NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
17165 | 2bdo | 4426 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLU 77 H GLU 77 15.517 19.298 -1.141 2 HA GLU 77 HA GLU 77 16.032 17.124 -2.772 3 1HB GLU 77 1HB GLU 77 16.618 15.913 -0.788 4 2HB GLU 77 2HB GLU 77 17.093 17.592 -0.556 5 1HG GLU 77 1HG GLU 77 14.431 17.230 0.406 6 2HG GLU 77 2HG GLU 77 15.477 15.990 1.097 7 H ILE 78 H ILE 78 14.990 15.265 -3.301 8 HA ILE 78 HA ILE 78 12.156 15.213 -3.122 9 HB ILE 78 HB ILE 78 12.471 12.853 -4.070 10 1HG1 ILE 78 1HG1 ILE 78 15.178 13.547 -4.946 11 2HG1 ILE 78 2HG1 ILE 78 15.066 13.222 -3.219 12 1HG2 ILE 78 1HG2 ILE 78 12.108 15.109 -5.291 13 2HG2 ILE 78 2HG2 ILE 78 13.795 14.926 -5.767 14 3HG2 ILE 78 3HG2 ILE 78 12.613 13.697 -6.218 15 1HD1 ILE 78 1HD1 ILE 78 13.949 11.346 -5.273 16 2HD1 ILE 78 2HD1 ILE 78 15.625 11.270 -4.727 17 3HD1 ILE 78 3HD1 ILE 78 14.310 11.032 -3.575 18 H SER 79 H SER 79 10.833 13.610 -2.125 19 HA SER 79 HA SER 79 11.999 12.569 0.364 20 1HB SER 79 1HB SER 79 9.224 12.332 0.546 21 2HB SER 79 2HB SER 79 10.223 13.575 1.298 22 HG SER 79 HG SER 79 8.829 14.723 0.109 23 H GLY 80 H GLY 80 12.308 11.210 -2.159 24 1HA GLY 80 1HA GLY 80 12.386 8.949 -2.691 25 2HA GLY 80 2HA GLY 80 11.304 8.622 -1.346 26 H HIS 81 H HIS 81 9.593 7.577 -2.116 27 HA HIS 81 HA HIS 81 8.135 8.783 -4.358 28 1HB HIS 81 1HB HIS 81 7.772 5.980 -4.555 29 2HB HIS 81 2HB HIS 81 8.549 7.054 -5.712 30 HD1 HIS 81 HD1 HIS 81 11.215 7.604 -4.796 31 HD2 HIS 81 HD2 HIS 81 9.426 3.960 -3.907 32 HE1 HIS 81 HE1 HIS 81 13.110 6.033 -4.279 33 HE2 HIS 81 HE2 HIS 81 12.007 3.815 -3.819 34 H ILE 82 H ILE 82 5.973 8.850 -4.098 35 HA ILE 82 HA ILE 82 4.863 7.476 -1.738 36 HB ILE 82 HB ILE 82 3.802 10.017 -2.967 37 1HG1 ILE 82 1HG1 ILE 82 5.866 9.549 -0.851 38 2HG1 ILE 82 2HG1 ILE 82 5.822 10.772 -2.115 39 1HG2 ILE 82 1HG2 ILE 82 2.521 8.255 -1.368 40 2HG2 ILE 82 2HG2 ILE 82 3.244 9.322 -0.165 41 3HG2 ILE 82 3HG2 ILE 82 2.181 9.986 -1.406 42 1HD1 ILE 82 1HD1 ILE 82 3.659 11.439 -0.586 43 2HD1 ILE 82 2HD1 ILE 82 4.814 10.856 0.613 44 3HD1 ILE 82 3HD1 ILE 82 5.262 12.168 -0.477 45 H VAL 83 H VAL 83 3.215 6.113 -2.039 46 HA VAL 83 HA VAL 83 2.095 5.889 -4.740 47 HB VAL 83 HB VAL 83 1.750 3.894 -2.509 48 1HG1 VAL 83 1HG1 VAL 83 0.314 3.883 -4.624 49 2HG1 VAL 83 2HG1 VAL 83 1.781 3.389 -5.468 50 3HG1 VAL 83 3HG1 VAL 83 1.122 2.379 -4.181 51 1HG2 VAL 83 1HG2 VAL 83 4.154 4.545 -3.996 52 2HG2 VAL 83 2HG2 VAL 83 3.941 3.485 -2.603 53 3HG2 VAL 83 3HG2 VAL 83 3.662 2.868 -4.231 54 H ARG 84 H ARG 84 0.265 6.992 -5.017 55 HA ARG 84 HA ARG 84 -1.587 7.317 -2.780 56 1HB ARG 84 1HB ARG 84 -0.851 8.904 -5.061 57 2HB ARG 84 2HB ARG 84 -2.587 8.622 -5.074 58 1HG ARG 84 1HG ARG 84 -2.715 9.468 -2.764 59 2HG ARG 84 2HG ARG 84 -0.986 9.817 -2.821 60 1HD ARG 84 1HD ARG 84 -2.762 10.918 -4.948 61 2HD ARG 84 2HD ARG 84 -2.758 11.679 -3.357 62 HE ARG 84 HE ARG 84 -0.612 12.444 -3.746 63 1HH1 ARG 84 1HH1 ARG 84 -1.594 10.245 -6.260 64 2HH1 ARG 84 2HH1 ARG 84 -0.263 10.633 -7.300 65 1HH2 ARG 84 1HH2 ARG 84 1.144 12.964 -5.106 66 2HH2 ARG 84 2HH2 ARG 84 1.294 12.179 -6.643 67 H SER 85 H SER 85 -3.507 6.326 -2.652 68 HA SER 85 HA SER 85 -4.119 4.052 -4.090 69 1HB SER 85 1HB SER 85 -5.808 3.893 -2.615 70 2HB SER 85 2HB SER 85 -5.253 5.432 -1.956 71 HG SER 85 HG SER 85 -7.425 5.602 -2.489 72 HA PRO 86 HA PRO 86 -5.550 5.758 -7.942 73 1HB PRO 86 1HB PRO 86 -6.212 3.439 -9.131 74 2HB PRO 86 2HB PRO 86 -4.528 3.902 -8.864 75 1HG PRO 86 1HG PRO 86 -6.247 2.027 -7.289 76 2HG PRO 86 2HG PRO 86 -4.554 1.844 -7.783 77 1HD PRO 86 1HD PRO 86 -5.322 2.651 -5.286 78 2HD PRO 86 2HD PRO 86 -3.781 3.110 -6.035 79 H MET 87 H MET 87 -7.446 3.730 -5.827 80 HA MET 87 HA MET 87 -9.870 5.062 -6.758 81 1HB MET 87 1HB MET 87 -9.233 2.322 -7.326 82 2HB MET 87 2HB MET 87 -10.627 2.387 -6.257 83 1HG MET 87 1HG MET 87 -11.934 2.906 -7.954 84 2HG MET 87 2HG MET 87 -10.966 4.341 -8.290 85 1HE MET 87 1HE MET 87 -11.830 0.756 -9.061 86 2HE MET 87 2HE MET 87 -10.736 0.262 -10.354 87 3HE MET 87 3HE MET 87 -10.149 0.368 -8.695 88 H VAL 88 H VAL 88 -11.718 3.668 -5.272 89 HA VAL 88 HA VAL 88 -10.850 4.287 -2.530 90 HB VAL 88 HB VAL 88 -13.586 4.338 -3.799 91 1HG1 VAL 88 1HG1 VAL 88 -12.873 3.832 -1.047 92 2HG1 VAL 88 2HG1 VAL 88 -13.812 5.317 -1.203 93 3HG1 VAL 88 3HG1 VAL 88 -14.456 3.797 -1.825 94 1HG2 VAL 88 1HG2 VAL 88 -11.595 6.282 -3.475 95 2HG2 VAL 88 2HG2 VAL 88 -13.266 6.530 -3.979 96 3HG2 VAL 88 3HG2 VAL 88 -12.832 6.655 -2.274 97 H GLY 89 H GLY 89 -11.162 2.840 -0.880 98 1HA GLY 89 1HA GLY 89 -12.756 0.502 -1.084 99 2HA GLY 89 2HA GLY 89 -11.074 0.115 -1.418 100 H THR 90 H THR 90 -10.064 -0.675 0.290 101 HA THR 90 HA THR 90 -10.270 0.666 2.852 102 HB THR 90 HB THR 90 -10.926 -2.276 2.608 103 HG1 THR 90 HG1 THR 90 -13.009 -1.516 3.370 104 1HG2 THR 90 1HG2 THR 90 -9.802 -1.415 4.741 105 2HG2 THR 90 2HG2 THR 90 -11.329 -0.584 5.039 106 3HG2 THR 90 3HG2 THR 90 -11.295 -2.342 4.895 107 H PHE 91 H PHE 91 -8.180 1.049 3.208 108 HA PHE 91 HA PHE 91 -6.060 -0.529 2.217 109 1HB PHE 91 1HB PHE 91 -5.972 1.918 2.891 110 2HB PHE 91 2HB PHE 91 -5.890 1.366 4.563 111 HD1 PHE 91 HD1 PHE 91 -4.246 0.227 1.405 112 HD2 PHE 91 HD2 PHE 91 -3.773 1.660 5.393 113 HE1 PHE 91 HE1 PHE 91 -1.801 -0.020 1.199 114 HE2 PHE 91 HE2 PHE 91 -1.328 1.417 5.194 115 HZ PHE 91 HZ PHE 91 -0.341 0.576 3.095 116 H TYR 92 H TYR 92 -4.340 -1.477 3.676 117 HA TYR 92 HA TYR 92 -5.080 -2.476 6.234 118 1HB TYR 92 1HB TYR 92 -5.382 -4.247 3.843 119 2HB TYR 92 2HB TYR 92 -4.934 -4.936 5.399 120 HD1 TYR 92 HD1 TYR 92 -6.587 -3.151 7.178 121 HD2 TYR 92 HD2 TYR 92 -7.533 -5.149 3.533 122 HE1 TYR 92 HE1 TYR 92 -8.962 -3.210 7.833 123 HE2 TYR 92 HE2 TYR 92 -9.910 -5.213 4.176 124 HH TYR 92 HH TYR 92 -11.014 -4.811 7.180 125 H ARG 93 H ARG 93 -3.422 -3.930 7.139 126 HA ARG 93 HA ARG 93 -0.827 -3.613 5.774 127 1HB ARG 93 1HB ARG 93 -0.980 -3.858 8.747 128 2HB ARG 93 2HB ARG 93 0.233 -3.064 7.752 129 1HG ARG 93 1HG ARG 93 -2.047 -1.606 7.253 130 2HG ARG 93 2HG ARG 93 -2.167 -1.986 8.972 131 1HD ARG 93 1HD ARG 93 0.519 -1.235 8.371 132 2HD ARG 93 2HD ARG 93 -0.571 -0.018 7.710 133 HE ARG 93 HE ARG 93 -1.311 -0.671 10.363 134 1HH1 ARG 93 1HH1 ARG 93 1.096 1.059 8.535 135 2HH1 ARG 93 2HH1 ARG 93 1.436 2.188 9.805 136 1HH2 ARG 93 1HH2 ARG 93 -0.870 0.810 12.042 137 2HH2 ARG 93 2HH2 ARG 93 0.319 2.047 11.798 138 H THR 94 H THR 94 -3.003 -5.709 7.465 139 HA THR 94 HA THR 94 -1.203 -7.954 6.906 140 HB THR 94 HB THR 94 -2.175 -8.936 9.122 141 HG1 THR 94 HG1 THR 94 -2.495 -6.148 9.499 142 1HG2 THR 94 1HG2 THR 94 -0.011 -6.872 8.982 143 2HG2 THR 94 2HG2 THR 94 -0.404 -7.725 10.475 144 3HG2 THR 94 3HG2 THR 94 0.135 -8.631 9.062 145 HA PRO 95 HA PRO 95 -5.258 -8.829 4.960 146 1HB PRO 95 1HB PRO 95 -3.523 -10.877 3.699 147 2HB PRO 95 2HB PRO 95 -4.661 -9.748 2.952 148 1HG PRO 95 1HG PRO 95 -2.027 -9.368 2.761 149 2HG PRO 95 2HG PRO 95 -3.139 -8.001 2.969 150 1HD PRO 95 1HD PRO 95 -1.361 -9.321 4.978 151 2HD PRO 95 2HD PRO 95 -1.751 -7.601 4.774 152 H SER 96 H SER 96 -5.047 -11.767 4.212 153 HA SER 96 HA SER 96 -6.534 -13.026 5.993 154 1HB SER 96 1HB SER 96 -4.148 -14.653 5.344 155 2HB SER 96 2HB SER 96 -5.858 -14.991 5.064 156 HG SER 96 HG SER 96 -4.091 -13.424 3.513 157 HA PRO 97 HA PRO 97 -4.748 -12.004 10.007 158 1HB PRO 97 1HB PRO 97 -6.413 -14.475 10.400 159 2HB PRO 97 2HB PRO 97 -6.250 -13.062 11.452 160 1HG PRO 97 1HG PRO 97 -8.330 -13.320 9.767 161 2HG PRO 97 2HG PRO 97 -7.607 -11.745 10.127 162 1HD PRO 97 1HD PRO 97 -7.538 -13.294 7.638 163 2HD PRO 97 2HD PRO 97 -7.154 -11.583 7.907 164 H ASP 98 H ASP 98 -4.688 -15.147 8.414 165 HA ASP 98 HA ASP 98 -2.472 -16.013 10.111 166 1HB ASP 98 1HB ASP 98 -3.787 -17.591 7.900 167 2HB ASP 98 2HB ASP 98 -2.808 -18.204 9.229 168 H ALA 99 H ALA 99 -1.864 -13.852 8.481 169 HA ALA 99 HA ALA 99 -0.243 -15.050 6.332 170 1HB ALA 99 1HB ALA 99 -1.976 -13.299 5.741 171 2HB ALA 99 2HB ALA 99 -0.947 -12.137 6.578 172 3HB ALA 99 3HB ALA 99 -0.335 -12.999 5.167 173 H LYS 100 H LYS 100 1.462 -12.848 5.955 174 HA LYS 100 HA LYS 100 3.017 -12.850 8.458 175 1HB LYS 100 1HB LYS 100 3.737 -13.889 5.912 176 2HB LYS 100 2HB LYS 100 4.724 -12.462 6.198 177 1HG LYS 100 1HG LYS 100 5.196 -13.510 8.499 178 2HG LYS 100 2HG LYS 100 4.583 -14.999 7.776 179 1HD LYS 100 1HD LYS 100 6.422 -15.284 6.513 180 2HD LYS 100 2HD LYS 100 6.542 -13.566 6.129 181 1HE LYS 100 1HE LYS 100 7.355 -13.267 8.532 182 2HE LYS 100 2HE LYS 100 7.553 -15.019 8.557 183 1HZ LYS 100 1HZ LYS 100 8.728 -13.924 6.225 184 2HZ LYS 100 2HZ LYS 100 9.343 -13.148 7.596 185 3HZ LYS 100 3HZ LYS 100 9.451 -14.831 7.456 186 H ALA 101 H ALA 101 1.088 -10.884 7.493 187 HA ALA 101 HA ALA 101 0.846 -8.628 7.337 188 1HB ALA 101 1HB ALA 101 2.780 -9.051 9.213 189 2HB ALA 101 2HB ALA 101 3.583 -7.939 8.103 190 3HB ALA 101 3HB ALA 101 2.048 -7.489 8.845 191 H PHE 102 H PHE 102 0.982 -7.119 5.762 192 HA PHE 102 HA PHE 102 2.505 -7.745 3.427 193 1HB PHE 102 1HB PHE 102 0.379 -5.869 4.171 194 2HB PHE 102 2HB PHE 102 1.522 -5.207 3.007 195 HD1 PHE 102 HD1 PHE 102 2.220 -7.572 1.422 196 HD2 PHE 102 HD2 PHE 102 -1.548 -6.305 2.965 197 HE1 PHE 102 HE1 PHE 102 1.073 -8.785 -0.393 198 HE2 PHE 102 HE2 PHE 102 -2.702 -7.515 1.154 199 HZ PHE 102 HZ PHE 102 -1.390 -8.758 -0.528 200 H ILE 103 H ILE 103 3.286 -5.314 2.413 201 HA ILE 103 HA ILE 103 5.818 -4.964 3.645 202 HB ILE 103 HB ILE 103 4.593 -3.038 1.682 203 1HG1 ILE 103 1HG1 ILE 103 4.196 -5.165 0.685 204 2HG1 ILE 103 2HG1 ILE 103 5.651 -4.530 -0.076 205 1HG2 ILE 103 1HG2 ILE 103 6.823 -2.611 2.838 206 2HG2 ILE 103 2HG2 ILE 103 7.446 -3.953 1.878 207 3HG2 ILE 103 3HG2 ILE 103 6.801 -2.521 1.076 208 1HD1 ILE 103 1HD1 ILE 103 7.012 -5.933 1.409 209 2HD1 ILE 103 2HD1 ILE 103 5.534 -6.597 2.107 210 3HD1 ILE 103 3HD1 ILE 103 5.909 -6.877 0.406 211 H GLU 104 H GLU 104 5.546 -4.283 5.764 212 HA GLU 104 HA GLU 104 4.069 -1.839 6.298 213 1HB GLU 104 1HB GLU 104 4.917 -4.121 7.824 214 2HB GLU 104 2HB GLU 104 5.465 -2.646 8.609 215 1HG GLU 104 1HG GLU 104 2.716 -2.455 7.712 216 2HG GLU 104 2HG GLU 104 2.970 -3.801 8.823 217 H VAL 105 H VAL 105 5.380 -0.506 8.164 218 HA VAL 105 HA VAL 105 7.280 1.001 6.785 219 HB VAL 105 HB VAL 105 7.015 0.793 9.788 220 1HG1 VAL 105 1HG1 VAL 105 8.414 2.653 7.941 221 2HG1 VAL 105 2HG1 VAL 105 7.670 3.325 9.392 222 3HG1 VAL 105 3HG1 VAL 105 8.894 2.062 9.532 223 1HG2 VAL 105 1HG2 VAL 105 5.084 1.601 7.913 224 2HG2 VAL 105 2HG2 VAL 105 5.042 1.807 9.664 225 3HG2 VAL 105 3HG2 VAL 105 5.716 3.077 8.643 226 H GLY 106 H GLY 106 9.558 1.316 7.256 227 1HA GLY 106 1HA GLY 106 11.708 0.521 7.388 228 2HA GLY 106 2HA GLY 106 11.147 -0.368 8.797 229 H GLN 107 H GLN 107 9.509 -1.068 5.883 230 HA GLN 107 HA GLN 107 10.754 -3.703 5.822 231 1HB GLN 107 1HB GLN 107 8.288 -3.521 5.844 232 2HB GLN 107 2HB GLN 107 8.349 -2.652 4.317 233 1HG GLN 107 1HG GLN 107 7.764 -4.897 3.843 234 2HG GLN 107 2HG GLN 107 9.425 -4.658 3.303 235 1HE2 GLN 107 2HE2 GLN 107 9.196 -7.091 3.424 236 2HE2 GLN 107 1HE2 GLN 107 9.660 -7.836 4.912 237 H LYS 108 H LYS 108 11.255 -4.684 3.677 238 HA LYS 108 HA LYS 108 12.374 -2.659 1.852 239 1HB LYS 108 1HB LYS 108 13.972 -4.583 1.225 240 2HB LYS 108 2HB LYS 108 14.236 -3.746 2.749 241 1HG LYS 108 1HG LYS 108 12.602 -6.249 2.644 242 2HG LYS 108 2HG LYS 108 14.365 -6.314 2.698 243 1HD LYS 108 1HD LYS 108 13.064 -4.534 4.664 244 2HD LYS 108 2HD LYS 108 12.808 -6.265 4.893 245 1HE LYS 108 1HE LYS 108 15.566 -5.259 4.371 246 2HE LYS 108 2HE LYS 108 14.868 -5.054 5.977 247 1HZ LYS 108 1HZ LYS 108 14.592 -7.703 4.834 248 2HZ LYS 108 2HZ LYS 108 16.181 -7.239 5.183 249 3HZ LYS 108 3HZ LYS 108 15.012 -7.238 6.406 250 H VAL 109 H VAL 109 11.597 -2.631 -0.145 251 HA VAL 109 HA VAL 109 10.378 -5.081 -1.229 252 HB VAL 109 HB VAL 109 8.869 -3.255 -2.470 253 1HG1 VAL 109 1HG1 VAL 109 8.507 -4.740 0.084 254 2HG1 VAL 109 2HG1 VAL 109 7.251 -3.613 -0.425 255 3HG1 VAL 109 3HG1 VAL 109 7.707 -4.957 -1.472 256 1HG2 VAL 109 1HG2 VAL 109 10.081 -1.482 -1.039 257 2HG2 VAL 109 2HG2 VAL 109 8.326 -1.384 -1.196 258 3HG2 VAL 109 3HG2 VAL 109 9.045 -2.052 0.270 259 H ASN 110 H ASN 110 10.730 -5.484 -3.376 260 HA ASN 110 HA ASN 110 12.389 -3.530 -4.829 261 1HB ASN 110 1HB ASN 110 13.363 -5.636 -5.966 262 2HB ASN 110 2HB ASN 110 13.904 -5.249 -4.336 263 1HD2 ASN 110 2HD2 ASN 110 13.217 -7.742 -6.175 264 2HD2 ASN 110 1HD2 ASN 110 12.530 -8.835 -5.027 265 H VAL 111 H VAL 111 11.959 -3.213 -6.985 266 HA VAL 111 HA VAL 111 9.478 -3.262 -7.995 267 HB VAL 111 HB VAL 111 12.013 -3.776 -9.554 268 1HG1 VAL 111 1HG1 VAL 111 9.220 -3.666 -10.410 269 2HG1 VAL 111 2HG1 VAL 111 10.281 -2.560 -11.283 270 3HG1 VAL 111 3HG1 VAL 111 10.641 -4.285 -11.249 271 1HG2 VAL 111 1HG2 VAL 111 11.746 -1.643 -8.194 272 2HG2 VAL 111 2HG2 VAL 111 12.107 -1.451 -9.910 273 3HG2 VAL 111 3HG2 VAL 111 10.462 -1.212 -9.323 274 H GLY 112 H GLY 112 8.079 -4.914 -7.827 275 1HA GLY 112 1HA GLY 112 7.338 -6.834 -9.237 276 2HA GLY 112 2HA GLY 112 8.924 -7.524 -8.926 277 H ASP 113 H ASP 113 8.225 -6.079 -6.126 278 HA ASP 113 HA ASP 113 7.266 -8.566 -4.947 279 1HB ASP 113 1HB ASP 113 8.988 -6.422 -4.103 280 2HB ASP 113 2HB ASP 113 7.700 -6.656 -2.925 281 H THR 114 H THR 114 5.576 -8.548 -3.323 282 HA THR 114 HA THR 114 3.259 -7.183 -4.201 283 HB THR 114 HB THR 114 3.152 -8.217 -1.462 284 HG1 THR 114 HG1 THR 114 3.714 -10.092 -3.491 285 1HG2 THR 114 1HG2 THR 114 1.146 -7.887 -2.808 286 2HG2 THR 114 2HG2 THR 114 1.738 -9.066 -3.978 287 3HG2 THR 114 3HG2 THR 114 1.344 -9.575 -2.337 288 H LEU 115 H LEU 115 1.843 -5.942 -2.604 289 HA LEU 115 HA LEU 115 3.438 -4.148 -0.915 290 1HB LEU 115 1HB LEU 115 3.003 -3.163 -3.202 291 2HB LEU 115 2HB LEU 115 1.297 -3.165 -2.795 292 HG LEU 115 HG LEU 115 2.410 -1.846 -0.653 293 1HD1 LEU 115 1HD1 LEU 115 4.480 -1.888 -2.371 294 2HD1 LEU 115 2HD1 LEU 115 3.662 -0.420 -2.905 295 3HD1 LEU 115 3HD1 LEU 115 4.182 -0.579 -1.227 296 1HD2 LEU 115 1HD2 LEU 115 0.364 -1.291 -1.940 297 2HD2 LEU 115 2HD2 LEU 115 1.366 0.113 -1.578 298 3HD2 LEU 115 3HD2 LEU 115 1.386 -0.590 -3.195 299 H CYS 116 H CYS 116 0.031 -4.251 -1.945 300 HA CYS 116 HA CYS 116 -0.982 -5.374 0.419 301 1HB CYS 116 1HB CYS 116 -0.360 -2.540 0.561 302 2HB CYS 116 2HB CYS 116 -2.070 -2.844 0.847 303 HG CYS 116 HG CYS 116 -1.359 -3.334 3.137 304 H ILE 117 H ILE 117 -3.378 -5.102 0.594 305 HA ILE 117 HA ILE 117 -4.516 -4.881 -2.104 306 HB ILE 117 HB ILE 117 -5.529 -6.292 0.364 307 1HG1 ILE 117 1HG1 ILE 117 -5.307 -7.814 -2.104 308 2HG1 ILE 117 2HG1 ILE 117 -3.765 -7.105 -1.633 309 1HG2 ILE 117 1HG2 ILE 117 -7.355 -5.213 -0.931 310 2HG2 ILE 117 2HG2 ILE 117 -6.857 -6.158 -2.335 311 3HG2 ILE 117 3HG2 ILE 117 -7.454 -6.974 -0.890 312 1HD1 ILE 117 1HD1 ILE 117 -4.578 -8.116 0.728 313 2HD1 ILE 117 2HD1 ILE 117 -5.313 -9.264 -0.391 314 3HD1 ILE 117 3HD1 ILE 117 -3.573 -8.986 -0.431 315 H VAL 118 H VAL 118 -6.432 -3.732 -2.479 316 HA VAL 118 HA VAL 118 -6.851 -1.503 -0.647 317 HB VAL 118 HB VAL 118 -7.964 -2.002 -3.413 318 1HG1 VAL 118 1HG1 VAL 118 -9.123 -0.441 -1.539 319 2HG1 VAL 118 2HG1 VAL 118 -8.003 0.709 -2.269 320 3HG1 VAL 118 3HG1 VAL 118 -9.194 -0.120 -3.272 321 1HG2 VAL 118 1HG2 VAL 118 -5.408 -1.336 -2.765 322 2HG2 VAL 118 2HG2 VAL 118 -6.206 -0.904 -4.278 323 3HG2 VAL 118 3HG2 VAL 118 -6.148 0.254 -2.948 324 H GLU 119 H GLU 119 -8.566 -4.257 -2.001 325 HA GLU 119 HA GLU 119 -10.454 -5.339 -1.341 326 1HB GLU 119 1HB GLU 119 -9.493 -4.943 0.954 327 2HB GLU 119 2HB GLU 119 -10.483 -3.494 1.051 328 1HG GLU 119 1HG GLU 119 -12.473 -5.019 0.613 329 2HG GLU 119 2HG GLU 119 -11.372 -6.356 0.947 330 H ALA 120 H ALA 120 -10.939 -3.694 -3.281 331 HA ALA 120 HA ALA 120 -13.156 -1.935 -2.497 332 1HB ALA 120 1HB ALA 120 -11.300 -2.003 -4.827 333 2HB ALA 120 2HB ALA 120 -12.898 -1.281 -5.024 334 3HB ALA 120 3HB ALA 120 -11.787 -0.646 -3.811 335 H MET 121 H MET 121 -14.940 -3.184 -2.340 336 HA MET 121 HA MET 121 -16.746 -4.392 -2.995 337 1HB MET 121 1HB MET 121 -17.527 -3.983 -5.077 338 2HB MET 121 2HB MET 121 -16.162 -2.880 -5.160 339 1HG MET 121 1HG MET 121 -14.964 -5.111 -6.018 340 2HG MET 121 2HG MET 121 -16.614 -5.453 -6.531 341 1HE MET 121 1HE MET 121 -14.178 -2.338 -6.380 342 2HE MET 121 2HE MET 121 -13.351 -3.616 -7.270 343 3HE MET 121 3HE MET 121 -13.851 -2.144 -8.103 344 H LYS 122 H LYS 122 -14.100 -5.623 -2.433 345 HA LYS 122 HA LYS 122 -13.300 -7.746 -2.228 346 1HB LYS 122 1HB LYS 122 -15.915 -8.180 -2.335 347 2HB LYS 122 2HB LYS 122 -15.494 -8.904 -3.881 348 1HG LYS 122 1HG LYS 122 -15.602 -10.472 -1.920 349 2HG LYS 122 2HG LYS 122 -14.110 -10.519 -2.861 350 1HD LYS 122 1HD LYS 122 -13.832 -10.537 -0.352 351 2HD LYS 122 2HD LYS 122 -12.926 -9.293 -1.216 352 1HE LYS 122 1HE LYS 122 -14.233 -7.591 -0.415 353 2HE LYS 122 2HE LYS 122 -15.648 -8.625 -0.222 354 H MET 123 H MET 123 -11.995 -6.379 -4.005 355 HA MET 123 HA MET 123 -11.823 -8.079 -6.406 356 1HB MET 123 1HB MET 123 -12.365 -5.965 -7.225 357 2HB MET 123 2HB MET 123 -11.401 -5.136 -6.011 358 1HG MET 123 1HG MET 123 -9.961 -6.867 -7.930 359 2HG MET 123 2HG MET 123 -10.647 -5.365 -8.547 360 1HE MET 123 1HE MET 123 -10.216 -3.075 -7.584 361 2HE MET 123 2HE MET 123 -10.257 -3.389 -5.849 362 3HE MET 123 3HE MET 123 -8.846 -2.617 -6.572 363 H MET 124 H MET 124 -10.297 -7.217 -3.547 364 HA MET 124 HA MET 124 -8.223 -7.556 -2.681 365 1HB MET 124 1HB MET 124 -8.362 -9.645 -4.837 366 2HB MET 124 2HB MET 124 -6.927 -9.474 -3.836 367 1HG MET 124 1HG MET 124 -8.714 -11.185 -3.158 368 2HG MET 124 2HG MET 124 -8.025 -10.142 -1.916 369 1HE MET 124 1HE MET 124 -9.460 -10.411 -0.292 370 2HE MET 124 2HE MET 124 -10.047 -8.754 -0.154 371 3HE MET 124 3HE MET 124 -11.193 -10.093 -0.216 372 H ASN 125 H ASN 125 -8.108 -5.300 -3.941 373 HA ASN 125 HA ASN 125 -6.383 -5.121 -6.172 374 1HB ASN 125 1HB ASN 125 -8.004 -3.356 -5.015 375 2HB ASN 125 2HB ASN 125 -6.511 -2.884 -4.204 376 1HD2 ASN 125 2HD2 ASN 125 -7.603 -1.016 -5.686 377 2HD2 ASN 125 1HD2 ASN 125 -6.762 -0.794 -7.179 378 H GLN 126 H GLN 126 -4.953 -6.854 -4.977 379 HA GLN 126 HA GLN 126 -3.104 -5.887 -3.034 380 1HB GLN 126 1HB GLN 126 -3.530 -8.236 -3.104 381 2HB GLN 126 2HB GLN 126 -3.123 -8.324 -4.812 382 1HG GLN 126 1HG GLN 126 -0.884 -7.270 -3.425 383 2HG GLN 126 2HG GLN 126 -1.442 -8.707 -2.568 384 1HE2 GLN 126 2HE2 GLN 126 0.290 -7.524 -5.208 385 2HE2 GLN 126 1HE2 GLN 126 0.557 -9.023 -6.024 386 H ILE 127 H ILE 127 -1.981 -4.114 -3.681 387 HA ILE 127 HA ILE 127 -0.846 -3.848 -6.291 388 HB ILE 127 HB ILE 127 -0.047 -2.267 -3.855 389 1HG1 ILE 127 1HG1 ILE 127 -2.485 -2.254 -3.986 390 2HG1 ILE 127 2HG1 ILE 127 -1.843 -0.683 -4.455 391 1HG2 ILE 127 1HG2 ILE 127 0.324 -2.023 -6.771 392 2HG2 ILE 127 2HG2 ILE 127 -0.049 -0.533 -5.904 393 3HG2 ILE 127 3HG2 ILE 127 1.357 -1.493 -5.444 394 1HD1 ILE 127 1HD1 ILE 127 -2.234 -2.529 -6.686 395 2HD1 ILE 127 2HD1 ILE 127 -3.713 -2.085 -5.833 396 3HD1 ILE 127 3HD1 ILE 127 -2.678 -0.831 -6.520 397 H GLU 128 H GLU 128 1.449 -3.609 -6.735 398 HA GLU 128 HA GLU 128 3.176 -5.143 -4.916 399 1HB GLU 128 1HB GLU 128 3.171 -5.416 -7.926 400 2HB GLU 128 2HB GLU 128 4.184 -6.302 -6.795 401 1HG GLU 128 1HG GLU 128 2.450 -7.636 -6.074 402 2HG GLU 128 2HG GLU 128 1.215 -6.481 -6.576 403 H ALA 129 H ALA 129 4.826 -3.928 -4.298 404 HA ALA 129 HA ALA 129 5.483 -1.422 -5.174 405 1HB ALA 129 1HB ALA 129 7.070 -3.547 -3.799 406 2HB ALA 129 2HB ALA 129 7.850 -2.042 -4.284 407 3HB ALA 129 3HB ALA 129 6.478 -2.007 -3.177 408 H ASP 130 H ASP 130 6.275 -0.623 -7.000 409 HA ASP 130 HA ASP 130 7.987 -2.343 -8.668 410 1HB ASP 130 1HB ASP 130 6.976 -1.240 -10.663 411 2HB ASP 130 2HB ASP 130 5.829 -2.213 -9.745 412 H LYS 131 H LYS 131 8.437 -0.106 -6.655 413 HA LYS 131 HA LYS 131 10.127 1.548 -8.408 414 1HB LYS 131 1HB LYS 131 8.248 2.373 -6.244 415 2HB LYS 131 2HB LYS 131 9.734 3.290 -6.448 416 1HG LYS 131 1HG LYS 131 7.810 2.764 -8.696 417 2HG LYS 131 2HG LYS 131 7.720 4.184 -7.652 418 1HD LYS 131 1HD LYS 131 9.706 5.063 -8.459 419 2HD LYS 131 2HD LYS 131 10.291 3.494 -9.016 420 1HE LYS 131 1HE LYS 131 9.527 3.944 -11.051 421 2HE LYS 131 2HE LYS 131 7.889 4.048 -10.404 422 1HZ LYS 131 1HZ LYS 131 8.934 6.434 -9.722 423 2HZ LYS 131 2HZ LYS 131 9.685 6.153 -11.212 424 3HZ LYS 131 3HZ LYS 131 7.997 6.154 -11.102 425 H SER 132 H SER 132 10.139 -0.745 -6.085 426 HA SER 132 HA SER 132 11.634 -1.491 -4.539 427 1HB SER 132 1HB SER 132 13.564 -1.786 -5.638 428 2HB SER 132 2HB SER 132 13.088 -0.539 -6.790 429 HG SER 132 HG SER 132 14.373 0.840 -5.836 430 H GLY 133 H GLY 133 13.174 -0.850 -2.787 431 1HA GLY 133 1HA GLY 133 14.137 1.152 -1.633 432 2HA GLY 133 2HA GLY 133 12.567 1.898 -1.885 433 H THR 134 H THR 134 12.914 2.155 0.526 434 HA THR 134 HA THR 134 11.827 -0.208 1.914 435 HB THR 134 HB THR 134 13.874 1.803 2.814 436 HG1 THR 134 HG1 THR 134 13.852 -0.809 2.130 437 1HG2 THR 134 1HG2 THR 134 12.179 0.048 4.561 438 2HG2 THR 134 2HG2 THR 134 13.752 0.675 5.054 439 3HG2 THR 134 3HG2 THR 134 12.437 1.789 4.681 440 H VAL 135 H VAL 135 9.774 0.120 2.430 441 HA VAL 135 HA VAL 135 8.270 2.359 2.269 442 HB VAL 135 HB VAL 135 7.906 0.386 4.524 443 1HG1 VAL 135 1HG1 VAL 135 6.274 2.495 3.298 444 2HG1 VAL 135 2HG1 VAL 135 5.443 0.959 3.540 445 3HG1 VAL 135 3HG1 VAL 135 6.189 1.783 4.909 446 1HG2 VAL 135 1HG2 VAL 135 7.627 0.052 1.598 447 2HG2 VAL 135 2HG2 VAL 135 7.988 -1.138 2.848 448 3HG2 VAL 135 3HG2 VAL 135 6.328 -0.599 2.597 449 H LYS 136 H LYS 136 7.904 4.193 3.396 450 HA LYS 136 HA LYS 136 9.654 4.710 5.685 451 1HB LYS 136 1HB LYS 136 8.967 6.231 3.445 452 2HB LYS 136 2HB LYS 136 8.104 6.986 4.779 453 1HG LYS 136 1HG LYS 136 11.064 6.535 4.524 454 2HG LYS 136 2HG LYS 136 10.201 8.073 4.583 455 1HD LYS 136 1HD LYS 136 10.292 6.065 6.833 456 2HD LYS 136 2HD LYS 136 11.326 7.491 6.717 457 1HE LYS 136 1HE LYS 136 8.419 7.947 6.453 458 2HE LYS 136 2HE LYS 136 8.992 7.456 8.047 459 1HZ LYS 136 1HZ LYS 136 10.701 9.440 7.023 460 2HZ LYS 136 2HZ LYS 136 9.105 9.987 6.894 461 3HZ LYS 136 3HZ LYS 136 9.716 9.504 8.395 462 H ALA 137 H ALA 137 6.255 5.001 4.707 463 HA ALA 137 HA ALA 137 5.238 4.247 7.207 464 1HB ALA 137 1HB ALA 137 6.228 6.538 7.741 465 2HB ALA 137 2HB ALA 137 4.903 7.201 6.784 466 3HB ALA 137 3HB ALA 137 4.557 6.246 8.225 467 H ILE 138 H ILE 138 2.819 5.276 7.376 468 HA ILE 138 HA ILE 138 1.648 5.164 4.679 469 HB ILE 138 HB ILE 138 0.631 3.692 7.113 470 1HG1 ILE 138 1HG1 ILE 138 1.733 2.694 4.478 471 2HG1 ILE 138 2HG1 ILE 138 2.538 2.591 6.040 472 1HG2 ILE 138 1HG2 ILE 138 -0.888 4.779 5.108 473 2HG2 ILE 138 2HG2 ILE 138 -0.624 3.130 4.541 474 3HG2 ILE 138 3HG2 ILE 138 -1.353 3.412 6.121 475 1HD1 ILE 138 1HD1 ILE 138 0.137 1.363 6.517 476 2HD1 ILE 138 2HD1 ILE 138 0.511 0.878 4.863 477 3HD1 ILE 138 3HD1 ILE 138 1.662 0.554 6.158 478 H LEU 139 H LEU 139 -0.060 6.508 4.307 479 HA LEU 139 HA LEU 139 -0.793 8.309 6.516 480 1HB LEU 139 1HB LEU 139 -0.569 8.705 3.555 481 2HB LEU 139 2HB LEU 139 -1.586 9.764 4.512 482 HG LEU 139 HG LEU 139 0.396 10.347 5.900 483 1HD1 LEU 139 1HD1 LEU 139 1.603 8.288 4.193 484 2HD1 LEU 139 2HD1 LEU 139 2.565 9.754 4.388 485 3HD1 LEU 139 3HD1 LEU 139 2.055 8.839 5.807 486 1HD2 LEU 139 1HD2 LEU 139 -0.403 11.432 3.599 487 2HD2 LEU 139 2HD2 LEU 139 0.995 12.025 4.496 488 3HD2 LEU 139 3HD2 LEU 139 1.224 10.946 3.121 489 H VAL 140 H VAL 140 -2.022 6.109 4.129 490 HA VAL 140 HA VAL 140 -4.730 6.913 4.168 491 HB VAL 140 HB VAL 140 -3.429 4.281 3.486 492 1HG1 VAL 140 1HG1 VAL 140 -6.334 5.023 3.538 493 2HG1 VAL 140 2HG1 VAL 140 -5.719 3.806 2.419 494 3HG1 VAL 140 3HG1 VAL 140 -5.547 3.572 4.158 495 1HG2 VAL 140 1HG2 VAL 140 -3.004 6.133 1.953 496 2HG2 VAL 140 2HG2 VAL 140 -4.023 4.907 1.197 497 3HG2 VAL 140 3HG2 VAL 140 -4.739 6.405 1.790 498 H GLU 141 H GLU 141 -2.814 4.922 6.294 499 HA GLU 141 HA GLU 141 -3.243 4.029 8.340 500 1HB GLU 141 1HB GLU 141 -5.559 5.908 8.047 501 2HB GLU 141 2HB GLU 141 -5.506 4.791 9.404 502 1HG GLU 141 1HG GLU 141 -3.204 5.724 9.898 503 2HG GLU 141 2HG GLU 141 -3.582 6.996 8.737 504 H SER 142 H SER 142 -3.368 1.926 7.583 505 HA SER 142 HA SER 142 -5.299 0.609 6.241 506 1HB SER 142 1HB SER 142 -3.943 -1.091 6.762 507 2HB SER 142 2HB SER 142 -3.200 -0.123 8.035 508 HG SER 142 HG SER 142 -4.855 -0.836 9.437 509 H GLY 143 H GLY 143 -7.009 -0.923 7.031 510 1HA GLY 143 1HA GLY 143 -8.950 -1.357 8.181 511 2HA GLY 143 2HA GLY 143 -8.241 -0.528 9.558 512 H GLN 144 H GLN 144 -8.116 1.514 6.940 513 HA GLN 144 HA GLN 144 -10.728 2.710 7.601 514 1HB GLN 144 1HB GLN 144 -9.032 4.051 8.659 515 2HB GLN 144 2HB GLN 144 -8.079 4.099 7.183 516 1HG GLN 144 1HG GLN 144 -10.477 5.140 6.372 517 2HG GLN 144 2HG GLN 144 -10.326 5.751 8.020 518 1HE2 GLN 144 2HE2 GLN 144 -8.581 5.457 4.964 519 2HE2 GLN 144 1HE2 GLN 144 -7.678 6.920 5.132 520 HA PRO 145 HA PRO 145 -11.836 2.457 3.343 521 1HB PRO 145 1HB PRO 145 -12.811 5.241 3.829 522 2HB PRO 145 2HB PRO 145 -13.642 3.875 3.076 523 1HG PRO 145 1HG PRO 145 -14.199 4.589 5.579 524 2HG PRO 145 2HG PRO 145 -14.137 2.881 5.110 525 1HD PRO 145 1HD PRO 145 -12.196 4.485 6.692 526 2HD PRO 145 2HD PRO 145 -12.584 2.756 6.796 527 H VAL 146 H VAL 146 -10.972 3.039 1.403 528 HA VAL 146 HA VAL 146 -8.830 5.042 1.475 529 HB VAL 146 HB VAL 146 -9.307 3.114 -0.781 530 1HG1 VAL 146 1HG1 VAL 146 -7.475 5.171 -0.337 531 2HG1 VAL 146 2HG1 VAL 146 -6.572 3.679 -0.072 532 3HG1 VAL 146 3HG1 VAL 146 -7.414 3.942 -1.600 533 1HG2 VAL 146 1HG2 VAL 146 -8.608 2.443 1.922 534 2HG2 VAL 146 2HG2 VAL 146 -8.858 1.382 0.536 535 3HG2 VAL 146 3HG2 VAL 146 -7.266 2.080 0.837 536 H GLU 147 H GLU 147 -8.634 6.632 -0.135 537 HA GLU 147 HA GLU 147 -11.063 7.105 -1.733 538 1HB GLU 147 1HB GLU 147 -10.359 9.610 -1.384 539 2HB GLU 147 2HB GLU 147 -11.301 8.772 -0.156 540 1HG GLU 147 1HG GLU 147 -8.418 8.502 0.196 541 2HG GLU 147 2HG GLU 147 -8.995 10.166 0.279 542 H PHE 148 H PHE 148 -10.736 8.406 -3.663 543 HA PHE 148 HA PHE 148 -8.668 7.517 -5.271 544 1HB PHE 148 1HB PHE 148 -10.555 8.378 -6.371 545 2HB PHE 148 2HB PHE 148 -10.490 9.887 -5.473 546 HD1 PHE 148 HD1 PHE 148 -8.618 7.893 -7.988 547 HD2 PHE 148 HD2 PHE 148 -9.467 11.757 -6.397 548 HE1 PHE 148 HE1 PHE 148 -7.349 8.927 -9.832 549 HE2 PHE 148 HE2 PHE 148 -8.201 12.799 -8.238 550 HZ PHE 148 HZ PHE 148 -7.141 11.382 -9.960 551 H ASP 149 H ASP 149 -6.578 7.998 -5.415 552 HA ASP 149 HA ASP 149 -4.585 9.080 -5.220 553 1HB ASP 149 1HB ASP 149 -6.489 11.398 -5.218 554 2HB ASP 149 2HB ASP 149 -4.778 11.666 -4.897 555 H GLU 150 H GLU 150 -4.832 7.759 -3.130 556 HA GLU 150 HA GLU 150 -4.484 9.587 -0.848 557 1HB GLU 150 1HB GLU 150 -6.481 7.697 -1.101 558 2HB GLU 150 2HB GLU 150 -5.265 6.858 -0.146 559 1HG GLU 150 1HG GLU 150 -6.490 9.526 0.516 560 2HG GLU 150 2HG GLU 150 -6.905 7.983 1.259 561 HA PRO 151 HA PRO 151 -0.342 7.935 -0.895 562 1HB PRO 151 1HB PRO 151 0.198 8.735 1.723 563 2HB PRO 151 2HB PRO 151 0.462 9.708 0.275 564 1HG PRO 151 1HG PRO 151 -1.814 9.754 2.203 565 2HG PRO 151 2HG PRO 151 -1.034 11.099 1.351 566 1HD PRO 151 1HD PRO 151 -3.412 10.145 0.570 567 2HD PRO 151 2HD PRO 151 -2.206 10.696 -0.614 568 H LEU 152 H LEU 152 -1.317 5.758 -0.917 569 HA LEU 152 HA LEU 152 -2.118 4.372 1.373 570 1HB LEU 152 1HB LEU 152 -0.963 3.506 -1.257 571 2HB LEU 152 2HB LEU 152 -1.291 2.331 0.005 572 HG LEU 152 HG LEU 152 -3.479 4.186 -0.817 573 1HD1 LEU 152 1HD1 LEU 152 -2.534 3.357 -2.927 574 2HD1 LEU 152 2HD1 LEU 152 -2.718 1.702 -2.346 575 3HD1 LEU 152 3HD1 LEU 152 -4.143 2.706 -2.615 576 1HD2 LEU 152 1HD2 LEU 152 -3.776 2.668 1.081 577 2HD2 LEU 152 2HD2 LEU 152 -4.858 2.260 -0.250 578 3HD2 LEU 152 3HD2 LEU 152 -3.412 1.294 0.038 579 H VAL 153 H VAL 153 1.088 4.664 -0.118 580 HA VAL 153 HA VAL 153 2.354 4.259 2.436 581 HB VAL 153 HB VAL 153 3.290 2.346 0.346 582 1HG1 VAL 153 1HG1 VAL 153 3.390 2.567 3.331 583 2HG1 VAL 153 2HG1 VAL 153 3.691 1.026 2.527 584 3HG1 VAL 153 3HG1 VAL 153 4.717 2.418 2.179 585 1HG2 VAL 153 1HG2 VAL 153 0.844 1.997 0.521 586 2HG2 VAL 153 2HG2 VAL 153 1.782 0.621 1.098 587 3HG2 VAL 153 3HG2 VAL 153 1.037 1.727 2.253 588 H VAL 154 H VAL 154 4.170 5.415 2.533 589 HA VAL 154 HA VAL 154 5.255 6.487 0.022 590 HB VAL 154 HB VAL 154 6.102 8.333 1.237 591 1HG1 VAL 154 1HG1 VAL 154 3.402 7.737 1.185 592 2HG1 VAL 154 2HG1 VAL 154 3.686 8.271 2.842 593 3HG1 VAL 154 3HG1 VAL 154 4.118 9.319 1.491 594 1HG2 VAL 154 1HG2 VAL 154 5.622 6.620 3.647 595 2HG2 VAL 154 2HG2 VAL 154 7.090 7.462 3.151 596 3HG2 VAL 154 3HG2 VAL 154 5.725 8.375 3.795 597 H ILE 155 H ILE 155 7.074 5.621 -0.708 598 HA ILE 155 HA ILE 155 8.728 3.990 1.024 599 HB ILE 155 HB ILE 155 9.417 4.597 -1.826 600 1HG1 ILE 155 1HG1 ILE 155 7.890 2.281 -1.913 601 2HG1 ILE 155 2HG1 ILE 155 6.961 3.349 -0.865 602 1HG2 ILE 155 1HG2 ILE 155 10.926 3.252 -0.395 603 2HG2 ILE 155 2HG2 ILE 155 9.632 2.070 -0.198 604 3HG2 ILE 155 3HG2 ILE 155 10.320 2.366 -1.794 605 1HD1 ILE 155 1HD1 ILE 155 7.629 5.011 -2.921 606 2HD1 ILE 155 2HD1 ILE 155 7.411 3.465 -3.741 607 3HD1 ILE 155 3HD1 ILE 155 6.106 4.137 -2.763 608 H GLU 156 H GLU 156 10.952 4.306 1.376 609 HA GLU 156 HA GLU 156 11.717 7.091 1.546 610 1HB GLU 156 1HB GLU 156 12.109 5.423 3.389 611 2HB GLU 156 2HB GLU 156 13.314 4.659 2.360 612 1HG GLU 156 1HG GLU 156 14.056 7.315 2.356 613 2HG GLU 156 2HG GLU 156 13.508 7.035 4.009 614 1H10 BTN 222 1H10 BTN 122 -15.117 -10.409 4.060 615 2H10 BTN 222 2H10 BTN 122 -15.922 -8.884 3.701 616 1H9 BTN 222 1H9 BTN 122 -14.038 -8.663 5.302 617 2H9 BTN 222 2H9 BTN 122 -13.853 -7.681 3.848 618 1H8 BTN 222 1H8 BTN 122 -12.293 -9.231 2.910 619 2H8 BTN 222 2H8 BTN 122 -12.599 -10.397 4.199 620 1H7 BTN 222 1H7 BTN 122 -11.456 -9.153 5.779 621 2H7 BTN 222 2H7 BTN 122 -11.607 -7.662 4.860 622 H2 BTN 222 H2 BTN 122 -10.036 -8.689 3.154 623 1H6 BTN 222 1H6 BTN 122 -7.314 -9.856 3.235 624 2H6 BTN 222 2H6 BTN 122 -6.919 -10.693 4.729 625 H5 BTN 222 H5 BTN 122 -6.859 -8.030 4.622 626 HN1 BTN 222 HN2 BTN 122 -6.677 -9.272 6.852 627 HN2 BTN 222 HN1 BTN 122 -10.252 -7.550 6.579 628 H4 BTN 222 H4 BTN 122 -8.934 -7.066 4.436 Start of MODEL 2 1 1H GLU 77 H GLU 77 16.825 16.629 -5.230 2 HA GLU 77 HA GLU 77 16.892 15.813 -2.460 3 1HB GLU 77 1HB GLU 77 14.169 16.529 -2.996 4 2HB GLU 77 2HB GLU 77 15.215 17.064 -1.686 5 1HG GLU 77 1HG GLU 77 14.487 19.012 -2.778 6 2HG GLU 77 2HG GLU 77 16.154 18.764 -3.292 7 H ILE 78 H ILE 78 15.519 13.995 -2.013 8 HA ILE 78 HA ILE 78 14.240 12.721 -4.307 9 HB ILE 78 HB ILE 78 16.442 11.800 -4.468 10 1HG1 ILE 78 1HG1 ILE 78 15.997 9.425 -4.124 11 2HG1 ILE 78 2HG1 ILE 78 14.683 9.811 -3.017 12 1HG2 ILE 78 1HG2 ILE 78 16.597 12.251 -1.751 13 2HG2 ILE 78 2HG2 ILE 78 16.608 10.492 -1.882 14 3HG2 ILE 78 3HG2 ILE 78 17.812 11.448 -2.746 15 1HD1 ILE 78 1HD1 ILE 78 14.676 10.714 -5.875 16 2HD1 ILE 78 2HD1 ILE 78 14.053 9.142 -5.375 17 3HD1 ILE 78 3HD1 ILE 78 13.325 10.620 -4.746 18 H SER 79 H SER 79 12.320 11.992 -3.698 19 HA SER 79 HA SER 79 11.972 11.072 -0.921 20 1HB SER 79 1HB SER 79 10.925 13.302 -1.293 21 2HB SER 79 2HB SER 79 9.917 12.585 -2.550 22 HG SER 79 HG SER 79 8.988 12.738 -0.363 23 H GLY 80 H GLY 80 12.644 9.313 -2.923 24 1HA GLY 80 1HA GLY 80 11.899 7.508 -4.179 25 2HA GLY 80 2HA GLY 80 10.990 7.210 -2.704 26 H HIS 81 H HIS 81 8.843 7.141 -2.852 27 HA HIS 81 HA HIS 81 7.342 8.783 -4.631 28 1HB HIS 81 1HB HIS 81 6.460 7.084 -6.107 29 2HB HIS 81 2HB HIS 81 8.217 7.080 -6.224 30 HD1 HIS 81 HD1 HIS 81 5.427 4.860 -5.811 31 HD2 HIS 81 HD2 HIS 81 9.377 4.916 -4.522 32 HE1 HIS 81 HE1 HIS 81 5.953 2.491 -5.153 33 HE2 HIS 81 HE2 HIS 81 8.365 2.537 -4.427 34 H ILE 82 H ILE 82 5.179 8.828 -4.110 35 HA ILE 82 HA ILE 82 4.434 7.244 -1.749 36 HB ILE 82 HB ILE 82 3.323 9.849 -2.793 37 1HG1 ILE 82 1HG1 ILE 82 4.186 10.750 -0.666 38 2HG1 ILE 82 2HG1 ILE 82 4.824 9.160 -0.256 39 1HG2 ILE 82 1HG2 ILE 82 1.982 7.881 -1.314 40 2HG2 ILE 82 2HG2 ILE 82 2.409 9.148 -0.165 41 3HG2 ILE 82 3HG2 ILE 82 1.471 9.544 -1.606 42 1HD1 ILE 82 1HD1 ILE 82 5.717 10.178 -2.846 43 2HD1 ILE 82 2HD1 ILE 82 6.226 11.145 -1.462 44 3HD1 ILE 82 3HD1 ILE 82 6.632 9.430 -1.536 45 H VAL 83 H VAL 83 3.212 5.532 -2.152 46 HA VAL 83 HA VAL 83 1.689 5.291 -4.584 47 HB VAL 83 HB VAL 83 1.686 3.421 -2.213 48 1HG1 VAL 83 1HG1 VAL 83 0.400 3.418 -4.815 49 2HG1 VAL 83 2HG1 VAL 83 1.379 1.975 -4.548 50 3HG1 VAL 83 3HG1 VAL 83 0.104 2.400 -3.406 51 1HG2 VAL 83 1HG2 VAL 83 3.964 3.988 -3.274 52 2HG2 VAL 83 2HG2 VAL 83 3.527 2.290 -3.081 53 3HG2 VAL 83 3HG2 VAL 83 3.382 3.065 -4.658 54 H ARG 84 H ARG 84 0.061 6.828 -4.502 55 HA ARG 84 HA ARG 84 -1.860 6.638 -2.291 56 1HB ARG 84 1HB ARG 84 -2.677 8.790 -2.962 57 2HB ARG 84 2HB ARG 84 -0.923 8.877 -2.895 58 1HG ARG 84 1HG ARG 84 -1.382 8.174 -5.503 59 2HG ARG 84 2HG ARG 84 -2.732 9.253 -5.145 60 1HD ARG 84 1HD ARG 84 -1.299 11.029 -4.580 61 2HD ARG 84 2HD ARG 84 0.102 9.967 -4.452 62 HE ARG 84 HE ARG 84 -0.535 9.688 -7.027 63 1HH1 ARG 84 1HH1 ARG 84 -0.235 12.533 -5.042 64 2HH1 ARG 84 2HH1 ARG 84 0.264 13.552 -6.350 65 1HH2 ARG 84 1HH2 ARG 84 0.121 11.021 -8.759 66 2HH2 ARG 84 2HH2 ARG 84 0.466 12.694 -8.464 67 H SER 85 H SER 85 -3.711 5.591 -2.573 68 HA SER 85 HA SER 85 -4.405 4.163 -4.826 69 1HB SER 85 1HB SER 85 -6.738 4.128 -3.831 70 2HB SER 85 2HB SER 85 -5.446 3.616 -2.746 71 HG SER 85 HG SER 85 -5.692 5.394 -1.578 72 HA PRO 86 HA PRO 86 -5.700 7.384 -7.619 73 1HB PRO 86 1HB PRO 86 -6.715 5.734 -9.538 74 2HB PRO 86 2HB PRO 86 -4.986 6.039 -9.333 75 1HG PRO 86 1HG PRO 86 -6.627 3.721 -8.389 76 2HG PRO 86 2HG PRO 86 -5.012 3.725 -9.121 77 1HD PRO 86 1HD PRO 86 -5.388 3.469 -6.459 78 2HD PRO 86 2HD PRO 86 -3.978 4.307 -7.140 79 H MET 87 H MET 87 -7.748 4.891 -6.307 80 HA MET 87 HA MET 87 -10.028 6.708 -6.476 81 1HB MET 87 1HB MET 87 -11.429 4.583 -7.062 82 2HB MET 87 2HB MET 87 -10.609 5.469 -8.340 83 1HG MET 87 1HG MET 87 -8.684 3.804 -7.962 84 2HG MET 87 2HG MET 87 -9.892 2.839 -7.117 85 1HE MET 87 1HE MET 87 -12.166 2.559 -7.997 86 2HE MET 87 2HE MET 87 -12.659 3.408 -9.461 87 3HE MET 87 3HE MET 87 -12.339 1.675 -9.512 88 H VAL 88 H VAL 88 -11.974 5.541 -5.281 89 HA VAL 88 HA VAL 88 -11.243 5.306 -2.593 90 HB VAL 88 HB VAL 88 -13.764 4.421 -3.997 91 1HG1 VAL 88 1HG1 VAL 88 -13.114 4.541 -1.060 92 2HG1 VAL 88 2HG1 VAL 88 -14.760 4.481 -1.691 93 3HG1 VAL 88 3HG1 VAL 88 -13.650 3.144 -1.994 94 1HG2 VAL 88 1HG2 VAL 88 -12.846 6.939 -3.627 95 2HG2 VAL 88 2HG2 VAL 88 -14.556 6.511 -3.704 96 3HG2 VAL 88 3HG2 VAL 88 -13.765 6.704 -2.140 97 H GLY 89 H GLY 89 -11.509 3.462 -1.157 98 1HA GLY 89 1HA GLY 89 -11.800 0.814 -1.924 99 2HA GLY 89 2HA GLY 89 -10.090 1.184 -2.094 100 H THR 90 H THR 90 -10.018 -0.586 -0.435 101 HA THR 90 HA THR 90 -10.192 0.610 2.249 102 HB THR 90 HB THR 90 -10.554 -2.338 1.897 103 HG1 THR 90 HG1 THR 90 -12.594 -0.397 1.563 104 1HG2 THR 90 1HG2 THR 90 -10.801 -0.466 4.037 105 2HG2 THR 90 2HG2 THR 90 -12.354 -1.250 3.748 106 3HG2 THR 90 3HG2 THR 90 -10.920 -2.226 4.069 107 H PHE 91 H PHE 91 -8.095 1.041 2.641 108 HA PHE 91 HA PHE 91 -5.926 -0.536 1.745 109 1HB PHE 91 1HB PHE 91 -5.745 1.865 2.356 110 2HB PHE 91 2HB PHE 91 -5.985 1.428 4.046 111 HD1 PHE 91 HD1 PHE 91 -3.757 0.701 1.146 112 HD2 PHE 91 HD2 PHE 91 -4.152 1.000 5.380 113 HE1 PHE 91 HE1 PHE 91 -1.331 0.345 1.392 114 HE2 PHE 91 HE2 PHE 91 -1.726 0.645 5.637 115 HZ PHE 91 HZ PHE 91 -0.313 0.317 3.640 116 H TYR 92 H TYR 92 -4.294 -1.496 3.314 117 HA TYR 92 HA TYR 92 -5.299 -2.551 5.782 118 1HB TYR 92 1HB TYR 92 -5.249 -4.228 3.324 119 2HB TYR 92 2HB TYR 92 -4.831 -4.976 4.860 120 HD1 TYR 92 HD1 TYR 92 -6.702 -3.511 6.670 121 HD2 TYR 92 HD2 TYR 92 -7.314 -5.209 2.808 122 HE1 TYR 92 HE1 TYR 92 -9.095 -3.795 7.180 123 HE2 TYR 92 HE2 TYR 92 -9.709 -5.497 3.307 124 HH TYR 92 HH TYR 92 -11.158 -4.166 6.202 125 H ARG 93 H ARG 93 -3.717 -3.836 6.931 126 HA ARG 93 HA ARG 93 -0.975 -3.360 5.962 127 1HB ARG 93 1HB ARG 93 -2.233 -3.019 8.633 128 2HB ARG 93 2HB ARG 93 -0.582 -3.621 8.598 129 1HG ARG 93 1HG ARG 93 0.266 -1.664 7.783 130 2HG ARG 93 2HG ARG 93 -1.241 -1.217 6.980 131 1HD ARG 93 1HD ARG 93 -1.211 0.267 8.737 132 2HD ARG 93 2HD ARG 93 -2.155 -1.056 9.421 133 HE ARG 93 HE ARG 93 -0.480 -1.413 10.935 134 1HH1 ARG 93 1HH1 ARG 93 0.754 0.523 8.317 135 2HH1 ARG 93 2HH1 ARG 93 2.275 0.827 9.086 136 1HH2 ARG 93 1HH2 ARG 93 1.520 -1.019 11.958 137 2HH2 ARG 93 2HH2 ARG 93 2.712 -0.050 11.156 138 H THR 94 H THR 94 -3.262 -5.640 7.158 139 HA THR 94 HA THR 94 -1.283 -7.777 6.821 140 HB THR 94 HB THR 94 -2.246 -8.956 8.796 141 HG1 THR 94 HG1 THR 94 -3.957 -8.164 9.674 142 1HG2 THR 94 1HG2 THR 94 -0.722 -6.445 9.016 143 2HG2 THR 94 2HG2 THR 94 -1.439 -7.066 10.503 144 3HG2 THR 94 3HG2 THR 94 -0.330 -8.072 9.573 145 HA PRO 95 HA PRO 95 -4.850 -8.972 4.324 146 1HB PRO 95 1HB PRO 95 -3.517 -10.713 2.758 147 2HB PRO 95 2HB PRO 95 -3.404 -8.964 2.531 148 1HG PRO 95 1HG PRO 95 -1.501 -10.821 3.910 149 2HG PRO 95 2HG PRO 95 -1.151 -9.491 2.791 150 1HD PRO 95 1HD PRO 95 -0.935 -9.259 5.496 151 2HD PRO 95 2HD PRO 95 -1.338 -7.895 4.435 152 H SER 96 H SER 96 -4.891 -9.986 6.827 153 HA SER 96 HA SER 96 -6.263 -12.281 6.774 154 1HB SER 96 1HB SER 96 -4.832 -13.837 5.959 155 2HB SER 96 2HB SER 96 -3.410 -12.858 6.325 156 HG SER 96 HG SER 96 -3.148 -14.266 7.867 157 HA PRO 97 HA PRO 97 -6.564 -10.970 10.997 158 1HB PRO 97 1HB PRO 97 -7.487 -13.793 11.316 159 2HB PRO 97 2HB PRO 97 -8.236 -12.295 11.880 160 1HG PRO 97 1HG PRO 97 -9.199 -13.562 9.751 161 2HG PRO 97 2HG PRO 97 -9.117 -11.792 9.792 162 1HD PRO 97 1HD PRO 97 -7.392 -13.737 8.333 163 2HD PRO 97 2HD PRO 97 -7.908 -12.107 7.860 164 H ASP 98 H ASP 98 -4.197 -10.955 11.092 165 HA ASP 98 HA ASP 98 -2.444 -11.391 12.548 166 1HB ASP 98 1HB ASP 98 -4.278 -12.966 13.718 167 2HB ASP 98 2HB ASP 98 -3.225 -14.212 13.053 168 H ALA 99 H ALA 99 -2.103 -11.449 9.948 169 HA ALA 99 HA ALA 99 -0.851 -13.995 9.218 170 1HB ALA 99 1HB ALA 99 -2.402 -12.210 7.772 171 2HB ALA 99 2HB ALA 99 -0.763 -11.944 7.176 172 3HB ALA 99 3HB ALA 99 -1.468 -13.559 7.124 173 H LYS 100 H LYS 100 0.908 -12.784 7.271 174 HA LYS 100 HA LYS 100 3.120 -12.191 9.036 175 1HB LYS 100 1HB LYS 100 2.807 -12.849 6.146 176 2HB LYS 100 2HB LYS 100 4.263 -12.001 6.648 177 1HG LYS 100 1HG LYS 100 3.307 -14.607 7.815 178 2HG LYS 100 2HG LYS 100 4.536 -14.449 6.558 179 1HD LYS 100 1HD LYS 100 5.812 -12.976 8.163 180 2HD LYS 100 2HD LYS 100 4.663 -13.474 9.405 181 1HE LYS 100 1HE LYS 100 5.880 -15.296 9.765 182 2HE LYS 100 2HE LYS 100 5.544 -15.821 8.115 183 1HZ LYS 100 1HZ LYS 100 7.482 -14.570 7.372 184 2HZ LYS 100 2HZ LYS 100 7.808 -14.095 8.963 185 3HZ LYS 100 3HZ LYS 100 7.913 -15.728 8.528 186 H ALA 101 H ALA 101 0.738 -10.317 7.939 187 HA ALA 101 HA ALA 101 0.442 -8.090 7.590 188 1HB ALA 101 1HB ALA 101 2.167 -8.329 9.683 189 2HB ALA 101 2HB ALA 101 3.066 -7.268 8.598 190 3HB ALA 101 3HB ALA 101 1.449 -6.815 9.135 191 H PHE 102 H PHE 102 0.527 -7.014 5.738 192 HA PHE 102 HA PHE 102 2.292 -7.610 3.668 193 1HB PHE 102 1HB PHE 102 0.220 -5.574 4.175 194 2HB PHE 102 2HB PHE 102 1.437 -5.114 2.990 195 HD1 PHE 102 HD1 PHE 102 2.038 -7.469 1.521 196 HD2 PHE 102 HD2 PHE 102 -1.712 -6.217 3.116 197 HE1 PHE 102 HE1 PHE 102 0.869 -8.795 -0.197 198 HE2 PHE 102 HE2 PHE 102 -2.889 -7.541 1.402 199 HZ PHE 102 HZ PHE 102 -1.597 -8.831 -0.258 200 H ILE 103 H ILE 103 3.252 -5.305 2.574 201 HA ILE 103 HA ILE 103 5.676 -4.937 4.003 202 HB ILE 103 HB ILE 103 4.742 -3.109 1.809 203 1HG1 ILE 103 1HG1 ILE 103 4.244 -5.245 0.903 204 2HG1 ILE 103 2HG1 ILE 103 5.820 -4.810 0.250 205 1HG2 ILE 103 1HG2 ILE 103 7.004 -3.059 3.233 206 2HG2 ILE 103 2HG2 ILE 103 7.489 -4.187 1.967 207 3HG2 ILE 103 3HG2 ILE 103 6.925 -2.571 1.540 208 1HD1 ILE 103 1HD1 ILE 103 6.837 -6.192 2.081 209 2HD1 ILE 103 2HD1 ILE 103 5.209 -6.763 2.447 210 3HD1 ILE 103 3HD1 ILE 103 5.924 -7.086 0.867 211 H GLU 104 H GLU 104 5.664 -3.891 5.895 212 HA GLU 104 HA GLU 104 4.098 -1.425 6.150 213 1HB GLU 104 1HB GLU 104 5.478 -2.480 8.522 214 2HB GLU 104 2HB GLU 104 3.839 -1.869 8.353 215 1HG GLU 104 1HG GLU 104 4.686 -4.561 7.325 216 2HG GLU 104 2HG GLU 104 4.078 -4.304 8.960 217 H VAL 105 H VAL 105 5.350 -0.027 8.034 218 HA VAL 105 HA VAL 105 7.417 1.277 6.671 219 HB VAL 105 HB VAL 105 7.116 1.417 9.658 220 1HG1 VAL 105 1HG1 VAL 105 8.198 3.141 7.498 221 2HG1 VAL 105 2HG1 VAL 105 7.435 3.932 8.878 222 3HG1 VAL 105 3HG1 VAL 105 8.805 2.850 9.128 223 1HG2 VAL 105 1HG2 VAL 105 5.143 2.120 7.592 224 2HG2 VAL 105 2HG2 VAL 105 4.921 1.784 9.308 225 3HG2 VAL 105 3HG2 VAL 105 5.466 3.378 8.786 226 H GLY 106 H GLY 106 9.647 1.366 7.000 227 1HA GLY 106 1HA GLY 106 11.740 0.578 7.519 228 2HA GLY 106 2HA GLY 106 11.024 -0.190 8.928 229 H GLN 107 H GLN 107 9.601 -1.034 5.940 230 HA GLN 107 HA GLN 107 10.894 -3.661 6.092 231 1HB GLN 107 1HB GLN 107 8.465 -3.697 6.267 232 2HB GLN 107 2HB GLN 107 8.316 -2.799 4.764 233 1HG GLN 107 1HG GLN 107 8.669 -4.618 3.481 234 2HG GLN 107 2HG GLN 107 9.812 -5.336 4.616 235 1HE2 GLN 107 2HE2 GLN 107 8.129 -7.030 3.525 236 2HE2 GLN 107 1HE2 GLN 107 6.878 -7.501 4.622 237 H LYS 108 H LYS 108 11.484 -4.746 4.069 238 HA LYS 108 HA LYS 108 12.684 -2.871 2.207 239 1HB LYS 108 1HB LYS 108 14.187 -4.558 2.780 240 2HB LYS 108 2HB LYS 108 12.957 -5.812 2.725 241 1HG LYS 108 1HG LYS 108 14.377 -6.146 0.863 242 2HG LYS 108 2HG LYS 108 12.866 -5.482 0.241 243 1HD LYS 108 1HD LYS 108 14.331 -4.149 -0.886 244 2HD LYS 108 2HD LYS 108 14.177 -3.197 0.593 245 1HE LYS 108 1HE LYS 108 16.174 -4.944 1.242 246 2HE LYS 108 2HE LYS 108 16.472 -4.668 -0.473 247 1HZ LYS 108 1HZ LYS 108 15.908 -2.233 0.885 248 2HZ LYS 108 2HZ LYS 108 17.213 -3.036 1.602 249 3HZ LYS 108 3HZ LYS 108 17.256 -2.653 -0.046 250 H VAL 109 H VAL 109 12.380 -2.931 -0.053 251 HA VAL 109 HA VAL 109 10.177 -4.511 -1.110 252 HB VAL 109 HB VAL 109 9.425 -2.203 -2.227 253 1HG1 VAL 109 1HG1 VAL 109 8.561 -3.288 0.448 254 2HG1 VAL 109 2HG1 VAL 109 7.664 -2.069 -0.458 255 3HG1 VAL 109 3HG1 VAL 109 7.894 -3.680 -1.138 256 1HG2 VAL 109 1HG2 VAL 109 11.156 -0.963 -0.898 257 2HG2 VAL 109 2HG2 VAL 109 9.509 -0.359 -0.719 258 3HG2 VAL 109 3HG2 VAL 109 10.226 -1.352 0.549 259 H ASN 110 H ASN 110 10.111 -4.576 -3.409 260 HA ASN 110 HA ASN 110 12.198 -3.234 -4.904 261 1HB ASN 110 1HB ASN 110 12.537 -5.917 -3.952 262 2HB ASN 110 2HB ASN 110 12.430 -5.932 -5.709 263 1HD2 ASN 110 2HD2 ASN 110 14.076 -5.121 -6.906 264 2HD2 ASN 110 1HD2 ASN 110 15.557 -4.536 -6.234 265 H VAL 111 H VAL 111 11.714 -3.004 -7.048 266 HA VAL 111 HA VAL 111 9.214 -2.907 -8.003 267 HB VAL 111 HB VAL 111 11.524 -3.873 -9.692 268 1HG1 VAL 111 1HG1 VAL 111 9.289 -4.016 -10.741 269 2HG1 VAL 111 2HG1 VAL 111 9.077 -2.287 -10.462 270 3HG1 VAL 111 3HG1 VAL 111 10.351 -2.856 -11.540 271 1HG2 VAL 111 1HG2 VAL 111 11.182 -1.420 -8.263 272 2HG2 VAL 111 2HG2 VAL 111 12.516 -1.927 -9.298 273 3HG2 VAL 111 3HG2 VAL 111 11.123 -1.102 -9.996 274 H GLY 112 H GLY 112 7.713 -4.445 -7.598 275 1HA GLY 112 1HA GLY 112 6.704 -6.357 -8.817 276 2HA GLY 112 2HA GLY 112 8.264 -7.150 -8.658 277 H ASP 113 H ASP 113 8.638 -6.195 -5.905 278 HA ASP 113 HA ASP 113 7.536 -8.378 -4.534 279 1HB ASP 113 1HB ASP 113 9.260 -6.157 -3.932 280 2HB ASP 113 2HB ASP 113 8.107 -6.391 -2.622 281 H THR 114 H THR 114 5.544 -8.723 -3.836 282 HA THR 114 HA THR 114 3.316 -7.317 -4.186 283 HB THR 114 HB THR 114 3.305 -8.372 -1.464 284 HG1 THR 114 HG1 THR 114 4.556 -10.002 -1.797 285 1HG2 THR 114 1HG2 THR 114 1.557 -8.277 -3.619 286 2HG2 THR 114 2HG2 THR 114 1.957 -9.984 -3.425 287 3HG2 THR 114 3HG2 THR 114 1.298 -9.072 -2.067 288 H LEU 115 H LEU 115 1.983 -5.885 -2.961 289 HA LEU 115 HA LEU 115 3.518 -4.085 -1.205 290 1HB LEU 115 1HB LEU 115 2.939 -3.081 -3.377 291 2HB LEU 115 2HB LEU 115 1.242 -3.394 -3.065 292 HG LEU 115 HG LEU 115 2.004 -1.936 -0.853 293 1HD1 LEU 115 1HD1 LEU 115 4.128 -1.568 -2.419 294 2HD1 LEU 115 2HD1 LEU 115 3.080 -0.313 -3.081 295 3HD1 LEU 115 3HD1 LEU 115 3.490 -0.305 -1.366 296 1HD2 LEU 115 1HD2 LEU 115 -0.045 -1.778 -2.306 297 2HD2 LEU 115 2HD2 LEU 115 0.602 -0.238 -1.741 298 3HD2 LEU 115 3HD2 LEU 115 0.900 -0.765 -3.398 299 H CYS 116 H CYS 116 0.055 -4.354 -1.957 300 HA CYS 116 HA CYS 116 -0.731 -5.578 0.437 301 1HB CYS 116 1HB CYS 116 -1.749 -3.570 1.563 302 2HB CYS 116 2HB CYS 116 0.009 -3.630 1.611 303 HG CYS 116 HG CYS 116 -1.010 -1.917 -0.675 304 H ILE 117 H ILE 117 -3.077 -5.559 0.747 305 HA ILE 117 HA ILE 117 -4.433 -5.471 -1.802 306 HB ILE 117 HB ILE 117 -5.335 -6.344 0.938 307 1HG1 ILE 117 1HG1 ILE 117 -5.425 -8.214 -1.319 308 2HG1 ILE 117 2HG1 ILE 117 -3.804 -7.633 -0.954 309 1HG2 ILE 117 1HG2 ILE 117 -6.886 -6.313 -1.646 310 2HG2 ILE 117 2HG2 ILE 117 -7.382 -7.171 -0.186 311 3HG2 ILE 117 3HG2 ILE 117 -7.256 -5.411 -0.175 312 1HD1 ILE 117 1HD1 ILE 117 -4.878 -8.270 1.519 313 2HD1 ILE 117 2HD1 ILE 117 -5.435 -9.553 0.445 314 3HD1 ILE 117 3HD1 ILE 117 -3.711 -9.213 0.592 315 H VAL 118 H VAL 118 -6.142 -4.180 -2.375 316 HA VAL 118 HA VAL 118 -6.485 -1.754 -0.757 317 HB VAL 118 HB VAL 118 -7.461 -2.085 -3.581 318 1HG1 VAL 118 1HG1 VAL 118 -6.641 0.300 -1.926 319 2HG1 VAL 118 2HG1 VAL 118 -7.132 0.363 -3.619 320 3HG1 VAL 118 3HG1 VAL 118 -8.282 -0.153 -2.385 321 1HG2 VAL 118 1HG2 VAL 118 -5.003 -2.678 -3.345 322 2HG2 VAL 118 2HG2 VAL 118 -5.397 -1.380 -4.472 323 3HG2 VAL 118 3HG2 VAL 118 -4.748 -0.995 -2.878 324 H GLU 119 H GLU 119 -8.082 -4.596 -1.773 325 HA GLU 119 HA GLU 119 -10.301 -5.231 -1.817 326 1HB GLU 119 1HB GLU 119 -9.621 -5.587 0.492 327 2HB GLU 119 2HB GLU 119 -10.013 -3.920 0.892 328 1HG GLU 119 1HG GLU 119 -12.375 -4.773 -0.115 329 2HG GLU 119 2HG GLU 119 -11.758 -6.257 0.610 330 H ALA 120 H ALA 120 -10.404 -3.231 -3.439 331 HA ALA 120 HA ALA 120 -12.123 -1.103 -2.477 332 1HB ALA 120 1HB ALA 120 -10.230 -1.223 -4.445 333 2HB ALA 120 2HB ALA 120 -11.733 -1.298 -5.367 334 3HB ALA 120 3HB ALA 120 -11.438 0.050 -4.269 335 H MET 121 H MET 121 -12.590 -4.228 -3.519 336 HA MET 121 HA MET 121 -15.404 -3.958 -3.630 337 1HB MET 121 1HB MET 121 -15.876 -4.367 -5.909 338 2HB MET 121 2HB MET 121 -14.684 -3.075 -5.904 339 1HG MET 121 1HG MET 121 -12.925 -4.706 -6.393 340 2HG MET 121 2HG MET 121 -14.132 -5.989 -6.419 341 1HE MET 121 1HE MET 121 -12.666 -6.347 -8.642 342 2HE MET 121 2HE MET 121 -14.306 -6.910 -8.963 343 3HE MET 121 3HE MET 121 -13.460 -5.931 -10.161 344 H LYS 122 H LYS 122 -13.296 -5.544 -2.368 345 HA LYS 122 HA LYS 122 -13.090 -7.671 -1.573 346 1HB LYS 122 1HB LYS 122 -15.658 -7.615 -2.017 347 2HB LYS 122 2HB LYS 122 -15.268 -8.621 -3.405 348 1HG LYS 122 1HG LYS 122 -15.956 -9.827 -1.299 349 2HG LYS 122 2HG LYS 122 -14.447 -10.358 -2.048 350 1HD LYS 122 1HD LYS 122 -14.344 -10.126 0.440 351 2HD LYS 122 2HD LYS 122 -13.146 -9.167 -0.434 352 1HE LYS 122 1HE LYS 122 -14.497 -7.177 -0.172 353 2HE LYS 122 2HE LYS 122 -15.777 -8.114 0.597 354 H MET 123 H MET 123 -12.146 -6.625 -4.357 355 HA MET 123 HA MET 123 -11.587 -9.143 -5.700 356 1HB MET 123 1HB MET 123 -10.980 -7.901 -7.555 357 2HB MET 123 2HB MET 123 -12.188 -6.863 -6.813 358 1HG MET 123 1HG MET 123 -9.218 -6.563 -6.446 359 2HG MET 123 2HG MET 123 -10.188 -5.653 -7.604 360 1HE MET 123 1HE MET 123 -9.352 -3.708 -6.993 361 2HE MET 123 2HE MET 123 -10.482 -2.680 -6.112 362 3HE MET 123 3HE MET 123 -8.972 -3.184 -5.353 363 H MET 124 H MET 124 -10.312 -7.755 -3.101 364 HA MET 124 HA MET 124 -8.235 -7.567 -2.152 365 1HB MET 124 1HB MET 124 -7.943 -10.224 -3.565 366 2HB MET 124 2HB MET 124 -6.992 -9.679 -2.189 367 1HG MET 124 1HG MET 124 -9.951 -10.229 -2.215 368 2HG MET 124 2HG MET 124 -8.700 -11.227 -1.475 369 1HE MET 124 1HE MET 124 -11.311 -10.234 -0.445 370 2HE MET 124 2HE MET 124 -10.624 -10.587 1.140 371 3HE MET 124 3HE MET 124 -11.292 -8.990 0.805 372 H ASN 125 H ASN 125 -8.336 -6.153 -4.577 373 HA ASN 125 HA ASN 125 -6.269 -6.721 -6.374 374 1HB ASN 125 1HB ASN 125 -8.054 -5.040 -6.766 375 2HB ASN 125 2HB ASN 125 -7.298 -3.992 -5.566 376 1HD2 ASN 125 2HD2 ASN 125 -7.271 -2.495 -7.397 377 2HD2 ASN 125 1HD2 ASN 125 -5.937 -2.555 -8.493 378 H GLN 126 H GLN 126 -4.581 -7.479 -4.950 379 HA GLN 126 HA GLN 126 -3.278 -5.563 -3.226 380 1HB GLN 126 1HB GLN 126 -1.891 -7.341 -2.525 381 2HB GLN 126 2HB GLN 126 -3.487 -8.045 -2.751 382 1HG GLN 126 1HG GLN 126 -2.573 -8.594 -5.139 383 2HG GLN 126 2HG GLN 126 -1.005 -8.413 -4.352 384 1HE2 GLN 126 2HE2 GLN 126 -0.384 -10.514 -4.406 385 2HE2 GLN 126 1HE2 GLN 126 -1.190 -11.781 -3.554 386 H ILE 127 H ILE 127 -1.914 -4.105 -3.939 387 HA ILE 127 HA ILE 127 -0.725 -4.269 -6.553 388 HB ILE 127 HB ILE 127 -0.113 -2.249 -4.396 389 1HG1 ILE 127 1HG1 ILE 127 -2.508 -2.260 -4.677 390 2HG1 ILE 127 2HG1 ILE 127 -1.863 -0.846 -5.503 391 1HG2 ILE 127 1HG2 ILE 127 0.348 -2.412 -7.340 392 2HG2 ILE 127 2HG2 ILE 127 0.153 -0.838 -6.570 393 3HG2 ILE 127 3HG2 ILE 127 1.449 -1.916 -6.054 394 1HD1 ILE 127 1HD1 ILE 127 -1.908 -2.359 -7.600 395 2HD1 ILE 127 2HD1 ILE 127 -3.027 -3.339 -6.652 396 3HD1 ILE 127 3HD1 ILE 127 -3.410 -1.653 -7.004 397 H GLU 128 H GLU 128 1.664 -3.813 -6.810 398 HA GLU 128 HA GLU 128 3.234 -5.186 -4.736 399 1HB GLU 128 1HB GLU 128 4.280 -6.579 -6.240 400 2HB GLU 128 2HB GLU 128 2.675 -6.482 -6.950 401 1HG GLU 128 1HG GLU 128 3.828 -4.425 -8.210 402 2HG GLU 128 2HG GLU 128 5.252 -5.429 -7.924 403 H ALA 129 H ALA 129 5.040 -4.176 -4.114 404 HA ALA 129 HA ALA 129 5.621 -1.583 -4.482 405 1HB ALA 129 1HB ALA 129 7.441 -3.902 -3.979 406 2HB ALA 129 2HB ALA 129 8.092 -2.269 -4.124 407 3HB ALA 129 3HB ALA 129 6.907 -2.639 -2.872 408 H ASP 130 H ASP 130 5.603 -0.531 -6.372 409 HA ASP 130 HA ASP 130 6.678 -1.655 -8.783 410 1HB ASP 130 1HB ASP 130 6.182 0.659 -9.703 411 2HB ASP 130 2HB ASP 130 4.800 -0.214 -9.041 412 H LYS 131 H LYS 131 7.761 0.599 -6.335 413 HA LYS 131 HA LYS 131 10.330 0.842 -7.757 414 1HB LYS 131 1HB LYS 131 8.606 2.871 -6.772 415 2HB LYS 131 2HB LYS 131 10.044 2.872 -5.762 416 1HG LYS 131 1HG LYS 131 11.249 3.848 -7.346 417 2HG LYS 131 2HG LYS 131 10.741 2.665 -8.553 418 1HD LYS 131 1HD LYS 131 8.634 4.551 -7.847 419 2HD LYS 131 2HD LYS 131 10.065 5.335 -8.519 420 1HE LYS 131 1HE LYS 131 8.882 4.868 -10.432 421 2HE LYS 131 2HE LYS 131 9.900 3.434 -10.307 422 1HZ LYS 131 1HZ LYS 131 7.742 2.722 -8.873 423 2HZ LYS 131 2HZ LYS 131 7.035 3.685 -10.070 424 3HZ LYS 131 3HZ LYS 131 7.972 2.346 -10.506 425 H SER 132 H SER 132 12.079 0.076 -6.755 426 HA SER 132 HA SER 132 11.912 -1.420 -4.393 427 1HB SER 132 1HB SER 132 14.431 -0.226 -5.568 428 2HB SER 132 2HB SER 132 14.305 -1.658 -4.546 429 HG SER 132 HG SER 132 14.416 -2.438 -6.582 430 H GLY 133 H GLY 133 13.871 -0.872 -2.691 431 1HA GLY 133 1HA GLY 133 14.823 1.023 -1.448 432 2HA GLY 133 2HA GLY 133 13.304 1.861 -1.722 433 H THR 134 H THR 134 12.719 2.188 0.379 434 HA THR 134 HA THR 134 11.838 -0.187 1.828 435 HB THR 134 HB THR 134 13.803 1.838 2.870 436 HG1 THR 134 HG1 THR 134 14.085 -0.554 2.009 437 1HG2 THR 134 1HG2 THR 134 11.863 1.594 4.467 438 2HG2 THR 134 2HG2 THR 134 12.348 -0.093 4.643 439 3HG2 THR 134 3HG2 THR 134 13.460 1.197 5.100 440 H VAL 135 H VAL 135 9.821 0.096 2.493 441 HA VAL 135 HA VAL 135 8.282 2.331 2.068 442 HB VAL 135 HB VAL 135 7.875 0.308 4.277 443 1HG1 VAL 135 1HG1 VAL 135 6.091 2.368 3.027 444 2HG1 VAL 135 2HG1 VAL 135 5.427 0.918 3.783 445 3HG1 VAL 135 3HG1 VAL 135 6.391 2.047 4.735 446 1HG2 VAL 135 1HG2 VAL 135 6.955 0.299 1.404 447 2HG2 VAL 135 2HG2 VAL 135 8.123 -0.798 2.139 448 3HG2 VAL 135 3HG2 VAL 135 6.434 -0.846 2.639 449 H LYS 136 H LYS 136 8.485 4.320 2.843 450 HA LYS 136 HA LYS 136 9.965 4.936 5.191 451 1HB LYS 136 1HB LYS 136 9.307 6.352 3.002 452 2HB LYS 136 2HB LYS 136 8.070 6.944 4.102 453 1HG LYS 136 1HG LYS 136 10.152 8.317 4.013 454 2HG LYS 136 2HG LYS 136 9.696 7.763 5.625 455 1HD LYS 136 1HD LYS 136 11.399 5.828 4.359 456 2HD LYS 136 2HD LYS 136 12.160 7.419 4.322 457 1HE LYS 136 1HE LYS 136 12.376 7.518 6.579 458 2HE LYS 136 2HE LYS 136 10.891 6.612 6.869 459 1HZ LYS 136 1HZ LYS 136 13.143 5.179 5.677 460 2HZ LYS 136 2HZ LYS 136 13.256 5.580 7.316 461 3HZ LYS 136 3HZ LYS 136 11.968 4.633 6.766 462 H ALA 137 H ALA 137 6.496 4.987 4.419 463 HA ALA 137 HA ALA 137 5.654 4.152 6.943 464 1HB ALA 137 1HB ALA 137 6.612 6.451 7.505 465 2HB ALA 137 2HB ALA 137 5.209 7.107 6.661 466 3HB ALA 137 3HB ALA 137 4.986 6.086 8.082 467 H ILE 138 H ILE 138 3.223 5.147 7.297 468 HA ILE 138 HA ILE 138 1.892 5.054 4.674 469 HB ILE 138 HB ILE 138 1.156 3.490 7.145 470 1HG1 ILE 138 1HG1 ILE 138 1.903 2.740 4.316 471 2HG1 ILE 138 2HG1 ILE 138 2.764 2.336 5.798 472 1HG2 ILE 138 1HG2 ILE 138 -0.827 4.589 6.136 473 2HG2 ILE 138 2HG2 ILE 138 -0.469 3.760 4.621 474 3HG2 ILE 138 3HG2 ILE 138 -0.883 2.827 6.059 475 1HD1 ILE 138 1HD1 ILE 138 -0.015 1.360 5.224 476 2HD1 ILE 138 2HD1 ILE 138 1.434 0.486 4.726 477 3HD1 ILE 138 3HD1 ILE 138 1.123 0.776 6.438 478 H LEU 139 H LEU 139 -0.165 6.079 4.571 479 HA LEU 139 HA LEU 139 -0.663 7.972 6.776 480 1HB LEU 139 1HB LEU 139 -1.399 8.559 3.930 481 2HB LEU 139 2HB LEU 139 -1.176 9.677 5.262 482 HG LEU 139 HG LEU 139 0.919 8.308 3.603 483 1HD1 LEU 139 1HD1 LEU 139 -0.263 10.836 3.561 484 2HD1 LEU 139 2HD1 LEU 139 1.332 11.076 4.276 485 3HD1 LEU 139 3HD1 LEU 139 1.180 10.315 2.692 486 1HD2 LEU 139 1HD2 LEU 139 1.046 8.865 6.423 487 2HD2 LEU 139 2HD2 LEU 139 2.241 8.102 5.375 488 3HD2 LEU 139 3HD2 LEU 139 2.207 9.857 5.541 489 H VAL 140 H VAL 140 -2.114 6.073 4.170 490 HA VAL 140 HA VAL 140 -4.785 6.633 4.546 491 HB VAL 140 HB VAL 140 -3.484 4.015 3.798 492 1HG1 VAL 140 1HG1 VAL 140 -6.352 4.748 4.111 493 2HG1 VAL 140 2HG1 VAL 140 -5.890 3.693 2.775 494 3HG1 VAL 140 3HG1 VAL 140 -5.533 3.220 4.436 495 1HG2 VAL 140 1HG2 VAL 140 -3.295 6.139 2.349 496 2HG2 VAL 140 2HG2 VAL 140 -3.802 4.637 1.577 497 3HG2 VAL 140 3HG2 VAL 140 -4.999 5.865 1.990 498 H GLU 141 H GLU 141 -2.955 3.984 6.090 499 HA GLU 141 HA GLU 141 -3.129 3.185 8.246 500 1HB GLU 141 1HB GLU 141 -5.699 4.709 8.601 501 2HB GLU 141 2HB GLU 141 -4.593 4.129 9.839 502 1HG GLU 141 1HG GLU 141 -3.213 5.919 8.090 503 2HG GLU 141 2HG GLU 141 -4.699 6.674 8.663 504 H SER 142 H SER 142 -3.488 1.111 7.637 505 HA SER 142 HA SER 142 -5.459 -0.075 6.270 506 1HB SER 142 1HB SER 142 -3.862 -1.581 6.981 507 2HB SER 142 2HB SER 142 -3.885 -0.985 8.641 508 HG SER 142 HG SER 142 -4.941 -2.876 8.763 509 H GLY 143 H GLY 143 -7.411 -1.305 6.898 510 1HA GLY 143 1HA GLY 143 -9.438 -1.535 7.966 511 2HA GLY 143 2HA GLY 143 -8.736 -0.732 9.362 512 H GLN 144 H GLN 144 -8.179 1.235 6.788 513 HA GLN 144 HA GLN 144 -10.686 2.722 7.214 514 1HB GLN 144 1HB GLN 144 -8.598 3.724 8.247 515 2HB GLN 144 2HB GLN 144 -8.002 3.963 6.611 516 1HG GLN 144 1HG GLN 144 -10.689 5.023 7.301 517 2HG GLN 144 2HG GLN 144 -9.267 5.863 7.918 518 1HE2 GLN 144 2HE2 GLN 144 -7.494 5.651 5.901 519 2HE2 GLN 144 1HE2 GLN 144 -8.080 6.454 4.489 520 HA PRO 145 HA PRO 145 -11.093 2.265 2.815 521 1HB PRO 145 1HB PRO 145 -13.279 3.822 2.496 522 2HB PRO 145 2HB PRO 145 -13.358 2.212 3.219 523 1HG PRO 145 1HG PRO 145 -13.310 4.889 4.558 524 2HG PRO 145 2HG PRO 145 -14.307 3.470 4.930 525 1HD PRO 145 1HD PRO 145 -12.070 4.119 6.334 526 2HD PRO 145 2HD PRO 145 -12.627 2.447 6.122 527 H VAL 146 H VAL 146 -9.781 3.255 1.424 528 HA VAL 146 HA VAL 146 -8.881 5.922 1.715 529 HB VAL 146 HB VAL 146 -7.803 5.631 -0.458 530 1HG1 VAL 146 1HG1 VAL 146 -7.640 3.328 1.466 531 2HG1 VAL 146 2HG1 VAL 146 -6.563 3.474 0.076 532 3HG1 VAL 146 3HG1 VAL 146 -6.568 4.720 1.324 533 1HG2 VAL 146 1HG2 VAL 146 -9.734 4.397 -1.487 534 2HG2 VAL 146 2HG2 VAL 146 -8.143 3.724 -1.843 535 3HG2 VAL 146 3HG2 VAL 146 -9.176 2.956 -0.637 536 H GLU 147 H GLU 147 -9.040 7.536 -0.134 537 HA GLU 147 HA GLU 147 -11.490 7.479 -1.660 538 1HB GLU 147 1HB GLU 147 -12.093 9.808 -0.648 539 2HB GLU 147 2HB GLU 147 -12.574 8.338 0.194 540 1HG GLU 147 1HG GLU 147 -10.676 8.552 1.692 541 2HG GLU 147 2HG GLU 147 -10.138 9.992 0.828 542 H PHE 148 H PHE 148 -10.113 7.670 -3.439 543 HA PHE 148 HA PHE 148 -8.923 8.744 -5.054 544 1HB PHE 148 1HB PHE 148 -10.899 10.429 -4.365 545 2HB PHE 148 2HB PHE 148 -9.509 11.426 -3.956 546 HD1 PHE 148 HD1 PHE 148 -10.815 9.315 -6.737 547 HD2 PHE 148 HD2 PHE 148 -8.558 12.745 -5.587 548 HE1 PHE 148 HE1 PHE 148 -10.574 9.946 -9.108 549 HE2 PHE 148 HE2 PHE 148 -8.313 13.383 -7.956 550 HZ PHE 148 HZ PHE 148 -9.322 11.983 -9.719 551 H ASP 149 H ASP 149 -6.807 9.083 -5.303 552 HA ASP 149 HA ASP 149 -4.618 9.168 -4.561 553 1HB ASP 149 1HB ASP 149 -5.713 11.937 -4.035 554 2HB ASP 149 2HB ASP 149 -3.996 11.547 -4.033 555 H GLU 150 H GLU 150 -4.904 7.680 -2.767 556 HA GLU 150 HA GLU 150 -4.672 9.041 -0.164 557 1HB GLU 150 1HB GLU 150 -6.526 7.023 -0.994 558 2HB GLU 150 2HB GLU 150 -5.475 6.351 0.245 559 1HG GLU 150 1HG GLU 150 -7.279 8.739 0.434 560 2HG GLU 150 2HG GLU 150 -7.339 7.244 1.366 561 HA PRO 151 HA PRO 151 -0.497 7.347 -0.629 562 1HB PRO 151 1HB PRO 151 -0.523 8.335 2.190 563 2HB PRO 151 2HB PRO 151 0.696 8.561 0.931 564 1HG PRO 151 1HG PRO 151 -0.974 10.533 1.569 565 2HG PRO 151 2HG PRO 151 -0.503 10.247 -0.117 566 1HD PRO 151 1HD PRO 151 -3.071 9.643 1.262 567 2HD PRO 151 2HD PRO 151 -2.774 10.099 -0.427 568 H LEU 152 H LEU 152 -1.286 5.164 -0.681 569 HA LEU 152 HA LEU 152 -2.124 3.777 1.644 570 1HB LEU 152 1HB LEU 152 -0.857 2.520 -0.780 571 2HB LEU 152 2HB LEU 152 -2.008 1.799 0.331 572 HG LEU 152 HG LEU 152 -2.797 4.178 -1.312 573 1HD1 LEU 152 1HD1 LEU 152 -2.231 1.459 -2.270 574 2HD1 LEU 152 2HD1 LEU 152 -3.805 2.109 -2.732 575 3HD1 LEU 152 3HD1 LEU 152 -2.332 2.981 -3.154 576 1HD2 LEU 152 1HD2 LEU 152 -4.051 2.457 0.568 577 2HD2 LEU 152 2HD2 LEU 152 -4.741 3.824 -0.307 578 3HD2 LEU 152 3HD2 LEU 152 -4.809 2.206 -1.005 579 H VAL 153 H VAL 153 0.983 3.894 -0.082 580 HA VAL 153 HA VAL 153 2.414 3.467 2.386 581 HB VAL 153 HB VAL 153 2.678 1.422 0.178 582 1HG1 VAL 153 1HG1 VAL 153 4.243 2.020 2.633 583 2HG1 VAL 153 2HG1 VAL 153 4.027 0.332 2.170 584 3HG1 VAL 153 3HG1 VAL 153 4.788 1.463 1.051 585 1HG2 VAL 153 1HG2 VAL 153 1.362 1.313 2.878 586 2HG2 VAL 153 2HG2 VAL 153 0.678 0.907 1.304 587 3HG2 VAL 153 3HG2 VAL 153 1.897 -0.139 2.031 588 H VAL 154 H VAL 154 3.820 5.091 2.213 589 HA VAL 154 HA VAL 154 4.941 5.825 -0.364 590 HB VAL 154 HB VAL 154 5.832 7.757 0.693 591 1HG1 VAL 154 1HG1 VAL 154 3.290 7.514 0.404 592 2HG1 VAL 154 2HG1 VAL 154 3.245 7.377 2.162 593 3HG1 VAL 154 3HG1 VAL 154 3.891 8.834 1.406 594 1HG2 VAL 154 1HG2 VAL 154 5.312 6.293 3.268 595 2HG2 VAL 154 2HG2 VAL 154 6.841 6.918 2.651 596 3HG2 VAL 154 3HG2 VAL 154 5.594 8.034 3.209 597 H ILE 155 H ILE 155 6.978 5.454 -1.033 598 HA ILE 155 HA ILE 155 8.724 3.919 0.774 599 HB ILE 155 HB ILE 155 8.711 3.969 -2.246 600 1HG1 ILE 155 1HG1 ILE 155 8.223 1.380 -1.305 601 2HG1 ILE 155 2HG1 ILE 155 7.228 2.422 -0.291 602 1HG2 ILE 155 1HG2 ILE 155 10.919 3.587 -0.968 603 2HG2 ILE 155 2HG2 ILE 155 10.222 2.025 -0.543 604 3HG2 ILE 155 3HG2 ILE 155 10.468 2.449 -2.237 605 1HD1 ILE 155 1HD1 ILE 155 6.722 3.426 -2.763 606 2HD1 ILE 155 2HD1 ILE 155 6.948 1.711 -3.109 607 3HD1 ILE 155 3HD1 ILE 155 5.735 2.221 -1.935 608 H GLU 156 H GLU 156 10.835 4.514 1.072 609 HA GLU 156 HA GLU 156 11.779 6.917 -0.331 610 1HB GLU 156 1HB GLU 156 10.855 7.328 2.043 611 2HB GLU 156 2HB GLU 156 12.304 6.503 2.600 612 1HG GLU 156 1HG GLU 156 12.980 8.684 2.682 613 2HG GLU 156 2HG GLU 156 13.526 8.225 1.070 614 1H10 BTN 222 1H10 BTN 122 -15.324 -7.701 4.764 615 2H10 BTN 222 2H10 BTN 122 -14.246 -6.541 3.989 616 1H9 BTN 222 1H9 BTN 122 -13.526 -9.029 5.504 617 2H9 BTN 222 2H9 BTN 122 -13.034 -7.364 5.823 618 1H8 BTN 222 1H8 BTN 122 -12.141 -7.839 3.247 619 2H8 BTN 222 2H8 BTN 122 -11.828 -9.357 4.090 620 1H7 BTN 222 1H7 BTN 122 -10.929 -7.682 5.943 621 2H7 BTN 222 2H7 BTN 122 -10.684 -6.659 4.535 622 H2 BTN 222 H2 BTN 122 -9.253 -8.328 3.509 623 1H6 BTN 222 1H6 BTN 122 -7.262 -11.008 5.760 624 2H6 BTN 222 2H6 BTN 122 -7.145 -10.295 4.156 625 H5 BTN 222 H5 BTN 122 -6.270 -8.556 5.453 626 HN1 BTN 222 HN2 BTN 122 -6.840 -9.467 7.769 627 HN2 BTN 222 HN1 BTN 122 -9.522 -6.717 6.735 628 H4 BTN 222 H4 BTN 122 -7.842 -6.991 4.822 Start of MODEL 3 1 1H GLU 77 H GLU 77 15.953 15.933 -4.451 2 HA GLU 77 HA GLU 77 14.943 14.177 -6.395 3 1HB GLU 77 1HB GLU 77 17.459 15.083 -7.095 4 2HB GLU 77 2HB GLU 77 17.796 13.547 -6.304 5 1HG GLU 77 1HG GLU 77 16.867 12.337 -7.957 6 2HG GLU 77 2HG GLU 77 15.599 13.523 -8.262 7 H ILE 78 H ILE 78 14.601 12.192 -5.526 8 HA ILE 78 HA ILE 78 16.081 11.438 -3.111 9 HB ILE 78 HB ILE 78 14.057 12.497 -2.283 10 1HG1 ILE 78 1HG1 ILE 78 13.975 9.477 -2.090 11 2HG1 ILE 78 2HG1 ILE 78 14.884 10.566 -1.048 12 1HG2 ILE 78 1HG2 ILE 78 12.882 11.377 -4.570 13 2HG2 ILE 78 2HG2 ILE 78 12.086 10.622 -3.189 14 3HG2 ILE 78 3HG2 ILE 78 12.110 12.379 -3.341 15 1HD1 ILE 78 1HD1 ILE 78 12.407 11.550 -0.708 16 2HD1 ILE 78 2HD1 ILE 78 12.035 9.853 -1.019 17 3HD1 ILE 78 3HD1 ILE 78 13.117 10.291 0.304 18 H SER 79 H SER 79 15.970 9.179 -2.597 19 HA SER 79 HA SER 79 15.703 7.539 -4.985 20 1HB SER 79 1HB SER 79 16.619 6.556 -2.290 21 2HB SER 79 2HB SER 79 17.035 5.937 -3.888 22 HG SER 79 HG SER 79 18.443 7.547 -4.168 23 H GLY 80 H GLY 80 13.317 8.561 -3.617 24 1HA GLY 80 1HA GLY 80 11.988 5.973 -3.247 25 2HA GLY 80 2HA GLY 80 11.834 7.172 -1.971 26 H HIS 81 H HIS 81 9.523 6.969 -2.406 27 HA HIS 81 HA HIS 81 8.578 9.105 -3.998 28 1HB HIS 81 1HB HIS 81 7.285 7.855 -5.658 29 2HB HIS 81 2HB HIS 81 9.006 7.527 -5.834 30 HD1 HIS 81 HD1 HIS 81 6.156 5.751 -6.318 31 HD2 HIS 81 HD2 HIS 81 9.403 5.058 -3.819 32 HE1 HIS 81 HE1 HIS 81 6.127 3.281 -5.847 33 HE2 HIS 81 HE2 HIS 81 8.155 2.871 -4.409 34 H ILE 82 H ILE 82 5.964 8.364 -4.428 35 HA ILE 82 HA ILE 82 4.986 7.355 -1.855 36 HB ILE 82 HB ILE 82 4.106 9.962 -3.100 37 1HG1 ILE 82 1HG1 ILE 82 5.782 9.234 -0.727 38 2HG1 ILE 82 2HG1 ILE 82 6.039 10.494 -1.929 39 1HG2 ILE 82 1HG2 ILE 82 2.325 8.449 -2.039 40 2HG2 ILE 82 2HG2 ILE 82 3.106 8.838 -0.506 41 3HG2 ILE 82 3HG2 ILE 82 2.418 10.125 -1.498 42 1HD1 ILE 82 1HD1 ILE 82 3.751 11.346 -0.751 43 2HD1 ILE 82 2HD1 ILE 82 4.575 10.570 0.601 44 3HD1 ILE 82 3HD1 ILE 82 5.374 11.862 -0.294 45 H VAL 83 H VAL 83 3.612 5.768 -2.258 46 HA VAL 83 HA VAL 83 2.297 5.581 -4.843 47 HB VAL 83 HB VAL 83 2.111 3.656 -2.525 48 1HG1 VAL 83 1HG1 VAL 83 1.004 3.744 -5.218 49 2HG1 VAL 83 2HG1 VAL 83 1.880 2.252 -4.877 50 3HG1 VAL 83 3HG1 VAL 83 0.546 2.749 -3.835 51 1HG2 VAL 83 1HG2 VAL 83 4.450 3.981 -3.180 52 2HG2 VAL 83 2HG2 VAL 83 3.873 2.371 -3.616 53 3HG2 VAL 83 3HG2 VAL 83 4.029 3.617 -4.854 54 H ARG 84 H ARG 84 0.740 7.209 -4.766 55 HA ARG 84 HA ARG 84 -1.116 7.455 -2.611 56 1HB ARG 84 1HB ARG 84 -2.036 9.226 -3.786 57 2HB ARG 84 2HB ARG 84 -0.384 9.214 -4.390 58 1HG ARG 84 1HG ARG 84 -2.658 7.847 -5.802 59 2HG ARG 84 2HG ARG 84 -2.178 9.515 -6.118 60 1HD ARG 84 1HD ARG 84 0.186 8.502 -6.452 61 2HD ARG 84 2HD ARG 84 -0.680 6.979 -6.647 62 HE ARG 84 HE ARG 84 -0.678 9.239 -8.468 63 1HH1 ARG 84 1HH1 ARG 84 -2.119 6.203 -7.553 64 2HH1 ARG 84 2HH1 ARG 84 -2.831 5.924 -9.107 65 1HH2 ARG 84 1HH2 ARG 84 -1.613 8.882 -10.518 66 2HH2 ARG 84 2HH2 ARG 84 -2.545 7.448 -10.792 67 H SER 85 H SER 85 -3.535 7.369 -3.088 68 HA SER 85 HA SER 85 -4.136 4.698 -4.046 69 1HB SER 85 1HB SER 85 -5.903 4.765 -2.638 70 2HB SER 85 2HB SER 85 -5.114 6.192 -1.968 71 HG SER 85 HG SER 85 -7.236 6.702 -2.479 72 HA PRO 86 HA PRO 86 -5.451 6.218 -8.016 73 1HB PRO 86 1HB PRO 86 -6.394 3.882 -8.987 74 2HB PRO 86 2HB PRO 86 -4.666 4.208 -8.825 75 1HG PRO 86 1HG PRO 86 -6.471 2.634 -7.031 76 2HG PRO 86 2HG PRO 86 -4.824 2.258 -7.571 77 1HD PRO 86 1HD PRO 86 -5.388 3.316 -5.125 78 2HD PRO 86 2HD PRO 86 -3.862 3.610 -5.982 79 H MET 87 H MET 87 -7.580 4.182 -6.036 80 HA MET 87 HA MET 87 -9.812 5.946 -6.685 81 1HB MET 87 1HB MET 87 -11.307 4.132 -7.245 82 2HB MET 87 2HB MET 87 -9.912 4.078 -8.313 83 1HG MET 87 1HG MET 87 -9.204 2.457 -6.181 84 2HG MET 87 2HG MET 87 -10.906 2.097 -6.463 85 1HE MET 87 1HE MET 87 -11.665 2.301 -9.012 86 2HE MET 87 2HE MET 87 -10.912 1.306 -10.259 87 3HE MET 87 3HE MET 87 -11.676 0.544 -8.864 88 H VAL 88 H VAL 88 -11.821 4.441 -5.461 89 HA VAL 88 HA VAL 88 -11.006 4.694 -2.664 90 HB VAL 88 HB VAL 88 -13.731 4.534 -3.950 91 1HG1 VAL 88 1HG1 VAL 88 -12.907 4.015 -1.201 92 2HG1 VAL 88 2HG1 VAL 88 -14.136 5.274 -1.336 93 3HG1 VAL 88 3HG1 VAL 88 -14.436 3.672 -2.011 94 1HG2 VAL 88 1HG2 VAL 88 -11.959 6.690 -3.125 95 2HG2 VAL 88 2HG2 VAL 88 -13.377 6.729 -4.173 96 3HG2 VAL 88 3HG2 VAL 88 -13.571 6.820 -2.422 97 H GLY 89 H GLY 89 -11.289 3.073 -1.145 98 1HA GLY 89 1HA GLY 89 -12.539 0.587 -1.682 99 2HA GLY 89 2HA GLY 89 -10.803 0.448 -1.919 100 H THR 90 H THR 90 -10.040 -0.631 -0.216 101 HA THR 90 HA THR 90 -10.414 0.535 2.425 102 HB THR 90 HB THR 90 -10.736 -2.429 2.238 103 HG1 THR 90 HG1 THR 90 -12.974 -0.726 2.098 104 1HG2 THR 90 1HG2 THR 90 -10.771 -0.639 4.330 105 2HG2 THR 90 2HG2 THR 90 -12.477 -0.971 4.030 106 3HG2 THR 90 3HG2 THR 90 -11.365 -2.299 4.358 107 H PHE 91 H PHE 91 -8.307 1.025 2.712 108 HA PHE 91 HA PHE 91 -6.149 -0.601 1.867 109 1HB PHE 91 1HB PHE 91 -5.626 1.666 2.125 110 2HB PHE 91 2HB PHE 91 -6.396 1.761 3.707 111 HD1 PHE 91 HD1 PHE 91 -3.575 0.010 1.998 112 HD2 PHE 91 HD2 PHE 91 -5.056 1.800 5.573 113 HE1 PHE 91 HE1 PHE 91 -1.386 -0.345 3.078 114 HE2 PHE 91 HE2 PHE 91 -2.871 1.449 6.659 115 HZ PHE 91 HZ PHE 91 -1.034 0.376 5.411 116 H TYR 92 H TYR 92 -4.590 -1.695 3.208 117 HA TYR 92 HA TYR 92 -5.428 -2.466 5.882 118 1HB TYR 92 1HB TYR 92 -5.714 -4.185 3.543 119 2HB TYR 92 2HB TYR 92 -4.762 -4.929 4.823 120 HD1 TYR 92 HD1 TYR 92 -5.771 -5.417 7.001 121 HD2 TYR 92 HD2 TYR 92 -8.071 -3.744 3.826 122 HE1 TYR 92 HE1 TYR 92 -7.841 -6.014 8.194 123 HE2 TYR 92 HE2 TYR 92 -10.148 -4.335 5.011 124 HH TYR 92 HH TYR 92 -10.993 -4.970 7.048 125 H ARG 93 H ARG 93 -3.734 -4.270 6.650 126 HA ARG 93 HA ARG 93 -1.059 -3.507 5.700 127 1HB ARG 93 1HB ARG 93 -1.732 -3.821 8.626 128 2HB ARG 93 2HB ARG 93 -0.229 -3.235 7.926 129 1HG ARG 93 1HG ARG 93 -2.317 -1.576 6.982 130 2HG ARG 93 2HG ARG 93 -2.514 -1.760 8.726 131 1HD ARG 93 1HD ARG 93 0.240 -1.389 8.243 132 2HD ARG 93 2HD ARG 93 -0.614 -0.185 7.278 133 HE ARG 93 HE ARG 93 -1.657 -0.264 9.906 134 1HH1 ARG 93 1HH1 ARG 93 1.107 0.815 8.084 135 2HH1 ARG 93 2HH1 ARG 93 1.493 2.097 9.182 136 1HH2 ARG 93 1HH2 ARG 93 -1.159 1.423 11.359 137 2HH2 ARG 93 2HH2 ARG 93 0.206 2.442 11.044 138 H THR 94 H THR 94 -2.971 -5.764 7.652 139 HA THR 94 HA THR 94 -1.036 -7.876 6.959 140 HB THR 94 HB THR 94 -1.921 -9.059 9.000 141 HG1 THR 94 HG1 THR 94 -3.794 -8.068 9.467 142 1HG2 THR 94 1HG2 THR 94 -0.459 -6.465 9.237 143 2HG2 THR 94 2HG2 THR 94 -0.863 -7.416 10.667 144 3HG2 THR 94 3HG2 THR 94 0.149 -8.112 9.402 145 HA PRO 95 HA PRO 95 -4.724 -9.238 4.709 146 1HB PRO 95 1HB PRO 95 -3.412 -10.781 2.941 147 2HB PRO 95 2HB PRO 95 -3.442 -9.019 2.799 148 1HG PRO 95 1HG PRO 95 -1.301 -10.791 3.921 149 2HG PRO 95 2HG PRO 95 -1.142 -9.402 2.830 150 1HD PRO 95 1HD PRO 95 -0.705 -9.244 5.515 151 2HD PRO 95 2HD PRO 95 -1.295 -7.878 4.547 152 H SER 96 H SER 96 -4.296 -10.349 7.187 153 HA SER 96 HA SER 96 -5.517 -12.724 7.231 154 1HB SER 96 1HB SER 96 -2.727 -13.091 6.323 155 2HB SER 96 2HB SER 96 -3.262 -14.200 7.588 156 HG SER 96 HG SER 96 -4.840 -13.733 5.299 157 HA PRO 97 HA PRO 97 -5.102 -11.482 11.491 158 1HB PRO 97 1HB PRO 97 -6.100 -14.272 11.860 159 2HB PRO 97 2HB PRO 97 -6.674 -12.766 12.587 160 1HG PRO 97 1HG PRO 97 -8.026 -13.910 10.600 161 2HG PRO 97 2HG PRO 97 -7.859 -12.146 10.691 162 1HD PRO 97 1HD PRO 97 -6.490 -14.091 8.896 163 2HD PRO 97 2HD PRO 97 -6.993 -12.418 8.578 164 H ASP 98 H ASP 98 -3.679 -14.269 10.006 165 HA ASP 98 HA ASP 98 -1.612 -14.290 12.093 166 1HB ASP 98 1HB ASP 98 -1.500 -16.839 11.631 167 2HB ASP 98 2HB ASP 98 -2.773 -16.229 12.683 168 H ALA 99 H ALA 99 -1.024 -12.823 10.061 169 HA ALA 99 HA ALA 99 0.529 -14.509 8.206 170 1HB ALA 99 1HB ALA 99 -1.394 -12.636 7.568 171 2HB ALA 99 2HB ALA 99 0.123 -11.770 7.324 172 3HB ALA 99 3HB ALA 99 -0.172 -13.288 6.476 173 H LYS 100 H LYS 100 2.084 -12.444 7.120 174 HA LYS 100 HA LYS 100 3.798 -11.785 9.421 175 1HB LYS 100 1HB LYS 100 5.663 -11.738 7.766 176 2HB LYS 100 2HB LYS 100 4.905 -13.316 7.932 177 1HG LYS 100 1HG LYS 100 4.378 -13.374 5.780 178 2HG LYS 100 2HG LYS 100 3.644 -11.771 5.848 179 1HD LYS 100 1HD LYS 100 5.452 -10.789 4.963 180 2HD LYS 100 2HD LYS 100 6.558 -11.714 5.979 181 1HE LYS 100 1HE LYS 100 5.213 -13.237 3.848 182 2HE LYS 100 2HE LYS 100 6.349 -12.006 3.298 183 1HZ LYS 100 1HZ LYS 100 7.666 -13.275 5.320 184 2HZ LYS 100 2HZ LYS 100 6.868 -14.536 4.524 185 3HZ LYS 100 3HZ LYS 100 7.914 -13.522 3.665 186 H ALA 101 H ALA 101 1.526 -10.247 8.156 187 HA ALA 101 HA ALA 101 1.004 -8.094 7.642 188 1HB ALA 101 1HB ALA 101 2.452 -7.864 9.759 189 2HB ALA 101 2HB ALA 101 3.692 -7.255 8.664 190 3HB ALA 101 3HB ALA 101 2.143 -6.422 8.792 191 H PHE 102 H PHE 102 0.939 -7.149 5.716 192 HA PHE 102 HA PHE 102 2.632 -7.760 3.611 193 1HB PHE 102 1HB PHE 102 0.407 -5.969 4.079 194 2HB PHE 102 2HB PHE 102 1.598 -5.224 3.020 195 HD1 PHE 102 HD1 PHE 102 2.606 -7.312 1.375 196 HD2 PHE 102 HD2 PHE 102 -1.358 -6.766 2.852 197 HE1 PHE 102 HE1 PHE 102 1.721 -8.604 -0.530 198 HE2 PHE 102 HE2 PHE 102 -2.248 -8.058 0.951 199 HZ PHE 102 HZ PHE 102 -0.708 -8.979 -0.743 200 H ILE 103 H ILE 103 3.340 -5.361 2.383 201 HA ILE 103 HA ILE 103 5.875 -4.880 3.568 202 HB ILE 103 HB ILE 103 4.586 -3.160 1.456 203 1HG1 ILE 103 1HG1 ILE 103 4.307 -5.298 0.540 204 2HG1 ILE 103 2HG1 ILE 103 5.853 -4.774 -0.118 205 1HG2 ILE 103 1HG2 ILE 103 6.781 -2.525 2.587 206 2HG2 ILE 103 2HG2 ILE 103 7.481 -3.904 1.740 207 3HG2 ILE 103 3HG2 ILE 103 6.767 -2.576 0.826 208 1HD1 ILE 103 1HD1 ILE 103 6.538 -6.048 2.231 209 2HD1 ILE 103 2HD1 ILE 103 5.226 -7.029 1.579 210 3HD1 ILE 103 3HD1 ILE 103 6.658 -6.709 0.600 211 H GLU 104 H GLU 104 4.753 -4.279 5.702 212 HA GLU 104 HA GLU 104 3.557 -1.725 5.970 213 1HB GLU 104 1HB GLU 104 4.960 -3.349 8.080 214 2HB GLU 104 2HB GLU 104 3.814 -2.046 8.360 215 1HG GLU 104 1HG GLU 104 2.209 -3.547 6.958 216 2HG GLU 104 2HG GLU 104 3.331 -4.830 7.413 217 H VAL 105 H VAL 105 4.766 -0.381 7.950 218 HA VAL 105 HA VAL 105 6.819 1.031 6.627 219 HB VAL 105 HB VAL 105 6.468 1.197 9.596 220 1HG1 VAL 105 1HG1 VAL 105 7.259 3.025 7.374 221 2HG1 VAL 105 2HG1 VAL 105 6.591 3.696 8.862 222 3HG1 VAL 105 3HG1 VAL 105 8.057 2.719 8.916 223 1HG2 VAL 105 1HG2 VAL 105 4.454 1.882 7.506 224 2HG2 VAL 105 2HG2 VAL 105 4.219 1.209 9.118 225 3HG2 VAL 105 3HG2 VAL 105 4.608 2.918 8.926 226 H GLY 106 H GLY 106 9.029 1.154 7.004 227 1HA GLY 106 1HA GLY 106 11.099 0.523 7.852 228 2HA GLY 106 2HA GLY 106 10.282 -0.564 8.965 229 H GLN 107 H GLN 107 8.846 -1.476 6.310 230 HA GLN 107 HA GLN 107 10.686 -3.670 5.862 231 1HB GLN 107 1HB GLN 107 7.963 -3.524 5.959 232 2HB GLN 107 2HB GLN 107 8.238 -3.510 4.224 233 1HG GLN 107 1HG GLN 107 9.174 -5.610 6.168 234 2HG GLN 107 2HG GLN 107 7.860 -5.762 5.003 235 1HE2 GLN 107 2HE2 GLN 107 8.451 -5.529 2.716 236 2HE2 GLN 107 1HE2 GLN 107 9.982 -6.140 2.198 237 H LYS 108 H LYS 108 11.506 -4.262 3.768 238 HA LYS 108 HA LYS 108 11.779 -1.957 1.970 239 1HB LYS 108 1HB LYS 108 13.891 -2.778 2.803 240 2HB LYS 108 2HB LYS 108 13.490 -4.421 2.324 241 1HG LYS 108 1HG LYS 108 14.587 -4.027 0.439 242 2HG LYS 108 2HG LYS 108 13.261 -2.954 -0.018 243 1HD LYS 108 1HD LYS 108 14.422 -1.073 1.031 244 2HD LYS 108 2HD LYS 108 15.745 -2.145 1.494 245 1HE LYS 108 1HE LYS 108 16.419 -2.458 -0.730 246 2HE LYS 108 2HE LYS 108 14.895 -1.843 -1.368 247 1HZ LYS 108 1HZ LYS 108 16.018 0.185 0.162 248 2HZ LYS 108 2HZ LYS 108 17.264 -0.429 -0.803 249 3HZ LYS 108 3HZ LYS 108 15.839 0.137 -1.519 250 H VAL 109 H VAL 109 11.457 -2.156 -0.243 251 HA VAL 109 HA VAL 109 10.138 -4.638 -1.130 252 HB VAL 109 HB VAL 109 9.014 -2.788 -2.760 253 1HG1 VAL 109 1HG1 VAL 109 8.057 -3.821 -0.101 254 2HG1 VAL 109 2HG1 VAL 109 7.022 -2.947 -1.229 255 3HG1 VAL 109 3HG1 VAL 109 7.739 -4.487 -1.702 256 1HG2 VAL 109 1HG2 VAL 109 10.047 -0.928 -1.537 257 2HG2 VAL 109 2HG2 VAL 109 8.287 -0.886 -1.426 258 3HG2 VAL 109 3HG2 VAL 109 9.243 -1.460 -0.060 259 H ASN 110 H ASN 110 9.982 -4.642 -3.631 260 HA ASN 110 HA ASN 110 12.215 -3.352 -4.958 261 1HB ASN 110 1HB ASN 110 12.765 -5.801 -5.872 262 2HB ASN 110 2HB ASN 110 13.543 -5.139 -4.436 263 1HD2 ASN 110 2HD2 ASN 110 13.023 -5.942 -2.431 264 2HD2 ASN 110 1HD2 ASN 110 12.102 -7.386 -2.209 265 H VAL 111 H VAL 111 11.998 -3.256 -7.186 266 HA VAL 111 HA VAL 111 9.503 -3.121 -8.294 267 HB VAL 111 HB VAL 111 12.068 -3.806 -9.735 268 1HG1 VAL 111 1HG1 VAL 111 9.321 -3.267 -10.682 269 2HG1 VAL 111 2HG1 VAL 111 10.629 -2.469 -11.555 270 3HG1 VAL 111 3HG1 VAL 111 10.607 -4.227 -11.412 271 1HG2 VAL 111 1HG2 VAL 111 11.071 -1.387 -8.499 272 2HG2 VAL 111 2HG2 VAL 111 12.668 -1.740 -9.161 273 3HG2 VAL 111 3HG2 VAL 111 11.383 -1.160 -10.221 274 H GLY 112 H GLY 112 8.144 -4.829 -7.861 275 1HA GLY 112 1HA GLY 112 7.380 -6.726 -9.389 276 2HA GLY 112 2HA GLY 112 8.922 -7.452 -8.962 277 H ASP 113 H ASP 113 8.469 -6.153 -6.194 278 HA ASP 113 HA ASP 113 7.231 -8.485 -5.041 279 1HB ASP 113 1HB ASP 113 8.995 -6.390 -4.154 280 2HB ASP 113 2HB ASP 113 7.660 -6.577 -3.021 281 H THR 114 H THR 114 5.464 -8.415 -3.531 282 HA THR 114 HA THR 114 3.243 -6.964 -4.496 283 HB THR 114 HB THR 114 3.289 -8.169 -1.752 284 HG1 THR 114 HG1 THR 114 3.177 -10.197 -2.616 285 1HG2 THR 114 1HG2 THR 114 1.274 -7.678 -3.849 286 2HG2 THR 114 2HG2 THR 114 1.121 -9.175 -2.929 287 3HG2 THR 114 3HG2 THR 114 1.130 -7.623 -2.092 288 H LEU 115 H LEU 115 1.785 -5.835 -2.708 289 HA LEU 115 HA LEU 115 3.430 -3.941 -1.181 290 1HB LEU 115 1HB LEU 115 2.747 -2.972 -3.392 291 2HB LEU 115 2HB LEU 115 1.077 -3.128 -2.886 292 HG LEU 115 HG LEU 115 2.021 -1.710 -0.809 293 1HD1 LEU 115 1HD1 LEU 115 4.054 -1.520 -2.858 294 2HD1 LEU 115 2HD1 LEU 115 3.381 0.059 -2.452 295 3HD1 LEU 115 3HD1 LEU 115 4.076 -0.954 -1.186 296 1HD2 LEU 115 1HD2 LEU 115 0.086 -1.148 -2.186 297 2HD2 LEU 115 2HD2 LEU 115 1.103 0.267 -1.912 298 3HD2 LEU 115 3HD2 LEU 115 1.155 -0.570 -3.463 299 H CYS 116 H CYS 116 -0.048 -4.243 -1.873 300 HA CYS 116 HA CYS 116 -0.749 -5.391 0.600 301 1HB CYS 116 1HB CYS 116 -0.370 -2.499 0.598 302 2HB CYS 116 2HB CYS 116 -1.990 -2.967 1.104 303 HG CYS 116 HG CYS 116 0.455 -3.158 2.795 304 H ILE 117 H ILE 117 -3.019 -5.661 0.849 305 HA ILE 117 HA ILE 117 -4.422 -5.823 -1.622 306 HB ILE 117 HB ILE 117 -5.203 -6.374 1.229 307 1HG1 ILE 117 1HG1 ILE 117 -5.444 -8.350 -0.978 308 2HG1 ILE 117 2HG1 ILE 117 -3.814 -7.887 -0.495 309 1HG2 ILE 117 1HG2 ILE 117 -6.996 -6.545 -1.189 310 2HG2 ILE 117 2HG2 ILE 117 -7.368 -7.210 0.402 311 3HG2 ILE 117 3HG2 ILE 117 -7.195 -5.468 0.194 312 1HD1 ILE 117 1HD1 ILE 117 -4.982 -8.373 1.912 313 2HD1 ILE 117 2HD1 ILE 117 -5.784 -9.551 0.874 314 3HD1 ILE 117 3HD1 ILE 117 -4.026 -9.535 0.995 315 H VAL 118 H VAL 118 -5.578 -4.302 -2.599 316 HA VAL 118 HA VAL 118 -6.110 -1.788 -1.293 317 HB VAL 118 HB VAL 118 -7.147 -2.588 -4.003 318 1HG1 VAL 118 1HG1 VAL 118 -7.920 -0.468 -2.998 319 2HG1 VAL 118 2HG1 VAL 118 -6.244 0.073 -2.910 320 3HG1 VAL 118 3HG1 VAL 118 -6.993 -0.227 -4.478 321 1HG2 VAL 118 1HG2 VAL 118 -4.563 -2.946 -3.459 322 2HG2 VAL 118 2HG2 VAL 118 -5.131 -2.347 -5.018 323 3HG2 VAL 118 3HG2 VAL 118 -4.530 -1.216 -3.804 324 H GLU 119 H GLU 119 -7.738 -4.736 -1.691 325 HA GLU 119 HA GLU 119 -9.937 -5.381 -1.528 326 1HB GLU 119 1HB GLU 119 -9.169 -5.072 0.804 327 2HB GLU 119 2HB GLU 119 -9.748 -3.413 0.765 328 1HG GLU 119 1HG GLU 119 -12.002 -4.098 0.663 329 2HG GLU 119 2HG GLU 119 -11.559 -5.766 0.304 330 H ALA 120 H ALA 120 -9.666 -3.331 -3.436 331 HA ALA 120 HA ALA 120 -11.693 -1.337 -2.993 332 1HB ALA 120 1HB ALA 120 -9.554 -1.641 -4.758 333 2HB ALA 120 2HB ALA 120 -10.999 -1.686 -5.769 334 3HB ALA 120 3HB ALA 120 -10.710 -0.311 -4.703 335 H MET 121 H MET 121 -13.528 -2.610 -2.513 336 HA MET 121 HA MET 121 -15.627 -3.266 -3.220 337 1HB MET 121 1HB MET 121 -16.199 -3.283 -5.419 338 2HB MET 121 2HB MET 121 -14.658 -2.459 -5.592 339 1HG MET 121 1HG MET 121 -13.756 -4.924 -5.846 340 2HG MET 121 2HG MET 121 -15.425 -5.233 -6.323 341 1HE MET 121 1HE MET 121 -13.385 -6.043 -8.151 342 2HE MET 121 2HE MET 121 -14.909 -5.869 -9.021 343 3HE MET 121 3HE MET 121 -13.430 -5.177 -9.687 344 H LYS 122 H LYS 122 -13.414 -4.823 -2.073 345 HA LYS 122 HA LYS 122 -12.967 -6.954 -1.423 346 1HB LYS 122 1HB LYS 122 -15.752 -6.798 -1.740 347 2HB LYS 122 2HB LYS 122 -15.279 -8.302 -2.516 348 1HG LYS 122 1HG LYS 122 -15.082 -7.498 0.341 349 2HG LYS 122 2HG LYS 122 -15.658 -9.006 -0.371 350 1HD LYS 122 1HD LYS 122 -13.222 -9.354 -1.108 351 2HD LYS 122 2HD LYS 122 -12.833 -8.084 0.053 352 1HE LYS 122 1HE LYS 122 -14.516 -10.406 0.891 353 2HE LYS 122 2HE LYS 122 -12.765 -10.584 0.782 354 H MET 123 H MET 123 -11.704 -6.269 -3.677 355 HA MET 123 HA MET 123 -11.971 -8.618 -5.434 356 1HB MET 123 1HB MET 123 -11.378 -7.338 -7.273 357 2HB MET 123 2HB MET 123 -12.334 -6.200 -6.334 358 1HG MET 123 1HG MET 123 -10.303 -5.195 -5.453 359 2HG MET 123 2HG MET 123 -9.329 -6.353 -6.356 360 1HE MET 123 1HE MET 123 -9.410 -3.304 -6.040 361 2HE MET 123 2HE MET 123 -8.357 -3.303 -7.454 362 3HE MET 123 3HE MET 123 -9.850 -2.366 -7.467 363 H MET 124 H MET 124 -10.271 -7.776 -2.902 364 HA MET 124 HA MET 124 -8.083 -7.930 -2.197 365 1HB MET 124 1HB MET 124 -8.483 -10.464 -3.793 366 2HB MET 124 2HB MET 124 -7.163 -10.208 -2.662 367 1HG MET 124 1HG MET 124 -10.094 -10.208 -1.984 368 2HG MET 124 2HG MET 124 -8.954 -11.515 -1.667 369 1HE MET 124 1HE MET 124 -10.972 -9.219 -0.288 370 2HE MET 124 2HE MET 124 -10.260 -8.625 1.212 371 3HE MET 124 3HE MET 124 -10.007 -7.742 -0.294 372 H ASN 125 H ASN 125 -8.240 -6.321 -4.504 373 HA ASN 125 HA ASN 125 -6.183 -7.145 -6.350 374 1HB ASN 125 1HB ASN 125 -7.846 -5.821 -7.352 375 2HB ASN 125 2HB ASN 125 -7.844 -4.657 -6.027 376 1HD2 ASN 125 2HD2 ASN 125 -6.797 -2.834 -6.354 377 2HD2 ASN 125 1HD2 ASN 125 -5.581 -2.560 -7.549 378 H GLN 126 H GLN 126 -4.628 -7.474 -4.525 379 HA GLN 126 HA GLN 126 -3.563 -5.220 -3.159 380 1HB GLN 126 1HB GLN 126 -1.885 -6.710 -2.329 381 2HB GLN 126 2HB GLN 126 -3.407 -7.589 -2.366 382 1HG GLN 126 1HG GLN 126 -2.472 -8.273 -4.769 383 2HG GLN 126 2HG GLN 126 -0.942 -7.990 -3.941 384 1HE2 GLN 126 2HE2 GLN 126 -1.313 -10.455 -4.773 385 2HE2 GLN 126 1HE2 GLN 126 -1.717 -11.524 -3.478 386 H ILE 127 H ILE 127 -1.994 -3.839 -3.702 387 HA ILE 127 HA ILE 127 -1.030 -3.830 -6.411 388 HB ILE 127 HB ILE 127 -0.194 -1.992 -4.169 389 1HG1 ILE 127 1HG1 ILE 127 -2.548 -1.794 -4.210 390 2HG1 ILE 127 2HG1 ILE 127 -1.968 -0.465 -5.207 391 1HG2 ILE 127 1HG2 ILE 127 -0.012 -1.885 -7.159 392 2HG2 ILE 127 2HG2 ILE 127 0.047 -0.420 -6.179 393 3HG2 ILE 127 3HG2 ILE 127 1.265 -1.677 -5.960 394 1HD1 ILE 127 1HD1 ILE 127 -2.321 -2.118 -7.168 395 2HD1 ILE 127 2HD1 ILE 127 -3.354 -2.973 -6.023 396 3HD1 ILE 127 3HD1 ILE 127 -3.710 -1.300 -6.452 397 H GLU 128 H GLU 128 1.216 -3.712 -7.010 398 HA GLU 128 HA GLU 128 2.967 -5.201 -5.166 399 1HB GLU 128 1HB GLU 128 2.782 -5.275 -8.177 400 2HB GLU 128 2HB GLU 128 4.148 -5.942 -7.292 401 1HG GLU 128 1HG GLU 128 3.046 -7.817 -6.910 402 2HG GLU 128 2HG GLU 128 1.708 -6.932 -6.174 403 H ALA 129 H ALA 129 4.591 -4.040 -4.390 404 HA ALA 129 HA ALA 129 5.246 -1.475 -4.835 405 1HB ALA 129 1HB ALA 129 6.697 -3.786 -3.807 406 2HB ALA 129 2HB ALA 129 7.752 -2.531 -4.458 407 3HB ALA 129 3HB ALA 129 6.598 -2.139 -3.183 408 H ASP 130 H ASP 130 5.138 -0.722 -6.918 409 HA ASP 130 HA ASP 130 6.486 -1.934 -9.107 410 1HB ASP 130 1HB ASP 130 5.716 -0.122 -10.403 411 2HB ASP 130 2HB ASP 130 4.469 -0.349 -9.178 412 H LYS 131 H LYS 131 7.566 -0.049 -6.528 413 HA LYS 131 HA LYS 131 10.138 0.357 -7.873 414 1HB LYS 131 1HB LYS 131 8.643 2.439 -6.272 415 2HB LYS 131 2HB LYS 131 10.338 2.579 -6.722 416 1HG LYS 131 1HG LYS 131 9.119 2.048 -9.122 417 2HG LYS 131 2HG LYS 131 7.938 3.064 -8.293 418 1HD LYS 131 1HD LYS 131 10.634 4.069 -7.963 419 2HD LYS 131 2HD LYS 131 10.200 3.915 -9.667 420 1HE LYS 131 1HE LYS 131 8.648 5.399 -7.549 421 2HE LYS 131 2HE LYS 131 9.615 6.122 -8.835 422 1HZ LYS 131 1HZ LYS 131 7.648 4.281 -9.816 423 2HZ LYS 131 2HZ LYS 131 6.960 5.571 -8.964 424 3HZ LYS 131 3HZ LYS 131 7.967 5.875 -10.289 425 H SER 132 H SER 132 11.913 0.029 -6.603 426 HA SER 132 HA SER 132 11.529 -1.413 -4.168 427 1HB SER 132 1HB SER 132 13.398 -1.717 -5.922 428 2HB SER 132 2HB SER 132 14.181 -0.352 -5.124 429 HG SER 132 HG SER 132 14.661 -2.616 -4.384 430 H GLY 133 H GLY 133 13.363 -0.731 -2.393 431 1HA GLY 133 1HA GLY 133 14.271 1.318 -1.325 432 2HA GLY 133 2HA GLY 133 12.729 2.071 -1.699 433 H THR 134 H THR 134 13.654 2.140 0.860 434 HA THR 134 HA THR 134 12.329 -0.010 2.323 435 HB THR 134 HB THR 134 14.060 2.292 3.235 436 HG1 THR 134 HG1 THR 134 14.533 -0.496 3.341 437 1HG2 THR 134 1HG2 THR 134 12.178 1.090 4.815 438 2HG2 THR 134 2HG2 THR 134 13.630 0.145 5.144 439 3HG2 THR 134 3HG2 THR 134 13.643 1.893 5.379 440 H VAL 135 H VAL 135 10.169 0.287 2.317 441 HA VAL 135 HA VAL 135 8.614 2.448 2.079 442 HB VAL 135 HB VAL 135 8.104 0.384 4.224 443 1HG1 VAL 135 1HG1 VAL 135 6.616 2.359 4.230 444 2HG1 VAL 135 2HG1 VAL 135 6.171 1.996 2.564 445 3HG1 VAL 135 3HG1 VAL 135 5.768 0.861 3.851 446 1HG2 VAL 135 1HG2 VAL 135 8.299 0.109 1.353 447 2HG2 VAL 135 2HG2 VAL 135 8.109 -1.131 2.593 448 3HG2 VAL 135 3HG2 VAL 135 6.690 -0.318 1.935 449 H LYS 136 H LYS 136 8.334 4.347 3.051 450 HA LYS 136 HA LYS 136 9.774 4.949 5.472 451 1HB LYS 136 1HB LYS 136 8.606 6.430 3.292 452 2HB LYS 136 2HB LYS 136 8.094 7.112 4.829 453 1HG LYS 136 1HG LYS 136 10.959 6.591 4.066 454 2HG LYS 136 2HG LYS 136 10.143 8.147 3.908 455 1HD LYS 136 1HD LYS 136 10.583 6.618 6.472 456 2HD LYS 136 2HD LYS 136 11.456 8.064 5.960 457 1HE LYS 136 1HE LYS 136 8.747 8.728 5.788 458 2HE LYS 136 2HE LYS 136 8.910 7.829 7.295 459 1HZ LYS 136 1HZ LYS 136 11.038 9.672 7.022 460 2HZ LYS 136 2HZ LYS 136 9.562 10.478 6.843 461 3HZ LYS 136 3HZ LYS 136 9.867 9.573 8.239 462 H ALA 137 H ALA 137 6.358 4.863 4.488 463 HA ALA 137 HA ALA 137 5.317 3.766 6.764 464 1HB ALA 137 1HB ALA 137 5.771 6.702 7.066 465 2HB ALA 137 2HB ALA 137 4.377 5.944 7.836 466 3HB ALA 137 3HB ALA 137 6.007 5.403 8.235 467 H ILE 138 H ILE 138 2.941 4.288 7.092 468 HA ILE 138 HA ILE 138 1.738 5.078 4.517 469 HB ILE 138 HB ILE 138 0.830 2.947 6.453 470 1HG1 ILE 138 1HG1 ILE 138 1.729 2.823 3.566 471 2HG1 ILE 138 2HG1 ILE 138 2.647 2.262 4.960 472 1HG2 ILE 138 1HG2 ILE 138 -0.588 4.338 4.241 473 2HG2 ILE 138 2HG2 ILE 138 -0.874 2.614 4.471 474 3HG2 ILE 138 3HG2 ILE 138 -1.204 3.744 5.783 475 1HD1 ILE 138 1HD1 ILE 138 0.817 0.633 5.409 476 2HD1 ILE 138 2HD1 ILE 138 0.088 1.119 3.878 477 3HD1 ILE 138 3HD1 ILE 138 1.685 0.370 3.896 478 H LEU 139 H LEU 139 -0.288 6.160 4.591 479 HA LEU 139 HA LEU 139 -0.903 7.360 7.213 480 1HB LEU 139 1HB LEU 139 -1.155 8.669 4.507 481 2HB LEU 139 2HB LEU 139 -1.541 9.407 6.049 482 HG LEU 139 HG LEU 139 0.568 10.268 5.371 483 1HD1 LEU 139 1HD1 LEU 139 0.226 8.821 7.739 484 2HD1 LEU 139 2HD1 LEU 139 1.842 8.417 7.160 485 3HD1 LEU 139 3HD1 LEU 139 1.396 10.103 7.421 486 1HD2 LEU 139 1HD2 LEU 139 0.888 8.023 3.930 487 2HD2 LEU 139 2HD2 LEU 139 2.208 9.124 4.321 488 3HD2 LEU 139 3HD2 LEU 139 1.961 7.669 5.285 489 H VAL 140 H VAL 140 -2.161 6.078 4.203 490 HA VAL 140 HA VAL 140 -4.787 6.682 4.199 491 HB VAL 140 HB VAL 140 -3.536 3.980 3.725 492 1HG1 VAL 140 1HG1 VAL 140 -6.386 4.864 3.345 493 2HG1 VAL 140 2HG1 VAL 140 -5.686 3.498 2.478 494 3HG1 VAL 140 3HG1 VAL 140 -5.784 3.467 4.238 495 1HG2 VAL 140 1HG2 VAL 140 -4.474 6.193 1.905 496 2HG2 VAL 140 2HG2 VAL 140 -2.817 5.646 2.160 497 3HG2 VAL 140 3HG2 VAL 140 -3.976 4.596 1.347 498 H GLU 141 H GLU 141 -3.163 4.677 6.550 499 HA GLU 141 HA GLU 141 -3.819 3.900 8.583 500 1HB GLU 141 1HB GLU 141 -5.920 5.897 7.967 501 2HB GLU 141 2HB GLU 141 -6.311 4.710 9.202 502 1HG GLU 141 1HG GLU 141 -4.606 5.428 10.608 503 2HG GLU 141 2HG GLU 141 -3.749 6.250 9.305 504 H SER 142 H SER 142 -3.946 1.757 8.198 505 HA SER 142 HA SER 142 -5.689 0.370 6.606 506 1HB SER 142 1HB SER 142 -4.508 -1.357 7.402 507 2HB SER 142 2HB SER 142 -3.771 -0.265 8.576 508 HG SER 142 HG SER 142 -5.208 -2.287 9.169 509 H GLY 143 H GLY 143 -7.498 -1.105 7.273 510 1HA GLY 143 1HA GLY 143 -9.569 -1.459 8.202 511 2HA GLY 143 2HA GLY 143 -9.010 -0.573 9.613 512 H GLN 144 H GLN 144 -8.561 1.334 6.925 513 HA GLN 144 HA GLN 144 -11.176 2.643 7.306 514 1HB GLN 144 1HB GLN 144 -8.586 3.676 7.770 515 2HB GLN 144 2HB GLN 144 -9.186 4.467 6.320 516 1HG GLN 144 1HG GLN 144 -11.349 4.640 7.945 517 2HG GLN 144 2HG GLN 144 -10.031 4.739 9.111 518 1HE2 GLN 144 2HE2 GLN 144 -8.160 6.005 7.398 519 2HE2 GLN 144 1HE2 GLN 144 -8.693 7.630 7.147 520 HA PRO 145 HA PRO 145 -11.849 2.086 2.980 521 1HB PRO 145 1HB PRO 145 -13.532 4.198 2.538 522 2HB PRO 145 2HB PRO 145 -14.035 2.686 3.300 523 1HG PRO 145 1HG PRO 145 -13.295 5.292 4.568 524 2HG PRO 145 2HG PRO 145 -14.618 4.183 4.976 525 1HD PRO 145 1HD PRO 145 -12.336 4.271 6.405 526 2HD PRO 145 2HD PRO 145 -13.228 2.757 6.150 527 H VAL 146 H VAL 146 -10.397 2.539 1.465 528 HA VAL 146 HA VAL 146 -8.715 4.783 1.464 529 HB VAL 146 HB VAL 146 -9.392 2.991 -0.872 530 1HG1 VAL 146 1HG1 VAL 146 -8.267 5.146 -1.433 531 2HG1 VAL 146 2HG1 VAL 146 -6.918 4.647 -0.411 532 3HG1 VAL 146 3HG1 VAL 146 -7.330 3.711 -1.848 533 1HG2 VAL 146 1HG2 VAL 146 -7.333 2.750 1.310 534 2HG2 VAL 146 2HG2 VAL 146 -8.617 1.613 0.901 535 3HG2 VAL 146 3HG2 VAL 146 -7.257 1.840 -0.199 536 H GLU 147 H GLU 147 -8.650 6.633 0.189 537 HA GLU 147 HA GLU 147 -11.139 7.303 -1.237 538 1HB GLU 147 1HB GLU 147 -9.971 8.591 1.062 539 2HB GLU 147 2HB GLU 147 -10.015 9.708 -0.297 540 1HG GLU 147 1HG GLU 147 -12.112 10.129 0.286 541 2HG GLU 147 2HG GLU 147 -12.507 8.534 -0.353 542 H PHE 148 H PHE 148 -10.923 8.283 -3.187 543 HA PHE 148 HA PHE 148 -8.782 7.985 -4.788 544 1HB PHE 148 1HB PHE 148 -10.724 8.734 -5.845 545 2HB PHE 148 2HB PHE 148 -10.888 10.110 -4.765 546 HD1 PHE 148 HD1 PHE 148 -8.575 8.746 -7.352 547 HD2 PHE 148 HD2 PHE 148 -10.277 12.201 -5.522 548 HE1 PHE 148 HE1 PHE 148 -7.450 10.175 -9.015 549 HE2 PHE 148 HE2 PHE 148 -9.156 13.637 -7.183 550 HZ PHE 148 HZ PHE 148 -7.740 12.624 -8.931 551 H ASP 149 H ASP 149 -6.723 8.515 -4.512 552 HA ASP 149 HA ASP 149 -4.899 9.928 -4.440 553 1HB ASP 149 1HB ASP 149 -6.577 11.776 -5.054 554 2HB ASP 149 2HB ASP 149 -6.639 12.120 -3.328 555 H GLU 150 H GLU 150 -5.168 8.112 -2.577 556 HA GLU 150 HA GLU 150 -4.600 9.509 -0.046 557 1HB GLU 150 1HB GLU 150 -6.612 7.647 -0.507 558 2HB GLU 150 2HB GLU 150 -5.340 6.712 0.264 559 1HG GLU 150 1HG GLU 150 -5.846 7.548 2.246 560 2HG GLU 150 2HG GLU 150 -5.692 9.197 1.643 561 HA PRO 151 HA PRO 151 -0.521 7.823 -0.686 562 1HB PRO 151 1HB PRO 151 0.352 8.333 1.884 563 2HB PRO 151 2HB PRO 151 0.373 9.506 0.564 564 1HG PRO 151 1HG PRO 151 -1.614 9.170 2.771 565 2HG PRO 151 2HG PRO 151 -0.960 10.660 2.067 566 1HD PRO 151 1HD PRO 151 -3.409 9.763 1.437 567 2HD PRO 151 2HD PRO 151 -2.376 10.561 0.233 568 H LEU 152 H LEU 152 -1.375 5.653 -0.865 569 HA LEU 152 HA LEU 152 -2.067 4.017 1.292 570 1HB LEU 152 1HB LEU 152 -1.064 3.513 -1.478 571 2HB LEU 152 2HB LEU 152 -1.167 2.172 -0.351 572 HG LEU 152 HG LEU 152 -3.557 3.919 -0.804 573 1HD1 LEU 152 1HD1 LEU 152 -2.400 2.912 -2.968 574 2HD1 LEU 152 2HD1 LEU 152 -3.251 1.463 -2.436 575 3HD1 LEU 152 3HD1 LEU 152 -4.152 2.941 -2.767 576 1HD2 LEU 152 1HD2 LEU 152 -3.438 2.203 1.026 577 2HD2 LEU 152 2HD2 LEU 152 -4.771 1.997 -0.110 578 3HD2 LEU 152 3HD2 LEU 152 -3.342 0.971 -0.232 579 H VAL 153 H VAL 153 1.066 4.346 -0.370 580 HA VAL 153 HA VAL 153 2.454 3.786 2.109 581 HB VAL 153 HB VAL 153 3.150 2.051 -0.242 582 1HG1 VAL 153 1HG1 VAL 153 3.970 2.313 2.582 583 2HG1 VAL 153 2HG1 VAL 153 3.836 0.671 1.955 584 3HG1 VAL 153 3HG1 VAL 153 4.906 1.830 1.168 585 1HG2 VAL 153 1HG2 VAL 153 0.809 1.593 0.336 586 2HG2 VAL 153 2HG2 VAL 153 1.862 0.238 0.741 587 3HG2 VAL 153 3HG2 VAL 153 1.284 1.315 2.012 588 H VAL 154 H VAL 154 4.236 4.992 2.226 589 HA VAL 154 HA VAL 154 5.266 6.178 -0.264 590 HB VAL 154 HB VAL 154 5.996 8.061 0.957 591 1HG1 VAL 154 1HG1 VAL 154 3.390 7.485 0.754 592 2HG1 VAL 154 2HG1 VAL 154 3.513 7.651 2.506 593 3HG1 VAL 154 3HG1 VAL 154 3.991 8.986 1.458 594 1HG2 VAL 154 1HG2 VAL 154 5.847 6.227 3.265 595 2HG2 VAL 154 2HG2 VAL 154 7.012 7.499 2.896 596 3HG2 VAL 154 3HG2 VAL 154 5.441 7.913 3.581 597 H ILE 155 H ILE 155 7.130 5.402 -0.972 598 HA ILE 155 HA ILE 155 8.924 4.041 0.908 599 HB ILE 155 HB ILE 155 8.955 3.997 -2.112 600 1HG1 ILE 155 1HG1 ILE 155 8.179 1.679 -0.376 601 2HG1 ILE 155 2HG1 ILE 155 6.985 2.915 -0.762 602 1HG2 ILE 155 1HG2 ILE 155 11.083 3.539 -0.638 603 2HG2 ILE 155 2HG2 ILE 155 10.311 1.970 -0.406 604 3HG2 ILE 155 3HG2 ILE 155 10.708 2.526 -2.032 605 1HD1 ILE 155 1HD1 ILE 155 8.556 1.603 -2.935 606 2HD1 ILE 155 2HD1 ILE 155 7.148 0.807 -2.233 607 3HD1 ILE 155 3HD1 ILE 155 6.975 2.382 -3.008 608 H GLU 156 H GLU 156 11.011 4.667 1.226 609 HA GLU 156 HA GLU 156 11.708 7.340 0.315 610 1HB GLU 156 1HB GLU 156 12.159 5.865 2.673 611 2HB GLU 156 2HB GLU 156 13.738 6.100 1.937 612 1HG GLU 156 1HG GLU 156 12.172 8.528 1.896 613 2HG GLU 156 2HG GLU 156 12.356 7.893 3.530 614 1H10 BTN 222 1H10 BTN 122 -14.177 -9.414 5.392 615 2H10 BTN 222 2H10 BTN 122 -14.887 -8.007 4.603 616 1H9 BTN 222 1H9 BTN 122 -12.706 -7.506 5.625 617 2H9 BTN 222 2H9 BTN 122 -12.704 -7.260 3.878 618 1H8 BTN 222 1H8 BTN 122 -11.106 -8.785 3.575 619 2H8 BTN 222 2H8 BTN 122 -11.949 -9.967 4.581 620 1H7 BTN 222 1H7 BTN 122 -10.902 -9.272 6.514 621 2H7 BTN 222 2H7 BTN 122 -10.525 -7.683 5.863 622 H2 BTN 222 H2 BTN 122 -9.005 -9.100 4.213 623 1H6 BTN 222 1H6 BTN 122 -6.443 -11.312 6.395 624 2H6 BTN 222 2H6 BTN 122 -6.527 -10.616 4.783 625 H5 BTN 222 H5 BTN 122 -5.959 -8.718 6.025 626 HN1 BTN 222 HN2 BTN 122 -6.241 -9.691 8.369 627 HN2 BTN 222 HN1 BTN 122 -9.452 -7.537 7.443 628 H4 BTN 222 H4 BTN 122 -7.834 -7.496 5.461 Start of MODEL 4 1 1H GLU 77 H GLU 77 21.896 14.189 -2.423 2 HA GLU 77 HA GLU 77 19.960 14.925 -4.325 3 1HB GLU 77 1HB GLU 77 20.093 12.427 -5.343 4 2HB GLU 77 2HB GLU 77 20.826 13.832 -6.109 5 1HG GLU 77 1HG GLU 77 22.966 13.298 -5.146 6 2HG GLU 77 2HG GLU 77 22.260 11.966 -4.233 7 H ILE 78 H ILE 78 18.015 13.589 -4.201 8 HA ILE 78 HA ILE 78 17.937 11.703 -1.965 9 HB ILE 78 HB ILE 78 17.358 13.908 -1.018 10 1HG1 ILE 78 1HG1 ILE 78 16.241 11.618 -0.406 11 2HG1 ILE 78 2HG1 ILE 78 15.599 13.112 0.268 12 1HG2 ILE 78 1HG2 ILE 78 15.157 13.830 -3.071 13 2HG2 ILE 78 2HG2 ILE 78 15.183 14.931 -1.694 14 3HG2 ILE 78 3HG2 ILE 78 16.445 15.024 -2.922 15 1HD1 ILE 78 1HD1 ILE 78 13.935 13.116 -1.613 16 2HD1 ILE 78 2HD1 ILE 78 14.491 11.487 -1.999 17 3HD1 ILE 78 3HD1 ILE 78 13.754 11.820 -0.431 18 H SER 79 H SER 79 16.650 10.003 -2.347 19 HA SER 79 HA SER 79 14.837 10.159 -4.665 20 1HB SER 79 1HB SER 79 16.974 8.529 -4.484 21 2HB SER 79 2HB SER 79 15.760 7.500 -3.723 22 HG SER 79 HG SER 79 15.960 8.379 -6.354 23 H GLY 80 H GLY 80 12.742 10.058 -4.179 24 1HA GLY 80 1HA GLY 80 11.699 8.142 -2.330 25 2HA GLY 80 2HA GLY 80 11.652 9.770 -1.672 26 H HIS 81 H HIS 81 9.316 8.448 -1.971 27 HA HIS 81 HA HIS 81 7.847 10.195 -3.665 28 1HB HIS 81 1HB HIS 81 6.884 7.900 -4.810 29 2HB HIS 81 2HB HIS 81 8.024 9.003 -5.572 30 HD1 HIS 81 HD1 HIS 81 9.047 7.032 -6.919 31 HD2 HIS 81 HD2 HIS 81 9.402 6.660 -2.795 32 HE1 HIS 81 HE1 HIS 81 10.719 5.189 -6.550 33 HE2 HIS 81 HE2 HIS 81 10.870 4.939 -4.048 34 H ILE 82 H ILE 82 5.470 9.061 -3.915 35 HA ILE 82 HA ILE 82 4.781 7.768 -1.381 36 HB ILE 82 HB ILE 82 3.463 10.297 -2.373 37 1HG1 ILE 82 1HG1 ILE 82 5.362 9.671 -0.137 38 2HG1 ILE 82 2HG1 ILE 82 5.392 11.012 -1.278 39 1HG2 ILE 82 1HG2 ILE 82 2.311 8.198 -0.973 40 2HG2 ILE 82 2HG2 ILE 82 2.697 9.393 0.264 41 3HG2 ILE 82 3HG2 ILE 82 1.689 9.843 -1.110 42 1HD1 ILE 82 1HD1 ILE 82 3.037 11.384 0.115 43 2HD1 ILE 82 2HD1 ILE 82 4.181 10.830 1.339 44 3HD1 ILE 82 3HD1 ILE 82 4.555 12.248 0.359 45 H VAL 83 H VAL 83 3.401 6.150 -1.690 46 HA VAL 83 HA VAL 83 2.172 5.804 -4.297 47 HB VAL 83 HB VAL 83 1.918 3.941 -1.941 48 1HG1 VAL 83 1HG1 VAL 83 0.420 3.561 -3.850 49 2HG1 VAL 83 2HG1 VAL 83 1.821 3.451 -4.915 50 3HG1 VAL 83 3HG1 VAL 83 1.580 2.247 -3.649 51 1HG2 VAL 83 1HG2 VAL 83 4.167 4.205 -3.921 52 2HG2 VAL 83 2HG2 VAL 83 4.255 4.222 -2.159 53 3HG2 VAL 83 3HG2 VAL 83 3.864 2.727 -3.009 54 H ARG 84 H ARG 84 0.483 7.251 -4.413 55 HA ARG 84 HA ARG 84 -1.483 7.384 -2.294 56 1HB ARG 84 1HB ARG 84 -2.584 9.057 -3.705 57 2HB ARG 84 2HB ARG 84 -0.876 9.422 -3.501 58 1HG ARG 84 1HG ARG 84 -0.397 8.541 -5.709 59 2HG ARG 84 2HG ARG 84 -2.093 8.095 -5.915 60 1HD ARG 84 1HD ARG 84 -2.641 10.159 -6.545 61 2HD ARG 84 2HD ARG 84 -1.818 10.869 -5.156 62 HE ARG 84 HE ARG 84 -0.191 11.503 -6.607 63 1HH1 ARG 84 1HH1 ARG 84 -1.639 8.576 -7.815 64 2HH1 ARG 84 2HH1 ARG 84 -0.630 8.503 -9.222 65 1HH2 ARG 84 1HH2 ARG 84 1.144 11.418 -8.455 66 2HH2 ARG 84 2HH2 ARG 84 0.953 10.119 -9.585 67 H SER 85 H SER 85 -3.461 6.462 -2.271 68 HA SER 85 HA SER 85 -3.970 4.194 -3.840 69 1HB SER 85 1HB SER 85 -5.690 3.852 -2.410 70 2HB SER 85 2HB SER 85 -5.019 5.227 -1.531 71 HG SER 85 HG SER 85 -6.469 6.572 -2.605 72 HA PRO 86 HA PRO 86 -5.359 6.489 -7.468 73 1HB PRO 86 1HB PRO 86 -5.494 4.303 -9.084 74 2HB PRO 86 2HB PRO 86 -3.985 5.149 -8.727 75 1HG PRO 86 1HG PRO 86 -5.085 2.644 -7.514 76 2HG PRO 86 2HG PRO 86 -3.423 3.008 -8.017 77 1HD PRO 86 1HD PRO 86 -4.215 3.122 -5.434 78 2HD PRO 86 2HD PRO 86 -2.969 4.200 -6.095 79 H MET 87 H MET 87 -6.702 3.249 -6.787 80 HA MET 87 HA MET 87 -9.362 4.276 -7.492 81 1HB MET 87 1HB MET 87 -8.158 2.070 -8.436 82 2HB MET 87 2HB MET 87 -8.940 1.376 -7.022 83 1HG MET 87 1HG MET 87 -10.851 1.263 -8.114 84 2HG MET 87 2HG MET 87 -10.833 3.010 -8.355 85 1HE MET 87 1HE MET 87 -8.110 0.606 -9.612 86 2HE MET 87 2HE MET 87 -9.495 -0.444 -9.912 87 3HE MET 87 3HE MET 87 -8.593 0.234 -11.267 88 H VAL 88 H VAL 88 -10.976 4.371 -6.032 89 HA VAL 88 HA VAL 88 -10.461 4.397 -3.300 90 HB VAL 88 HB VAL 88 -13.080 4.076 -4.764 91 1HG1 VAL 88 1HG1 VAL 88 -12.567 4.543 -1.831 92 2HG1 VAL 88 2HG1 VAL 88 -14.127 4.785 -2.617 93 3HG1 VAL 88 3HG1 VAL 88 -13.405 3.176 -2.568 94 1HG2 VAL 88 1HG2 VAL 88 -11.578 6.196 -4.915 95 2HG2 VAL 88 2HG2 VAL 88 -13.309 6.372 -4.631 96 3HG2 VAL 88 3HG2 VAL 88 -12.176 6.512 -3.287 97 H GLY 89 H GLY 89 -11.476 3.029 -1.616 98 1HA GLY 89 1HA GLY 89 -12.563 0.565 -1.797 99 2HA GLY 89 2HA GLY 89 -10.869 0.249 -2.142 100 H THR 90 H THR 90 -9.664 -0.289 -0.456 101 HA THR 90 HA THR 90 -9.891 1.045 2.070 102 HB THR 90 HB THR 90 -10.348 -1.903 2.269 103 HG1 THR 90 HG1 THR 90 -12.613 -1.453 2.299 104 1HG2 THR 90 1HG2 THR 90 -10.043 0.034 4.152 105 2HG2 THR 90 2HG2 THR 90 -11.798 -0.075 4.020 106 3HG2 THR 90 3HG2 THR 90 -10.851 -1.513 4.403 107 H PHE 91 H PHE 91 -8.027 0.911 3.219 108 HA PHE 91 HA PHE 91 -5.801 -0.440 1.947 109 1HB PHE 91 1HB PHE 91 -5.728 1.930 2.878 110 2HB PHE 91 2HB PHE 91 -5.716 1.196 4.480 111 HD1 PHE 91 HD1 PHE 91 -3.919 0.863 1.219 112 HD2 PHE 91 HD2 PHE 91 -3.675 0.889 5.476 113 HE1 PHE 91 HE1 PHE 91 -1.471 0.607 1.075 114 HE2 PHE 91 HE2 PHE 91 -1.227 0.634 5.341 115 HZ PHE 91 HZ PHE 91 -0.123 0.492 3.139 116 H TYR 92 H TYR 92 -4.173 -1.554 3.408 117 HA TYR 92 HA TYR 92 -5.058 -2.773 5.814 118 1HB TYR 92 1HB TYR 92 -5.667 -4.119 3.296 119 2HB TYR 92 2HB TYR 92 -4.755 -5.127 4.414 120 HD1 TYR 92 HD1 TYR 92 -5.677 -5.406 6.785 121 HD2 TYR 92 HD2 TYR 92 -7.974 -3.813 3.567 122 HE1 TYR 92 HE1 TYR 92 -7.747 -5.906 8.023 123 HE2 TYR 92 HE2 TYR 92 -10.051 -4.307 4.797 124 HH TYR 92 HH TYR 92 -10.841 -4.742 6.980 125 H ARG 93 H ARG 93 -3.482 -4.292 6.687 126 HA ARG 93 HA ARG 93 -0.887 -4.307 5.329 127 1HB ARG 93 1HB ARG 93 -1.225 -3.490 8.218 128 2HB ARG 93 2HB ARG 93 0.286 -3.585 7.324 129 1HG ARG 93 1HG ARG 93 -0.031 -1.601 6.311 130 2HG ARG 93 2HG ARG 93 -1.774 -1.836 6.158 131 1HD ARG 93 1HD ARG 93 -1.857 -0.237 7.744 132 2HD ARG 93 2HD ARG 93 -1.562 -1.595 8.830 133 HE ARG 93 HE ARG 93 0.929 -0.816 8.237 134 1HH1 ARG 93 1HH1 ARG 93 -1.883 0.984 9.223 135 2HH1 ARG 93 2HH1 ARG 93 -0.973 2.217 10.028 136 1HH2 ARG 93 1HH2 ARG 93 2.139 0.802 9.294 137 2HH2 ARG 93 2HH2 ARG 93 1.316 2.114 10.068 138 H THR 94 H THR 94 -3.215 -6.129 6.454 139 HA THR 94 HA THR 94 -1.463 -8.344 7.031 140 HB THR 94 HB THR 94 -2.759 -8.881 9.168 141 HG1 THR 94 HG1 THR 94 -4.349 -7.202 8.788 142 1HG2 THR 94 1HG2 THR 94 -0.958 -6.472 9.210 143 2HG2 THR 94 2HG2 THR 94 -1.384 -7.474 10.599 144 3HG2 THR 94 3HG2 THR 94 -0.445 -8.160 9.272 145 HA PRO 95 HA PRO 95 -5.281 -9.462 4.716 146 1HB PRO 95 1HB PRO 95 -4.020 -11.148 3.002 147 2HB PRO 95 2HB PRO 95 -4.118 -9.404 2.735 148 1HG PRO 95 1HG PRO 95 -1.864 -11.027 3.850 149 2HG PRO 95 2HG PRO 95 -1.811 -9.687 2.690 150 1HD PRO 95 1HD PRO 95 -1.229 -9.375 5.321 151 2HD PRO 95 2HD PRO 95 -1.958 -8.088 4.344 152 H SER 96 H SER 96 -6.106 -10.587 6.495 153 HA SER 96 HA SER 96 -5.542 -12.553 8.041 154 1HB SER 96 1HB SER 96 -7.781 -12.497 8.169 155 2HB SER 96 2HB SER 96 -7.939 -12.039 6.473 156 HG SER 96 HG SER 96 -8.734 -14.230 7.324 157 HA PRO 97 HA PRO 97 -5.856 -16.196 4.658 158 1HB PRO 97 1HB PRO 97 -4.813 -14.427 2.481 159 2HB PRO 97 2HB PRO 97 -5.870 -15.840 2.370 160 1HG PRO 97 1HG PRO 97 -6.868 -13.374 2.196 161 2HG PRO 97 2HG PRO 97 -7.744 -14.658 3.048 162 1HD PRO 97 1HD PRO 97 -6.274 -12.324 4.144 163 2HD PRO 97 2HD PRO 97 -7.659 -13.205 4.817 164 H ASP 98 H ASP 98 -3.466 -13.596 4.271 165 HA ASP 98 HA ASP 98 -1.373 -15.385 5.222 166 1HB ASP 98 1HB ASP 98 -1.363 -15.630 2.755 167 2HB ASP 98 2HB ASP 98 -1.132 -13.891 2.598 168 H ALA 99 H ALA 99 -2.595 -13.252 6.515 169 HA ALA 99 HA ALA 99 -1.816 -10.733 6.439 170 1HB ALA 99 1HB ALA 99 -1.766 -12.554 8.825 171 2HB ALA 99 2HB ALA 99 -1.495 -10.817 8.957 172 3HB ALA 99 3HB ALA 99 -3.027 -11.424 8.328 173 H LYS 100 H LYS 100 0.224 -12.410 8.731 174 HA LYS 100 HA LYS 100 2.448 -12.187 9.194 175 1HB LYS 100 1HB LYS 100 2.187 -13.031 6.416 176 2HB LYS 100 2HB LYS 100 3.695 -12.178 6.712 177 1HG LYS 100 1HG LYS 100 4.283 -14.362 7.129 178 2HG LYS 100 2HG LYS 100 3.903 -13.772 8.748 179 1HD LYS 100 1HD LYS 100 2.378 -15.374 8.967 180 2HD LYS 100 2HD LYS 100 1.497 -14.720 7.584 181 1HE LYS 100 1HE LYS 100 3.549 -16.901 7.658 182 2HE LYS 100 2HE LYS 100 1.923 -16.930 6.976 183 1HZ LYS 100 1HZ LYS 100 2.962 -15.073 5.452 184 2HZ LYS 100 2HZ LYS 100 4.400 -15.878 5.835 185 3HZ LYS 100 3HZ LYS 100 3.136 -16.715 5.085 186 H ALA 101 H ALA 101 0.823 -9.748 8.491 187 HA ALA 101 HA ALA 101 1.121 -7.504 8.321 188 1HB ALA 101 1HB ALA 101 3.022 -8.324 10.000 189 2HB ALA 101 2HB ALA 101 4.049 -7.674 8.722 190 3HB ALA 101 3HB ALA 101 2.854 -6.640 9.504 191 H PHE 102 H PHE 102 0.686 -7.101 6.208 192 HA PHE 102 HA PHE 102 2.247 -7.737 4.000 193 1HB PHE 102 1HB PHE 102 -0.122 -6.263 4.513 194 2HB PHE 102 2HB PHE 102 0.922 -5.239 3.534 195 HD1 PHE 102 HD1 PHE 102 2.298 -7.509 2.022 196 HD2 PHE 102 HD2 PHE 102 -1.795 -6.689 2.895 197 HE1 PHE 102 HE1 PHE 102 1.622 -8.752 0.003 198 HE2 PHE 102 HE2 PHE 102 -2.478 -7.931 0.878 199 HZ PHE 102 HZ PHE 102 -0.769 -8.964 -0.570 200 H ILE 103 H ILE 103 2.565 -5.235 2.664 201 HA ILE 103 HA ILE 103 5.200 -4.586 3.458 202 HB ILE 103 HB ILE 103 3.354 -3.055 1.621 203 1HG1 ILE 103 1HG1 ILE 103 3.577 -5.204 0.682 204 2HG1 ILE 103 2HG1 ILE 103 4.802 -4.241 -0.138 205 1HG2 ILE 103 1HG2 ILE 103 6.025 -2.530 2.574 206 2HG2 ILE 103 2HG2 ILE 103 5.993 -2.708 0.820 207 3HG2 ILE 103 3HG2 ILE 103 4.957 -1.516 1.605 208 1HD1 ILE 103 1HD1 ILE 103 6.462 -5.138 1.511 209 2HD1 ILE 103 2HD1 ILE 103 5.204 -6.244 2.062 210 3HD1 ILE 103 3HD1 ILE 103 5.782 -6.324 0.398 211 H GLU 104 H GLU 104 5.372 -3.778 5.504 212 HA GLU 104 HA GLU 104 3.827 -1.360 6.146 213 1HB GLU 104 1HB GLU 104 4.525 -3.694 7.660 214 2HB GLU 104 2HB GLU 104 5.200 -2.268 8.440 215 1HG GLU 104 1HG GLU 104 2.719 -1.382 7.926 216 2HG GLU 104 2HG GLU 104 2.397 -3.106 8.106 217 H VAL 105 H VAL 105 5.302 -0.225 8.094 218 HA VAL 105 HA VAL 105 7.315 1.146 6.652 219 HB VAL 105 HB VAL 105 7.258 1.226 9.636 220 1HG1 VAL 105 1HG1 VAL 105 8.597 2.665 7.789 221 2HG1 VAL 105 2HG1 VAL 105 7.156 3.663 7.987 222 3HG1 VAL 105 3HG1 VAL 105 8.160 3.276 9.385 223 1HG2 VAL 105 1HG2 VAL 105 4.971 1.765 7.877 224 2HG2 VAL 105 2HG2 VAL 105 5.020 1.434 9.608 225 3HG2 VAL 105 3HG2 VAL 105 5.357 3.059 9.011 226 H GLY 106 H GLY 106 9.569 1.217 7.006 227 1HA GLY 106 1HA GLY 106 11.652 0.362 7.478 228 2HA GLY 106 2HA GLY 106 10.911 -0.555 8.780 229 H GLN 107 H GLN 107 9.264 -1.221 5.983 230 HA GLN 107 HA GLN 107 11.032 -3.452 5.266 231 1HB GLN 107 1HB GLN 107 8.934 -3.947 6.806 232 2HB GLN 107 2HB GLN 107 8.067 -3.866 5.281 233 1HG GLN 107 1HG GLN 107 10.392 -5.701 5.834 234 2HG GLN 107 2HG GLN 107 8.694 -6.156 5.950 235 1HE2 GLN 107 2HE2 GLN 107 7.403 -5.985 3.998 236 2HE2 GLN 107 1HE2 GLN 107 8.155 -6.261 2.466 237 H LYS 108 H LYS 108 10.795 -4.215 3.079 238 HA LYS 108 HA LYS 108 8.954 -3.363 1.211 239 1HB LYS 108 1HB LYS 108 10.349 -1.164 1.980 240 2HB LYS 108 2HB LYS 108 11.337 -1.717 0.638 241 1HG LYS 108 1HG LYS 108 9.468 -0.008 0.192 242 2HG LYS 108 2HG LYS 108 9.652 -1.366 -0.916 243 1HD LYS 108 1HD LYS 108 7.792 -2.491 -0.006 244 2HD LYS 108 2HD LYS 108 7.756 -1.444 1.415 245 1HE LYS 108 1HE LYS 108 5.991 -0.678 0.085 246 2HE LYS 108 2HE LYS 108 7.299 0.462 -0.225 247 1HZ LYS 108 1HZ LYS 108 7.527 -1.632 -2.059 248 2HZ LYS 108 2HZ LYS 108 5.911 -1.134 -2.064 249 3HZ LYS 108 3HZ LYS 108 7.142 -0.015 -2.366 250 H VAL 109 H VAL 109 10.691 -2.880 -1.006 251 HA VAL 109 HA VAL 109 12.815 -4.659 -1.251 252 HB VAL 109 HB VAL 109 11.387 -6.319 -2.786 253 1HG1 VAL 109 1HG1 VAL 109 12.615 -6.410 -0.236 254 2HG1 VAL 109 2HG1 VAL 109 11.123 -7.346 -0.148 255 3HG1 VAL 109 3HG1 VAL 109 12.337 -7.734 -1.368 256 1HG2 VAL 109 1HG2 VAL 109 9.271 -5.127 -2.144 257 2HG2 VAL 109 2HG2 VAL 109 9.266 -6.866 -1.858 258 3HG2 VAL 109 3HG2 VAL 109 9.496 -5.753 -0.511 259 H ASN 110 H ASN 110 12.735 -5.536 -3.789 260 HA ASN 110 HA ASN 110 12.697 -3.055 -5.290 261 1HB ASN 110 1HB ASN 110 13.673 -4.554 -7.113 262 2HB ASN 110 2HB ASN 110 14.643 -4.350 -5.657 263 1HD2 ASN 110 2HD2 ASN 110 15.444 -6.124 -4.813 264 2HD2 ASN 110 1HD2 ASN 110 14.833 -7.726 -5.034 265 H VAL 111 H VAL 111 11.738 -2.938 -7.439 266 HA VAL 111 HA VAL 111 9.034 -3.416 -7.496 267 HB VAL 111 HB VAL 111 10.944 -3.147 -9.816 268 1HG1 VAL 111 1HG1 VAL 111 7.948 -3.321 -9.761 269 2HG1 VAL 111 2HG1 VAL 111 8.803 -2.472 -11.049 270 3HG1 VAL 111 3HG1 VAL 111 9.090 -4.191 -10.786 271 1HG2 VAL 111 1HG2 VAL 111 10.019 -1.309 -7.921 272 2HG2 VAL 111 2HG2 VAL 111 10.870 -0.958 -9.425 273 3HG2 VAL 111 3HG2 VAL 111 9.107 -0.972 -9.392 274 H GLY 112 H GLY 112 7.940 -5.265 -7.436 275 1HA GLY 112 1HA GLY 112 7.644 -7.197 -9.201 276 2HA GLY 112 2HA GLY 112 9.172 -7.698 -8.494 277 H ASP 113 H ASP 113 8.408 -6.736 -5.815 278 HA ASP 113 HA ASP 113 7.068 -9.126 -4.954 279 1HB ASP 113 1HB ASP 113 8.715 -7.103 -3.763 280 2HB ASP 113 2HB ASP 113 7.264 -7.323 -2.792 281 H THR 114 H THR 114 5.458 -8.584 -2.945 282 HA THR 114 HA THR 114 3.138 -7.439 -4.238 283 HB THR 114 HB THR 114 2.810 -8.228 -1.445 284 HG1 THR 114 HG1 THR 114 3.558 -10.215 -1.543 285 1HG2 THR 114 1HG2 THR 114 1.119 -8.077 -3.460 286 2HG2 THR 114 2HG2 THR 114 1.626 -9.749 -3.695 287 3HG2 THR 114 3HG2 THR 114 0.916 -9.252 -2.160 288 H LEU 115 H LEU 115 1.627 -6.138 -2.688 289 HA LEU 115 HA LEU 115 3.210 -4.133 -1.232 290 1HB LEU 115 1HB LEU 115 1.970 -3.706 -3.690 291 2HB LEU 115 2HB LEU 115 0.874 -2.997 -2.520 292 HG LEU 115 HG LEU 115 3.666 -2.202 -3.218 293 1HD1 LEU 115 1HD1 LEU 115 1.019 -1.128 -3.467 294 2HD1 LEU 115 2HD1 LEU 115 2.033 -0.031 -2.529 295 3HD1 LEU 115 3HD1 LEU 115 2.536 -0.536 -4.143 296 1HD2 LEU 115 1HD2 LEU 115 2.541 -2.285 -0.525 297 2HD2 LEU 115 2HD2 LEU 115 4.208 -2.053 -1.054 298 3HD2 LEU 115 3HD2 LEU 115 3.098 -0.684 -1.012 299 H CYS 116 H CYS 116 -0.245 -4.630 -1.978 300 HA CYS 116 HA CYS 116 -1.023 -5.584 0.519 301 1HB CYS 116 1HB CYS 116 -2.080 -3.478 1.443 302 2HB CYS 116 2HB CYS 116 -0.324 -3.554 1.541 303 HG CYS 116 HG CYS 116 -1.943 -1.601 -0.196 304 H ILE 117 H ILE 117 -3.314 -5.742 0.767 305 HA ILE 117 HA ILE 117 -4.699 -5.760 -1.764 306 HB ILE 117 HB ILE 117 -5.452 -6.680 1.001 307 1HG1 ILE 117 1HG1 ILE 117 -5.666 -8.481 -1.313 308 2HG1 ILE 117 2HG1 ILE 117 -4.032 -7.895 -1.006 309 1HG2 ILE 117 1HG2 ILE 117 -7.451 -5.709 -0.052 310 2HG2 ILE 117 2HG2 ILE 117 -7.212 -6.761 -1.448 311 3HG2 ILE 117 3HG2 ILE 117 -7.580 -7.459 0.129 312 1HD1 ILE 117 1HD1 ILE 117 -5.331 -8.757 1.428 313 2HD1 ILE 117 2HD1 ILE 117 -5.286 -10.034 0.214 314 3HD1 ILE 117 3HD1 ILE 117 -3.791 -9.256 0.728 315 H VAL 118 H VAL 118 -6.068 -4.277 -2.504 316 HA VAL 118 HA VAL 118 -6.602 -1.909 -0.936 317 HB VAL 118 HB VAL 118 -7.714 -2.544 -3.667 318 1HG1 VAL 118 1HG1 VAL 118 -7.831 -0.284 -1.885 319 2HG1 VAL 118 2HG1 VAL 118 -7.085 0.164 -3.418 320 3HG1 VAL 118 3HG1 VAL 118 -8.691 -0.566 -3.398 321 1HG2 VAL 118 1HG2 VAL 118 -5.025 -2.480 -3.070 322 2HG2 VAL 118 2HG2 VAL 118 -5.742 -2.206 -4.658 323 3HG2 VAL 118 3HG2 VAL 118 -5.359 -0.836 -3.615 324 H GLU 119 H GLU 119 -8.132 -4.875 -1.599 325 HA GLU 119 HA GLU 119 -10.221 -5.712 -1.246 326 1HB GLU 119 1HB GLU 119 -9.390 -5.276 1.061 327 2HB GLU 119 2HB GLU 119 -10.193 -3.713 1.022 328 1HG GLU 119 1HG GLU 119 -12.276 -5.260 0.411 329 2HG GLU 119 2HG GLU 119 -11.324 -6.426 1.329 330 H ALA 120 H ALA 120 -10.212 -3.691 -3.190 331 HA ALA 120 HA ALA 120 -12.459 -1.939 -2.665 332 1HB ALA 120 1HB ALA 120 -10.274 -1.917 -4.441 333 2HB ALA 120 2HB ALA 120 -11.731 -1.997 -5.430 334 3HB ALA 120 3HB ALA 120 -11.533 -0.697 -4.256 335 H MET 121 H MET 121 -14.503 -2.537 -2.932 336 HA MET 121 HA MET 121 -16.340 -3.744 -3.532 337 1HB MET 121 1HB MET 121 -16.725 -3.979 -5.854 338 2HB MET 121 2HB MET 121 -15.708 -2.556 -5.687 339 1HG MET 121 1HG MET 121 -13.933 -3.528 -6.708 340 2HG MET 121 2HG MET 121 -14.344 -5.143 -6.139 341 1HE MET 121 1HE MET 121 -15.660 -6.637 -6.936 342 2HE MET 121 2HE MET 121 -16.985 -6.445 -8.084 343 3HE MET 121 3HE MET 121 -15.389 -6.935 -8.652 344 H LYS 122 H LYS 122 -14.197 -5.201 -2.296 345 HA LYS 122 HA LYS 122 -13.516 -7.328 -1.854 346 1HB LYS 122 1HB LYS 122 -15.990 -7.572 -1.599 347 2HB LYS 122 2HB LYS 122 -16.070 -8.103 -3.273 348 1HG LYS 122 1HG LYS 122 -16.008 -9.847 -1.349 349 2HG LYS 122 2HG LYS 122 -15.084 -10.127 -2.825 350 1HD LYS 122 1HD LYS 122 -13.692 -10.641 -0.933 351 2HD LYS 122 2HD LYS 122 -13.092 -9.165 -1.692 352 1HE LYS 122 1HE LYS 122 -13.603 -7.883 0.093 353 2HE LYS 122 2HE LYS 122 -15.085 -8.775 0.440 354 H MET 123 H MET 123 -12.048 -6.481 -3.805 355 HA MET 123 HA MET 123 -12.056 -8.641 -5.807 356 1HB MET 123 1HB MET 123 -11.544 -7.185 -7.526 357 2HB MET 123 2HB MET 123 -12.629 -6.205 -6.553 358 1HG MET 123 1HG MET 123 -10.683 -5.128 -5.506 359 2HG MET 123 2HG MET 123 -9.623 -6.073 -6.549 360 1HE MET 123 1HE MET 123 -9.626 -3.227 -5.979 361 2HE MET 123 2HE MET 123 -8.920 -2.835 -7.547 362 3HE MET 123 3HE MET 123 -10.444 -2.096 -7.057 363 H MET 124 H MET 124 -10.592 -7.936 -3.132 364 HA MET 124 HA MET 124 -8.433 -7.914 -2.311 365 1HB MET 124 1HB MET 124 -8.481 -10.286 -4.182 366 2HB MET 124 2HB MET 124 -7.237 -10.016 -2.970 367 1HG MET 124 1HG MET 124 -10.144 -10.615 -2.554 368 2HG MET 124 2HG MET 124 -8.744 -11.545 -2.024 369 1HE MET 124 1HE MET 124 -11.524 -9.899 -0.771 370 2HE MET 124 2HE MET 124 -11.064 -8.668 0.405 371 3HE MET 124 3HE MET 124 -10.969 -8.317 -1.321 372 H ASN 125 H ASN 125 -8.646 -6.076 -4.425 373 HA ASN 125 HA ASN 125 -6.685 -6.383 -6.417 374 1HB ASN 125 1HB ASN 125 -8.243 -4.674 -6.804 375 2HB ASN 125 2HB ASN 125 -8.035 -3.989 -5.192 376 1HD2 ASN 125 2HD2 ASN 125 -7.734 -1.953 -6.192 377 2HD2 ASN 125 1HD2 ASN 125 -6.218 -1.533 -6.906 378 H GLN 126 H GLN 126 -5.025 -7.385 -5.025 379 HA GLN 126 HA GLN 126 -3.580 -5.668 -3.217 380 1HB GLN 126 1HB GLN 126 -2.159 -7.561 -2.817 381 2HB GLN 126 2HB GLN 126 -3.828 -8.119 -2.848 382 1HG GLN 126 1HG GLN 126 -3.257 -9.630 -4.353 383 2HG GLN 126 2HG GLN 126 -2.876 -8.330 -5.481 384 1HE2 GLN 126 2HE2 GLN 126 -0.750 -7.722 -5.785 385 2HE2 GLN 126 1HE2 GLN 126 0.580 -8.672 -5.225 386 H ILE 127 H ILE 127 -2.059 -4.284 -3.773 387 HA ILE 127 HA ILE 127 -1.057 -4.201 -6.473 388 HB ILE 127 HB ILE 127 -0.046 -2.499 -4.210 389 1HG1 ILE 127 1HG1 ILE 127 -2.587 -2.569 -4.294 390 2HG1 ILE 127 2HG1 ILE 127 -1.852 -0.979 -4.468 391 1HG2 ILE 127 1HG2 ILE 127 -0.247 -2.186 -7.192 392 2HG2 ILE 127 2HG2 ILE 127 0.082 -0.830 -6.113 393 3HG2 ILE 127 3HG2 ILE 127 1.200 -2.192 -6.184 394 1HD1 ILE 127 1HD1 ILE 127 -2.107 -1.220 -6.936 395 2HD1 ILE 127 2HD1 ILE 127 -3.023 -2.697 -6.636 396 3HD1 ILE 127 3HD1 ILE 127 -3.624 -1.151 -6.040 397 H GLU 128 H GLU 128 1.192 -4.194 -7.033 398 HA GLU 128 HA GLU 128 2.813 -5.881 -5.244 399 1HB GLU 128 1HB GLU 128 2.561 -5.768 -8.228 400 2HB GLU 128 2HB GLU 128 4.055 -6.343 -7.501 401 1HG GLU 128 1HG GLU 128 2.563 -7.945 -6.170 402 2HG GLU 128 2HG GLU 128 1.312 -7.531 -7.344 403 H ALA 129 H ALA 129 4.392 -4.803 -4.272 404 HA ALA 129 HA ALA 129 5.199 -2.267 -4.499 405 1HB ALA 129 1HB ALA 129 6.537 -4.727 -3.635 406 2HB ALA 129 2HB ALA 129 7.635 -3.421 -4.080 407 3HB ALA 129 3HB ALA 129 6.411 -3.159 -2.835 408 H ASP 130 H ASP 130 5.390 -1.222 -6.403 409 HA ASP 130 HA ASP 130 7.391 -2.245 -8.308 410 1HB ASP 130 1HB ASP 130 6.026 -0.928 -10.037 411 2HB ASP 130 2HB ASP 130 5.337 -2.439 -9.447 412 H LYS 131 H LYS 131 7.665 -0.384 -6.013 413 HA LYS 131 HA LYS 131 8.398 2.084 -7.432 414 1HB LYS 131 1HB LYS 131 8.323 1.761 -4.442 415 2HB LYS 131 2HB LYS 131 8.240 3.243 -5.384 416 1HG LYS 131 1HG LYS 131 6.099 1.127 -5.276 417 2HG LYS 131 2HG LYS 131 6.085 2.650 -4.385 418 1HD LYS 131 1HD LYS 131 6.072 3.895 -6.473 419 2HD LYS 131 2HD LYS 131 6.161 2.390 -7.391 420 1HE LYS 131 1HE LYS 131 3.993 1.728 -6.671 421 2HE LYS 131 2HE LYS 131 3.925 3.023 -5.477 422 1HZ LYS 131 1HZ LYS 131 4.315 4.373 -7.774 423 2HZ LYS 131 2HZ LYS 131 3.346 3.090 -8.301 424 3HZ LYS 131 3HZ LYS 131 2.805 4.106 -7.061 425 H SER 132 H SER 132 9.685 -0.722 -6.056 426 HA SER 132 HA SER 132 11.786 -1.409 -5.498 427 1HB SER 132 1HB SER 132 13.610 -0.399 -6.958 428 2HB SER 132 2HB SER 132 12.253 -1.128 -7.817 429 HG SER 132 HG SER 132 13.146 1.382 -7.946 430 H GLY 133 H GLY 133 11.276 -0.288 -3.373 431 1HA GLY 133 1HA GLY 133 13.590 1.186 -2.570 432 2HA GLY 133 2HA GLY 133 12.159 2.204 -2.621 433 H THR 134 H THR 134 12.696 2.419 -0.300 434 HA THR 134 HA THR 134 11.643 0.161 1.268 435 HB THR 134 HB THR 134 13.623 2.309 2.019 436 HG1 THR 134 HG1 THR 134 14.684 0.670 1.070 437 1HG2 THR 134 1HG2 THR 134 11.958 0.613 3.744 438 2HG2 THR 134 2HG2 THR 134 13.682 0.631 4.117 439 3HG2 THR 134 3HG2 THR 134 12.770 2.141 4.085 440 H VAL 135 H VAL 135 10.026 0.513 2.751 441 HA VAL 135 HA VAL 135 8.371 2.803 2.329 442 HB VAL 135 HB VAL 135 8.190 0.535 4.309 443 1HG1 VAL 135 1HG1 VAL 135 6.258 2.803 3.840 444 2HG1 VAL 135 2HG1 VAL 135 5.896 1.347 4.768 445 3HG1 VAL 135 3HG1 VAL 135 7.148 2.458 5.324 446 1HG2 VAL 135 1HG2 VAL 135 7.713 0.509 1.646 447 2HG2 VAL 135 2HG2 VAL 135 6.889 -0.530 2.810 448 3HG2 VAL 135 3HG2 VAL 135 6.122 0.961 2.260 449 H LYS 136 H LYS 136 8.050 4.576 3.582 450 HA LYS 136 HA LYS 136 9.944 4.963 5.795 451 1HB LYS 136 1HB LYS 136 9.511 6.536 3.609 452 2HB LYS 136 2HB LYS 136 8.461 7.301 4.792 453 1HG LYS 136 1HG LYS 136 10.759 8.253 4.661 454 2HG LYS 136 2HG LYS 136 10.280 7.705 6.268 455 1HD LYS 136 1HD LYS 136 11.557 5.601 4.729 456 2HD LYS 136 2HD LYS 136 12.596 7.016 4.911 457 1HE LYS 136 1HE LYS 136 11.469 6.656 7.423 458 2HE LYS 136 2HE LYS 136 11.819 5.021 6.863 459 1HZ LYS 136 1HZ LYS 136 13.815 7.211 6.779 460 2HZ LYS 136 2HZ LYS 136 13.657 6.163 8.097 461 3HZ LYS 136 3HZ LYS 136 14.086 5.552 6.579 462 H ALA 137 H ALA 137 6.546 5.267 4.895 463 HA ALA 137 HA ALA 137 5.577 4.672 7.447 464 1HB ALA 137 1HB ALA 137 5.601 7.625 6.836 465 2HB ALA 137 2HB ALA 137 4.723 6.865 8.164 466 3HB ALA 137 3HB ALA 137 6.486 6.812 8.127 467 H ILE 138 H ILE 138 3.182 5.309 7.658 468 HA ILE 138 HA ILE 138 1.932 5.311 4.988 469 HB ILE 138 HB ILE 138 1.197 3.669 7.407 470 1HG1 ILE 138 1HG1 ILE 138 2.180 3.096 4.633 471 2HG1 ILE 138 2HG1 ILE 138 2.756 2.457 6.169 472 1HG2 ILE 138 1HG2 ILE 138 -0.424 4.239 4.936 473 2HG2 ILE 138 2HG2 ILE 138 -0.739 2.882 6.018 474 3HG2 ILE 138 3HG2 ILE 138 -0.870 4.536 6.615 475 1HD1 ILE 138 1HD1 ILE 138 0.562 1.221 6.327 476 2HD1 ILE 138 2HD1 ILE 138 0.289 1.685 4.647 477 3HD1 ILE 138 3HD1 ILE 138 1.676 0.682 5.070 478 H LEU 139 H LEU 139 0.035 6.467 4.738 479 HA LEU 139 HA LEU 139 -0.631 8.268 6.970 480 1HB LEU 139 1HB LEU 139 -0.650 8.613 3.999 481 2HB LEU 139 2HB LEU 139 -1.711 9.594 4.990 482 HG LEU 139 HG LEU 139 0.405 10.735 4.427 483 1HD1 LEU 139 1HD1 LEU 139 -0.239 10.122 7.290 484 2HD1 LEU 139 2HD1 LEU 139 1.045 11.250 6.852 485 3HD1 LEU 139 3HD1 LEU 139 -0.616 11.568 6.352 486 1HD2 LEU 139 1HD2 LEU 139 1.586 8.321 4.825 487 2HD2 LEU 139 2HD2 LEU 139 2.442 9.862 4.777 488 3HD2 LEU 139 3HD2 LEU 139 1.984 9.156 6.327 489 H VAL 140 H VAL 140 -2.025 6.311 4.370 490 HA VAL 140 HA VAL 140 -4.715 6.794 4.785 491 HB VAL 140 HB VAL 140 -3.358 4.227 3.957 492 1HG1 VAL 140 1HG1 VAL 140 -6.192 4.845 4.442 493 2HG1 VAL 140 2HG1 VAL 140 -5.842 4.061 2.902 494 3HG1 VAL 140 3HG1 VAL 140 -5.355 3.294 4.413 495 1HG2 VAL 140 1HG2 VAL 140 -3.036 6.197 2.490 496 2HG2 VAL 140 2HG2 VAL 140 -3.933 4.894 1.711 497 3HG2 VAL 140 3HG2 VAL 140 -4.786 6.314 2.313 498 H GLU 141 H GLU 141 -2.778 4.166 6.229 499 HA GLU 141 HA GLU 141 -2.898 3.301 8.363 500 1HB GLU 141 1HB GLU 141 -5.522 4.700 8.804 501 2HB GLU 141 2HB GLU 141 -4.355 4.158 10.002 502 1HG GLU 141 1HG GLU 141 -3.065 6.025 8.302 503 2HG GLU 141 2HG GLU 141 -4.611 6.709 8.802 504 H SER 142 H SER 142 -3.189 1.238 7.661 505 HA SER 142 HA SER 142 -5.167 0.040 6.304 506 1HB SER 142 1HB SER 142 -3.473 -1.427 6.879 507 2HB SER 142 2HB SER 142 -3.471 -0.928 8.570 508 HG SER 142 HG SER 142 -4.610 -2.669 8.852 509 H GLY 143 H GLY 143 -7.016 -1.340 6.986 510 1HA GLY 143 1HA GLY 143 -8.939 -1.751 8.203 511 2HA GLY 143 2HA GLY 143 -8.262 -0.808 9.522 512 H GLN 144 H GLN 144 -7.924 1.167 6.986 513 HA GLN 144 HA GLN 144 -10.594 2.362 7.353 514 1HB GLN 144 1HB GLN 144 -7.925 3.482 7.643 515 2HB GLN 144 2HB GLN 144 -8.902 4.404 6.507 516 1HG GLN 144 1HG GLN 144 -10.702 4.358 8.336 517 2HG GLN 144 2HG GLN 144 -9.389 3.881 9.412 518 1HE2 GLN 144 2HE2 GLN 144 -7.441 5.458 7.871 519 2HE2 GLN 144 1HE2 GLN 144 -7.715 7.103 8.321 520 HA PRO 145 HA PRO 145 -11.172 2.276 2.990 521 1HB PRO 145 1HB PRO 145 -12.599 4.535 2.556 522 2HB PRO 145 2HB PRO 145 -13.274 3.125 3.383 523 1HG PRO 145 1HG PRO 145 -12.171 5.655 4.545 524 2HG PRO 145 2HG PRO 145 -13.630 4.756 5.001 525 1HD PRO 145 1HD PRO 145 -11.298 4.576 6.380 526 2HD PRO 145 2HD PRO 145 -12.450 3.231 6.257 527 H VAL 146 H VAL 146 -10.256 2.964 1.095 528 HA VAL 146 HA VAL 146 -8.261 5.099 1.331 529 HB VAL 146 HB VAL 146 -7.194 4.168 -0.621 530 1HG1 VAL 146 1HG1 VAL 146 -7.950 2.244 1.546 531 2HG1 VAL 146 2HG1 VAL 146 -6.895 1.743 0.223 532 3HG1 VAL 146 3HG1 VAL 146 -6.419 3.077 1.274 533 1HG2 VAL 146 1HG2 VAL 146 -9.730 2.614 -0.840 534 2HG2 VAL 146 2HG2 VAL 146 -8.809 3.448 -2.090 535 3HG2 VAL 146 3HG2 VAL 146 -8.235 1.908 -1.452 536 H GLU 147 H GLU 147 -8.188 6.837 -0.056 537 HA GLU 147 HA GLU 147 -10.488 7.153 -1.870 538 1HB GLU 147 1HB GLU 147 -10.181 8.578 0.397 539 2HB GLU 147 2HB GLU 147 -9.260 9.588 -0.712 540 1HG GLU 147 1HG GLU 147 -11.929 8.697 -1.616 541 2HG GLU 147 2HG GLU 147 -11.874 9.880 -0.308 542 H PHE 148 H PHE 148 -10.106 7.963 -3.877 543 HA PHE 148 HA PHE 148 -7.827 7.597 -5.238 544 1HB PHE 148 1HB PHE 148 -10.186 8.659 -5.914 545 2HB PHE 148 2HB PHE 148 -9.216 10.125 -5.913 546 HD1 PHE 148 HD1 PHE 148 -6.618 8.753 -6.816 547 HD2 PHE 148 HD2 PHE 148 -10.632 8.613 -8.251 548 HE1 PHE 148 HE1 PHE 148 -5.788 8.209 -9.074 549 HE2 PHE 148 HE2 PHE 148 -9.810 8.068 -10.511 550 HZ PHE 148 HZ PHE 148 -7.385 7.865 -10.922 551 H ASP 149 H ASP 149 -5.804 8.294 -5.117 552 HA ASP 149 HA ASP 149 -4.000 9.668 -4.839 553 1HB ASP 149 1HB ASP 149 -5.737 12.007 -4.152 554 2HB ASP 149 2HB ASP 149 -4.221 11.967 -5.048 555 H GLU 150 H GLU 150 -4.577 8.089 -2.796 556 HA GLU 150 HA GLU 150 -4.272 9.802 -0.418 557 1HB GLU 150 1HB GLU 150 -5.934 7.405 -0.897 558 2HB GLU 150 2HB GLU 150 -5.092 7.451 0.646 559 1HG GLU 150 1HG GLU 150 -6.130 9.951 0.547 560 2HG GLU 150 2HG GLU 150 -7.362 9.033 -0.317 561 HA PRO 151 HA PRO 151 -0.112 8.092 -0.523 562 1HB PRO 151 1HB PRO 151 -0.277 9.176 2.256 563 2HB PRO 151 2HB PRO 151 0.998 9.369 1.048 564 1HG PRO 151 1HG PRO 151 -0.711 11.348 1.536 565 2HG PRO 151 2HG PRO 151 -0.168 11.002 -0.116 566 1HD PRO 151 1HD PRO 151 -2.785 10.419 1.180 567 2HD PRO 151 2HD PRO 151 -2.425 10.827 -0.510 568 H LEU 152 H LEU 152 -1.098 5.922 -0.530 569 HA LEU 152 HA LEU 152 -1.952 4.606 1.800 570 1HB LEU 152 1HB LEU 152 -0.704 3.488 -0.711 571 2HB LEU 152 2HB LEU 152 -1.478 2.519 0.531 572 HG LEU 152 HG LEU 152 -3.038 4.711 -0.767 573 1HD1 LEU 152 1HD1 LEU 152 -2.197 2.139 -2.026 574 2HD1 LEU 152 2HD1 LEU 152 -3.798 2.799 -2.362 575 3HD1 LEU 152 3HD1 LEU 152 -2.357 3.743 -2.742 576 1HD2 LEU 152 1HD2 LEU 152 -3.624 2.956 1.200 577 2HD2 LEU 152 2HD2 LEU 152 -4.823 3.662 0.118 578 3HD2 LEU 152 3HD2 LEU 152 -4.176 2.055 -0.212 579 H VAL 153 H VAL 153 1.228 4.709 0.222 580 HA VAL 153 HA VAL 153 2.518 4.267 2.776 581 HB VAL 153 HB VAL 153 3.293 2.392 0.564 582 1HG1 VAL 153 1HG1 VAL 153 3.718 2.501 3.539 583 2HG1 VAL 153 2HG1 VAL 153 4.050 1.057 2.581 584 3HG1 VAL 153 3HG1 VAL 153 4.928 2.552 2.256 585 1HG2 VAL 153 1HG2 VAL 153 1.176 1.939 2.660 586 2HG2 VAL 153 2HG2 VAL 153 0.977 1.890 0.908 587 3HG2 VAL 153 3HG2 VAL 153 1.931 0.651 1.723 588 H VAL 154 H VAL 154 3.984 5.828 2.814 589 HA VAL 154 HA VAL 154 5.116 6.893 0.379 590 HB VAL 154 HB VAL 154 6.033 8.622 1.683 591 1HG1 VAL 154 1HG1 VAL 154 3.460 8.354 1.618 592 2HG1 VAL 154 2HG1 VAL 154 3.620 7.986 3.335 593 3HG1 VAL 154 3HG1 VAL 154 4.170 9.542 2.711 594 1HG2 VAL 154 1HG2 VAL 154 5.760 6.731 4.007 595 2HG2 VAL 154 2HG2 VAL 154 7.226 7.472 3.362 596 3HG2 VAL 154 3HG2 VAL 154 6.043 8.460 4.219 597 H ILE 155 H ILE 155 6.967 6.270 -0.524 598 HA ILE 155 HA ILE 155 8.723 4.469 0.977 599 HB ILE 155 HB ILE 155 9.212 5.033 -1.898 600 1HG1 ILE 155 1HG1 ILE 155 7.462 3.042 -2.210 601 2HG1 ILE 155 2HG1 ILE 155 6.729 3.805 -0.802 602 1HG2 ILE 155 1HG2 ILE 155 10.615 3.487 -0.595 603 2HG2 ILE 155 2HG2 ILE 155 9.197 2.483 -0.289 604 3HG2 ILE 155 3HG2 ILE 155 9.798 2.684 -1.936 605 1HD1 ILE 155 1HD1 ILE 155 7.375 5.830 -2.684 606 2HD1 ILE 155 2HD1 ILE 155 6.507 4.540 -3.515 607 3HD1 ILE 155 3HD1 ILE 155 5.790 5.318 -2.105 608 H GLU 156 H GLU 156 10.925 4.826 1.198 609 HA GLU 156 HA GLU 156 11.908 7.480 0.394 610 1HB GLU 156 1HB GLU 156 11.330 7.536 2.776 611 2HB GLU 156 2HB GLU 156 12.356 6.139 3.067 612 1HG GLU 156 1HG GLU 156 14.073 7.481 3.415 613 2HG GLU 156 2HG GLU 156 13.935 8.085 1.765 614 1H10 BTN 222 1H10 BTN 122 -11.682 -11.422 0.724 615 2H10 BTN 222 2H10 BTN 122 -12.856 -12.730 0.845 616 1H9 BTN 222 1H9 BTN 122 -11.848 -13.399 2.705 617 2H9 BTN 222 2H9 BTN 122 -12.363 -11.899 3.477 618 1H8 BTN 222 1H8 BTN 122 -9.788 -12.360 1.977 619 2H8 BTN 222 2H8 BTN 122 -9.972 -12.157 3.719 620 1H7 BTN 222 1H7 BTN 122 -11.062 -10.016 2.000 621 2H7 BTN 222 2H7 BTN 122 -9.311 -10.161 2.064 622 H2 BTN 222 H2 BTN 122 -10.878 -10.098 4.622 623 1H6 BTN 222 1H6 BTN 122 -8.776 -6.319 3.712 624 2H6 BTN 222 2H6 BTN 122 -8.772 -7.435 2.356 625 H5 BTN 222 H5 BTN 122 -7.683 -7.809 5.084 626 HN1 BTN 222 HN2 BTN 122 -6.288 -8.189 2.980 627 HN2 BTN 222 HN1 BTN 122 -8.215 -11.542 3.909 628 H4 BTN 222 H4 BTN 122 -8.836 -9.733 5.610 Start of MODEL 5 1 1H GLU 77 H GLU 77 18.204 13.284 -5.899 2 HA GLU 77 HA GLU 77 15.738 12.561 -7.179 3 1HB GLU 77 1HB GLU 77 17.069 12.524 -9.157 4 2HB GLU 77 2HB GLU 77 18.382 11.687 -8.335 5 1HG GLU 77 1HG GLU 77 16.769 9.760 -8.028 6 2HG GLU 77 2HG GLU 77 15.714 10.594 -9.167 7 H ILE 78 H ILE 78 15.126 11.742 -5.196 8 HA ILE 78 HA ILE 78 16.737 9.977 -3.658 9 HB ILE 78 HB ILE 78 14.475 9.451 -2.542 10 1HG1 ILE 78 1HG1 ILE 78 13.454 11.980 -3.687 11 2HG1 ILE 78 2HG1 ILE 78 13.416 10.585 -4.761 12 1HG2 ILE 78 1HG2 ILE 78 16.243 11.691 -2.392 13 2HG2 ILE 78 2HG2 ILE 78 14.603 12.210 -2.003 14 3HG2 ILE 78 3HG2 ILE 78 15.349 10.891 -1.099 15 1HD1 ILE 78 1HD1 ILE 78 12.162 9.344 -3.033 16 2HD1 ILE 78 2HD1 ILE 78 12.123 10.813 -2.057 17 3HD1 ILE 78 3HD1 ILE 78 11.317 10.775 -3.625 18 H SER 79 H SER 79 15.646 7.785 -2.973 19 HA SER 79 HA SER 79 15.081 6.310 -5.458 20 1HB SER 79 1HB SER 79 16.563 5.517 -2.958 21 2HB SER 79 2HB SER 79 15.946 4.312 -4.087 22 HG SER 79 HG SER 79 17.495 4.794 -5.428 23 H GLY 80 H GLY 80 13.034 7.616 -3.978 24 1HA GLY 80 1HA GLY 80 11.451 5.255 -3.222 25 2HA GLY 80 2HA GLY 80 11.514 6.630 -2.129 26 H HIS 81 H HIS 81 9.114 6.393 -2.528 27 HA HIS 81 HA HIS 81 8.274 8.483 -4.264 28 1HB HIS 81 1HB HIS 81 6.838 7.171 -5.755 29 2HB HIS 81 2HB HIS 81 8.527 6.718 -5.953 30 HD1 HIS 81 HD1 HIS 81 5.279 5.268 -5.546 31 HD2 HIS 81 HD2 HIS 81 9.128 4.250 -4.358 32 HE1 HIS 81 HE1 HIS 81 5.188 2.815 -5.001 33 HE2 HIS 81 HE2 HIS 81 7.554 2.199 -4.393 34 H ILE 82 H ILE 82 5.638 8.090 -4.510 35 HA ILE 82 HA ILE 82 4.636 7.282 -1.874 36 HB ILE 82 HB ILE 82 4.032 9.925 -3.204 37 1HG1 ILE 82 1HG1 ILE 82 5.667 9.095 -0.832 38 2HG1 ILE 82 2HG1 ILE 82 6.057 10.248 -2.104 39 1HG2 ILE 82 1HG2 ILE 82 2.104 8.713 -2.056 40 2HG2 ILE 82 2HG2 ILE 82 2.978 8.999 -0.551 41 3HG2 ILE 82 3HG2 ILE 82 2.445 10.363 -1.535 42 1HD1 ILE 82 1HD1 ILE 82 3.874 11.379 -0.871 43 2HD1 ILE 82 2HD1 ILE 82 4.783 10.666 0.463 44 3HD1 ILE 82 3HD1 ILE 82 5.564 11.820 -0.620 45 H VAL 83 H VAL 83 3.204 5.737 -2.293 46 HA VAL 83 HA VAL 83 1.717 5.705 -4.781 47 HB VAL 83 HB VAL 83 1.267 3.764 -2.541 48 1HG1 VAL 83 1HG1 VAL 83 -0.158 3.656 -4.532 49 2HG1 VAL 83 2HG1 VAL 83 1.275 3.463 -5.542 50 3HG1 VAL 83 3HG1 VAL 83 0.847 2.216 -4.369 51 1HG2 VAL 83 1HG2 VAL 83 3.739 4.152 -4.101 52 2HG2 VAL 83 2HG2 VAL 83 3.498 3.414 -2.517 53 3HG2 VAL 83 3HG2 VAL 83 3.152 2.494 -3.981 54 H ARG 84 H ARG 84 -0.019 6.968 -4.932 55 HA ARG 84 HA ARG 84 -1.686 7.425 -2.571 56 1HB ARG 84 1HB ARG 84 -2.691 9.244 -3.837 57 2HB ARG 84 2HB ARG 84 -0.940 9.392 -3.852 58 1HG ARG 84 1HG ARG 84 -2.018 7.883 -6.110 59 2HG ARG 84 2HG ARG 84 -2.557 9.562 -6.036 60 1HD ARG 84 1HD ARG 84 -0.071 10.117 -5.659 61 2HD ARG 84 2HD ARG 84 0.234 8.485 -6.252 62 HE ARG 84 HE ARG 84 -0.162 9.249 -8.360 63 1HH1 ARG 84 1HH1 ARG 84 -1.683 11.417 -6.098 64 2HH1 ARG 84 2HH1 ARG 84 -2.178 12.547 -7.315 65 1HH2 ARG 84 1HH2 ARG 84 -0.808 10.731 -9.970 66 2HH2 ARG 84 2HH2 ARG 84 -1.680 12.157 -9.516 67 H SER 85 H SER 85 -3.796 6.805 -2.434 68 HA SER 85 HA SER 85 -4.654 4.588 -3.935 69 1HB SER 85 1HB SER 85 -5.697 4.600 -1.894 70 2HB SER 85 2HB SER 85 -5.861 6.355 -1.868 71 HG SER 85 HG SER 85 -7.862 5.182 -2.157 72 HA PRO 86 HA PRO 86 -6.024 7.017 -7.478 73 1HB PRO 86 1HB PRO 86 -6.477 4.880 -9.086 74 2HB PRO 86 2HB PRO 86 -4.861 5.534 -8.795 75 1HG PRO 86 1HG PRO 86 -6.199 3.168 -7.544 76 2HG PRO 86 2HG PRO 86 -4.532 3.334 -8.125 77 1HD PRO 86 1HD PRO 86 -5.193 3.523 -5.502 78 2HD PRO 86 2HD PRO 86 -3.841 4.425 -6.218 79 H MET 87 H MET 87 -7.656 4.097 -6.280 80 HA MET 87 HA MET 87 -10.229 5.438 -6.762 81 1HB MET 87 1HB MET 87 -10.302 2.507 -6.904 82 2HB MET 87 2HB MET 87 -11.088 3.704 -7.923 83 1HG MET 87 1HG MET 87 -8.159 3.104 -8.135 84 2HG MET 87 2HG MET 87 -9.378 2.183 -9.014 85 1HE MET 87 1HE MET 87 -8.812 2.442 -11.168 86 2HE MET 87 2HE MET 87 -8.862 3.895 -12.166 87 3HE MET 87 3HE MET 87 -7.420 3.523 -11.221 88 H VAL 88 H VAL 88 -11.749 5.247 -5.171 89 HA VAL 88 HA VAL 88 -11.006 4.864 -2.553 90 HB VAL 88 HB VAL 88 -13.732 4.552 -3.808 91 1HG1 VAL 88 1HG1 VAL 88 -12.963 4.622 -0.896 92 2HG1 VAL 88 2HG1 VAL 88 -14.604 4.867 -1.492 93 3HG1 VAL 88 3HG1 VAL 88 -13.791 3.324 -1.754 94 1HG2 VAL 88 1HG2 VAL 88 -12.216 6.785 -3.542 95 2HG2 VAL 88 2HG2 VAL 88 -13.979 6.776 -3.573 96 3HG2 VAL 88 3HG2 VAL 88 -13.126 6.811 -2.030 97 H GLY 89 H GLY 89 -11.714 3.205 -0.995 98 1HA GLY 89 1HA GLY 89 -12.621 0.670 -1.575 99 2HA GLY 89 2HA GLY 89 -10.889 0.610 -1.861 100 H THR 90 H THR 90 -9.915 -0.334 -0.199 101 HA THR 90 HA THR 90 -10.200 0.752 2.449 102 HB THR 90 HB THR 90 -10.822 -2.178 2.131 103 HG1 THR 90 HG1 THR 90 -12.970 -1.675 2.239 104 1HG2 THR 90 1HG2 THR 90 -10.062 -1.322 4.354 105 2HG2 THR 90 2HG2 THR 90 -11.514 -0.321 4.387 106 3HG2 THR 90 3HG2 THR 90 -11.655 -2.079 4.344 107 H PHE 91 H PHE 91 -8.135 0.995 2.966 108 HA PHE 91 HA PHE 91 -6.048 -0.617 1.891 109 1HB PHE 91 1HB PHE 91 -5.902 1.826 2.634 110 2HB PHE 91 2HB PHE 91 -5.799 1.206 4.281 111 HD1 PHE 91 HD1 PHE 91 -4.222 0.528 0.958 112 HD2 PHE 91 HD2 PHE 91 -3.695 1.024 5.160 113 HE1 PHE 91 HE1 PHE 91 -1.790 0.222 0.686 114 HE2 PHE 91 HE2 PHE 91 -1.263 0.719 4.895 115 HZ PHE 91 HZ PHE 91 -0.309 0.318 2.656 116 H TYR 92 H TYR 92 -4.380 -1.648 3.364 117 HA TYR 92 HA TYR 92 -5.294 -2.701 5.869 118 1HB TYR 92 1HB TYR 92 -5.332 -4.391 3.405 119 2HB TYR 92 2HB TYR 92 -4.980 -5.124 4.967 120 HD1 TYR 92 HD1 TYR 92 -6.783 -3.717 6.777 121 HD2 TYR 92 HD2 TYR 92 -7.462 -5.092 2.800 122 HE1 TYR 92 HE1 TYR 92 -9.197 -3.867 7.247 123 HE2 TYR 92 HE2 TYR 92 -9.878 -5.243 3.258 124 HH TYR 92 HH TYR 92 -11.525 -4.470 4.735 125 H ARG 93 H ARG 93 -3.690 -4.359 6.731 126 HA ARG 93 HA ARG 93 -1.008 -4.005 5.607 127 1HB ARG 93 1HB ARG 93 -1.983 -2.994 8.205 128 2HB ARG 93 2HB ARG 93 -0.436 -3.829 8.250 129 1HG ARG 93 1HG ARG 93 0.557 -2.282 6.777 130 2HG ARG 93 2HG ARG 93 -1.007 -1.603 6.315 131 1HD ARG 93 1HD ARG 93 0.068 -0.070 7.809 132 2HD ARG 93 2HD ARG 93 -1.286 -0.815 8.658 133 HE ARG 93 HE ARG 93 0.773 -2.388 9.373 134 1HH1 ARG 93 1HH1 ARG 93 0.365 1.072 9.358 135 2HH1 ARG 93 2HH1 ARG 93 1.417 1.333 10.708 136 1HH2 ARG 93 1HH2 ARG 93 2.163 -2.055 11.150 137 2HH2 ARG 93 2HH2 ARG 93 2.441 -0.445 11.726 138 H THR 94 H THR 94 -3.241 -6.143 6.362 139 HA THR 94 HA THR 94 -1.279 -8.197 6.967 140 HB THR 94 HB THR 94 -2.883 -9.130 8.744 141 HG1 THR 94 HG1 THR 94 -4.496 -7.932 9.304 142 1HG2 THR 94 1HG2 THR 94 -1.155 -6.727 9.163 143 2HG2 THR 94 2HG2 THR 94 -2.035 -7.471 10.500 144 3HG2 THR 94 3HG2 THR 94 -0.850 -8.413 9.592 145 HA PRO 95 HA PRO 95 -4.116 -9.625 3.664 146 1HB PRO 95 1HB PRO 95 -2.401 -11.757 3.099 147 2HB PRO 95 2HB PRO 95 -2.405 -10.194 2.283 148 1HG PRO 95 1HG PRO 95 -0.645 -11.193 4.466 149 2HG PRO 95 2HG PRO 95 -0.254 -10.132 3.101 150 1HD PRO 95 1HD PRO 95 -0.569 -9.180 5.590 151 2HD PRO 95 2HD PRO 95 -1.082 -8.252 4.166 152 H SER 96 H SER 96 -4.068 -12.434 3.259 153 HA SER 96 HA SER 96 -6.013 -13.525 4.608 154 1HB SER 96 1HB SER 96 -4.741 -15.744 4.656 155 2HB SER 96 2HB SER 96 -4.871 -14.936 3.092 156 HG SER 96 HG SER 96 -2.744 -15.636 3.474 157 HA PRO 97 HA PRO 97 -5.437 -13.245 8.980 158 1HB PRO 97 1HB PRO 97 -7.069 -15.721 9.069 159 2HB PRO 97 2HB PRO 97 -7.350 -14.159 9.843 160 1HG PRO 97 1HG PRO 97 -8.792 -14.916 7.732 161 2HG PRO 97 2HG PRO 97 -8.278 -13.230 7.931 162 1HD PRO 97 1HD PRO 97 -7.158 -15.356 6.148 163 2HD PRO 97 2HD PRO 97 -7.410 -13.628 5.825 164 H ASP 98 H ASP 98 -3.166 -14.159 8.096 165 HA ASP 98 HA ASP 98 -1.942 -15.614 9.957 166 1HB ASP 98 1HB ASP 98 -3.651 -17.395 8.367 167 2HB ASP 98 2HB ASP 98 -1.981 -17.939 8.492 168 H ALA 99 H ALA 99 -1.373 -13.714 7.952 169 HA ALA 99 HA ALA 99 0.523 -15.082 6.183 170 1HB ALA 99 1HB ALA 99 -0.574 -12.277 6.148 171 2HB ALA 99 2HB ALA 99 0.679 -12.858 5.052 172 3HB ALA 99 3HB ALA 99 -0.927 -13.587 5.019 173 H LYS 100 H LYS 100 1.020 -11.762 7.072 174 HA LYS 100 HA LYS 100 2.708 -11.968 9.250 175 1HB LYS 100 1HB LYS 100 4.941 -11.953 8.265 176 2HB LYS 100 2HB LYS 100 4.092 -13.433 7.844 177 1HG LYS 100 1HG LYS 100 4.460 -13.041 5.701 178 2HG LYS 100 2HG LYS 100 3.574 -11.519 5.815 179 1HD LYS 100 1HD LYS 100 5.465 -10.275 5.969 180 2HD LYS 100 2HD LYS 100 6.339 -11.520 6.863 181 1HE LYS 100 1HE LYS 100 7.349 -11.250 4.695 182 2HE LYS 100 2HE LYS 100 6.549 -12.819 4.769 183 1HZ LYS 100 1HZ LYS 100 5.103 -10.501 3.677 184 2HZ LYS 100 2HZ LYS 100 6.228 -11.314 2.708 185 3HZ LYS 100 3HZ LYS 100 4.898 -12.146 3.341 186 H ALA 101 H ALA 101 0.852 -10.148 8.211 187 HA ALA 101 HA ALA 101 0.503 -7.921 7.898 188 1HB ALA 101 1HB ALA 101 2.228 -8.084 9.906 189 2HB ALA 101 2HB ALA 101 3.262 -7.239 8.755 190 3HB ALA 101 3HB ALA 101 1.718 -6.534 9.237 191 H PHE 102 H PHE 102 0.360 -7.075 5.935 192 HA PHE 102 HA PHE 102 2.006 -7.586 3.785 193 1HB PHE 102 1HB PHE 102 -0.194 -5.800 4.364 194 2HB PHE 102 2HB PHE 102 0.980 -5.020 3.310 195 HD1 PHE 102 HD1 PHE 102 1.955 -7.237 1.684 196 HD2 PHE 102 HD2 PHE 102 -1.995 -6.356 3.027 197 HE1 PHE 102 HE1 PHE 102 1.029 -8.458 -0.248 198 HE2 PHE 102 HE2 PHE 102 -2.927 -7.574 1.098 199 HZ PHE 102 HZ PHE 102 -1.414 -8.627 -0.542 200 H ILE 103 H ILE 103 2.806 -5.291 2.568 201 HA ILE 103 HA ILE 103 5.276 -4.749 3.919 202 HB ILE 103 HB ILE 103 4.338 -3.237 1.505 203 1HG1 ILE 103 1HG1 ILE 103 3.805 -5.446 0.851 204 2HG1 ILE 103 2HG1 ILE 103 5.403 -5.143 0.174 205 1HG2 ILE 103 1HG2 ILE 103 6.586 -2.971 2.867 206 2HG2 ILE 103 2HG2 ILE 103 7.075 -4.335 1.862 207 3HG2 ILE 103 3HG2 ILE 103 6.547 -2.830 1.110 208 1HD1 ILE 103 1HD1 ILE 103 6.283 -6.272 2.308 209 2HD1 ILE 103 2HD1 ILE 103 4.634 -6.873 2.486 210 3HD1 ILE 103 3HD1 ILE 103 5.571 -7.279 1.048 211 H GLU 104 H GLU 104 5.229 -3.443 5.649 212 HA GLU 104 HA GLU 104 3.809 -0.875 5.389 213 1HB GLU 104 1HB GLU 104 4.380 -1.688 8.122 214 2HB GLU 104 2HB GLU 104 2.878 -1.115 7.412 215 1HG GLU 104 1HG GLU 104 2.174 -3.189 7.886 216 2HG GLU 104 2HG GLU 104 2.974 -3.589 6.366 217 H VAL 105 H VAL 105 4.811 0.390 7.618 218 HA VAL 105 HA VAL 105 7.119 1.585 6.730 219 HB VAL 105 HB VAL 105 6.634 1.293 9.677 220 1HG1 VAL 105 1HG1 VAL 105 8.294 2.894 8.049 221 2HG1 VAL 105 2HG1 VAL 105 7.077 3.956 8.755 222 3HG1 VAL 105 3HG1 VAL 105 8.092 2.962 9.799 223 1HG2 VAL 105 1HG2 VAL 105 4.790 2.377 7.673 224 2HG2 VAL 105 2HG2 VAL 105 4.491 1.869 9.334 225 3HG2 VAL 105 3HG2 VAL 105 5.146 3.473 9.008 226 H GLY 106 H GLY 106 9.317 1.430 7.245 227 1HA GLY 106 1HA GLY 106 11.290 0.316 7.606 228 2HA GLY 106 2HA GLY 106 10.490 -0.393 8.999 229 H GLN 107 H GLN 107 9.277 -0.872 5.767 230 HA GLN 107 HA GLN 107 10.217 -3.663 5.886 231 1HB GLN 107 1HB GLN 107 7.763 -3.384 6.222 232 2HB GLN 107 2HB GLN 107 7.661 -2.666 4.619 233 1HG GLN 107 1HG GLN 107 7.138 -4.778 4.044 234 2HG GLN 107 2HG GLN 107 8.892 -4.943 3.978 235 1HE2 GLN 107 2HE2 GLN 107 8.533 -7.204 4.325 236 2HE2 GLN 107 1HE2 GLN 107 8.254 -7.802 5.921 237 H LYS 108 H LYS 108 12.082 -3.242 4.608 238 HA LYS 108 HA LYS 108 12.332 -1.793 2.318 239 1HB LYS 108 1HB LYS 108 14.217 -3.092 1.782 240 2HB LYS 108 2HB LYS 108 14.088 -3.210 3.532 241 1HG LYS 108 1HG LYS 108 14.514 -5.388 2.918 242 2HG LYS 108 2HG LYS 108 12.754 -5.372 3.046 243 1HD LYS 108 1HD LYS 108 12.637 -6.105 0.950 244 2HD LYS 108 2HD LYS 108 13.367 -4.590 0.414 245 1HE LYS 108 1HE LYS 108 14.979 -5.925 -0.404 246 2HE LYS 108 2HE LYS 108 15.554 -5.945 1.262 247 1HZ LYS 108 1HZ LYS 108 13.920 -7.938 1.455 248 2HZ LYS 108 2HZ LYS 108 14.098 -8.018 -0.225 249 3HZ LYS 108 3HZ LYS 108 15.453 -8.167 0.777 250 H VAL 109 H VAL 109 12.357 -2.427 0.038 251 HA VAL 109 HA VAL 109 10.792 -4.712 -0.767 252 HB VAL 109 HB VAL 109 9.646 -2.270 -1.934 253 1HG1 VAL 109 1HG1 VAL 109 8.579 -4.863 -0.845 254 2HG1 VAL 109 2HG1 VAL 109 7.541 -3.578 -1.461 255 3HG1 VAL 109 3HG1 VAL 109 8.706 -4.358 -2.530 256 1HG2 VAL 109 1HG2 VAL 109 9.957 -1.599 0.448 257 2HG2 VAL 109 2HG2 VAL 109 8.270 -1.667 -0.064 258 3HG2 VAL 109 3HG2 VAL 109 8.949 -2.968 0.915 259 H ASN 110 H ASN 110 10.895 -5.128 -3.013 260 HA ASN 110 HA ASN 110 12.691 -3.388 -4.555 261 1HB ASN 110 1HB ASN 110 14.015 -5.214 -5.310 262 2HB ASN 110 2HB ASN 110 13.899 -5.390 -3.562 263 1HD2 ASN 110 2HD2 ASN 110 13.434 -7.337 -2.856 264 2HD2 ASN 110 1HD2 ASN 110 12.623 -8.578 -3.742 265 H VAL 111 H VAL 111 12.335 -3.339 -6.769 266 HA VAL 111 HA VAL 111 9.803 -3.474 -7.745 267 HB VAL 111 HB VAL 111 12.379 -3.930 -9.249 268 1HG1 VAL 111 1HG1 VAL 111 9.565 -3.632 -10.249 269 2HG1 VAL 111 2HG1 VAL 111 10.956 -3.197 -11.241 270 3HG1 VAL 111 3HG1 VAL 111 10.763 -4.855 -10.671 271 1HG2 VAL 111 1HG2 VAL 111 10.638 -1.509 -8.809 272 2HG2 VAL 111 2HG2 VAL 111 12.290 -1.762 -8.242 273 3HG2 VAL 111 3HG2 VAL 111 11.968 -1.572 -9.965 274 H GLY 112 H GLY 112 8.392 -5.083 -7.894 275 1HA GLY 112 1HA GLY 112 7.773 -7.120 -9.070 276 2HA GLY 112 2HA GLY 112 9.384 -7.734 -8.728 277 H ASP 113 H ASP 113 8.097 -6.058 -6.102 278 HA ASP 113 HA ASP 113 7.379 -8.601 -4.809 279 1HB ASP 113 1HB ASP 113 9.071 -6.433 -4.000 280 2HB ASP 113 2HB ASP 113 7.746 -6.596 -2.852 281 H THR 114 H THR 114 5.637 -8.589 -3.263 282 HA THR 114 HA THR 114 3.313 -7.333 -4.215 283 HB THR 114 HB THR 114 3.307 -8.191 -1.388 284 HG1 THR 114 HG1 THR 114 3.442 -10.428 -2.150 285 1HG2 THR 114 1HG2 THR 114 1.670 -8.835 -3.816 286 2HG2 THR 114 2HG2 THR 114 1.481 -9.683 -2.281 287 3HG2 THR 114 3HG2 THR 114 1.189 -7.946 -2.371 288 H LEU 115 H LEU 115 1.844 -6.016 -2.730 289 HA LEU 115 HA LEU 115 3.396 -3.998 -1.256 290 1HB LEU 115 1HB LEU 115 2.544 -3.420 -3.681 291 2HB LEU 115 2HB LEU 115 1.015 -3.176 -2.859 292 HG LEU 115 HG LEU 115 2.583 -1.684 -1.275 293 1HD1 LEU 115 1HD1 LEU 115 4.504 -2.329 -2.899 294 2HD1 LEU 115 2HD1 LEU 115 3.785 -1.106 -3.947 295 3HD1 LEU 115 3HD1 LEU 115 4.356 -0.662 -2.339 296 1HD2 LEU 115 1HD2 LEU 115 0.499 -1.153 -2.725 297 2HD2 LEU 115 2HD2 LEU 115 1.571 0.161 -2.241 298 3HD2 LEU 115 3HD2 LEU 115 1.675 -0.506 -3.870 299 H CYS 116 H CYS 116 -0.042 -4.526 -2.041 300 HA CYS 116 HA CYS 116 -0.878 -5.515 0.406 301 1HB CYS 116 1HB CYS 116 -1.991 -3.155 1.082 302 2HB CYS 116 2HB CYS 116 -0.456 -3.719 1.734 303 HG CYS 116 HG CYS 116 -0.112 -2.015 -0.760 304 H ILE 117 H ILE 117 -3.169 -5.653 0.599 305 HA ILE 117 HA ILE 117 -4.511 -5.533 -1.947 306 HB ILE 117 HB ILE 117 -5.419 -6.455 0.777 307 1HG1 ILE 117 1HG1 ILE 117 -5.420 -8.290 -1.523 308 2HG1 ILE 117 2HG1 ILE 117 -3.823 -7.698 -1.072 309 1HG2 ILE 117 1HG2 ILE 117 -7.330 -5.528 -0.406 310 2HG2 ILE 117 2HG2 ILE 117 -6.949 -6.511 -1.820 311 3HG2 ILE 117 3HG2 ILE 117 -7.447 -7.285 -0.316 312 1HD1 ILE 117 1HD1 ILE 117 -4.599 -8.379 1.336 313 2HD1 ILE 117 2HD1 ILE 117 -5.705 -9.423 0.444 314 3HD1 ILE 117 3HD1 ILE 117 -3.965 -9.579 0.209 315 H VAL 118 H VAL 118 -6.132 -4.196 -2.575 316 HA VAL 118 HA VAL 118 -6.509 -1.770 -1.007 317 HB VAL 118 HB VAL 118 -7.760 -2.319 -3.688 318 1HG1 VAL 118 1HG1 VAL 118 -7.824 -0.158 -1.922 319 2HG1 VAL 118 2HG1 VAL 118 -6.739 0.333 -3.223 320 3HG1 VAL 118 3HG1 VAL 118 -8.382 -0.188 -3.595 321 1HG2 VAL 118 1HG2 VAL 118 -5.037 -2.490 -3.243 322 2HG2 VAL 118 2HG2 VAL 118 -5.827 -2.187 -4.791 323 3HG2 VAL 118 3HG2 VAL 118 -5.268 -0.835 -3.805 324 H GLU 119 H GLU 119 -8.165 -4.671 -1.845 325 HA GLU 119 HA GLU 119 -10.279 -5.445 -1.494 326 1HB GLU 119 1HB GLU 119 -9.410 -5.428 0.785 327 2HB GLU 119 2HB GLU 119 -9.910 -3.754 0.985 328 1HG GLU 119 1HG GLU 119 -12.206 -5.158 0.198 329 2HG GLU 119 2HG GLU 119 -11.403 -6.162 1.404 330 H ALA 120 H ALA 120 -10.254 -3.202 -3.190 331 HA ALA 120 HA ALA 120 -12.046 -1.167 -2.506 332 1HB ALA 120 1HB ALA 120 -10.589 -1.122 -4.495 333 2HB ALA 120 2HB ALA 120 -11.606 -2.353 -5.245 334 3HB ALA 120 3HB ALA 120 -12.271 -0.760 -4.883 335 H MET 121 H MET 121 -12.891 -3.658 -4.884 336 HA MET 121 HA MET 121 -15.599 -3.711 -3.764 337 1HB MET 121 1HB MET 121 -16.325 -4.561 -5.936 338 2HB MET 121 2HB MET 121 -15.447 -3.051 -6.129 339 1HG MET 121 1HG MET 121 -13.476 -4.240 -6.851 340 2HG MET 121 2HG MET 121 -14.264 -5.788 -6.550 341 1HE MET 121 1HE MET 121 -12.789 -4.489 -9.132 342 2HE MET 121 2HE MET 121 -13.863 -4.149 -10.490 343 3HE MET 121 3HE MET 121 -13.665 -2.960 -9.202 344 H LYS 122 H LYS 122 -13.524 -5.118 -2.495 345 HA LYS 122 HA LYS 122 -13.009 -7.149 -1.632 346 1HB LYS 122 1HB LYS 122 -15.762 -7.096 -1.861 347 2HB LYS 122 2HB LYS 122 -15.331 -8.601 -2.660 348 1HG LYS 122 1HG LYS 122 -15.105 -7.829 0.187 349 2HG LYS 122 2HG LYS 122 -15.548 -9.375 -0.540 350 1HD LYS 122 1HD LYS 122 -13.093 -9.521 -1.266 351 2HD LYS 122 2HD LYS 122 -12.809 -8.215 -0.115 352 1HE LYS 122 1HE LYS 122 -14.397 -10.359 1.023 353 2HE LYS 122 2HE LYS 122 -12.833 -10.925 0.436 354 H MET 123 H MET 123 -12.019 -6.522 -4.174 355 HA MET 123 HA MET 123 -12.006 -9.127 -5.542 356 1HB MET 123 1HB MET 123 -10.924 -7.615 -7.398 357 2HB MET 123 2HB MET 123 -12.665 -7.636 -7.173 358 1HG MET 123 1HG MET 123 -11.882 -5.373 -7.458 359 2HG MET 123 2HG MET 123 -12.512 -5.602 -5.828 360 1HE MET 123 1HE MET 123 -10.985 -3.272 -6.823 361 2HE MET 123 2HE MET 123 -9.437 -3.006 -6.022 362 3HE MET 123 3HE MET 123 -9.493 -3.817 -7.588 363 H MET 124 H MET 124 -10.375 -7.907 -3.196 364 HA MET 124 HA MET 124 -8.193 -7.749 -2.507 365 1HB MET 124 1HB MET 124 -7.642 -10.212 -4.104 366 2HB MET 124 2HB MET 124 -7.192 -9.830 -2.448 367 1HG MET 124 1HG MET 124 -10.069 -10.184 -3.110 368 2HG MET 124 2HG MET 124 -9.039 -11.606 -2.978 369 1HE MET 124 1HE MET 124 -10.869 -8.766 -1.313 370 2HE MET 124 2HE MET 124 -10.356 -8.782 0.374 371 3HE MET 124 3HE MET 124 -9.279 -8.143 -0.867 372 H ASN 125 H ASN 125 -8.200 -5.917 -4.321 373 HA ASN 125 HA ASN 125 -6.414 -6.476 -6.524 374 1HB ASN 125 1HB ASN 125 -8.025 -4.859 -7.070 375 2HB ASN 125 2HB ASN 125 -7.833 -4.013 -5.536 376 1HD2 ASN 125 2HD2 ASN 125 -7.547 -2.052 -6.614 377 2HD2 ASN 125 1HD2 ASN 125 -6.071 -1.664 -7.423 378 H GLN 126 H GLN 126 -4.727 -7.283 -5.017 379 HA GLN 126 HA GLN 126 -3.343 -5.397 -3.366 380 1HB GLN 126 1HB GLN 126 -1.788 -7.182 -2.930 381 2HB GLN 126 2HB GLN 126 -3.422 -7.830 -2.888 382 1HG GLN 126 1HG GLN 126 -2.511 -8.099 -5.536 383 2HG GLN 126 2HG GLN 126 -1.203 -8.640 -4.484 384 1HE2 GLN 126 2HE2 GLN 126 -1.740 -10.253 -2.860 385 2HE2 GLN 126 1HE2 GLN 126 -2.962 -11.423 -3.210 386 H ILE 127 H ILE 127 -1.683 -4.116 -3.842 387 HA ILE 127 HA ILE 127 -0.765 -4.012 -6.602 388 HB ILE 127 HB ILE 127 0.022 -2.171 -4.346 389 1HG1 ILE 127 1HG1 ILE 127 -2.407 -2.166 -4.524 390 2HG1 ILE 127 2HG1 ILE 127 -1.756 -0.662 -5.168 391 1HG2 ILE 127 1HG2 ILE 127 0.170 -2.002 -7.343 392 2HG2 ILE 127 2HG2 ILE 127 0.329 -0.589 -6.299 393 3HG2 ILE 127 3HG2 ILE 127 1.488 -1.911 -6.174 394 1HD1 ILE 127 1HD1 ILE 127 -1.912 -1.808 -7.453 395 2HD1 ILE 127 2HD1 ILE 127 -2.958 -2.971 -6.638 396 3HD1 ILE 127 3HD1 ILE 127 -3.403 -1.265 -6.685 397 H GLU 128 H GLU 128 1.502 -3.876 -7.131 398 HA GLU 128 HA GLU 128 3.204 -5.352 -5.230 399 1HB GLU 128 1HB GLU 128 3.180 -5.444 -8.250 400 2HB GLU 128 2HB GLU 128 4.415 -6.197 -7.252 401 1HG GLU 128 1HG GLU 128 2.883 -7.740 -6.343 402 2HG GLU 128 2HG GLU 128 1.498 -6.849 -6.977 403 H ALA 129 H ALA 129 4.893 -4.262 -4.488 404 HA ALA 129 HA ALA 129 5.554 -1.691 -4.863 405 1HB ALA 129 1HB ALA 129 7.247 -4.059 -4.215 406 2HB ALA 129 2HB ALA 129 8.012 -2.485 -4.441 407 3HB ALA 129 3HB ALA 129 6.779 -2.696 -3.198 408 H ASP 130 H ASP 130 5.795 -0.573 -6.682 409 HA ASP 130 HA ASP 130 7.072 -1.808 -8.998 410 1HB ASP 130 1HB ASP 130 6.318 0.282 -10.173 411 2HB ASP 130 2HB ASP 130 5.010 -0.674 -9.479 412 H LYS 131 H LYS 131 7.739 0.433 -6.480 413 HA LYS 131 HA LYS 131 10.266 1.164 -7.810 414 1HB LYS 131 1HB LYS 131 8.240 2.834 -6.508 415 2HB LYS 131 2HB LYS 131 9.873 3.133 -5.929 416 1HG LYS 131 1HG LYS 131 10.441 4.206 -7.791 417 2HG LYS 131 2HG LYS 131 9.748 2.951 -8.822 418 1HD LYS 131 1HD LYS 131 7.515 3.908 -8.467 419 2HD LYS 131 2HD LYS 131 8.223 5.171 -7.458 420 1HE LYS 131 1HE LYS 131 9.630 5.082 -9.935 421 2HE LYS 131 2HE LYS 131 7.900 5.136 -10.272 422 1HZ LYS 131 1HZ LYS 131 8.409 6.965 -8.237 423 2HZ LYS 131 2HZ LYS 131 9.587 7.219 -9.422 424 3HZ LYS 131 3HZ LYS 131 7.948 7.291 -9.832 425 H SER 132 H SER 132 11.897 0.147 -6.870 426 HA SER 132 HA SER 132 11.870 -1.235 -4.488 427 1HB SER 132 1HB SER 132 13.656 -1.095 -6.425 428 2HB SER 132 2HB SER 132 14.418 0.077 -5.351 429 HG SER 132 HG SER 132 15.043 -1.505 -4.126 430 H GLY 133 H GLY 133 13.819 -0.557 -2.798 431 1HA GLY 133 1HA GLY 133 14.639 1.402 -1.557 432 2HA GLY 133 2HA GLY 133 13.054 2.119 -1.804 433 H THR 134 H THR 134 12.337 2.352 0.242 434 HA THR 134 HA THR 134 11.670 -0.069 1.693 435 HB THR 134 HB THR 134 13.324 2.104 2.991 436 HG1 THR 134 HG1 THR 134 14.845 0.970 2.058 437 1HG2 THR 134 1HG2 THR 134 11.573 0.651 4.331 438 2HG2 THR 134 2HG2 THR 134 12.878 -0.532 4.261 439 3HG2 THR 134 3HG2 THR 134 13.161 1.050 4.989 440 H VAL 135 H VAL 135 9.716 0.113 2.601 441 HA VAL 135 HA VAL 135 8.074 2.323 2.195 442 HB VAL 135 HB VAL 135 7.782 0.169 4.295 443 1HG1 VAL 135 1HG1 VAL 135 6.146 2.488 3.596 444 2HG1 VAL 135 2HG1 VAL 135 5.261 0.963 3.591 445 3HG1 VAL 135 3HG1 VAL 135 6.125 1.477 5.041 446 1HG2 VAL 135 1HG2 VAL 135 7.680 0.018 1.487 447 2HG2 VAL 135 2HG2 VAL 135 7.219 -1.219 2.656 448 3HG2 VAL 135 3HG2 VAL 135 6.014 -0.079 2.059 449 H LYS 136 H LYS 136 8.399 4.294 2.994 450 HA LYS 136 HA LYS 136 9.802 4.797 5.417 451 1HB LYS 136 1HB LYS 136 9.148 6.284 3.200 452 2HB LYS 136 2HB LYS 136 8.100 6.970 4.433 453 1HG LYS 136 1HG LYS 136 10.274 8.129 4.204 454 2HG LYS 136 2HG LYS 136 9.972 7.501 5.825 455 1HD LYS 136 1HD LYS 136 11.270 5.447 4.411 456 2HD LYS 136 2HD LYS 136 12.140 6.934 4.032 457 1HE LYS 136 1HE LYS 136 11.506 5.894 6.791 458 2HE LYS 136 2HE LYS 136 13.081 5.846 6.000 459 1HZ LYS 136 1HZ LYS 136 12.867 8.352 5.865 460 2HZ LYS 136 2HZ LYS 136 11.594 8.212 6.969 461 3HZ LYS 136 3HZ LYS 136 13.146 7.698 7.401 462 H ALA 137 H ALA 137 6.377 4.987 4.492 463 HA ALA 137 HA ALA 137 5.394 4.149 6.960 464 1HB ALA 137 1HB ALA 137 5.835 7.084 6.732 465 2HB ALA 137 2HB ALA 137 4.408 6.500 7.587 466 3HB ALA 137 3HB ALA 137 6.018 6.020 8.125 467 H ILE 138 H ILE 138 2.998 4.861 7.246 468 HA ILE 138 HA ILE 138 1.752 5.048 4.580 469 HB ILE 138 HB ILE 138 0.866 3.373 6.931 470 1HG1 ILE 138 1HG1 ILE 138 1.808 2.659 4.146 471 2HG1 ILE 138 2HG1 ILE 138 2.664 2.350 5.654 472 1HG2 ILE 138 1HG2 ILE 138 -0.763 4.628 5.070 473 2HG2 ILE 138 2HG2 ILE 138 -0.604 2.977 4.472 474 3HG2 ILE 138 3HG2 ILE 138 -1.197 3.270 6.107 475 1HD1 ILE 138 1HD1 ILE 138 0.274 1.108 6.085 476 2HD1 ILE 138 2HD1 ILE 138 0.532 0.845 4.361 477 3HD1 ILE 138 3HD1 ILE 138 1.751 0.325 5.525 478 H LEU 139 H LEU 139 0.095 6.461 4.342 479 HA LEU 139 HA LEU 139 -0.583 8.096 6.686 480 1HB LEU 139 1HB LEU 139 -1.269 8.881 3.886 481 2HB LEU 139 2HB LEU 139 -0.932 9.899 5.273 482 HG LEU 139 HG LEU 139 0.989 8.538 3.427 483 1HD1 LEU 139 1HD1 LEU 139 0.149 11.217 4.019 484 2HD1 LEU 139 2HD1 LEU 139 1.882 11.046 4.294 485 3HD1 LEU 139 3HD1 LEU 139 1.193 10.630 2.724 486 1HD2 LEU 139 1HD2 LEU 139 1.257 8.684 6.292 487 2HD2 LEU 139 2HD2 LEU 139 2.323 7.941 5.101 488 3HD2 LEU 139 3HD2 LEU 139 2.497 9.651 5.494 489 H VAL 140 H VAL 140 -1.932 6.033 4.230 490 HA VAL 140 HA VAL 140 -4.637 6.777 4.461 491 HB VAL 140 HB VAL 140 -3.336 4.194 3.610 492 1HG1 VAL 140 1HG1 VAL 140 -6.143 4.733 4.230 493 2HG1 VAL 140 2HG1 VAL 140 -5.880 4.081 2.613 494 3HG1 VAL 140 3HG1 VAL 140 -5.299 3.197 4.025 495 1HG2 VAL 140 1HG2 VAL 140 -3.022 6.095 2.122 496 2HG2 VAL 140 2HG2 VAL 140 -4.085 4.898 1.382 497 3HG2 VAL 140 3HG2 VAL 140 -4.763 6.368 2.081 498 H GLU 141 H GLU 141 -2.639 4.531 6.294 499 HA GLU 141 HA GLU 141 -2.946 3.603 8.355 500 1HB GLU 141 1HB GLU 141 -5.619 4.976 8.537 501 2HB GLU 141 2HB GLU 141 -4.564 4.468 9.849 502 1HG GLU 141 1HG GLU 141 -3.829 6.613 7.880 503 2HG GLU 141 2HG GLU 141 -4.651 6.934 9.406 504 H SER 142 H SER 142 -3.117 1.542 7.469 505 HA SER 142 HA SER 142 -5.103 0.296 6.160 506 1HB SER 142 1HB SER 142 -3.579 -1.317 6.534 507 2HB SER 142 2HB SER 142 -3.040 -0.566 8.036 508 HG SER 142 HG SER 142 -4.505 -2.735 7.762 509 H GLY 143 H GLY 143 -6.831 -1.216 6.894 510 1HA GLY 143 1HA GLY 143 -8.674 -1.761 8.171 511 2HA GLY 143 2HA GLY 143 -7.970 -0.856 9.502 512 H GLN 144 H GLN 144 -7.883 1.251 7.036 513 HA GLN 144 HA GLN 144 -10.587 2.273 7.602 514 1HB GLN 144 1HB GLN 144 -9.007 3.697 8.707 515 2HB GLN 144 2HB GLN 144 -7.993 3.778 7.273 516 1HG GLN 144 1HG GLN 144 -10.107 4.827 6.175 517 2HG GLN 144 2HG GLN 144 -10.581 5.142 7.843 518 1HE2 GLN 144 2HE2 GLN 144 -8.069 5.692 5.447 519 2HE2 GLN 144 1HE2 GLN 144 -7.464 7.153 6.143 520 HA PRO 145 HA PRO 145 -11.371 2.167 3.268 521 1HB PRO 145 1HB PRO 145 -13.106 4.283 3.083 522 2HB PRO 145 2HB PRO 145 -13.559 2.683 3.675 523 1HG PRO 145 1HG PRO 145 -12.862 5.148 5.219 524 2HG PRO 145 2HG PRO 145 -14.144 3.959 5.523 525 1HD PRO 145 1HD PRO 145 -11.840 3.954 6.915 526 2HD PRO 145 2HD PRO 145 -12.685 2.449 6.497 527 H VAL 146 H VAL 146 -10.143 2.857 1.643 528 HA VAL 146 HA VAL 146 -8.593 5.270 1.882 529 HB VAL 146 HB VAL 146 -7.471 4.610 -0.098 530 1HG1 VAL 146 1HG1 VAL 146 -7.881 2.780 2.041 531 2HG1 VAL 146 2HG1 VAL 146 -7.704 1.863 0.545 532 3HG1 VAL 146 3HG1 VAL 146 -6.449 3.001 1.035 533 1HG2 VAL 146 1HG2 VAL 146 -9.450 4.164 -1.470 534 2HG2 VAL 146 2HG2 VAL 146 -8.268 2.861 -1.595 535 3HG2 VAL 146 3HG2 VAL 146 -9.709 2.651 -0.601 536 H GLU 147 H GLU 147 -8.591 7.016 0.394 537 HA GLU 147 HA GLU 147 -11.076 7.333 -1.150 538 1HB GLU 147 1HB GLU 147 -11.082 8.599 1.036 539 2HB GLU 147 2HB GLU 147 -9.747 9.554 0.405 540 1HG GLU 147 1HG GLU 147 -11.700 9.634 -1.580 541 2HG GLU 147 2HG GLU 147 -12.574 9.812 -0.061 542 H PHE 148 H PHE 148 -10.917 8.422 -3.085 543 HA PHE 148 HA PHE 148 -8.815 8.181 -4.711 544 1HB PHE 148 1HB PHE 148 -11.191 9.400 -4.980 545 2HB PHE 148 2HB PHE 148 -10.142 10.811 -4.959 546 HD1 PHE 148 HD1 PHE 148 -8.304 10.997 -6.654 547 HD2 PHE 148 HD2 PHE 148 -11.358 8.029 -6.885 548 HE1 PHE 148 HE1 PHE 148 -7.776 10.644 -9.036 549 HE2 PHE 148 HE2 PHE 148 -10.835 7.671 -9.267 550 HZ PHE 148 HZ PHE 148 -9.042 8.980 -10.345 551 H ASP 149 H ASP 149 -6.792 8.895 -4.878 552 HA ASP 149 HA ASP 149 -4.893 10.108 -4.565 553 1HB ASP 149 1HB ASP 149 -6.928 12.024 -4.882 554 2HB ASP 149 2HB ASP 149 -5.980 12.561 -3.498 555 H GLU 150 H GLU 150 -4.959 8.462 -2.686 556 HA GLU 150 HA GLU 150 -4.516 9.969 -0.203 557 1HB GLU 150 1HB GLU 150 -6.388 7.766 -0.678 558 2HB GLU 150 2HB GLU 150 -5.320 7.494 0.692 559 1HG GLU 150 1HG GLU 150 -6.542 10.161 0.571 560 2HG GLU 150 2HG GLU 150 -7.665 8.823 0.817 561 HA PRO 151 HA PRO 151 -0.478 8.098 -0.734 562 1HB PRO 151 1HB PRO 151 -0.303 8.927 2.122 563 2HB PRO 151 2HB PRO 151 0.816 9.234 0.789 564 1HG PRO 151 1HG PRO 151 -0.777 11.165 1.695 565 2HG PRO 151 2HG PRO 151 -0.440 10.997 -0.038 566 1HD PRO 151 1HD PRO 151 -2.891 10.261 1.498 567 2HD PRO 151 2HD PRO 151 -2.741 10.909 -0.148 568 H LEU 152 H LEU 152 -1.252 5.937 -0.853 569 HA LEU 152 HA LEU 152 -2.136 4.444 1.369 570 1HB LEU 152 1HB LEU 152 -0.949 3.651 -1.280 571 2HB LEU 152 2HB LEU 152 -1.446 2.462 -0.087 572 HG LEU 152 HG LEU 152 -3.348 4.543 -1.139 573 1HD1 LEU 152 1HD1 LEU 152 -2.489 1.959 -2.357 574 2HD1 LEU 152 2HD1 LEU 152 -4.162 2.492 -2.523 575 3HD1 LEU 152 3HD1 LEU 152 -2.850 3.503 -3.130 576 1HD2 LEU 152 1HD2 LEU 152 -3.546 2.795 0.954 577 2HD2 LEU 152 2HD2 LEU 152 -4.906 3.497 0.078 578 3HD2 LEU 152 3HD2 LEU 152 -4.307 1.897 -0.359 579 H VAL 153 H VAL 153 1.020 4.375 -0.291 580 HA VAL 153 HA VAL 153 2.351 3.986 2.265 581 HB VAL 153 HB VAL 153 2.744 2.000 0.022 582 1HG1 VAL 153 1HG1 VAL 153 4.115 2.530 2.596 583 2HG1 VAL 153 2HG1 VAL 153 3.891 0.847 2.123 584 3HG1 VAL 153 3HG1 VAL 153 4.766 1.952 1.062 585 1HG2 VAL 153 1HG2 VAL 153 0.557 1.799 1.238 586 2HG2 VAL 153 2HG2 VAL 153 1.604 0.384 1.350 587 3HG2 VAL 153 3HG2 VAL 153 1.482 1.499 2.710 588 H VAL 154 H VAL 154 3.976 5.380 2.277 589 HA VAL 154 HA VAL 154 5.116 6.305 -0.243 590 HB VAL 154 HB VAL 154 6.074 8.107 0.956 591 1HG1 VAL 154 1HG1 VAL 154 3.294 7.452 1.285 592 2HG1 VAL 154 2HG1 VAL 154 3.863 8.429 2.639 593 3HG1 VAL 154 3HG1 VAL 154 4.049 9.018 0.987 594 1HG2 VAL 154 1HG2 VAL 154 5.780 6.298 3.283 595 2HG2 VAL 154 2HG2 VAL 154 7.093 7.397 2.857 596 3HG2 VAL 154 3HG2 VAL 154 5.615 8.028 3.583 597 H ILE 155 H ILE 155 6.914 5.472 -1.039 598 HA ILE 155 HA ILE 155 8.609 3.807 0.659 599 HB ILE 155 HB ILE 155 8.962 4.205 -2.300 600 1HG1 ILE 155 1HG1 ILE 155 6.674 3.579 -2.136 601 2HG1 ILE 155 2HG1 ILE 155 7.554 2.103 -2.521 602 1HG2 ILE 155 1HG2 ILE 155 10.677 3.040 -0.817 603 2HG2 ILE 155 2HG2 ILE 155 9.489 1.745 -0.663 604 3HG2 ILE 155 3HG2 ILE 155 10.127 2.171 -2.251 605 1HD1 ILE 155 1HD1 ILE 155 7.011 2.749 0.331 606 2HD1 ILE 155 2HD1 ILE 155 5.705 2.125 -0.677 607 3HD1 ILE 155 3HD1 ILE 155 7.179 1.182 -0.461 608 H GLU 156 H GLU 156 10.811 4.128 0.922 609 HA GLU 156 HA GLU 156 12.276 6.187 -0.361 610 1HB GLU 156 1HB GLU 156 10.781 6.903 2.034 611 2HB GLU 156 2HB GLU 156 12.505 7.197 2.213 612 1HG GLU 156 1HG GLU 156 11.127 8.140 -0.250 613 2HG GLU 156 2HG GLU 156 10.914 9.035 1.254 614 1H10 BTN 222 1H10 BTN 122 -14.049 -8.717 4.841 615 2H10 BTN 222 2H10 BTN 122 -13.157 -7.682 3.726 616 1H9 BTN 222 1H9 BTN 122 -11.357 -9.571 4.889 617 2H9 BTN 222 2H9 BTN 122 -12.269 -8.767 6.169 618 1H8 BTN 222 1H8 BTN 122 -11.403 -6.708 5.690 619 2H8 BTN 222 2H8 BTN 122 -11.162 -7.086 3.984 620 1H7 BTN 222 1H7 BTN 122 -9.556 -8.541 6.020 621 2H7 BTN 222 2H7 BTN 122 -9.134 -6.875 5.649 622 H2 BTN 222 H2 BTN 122 -8.795 -7.433 3.309 623 1H6 BTN 222 1H6 BTN 122 -7.800 -11.192 2.236 624 2H6 BTN 222 2H6 BTN 122 -7.671 -9.570 1.571 625 H5 BTN 222 H5 BTN 122 -5.911 -9.527 3.109 626 HN1 BTN 222 HN2 BTN 122 -6.388 -11.734 4.303 627 HN2 BTN 222 HN1 BTN 122 -7.740 -8.721 6.516 628 H4 BTN 222 H4 BTN 122 -6.730 -7.774 4.364 Start of MODEL 6 1 1H GLU 77 H GLU 77 14.235 17.823 0.997 2 HA GLU 77 HA GLU 77 16.196 16.331 -0.310 3 1HB GLU 77 1HB GLU 77 16.833 15.556 1.982 4 2HB GLU 77 2HB GLU 77 16.668 17.302 1.830 5 1HG GLU 77 1HG GLU 77 14.155 16.511 2.604 6 2HG GLU 77 2HG GLU 77 15.212 15.423 3.503 7 H ILE 78 H ILE 78 16.140 14.373 -1.171 8 HA ILE 78 HA ILE 78 15.222 12.364 -1.839 9 HB ILE 78 HB ILE 78 16.740 11.593 -0.180 10 1HG1 ILE 78 1HG1 ILE 78 15.594 9.591 0.693 11 2HG1 ILE 78 2HG1 ILE 78 14.037 10.324 0.320 12 1HG2 ILE 78 1HG2 ILE 78 14.662 12.501 1.785 13 2HG2 ILE 78 2HG2 ILE 78 15.937 11.367 2.230 14 3HG2 ILE 78 3HG2 ILE 78 16.353 12.985 1.666 15 1HD1 ILE 78 1HD1 ILE 78 15.535 10.399 -2.051 16 2HD1 ILE 78 2HD1 ILE 78 15.764 8.794 -1.358 17 3HD1 ILE 78 3HD1 ILE 78 14.136 9.393 -1.679 18 H SER 79 H SER 79 13.149 12.928 -2.538 19 HA SER 79 HA SER 79 10.971 12.776 -0.592 20 1HB SER 79 1HB SER 79 9.676 13.358 -2.854 21 2HB SER 79 2HB SER 79 10.486 14.600 -1.898 22 HG SER 79 HG SER 79 11.101 14.788 -4.053 23 H GLY 80 H GLY 80 12.659 10.542 -2.038 24 1HA GLY 80 1HA GLY 80 12.243 8.508 -3.083 25 2HA GLY 80 2HA GLY 80 11.075 8.400 -1.775 26 H HIS 81 H HIS 81 9.223 7.644 -2.543 27 HA HIS 81 HA HIS 81 7.911 9.032 -4.720 28 1HB HIS 81 1HB HIS 81 7.508 6.324 -5.380 29 2HB HIS 81 2HB HIS 81 8.381 7.535 -6.313 30 HD1 HIS 81 HD1 HIS 81 11.030 7.742 -5.590 31 HD2 HIS 81 HD2 HIS 81 9.041 4.227 -4.614 32 HE1 HIS 81 HE1 HIS 81 12.836 6.046 -5.158 33 HE2 HIS 81 HE2 HIS 81 11.609 3.952 -4.482 34 H ILE 82 H ILE 82 6.233 9.608 -3.426 35 HA ILE 82 HA ILE 82 4.985 7.813 -1.589 36 HB ILE 82 HB ILE 82 4.018 10.461 -2.672 37 1HG1 ILE 82 1HG1 ILE 82 5.686 9.647 -0.315 38 2HG1 ILE 82 2HG1 ILE 82 5.945 10.961 -1.459 39 1HG2 ILE 82 1HG2 ILE 82 2.540 8.527 -1.354 40 2HG2 ILE 82 2HG2 ILE 82 2.995 9.661 -0.083 41 3HG2 ILE 82 3HG2 ILE 82 2.132 10.235 -1.511 42 1HD1 ILE 82 1HD1 ILE 82 3.540 11.557 -0.180 43 2HD1 ILE 82 2HD1 ILE 82 4.626 10.987 1.087 44 3HD1 ILE 82 3HD1 ILE 82 5.106 12.335 0.054 45 H VAL 83 H VAL 83 3.627 6.232 -2.078 46 HA VAL 83 HA VAL 83 2.360 6.146 -4.691 47 HB VAL 83 HB VAL 83 1.991 4.082 -2.540 48 1HG1 VAL 83 1HG1 VAL 83 1.843 4.137 -5.534 49 2HG1 VAL 83 2HG1 VAL 83 2.044 2.622 -4.654 50 3HG1 VAL 83 3HG1 VAL 83 0.621 3.623 -4.370 51 1HG2 VAL 83 1HG2 VAL 83 4.379 4.446 -4.339 52 2HG2 VAL 83 2HG2 VAL 83 4.354 4.366 -2.577 53 3HG2 VAL 83 3HG2 VAL 83 3.992 2.928 -3.531 54 H ARG 84 H ARG 84 0.685 7.588 -4.706 55 HA ARG 84 HA ARG 84 -1.170 7.805 -2.530 56 1HB ARG 84 1HB ARG 84 -2.339 9.399 -3.912 57 2HB ARG 84 2HB ARG 84 -0.612 9.704 -4.033 58 1HG ARG 84 1HG ARG 84 -1.237 7.912 -6.101 59 2HG ARG 84 2HG ARG 84 -2.502 9.143 -6.103 60 1HD ARG 84 1HD ARG 84 0.193 10.218 -5.750 61 2HD ARG 84 2HD ARG 84 -0.041 9.383 -7.284 62 HE ARG 84 HE ARG 84 -2.158 11.211 -6.707 63 1HH1 ARG 84 1HH1 ARG 84 1.088 10.961 -7.944 64 2HH1 ARG 84 2HH1 ARG 84 0.967 12.393 -8.912 65 1HH2 ARG 84 1HH2 ARG 84 -2.327 13.097 -7.977 66 2HH2 ARG 84 2HH2 ARG 84 -0.974 13.607 -8.930 67 H SER 85 H SER 85 -3.408 7.287 -2.593 68 HA SER 85 HA SER 85 -3.956 4.714 -3.635 69 1HB SER 85 1HB SER 85 -5.651 4.782 -2.166 70 2HB SER 85 2HB SER 85 -5.099 6.397 -1.721 71 HG SER 85 HG SER 85 -6.710 7.254 -2.798 72 HA PRO 86 HA PRO 86 -5.164 5.989 -7.736 73 1HB PRO 86 1HB PRO 86 -5.973 3.547 -8.599 74 2HB PRO 86 2HB PRO 86 -4.270 3.999 -8.459 75 1HG PRO 86 1HG PRO 86 -5.966 2.401 -6.582 76 2HG PRO 86 2HG PRO 86 -4.297 2.109 -7.107 77 1HD PRO 86 1HD PRO 86 -4.905 3.232 -4.715 78 2HD PRO 86 2HD PRO 86 -3.428 3.635 -5.616 79 H MET 87 H MET 87 -7.270 3.674 -6.018 80 HA MET 87 HA MET 87 -9.561 5.397 -6.617 81 1HB MET 87 1HB MET 87 -9.688 3.766 -8.357 82 2HB MET 87 2HB MET 87 -9.362 2.452 -7.235 83 1HG MET 87 1HG MET 87 -11.506 2.798 -6.163 84 2HG MET 87 2HG MET 87 -11.833 4.168 -7.222 85 1HE MET 87 1HE MET 87 -13.031 4.098 -9.209 86 2HE MET 87 2HE MET 87 -11.645 3.584 -10.172 87 3HE MET 87 3HE MET 87 -13.196 2.762 -10.350 88 H VAL 88 H VAL 88 -11.481 4.841 -5.300 89 HA VAL 88 HA VAL 88 -10.787 4.588 -2.573 90 HB VAL 88 HB VAL 88 -13.492 4.431 -3.908 91 1HG1 VAL 88 1HG1 VAL 88 -12.691 3.966 -1.159 92 2HG1 VAL 88 2HG1 VAL 88 -13.855 5.283 -1.302 93 3HG1 VAL 88 3HG1 VAL 88 -14.245 3.688 -1.946 94 1HG2 VAL 88 1HG2 VAL 88 -12.303 6.563 -4.201 95 2HG2 VAL 88 2HG2 VAL 88 -13.737 6.740 -3.191 96 3HG2 VAL 88 3HG2 VAL 88 -12.137 6.700 -2.451 97 H GLY 89 H GLY 89 -11.089 2.931 -1.107 98 1HA GLY 89 1HA GLY 89 -12.368 0.475 -1.719 99 2HA GLY 89 2HA GLY 89 -10.632 0.318 -1.943 100 H THR 90 H THR 90 -9.489 -0.291 -0.233 101 HA THR 90 HA THR 90 -9.970 0.651 2.402 102 HB THR 90 HB THR 90 -10.576 -2.278 1.989 103 HG1 THR 90 HG1 THR 90 -12.684 -1.796 2.017 104 1HG2 THR 90 1HG2 THR 90 -9.781 -1.293 4.259 105 2HG2 THR 90 2HG2 THR 90 -11.427 -0.666 4.343 106 3HG2 THR 90 3HG2 THR 90 -11.151 -2.402 4.203 107 H PHE 91 H PHE 91 -7.887 0.985 2.856 108 HA PHE 91 HA PHE 91 -5.762 -0.620 1.891 109 1HB PHE 91 1HB PHE 91 -5.630 1.812 2.613 110 2HB PHE 91 2HB PHE 91 -5.639 1.229 4.275 111 HD1 PHE 91 HD1 PHE 91 -3.758 1.156 1.093 112 HD2 PHE 91 HD2 PHE 91 -3.686 0.377 5.284 113 HE1 PHE 91 HE1 PHE 91 -1.315 0.836 0.988 114 HE2 PHE 91 HE2 PHE 91 -1.245 0.058 5.188 115 HZ PHE 91 HZ PHE 91 -0.057 0.287 3.037 116 H TYR 92 H TYR 92 -4.094 -1.542 3.515 117 HA TYR 92 HA TYR 92 -5.009 -2.591 5.977 118 1HB TYR 92 1HB TYR 92 -5.484 -4.185 3.546 119 2HB TYR 92 2HB TYR 92 -4.741 -5.056 4.883 120 HD1 TYR 92 HD1 TYR 92 -5.934 -4.568 7.243 121 HD2 TYR 92 HD2 TYR 92 -7.783 -4.198 3.420 122 HE1 TYR 92 HE1 TYR 92 -8.146 -4.838 8.293 123 HE2 TYR 92 HE2 TYR 92 -10.001 -4.468 4.460 124 HH TYR 92 HH TYR 92 -11.069 -4.215 6.617 125 H ARG 93 H ARG 93 -3.443 -4.008 6.998 126 HA ARG 93 HA ARG 93 -0.767 -3.779 5.780 127 1HB ARG 93 1HB ARG 93 -1.035 -4.114 8.721 128 2HB ARG 93 2HB ARG 93 0.155 -3.206 7.796 129 1HG ARG 93 1HG ARG 93 -2.079 -1.773 7.280 130 2HG ARG 93 2HG ARG 93 -2.424 -2.353 8.910 131 1HD ARG 93 1HD ARG 93 -0.109 -0.688 7.965 132 2HD ARG 93 2HD ARG 93 -1.313 -0.294 9.192 133 HE ARG 93 HE ARG 93 1.121 -1.683 9.598 134 1HH1 ARG 93 1HH1 ARG 93 -2.207 -1.615 10.622 135 2HH1 ARG 93 2HH1 ARG 93 -1.875 -2.286 12.184 136 1HH2 ARG 93 1HH2 ARG 93 1.569 -2.566 11.653 137 2HH2 ARG 93 2HH2 ARG 93 0.272 -2.826 12.771 138 H THR 94 H THR 94 -3.125 -5.835 7.213 139 HA THR 94 HA THR 94 -1.432 -8.152 6.667 140 HB THR 94 HB THR 94 -2.417 -9.118 8.891 141 HG1 THR 94 HG1 THR 94 -2.527 -7.389 10.468 142 1HG2 THR 94 1HG2 THR 94 -0.015 -8.704 8.475 143 2HG2 THR 94 2HG2 THR 94 -0.235 -7.060 9.081 144 3HG2 THR 94 3HG2 THR 94 -0.505 -8.440 10.148 145 HA PRO 95 HA PRO 95 -5.559 -8.996 5.008 146 1HB PRO 95 1HB PRO 95 -4.754 -10.657 3.058 147 2HB PRO 95 2HB PRO 95 -4.584 -8.904 2.921 148 1HG PRO 95 1HG PRO 95 -2.529 -10.951 3.665 149 2HG PRO 95 2HG PRO 95 -2.374 -9.554 2.585 150 1HD PRO 95 1HD PRO 95 -1.510 -9.562 5.179 151 2HD PRO 95 2HD PRO 95 -2.026 -8.096 4.323 152 H SER 96 H SER 96 -6.838 -10.409 6.001 153 HA SER 96 HA SER 96 -6.253 -12.404 7.690 154 1HB SER 96 1HB SER 96 -8.556 -11.749 6.045 155 2HB SER 96 2HB SER 96 -8.426 -13.490 6.306 156 HG SER 96 HG SER 96 -9.064 -11.496 8.069 157 HA PRO 97 HA PRO 97 -6.112 -15.649 3.985 158 1HB PRO 97 1HB PRO 97 -5.091 -13.810 1.891 159 2HB PRO 97 2HB PRO 97 -6.260 -15.127 1.759 160 1HG PRO 97 1HG PRO 97 -7.052 -12.582 1.683 161 2HG PRO 97 2HG PRO 97 -8.019 -13.818 2.509 162 1HD PRO 97 1HD PRO 97 -6.217 -11.732 3.668 163 2HD PRO 97 2HD PRO 97 -7.780 -12.329 4.262 164 H ASP 98 H ASP 98 -4.362 -15.627 5.769 165 HA ASP 98 HA ASP 98 -2.212 -16.256 6.227 166 1HB ASP 98 1HB ASP 98 -2.264 -17.073 3.796 167 2HB ASP 98 2HB ASP 98 -1.434 -15.572 3.397 168 H ALA 99 H ALA 99 -3.260 -13.522 6.419 169 HA ALA 99 HA ALA 99 -1.771 -11.431 5.688 170 1HB ALA 99 1HB ALA 99 -3.174 -12.117 8.175 171 2HB ALA 99 2HB ALA 99 -1.975 -10.832 8.320 172 3HB ALA 99 3HB ALA 99 -3.295 -10.681 7.158 173 H LYS 100 H LYS 100 0.369 -11.766 5.233 174 HA LYS 100 HA LYS 100 2.128 -12.625 7.415 175 1HB LYS 100 1HB LYS 100 2.388 -12.555 4.434 176 2HB LYS 100 2HB LYS 100 3.840 -12.536 5.425 177 1HG LYS 100 1HG LYS 100 3.578 -14.682 6.103 178 2HG LYS 100 2HG LYS 100 1.815 -14.601 6.049 179 1HD LYS 100 1HD LYS 100 2.057 -15.861 4.198 180 2HD LYS 100 2HD LYS 100 2.420 -14.318 3.422 181 1HE LYS 100 1HE LYS 100 4.653 -14.759 3.280 182 2HE LYS 100 2HE LYS 100 4.658 -15.759 4.732 183 1HZ LYS 100 1HZ LYS 100 3.173 -17.259 3.130 184 2HZ LYS 100 2HZ LYS 100 4.143 -16.502 1.969 185 3HZ LYS 100 3HZ LYS 100 4.858 -17.394 3.215 186 H ALA 101 H ALA 101 0.881 -9.978 7.293 187 HA ALA 101 HA ALA 101 1.409 -7.798 7.660 188 1HB ALA 101 1HB ALA 101 3.268 -9.274 9.009 189 2HB ALA 101 2HB ALA 101 4.279 -8.204 8.039 190 3HB ALA 101 3HB ALA 101 3.073 -7.526 9.132 191 H PHE 102 H PHE 102 1.019 -7.126 5.535 192 HA PHE 102 HA PHE 102 2.651 -7.314 3.337 193 1HB PHE 102 1HB PHE 102 0.562 -5.416 4.227 194 2HB PHE 102 2HB PHE 102 1.627 -4.838 2.950 195 HD1 PHE 102 HD1 PHE 102 2.022 -6.625 1.009 196 HD2 PHE 102 HD2 PHE 102 -1.364 -6.499 3.600 197 HE1 PHE 102 HE1 PHE 102 0.703 -7.867 -0.661 198 HE2 PHE 102 HE2 PHE 102 -2.689 -7.743 1.935 199 HZ PHE 102 HZ PHE 102 -1.656 -8.427 -0.199 200 H ILE 103 H ILE 103 3.555 -5.042 2.340 201 HA ILE 103 HA ILE 103 5.981 -4.599 3.755 202 HB ILE 103 HB ILE 103 4.992 -2.810 1.553 203 1HG1 ILE 103 1HG1 ILE 103 4.560 -4.867 0.547 204 2HG1 ILE 103 2HG1 ILE 103 6.226 -4.560 0.066 205 1HG2 ILE 103 1HG2 ILE 103 7.724 -3.802 2.357 206 2HG2 ILE 103 2HG2 ILE 103 7.387 -2.760 0.974 207 3HG2 ILE 103 3HG2 ILE 103 7.077 -2.182 2.611 208 1HD1 ILE 103 1HD1 ILE 103 6.845 -5.945 2.144 209 2HD1 ILE 103 2HD1 ILE 103 5.171 -6.497 2.080 210 3HD1 ILE 103 3HD1 ILE 103 6.246 -6.781 0.711 211 H GLU 104 H GLU 104 5.333 -3.812 5.800 212 HA GLU 104 HA GLU 104 3.915 -1.299 5.971 213 1HB GLU 104 1HB GLU 104 4.693 -3.431 7.797 214 2HB GLU 104 2HB GLU 104 4.918 -1.831 8.491 215 1HG GLU 104 1HG GLU 104 2.399 -3.139 7.547 216 2HG GLU 104 2HG GLU 104 2.765 -2.433 9.120 217 H VAL 105 H VAL 105 5.067 0.117 7.918 218 HA VAL 105 HA VAL 105 7.148 1.488 6.629 219 HB VAL 105 HB VAL 105 6.582 1.591 9.590 220 1HG1 VAL 105 1HG1 VAL 105 8.074 3.264 7.657 221 2HG1 VAL 105 2HG1 VAL 105 7.149 4.105 8.901 222 3HG1 VAL 105 3HG1 VAL 105 8.392 2.941 9.361 223 1HG2 VAL 105 1HG2 VAL 105 5.122 2.885 7.299 224 2HG2 VAL 105 2HG2 VAL 105 4.461 1.866 8.579 225 3HG2 VAL 105 3HG2 VAL 105 5.038 3.490 8.954 226 H GLY 106 H GLY 106 9.358 1.574 6.972 227 1HA GLY 106 1HA GLY 106 11.429 0.936 7.812 228 2HA GLY 106 2HA GLY 106 10.610 -0.118 8.954 229 H GLN 107 H GLN 107 9.347 -0.744 5.965 230 HA GLN 107 HA GLN 107 11.009 -3.132 5.701 231 1HB GLN 107 1HB GLN 107 8.381 -3.029 5.718 232 2HB GLN 107 2HB GLN 107 8.586 -2.616 4.021 233 1HG GLN 107 1HG GLN 107 8.330 -4.893 3.931 234 2HG GLN 107 2HG GLN 107 10.085 -4.728 3.948 235 1HE2 GLN 107 2HE2 GLN 107 7.295 -5.818 5.648 236 2HE2 GLN 107 1HE2 GLN 107 8.124 -6.587 6.953 237 H LYS 108 H LYS 108 11.670 -3.840 3.516 238 HA LYS 108 HA LYS 108 11.827 -1.786 1.474 239 1HB LYS 108 1HB LYS 108 14.369 -3.030 2.523 240 2HB LYS 108 2HB LYS 108 14.220 -1.767 1.309 241 1HG LYS 108 1HG LYS 108 14.810 -0.527 3.127 242 2HG LYS 108 2HG LYS 108 13.052 -0.467 3.266 243 1HD LYS 108 1HD LYS 108 13.865 -0.969 5.430 244 2HD LYS 108 2HD LYS 108 13.232 -2.484 4.781 245 1HE LYS 108 1HE LYS 108 15.355 -3.368 4.440 246 2HE LYS 108 2HE LYS 108 16.124 -1.783 4.461 247 1HZ LYS 108 1HZ LYS 108 14.777 -2.584 6.908 248 2HZ LYS 108 2HZ LYS 108 16.175 -3.453 6.518 249 3HZ LYS 108 3HZ LYS 108 16.245 -1.773 6.697 250 H VAL 109 H VAL 109 10.870 -2.991 -0.072 251 HA VAL 109 HA VAL 109 11.989 -5.661 -0.617 252 HB VAL 109 HB VAL 109 9.444 -4.902 -1.913 253 1HG1 VAL 109 1HG1 VAL 109 10.630 -7.347 -0.644 254 2HG1 VAL 109 2HG1 VAL 109 8.925 -7.272 -1.087 255 3HG1 VAL 109 3HG1 VAL 109 10.166 -7.085 -2.326 256 1HG2 VAL 109 1HG2 VAL 109 9.631 -5.395 1.056 257 2HG2 VAL 109 2HG2 VAL 109 9.022 -3.946 0.254 258 3HG2 VAL 109 3HG2 VAL 109 8.137 -5.466 0.122 259 H ASN 110 H ASN 110 12.053 -6.307 -2.908 260 HA ASN 110 HA ASN 110 12.907 -4.046 -4.573 261 1HB ASN 110 1HB ASN 110 13.860 -6.062 -5.972 262 2HB ASN 110 2HB ASN 110 14.701 -5.499 -4.532 263 1HD2 ASN 110 2HD2 ASN 110 12.439 -7.909 -5.735 264 2HD2 ASN 110 1HD2 ASN 110 12.817 -9.117 -4.560 265 H VAL 111 H VAL 111 12.218 -3.835 -6.717 266 HA VAL 111 HA VAL 111 9.602 -4.089 -7.325 267 HB VAL 111 HB VAL 111 11.765 -4.503 -9.391 268 1HG1 VAL 111 1HG1 VAL 111 8.896 -4.119 -9.504 269 2HG1 VAL 111 2HG1 VAL 111 9.763 -2.884 -10.416 270 3HG1 VAL 111 3HG1 VAL 111 10.022 -4.592 -10.776 271 1HG2 VAL 111 1HG2 VAL 111 10.880 -2.061 -7.916 272 2HG2 VAL 111 2HG2 VAL 111 12.507 -2.580 -8.354 273 3HG2 VAL 111 3HG2 VAL 111 11.428 -1.923 -9.585 274 H GLY 112 H GLY 112 8.230 -5.732 -7.480 275 1HA GLY 112 1HA GLY 112 7.796 -7.769 -8.909 276 2HA GLY 112 2HA GLY 112 9.303 -8.377 -8.242 277 H ASP 113 H ASP 113 8.236 -6.837 -5.694 278 HA ASP 113 HA ASP 113 6.835 -9.191 -4.655 279 1HB ASP 113 1HB ASP 113 8.818 -7.413 -3.591 280 2HB ASP 113 2HB ASP 113 7.392 -7.384 -2.559 281 H THR 114 H THR 114 5.034 -8.876 -3.170 282 HA THR 114 HA THR 114 3.065 -7.155 -4.247 283 HB THR 114 HB THR 114 2.611 -8.161 -1.513 284 HG1 THR 114 HG1 THR 114 3.522 -10.006 -1.908 285 1HG2 THR 114 1HG2 THR 114 1.159 -8.163 -4.109 286 2HG2 THR 114 2HG2 THR 114 0.723 -9.339 -2.869 287 3HG2 THR 114 3HG2 THR 114 0.633 -7.613 -2.518 288 H LEU 115 H LEU 115 1.678 -5.888 -2.440 289 HA LEU 115 HA LEU 115 3.483 -4.221 -0.846 290 1HB LEU 115 1HB LEU 115 3.139 -3.114 -3.031 291 2HB LEU 115 2HB LEU 115 1.410 -3.121 -2.744 292 HG LEU 115 HG LEU 115 2.292 -1.847 -0.508 293 1HD1 LEU 115 1HD1 LEU 115 4.127 -1.057 -2.765 294 2HD1 LEU 115 2HD1 LEU 115 3.926 -0.164 -1.257 295 3HD1 LEU 115 3HD1 LEU 115 4.596 -1.795 -1.234 296 1HD2 LEU 115 1HD2 LEU 115 0.478 -1.220 -2.120 297 2HD2 LEU 115 2HD2 LEU 115 1.412 0.136 -1.488 298 3HD2 LEU 115 3HD2 LEU 115 1.717 -0.462 -3.120 299 H CYS 116 H CYS 116 0.040 -4.463 -1.758 300 HA CYS 116 HA CYS 116 -0.883 -5.304 0.737 301 1HB CYS 116 1HB CYS 116 -1.808 -3.270 1.694 302 2HB CYS 116 2HB CYS 116 -0.067 -3.099 1.506 303 HG CYS 116 HG CYS 116 -1.824 -1.840 -0.693 304 H ILE 117 H ILE 117 -3.111 -5.627 0.769 305 HA ILE 117 HA ILE 117 -4.376 -5.533 -1.825 306 HB ILE 117 HB ILE 117 -5.177 -6.703 0.827 307 1HG1 ILE 117 1HG1 ILE 117 -5.268 -8.344 -1.596 308 2HG1 ILE 117 2HG1 ILE 117 -3.673 -7.668 -1.279 309 1HG2 ILE 117 1HG2 ILE 117 -7.190 -5.732 -0.207 310 2HG2 ILE 117 2HG2 ILE 117 -6.873 -6.671 -1.667 311 3HG2 ILE 117 3HG2 ILE 117 -7.246 -7.495 -0.153 312 1HD1 ILE 117 1HD1 ILE 117 -4.887 -8.775 1.106 313 2HD1 ILE 117 2HD1 ILE 117 -4.730 -9.963 -0.186 314 3HD1 ILE 117 3HD1 ILE 117 -3.309 -9.090 0.388 315 H VAL 118 H VAL 118 -5.717 -4.017 -2.528 316 HA VAL 118 HA VAL 118 -6.433 -1.797 -0.849 317 HB VAL 118 HB VAL 118 -7.484 -2.332 -3.623 318 1HG1 VAL 118 1HG1 VAL 118 -8.294 -0.436 -1.999 319 2HG1 VAL 118 2HG1 VAL 118 -6.810 0.356 -2.529 320 3HG1 VAL 118 3HG1 VAL 118 -8.033 -0.107 -3.713 321 1HG2 VAL 118 1HG2 VAL 118 -4.847 -2.356 -3.129 322 2HG2 VAL 118 2HG2 VAL 118 -5.548 -1.704 -4.610 323 3HG2 VAL 118 3HG2 VAL 118 -5.101 -0.618 -3.294 324 H GLU 119 H GLU 119 -7.957 -4.692 -2.018 325 HA GLU 119 HA GLU 119 -10.062 -5.548 -1.809 326 1HB GLU 119 1HB GLU 119 -9.180 -5.720 0.493 327 2HB GLU 119 2HB GLU 119 -9.860 -4.141 0.861 328 1HG GLU 119 1HG GLU 119 -12.097 -5.234 0.110 329 2HG GLU 119 2HG GLU 119 -11.244 -6.744 0.424 330 H ALA 120 H ALA 120 -10.466 -3.659 -3.474 331 HA ALA 120 HA ALA 120 -12.380 -1.715 -2.428 332 1HB ALA 120 1HB ALA 120 -10.461 -1.294 -4.183 333 2HB ALA 120 2HB ALA 120 -11.687 -1.859 -5.318 334 3HB ALA 120 3HB ALA 120 -12.007 -0.454 -4.300 335 H MET 121 H MET 121 -13.877 -3.523 -1.931 336 HA MET 121 HA MET 121 -16.013 -4.267 -2.393 337 1HB MET 121 1HB MET 121 -17.082 -3.720 -4.322 338 2HB MET 121 2HB MET 121 -15.710 -2.639 -4.502 339 1HG MET 121 1HG MET 121 -14.682 -4.764 -5.712 340 2HG MET 121 2HG MET 121 -16.389 -5.115 -5.977 341 1HE MET 121 1HE MET 121 -17.977 -3.093 -6.494 342 2HE MET 121 2HE MET 121 -17.664 -2.041 -7.875 343 3HE MET 121 3HE MET 121 -17.789 -3.785 -8.106 344 H LYS 122 H LYS 122 -13.516 -5.754 -2.211 345 HA LYS 122 HA LYS 122 -12.935 -7.963 -2.212 346 1HB LYS 122 1HB LYS 122 -15.450 -8.318 -2.098 347 2HB LYS 122 2HB LYS 122 -15.409 -8.524 -3.843 348 1HG LYS 122 1HG LYS 122 -15.369 -10.625 -2.418 349 2HG LYS 122 2HG LYS 122 -14.160 -10.495 -3.698 350 1HD LYS 122 1HD LYS 122 -13.195 -11.336 -1.599 351 2HD LYS 122 2HD LYS 122 -12.489 -9.792 -2.081 352 1HE LYS 122 1HE LYS 122 -13.578 -8.623 -0.402 353 2HE LYS 122 2HE LYS 122 -14.820 -9.860 -0.210 354 H MET 123 H MET 123 -11.708 -6.349 -3.966 355 HA MET 123 HA MET 123 -11.646 -7.848 -6.498 356 1HB MET 123 1HB MET 123 -12.091 -5.658 -7.113 357 2HB MET 123 2HB MET 123 -11.120 -4.985 -5.811 358 1HG MET 123 1HG MET 123 -9.085 -5.720 -6.994 359 2HG MET 123 2HG MET 123 -10.094 -6.294 -8.319 360 1HE MET 123 1HE MET 123 -9.948 -3.494 -5.916 361 2HE MET 123 2HE MET 123 -8.755 -2.521 -6.775 362 3HE MET 123 3HE MET 123 -10.461 -2.074 -6.827 363 H MET 124 H MET 124 -10.000 -7.424 -3.622 364 HA MET 124 HA MET 124 -7.866 -7.822 -2.909 365 1HB MET 124 1HB MET 124 -7.688 -9.799 -5.166 366 2HB MET 124 2HB MET 124 -7.002 -9.915 -3.551 367 1HG MET 124 1HG MET 124 -9.964 -9.840 -3.951 368 2HG MET 124 2HG MET 124 -9.060 -11.341 -4.146 369 1HE MET 124 1HE MET 124 -10.528 -8.755 -2.234 370 2HE MET 124 2HE MET 124 -10.972 -9.648 -0.780 371 3HE MET 124 3HE MET 124 -9.572 -8.576 -0.763 372 H ASN 125 H ASN 125 -8.061 -5.670 -4.731 373 HA ASN 125 HA ASN 125 -6.079 -5.800 -6.754 374 1HB ASN 125 1HB ASN 125 -7.765 -4.110 -6.925 375 2HB ASN 125 2HB ASN 125 -7.371 -3.471 -5.330 376 1HD2 ASN 125 2HD2 ASN 125 -7.116 -1.417 -6.303 377 2HD2 ASN 125 1HD2 ASN 125 -5.674 -1.018 -7.167 378 H GLN 126 H GLN 126 -4.610 -6.963 -5.074 379 HA GLN 126 HA GLN 126 -3.199 -5.313 -3.222 380 1HB GLN 126 1HB GLN 126 -1.967 -7.209 -2.675 381 2HB GLN 126 2HB GLN 126 -3.504 -7.881 -3.200 382 1HG GLN 126 1HG GLN 126 -2.297 -7.991 -5.526 383 2HG GLN 126 2HG GLN 126 -0.844 -7.956 -4.527 384 1HE2 GLN 126 2HE2 GLN 126 -2.070 -10.066 -6.229 385 2HE2 GLN 126 1HE2 GLN 126 -2.215 -11.444 -5.197 386 H ILE 127 H ILE 127 -1.849 -3.765 -3.785 387 HA ILE 127 HA ILE 127 -0.666 -3.583 -6.369 388 HB ILE 127 HB ILE 127 0.080 -2.030 -3.890 389 1HG1 ILE 127 1HG1 ILE 127 -2.325 -1.850 -4.331 390 2HG1 ILE 127 2HG1 ILE 127 -1.510 -0.330 -4.685 391 1HG2 ILE 127 1HG2 ILE 127 1.607 -2.008 -5.926 392 2HG2 ILE 127 2HG2 ILE 127 0.310 -1.142 -6.749 393 3HG2 ILE 127 3HG2 ILE 127 1.064 -0.445 -5.315 394 1HD1 ILE 127 1HD1 ILE 127 -1.501 -1.745 -7.086 395 2HD1 ILE 127 2HD1 ILE 127 -3.104 -1.994 -6.395 396 3HD1 ILE 127 3HD1 ILE 127 -2.502 -0.358 -6.660 397 H GLU 128 H GLU 128 1.487 -3.803 -6.976 398 HA GLU 128 HA GLU 128 3.161 -5.336 -5.096 399 1HB GLU 128 1HB GLU 128 3.042 -5.503 -8.112 400 2HB GLU 128 2HB GLU 128 4.196 -6.368 -7.106 401 1HG GLU 128 1HG GLU 128 2.311 -7.512 -5.993 402 2HG GLU 128 2HG GLU 128 1.204 -6.703 -7.104 403 H ALA 129 H ALA 129 4.693 -4.052 -4.307 404 HA ALA 129 HA ALA 129 5.566 -1.630 -5.080 405 1HB ALA 129 1HB ALA 129 7.309 -3.840 -3.997 406 2HB ALA 129 2HB ALA 129 7.723 -2.125 -4.001 407 3HB ALA 129 3HB ALA 129 6.351 -2.699 -3.053 408 H ASP 130 H ASP 130 5.688 -1.244 -7.267 409 HA ASP 130 HA ASP 130 7.517 -2.835 -8.887 410 1HB ASP 130 1HB ASP 130 6.579 -1.722 -10.789 411 2HB ASP 130 2HB ASP 130 5.241 -2.154 -9.726 412 H LYS 131 H LYS 131 7.703 -0.169 -6.913 413 HA LYS 131 HA LYS 131 10.161 0.719 -8.241 414 1HB LYS 131 1HB LYS 131 8.132 2.252 -8.666 415 2HB LYS 131 2HB LYS 131 8.285 2.699 -6.973 416 1HG LYS 131 1HG LYS 131 10.171 3.899 -7.315 417 2HG LYS 131 2HG LYS 131 10.738 2.848 -8.613 418 1HD LYS 131 1HD LYS 131 8.291 4.437 -9.131 419 2HD LYS 131 2HD LYS 131 9.819 5.317 -9.051 420 1HE LYS 131 1HE LYS 131 9.253 2.938 -10.819 421 2HE LYS 131 2HE LYS 131 9.267 4.621 -11.343 422 1HZ LYS 131 1HZ LYS 131 11.672 4.145 -10.030 423 2HZ LYS 131 2HZ LYS 131 11.434 2.846 -11.088 424 3HZ LYS 131 3HZ LYS 131 11.432 4.430 -11.680 425 H SER 132 H SER 132 10.814 -0.850 -6.459 426 HA SER 132 HA SER 132 11.917 -1.175 -4.495 427 1HB SER 132 1HB SER 132 12.858 1.117 -5.126 428 2HB SER 132 2HB SER 132 11.695 1.791 -3.984 429 HG SER 132 HG SER 132 12.672 0.574 -2.348 430 H GLY 133 H GLY 133 11.372 -1.718 -2.417 431 1HA GLY 133 1HA GLY 133 8.674 -0.882 -1.572 432 2HA GLY 133 2HA GLY 133 9.443 -2.400 -1.133 433 H THR 134 H THR 134 11.309 0.514 -1.045 434 HA THR 134 HA THR 134 11.843 0.182 1.742 435 HB THR 134 HB THR 134 12.541 2.578 0.044 436 HG1 THR 134 HG1 THR 134 14.288 1.477 -0.674 437 1HG2 THR 134 1HG2 THR 134 12.982 2.653 2.523 438 2HG2 THR 134 2HG2 THR 134 14.138 1.347 2.265 439 3HG2 THR 134 3HG2 THR 134 14.377 2.906 1.475 440 H VAL 135 H VAL 135 9.352 0.342 2.063 441 HA VAL 135 HA VAL 135 7.944 2.713 1.967 442 HB VAL 135 HB VAL 135 7.759 0.624 4.143 443 1HG1 VAL 135 1HG1 VAL 135 6.020 2.915 3.333 444 2HG1 VAL 135 2HG1 VAL 135 5.298 1.464 4.029 445 3HG1 VAL 135 3HG1 VAL 135 6.495 2.380 4.946 446 1HG2 VAL 135 1HG2 VAL 135 6.344 0.819 1.485 447 2HG2 VAL 135 2HG2 VAL 135 7.547 -0.386 1.947 448 3HG2 VAL 135 3HG2 VAL 135 5.977 -0.352 2.751 449 H LYS 136 H LYS 136 8.115 4.612 2.953 450 HA LYS 136 HA LYS 136 10.008 4.885 5.163 451 1HB LYS 136 1HB LYS 136 9.543 6.423 2.909 452 2HB LYS 136 2HB LYS 136 8.764 7.342 4.191 453 1HG LYS 136 1HG LYS 136 11.573 6.331 4.462 454 2HG LYS 136 2HG LYS 136 11.202 7.863 3.670 455 1HD LYS 136 1HD LYS 136 10.611 8.881 5.614 456 2HD LYS 136 2HD LYS 136 9.970 7.396 6.321 457 1HE LYS 136 1HE LYS 136 12.526 6.707 6.269 458 2HE LYS 136 2HE LYS 136 12.748 8.456 6.303 459 1HZ LYS 136 1HZ LYS 136 10.811 7.571 8.212 460 2HZ LYS 136 2HZ LYS 136 12.318 6.845 8.463 461 3HZ LYS 136 3HZ LYS 136 12.185 8.532 8.438 462 H ALA 137 H ALA 137 6.624 5.050 4.448 463 HA ALA 137 HA ALA 137 5.753 4.834 7.055 464 1HB ALA 137 1HB ALA 137 6.593 7.514 6.435 465 2HB ALA 137 2HB ALA 137 4.872 7.477 6.817 466 3HB ALA 137 3HB ALA 137 6.044 6.838 7.969 467 H ILE 138 H ILE 138 3.413 5.197 7.302 468 HA ILE 138 HA ILE 138 2.021 5.265 4.704 469 HB ILE 138 HB ILE 138 1.559 3.412 7.037 470 1HG1 ILE 138 1HG1 ILE 138 2.359 3.109 4.162 471 2HG1 ILE 138 2HG1 ILE 138 3.095 2.408 5.600 472 1HG2 ILE 138 1HG2 ILE 138 -0.591 4.369 6.297 473 2HG2 ILE 138 2HG2 ILE 138 -0.256 3.802 4.661 474 3HG2 ILE 138 3HG2 ILE 138 -0.469 2.641 5.970 475 1HD1 ILE 138 1HD1 ILE 138 1.107 0.948 5.836 476 2HD1 ILE 138 2HD1 ILE 138 0.508 1.586 4.305 477 3HD1 ILE 138 3HD1 ILE 138 2.019 0.678 4.351 478 H LEU 139 H LEU 139 0.299 6.585 4.564 479 HA LEU 139 HA LEU 139 -0.464 8.066 6.978 480 1HB LEU 139 1HB LEU 139 -0.853 8.630 4.044 481 2HB LEU 139 2HB LEU 139 -1.601 9.587 5.308 482 HG LEU 139 HG LEU 139 0.744 10.029 6.185 483 1HD1 LEU 139 1HD1 LEU 139 1.416 8.774 3.535 484 2HD1 LEU 139 2HD1 LEU 139 2.518 9.833 4.415 485 3HD1 LEU 139 3HD1 LEU 139 1.994 8.311 5.135 486 1HD2 LEU 139 1HD2 LEU 139 -0.668 11.607 4.824 487 2HD2 LEU 139 2HD2 LEU 139 1.073 11.868 4.722 488 3HD2 LEU 139 3HD2 LEU 139 0.225 11.059 3.405 489 H VAL 140 H VAL 140 -1.909 6.408 4.195 490 HA VAL 140 HA VAL 140 -4.558 6.637 4.638 491 HB VAL 140 HB VAL 140 -3.031 4.163 3.842 492 1HG1 VAL 140 1HG1 VAL 140 -5.876 4.472 4.467 493 2HG1 VAL 140 2HG1 VAL 140 -5.554 3.778 2.879 494 3HG1 VAL 140 3HG1 VAL 140 -4.895 3.012 4.324 495 1HG2 VAL 140 1HG2 VAL 140 -4.621 6.208 2.299 496 2HG2 VAL 140 2HG2 VAL 140 -2.873 5.977 2.266 497 3HG2 VAL 140 3HG2 VAL 140 -3.939 4.738 1.604 498 H GLU 141 H GLU 141 -5.949 6.190 6.187 499 HA GLU 141 HA GLU 141 -5.155 5.132 8.683 500 1HB GLU 141 1HB GLU 141 -7.943 5.569 7.590 501 2HB GLU 141 2HB GLU 141 -7.541 5.282 9.277 502 1HG GLU 141 1HG GLU 141 -6.472 7.366 9.486 503 2HG GLU 141 2HG GLU 141 -6.433 7.608 7.741 504 H SER 142 H SER 142 -4.242 3.208 7.387 505 HA SER 142 HA SER 142 -5.414 1.165 6.219 506 1HB SER 142 1HB SER 142 -3.096 1.133 6.969 507 2HB SER 142 2HB SER 142 -3.622 0.892 8.634 508 HG SER 142 HG SER 142 -3.858 -1.156 8.234 509 H GLY 143 H GLY 143 -6.543 -0.787 6.797 510 1HA GLY 143 1HA GLY 143 -7.946 -2.105 8.105 511 2HA GLY 143 2HA GLY 143 -7.744 -0.963 9.429 512 H GLN 144 H GLN 144 -8.410 0.972 6.941 513 HA GLN 144 HA GLN 144 -11.329 0.695 7.184 514 1HB GLN 144 1HB GLN 144 -11.640 2.875 7.807 515 2HB GLN 144 2HB GLN 144 -10.070 2.597 8.546 516 1HG GLN 144 1HG GLN 144 -8.955 3.698 6.725 517 2HG GLN 144 2HG GLN 144 -10.469 3.844 5.836 518 1HE2 GLN 144 1HE2 GLN 144 -10.366 4.299 9.267 519 2HE2 GLN 144 2HE2 GLN 144 -10.598 6.011 9.257 520 HA PRO 145 HA PRO 145 -11.779 1.588 2.885 521 1HB PRO 145 1HB PRO 145 -13.076 4.200 3.210 522 2HB PRO 145 2HB PRO 145 -13.749 2.687 2.603 523 1HG PRO 145 1HG PRO 145 -14.456 3.714 4.993 524 2HG PRO 145 2HG PRO 145 -14.374 1.967 4.699 525 1HD PRO 145 1HD PRO 145 -12.415 3.752 6.093 526 2HD PRO 145 2HD PRO 145 -12.947 2.110 6.518 527 H VAL 146 H VAL 146 -10.978 2.749 1.081 528 HA VAL 146 HA VAL 146 -8.864 4.662 1.775 529 HB VAL 146 HB VAL 146 -9.238 3.173 -0.826 530 1HG1 VAL 146 1HG1 VAL 146 -7.300 5.160 0.174 531 2HG1 VAL 146 2HG1 VAL 146 -6.624 3.788 -0.705 532 3HG1 VAL 146 3HG1 VAL 146 -7.832 4.818 -1.473 533 1HG2 VAL 146 1HG2 VAL 146 -8.816 1.725 1.201 534 2HG2 VAL 146 2HG2 VAL 146 -7.630 1.592 -0.097 535 3HG2 VAL 146 3HG2 VAL 146 -7.254 2.533 1.346 536 H GLU 147 H GLU 147 -8.638 6.624 0.693 537 HA GLU 147 HA GLU 147 -11.046 7.515 -0.753 538 1HB GLU 147 1HB GLU 147 -9.756 8.595 1.529 539 2HB GLU 147 2HB GLU 147 -9.486 9.721 0.203 540 1HG GLU 147 1HG GLU 147 -12.160 9.075 -0.024 541 2HG GLU 147 2HG GLU 147 -11.895 9.167 1.717 542 H PHE 148 H PHE 148 -10.838 8.488 -2.702 543 HA PHE 148 HA PHE 148 -8.797 7.979 -4.406 544 1HB PHE 148 1HB PHE 148 -10.692 8.825 -5.435 545 2HB PHE 148 2HB PHE 148 -10.810 10.179 -4.322 546 HD1 PHE 148 HD1 PHE 148 -8.489 8.842 -6.923 547 HD2 PHE 148 HD2 PHE 148 -10.268 12.269 -5.111 548 HE1 PHE 148 HE1 PHE 148 -7.379 10.290 -8.581 549 HE2 PHE 148 HE2 PHE 148 -9.161 13.723 -6.767 550 HZ PHE 148 HZ PHE 148 -7.715 12.732 -8.504 551 H ASP 149 H ASP 149 -6.746 8.582 -4.632 552 HA ASP 149 HA ASP 149 -4.799 9.749 -4.457 553 1HB ASP 149 1HB ASP 149 -6.776 11.722 -4.808 554 2HB ASP 149 2HB ASP 149 -5.755 12.294 -3.494 555 H GLU 150 H GLU 150 -5.044 8.183 -2.443 556 HA GLU 150 HA GLU 150 -4.486 9.810 -0.052 557 1HB GLU 150 1HB GLU 150 -6.290 7.538 -0.432 558 2HB GLU 150 2HB GLU 150 -5.187 7.326 0.919 559 1HG GLU 150 1HG GLU 150 -6.839 9.804 0.567 560 2HG GLU 150 2HG GLU 150 -7.430 8.379 1.420 561 HA PRO 151 HA PRO 151 -0.375 8.111 -0.582 562 1HB PRO 151 1HB PRO 151 -0.263 8.930 2.283 563 2HB PRO 151 2HB PRO 151 0.870 9.270 0.970 564 1HG PRO 151 1HG PRO 151 -0.803 11.149 1.847 565 2HG PRO 151 2HG PRO 151 -0.422 10.996 0.121 566 1HD PRO 151 1HD PRO 151 -2.890 10.212 1.596 567 2HD PRO 151 2HD PRO 151 -2.708 10.821 -0.061 568 H LEU 152 H LEU 152 -1.189 5.929 -0.715 569 HA LEU 152 HA LEU 152 -1.953 4.383 1.497 570 1HB LEU 152 1HB LEU 152 -0.585 3.411 -1.010 571 2HB LEU 152 2HB LEU 152 -1.561 2.452 0.087 572 HG LEU 152 HG LEU 152 -2.775 4.810 -1.301 573 1HD1 LEU 152 1HD1 LEU 152 -1.847 2.316 -2.542 574 2HD1 LEU 152 2HD1 LEU 152 -3.524 2.746 -2.881 575 3HD1 LEU 152 3HD1 LEU 152 -2.228 3.877 -3.268 576 1HD2 LEU 152 1HD2 LEU 152 -3.699 2.993 0.545 577 2HD2 LEU 152 2HD2 LEU 152 -4.697 3.998 -0.507 578 3HD2 LEU 152 3HD2 LEU 152 -4.296 2.348 -0.985 579 H VAL 153 H VAL 153 1.204 4.656 -0.125 580 HA VAL 153 HA VAL 153 2.562 4.193 2.385 581 HB VAL 153 HB VAL 153 3.458 2.364 0.217 582 1HG1 VAL 153 1HG1 VAL 153 3.839 2.739 3.071 583 2HG1 VAL 153 2HG1 VAL 153 3.486 1.063 2.652 584 3HG1 VAL 153 3HG1 VAL 153 4.846 1.892 1.897 585 1HG2 VAL 153 1HG2 VAL 153 0.974 2.078 0.387 586 2HG2 VAL 153 2HG2 VAL 153 1.912 0.637 0.781 587 3HG2 VAL 153 3HG2 VAL 153 1.207 1.611 2.072 588 H VAL 154 H VAL 154 4.132 5.648 2.423 589 HA VAL 154 HA VAL 154 5.171 6.744 -0.060 590 HB VAL 154 HB VAL 154 6.101 8.497 1.207 591 1HG1 VAL 154 1HG1 VAL 154 3.489 8.119 1.207 592 2HG1 VAL 154 2HG1 VAL 154 3.743 7.990 2.946 593 3HG1 VAL 154 3HG1 VAL 154 4.224 9.456 2.092 594 1HG2 VAL 154 1HG2 VAL 154 5.894 6.605 3.524 595 2HG2 VAL 154 2HG2 VAL 154 7.307 7.468 2.916 596 3HG2 VAL 154 3HG2 VAL 154 6.041 8.343 3.778 597 H ILE 155 H ILE 155 6.879 5.867 -1.011 598 HA ILE 155 HA ILE 155 8.657 4.111 0.444 599 HB ILE 155 HB ILE 155 8.913 4.993 -2.429 600 1HG1 ILE 155 1HG1 ILE 155 7.732 2.357 -1.852 601 2HG1 ILE 155 2HG1 ILE 155 6.714 3.727 -1.419 602 1HG2 ILE 155 1HG2 ILE 155 9.942 2.587 -0.933 603 2HG2 ILE 155 2HG2 ILE 155 10.105 2.848 -2.670 604 3HG2 ILE 155 3HG2 ILE 155 10.897 3.942 -1.535 605 1HD1 ILE 155 1HD1 ILE 155 7.166 4.575 -3.782 606 2HD1 ILE 155 2HD1 ILE 155 7.763 2.950 -4.112 607 3HD1 ILE 155 3HD1 ILE 155 6.094 3.187 -3.597 608 H GLU 156 H GLU 156 10.763 4.479 0.967 609 HA GLU 156 HA GLU 156 11.603 7.180 1.272 610 1HB GLU 156 1HB GLU 156 12.256 5.529 2.909 611 2HB GLU 156 2HB GLU 156 13.065 4.568 1.680 612 1HG GLU 156 1HG GLU 156 14.946 5.645 2.090 613 2HG GLU 156 2HG GLU 156 14.187 7.156 1.588 614 1H10 BTN 222 1H10 BTN 122 -11.705 -12.256 -0.373 615 2H10 BTN 222 2H10 BTN 122 -12.541 -13.528 0.514 616 1H9 BTN 222 1H9 BTN 122 -10.435 -13.655 1.428 617 2H9 BTN 222 2H9 BTN 122 -11.242 -12.572 2.563 618 1H8 BTN 222 1H8 BTN 122 -10.197 -10.968 0.487 619 2H8 BTN 222 2H8 BTN 122 -8.923 -12.091 0.967 620 1H7 BTN 222 1H7 BTN 122 -8.985 -11.370 3.203 621 2H7 BTN 222 2H7 BTN 122 -10.511 -10.529 2.973 622 H2 BTN 222 H2 BTN 122 -9.113 -9.101 1.254 623 1H6 BTN 222 1H6 BTN 122 -5.858 -7.586 3.063 624 2H6 BTN 222 2H6 BTN 122 -6.898 -7.207 1.697 625 H5 BTN 222 H5 BTN 122 -8.233 -6.453 3.463 626 HN1 BTN 222 HN2 BTN 122 -6.872 -7.390 5.410 627 HN2 BTN 222 HN1 BTN 122 -9.973 -9.776 4.703 628 H4 BTN 222 H4 BTN 122 -10.009 -7.850 3.020 Start of MODEL 7 1 1H GLU 77 H GLU 77 17.592 13.561 0.849 2 HA GLU 77 HA GLU 77 17.044 11.151 2.160 3 1HB GLU 77 1HB GLU 77 18.410 12.257 3.955 4 2HB GLU 77 2HB GLU 77 17.167 13.497 4.059 5 1HG GLU 77 1HG GLU 77 17.017 11.710 5.786 6 2HG GLU 77 2HG GLU 77 15.554 11.936 4.827 7 H ILE 78 H ILE 78 15.662 12.045 0.206 8 HA ILE 78 HA ILE 78 13.526 13.821 0.981 9 HB ILE 78 HB ILE 78 12.579 12.994 -1.296 10 1HG1 ILE 78 1HG1 ILE 78 15.411 12.393 -1.977 11 2HG1 ILE 78 2HG1 ILE 78 14.498 11.132 -1.155 12 1HG2 ILE 78 1HG2 ILE 78 15.064 14.658 -0.982 13 2HG2 ILE 78 2HG2 ILE 78 14.155 14.548 -2.489 14 3HG2 ILE 78 3HG2 ILE 78 13.390 15.208 -1.044 15 1HD1 ILE 78 1HD1 ILE 78 13.040 12.321 -3.369 16 2HD1 ILE 78 2HD1 ILE 78 14.564 11.578 -3.857 17 3HD1 ILE 78 3HD1 ILE 78 13.354 10.627 -2.994 18 H SER 79 H SER 79 11.235 12.918 0.125 19 HA SER 79 HA SER 79 10.613 10.761 1.952 20 1HB SER 79 1HB SER 79 9.065 12.808 0.447 21 2HB SER 79 2HB SER 79 8.230 11.307 0.852 22 HG SER 79 HG SER 79 8.746 11.680 3.031 23 H GLY 80 H GLY 80 11.934 10.607 -0.916 24 1HA GLY 80 1HA GLY 80 12.013 9.039 -2.589 25 2HA GLY 80 2HA GLY 80 11.173 7.973 -1.472 26 H HIS 81 H HIS 81 9.503 7.089 -2.488 27 HA HIS 81 HA HIS 81 7.981 8.699 -4.408 28 1HB HIS 81 1HB HIS 81 7.831 5.719 -3.909 29 2HB HIS 81 2HB HIS 81 7.077 6.600 -5.230 30 HD1 HIS 81 HD1 HIS 81 10.689 6.749 -4.028 31 HD2 HIS 81 HD2 HIS 81 8.464 5.770 -7.397 32 HE1 HIS 81 HE1 HIS 81 12.375 6.267 -5.829 33 HE2 HIS 81 HE2 HIS 81 11.007 5.609 -7.840 34 H ILE 82 H ILE 82 5.630 8.550 -4.393 35 HA ILE 82 HA ILE 82 4.495 7.928 -1.755 36 HB ILE 82 HB ILE 82 3.749 10.388 -3.327 37 1HG1 ILE 82 1HG1 ILE 82 5.988 9.891 -1.510 38 2HG1 ILE 82 2HG1 ILE 82 5.714 11.234 -2.613 39 1HG2 ILE 82 1HG2 ILE 82 3.046 9.393 -0.572 40 2HG2 ILE 82 2HG2 ILE 82 2.700 11.025 -1.143 41 3HG2 ILE 82 3HG2 ILE 82 1.961 9.637 -1.941 42 1HD1 ILE 82 1HD1 ILE 82 4.148 12.177 -0.885 43 2HD1 ILE 82 2HD1 ILE 82 4.749 10.933 0.213 44 3HD1 ILE 82 3HD1 ILE 82 5.854 12.140 -0.443 45 H VAL 83 H VAL 83 3.297 6.191 -2.288 46 HA VAL 83 HA VAL 83 1.752 6.139 -4.741 47 HB VAL 83 HB VAL 83 1.587 4.069 -2.569 48 1HG1 VAL 83 1HG1 VAL 83 1.004 4.225 -5.483 49 2HG1 VAL 83 2HG1 VAL 83 1.510 2.678 -4.805 50 3HG1 VAL 83 3HG1 VAL 83 0.072 3.485 -4.182 51 1HG2 VAL 83 1HG2 VAL 83 3.986 4.625 -3.075 52 2HG2 VAL 83 2HG2 VAL 83 3.520 2.955 -3.396 53 3HG2 VAL 83 3HG2 VAL 83 3.685 4.096 -4.730 54 H ARG 84 H ARG 84 -0.149 7.123 -4.832 55 HA ARG 84 HA ARG 84 -1.761 7.363 -2.392 56 1HB ARG 84 1HB ARG 84 -3.072 8.904 -4.175 57 2HB ARG 84 2HB ARG 84 -1.763 9.493 -3.158 58 1HG ARG 84 1HG ARG 84 -1.158 8.331 -5.840 59 2HG ARG 84 2HG ARG 84 -1.750 9.988 -5.703 60 1HD ARG 84 1HD ARG 84 0.516 9.103 -3.977 61 2HD ARG 84 2HD ARG 84 0.823 9.472 -5.674 62 HE ARG 84 HE ARG 84 0.401 11.340 -3.593 63 1HH1 ARG 84 1HH1 ARG 84 -0.325 10.765 -6.948 64 2HH1 ARG 84 2HH1 ARG 84 -0.451 12.446 -7.345 65 1HH2 ARG 84 1HH2 ARG 84 0.239 13.559 -4.102 66 2HH2 ARG 84 2HH2 ARG 84 -0.129 14.036 -5.726 67 H SER 85 H SER 85 -3.937 6.778 -2.352 68 HA SER 85 HA SER 85 -4.740 4.415 -3.327 69 1HB SER 85 1HB SER 85 -6.024 6.584 -2.076 70 2HB SER 85 2HB SER 85 -7.020 6.177 -3.473 71 HG SER 85 HG SER 85 -6.459 3.885 -2.485 72 HA PRO 86 HA PRO 86 -5.100 4.860 -7.717 73 1HB PRO 86 1HB PRO 86 -6.282 2.500 -8.250 74 2HB PRO 86 2HB PRO 86 -4.591 2.610 -7.746 75 1HG PRO 86 1HG PRO 86 -7.009 1.913 -6.126 76 2HG PRO 86 2HG PRO 86 -5.401 1.167 -6.114 77 1HD PRO 86 1HD PRO 86 -6.232 2.992 -4.256 78 2HD PRO 86 2HD PRO 86 -4.534 2.768 -4.718 79 H MET 87 H MET 87 -7.938 3.709 -5.904 80 HA MET 87 HA MET 87 -9.643 5.700 -6.967 81 1HB MET 87 1HB MET 87 -11.056 3.519 -7.957 82 2HB MET 87 2HB MET 87 -10.240 4.755 -8.904 83 1HG MET 87 1HG MET 87 -8.417 3.419 -9.333 84 2HG MET 87 2HG MET 87 -8.700 2.399 -7.923 85 1HE MET 87 1HE MET 87 -9.564 3.434 -11.376 86 2HE MET 87 2HE MET 87 -10.445 2.087 -12.096 87 3HE MET 87 3HE MET 87 -11.297 3.263 -11.095 88 H VAL 88 H VAL 88 -9.518 5.509 -4.503 89 HA VAL 88 HA VAL 88 -10.525 5.051 -2.512 90 HB VAL 88 HB VAL 88 -12.818 4.441 -4.375 91 1HG1 VAL 88 1HG1 VAL 88 -12.801 4.617 -1.365 92 2HG1 VAL 88 2HG1 VAL 88 -14.259 4.645 -2.359 93 3HG1 VAL 88 3HG1 VAL 88 -13.225 3.216 -2.349 94 1HG2 VAL 88 1HG2 VAL 88 -11.623 6.839 -3.608 95 2HG2 VAL 88 2HG2 VAL 88 -13.184 6.635 -4.400 96 3HG2 VAL 88 3HG2 VAL 88 -13.093 6.732 -2.642 97 H GLY 89 H GLY 89 -11.450 3.345 -1.128 98 1HA GLY 89 1HA GLY 89 -12.052 0.790 -1.573 99 2HA GLY 89 2HA GLY 89 -10.322 0.769 -1.882 100 H THR 90 H THR 90 -10.627 -0.845 -0.035 101 HA THR 90 HA THR 90 -10.522 0.568 2.545 102 HB THR 90 HB THR 90 -10.889 -2.401 2.283 103 HG1 THR 90 HG1 THR 90 -12.649 -1.930 1.218 104 1HG2 THR 90 1HG2 THR 90 -11.557 -0.354 4.358 105 2HG2 THR 90 2HG2 THR 90 -12.360 -1.923 4.316 106 3HG2 THR 90 3HG2 THR 90 -10.610 -1.833 4.518 107 H PHE 91 H PHE 91 -8.373 1.104 2.642 108 HA PHE 91 HA PHE 91 -6.241 -0.549 1.858 109 1HB PHE 91 1HB PHE 91 -6.055 1.898 2.213 110 2HB PHE 91 2HB PHE 91 -6.217 1.638 3.948 111 HD1 PHE 91 HD1 PHE 91 -4.131 0.472 1.077 112 HD2 PHE 91 HD2 PHE 91 -4.301 1.517 5.208 113 HE1 PHE 91 HE1 PHE 91 -1.692 0.157 1.253 114 HE2 PHE 91 HE2 PHE 91 -1.863 1.205 5.391 115 HZ PHE 91 HZ PHE 91 -0.556 0.523 3.412 116 H TYR 92 H TYR 92 -4.548 -1.403 3.350 117 HA TYR 92 HA TYR 92 -5.269 -2.145 6.008 118 1HB TYR 92 1HB TYR 92 -5.476 -4.178 3.811 119 2HB TYR 92 2HB TYR 92 -5.160 -4.649 5.476 120 HD1 TYR 92 HD1 TYR 92 -6.866 -3.384 7.197 121 HD2 TYR 92 HD2 TYR 92 -7.664 -4.355 3.124 122 HE1 TYR 92 HE1 TYR 92 -9.285 -3.344 7.667 123 HE2 TYR 92 HE2 TYR 92 -10.084 -4.316 3.582 124 HH TYR 92 HH TYR 92 -11.668 -3.966 5.099 125 H ARG 93 H ARG 93 -3.624 -3.774 6.898 126 HA ARG 93 HA ARG 93 -0.999 -3.128 5.734 127 1HB ARG 93 1HB ARG 93 -1.394 -4.099 8.547 128 2HB ARG 93 2HB ARG 93 -0.063 -3.162 7.879 129 1HG ARG 93 1HG ARG 93 -2.540 -1.723 7.626 130 2HG ARG 93 2HG ARG 93 -2.263 -2.208 9.300 131 1HD ARG 93 1HD ARG 93 -1.285 0.045 8.348 132 2HD ARG 93 2HD ARG 93 -0.375 -0.933 9.499 133 HE ARG 93 HE ARG 93 0.132 -1.482 6.699 134 1HH1 ARG 93 1HH1 ARG 93 1.089 0.242 9.568 135 2HH1 ARG 93 2HH1 ARG 93 2.711 0.508 9.024 136 1HH2 ARG 93 1HH2 ARG 93 2.267 -1.140 5.972 137 2HH2 ARG 93 2HH2 ARG 93 3.382 -0.278 6.979 138 H THR 94 H THR 94 -3.186 -5.652 6.301 139 HA THR 94 HA THR 94 -1.584 -7.587 5.061 140 HB THR 94 HB THR 94 -0.354 -7.400 7.223 141 HG1 THR 94 HG1 THR 94 -0.027 -9.326 6.336 142 1HG2 THR 94 1HG2 THR 94 -2.944 -8.403 8.346 143 2HG2 THR 94 2HG2 THR 94 -1.396 -8.635 9.159 144 3HG2 THR 94 3HG2 THR 94 -1.994 -7.004 8.849 145 HA PRO 95 HA PRO 95 -5.591 -9.408 4.670 146 1HB PRO 95 1HB PRO 95 -4.237 -11.994 4.291 147 2HB PRO 95 2HB PRO 95 -5.242 -11.079 3.166 148 1HG PRO 95 1HG PRO 95 -2.586 -11.301 2.831 149 2HG PRO 95 2HG PRO 95 -3.467 -9.827 2.390 150 1HD PRO 95 1HD PRO 95 -1.791 -10.384 4.808 151 2HD PRO 95 2HD PRO 95 -1.893 -8.912 3.821 152 H SER 96 H SER 96 -6.037 -12.182 5.198 153 HA SER 96 HA SER 96 -5.784 -12.250 8.131 154 1HB SER 96 1HB SER 96 -8.171 -12.443 6.433 155 2HB SER 96 2HB SER 96 -8.048 -13.723 7.642 156 HG SER 96 HG SER 96 -7.512 -11.777 9.076 157 HA PRO 97 HA PRO 97 -5.927 -16.918 6.904 158 1HB PRO 97 1HB PRO 97 -6.158 -17.456 4.217 159 2HB PRO 97 2HB PRO 97 -7.515 -17.429 5.347 160 1HG PRO 97 1HG PRO 97 -6.579 -15.306 3.460 161 2HG PRO 97 2HG PRO 97 -8.234 -15.821 3.838 162 1HD PRO 97 1HD PRO 97 -7.185 -13.592 4.895 163 2HD PRO 97 2HD PRO 97 -8.280 -14.632 5.827 164 H ASP 98 H ASP 98 -3.720 -16.101 7.438 165 HA ASP 98 HA ASP 98 -1.486 -16.602 7.138 166 1HB ASP 98 1HB ASP 98 -2.561 -18.046 5.087 167 2HB ASP 98 2HB ASP 98 -1.571 -16.887 4.205 168 H ALA 99 H ALA 99 -2.470 -14.056 7.248 169 HA ALA 99 HA ALA 99 -1.791 -12.344 5.145 170 1HB ALA 99 1HB ALA 99 -2.936 -12.033 7.600 171 2HB ALA 99 2HB ALA 99 -1.385 -11.222 7.817 172 3HB ALA 99 3HB ALA 99 -2.471 -10.715 6.523 173 H LYS 100 H LYS 100 0.098 -13.152 8.064 174 HA LYS 100 HA LYS 100 2.334 -13.126 8.481 175 1HB LYS 100 1HB LYS 100 2.072 -14.085 5.859 176 2HB LYS 100 2HB LYS 100 3.355 -12.883 5.787 177 1HG LYS 100 1HG LYS 100 3.599 -14.682 8.063 178 2HG LYS 100 2HG LYS 100 3.650 -15.509 6.506 179 1HD LYS 100 1HD LYS 100 5.875 -14.980 6.843 180 2HD LYS 100 2HD LYS 100 5.322 -13.623 5.861 181 1HE LYS 100 1HE LYS 100 6.093 -12.272 7.453 182 2HE LYS 100 2HE LYS 100 4.795 -12.865 8.488 183 1HZ LYS 100 1HZ LYS 100 7.294 -14.399 8.291 184 2HZ LYS 100 2HZ LYS 100 7.251 -13.017 9.265 185 3HZ LYS 100 3HZ LYS 100 6.194 -14.302 9.573 186 H ALA 101 H ALA 101 0.739 -10.634 7.941 187 HA ALA 101 HA ALA 101 1.044 -8.385 7.847 188 1HB ALA 101 1HB ALA 101 2.839 -9.324 9.608 189 2HB ALA 101 2HB ALA 101 3.920 -8.528 8.464 190 3HB ALA 101 3HB ALA 101 2.630 -7.611 9.245 191 H PHE 102 H PHE 102 0.847 -7.651 5.818 192 HA PHE 102 HA PHE 102 2.473 -8.260 3.644 193 1HB PHE 102 1HB PHE 102 0.319 -6.403 4.232 194 2HB PHE 102 2HB PHE 102 1.499 -5.693 3.136 195 HD1 PHE 102 HD1 PHE 102 2.362 -7.911 1.500 196 HD2 PHE 102 HD2 PHE 102 -1.525 -7.004 3.000 197 HE1 PHE 102 HE1 PHE 102 1.352 -9.149 -0.378 198 HE2 PHE 102 HE2 PHE 102 -2.541 -8.240 1.126 199 HZ PHE 102 HZ PHE 102 -1.102 -9.314 -0.566 200 H ILE 103 H ILE 103 3.232 -5.843 2.490 201 HA ILE 103 HA ILE 103 5.789 -5.465 3.670 202 HB ILE 103 HB ILE 103 4.683 -3.518 1.689 203 1HG1 ILE 103 1HG1 ILE 103 3.866 -5.548 0.752 204 2HG1 ILE 103 2HG1 ILE 103 5.359 -5.183 -0.108 205 1HG2 ILE 103 1HG2 ILE 103 7.006 -3.398 2.644 206 2HG2 ILE 103 2HG2 ILE 103 7.354 -4.899 1.786 207 3HG2 ILE 103 3HG2 ILE 103 6.911 -3.450 0.884 208 1HD1 ILE 103 1HD1 ILE 103 6.536 -6.776 1.387 209 2HD1 ILE 103 2HD1 ILE 103 4.972 -7.212 2.076 210 3HD1 ILE 103 3HD1 ILE 103 5.299 -7.518 0.371 211 H GLU 104 H GLU 104 5.362 -4.742 5.795 212 HA GLU 104 HA GLU 104 3.945 -2.268 6.222 213 1HB GLU 104 1HB GLU 104 4.876 -4.455 7.832 214 2HB GLU 104 2HB GLU 104 5.418 -2.935 8.532 215 1HG GLU 104 1HG GLU 104 3.078 -2.125 8.452 216 2HG GLU 104 2HG GLU 104 2.586 -3.720 7.887 217 H VAL 105 H VAL 105 5.111 -0.630 7.748 218 HA VAL 105 HA VAL 105 7.176 0.576 6.259 219 HB VAL 105 HB VAL 105 6.649 1.204 9.150 220 1HG1 VAL 105 1HG1 VAL 105 7.736 2.657 6.779 221 2HG1 VAL 105 2HG1 VAL 105 6.968 3.562 8.084 222 3HG1 VAL 105 3HG1 VAL 105 8.372 2.550 8.420 223 1HG2 VAL 105 1HG2 VAL 105 4.812 1.430 6.870 224 2HG2 VAL 105 2HG2 VAL 105 4.477 1.411 8.601 225 3HG2 VAL 105 3HG2 VAL 105 5.002 2.903 7.821 226 H GLY 106 H GLY 106 9.368 0.912 6.759 227 1HA GLY 106 1HA GLY 106 11.389 0.509 7.867 228 2HA GLY 106 2HA GLY 106 10.556 -0.614 8.932 229 H GLN 107 H GLN 107 9.336 -2.033 6.636 230 HA GLN 107 HA GLN 107 11.719 -3.571 5.868 231 1HB GLN 107 1HB GLN 107 10.298 -5.016 7.039 232 2HB GLN 107 2HB GLN 107 8.850 -4.337 6.308 233 1HG GLN 107 1HG GLN 107 9.603 -5.316 4.130 234 2HG GLN 107 2HG GLN 107 10.875 -6.148 5.023 235 1HE2 GLN 107 2HE2 GLN 107 8.497 -7.108 3.494 236 2HE2 GLN 107 1HE2 GLN 107 7.663 -8.156 4.585 237 H LYS 108 H LYS 108 11.796 -4.488 3.704 238 HA LYS 108 HA LYS 108 10.240 -4.288 1.568 239 1HB LYS 108 1HB LYS 108 10.922 -1.584 2.431 240 2HB LYS 108 2HB LYS 108 11.356 -1.891 0.764 241 1HG LYS 108 1HG LYS 108 8.619 -2.441 1.867 242 2HG LYS 108 2HG LYS 108 9.082 -0.913 1.118 243 1HD LYS 108 1HD LYS 108 9.935 -2.700 -0.744 244 2HD LYS 108 2HD LYS 108 8.504 -3.514 -0.108 245 1HE LYS 108 1HE LYS 108 8.504 -0.639 -0.997 246 2HE LYS 108 2HE LYS 108 8.128 -1.979 -2.080 247 1HZ LYS 108 1HZ LYS 108 6.688 -1.631 0.475 248 2HZ LYS 108 2HZ LYS 108 6.205 -0.803 -0.920 249 3HZ LYS 108 3HZ LYS 108 6.210 -2.494 -0.899 250 H VAL 109 H VAL 109 11.561 -3.575 -0.568 251 HA VAL 109 HA VAL 109 14.401 -4.020 -0.337 252 HB VAL 109 HB VAL 109 12.661 -6.068 -1.718 253 1HG1 VAL 109 1HG1 VAL 109 15.456 -5.324 -2.070 254 2HG1 VAL 109 2HG1 VAL 109 15.235 -7.031 -1.688 255 3HG1 VAL 109 3HG1 VAL 109 14.415 -6.326 -3.081 256 1HG2 VAL 109 1HG2 VAL 109 12.742 -6.312 0.710 257 2HG2 VAL 109 2HG2 VAL 109 13.591 -7.631 -0.099 258 3HG2 VAL 109 3HG2 VAL 109 14.504 -6.322 0.652 259 H ASN 110 H ASN 110 12.635 -5.012 -3.190 260 HA ASN 110 HA ASN 110 12.867 -2.419 -4.447 261 1HB ASN 110 1HB ASN 110 14.940 -4.350 -4.729 262 2HB ASN 110 2HB ASN 110 14.104 -4.215 -6.272 263 1HD2 ASN 110 2HD2 ASN 110 15.570 -2.270 -3.711 264 2HD2 ASN 110 1HD2 ASN 110 16.134 -1.010 -4.750 265 H VAL 111 H VAL 111 12.335 -2.776 -6.940 266 HA VAL 111 HA VAL 111 9.709 -3.393 -7.212 267 HB VAL 111 HB VAL 111 11.778 -3.906 -9.353 268 1HG1 VAL 111 1HG1 VAL 111 8.876 -4.010 -9.303 269 2HG1 VAL 111 2HG1 VAL 111 9.491 -2.893 -10.521 270 3HG1 VAL 111 3HG1 VAL 111 10.008 -4.578 -10.531 271 1HG2 VAL 111 1HG2 VAL 111 10.853 -1.450 -8.094 272 2HG2 VAL 111 2HG2 VAL 111 12.236 -1.728 -9.152 273 3HG2 VAL 111 3HG2 VAL 111 10.639 -1.447 -9.845 274 H GLY 112 H GLY 112 8.453 -5.162 -7.686 275 1HA GLY 112 1HA GLY 112 8.268 -7.456 -8.484 276 2HA GLY 112 2HA GLY 112 9.824 -7.777 -7.733 277 H ASP 113 H ASP 113 8.982 -6.177 -5.332 278 HA ASP 113 HA ASP 113 7.748 -8.379 -3.930 279 1HB ASP 113 1HB ASP 113 9.404 -6.146 -3.241 280 2HB ASP 113 2HB ASP 113 7.969 -6.136 -2.222 281 H THR 114 H THR 114 5.779 -8.351 -2.854 282 HA THR 114 HA THR 114 3.674 -6.970 -4.106 283 HB THR 114 HB THR 114 3.059 -7.871 -1.399 284 HG1 THR 114 HG1 THR 114 4.035 -9.714 -1.405 285 1HG2 THR 114 1HG2 THR 114 2.168 -8.808 -4.113 286 2HG2 THR 114 2HG2 THR 114 1.505 -9.363 -2.576 287 3HG2 THR 114 3HG2 THR 114 1.328 -7.675 -3.055 288 H LEU 115 H LEU 115 2.018 -6.102 -2.057 289 HA LEU 115 HA LEU 115 3.430 -4.029 -0.592 290 1HB LEU 115 1HB LEU 115 2.865 -3.175 -2.932 291 2HB LEU 115 2HB LEU 115 1.185 -3.245 -2.435 292 HG LEU 115 HG LEU 115 2.201 -1.791 -0.402 293 1HD1 LEU 115 1HD1 LEU 115 4.202 -1.738 -2.486 294 2HD1 LEU 115 2HD1 LEU 115 3.578 -0.125 -2.142 295 3HD1 LEU 115 3HD1 LEU 115 4.265 -1.100 -0.843 296 1HD2 LEU 115 1HD2 LEU 115 1.222 -0.842 -3.088 297 2HD2 LEU 115 2HD2 LEU 115 0.265 -1.140 -1.638 298 3HD2 LEU 115 3HD2 LEU 115 1.404 0.205 -1.681 299 H CYS 116 H CYS 116 0.059 -4.513 -1.626 300 HA CYS 116 HA CYS 116 -0.902 -5.691 0.700 301 1HB CYS 116 1HB CYS 116 -2.117 -3.531 1.558 302 2HB CYS 116 2HB CYS 116 -0.472 -3.883 2.075 303 HG CYS 116 HG CYS 116 -1.204 -1.707 -0.022 304 H ILE 117 H ILE 117 -3.298 -5.595 0.861 305 HA ILE 117 HA ILE 117 -4.439 -5.335 -1.823 306 HB ILE 117 HB ILE 117 -5.416 -6.788 0.632 307 1HG1 ILE 117 1HG1 ILE 117 -5.162 -8.248 -1.884 308 2HG1 ILE 117 2HG1 ILE 117 -3.636 -7.546 -1.352 309 1HG2 ILE 117 1HG2 ILE 117 -6.782 -6.306 -2.000 310 2HG2 ILE 117 2HG2 ILE 117 -7.226 -7.625 -0.918 311 3HG2 ILE 117 3HG2 ILE 117 -7.380 -5.953 -0.378 312 1HD1 ILE 117 1HD1 ILE 117 -4.623 -8.666 0.947 313 2HD1 ILE 117 2HD1 ILE 117 -5.122 -9.809 -0.299 314 3HD1 ILE 117 3HD1 ILE 117 -3.419 -9.386 -0.122 315 H VAL 118 H VAL 118 -6.138 -4.023 -2.302 316 HA VAL 118 HA VAL 118 -6.733 -1.915 -0.399 317 HB VAL 118 HB VAL 118 -7.931 -2.181 -3.147 318 1HG1 VAL 118 1HG1 VAL 118 -8.158 -0.292 -1.075 319 2HG1 VAL 118 2HG1 VAL 118 -7.202 0.467 -2.347 320 3HG1 VAL 118 3HG1 VAL 118 -8.799 -0.186 -2.715 321 1HG2 VAL 118 1HG2 VAL 118 -5.202 -2.138 -2.660 322 2HG2 VAL 118 2HG2 VAL 118 -6.007 -1.727 -4.175 323 3HG2 VAL 118 3HG2 VAL 118 -5.605 -0.458 -3.017 324 H GLU 119 H GLU 119 -8.182 -4.799 -1.604 325 HA GLU 119 HA GLU 119 -10.193 -5.806 -1.265 326 1HB GLU 119 1HB GLU 119 -9.430 -5.729 1.054 327 2HB GLU 119 2HB GLU 119 -10.099 -4.114 1.240 328 1HG GLU 119 1HG GLU 119 -12.219 -5.696 0.345 329 2HG GLU 119 2HG GLU 119 -11.370 -6.671 1.544 330 H ALA 120 H ALA 120 -10.296 -3.576 -2.949 331 HA ALA 120 HA ALA 120 -12.696 -2.093 -2.203 332 1HB ALA 120 1HB ALA 120 -10.490 -1.701 -4.093 333 2HB ALA 120 2HB ALA 120 -12.074 -1.234 -4.711 334 3HB ALA 120 3HB ALA 120 -11.462 -0.517 -3.220 335 H MET 121 H MET 121 -14.337 -3.593 -2.350 336 HA MET 121 HA MET 121 -16.137 -4.449 -3.507 337 1HB MET 121 1HB MET 121 -16.388 -4.089 -5.734 338 2HB MET 121 2HB MET 121 -15.019 -3.017 -5.490 339 1HG MET 121 1HG MET 121 -13.674 -5.244 -6.017 340 2HG MET 121 2HG MET 121 -15.167 -5.631 -6.871 341 1HE MET 121 1HE MET 121 -16.064 -4.779 -8.611 342 2HE MET 121 2HE MET 121 -15.821 -3.175 -9.303 343 3HE MET 121 3HE MET 121 -14.933 -4.556 -9.946 344 H LYS 122 H LYS 122 -13.628 -5.770 -2.445 345 HA LYS 122 HA LYS 122 -12.885 -7.889 -2.102 346 1HB LYS 122 1HB LYS 122 -15.597 -8.145 -2.536 347 2HB LYS 122 2HB LYS 122 -14.909 -9.282 -3.687 348 1HG LYS 122 1HG LYS 122 -14.753 -9.282 -0.707 349 2HG LYS 122 2HG LYS 122 -15.218 -10.581 -1.806 350 1HD LYS 122 1HD LYS 122 -12.830 -10.588 -2.620 351 2HD LYS 122 2HD LYS 122 -12.454 -9.508 -1.276 352 1HE LYS 122 1HE LYS 122 -13.956 -11.955 -0.595 353 2HE LYS 122 2HE LYS 122 -12.294 -12.193 -1.133 354 H MET 123 H MET 123 -11.771 -6.493 -4.218 355 HA MET 123 HA MET 123 -11.445 -8.528 -6.316 356 1HB MET 123 1HB MET 123 -10.942 -6.853 -7.832 357 2HB MET 123 2HB MET 123 -12.124 -6.055 -6.805 358 1HG MET 123 1HG MET 123 -10.301 -4.994 -5.555 359 2HG MET 123 2HG MET 123 -9.132 -5.771 -6.623 360 1HE MET 123 1HE MET 123 -9.356 -2.777 -5.882 361 2HE MET 123 2HE MET 123 -9.919 -1.702 -7.161 362 3HE MET 123 3HE MET 123 -11.081 -2.462 -6.074 363 H MET 124 H MET 124 -10.116 -8.027 -3.522 364 HA MET 124 HA MET 124 -8.004 -8.017 -2.608 365 1HB MET 124 1HB MET 124 -7.607 -10.076 -4.783 366 2HB MET 124 2HB MET 124 -6.735 -9.977 -3.258 367 1HG MET 124 1HG MET 124 -9.687 -10.496 -3.528 368 2HG MET 124 2HG MET 124 -8.456 -11.733 -3.283 369 1HE MET 124 1HE MET 124 -10.636 -9.108 -2.077 370 2HE MET 124 2HE MET 124 -10.550 -9.142 -0.315 371 3HE MET 124 3HE MET 124 -9.417 -8.152 -1.235 372 H ASN 125 H ASN 125 -8.000 -5.811 -4.020 373 HA ASN 125 HA ASN 125 -6.177 -5.660 -6.172 374 1HB ASN 125 1HB ASN 125 -7.908 -3.930 -5.562 375 2HB ASN 125 2HB ASN 125 -6.855 -3.439 -4.235 376 1HD2 ASN 125 2HD2 ASN 125 -7.757 -2.660 -7.246 377 2HD2 ASN 125 1HD2 ASN 125 -6.334 -1.851 -7.797 378 H GLN 126 H GLN 126 -4.710 -7.221 -4.791 379 HA GLN 126 HA GLN 126 -3.026 -6.021 -2.835 380 1HB GLN 126 1HB GLN 126 -1.755 -8.058 -2.924 381 2HB GLN 126 2HB GLN 126 -3.463 -8.467 -3.011 382 1HG GLN 126 1HG GLN 126 -3.036 -8.413 -5.589 383 2HG GLN 126 2HG GLN 126 -1.357 -8.651 -5.108 384 1HE2 GLN 126 2HE2 GLN 126 -0.695 -10.642 -4.638 385 2HE2 GLN 126 1HE2 GLN 126 -1.719 -12.023 -4.467 386 H ILE 127 H ILE 127 -1.981 -4.223 -3.533 387 HA ILE 127 HA ILE 127 -0.778 -3.985 -6.099 388 HB ILE 127 HB ILE 127 -0.117 -2.335 -3.665 389 1HG1 ILE 127 1HG1 ILE 127 -2.616 -2.579 -4.200 390 2HG1 ILE 127 2HG1 ILE 127 -1.972 -0.943 -4.092 391 1HG2 ILE 127 1HG2 ILE 127 0.011 -1.773 -6.623 392 2HG2 ILE 127 2HG2 ILE 127 0.315 -0.585 -5.356 393 3HG2 ILE 127 3HG2 ILE 127 1.376 -1.983 -5.526 394 1HD1 ILE 127 1HD1 ILE 127 -1.841 -0.840 -6.528 395 2HD1 ILE 127 2HD1 ILE 127 -2.501 -2.473 -6.628 396 3HD1 ILE 127 3HD1 ILE 127 -3.483 -1.163 -5.971 397 H GLU 128 H GLU 128 1.505 -3.666 -6.516 398 HA GLU 128 HA GLU 128 3.301 -5.018 -4.629 399 1HB GLU 128 1HB GLU 128 3.238 -5.575 -7.600 400 2HB GLU 128 2HB GLU 128 4.321 -6.306 -6.423 401 1HG GLU 128 1HG GLU 128 2.206 -7.171 -5.282 402 2HG GLU 128 2HG GLU 128 1.378 -6.736 -6.779 403 H ALA 129 H ALA 129 4.846 -3.619 -4.135 404 HA ALA 129 HA ALA 129 5.419 -1.199 -5.123 405 1HB ALA 129 1HB ALA 129 6.540 -2.210 -3.176 406 2HB ALA 129 2HB ALA 129 7.552 -3.154 -4.270 407 3HB ALA 129 3HB ALA 129 7.670 -1.394 -4.257 408 H ASP 130 H ASP 130 5.471 -0.664 -7.222 409 HA ASP 130 HA ASP 130 6.992 -2.299 -9.104 410 1HB ASP 130 1HB ASP 130 5.932 -0.963 -10.847 411 2HB ASP 130 2HB ASP 130 4.713 -1.572 -9.728 412 H LYS 131 H LYS 131 7.233 0.618 -7.319 413 HA LYS 131 HA LYS 131 9.633 1.376 -8.853 414 1HB LYS 131 1HB LYS 131 7.458 3.022 -7.652 415 2HB LYS 131 2HB LYS 131 9.090 3.677 -7.632 416 1HG LYS 131 1HG LYS 131 8.345 2.600 -10.227 417 2HG LYS 131 2HG LYS 131 7.279 3.898 -9.684 418 1HD LYS 131 1HD LYS 131 9.529 5.094 -9.092 419 2HD LYS 131 2HD LYS 131 10.210 3.959 -10.259 420 1HE LYS 131 1HE LYS 131 8.824 4.787 -12.001 421 2HE LYS 131 2HE LYS 131 7.843 5.715 -10.867 422 1HZ LYS 131 1HZ LYS 131 9.969 6.968 -10.364 423 2HZ LYS 131 2HZ LYS 131 10.615 6.249 -11.752 424 3HZ LYS 131 3HZ LYS 131 9.261 7.258 -11.872 425 H SER 132 H SER 132 11.309 0.584 -7.728 426 HA SER 132 HA SER 132 12.738 0.128 -6.015 427 1HB SER 132 1HB SER 132 11.620 2.484 -4.519 428 2HB SER 132 2HB SER 132 13.291 1.926 -4.626 429 HG SER 132 HG SER 132 12.880 2.481 -7.019 430 H GLY 133 H GLY 133 12.892 -0.481 -3.679 431 1HA GLY 133 1HA GLY 133 10.243 -1.205 -2.603 432 2HA GLY 133 2HA GLY 133 11.563 -2.365 -2.653 433 H THR 134 H THR 134 10.330 0.526 -1.137 434 HA THR 134 HA THR 134 11.697 -0.104 1.296 435 HB THR 134 HB THR 134 12.369 2.624 0.296 436 HG1 THR 134 HG1 THR 134 14.418 1.491 -0.409 437 1HG2 THR 134 1HG2 THR 134 13.737 0.645 2.095 438 2HG2 THR 134 2HG2 THR 134 14.472 2.155 1.554 439 3HG2 THR 134 3HG2 THR 134 13.009 2.190 2.538 440 H VAL 135 H VAL 135 9.876 0.025 2.512 441 HA VAL 135 HA VAL 135 7.929 2.109 2.073 442 HB VAL 135 HB VAL 135 8.091 0.045 4.276 443 1HG1 VAL 135 1HG1 VAL 135 6.762 2.027 4.886 444 2HG1 VAL 135 2HG1 VAL 135 5.777 1.792 3.442 445 3HG1 VAL 135 3HG1 VAL 135 5.768 0.579 4.721 446 1HG2 VAL 135 1HG2 VAL 135 7.415 -0.191 1.524 447 2HG2 VAL 135 2HG2 VAL 135 7.349 -1.423 2.784 448 3HG2 VAL 135 3HG2 VAL 135 5.945 -0.403 2.475 449 H LYS 136 H LYS 136 8.033 4.085 2.896 450 HA LYS 136 HA LYS 136 9.884 4.631 5.080 451 1HB LYS 136 1HB LYS 136 9.058 6.050 2.788 452 2HB LYS 136 2HB LYS 136 8.458 6.958 4.170 453 1HG LYS 136 1HG LYS 136 11.315 6.107 3.738 454 2HG LYS 136 2HG LYS 136 10.665 7.725 3.463 455 1HD LYS 136 1HD LYS 136 10.516 8.191 5.691 456 2HD LYS 136 2HD LYS 136 10.229 6.507 6.134 457 1HE LYS 136 1HE LYS 136 12.605 6.018 5.636 458 2HE LYS 136 2HE LYS 136 12.861 7.732 5.316 459 1HZ LYS 136 1HZ LYS 136 11.675 6.984 7.885 460 2HZ LYS 136 2HZ LYS 136 13.325 6.683 7.666 461 3HZ LYS 136 3HZ LYS 136 12.726 8.257 7.509 462 H ALA 137 H ALA 137 6.448 5.122 4.295 463 HA ALA 137 HA ALA 137 5.568 4.583 6.910 464 1HB ALA 137 1HB ALA 137 6.711 6.781 7.304 465 2HB ALA 137 2HB ALA 137 5.487 7.523 6.274 466 3HB ALA 137 3HB ALA 137 5.012 6.726 7.774 467 H ILE 138 H ILE 138 3.240 5.139 7.226 468 HA ILE 138 HA ILE 138 1.835 5.255 4.634 469 HB ILE 138 HB ILE 138 1.184 3.637 7.095 470 1HG1 ILE 138 1HG1 ILE 138 1.985 3.030 4.269 471 2HG1 ILE 138 2HG1 ILE 138 2.630 2.377 5.772 472 1HG2 ILE 138 1HG2 ILE 138 -0.840 4.771 6.198 473 2HG2 ILE 138 2HG2 ILE 138 -0.555 3.961 4.656 474 3HG2 ILE 138 3HG2 ILE 138 -0.905 3.011 6.101 475 1HD1 ILE 138 1HD1 ILE 138 -0.126 1.769 4.744 476 2HD1 ILE 138 2HD1 ILE 138 1.292 0.777 4.408 477 3HD1 ILE 138 3HD1 ILE 138 0.731 0.981 6.066 478 H LEU 139 H LEU 139 -0.180 6.341 4.577 479 HA LEU 139 HA LEU 139 -0.694 8.094 6.888 480 1HB LEU 139 1HB LEU 139 -1.292 9.018 4.116 481 2HB LEU 139 2HB LEU 139 -0.949 9.961 5.554 482 HG LEU 139 HG LEU 139 1.097 8.368 4.006 483 1HD1 LEU 139 1HD1 LEU 139 -0.058 10.902 3.461 484 2HD1 LEU 139 2HD1 LEU 139 1.605 11.154 3.988 485 3HD1 LEU 139 3HD1 LEU 139 1.265 10.090 2.625 486 1HD2 LEU 139 1HD2 LEU 139 1.302 8.900 6.580 487 2HD2 LEU 139 2HD2 LEU 139 2.686 9.059 5.496 488 3HD2 LEU 139 3HD2 LEU 139 1.772 10.489 5.977 489 H VAL 140 H VAL 140 -2.022 6.321 4.161 490 HA VAL 140 HA VAL 140 -4.678 7.013 4.253 491 HB VAL 140 HB VAL 140 -3.386 4.351 3.691 492 1HG1 VAL 140 1HG1 VAL 140 -6.309 5.070 3.581 493 2HG1 VAL 140 2HG1 VAL 140 -5.614 3.720 2.684 494 3HG1 VAL 140 3HG1 VAL 140 -5.549 3.734 4.446 495 1HG2 VAL 140 1HG2 VAL 140 -4.645 6.473 1.959 496 2HG2 VAL 140 2HG2 VAL 140 -2.935 6.058 2.061 497 3HG2 VAL 140 3HG2 VAL 140 -4.082 4.909 1.371 498 H GLU 141 H GLU 141 -2.884 5.007 6.495 499 HA GLU 141 HA GLU 141 -3.407 4.223 8.567 500 1HB GLU 141 1HB GLU 141 -5.519 6.258 8.111 501 2HB GLU 141 2HB GLU 141 -5.822 5.079 9.379 502 1HG GLU 141 1HG GLU 141 -3.544 5.694 10.297 503 2HG GLU 141 2HG GLU 141 -3.575 7.056 9.178 504 H SER 142 H SER 142 -3.566 2.095 7.967 505 HA SER 142 HA SER 142 -5.361 0.725 6.535 506 1HB SER 142 1HB SER 142 -4.363 -1.075 7.430 507 2HB SER 142 2HB SER 142 -3.463 0.049 8.450 508 HG SER 142 HG SER 142 -4.415 -1.158 9.935 509 H GLY 143 H GLY 143 -7.273 -0.597 7.097 510 1HA GLY 143 1HA GLY 143 -9.371 -0.879 7.996 511 2HA GLY 143 2HA GLY 143 -8.807 -0.022 9.423 512 H GLN 144 H GLN 144 -8.183 1.875 6.777 513 HA GLN 144 HA GLN 144 -10.699 3.360 7.154 514 1HB GLN 144 1HB GLN 144 -8.572 4.460 7.950 515 2HB GLN 144 2HB GLN 144 -8.048 4.507 6.272 516 1HG GLN 144 1HG GLN 144 -10.356 5.708 5.923 517 2HG GLN 144 2HG GLN 144 -10.179 6.061 7.642 518 1HE2 GLN 144 2HE2 GLN 144 -8.202 6.094 4.692 519 2HE2 GLN 144 1HE2 GLN 144 -7.446 7.615 5.012 520 HA PRO 145 HA PRO 145 -11.412 2.609 2.843 521 1HB PRO 145 1HB PRO 145 -13.580 4.170 2.537 522 2HB PRO 145 2HB PRO 145 -13.637 2.662 3.458 523 1HG PRO 145 1HG PRO 145 -13.422 5.477 4.448 524 2HG PRO 145 2HG PRO 145 -14.412 4.146 5.070 525 1HD PRO 145 1HD PRO 145 -12.029 4.904 6.175 526 2HD PRO 145 2HD PRO 145 -12.676 3.256 6.273 527 H VAL 146 H VAL 146 -9.565 3.586 1.927 528 HA VAL 146 HA VAL 146 -8.864 6.210 1.747 529 HB VAL 146 HB VAL 146 -7.949 5.667 -0.558 530 1HG1 VAL 146 1HG1 VAL 146 -6.893 5.232 1.793 531 2HG1 VAL 146 2HG1 VAL 146 -7.128 3.537 1.363 532 3HG1 VAL 146 3HG1 VAL 146 -6.135 4.576 0.342 533 1HG2 VAL 146 1HG2 VAL 146 -9.787 3.511 -0.288 534 2HG2 VAL 146 2HG2 VAL 146 -8.755 3.916 -1.659 535 3HG2 VAL 146 3HG2 VAL 146 -8.156 2.849 -0.389 536 H GLU 147 H GLU 147 -9.256 7.920 0.307 537 HA GLU 147 HA GLU 147 -11.797 7.717 -1.173 538 1HB GLU 147 1HB GLU 147 -10.821 10.352 -0.165 539 2HB GLU 147 2HB GLU 147 -12.469 9.798 -0.442 540 1HG GLU 147 1HG GLU 147 -12.450 8.506 1.559 541 2HG GLU 147 2HG GLU 147 -10.724 8.786 1.788 542 H PHE 148 H PHE 148 -9.489 7.029 -2.455 543 HA PHE 148 HA PHE 148 -8.314 7.422 -4.360 544 1HB PHE 148 1HB PHE 148 -10.320 8.009 -5.457 545 2HB PHE 148 2HB PHE 148 -10.425 9.539 -4.601 546 HD1 PHE 148 HD1 PHE 148 -8.541 7.701 -7.196 547 HD2 PHE 148 HD2 PHE 148 -9.427 11.492 -5.457 548 HE1 PHE 148 HE1 PHE 148 -7.407 8.823 -9.075 549 HE2 PHE 148 HE2 PHE 148 -8.295 12.622 -7.334 550 HZ PHE 148 HZ PHE 148 -7.282 11.286 -9.145 551 H ASP 149 H ASP 149 -6.450 8.466 -4.940 552 HA ASP 149 HA ASP 149 -4.637 9.820 -4.718 553 1HB ASP 149 1HB ASP 149 -6.726 11.485 -5.225 554 2HB ASP 149 2HB ASP 149 -6.157 12.135 -3.690 555 H GLU 150 H GLU 150 -5.159 8.174 -2.562 556 HA GLU 150 HA GLU 150 -4.399 9.859 -0.264 557 1HB GLU 150 1HB GLU 150 -6.573 8.201 -0.418 558 2HB GLU 150 2HB GLU 150 -5.374 7.145 0.318 559 1HG GLU 150 1HG GLU 150 -5.778 8.079 2.275 560 2HG GLU 150 2HG GLU 150 -5.214 9.627 1.646 561 HA PRO 151 HA PRO 151 -0.442 7.843 -0.788 562 1HB PRO 151 1HB PRO 151 0.499 8.647 1.702 563 2HB PRO 151 2HB PRO 151 0.638 9.578 0.208 564 1HG PRO 151 1HG PRO 151 -1.352 9.823 2.420 565 2HG PRO 151 2HG PRO 151 -0.581 11.095 1.454 566 1HD PRO 151 1HD PRO 151 -3.110 10.332 1.000 567 2HD PRO 151 2HD PRO 151 -2.027 10.788 -0.333 568 H LEU 152 H LEU 152 -1.194 5.699 -0.675 569 HA LEU 152 HA LEU 152 -1.969 4.458 1.764 570 1HB LEU 152 1HB LEU 152 -0.862 2.863 -0.497 571 2HB LEU 152 2HB LEU 152 -2.236 2.524 0.543 572 HG LEU 152 HG LEU 152 -2.949 4.825 -0.890 573 1HD1 LEU 152 1HD1 LEU 152 -1.113 4.388 -2.437 574 2HD1 LEU 152 2HD1 LEU 152 -1.723 2.754 -2.705 575 3HD1 LEU 152 3HD1 LEU 152 -2.678 4.146 -3.215 576 1HD2 LEU 152 1HD2 LEU 152 -4.170 2.619 -0.126 577 2HD2 LEU 152 2HD2 LEU 152 -4.773 3.578 -1.478 578 3HD2 LEU 152 3HD2 LEU 152 -3.821 2.125 -1.783 579 H VAL 153 H VAL 153 1.073 4.663 -0.025 580 HA VAL 153 HA VAL 153 2.562 4.094 2.368 581 HB VAL 153 HB VAL 153 2.776 2.148 0.066 582 1HG1 VAL 153 1HG1 VAL 153 4.425 2.683 2.467 583 2HG1 VAL 153 2HG1 VAL 153 4.151 0.994 2.039 584 3HG1 VAL 153 3HG1 VAL 153 4.897 2.089 0.874 585 1HG2 VAL 153 1HG2 VAL 153 1.608 1.843 2.828 586 2HG2 VAL 153 2HG2 VAL 153 0.770 1.683 1.285 587 3HG2 VAL 153 3HG2 VAL 153 1.982 0.491 1.759 588 H VAL 154 H VAL 154 4.052 5.635 2.273 589 HA VAL 154 HA VAL 154 5.056 6.582 -0.280 590 HB VAL 154 HB VAL 154 6.117 8.350 0.927 591 1HG1 VAL 154 1HG1 VAL 154 3.477 8.100 0.805 592 2HG1 VAL 154 2HG1 VAL 154 3.651 8.112 2.560 593 3HG1 VAL 154 3HG1 VAL 154 4.253 9.467 1.604 594 1HG2 VAL 154 1HG2 VAL 154 5.600 6.654 3.356 595 2HG2 VAL 154 2HG2 VAL 154 7.139 7.267 2.751 596 3HG2 VAL 154 3HG2 VAL 154 5.969 8.376 3.466 597 H ILE 155 H ILE 155 6.757 5.690 -1.224 598 HA ILE 155 HA ILE 155 8.456 3.827 0.108 599 HB ILE 155 HB ILE 155 8.960 5.097 -2.578 600 1HG1 ILE 155 1HG1 ILE 155 7.438 2.537 -2.115 601 2HG1 ILE 155 2HG1 ILE 155 6.623 4.092 -2.243 602 1HG2 ILE 155 1HG2 ILE 155 10.818 3.818 -1.654 603 2HG2 ILE 155 2HG2 ILE 155 9.760 2.425 -1.436 604 3HG2 ILE 155 3HG2 ILE 155 10.127 3.008 -3.060 605 1HD1 ILE 155 1HD1 ILE 155 8.308 3.990 -4.451 606 2HD1 ILE 155 2HD1 ILE 155 7.629 2.368 -4.314 607 3HD1 ILE 155 3HD1 ILE 155 6.559 3.766 -4.431 608 H GLU 156 H GLU 156 10.560 4.027 0.774 609 HA GLU 156 HA GLU 156 11.432 6.612 1.576 610 1HB GLU 156 1HB GLU 156 11.911 4.441 2.775 611 2HB GLU 156 2HB GLU 156 13.083 4.084 1.513 612 1HG GLU 156 1HG GLU 156 14.384 6.022 2.111 613 2HG GLU 156 2HG GLU 156 13.174 6.505 3.298 614 1H10 BTN 222 1H10 BTN 122 -12.763 -13.741 0.731 615 2H10 BTN 222 2H10 BTN 122 -12.901 -13.823 2.486 616 1H9 BTN 222 1H9 BTN 122 -10.410 -13.358 0.863 617 2H9 BTN 222 2H9 BTN 122 -10.785 -14.739 1.895 618 1H8 BTN 222 1H8 BTN 122 -10.256 -13.636 3.801 619 2H8 BTN 222 2H8 BTN 122 -10.843 -12.086 3.193 620 1H7 BTN 222 1H7 BTN 122 -8.395 -13.290 1.999 621 2H7 BTN 222 2H7 BTN 122 -8.283 -12.514 3.573 622 H2 BTN 222 H2 BTN 122 -9.353 -11.175 1.081 623 1H6 BTN 222 1H6 BTN 122 -8.007 -8.575 0.611 624 2H6 BTN 222 2H6 BTN 122 -6.648 -8.249 1.678 625 H5 BTN 222 H5 BTN 122 -9.149 -7.934 2.549 626 HN1 BTN 222 HN2 BTN 122 -7.165 -7.855 4.154 627 HN2 BTN 222 HN1 BTN 122 -9.157 -11.253 4.692 628 H4 BTN 222 H4 BTN 122 -10.291 -9.920 2.826 Start of MODEL 8 1 1H GLU 77 H GLU 77 20.293 15.086 0.195 2 HA GLU 77 HA GLU 77 18.708 14.985 -1.476 3 1HB GLU 77 1HB GLU 77 20.936 14.909 -2.597 4 2HB GLU 77 2HB GLU 77 20.816 13.153 -2.636 5 1HG GLU 77 1HG GLU 77 18.477 13.852 -3.804 6 2HG GLU 77 2HG GLU 77 19.520 15.178 -4.316 7 H ILE 78 H ILE 78 16.922 13.936 -0.678 8 HA ILE 78 HA ILE 78 16.518 11.228 -1.663 9 HB ILE 78 HB ILE 78 17.384 10.942 0.643 10 1HG1 ILE 78 1HG1 ILE 78 15.484 9.539 -0.547 11 2HG1 ILE 78 2HG1 ILE 78 15.938 9.214 1.123 12 1HG2 ILE 78 1HG2 ILE 78 16.446 13.079 1.513 13 2HG2 ILE 78 2HG2 ILE 78 14.855 12.319 1.525 14 3HG2 ILE 78 3HG2 ILE 78 16.144 11.683 2.549 15 1HD1 ILE 78 1HD1 ILE 78 13.647 10.992 0.332 16 2HD1 ILE 78 2HD1 ILE 78 13.488 9.273 0.692 17 3HD1 ILE 78 3HD1 ILE 78 14.038 10.389 1.943 18 H SER 79 H SER 79 14.595 11.129 -2.611 19 HA SER 79 HA SER 79 12.437 12.864 -1.614 20 1HB SER 79 1HB SER 79 12.572 13.983 -3.560 21 2HB SER 79 2HB SER 79 13.639 12.772 -4.270 22 HG SER 79 HG SER 79 11.957 11.746 -5.101 23 H GLY 80 H GLY 80 13.396 9.792 -1.861 24 1HA GLY 80 1HA GLY 80 12.349 7.748 -2.226 25 2HA GLY 80 2HA GLY 80 11.183 8.483 -1.138 26 H HIS 81 H HIS 81 9.536 7.236 -2.147 27 HA HIS 81 HA HIS 81 8.399 8.577 -4.453 28 1HB HIS 81 1HB HIS 81 8.110 5.775 -4.963 29 2HB HIS 81 2HB HIS 81 8.838 7.009 -5.984 30 HD1 HIS 81 HD1 HIS 81 11.467 7.494 -5.410 31 HD2 HIS 81 HD2 HIS 81 9.861 3.908 -4.057 32 HE1 HIS 81 HE1 HIS 81 13.441 6.015 -4.917 33 HE2 HIS 81 HE2 HIS 81 12.447 3.885 -4.013 34 H ILE 82 H ILE 82 6.541 9.150 -3.488 35 HA ILE 82 HA ILE 82 5.171 7.412 -1.649 36 HB ILE 82 HB ILE 82 4.273 10.027 -2.864 37 1HG1 ILE 82 1HG1 ILE 82 5.838 9.312 -0.407 38 2HG1 ILE 82 2HG1 ILE 82 6.137 10.589 -1.582 39 1HG2 ILE 82 1HG2 ILE 82 2.560 8.333 -1.872 40 2HG2 ILE 82 2HG2 ILE 82 3.202 8.881 -0.324 41 3HG2 ILE 82 3HG2 ILE 82 2.467 10.039 -1.431 42 1HD1 ILE 82 1HD1 ILE 82 3.677 11.216 -0.444 43 2HD1 ILE 82 2HD1 ILE 82 4.688 10.678 0.896 44 3HD1 ILE 82 3HD1 ILE 82 5.228 11.997 -0.141 45 H VAL 83 H VAL 83 3.282 6.299 -1.954 46 HA VAL 83 HA VAL 83 2.308 6.120 -4.731 47 HB VAL 83 HB VAL 83 2.182 3.873 -2.725 48 1HG1 VAL 83 1HG1 VAL 83 1.114 4.298 -5.335 49 2HG1 VAL 83 2HG1 VAL 83 2.294 2.990 -5.406 50 3HG1 VAL 83 3HG1 VAL 83 0.939 2.895 -4.281 51 1HG2 VAL 83 1HG2 VAL 83 4.528 4.436 -3.100 52 2HG2 VAL 83 2HG2 VAL 83 4.122 2.892 -3.850 53 3HG2 VAL 83 3HG2 VAL 83 4.280 4.341 -4.843 54 H ARG 84 H ARG 84 0.441 7.209 -4.791 55 HA ARG 84 HA ARG 84 -1.390 7.095 -2.521 56 1HB ARG 84 1HB ARG 84 -2.691 8.767 -3.980 57 2HB ARG 84 2HB ARG 84 -1.164 9.296 -3.285 58 1HG ARG 84 1HG ARG 84 -0.885 8.085 -5.925 59 2HG ARG 84 2HG ARG 84 -1.888 9.538 -5.905 60 1HD ARG 84 1HD ARG 84 0.647 9.646 -4.385 61 2HD ARG 84 2HD ARG 84 0.780 9.598 -6.142 62 HE ARG 84 HE ARG 84 -0.287 11.756 -4.527 63 1HH1 ARG 84 1HH1 ARG 84 0.043 10.356 -7.699 64 2HH1 ARG 84 2HH1 ARG 84 -0.276 11.841 -8.530 65 1HH2 ARG 84 1HH2 ARG 84 -0.709 13.717 -5.611 66 2HH2 ARG 84 2HH2 ARG 84 -0.703 13.753 -7.343 67 H SER 85 H SER 85 -3.613 6.544 -2.771 68 HA SER 85 HA SER 85 -4.009 4.341 -4.605 69 1HB SER 85 1HB SER 85 -4.791 4.632 -2.075 70 2HB SER 85 2HB SER 85 -6.213 5.327 -2.854 71 HG SER 85 HG SER 85 -6.458 3.088 -2.567 72 HA PRO 86 HA PRO 86 -5.805 7.243 -7.565 73 1HB PRO 86 1HB PRO 86 -6.108 5.354 -9.522 74 2HB PRO 86 2HB PRO 86 -4.600 6.223 -9.221 75 1HG PRO 86 1HG PRO 86 -5.416 3.483 -8.337 76 2HG PRO 86 2HG PRO 86 -3.854 4.039 -8.965 77 1HD PRO 86 1HD PRO 86 -4.276 3.654 -6.334 78 2HD PRO 86 2HD PRO 86 -3.219 4.948 -6.935 79 H MET 87 H MET 87 -7.067 4.288 -6.275 80 HA MET 87 HA MET 87 -9.777 5.134 -7.059 81 1HB MET 87 1HB MET 87 -8.557 2.814 -7.875 82 2HB MET 87 2HB MET 87 -9.452 2.281 -6.459 83 1HG MET 87 1HG MET 87 -11.348 2.277 -7.591 84 2HG MET 87 2HG MET 87 -11.115 3.956 -8.075 85 1HE MET 87 1HE MET 87 -12.653 3.097 -9.740 86 2HE MET 87 2HE MET 87 -11.829 3.627 -11.206 87 3HE MET 87 3HE MET 87 -12.312 1.940 -11.026 88 H VAL 88 H VAL 88 -11.481 4.172 -5.582 89 HA VAL 88 HA VAL 88 -10.631 4.635 -2.828 90 HB VAL 88 HB VAL 88 -13.360 4.502 -4.104 91 1HG1 VAL 88 1HG1 VAL 88 -12.657 4.812 -1.188 92 2HG1 VAL 88 2HG1 VAL 88 -14.255 5.099 -1.875 93 3HG1 VAL 88 3HG1 VAL 88 -13.552 3.483 -1.926 94 1HG2 VAL 88 1HG2 VAL 88 -11.701 6.556 -4.161 95 2HG2 VAL 88 2HG2 VAL 88 -13.432 6.781 -3.917 96 3HG2 VAL 88 3HG2 VAL 88 -12.336 6.813 -2.537 97 H GLY 89 H GLY 89 -11.567 3.275 -1.104 98 1HA GLY 89 1HA GLY 89 -12.785 0.879 -1.219 99 2HA GLY 89 2HA GLY 89 -11.154 0.481 -1.741 100 H THR 90 H THR 90 -10.896 -0.858 0.100 101 HA THR 90 HA THR 90 -10.530 0.645 2.609 102 HB THR 90 HB THR 90 -10.933 -2.324 2.563 103 HG1 THR 90 HG1 THR 90 -12.822 -1.972 1.716 104 1HG2 THR 90 1HG2 THR 90 -11.436 -0.142 4.552 105 2HG2 THR 90 2HG2 THR 90 -12.158 -1.743 4.706 106 3HG2 THR 90 3HG2 THR 90 -10.405 -1.564 4.707 107 H PHE 91 H PHE 91 -8.483 0.867 3.204 108 HA PHE 91 HA PHE 91 -6.438 -0.807 1.989 109 1HB PHE 91 1HB PHE 91 -6.099 1.624 2.053 110 2HB PHE 91 2HB PHE 91 -6.182 1.593 3.814 111 HD1 PHE 91 HD1 PHE 91 -4.232 0.307 0.926 112 HD2 PHE 91 HD2 PHE 91 -4.266 1.226 5.089 113 HE1 PHE 91 HE1 PHE 91 -1.801 -0.091 1.030 114 HE2 PHE 91 HE2 PHE 91 -1.836 0.830 5.201 115 HZ PHE 91 HZ PHE 91 -0.601 0.169 3.168 116 H TYR 92 H TYR 92 -4.582 -1.503 3.427 117 HA TYR 92 HA TYR 92 -5.182 -2.054 6.179 118 1HB TYR 92 1HB TYR 92 -4.982 -4.390 4.287 119 2HB TYR 92 2HB TYR 92 -5.205 -4.471 6.030 120 HD1 TYR 92 HD1 TYR 92 -7.365 -3.706 7.029 121 HD2 TYR 92 HD2 TYR 92 -6.825 -4.072 2.816 122 HE1 TYR 92 HE1 TYR 92 -9.810 -3.687 6.720 123 HE2 TYR 92 HE2 TYR 92 -9.267 -4.053 2.495 124 HH TYR 92 HH TYR 92 -11.391 -4.753 4.482 125 H ARG 93 H ARG 93 -3.425 -4.153 6.619 126 HA ARG 93 HA ARG 93 -0.871 -3.122 5.581 127 1HB ARG 93 1HB ARG 93 -1.046 -4.197 8.365 128 2HB ARG 93 2HB ARG 93 0.109 -3.064 7.679 129 1HG ARG 93 1HG ARG 93 -2.439 -1.852 7.535 130 2HG ARG 93 2HG ARG 93 -2.262 -2.529 9.155 131 1HD ARG 93 1HD ARG 93 -0.479 -0.545 7.762 132 2HD ARG 93 2HD ARG 93 -1.405 -0.321 9.246 133 HE ARG 93 HE ARG 93 0.308 -2.378 9.800 134 1HH1 ARG 93 1HH1 ARG 93 0.659 0.906 8.696 135 2HH1 ARG 93 2HH1 ARG 93 2.211 1.125 9.431 136 1HH2 ARG 93 1HH2 ARG 93 2.351 -2.101 10.774 137 2HH2 ARG 93 2HH2 ARG 93 3.173 -0.586 10.615 138 H THR 94 H THR 94 -2.886 -5.757 5.844 139 HA THR 94 HA THR 94 -1.019 -7.529 4.707 140 HB THR 94 HB THR 94 0.067 -7.961 6.679 141 HG1 THR 94 HG1 THR 94 -2.179 -9.671 6.885 142 1HG2 THR 94 1HG2 THR 94 -2.141 -6.737 7.911 143 2HG2 THR 94 2HG2 THR 94 -1.945 -8.323 8.658 144 3HG2 THR 94 3HG2 THR 94 -0.596 -7.186 8.634 145 HA PRO 95 HA PRO 95 -4.802 -9.616 3.817 146 1HB PRO 95 1HB PRO 95 -3.875 -11.908 2.803 147 2HB PRO 95 2HB PRO 95 -3.585 -10.362 1.999 148 1HG PRO 95 1HG PRO 95 -1.740 -12.006 3.669 149 2HG PRO 95 2HG PRO 95 -1.391 -11.049 2.221 150 1HD PRO 95 1HD PRO 95 -0.929 -10.244 4.850 151 2HD PRO 95 2HD PRO 95 -1.003 -9.168 3.445 152 H SER 96 H SER 96 -5.865 -10.014 5.736 153 HA SER 96 HA SER 96 -5.453 -11.387 7.922 154 1HB SER 96 1HB SER 96 -7.852 -11.204 6.201 155 2HB SER 96 2HB SER 96 -7.889 -12.452 7.449 156 HG SER 96 HG SER 96 -7.907 -10.957 8.967 157 HA PRO 97 HA PRO 97 -6.658 -15.821 5.895 158 1HB PRO 97 1HB PRO 97 -5.266 -15.012 3.364 159 2HB PRO 97 2HB PRO 97 -6.544 -16.209 3.606 160 1HG PRO 97 1HG PRO 97 -7.077 -13.746 2.670 161 2HG PRO 97 2HG PRO 97 -8.204 -14.614 3.725 162 1HD PRO 97 1HD PRO 97 -6.549 -12.252 4.302 163 2HD PRO 97 2HD PRO 97 -7.980 -12.860 5.155 164 H ASP 98 H ASP 98 -3.766 -14.498 4.303 165 HA ASP 98 HA ASP 98 -2.117 -16.188 6.068 166 1HB ASP 98 1HB ASP 98 -0.499 -16.336 4.184 167 2HB ASP 98 2HB ASP 98 -2.056 -17.063 3.800 168 H ALA 99 H ALA 99 -2.854 -13.658 6.827 169 HA ALA 99 HA ALA 99 -1.437 -11.473 6.128 170 1HB ALA 99 1HB ALA 99 -2.102 -12.359 8.926 171 2HB ALA 99 2HB ALA 99 -1.592 -10.730 8.479 172 3HB ALA 99 3HB ALA 99 -3.106 -11.385 7.850 173 H LYS 100 H LYS 100 0.626 -11.376 5.597 174 HA LYS 100 HA LYS 100 2.614 -12.465 7.481 175 1HB LYS 100 1HB LYS 100 2.505 -13.558 5.195 176 2HB LYS 100 2HB LYS 100 3.041 -12.024 4.524 177 1HG LYS 100 1HG LYS 100 5.141 -12.182 5.546 178 2HG LYS 100 2HG LYS 100 4.600 -13.445 6.653 179 1HD LYS 100 1HD LYS 100 4.316 -14.963 4.719 180 2HD LYS 100 2HD LYS 100 4.963 -13.702 3.668 181 1HE LYS 100 1HE LYS 100 6.684 -14.191 5.944 182 2HE LYS 100 2HE LYS 100 6.407 -15.661 5.011 183 1HZ LYS 100 1HZ LYS 100 7.057 -14.390 3.007 184 2HZ LYS 100 2HZ LYS 100 7.463 -13.078 3.994 185 3HZ LYS 100 3HZ LYS 100 8.308 -14.538 4.137 186 H ALA 101 H ALA 101 1.200 -9.789 7.126 187 HA ALA 101 HA ALA 101 1.691 -7.603 7.470 188 1HB ALA 101 1HB ALA 101 3.603 -8.912 8.848 189 2HB ALA 101 2HB ALA 101 4.596 -7.971 7.735 190 3HB ALA 101 3HB ALA 101 3.448 -7.156 8.797 191 H PHE 102 H PHE 102 1.152 -7.194 5.284 192 HA PHE 102 HA PHE 102 2.781 -7.365 3.070 193 1HB PHE 102 1HB PHE 102 0.503 -5.617 3.845 194 2HB PHE 102 2HB PHE 102 1.450 -5.130 2.444 195 HD1 PHE 102 HD1 PHE 102 2.140 -7.848 1.379 196 HD2 PHE 102 HD2 PHE 102 -1.522 -6.238 2.854 197 HE1 PHE 102 HE1 PHE 102 0.881 -9.436 -0.024 198 HE2 PHE 102 HE2 PHE 102 -2.788 -7.824 1.456 199 HZ PHE 102 HZ PHE 102 -1.586 -9.427 0.015 200 H ILE 103 H ILE 103 3.233 -4.956 1.926 201 HA ILE 103 HA ILE 103 5.683 -4.159 3.087 202 HB ILE 103 HB ILE 103 4.246 -2.402 1.140 203 1HG1 ILE 103 1HG1 ILE 103 3.745 -4.486 0.159 204 2HG1 ILE 103 2HG1 ILE 103 5.210 -3.956 -0.662 205 1HG2 ILE 103 1HG2 ILE 103 6.968 -2.868 2.042 206 2HG2 ILE 103 2HG2 ILE 103 6.824 -2.868 0.284 207 3HG2 ILE 103 3HG2 ILE 103 6.272 -1.475 1.214 208 1HD1 ILE 103 1HD1 ILE 103 6.416 -5.366 1.154 209 2HD1 ILE 103 2HD1 ILE 103 4.841 -6.140 1.330 210 3HD1 ILE 103 3HD1 ILE 103 5.666 -6.164 -0.229 211 H GLU 104 H GLU 104 5.586 -3.273 5.086 212 HA GLU 104 HA GLU 104 3.858 -0.920 5.448 213 1HB GLU 104 1HB GLU 104 5.004 -2.730 7.562 214 2HB GLU 104 2HB GLU 104 3.930 -1.367 7.843 215 1HG GLU 104 1HG GLU 104 3.314 -4.005 6.568 216 2HG GLU 104 2HG GLU 104 2.567 -3.257 7.978 217 H VAL 105 H VAL 105 4.984 0.187 7.669 218 HA VAL 105 HA VAL 105 7.121 1.674 6.600 219 HB VAL 105 HB VAL 105 6.665 1.487 9.556 220 1HG1 VAL 105 1HG1 VAL 105 7.814 3.392 7.638 221 2HG1 VAL 105 2HG1 VAL 105 6.813 4.113 8.898 222 3HG1 VAL 105 3HG1 VAL 105 8.199 3.116 9.336 223 1HG2 VAL 105 1HG2 VAL 105 4.719 2.342 7.503 224 2HG2 VAL 105 2HG2 VAL 105 4.454 1.725 9.133 225 3HG2 VAL 105 3HG2 VAL 105 4.914 3.410 8.892 226 H GLY 106 H GLY 106 9.310 1.826 7.355 227 1HA GLY 106 1HA GLY 106 11.370 0.867 7.697 228 2HA GLY 106 2HA GLY 106 10.615 0.176 9.126 229 H GLN 107 H GLN 107 9.283 -0.692 6.070 230 HA GLN 107 HA GLN 107 10.420 -3.379 6.389 231 1HB GLN 107 1HB GLN 107 7.988 -3.291 6.417 232 2HB GLN 107 2HB GLN 107 7.974 -2.438 4.879 233 1HG GLN 107 1HG GLN 107 8.703 -4.344 3.701 234 2HG GLN 107 2HG GLN 107 9.139 -5.188 5.186 235 1HE2 GLN 107 2HE2 GLN 107 7.463 -6.212 3.161 236 2HE2 GLN 107 1HE2 GLN 107 5.889 -6.441 3.837 237 H LYS 108 H LYS 108 10.726 -4.594 4.270 238 HA LYS 108 HA LYS 108 12.316 -2.902 2.500 239 1HB LYS 108 1HB LYS 108 13.503 -4.810 3.261 240 2HB LYS 108 2HB LYS 108 12.155 -5.882 2.913 241 1HG LYS 108 1HG LYS 108 13.601 -6.338 1.184 242 2HG LYS 108 2HG LYS 108 12.528 -5.142 0.457 243 1HD LYS 108 1HD LYS 108 14.201 -3.695 0.161 244 2HD LYS 108 2HD LYS 108 14.767 -3.905 1.820 245 1HE LYS 108 1HE LYS 108 16.230 -5.583 1.252 246 2HE LYS 108 2HE LYS 108 15.292 -6.066 -0.160 247 1HZ LYS 108 1HZ LYS 108 16.370 -3.400 -0.325 248 2HZ LYS 108 2HZ LYS 108 17.553 -4.605 -0.235 249 3HZ LYS 108 3HZ LYS 108 16.393 -4.648 -1.466 250 H VAL 109 H VAL 109 11.836 -2.510 0.412 251 HA VAL 109 HA VAL 109 9.479 -3.866 -0.725 252 HB VAL 109 HB VAL 109 8.764 -1.841 -1.777 253 1HG1 VAL 109 1HG1 VAL 109 8.725 -2.235 0.945 254 2HG1 VAL 109 2HG1 VAL 109 9.283 -0.570 0.788 255 3HG1 VAL 109 3HG1 VAL 109 7.756 -1.060 0.055 256 1HG2 VAL 109 1HG2 VAL 109 11.421 -0.818 -0.889 257 2HG2 VAL 109 2HG2 VAL 109 10.618 -0.658 -2.451 258 3HG2 VAL 109 3HG2 VAL 109 10.083 0.314 -1.080 259 H ASN 110 H ASN 110 9.863 -4.887 -2.574 260 HA ASN 110 HA ASN 110 12.161 -4.023 -4.205 261 1HB ASN 110 1HB ASN 110 11.512 -6.762 -4.722 262 2HB ASN 110 2HB ASN 110 13.016 -6.085 -4.114 263 1HD2 ASN 110 2HD2 ASN 110 11.220 -8.502 -3.493 264 2HD2 ASN 110 1HD2 ASN 110 11.139 -8.499 -1.767 265 H VAL 111 H VAL 111 11.951 -4.114 -6.452 266 HA VAL 111 HA VAL 111 9.476 -3.411 -7.515 267 HB VAL 111 HB VAL 111 11.893 -4.543 -8.933 268 1HG1 VAL 111 1HG1 VAL 111 9.276 -3.556 -9.939 269 2HG1 VAL 111 2HG1 VAL 111 10.730 -3.144 -10.850 270 3HG1 VAL 111 3HG1 VAL 111 10.320 -4.835 -10.560 271 1HG2 VAL 111 1HG2 VAL 111 11.337 -2.004 -7.734 272 2HG2 VAL 111 2HG2 VAL 111 12.803 -2.555 -8.545 273 3HG2 VAL 111 3HG2 VAL 111 11.507 -1.808 -9.479 274 H GLY 112 H GLY 112 7.772 -4.761 -7.254 275 1HA GLY 112 1HA GLY 112 6.627 -6.499 -8.607 276 2HA GLY 112 2HA GLY 112 8.060 -7.487 -8.359 277 H ASP 113 H ASP 113 8.205 -6.424 -5.530 278 HA ASP 113 HA ASP 113 6.919 -8.562 -4.259 279 1HB ASP 113 1HB ASP 113 8.555 -6.323 -3.489 280 2HB ASP 113 2HB ASP 113 7.243 -6.536 -2.335 281 H THR 114 H THR 114 4.973 -8.806 -3.286 282 HA THR 114 HA THR 114 2.764 -7.381 -4.119 283 HB THR 114 HB THR 114 2.835 -8.706 -1.421 284 HG1 THR 114 HG1 THR 114 2.809 -9.994 -3.947 285 1HG2 THR 114 1HG2 THR 114 0.779 -8.388 -3.571 286 2HG2 THR 114 2HG2 THR 114 0.659 -9.663 -2.359 287 3HG2 THR 114 3HG2 THR 114 0.676 -7.972 -1.859 288 H LEU 115 H LEU 115 1.947 -5.453 -3.654 289 HA LEU 115 HA LEU 115 3.186 -3.803 -1.644 290 1HB LEU 115 1HB LEU 115 2.216 -3.171 -4.014 291 2HB LEU 115 2HB LEU 115 0.723 -2.981 -3.117 292 HG LEU 115 HG LEU 115 2.383 -1.523 -1.561 293 1HD1 LEU 115 1HD1 LEU 115 4.211 -2.002 -3.274 294 2HD1 LEU 115 2HD1 LEU 115 3.337 -0.897 -4.336 295 3HD1 LEU 115 3HD1 LEU 115 3.969 -0.322 -2.793 296 1HD2 LEU 115 1HD2 LEU 115 0.270 -1.061 -3.360 297 2HD2 LEU 115 2HD2 LEU 115 0.851 -0.001 -2.076 298 3HD2 LEU 115 3HD2 LEU 115 1.499 0.153 -3.708 299 H CYS 116 H CYS 116 -0.267 -4.393 -2.300 300 HA CYS 116 HA CYS 116 -0.975 -5.446 0.166 301 1HB CYS 116 1HB CYS 116 -2.142 -3.116 0.888 302 2HB CYS 116 2HB CYS 116 -0.584 -3.655 1.504 303 HG CYS 116 HG CYS 116 0.397 -1.645 0.538 304 H ILE 117 H ILE 117 -3.325 -5.428 0.541 305 HA ILE 117 HA ILE 117 -4.732 -5.425 -1.995 306 HB ILE 117 HB ILE 117 -5.472 -6.397 0.757 307 1HG1 ILE 117 1HG1 ILE 117 -5.614 -8.078 -1.688 308 2HG1 ILE 117 2HG1 ILE 117 -4.007 -7.617 -1.132 309 1HG2 ILE 117 1HG2 ILE 117 -7.458 -5.383 -0.295 310 2HG2 ILE 117 2HG2 ILE 117 -7.237 -6.440 -1.689 311 3HG2 ILE 117 3HG2 ILE 117 -7.611 -7.129 -0.109 312 1HD1 ILE 117 1HD1 ILE 117 -6.077 -8.973 0.576 313 2HD1 ILE 117 2HD1 ILE 117 -4.772 -9.801 -0.274 314 3HD1 ILE 117 3HD1 ILE 117 -4.398 -8.643 1.001 315 H VAL 118 H VAL 118 -6.714 -4.358 -2.367 316 HA VAL 118 HA VAL 118 -7.020 -1.879 -0.810 317 HB VAL 118 HB VAL 118 -8.203 -2.327 -3.537 318 1HG1 VAL 118 1HG1 VAL 118 -8.200 -0.212 -1.647 319 2HG1 VAL 118 2HG1 VAL 118 -7.280 0.317 -3.058 320 3HG1 VAL 118 3HG1 VAL 118 -8.937 -0.254 -3.249 321 1HG2 VAL 118 1HG2 VAL 118 -5.480 -2.471 -3.058 322 2HG2 VAL 118 2HG2 VAL 118 -6.256 -2.119 -4.603 323 3HG2 VAL 118 3HG2 VAL 118 -5.737 -0.799 -3.555 324 H GLU 119 H GLU 119 -8.536 -4.812 -1.735 325 HA GLU 119 HA GLU 119 -10.683 -5.608 -1.556 326 1HB GLU 119 1HB GLU 119 -9.573 -5.387 0.826 327 2HB GLU 119 2HB GLU 119 -10.838 -4.190 1.071 328 1HG GLU 119 1HG GLU 119 -11.168 -7.107 0.433 329 2HG GLU 119 2HG GLU 119 -11.624 -6.264 1.913 330 H ALA 120 H ALA 120 -11.353 -4.018 -3.259 331 HA ALA 120 HA ALA 120 -13.062 -1.872 -2.226 332 1HB ALA 120 1HB ALA 120 -11.323 -1.948 -4.365 333 2HB ALA 120 2HB ALA 120 -12.910 -2.106 -5.121 334 3HB ALA 120 3HB ALA 120 -12.563 -0.727 -4.076 335 H MET 121 H MET 121 -13.255 -5.062 -3.255 336 HA MET 121 HA MET 121 -16.007 -5.284 -2.952 337 1HB MET 121 1HB MET 121 -16.873 -5.434 -5.166 338 2HB MET 121 2HB MET 121 -15.991 -3.917 -5.071 339 1HG MET 121 1HG MET 121 -14.032 -5.478 -5.983 340 2HG MET 121 2HG MET 121 -15.415 -6.357 -6.633 341 1HE MET 121 1HE MET 121 -17.408 -5.048 -7.494 342 2HE MET 121 2HE MET 121 -17.298 -3.667 -8.584 343 3HE MET 121 3HE MET 121 -16.731 -5.253 -9.109 344 H LYS 122 H LYS 122 -14.359 -6.882 -1.876 345 HA LYS 122 HA LYS 122 -13.466 -8.982 -1.707 346 1HB LYS 122 1HB LYS 122 -16.025 -9.269 -1.899 347 2HB LYS 122 2HB LYS 122 -15.700 -9.850 -3.527 348 1HG LYS 122 1HG LYS 122 -15.939 -11.585 -1.683 349 2HG LYS 122 2HG LYS 122 -14.541 -11.725 -2.753 350 1HD LYS 122 1HD LYS 122 -14.011 -12.054 -0.339 351 2HD LYS 122 2HD LYS 122 -13.102 -10.748 -1.101 352 1HE LYS 122 1HE LYS 122 -14.632 -9.109 -0.154 353 2HE LYS 122 2HE LYS 122 -15.593 -10.400 0.565 354 H MET 123 H MET 123 -12.519 -7.352 -3.950 355 HA MET 123 HA MET 123 -11.926 -9.397 -5.967 356 1HB MET 123 1HB MET 123 -11.384 -7.649 -7.461 357 2HB MET 123 2HB MET 123 -12.832 -7.114 -6.621 358 1HG MET 123 1HG MET 123 -11.238 -5.886 -5.043 359 2HG MET 123 2HG MET 123 -10.012 -6.172 -6.277 360 1HE MET 123 1HE MET 123 -10.132 -3.623 -5.467 361 2HE MET 123 2HE MET 123 -9.659 -3.318 -7.139 362 3HE MET 123 3HE MET 123 -10.983 -2.405 -6.416 363 H MET 124 H MET 124 -10.621 -8.212 -3.178 364 HA MET 124 HA MET 124 -8.514 -8.031 -2.307 365 1HB MET 124 1HB MET 124 -7.915 -10.371 -4.111 366 2HB MET 124 2HB MET 124 -7.206 -10.011 -2.544 367 1HG MET 124 1HG MET 124 -10.139 -10.501 -2.768 368 2HG MET 124 2HG MET 124 -9.015 -11.857 -2.768 369 1HE MET 124 1HE MET 124 -11.314 -11.561 -0.691 370 2HE MET 124 2HE MET 124 -10.924 -10.774 0.838 371 3HE MET 124 3HE MET 124 -11.250 -9.801 -0.597 372 H ASN 125 H ASN 125 -8.899 -6.329 -4.524 373 HA ASN 125 HA ASN 125 -6.919 -6.454 -6.487 374 1HB ASN 125 1HB ASN 125 -8.700 -4.888 -6.757 375 2HB ASN 125 2HB ASN 125 -8.325 -4.098 -5.226 376 1HD2 ASN 125 2HD2 ASN 125 -8.262 -2.129 -6.426 377 2HD2 ASN 125 1HD2 ASN 125 -6.849 -1.701 -7.322 378 H GLN 126 H GLN 126 -5.042 -7.221 -5.383 379 HA GLN 126 HA GLN 126 -3.746 -5.345 -3.559 380 1HB GLN 126 1HB GLN 126 -2.406 -7.096 -2.835 381 2HB GLN 126 2HB GLN 126 -3.923 -7.907 -3.201 382 1HG GLN 126 1HG GLN 126 -2.799 -8.244 -5.551 383 2HG GLN 126 2HG GLN 126 -1.316 -8.020 -4.624 384 1HE2 GLN 126 2HE2 GLN 126 -2.080 -9.219 -2.236 385 2HE2 GLN 126 1HE2 GLN 126 -2.281 -10.914 -2.502 386 H ILE 127 H ILE 127 -2.074 -4.103 -4.094 387 HA ILE 127 HA ILE 127 -1.153 -4.138 -6.856 388 HB ILE 127 HB ILE 127 -0.285 -2.196 -4.728 389 1HG1 ILE 127 1HG1 ILE 127 -2.619 -1.983 -4.589 390 2HG1 ILE 127 2HG1 ILE 127 -2.154 -0.739 -5.746 391 1HG2 ILE 127 1HG2 ILE 127 -0.243 -2.278 -7.710 392 2HG2 ILE 127 2HG2 ILE 127 -0.285 -0.725 -6.875 393 3HG2 ILE 127 3HG2 ILE 127 1.041 -1.850 -6.580 394 1HD1 ILE 127 1HD1 ILE 127 -2.729 -2.347 -7.569 395 2HD1 ILE 127 2HD1 ILE 127 -3.384 -3.417 -6.329 396 3HD1 ILE 127 3HD1 ILE 127 -4.091 -1.820 -6.580 397 H GLU 128 H GLU 128 1.197 -3.795 -7.274 398 HA GLU 128 HA GLU 128 2.860 -5.275 -5.344 399 1HB GLU 128 1HB GLU 128 3.269 -5.402 -8.324 400 2HB GLU 128 2HB GLU 128 3.940 -6.455 -7.087 401 1HG GLU 128 1HG GLU 128 2.323 -7.815 -7.915 402 2HG GLU 128 2HG GLU 128 1.402 -6.998 -6.650 403 H ALA 129 H ALA 129 4.578 -4.190 -4.653 404 HA ALA 129 HA ALA 129 5.211 -1.623 -5.028 405 1HB ALA 129 1HB ALA 129 6.555 -3.856 -3.961 406 2HB ALA 129 2HB ALA 129 7.715 -3.001 -4.979 407 3HB ALA 129 3HB ALA 129 6.889 -2.149 -3.674 408 H ASP 130 H ASP 130 6.226 -0.309 -6.464 409 HA ASP 130 HA ASP 130 7.048 -1.536 -9.014 410 1HB ASP 130 1HB ASP 130 6.228 0.336 -10.179 411 2HB ASP 130 2HB ASP 130 4.999 0.017 -8.956 412 H LYS 131 H LYS 131 8.050 0.297 -6.330 413 HA LYS 131 HA LYS 131 10.623 0.824 -7.648 414 1HB LYS 131 1HB LYS 131 8.828 2.818 -6.946 415 2HB LYS 131 2HB LYS 131 9.963 2.793 -5.603 416 1HG LYS 131 1HG LYS 131 11.476 3.878 -6.797 417 2HG LYS 131 2HG LYS 131 11.398 2.664 -8.077 418 1HD LYS 131 1HD LYS 131 9.118 3.980 -8.580 419 2HD LYS 131 2HD LYS 131 10.051 5.291 -7.857 420 1HE LYS 131 1HE LYS 131 10.734 3.645 -10.281 421 2HE LYS 131 2HE LYS 131 10.434 5.380 -10.198 422 1HZ LYS 131 1HZ LYS 131 12.492 4.989 -8.462 423 2HZ LYS 131 2HZ LYS 131 12.856 3.927 -9.728 424 3HZ LYS 131 3HZ LYS 131 12.632 5.572 -10.043 425 H SER 132 H SER 132 12.121 -0.321 -6.637 426 HA SER 132 HA SER 132 11.799 -1.571 -4.158 427 1HB SER 132 1HB SER 132 13.734 -2.581 -4.704 428 2HB SER 132 2HB SER 132 13.674 -1.650 -6.201 429 HG SER 132 HG SER 132 15.325 -1.381 -4.033 430 H GLY 133 H GLY 133 13.973 -1.156 -2.604 431 1HA GLY 133 1HA GLY 133 15.188 0.704 -1.553 432 2HA GLY 133 2HA GLY 133 13.747 1.680 -1.801 433 H THR 134 H THR 134 13.016 2.164 0.172 434 HA THR 134 HA THR 134 12.205 -0.029 1.905 435 HB THR 134 HB THR 134 13.929 2.237 2.926 436 HG1 THR 134 HG1 THR 134 14.517 -0.312 2.038 437 1HG2 THR 134 1HG2 THR 134 12.280 1.358 4.561 438 2HG2 THR 134 2HG2 THR 134 13.025 -0.232 4.383 439 3HG2 THR 134 3HG2 THR 134 13.964 1.116 5.026 440 H VAL 135 H VAL 135 10.281 0.348 2.817 441 HA VAL 135 HA VAL 135 8.766 2.620 2.126 442 HB VAL 135 HB VAL 135 8.258 0.535 4.252 443 1HG1 VAL 135 1HG1 VAL 135 6.527 2.752 3.193 444 2HG1 VAL 135 2HG1 VAL 135 5.855 1.314 3.962 445 3HG1 VAL 135 3HG1 VAL 135 6.931 2.378 4.868 446 1HG2 VAL 135 1HG2 VAL 135 7.886 0.643 1.348 447 2HG2 VAL 135 2HG2 VAL 135 7.980 -0.747 2.431 448 3HG2 VAL 135 3HG2 VAL 135 6.458 0.125 2.244 449 H LYS 136 H LYS 136 8.738 4.586 2.981 450 HA LYS 136 HA LYS 136 10.253 5.197 5.337 451 1HB LYS 136 1HB LYS 136 9.285 6.623 3.106 452 2HB LYS 136 2HB LYS 136 8.533 7.356 4.517 453 1HG LYS 136 1HG LYS 136 11.483 6.980 4.049 454 2HG LYS 136 2HG LYS 136 10.587 8.498 3.992 455 1HD LYS 136 1HD LYS 136 10.901 6.738 6.424 456 2HD LYS 136 2HD LYS 136 11.806 8.219 6.109 457 1HE LYS 136 1HE LYS 136 8.814 8.009 6.430 458 2HE LYS 136 2HE LYS 136 9.942 8.613 7.644 459 1HZ LYS 136 1HZ LYS 136 10.562 10.151 5.555 460 2HZ LYS 136 2HZ LYS 136 8.913 9.911 5.265 461 3HZ LYS 136 3HZ LYS 136 9.426 10.582 6.730 462 H ALA 137 H ALA 137 6.826 4.988 4.518 463 HA ALA 137 HA ALA 137 5.864 4.169 6.917 464 1HB ALA 137 1HB ALA 137 6.280 7.133 6.916 465 2HB ALA 137 2HB ALA 137 4.980 6.403 7.858 466 3HB ALA 137 3HB ALA 137 6.655 5.953 8.173 467 H ILE 138 H ILE 138 3.543 4.374 7.163 468 HA ILE 138 HA ILE 138 2.242 4.981 4.598 469 HB ILE 138 HB ILE 138 1.485 3.115 6.840 470 1HG1 ILE 138 1HG1 ILE 138 2.312 2.837 3.972 471 2HG1 ILE 138 2HG1 ILE 138 2.895 1.969 5.389 472 1HG2 ILE 138 1HG2 ILE 138 -0.219 4.008 4.520 473 2HG2 ILE 138 2HG2 ILE 138 -0.571 2.613 5.539 474 3HG2 ILE 138 3HG2 ILE 138 -0.552 4.233 6.236 475 1HD1 ILE 138 1HD1 ILE 138 0.768 0.750 5.493 476 2HD1 ILE 138 2HD1 ILE 138 0.231 1.594 4.041 477 3HD1 ILE 138 3HD1 ILE 138 1.613 0.501 3.965 478 H LEU 139 H LEU 139 0.595 6.414 4.458 479 HA LEU 139 HA LEU 139 0.011 7.993 6.859 480 1HB LEU 139 1HB LEU 139 -0.038 8.521 3.932 481 2HB LEU 139 2HB LEU 139 -1.178 9.399 4.935 482 HG LEU 139 HG LEU 139 0.554 10.474 6.148 483 1HD1 LEU 139 1HD1 LEU 139 1.956 8.316 6.192 484 2HD1 LEU 139 2HD1 LEU 139 2.672 8.927 4.702 485 3HD1 LEU 139 3HD1 LEU 139 2.797 9.865 6.190 486 1HD2 LEU 139 1HD2 LEU 139 0.587 10.500 3.240 487 2HD2 LEU 139 2HD2 LEU 139 0.629 11.840 4.385 488 3HD2 LEU 139 3HD2 LEU 139 2.121 11.010 3.944 489 H VAL 140 H VAL 140 -1.506 6.089 4.334 490 HA VAL 140 HA VAL 140 -4.172 6.658 4.754 491 HB VAL 140 HB VAL 140 -2.854 4.061 3.974 492 1HG1 VAL 140 1HG1 VAL 140 -5.597 4.540 4.749 493 2HG1 VAL 140 2HG1 VAL 140 -5.485 3.995 3.076 494 3HG1 VAL 140 3HG1 VAL 140 -4.783 3.022 4.369 495 1HG2 VAL 140 1HG2 VAL 140 -4.322 6.176 2.400 496 2HG2 VAL 140 2HG2 VAL 140 -2.586 5.867 2.380 497 3HG2 VAL 140 3HG2 VAL 140 -3.703 4.663 1.739 498 H GLU 141 H GLU 141 -5.464 6.454 6.423 499 HA GLU 141 HA GLU 141 -4.690 5.295 8.871 500 1HB GLU 141 1HB GLU 141 -7.193 6.502 7.784 501 2HB GLU 141 2HB GLU 141 -7.312 5.534 9.246 502 1HG GLU 141 1HG GLU 141 -7.067 7.806 9.890 503 2HG GLU 141 2HG GLU 141 -5.559 6.975 10.263 504 H SER 142 H SER 142 -4.078 3.258 7.667 505 HA SER 142 HA SER 142 -5.458 1.353 6.522 506 1HB SER 142 1HB SER 142 -3.629 0.227 7.112 507 2HB SER 142 2HB SER 142 -3.295 1.414 8.371 508 HG SER 142 HG SER 142 -4.435 -1.098 8.558 509 H GLY 143 H GLY 143 -6.913 -0.362 7.046 510 1HA GLY 143 1HA GLY 143 -8.572 -1.434 8.265 511 2HA GLY 143 2HA GLY 143 -8.179 -0.413 9.643 512 H GLN 144 H GLN 144 -8.473 1.634 7.119 513 HA GLN 144 HA GLN 144 -11.372 1.996 7.493 514 1HB GLN 144 1HB GLN 144 -10.388 3.713 8.795 515 2HB GLN 144 2HB GLN 144 -9.165 4.046 7.577 516 1HG GLN 144 1HG GLN 144 -11.230 4.685 6.106 517 2HG GLN 144 2HG GLN 144 -12.023 4.870 7.670 518 1HE2 GLN 144 2HE2 GLN 144 -10.950 6.296 9.232 519 2HE2 GLN 144 1HE2 GLN 144 -10.118 7.689 8.640 520 HA PRO 145 HA PRO 145 -11.774 1.956 3.108 521 1HB PRO 145 1HB PRO 145 -13.700 3.919 2.815 522 2HB PRO 145 2HB PRO 145 -14.031 2.239 3.242 523 1HG PRO 145 1HG PRO 145 -13.808 4.636 5.013 524 2HG PRO 145 2HG PRO 145 -14.953 3.284 5.094 525 1HD PRO 145 1HD PRO 145 -12.854 3.432 6.750 526 2HD PRO 145 2HD PRO 145 -13.407 1.874 6.100 527 H VAL 146 H VAL 146 -9.844 2.751 2.329 528 HA VAL 146 HA VAL 146 -9.010 5.442 2.499 529 HB VAL 146 HB VAL 146 -7.492 3.527 2.020 530 1HG1 VAL 146 1HG1 VAL 146 -9.060 3.509 -0.517 531 2HG1 VAL 146 2HG1 VAL 146 -7.362 3.034 -0.545 532 3HG1 VAL 146 3HG1 VAL 146 -8.505 2.160 0.474 533 1HG2 VAL 146 1HG2 VAL 146 -7.051 6.011 1.467 534 2HG2 VAL 146 2HG2 VAL 146 -5.980 4.789 0.783 535 3HG2 VAL 146 3HG2 VAL 146 -7.245 5.509 -0.212 536 H GLU 147 H GLU 147 -8.616 6.839 0.547 537 HA GLU 147 HA GLU 147 -10.870 6.674 -1.340 538 1HB GLU 147 1HB GLU 147 -9.885 9.003 0.271 539 2HB GLU 147 2HB GLU 147 -10.655 9.280 -1.287 540 1HG GLU 147 1HG GLU 147 -11.993 7.586 0.778 541 2HG GLU 147 2HG GLU 147 -12.073 9.345 0.871 542 H PHE 148 H PHE 148 -10.428 8.413 -3.175 543 HA PHE 148 HA PHE 148 -8.147 7.489 -4.576 544 1HB PHE 148 1HB PHE 148 -9.917 8.060 -5.968 545 2HB PHE 148 2HB PHE 148 -10.243 9.551 -5.099 546 HD1 PHE 148 HD1 PHE 148 -6.974 8.379 -6.392 547 HD2 PHE 148 HD2 PHE 148 -10.200 11.135 -6.823 548 HE1 PHE 148 HE1 PHE 148 -5.674 9.634 -8.068 549 HE2 PHE 148 HE2 PHE 148 -8.906 12.393 -8.501 550 HZ PHE 148 HZ PHE 148 -6.640 11.643 -9.126 551 H ASP 149 H ASP 149 -6.135 8.274 -4.705 552 HA ASP 149 HA ASP 149 -4.359 9.711 -4.558 553 1HB ASP 149 1HB ASP 149 -6.407 11.449 -5.024 554 2HB ASP 149 2HB ASP 149 -5.847 12.003 -3.449 555 H GLU 150 H GLU 150 -4.826 7.956 -2.552 556 HA GLU 150 HA GLU 150 -4.222 9.505 -0.118 557 1HB GLU 150 1HB GLU 150 -6.257 7.624 -0.526 558 2HB GLU 150 2HB GLU 150 -5.036 6.779 0.415 559 1HG GLU 150 1HG GLU 150 -6.607 9.220 1.129 560 2HG GLU 150 2HG GLU 150 -6.439 7.704 2.014 561 HA PRO 151 HA PRO 151 -0.143 7.721 -0.748 562 1HB PRO 151 1HB PRO 151 0.094 8.716 2.052 563 2HB PRO 151 2HB PRO 151 1.174 8.961 0.675 564 1HG PRO 151 1HG PRO 151 -0.434 10.915 1.505 565 2HG PRO 151 2HG PRO 151 -0.138 10.649 -0.224 566 1HD PRO 151 1HD PRO 151 -2.536 9.971 1.417 567 2HD PRO 151 2HD PRO 151 -2.437 10.510 -0.273 568 H LEU 152 H LEU 152 -1.072 5.561 -0.700 569 HA LEU 152 HA LEU 152 -1.739 4.199 1.666 570 1HB LEU 152 1HB LEU 152 -0.679 3.095 -0.937 571 2HB LEU 152 2HB LEU 152 -1.434 2.145 0.333 572 HG LEU 152 HG LEU 152 -2.955 4.412 -0.887 573 1HD1 LEU 152 1HD1 LEU 152 -2.097 1.959 -2.255 574 2HD1 LEU 152 2HD1 LEU 152 -3.827 2.294 -2.330 575 3HD1 LEU 152 3HD1 LEU 152 -2.672 3.491 -2.915 576 1HD2 LEU 152 1HD2 LEU 152 -3.544 2.743 1.123 577 2HD2 LEU 152 2HD2 LEU 152 -4.763 3.418 0.041 578 3HD2 LEU 152 3HD2 LEU 152 -4.145 1.788 -0.231 579 H VAL 153 H VAL 153 1.307 4.347 -0.154 580 HA VAL 153 HA VAL 153 2.779 3.796 2.287 581 HB VAL 153 HB VAL 153 3.379 2.075 -0.105 582 1HG1 VAL 153 1HG1 VAL 153 4.475 2.461 2.552 583 2HG1 VAL 153 2HG1 VAL 153 4.081 0.772 2.232 584 3HG1 VAL 153 3HG1 VAL 153 5.168 1.644 1.152 585 1HG2 VAL 153 1HG2 VAL 153 1.542 1.435 2.199 586 2HG2 VAL 153 2HG2 VAL 153 1.120 1.510 0.488 587 3HG2 VAL 153 3HG2 VAL 153 2.190 0.239 1.077 588 H VAL 154 H VAL 154 4.437 5.153 2.357 589 HA VAL 154 HA VAL 154 5.403 6.331 -0.149 590 HB VAL 154 HB VAL 154 6.184 8.184 1.076 591 1HG1 VAL 154 1HG1 VAL 154 3.505 7.289 1.396 592 2HG1 VAL 154 2HG1 VAL 154 3.991 8.131 2.867 593 3HG1 VAL 154 3HG1 VAL 154 4.114 8.943 1.307 594 1HG2 VAL 154 1HG2 VAL 154 6.149 6.301 3.368 595 2HG2 VAL 154 2HG2 VAL 154 7.354 7.502 2.907 596 3HG2 VAL 154 3HG2 VAL 154 5.867 8.008 3.708 597 H ILE 155 H ILE 155 7.186 5.512 -0.993 598 HA ILE 155 HA ILE 155 8.999 3.917 0.600 599 HB ILE 155 HB ILE 155 9.410 4.672 -2.282 600 1HG1 ILE 155 1HG1 ILE 155 8.058 2.113 -1.697 601 2HG1 ILE 155 2HG1 ILE 155 7.078 3.553 -1.433 602 1HG2 ILE 155 1HG2 ILE 155 10.270 2.364 -0.554 603 2HG2 ILE 155 2HG2 ILE 155 10.439 2.375 -2.310 604 3HG2 ILE 155 3HG2 ILE 155 11.287 3.575 -1.334 605 1HD1 ILE 155 1HD1 ILE 155 7.640 4.265 -3.752 606 2HD1 ILE 155 2HD1 ILE 155 8.419 2.700 -3.982 607 3HD1 ILE 155 3HD1 ILE 155 6.690 2.782 -3.647 608 H GLU 156 H GLU 156 11.197 4.332 0.914 609 HA GLU 156 HA GLU 156 11.857 7.138 1.119 610 1HB GLU 156 1HB GLU 156 12.438 5.683 2.965 611 2HB GLU 156 2HB GLU 156 13.375 4.644 1.900 612 1HG GLU 156 1HG GLU 156 14.906 6.541 1.474 613 2HG GLU 156 2HG GLU 156 14.005 7.486 2.657 614 1H10 BTN 222 1H10 BTN 122 -12.305 -11.974 2.336 615 2H10 BTN 222 2H10 BTN 122 -13.668 -12.759 3.131 616 1H9 BTN 222 1H9 BTN 122 -11.716 -12.273 4.622 617 2H9 BTN 222 2H9 BTN 122 -13.256 -11.607 5.170 618 1H8 BTN 222 1H8 BTN 122 -11.942 -9.768 5.462 619 2H8 BTN 222 2H8 BTN 122 -12.418 -9.510 3.782 620 1H7 BTN 222 1H7 BTN 122 -10.368 -10.351 2.971 621 2H7 BTN 222 2H7 BTN 122 -9.926 -10.997 4.545 622 H2 BTN 222 H2 BTN 122 -10.061 -8.458 5.265 623 1H6 BTN 222 1H6 BTN 122 -7.640 -6.277 2.898 624 2H6 BTN 222 2H6 BTN 122 -8.327 -6.177 4.514 625 H5 BTN 222 H5 BTN 122 -6.598 -7.707 4.892 626 HN1 BTN 222 HN2 BTN 122 -5.901 -8.103 2.468 627 HN2 BTN 222 HN1 BTN 122 -8.187 -11.121 3.687 628 H4 BTN 222 H4 BTN 122 -7.955 -9.437 5.598 Start of MODEL 9 1 1H GLU 77 H GLU 77 21.857 11.289 -7.144 2 HA GLU 77 HA GLU 77 20.687 10.067 -4.923 3 1HB GLU 77 1HB GLU 77 20.546 12.907 -5.932 4 2HB GLU 77 2HB GLU 77 19.858 12.404 -4.393 5 1HG GLU 77 1HG GLU 77 22.245 13.434 -4.503 6 2HG GLU 77 2HG GLU 77 21.904 12.084 -3.422 7 H ILE 78 H ILE 78 18.405 10.874 -4.137 8 HA ILE 78 HA ILE 78 16.349 11.170 -6.064 9 HB ILE 78 HB ILE 78 16.996 8.762 -6.433 10 1HG1 ILE 78 1HG1 ILE 78 14.196 9.386 -5.472 11 2HG1 ILE 78 2HG1 ILE 78 14.813 9.577 -7.111 12 1HG2 ILE 78 1HG2 ILE 78 17.300 8.473 -3.863 13 2HG2 ILE 78 2HG2 ILE 78 15.572 8.122 -3.888 14 3HG2 ILE 78 3HG2 ILE 78 16.687 7.134 -4.832 15 1HD1 ILE 78 1HD1 ILE 78 15.285 6.915 -6.494 16 2HD1 ILE 78 2HD1 ILE 78 13.692 7.259 -5.822 17 3HD1 ILE 78 3HD1 ILE 78 14.012 7.558 -7.530 18 H SER 79 H SER 79 14.246 11.311 -5.118 19 HA SER 79 HA SER 79 14.328 11.652 -2.193 20 1HB SER 79 1HB SER 79 12.459 13.281 -2.528 21 2HB SER 79 2HB SER 79 13.967 13.771 -3.300 22 HG SER 79 HG SER 79 12.789 13.924 -5.029 23 H GLY 80 H GLY 80 13.789 9.148 -3.504 24 1HA GLY 80 1HA GLY 80 12.286 7.413 -3.450 25 2HA GLY 80 2HA GLY 80 11.623 8.226 -2.040 26 H HIS 81 H HIS 81 9.504 7.647 -2.545 27 HA HIS 81 HA HIS 81 8.136 9.469 -4.253 28 1HB HIS 81 1HB HIS 81 7.171 7.841 -5.811 29 2HB HIS 81 2HB HIS 81 8.922 7.903 -5.973 30 HD1 HIS 81 HD1 HIS 81 6.595 5.491 -6.360 31 HD2 HIS 81 HD2 HIS 81 9.812 5.745 -3.742 32 HE1 HIS 81 HE1 HIS 81 7.120 3.119 -5.708 33 HE2 HIS 81 HE2 HIS 81 9.108 3.293 -4.170 34 H ILE 82 H ILE 82 5.801 9.223 -4.132 35 HA ILE 82 HA ILE 82 4.994 7.717 -1.731 36 HB ILE 82 HB ILE 82 3.705 10.215 -2.830 37 1HG1 ILE 82 1HG1 ILE 82 5.918 9.775 -0.899 38 2HG1 ILE 82 2HG1 ILE 82 5.616 11.135 -1.973 39 1HG2 ILE 82 1HG2 ILE 82 2.492 8.361 -1.350 40 2HG2 ILE 82 2HG2 ILE 82 3.268 9.274 -0.056 41 3HG2 ILE 82 3HG2 ILE 82 2.165 10.084 -1.167 42 1HD1 ILE 82 1HD1 ILE 82 3.581 11.419 -0.218 43 2HD1 ILE 82 2HD1 ILE 82 4.825 10.715 0.816 44 3HD1 ILE 82 3HD1 ILE 82 5.152 12.208 -0.065 45 H VAL 83 H VAL 83 3.451 6.226 -1.924 46 HA VAL 83 HA VAL 83 2.171 5.899 -4.535 47 HB VAL 83 HB VAL 83 2.351 4.005 -2.190 48 1HG1 VAL 83 1HG1 VAL 83 0.282 3.723 -3.515 49 2HG1 VAL 83 2HG1 VAL 83 1.270 3.487 -4.957 50 3HG1 VAL 83 3HG1 VAL 83 1.364 2.335 -3.625 51 1HG2 VAL 83 1HG2 VAL 83 4.229 4.659 -4.167 52 2HG2 VAL 83 2HG2 VAL 83 4.287 3.310 -3.032 53 3HG2 VAL 83 3HG2 VAL 83 3.565 3.091 -4.626 54 H ARG 84 H ARG 84 0.457 7.307 -4.521 55 HA ARG 84 HA ARG 84 -1.367 7.391 -2.277 56 1HB ARG 84 1HB ARG 84 -0.989 8.914 -4.790 57 2HB ARG 84 2HB ARG 84 -2.635 8.824 -4.176 58 1HG ARG 84 1HG ARG 84 -2.155 10.507 -2.822 59 2HG ARG 84 2HG ARG 84 -1.041 9.441 -1.963 60 1HD ARG 84 1HD ARG 84 0.667 10.073 -3.750 61 2HD ARG 84 2HD ARG 84 -0.447 11.365 -4.193 62 HE ARG 84 HE ARG 84 -0.109 11.647 -1.499 63 1HH1 ARG 84 1HH1 ARG 84 2.022 11.531 -4.251 64 2HH1 ARG 84 2HH1 ARG 84 3.217 12.558 -3.533 65 1HH2 ARG 84 1HH2 ARG 84 1.458 13.002 -0.543 66 2HH2 ARG 84 2HH2 ARG 84 2.898 13.393 -1.424 67 H SER 85 H SER 85 -3.693 7.054 -2.562 68 HA SER 85 HA SER 85 -4.206 4.536 -3.823 69 1HB SER 85 1HB SER 85 -5.302 5.891 -1.689 70 2HB SER 85 2HB SER 85 -6.558 6.033 -2.919 71 HG SER 85 HG SER 85 -6.009 3.613 -3.149 72 HA PRO 86 HA PRO 86 -5.400 6.316 -7.742 73 1HB PRO 86 1HB PRO 86 -6.158 3.990 -8.915 74 2HB PRO 86 2HB PRO 86 -4.464 4.447 -8.701 75 1HG PRO 86 1HG PRO 86 -6.149 2.603 -7.052 76 2HG PRO 86 2HG PRO 86 -4.476 2.398 -7.601 77 1HD PRO 86 1HD PRO 86 -5.096 3.204 -5.092 78 2HD PRO 86 2HD PRO 86 -3.630 3.745 -5.933 79 H MET 87 H MET 87 -7.427 4.210 -5.790 80 HA MET 87 HA MET 87 -9.748 5.804 -6.413 81 1HB MET 87 1HB MET 87 -11.080 3.704 -7.023 82 2HB MET 87 2HB MET 87 -10.021 4.373 -8.256 83 1HG MET 87 1HG MET 87 -8.592 2.611 -8.189 84 2HG MET 87 2HG MET 87 -8.904 2.278 -6.487 85 1HE MET 87 1HE MET 87 -8.540 0.040 -8.586 86 2HE MET 87 2HE MET 87 -9.994 -0.622 -9.333 87 3HE MET 87 3HE MET 87 -9.301 0.885 -9.935 88 H VAL 88 H VAL 88 -11.727 4.842 -5.230 89 HA VAL 88 HA VAL 88 -11.161 4.707 -2.503 90 HB VAL 88 HB VAL 88 -13.625 3.825 -4.004 91 1HG1 VAL 88 1HG1 VAL 88 -12.972 3.774 -1.109 92 2HG1 VAL 88 2HG1 VAL 88 -14.594 4.283 -1.581 93 3HG1 VAL 88 3HG1 VAL 88 -13.994 2.696 -2.060 94 1HG2 VAL 88 1HG2 VAL 88 -12.563 6.372 -3.321 95 2HG2 VAL 88 2HG2 VAL 88 -14.079 5.994 -4.138 96 3HG2 VAL 88 3HG2 VAL 88 -14.031 6.112 -2.379 97 H GLY 89 H GLY 89 -11.257 3.004 -0.992 98 1HA GLY 89 1HA GLY 89 -11.776 0.336 -1.463 99 2HA GLY 89 2HA GLY 89 -10.090 0.563 -1.902 100 H THR 90 H THR 90 -11.013 -1.117 0.179 101 HA THR 90 HA THR 90 -10.426 0.293 2.659 102 HB THR 90 HB THR 90 -10.837 -2.658 2.571 103 HG1 THR 90 HG1 THR 90 -12.950 -0.796 2.251 104 1HG2 THR 90 1HG2 THR 90 -10.562 -1.282 4.691 105 2HG2 THR 90 2HG2 THR 90 -12.177 -0.660 4.353 106 3HG2 THR 90 3HG2 THR 90 -11.934 -2.388 4.609 107 H PHE 91 H PHE 91 -8.321 0.663 2.989 108 HA PHE 91 HA PHE 91 -6.283 -1.142 2.059 109 1HB PHE 91 1HB PHE 91 -5.957 1.319 2.123 110 2HB PHE 91 2HB PHE 91 -6.027 1.259 3.883 111 HD1 PHE 91 HD1 PHE 91 -4.174 -0.300 1.040 112 HD2 PHE 91 HD2 PHE 91 -4.052 1.140 5.052 113 HE1 PHE 91 HE1 PHE 91 -1.749 -0.732 1.116 114 HE2 PHE 91 HE2 PHE 91 -1.626 0.712 5.136 115 HZ PHE 91 HZ PHE 91 -0.472 -0.225 3.167 116 H TYR 92 H TYR 92 -4.536 -1.878 3.609 117 HA TYR 92 HA TYR 92 -5.279 -2.309 6.343 118 1HB TYR 92 1HB TYR 92 -5.739 -4.410 4.314 119 2HB TYR 92 2HB TYR 92 -4.994 -4.929 5.822 120 HD1 TYR 92 HD1 TYR 92 -6.249 -3.666 7.950 121 HD2 TYR 92 HD2 TYR 92 -8.008 -4.759 4.224 122 HE1 TYR 92 HE1 TYR 92 -8.467 -3.723 9.020 123 HE2 TYR 92 HE2 TYR 92 -10.230 -4.819 5.282 124 HH TYR 92 HH TYR 92 -10.688 -3.850 8.656 125 H ARG 93 H ARG 93 -3.682 -3.992 7.346 126 HA ARG 93 HA ARG 93 -1.025 -3.522 6.160 127 1HB ARG 93 1HB ARG 93 -1.473 -3.959 9.099 128 2HB ARG 93 2HB ARG 93 -0.093 -3.227 8.294 129 1HG ARG 93 1HG ARG 93 -2.330 -1.648 7.648 130 2HG ARG 93 2HG ARG 93 -2.416 -1.979 9.379 131 1HD ARG 93 1HD ARG 93 -0.028 -0.863 7.912 132 2HD ARG 93 2HD ARG 93 -1.151 0.066 8.904 133 HE ARG 93 HE ARG 93 0.990 -1.622 9.822 134 1HH1 ARG 93 1HH1 ARG 93 -2.064 -0.164 10.640 135 2HH1 ARG 93 2HH1 ARG 93 -1.777 -0.210 12.347 136 1HH2 ARG 93 1HH2 ARG 93 1.381 -1.688 12.069 137 2HH2 ARG 93 2HH2 ARG 93 0.182 -1.076 13.160 138 H THR 94 H THR 94 -3.274 -5.813 7.373 139 HA THR 94 HA THR 94 -1.386 -7.967 6.776 140 HB THR 94 HB THR 94 -2.354 -9.200 8.809 141 HG1 THR 94 HG1 THR 94 -3.755 -8.119 9.905 142 1HG2 THR 94 1HG2 THR 94 -0.488 -6.874 9.121 143 2HG2 THR 94 2HG2 THR 94 -0.854 -7.995 10.433 144 3HG2 THR 94 3HG2 THR 94 -0.093 -8.586 8.955 145 HA PRO 95 HA PRO 95 -5.044 -8.986 4.341 146 1HB PRO 95 1HB PRO 95 -3.355 -11.391 3.875 147 2HB PRO 95 2HB PRO 95 -4.179 -10.350 2.708 148 1HG PRO 95 1HG PRO 95 -1.540 -10.203 3.039 149 2HG PRO 95 2HG PRO 95 -2.510 -8.744 2.760 150 1HD PRO 95 1HD PRO 95 -1.306 -9.764 5.294 151 2HD PRO 95 2HD PRO 95 -1.500 -8.093 4.728 152 H SER 96 H SER 96 -5.406 -11.835 3.998 153 HA SER 96 HA SER 96 -7.266 -12.526 5.779 154 1HB SER 96 1HB SER 96 -5.562 -14.847 5.396 155 2HB SER 96 2HB SER 96 -7.180 -14.528 4.766 156 HG SER 96 HG SER 96 -4.721 -14.209 3.568 157 HA PRO 97 HA PRO 97 -5.728 -12.540 9.909 158 1HB PRO 97 1HB PRO 97 -7.451 -14.969 10.134 159 2HB PRO 97 2HB PRO 97 -7.385 -13.538 11.168 160 1HG PRO 97 1HG PRO 97 -9.368 -13.854 9.421 161 2HG PRO 97 2HG PRO 97 -8.648 -12.258 9.702 162 1HD PRO 97 1HD PRO 97 -8.308 -14.111 7.396 163 2HD PRO 97 2HD PRO 97 -8.313 -12.337 7.429 164 H ASP 98 H ASP 98 -3.610 -13.238 9.019 165 HA ASP 98 HA ASP 98 -2.357 -15.164 10.401 166 1HB ASP 98 1HB ASP 98 -3.986 -16.394 8.286 167 2HB ASP 98 2HB ASP 98 -2.309 -16.933 8.315 168 H ALA 99 H ALA 99 -2.677 -13.460 7.430 169 HA ALA 99 HA ALA 99 -0.421 -14.003 6.006 170 1HB ALA 99 1HB ALA 99 -1.702 -11.336 6.561 171 2HB ALA 99 2HB ALA 99 -0.415 -11.568 5.376 172 3HB ALA 99 3HB ALA 99 -1.959 -12.397 5.175 173 H LYS 100 H LYS 100 1.591 -12.604 5.831 174 HA LYS 100 HA LYS 100 2.788 -12.403 8.502 175 1HB LYS 100 1HB LYS 100 4.448 -12.223 6.038 176 2HB LYS 100 2HB LYS 100 4.810 -12.981 7.582 177 1HG LYS 100 1HG LYS 100 3.563 -14.904 7.049 178 2HG LYS 100 2HG LYS 100 2.787 -14.112 5.675 179 1HD LYS 100 1HD LYS 100 4.369 -15.360 4.584 180 2HD LYS 100 2HD LYS 100 5.274 -13.866 4.842 181 1HE LYS 100 1HE LYS 100 5.941 -15.061 7.095 182 2HE LYS 100 2HE LYS 100 5.547 -16.514 6.178 183 1HZ LYS 100 1HZ LYS 100 7.091 -15.600 4.421 184 2HZ LYS 100 2HZ LYS 100 7.619 -14.488 5.582 185 3HZ LYS 100 3HZ LYS 100 7.822 -16.146 5.845 186 H ALA 101 H ALA 101 1.103 -10.315 7.723 187 HA ALA 101 HA ALA 101 0.991 -8.049 7.521 188 1HB ALA 101 1HB ALA 101 3.107 -8.677 9.298 189 2HB ALA 101 2HB ALA 101 3.599 -7.278 8.342 190 3HB ALA 101 3HB ALA 101 2.095 -7.234 9.261 191 H PHE 102 H PHE 102 0.893 -7.280 5.516 192 HA PHE 102 HA PHE 102 2.660 -7.722 3.440 193 1HB PHE 102 1HB PHE 102 0.413 -5.939 3.956 194 2HB PHE 102 2HB PHE 102 1.607 -5.212 2.888 195 HD1 PHE 102 HD1 PHE 102 2.558 -7.152 1.148 196 HD2 PHE 102 HD2 PHE 102 -1.349 -6.883 2.836 197 HE1 PHE 102 HE1 PHE 102 1.655 -8.442 -0.746 198 HE2 PHE 102 HE2 PHE 102 -2.259 -8.175 0.944 199 HZ PHE 102 HZ PHE 102 -0.757 -8.955 -0.851 200 H ILE 103 H ILE 103 3.404 -5.313 2.335 201 HA ILE 103 HA ILE 103 5.808 -4.759 3.810 202 HB ILE 103 HB ILE 103 4.924 -3.207 1.400 203 1HG1 ILE 103 1HG1 ILE 103 4.523 -5.414 0.657 204 2HG1 ILE 103 2HG1 ILE 103 6.140 -5.028 0.076 205 1HG2 ILE 103 1HG2 ILE 103 7.095 -2.902 2.890 206 2HG2 ILE 103 2HG2 ILE 103 7.686 -4.194 1.844 207 3HG2 ILE 103 3HG2 ILE 103 7.123 -2.678 1.140 208 1HD1 ILE 103 1HD1 ILE 103 6.524 -6.165 2.587 209 2HD1 ILE 103 2HD1 ILE 103 5.272 -7.139 1.817 210 3HD1 ILE 103 3HD1 ILE 103 6.827 -6.907 1.016 211 H GLU 104 H GLU 104 5.283 -3.681 5.690 212 HA GLU 104 HA GLU 104 3.873 -1.118 5.418 213 1HB GLU 104 1HB GLU 104 4.427 -1.865 8.145 214 2HB GLU 104 2HB GLU 104 2.880 -1.556 7.368 215 1HG GLU 104 1HG GLU 104 2.760 -3.841 6.608 216 2HG GLU 104 2HG GLU 104 4.366 -4.171 7.256 217 H VAL 105 H VAL 105 4.703 0.327 7.480 218 HA VAL 105 HA VAL 105 6.988 1.585 6.697 219 HB VAL 105 HB VAL 105 6.395 1.357 9.630 220 1HG1 VAL 105 1HG1 VAL 105 7.747 3.246 7.822 221 2HG1 VAL 105 2HG1 VAL 105 6.751 3.975 9.082 222 3HG1 VAL 105 3HG1 VAL 105 8.057 2.874 9.518 223 1HG2 VAL 105 1HG2 VAL 105 4.607 2.334 7.508 224 2HG2 VAL 105 2HG2 VAL 105 4.237 1.781 9.142 225 3HG2 VAL 105 3HG2 VAL 105 4.822 3.424 8.878 226 H GLY 106 H GLY 106 9.163 1.469 7.121 227 1HA GLY 106 1HA GLY 106 11.129 0.637 8.078 228 2HA GLY 106 2HA GLY 106 10.182 -0.588 8.907 229 H GLN 107 H GLN 107 8.961 -2.022 7.075 230 HA GLN 107 HA GLN 107 10.938 -3.647 5.981 231 1HB GLN 107 1HB GLN 107 8.684 -4.465 6.411 232 2HB GLN 107 2HB GLN 107 8.030 -3.382 5.189 233 1HG GLN 107 1HG GLN 107 8.950 -4.621 3.433 234 2HG GLN 107 2HG GLN 107 10.063 -5.475 4.501 235 1HE2 GLN 107 2HE2 GLN 107 9.321 -7.448 3.653 236 2HE2 GLN 107 1HE2 GLN 107 7.808 -8.123 4.141 237 H LYS 108 H LYS 108 11.075 -4.211 3.579 238 HA LYS 108 HA LYS 108 11.131 -1.729 1.994 239 1HB LYS 108 1HB LYS 108 13.029 -3.946 1.393 240 2HB LYS 108 2HB LYS 108 13.220 -2.214 1.159 241 1HG LYS 108 1HG LYS 108 14.712 -2.777 2.872 242 2HG LYS 108 2HG LYS 108 13.335 -2.035 3.689 243 1HD LYS 108 1HD LYS 108 13.079 -3.867 4.921 244 2HD LYS 108 2HD LYS 108 12.828 -4.820 3.458 245 1HE LYS 108 1HE LYS 108 14.643 -5.779 4.702 246 2HE LYS 108 2HE LYS 108 15.286 -5.038 3.237 247 1HZ LYS 108 1HZ LYS 108 15.267 -3.168 5.361 248 2HZ LYS 108 2HZ LYS 108 16.085 -4.569 5.838 249 3HZ LYS 108 3HZ LYS 108 16.576 -3.732 4.452 250 H VAL 109 H VAL 109 11.083 -2.091 -0.375 251 HA VAL 109 HA VAL 109 9.624 -4.531 -1.126 252 HB VAL 109 HB VAL 109 8.516 -2.682 -2.798 253 1HG1 VAL 109 1HG1 VAL 109 7.633 -3.944 -0.245 254 2HG1 VAL 109 2HG1 VAL 109 6.581 -2.773 -1.037 255 3HG1 VAL 109 3HG1 VAL 109 7.079 -4.231 -1.894 256 1HG2 VAL 109 1HG2 VAL 109 9.690 -0.970 -1.215 257 2HG2 VAL 109 2HG2 VAL 109 8.037 -0.681 -1.757 258 3HG2 VAL 109 3HG2 VAL 109 8.335 -1.327 -0.143 259 H ASN 110 H ASN 110 10.492 -5.516 -2.828 260 HA ASN 110 HA ASN 110 12.424 -4.040 -4.462 261 1HB ASN 110 1HB ASN 110 11.995 -7.016 -4.320 262 2HB ASN 110 2HB ASN 110 13.337 -6.182 -5.092 263 1HD2 ASN 110 2HD2 ASN 110 14.889 -5.149 -3.786 264 2HD2 ASN 110 1HD2 ASN 110 15.114 -5.606 -2.135 265 H VAL 111 H VAL 111 12.105 -3.642 -6.567 266 HA VAL 111 HA VAL 111 9.736 -3.514 -7.816 267 HB VAL 111 HB VAL 111 12.346 -4.268 -9.136 268 1HG1 VAL 111 1HG1 VAL 111 9.809 -4.313 -10.268 269 2HG1 VAL 111 2HG1 VAL 111 10.495 -2.768 -10.769 270 3HG1 VAL 111 3HG1 VAL 111 11.349 -4.269 -11.124 271 1HG2 VAL 111 1HG2 VAL 111 11.437 -1.875 -7.893 272 2HG2 VAL 111 2HG2 VAL 111 12.965 -2.177 -8.721 273 3HG2 VAL 111 3HG2 VAL 111 11.571 -1.590 -9.629 274 H GLY 112 H GLY 112 8.230 -5.094 -7.655 275 1HA GLY 112 1HA GLY 112 7.406 -6.950 -9.089 276 2HA GLY 112 2HA GLY 112 8.947 -7.733 -8.778 277 H ASP 113 H ASP 113 8.501 -6.446 -5.930 278 HA ASP 113 HA ASP 113 7.338 -8.856 -4.827 279 1HB ASP 113 1HB ASP 113 9.153 -6.822 -3.923 280 2HB ASP 113 2HB ASP 113 7.844 -7.003 -2.761 281 H THR 114 H THR 114 5.438 -9.018 -3.710 282 HA THR 114 HA THR 114 3.276 -7.462 -4.414 283 HB THR 114 HB THR 114 3.233 -8.709 -1.711 284 HG1 THR 114 HG1 THR 114 2.966 -10.766 -3.009 285 1HG2 THR 114 1HG2 THR 114 1.172 -7.889 -2.825 286 2HG2 THR 114 2HG2 THR 114 1.420 -9.108 -4.075 287 3HG2 THR 114 3HG2 THR 114 1.137 -9.601 -2.406 288 H LEU 115 H LEU 115 2.071 -5.844 -3.388 289 HA LEU 115 HA LEU 115 3.644 -4.175 -1.554 290 1HB LEU 115 1HB LEU 115 2.884 -3.225 -3.751 291 2HB LEU 115 2HB LEU 115 1.231 -3.386 -3.187 292 HG LEU 115 HG LEU 115 2.265 -1.949 -1.151 293 1HD1 LEU 115 1HD1 LEU 115 4.258 -1.841 -3.163 294 2HD1 LEU 115 2HD1 LEU 115 3.497 -0.253 -3.066 295 3HD1 LEU 115 3HD1 LEU 115 4.201 -0.983 -1.623 296 1HD2 LEU 115 1HD2 LEU 115 0.245 -1.439 -2.438 297 2HD2 LEU 115 2HD2 LEU 115 1.240 -0.003 -2.196 298 3HD2 LEU 115 3HD2 LEU 115 1.243 -0.824 -3.757 299 H CYS 116 H CYS 116 0.147 -4.487 -2.128 300 HA CYS 116 HA CYS 116 -0.539 -5.688 0.290 301 1HB CYS 116 1HB CYS 116 -1.579 -3.382 1.201 302 2HB CYS 116 2HB CYS 116 -0.001 -3.983 1.697 303 HG CYS 116 HG CYS 116 0.007 -2.029 -0.676 304 H ILE 117 H ILE 117 -2.866 -5.638 0.710 305 HA ILE 117 HA ILE 117 -4.357 -5.687 -1.707 306 HB ILE 117 HB ILE 117 -5.055 -6.084 1.183 307 1HG1 ILE 117 1HG1 ILE 117 -5.729 -7.886 -1.120 308 2HG1 ILE 117 2HG1 ILE 117 -4.086 -7.842 -0.481 309 1HG2 ILE 117 1HG2 ILE 117 -6.916 -4.788 0.264 310 2HG2 ILE 117 2HG2 ILE 117 -7.074 -5.953 -1.050 311 3HG2 ILE 117 3HG2 ILE 117 -7.394 -6.449 0.612 312 1HD1 ILE 117 1HD1 ILE 117 -5.787 -8.098 1.734 313 2HD1 ILE 117 2HD1 ILE 117 -6.374 -9.225 0.511 314 3HD1 ILE 117 3HD1 ILE 117 -4.697 -9.306 1.053 315 H VAL 118 H VAL 118 -6.369 -4.505 -2.082 316 HA VAL 118 HA VAL 118 -6.262 -1.747 -1.047 317 HB VAL 118 HB VAL 118 -7.326 -2.421 -3.773 318 1HG1 VAL 118 1HG1 VAL 118 -7.276 -0.107 -2.232 319 2HG1 VAL 118 2HG1 VAL 118 -6.005 0.124 -3.433 320 3HG1 VAL 118 3HG1 VAL 118 -7.654 -0.230 -3.950 321 1HG2 VAL 118 1HG2 VAL 118 -4.798 -3.066 -3.241 322 2HG2 VAL 118 2HG2 VAL 118 -5.291 -2.373 -4.786 323 3HG2 VAL 118 3HG2 VAL 118 -4.574 -1.344 -3.546 324 H GLU 119 H GLU 119 -8.229 -4.460 -2.056 325 HA GLU 119 HA GLU 119 -10.458 -4.917 -1.885 326 1HB GLU 119 1HB GLU 119 -9.936 -3.368 0.656 327 2HB GLU 119 2HB GLU 119 -11.468 -4.163 0.328 328 1HG GLU 119 1HG GLU 119 -10.659 -6.195 0.796 329 2HG GLU 119 2HG GLU 119 -9.118 -5.882 -0.001 330 H ALA 120 H ALA 120 -10.252 -3.069 -3.717 331 HA ALA 120 HA ALA 120 -11.727 -0.673 -3.102 332 1HB ALA 120 1HB ALA 120 -9.956 -1.410 -5.091 333 2HB ALA 120 2HB ALA 120 -11.505 -1.304 -5.928 334 3HB ALA 120 3HB ALA 120 -10.893 0.083 -5.028 335 H MET 121 H MET 121 -12.379 -3.771 -4.628 336 HA MET 121 HA MET 121 -15.236 -3.229 -4.420 337 1HB MET 121 1HB MET 121 -15.639 -4.172 -6.668 338 2HB MET 121 2HB MET 121 -14.705 -2.685 -6.727 339 1HG MET 121 1HG MET 121 -12.672 -3.914 -7.091 340 2HG MET 121 2HG MET 121 -13.518 -5.445 -6.877 341 1HE MET 121 1HE MET 121 -14.349 -6.739 -8.381 342 2HE MET 121 2HE MET 121 -15.806 -5.995 -9.039 343 3HE MET 121 3HE MET 121 -14.509 -6.502 -10.122 344 H LYS 122 H LYS 122 -14.076 -4.706 -2.583 345 HA LYS 122 HA LYS 122 -13.862 -6.770 -1.623 346 1HB LYS 122 1HB LYS 122 -16.441 -6.518 -2.817 347 2HB LYS 122 2HB LYS 122 -15.916 -8.186 -2.999 348 1HG LYS 122 1HG LYS 122 -16.414 -6.625 -0.502 349 2HG LYS 122 2HG LYS 122 -17.036 -8.206 -0.979 350 1HD LYS 122 1HD LYS 122 -15.437 -9.078 0.314 351 2HD LYS 122 2HD LYS 122 -14.295 -8.566 -0.930 352 1HE LYS 122 1HE LYS 122 -13.616 -6.725 0.258 353 2HE LYS 122 2HE LYS 122 -15.144 -6.589 1.127 354 H MET 123 H MET 123 -12.449 -6.284 -4.190 355 HA MET 123 HA MET 123 -12.396 -8.909 -5.440 356 1HB MET 123 1HB MET 123 -10.622 -7.773 -6.892 357 2HB MET 123 2HB MET 123 -12.270 -7.172 -7.020 358 1HG MET 123 1HG MET 123 -11.773 -5.245 -5.761 359 2HG MET 123 2HG MET 123 -10.230 -5.904 -5.221 360 1HE MET 123 1HE MET 123 -9.502 -3.612 -5.648 361 2HE MET 123 2HE MET 123 -8.698 -3.156 -7.151 362 3HE MET 123 3HE MET 123 -10.399 -2.760 -6.904 363 H MET 124 H MET 124 -10.582 -7.027 -3.159 364 HA MET 124 HA MET 124 -8.831 -7.559 -1.817 365 1HB MET 124 1HB MET 124 -9.938 -10.096 -2.564 366 2HB MET 124 2HB MET 124 -8.185 -10.228 -2.534 367 1HG MET 124 1HG MET 124 -9.433 -10.769 -0.395 368 2HG MET 124 2HG MET 124 -8.063 -9.667 -0.272 369 1HE MET 124 1HE MET 124 -11.873 -10.160 -0.110 370 2HE MET 124 2HE MET 124 -12.511 -8.525 0.070 371 3HE MET 124 3HE MET 124 -11.831 -9.042 -1.473 372 H ASN 125 H ASN 125 -8.463 -6.453 -4.407 373 HA ASN 125 HA ASN 125 -6.185 -7.727 -5.627 374 1HB ASN 125 1HB ASN 125 -6.307 -6.076 -7.275 375 2HB ASN 125 2HB ASN 125 -7.986 -6.240 -6.766 376 1HD2 ASN 125 2HD2 ASN 125 -6.161 -4.014 -7.859 377 2HD2 ASN 125 1HD2 ASN 125 -6.547 -2.664 -6.852 378 H GLN 126 H GLN 126 -4.165 -7.549 -4.950 379 HA GLN 126 HA GLN 126 -3.459 -5.233 -3.279 380 1HB GLN 126 1HB GLN 126 -1.772 -6.636 -2.225 381 2HB GLN 126 2HB GLN 126 -3.362 -7.377 -2.098 382 1HG GLN 126 1HG GLN 126 -1.988 -8.259 -4.475 383 2HG GLN 126 2HG GLN 126 -1.029 -8.558 -3.025 384 1HE2 GLN 126 1HE2 GLN 126 -2.652 -10.271 -4.945 385 2HE2 GLN 126 2HE2 GLN 126 -3.619 -11.254 -3.903 386 H ILE 127 H ILE 127 -2.038 -3.854 -4.055 387 HA ILE 127 HA ILE 127 -0.878 -4.155 -6.618 388 HB ILE 127 HB ILE 127 -0.010 -2.164 -4.532 389 1HG1 ILE 127 1HG1 ILE 127 -2.304 -1.816 -4.479 390 2HG1 ILE 127 2HG1 ILE 127 -1.812 -0.727 -5.774 391 1HG2 ILE 127 1HG2 ILE 127 0.152 -2.349 -7.508 392 2HG2 ILE 127 2HG2 ILE 127 0.129 -0.771 -6.720 393 3HG2 ILE 127 3HG2 ILE 127 1.403 -1.929 -6.339 394 1HD1 ILE 127 1HD1 ILE 127 -2.311 -2.910 -7.223 395 2HD1 ILE 127 2HD1 ILE 127 -3.410 -3.205 -5.875 396 3HD1 ILE 127 3HD1 ILE 127 -3.547 -1.720 -6.817 397 H GLU 128 H GLU 128 1.498 -3.823 -7.015 398 HA GLU 128 HA GLU 128 3.177 -5.154 -5.011 399 1HB GLU 128 1HB GLU 128 3.408 -5.841 -7.931 400 2HB GLU 128 2HB GLU 128 4.085 -6.693 -6.551 401 1HG GLU 128 1HG GLU 128 2.369 -8.085 -6.784 402 2HG GLU 128 2HG GLU 128 1.399 -6.808 -6.046 403 H ALA 129 H ALA 129 4.762 -3.797 -4.533 404 HA ALA 129 HA ALA 129 5.472 -1.464 -5.679 405 1HB ALA 129 1HB ALA 129 7.138 -3.484 -4.228 406 2HB ALA 129 2HB ALA 129 7.850 -1.981 -4.816 407 3HB ALA 129 3HB ALA 129 6.518 -1.934 -3.660 408 H ASP 130 H ASP 130 7.022 -0.723 -7.168 409 HA ASP 130 HA ASP 130 8.386 -2.626 -8.874 410 1HB ASP 130 1HB ASP 130 7.387 -1.771 -10.953 411 2HB ASP 130 2HB ASP 130 6.170 -2.514 -9.916 412 H LYS 131 H LYS 131 8.822 -0.223 -7.041 413 HA LYS 131 HA LYS 131 10.445 1.353 -8.930 414 1HB LYS 131 1HB LYS 131 8.934 2.217 -6.472 415 2HB LYS 131 2HB LYS 131 10.233 3.187 -7.153 416 1HG LYS 131 1HG LYS 131 8.705 2.713 -9.351 417 2HG LYS 131 2HG LYS 131 7.485 2.798 -8.078 418 1HD LYS 131 1HD LYS 131 7.604 5.017 -8.272 419 2HD LYS 131 2HD LYS 131 9.198 4.908 -7.523 420 1HE LYS 131 1HE LYS 131 10.026 4.437 -9.931 421 2HE LYS 131 2HE LYS 131 8.479 5.128 -10.421 422 1HZ LYS 131 1HZ LYS 131 9.360 6.943 -8.655 423 2HZ LYS 131 2HZ LYS 131 10.819 6.429 -9.336 424 3HZ LYS 131 3HZ LYS 131 9.597 7.049 -10.327 425 H SER 132 H SER 132 10.437 -0.674 -6.213 426 HA SER 132 HA SER 132 12.098 -1.487 -4.888 427 1HB SER 132 1HB SER 132 13.604 -0.248 -7.133 428 2HB SER 132 2HB SER 132 14.515 -0.628 -5.671 429 HG SER 132 HG SER 132 14.564 -2.429 -6.959 430 H GLY 133 H GLY 133 12.784 -0.892 -2.912 431 1HA GLY 133 1HA GLY 133 14.238 1.099 -1.955 432 2HA GLY 133 2HA GLY 133 12.743 1.960 -2.286 433 H THR 134 H THR 134 13.251 2.227 0.174 434 HA THR 134 HA THR 134 12.008 0.015 1.663 435 HB THR 134 HB THR 134 13.733 2.302 2.634 436 HG1 THR 134 HG1 THR 134 14.212 -0.487 2.455 437 1HG2 THR 134 1HG2 THR 134 11.864 1.117 4.169 438 2HG2 THR 134 2HG2 THR 134 13.228 0.027 4.414 439 3HG2 THR 134 3HG2 THR 134 13.397 1.744 4.775 440 H VAL 135 H VAL 135 10.198 0.334 2.881 441 HA VAL 135 HA VAL 135 8.533 2.551 2.202 442 HB VAL 135 HB VAL 135 8.137 0.375 4.260 443 1HG1 VAL 135 1HG1 VAL 135 6.211 2.432 3.188 444 2HG1 VAL 135 2HG1 VAL 135 5.748 1.030 4.153 445 3HG1 VAL 135 3HG1 VAL 135 6.785 2.277 4.848 446 1HG2 VAL 135 1HG2 VAL 135 7.467 0.640 1.363 447 2HG2 VAL 135 2HG2 VAL 135 8.113 -0.743 2.245 448 3HG2 VAL 135 3HG2 VAL 135 6.414 -0.304 2.416 449 H LYS 136 H LYS 136 8.687 4.505 3.065 450 HA LYS 136 HA LYS 136 10.128 5.031 5.464 451 1HB LYS 136 1HB LYS 136 9.238 6.527 3.284 452 2HB LYS 136 2HB LYS 136 8.347 7.177 4.654 453 1HG LYS 136 1HG LYS 136 11.337 6.848 4.601 454 2HG LYS 136 2HG LYS 136 10.493 8.336 4.167 455 1HD LYS 136 1HD LYS 136 9.784 8.722 6.336 456 2HD LYS 136 2HD LYS 136 9.944 7.027 6.798 457 1HE LYS 136 1HE LYS 136 12.464 7.382 6.404 458 2HE LYS 136 2HE LYS 136 12.084 9.102 6.474 459 1HZ LYS 136 1HZ LYS 136 11.070 8.690 8.675 460 2HZ LYS 136 2HZ LYS 136 11.615 7.090 8.606 461 3HZ LYS 136 3HZ LYS 136 12.730 8.362 8.636 462 H ALA 137 H ALA 137 6.679 5.084 4.619 463 HA ALA 137 HA ALA 137 5.728 4.093 7.006 464 1HB ALA 137 1HB ALA 137 6.218 7.030 7.085 465 2HB ALA 137 2HB ALA 137 4.804 6.374 7.911 466 3HB ALA 137 3HB ALA 137 6.419 5.818 8.350 467 H ILE 138 H ILE 138 3.451 4.076 7.145 468 HA ILE 138 HA ILE 138 2.140 4.764 4.619 469 HB ILE 138 HB ILE 138 1.383 2.899 6.862 470 1HG1 ILE 138 1HG1 ILE 138 2.189 2.597 3.983 471 2HG1 ILE 138 2HG1 ILE 138 2.860 1.808 5.406 472 1HG2 ILE 138 1HG2 ILE 138 -0.302 3.850 4.559 473 2HG2 ILE 138 2HG2 ILE 138 -0.632 2.359 5.442 474 3HG2 ILE 138 3HG2 ILE 138 -0.677 3.909 6.281 475 1HD1 ILE 138 1HD1 ILE 138 0.749 0.530 5.624 476 2HD1 ILE 138 2HD1 ILE 138 0.207 1.247 4.107 477 3HD1 ILE 138 3HD1 ILE 138 1.629 0.205 4.131 478 H LEU 139 H LEU 139 0.426 6.137 4.476 479 HA LEU 139 HA LEU 139 -0.186 7.710 6.880 480 1HB LEU 139 1HB LEU 139 -0.070 8.289 3.985 481 2HB LEU 139 2HB LEU 139 -1.365 9.077 4.867 482 HG LEU 139 HG LEU 139 0.068 10.410 6.071 483 1HD1 LEU 139 1HD1 LEU 139 2.057 8.196 5.733 484 2HD1 LEU 139 2HD1 LEU 139 2.559 9.806 6.251 485 3HD1 LEU 139 3HD1 LEU 139 1.403 8.889 7.218 486 1HD2 LEU 139 1HD2 LEU 139 1.086 9.881 3.347 487 2HD2 LEU 139 2HD2 LEU 139 0.512 11.381 4.077 488 3HD2 LEU 139 3HD2 LEU 139 2.142 10.800 4.422 489 H VAL 140 H VAL 140 -1.768 6.208 4.079 490 HA VAL 140 HA VAL 140 -4.375 6.640 4.459 491 HB VAL 140 HB VAL 140 -3.022 4.037 3.787 492 1HG1 VAL 140 1HG1 VAL 140 -5.976 4.602 3.933 493 2HG1 VAL 140 2HG1 VAL 140 -5.289 3.279 2.992 494 3HG1 VAL 140 3HG1 VAL 140 -5.076 3.320 4.742 495 1HG2 VAL 140 1HG2 VAL 140 -2.995 6.056 2.247 496 2HG2 VAL 140 2HG2 VAL 140 -3.589 4.545 1.558 497 3HG2 VAL 140 3HG2 VAL 140 -4.727 5.798 2.051 498 H GLU 141 H GLU 141 -5.874 6.353 5.944 499 HA GLU 141 HA GLU 141 -5.253 5.403 8.533 500 1HB GLU 141 1HB GLU 141 -7.871 6.125 7.210 501 2HB GLU 141 2HB GLU 141 -7.754 5.637 8.896 502 1HG GLU 141 1HG GLU 141 -7.547 7.820 9.296 503 2HG GLU 141 2HG GLU 141 -5.877 7.594 8.778 504 H SER 142 H SER 142 -4.428 3.345 7.380 505 HA SER 142 HA SER 142 -5.715 1.323 6.286 506 1HB SER 142 1HB SER 142 -3.386 1.361 7.304 507 2HB SER 142 2HB SER 142 -4.143 0.837 8.808 508 HG SER 142 HG SER 142 -4.303 -0.522 6.319 509 H GLY 143 H GLY 143 -6.979 -0.523 6.964 510 1HA GLY 143 1HA GLY 143 -8.536 -1.639 8.276 511 2HA GLY 143 2HA GLY 143 -8.241 -0.476 9.563 512 H GLN 144 H GLN 144 -8.708 1.357 6.923 513 HA GLN 144 HA GLN 144 -11.638 1.398 7.159 514 1HB GLN 144 1HB GLN 144 -9.855 3.842 7.143 515 2HB GLN 144 2HB GLN 144 -11.612 3.840 7.215 516 1HG GLN 144 1HG GLN 144 -11.223 2.406 9.365 517 2HG GLN 144 2HG GLN 144 -9.626 3.150 9.321 518 1HE2 GLN 144 2HE2 GLN 144 -10.507 5.625 8.183 519 2HE2 GLN 144 1HE2 GLN 144 -11.364 6.476 9.418 520 HA PRO 145 HA PRO 145 -11.594 1.736 2.763 521 1HB PRO 145 1HB PRO 145 -13.882 3.044 2.256 522 2HB PRO 145 2HB PRO 145 -13.875 1.415 2.941 523 1HG PRO 145 1HG PRO 145 -14.257 4.047 4.316 524 2HG PRO 145 2HG PRO 145 -15.132 2.523 4.553 525 1HD PRO 145 1HD PRO 145 -13.108 3.389 6.185 526 2HD PRO 145 2HD PRO 145 -13.527 1.680 5.954 527 H VAL 146 H VAL 146 -10.065 2.971 1.823 528 HA VAL 146 HA VAL 146 -9.713 5.740 2.311 529 HB VAL 146 HB VAL 146 -8.072 5.712 0.542 530 1HG1 VAL 146 1HG1 VAL 146 -8.125 3.775 2.674 531 2HG1 VAL 146 2HG1 VAL 146 -7.160 3.193 1.317 532 3HG1 VAL 146 3HG1 VAL 146 -6.781 4.743 2.069 533 1HG2 VAL 146 1HG2 VAL 146 -9.721 4.056 -0.797 534 2HG2 VAL 146 2HG2 VAL 146 -8.018 4.277 -1.199 535 3HG2 VAL 146 3HG2 VAL 146 -8.521 2.899 -0.218 536 H GLU 147 H GLU 147 -9.559 7.261 0.277 537 HA GLU 147 HA GLU 147 -11.860 6.884 -1.489 538 1HB GLU 147 1HB GLU 147 -11.446 9.440 0.065 539 2HB GLU 147 2HB GLU 147 -12.785 9.053 -1.012 540 1HG GLU 147 1HG GLU 147 -12.796 7.016 0.872 541 2HG GLU 147 2HG GLU 147 -12.442 8.476 1.795 542 H PHE 148 H PHE 148 -9.623 6.495 -2.628 543 HA PHE 148 HA PHE 148 -8.127 7.155 -4.209 544 1HB PHE 148 1HB PHE 148 -9.843 7.789 -5.624 545 2HB PHE 148 2HB PHE 148 -10.396 9.060 -4.545 546 HD1 PHE 148 HD1 PHE 148 -7.620 8.145 -6.835 547 HD2 PHE 148 HD2 PHE 148 -9.782 11.276 -4.910 548 HE1 PHE 148 HE1 PHE 148 -6.399 9.810 -8.182 549 HE2 PHE 148 HE2 PHE 148 -8.567 12.947 -6.254 550 HZ PHE 148 HZ PHE 148 -6.872 12.215 -7.892 551 H ASP 149 H ASP 149 -6.459 8.708 -4.752 552 HA ASP 149 HA ASP 149 -4.754 10.081 -4.123 553 1HB ASP 149 1HB ASP 149 -7.130 11.579 -4.132 554 2HB ASP 149 2HB ASP 149 -6.281 12.055 -2.665 555 H GLU 150 H GLU 150 -5.317 7.964 -2.334 556 HA GLU 150 HA GLU 150 -4.700 9.189 0.270 557 1HB GLU 150 1HB GLU 150 -6.644 7.290 -0.408 558 2HB GLU 150 2HB GLU 150 -5.382 6.380 0.411 559 1HG GLU 150 1HG GLU 150 -7.161 8.520 1.451 560 2HG GLU 150 2HG GLU 150 -6.707 6.977 2.173 561 HA PRO 151 HA PRO 151 -0.589 7.602 -0.589 562 1HB PRO 151 1HB PRO 151 0.387 8.249 1.913 563 2HB PRO 151 2HB PRO 151 0.330 9.357 0.538 564 1HG PRO 151 1HG PRO 151 -1.555 9.094 2.843 565 2HG PRO 151 2HG PRO 151 -0.955 10.560 2.046 566 1HD PRO 151 1HD PRO 151 -3.414 9.608 1.558 567 2HD PRO 151 2HD PRO 151 -2.439 10.353 0.274 568 H LEU 152 H LEU 152 -1.188 5.401 -0.659 569 HA LEU 152 HA LEU 152 -1.853 3.850 1.590 570 1HB LEU 152 1HB LEU 152 -0.622 3.059 -1.047 571 2HB LEU 152 2HB LEU 152 -1.210 1.914 0.147 572 HG LEU 152 HG LEU 152 -3.100 4.001 -0.821 573 1HD1 LEU 152 1HD1 LEU 152 -1.944 1.823 -2.484 574 2HD1 LEU 152 2HD1 LEU 152 -3.666 2.172 -2.627 575 3HD1 LEU 152 3HD1 LEU 152 -2.481 3.437 -2.947 576 1HD2 LEU 152 1HD2 LEU 152 -3.441 2.098 0.946 577 2HD2 LEU 152 2HD2 LEU 152 -4.718 2.490 -0.206 578 3HD2 LEU 152 3HD2 LEU 152 -3.675 1.095 -0.486 579 H VAL 153 H VAL 153 1.257 4.196 -0.122 580 HA VAL 153 HA VAL 153 2.681 3.818 2.371 581 HB VAL 153 HB VAL 153 3.439 1.981 0.123 582 1HG1 VAL 153 1HG1 VAL 153 4.358 2.547 2.808 583 2HG1 VAL 153 2HG1 VAL 153 4.006 0.833 2.583 584 3HG1 VAL 153 3HG1 VAL 153 5.147 1.648 1.512 585 1HG2 VAL 153 1HG2 VAL 153 1.068 1.545 0.763 586 2HG2 VAL 153 2HG2 VAL 153 2.159 0.196 1.081 587 3HG2 VAL 153 3HG2 VAL 153 1.621 1.228 2.406 588 H VAL 154 H VAL 154 4.384 5.127 2.407 589 HA VAL 154 HA VAL 154 5.360 6.219 -0.139 590 HB VAL 154 HB VAL 154 6.116 8.132 1.016 591 1HG1 VAL 154 1HG1 VAL 154 3.547 7.647 0.845 592 2HG1 VAL 154 2HG1 VAL 154 3.648 7.613 2.605 593 3HG1 VAL 154 3HG1 VAL 154 4.138 9.059 1.721 594 1HG2 VAL 154 1HG2 VAL 154 5.999 6.365 3.398 595 2HG2 VAL 154 2HG2 VAL 154 7.228 7.533 2.913 596 3HG2 VAL 154 3HG2 VAL 154 5.721 8.089 3.641 597 H ILE 155 H ILE 155 7.251 5.532 -0.887 598 HA ILE 155 HA ILE 155 9.073 4.142 0.941 599 HB ILE 155 HB ILE 155 9.345 4.194 -2.051 600 1HG1 ILE 155 1HG1 ILE 155 8.142 1.771 -1.379 601 2HG1 ILE 155 2HG1 ILE 155 7.229 2.972 -0.470 602 1HG2 ILE 155 1HG2 ILE 155 11.146 3.334 -0.443 603 2HG2 ILE 155 2HG2 ILE 155 10.056 1.977 -0.160 604 3HG2 ILE 155 3HG2 ILE 155 10.671 2.290 -1.783 605 1HD1 ILE 155 1HD1 ILE 155 7.239 4.212 -2.802 606 2HD1 ILE 155 2HD1 ILE 155 7.448 2.564 -3.394 607 3HD1 ILE 155 3HD1 ILE 155 6.046 2.975 -2.404 608 H GLU 156 H GLU 156 11.061 4.882 1.401 609 HA GLU 156 HA GLU 156 11.743 7.567 0.665 610 1HB GLU 156 1HB GLU 156 12.275 6.799 2.890 611 2HB GLU 156 2HB GLU 156 13.229 5.469 2.251 612 1HG GLU 156 1HG GLU 156 14.956 6.833 2.641 613 2HG GLU 156 2HG GLU 156 14.483 7.571 1.111 614 1H10 BTN 222 1H10 BTN 122 -13.661 -5.441 3.351 615 2H10 BTN 222 2H10 BTN 122 -12.154 -6.306 3.051 616 1H9 BTN 222 1H9 BTN 122 -13.716 -6.223 5.626 617 2H9 BTN 222 2H9 BTN 122 -12.139 -5.496 5.310 618 1H8 BTN 222 1H8 BTN 122 -12.150 -8.324 4.694 619 2H8 BTN 222 2H8 BTN 122 -12.626 -8.021 6.367 620 1H7 BTN 222 1H7 BTN 122 -10.325 -8.201 6.505 621 2H7 BTN 222 2H7 BTN 122 -10.593 -6.464 6.450 622 H2 BTN 222 H2 BTN 122 -9.812 -6.295 4.229 623 1H6 BTN 222 1H6 BTN 122 -9.486 -10.270 5.005 624 2H6 BTN 222 2H6 BTN 122 -8.512 -10.469 3.556 625 H5 BTN 222 H5 BTN 122 -6.910 -8.991 4.297 626 HN1 BTN 222 HN2 BTN 122 -7.255 -10.261 6.486 627 HN2 BTN 222 HN1 BTN 122 -8.365 -6.472 6.968 628 H4 BTN 222 H4 BTN 122 -7.592 -6.804 4.551 Start of MODEL 10 1 1H GLU 77 H GLU 77 12.606 16.993 3.333 2 HA GLU 77 HA GLU 77 11.708 17.642 0.713 3 1HB GLU 77 1HB GLU 77 14.004 18.637 0.058 4 2HB GLU 77 2HB GLU 77 12.824 19.685 0.836 5 1HG GLU 77 1HG GLU 77 13.994 19.131 3.018 6 2HG GLU 77 2HG GLU 77 15.278 18.437 2.029 7 H ILE 78 H ILE 78 11.802 15.217 1.543 8 HA ILE 78 HA ILE 78 14.373 13.954 1.208 9 HB ILE 78 HB ILE 78 12.956 11.831 1.324 10 1HG1 ILE 78 1HG1 ILE 78 10.785 13.330 2.610 11 2HG1 ILE 78 2HG1 ILE 78 10.877 13.563 0.868 12 1HG2 ILE 78 1HG2 ILE 78 13.149 13.842 3.539 13 2HG2 ILE 78 2HG2 ILE 78 12.488 12.229 3.807 14 3HG2 ILE 78 3HG2 ILE 78 14.150 12.421 3.245 15 1HD1 ILE 78 1HD1 ILE 78 11.106 10.889 0.999 16 2HD1 ILE 78 2HD1 ILE 78 10.117 11.192 2.427 17 3HD1 ILE 78 3HD1 ILE 78 9.570 11.740 0.843 18 H SER 79 H SER 79 14.926 12.476 -0.441 19 HA SER 79 HA SER 79 13.654 13.082 -3.004 20 1HB SER 79 1HB SER 79 16.354 12.559 -2.153 21 2HB SER 79 2HB SER 79 15.894 11.407 -3.405 22 HG SER 79 HG SER 79 15.018 13.534 -4.401 23 H GLY 80 H GLY 80 11.827 11.676 -2.056 24 1HA GLY 80 1HA GLY 80 12.340 8.870 -2.836 25 2HA GLY 80 2HA GLY 80 11.274 9.305 -1.508 26 H HIS 81 H HIS 81 9.473 8.303 -2.383 27 HA HIS 81 HA HIS 81 8.033 9.871 -4.319 28 1HB HIS 81 1HB HIS 81 7.609 7.490 -5.537 29 2HB HIS 81 2HB HIS 81 8.800 8.668 -6.079 30 HD1 HIS 81 HD1 HIS 81 10.340 6.851 -7.053 31 HD2 HIS 81 HD2 HIS 81 9.612 6.437 -2.983 32 HE1 HIS 81 HE1 HIS 81 12.009 5.155 -6.241 33 HE2 HIS 81 HE2 HIS 81 11.605 4.984 -3.760 34 H ILE 82 H ILE 82 6.252 10.129 -3.125 35 HA ILE 82 HA ILE 82 5.233 8.111 -1.374 36 HB ILE 82 HB ILE 82 4.054 10.732 -2.294 37 1HG1 ILE 82 1HG1 ILE 82 4.661 11.520 -0.075 38 2HG1 ILE 82 2HG1 ILE 82 5.236 9.916 0.370 39 1HG2 ILE 82 1HG2 ILE 82 2.758 8.526 -1.046 40 2HG2 ILE 82 2HG2 ILE 82 2.863 9.851 0.113 41 3HG2 ILE 82 3HG2 ILE 82 2.099 10.110 -1.456 42 1HD1 ILE 82 1HD1 ILE 82 6.429 11.526 -1.866 43 2HD1 ILE 82 2HD1 ILE 82 7.008 11.590 -0.202 44 3HD1 ILE 82 3HD1 ILE 82 7.080 10.076 -1.103 45 H VAL 83 H VAL 83 3.769 6.570 -1.761 46 HA VAL 83 HA VAL 83 2.644 6.379 -4.450 47 HB VAL 83 HB VAL 83 2.641 4.354 -2.207 48 1HG1 VAL 83 1HG1 VAL 83 1.449 4.394 -4.916 49 2HG1 VAL 83 2HG1 VAL 83 2.223 2.896 -4.403 50 3HG1 VAL 83 3HG1 VAL 83 0.907 3.580 -3.450 51 1HG2 VAL 83 1HG2 VAL 83 4.413 4.706 -4.614 52 2HG2 VAL 83 2HG2 VAL 83 4.882 4.646 -2.915 53 3HG2 VAL 83 3HG2 VAL 83 4.296 3.190 -3.720 54 H ARG 84 H ARG 84 0.873 7.678 -4.544 55 HA ARG 84 HA ARG 84 -1.063 7.747 -2.404 56 1HB ARG 84 1HB ARG 84 -0.632 9.179 -4.962 57 2HB ARG 84 2HB ARG 84 -2.298 9.046 -4.417 58 1HG ARG 84 1HG ARG 84 -1.957 10.372 -2.589 59 2HG ARG 84 2HG ARG 84 -0.244 9.960 -2.473 60 1HD ARG 84 1HD ARG 84 0.362 11.467 -4.121 61 2HD ARG 84 2HD ARG 84 -1.252 11.497 -4.830 62 HE ARG 84 HE ARG 84 -1.226 12.560 -2.183 63 1HH1 ARG 84 1HH1 ARG 84 -0.506 13.305 -5.507 64 2HH1 ARG 84 2HH1 ARG 84 -0.741 15.010 -5.312 65 1HH2 ARG 84 1HH2 ARG 84 -1.541 14.802 -1.914 66 2HH2 ARG 84 2HH2 ARG 84 -1.329 15.861 -3.268 67 H SER 85 H SER 85 -3.364 7.325 -2.792 68 HA SER 85 HA SER 85 -3.705 4.759 -4.072 69 1HB SER 85 1HB SER 85 -5.762 6.458 -2.646 70 2HB SER 85 2HB SER 85 -5.907 4.748 -3.047 71 HG SER 85 HG SER 85 -5.139 5.511 -0.819 72 HA PRO 86 HA PRO 86 -5.599 6.374 -7.724 73 1HB PRO 86 1HB PRO 86 -6.586 4.059 -8.712 74 2HB PRO 86 2HB PRO 86 -4.860 4.424 -8.674 75 1HG PRO 86 1HG PRO 86 -6.413 2.538 -7.031 76 2HG PRO 86 2HG PRO 86 -4.683 2.550 -7.399 77 1HD PRO 86 1HD PRO 86 -5.984 3.460 -5.017 78 2HD PRO 86 2HD PRO 86 -4.253 3.508 -5.400 79 H MET 87 H MET 87 -7.793 3.746 -6.793 80 HA MET 87 HA MET 87 -9.994 5.705 -6.738 81 1HB MET 87 1HB MET 87 -10.183 4.256 -8.678 82 2HB MET 87 2HB MET 87 -10.030 2.828 -7.664 83 1HG MET 87 1HG MET 87 -12.154 3.099 -6.752 84 2HG MET 87 2HG MET 87 -12.256 4.784 -7.255 85 1HE MET 87 1HE MET 87 -14.462 4.548 -7.930 86 2HE MET 87 2HE MET 87 -14.044 5.257 -9.491 87 3HE MET 87 3HE MET 87 -15.061 3.818 -9.420 88 H VAL 88 H VAL 88 -10.936 5.933 -4.831 89 HA VAL 88 HA VAL 88 -10.332 4.881 -2.470 90 HB VAL 88 HB VAL 88 -13.081 5.583 -3.466 91 1HG1 VAL 88 1HG1 VAL 88 -12.265 4.433 -0.868 92 2HG1 VAL 88 2HG1 VAL 88 -13.372 5.806 -0.815 93 3HG1 VAL 88 3HG1 VAL 88 -13.813 4.352 -1.712 94 1HG2 VAL 88 1HG2 VAL 88 -10.829 7.008 -2.218 95 2HG2 VAL 88 2HG2 VAL 88 -12.075 7.594 -3.320 96 3HG2 VAL 88 3HG2 VAL 88 -12.429 7.419 -1.602 97 H GLY 89 H GLY 89 -10.718 3.112 -1.213 98 1HA GLY 89 1HA GLY 89 -12.517 1.018 -2.044 99 2HA GLY 89 2HA GLY 89 -10.820 0.600 -2.234 100 H THR 90 H THR 90 -9.751 -0.181 -0.518 101 HA THR 90 HA THR 90 -10.451 0.512 2.177 102 HB THR 90 HB THR 90 -10.783 -2.395 1.458 103 HG1 THR 90 HG1 THR 90 -12.996 -0.761 1.952 104 1HG2 THR 90 1HG2 THR 90 -10.437 -1.428 3.881 105 2HG2 THR 90 2HG2 THR 90 -12.158 -1.075 3.729 106 3HG2 THR 90 3HG2 THR 90 -11.579 -2.732 3.560 107 H PHE 91 H PHE 91 -8.322 1.062 2.474 108 HA PHE 91 HA PHE 91 -6.131 -0.524 1.659 109 1HB PHE 91 1HB PHE 91 -6.170 1.966 2.321 110 2HB PHE 91 2HB PHE 91 -6.034 1.390 3.981 111 HD1 PHE 91 HD1 PHE 91 -4.417 0.802 0.664 112 HD2 PHE 91 HD2 PHE 91 -3.924 1.277 4.873 113 HE1 PHE 91 HE1 PHE 91 -1.973 0.626 0.393 114 HE2 PHE 91 HE2 PHE 91 -1.479 1.100 4.610 115 HZ PHE 91 HZ PHE 91 -0.501 0.776 2.368 116 H TYR 92 H TYR 92 -4.466 -1.315 3.355 117 HA TYR 92 HA TYR 92 -5.389 -2.274 5.849 118 1HB TYR 92 1HB TYR 92 -5.750 -4.016 3.489 119 2HB TYR 92 2HB TYR 92 -5.090 -4.780 4.930 120 HD1 TYR 92 HD1 TYR 92 -6.439 -3.962 7.170 121 HD2 TYR 92 HD2 TYR 92 -8.024 -4.214 3.220 122 HE1 TYR 92 HE1 TYR 92 -8.712 -4.168 8.101 123 HE2 TYR 92 HE2 TYR 92 -10.299 -4.419 4.139 124 HH TYR 92 HH TYR 92 -10.867 -4.778 7.583 125 H ARG 93 H ARG 93 -3.798 -3.463 7.008 126 HA ARG 93 HA ARG 93 -1.125 -3.385 5.769 127 1HB ARG 93 1HB ARG 93 -2.113 -2.463 8.398 128 2HB ARG 93 2HB ARG 93 -0.578 -3.322 8.424 129 1HG ARG 93 1HG ARG 93 0.521 -1.593 7.557 130 2HG ARG 93 2HG ARG 93 -0.705 -1.325 6.317 131 1HD ARG 93 1HD ARG 93 -0.579 0.621 7.722 132 2HD ARG 93 2HD ARG 93 -2.112 -0.198 8.016 133 HE ARG 93 HE ARG 93 -1.427 -0.658 10.163 134 1HH1 ARG 93 1HH1 ARG 93 1.267 0.505 8.291 135 2HH1 ARG 93 2HH1 ARG 93 2.313 0.676 9.660 136 1HH2 ARG 93 1HH2 ARG 93 -0.059 -0.435 11.975 137 2HH2 ARG 93 2HH2 ARG 93 1.559 0.141 11.756 138 H THR 94 H THR 94 -3.470 -5.238 7.478 139 HA THR 94 HA THR 94 -1.744 -7.590 7.282 140 HB THR 94 HB THR 94 -2.738 -8.301 9.561 141 HG1 THR 94 HG1 THR 94 -4.169 -6.430 9.607 142 1HG2 THR 94 1HG2 THR 94 -0.356 -7.727 9.230 143 2HG2 THR 94 2HG2 THR 94 -0.747 -6.049 9.609 144 3HG2 THR 94 3HG2 THR 94 -0.973 -7.305 10.827 145 HA PRO 95 HA PRO 95 -5.627 -8.677 5.253 146 1HB PRO 95 1HB PRO 95 -4.137 -11.201 4.878 147 2HB PRO 95 2HB PRO 95 -4.965 -10.189 3.693 148 1HG PRO 95 1HG PRO 95 -2.291 -10.245 3.848 149 2HG PRO 95 2HG PRO 95 -3.171 -8.759 3.450 150 1HD PRO 95 1HD PRO 95 -1.875 -9.570 6.014 151 2HD PRO 95 2HD PRO 95 -1.997 -7.964 5.267 152 H SER 96 H SER 96 -5.986 -11.595 5.272 153 HA SER 96 HA SER 96 -7.815 -12.155 7.042 154 1HB SER 96 1HB SER 96 -5.689 -13.780 5.882 155 2HB SER 96 2HB SER 96 -6.281 -14.430 7.412 156 HG SER 96 HG SER 96 -8.389 -14.360 6.541 157 HA PRO 97 HA PRO 97 -6.840 -11.300 11.239 158 1HB PRO 97 1HB PRO 97 -8.031 -14.008 11.688 159 2HB PRO 97 2HB PRO 97 -8.365 -12.483 12.516 160 1HG PRO 97 1HG PRO 97 -10.045 -13.421 10.674 161 2HG PRO 97 2HG PRO 97 -9.701 -11.686 10.797 162 1HD PRO 97 1HD PRO 97 -8.785 -13.660 8.774 163 2HD PRO 97 2HD PRO 97 -9.092 -11.921 8.600 164 H ASP 98 H ASP 98 -5.898 -14.298 9.715 165 HA ASP 98 HA ASP 98 -3.792 -14.661 11.738 166 1HB ASP 98 1HB ASP 98 -5.431 -16.553 11.350 167 2HB ASP 98 2HB ASP 98 -4.734 -16.722 9.740 168 H ALA 99 H ALA 99 -3.113 -12.703 10.151 169 HA ALA 99 HA ALA 99 -1.347 -13.896 8.113 170 1HB ALA 99 1HB ALA 99 -2.798 -11.267 8.129 171 2HB ALA 99 2HB ALA 99 -1.418 -11.570 7.074 172 3HB ALA 99 3HB ALA 99 -2.870 -12.559 6.930 173 H LYS 100 H LYS 100 0.439 -12.062 7.593 174 HA LYS 100 HA LYS 100 1.564 -11.188 10.167 175 1HB LYS 100 1HB LYS 100 3.051 -12.547 7.912 176 2HB LYS 100 2HB LYS 100 3.812 -11.832 9.327 177 1HG LYS 100 1HG LYS 100 1.920 -13.537 10.396 178 2HG LYS 100 2HG LYS 100 2.551 -14.419 9.004 179 1HD LYS 100 1HD LYS 100 3.906 -14.990 10.880 180 2HD LYS 100 2HD LYS 100 4.859 -13.921 9.849 181 1HE LYS 100 1HE LYS 100 5.180 -12.579 11.587 182 2HE LYS 100 2HE LYS 100 3.444 -12.269 11.639 183 1HZ LYS 100 1HZ LYS 100 4.612 -14.657 12.927 184 2HZ LYS 100 2HZ LYS 100 4.558 -13.168 13.730 185 3HZ LYS 100 3HZ LYS 100 3.124 -13.913 13.232 186 H ALA 101 H ALA 101 0.089 -9.623 8.302 187 HA ALA 101 HA ALA 101 0.156 -7.625 7.215 188 1HB ALA 101 1HB ALA 101 1.752 -7.366 9.391 189 2HB ALA 101 2HB ALA 101 2.865 -6.917 8.099 190 3HB ALA 101 3HB ALA 101 1.342 -6.049 8.292 191 H PHE 102 H PHE 102 0.478 -7.210 5.126 192 HA PHE 102 HA PHE 102 2.142 -8.745 3.501 193 1HB PHE 102 1HB PHE 102 0.525 -6.287 3.144 194 2HB PHE 102 2HB PHE 102 1.787 -6.569 1.949 195 HD1 PHE 102 HD1 PHE 102 1.848 -9.046 1.005 196 HD2 PHE 102 HD2 PHE 102 -1.558 -7.168 2.751 197 HE1 PHE 102 HE1 PHE 102 0.373 -10.626 -0.183 198 HE2 PHE 102 HE2 PHE 102 -3.039 -8.744 1.569 199 HZ PHE 102 HZ PHE 102 -2.074 -10.475 0.101 200 H ILE 103 H ILE 103 2.612 -5.301 3.177 201 HA ILE 103 HA ILE 103 5.486 -5.706 3.693 202 HB ILE 103 HB ILE 103 4.262 -3.602 1.910 203 1HG1 ILE 103 1HG1 ILE 103 3.815 -5.691 0.853 204 2HG1 ILE 103 2HG1 ILE 103 5.238 -5.028 0.057 205 1HG2 ILE 103 1HG2 ILE 103 6.739 -3.682 3.084 206 2HG2 ILE 103 2HG2 ILE 103 7.040 -4.382 1.494 207 3HG2 ILE 103 3HG2 ILE 103 6.320 -2.778 1.629 208 1HD1 ILE 103 1HD1 ILE 103 5.456 -6.998 2.302 209 2HD1 ILE 103 2HD1 ILE 103 5.255 -7.501 0.625 210 3HD1 ILE 103 3HD1 ILE 103 6.667 -6.557 1.099 211 H GLU 104 H GLU 104 5.061 -5.244 5.953 212 HA GLU 104 HA GLU 104 3.905 -2.920 6.942 213 1HB GLU 104 1HB GLU 104 5.501 -5.071 7.966 214 2HB GLU 104 2HB GLU 104 6.066 -3.551 8.646 215 1HG GLU 104 1HG GLU 104 3.670 -3.069 9.251 216 2HG GLU 104 2HG GLU 104 3.311 -4.737 8.807 217 H VAL 105 H VAL 105 5.086 -1.134 8.092 218 HA VAL 105 HA VAL 105 6.658 0.310 6.235 219 HB VAL 105 HB VAL 105 6.079 0.814 9.153 220 1HG1 VAL 105 1HG1 VAL 105 7.602 2.463 7.155 221 2HG1 VAL 105 2HG1 VAL 105 6.838 3.172 8.578 222 3HG1 VAL 105 3HG1 VAL 105 8.101 1.955 8.769 223 1HG2 VAL 105 1HG2 VAL 105 4.936 1.896 6.585 224 2HG2 VAL 105 2HG2 VAL 105 4.102 0.987 7.846 225 3HG2 VAL 105 3HG2 VAL 105 4.649 2.633 8.162 226 H GLY 106 H GLY 106 8.830 0.973 6.359 227 1HA GLY 106 1HA GLY 106 11.053 0.882 7.026 228 2HA GLY 106 2HA GLY 106 10.578 -0.147 8.369 229 H GLN 107 H GLN 107 9.132 -1.691 6.007 230 HA GLN 107 HA GLN 107 11.197 -3.668 5.776 231 1HB GLN 107 1HB GLN 107 8.909 -4.403 5.976 232 2HB GLN 107 2HB GLN 107 8.437 -3.468 4.564 233 1HG GLN 107 1HG GLN 107 9.641 -4.908 3.107 234 2HG GLN 107 2HG GLN 107 10.405 -5.736 4.463 235 1HE2 GLN 107 2HE2 GLN 107 8.877 -6.905 2.335 236 2HE2 GLN 107 1HE2 GLN 107 7.517 -7.686 3.059 237 H LYS 108 H LYS 108 11.694 -4.637 3.573 238 HA LYS 108 HA LYS 108 12.432 -2.450 1.771 239 1HB LYS 108 1HB LYS 108 13.764 -4.512 0.733 240 2HB LYS 108 2HB LYS 108 14.381 -3.590 2.097 241 1HG LYS 108 1HG LYS 108 12.671 -5.970 2.623 242 2HG LYS 108 2HG LYS 108 14.353 -6.204 2.143 243 1HD LYS 108 1HD LYS 108 15.175 -5.249 4.065 244 2HD LYS 108 2HD LYS 108 13.738 -4.253 4.311 245 1HE LYS 108 1HE LYS 108 12.760 -6.816 4.510 246 2HE LYS 108 2HE LYS 108 14.346 -6.940 5.269 247 1HZ LYS 108 1HZ LYS 108 13.474 -4.717 6.399 248 2HZ LYS 108 2HZ LYS 108 11.984 -5.471 6.131 249 3HZ LYS 108 3HZ LYS 108 13.171 -6.248 7.051 250 H VAL 109 H VAL 109 11.663 -2.270 -0.255 251 HA VAL 109 HA VAL 109 10.045 -4.479 -1.331 252 HB VAL 109 HB VAL 109 8.687 -2.443 -2.374 253 1HG1 VAL 109 1HG1 VAL 109 8.143 -4.404 -0.612 254 2HG1 VAL 109 2HG1 VAL 109 7.873 -2.990 0.407 255 3HG1 VAL 109 3HG1 VAL 109 6.974 -3.176 -1.099 256 1HG2 VAL 109 1HG2 VAL 109 9.823 -1.373 0.198 257 2HG2 VAL 109 2HG2 VAL 109 9.850 -0.631 -1.402 258 3HG2 VAL 109 3HG2 VAL 109 8.332 -0.758 -0.515 259 H ASN 110 H ASN 110 10.721 -5.083 -3.273 260 HA ASN 110 HA ASN 110 12.074 -3.093 -4.975 261 1HB ASN 110 1HB ASN 110 13.052 -5.498 -5.859 262 2HB ASN 110 2HB ASN 110 13.886 -4.416 -4.747 263 1HD2 ASN 110 2HD2 ASN 110 14.329 -5.106 -2.756 264 2HD2 ASN 110 1HD2 ASN 110 13.782 -6.597 -2.076 265 H VAL 111 H VAL 111 11.449 -2.953 -7.066 266 HA VAL 111 HA VAL 111 9.004 -3.505 -7.980 267 HB VAL 111 HB VAL 111 11.545 -3.676 -9.600 268 1HG1 VAL 111 1HG1 VAL 111 8.668 -3.639 -10.471 269 2HG1 VAL 111 2HG1 VAL 111 9.986 -3.138 -11.528 270 3HG1 VAL 111 3HG1 VAL 111 9.932 -4.788 -10.910 271 1HG2 VAL 111 1HG2 VAL 111 10.338 -1.525 -8.331 272 2HG2 VAL 111 2HG2 VAL 111 11.546 -1.447 -9.614 273 3HG2 VAL 111 3HG2 VAL 111 9.830 -1.380 -10.014 274 H GLY 112 H GLY 112 8.112 -5.439 -7.282 275 1HA GLY 112 1HA GLY 112 7.760 -7.550 -8.820 276 2HA GLY 112 2HA GLY 112 9.345 -7.938 -8.170 277 H ASP 113 H ASP 113 8.237 -6.395 -5.666 278 HA ASP 113 HA ASP 113 7.170 -8.814 -4.425 279 1HB ASP 113 1HB ASP 113 8.861 -6.659 -3.556 280 2HB ASP 113 2HB ASP 113 7.470 -6.793 -2.485 281 H THR 114 H THR 114 5.406 -8.567 -2.819 282 HA THR 114 HA THR 114 3.186 -7.215 -4.011 283 HB THR 114 HB THR 114 2.772 -8.167 -1.281 284 HG1 THR 114 HG1 THR 114 3.720 -10.011 -3.215 285 1HG2 THR 114 1HG2 THR 114 0.940 -7.863 -2.857 286 2HG2 THR 114 2HG2 THR 114 1.642 -9.089 -3.913 287 3HG2 THR 114 3HG2 THR 114 1.055 -9.537 -2.310 288 H LEU 115 H LEU 115 1.652 -6.192 -2.089 289 HA LEU 115 HA LEU 115 3.194 -4.281 -0.523 290 1HB LEU 115 1HB LEU 115 2.792 -3.320 -2.831 291 2HB LEU 115 2HB LEU 115 1.082 -3.319 -2.444 292 HG LEU 115 HG LEU 115 2.084 -1.969 -0.308 293 1HD1 LEU 115 1HD1 LEU 115 4.351 -1.989 -1.221 294 2HD1 LEU 115 2HD1 LEU 115 3.771 -1.191 -2.682 295 3HD1 LEU 115 3HD1 LEU 115 3.705 -0.351 -1.133 296 1HD2 LEU 115 1HD2 LEU 115 0.204 -1.423 -1.929 297 2HD2 LEU 115 2HD2 LEU 115 1.094 -0.057 -1.255 298 3HD2 LEU 115 3HD2 LEU 115 1.425 -0.602 -2.901 299 H CYS 116 H CYS 116 -0.187 -4.451 -1.632 300 HA CYS 116 HA CYS 116 -1.227 -5.526 0.758 301 1HB CYS 116 1HB CYS 116 -2.300 -3.519 1.696 302 2HB CYS 116 2HB CYS 116 -0.545 -3.394 1.736 303 HG CYS 116 HG CYS 116 -2.267 -1.859 -0.354 304 H ILE 117 H ILE 117 -3.625 -5.396 0.837 305 HA ILE 117 HA ILE 117 -4.690 -5.303 -1.895 306 HB ILE 117 HB ILE 117 -5.604 -6.756 0.577 307 1HG1 ILE 117 1HG1 ILE 117 -5.456 -8.156 -1.989 308 2HG1 ILE 117 2HG1 ILE 117 -3.913 -7.475 -1.479 309 1HG2 ILE 117 1HG2 ILE 117 -7.110 -6.388 -2.005 310 2HG2 ILE 117 2HG2 ILE 117 -7.518 -7.576 -0.767 311 3HG2 ILE 117 3HG2 ILE 117 -7.607 -5.853 -0.399 312 1HD1 ILE 117 1HD1 ILE 117 -4.925 -8.684 0.801 313 2HD1 ILE 117 2HD1 ILE 117 -5.316 -9.796 -0.510 314 3HD1 ILE 117 3HD1 ILE 117 -3.646 -9.295 -0.248 315 H VAL 118 H VAL 118 -6.394 -4.059 -2.467 316 HA VAL 118 HA VAL 118 -7.091 -1.875 -0.700 317 HB VAL 118 HB VAL 118 -8.132 -2.434 -3.480 318 1HG1 VAL 118 1HG1 VAL 118 -8.132 0.014 -1.728 319 2HG1 VAL 118 2HG1 VAL 118 -8.464 0.061 -3.459 320 3HG1 VAL 118 3HG1 VAL 118 -9.521 -0.852 -2.384 321 1HG2 VAL 118 1HG2 VAL 118 -5.543 -2.138 -3.027 322 2HG2 VAL 118 2HG2 VAL 118 -6.331 -1.392 -4.417 323 3HG2 VAL 118 3HG2 VAL 118 -5.993 -0.434 -2.975 324 H GLU 119 H GLU 119 -8.433 -4.869 -1.751 325 HA GLU 119 HA GLU 119 -10.529 -5.800 -1.563 326 1HB GLU 119 1HB GLU 119 -9.623 -6.274 0.597 327 2HB GLU 119 2HB GLU 119 -9.961 -4.645 1.165 328 1HG GLU 119 1HG GLU 119 -12.112 -5.105 1.628 329 2HG GLU 119 2HG GLU 119 -12.294 -6.179 0.242 330 H ALA 120 H ALA 120 -10.986 -3.622 -2.974 331 HA ALA 120 HA ALA 120 -12.843 -1.825 -1.706 332 1HB ALA 120 1HB ALA 120 -11.376 -1.914 -4.158 333 2HB ALA 120 2HB ALA 120 -13.080 -1.624 -4.507 334 3HB ALA 120 3HB ALA 120 -12.210 -0.552 -3.411 335 H MET 121 H MET 121 -13.287 -3.829 -4.614 336 HA MET 121 HA MET 121 -16.060 -4.283 -3.789 337 1HB MET 121 1HB MET 121 -16.428 -4.914 -6.176 338 2HB MET 121 2HB MET 121 -15.901 -3.251 -5.955 339 1HG MET 121 1HG MET 121 -13.592 -3.964 -6.508 340 2HG MET 121 2HG MET 121 -14.217 -5.574 -6.859 341 1HE MET 121 1HE MET 121 -16.828 -5.237 -8.067 342 2HE MET 121 2HE MET 121 -17.131 -3.500 -8.087 343 3HE MET 121 3HE MET 121 -16.937 -4.379 -9.604 344 H LYS 122 H LYS 122 -13.883 -5.745 -2.633 345 HA LYS 122 HA LYS 122 -13.348 -7.871 -2.035 346 1HB LYS 122 1HB LYS 122 -15.843 -8.104 -1.973 347 2HB LYS 122 2HB LYS 122 -15.780 -8.697 -3.628 348 1HG LYS 122 1HG LYS 122 -15.868 -10.364 -1.627 349 2HG LYS 122 2HG LYS 122 -14.844 -10.701 -3.024 350 1HD LYS 122 1HD LYS 122 -12.940 -9.666 -1.782 351 2HD LYS 122 2HD LYS 122 -13.991 -9.552 -0.368 352 1HE LYS 122 1HE LYS 122 -14.354 -12.084 -0.722 353 2HE LYS 122 2HE LYS 122 -12.908 -11.993 -1.727 354 H MET 123 H MET 123 -12.213 -6.728 -4.396 355 HA MET 123 HA MET 123 -11.906 -9.044 -6.173 356 1HB MET 123 1HB MET 123 -11.315 -7.595 -7.878 357 2HB MET 123 2HB MET 123 -12.472 -6.627 -6.975 358 1HG MET 123 1HG MET 123 -10.278 -5.835 -5.726 359 2HG MET 123 2HG MET 123 -9.538 -6.315 -7.253 360 1HE MET 123 1HE MET 123 -9.742 -3.791 -5.581 361 2HE MET 123 2HE MET 123 -9.693 -2.544 -6.829 362 3HE MET 123 3HE MET 123 -11.142 -2.749 -5.844 363 H MET 124 H MET 124 -10.456 -7.747 -3.515 364 HA MET 124 HA MET 124 -8.405 -7.906 -2.554 365 1HB MET 124 1HB MET 124 -8.209 -10.217 -4.492 366 2HB MET 124 2HB MET 124 -7.054 -9.912 -3.202 367 1HG MET 124 1HG MET 124 -9.966 -10.599 -2.919 368 2HG MET 124 2HG MET 124 -8.579 -11.593 -2.475 369 1HE MET 124 1HE MET 124 -10.951 -9.030 -1.914 370 2HE MET 124 2HE MET 124 -11.210 -9.405 -0.210 371 3HE MET 124 3HE MET 124 -10.350 -7.936 -0.668 372 H ASN 125 H ASN 125 -8.548 -5.948 -4.483 373 HA ASN 125 HA ASN 125 -6.581 -6.045 -6.478 374 1HB ASN 125 1HB ASN 125 -8.231 -4.309 -6.559 375 2HB ASN 125 2HB ASN 125 -7.770 -3.715 -4.965 376 1HD2 ASN 125 2HD2 ASN 125 -7.763 -1.741 -6.461 377 2HD2 ASN 125 1HD2 ASN 125 -6.232 -1.326 -7.145 378 H GLN 126 H GLN 126 -4.911 -7.193 -5.231 379 HA GLN 126 HA GLN 126 -3.480 -5.744 -3.203 380 1HB GLN 126 1HB GLN 126 -2.006 -7.653 -3.132 381 2HB GLN 126 2HB GLN 126 -3.674 -8.209 -3.187 382 1HG GLN 126 1HG GLN 126 -3.481 -8.830 -5.469 383 2HG GLN 126 2HG GLN 126 -1.922 -8.023 -5.622 384 1HE2 GLN 126 2HE2 GLN 126 -2.915 -9.986 -2.900 385 2HE2 GLN 126 1HE2 GLN 126 -1.784 -11.265 -3.165 386 H ILE 127 H ILE 127 -1.881 -4.356 -3.476 387 HA ILE 127 HA ILE 127 -0.859 -3.876 -6.159 388 HB ILE 127 HB ILE 127 -0.206 -2.346 -3.643 389 1HG1 ILE 127 1HG1 ILE 127 -2.623 -2.331 -3.964 390 2HG1 ILE 127 2HG1 ILE 127 -1.954 -0.750 -4.358 391 1HG2 ILE 127 1HG2 ILE 127 0.112 -1.779 -6.578 392 2HG2 ILE 127 2HG2 ILE 127 0.193 -0.518 -5.347 393 3HG2 ILE 127 3HG2 ILE 127 1.359 -1.841 -5.332 394 1HD1 ILE 127 1HD1 ILE 127 -1.981 -2.240 -6.745 395 2HD1 ILE 127 2HD1 ILE 127 -3.544 -2.481 -5.963 396 3HD1 ILE 127 3HD1 ILE 127 -2.975 -0.849 -6.313 397 H GLU 128 H GLU 128 1.278 -4.028 -6.760 398 HA GLU 128 HA GLU 128 3.039 -5.449 -4.873 399 1HB GLU 128 1HB GLU 128 3.259 -5.557 -7.876 400 2HB GLU 128 2HB GLU 128 4.015 -6.618 -6.695 401 1HG GLU 128 1HG GLU 128 2.333 -7.965 -7.413 402 2HG GLU 128 2HG GLU 128 1.519 -7.157 -6.072 403 H ALA 129 H ALA 129 4.504 -4.093 -4.072 404 HA ALA 129 HA ALA 129 5.229 -1.616 -4.778 405 1HB ALA 129 1HB ALA 129 7.023 -3.804 -3.753 406 2HB ALA 129 2HB ALA 129 7.521 -2.116 -3.863 407 3HB ALA 129 3HB ALA 129 6.172 -2.571 -2.821 408 H ASP 130 H ASP 130 5.672 -0.792 -6.712 409 HA ASP 130 HA ASP 130 7.671 -2.162 -8.383 410 1HB ASP 130 1HB ASP 130 6.287 -1.006 -10.315 411 2HB ASP 130 2HB ASP 130 5.806 -2.576 -9.673 412 H LYS 131 H LYS 131 8.065 -0.050 -6.466 413 HA LYS 131 HA LYS 131 8.822 2.160 -8.263 414 1HB LYS 131 1HB LYS 131 7.140 2.430 -6.210 415 2HB LYS 131 2HB LYS 131 8.651 2.596 -5.324 416 1HG LYS 131 1HG LYS 131 8.240 4.777 -5.831 417 2HG LYS 131 2HG LYS 131 9.201 4.314 -7.239 418 1HD LYS 131 1HD LYS 131 7.505 4.767 -8.607 419 2HD LYS 131 2HD LYS 131 6.429 3.708 -7.692 420 1HE LYS 131 1HE LYS 131 6.556 5.843 -6.038 421 2HE LYS 131 2HE LYS 131 6.743 6.635 -7.602 422 1HZ LYS 131 1HZ LYS 131 4.690 4.808 -7.897 423 2HZ LYS 131 2HZ LYS 131 4.406 5.572 -6.415 424 3HZ LYS 131 3HZ LYS 131 4.558 6.492 -7.826 425 H SER 132 H SER 132 9.949 -0.324 -6.279 426 HA SER 132 HA SER 132 12.002 -0.934 -5.510 427 1HB SER 132 1HB SER 132 12.536 0.668 -7.945 428 2HB SER 132 2HB SER 132 13.916 0.405 -6.877 429 HG SER 132 HG SER 132 14.021 -1.516 -7.693 430 H GLY 133 H GLY 133 12.455 -0.334 -3.493 431 1HA GLY 133 1HA GLY 133 14.203 1.558 -2.694 432 2HA GLY 133 2HA GLY 133 12.697 2.460 -2.777 433 H THR 134 H THR 134 13.495 2.629 -0.410 434 HA THR 134 HA THR 134 12.518 0.346 1.158 435 HB THR 134 HB THR 134 14.097 2.735 2.124 436 HG1 THR 134 HG1 THR 134 15.237 0.207 1.856 437 1HG2 THR 134 1HG2 THR 134 13.294 0.157 3.403 438 2HG2 THR 134 2HG2 THR 134 14.744 1.021 3.916 439 3HG2 THR 134 3HG2 THR 134 13.166 1.801 4.027 440 H VAL 135 H VAL 135 10.584 0.459 2.070 441 HA VAL 135 HA VAL 135 8.888 2.686 1.834 442 HB VAL 135 HB VAL 135 8.669 0.297 3.669 443 1HG1 VAL 135 1HG1 VAL 135 6.767 2.537 3.073 444 2HG1 VAL 135 2HG1 VAL 135 6.187 0.949 3.573 445 3HG1 VAL 135 3HG1 VAL 135 7.247 1.874 4.635 446 1HG2 VAL 135 1HG2 VAL 135 7.975 0.814 0.842 447 2HG2 VAL 135 2HG2 VAL 135 8.441 -0.688 1.641 448 3HG2 VAL 135 3HG2 VAL 135 6.792 -0.083 1.795 449 H LYS 136 H LYS 136 8.827 4.514 2.950 450 HA LYS 136 HA LYS 136 10.402 4.828 5.344 451 1HB LYS 136 1HB LYS 136 10.146 6.562 3.498 452 2HB LYS 136 2HB LYS 136 8.534 6.860 4.133 453 1HG LYS 136 1HG LYS 136 10.017 8.506 5.019 454 2HG LYS 136 2HG LYS 136 9.557 7.410 6.325 455 1HD LYS 136 1HD LYS 136 11.905 6.414 5.022 456 2HD LYS 136 2HD LYS 136 12.153 8.103 5.470 457 1HE LYS 136 1HE LYS 136 12.459 7.510 7.587 458 2HE LYS 136 2HE LYS 136 10.852 6.787 7.628 459 1HZ LYS 136 1HZ LYS 136 12.406 4.975 6.284 460 2HZ LYS 136 2HZ LYS 136 13.401 5.517 7.541 461 3HZ LYS 136 3HZ LYS 136 11.885 4.855 7.889 462 H ALA 137 H ALA 137 6.957 5.241 4.527 463 HA ALA 137 HA ALA 137 5.974 3.981 6.813 464 1HB ALA 137 1HB ALA 137 7.113 6.229 7.664 465 2HB ALA 137 2HB ALA 137 5.532 6.881 7.231 466 3HB ALA 137 3HB ALA 137 5.655 5.570 8.405 467 H ILE 138 H ILE 138 3.672 4.079 6.987 468 HA ILE 138 HA ILE 138 2.407 4.982 4.498 469 HB ILE 138 HB ILE 138 1.558 2.946 6.556 470 1HG1 ILE 138 1HG1 ILE 138 2.388 2.820 3.658 471 2HG1 ILE 138 2HG1 ILE 138 3.137 2.023 5.039 472 1HG2 ILE 138 1HG2 ILE 138 0.001 4.024 4.212 473 2HG2 ILE 138 2HG2 ILE 138 -0.419 2.559 5.099 474 3HG2 ILE 138 3HG2 ILE 138 -0.433 4.119 5.919 475 1HD1 ILE 138 1HD1 ILE 138 1.157 0.602 5.275 476 2HD1 ILE 138 2HD1 ILE 138 0.441 1.385 3.867 477 3HD1 ILE 138 3HD1 ILE 138 1.915 0.433 3.692 478 H LEU 139 H LEU 139 0.535 6.224 4.498 479 HA LEU 139 HA LEU 139 -0.001 7.643 7.022 480 1HB LEU 139 1HB LEU 139 -0.135 8.455 4.145 481 2HB LEU 139 2HB LEU 139 -1.137 9.280 5.323 482 HG LEU 139 HG LEU 139 0.977 9.778 6.617 483 1HD1 LEU 139 1HD1 LEU 139 2.272 7.966 5.393 484 2HD1 LEU 139 2HD1 LEU 139 2.384 9.104 4.051 485 3HD1 LEU 139 3HD1 LEU 139 3.085 9.516 5.615 486 1HD2 LEU 139 1HD2 LEU 139 -0.253 11.318 4.989 487 2HD2 LEU 139 2HD2 LEU 139 1.415 11.723 5.392 488 3HD2 LEU 139 3HD2 LEU 139 1.044 10.946 3.853 489 H VAL 140 H VAL 140 -1.543 6.197 4.189 490 HA VAL 140 HA VAL 140 -4.185 6.634 4.657 491 HB VAL 140 HB VAL 140 -2.861 4.109 3.676 492 1HG1 VAL 140 1HG1 VAL 140 -5.060 3.552 4.583 493 2HG1 VAL 140 2HG1 VAL 140 -5.792 4.819 3.600 494 3HG1 VAL 140 3HG1 VAL 140 -5.046 3.423 2.825 495 1HG2 VAL 140 1HG2 VAL 140 -3.611 6.661 2.496 496 2HG2 VAL 140 2HG2 VAL 140 -2.521 5.413 1.895 497 3HG2 VAL 140 3HG2 VAL 140 -4.257 5.279 1.612 498 H GLU 141 H GLU 141 -5.523 6.263 6.265 499 HA GLU 141 HA GLU 141 -4.790 4.862 8.607 500 1HB GLU 141 1HB GLU 141 -7.552 5.731 7.730 501 2HB GLU 141 2HB GLU 141 -7.065 5.310 9.366 502 1HG GLU 141 1HG GLU 141 -6.978 7.579 9.493 503 2HG GLU 141 2HG GLU 141 -5.321 7.237 8.998 504 H SER 142 H SER 142 -4.204 2.977 7.090 505 HA SER 142 HA SER 142 -5.685 1.236 5.794 506 1HB SER 142 1HB SER 142 -3.927 -0.097 6.133 507 2HB SER 142 2HB SER 142 -3.340 1.086 7.302 508 HG SER 142 HG SER 142 -4.923 -1.214 7.789 509 H GLY 143 H GLY 143 -7.047 -0.594 6.232 510 1HA GLY 143 1HA GLY 143 -8.498 -1.884 7.545 511 2HA GLY 143 2HA GLY 143 -8.210 -0.798 8.895 512 H GLN 144 H GLN 144 -8.702 1.383 6.692 513 HA GLN 144 HA GLN 144 -11.628 1.361 7.015 514 1HB GLN 144 1HB GLN 144 -11.621 3.618 7.393 515 2HB GLN 144 2HB GLN 144 -10.034 3.219 8.035 516 1HG GLN 144 1HG GLN 144 -9.036 3.865 5.871 517 2HG GLN 144 2HG GLN 144 -10.635 4.346 5.309 518 1HE2 GLN 144 2HE2 GLN 144 -11.211 5.270 8.144 519 2HE2 GLN 144 1HE2 GLN 144 -10.449 6.816 8.239 520 HA PRO 145 HA PRO 145 -12.125 1.419 2.643 521 1HB PRO 145 1HB PRO 145 -14.417 2.801 2.351 522 2HB PRO 145 2HB PRO 145 -14.378 1.197 3.095 523 1HG PRO 145 1HG PRO 145 -14.507 3.889 4.397 524 2HG PRO 145 2HG PRO 145 -15.392 2.406 4.801 525 1HD PRO 145 1HD PRO 145 -13.170 3.256 6.148 526 2HD PRO 145 2HD PRO 145 -13.645 1.551 6.017 527 H VAL 146 H VAL 146 -10.499 2.590 1.687 528 HA VAL 146 HA VAL 146 -11.139 5.123 0.594 529 HB VAL 146 HB VAL 146 -10.579 5.942 2.823 530 1HG1 VAL 146 1HG1 VAL 146 -8.164 4.256 2.409 531 2HG1 VAL 146 2HG1 VAL 146 -8.002 5.739 3.348 532 3HG1 VAL 146 3HG1 VAL 146 -9.142 4.494 3.856 533 1HG2 VAL 146 1HG2 VAL 146 -9.857 7.071 0.580 534 2HG2 VAL 146 2HG2 VAL 146 -9.283 7.715 2.119 535 3HG2 VAL 146 3HG2 VAL 146 -8.228 6.693 1.142 536 H GLU 147 H GLU 147 -9.520 5.918 -0.858 537 HA GLU 147 HA GLU 147 -7.007 4.895 -1.315 538 1HB GLU 147 1HB GLU 147 -9.005 2.973 -1.951 539 2HB GLU 147 2HB GLU 147 -8.293 3.524 -3.464 540 1HG GLU 147 1HG GLU 147 -6.120 3.123 -1.791 541 2HG GLU 147 2HG GLU 147 -7.208 1.783 -1.430 542 H PHE 148 H PHE 148 -8.664 7.283 -1.653 543 HA PHE 148 HA PHE 148 -8.225 7.783 -4.520 544 1HB PHE 148 1HB PHE 148 -10.517 8.083 -4.242 545 2HB PHE 148 2HB PHE 148 -10.325 8.766 -2.634 546 HD1 PHE 148 HD1 PHE 148 -9.022 9.599 -6.036 547 HD2 PHE 148 HD2 PHE 148 -10.999 10.951 -2.508 548 HE1 PHE 148 HE1 PHE 148 -9.159 11.869 -6.988 549 HE2 PHE 148 HE2 PHE 148 -11.141 13.224 -3.455 550 HZ PHE 148 HZ PHE 148 -10.219 13.685 -5.696 551 H ASP 149 H ASP 149 -6.041 8.368 -4.171 552 HA ASP 149 HA ASP 149 -4.426 9.986 -4.046 553 1HB ASP 149 1HB ASP 149 -6.623 11.516 -4.292 554 2HB ASP 149 2HB ASP 149 -6.149 11.966 -2.656 555 H GLU 150 H GLU 150 -5.065 8.050 -1.974 556 HA GLU 150 HA GLU 150 -4.142 9.482 0.424 557 1HB GLU 150 1HB GLU 150 -6.300 7.873 0.233 558 2HB GLU 150 2HB GLU 150 -5.079 6.680 0.653 559 1HG GLU 150 1HG GLU 150 -5.685 7.241 2.744 560 2HG GLU 150 2HG GLU 150 -4.511 8.532 2.491 561 HA PRO 151 HA PRO 151 -0.120 7.807 -0.694 562 1HB PRO 151 1HB PRO 151 0.219 8.537 2.188 563 2HB PRO 151 2HB PRO 151 1.296 8.841 0.820 564 1HG PRO 151 1HG PRO 151 -0.250 10.781 1.794 565 2HG PRO 151 2HG PRO 151 0.036 10.627 0.051 566 1HD PRO 151 1HD PRO 151 -2.399 9.998 1.631 567 2HD PRO 151 2HD PRO 151 -2.248 10.510 -0.061 568 H LEU 152 H LEU 152 -0.746 5.633 -0.883 569 HA LEU 152 HA LEU 152 -1.481 3.952 1.236 570 1HB LEU 152 1HB LEU 152 -0.187 3.372 -1.424 571 2HB LEU 152 2HB LEU 152 -0.687 2.109 -0.313 572 HG LEU 152 HG LEU 152 -2.356 3.937 -1.975 573 1HD1 LEU 152 1HD1 LEU 152 -1.726 1.216 -1.960 574 2HD1 LEU 152 2HD1 LEU 152 -3.398 1.319 -1.404 575 3HD1 LEU 152 3HD1 LEU 152 -2.937 2.030 -2.950 576 1HD2 LEU 152 1HD2 LEU 152 -3.032 2.943 0.757 577 2HD2 LEU 152 2HD2 LEU 152 -3.381 4.501 0.010 578 3HD2 LEU 152 3HD2 LEU 152 -4.293 3.070 -0.470 579 H VAL 153 H VAL 153 1.690 4.396 -0.322 580 HA VAL 153 HA VAL 153 3.033 3.909 2.188 581 HB VAL 153 HB VAL 153 3.865 2.125 -0.074 582 1HG1 VAL 153 1HG1 VAL 153 4.883 2.696 2.454 583 2HG1 VAL 153 2HG1 VAL 153 4.129 1.111 2.615 584 3HG1 VAL 153 3HG1 VAL 153 5.367 1.379 1.387 585 1HG2 VAL 153 1HG2 VAL 153 1.466 1.691 0.384 586 2HG2 VAL 153 2HG2 VAL 153 2.510 0.326 0.779 587 3HG2 VAL 153 3HG2 VAL 153 1.882 1.357 2.064 588 H VAL 154 H VAL 154 4.558 5.408 2.274 589 HA VAL 154 HA VAL 154 5.643 6.505 -0.207 590 HB VAL 154 HB VAL 154 6.358 8.385 1.025 591 1HG1 VAL 154 1HG1 VAL 154 3.931 8.259 0.685 592 2HG1 VAL 154 2HG1 VAL 154 3.756 7.495 2.264 593 3HG1 VAL 154 3HG1 VAL 154 4.346 9.153 2.147 594 1HG2 VAL 154 1HG2 VAL 154 6.330 6.508 3.298 595 2HG2 VAL 154 2HG2 VAL 154 7.429 7.839 2.935 596 3HG2 VAL 154 3HG2 VAL 154 5.857 8.167 3.664 597 H ILE 155 H ILE 155 7.557 5.901 -0.954 598 HA ILE 155 HA ILE 155 9.357 4.391 0.788 599 HB ILE 155 HB ILE 155 9.911 4.791 -2.116 600 1HG1 ILE 155 1HG1 ILE 155 8.404 2.446 -1.969 601 2HG1 ILE 155 2HG1 ILE 155 7.476 3.623 -1.045 602 1HG2 ILE 155 1HG2 ILE 155 11.488 3.574 -0.687 603 2HG2 ILE 155 2HG2 ILE 155 10.215 2.426 -0.271 604 3HG2 ILE 155 3HG2 ILE 155 10.795 2.534 -1.933 605 1HD1 ILE 155 1HD1 ILE 155 8.521 4.392 -3.721 606 2HD1 ILE 155 2HD1 ILE 155 7.110 3.340 -3.612 607 3HD1 ILE 155 3HD1 ILE 155 7.076 4.940 -2.871 608 H GLU 156 H GLU 156 11.404 5.032 1.284 609 HA GLU 156 HA GLU 156 12.101 7.791 0.568 610 1HB GLU 156 1HB GLU 156 12.156 6.375 3.008 611 2HB GLU 156 2HB GLU 156 13.834 6.653 2.561 612 1HG GLU 156 1HG GLU 156 12.505 9.072 2.093 613 2HG GLU 156 2HG GLU 156 11.910 8.477 3.643 614 1H10 BTN 222 1H10 BTN 122 -12.814 -12.709 2.991 615 2H10 BTN 222 2H10 BTN 122 -11.327 -11.855 2.581 616 1H9 BTN 222 1H9 BTN 122 -11.261 -14.737 2.042 617 2H9 BTN 222 2H9 BTN 122 -11.433 -14.310 3.746 618 1H8 BTN 222 1H8 BTN 122 -9.292 -13.274 1.889 619 2H8 BTN 222 2H8 BTN 122 -9.078 -14.549 3.090 620 1H7 BTN 222 1H7 BTN 122 -8.489 -12.946 4.507 621 2H7 BTN 222 2H7 BTN 122 -10.190 -12.502 4.545 622 H2 BTN 222 H2 BTN 122 -9.510 -11.089 2.405 623 1H6 BTN 222 1H6 BTN 122 -6.478 -8.630 3.497 624 2H6 BTN 222 2H6 BTN 122 -7.730 -8.644 2.266 625 H5 BTN 222 H5 BTN 122 -9.010 -7.994 4.099 626 HN1 BTN 222 HN2 BTN 122 -7.237 -8.268 5.916 627 HN2 BTN 222 HN1 BTN 122 -9.698 -11.390 5.996 628 H4 BTN 222 H4 BTN 122 -10.412 -9.806 4.125 Start of MODEL 11 1 1H GLU 77 H GLU 77 12.576 17.067 1.596 2 HA GLU 77 HA GLU 77 10.573 16.506 -0.258 3 1HB GLU 77 1HB GLU 77 10.687 18.934 -0.729 4 2HB GLU 77 2HB GLU 77 12.388 18.757 -1.146 5 1HG GLU 77 1HG GLU 77 11.757 17.240 -2.974 6 2HG GLU 77 2HG GLU 77 10.059 17.497 -2.576 7 H ILE 78 H ILE 78 12.277 14.822 0.759 8 HA ILE 78 HA ILE 78 14.769 14.521 -0.519 9 HB ILE 78 HB ILE 78 14.907 12.401 0.478 10 1HG1 ILE 78 1HG1 ILE 78 13.008 11.245 -0.300 11 2HG1 ILE 78 2HG1 ILE 78 12.789 11.313 1.446 12 1HG2 ILE 78 1HG2 ILE 78 14.644 14.404 2.019 13 2HG2 ILE 78 2HG2 ILE 78 13.013 13.809 2.331 14 3HG2 ILE 78 3HG2 ILE 78 14.408 12.809 2.736 15 1HD1 ILE 78 1HD1 ILE 78 11.281 13.235 1.149 16 2HD1 ILE 78 2HD1 ILE 78 11.457 13.072 -0.599 17 3HD1 ILE 78 3HD1 ILE 78 10.708 11.778 0.337 18 H SER 79 H SER 79 15.071 12.153 -1.621 19 HA SER 79 HA SER 79 13.443 12.308 -4.052 20 1HB SER 79 1HB SER 79 15.876 12.439 -4.352 21 2HB SER 79 2HB SER 79 16.067 10.882 -3.546 22 HG SER 79 HG SER 79 14.332 10.453 -5.433 23 H GLY 80 H GLY 80 12.067 11.213 -1.980 24 1HA GLY 80 1HA GLY 80 12.323 8.319 -2.085 25 2HA GLY 80 2HA GLY 80 11.187 9.232 -1.102 26 H HIS 81 H HIS 81 9.755 7.455 -1.896 27 HA HIS 81 HA HIS 81 8.347 8.390 -4.279 28 1HB HIS 81 1HB HIS 81 8.241 5.538 -4.312 29 2HB HIS 81 2HB HIS 81 8.871 6.625 -5.544 30 HD1 HIS 81 HD1 HIS 81 11.477 7.482 -4.847 31 HD2 HIS 81 HD2 HIS 81 10.121 3.807 -3.460 32 HE1 HIS 81 HE1 HIS 81 13.547 6.182 -4.252 33 HE2 HIS 81 HE2 HIS 81 12.699 3.990 -3.346 34 H ILE 82 H ILE 82 6.315 8.737 -3.700 35 HA ILE 82 HA ILE 82 5.184 7.201 -1.470 36 HB ILE 82 HB ILE 82 4.293 9.795 -2.731 37 1HG1 ILE 82 1HG1 ILE 82 4.903 10.786 -0.600 38 2HG1 ILE 82 2HG1 ILE 82 5.302 9.203 0.059 39 1HG2 ILE 82 1HG2 ILE 82 2.997 8.064 -0.652 40 2HG2 ILE 82 2HG2 ILE 82 2.689 9.798 -0.738 41 3HG2 ILE 82 3HG2 ILE 82 2.289 8.761 -2.108 42 1HD1 ILE 82 1HD1 ILE 82 6.726 10.237 -2.353 43 2HD1 ILE 82 2HD1 ILE 82 7.196 10.758 -0.734 44 3HD1 ILE 82 3HD1 ILE 82 7.256 9.048 -1.162 45 H VAL 83 H VAL 83 3.550 5.808 -1.745 46 HA VAL 83 HA VAL 83 2.505 5.452 -4.460 47 HB VAL 83 HB VAL 83 2.270 3.599 -2.085 48 1HG1 VAL 83 1HG1 VAL 83 0.796 3.660 -4.429 49 2HG1 VAL 83 2HG1 VAL 83 2.026 2.432 -4.726 50 3HG1 VAL 83 3HG1 VAL 83 0.961 2.293 -3.327 51 1HG2 VAL 83 1HG2 VAL 83 4.461 4.110 -3.887 52 2HG2 VAL 83 2HG2 VAL 83 4.395 3.065 -2.467 53 3HG2 VAL 83 3HG2 VAL 83 3.894 2.446 -4.040 54 H ARG 84 H ARG 84 0.646 6.439 -4.886 55 HA ARG 84 HA ARG 84 -1.300 6.813 -2.721 56 1HB ARG 84 1HB ARG 84 -2.266 8.574 -4.043 57 2HB ARG 84 2HB ARG 84 -0.527 8.824 -3.974 58 1HG ARG 84 1HG ARG 84 -0.455 7.598 -6.222 59 2HG ARG 84 2HG ARG 84 -2.196 7.882 -6.274 60 1HD ARG 84 1HD ARG 84 -1.855 9.960 -6.976 61 2HD ARG 84 2HD ARG 84 -0.905 10.307 -5.532 62 HE ARG 84 HE ARG 84 0.793 8.956 -7.216 63 1HH1 ARG 84 1HH1 ARG 84 -1.095 11.878 -7.367 64 2HH1 ARG 84 2HH1 ARG 84 -0.003 12.683 -8.443 65 1HH2 ARG 84 1HH2 ARG 84 2.239 10.007 -8.635 66 2HH2 ARG 84 2HH2 ARG 84 1.892 11.619 -9.165 67 H SER 85 H SER 85 -3.389 6.086 -2.878 68 HA SER 85 HA SER 85 -3.854 3.787 -4.458 69 1HB SER 85 1HB SER 85 -6.114 5.321 -3.226 70 2HB SER 85 2HB SER 85 -5.860 3.578 -3.309 71 HG SER 85 HG SER 85 -5.477 4.299 -1.213 72 HA PRO 86 HA PRO 86 -5.025 6.102 -8.136 73 1HB PRO 86 1HB PRO 86 -5.256 3.922 -9.742 74 2HB PRO 86 2HB PRO 86 -3.701 4.658 -9.335 75 1HG PRO 86 1HG PRO 86 -5.022 2.246 -8.154 76 2HG PRO 86 2HG PRO 86 -3.322 2.489 -8.596 77 1HD PRO 86 1HD PRO 86 -4.206 2.677 -6.042 78 2HD PRO 86 2HD PRO 86 -2.852 3.645 -6.659 79 H MET 87 H MET 87 -6.776 3.931 -6.240 80 HA MET 87 HA MET 87 -9.277 4.874 -7.329 81 1HB MET 87 1HB MET 87 -8.515 2.756 -8.631 82 2HB MET 87 2HB MET 87 -8.964 1.893 -7.166 83 1HG MET 87 1HG MET 87 -10.987 1.767 -8.081 84 2HG MET 87 2HG MET 87 -11.158 3.452 -7.593 85 1HE MET 87 1HE MET 87 -11.393 0.980 -10.338 86 2HE MET 87 2HE MET 87 -12.806 1.988 -10.026 87 3HE MET 87 3HE MET 87 -12.005 2.054 -11.596 88 H VAL 88 H VAL 88 -11.083 4.433 -5.959 89 HA VAL 88 HA VAL 88 -10.510 4.586 -3.218 90 HB VAL 88 HB VAL 88 -13.086 3.954 -4.656 91 1HG1 VAL 88 1HG1 VAL 88 -12.571 4.365 -1.719 92 2HG1 VAL 88 2HG1 VAL 88 -14.162 4.550 -2.457 93 3HG1 VAL 88 3HG1 VAL 88 -13.343 2.988 -2.506 94 1HG2 VAL 88 1HG2 VAL 88 -12.077 6.208 -4.973 95 2HG2 VAL 88 2HG2 VAL 88 -13.661 6.240 -4.197 96 3HG2 VAL 88 3HG2 VAL 88 -12.202 6.461 -3.233 97 H GLY 89 H GLY 89 -11.194 3.107 -1.510 98 1HA GLY 89 1HA GLY 89 -12.010 0.521 -1.687 99 2HA GLY 89 2HA GLY 89 -10.298 0.425 -2.072 100 H THR 90 H THR 90 -10.819 -1.003 -0.012 101 HA THR 90 HA THR 90 -10.483 0.631 2.403 102 HB THR 90 HB THR 90 -10.884 -2.335 2.468 103 HG1 THR 90 HG1 THR 90 -12.663 -0.480 1.494 104 1HG2 THR 90 1HG2 THR 90 -11.678 -0.057 4.252 105 2HG2 THR 90 2HG2 THR 90 -12.323 -1.689 4.427 106 3HG2 THR 90 3HG2 THR 90 -10.592 -1.401 4.608 107 H PHE 91 H PHE 91 -8.352 1.108 2.551 108 HA PHE 91 HA PHE 91 -6.232 -0.569 1.790 109 1HB PHE 91 1HB PHE 91 -6.081 1.904 2.153 110 2HB PHE 91 2HB PHE 91 -6.154 1.606 3.889 111 HD1 PHE 91 HD1 PHE 91 -4.262 0.109 1.031 112 HD2 PHE 91 HD2 PHE 91 -4.124 1.877 4.909 113 HE1 PHE 91 HE1 PHE 91 -1.816 -0.192 1.077 114 HE2 PHE 91 HE2 PHE 91 -1.677 1.581 4.961 115 HZ PHE 91 HZ PHE 91 -0.520 0.544 3.044 116 H TYR 92 H TYR 92 -4.592 -1.519 3.228 117 HA TYR 92 HA TYR 92 -5.317 -2.198 5.917 118 1HB TYR 92 1HB TYR 92 -5.622 -4.191 3.709 119 2HB TYR 92 2HB TYR 92 -5.178 -4.728 5.325 120 HD1 TYR 92 HD1 TYR 92 -6.734 -3.759 7.253 121 HD2 TYR 92 HD2 TYR 92 -7.865 -4.111 3.158 122 HE1 TYR 92 HE1 TYR 92 -9.107 -3.733 7.912 123 HE2 TYR 92 HE2 TYR 92 -10.241 -4.085 3.806 124 HH TYR 92 HH TYR 92 -11.295 -3.188 6.899 125 H ARG 93 H ARG 93 -3.707 -3.855 6.823 126 HA ARG 93 HA ARG 93 -1.094 -3.548 5.504 127 1HB ARG 93 1HB ARG 93 -1.913 -2.808 8.261 128 2HB ARG 93 2HB ARG 93 -0.331 -3.551 8.073 129 1HG ARG 93 1HG ARG 93 0.400 -1.819 6.617 130 2HG ARG 93 2HG ARG 93 -1.230 -1.151 6.500 131 1HD ARG 93 1HD ARG 93 0.271 0.127 8.011 132 2HD ARG 93 2HD ARG 93 -1.184 -0.478 8.800 133 HE ARG 93 HE ARG 93 1.554 -1.354 9.261 134 1HH1 ARG 93 1HH1 ARG 93 -1.847 -1.840 9.864 135 2HH1 ARG 93 2HH1 ARG 93 -1.587 -2.801 11.280 136 1HH2 ARG 93 1HH2 ARG 93 1.899 -2.623 11.120 137 2HH2 ARG 93 2HH2 ARG 93 0.540 -3.248 11.993 138 H THR 94 H THR 94 -3.370 -5.673 6.527 139 HA THR 94 HA THR 94 -1.409 -7.831 6.672 140 HB THR 94 HB THR 94 -2.735 -8.866 8.562 141 HG1 THR 94 HG1 THR 94 -3.745 -6.225 8.777 142 1HG2 THR 94 1HG2 THR 94 -1.179 -6.343 8.991 143 2HG2 THR 94 2HG2 THR 94 -1.835 -7.280 10.335 144 3HG2 THR 94 3HG2 THR 94 -0.671 -8.016 9.233 145 HA PRO 95 HA PRO 95 -4.369 -9.232 3.581 146 1HB PRO 95 1HB PRO 95 -2.691 -11.668 3.891 147 2HB PRO 95 2HB PRO 95 -3.164 -10.806 2.423 148 1HG PRO 95 1HG PRO 95 -0.689 -10.597 3.383 149 2HG PRO 95 2HG PRO 95 -1.515 -9.196 2.677 150 1HD PRO 95 1HD PRO 95 -1.018 -9.858 5.546 151 2HD PRO 95 2HD PRO 95 -1.009 -8.280 4.733 152 H SER 96 H SER 96 -4.699 -12.106 3.548 153 HA SER 96 HA SER 96 -6.977 -12.584 4.828 154 1HB SER 96 1HB SER 96 -4.651 -14.497 4.573 155 2HB SER 96 2HB SER 96 -6.264 -14.996 5.089 156 HG SER 96 HG SER 96 -5.757 -15.176 2.770 157 HA PRO 97 HA PRO 97 -6.936 -12.338 9.205 158 1HB PRO 97 1HB PRO 97 -7.754 -15.215 9.164 159 2HB PRO 97 2HB PRO 97 -8.460 -13.859 10.051 160 1HG PRO 97 1HG PRO 97 -9.625 -14.794 7.845 161 2HG PRO 97 2HG PRO 97 -9.587 -13.055 8.192 162 1HD PRO 97 1HD PRO 97 -8.034 -14.624 6.202 163 2HD PRO 97 2HD PRO 97 -8.574 -12.935 6.139 164 H ASP 98 H ASP 98 -5.338 -15.025 7.629 165 HA ASP 98 HA ASP 98 -3.495 -15.235 9.919 166 1HB ASP 98 1HB ASP 98 -2.966 -17.523 8.762 167 2HB ASP 98 2HB ASP 98 -4.402 -17.365 9.768 168 H ALA 99 H ALA 99 -2.862 -13.192 8.418 169 HA ALA 99 HA ALA 99 -0.933 -14.096 6.399 170 1HB ALA 99 1HB ALA 99 -2.772 -12.204 6.106 171 2HB ALA 99 2HB ALA 99 -1.489 -11.211 6.794 172 3HB ALA 99 3HB ALA 99 -1.201 -12.117 5.309 173 H LYS 100 H LYS 100 0.803 -11.977 6.373 174 HA LYS 100 HA LYS 100 1.976 -11.945 9.070 175 1HB LYS 100 1HB LYS 100 3.022 -13.249 6.753 176 2HB LYS 100 2HB LYS 100 4.079 -11.904 7.157 177 1HG LYS 100 1HG LYS 100 3.351 -13.369 9.525 178 2HG LYS 100 2HG LYS 100 4.049 -14.440 8.308 179 1HD LYS 100 1HD LYS 100 5.591 -12.059 8.362 180 2HD LYS 100 2HD LYS 100 5.372 -12.600 10.028 181 1HE LYS 100 1HE LYS 100 6.674 -14.406 9.739 182 2HE LYS 100 2HE LYS 100 6.010 -14.745 8.140 183 1HZ LYS 100 1HZ LYS 100 7.752 -12.418 8.388 184 2HZ LYS 100 2HZ LYS 100 8.488 -13.937 8.499 185 3HZ LYS 100 3HZ LYS 100 7.601 -13.525 7.118 186 H ALA 101 H ALA 101 0.408 -9.926 7.780 187 HA ALA 101 HA ALA 101 0.395 -7.684 7.404 188 1HB ALA 101 1HB ALA 101 1.942 -8.034 9.548 189 2HB ALA 101 2HB ALA 101 3.131 -7.308 8.467 190 3HB ALA 101 3HB ALA 101 1.638 -6.447 8.841 191 H PHE 102 H PHE 102 0.481 -7.068 5.350 192 HA PHE 102 HA PHE 102 2.436 -7.791 3.491 193 1HB PHE 102 1HB PHE 102 0.037 -6.240 3.518 194 2HB PHE 102 2HB PHE 102 1.280 -5.320 2.678 195 HD1 PHE 102 HD1 PHE 102 2.830 -7.449 1.377 196 HD2 PHE 102 HD2 PHE 102 -1.384 -7.004 1.857 197 HE1 PHE 102 HE1 PHE 102 2.461 -8.803 -0.649 198 HE2 PHE 102 HE2 PHE 102 -1.761 -8.359 -0.168 199 HZ PHE 102 HZ PHE 102 0.162 -9.260 -1.423 200 H ILE 103 H ILE 103 3.064 -5.340 2.190 201 HA ILE 103 HA ILE 103 5.474 -4.681 3.518 202 HB ILE 103 HB ILE 103 4.062 -3.362 1.202 203 1HG1 ILE 103 1HG1 ILE 103 6.183 -4.373 0.063 204 2HG1 ILE 103 2HG1 ILE 103 6.255 -5.390 1.499 205 1HG2 ILE 103 1HG2 ILE 103 6.203 -2.355 2.817 206 2HG2 ILE 103 2HG2 ILE 103 6.785 -2.678 1.184 207 3HG2 ILE 103 3HG2 ILE 103 5.404 -1.610 1.432 208 1HD1 ILE 103 1HD1 ILE 103 3.634 -5.257 0.178 209 2HD1 ILE 103 2HD1 ILE 103 4.922 -6.033 -0.744 210 3HD1 ILE 103 3HD1 ILE 103 4.501 -6.634 0.860 211 H GLU 104 H GLU 104 5.410 -3.670 5.434 212 HA GLU 104 HA GLU 104 3.755 -1.241 5.652 213 1HB GLU 104 1HB GLU 104 4.643 -2.268 8.202 214 2HB GLU 104 2HB GLU 104 3.012 -1.916 7.648 215 1HG GLU 104 1HG GLU 104 2.861 -4.104 6.616 216 2HG GLU 104 2HG GLU 104 4.523 -4.459 7.087 217 H VAL 105 H VAL 105 4.806 -0.081 7.858 218 HA VAL 105 HA VAL 105 7.037 1.281 6.885 219 HB VAL 105 HB VAL 105 6.525 1.083 9.830 220 1HG1 VAL 105 1HG1 VAL 105 7.880 2.886 7.996 221 2HG1 VAL 105 2HG1 VAL 105 6.770 3.724 9.082 222 3HG1 VAL 105 3HG1 VAL 105 8.052 2.707 9.742 223 1HG2 VAL 105 1HG2 VAL 105 4.655 2.037 7.753 224 2HG2 VAL 105 2HG2 VAL 105 4.333 1.413 9.371 225 3HG2 VAL 105 3HG2 VAL 105 4.866 3.081 9.159 226 H GLY 106 H GLY 106 9.200 1.038 7.089 227 1HA GLY 106 1HA GLY 106 11.196 0.236 8.045 228 2HA GLY 106 2HA GLY 106 10.262 -0.943 8.953 229 H GLN 107 H GLN 107 8.818 -2.132 6.892 230 HA GLN 107 HA GLN 107 10.642 -4.037 5.953 231 1HB GLN 107 1HB GLN 107 8.302 -4.581 6.199 232 2HB GLN 107 2HB GLN 107 7.850 -3.366 5.012 233 1HG GLN 107 1HG GLN 107 8.854 -4.622 3.245 234 2HG GLN 107 2HG GLN 107 9.548 -5.769 4.391 235 1HE2 GLN 107 2HE2 GLN 107 8.074 -6.715 2.342 236 2HE2 GLN 107 1HE2 GLN 107 6.554 -7.309 2.911 237 H LYS 108 H LYS 108 10.899 -4.607 3.576 238 HA LYS 108 HA LYS 108 11.140 -2.218 1.890 239 1HB LYS 108 1HB LYS 108 13.347 -2.427 2.704 240 2HB LYS 108 2HB LYS 108 13.317 -4.180 2.574 241 1HG LYS 108 1HG LYS 108 14.108 -4.113 0.506 242 2HG LYS 108 2HG LYS 108 12.877 -2.953 0.006 243 1HD LYS 108 1HD LYS 108 14.670 -1.606 -0.286 244 2HD LYS 108 2HD LYS 108 14.474 -1.338 1.447 245 1HE LYS 108 1HE LYS 108 16.118 -3.077 1.912 246 2HE LYS 108 2HE LYS 108 16.296 -3.384 0.185 247 1HZ LYS 108 1HZ LYS 108 16.692 -0.630 0.892 248 2HZ LYS 108 2HZ LYS 108 17.799 -1.665 1.642 249 3HZ LYS 108 3HZ LYS 108 17.658 -1.655 -0.044 250 H VAL 109 H VAL 109 10.956 -2.575 -0.318 251 HA VAL 109 HA VAL 109 10.393 -5.328 -1.179 252 HB VAL 109 HB VAL 109 8.681 -3.831 -2.737 253 1HG1 VAL 109 1HG1 VAL 109 8.328 -6.069 -1.717 254 2HG1 VAL 109 2HG1 VAL 109 7.946 -5.269 -0.193 255 3HG1 VAL 109 3HG1 VAL 109 6.924 -5.009 -1.606 256 1HG2 VAL 109 1HG2 VAL 109 9.033 -1.912 -1.187 257 2HG2 VAL 109 2HG2 VAL 109 7.356 -2.451 -1.287 258 3HG2 VAL 109 3HG2 VAL 109 8.342 -2.890 0.108 259 H ASN 110 H ASN 110 9.957 -5.130 -3.750 260 HA ASN 110 HA ASN 110 12.125 -3.478 -4.858 261 1HB ASN 110 1HB ASN 110 12.032 -6.309 -4.718 262 2HB ASN 110 2HB ASN 110 11.820 -5.859 -6.406 263 1HD2 ASN 110 2HD2 ASN 110 13.643 -4.124 -3.950 264 2HD2 ASN 110 1HD2 ASN 110 15.188 -4.316 -4.700 265 H VAL 111 H VAL 111 11.963 -3.384 -7.326 266 HA VAL 111 HA VAL 111 9.387 -2.355 -7.993 267 HB VAL 111 HB VAL 111 11.731 -2.878 -9.826 268 1HG1 VAL 111 1HG1 VAL 111 9.067 -1.747 -10.221 269 2HG1 VAL 111 2HG1 VAL 111 10.373 -0.710 -10.795 270 3HG1 VAL 111 3HG1 VAL 111 10.227 -2.360 -11.400 271 1HG2 VAL 111 1HG2 VAL 111 11.451 -1.021 -7.693 272 2HG2 VAL 111 2HG2 VAL 111 12.778 -1.184 -8.844 273 3HG2 VAL 111 3HG2 VAL 111 11.414 -0.127 -9.213 274 H GLY 112 H GLY 112 7.865 -3.982 -7.952 275 1HA GLY 112 1HA GLY 112 6.833 -5.265 -9.917 276 2HA GLY 112 2HA GLY 112 8.286 -6.244 -9.793 277 H ASP 113 H ASP 113 8.198 -5.876 -6.796 278 HA ASP 113 HA ASP 113 6.739 -8.251 -6.222 279 1HB ASP 113 1HB ASP 113 8.646 -6.568 -4.886 280 2HB ASP 113 2HB ASP 113 7.312 -6.934 -3.798 281 H THR 114 H THR 114 5.178 -8.312 -4.320 282 HA THR 114 HA THR 114 2.868 -6.865 -4.976 283 HB THR 114 HB THR 114 3.230 -8.015 -2.237 284 HG1 THR 114 HG1 THR 114 3.325 -9.412 -4.671 285 1HG2 THR 114 1HG2 THR 114 1.009 -7.704 -4.174 286 2HG2 THR 114 2HG2 THR 114 0.991 -9.105 -3.103 287 3HG2 THR 114 3HG2 THR 114 1.033 -7.477 -2.425 288 H LEU 115 H LEU 115 1.639 -5.774 -2.950 289 HA LEU 115 HA LEU 115 3.416 -3.894 -1.597 290 1HB LEU 115 1HB LEU 115 2.843 -2.785 -3.690 291 2HB LEU 115 2HB LEU 115 1.137 -3.048 -3.385 292 HG LEU 115 HG LEU 115 1.790 -1.676 -1.157 293 1HD1 LEU 115 1HD1 LEU 115 4.146 -1.485 -2.216 294 2HD1 LEU 115 2HD1 LEU 115 3.399 -0.257 -3.238 295 3HD1 LEU 115 3HD1 LEU 115 3.408 -0.059 -1.485 296 1HD2 LEU 115 1HD2 LEU 115 -0.036 -1.220 -2.763 297 2HD2 LEU 115 2HD2 LEU 115 0.778 0.243 -2.208 298 3HD2 LEU 115 3HD2 LEU 115 1.127 -0.407 -3.810 299 H CYS 116 H CYS 116 -0.092 -4.135 -2.194 300 HA CYS 116 HA CYS 116 -0.736 -5.140 0.363 301 1HB CYS 116 1HB CYS 116 -0.486 -2.206 0.101 302 2HB CYS 116 2HB CYS 116 -1.950 -2.778 0.895 303 HG CYS 116 HG CYS 116 -0.587 -2.966 2.910 304 H ILE 117 H ILE 117 -3.023 -5.322 0.715 305 HA ILE 117 HA ILE 117 -4.501 -5.436 -1.772 306 HB ILE 117 HB ILE 117 -5.099 -6.376 1.024 307 1HG1 ILE 117 1HG1 ILE 117 -5.348 -8.201 -1.260 308 2HG1 ILE 117 2HG1 ILE 117 -3.727 -7.541 -1.052 309 1HG2 ILE 117 1HG2 ILE 117 -6.956 -6.245 -1.335 310 2HG2 ILE 117 2HG2 ILE 117 -7.192 -7.373 0.000 311 3HG2 ILE 117 3HG2 ILE 117 -7.217 -5.635 0.299 312 1HD1 ILE 117 1HD1 ILE 117 -3.866 -8.288 1.349 313 2HD1 ILE 117 2HD1 ILE 117 -5.331 -9.160 0.901 314 3HD1 ILE 117 3HD1 ILE 117 -3.794 -9.571 0.141 315 H VAL 118 H VAL 118 -6.552 -4.478 -2.112 316 HA VAL 118 HA VAL 118 -6.924 -1.971 -0.616 317 HB VAL 118 HB VAL 118 -8.199 -2.569 -3.271 318 1HG1 VAL 118 1HG1 VAL 118 -8.431 -0.476 -1.486 319 2HG1 VAL 118 2HG1 VAL 118 -7.320 0.140 -2.710 320 3HG1 VAL 118 3HG1 VAL 118 -8.910 -0.458 -3.183 321 1HG2 VAL 118 1HG2 VAL 118 -5.480 -2.620 -2.961 322 2HG2 VAL 118 2HG2 VAL 118 -6.331 -2.214 -4.451 323 3HG2 VAL 118 3HG2 VAL 118 -5.780 -0.932 -3.372 324 H GLU 119 H GLU 119 -8.502 -4.893 -1.715 325 HA GLU 119 HA GLU 119 -10.618 -5.718 -1.413 326 1HB GLU 119 1HB GLU 119 -9.337 -5.795 0.868 327 2HB GLU 119 2HB GLU 119 -10.498 -4.568 1.353 328 1HG GLU 119 1HG GLU 119 -11.136 -7.347 0.382 329 2HG GLU 119 2HG GLU 119 -11.245 -6.758 2.039 330 H ALA 120 H ALA 120 -11.292 -3.845 -2.883 331 HA ALA 120 HA ALA 120 -13.006 -1.921 -1.485 332 1HB ALA 120 1HB ALA 120 -11.309 -1.244 -3.287 333 2HB ALA 120 2HB ALA 120 -12.467 -1.915 -4.435 334 3HB ALA 120 3HB ALA 120 -12.937 -0.573 -3.390 335 H MET 121 H MET 121 -13.306 -4.949 -2.586 336 HA MET 121 HA MET 121 -16.107 -4.957 -2.612 337 1HB MET 121 1HB MET 121 -16.652 -5.294 -4.910 338 2HB MET 121 2HB MET 121 -15.691 -3.824 -4.820 339 1HG MET 121 1HG MET 121 -13.726 -5.040 -5.566 340 2HG MET 121 2HG MET 121 -14.652 -6.539 -5.605 341 1HE MET 121 1HE MET 121 -16.762 -6.890 -7.168 342 2HE MET 121 2HE MET 121 -17.482 -5.328 -6.775 343 3HE MET 121 3HE MET 121 -17.238 -5.788 -8.462 344 H LYS 122 H LYS 122 -13.952 -6.422 -1.472 345 HA LYS 122 HA LYS 122 -13.367 -8.557 -0.952 346 1HB LYS 122 1HB LYS 122 -15.984 -8.684 -1.152 347 2HB LYS 122 2HB LYS 122 -15.630 -9.626 -2.594 348 1HG LYS 122 1HG LYS 122 -16.016 -10.888 -0.414 349 2HG LYS 122 2HG LYS 122 -14.605 -11.330 -1.377 350 1HD LYS 122 1HD LYS 122 -14.237 -11.092 1.120 351 2HD LYS 122 2HD LYS 122 -13.134 -10.194 0.075 352 1HE LYS 122 1HE LYS 122 -14.688 -8.213 0.378 353 2HE LYS 122 2HE LYS 122 -15.465 -9.143 1.660 354 H MET 123 H MET 123 -12.195 -7.352 -3.228 355 HA MET 123 HA MET 123 -11.771 -9.680 -4.984 356 1HB MET 123 1HB MET 123 -11.472 -8.281 -6.804 357 2HB MET 123 2HB MET 123 -12.709 -7.420 -5.900 358 1HG MET 123 1HG MET 123 -10.696 -6.179 -4.831 359 2HG MET 123 2HG MET 123 -9.817 -6.768 -6.240 360 1HE MET 123 1HE MET 123 -10.339 -3.987 -5.079 361 2HE MET 123 2HE MET 123 -9.701 -3.545 -6.663 362 3HE MET 123 3HE MET 123 -11.243 -2.886 -6.118 363 H MET 124 H MET 124 -10.402 -7.926 -2.526 364 HA MET 124 HA MET 124 -8.283 -7.584 -1.753 365 1HB MET 124 1HB MET 124 -7.908 -10.267 -3.099 366 2HB MET 124 2HB MET 124 -6.813 -9.572 -1.912 367 1HG MET 124 1HG MET 124 -7.999 -10.865 -0.508 368 2HG MET 124 2HG MET 124 -9.083 -9.476 -0.502 369 1HE MET 124 1HE MET 124 -11.176 -10.326 0.091 370 2HE MET 124 2HE MET 124 -12.049 -11.695 -0.598 371 3HE MET 124 3HE MET 124 -10.661 -11.974 0.454 372 H ASN 125 H ASN 125 -8.770 -6.322 -4.237 373 HA ASN 125 HA ASN 125 -6.785 -6.746 -6.164 374 1HB ASN 125 1HB ASN 125 -8.603 -5.347 -6.768 375 2HB ASN 125 2HB ASN 125 -8.353 -4.293 -5.377 376 1HD2 ASN 125 2HD2 ASN 125 -7.989 -2.391 -6.332 377 2HD2 ASN 125 1HD2 ASN 125 -6.709 -2.076 -7.450 378 H GLN 126 H GLN 126 -4.870 -7.184 -4.981 379 HA GLN 126 HA GLN 126 -3.709 -5.052 -3.398 380 1HB GLN 126 1HB GLN 126 -2.159 -6.604 -2.640 381 2HB GLN 126 2HB GLN 126 -3.582 -7.598 -2.922 382 1HG GLN 126 1HG GLN 126 -2.211 -7.607 -5.344 383 2HG GLN 126 2HG GLN 126 -0.963 -7.754 -4.106 384 1HE2 GLN 126 2HE2 GLN 126 -2.869 -9.486 -6.072 385 2HE2 GLN 126 1HE2 GLN 126 -3.019 -10.944 -5.158 386 H ILE 127 H ILE 127 -1.891 -3.893 -3.889 387 HA ILE 127 HA ILE 127 -1.209 -3.788 -6.729 388 HB ILE 127 HB ILE 127 -0.407 -1.879 -4.532 389 1HG1 ILE 127 1HG1 ILE 127 -2.693 -1.547 -4.591 390 2HG1 ILE 127 2HG1 ILE 127 -2.171 -0.438 -5.854 391 1HG2 ILE 127 1HG2 ILE 127 -0.140 -1.838 -7.518 392 2HG2 ILE 127 2HG2 ILE 127 -0.109 -0.356 -6.564 393 3HG2 ILE 127 3HG2 ILE 127 1.105 -1.606 -6.293 394 1HD1 ILE 127 1HD1 ILE 127 -2.610 -2.361 -7.472 395 2HD1 ILE 127 2HD1 ILE 127 -3.480 -3.113 -6.136 396 3HD1 ILE 127 3HD1 ILE 127 -4.004 -1.548 -6.760 397 H GLU 128 H GLU 128 1.071 -3.447 -7.329 398 HA GLU 128 HA GLU 128 2.848 -5.068 -5.632 399 1HB GLU 128 1HB GLU 128 3.153 -4.581 -8.595 400 2HB GLU 128 2HB GLU 128 4.001 -5.766 -7.610 401 1HG GLU 128 1HG GLU 128 2.433 -7.273 -7.994 402 2HG GLU 128 2HG GLU 128 1.184 -6.186 -7.384 403 H ALA 129 H ALA 129 4.456 -4.028 -4.676 404 HA ALA 129 HA ALA 129 5.010 -1.418 -4.593 405 1HB ALA 129 1HB ALA 129 6.981 -3.690 -4.521 406 2HB ALA 129 2HB ALA 129 7.417 -2.025 -4.135 407 3HB ALA 129 3HB ALA 129 6.213 -2.870 -3.162 408 H ASP 130 H ASP 130 4.878 -0.167 -6.391 409 HA ASP 130 HA ASP 130 6.116 -0.819 -8.868 410 1HB ASP 130 1HB ASP 130 5.636 1.681 -9.331 411 2HB ASP 130 2HB ASP 130 4.267 0.602 -9.072 412 H LYS 131 H LYS 131 7.148 0.837 -6.002 413 HA LYS 131 HA LYS 131 9.727 1.411 -7.306 414 1HB LYS 131 1HB LYS 131 7.939 3.207 -5.920 415 2HB LYS 131 2HB LYS 131 9.493 3.137 -5.102 416 1HG LYS 131 1HG LYS 131 9.537 4.925 -6.688 417 2HG LYS 131 2HG LYS 131 10.599 3.638 -7.263 418 1HD LYS 131 1HD LYS 131 8.740 2.838 -8.713 419 2HD LYS 131 2HD LYS 131 7.800 4.246 -8.213 420 1HE LYS 131 1HE LYS 131 10.195 4.080 -9.972 421 2HE LYS 131 2HE LYS 131 8.717 5.023 -10.166 422 1HZ LYS 131 1HZ LYS 131 10.873 5.595 -8.203 423 2HZ LYS 131 2HZ LYS 131 10.625 6.424 -9.656 424 3HZ LYS 131 3HZ LYS 131 9.468 6.509 -8.425 425 H SER 132 H SER 132 11.502 0.647 -6.313 426 HA SER 132 HA SER 132 11.136 -1.016 -3.969 427 1HB SER 132 1HB SER 132 13.271 -1.922 -4.445 428 2HB SER 132 2HB SER 132 12.536 -1.638 -6.023 429 HG SER 132 HG SER 132 14.770 -0.895 -5.736 430 H GLY 133 H GLY 133 12.739 -0.916 -2.177 431 1HA GLY 133 1HA GLY 133 14.495 0.756 -1.291 432 2HA GLY 133 2HA GLY 133 13.168 1.899 -1.433 433 H THR 134 H THR 134 13.541 2.222 0.876 434 HA THR 134 HA THR 134 12.415 0.065 2.531 435 HB THR 134 HB THR 134 14.165 2.409 3.301 436 HG1 THR 134 HG1 THR 134 14.624 -0.376 3.103 437 1HG2 THR 134 1HG2 THR 134 13.096 0.199 5.040 438 2HG2 THR 134 2HG2 THR 134 14.308 1.391 5.512 439 3HG2 THR 134 3HG2 THR 134 12.664 1.906 5.135 440 H VAL 135 H VAL 135 10.304 0.343 2.840 441 HA VAL 135 HA VAL 135 8.817 2.635 2.479 442 HB VAL 135 HB VAL 135 8.201 0.445 4.467 443 1HG1 VAL 135 1HG1 VAL 135 6.569 2.621 3.215 444 2HG1 VAL 135 2HG1 VAL 135 5.815 1.120 3.752 445 3HG1 VAL 135 3HG1 VAL 135 6.673 2.139 4.908 446 1HG2 VAL 135 1HG2 VAL 135 8.394 0.393 1.604 447 2HG2 VAL 135 2HG2 VAL 135 8.033 -0.921 2.723 448 3HG2 VAL 135 3HG2 VAL 135 6.730 0.093 2.104 449 H LYS 136 H LYS 136 8.625 4.493 3.539 450 HA LYS 136 HA LYS 136 10.027 4.894 6.024 451 1HB LYS 136 1HB LYS 136 9.436 6.513 3.898 452 2HB LYS 136 2HB LYS 136 8.257 7.046 5.088 453 1HG LYS 136 1HG LYS 136 11.245 6.958 5.444 454 2HG LYS 136 2HG LYS 136 10.249 8.398 5.226 455 1HD LYS 136 1HD LYS 136 10.161 8.494 7.458 456 2HD LYS 136 2HD LYS 136 9.058 7.120 7.360 457 1HE LYS 136 1HE LYS 136 11.064 5.622 7.459 458 2HE LYS 136 2HE LYS 136 12.042 7.052 7.782 459 1HZ LYS 136 1HZ LYS 136 9.803 6.944 9.523 460 2HZ LYS 136 2HZ LYS 136 10.699 5.512 9.627 461 3HZ LYS 136 3HZ LYS 136 11.450 7.002 9.903 462 H ALA 137 H ALA 137 6.644 5.033 4.949 463 HA ALA 137 HA ALA 137 5.525 3.909 7.206 464 1HB ALA 137 1HB ALA 137 6.553 6.335 7.941 465 2HB ALA 137 2HB ALA 137 4.865 6.727 7.606 466 3HB ALA 137 3HB ALA 137 5.263 5.475 8.783 467 H ILE 138 H ILE 138 3.141 4.411 7.422 468 HA ILE 138 HA ILE 138 2.042 4.787 4.735 469 HB ILE 138 HB ILE 138 0.818 3.616 7.233 470 1HG1 ILE 138 1HG1 ILE 138 1.841 2.438 4.650 471 2HG1 ILE 138 2HG1 ILE 138 2.375 2.081 6.289 472 1HG2 ILE 138 1HG2 ILE 138 -0.804 4.858 5.789 473 2HG2 ILE 138 2HG2 ILE 138 -0.413 3.733 4.488 474 3HG2 ILE 138 3HG2 ILE 138 -1.151 3.139 5.976 475 1HD1 ILE 138 1HD1 ILE 138 -0.230 1.383 6.442 476 2HD1 ILE 138 2HD1 ILE 138 0.125 1.003 4.757 477 3HD1 ILE 138 3HD1 ILE 138 1.083 0.273 6.045 478 H LEU 139 H LEU 139 0.276 6.166 4.329 479 HA LEU 139 HA LEU 139 -0.106 8.269 6.359 480 1HB LEU 139 1HB LEU 139 0.631 8.412 3.564 481 2HB LEU 139 2HB LEU 139 -0.831 9.328 3.876 482 HG LEU 139 HG LEU 139 0.339 10.606 5.621 483 1HD1 LEU 139 1HD1 LEU 139 2.433 8.606 5.071 484 2HD1 LEU 139 2HD1 LEU 139 2.985 10.264 5.303 485 3HD1 LEU 139 3HD1 LEU 139 2.042 9.465 6.561 486 1HD2 LEU 139 1HD2 LEU 139 1.693 10.547 2.927 487 2HD2 LEU 139 2HD2 LEU 139 0.297 11.519 3.393 488 3HD2 LEU 139 3HD2 LEU 139 1.874 11.837 4.116 489 H VAL 140 H VAL 140 -1.605 5.958 4.314 490 HA VAL 140 HA VAL 140 -4.211 7.140 4.275 491 HB VAL 140 HB VAL 140 -3.246 4.350 3.657 492 1HG1 VAL 140 1HG1 VAL 140 -6.042 5.464 3.471 493 2HG1 VAL 140 2HG1 VAL 140 -5.513 3.953 2.732 494 3HG1 VAL 140 3HG1 VAL 140 -5.495 4.130 4.486 495 1HG2 VAL 140 1HG2 VAL 140 -3.404 6.796 2.186 496 2HG2 VAL 140 2HG2 VAL 140 -2.776 5.231 1.674 497 3HG2 VAL 140 3HG2 VAL 140 -4.485 5.607 1.462 498 H GLU 141 H GLU 141 -2.609 4.667 6.232 499 HA GLU 141 HA GLU 141 -3.039 4.078 8.417 500 1HB GLU 141 1HB GLU 141 -5.698 5.480 8.281 501 2HB GLU 141 2HB GLU 141 -4.722 5.117 9.699 502 1HG GLU 141 1HG GLU 141 -2.993 6.704 8.568 503 2HG GLU 141 2HG GLU 141 -4.402 7.290 7.685 504 H SER 142 H SER 142 -3.216 1.933 7.940 505 HA SER 142 HA SER 142 -4.995 0.527 6.508 506 1HB SER 142 1HB SER 142 -3.606 -1.007 7.408 507 2HB SER 142 2HB SER 142 -3.373 -0.059 8.876 508 HG SER 142 HG SER 142 -5.023 -2.171 8.423 509 H GLY 143 H GLY 143 -6.901 -0.806 7.128 510 1HA GLY 143 1HA GLY 143 -9.031 -1.018 7.956 511 2HA GLY 143 2HA GLY 143 -8.466 -0.195 9.402 512 H GLN 144 H GLN 144 -7.835 1.680 6.701 513 HA GLN 144 HA GLN 144 -10.333 3.196 7.089 514 1HB GLN 144 1HB GLN 144 -8.060 4.175 7.907 515 2HB GLN 144 2HB GLN 144 -7.774 4.484 6.199 516 1HG GLN 144 1HG GLN 144 -10.137 5.600 6.320 517 2HG GLN 144 2HG GLN 144 -9.765 5.704 8.041 518 1HE2 GLN 144 2HE2 GLN 144 -7.816 6.081 5.100 519 2HE2 GLN 144 1HE2 GLN 144 -7.219 7.654 5.491 520 HA PRO 145 HA PRO 145 -10.912 2.424 2.749 521 1HB PRO 145 1HB PRO 145 -13.084 4.005 2.406 522 2HB PRO 145 2HB PRO 145 -13.164 2.439 3.221 523 1HG PRO 145 1HG PRO 145 -13.024 5.186 4.405 524 2HG PRO 145 2HG PRO 145 -14.035 3.810 4.887 525 1HD PRO 145 1HD PRO 145 -11.754 4.483 6.192 526 2HD PRO 145 2HD PRO 145 -12.328 2.807 6.064 527 H VAL 146 H VAL 146 -9.566 3.301 1.307 528 HA VAL 146 HA VAL 146 -8.701 6.000 1.376 529 HB VAL 146 HB VAL 146 -7.534 5.532 -0.692 530 1HG1 VAL 146 1HG1 VAL 146 -7.326 3.938 1.670 531 2HG1 VAL 146 2HG1 VAL 146 -6.890 2.961 0.269 532 3HG1 VAL 146 3HG1 VAL 146 -6.051 4.480 0.580 533 1HG2 VAL 146 1HG2 VAL 146 -9.585 4.171 -1.562 534 2HG2 VAL 146 2HG2 VAL 146 -7.959 3.770 -2.117 535 3HG2 VAL 146 3HG2 VAL 146 -8.727 2.800 -0.859 536 H GLU 147 H GLU 147 -9.035 7.643 -0.221 537 HA GLU 147 HA GLU 147 -11.550 7.375 -1.728 538 1HB GLU 147 1HB GLU 147 -10.668 9.897 -0.321 539 2HB GLU 147 2HB GLU 147 -12.206 9.604 -1.125 540 1HG GLU 147 1HG GLU 147 -12.118 7.598 0.736 541 2HG GLU 147 2HG GLU 147 -11.342 8.940 1.576 542 H PHE 148 H PHE 148 -9.705 6.798 -3.298 543 HA PHE 148 HA PHE 148 -8.493 7.317 -5.151 544 1HB PHE 148 1HB PHE 148 -10.612 8.374 -5.809 545 2HB PHE 148 2HB PHE 148 -10.095 9.866 -5.040 546 HD1 PHE 148 HD1 PHE 148 -7.525 7.976 -6.707 547 HD2 PHE 148 HD2 PHE 148 -10.535 10.948 -7.250 548 HE1 PHE 148 HE1 PHE 148 -6.444 8.681 -8.807 549 HE2 PHE 148 HE2 PHE 148 -9.460 11.657 -9.353 550 HZ PHE 148 HZ PHE 148 -7.412 10.523 -10.133 551 H ASP 149 H ASP 149 -6.404 7.780 -5.200 552 HA ASP 149 HA ASP 149 -4.412 8.842 -4.914 553 1HB ASP 149 1HB ASP 149 -5.888 10.805 -5.784 554 2HB ASP 149 2HB ASP 149 -5.835 11.362 -4.113 555 H GLU 150 H GLU 150 -4.821 7.302 -2.919 556 HA GLU 150 HA GLU 150 -4.399 8.911 -0.486 557 1HB GLU 150 1HB GLU 150 -6.446 7.177 -0.857 558 2HB GLU 150 2HB GLU 150 -5.240 6.095 -0.175 559 1HG GLU 150 1HG GLU 150 -6.047 6.772 1.789 560 2HG GLU 150 2HG GLU 150 -5.070 8.213 1.514 561 HA PRO 151 HA PRO 151 -0.226 7.275 -0.919 562 1HB PRO 151 1HB PRO 151 -0.190 8.322 1.875 563 2HB PRO 151 2HB PRO 151 0.974 8.565 0.568 564 1HG PRO 151 1HG PRO 151 -0.732 10.494 1.237 565 2HG PRO 151 2HG PRO 151 -0.321 10.192 -0.462 566 1HD PRO 151 1HD PRO 151 -2.805 9.509 1.038 567 2HD PRO 151 2HD PRO 151 -2.603 9.980 -0.661 568 H LEU 152 H LEU 152 -0.943 5.073 -0.901 569 HA LEU 152 HA LEU 152 -1.733 3.703 1.437 570 1HB LEU 152 1HB LEU 152 -0.379 2.515 -0.981 571 2HB LEU 152 2HB LEU 152 -1.398 1.678 0.177 572 HG LEU 152 HG LEU 152 -2.699 3.942 -1.179 573 1HD1 LEU 152 1HD1 LEU 152 -1.330 1.853 -2.702 574 2HD1 LEU 152 2HD1 LEU 152 -3.043 2.028 -3.086 575 3HD1 LEU 152 3HD1 LEU 152 -1.962 3.414 -3.226 576 1HD2 LEU 152 1HD2 LEU 152 -3.877 2.416 0.322 577 2HD2 LEU 152 2HD2 LEU 152 -4.532 2.341 -1.313 578 3HD2 LEU 152 3HD2 LEU 152 -3.468 1.061 -0.730 579 H VAL 153 H VAL 153 1.416 4.126 -0.125 580 HA VAL 153 HA VAL 153 2.746 3.628 2.393 581 HB VAL 153 HB VAL 153 3.491 1.890 0.042 582 1HG1 VAL 153 1HG1 VAL 153 4.694 2.498 2.593 583 2HG1 VAL 153 2HG1 VAL 153 4.361 0.773 2.443 584 3HG1 VAL 153 3HG1 VAL 153 5.347 1.590 1.230 585 1HG2 VAL 153 1HG2 VAL 153 1.788 1.228 2.441 586 2HG2 VAL 153 2HG2 VAL 153 1.314 1.173 0.743 587 3HG2 VAL 153 3HG2 VAL 153 2.498 0.024 1.366 588 H VAL 154 H VAL 154 4.481 4.899 2.565 589 HA VAL 154 HA VAL 154 5.520 6.147 0.110 590 HB VAL 154 HB VAL 154 6.126 8.059 1.357 591 1HG1 VAL 154 1HG1 VAL 154 3.474 7.120 1.332 592 2HG1 VAL 154 2HG1 VAL 154 3.724 7.877 2.906 593 3HG1 VAL 154 3HG1 VAL 154 4.031 8.791 1.429 594 1HG2 VAL 154 1HG2 VAL 154 5.972 6.213 3.657 595 2HG2 VAL 154 2HG2 VAL 154 7.099 7.529 3.330 596 3HG2 VAL 154 3HG2 VAL 154 5.490 7.881 3.960 597 H ILE 155 H ILE 155 7.438 5.456 -0.543 598 HA ILE 155 HA ILE 155 9.194 4.058 1.317 599 HB ILE 155 HB ILE 155 9.769 4.468 -1.601 600 1HG1 ILE 155 1HG1 ILE 155 8.545 1.933 -1.186 601 2HG1 ILE 155 2HG1 ILE 155 7.471 3.157 -0.517 602 1HG2 ILE 155 1HG2 ILE 155 10.575 2.502 0.510 603 2HG2 ILE 155 2HG2 ILE 155 10.720 2.110 -1.205 604 3HG2 ILE 155 3HG2 ILE 155 11.592 3.491 -0.539 605 1HD1 ILE 155 1HD1 ILE 155 8.255 4.201 -2.957 606 2HD1 ILE 155 2HD1 ILE 155 8.018 2.481 -3.266 607 3HD1 ILE 155 3HD1 ILE 155 6.710 3.442 -2.575 608 H GLU 156 H GLU 156 11.512 4.515 1.325 609 HA GLU 156 HA GLU 156 12.414 7.088 0.390 610 1HB GLU 156 1HB GLU 156 11.318 7.814 2.410 611 2HB GLU 156 2HB GLU 156 12.096 6.543 3.343 612 1HG GLU 156 1HG GLU 156 13.718 8.617 1.924 613 2HG GLU 156 2HG GLU 156 13.003 8.943 3.502 614 1H10 BTN 222 1H10 BTN 122 -13.708 -6.729 4.700 615 2H10 BTN 222 2H10 BTN 122 -12.472 -6.670 3.446 616 1H9 BTN 222 1H9 BTN 122 -11.300 -8.543 4.570 617 2H9 BTN 222 2H9 BTN 122 -12.489 -8.460 5.870 618 1H8 BTN 222 1H8 BTN 122 -11.688 -6.459 6.666 619 2H8 BTN 222 2H8 BTN 122 -11.029 -5.978 5.102 620 1H7 BTN 222 1H7 BTN 122 -9.835 -8.379 6.311 621 2H7 BTN 222 2H7 BTN 122 -9.546 -6.873 7.172 622 H2 BTN 222 H2 BTN 122 -8.247 -5.991 5.483 623 1H6 BTN 222 1H6 BTN 122 -8.720 -8.973 2.249 624 2H6 BTN 222 2H6 BTN 122 -9.792 -9.260 3.611 625 H5 BTN 222 H5 BTN 122 -6.833 -9.151 3.557 626 HN1 BTN 222 HN2 BTN 122 -8.117 -11.133 4.527 627 HN2 BTN 222 HN1 BTN 122 -7.600 -8.383 7.354 628 H4 BTN 222 H4 BTN 122 -6.567 -7.532 5.173 Start of MODEL 12 1 1H GLU 77 H GLU 77 13.419 16.149 -6.653 2 HA GLU 77 HA GLU 77 14.229 16.388 -3.872 3 1HB GLU 77 1HB GLU 77 11.697 17.558 -5.008 4 2HB GLU 77 2HB GLU 77 11.835 17.119 -3.309 5 1HG GLU 77 1HG GLU 77 13.865 18.620 -3.224 6 2HG GLU 77 2HG GLU 77 13.385 19.201 -4.818 7 H ILE 78 H ILE 78 12.697 15.139 -2.429 8 HA ILE 78 HA ILE 78 12.075 12.985 -1.904 9 HB ILE 78 HB ILE 78 9.925 13.944 -2.277 10 1HG1 ILE 78 1HG1 ILE 78 8.633 12.019 -2.961 11 2HG1 ILE 78 2HG1 ILE 78 10.001 11.364 -3.855 12 1HG2 ILE 78 1HG2 ILE 78 10.386 14.981 -4.442 13 2HG2 ILE 78 2HG2 ILE 78 10.322 13.398 -5.215 14 3HG2 ILE 78 3HG2 ILE 78 8.873 14.075 -4.471 15 1HD1 ILE 78 1HD1 ILE 78 11.214 11.229 -1.651 16 2HD1 ILE 78 2HD1 ILE 78 9.669 11.591 -0.882 17 3HD1 ILE 78 3HD1 ILE 78 9.848 10.132 -1.855 18 H SER 79 H SER 79 13.719 11.617 -2.478 19 HA SER 79 HA SER 79 14.038 10.729 -5.207 20 1HB SER 79 1HB SER 79 15.654 9.073 -3.835 21 2HB SER 79 2HB SER 79 16.118 10.719 -4.263 22 HG SER 79 HG SER 79 16.493 10.444 -2.087 23 H GLY 80 H GLY 80 11.691 10.072 -3.170 24 1HA GLY 80 1HA GLY 80 11.661 7.174 -3.736 25 2HA GLY 80 2HA GLY 80 10.838 7.925 -2.377 26 H HIS 81 H HIS 81 8.760 7.374 -2.784 27 HA HIS 81 HA HIS 81 7.311 8.842 -4.711 28 1HB HIS 81 1HB HIS 81 6.568 7.067 -6.187 29 2HB HIS 81 2HB HIS 81 8.325 7.164 -6.233 30 HD1 HIS 81 HD1 HIS 81 5.946 4.688 -6.399 31 HD2 HIS 81 HD2 HIS 81 9.243 5.206 -3.924 32 HE1 HIS 81 HE1 HIS 81 6.506 2.393 -5.535 33 HE2 HIS 81 HE2 HIS 81 8.463 2.741 -3.987 34 H ILE 82 H ILE 82 5.523 9.265 -3.612 35 HA ILE 82 HA ILE 82 4.564 7.425 -1.585 36 HB ILE 82 HB ILE 82 3.596 10.161 -2.416 37 1HG1 ILE 82 1HG1 ILE 82 4.553 10.895 -0.305 38 2HG1 ILE 82 2HG1 ILE 82 4.995 9.241 0.105 39 1HG2 ILE 82 1HG2 ILE 82 2.424 8.126 -0.634 40 2HG2 ILE 82 2HG2 ILE 82 2.468 9.774 -0.008 41 3HG2 ILE 82 3HG2 ILE 82 1.651 9.432 -1.532 42 1HD1 ILE 82 1HD1 ILE 82 6.070 10.581 -2.346 43 2HD1 ILE 82 2HD1 ILE 82 6.819 10.796 -0.764 44 3HD1 ILE 82 3HD1 ILE 82 6.705 9.186 -1.474 45 H VAL 83 H VAL 83 3.017 5.969 -1.895 46 HA VAL 83 HA VAL 83 1.514 6.010 -4.397 47 HB VAL 83 HB VAL 83 1.333 3.835 -2.333 48 1HG1 VAL 83 1HG1 VAL 83 0.369 4.268 -5.000 49 2HG1 VAL 83 2HG1 VAL 83 1.410 2.844 -4.957 50 3HG1 VAL 83 3HG1 VAL 83 0.014 2.948 -3.884 51 1HG2 VAL 83 1HG2 VAL 83 3.705 4.649 -3.747 52 2HG2 VAL 83 2HG2 VAL 83 3.500 3.380 -2.538 53 3HG2 VAL 83 3HG2 VAL 83 3.210 3.030 -4.242 54 H ARG 84 H ARG 84 -0.341 7.095 -4.388 55 HA ARG 84 HA ARG 84 -1.962 7.134 -1.939 56 1HB ARG 84 1HB ARG 84 -3.145 9.035 -2.998 57 2HB ARG 84 2HB ARG 84 -1.424 9.333 -2.797 58 1HG ARG 84 1HG ARG 84 -1.672 8.204 -5.334 59 2HG ARG 84 2HG ARG 84 -3.020 9.334 -5.190 60 1HD ARG 84 1HD ARG 84 -1.011 10.812 -4.144 61 2HD ARG 84 2HD ARG 84 -0.121 9.840 -5.315 62 HE ARG 84 HE ARG 84 -1.961 11.965 -5.874 63 1HH1 ARG 84 1HH1 ARG 84 -0.580 9.012 -7.102 64 2HH1 ARG 84 2HH1 ARG 84 -0.845 9.427 -8.763 65 1HH2 ARG 84 1HH2 ARG 84 -2.314 12.520 -8.056 66 2HH2 ARG 84 2HH2 ARG 84 -1.833 11.422 -9.305 67 H SER 85 H SER 85 -3.812 6.040 -1.828 68 HA SER 85 HA SER 85 -4.639 4.079 -3.479 69 1HB SER 85 1HB SER 85 -5.669 5.198 -1.218 70 2HB SER 85 2HB SER 85 -6.909 5.623 -2.397 71 HG SER 85 HG SER 85 -7.125 3.441 -2.899 72 HA PRO 86 HA PRO 86 -5.380 6.547 -7.237 73 1HB PRO 86 1HB PRO 86 -5.952 3.775 -8.165 74 2HB PRO 86 2HB PRO 86 -4.953 5.027 -8.909 75 1HG PRO 86 1HG PRO 86 -3.836 2.961 -7.651 76 2HG PRO 86 2HG PRO 86 -3.141 4.588 -7.534 77 1HD PRO 86 1HD PRO 86 -4.738 3.057 -5.532 78 2HD PRO 86 2HD PRO 86 -3.392 4.187 -5.279 79 H MET 87 H MET 87 -7.355 3.708 -6.354 80 HA MET 87 HA MET 87 -9.756 5.303 -6.970 81 1HB MET 87 1HB MET 87 -9.287 3.386 -8.542 82 2HB MET 87 2HB MET 87 -9.530 2.299 -7.180 83 1HG MET 87 1HG MET 87 -11.816 3.343 -6.925 84 2HG MET 87 2HG MET 87 -11.537 4.106 -8.489 85 1HE MET 87 1HE MET 87 -12.713 3.345 -10.243 86 2HE MET 87 2HE MET 87 -13.267 1.710 -10.608 87 3HE MET 87 3HE MET 87 -13.993 2.610 -9.277 88 H VAL 88 H VAL 88 -11.531 5.109 -5.589 89 HA VAL 88 HA VAL 88 -11.048 4.902 -2.881 90 HB VAL 88 HB VAL 88 -13.636 4.533 -4.386 91 1HG1 VAL 88 1HG1 VAL 88 -13.169 4.777 -1.419 92 2HG1 VAL 88 2HG1 VAL 88 -14.738 4.974 -2.198 93 3HG1 VAL 88 3HG1 VAL 88 -13.903 3.423 -2.277 94 1HG2 VAL 88 1HG2 VAL 88 -12.308 6.750 -4.374 95 2HG2 VAL 88 2HG2 VAL 88 -14.034 6.792 -4.010 96 3HG2 VAL 88 3HG2 VAL 88 -12.854 6.883 -2.702 97 H GLY 89 H GLY 89 -11.966 3.346 -1.315 98 1HA GLY 89 1HA GLY 89 -12.896 0.843 -1.676 99 2HA GLY 89 2HA GLY 89 -11.192 0.657 -2.064 100 H THR 90 H THR 90 -9.961 0.019 -0.437 101 HA THR 90 HA THR 90 -10.116 1.178 2.160 102 HB THR 90 HB THR 90 -10.737 -1.758 2.152 103 HG1 THR 90 HG1 THR 90 -12.739 -1.402 1.682 104 1HG2 THR 90 1HG2 THR 90 -10.140 -0.050 4.187 105 2HG2 THR 90 2HG2 THR 90 -11.903 -0.030 4.188 106 3HG2 THR 90 3HG2 THR 90 -11.040 -1.559 4.348 107 H PHE 91 H PHE 91 -8.120 1.173 2.959 108 HA PHE 91 HA PHE 91 -6.080 -0.428 1.684 109 1HB PHE 91 1HB PHE 91 -5.690 1.951 2.268 110 2HB PHE 91 2HB PHE 91 -5.830 1.533 3.974 111 HD1 PHE 91 HD1 PHE 91 -3.987 0.195 1.006 112 HD2 PHE 91 HD2 PHE 91 -3.829 1.440 5.081 113 HE1 PHE 91 HE1 PHE 91 -1.581 -0.335 1.070 114 HE2 PHE 91 HE2 PHE 91 -1.423 0.912 5.153 115 HZ PHE 91 HZ PHE 91 -0.297 0.024 3.145 116 H TYR 92 H TYR 92 -4.375 -1.459 3.130 117 HA TYR 92 HA TYR 92 -5.339 -2.541 5.628 118 1HB TYR 92 1HB TYR 92 -5.168 -4.166 3.133 119 2HB TYR 92 2HB TYR 92 -4.787 -4.923 4.676 120 HD1 TYR 92 HD1 TYR 92 -6.671 -4.033 6.560 121 HD2 TYR 92 HD2 TYR 92 -7.280 -4.703 2.394 122 HE1 TYR 92 HE1 TYR 92 -9.072 -4.392 6.975 123 HE2 TYR 92 HE2 TYR 92 -9.684 -5.063 2.797 124 HH TYR 92 HH TYR 92 -11.340 -4.125 5.014 125 H ARG 93 H ARG 93 -3.644 -4.401 6.279 126 HA ARG 93 HA ARG 93 -0.951 -3.654 5.441 127 1HB ARG 93 1HB ARG 93 -2.132 -3.119 8.108 128 2HB ARG 93 2HB ARG 93 -0.495 -3.761 8.088 129 1HG ARG 93 1HG ARG 93 0.312 -1.914 6.844 130 2HG ARG 93 2HG ARG 93 -1.325 -1.345 6.506 131 1HD ARG 93 1HD ARG 93 -0.349 0.021 8.235 132 2HD ARG 93 2HD ARG 93 -1.649 -0.951 8.923 133 HE ARG 93 HE ARG 93 0.783 -2.315 9.250 134 1HH1 ARG 93 1HH1 ARG 93 -0.877 0.518 10.408 135 2HH1 ARG 93 2HH1 ARG 93 -0.088 0.510 11.950 136 1HH2 ARG 93 1HH2 ARG 93 1.828 -2.337 11.278 137 2HH2 ARG 93 2HH2 ARG 93 1.450 -1.115 12.445 138 H THR 94 H THR 94 -2.989 -6.028 5.644 139 HA THR 94 HA THR 94 -0.932 -8.007 6.150 140 HB THR 94 HB THR 94 -2.473 -9.312 7.666 141 HG1 THR 94 HG1 THR 94 -3.766 -6.822 8.022 142 1HG2 THR 94 1HG2 THR 94 -1.332 -6.694 8.570 143 2HG2 THR 94 2HG2 THR 94 -2.120 -7.812 9.684 144 3HG2 THR 94 3HG2 THR 94 -0.686 -8.319 8.791 145 HA PRO 95 HA PRO 95 -2.993 -9.689 2.585 146 1HB PRO 95 1HB PRO 95 -1.574 -12.163 3.368 147 2HB PRO 95 2HB PRO 95 -1.513 -11.264 1.849 148 1HG PRO 95 1HG PRO 95 0.534 -11.215 3.572 149 2HG PRO 95 2HG PRO 95 0.078 -9.781 2.634 150 1HD PRO 95 1HD PRO 95 -0.460 -10.422 5.505 151 2HD PRO 95 2HD PRO 95 -0.038 -8.869 4.755 152 H SER 96 H SER 96 -3.378 -12.547 2.542 153 HA SER 96 HA SER 96 -5.928 -12.950 3.171 154 1HB SER 96 1HB SER 96 -5.504 -15.319 3.415 155 2HB SER 96 2HB SER 96 -4.395 -14.672 2.204 156 HG SER 96 HG SER 96 -3.159 -15.899 3.538 157 HA PRO 97 HA PRO 97 -6.733 -12.530 7.473 158 1HB PRO 97 1HB PRO 97 -8.590 -14.521 7.832 159 2HB PRO 97 2HB PRO 97 -8.949 -12.950 7.108 160 1HG PRO 97 1HG PRO 97 -8.401 -15.570 5.774 161 2HG PRO 97 2HG PRO 97 -9.611 -14.338 5.370 162 1HD PRO 97 1HD PRO 97 -7.320 -14.581 3.985 163 2HD PRO 97 2HD PRO 97 -8.066 -12.998 4.286 164 H ASP 98 H ASP 98 -4.367 -13.712 7.273 165 HA ASP 98 HA ASP 98 -4.028 -15.168 9.577 166 1HB ASP 98 1HB ASP 98 -5.263 -16.806 7.720 167 2HB ASP 98 2HB ASP 98 -3.565 -17.250 7.581 168 H ALA 99 H ALA 99 -2.752 -13.170 7.944 169 HA ALA 99 HA ALA 99 -0.155 -14.462 7.424 170 1HB ALA 99 1HB ALA 99 -1.628 -12.314 6.026 171 2HB ALA 99 2HB ALA 99 0.120 -12.124 6.153 172 3HB ALA 99 3HB ALA 99 -0.556 -13.559 5.386 173 H LYS 100 H LYS 100 1.505 -12.327 7.391 174 HA LYS 100 HA LYS 100 1.589 -11.605 10.207 175 1HB LYS 100 1HB LYS 100 3.528 -12.299 8.343 176 2HB LYS 100 2HB LYS 100 3.756 -10.570 8.566 177 1HG LYS 100 1HG LYS 100 4.224 -10.806 10.842 178 2HG LYS 100 2HG LYS 100 3.548 -12.435 10.903 179 1HD LYS 100 1HD LYS 100 5.893 -12.709 10.956 180 2HD LYS 100 2HD LYS 100 5.400 -13.112 9.310 181 1HE LYS 100 1HE LYS 100 6.097 -10.949 8.518 182 2HE LYS 100 2HE LYS 100 6.441 -10.415 10.162 183 1HZ LYS 100 1HZ LYS 100 8.176 -12.110 10.292 184 2HZ LYS 100 2HZ LYS 100 7.862 -12.571 8.696 185 3HZ LYS 100 3HZ LYS 100 8.466 -11.025 9.027 186 H ALA 101 H ALA 101 2.364 -9.783 7.253 187 HA ALA 101 HA ALA 101 0.500 -7.765 7.471 188 1HB ALA 101 1HB ALA 101 2.804 -7.443 9.296 189 2HB ALA 101 2HB ALA 101 2.270 -6.011 8.415 190 3HB ALA 101 3HB ALA 101 1.142 -6.877 9.458 191 H PHE 102 H PHE 102 0.552 -6.692 5.606 192 HA PHE 102 HA PHE 102 2.364 -7.181 3.585 193 1HB PHE 102 1HB PHE 102 0.395 -4.977 4.077 194 2HB PHE 102 2HB PHE 102 1.475 -4.882 2.690 195 HD1 PHE 102 HD1 PHE 102 1.596 -7.183 1.311 196 HD2 PHE 102 HD2 PHE 102 -1.674 -5.894 3.725 197 HE1 PHE 102 HE1 PHE 102 0.079 -8.644 0.029 198 HE2 PHE 102 HE2 PHE 102 -3.197 -7.354 2.449 199 HZ PHE 102 HZ PHE 102 -2.320 -8.731 0.599 200 H ILE 103 H ILE 103 3.325 -4.913 2.478 201 HA ILE 103 HA ILE 103 5.711 -4.470 3.937 202 HB ILE 103 HB ILE 103 4.723 -2.751 1.669 203 1HG1 ILE 103 1HG1 ILE 103 4.481 -4.899 0.762 204 2HG1 ILE 103 2HG1 ILE 103 6.107 -4.432 0.274 205 1HG2 ILE 103 1HG2 ILE 103 7.034 -2.685 3.217 206 2HG2 ILE 103 2HG2 ILE 103 7.525 -3.442 1.702 207 3HG2 ILE 103 3HG2 ILE 103 6.757 -1.855 1.686 208 1HD1 ILE 103 1HD1 ILE 103 5.493 -6.127 2.680 209 2HD1 ILE 103 2HD1 ILE 103 5.906 -6.766 1.089 210 3HD1 ILE 103 3HD1 ILE 103 7.076 -5.791 1.979 211 H GLU 104 H GLU 104 5.492 -3.486 5.879 212 HA GLU 104 HA GLU 104 3.967 -0.992 6.040 213 1HB GLU 104 1HB GLU 104 5.176 -1.833 8.525 214 2HB GLU 104 2HB GLU 104 3.480 -1.571 8.143 215 1HG GLU 104 1HG GLU 104 3.462 -3.850 7.102 216 2HG GLU 104 2HG GLU 104 5.081 -4.087 7.762 217 H VAL 105 H VAL 105 5.311 0.151 8.216 218 HA VAL 105 HA VAL 105 7.359 1.580 6.872 219 HB VAL 105 HB VAL 105 7.083 1.618 9.854 220 1HG1 VAL 105 1HG1 VAL 105 8.003 3.443 7.705 221 2HG1 VAL 105 2HG1 VAL 105 7.239 4.167 9.121 222 3HG1 VAL 105 3HG1 VAL 105 8.670 3.155 9.313 223 1HG2 VAL 105 1HG2 VAL 105 4.989 2.232 7.896 224 2HG2 VAL 105 2HG2 VAL 105 4.868 1.908 9.625 225 3HG2 VAL 105 3HG2 VAL 105 5.306 3.520 9.059 226 H GLY 106 H GLY 106 9.588 1.655 7.286 227 1HA GLY 106 1HA GLY 106 11.662 0.830 7.843 228 2HA GLY 106 2HA GLY 106 10.887 -0.051 9.150 229 H GLN 107 H GLN 107 9.350 -0.813 6.306 230 HA GLN 107 HA GLN 107 10.834 -3.331 6.132 231 1HB GLN 107 1HB GLN 107 8.190 -2.974 6.387 232 2HB GLN 107 2HB GLN 107 8.295 -2.931 4.633 233 1HG GLN 107 1HG GLN 107 9.216 -5.171 6.421 234 2HG GLN 107 2HG GLN 107 7.777 -5.160 5.404 235 1HE2 GLN 107 2HE2 GLN 107 8.231 -4.727 3.048 236 2HE2 GLN 107 1HE2 GLN 107 9.597 -5.532 2.362 237 H LYS 108 H LYS 108 11.584 -4.143 4.117 238 HA LYS 108 HA LYS 108 11.750 -2.114 1.989 239 1HB LYS 108 1HB LYS 108 13.930 -2.483 2.937 240 2HB LYS 108 2HB LYS 108 13.743 -4.227 2.815 241 1HG LYS 108 1HG LYS 108 14.555 -4.234 0.756 242 2HG LYS 108 2HG LYS 108 13.402 -3.003 0.239 243 1HD LYS 108 1HD LYS 108 14.897 -1.325 0.464 244 2HD LYS 108 2HD LYS 108 15.626 -2.034 1.907 245 1HE LYS 108 1HE LYS 108 16.074 -3.503 -0.606 246 2HE LYS 108 2HE LYS 108 16.839 -1.918 -0.504 247 1HZ LYS 108 1HZ LYS 108 17.692 -2.713 1.739 248 2HZ LYS 108 2HZ LYS 108 17.249 -4.268 1.241 249 3HZ LYS 108 3HZ LYS 108 18.401 -3.395 0.363 250 H VAL 109 H VAL 109 11.511 -2.766 -0.152 251 HA VAL 109 HA VAL 109 10.939 -5.550 -0.745 252 HB VAL 109 HB VAL 109 8.752 -4.790 -0.025 253 1HG1 VAL 109 1HG1 VAL 109 9.140 -2.585 -2.043 254 2HG1 VAL 109 2HG1 VAL 109 7.599 -2.970 -1.275 255 3HG1 VAL 109 3HG1 VAL 109 8.957 -2.419 -0.296 256 1HG2 VAL 109 1HG2 VAL 109 8.900 -6.342 -1.930 257 2HG2 VAL 109 2HG2 VAL 109 7.470 -5.312 -2.017 258 3HG2 VAL 109 3HG2 VAL 109 8.869 -4.967 -3.034 259 H ASN 110 H ASN 110 11.727 -6.045 -2.684 260 HA ASN 110 HA ASN 110 12.661 -3.915 -4.420 261 1HB ASN 110 1HB ASN 110 13.700 -5.789 -5.708 262 2HB ASN 110 2HB ASN 110 14.201 -5.728 -4.021 263 1HD2 ASN 110 2HD2 ASN 110 14.730 -8.010 -5.013 264 2HD2 ASN 110 1HD2 ASN 110 13.568 -9.229 -4.626 265 H VAL 111 H VAL 111 12.180 -3.831 -6.684 266 HA VAL 111 HA VAL 111 9.501 -3.869 -7.333 267 HB VAL 111 HB VAL 111 11.886 -4.097 -9.171 268 1HG1 VAL 111 1HG1 VAL 111 9.164 -4.519 -9.792 269 2HG1 VAL 111 2HG1 VAL 111 9.609 -2.941 -10.441 270 3HG1 VAL 111 3HG1 VAL 111 10.526 -4.374 -10.902 271 1HG2 VAL 111 1HG2 VAL 111 10.903 -1.980 -7.614 272 2HG2 VAL 111 2HG2 VAL 111 12.132 -1.908 -8.877 273 3HG2 VAL 111 3HG2 VAL 111 10.437 -1.620 -9.276 274 H GLY 112 H GLY 112 8.071 -5.400 -7.843 275 1HA GLY 112 1HA GLY 112 7.479 -7.360 -9.134 276 2HA GLY 112 2HA GLY 112 9.083 -7.998 -8.804 277 H ASP 113 H ASP 113 8.006 -6.584 -6.020 278 HA ASP 113 HA ASP 113 7.081 -9.174 -4.984 279 1HB ASP 113 1HB ASP 113 8.956 -7.228 -4.004 280 2HB ASP 113 2HB ASP 113 7.659 -7.447 -2.834 281 H THR 114 H THR 114 5.540 -9.008 -3.105 282 HA THR 114 HA THR 114 3.196 -7.676 -3.923 283 HB THR 114 HB THR 114 3.831 -8.829 -1.200 284 HG1 THR 114 HG1 THR 114 3.936 -10.592 -2.340 285 1HG2 THR 114 1HG2 THR 114 1.263 -8.068 -2.528 286 2HG2 THR 114 2HG2 THR 114 1.322 -9.338 -1.305 287 3HG2 THR 114 3HG2 THR 114 1.830 -7.700 -0.899 288 H LEU 115 H LEU 115 1.942 -6.146 -2.569 289 HA LEU 115 HA LEU 115 3.633 -4.279 -1.060 290 1HB LEU 115 1HB LEU 115 3.467 -3.334 -3.270 291 2HB LEU 115 2HB LEU 115 1.729 -3.569 -3.288 292 HG LEU 115 HG LEU 115 1.917 -1.984 -1.130 293 1HD1 LEU 115 1HD1 LEU 115 4.355 -1.795 -1.314 294 2HD1 LEU 115 2HD1 LEU 115 4.172 -1.101 -2.925 295 3HD1 LEU 115 3HD1 LEU 115 3.554 -0.237 -1.517 296 1HD2 LEU 115 1HD2 LEU 115 1.633 -1.381 -4.042 297 2HD2 LEU 115 2HD2 LEU 115 0.418 -1.349 -2.763 298 3HD2 LEU 115 3HD2 LEU 115 1.623 -0.066 -2.867 299 H CYS 116 H CYS 116 0.240 -4.280 -2.133 300 HA CYS 116 HA CYS 116 -0.836 -5.015 0.377 301 1HB CYS 116 1HB CYS 116 -0.226 -2.176 -0.038 302 2HB CYS 116 2HB CYS 116 -1.899 -2.479 0.418 303 HG CYS 116 HG CYS 116 -0.962 -3.671 2.590 304 H ILE 117 H ILE 117 -3.245 -4.597 0.454 305 HA ILE 117 HA ILE 117 -4.323 -4.821 -2.274 306 HB ILE 117 HB ILE 117 -5.354 -5.889 0.353 307 1HG1 ILE 117 1HG1 ILE 117 -5.135 -7.658 -1.971 308 2HG1 ILE 117 2HG1 ILE 117 -3.591 -6.977 -1.459 309 1HG2 ILE 117 1HG2 ILE 117 -6.704 -5.796 -2.335 310 2HG2 ILE 117 2HG2 ILE 117 -7.206 -6.858 -1.019 311 3HG2 ILE 117 3HG2 ILE 117 -7.277 -5.108 -0.814 312 1HD1 ILE 117 1HD1 ILE 117 -3.997 -7.820 0.808 313 2HD1 ILE 117 2HD1 ILE 117 -5.512 -8.533 0.256 314 3HD1 ILE 117 3HD1 ILE 117 -3.977 -9.110 -0.395 315 H VAL 118 H VAL 118 -6.019 -3.584 -2.943 316 HA VAL 118 HA VAL 118 -6.605 -1.217 -1.355 317 HB VAL 118 HB VAL 118 -7.708 -1.868 -4.084 318 1HG1 VAL 118 1HG1 VAL 118 -7.998 0.312 -2.275 319 2HG1 VAL 118 2HG1 VAL 118 -7.152 0.877 -3.715 320 3HG1 VAL 118 3HG1 VAL 118 -8.723 0.090 -3.867 321 1HG2 VAL 118 1HG2 VAL 118 -5.238 -2.053 -4.093 322 2HG2 VAL 118 2HG2 VAL 118 -5.835 -0.717 -5.077 323 3HG2 VAL 118 3HG2 VAL 118 -5.142 -0.400 -3.487 324 H GLU 119 H GLU 119 -8.027 -4.216 -2.266 325 HA GLU 119 HA GLU 119 -10.028 -5.207 -1.865 326 1HB GLU 119 1HB GLU 119 -9.344 -4.949 0.441 327 2HB GLU 119 2HB GLU 119 -9.942 -3.296 0.475 328 1HG GLU 119 1HG GLU 119 -12.069 -5.008 -0.320 329 2HG GLU 119 2HG GLU 119 -11.310 -5.678 1.124 330 H ALA 120 H ALA 120 -10.153 -3.151 -3.760 331 HA ALA 120 HA ALA 120 -12.344 -1.396 -3.251 332 1HB ALA 120 1HB ALA 120 -10.461 -1.858 -5.373 333 2HB ALA 120 2HB ALA 120 -12.093 -1.703 -6.025 334 3HB ALA 120 3HB ALA 120 -11.418 -0.420 -5.021 335 H MET 121 H MET 121 -14.328 -2.161 -2.902 336 HA MET 121 HA MET 121 -16.233 -3.400 -3.064 337 1HB MET 121 1HB MET 121 -17.147 -3.647 -5.239 338 2HB MET 121 2HB MET 121 -16.173 -2.185 -5.284 339 1HG MET 121 1HG MET 121 -14.633 -3.081 -6.691 340 2HG MET 121 2HG MET 121 -14.876 -4.722 -6.094 341 1HE MET 121 1HE MET 121 -14.962 -6.028 -7.880 342 2HE MET 121 2HE MET 121 -16.624 -6.522 -7.554 343 3HE MET 121 3HE MET 121 -16.142 -6.072 -9.191 344 H LYS 122 H LYS 122 -13.956 -4.837 -2.274 345 HA LYS 122 HA LYS 122 -13.302 -6.975 -1.864 346 1HB LYS 122 1HB LYS 122 -15.862 -7.252 -1.815 347 2HB LYS 122 2HB LYS 122 -15.683 -7.952 -3.419 348 1HG LYS 122 1HG LYS 122 -15.787 -9.611 -1.567 349 2HG LYS 122 2HG LYS 122 -14.345 -9.733 -2.577 350 1HD LYS 122 1HD LYS 122 -14.030 -9.886 -0.043 351 2HD LYS 122 2HD LYS 122 -12.972 -8.787 -0.931 352 1HE LYS 122 1HE LYS 122 -14.491 -6.922 -0.341 353 2HE LYS 122 2HE LYS 122 -15.445 -8.044 0.628 354 H MET 123 H MET 123 -11.987 -5.815 -3.865 355 HA MET 123 HA MET 123 -11.974 -7.676 -6.125 356 1HB MET 123 1HB MET 123 -11.915 -5.597 -7.076 357 2HB MET 123 2HB MET 123 -11.091 -4.872 -5.704 358 1HG MET 123 1HG MET 123 -8.991 -5.637 -6.429 359 2HG MET 123 2HG MET 123 -9.709 -6.744 -7.597 360 1HE MET 123 1HE MET 123 -9.425 -3.315 -6.354 361 2HE MET 123 2HE MET 123 -8.612 -2.502 -7.692 362 3HE MET 123 3HE MET 123 -10.365 -2.393 -7.527 363 H MET 124 H MET 124 -10.241 -6.887 -3.271 364 HA MET 124 HA MET 124 -8.253 -7.567 -2.396 365 1HB MET 124 1HB MET 124 -8.607 -10.039 -4.081 366 2HB MET 124 2HB MET 124 -7.843 -9.901 -2.503 367 1HG MET 124 1HG MET 124 -10.699 -9.149 -2.698 368 2HG MET 124 2HG MET 124 -10.295 -10.859 -2.838 369 1HE MET 124 1HE MET 124 -10.521 -7.770 -1.020 370 2HE MET 124 2HE MET 124 -11.498 -8.567 0.212 371 3HE MET 124 3HE MET 124 -9.874 -8.003 0.604 372 H ASN 125 H ASN 125 -7.997 -5.950 -4.701 373 HA ASN 125 HA ASN 125 -6.009 -7.096 -6.434 374 1HB ASN 125 1HB ASN 125 -5.804 -4.733 -7.291 375 2HB ASN 125 2HB ASN 125 -7.421 -5.423 -7.398 376 1HD2 ASN 125 2HD2 ASN 125 -6.288 -2.626 -7.152 377 2HD2 ASN 125 1HD2 ASN 125 -7.207 -1.916 -5.873 378 H GLN 126 H GLN 126 -4.411 -7.773 -4.957 379 HA GLN 126 HA GLN 126 -3.114 -5.884 -3.230 380 1HB GLN 126 1HB GLN 126 -1.674 -7.698 -2.609 381 2HB GLN 126 2HB GLN 126 -3.314 -8.322 -2.733 382 1HG GLN 126 1HG GLN 126 -2.533 -9.915 -4.049 383 2HG GLN 126 2HG GLN 126 -2.208 -8.682 -5.265 384 1HE2 GLN 126 2HE2 GLN 126 -0.237 -8.794 -6.040 385 2HE2 GLN 126 1HE2 GLN 126 1.182 -9.258 -5.172 386 H ILE 127 H ILE 127 -1.867 -4.334 -4.023 387 HA ILE 127 HA ILE 127 -0.646 -4.433 -6.583 388 HB ILE 127 HB ILE 127 0.029 -2.550 -4.323 389 1HG1 ILE 127 1HG1 ILE 127 -2.262 -2.223 -4.537 390 2HG1 ILE 127 2HG1 ILE 127 -1.623 -1.059 -5.694 391 1HG2 ILE 127 1HG2 ILE 127 0.678 -2.683 -7.207 392 2HG2 ILE 127 2HG2 ILE 127 0.309 -1.093 -6.540 393 3HG2 ILE 127 3HG2 ILE 127 1.623 -2.052 -5.858 394 1HD1 ILE 127 1HD1 ILE 127 -1.921 -3.015 -7.388 395 2HD1 ILE 127 2HD1 ILE 127 -3.048 -3.627 -6.177 396 3HD1 ILE 127 3HD1 ILE 127 -3.306 -2.038 -6.898 397 H GLU 128 H GLU 128 1.628 -4.309 -7.055 398 HA GLU 128 HA GLU 128 3.323 -5.649 -5.052 399 1HB GLU 128 1HB GLU 128 3.636 -6.056 -8.018 400 2HB GLU 128 2HB GLU 128 4.301 -7.020 -6.707 401 1HG GLU 128 1HG GLU 128 2.577 -8.390 -6.837 402 2HG GLU 128 2HG GLU 128 1.486 -7.059 -6.445 403 H ALA 129 H ALA 129 4.793 -4.233 -4.382 404 HA ALA 129 HA ALA 129 5.514 -1.825 -5.271 405 1HB ALA 129 1HB ALA 129 6.489 -3.350 -3.346 406 2HB ALA 129 2HB ALA 129 7.806 -3.551 -4.501 407 3HB ALA 129 3HB ALA 129 7.364 -1.939 -3.941 408 H ASP 130 H ASP 130 6.441 -0.909 -6.990 409 HA ASP 130 HA ASP 130 8.068 -2.576 -8.782 410 1HB ASP 130 1HB ASP 130 6.986 -1.305 -10.707 411 2HB ASP 130 2HB ASP 130 5.981 -2.513 -9.907 412 H LYS 131 H LYS 131 8.992 -0.780 -6.813 413 HA LYS 131 HA LYS 131 10.239 1.261 -8.527 414 1HB LYS 131 1HB LYS 131 8.486 1.786 -6.421 415 2HB LYS 131 2HB LYS 131 10.084 2.068 -5.742 416 1HG LYS 131 1HG LYS 131 9.472 4.142 -6.571 417 2HG LYS 131 2HG LYS 131 10.500 3.485 -7.846 418 1HD LYS 131 1HD LYS 131 8.044 2.569 -8.592 419 2HD LYS 131 2HD LYS 131 7.637 4.127 -7.869 420 1HE LYS 131 1HE LYS 131 9.887 3.904 -9.830 421 2HE LYS 131 2HE LYS 131 8.220 4.002 -10.396 422 1HZ LYS 131 1HZ LYS 131 8.071 6.049 -8.920 423 2HZ LYS 131 2HZ LYS 131 9.761 6.008 -8.868 424 3HZ LYS 131 3HZ LYS 131 8.964 6.194 -10.349 425 H SER 132 H SER 132 10.486 -0.800 -5.683 426 HA SER 132 HA SER 132 12.291 -1.895 -4.807 427 1HB SER 132 1HB SER 132 13.111 -1.973 -7.202 428 2HB SER 132 2HB SER 132 14.015 -0.498 -6.860 429 HG SER 132 HG SER 132 15.281 -1.589 -5.451 430 H GLY 133 H GLY 133 12.023 -0.674 -2.910 431 1HA GLY 133 1HA GLY 133 14.297 0.877 -2.173 432 2HA GLY 133 2HA GLY 133 12.889 1.901 -2.408 433 H THR 134 H THR 134 13.391 2.327 -0.075 434 HA THR 134 HA THR 134 12.316 0.235 1.685 435 HB THR 134 HB THR 134 13.773 2.754 2.494 436 HG1 THR 134 HG1 THR 134 14.715 0.300 1.603 437 1HG2 THR 134 1HG2 THR 134 12.940 0.289 3.957 438 2HG2 THR 134 2HG2 THR 134 14.346 1.217 4.476 439 3HG2 THR 134 3HG2 THR 134 12.758 1.981 4.418 440 H VAL 135 H VAL 135 10.556 0.593 2.982 441 HA VAL 135 HA VAL 135 8.794 2.734 2.175 442 HB VAL 135 HB VAL 135 8.348 0.636 4.305 443 1HG1 VAL 135 1HG1 VAL 135 6.480 2.492 2.841 444 2HG1 VAL 135 2HG1 VAL 135 5.943 1.114 3.803 445 3HG1 VAL 135 3HG1 VAL 135 6.812 2.442 4.572 446 1HG2 VAL 135 1HG2 VAL 135 8.426 0.421 1.423 447 2HG2 VAL 135 2HG2 VAL 135 8.272 -0.843 2.643 448 3HG2 VAL 135 3HG2 VAL 135 6.836 -0.003 2.059 449 H LYS 136 H LYS 136 8.864 4.680 3.062 450 HA LYS 136 HA LYS 136 10.269 5.238 5.470 451 1HB LYS 136 1HB LYS 136 9.190 6.722 3.315 452 2HB LYS 136 2HB LYS 136 8.464 7.359 4.784 453 1HG LYS 136 1HG LYS 136 10.638 8.416 3.957 454 2HG LYS 136 2HG LYS 136 10.516 8.005 5.668 455 1HD LYS 136 1HD LYS 136 11.529 5.776 4.139 456 2HD LYS 136 2HD LYS 136 12.513 7.220 3.881 457 1HE LYS 136 1HE LYS 136 11.957 7.118 6.635 458 2HE LYS 136 2HE LYS 136 12.400 5.479 6.160 459 1HZ LYS 136 1HZ LYS 136 14.384 6.500 5.051 460 2HZ LYS 136 2HZ LYS 136 13.997 7.953 5.828 461 3HZ LYS 136 3HZ LYS 136 14.385 6.584 6.740 462 H ALA 137 H ALA 137 6.854 4.918 4.636 463 HA ALA 137 HA ALA 137 5.950 3.937 7.007 464 1HB ALA 137 1HB ALA 137 6.166 6.922 7.101 465 2HB ALA 137 2HB ALA 137 4.921 6.074 8.018 466 3HB ALA 137 3HB ALA 137 6.624 5.732 8.320 467 H ILE 138 H ILE 138 3.534 4.536 7.429 468 HA ILE 138 HA ILE 138 2.230 4.941 4.816 469 HB ILE 138 HB ILE 138 1.536 3.015 7.026 470 1HG1 ILE 138 1HG1 ILE 138 2.265 2.780 4.114 471 2HG1 ILE 138 2HG1 ILE 138 3.035 2.019 5.503 472 1HG2 ILE 138 1HG2 ILE 138 -0.199 4.034 4.796 473 2HG2 ILE 138 2HG2 ILE 138 -0.479 2.474 5.569 474 3HG2 ILE 138 3HG2 ILE 138 -0.557 3.955 6.521 475 1HD1 ILE 138 1HD1 ILE 138 0.965 0.664 5.807 476 2HD1 ILE 138 2HD1 ILE 138 0.373 1.333 4.286 477 3HD1 ILE 138 3HD1 ILE 138 1.838 0.350 4.308 478 H LEU 139 H LEU 139 0.501 6.294 4.719 479 HA LEU 139 HA LEU 139 -0.122 7.791 7.170 480 1HB LEU 139 1HB LEU 139 -0.183 8.445 4.259 481 2HB LEU 139 2HB LEU 139 -1.280 9.293 5.332 482 HG LEU 139 HG LEU 139 0.698 10.627 5.014 483 1HD1 LEU 139 1HD1 LEU 139 -0.355 9.974 7.443 484 2HD1 LEU 139 2HD1 LEU 139 1.365 9.679 7.698 485 3HD1 LEU 139 3HD1 LEU 139 0.813 11.264 7.155 486 1HD2 LEU 139 1HD2 LEU 139 2.015 8.160 4.928 487 2HD2 LEU 139 2HD2 LEU 139 2.730 9.764 4.769 488 3HD2 LEU 139 3HD2 LEU 139 2.647 8.989 6.351 489 H VAL 140 H VAL 140 -1.654 6.290 4.351 490 HA VAL 140 HA VAL 140 -4.298 6.699 4.869 491 HB VAL 140 HB VAL 140 -2.927 4.258 3.755 492 1HG1 VAL 140 1HG1 VAL 140 -5.871 4.781 4.086 493 2HG1 VAL 140 2HG1 VAL 140 -5.229 3.654 2.892 494 3HG1 VAL 140 3HG1 VAL 140 -4.946 3.375 4.610 495 1HG2 VAL 140 1HG2 VAL 140 -3.034 6.585 2.602 496 2HG2 VAL 140 2HG2 VAL 140 -3.395 5.135 1.665 497 3HG2 VAL 140 3HG2 VAL 140 -4.708 6.143 2.269 498 H GLU 141 H GLU 141 -5.631 6.229 6.453 499 HA GLU 141 HA GLU 141 -4.836 4.834 8.773 500 1HB GLU 141 1HB GLU 141 -7.350 6.096 7.796 501 2HB GLU 141 2HB GLU 141 -7.486 4.930 9.105 502 1HG GLU 141 1HG GLU 141 -7.267 6.901 10.254 503 2HG GLU 141 2HG GLU 141 -5.599 6.333 10.203 504 H SER 142 H SER 142 -4.152 2.988 7.261 505 HA SER 142 HA SER 142 -5.550 1.183 5.947 506 1HB SER 142 1HB SER 142 -3.159 1.040 6.813 507 2HB SER 142 2HB SER 142 -3.836 0.268 8.246 508 HG SER 142 HG SER 142 -3.888 -1.505 7.138 509 H GLY 143 H GLY 143 -6.794 -0.744 6.408 510 1HA GLY 143 1HA GLY 143 -8.272 -2.051 7.639 511 2HA GLY 143 2HA GLY 143 -7.901 -1.082 9.060 512 H GLN 144 H GLN 144 -8.484 1.155 6.822 513 HA GLN 144 HA GLN 144 -11.400 1.159 7.221 514 1HB GLN 144 1HB GLN 144 -10.582 2.767 8.764 515 2HB GLN 144 2HB GLN 144 -9.424 3.402 7.605 516 1HG GLN 144 1HG GLN 144 -11.736 3.880 6.298 517 2HG GLN 144 2HG GLN 144 -12.273 4.016 7.970 518 1HE2 GLN 144 2HE2 GLN 144 -11.754 5.964 5.693 519 2HE2 GLN 144 1HE2 GLN 144 -10.801 7.206 6.422 520 HA PRO 145 HA PRO 145 -11.796 1.677 2.866 521 1HB PRO 145 1HB PRO 145 -13.914 3.458 2.813 522 2HB PRO 145 2HB PRO 145 -14.070 1.708 2.996 523 1HG PRO 145 1HG PRO 145 -14.106 3.843 5.087 524 2HG PRO 145 2HG PRO 145 -15.099 2.378 4.960 525 1HD PRO 145 1HD PRO 145 -13.031 2.516 6.656 526 2HD PRO 145 2HD PRO 145 -13.414 1.014 5.788 527 H VAL 146 H VAL 146 -10.613 2.857 1.512 528 HA VAL 146 HA VAL 146 -9.659 5.468 2.290 529 HB VAL 146 HB VAL 146 -8.352 5.379 0.193 530 1HG1 VAL 146 1HG1 VAL 146 -7.887 4.050 2.484 531 2HG1 VAL 146 2HG1 VAL 146 -7.862 2.707 1.341 532 3HG1 VAL 146 3HG1 VAL 146 -6.765 4.071 1.123 533 1HG2 VAL 146 1HG2 VAL 146 -10.178 3.136 -0.332 534 2HG2 VAL 146 2HG2 VAL 146 -9.337 4.205 -1.454 535 3HG2 VAL 146 3HG2 VAL 146 -8.487 2.837 -0.737 536 H GLU 147 H GLU 147 -9.614 7.231 0.574 537 HA GLU 147 HA GLU 147 -12.043 7.276 -1.058 538 1HB GLU 147 1HB GLU 147 -12.242 8.388 1.326 539 2HB GLU 147 2HB GLU 147 -11.393 9.715 0.540 540 1HG GLU 147 1HG GLU 147 -14.050 8.536 -0.237 541 2HG GLU 147 2HG GLU 147 -13.743 10.133 0.443 542 H PHE 148 H PHE 148 -9.940 6.888 -2.420 543 HA PHE 148 HA PHE 148 -8.553 7.652 -4.054 544 1HB PHE 148 1HB PHE 148 -10.848 9.052 -4.323 545 2HB PHE 148 2HB PHE 148 -9.706 10.365 -4.078 546 HD1 PHE 148 HD1 PHE 148 -7.861 10.726 -5.663 547 HD2 PHE 148 HD2 PHE 148 -10.862 7.773 -6.334 548 HE1 PHE 148 HE1 PHE 148 -7.197 10.597 -8.035 549 HE2 PHE 148 HE2 PHE 148 -10.203 7.636 -8.705 550 HZ PHE 148 HZ PHE 148 -8.369 9.050 -9.558 551 H ASP 149 H ASP 149 -6.755 9.060 -4.515 552 HA ASP 149 HA ASP 149 -4.775 9.944 -3.767 553 1HB ASP 149 1HB ASP 149 -6.233 11.917 -4.286 554 2HB ASP 149 2HB ASP 149 -6.640 12.002 -2.574 555 H GLU 150 H GLU 150 -5.416 7.916 -2.089 556 HA GLU 150 HA GLU 150 -4.933 8.992 0.608 557 1HB GLU 150 1HB GLU 150 -6.762 7.055 -0.315 558 2HB GLU 150 2HB GLU 150 -5.540 6.178 0.594 559 1HG GLU 150 1HG GLU 150 -7.344 6.778 2.053 560 2HG GLU 150 2HG GLU 150 -5.906 7.696 2.498 561 HA PRO 151 HA PRO 151 -0.711 7.615 -0.397 562 1HB PRO 151 1HB PRO 151 -0.451 8.576 2.414 563 2HB PRO 151 2HB PRO 151 0.570 8.912 1.012 564 1HG PRO 151 1HG PRO 151 -1.136 10.743 1.916 565 2HG PRO 151 2HG PRO 151 -0.876 10.520 0.177 566 1HD PRO 151 1HD PRO 151 -3.177 9.675 1.874 567 2HD PRO 151 2HD PRO 151 -3.159 10.225 0.187 568 H LEU 152 H LEU 152 -1.545 5.401 -0.353 569 HA LEU 152 HA LEU 152 -2.001 3.943 1.996 570 1HB LEU 152 1HB LEU 152 -0.902 2.862 -0.596 571 2HB LEU 152 2HB LEU 152 -1.776 1.967 0.635 572 HG LEU 152 HG LEU 152 -3.044 4.251 -0.856 573 1HD1 LEU 152 1HD1 LEU 152 -2.182 1.831 -1.999 574 2HD1 LEU 152 2HD1 LEU 152 -3.928 1.700 -1.789 575 3HD1 LEU 152 3HD1 LEU 152 -3.249 3.046 -2.703 576 1HD2 LEU 152 1HD2 LEU 152 -3.828 2.600 1.295 577 2HD2 LEU 152 2HD2 LEU 152 -4.790 3.803 0.436 578 3HD2 LEU 152 3HD2 LEU 152 -4.789 2.125 -0.105 579 H VAL 153 H VAL 153 0.939 4.142 -0.010 580 HA VAL 153 HA VAL 153 2.543 3.655 2.382 581 HB VAL 153 HB VAL 153 2.774 1.988 -0.127 582 1HG1 VAL 153 1HG1 VAL 153 4.552 2.124 2.303 583 2HG1 VAL 153 2HG1 VAL 153 4.624 0.851 1.083 584 3HG1 VAL 153 3HG1 VAL 153 4.984 2.521 0.640 585 1HG2 VAL 153 1HG2 VAL 153 1.039 1.512 1.789 586 2HG2 VAL 153 2HG2 VAL 153 1.963 0.199 1.059 587 3HG2 VAL 153 3HG2 VAL 153 2.457 0.866 2.615 588 H VAL 154 H VAL 154 4.473 4.695 2.380 589 HA VAL 154 HA VAL 154 5.210 6.135 -0.086 590 HB VAL 154 HB VAL 154 5.934 8.004 1.161 591 1HG1 VAL 154 1HG1 VAL 154 3.330 6.950 2.239 592 2HG1 VAL 154 2HG1 VAL 154 3.917 8.583 2.559 593 3HG1 VAL 154 3HG1 VAL 154 3.580 8.075 0.903 594 1HG2 VAL 154 1HG2 VAL 154 6.003 6.087 3.398 595 2HG2 VAL 154 2HG2 VAL 154 7.070 7.442 3.028 596 3HG2 VAL 154 3HG2 VAL 154 5.516 7.731 3.809 597 H ILE 155 H ILE 155 7.091 5.534 -0.912 598 HA ILE 155 HA ILE 155 9.070 4.272 0.865 599 HB ILE 155 HB ILE 155 8.945 4.001 -2.136 600 1HG1 ILE 155 1HG1 ILE 155 8.192 1.582 -0.881 601 2HG1 ILE 155 2HG1 ILE 155 7.224 2.852 -0.139 602 1HG2 ILE 155 1HG2 ILE 155 11.061 3.532 -0.684 603 2HG2 ILE 155 2HG2 ILE 155 10.202 2.052 -0.257 604 3HG2 ILE 155 3HG2 ILE 155 10.584 2.394 -1.945 605 1HD1 ILE 155 1HD1 ILE 155 6.874 3.546 -2.667 606 2HD1 ILE 155 2HD1 ILE 155 7.216 1.834 -2.917 607 3HD1 ILE 155 3HD1 ILE 155 5.876 2.325 -1.880 608 H GLU 156 H GLU 156 11.230 4.858 0.746 609 HA GLU 156 HA GLU 156 11.879 7.199 -0.908 610 1HB GLU 156 1HB GLU 156 11.442 7.384 1.791 611 2HB GLU 156 2HB GLU 156 13.184 7.152 1.722 612 1HG GLU 156 1HG GLU 156 13.506 9.101 0.465 613 2HG GLU 156 2HG GLU 156 11.796 9.218 0.052 614 1H10 BTN 222 1H10 BTN 122 -13.517 -10.150 2.423 615 2H10 BTN 222 2H10 BTN 122 -13.545 -9.565 4.086 616 1H9 BTN 222 1H9 BTN 122 -11.344 -8.832 4.006 617 2H9 BTN 222 2H9 BTN 122 -11.326 -8.773 2.243 618 1H8 BTN 222 1H8 BTN 122 -11.534 -11.271 2.245 619 2H8 BTN 222 2H8 BTN 122 -11.300 -11.225 3.994 620 1H7 BTN 222 1H7 BTN 122 -9.337 -9.833 2.246 621 2H7 BTN 222 2H7 BTN 122 -9.282 -11.588 2.340 622 H2 BTN 222 H2 BTN 122 -9.058 -11.418 4.813 623 1H6 BTN 222 1H6 BTN 122 -8.060 -7.793 3.224 624 2H6 BTN 222 2H6 BTN 122 -7.231 -7.398 4.721 625 H5 BTN 222 H5 BTN 122 -5.806 -9.194 4.532 626 HN1 BTN 222 HN2 BTN 122 -5.729 -8.426 2.100 627 HN2 BTN 222 HN1 BTN 122 -7.347 -12.056 2.291 628 H4 BTN 222 H4 BTN 122 -6.772 -11.278 4.658 Start of MODEL 13 1 1H GLU 77 H GLU 77 14.376 17.170 -0.295 2 HA GLU 77 HA GLU 77 12.359 16.315 -1.010 3 1HB GLU 77 1HB GLU 77 12.945 17.695 -3.171 4 2HB GLU 77 2HB GLU 77 13.306 16.107 -3.839 5 1HG GLU 77 1HG GLU 77 11.145 15.528 -3.968 6 2HG GLU 77 2HG GLU 77 10.736 16.302 -2.438 7 H ILE 78 H ILE 78 12.069 14.286 -0.394 8 HA ILE 78 HA ILE 78 13.815 12.246 -0.273 9 HB ILE 78 HB ILE 78 11.539 12.133 0.655 10 1HG1 ILE 78 1HG1 ILE 78 12.374 9.835 -1.123 11 2HG1 ILE 78 2HG1 ILE 78 12.788 10.076 0.570 12 1HG2 ILE 78 1HG2 ILE 78 10.448 12.997 -1.447 13 2HG2 ILE 78 2HG2 ILE 78 10.603 11.365 -2.098 14 3HG2 ILE 78 3HG2 ILE 78 9.629 11.650 -0.657 15 1HD1 ILE 78 1HD1 ILE 78 10.098 10.056 0.725 16 2HD1 ILE 78 2HD1 ILE 78 10.357 8.975 -0.645 17 3HD1 ILE 78 3HD1 ILE 78 11.115 8.627 0.909 18 H SER 79 H SER 79 14.335 10.396 -1.511 19 HA SER 79 HA SER 79 14.218 10.879 -4.397 20 1HB SER 79 1HB SER 79 16.018 9.192 -2.663 21 2HB SER 79 2HB SER 79 15.978 9.008 -4.416 22 HG SER 79 HG SER 79 16.442 11.309 -4.503 23 H GLY 80 H GLY 80 11.881 9.924 -3.080 24 1HA GLY 80 1HA GLY 80 11.649 7.294 -4.394 25 2HA GLY 80 2HA GLY 80 11.001 7.547 -2.781 26 H HIS 81 H HIS 81 8.854 7.394 -3.059 27 HA HIS 81 HA HIS 81 7.458 9.513 -4.331 28 1HB HIS 81 1HB HIS 81 6.339 8.303 -6.094 29 2HB HIS 81 2HB HIS 81 8.077 8.146 -6.324 30 HD1 HIS 81 HD1 HIS 81 5.090 6.158 -5.149 31 HD2 HIS 81 HD2 HIS 81 9.028 5.567 -6.335 32 HE1 HIS 81 HE1 HIS 81 5.361 3.668 -5.363 33 HE2 HIS 81 HE2 HIS 81 7.729 3.339 -6.158 34 H ILE 82 H ILE 82 5.130 9.347 -4.054 35 HA ILE 82 HA ILE 82 4.459 7.622 -1.773 36 HB ILE 82 HB ILE 82 3.218 10.198 -2.732 37 1HG1 ILE 82 1HG1 ILE 82 3.994 11.103 -0.632 38 2HG1 ILE 82 2HG1 ILE 82 4.524 9.513 -0.092 39 1HG2 ILE 82 1HG2 ILE 82 2.233 8.146 -0.811 40 2HG2 ILE 82 2HG2 ILE 82 1.921 9.850 -0.480 41 3HG2 ILE 82 3HG2 ILE 82 1.338 9.121 -1.977 42 1HD1 ILE 82 1HD1 ILE 82 5.692 10.636 -2.582 43 2HD1 ILE 82 2HD1 ILE 82 6.225 11.266 -1.023 44 3HD1 ILE 82 3HD1 ILE 82 6.402 9.549 -1.388 45 H VAL 83 H VAL 83 3.264 5.892 -2.174 46 HA VAL 83 HA VAL 83 1.861 5.593 -4.676 47 HB VAL 83 HB VAL 83 1.972 3.731 -2.298 48 1HG1 VAL 83 1HG1 VAL 83 0.143 3.650 -4.274 49 2HG1 VAL 83 2HG1 VAL 83 1.437 2.702 -5.007 50 3HG1 VAL 83 3HG1 VAL 83 0.761 2.218 -3.452 51 1HG2 VAL 83 1HG2 VAL 83 3.850 4.304 -4.461 52 2HG2 VAL 83 2HG2 VAL 83 4.104 3.470 -2.928 53 3HG2 VAL 83 3HG2 VAL 83 3.444 2.594 -4.309 54 H ARG 84 H ARG 84 0.164 7.054 -4.648 55 HA ARG 84 HA ARG 84 -1.742 6.996 -2.458 56 1HB ARG 84 1HB ARG 84 -2.751 8.887 -3.453 57 2HB ARG 84 2HB ARG 84 -1.020 9.109 -3.673 58 1HG ARG 84 1HG ARG 84 -1.642 7.832 -5.966 59 2HG ARG 84 2HG ARG 84 -3.145 8.706 -5.660 60 1HD ARG 84 1HD ARG 84 -2.214 10.702 -6.096 61 2HD ARG 84 2HD ARG 84 -0.721 10.298 -5.250 62 HE ARG 84 HE ARG 84 -0.801 8.851 -7.644 63 1HH1 ARG 84 1HH1 ARG 84 -0.525 12.142 -6.537 64 2HH1 ARG 84 2HH1 ARG 84 0.396 12.663 -7.908 65 1HH2 ARG 84 1HH2 ARG 84 0.412 9.526 -9.455 66 2HH2 ARG 84 2HH2 ARG 84 0.928 11.176 -9.567 67 H SER 85 H SER 85 -3.861 6.300 -2.595 68 HA SER 85 HA SER 85 -4.361 4.129 -4.358 69 1HB SER 85 1HB SER 85 -5.274 4.287 -2.043 70 2HB SER 85 2HB SER 85 -6.337 5.585 -2.587 71 HG SER 85 HG SER 85 -7.174 4.041 -4.136 72 HA PRO 86 HA PRO 86 -6.044 6.249 -7.847 73 1HB PRO 86 1HB PRO 86 -7.618 4.234 -8.822 74 2HB PRO 86 2HB PRO 86 -5.865 4.301 -9.035 75 1HG PRO 86 1HG PRO 86 -7.475 2.756 -7.042 76 2HG PRO 86 2HG PRO 86 -6.055 2.245 -7.972 77 1HD PRO 86 1HD PRO 86 -5.881 2.983 -5.386 78 2HD PRO 86 2HD PRO 86 -4.581 3.316 -6.548 79 H MET 87 H MET 87 -8.487 4.147 -6.306 80 HA MET 87 HA MET 87 -10.274 6.474 -6.133 81 1HB MET 87 1HB MET 87 -12.160 4.807 -6.656 82 2HB MET 87 2HB MET 87 -11.172 5.373 -7.996 83 1HG MET 87 1HG MET 87 -9.805 3.283 -7.731 84 2HG MET 87 2HG MET 87 -11.034 2.716 -6.603 85 1HE MET 87 1HE MET 87 -10.559 0.808 -8.313 86 2HE MET 87 2HE MET 87 -12.288 0.528 -8.100 87 3HE MET 87 3HE MET 87 -11.589 0.545 -9.720 88 H VAL 88 H VAL 88 -12.377 5.570 -4.846 89 HA VAL 88 HA VAL 88 -11.530 5.226 -2.203 90 HB VAL 88 HB VAL 88 -14.225 4.733 -3.464 91 1HG1 VAL 88 1HG1 VAL 88 -13.435 4.705 -0.557 92 2HG1 VAL 88 2HG1 VAL 88 -15.099 4.825 -1.129 93 3HG1 VAL 88 3HG1 VAL 88 -14.144 3.385 -1.487 94 1HG2 VAL 88 1HG2 VAL 88 -12.794 7.072 -2.543 95 2HG2 VAL 88 2HG2 VAL 88 -14.289 6.960 -3.471 96 3HG2 VAL 88 3HG2 VAL 88 -14.337 6.884 -1.710 97 H GLY 89 H GLY 89 -12.085 3.415 -0.748 98 1HA GLY 89 1HA GLY 89 -12.749 0.848 -1.477 99 2HA GLY 89 2HA GLY 89 -11.022 0.966 -1.772 100 H THR 90 H THR 90 -10.572 -0.576 -0.170 101 HA THR 90 HA THR 90 -10.641 0.529 2.542 102 HB THR 90 HB THR 90 -11.146 -2.396 2.222 103 HG1 THR 90 HG1 THR 90 -13.461 -1.737 2.341 104 1HG2 THR 90 1HG2 THR 90 -11.136 -0.560 4.367 105 2HG2 THR 90 2HG2 THR 90 -12.792 -1.127 4.151 106 3HG2 THR 90 3HG2 THR 90 -11.487 -2.288 4.398 107 H PHE 91 H PHE 91 -8.540 0.796 2.952 108 HA PHE 91 HA PHE 91 -6.563 -1.061 1.931 109 1HB PHE 91 1HB PHE 91 -6.109 1.361 1.929 110 2HB PHE 91 2HB PHE 91 -6.236 1.382 3.686 111 HD1 PHE 91 HD1 PHE 91 -4.296 -0.108 0.889 112 HD2 PHE 91 HD2 PHE 91 -4.365 0.987 5.010 113 HE1 PHE 91 HE1 PHE 91 -1.891 -0.624 1.062 114 HE2 PHE 91 HE2 PHE 91 -1.960 0.472 5.191 115 HZ PHE 91 HZ PHE 91 -0.723 -0.335 3.215 116 H TYR 92 H TYR 92 -4.788 -1.770 3.502 117 HA TYR 92 HA TYR 92 -5.630 -2.237 6.224 118 1HB TYR 92 1HB TYR 92 -5.288 -4.546 4.320 119 2HB TYR 92 2HB TYR 92 -5.454 -4.697 6.064 120 HD1 TYR 92 HD1 TYR 92 -7.637 -3.141 6.878 121 HD2 TYR 92 HD2 TYR 92 -7.161 -5.210 3.182 122 HE1 TYR 92 HE1 TYR 92 -10.086 -3.256 6.635 123 HE2 TYR 92 HE2 TYR 92 -9.606 -5.332 2.927 124 HH TYR 92 HH TYR 92 -11.734 -4.879 5.349 125 H ARG 93 H ARG 93 -3.942 -4.147 7.030 126 HA ARG 93 HA ARG 93 -1.279 -3.172 6.224 127 1HB ARG 93 1HB ARG 93 -2.452 -3.717 8.919 128 2HB ARG 93 2HB ARG 93 -0.734 -4.003 8.677 129 1HG ARG 93 1HG ARG 93 -2.092 -1.393 8.052 130 2HG ARG 93 2HG ARG 93 -1.313 -1.757 9.594 131 1HD ARG 93 1HD ARG 93 0.330 -2.306 7.224 132 2HD ARG 93 2HD ARG 93 -0.077 -0.606 7.459 133 HE ARG 93 HE ARG 93 1.831 -2.065 8.910 134 1HH1 ARG 93 1HH1 ARG 93 -0.747 0.219 9.418 135 2HH1 ARG 93 2HH1 ARG 93 -0.041 0.897 10.846 136 1HH2 ARG 93 1HH2 ARG 93 2.772 -1.181 10.791 137 2HH2 ARG 93 2HH2 ARG 93 1.961 0.102 11.627 138 H THR 94 H THR 94 -3.296 -5.891 7.039 139 HA THR 94 HA THR 94 -1.309 -7.692 5.885 140 HB THR 94 HB THR 94 -1.150 -9.122 7.680 141 HG1 THR 94 HG1 THR 94 -2.750 -9.175 9.350 142 1HG2 THR 94 1HG2 THR 94 -0.552 -6.626 8.334 143 2HG2 THR 94 2HG2 THR 94 -1.852 -6.897 9.495 144 3HG2 THR 94 3HG2 THR 94 -0.443 -7.958 9.484 145 HA PRO 95 HA PRO 95 -5.020 -9.180 3.981 146 1HB PRO 95 1HB PRO 95 -4.002 -11.293 2.676 147 2HB PRO 95 2HB PRO 95 -3.634 -9.632 2.199 148 1HG PRO 95 1HG PRO 95 -1.984 -11.559 3.782 149 2HG PRO 95 2HG PRO 95 -1.476 -10.427 2.516 150 1HD PRO 95 1HD PRO 95 -1.204 -9.954 5.212 151 2HD PRO 95 2HD PRO 95 -1.314 -8.679 3.985 152 H SER 96 H SER 96 -4.982 -9.818 6.659 153 HA SER 96 HA SER 96 -6.712 -11.831 7.013 154 1HB SER 96 1HB SER 96 -4.913 -13.645 7.882 155 2HB SER 96 2HB SER 96 -5.582 -13.660 6.249 156 HG SER 96 HG SER 96 -3.616 -13.404 5.590 157 HA PRO 97 HA PRO 97 -6.463 -9.976 11.028 158 1HB PRO 97 1HB PRO 97 -7.685 -12.597 11.788 159 2HB PRO 97 2HB PRO 97 -8.182 -10.956 12.221 160 1HG PRO 97 1HG PRO 97 -9.498 -12.321 10.352 161 2HG PRO 97 2HG PRO 97 -9.205 -10.581 10.173 162 1HD PRO 97 1HD PRO 97 -7.903 -12.875 8.795 163 2HD PRO 97 2HD PRO 97 -8.226 -11.235 8.201 164 H ASP 98 H ASP 98 -5.184 -13.098 10.199 165 HA ASP 98 HA ASP 98 -3.286 -12.878 12.435 166 1HB ASP 98 1HB ASP 98 -5.185 -14.765 12.453 167 2HB ASP 98 2HB ASP 98 -3.993 -15.596 11.457 168 H ALA 99 H ALA 99 -2.482 -11.745 10.229 169 HA ALA 99 HA ALA 99 -0.827 -13.742 8.827 170 1HB ALA 99 1HB ALA 99 -2.502 -11.648 7.819 171 2HB ALA 99 2HB ALA 99 -0.830 -11.358 7.339 172 3HB ALA 99 3HB ALA 99 -1.611 -12.887 6.935 173 H LYS 100 H LYS 100 1.052 -12.228 7.668 174 HA LYS 100 HA LYS 100 2.464 -11.037 9.959 175 1HB LYS 100 1HB LYS 100 4.543 -11.566 8.700 176 2HB LYS 100 2HB LYS 100 3.602 -12.990 9.125 177 1HG LYS 100 1HG LYS 100 2.748 -13.148 6.874 178 2HG LYS 100 2HG LYS 100 3.566 -11.649 6.428 179 1HD LYS 100 1HD LYS 100 5.711 -12.650 6.688 180 2HD LYS 100 2HD LYS 100 5.016 -14.088 7.439 181 1HE LYS 100 1HE LYS 100 5.710 -13.975 4.855 182 2HE LYS 100 2HE LYS 100 4.399 -14.988 5.459 183 1HZ LYS 100 1HZ LYS 100 3.977 -12.227 4.467 184 2HZ LYS 100 2HZ LYS 100 3.857 -13.590 3.473 185 3HZ LYS 100 3HZ LYS 100 2.804 -13.403 4.785 186 H ALA 101 H ALA 101 0.575 -9.809 7.909 187 HA ALA 101 HA ALA 101 0.361 -7.852 6.768 188 1HB ALA 101 1HB ALA 101 1.479 -7.128 8.980 189 2HB ALA 101 2HB ALA 101 2.923 -6.899 7.993 190 3HB ALA 101 3HB ALA 101 1.454 -5.992 7.630 191 H PHE 102 H PHE 102 0.801 -7.209 4.733 192 HA PHE 102 HA PHE 102 2.515 -8.569 3.077 193 1HB PHE 102 1HB PHE 102 1.225 -5.873 2.886 194 2HB PHE 102 2HB PHE 102 2.370 -6.371 1.647 195 HD1 PHE 102 HD1 PHE 102 1.901 -8.378 0.266 196 HD2 PHE 102 HD2 PHE 102 -0.966 -6.765 2.977 197 HE1 PHE 102 HE1 PHE 102 0.118 -9.633 -0.882 198 HE2 PHE 102 HE2 PHE 102 -2.755 -8.017 1.836 199 HZ PHE 102 HZ PHE 102 -2.215 -9.453 -0.097 200 H ILE 103 H ILE 103 3.230 -5.154 3.116 201 HA ILE 103 HA ILE 103 5.991 -5.785 3.934 202 HB ILE 103 HB ILE 103 5.064 -3.920 1.752 203 1HG1 ILE 103 1HG1 ILE 103 6.780 -5.298 0.463 204 2HG1 ILE 103 2HG1 ILE 103 6.796 -6.390 1.844 205 1HG2 ILE 103 1HG2 ILE 103 7.495 -3.861 3.403 206 2HG2 ILE 103 2HG2 ILE 103 7.762 -3.767 1.662 207 3HG2 ILE 103 3HG2 ILE 103 6.728 -2.583 2.460 208 1HD1 ILE 103 1HD1 ILE 103 4.205 -5.693 0.550 209 2HD1 ILE 103 2HD1 ILE 103 5.273 -6.882 -0.197 210 3HD1 ILE 103 3HD1 ILE 103 4.666 -7.145 1.439 211 H GLU 104 H GLU 104 5.244 -5.195 6.084 212 HA GLU 104 HA GLU 104 4.133 -2.817 6.880 213 1HB GLU 104 1HB GLU 104 5.617 -4.941 8.116 214 2HB GLU 104 2HB GLU 104 6.122 -3.398 8.792 215 1HG GLU 104 1HG GLU 104 3.904 -2.880 9.471 216 2HG GLU 104 2HG GLU 104 3.247 -4.247 8.573 217 H VAL 105 H VAL 105 5.043 -0.882 7.795 218 HA VAL 105 HA VAL 105 6.897 0.384 6.116 219 HB VAL 105 HB VAL 105 6.049 1.194 8.900 220 1HG1 VAL 105 1HG1 VAL 105 8.092 2.324 8.145 221 2HG1 VAL 105 2HG1 VAL 105 7.254 2.849 6.684 222 3HG1 VAL 105 3HG1 VAL 105 6.730 3.438 8.262 223 1HG2 VAL 105 1HG2 VAL 105 4.165 0.898 7.349 224 2HG2 VAL 105 2HG2 VAL 105 4.394 2.589 7.795 225 3HG2 VAL 105 3HG2 VAL 105 4.934 2.011 6.218 226 H GLY 106 H GLY 106 8.996 1.232 6.602 227 1HA GLY 106 1HA GLY 106 11.056 1.278 7.704 228 2HA GLY 106 2HA GLY 106 10.437 0.110 8.863 229 H GLN 107 H GLN 107 9.514 -1.730 6.774 230 HA GLN 107 HA GLN 107 12.139 -2.841 6.070 231 1HB GLN 107 1HB GLN 107 10.953 -4.376 7.426 232 2HB GLN 107 2HB GLN 107 9.452 -4.114 6.549 233 1HG GLN 107 1HG GLN 107 10.374 -5.233 4.600 234 2HG GLN 107 2HG GLN 107 11.905 -5.462 5.443 235 1HE2 GLN 107 2HE2 GLN 107 9.653 -7.249 4.354 236 2HE2 GLN 107 1HE2 GLN 107 9.384 -8.372 5.639 237 H LYS 108 H LYS 108 12.198 -4.139 4.023 238 HA LYS 108 HA LYS 108 10.543 -4.204 1.931 239 1HB LYS 108 1HB LYS 108 11.207 -1.433 2.475 240 2HB LYS 108 2HB LYS 108 11.687 -1.903 0.859 241 1HG LYS 108 1HG LYS 108 8.929 -2.252 2.002 242 2HG LYS 108 2HG LYS 108 9.433 -0.946 0.927 243 1HD LYS 108 1HD LYS 108 10.164 -2.835 -0.665 244 2HD LYS 108 2HD LYS 108 9.143 -3.870 0.334 245 1HE LYS 108 1HE LYS 108 7.716 -1.479 -0.299 246 2HE LYS 108 2HE LYS 108 8.372 -2.165 -1.785 247 1HZ LYS 108 1HZ LYS 108 7.389 -4.333 -1.022 248 2HZ LYS 108 2HZ LYS 108 6.562 -3.461 0.168 249 3HZ LYS 108 3HZ LYS 108 6.272 -3.144 -1.466 250 H VAL 109 H VAL 109 11.893 -3.508 -0.304 251 HA VAL 109 HA VAL 109 14.697 -4.102 -0.077 252 HB VAL 109 HB VAL 109 12.870 -6.129 -1.375 253 1HG1 VAL 109 1HG1 VAL 109 15.800 -5.664 -1.504 254 2HG1 VAL 109 2HG1 VAL 109 15.232 -7.332 -1.418 255 3HG1 VAL 109 3HG1 VAL 109 14.697 -6.284 -2.732 256 1HG2 VAL 109 1HG2 VAL 109 14.617 -6.290 1.074 257 2HG2 VAL 109 2HG2 VAL 109 12.854 -6.325 1.025 258 3HG2 VAL 109 3HG2 VAL 109 13.782 -7.656 0.333 259 H ASN 110 H ASN 110 12.988 -5.187 -2.913 260 HA ASN 110 HA ASN 110 13.261 -2.635 -4.262 261 1HB ASN 110 1HB ASN 110 14.750 -3.398 -5.971 262 2HB ASN 110 2HB ASN 110 15.499 -3.784 -4.426 263 1HD2 ASN 110 2HD2 ASN 110 16.216 -5.016 -6.804 264 2HD2 ASN 110 1HD2 ASN 110 15.769 -6.683 -6.727 265 H VAL 111 H VAL 111 12.661 -2.996 -6.700 266 HA VAL 111 HA VAL 111 10.047 -3.599 -6.967 267 HB VAL 111 HB VAL 111 12.183 -4.114 -9.040 268 1HG1 VAL 111 1HG1 VAL 111 9.350 -4.637 -9.088 269 2HG1 VAL 111 2HG1 VAL 111 9.786 -3.430 -10.298 270 3HG1 VAL 111 3HG1 VAL 111 10.581 -5.005 -10.298 271 1HG2 VAL 111 1HG2 VAL 111 12.114 -1.811 -8.206 272 2HG2 VAL 111 2HG2 VAL 111 11.580 -1.909 -9.885 273 3HG2 VAL 111 3HG2 VAL 111 10.394 -1.725 -8.592 274 H GLY 112 H GLY 112 8.773 -5.345 -6.925 275 1HA GLY 112 1HA GLY 112 8.552 -7.686 -7.805 276 2HA GLY 112 2HA GLY 112 10.087 -7.990 -7.007 277 H ASP 113 H ASP 113 9.223 -6.223 -4.731 278 HA ASP 113 HA ASP 113 7.929 -8.312 -3.214 279 1HB ASP 113 1HB ASP 113 9.593 -6.044 -2.639 280 2HB ASP 113 2HB ASP 113 8.148 -5.985 -1.637 281 H THR 114 H THR 114 5.912 -8.256 -2.299 282 HA THR 114 HA THR 114 3.892 -6.833 -3.645 283 HB THR 114 HB THR 114 3.144 -7.749 -0.975 284 HG1 THR 114 HG1 THR 114 4.019 -9.652 -0.987 285 1HG2 THR 114 1HG2 THR 114 1.588 -7.449 -2.897 286 2HG2 THR 114 2HG2 THR 114 2.350 -8.847 -3.655 287 3HG2 THR 114 3HG2 THR 114 1.505 -9.029 -2.118 288 H LEU 115 H LEU 115 2.132 -5.770 -1.987 289 HA LEU 115 HA LEU 115 3.523 -3.753 -0.374 290 1HB LEU 115 1HB LEU 115 2.770 -3.103 -2.845 291 2HB LEU 115 2HB LEU 115 1.229 -2.856 -2.043 292 HG LEU 115 HG LEU 115 3.040 -1.523 -0.415 293 1HD1 LEU 115 1HD1 LEU 115 4.744 -1.773 -2.178 294 2HD1 LEU 115 2HD1 LEU 115 3.678 -0.927 -3.299 295 3HD1 LEU 115 3HD1 LEU 115 4.312 -0.089 -1.883 296 1HD2 LEU 115 1HD2 LEU 115 1.176 -0.576 -2.579 297 2HD2 LEU 115 2HD2 LEU 115 0.859 -0.693 -0.848 298 3HD2 LEU 115 3HD2 LEU 115 1.992 0.513 -1.458 299 H CYS 116 H CYS 116 0.165 -4.274 -1.436 300 HA CYS 116 HA CYS 116 -0.852 -5.464 0.830 301 1HB CYS 116 1HB CYS 116 -0.263 -2.637 1.225 302 2HB CYS 116 2HB CYS 116 -1.955 -3.015 1.526 303 HG CYS 116 HG CYS 116 -1.326 -4.063 3.644 304 H ILE 117 H ILE 117 -3.172 -5.518 0.894 305 HA ILE 117 HA ILE 117 -4.337 -5.191 -1.717 306 HB ILE 117 HB ILE 117 -5.458 -6.226 0.884 307 1HG1 ILE 117 1HG1 ILE 117 -5.424 -7.947 -1.486 308 2HG1 ILE 117 2HG1 ILE 117 -3.819 -7.420 -0.987 309 1HG2 ILE 117 1HG2 ILE 117 -7.244 -5.135 -0.370 310 2HG2 ILE 117 2HG2 ILE 117 -6.826 -6.082 -1.799 311 3HG2 ILE 117 3HG2 ILE 117 -7.452 -6.887 -0.359 312 1HD1 ILE 117 1HD1 ILE 117 -4.551 -8.187 1.363 313 2HD1 ILE 117 2HD1 ILE 117 -5.810 -9.073 0.503 314 3HD1 ILE 117 3HD1 ILE 117 -4.111 -9.402 0.162 315 H VAL 118 H VAL 118 -5.997 -3.839 -2.322 316 HA VAL 118 HA VAL 118 -6.374 -1.486 -0.617 317 HB VAL 118 HB VAL 118 -7.300 -1.733 -3.469 318 1HG1 VAL 118 1HG1 VAL 118 -7.805 0.188 -1.678 319 2HG1 VAL 118 2HG1 VAL 118 -6.270 0.783 -2.308 320 3HG1 VAL 118 3HG1 VAL 118 -7.625 0.507 -3.403 321 1HG2 VAL 118 1HG2 VAL 118 -4.690 -2.118 -2.794 322 2HG2 VAL 118 2HG2 VAL 118 -5.246 -1.452 -4.330 323 3HG2 VAL 118 3HG2 VAL 118 -4.742 -0.371 -3.030 324 H GLU 119 H GLU 119 -8.005 -4.249 -1.829 325 HA GLU 119 HA GLU 119 -10.168 -4.965 -1.772 326 1HB GLU 119 1HB GLU 119 -9.397 -4.625 0.709 327 2HB GLU 119 2HB GLU 119 -10.563 -3.309 0.693 328 1HG GLU 119 1HG GLU 119 -11.096 -6.228 0.213 329 2HG GLU 119 2HG GLU 119 -11.623 -5.249 1.580 330 H ALA 120 H ALA 120 -9.977 -2.918 -3.520 331 HA ALA 120 HA ALA 120 -12.109 -1.014 -2.923 332 1HB ALA 120 1HB ALA 120 -9.790 -1.036 -4.652 333 2HB ALA 120 2HB ALA 120 -11.246 -0.553 -5.522 334 3HB ALA 120 3HB ALA 120 -10.751 0.325 -4.075 335 H MET 121 H MET 121 -13.900 -2.397 -2.961 336 HA MET 121 HA MET 121 -15.814 -3.043 -4.087 337 1HB MET 121 1HB MET 121 -16.033 -2.782 -6.335 338 2HB MET 121 2HB MET 121 -14.552 -1.857 -6.140 339 1HG MET 121 1HG MET 121 -13.760 -3.150 -7.771 340 2HG MET 121 2HG MET 121 -13.583 -4.377 -6.519 341 1HE MET 121 1HE MET 121 -13.443 -5.270 -9.159 342 2HE MET 121 2HE MET 121 -13.982 -6.683 -8.250 343 3HE MET 121 3HE MET 121 -14.796 -6.234 -9.750 344 H LYS 122 H LYS 122 -13.454 -4.603 -2.978 345 HA LYS 122 HA LYS 122 -12.989 -6.781 -2.519 346 1HB LYS 122 1HB LYS 122 -15.532 -6.899 -2.474 347 2HB LYS 122 2HB LYS 122 -15.438 -7.522 -4.115 348 1HG LYS 122 1HG LYS 122 -15.585 -9.143 -2.071 349 2HG LYS 122 2HG LYS 122 -14.563 -9.529 -3.456 350 1HD LYS 122 1HD LYS 122 -12.612 -9.065 -2.313 351 2HD LYS 122 2HD LYS 122 -13.416 -7.991 -1.167 352 1HE LYS 122 1HE LYS 122 -14.608 -10.477 -0.779 353 2HE LYS 122 2HE LYS 122 -12.892 -10.827 -0.985 354 H MET 123 H MET 123 -11.498 -5.785 -4.453 355 HA MET 123 HA MET 123 -11.431 -7.882 -6.520 356 1HB MET 123 1HB MET 123 -10.836 -6.357 -8.140 357 2HB MET 123 2HB MET 123 -11.887 -5.367 -7.139 358 1HG MET 123 1HG MET 123 -9.755 -4.637 -5.938 359 2HG MET 123 2HG MET 123 -8.897 -5.342 -7.307 360 1HE MET 123 1HE MET 123 -9.123 -2.549 -5.917 361 2HE MET 123 2HE MET 123 -8.181 -2.082 -7.334 362 3HE MET 123 3HE MET 123 -9.686 -1.242 -6.958 363 H MET 124 H MET 124 -10.093 -7.352 -3.747 364 HA MET 124 HA MET 124 -7.995 -7.461 -2.803 365 1HB MET 124 1HB MET 124 -7.519 -9.609 -4.853 366 2HB MET 124 2HB MET 124 -7.009 -9.566 -3.171 367 1HG MET 124 1HG MET 124 -9.919 -9.549 -3.714 368 2HG MET 124 2HG MET 124 -9.039 -11.047 -4.014 369 1HE MET 124 1HE MET 124 -10.685 -8.758 -1.965 370 2HE MET 124 2HE MET 124 -11.041 -9.763 -0.560 371 3HE MET 124 3HE MET 124 -9.750 -8.564 -0.482 372 H ASN 125 H ASN 125 -7.902 -5.359 -4.464 373 HA ASN 125 HA ASN 125 -5.874 -5.557 -6.463 374 1HB ASN 125 1HB ASN 125 -7.516 -3.822 -6.685 375 2HB ASN 125 2HB ASN 125 -7.143 -3.187 -5.083 376 1HD2 ASN 125 2HD2 ASN 125 -6.758 -1.145 -5.991 377 2HD2 ASN 125 1HD2 ASN 125 -5.295 -0.800 -6.844 378 H GLN 126 H GLN 126 -4.356 -6.716 -4.971 379 HA GLN 126 HA GLN 126 -3.004 -5.113 -2.988 380 1HB GLN 126 1HB GLN 126 -1.807 -7.046 -2.428 381 2HB GLN 126 2HB GLN 126 -3.388 -7.650 -2.905 382 1HG GLN 126 1HG GLN 126 -2.385 -8.027 -5.204 383 2HG GLN 126 2HG GLN 126 -0.817 -7.742 -4.449 384 1HE2 GLN 126 2HE2 GLN 126 -3.730 -9.488 -3.425 385 2HE2 GLN 126 1HE2 GLN 126 -2.931 -10.988 -3.116 386 H ILE 127 H ILE 127 -1.528 -3.659 -3.483 387 HA ILE 127 HA ILE 127 -0.282 -3.587 -6.071 388 HB ILE 127 HB ILE 127 0.420 -1.876 -3.692 389 1HG1 ILE 127 1HG1 ILE 127 -1.957 -1.681 -3.945 390 2HG1 ILE 127 2HG1 ILE 127 -1.233 -0.248 -4.667 391 1HG2 ILE 127 1HG2 ILE 127 0.713 -1.524 -6.669 392 2HG2 ILE 127 2HG2 ILE 127 0.968 -0.232 -5.496 393 3HG2 ILE 127 3HG2 ILE 127 1.997 -1.665 -5.469 394 1HD1 ILE 127 1HD1 ILE 127 -1.383 -1.858 -6.822 395 2HD1 ILE 127 2HD1 ILE 127 -2.783 -2.410 -5.900 396 3HD1 ILE 127 3HD1 ILE 127 -2.636 -0.710 -6.349 397 H GLU 128 H GLU 128 1.929 -3.734 -6.528 398 HA GLU 128 HA GLU 128 3.582 -5.013 -4.455 399 1HB GLU 128 1HB GLU 128 3.224 -5.814 -7.337 400 2HB GLU 128 2HB GLU 128 4.633 -6.301 -6.404 401 1HG GLU 128 1HG GLU 128 3.490 -7.826 -5.218 402 2HG GLU 128 2HG GLU 128 2.038 -6.829 -5.132 403 H ALA 129 H ALA 129 5.258 -3.766 -4.003 404 HA ALA 129 HA ALA 129 6.074 -1.455 -5.040 405 1HB ALA 129 1HB ALA 129 7.088 -2.786 -3.106 406 2HB ALA 129 2HB ALA 129 8.172 -3.473 -4.317 407 3HB ALA 129 3HB ALA 129 8.162 -1.733 -4.028 408 H ASP 130 H ASP 130 5.928 -1.141 -7.223 409 HA ASP 130 HA ASP 130 7.503 -2.841 -9.005 410 1HB ASP 130 1HB ASP 130 6.378 -1.174 -10.729 411 2HB ASP 130 2HB ASP 130 5.475 -2.526 -10.047 412 H LYS 131 H LYS 131 7.771 0.055 -7.308 413 HA LYS 131 HA LYS 131 10.057 0.868 -8.975 414 1HB LYS 131 1HB LYS 131 7.694 2.390 -8.304 415 2HB LYS 131 2HB LYS 131 9.131 3.173 -7.662 416 1HG LYS 131 1HG LYS 131 10.132 2.979 -9.960 417 2HG LYS 131 2HG LYS 131 8.538 2.472 -10.523 418 1HD LYS 131 1HD LYS 131 7.571 4.563 -9.812 419 2HD LYS 131 2HD LYS 131 9.096 5.060 -9.075 420 1HE LYS 131 1HE LYS 131 9.632 6.024 -11.004 421 2HE LYS 131 2HE LYS 131 9.722 4.415 -11.720 422 1HZ LYS 131 1HZ LYS 131 7.243 4.653 -12.083 423 2HZ LYS 131 2HZ LYS 131 7.438 6.295 -11.731 424 3HZ LYS 131 3HZ LYS 131 8.241 5.612 -13.054 425 H SER 132 H SER 132 11.623 -0.011 -7.684 426 HA SER 132 HA SER 132 13.081 -0.183 -5.945 427 1HB SER 132 1HB SER 132 13.094 2.308 -6.134 428 2HB SER 132 2HB SER 132 11.793 2.369 -4.944 429 HG SER 132 HG SER 132 14.353 1.217 -4.512 430 H GLY 133 H GLY 133 13.200 -0.755 -3.650 431 1HA GLY 133 1HA GLY 133 10.537 -1.376 -2.547 432 2HA GLY 133 2HA GLY 133 11.877 -2.511 -2.475 433 H THR 134 H THR 134 10.496 0.393 -1.173 434 HA THR 134 HA THR 134 11.852 0.009 1.304 435 HB THR 134 HB THR 134 12.441 2.695 0.173 436 HG1 THR 134 HG1 THR 134 13.853 2.001 -1.206 437 1HG2 THR 134 1HG2 THR 134 13.802 0.831 2.083 438 2HG2 THR 134 2HG2 THR 134 14.603 2.252 1.414 439 3HG2 THR 134 3HG2 THR 134 13.146 2.440 2.390 440 H VAL 135 H VAL 135 9.928 0.092 2.387 441 HA VAL 135 HA VAL 135 7.997 2.164 1.808 442 HB VAL 135 HB VAL 135 8.046 -0.042 3.865 443 1HG1 VAL 135 1HG1 VAL 135 6.893 1.888 4.815 444 2HG1 VAL 135 2HG1 VAL 135 5.879 2.000 3.378 445 3HG1 VAL 135 3HG1 VAL 135 5.754 0.595 4.438 446 1HG2 VAL 135 1HG2 VAL 135 6.641 0.412 1.258 447 2HG2 VAL 135 2HG2 VAL 135 7.567 -0.989 1.795 448 3HG2 VAL 135 3HG2 VAL 135 5.968 -0.678 2.469 449 H LYS 136 H LYS 136 8.131 4.142 2.601 450 HA LYS 136 HA LYS 136 9.836 4.728 4.860 451 1HB LYS 136 1HB LYS 136 9.013 6.139 2.605 452 2HB LYS 136 2HB LYS 136 8.189 6.938 3.936 453 1HG LYS 136 1HG LYS 136 11.146 6.534 3.586 454 2HG LYS 136 2HG LYS 136 10.253 8.055 3.588 455 1HD LYS 136 1HD LYS 136 10.642 8.214 5.773 456 2HD LYS 136 2HD LYS 136 9.626 6.790 6.012 457 1HE LYS 136 1HE LYS 136 11.529 5.335 5.829 458 2HE LYS 136 2HE LYS 136 12.572 6.684 5.382 459 1HZ LYS 136 1HZ LYS 136 11.189 6.410 7.996 460 2HZ LYS 136 2HZ LYS 136 12.811 6.022 7.718 461 3HZ LYS 136 3HZ LYS 136 12.287 7.622 7.562 462 H ALA 137 H ALA 137 6.377 4.850 4.099 463 HA ALA 137 HA ALA 137 5.468 4.161 6.610 464 1HB ALA 137 1HB ALA 137 6.304 6.949 6.461 465 2HB ALA 137 2HB ALA 137 4.642 6.746 7.016 466 3HB ALA 137 3HB ALA 137 5.960 5.940 7.866 467 H ILE 138 H ILE 138 3.249 3.997 6.693 468 HA ILE 138 HA ILE 138 1.858 4.665 4.200 469 HB ILE 138 HB ILE 138 1.208 2.726 6.417 470 1HG1 ILE 138 1HG1 ILE 138 1.876 2.443 3.485 471 2HG1 ILE 138 2HG1 ILE 138 2.800 1.846 4.860 472 1HG2 ILE 138 1HG2 ILE 138 -0.627 4.112 4.722 473 2HG2 ILE 138 2HG2 ILE 138 -0.617 2.403 4.292 474 3HG2 ILE 138 3HG2 ILE 138 -0.955 2.892 5.952 475 1HD1 ILE 138 1HD1 ILE 138 0.112 0.788 4.852 476 2HD1 ILE 138 2HD1 ILE 138 0.966 0.435 3.349 477 3HD1 ILE 138 3HD1 ILE 138 1.661 -0.054 4.893 478 H LEU 139 H LEU 139 0.115 5.994 4.121 479 HA LEU 139 HA LEU 139 -0.380 7.675 6.427 480 1HB LEU 139 1HB LEU 139 -1.393 7.701 3.593 481 2HB LEU 139 2HB LEU 139 -1.993 8.804 4.817 482 HG LEU 139 HG LEU 139 -0.281 9.842 3.387 483 1HD1 LEU 139 1HD1 LEU 139 -0.511 10.008 6.105 484 2HD1 LEU 139 2HD1 LEU 139 1.213 9.705 5.891 485 3HD1 LEU 139 3HD1 LEU 139 0.454 11.082 5.095 486 1HD2 LEU 139 1HD2 LEU 139 0.960 7.593 3.141 487 2HD2 LEU 139 2HD2 LEU 139 1.906 9.080 3.212 488 3HD2 LEU 139 3HD2 LEU 139 1.768 8.054 4.639 489 H VAL 140 H VAL 140 -2.352 5.690 4.235 490 HA VAL 140 HA VAL 140 -4.813 5.853 5.244 491 HB VAL 140 HB VAL 140 -3.695 3.094 4.856 492 1HG1 VAL 140 1HG1 VAL 140 -6.316 4.386 4.830 493 2HG1 VAL 140 2HG1 VAL 140 -6.031 3.320 3.454 494 3HG1 VAL 140 3HG1 VAL 140 -5.885 2.698 5.098 495 1HG2 VAL 140 1HG2 VAL 140 -4.158 5.195 2.749 496 2HG2 VAL 140 2HG2 VAL 140 -2.687 4.274 3.061 497 3HG2 VAL 140 3HG2 VAL 140 -4.106 3.469 2.393 498 H GLU 141 H GLU 141 -5.961 5.250 6.990 499 HA GLU 141 HA GLU 141 -4.528 4.722 9.412 500 1HB GLU 141 1HB GLU 141 -7.318 5.419 8.677 501 2HB GLU 141 2HB GLU 141 -7.086 4.570 10.200 502 1HG GLU 141 1HG GLU 141 -5.174 6.682 9.990 503 2HG GLU 141 2HG GLU 141 -6.791 7.313 9.677 504 H SER 142 H SER 142 -4.069 2.591 7.806 505 HA SER 142 HA SER 142 -4.443 0.333 7.466 506 1HB SER 142 1HB SER 142 -3.122 0.803 9.613 507 2HB SER 142 2HB SER 142 -4.596 0.347 10.465 508 HG SER 142 HG SER 142 -3.180 -1.434 10.158 509 H GLY 143 H GLY 143 -6.482 -0.051 6.546 510 1HA GLY 143 1HA GLY 143 -8.420 -1.425 6.794 511 2HA GLY 143 2HA GLY 143 -8.534 -0.903 8.468 512 H GLN 144 H GLN 144 -8.090 1.918 7.739 513 HA GLN 144 HA GLN 144 -10.713 2.788 7.585 514 1HB GLN 144 1HB GLN 144 -8.453 4.045 8.108 515 2HB GLN 144 2HB GLN 144 -8.552 4.483 6.409 516 1HG GLN 144 1HG GLN 144 -10.652 5.572 6.741 517 2HG GLN 144 2HG GLN 144 -10.751 4.980 8.399 518 1HE2 GLN 144 2HE2 GLN 144 -9.235 7.245 6.244 519 2HE2 GLN 144 1HE2 GLN 144 -8.546 8.256 7.464 520 HA PRO 145 HA PRO 145 -11.980 2.186 3.404 521 1HB PRO 145 1HB PRO 145 -13.727 4.297 3.189 522 2HB PRO 145 2HB PRO 145 -14.114 2.765 3.978 523 1HG PRO 145 1HG PRO 145 -13.263 5.361 5.193 524 2HG PRO 145 2HG PRO 145 -14.498 4.215 5.746 525 1HD PRO 145 1HD PRO 145 -12.065 4.330 6.882 526 2HD PRO 145 2HD PRO 145 -12.935 2.793 6.694 527 H VAL 146 H VAL 146 -10.079 2.655 2.278 528 HA VAL 146 HA VAL 146 -8.707 4.925 1.877 529 HB VAL 146 HB VAL 146 -9.522 3.194 -0.455 530 1HG1 VAL 146 1HG1 VAL 146 -7.499 5.264 0.007 531 2HG1 VAL 146 2HG1 VAL 146 -6.885 3.795 -0.751 532 3HG1 VAL 146 3HG1 VAL 146 -8.211 4.685 -1.499 533 1HG2 VAL 146 1HG2 VAL 146 -8.129 2.464 1.952 534 2HG2 VAL 146 2HG2 VAL 146 -8.603 1.457 0.585 535 3HG2 VAL 146 3HG2 VAL 146 -7.063 2.314 0.555 536 H GLU 147 H GLU 147 -8.749 6.697 0.437 537 HA GLU 147 HA GLU 147 -11.390 7.319 -0.705 538 1HB GLU 147 1HB GLU 147 -9.696 9.508 0.421 539 2HB GLU 147 2HB GLU 147 -11.443 9.438 0.218 540 1HG GLU 147 1HG GLU 147 -11.475 7.713 2.046 541 2HG GLU 147 2HG GLU 147 -9.778 8.098 2.329 542 H PHE 148 H PHE 148 -11.391 8.668 -2.548 543 HA PHE 148 HA PHE 148 -9.701 8.180 -4.561 544 1HB PHE 148 1HB PHE 148 -11.788 9.830 -4.324 545 2HB PHE 148 2HB PHE 148 -10.501 11.027 -4.364 546 HD1 PHE 148 HD1 PHE 148 -8.652 9.413 -6.209 547 HD2 PHE 148 HD2 PHE 148 -12.793 10.413 -6.402 548 HE1 PHE 148 HE1 PHE 148 -8.572 9.253 -8.667 549 HE2 PHE 148 HE2 PHE 148 -12.721 10.254 -8.861 550 HZ PHE 148 HZ PHE 148 -10.609 9.673 -9.996 551 H ASP 149 H ASP 149 -7.547 8.118 -4.493 552 HA ASP 149 HA ASP 149 -5.393 8.866 -4.472 553 1HB ASP 149 1HB ASP 149 -6.950 11.336 -4.624 554 2HB ASP 149 2HB ASP 149 -5.402 11.550 -3.811 555 H GLU 150 H GLU 150 -5.457 7.526 -2.472 556 HA GLU 150 HA GLU 150 -4.880 9.192 -0.112 557 1HB GLU 150 1HB GLU 150 -6.952 7.412 -0.303 558 2HB GLU 150 2HB GLU 150 -5.693 6.416 0.413 559 1HG GLU 150 1HG GLU 150 -6.421 9.105 1.524 560 2HG GLU 150 2HG GLU 150 -7.269 7.630 1.990 561 HA PRO 151 HA PRO 151 -0.743 7.568 -0.809 562 1HB PRO 151 1HB PRO 151 -0.641 8.447 2.050 563 2HB PRO 151 2HB PRO 151 0.522 8.723 0.747 564 1HG PRO 151 1HG PRO 151 -1.143 10.655 1.516 565 2HG PRO 151 2HG PRO 151 -0.732 10.429 -0.194 566 1HD PRO 151 1HD PRO 151 -3.250 9.792 1.247 567 2HD PRO 151 2HD PRO 151 -3.001 10.241 -0.451 568 H LEU 152 H LEU 152 -1.354 5.364 -0.923 569 HA LEU 152 HA LEU 152 -2.135 3.825 1.311 570 1HB LEU 152 1HB LEU 152 -0.832 2.974 -1.277 571 2HB LEU 152 2HB LEU 152 -1.546 1.876 -0.108 572 HG LEU 152 HG LEU 152 -3.055 4.016 -1.613 573 1HD1 LEU 152 1HD1 LEU 152 -2.091 1.787 -2.739 574 2HD1 LEU 152 2HD1 LEU 152 -3.582 1.143 -2.052 575 3HD1 LEU 152 3HD1 LEU 152 -3.644 2.498 -3.180 576 1HD2 LEU 152 1HD2 LEU 152 -3.836 1.976 0.436 577 2HD2 LEU 152 2HD2 LEU 152 -4.241 3.691 0.357 578 3HD2 LEU 152 3HD2 LEU 152 -5.001 2.554 -0.756 579 H VAL 153 H VAL 153 0.994 3.905 -0.406 580 HA VAL 153 HA VAL 153 2.390 3.624 2.126 581 HB VAL 153 HB VAL 153 3.268 1.688 0.051 582 1HG1 VAL 153 1HG1 VAL 153 3.831 2.272 2.759 583 2HG1 VAL 153 2HG1 VAL 153 3.131 0.654 2.701 584 3HG1 VAL 153 3HG1 VAL 153 4.556 1.033 1.734 585 1HG2 VAL 153 1HG2 VAL 153 0.792 1.349 1.724 586 2HG2 VAL 153 2HG2 VAL 153 0.975 1.141 -0.017 587 3HG2 VAL 153 3HG2 VAL 153 1.704 -0.021 1.091 588 H VAL 154 H VAL 154 3.755 5.284 1.990 589 HA VAL 154 HA VAL 154 4.826 6.175 -0.529 590 HB VAL 154 HB VAL 154 5.747 8.000 0.619 591 1HG1 VAL 154 1HG1 VAL 154 3.158 7.608 0.736 592 2HG1 VAL 154 2HG1 VAL 154 3.465 7.497 2.469 593 3HG1 VAL 154 3HG1 VAL 154 3.901 8.961 1.588 594 1HG2 VAL 154 1HG2 VAL 154 5.672 6.231 3.042 595 2HG2 VAL 154 2HG2 VAL 154 7.050 7.056 2.314 596 3HG2 VAL 154 3HG2 VAL 154 5.827 7.982 3.184 597 H ILE 155 H ILE 155 6.581 5.401 -1.467 598 HA ILE 155 HA ILE 155 8.395 3.681 0.016 599 HB ILE 155 HB ILE 155 8.368 4.384 -2.922 600 1HG1 ILE 155 1HG1 ILE 155 7.531 1.757 -1.722 601 2HG1 ILE 155 2HG1 ILE 155 6.384 3.085 -1.869 602 1HG2 ILE 155 1HG2 ILE 155 10.557 3.617 -1.883 603 2HG2 ILE 155 2HG2 ILE 155 9.767 2.060 -1.630 604 3HG2 ILE 155 3HG2 ILE 155 9.967 2.691 -3.265 605 1HD1 ILE 155 1HD1 ILE 155 7.740 2.723 -4.356 606 2HD1 ILE 155 2HD1 ILE 155 7.083 1.182 -3.805 607 3HD1 ILE 155 3HD1 ILE 155 6.021 2.579 -3.988 608 H GLU 156 H GLU 156 10.534 4.083 0.400 609 HA GLU 156 HA GLU 156 11.351 6.843 0.378 610 1HB GLU 156 1HB GLU 156 11.874 5.351 2.273 611 2HB GLU 156 2HB GLU 156 12.880 4.371 1.215 612 1HG GLU 156 1HG GLU 156 14.402 6.213 0.889 613 2HG GLU 156 2HG GLU 156 13.361 7.277 1.833 614 1H10 BTN 222 1H10 BTN 122 -15.114 -9.754 3.463 615 2H10 BTN 222 2H10 BTN 122 -14.757 -8.324 2.499 616 1H9 BTN 222 1H9 BTN 122 -12.523 -9.797 3.821 617 2H9 BTN 222 2H9 BTN 122 -13.536 -8.709 4.772 618 1H8 BTN 222 1H8 BTN 122 -13.019 -6.872 3.268 619 2H8 BTN 222 2H8 BTN 122 -12.058 -7.950 2.254 620 1H7 BTN 222 1H7 BTN 122 -11.438 -7.609 5.160 621 2H7 BTN 222 2H7 BTN 122 -10.868 -6.441 3.977 622 H2 BTN 222 H2 BTN 122 -9.832 -8.415 2.735 623 1H6 BTN 222 1H6 BTN 122 -7.939 -11.044 5.126 624 2H6 BTN 222 2H6 BTN 122 -7.882 -10.518 3.449 625 H5 BTN 222 H5 BTN 122 -6.738 -8.759 4.478 626 HN1 BTN 222 HN2 BTN 122 -7.203 -9.353 6.915 627 HN2 BTN 222 HN1 BTN 122 -9.668 -6.452 5.765 628 H4 BTN 222 H4 BTN 122 -8.187 -7.112 3.782 Start of MODEL 14 1 1H GLU 77 H GLU 77 20.698 11.360 2.000 2 HA GLU 77 HA GLU 77 18.830 12.608 2.360 3 1HB GLU 77 1HB GLU 77 20.169 13.814 0.137 4 2HB GLU 77 2HB GLU 77 18.432 13.916 -0.129 5 1HG GLU 77 1HG GLU 77 18.355 15.655 1.228 6 2HG GLU 77 2HG GLU 77 18.871 14.618 2.557 7 H ILE 78 H ILE 78 16.559 12.999 1.574 8 HA ILE 78 HA ILE 78 15.278 10.641 0.961 9 HB ILE 78 HB ILE 78 14.022 12.459 1.880 10 1HG1 ILE 78 1HG1 ILE 78 12.074 12.523 0.347 11 2HG1 ILE 78 2HG1 ILE 78 13.080 11.850 -0.931 12 1HG2 ILE 78 1HG2 ILE 78 15.443 14.139 0.439 13 2HG2 ILE 78 2HG2 ILE 78 14.061 14.024 -0.650 14 3HG2 ILE 78 3HG2 ILE 78 13.831 14.568 1.013 15 1HD1 ILE 78 1HD1 ILE 78 13.483 9.954 0.842 16 2HD1 ILE 78 2HD1 ILE 78 11.949 10.546 1.481 17 3HD1 ILE 78 3HD1 ILE 78 12.046 9.967 -0.182 18 H SER 79 H SER 79 14.926 9.491 -0.831 19 HA SER 79 HA SER 79 15.063 10.780 -3.446 20 1HB SER 79 1HB SER 79 16.612 8.238 -3.023 21 2HB SER 79 2HB SER 79 16.751 9.415 -4.329 22 HG SER 79 HG SER 79 18.096 9.310 -2.019 23 H GLY 80 H GLY 80 13.066 9.394 -1.643 24 1HA GLY 80 1HA GLY 80 12.326 7.111 -3.333 25 2HA GLY 80 2HA GLY 80 11.658 7.478 -1.750 26 H HIS 81 H HIS 81 9.535 7.700 -2.082 27 HA HIS 81 HA HIS 81 8.536 9.984 -3.430 28 1HB HIS 81 1HB HIS 81 7.382 9.012 -5.268 29 2HB HIS 81 2HB HIS 81 9.034 8.411 -5.359 30 HD1 HIS 81 HD1 HIS 81 5.523 7.313 -4.771 31 HD2 HIS 81 HD2 HIS 81 9.332 5.655 -4.859 32 HE1 HIS 81 HE1 HIS 81 5.173 4.824 -4.812 33 HE2 HIS 81 HE2 HIS 81 7.492 3.842 -4.757 34 H ILE 82 H ILE 82 5.928 9.295 -3.870 35 HA ILE 82 HA ILE 82 5.037 8.067 -1.352 36 HB ILE 82 HB ILE 82 3.845 10.577 -2.530 37 1HG1 ILE 82 1HG1 ILE 82 5.915 10.110 -0.430 38 2HG1 ILE 82 2HG1 ILE 82 5.797 11.404 -1.618 39 1HG2 ILE 82 1HG2 ILE 82 2.587 8.731 -1.021 40 2HG2 ILE 82 2HG2 ILE 82 3.267 9.761 0.240 41 3HG2 ILE 82 3HG2 ILE 82 2.206 10.452 -0.987 42 1HD1 ILE 82 1HD1 ILE 82 3.625 11.894 -0.059 43 2HD1 ILE 82 2HD1 ILE 82 4.777 11.254 1.114 44 3HD1 ILE 82 3HD1 ILE 82 5.205 12.654 0.132 45 H VAL 83 H VAL 83 3.909 6.328 -1.884 46 HA VAL 83 HA VAL 83 2.694 5.951 -4.425 47 HB VAL 83 HB VAL 83 2.229 4.364 -1.898 48 1HG1 VAL 83 1HG1 VAL 83 1.138 4.184 -4.533 49 2HG1 VAL 83 2HG1 VAL 83 2.124 2.758 -4.208 50 3HG1 VAL 83 3HG1 VAL 83 0.802 3.183 -3.120 51 1HG2 VAL 83 1HG2 VAL 83 4.652 4.724 -2.967 52 2HG2 VAL 83 2HG2 VAL 83 4.145 3.199 -2.241 53 3HG2 VAL 83 3HG2 VAL 83 4.088 3.405 -3.992 54 H ARG 84 H ARG 84 0.957 7.074 -5.029 55 HA ARG 84 HA ARG 84 -0.940 8.153 -3.203 56 1HB ARG 84 1HB ARG 84 -0.482 8.183 -6.097 57 2HB ARG 84 2HB ARG 84 -2.183 8.213 -5.656 58 1HG ARG 84 1HG ARG 84 -2.075 10.336 -5.009 59 2HG ARG 84 2HG ARG 84 -0.613 10.056 -4.064 60 1HD ARG 84 1HD ARG 84 -0.261 10.033 -6.986 61 2HD ARG 84 2HD ARG 84 -0.717 11.588 -6.291 62 HE ARG 84 HE ARG 84 1.376 10.515 -4.772 63 1HH1 ARG 84 1HH1 ARG 84 0.784 11.794 -7.956 64 2HH1 ARG 84 2HH1 ARG 84 2.404 12.368 -8.167 65 1HH2 ARG 84 1HH2 ARG 84 3.512 11.268 -5.039 66 2HH2 ARG 84 2HH2 ARG 84 3.956 12.070 -6.510 67 H SER 85 H SER 85 -3.371 7.760 -3.684 68 HA SER 85 HA SER 85 -3.813 4.848 -3.646 69 1HB SER 85 1HB SER 85 -4.612 5.409 -1.586 70 2HB SER 85 2HB SER 85 -4.910 7.082 -2.047 71 HG SER 85 HG SER 85 -6.893 6.588 -2.519 72 HA PRO 86 HA PRO 86 -5.727 6.195 -7.634 73 1HB PRO 86 1HB PRO 86 -5.587 3.241 -7.946 74 2HB PRO 86 2HB PRO 86 -5.113 4.514 -9.075 75 1HG PRO 86 1HG PRO 86 -3.279 3.104 -7.744 76 2HG PRO 86 2HG PRO 86 -3.059 4.835 -8.057 77 1HD PRO 86 1HD PRO 86 -3.840 3.448 -5.533 78 2HD PRO 86 2HD PRO 86 -2.827 4.887 -5.764 79 H MET 87 H MET 87 -7.303 3.771 -8.535 80 HA MET 87 HA MET 87 -9.763 4.471 -7.294 81 1HB MET 87 1HB MET 87 -9.522 3.632 -9.645 82 2HB MET 87 2HB MET 87 -9.173 2.038 -8.990 83 1HG MET 87 1HG MET 87 -11.359 1.682 -9.190 84 2HG MET 87 2HG MET 87 -11.507 2.661 -7.731 85 1HE MET 87 1HE MET 87 -12.579 1.816 -10.816 86 2HE MET 87 2HE MET 87 -14.069 2.721 -10.553 87 3HE MET 87 3HE MET 87 -12.952 3.212 -11.827 88 H VAL 88 H VAL 88 -8.524 3.996 -5.123 89 HA VAL 88 HA VAL 88 -8.555 1.232 -4.316 90 HB VAL 88 HB VAL 88 -8.295 3.371 -2.279 91 1HG1 VAL 88 1HG1 VAL 88 -7.320 0.643 -2.775 92 2HG1 VAL 88 2HG1 VAL 88 -6.155 1.733 -2.026 93 3HG1 VAL 88 3HG1 VAL 88 -7.717 1.449 -1.258 94 1HG2 VAL 88 1HG2 VAL 88 -6.346 2.961 -4.532 95 2HG2 VAL 88 2HG2 VAL 88 -7.086 4.464 -3.984 96 3HG2 VAL 88 3HG2 VAL 88 -5.878 3.662 -2.982 97 H GLY 89 H GLY 89 -9.462 1.144 -1.814 98 1HA GLY 89 1HA GLY 89 -12.108 2.312 -1.621 99 2HA GLY 89 2HA GLY 89 -12.076 0.569 -1.849 100 H THR 90 H THR 90 -10.205 -0.412 -0.325 101 HA THR 90 HA THR 90 -10.379 0.790 2.337 102 HB THR 90 HB THR 90 -10.817 -2.158 2.125 103 HG1 THR 90 HG1 THR 90 -12.674 -0.170 1.460 104 1HG2 THR 90 1HG2 THR 90 -11.809 -0.056 4.033 105 2HG2 THR 90 2HG2 THR 90 -12.222 -1.769 4.105 106 3HG2 THR 90 3HG2 THR 90 -10.551 -1.253 4.334 107 H PHE 91 H PHE 91 -8.328 1.028 2.952 108 HA PHE 91 HA PHE 91 -6.268 -0.716 1.899 109 1HB PHE 91 1HB PHE 91 -5.818 1.679 2.035 110 2HB PHE 91 2HB PHE 91 -6.083 1.647 3.777 111 HD1 PHE 91 HD1 PHE 91 -3.955 0.084 1.144 112 HD2 PHE 91 HD2 PHE 91 -4.271 1.399 5.188 113 HE1 PHE 91 HE1 PHE 91 -1.568 -0.419 1.489 114 HE2 PHE 91 HE2 PHE 91 -1.884 0.898 5.542 115 HZ PHE 91 HZ PHE 91 -0.530 -0.013 3.690 116 H TYR 92 H TYR 92 -4.589 -1.596 3.364 117 HA TYR 92 HA TYR 92 -5.337 -2.170 6.083 118 1HB TYR 92 1HB TYR 92 -5.205 -4.416 4.080 119 2HB TYR 92 2HB TYR 92 -5.373 -4.609 5.819 120 HD1 TYR 92 HD1 TYR 92 -7.434 -3.128 6.799 121 HD2 TYR 92 HD2 TYR 92 -7.127 -4.679 2.840 122 HE1 TYR 92 HE1 TYR 92 -9.885 -3.025 6.574 123 HE2 TYR 92 HE2 TYR 92 -9.577 -4.580 2.605 124 HH TYR 92 HH TYR 92 -11.660 -4.033 5.263 125 H ARG 93 H ARG 93 -3.695 -4.143 6.777 126 HA ARG 93 HA ARG 93 -1.046 -3.272 5.819 127 1HB ARG 93 1HB ARG 93 -1.472 -4.436 8.551 128 2HB ARG 93 2HB ARG 93 -0.170 -3.403 7.976 129 1HG ARG 93 1HG ARG 93 -2.789 -2.133 7.846 130 2HG ARG 93 2HG ARG 93 -2.302 -2.591 9.480 131 1HD ARG 93 1HD ARG 93 -0.472 -1.098 7.621 132 2HD ARG 93 2HD ARG 93 -1.623 -0.269 8.666 133 HE ARG 93 HE ARG 93 0.864 -1.385 9.440 134 1HH1 ARG 93 1HH1 ARG 93 -2.405 -0.910 10.543 135 2HH1 ARG 93 2HH1 ARG 93 -1.977 -0.916 12.221 136 1HH2 ARG 93 1HH2 ARG 93 1.437 -1.396 11.648 137 2HH2 ARG 93 2HH2 ARG 93 0.207 -1.192 12.849 138 H THR 94 H THR 94 -3.185 -5.897 6.342 139 HA THR 94 HA THR 94 -1.632 -7.724 4.909 140 HB THR 94 HB THR 94 -0.234 -7.558 6.985 141 HG1 THR 94 HG1 THR 94 0.115 -9.398 5.922 142 1HG2 THR 94 1HG2 THR 94 -2.665 -8.793 8.228 143 2HG2 THR 94 2HG2 THR 94 -1.046 -8.981 8.903 144 3HG2 THR 94 3HG2 THR 94 -1.759 -7.374 8.755 145 HA PRO 95 HA PRO 95 -5.554 -9.736 5.119 146 1HB PRO 95 1HB PRO 95 -4.973 -11.980 3.752 147 2HB PRO 95 2HB PRO 95 -5.043 -10.396 2.976 148 1HG PRO 95 1HG PRO 95 -2.687 -12.039 3.715 149 2HG PRO 95 2HG PRO 95 -2.885 -10.887 2.386 150 1HD PRO 95 1HD PRO 95 -1.587 -10.419 4.847 151 2HD PRO 95 2HD PRO 95 -2.020 -9.204 3.631 152 H SER 96 H SER 96 -5.554 -10.069 7.424 153 HA SER 96 HA SER 96 -4.436 -11.725 9.110 154 1HB SER 96 1HB SER 96 -7.134 -10.769 8.816 155 2HB SER 96 2HB SER 96 -7.148 -12.395 9.502 156 HG SER 96 HG SER 96 -6.904 -10.484 10.973 157 HA PRO 97 HA PRO 97 -6.976 -15.699 7.531 158 1HB PRO 97 1HB PRO 97 -6.987 -14.795 4.683 159 2HB PRO 97 2HB PRO 97 -8.165 -15.785 5.553 160 1HG PRO 97 1HG PRO 97 -8.665 -13.221 5.040 161 2HG PRO 97 2HG PRO 97 -9.145 -13.952 6.582 162 1HD PRO 97 1HD PRO 97 -6.905 -12.086 5.985 163 2HD PRO 97 2HD PRO 97 -7.883 -12.242 7.456 164 H ASP 98 H ASP 98 -4.705 -16.100 8.157 165 HA ASP 98 HA ASP 98 -2.684 -17.089 7.809 166 1HB ASP 98 1HB ASP 98 -4.424 -18.185 5.884 167 2HB ASP 98 2HB ASP 98 -2.926 -17.827 5.030 168 H ALA 99 H ALA 99 -2.227 -14.611 7.804 169 HA ALA 99 HA ALA 99 -0.896 -13.891 5.277 170 1HB ALA 99 1HB ALA 99 -2.436 -12.337 7.243 171 2HB ALA 99 2HB ALA 99 -0.980 -11.557 6.627 172 3HB ALA 99 3HB ALA 99 -2.232 -12.095 5.509 173 H LYS 100 H LYS 100 1.025 -12.453 5.563 174 HA LYS 100 HA LYS 100 2.598 -13.174 7.943 175 1HB LYS 100 1HB LYS 100 3.588 -13.117 5.084 176 2HB LYS 100 2HB LYS 100 4.589 -13.396 6.503 177 1HG LYS 100 1HG LYS 100 4.254 -15.549 5.922 178 2HG LYS 100 2HG LYS 100 2.790 -15.328 6.881 179 1HD LYS 100 1HD LYS 100 1.711 -14.589 4.656 180 2HD LYS 100 2HD LYS 100 3.106 -15.362 3.899 181 1HE LYS 100 1HE LYS 100 2.403 -17.329 5.552 182 2HE LYS 100 2HE LYS 100 0.827 -16.560 5.371 183 1HZ LYS 100 1HZ LYS 100 2.188 -16.896 2.872 184 2HZ LYS 100 2HZ LYS 100 1.926 -18.368 3.662 185 3HZ LYS 100 3HZ LYS 100 0.620 -17.350 3.315 186 H ALA 101 H ALA 101 1.054 -10.785 7.188 187 HA ALA 101 HA ALA 101 1.226 -8.538 7.431 188 1HB ALA 101 1HB ALA 101 3.113 -9.462 9.083 189 2HB ALA 101 2HB ALA 101 4.125 -8.541 7.972 190 3HB ALA 101 3HB ALA 101 2.806 -7.743 8.832 191 H PHE 102 H PHE 102 0.887 -7.776 5.417 192 HA PHE 102 HA PHE 102 2.472 -8.080 3.176 193 1HB PHE 102 1HB PHE 102 0.299 -6.285 3.999 194 2HB PHE 102 2HB PHE 102 1.367 -5.593 2.784 195 HD1 PHE 102 HD1 PHE 102 2.030 -7.553 0.938 196 HD2 PHE 102 HD2 PHE 102 -1.616 -7.195 3.127 197 HE1 PHE 102 HE1 PHE 102 0.852 -8.818 -0.820 198 HE2 PHE 102 HE2 PHE 102 -2.797 -8.459 1.372 199 HZ PHE 102 HZ PHE 102 -1.564 -9.270 -0.604 200 H ILE 103 H ILE 103 3.123 -5.620 2.139 201 HA ILE 103 HA ILE 103 5.678 -5.168 3.264 202 HB ILE 103 HB ILE 103 4.221 -3.312 1.384 203 1HG1 ILE 103 1HG1 ILE 103 4.078 -5.455 0.358 204 2HG1 ILE 103 2HG1 ILE 103 5.440 -4.640 -0.406 205 1HG2 ILE 103 1HG2 ILE 103 6.336 -2.521 2.448 206 2HG2 ILE 103 2HG2 ILE 103 7.169 -3.863 1.663 207 3HG2 ILE 103 3HG2 ILE 103 6.397 -2.612 0.688 208 1HD1 ILE 103 1HD1 ILE 103 6.675 -5.940 1.626 209 2HD1 ILE 103 2HD1 ILE 103 5.367 -7.058 1.237 210 3HD1 ILE 103 3HD1 ILE 103 6.505 -6.563 -0.016 211 H GLU 104 H GLU 104 5.206 -4.683 5.474 212 HA GLU 104 HA GLU 104 3.726 -2.316 6.151 213 1HB GLU 104 1HB GLU 104 4.882 -4.565 7.547 214 2HB GLU 104 2HB GLU 104 5.261 -3.056 8.368 215 1HG GLU 104 1HG GLU 104 2.541 -2.925 7.676 216 2HG GLU 104 2HG GLU 104 2.818 -4.539 8.331 217 H VAL 105 H VAL 105 4.914 -0.826 7.859 218 HA VAL 105 HA VAL 105 6.846 0.644 6.401 219 HB VAL 105 HB VAL 105 6.159 0.903 9.331 220 1HG1 VAL 105 1HG1 VAL 105 7.444 2.805 7.378 221 2HG1 VAL 105 2HG1 VAL 105 6.889 3.252 8.991 222 3HG1 VAL 105 3HG1 VAL 105 8.187 2.074 8.800 223 1HG2 VAL 105 1HG2 VAL 105 4.852 2.010 6.864 224 2HG2 VAL 105 2HG2 VAL 105 4.113 1.131 8.203 225 3HG2 VAL 105 3HG2 VAL 105 4.682 2.784 8.440 226 H GLY 106 H GLY 106 9.033 1.062 6.897 227 1HA GLY 106 1HA GLY 106 11.122 0.649 7.828 228 2HA GLY 106 2HA GLY 106 10.377 -0.512 8.917 229 H GLN 107 H GLN 107 9.134 -1.606 6.245 230 HA GLN 107 HA GLN 107 11.235 -3.569 5.861 231 1HB GLN 107 1HB GLN 107 9.021 -4.450 6.085 232 2HB GLN 107 2HB GLN 107 8.400 -3.368 4.845 233 1HG GLN 107 1HG GLN 107 9.617 -4.540 3.138 234 2HG GLN 107 2HG GLN 107 10.410 -5.550 4.346 235 1HE2 GLN 107 2HE2 GLN 107 8.974 -6.575 2.191 236 2HE2 GLN 107 1HE2 GLN 107 7.576 -7.391 2.795 237 H LYS 108 H LYS 108 11.668 -4.314 3.562 238 HA LYS 108 HA LYS 108 12.256 -1.950 1.944 239 1HB LYS 108 1HB LYS 108 13.581 -3.836 0.636 240 2HB LYS 108 2HB LYS 108 14.234 -3.095 2.091 241 1HG LYS 108 1HG LYS 108 12.555 -5.513 2.427 242 2HG LYS 108 2HG LYS 108 14.165 -5.719 1.737 243 1HD LYS 108 1HD LYS 108 15.057 -4.415 3.693 244 2HD LYS 108 2HD LYS 108 13.442 -4.515 4.402 245 1HE LYS 108 1HE LYS 108 15.088 -6.901 3.575 246 2HE LYS 108 2HE LYS 108 15.028 -6.258 5.216 247 1HZ LYS 108 1HZ LYS 108 12.458 -6.543 4.800 248 2HZ LYS 108 2HZ LYS 108 12.994 -7.730 3.719 249 3HZ LYS 108 3HZ LYS 108 13.412 -7.825 5.356 250 H VAL 109 H VAL 109 12.285 -2.496 -0.525 251 HA VAL 109 HA VAL 109 10.191 -4.262 -1.416 252 HB VAL 109 HB VAL 109 9.166 -2.116 -2.647 253 1HG1 VAL 109 1HG1 VAL 109 8.113 -3.907 -1.130 254 2HG1 VAL 109 2HG1 VAL 109 8.277 -2.708 0.153 255 3HG1 VAL 109 3HG1 VAL 109 7.300 -2.349 -1.270 256 1HG2 VAL 109 1HG2 VAL 109 10.314 -1.103 -0.064 257 2HG2 VAL 109 2HG2 VAL 109 10.448 -0.406 -1.679 258 3HG2 VAL 109 3HG2 VAL 109 8.908 -0.352 -0.820 259 H ASN 110 H ASN 110 9.855 -4.032 -3.831 260 HA ASN 110 HA ASN 110 11.784 -2.671 -5.405 261 1HB ASN 110 1HB ASN 110 12.761 -4.951 -6.271 262 2HB ASN 110 2HB ASN 110 13.450 -4.175 -4.849 263 1HD2 ASN 110 1HD2 ASN 110 11.337 -6.724 -5.975 264 2HD2 ASN 110 2HD2 ASN 110 11.417 -7.686 -4.543 265 H VAL 111 H VAL 111 11.019 -2.462 -7.420 266 HA VAL 111 HA VAL 111 8.538 -2.991 -8.257 267 HB VAL 111 HB VAL 111 10.905 -3.319 -10.103 268 1HG1 VAL 111 1HG1 VAL 111 7.994 -2.924 -10.483 269 2HG1 VAL 111 2HG1 VAL 111 9.077 -2.054 -11.571 270 3HG1 VAL 111 3HG1 VAL 111 9.157 -3.813 -11.467 271 1HG2 VAL 111 1HG2 VAL 111 10.110 -1.063 -8.537 272 2HG2 VAL 111 2HG2 VAL 111 11.449 -1.210 -9.675 273 3HG2 VAL 111 3HG2 VAL 111 9.859 -0.706 -10.246 274 H GLY 112 H GLY 112 7.649 -4.929 -7.584 275 1HA GLY 112 1HA GLY 112 7.297 -7.019 -9.177 276 2HA GLY 112 2HA GLY 112 8.858 -7.426 -8.481 277 H ASP 113 H ASP 113 8.425 -6.454 -5.870 278 HA ASP 113 HA ASP 113 7.071 -8.671 -4.735 279 1HB ASP 113 1HB ASP 113 8.738 -6.516 -3.818 280 2HB ASP 113 2HB ASP 113 7.351 -6.693 -2.749 281 H THR 114 H THR 114 5.275 -8.539 -3.195 282 HA THR 114 HA THR 114 3.039 -7.214 -4.332 283 HB THR 114 HB THR 114 2.738 -8.138 -1.560 284 HG1 THR 114 HG1 THR 114 3.507 -10.083 -1.793 285 1HG2 THR 114 1HG2 THR 114 1.417 -8.818 -4.168 286 2HG2 THR 114 2HG2 THR 114 1.020 -9.605 -2.640 287 3HG2 THR 114 3HG2 THR 114 0.764 -7.871 -2.831 288 H LEU 115 H LEU 115 1.498 -6.159 -2.451 289 HA LEU 115 HA LEU 115 3.050 -4.125 -1.028 290 1HB LEU 115 1HB LEU 115 2.404 -3.224 -3.260 291 2HB LEU 115 2HB LEU 115 0.721 -3.463 -2.832 292 HG LEU 115 HG LEU 115 1.695 -1.949 -0.732 293 1HD1 LEU 115 1HD1 LEU 115 3.755 -1.654 -2.209 294 2HD1 LEU 115 2HD1 LEU 115 2.721 -0.671 -3.245 295 3HD1 LEU 115 3HD1 LEU 115 2.998 -0.195 -1.570 296 1HD2 LEU 115 1HD2 LEU 115 -0.425 -1.855 -2.269 297 2HD2 LEU 115 2HD2 LEU 115 0.126 -0.416 -1.411 298 3HD2 LEU 115 3HD2 LEU 115 0.504 -0.624 -3.122 299 H CYS 116 H CYS 116 -0.392 -4.675 -1.771 300 HA CYS 116 HA CYS 116 -1.149 -5.772 0.664 301 1HB CYS 116 1HB CYS 116 -0.542 -2.989 0.886 302 2HB CYS 116 2HB CYS 116 -2.278 -3.197 1.091 303 HG CYS 116 HG CYS 116 -1.863 -4.617 3.170 304 H ILE 117 H ILE 117 -3.494 -5.802 0.976 305 HA ILE 117 HA ILE 117 -4.852 -5.939 -1.542 306 HB ILE 117 HB ILE 117 -5.758 -6.431 1.289 307 1HG1 ILE 117 1HG1 ILE 117 -6.045 -8.560 -0.675 308 2HG1 ILE 117 2HG1 ILE 117 -4.380 -7.996 -0.551 309 1HG2 ILE 117 1HG2 ILE 117 -7.383 -6.635 -1.241 310 2HG2 ILE 117 2HG2 ILE 117 -7.871 -7.277 0.326 311 3HG2 ILE 117 3HG2 ILE 117 -7.667 -5.538 0.110 312 1HD1 ILE 117 1HD1 ILE 117 -4.602 -8.302 1.946 313 2HD1 ILE 117 2HD1 ILE 117 -6.111 -9.151 1.607 314 3HD1 ILE 117 3HD1 ILE 117 -4.589 -9.772 0.971 315 H VAL 118 H VAL 118 -6.589 -4.746 -2.266 316 HA VAL 118 HA VAL 118 -6.823 -2.058 -1.119 317 HB VAL 118 HB VAL 118 -7.557 -3.204 -3.809 318 1HG1 VAL 118 1HG1 VAL 118 -8.681 -0.872 -2.443 319 2HG1 VAL 118 2HG1 VAL 118 -8.057 -0.541 -4.059 320 3HG1 VAL 118 3HG1 VAL 118 -9.288 -1.783 -3.826 321 1HG2 VAL 118 1HG2 VAL 118 -5.206 -2.527 -3.386 322 2HG2 VAL 118 2HG2 VAL 118 -5.988 -1.617 -4.679 323 3HG2 VAL 118 3HG2 VAL 118 -5.777 -0.885 -3.089 324 H GLU 119 H GLU 119 -8.653 -4.935 -1.887 325 HA GLU 119 HA GLU 119 -10.869 -5.472 -1.637 326 1HB GLU 119 1HB GLU 119 -9.575 -5.152 0.782 327 2HB GLU 119 2HB GLU 119 -11.058 -4.234 1.003 328 1HG GLU 119 1HG GLU 119 -11.110 -6.661 1.694 329 2HG GLU 119 2HG GLU 119 -12.410 -6.112 0.639 330 H ALA 120 H ALA 120 -11.114 -3.504 -3.239 331 HA ALA 120 HA ALA 120 -12.684 -1.348 -2.048 332 1HB ALA 120 1HB ALA 120 -11.072 -1.647 -4.426 333 2HB ALA 120 2HB ALA 120 -12.662 -0.988 -4.807 334 3HB ALA 120 3HB ALA 120 -11.634 -0.181 -3.624 335 H MET 121 H MET 121 -13.244 -4.400 -3.170 336 HA MET 121 HA MET 121 -16.049 -4.126 -3.171 337 1HB MET 121 1HB MET 121 -16.596 -4.485 -5.470 338 2HB MET 121 2HB MET 121 -15.509 -3.105 -5.405 339 1HG MET 121 1HG MET 121 -13.973 -4.121 -6.653 340 2HG MET 121 2HG MET 121 -14.104 -5.627 -5.745 341 1HE MET 121 1HE MET 121 -13.315 -5.667 -8.438 342 2HE MET 121 2HE MET 121 -14.433 -6.451 -9.555 343 3HE MET 121 3HE MET 121 -14.354 -4.690 -9.475 344 H LYS 122 H LYS 122 -14.209 -5.762 -1.872 345 HA LYS 122 HA LYS 122 -13.859 -7.931 -1.280 346 1HB LYS 122 1HB LYS 122 -16.443 -7.854 -1.698 347 2HB LYS 122 2HB LYS 122 -16.056 -8.805 -3.125 348 1HG LYS 122 1HG LYS 122 -16.723 -10.099 -1.070 349 2HG LYS 122 2HG LYS 122 -15.207 -10.585 -1.835 350 1HD LYS 122 1HD LYS 122 -15.129 -10.435 0.668 351 2HD LYS 122 2HD LYS 122 -13.919 -9.464 -0.172 352 1HE LYS 122 1HE LYS 122 -15.184 -7.465 0.176 353 2HE LYS 122 2HE LYS 122 -16.557 -8.379 0.800 354 H MET 123 H MET 123 -12.668 -6.738 -3.729 355 HA MET 123 HA MET 123 -12.254 -9.101 -5.402 356 1HB MET 123 1HB MET 123 -11.160 -7.559 -6.967 357 2HB MET 123 2HB MET 123 -12.783 -7.024 -6.562 358 1HG MET 123 1HG MET 123 -12.007 -5.258 -5.255 359 2HG MET 123 2HG MET 123 -10.393 -5.952 -5.112 360 1HE MET 123 1HE MET 123 -10.608 -3.293 -5.372 361 2HE MET 123 2HE MET 123 -9.499 -2.832 -6.663 362 3HE MET 123 3HE MET 123 -11.229 -2.535 -6.839 363 H MET 124 H MET 124 -10.917 -7.835 -2.682 364 HA MET 124 HA MET 124 -8.793 -7.745 -1.786 365 1HB MET 124 1HB MET 124 -8.356 -10.468 -2.915 366 2HB MET 124 2HB MET 124 -8.111 -9.882 -1.275 367 1HG MET 124 1HG MET 124 -10.839 -9.673 -1.644 368 2HG MET 124 2HG MET 124 -10.413 -11.174 -2.464 369 1HE MET 124 1HE MET 124 -12.343 -10.839 0.103 370 2HE MET 124 2HE MET 124 -11.574 -11.091 1.670 371 3HE MET 124 3HE MET 124 -11.350 -9.567 0.814 372 H ASN 125 H ASN 125 -8.815 -6.583 -4.352 373 HA ASN 125 HA ASN 125 -6.683 -7.572 -5.963 374 1HB ASN 125 1HB ASN 125 -6.899 -5.465 -7.184 375 2HB ASN 125 2HB ASN 125 -8.491 -6.151 -6.865 376 1HD2 ASN 125 2HD2 ASN 125 -6.751 -3.382 -6.850 377 2HD2 ASN 125 1HD2 ASN 125 -7.679 -2.457 -5.724 378 H GLN 126 H GLN 126 -4.925 -7.849 -4.553 379 HA GLN 126 HA GLN 126 -3.891 -5.592 -3.086 380 1HB GLN 126 1HB GLN 126 -2.272 -7.086 -2.209 381 2HB GLN 126 2HB GLN 126 -3.777 -7.990 -2.306 382 1HG GLN 126 1HG GLN 126 -2.781 -8.670 -4.664 383 2HG GLN 126 2HG GLN 126 -1.263 -8.311 -3.841 384 1HE2 GLN 126 2HE2 GLN 126 -4.221 -10.212 -3.618 385 2HE2 GLN 126 1HE2 GLN 126 -3.537 -11.509 -2.706 386 H ILE 127 H ILE 127 -2.242 -4.288 -3.617 387 HA ILE 127 HA ILE 127 -1.287 -4.375 -6.351 388 HB ILE 127 HB ILE 127 -0.596 -2.374 -4.201 389 1HG1 ILE 127 1HG1 ILE 127 -2.918 -2.165 -4.364 390 2HG1 ILE 127 2HG1 ILE 127 -2.335 -0.980 -5.527 391 1HG2 ILE 127 1HG2 ILE 127 -0.330 -2.354 -7.199 392 2HG2 ILE 127 2HG2 ILE 127 -0.169 -0.913 -6.195 393 3HG2 ILE 127 3HG2 ILE 127 0.957 -2.256 -5.996 394 1HD1 ILE 127 1HD1 ILE 127 -2.575 -3.117 -7.131 395 2HD1 ILE 127 2HD1 ILE 127 -3.836 -3.472 -5.950 396 3HD1 ILE 127 3HD1 ILE 127 -3.869 -1.953 -6.845 397 H GLU 128 H GLU 128 1.028 -4.006 -6.816 398 HA GLU 128 HA GLU 128 2.764 -5.394 -4.882 399 1HB GLU 128 1HB GLU 128 2.542 -5.701 -7.862 400 2HB GLU 128 2HB GLU 128 4.045 -6.086 -7.035 401 1HG GLU 128 1HG GLU 128 3.210 -7.956 -6.089 402 2HG GLU 128 2HG GLU 128 1.589 -7.279 -5.915 403 H ALA 129 H ALA 129 4.456 -4.249 -4.215 404 HA ALA 129 HA ALA 129 5.000 -1.664 -4.597 405 1HB ALA 129 1HB ALA 129 6.631 -3.963 -3.838 406 2HB ALA 129 2HB ALA 129 7.564 -2.615 -4.488 407 3HB ALA 129 3HB ALA 129 6.505 -2.366 -3.100 408 H ASP 130 H ASP 130 5.594 -0.340 -6.186 409 HA ASP 130 HA ASP 130 6.600 -1.534 -8.680 410 1HB ASP 130 1HB ASP 130 5.867 0.843 -9.555 411 2HB ASP 130 2HB ASP 130 4.673 -0.433 -9.316 412 H LYS 131 H LYS 131 7.429 0.477 -6.062 413 HA LYS 131 HA LYS 131 9.875 1.315 -7.471 414 1HB LYS 131 1HB LYS 131 7.883 3.004 -6.434 415 2HB LYS 131 2HB LYS 131 9.216 3.091 -5.291 416 1HG LYS 131 1HG LYS 131 10.442 4.327 -6.671 417 2HG LYS 131 2HG LYS 131 10.125 3.256 -8.038 418 1HD LYS 131 1HD LYS 131 7.742 4.701 -7.404 419 2HD LYS 131 2HD LYS 131 9.082 5.837 -7.563 420 1HE LYS 131 1HE LYS 131 9.585 4.358 -9.705 421 2HE LYS 131 2HE LYS 131 7.855 4.040 -9.585 422 1HZ LYS 131 1HZ LYS 131 7.845 6.664 -9.317 423 2HZ LYS 131 2HZ LYS 131 9.247 6.511 -10.250 424 3HZ LYS 131 3HZ LYS 131 7.778 5.907 -10.829 425 H SER 132 H SER 132 11.526 0.235 -6.638 426 HA SER 132 HA SER 132 11.531 -1.168 -4.234 427 1HB SER 132 1HB SER 132 14.094 -0.096 -5.359 428 2HB SER 132 2HB SER 132 13.748 -1.691 -4.691 429 HG SER 132 HG SER 132 13.380 -0.721 -7.255 430 H GLY 133 H GLY 133 13.448 -0.713 -2.579 431 1HA GLY 133 1HA GLY 133 14.608 1.144 -1.436 432 2HA GLY 133 2HA GLY 133 13.154 2.094 -1.702 433 H THR 134 H THR 134 13.502 2.372 0.694 434 HA THR 134 HA THR 134 12.274 0.141 2.175 435 HB THR 134 HB THR 134 14.092 2.343 3.167 436 HG1 THR 134 HG1 THR 134 15.413 0.877 2.348 437 1HG2 THR 134 1HG2 THR 134 12.833 0.082 4.700 438 2HG2 THR 134 2HG2 THR 134 14.114 1.136 5.300 439 3HG2 THR 134 3HG2 THR 134 12.527 1.805 4.919 440 H VAL 135 H VAL 135 10.157 0.510 2.360 441 HA VAL 135 HA VAL 135 8.733 2.802 2.076 442 HB VAL 135 HB VAL 135 8.175 0.537 3.991 443 1HG1 VAL 135 1HG1 VAL 135 6.403 2.816 3.133 444 2HG1 VAL 135 2HG1 VAL 135 5.815 1.346 3.909 445 3HG1 VAL 135 3HG1 VAL 135 6.920 2.417 4.770 446 1HG2 VAL 135 1HG2 VAL 135 7.558 1.089 1.127 447 2HG2 VAL 135 2HG2 VAL 135 8.071 -0.410 1.900 448 3HG2 VAL 135 3HG2 VAL 135 6.410 0.153 2.086 449 H LYS 136 H LYS 136 8.584 4.688 3.096 450 HA LYS 136 HA LYS 136 10.061 5.158 5.509 451 1HB LYS 136 1HB LYS 136 9.042 6.728 3.389 452 2HB LYS 136 2HB LYS 136 8.306 7.334 4.866 453 1HG LYS 136 1HG LYS 136 11.264 6.891 4.625 454 2HG LYS 136 2HG LYS 136 10.489 8.399 4.134 455 1HD LYS 136 1HD LYS 136 10.006 9.007 6.278 456 2HD LYS 136 2HD LYS 136 9.837 7.339 6.827 457 1HE LYS 136 1HE LYS 136 11.837 7.637 7.784 458 2HE LYS 136 2HE LYS 136 12.486 7.469 6.153 459 1HZ LYS 136 1HZ LYS 136 11.638 10.093 7.217 460 2HZ LYS 136 2HZ LYS 136 13.195 9.490 7.491 461 3HZ LYS 136 3HZ LYS 136 12.663 9.768 5.910 462 H ALA 137 H ALA 137 6.616 5.172 4.630 463 HA ALA 137 HA ALA 137 5.664 4.058 6.959 464 1HB ALA 137 1HB ALA 137 6.522 6.747 7.393 465 2HB ALA 137 2HB ALA 137 4.773 6.653 7.600 466 3HB ALA 137 3HB ALA 137 5.830 5.601 8.542 467 H ILE 138 H ILE 138 3.327 4.248 7.225 468 HA ILE 138 HA ILE 138 2.034 4.841 4.662 469 HB ILE 138 HB ILE 138 1.178 3.155 7.010 470 1HG1 ILE 138 1HG1 ILE 138 1.858 2.552 4.128 471 2HG1 ILE 138 2HG1 ILE 138 2.747 2.043 5.560 472 1HG2 ILE 138 1HG2 ILE 138 -0.737 4.431 6.073 473 2HG2 ILE 138 2HG2 ILE 138 -0.418 3.682 4.509 474 3HG2 ILE 138 3HG2 ILE 138 -0.888 2.685 5.886 475 1HD1 ILE 138 1HD1 ILE 138 -0.086 1.194 5.082 476 2HD1 ILE 138 2HD1 ILE 138 1.283 0.320 4.397 477 3HD1 ILE 138 3HD1 ILE 138 1.121 0.473 6.146 478 H LEU 139 H LEU 139 0.065 6.015 4.571 479 HA LEU 139 HA LEU 139 -0.382 7.775 6.894 480 1HB LEU 139 1HB LEU 139 -0.276 8.356 3.966 481 2HB LEU 139 2HB LEU 139 -1.313 9.331 4.990 482 HG LEU 139 HG LEU 139 0.878 9.595 6.428 483 1HD1 LEU 139 1HD1 LEU 139 1.853 8.677 3.753 484 2HD1 LEU 139 2HD1 LEU 139 2.796 9.819 4.710 485 3HD1 LEU 139 3HD1 LEU 139 2.413 8.227 5.364 486 1HD2 LEU 139 1HD2 LEU 139 -0.320 11.065 4.247 487 2HD2 LEU 139 2HD2 LEU 139 0.367 11.654 5.760 488 3HD2 LEU 139 3HD2 LEU 139 1.411 11.378 4.365 489 H VAL 140 H VAL 140 -1.866 6.040 4.209 490 HA VAL 140 HA VAL 140 -4.495 6.743 4.415 491 HB VAL 140 HB VAL 140 -3.292 4.031 3.887 492 1HG1 VAL 140 1HG1 VAL 140 -6.153 4.843 4.072 493 2HG1 VAL 140 2HG1 VAL 140 -5.674 3.677 2.839 494 3HG1 VAL 140 3HG1 VAL 140 -5.378 3.331 4.542 495 1HG2 VAL 140 1HG2 VAL 140 -2.894 5.876 2.267 496 2HG2 VAL 140 2HG2 VAL 140 -3.783 4.513 1.586 497 3HG2 VAL 140 3HG2 VAL 140 -4.638 5.989 2.032 498 H GLU 141 H GLU 141 -2.674 4.649 6.579 499 HA GLU 141 HA GLU 141 -3.117 3.905 8.681 500 1HB GLU 141 1HB GLU 141 -5.475 5.781 8.452 501 2HB GLU 141 2HB GLU 141 -5.050 4.911 9.919 502 1HG GLU 141 1HG GLU 141 -2.702 6.179 9.131 503 2HG GLU 141 2HG GLU 141 -3.980 7.363 8.863 504 H SER 142 H SER 142 -3.444 1.795 8.159 505 HA SER 142 HA SER 142 -5.284 0.454 6.821 506 1HB SER 142 1HB SER 142 -3.447 -0.465 8.334 507 2HB SER 142 2HB SER 142 -4.643 -0.435 9.629 508 HG SER 142 HG SER 142 -5.751 -2.012 8.674 509 H GLY 143 H GLY 143 -7.362 -0.528 7.200 510 1HA GLY 143 1HA GLY 143 -9.518 -0.613 7.994 511 2HA GLY 143 2HA GLY 143 -8.932 0.104 9.488 512 H GLN 144 H GLN 144 -8.052 1.981 6.843 513 HA GLN 144 HA GLN 144 -10.278 3.825 7.388 514 1HB GLN 144 1HB GLN 144 -7.436 4.273 6.523 515 2HB GLN 144 2HB GLN 144 -8.661 5.507 6.272 516 1HG GLN 144 1HG GLN 144 -8.847 4.606 8.957 517 2HG GLN 144 2HG GLN 144 -7.157 4.960 8.602 518 1HE2 GLN 144 2HE2 GLN 144 -6.767 7.073 7.508 519 2HE2 GLN 144 1HE2 GLN 144 -7.708 8.424 8.033 520 HA PRO 145 HA PRO 145 -11.709 3.447 3.239 521 1HB PRO 145 1HB PRO 145 -12.963 5.801 2.908 522 2HB PRO 145 2HB PRO 145 -13.561 4.577 4.033 523 1HG PRO 145 1HG PRO 145 -11.965 7.046 4.593 524 2HG PRO 145 2HG PRO 145 -13.349 6.383 5.481 525 1HD PRO 145 1HD PRO 145 -10.744 6.043 6.252 526 2HD PRO 145 2HD PRO 145 -12.046 4.903 6.647 527 H VAL 146 H VAL 146 -9.933 3.366 1.892 528 HA VAL 146 HA VAL 146 -8.848 5.944 0.958 529 HB VAL 146 HB VAL 146 -7.142 4.485 1.930 530 1HG1 VAL 146 1HG1 VAL 146 -8.421 2.492 0.165 531 2HG1 VAL 146 2HG1 VAL 146 -6.665 2.412 0.301 532 3HG1 VAL 146 3HG1 VAL 146 -7.667 2.292 1.747 533 1HG2 VAL 146 1HG2 VAL 146 -7.022 5.765 -0.501 534 2HG2 VAL 146 2HG2 VAL 146 -5.644 5.156 0.415 535 3HG2 VAL 146 3HG2 VAL 146 -6.363 4.169 -0.858 536 H GLU 147 H GLU 147 -8.973 6.463 -1.185 537 HA GLU 147 HA GLU 147 -9.245 4.693 -3.319 538 1HB GLU 147 1HB GLU 147 -11.621 4.855 -3.857 539 2HB GLU 147 2HB GLU 147 -11.390 4.091 -2.288 540 1HG GLU 147 1HG GLU 147 -11.682 6.649 -1.520 541 2HG GLU 147 2HG GLU 147 -12.665 6.650 -2.983 542 H PHE 148 H PHE 148 -7.896 6.215 -4.284 543 HA PHE 148 HA PHE 148 -7.524 7.908 -5.784 544 1HB PHE 148 1HB PHE 148 -10.174 7.596 -6.045 545 2HB PHE 148 2HB PHE 148 -10.143 9.213 -5.356 546 HD1 PHE 148 HD1 PHE 148 -8.491 7.222 -8.045 547 HD2 PHE 148 HD2 PHE 148 -9.980 11.012 -6.780 548 HE1 PHE 148 HE1 PHE 148 -7.993 8.155 -10.270 549 HE2 PHE 148 HE2 PHE 148 -9.485 11.953 -9.004 550 HZ PHE 148 HZ PHE 148 -8.489 10.524 -10.753 551 H ASP 149 H ASP 149 -6.021 9.133 -4.821 552 HA ASP 149 HA ASP 149 -5.188 11.073 -3.919 553 1HB ASP 149 1HB ASP 149 -7.854 11.792 -2.752 554 2HB ASP 149 2HB ASP 149 -6.565 12.852 -3.318 555 H GLU 150 H GLU 150 -4.709 8.830 -2.614 556 HA GLU 150 HA GLU 150 -4.766 9.683 0.167 557 1HB GLU 150 1HB GLU 150 -6.331 7.453 -0.872 558 2HB GLU 150 2HB GLU 150 -5.251 6.973 0.430 559 1HG GLU 150 1HG GLU 150 -6.725 9.437 0.961 560 2HG GLU 150 2HG GLU 150 -7.747 8.016 0.745 561 HA PRO 151 HA PRO 151 -0.569 8.279 -0.373 562 1HB PRO 151 1HB PRO 151 0.230 8.718 2.194 563 2HB PRO 151 2HB PRO 151 0.059 10.008 0.999 564 1HG PRO 151 1HG PRO 151 -1.834 9.164 3.158 565 2HG PRO 151 2HG PRO 151 -1.370 10.800 2.651 566 1HD PRO 151 1HD PRO 151 -3.695 9.654 1.889 567 2HD PRO 151 2HD PRO 151 -2.806 10.781 0.843 568 H LEU 152 H LEU 152 -1.188 6.063 -0.707 569 HA LEU 152 HA LEU 152 -1.887 4.269 1.327 570 1HB LEU 152 1HB LEU 152 -0.768 4.024 -1.419 571 2HB LEU 152 2HB LEU 152 -0.687 2.614 -0.378 572 HG LEU 152 HG LEU 152 -3.290 4.047 -0.775 573 1HD1 LEU 152 1HD1 LEU 152 -2.103 1.954 -2.592 574 2HD1 LEU 152 2HD1 LEU 152 -3.781 2.498 -2.623 575 3HD1 LEU 152 3HD1 LEU 152 -2.480 3.625 -3.015 576 1HD2 LEU 152 1HD2 LEU 152 -2.345 1.462 0.301 577 2HD2 LEU 152 2HD2 LEU 152 -3.688 2.483 0.812 578 3HD2 LEU 152 3HD2 LEU 152 -3.861 1.439 -0.599 579 H VAL 153 H VAL 153 1.301 4.867 -0.150 580 HA VAL 153 HA VAL 153 2.608 4.377 2.379 581 HB VAL 153 HB VAL 153 3.577 2.651 0.136 582 1HG1 VAL 153 1HG1 VAL 153 4.341 3.157 2.797 583 2HG1 VAL 153 2HG1 VAL 153 3.709 1.511 2.756 584 3HG1 VAL 153 3HG1 VAL 153 5.025 1.978 1.678 585 1HG2 VAL 153 1HG2 VAL 153 1.152 2.176 0.434 586 2HG2 VAL 153 2HG2 VAL 153 2.199 0.812 0.826 587 3HG2 VAL 153 3HG2 VAL 153 1.482 1.774 2.119 588 H VAL 154 H VAL 154 4.351 5.641 2.543 589 HA VAL 154 HA VAL 154 5.326 6.955 0.112 590 HB VAL 154 HB VAL 154 6.144 8.714 1.453 591 1HG1 VAL 154 1HG1 VAL 154 3.530 8.181 1.349 592 2HG1 VAL 154 2HG1 VAL 154 3.748 8.153 3.099 593 3HG1 VAL 154 3HG1 VAL 154 4.184 9.594 2.179 594 1HG2 VAL 154 1HG2 VAL 154 6.141 6.669 3.576 595 2HG2 VAL 154 2HG2 VAL 154 7.266 7.993 3.274 596 3HG2 VAL 154 3HG2 VAL 154 5.733 8.306 4.087 597 H ILE 155 H ILE 155 7.170 6.329 -0.765 598 HA ILE 155 HA ILE 155 8.937 4.530 0.667 599 HB ILE 155 HB ILE 155 9.330 5.596 -2.124 600 1HG1 ILE 155 1HG1 ILE 155 7.120 4.658 -2.100 601 2HG1 ILE 155 2HG1 ILE 155 8.188 3.482 -2.859 602 1HG2 ILE 155 1HG2 ILE 155 10.334 3.176 -0.644 603 2HG2 ILE 155 2HG2 ILE 155 10.478 3.375 -2.391 604 3HG2 ILE 155 3HG2 ILE 155 11.276 4.512 -1.305 605 1HD1 ILE 155 1HD1 ILE 155 7.581 3.306 0.059 606 2HD1 ILE 155 2HD1 ILE 155 6.443 2.685 -1.138 607 3HD1 ILE 155 3HD1 ILE 155 8.082 2.038 -1.059 608 H GLU 156 H GLU 156 11.172 4.879 0.972 609 HA GLU 156 HA GLU 156 11.847 7.687 1.392 610 1HB GLU 156 1HB GLU 156 12.160 5.731 3.099 611 2HB GLU 156 2HB GLU 156 13.618 5.398 2.173 612 1HG GLU 156 1HG GLU 156 14.073 7.945 2.549 613 2HG GLU 156 2HG GLU 156 12.955 7.731 3.896 614 1H10 BTN 222 1H10 BTN 122 -12.698 -9.457 2.969 615 2H10 BTN 222 2H10 BTN 122 -13.554 -10.462 4.137 616 1H9 BTN 222 1H9 BTN 122 -12.615 -8.865 5.504 617 2H9 BTN 222 2H9 BTN 122 -14.215 -8.183 5.210 618 1H8 BTN 222 1H8 BTN 122 -13.263 -6.342 4.414 619 2H8 BTN 222 2H8 BTN 122 -12.542 -7.297 3.116 620 1H7 BTN 222 1H7 BTN 122 -11.278 -7.219 5.822 621 2H7 BTN 222 2H7 BTN 122 -11.023 -5.899 4.688 622 H2 BTN 222 H2 BTN 122 -10.151 -7.531 3.031 623 1H6 BTN 222 1H6 BTN 122 -8.212 -9.746 2.919 624 2H6 BTN 222 2H6 BTN 122 -8.054 -10.672 4.404 625 H5 BTN 222 H5 BTN 122 -6.870 -8.297 4.176 626 HN1 BTN 222 HN2 BTN 122 -7.019 -9.489 6.429 627 HN2 BTN 222 HN1 BTN 122 -9.522 -6.399 6.410 628 H4 BTN 222 H4 BTN 122 -8.349 -6.524 4.140 Start of MODEL 15 1 1H GLU 77 H GLU 77 14.953 15.800 -3.402 2 HA GLU 77 HA GLU 77 16.737 14.815 -5.183 3 1HB GLU 77 1HB GLU 77 18.131 16.032 -2.935 4 2HB GLU 77 2HB GLU 77 18.558 14.338 -3.139 5 1HG GLU 77 1HG GLU 77 19.736 14.736 -4.990 6 2HG GLU 77 2HG GLU 77 18.524 15.838 -5.639 7 H ILE 78 H ILE 78 14.407 13.927 -4.177 8 HA ILE 78 HA ILE 78 15.023 11.725 -2.346 9 HB ILE 78 HB ILE 78 13.011 13.246 -1.996 10 1HG1 ILE 78 1HG1 ILE 78 12.892 10.248 -2.091 11 2HG1 ILE 78 2HG1 ILE 78 13.032 11.307 -0.691 12 1HG2 ILE 78 1HG2 ILE 78 12.484 12.858 -4.584 13 2HG2 ILE 78 2HG2 ILE 78 11.486 11.575 -3.899 14 3HG2 ILE 78 3HG2 ILE 78 11.235 13.248 -3.402 15 1HD1 ILE 78 1HD1 ILE 78 10.604 12.018 -1.744 16 2HD1 ILE 78 2HD1 ILE 78 10.668 10.279 -2.030 17 3HD1 ILE 78 3HD1 ILE 78 10.865 10.911 -0.396 18 H SER 79 H SER 79 15.099 9.654 -2.982 19 HA SER 79 HA SER 79 14.523 9.083 -5.807 20 1HB SER 79 1HB SER 79 16.830 8.640 -5.175 21 2HB SER 79 2HB SER 79 16.298 7.628 -3.831 22 HG SER 79 HG SER 79 16.321 6.057 -5.210 23 H GLY 80 H GLY 80 12.361 9.212 -4.039 24 1HA GLY 80 1HA GLY 80 11.582 6.364 -3.915 25 2HA GLY 80 2HA GLY 80 11.123 7.511 -2.666 26 H HIS 81 H HIS 81 8.915 7.136 -2.980 27 HA HIS 81 HA HIS 81 7.661 8.827 -4.864 28 1HB HIS 81 1HB HIS 81 6.474 7.115 -6.193 29 2HB HIS 81 2HB HIS 81 8.213 7.072 -6.458 30 HD1 HIS 81 HD1 HIS 81 5.595 4.817 -6.216 31 HD2 HIS 81 HD2 HIS 81 9.303 5.024 -4.350 32 HE1 HIS 81 HE1 HIS 81 6.086 2.478 -5.434 33 HE2 HIS 81 HE2 HIS 81 8.358 2.616 -4.356 34 H ILE 82 H ILE 82 5.262 8.654 -4.761 35 HA ILE 82 HA ILE 82 4.423 7.584 -2.145 36 HB ILE 82 HB ILE 82 3.147 9.918 -3.549 37 1HG1 ILE 82 1HG1 ILE 82 5.696 10.007 -2.653 38 2HG1 ILE 82 2HG1 ILE 82 4.610 11.392 -2.645 39 1HG2 ILE 82 1HG2 ILE 82 2.732 8.493 -1.006 40 2HG2 ILE 82 2HG2 ILE 82 2.619 10.251 -0.944 41 3HG2 ILE 82 3HG2 ILE 82 1.580 9.340 -2.038 42 1HD1 ILE 82 1HD1 ILE 82 4.625 9.591 -0.290 43 2HD1 ILE 82 2HD1 ILE 82 5.971 10.707 -0.516 44 3HD1 ILE 82 3HD1 ILE 82 4.323 11.325 -0.391 45 H VAL 83 H VAL 83 3.067 5.933 -2.290 46 HA VAL 83 HA VAL 83 1.588 5.467 -4.753 47 HB VAL 83 HB VAL 83 1.543 3.720 -2.299 48 1HG1 VAL 83 1HG1 VAL 83 0.141 3.597 -4.658 49 2HG1 VAL 83 2HG1 VAL 83 1.489 2.496 -4.943 50 3HG1 VAL 83 3HG1 VAL 83 0.427 2.248 -3.557 51 1HG2 VAL 83 1HG2 VAL 83 3.559 3.708 -4.545 52 2HG2 VAL 83 2HG2 VAL 83 3.872 4.072 -2.847 53 3HG2 VAL 83 3HG2 VAL 83 3.391 2.444 -3.326 54 H ARG 84 H ARG 84 -0.063 6.969 -4.746 55 HA ARG 84 HA ARG 84 -1.823 7.158 -2.442 56 1HB ARG 84 1HB ARG 84 -2.971 8.907 -3.739 57 2HB ARG 84 2HB ARG 84 -1.243 9.212 -3.615 58 1HG ARG 84 1HG ARG 84 -1.389 7.807 -5.944 59 2HG ARG 84 2HG ARG 84 -2.905 8.712 -5.967 60 1HD ARG 84 1HD ARG 84 -1.698 10.790 -5.648 61 2HD ARG 84 2HD ARG 84 -0.175 9.914 -5.519 62 HE ARG 84 HE ARG 84 -1.625 9.507 -7.989 63 1HH1 ARG 84 1HH1 ARG 84 0.801 11.349 -6.303 64 2HH1 ARG 84 2HH1 ARG 84 1.587 11.885 -7.750 65 1HH2 ARG 84 1HH2 ARG 84 -0.599 10.207 -9.902 66 2HH2 ARG 84 2HH2 ARG 84 0.791 11.235 -9.797 67 H SER 85 H SER 85 -3.988 6.575 -2.418 68 HA SER 85 HA SER 85 -4.669 4.320 -4.046 69 1HB SER 85 1HB SER 85 -5.357 5.051 -1.536 70 2HB SER 85 2HB SER 85 -6.784 5.601 -2.414 71 HG SER 85 HG SER 85 -7.039 3.503 -3.214 72 HA PRO 86 HA PRO 86 -6.407 6.967 -7.252 73 1HB PRO 86 1HB PRO 86 -6.928 4.925 -8.979 74 2HB PRO 86 2HB PRO 86 -5.329 5.655 -8.793 75 1HG PRO 86 1HG PRO 86 -6.407 3.127 -7.609 76 2HG PRO 86 2HG PRO 86 -4.814 3.439 -8.324 77 1HD PRO 86 1HD PRO 86 -5.214 3.389 -5.651 78 2HD PRO 86 2HD PRO 86 -4.015 4.456 -6.411 79 H MET 87 H MET 87 -7.883 3.781 -6.583 80 HA MET 87 HA MET 87 -10.526 5.064 -6.773 81 1HB MET 87 1HB MET 87 -10.334 2.110 -6.791 82 2HB MET 87 2HB MET 87 -11.369 3.179 -7.729 83 1HG MET 87 1HG MET 87 -8.440 2.708 -8.240 84 2HG MET 87 2HG MET 87 -9.765 1.946 -9.116 85 1HE MET 87 1HE MET 87 -11.336 3.061 -10.693 86 2HE MET 87 2HE MET 87 -10.724 4.322 -11.762 87 3HE MET 87 3HE MET 87 -9.839 2.807 -11.590 88 H VAL 88 H VAL 88 -11.904 5.014 -5.084 89 HA VAL 88 HA VAL 88 -11.069 4.719 -2.491 90 HB VAL 88 HB VAL 88 -13.840 4.391 -3.639 91 1HG1 VAL 88 1HG1 VAL 88 -12.980 4.491 -0.752 92 2HG1 VAL 88 2HG1 VAL 88 -14.634 4.764 -1.299 93 3HG1 VAL 88 3HG1 VAL 88 -13.864 3.201 -1.566 94 1HG2 VAL 88 1HG2 VAL 88 -12.259 6.617 -3.383 95 2HG2 VAL 88 2HG2 VAL 88 -14.019 6.618 -3.503 96 3HG2 VAL 88 3HG2 VAL 88 -13.241 6.674 -1.920 97 H GLY 89 H GLY 89 -11.560 3.129 -0.845 98 1HA GLY 89 1HA GLY 89 -12.541 0.563 -1.310 99 2HA GLY 89 2HA GLY 89 -10.810 0.509 -1.609 100 H THR 90 H THR 90 -10.210 -0.734 0.111 101 HA THR 90 HA THR 90 -10.383 0.559 2.730 102 HB THR 90 HB THR 90 -10.851 -2.402 2.511 103 HG1 THR 90 HG1 THR 90 -12.647 -0.335 2.021 104 1HG2 THR 90 1HG2 THR 90 -10.370 -0.989 4.698 105 2HG2 THR 90 2HG2 THR 90 -12.105 -0.700 4.578 106 3HG2 THR 90 3HG2 THR 90 -11.491 -2.350 4.678 107 H PHE 91 H PHE 91 -8.262 0.982 2.987 108 HA PHE 91 HA PHE 91 -6.153 -0.643 2.060 109 1HB PHE 91 1HB PHE 91 -6.090 1.836 2.723 110 2HB PHE 91 2HB PHE 91 -5.926 1.265 4.382 111 HD1 PHE 91 HD1 PHE 91 -4.401 0.650 1.024 112 HD2 PHE 91 HD2 PHE 91 -3.802 1.080 5.224 113 HE1 PHE 91 HE1 PHE 91 -1.969 0.415 0.698 114 HE2 PHE 91 HE2 PHE 91 -1.371 0.845 4.906 115 HZ PHE 91 HZ PHE 91 -0.451 0.513 2.641 116 H TYR 92 H TYR 92 -4.442 -1.545 3.576 117 HA TYR 92 HA TYR 92 -5.134 -2.451 6.155 118 1HB TYR 92 1HB TYR 92 -5.739 -4.257 3.862 119 2HB TYR 92 2HB TYR 92 -5.152 -4.959 5.366 120 HD1 TYR 92 HD1 TYR 92 -6.433 -3.893 7.526 121 HD2 TYR 92 HD2 TYR 92 -8.023 -4.239 3.584 122 HE1 TYR 92 HE1 TYR 92 -8.717 -3.823 8.447 123 HE2 TYR 92 HE2 TYR 92 -10.311 -4.169 4.494 124 HH TYR 92 HH TYR 92 -10.896 -3.711 7.966 125 H ARG 93 H ARG 93 -3.556 -4.098 6.978 126 HA ARG 93 HA ARG 93 -1.027 -4.003 5.470 127 1HB ARG 93 1HB ARG 93 -0.929 -3.968 8.443 128 2HB ARG 93 2HB ARG 93 0.186 -3.276 7.275 129 1HG ARG 93 1HG ARG 93 -2.067 -1.788 6.861 130 2HG ARG 93 2HG ARG 93 -2.122 -2.083 8.600 131 1HD ARG 93 1HD ARG 93 0.448 -1.229 7.354 132 2HD ARG 93 2HD ARG 93 -0.815 -0.027 7.615 133 HE ARG 93 HE ARG 93 -0.213 -1.632 9.931 134 1HH1 ARG 93 1HH1 ARG 93 0.584 1.235 8.123 135 2HH1 ARG 93 2HH1 ARG 93 1.275 2.058 9.482 136 1HH2 ARG 93 1HH2 ARG 93 0.696 -0.559 11.729 137 2HH2 ARG 93 2HH2 ARG 93 1.339 1.037 11.532 138 H THR 94 H THR 94 -3.359 -5.940 6.798 139 HA THR 94 HA THR 94 -1.636 -8.260 6.631 140 HB THR 94 HB THR 94 -2.626 -9.065 8.894 141 HG1 THR 94 HG1 THR 94 -3.337 -7.552 10.232 142 1HG2 THR 94 1HG2 THR 94 -0.245 -8.638 8.580 143 2HG2 THR 94 2HG2 THR 94 -0.512 -6.925 8.906 144 3HG2 THR 94 3HG2 THR 94 -0.800 -8.120 10.172 145 HA PRO 95 HA PRO 95 -5.687 -9.147 4.754 146 1HB PRO 95 1HB PRO 95 -4.127 -11.377 3.614 147 2HB PRO 95 2HB PRO 95 -5.100 -10.152 2.795 148 1HG PRO 95 1HG PRO 95 -2.417 -10.117 2.696 149 2HG PRO 95 2HG PRO 95 -3.371 -8.624 2.738 150 1HD PRO 95 1HD PRO 95 -1.845 -9.963 4.932 151 2HD PRO 95 2HD PRO 95 -2.021 -8.234 4.573 152 H SER 96 H SER 96 -7.031 -10.062 6.160 153 HA SER 96 HA SER 96 -6.773 -11.708 8.197 154 1HB SER 96 1HB SER 96 -8.975 -11.053 7.690 155 2HB SER 96 2HB SER 96 -8.912 -11.772 6.079 156 HG SER 96 HG SER 96 -9.591 -13.567 6.912 157 HA PRO 97 HA PRO 97 -6.891 -15.844 5.591 158 1HB PRO 97 1HB PRO 97 -6.108 -15.446 2.960 159 2HB PRO 97 2HB PRO 97 -7.775 -15.656 3.501 160 1HG PRO 97 1HG PRO 97 -6.284 -13.143 2.882 161 2HG PRO 97 2HG PRO 97 -7.971 -13.564 2.531 162 1HD PRO 97 1HD PRO 97 -7.332 -11.932 4.559 163 2HD PRO 97 2HD PRO 97 -8.667 -13.095 4.695 164 H ASP 98 H ASP 98 -5.010 -15.577 7.084 165 HA ASP 98 HA ASP 98 -2.813 -15.924 7.566 166 1HB ASP 98 1HB ASP 98 -2.995 -17.725 5.898 167 2HB ASP 98 2HB ASP 98 -2.611 -16.579 4.617 168 H ALA 99 H ALA 99 -3.514 -13.325 7.280 169 HA ALA 99 HA ALA 99 -2.406 -11.630 5.526 170 1HB ALA 99 1HB ALA 99 -2.444 -11.412 8.524 171 2HB ALA 99 2HB ALA 99 -1.955 -10.084 7.472 172 3HB ALA 99 3HB ALA 99 -3.591 -10.737 7.365 173 H LYS 100 H LYS 100 -0.561 -12.501 8.456 174 HA LYS 100 HA LYS 100 1.670 -12.779 8.818 175 1HB LYS 100 1HB LYS 100 1.471 -13.500 5.909 176 2HB LYS 100 2HB LYS 100 3.036 -13.433 6.707 177 1HG LYS 100 1HG LYS 100 1.088 -14.964 8.219 178 2HG LYS 100 2HG LYS 100 1.351 -15.606 6.596 179 1HD LYS 100 1HD LYS 100 3.857 -15.362 7.137 180 2HD LYS 100 2HD LYS 100 3.333 -15.223 8.816 181 1HE LYS 100 1HE LYS 100 2.402 -17.491 7.095 182 2HE LYS 100 2HE LYS 100 3.971 -17.550 7.896 183 1HZ LYS 100 1HZ LYS 100 1.798 -16.770 9.621 184 2HZ LYS 100 2HZ LYS 100 1.644 -18.337 9.000 185 3HZ LYS 100 3HZ LYS 100 3.026 -17.906 9.874 186 H ALA 101 H ALA 101 0.410 -10.194 7.708 187 HA ALA 101 HA ALA 101 1.076 -8.062 7.285 188 1HB ALA 101 1HB ALA 101 2.584 -8.722 9.254 189 2HB ALA 101 2HB ALA 101 3.868 -8.840 8.052 190 3HB ALA 101 3HB ALA 101 3.034 -7.307 8.303 191 H PHE 102 H PHE 102 0.898 -7.752 5.133 192 HA PHE 102 HA PHE 102 2.411 -8.980 3.137 193 1HB PHE 102 1HB PHE 102 0.468 -6.832 3.305 194 2HB PHE 102 2HB PHE 102 1.708 -6.479 2.107 195 HD1 PHE 102 HD1 PHE 102 2.336 -8.799 0.732 196 HD2 PHE 102 HD2 PHE 102 -1.437 -7.737 2.413 197 HE1 PHE 102 HE1 PHE 102 1.205 -10.279 -0.884 198 HE2 PHE 102 HE2 PHE 102 -2.574 -9.216 0.801 199 HZ PHE 102 HZ PHE 102 -1.253 -10.488 -0.850 200 H ILE 103 H ILE 103 2.632 -5.478 3.378 201 HA ILE 103 HA ILE 103 5.542 -5.677 3.707 202 HB ILE 103 HB ILE 103 4.377 -3.765 1.707 203 1HG1 ILE 103 1HG1 ILE 103 3.695 -6.026 1.018 204 2HG1 ILE 103 2HG1 ILE 103 4.910 -5.365 -0.073 205 1HG2 ILE 103 1HG2 ILE 103 7.025 -4.529 2.657 206 2HG2 ILE 103 2HG2 ILE 103 6.889 -4.520 0.900 207 3HG2 ILE 103 3HG2 ILE 103 6.498 -3.069 1.821 208 1HD1 ILE 103 1HD1 ILE 103 6.021 -6.928 2.128 209 2HD1 ILE 103 2HD1 ILE 103 4.973 -7.844 1.044 210 3HD1 ILE 103 3HD1 ILE 103 6.371 -6.982 0.400 211 H GLU 104 H GLU 104 4.591 -5.034 5.889 212 HA GLU 104 HA GLU 104 3.437 -2.562 6.396 213 1HB GLU 104 1HB GLU 104 4.715 -4.644 7.919 214 2HB GLU 104 2HB GLU 104 5.185 -3.065 8.539 215 1HG GLU 104 1HG GLU 104 2.685 -2.525 8.520 216 2HG GLU 104 2HG GLU 104 2.448 -4.263 8.335 217 H VAL 105 H VAL 105 4.545 -0.740 7.613 218 HA VAL 105 HA VAL 105 6.459 0.463 5.921 219 HB VAL 105 HB VAL 105 5.721 1.257 8.742 220 1HG1 VAL 105 1HG1 VAL 105 7.830 2.226 7.701 221 2HG1 VAL 105 2HG1 VAL 105 6.761 3.038 6.556 222 3HG1 VAL 105 3HG1 VAL 105 6.627 3.379 8.282 223 1HG2 VAL 105 1HG2 VAL 105 3.891 1.032 6.893 224 2HG2 VAL 105 2HG2 VAL 105 3.934 2.462 7.926 225 3HG2 VAL 105 3HG2 VAL 105 4.592 2.534 6.290 226 H GLY 106 H GLY 106 8.639 0.948 6.254 227 1HA GLY 106 1HA GLY 106 10.731 0.808 7.280 228 2HA GLY 106 2HA GLY 106 10.014 -0.154 8.563 229 H GLN 107 H GLN 107 8.859 -1.635 5.970 230 HA GLN 107 HA GLN 107 10.944 -3.659 6.032 231 1HB GLN 107 1HB GLN 107 8.655 -4.416 6.277 232 2HB GLN 107 2HB GLN 107 8.196 -3.630 4.774 233 1HG GLN 107 1HG GLN 107 9.377 -5.188 3.473 234 2HG GLN 107 2HG GLN 107 10.263 -5.802 4.867 235 1HE2 GLN 107 2HE2 GLN 107 7.940 -6.572 2.761 236 2HE2 GLN 107 1HE2 GLN 107 6.982 -7.641 3.721 237 H LYS 108 H LYS 108 11.472 -4.760 3.895 238 HA LYS 108 HA LYS 108 12.436 -2.738 2.077 239 1HB LYS 108 1HB LYS 108 13.291 -4.895 0.866 240 2HB LYS 108 2HB LYS 108 14.040 -4.371 2.367 241 1HG LYS 108 1HG LYS 108 13.609 -6.807 2.252 242 2HG LYS 108 2HG LYS 108 12.832 -6.010 3.621 243 1HD LYS 108 1HD LYS 108 10.737 -6.354 2.808 244 2HD LYS 108 2HD LYS 108 11.254 -6.230 1.125 245 1HE LYS 108 1HE LYS 108 12.038 -8.446 1.091 246 2HE LYS 108 2HE LYS 108 12.008 -8.570 2.850 247 1HZ LYS 108 1HZ LYS 108 9.525 -8.136 1.311 248 2HZ LYS 108 2HZ LYS 108 10.151 -9.692 1.533 249 3HZ LYS 108 3HZ LYS 108 9.708 -8.761 2.873 250 H VAL 109 H VAL 109 12.096 -2.796 -0.224 251 HA VAL 109 HA VAL 109 9.788 -4.276 -1.199 252 HB VAL 109 HB VAL 109 9.089 -1.927 -2.264 253 1HG1 VAL 109 1HG1 VAL 109 7.906 -3.657 -0.647 254 2HG1 VAL 109 2HG1 VAL 109 8.129 -2.350 0.514 255 3HG1 VAL 109 3HG1 VAL 109 7.218 -2.066 -0.969 256 1HG2 VAL 109 1HG2 VAL 109 10.470 -1.261 0.317 257 2HG2 VAL 109 2HG2 VAL 109 10.650 -0.496 -1.261 258 3HG2 VAL 109 3HG2 VAL 109 9.172 -0.256 -0.329 259 H ASN 110 H ASN 110 11.354 -5.305 -2.519 260 HA ASN 110 HA ASN 110 12.929 -3.742 -4.365 261 1HB ASN 110 1HB ASN 110 13.859 -5.810 -5.091 262 2HB ASN 110 2HB ASN 110 13.660 -5.946 -3.346 263 1HD2 ASN 110 2HD2 ASN 110 13.921 -8.119 -5.099 264 2HD2 ASN 110 1HD2 ASN 110 12.451 -9.025 -5.059 265 H VAL 111 H VAL 111 12.591 -3.458 -6.526 266 HA VAL 111 HA VAL 111 10.101 -3.179 -7.574 267 HB VAL 111 HB VAL 111 12.434 -4.082 -9.259 268 1HG1 VAL 111 1HG1 VAL 111 9.877 -3.528 -9.996 269 2HG1 VAL 111 2HG1 VAL 111 10.643 -1.951 -10.186 270 3HG1 VAL 111 3HG1 VAL 111 11.284 -3.352 -11.044 271 1HG2 VAL 111 1HG2 VAL 111 12.109 -1.677 -7.634 272 2HG2 VAL 111 2HG2 VAL 111 13.554 -2.351 -8.389 273 3HG2 VAL 111 3HG2 VAL 111 12.457 -1.342 -9.332 274 H GLY 112 H GLY 112 8.517 -4.650 -7.585 275 1HA GLY 112 1HA GLY 112 7.671 -6.493 -9.019 276 2HA GLY 112 2HA GLY 112 9.157 -7.342 -8.625 277 H ASP 113 H ASP 113 8.714 -6.047 -5.812 278 HA ASP 113 HA ASP 113 7.384 -8.364 -4.727 279 1HB ASP 113 1HB ASP 113 9.206 -6.358 -3.770 280 2HB ASP 113 2HB ASP 113 7.836 -6.488 -2.673 281 H THR 114 H THR 114 5.566 -8.289 -3.302 282 HA THR 114 HA THR 114 3.443 -6.690 -4.270 283 HB THR 114 HB THR 114 2.980 -7.834 -1.628 284 HG1 THR 114 HG1 THR 114 3.180 -10.033 -2.657 285 1HG2 THR 114 1HG2 THR 114 1.652 -7.653 -4.166 286 2HG2 THR 114 2HG2 THR 114 1.615 -9.307 -3.556 287 3HG2 THR 114 3HG2 THR 114 0.987 -7.988 -2.567 288 H LEU 115 H LEU 115 1.979 -5.838 -2.161 289 HA LEU 115 HA LEU 115 3.628 -4.079 -0.530 290 1HB LEU 115 1HB LEU 115 2.991 -2.991 -2.797 291 2HB LEU 115 2HB LEU 115 1.383 -2.867 -2.107 292 HG LEU 115 HG LEU 115 2.838 -1.760 -0.114 293 1HD1 LEU 115 1HD1 LEU 115 4.292 -1.177 -2.684 294 2HD1 LEU 115 2HD1 LEU 115 4.432 -0.191 -1.228 295 3HD1 LEU 115 3HD1 LEU 115 4.952 -1.877 -1.206 296 1HD2 LEU 115 1HD2 LEU 115 1.592 -0.528 -2.553 297 2HD2 LEU 115 2HD2 LEU 115 0.918 -0.684 -0.930 298 3HD2 LEU 115 3HD2 LEU 115 2.237 0.448 -1.232 299 H CYS 116 H CYS 116 0.189 -4.214 -1.464 300 HA CYS 116 HA CYS 116 -0.719 -5.464 0.878 301 1HB CYS 116 1HB CYS 116 -1.816 -3.424 1.922 302 2HB CYS 116 2HB CYS 116 -0.073 -3.553 2.132 303 HG CYS 116 HG CYS 116 -0.661 -1.112 1.451 304 H ILE 117 H ILE 117 -3.029 -5.584 1.001 305 HA ILE 117 HA ILE 117 -4.274 -5.365 -1.594 306 HB ILE 117 HB ILE 117 -5.144 -6.521 1.037 307 1HG1 ILE 117 1HG1 ILE 117 -5.236 -7.961 -1.570 308 2HG1 ILE 117 2HG1 ILE 117 -3.654 -7.634 -0.866 309 1HG2 ILE 117 1HG2 ILE 117 -6.858 -6.233 -1.426 310 2HG2 ILE 117 2HG2 ILE 117 -7.267 -7.184 0.002 311 3HG2 ILE 117 3HG2 ILE 117 -7.114 -5.431 0.123 312 1HD1 ILE 117 1HD1 ILE 117 -4.440 -8.749 1.220 313 2HD1 ILE 117 2HD1 ILE 117 -5.906 -9.207 0.354 314 3HD1 ILE 117 3HD1 ILE 117 -4.338 -9.808 -0.186 315 H VAL 118 H VAL 118 -5.901 -4.015 -2.197 316 HA VAL 118 HA VAL 118 -6.417 -1.727 -0.446 317 HB VAL 118 HB VAL 118 -7.384 -1.984 -3.282 318 1HG1 VAL 118 1HG1 VAL 118 -7.687 -0.043 -1.325 319 2HG1 VAL 118 2HG1 VAL 118 -6.433 0.598 -2.387 320 3HG1 VAL 118 3HG1 VAL 118 -8.002 0.142 -3.050 321 1HG2 VAL 118 1HG2 VAL 118 -4.795 -2.370 -2.812 322 2HG2 VAL 118 2HG2 VAL 118 -5.372 -1.449 -4.200 323 3HG2 VAL 118 3HG2 VAL 118 -4.811 -0.608 -2.757 324 H GLU 119 H GLU 119 -7.884 -4.560 -1.693 325 HA GLU 119 HA GLU 119 -10.079 -5.270 -1.819 326 1HB GLU 119 1HB GLU 119 -9.235 -5.853 0.432 327 2HB GLU 119 2HB GLU 119 -9.883 -4.340 1.051 328 1HG GLU 119 1HG GLU 119 -12.101 -5.344 -0.059 329 2HG GLU 119 2HG GLU 119 -11.263 -6.844 0.332 330 H ALA 120 H ALA 120 -11.093 -3.816 -3.207 331 HA ALA 120 HA ALA 120 -12.726 -1.762 -1.861 332 1HB ALA 120 1HB ALA 120 -10.844 -1.064 -3.547 333 2HB ALA 120 2HB ALA 120 -12.044 -1.522 -4.755 334 3HB ALA 120 3HB ALA 120 -12.415 -0.264 -3.577 335 H MET 121 H MET 121 -13.051 -4.702 -2.781 336 HA MET 121 HA MET 121 -15.706 -4.925 -3.057 337 1HB MET 121 1HB MET 121 -16.010 -5.128 -5.591 338 2HB MET 121 2HB MET 121 -15.914 -3.505 -4.922 339 1HG MET 121 1HG MET 121 -13.724 -3.193 -5.714 340 2HG MET 121 2HG MET 121 -13.516 -4.911 -6.050 341 1HE MET 121 1HE MET 121 -13.456 -1.858 -7.522 342 2HE MET 121 2HE MET 121 -14.405 -1.839 -9.009 343 3HE MET 121 3HE MET 121 -15.182 -1.496 -7.464 344 H LYS 122 H LYS 122 -13.540 -6.444 -2.198 345 HA LYS 122 HA LYS 122 -12.771 -8.583 -2.134 346 1HB LYS 122 1HB LYS 122 -15.193 -9.107 -2.214 347 2HB LYS 122 2HB LYS 122 -15.108 -9.150 -3.970 348 1HG LYS 122 1HG LYS 122 -15.000 -11.353 -2.576 349 2HG LYS 122 2HG LYS 122 -13.992 -11.148 -4.009 350 1HD LYS 122 1HD LYS 122 -12.639 -12.060 -2.247 351 2HD LYS 122 2HD LYS 122 -12.144 -10.389 -2.525 352 1HE LYS 122 1HE LYS 122 -13.356 -9.646 -0.594 353 2HE LYS 122 2HE LYS 122 -14.074 -11.241 -0.373 354 H MET 123 H MET 123 -12.155 -6.648 -4.409 355 HA MET 123 HA MET 123 -11.485 -8.360 -6.627 356 1HB MET 123 1HB MET 123 -10.605 -6.370 -7.665 357 2HB MET 123 2HB MET 123 -12.144 -5.978 -6.913 358 1HG MET 123 1HG MET 123 -10.593 -5.290 -4.899 359 2HG MET 123 2HG MET 123 -9.400 -5.116 -6.185 360 1HE MET 123 1HE MET 123 -9.427 -2.811 -4.875 361 2HE MET 123 2HE MET 123 -9.063 -2.357 -6.540 362 3HE MET 123 3HE MET 123 -10.245 -1.434 -5.613 363 H MET 124 H MET 124 -9.960 -7.295 -3.726 364 HA MET 124 HA MET 124 -7.913 -7.674 -2.819 365 1HB MET 124 1HB MET 124 -8.618 -10.003 -4.177 366 2HB MET 124 2HB MET 124 -6.968 -9.684 -4.693 367 1HG MET 124 1HG MET 124 -7.219 -11.163 -2.687 368 2HG MET 124 2HG MET 124 -6.154 -9.774 -2.484 369 1HE MET 124 1HE MET 124 -9.853 -9.580 -2.834 370 2HE MET 124 2HE MET 124 -10.091 -10.847 -1.631 371 3HE MET 124 3HE MET 124 -10.484 -9.174 -1.238 372 H ASN 125 H ASN 125 -8.094 -5.623 -4.732 373 HA ASN 125 HA ASN 125 -5.966 -5.737 -6.615 374 1HB ASN 125 1HB ASN 125 -8.020 -3.888 -5.878 375 2HB ASN 125 2HB ASN 125 -6.480 -3.032 -5.912 376 1HD2 ASN 125 2HD2 ASN 125 -9.066 -3.961 -7.718 377 2HD2 ASN 125 1HD2 ASN 125 -8.370 -3.849 -9.295 378 H GLN 126 H GLN 126 -4.386 -6.641 -5.042 379 HA GLN 126 HA GLN 126 -3.296 -4.846 -3.073 380 1HB GLN 126 1HB GLN 126 -1.682 -6.631 -2.642 381 2HB GLN 126 2HB GLN 126 -3.325 -7.261 -2.671 382 1HG GLN 126 1HG GLN 126 -3.000 -8.155 -4.875 383 2HG GLN 126 2HG GLN 126 -1.409 -7.405 -4.987 384 1HE2 GLN 126 2HE2 GLN 126 -1.982 -10.163 -5.314 385 2HE2 GLN 126 1HE2 GLN 126 -1.154 -11.022 -4.066 386 H ILE 127 H ILE 127 -1.569 -3.551 -3.249 387 HA ILE 127 HA ILE 127 -0.469 -3.087 -5.877 388 HB ILE 127 HB ILE 127 0.408 -1.765 -3.316 389 1HG1 ILE 127 1HG1 ILE 127 -1.905 -1.386 -3.264 390 2HG1 ILE 127 2HG1 ILE 127 -1.274 0.039 -4.082 391 1HG2 ILE 127 1HG2 ILE 127 1.785 -1.445 -5.351 392 2HG2 ILE 127 2HG2 ILE 127 0.376 -0.750 -6.153 393 3HG2 ILE 127 3HG2 ILE 127 1.073 0.051 -4.746 394 1HD1 ILE 127 1HD1 ILE 127 -1.764 -1.656 -6.165 395 2HD1 ILE 127 2HD1 ILE 127 -3.073 -2.035 -5.046 396 3HD1 ILE 127 3HD1 ILE 127 -2.843 -0.378 -5.602 397 H GLU 128 H GLU 128 1.798 -3.073 -6.356 398 HA GLU 128 HA GLU 128 3.451 -4.743 -4.592 399 1HB GLU 128 1HB GLU 128 3.867 -5.100 -7.497 400 2HB GLU 128 2HB GLU 128 3.947 -6.278 -6.193 401 1HG GLU 128 1HG GLU 128 1.622 -6.603 -6.198 402 2HG GLU 128 2HG GLU 128 1.342 -5.157 -7.171 403 H ALA 129 H ALA 129 5.129 -3.553 -3.992 404 HA ALA 129 HA ALA 129 5.958 -1.149 -4.998 405 1HB ALA 129 1HB ALA 129 6.707 -2.451 -2.883 406 2HB ALA 129 2HB ALA 129 7.999 -3.053 -3.922 407 3HB ALA 129 3HB ALA 129 7.826 -1.319 -3.643 408 H ASP 130 H ASP 130 6.905 -0.486 -6.809 409 HA ASP 130 HA ASP 130 8.561 -2.383 -8.325 410 1HB ASP 130 1HB ASP 130 7.580 -1.225 -10.414 411 2HB ASP 130 2HB ASP 130 6.589 -2.428 -9.590 412 H LYS 131 H LYS 131 9.217 -0.179 -6.495 413 HA LYS 131 HA LYS 131 10.751 1.480 -8.385 414 1HB LYS 131 1HB LYS 131 8.801 2.613 -7.110 415 2HB LYS 131 2HB LYS 131 9.854 2.507 -5.707 416 1HG LYS 131 1HG LYS 131 10.636 4.488 -6.353 417 2HG LYS 131 2HG LYS 131 11.504 3.595 -7.604 418 1HD LYS 131 1HD LYS 131 9.201 3.856 -8.880 419 2HD LYS 131 2HD LYS 131 9.038 5.247 -7.805 420 1HE LYS 131 1HE LYS 131 11.640 5.407 -8.761 421 2HE LYS 131 2HE LYS 131 10.692 4.904 -10.159 422 1HZ LYS 131 1HZ LYS 131 9.128 6.807 -9.350 423 2HZ LYS 131 2HZ LYS 131 10.532 7.384 -8.601 424 3HZ LYS 131 3HZ LYS 131 10.497 7.163 -10.277 425 H SER 132 H SER 132 10.928 -0.835 -6.057 426 HA SER 132 HA SER 132 12.593 -1.684 -4.763 427 1HB SER 132 1HB SER 132 14.181 -1.882 -6.379 428 2HB SER 132 2HB SER 132 13.989 -0.212 -6.914 429 HG SER 132 HG SER 132 15.604 -1.263 -4.882 430 H GLY 133 H GLY 133 13.258 -1.284 -2.734 431 1HA GLY 133 1HA GLY 133 14.654 0.528 -1.492 432 2HA GLY 133 2HA GLY 133 13.249 1.518 -1.857 433 H THR 134 H THR 134 12.932 1.823 0.399 434 HA THR 134 HA THR 134 11.548 -0.445 1.649 435 HB THR 134 HB THR 134 13.533 1.379 3.018 436 HG1 THR 134 HG1 THR 134 14.433 -0.837 3.443 437 1HG2 THR 134 1HG2 THR 134 11.379 0.377 4.263 438 2HG2 THR 134 2HG2 THR 134 12.494 -0.979 4.429 439 3HG2 THR 134 3HG2 THR 134 12.944 0.612 5.041 440 H VAL 135 H VAL 135 9.631 0.053 2.535 441 HA VAL 135 HA VAL 135 8.326 2.437 2.010 442 HB VAL 135 HB VAL 135 7.760 0.419 4.185 443 1HG1 VAL 135 1HG1 VAL 135 6.763 2.658 4.635 444 2HG1 VAL 135 2HG1 VAL 135 5.894 2.524 3.106 445 3HG1 VAL 135 3HG1 VAL 135 5.575 1.374 4.405 446 1HG2 VAL 135 1HG2 VAL 135 7.712 -0.333 1.781 447 2HG2 VAL 135 2HG2 VAL 135 6.206 -0.550 2.673 448 3HG2 VAL 135 3HG2 VAL 135 6.373 0.790 1.538 449 H LYS 136 H LYS 136 8.039 4.341 3.055 450 HA LYS 136 HA LYS 136 9.831 4.889 5.290 451 1HB LYS 136 1HB LYS 136 9.097 6.343 3.038 452 2HB LYS 136 2HB LYS 136 8.241 7.138 4.352 453 1HG LYS 136 1HG LYS 136 11.182 6.817 3.938 454 2HG LYS 136 2HG LYS 136 10.249 8.280 4.260 455 1HD LYS 136 1HD LYS 136 10.902 8.058 6.384 456 2HD LYS 136 2HD LYS 136 9.762 6.713 6.478 457 1HE LYS 136 1HE LYS 136 11.874 5.449 5.401 458 2HE LYS 136 2HE LYS 136 12.712 6.701 6.316 459 1HZ LYS 136 1HZ LYS 136 10.618 5.025 7.558 460 2HZ LYS 136 2HZ LYS 136 12.229 4.513 7.486 461 3HZ LYS 136 3HZ LYS 136 11.828 5.932 8.315 462 H ALA 137 H ALA 137 6.407 5.397 4.445 463 HA ALA 137 HA ALA 137 5.475 4.657 7.010 464 1HB ALA 137 1HB ALA 137 6.254 7.432 6.678 465 2HB ALA 137 2HB ALA 137 4.563 7.261 7.148 466 3HB ALA 137 3HB ALA 137 5.831 6.543 8.141 467 H ILE 138 H ILE 138 3.093 5.452 7.288 468 HA ILE 138 HA ILE 138 1.790 5.480 4.644 469 HB ILE 138 HB ILE 138 1.049 3.843 7.066 470 1HG1 ILE 138 1HG1 ILE 138 1.952 3.252 4.264 471 2HG1 ILE 138 2HG1 ILE 138 2.563 2.608 5.786 472 1HG2 ILE 138 1HG2 ILE 138 -0.958 4.924 6.164 473 2HG2 ILE 138 2HG2 ILE 138 -0.585 4.274 4.568 474 3HG2 ILE 138 3HG2 ILE 138 -0.977 3.182 5.896 475 1HD1 ILE 138 1HD1 ILE 138 0.262 1.486 5.987 476 2HD1 ILE 138 2HD1 ILE 138 0.109 1.838 4.265 477 3HD1 ILE 138 3HD1 ILE 138 1.430 0.823 4.844 478 H LEU 139 H LEU 139 -0.182 6.587 4.494 479 HA LEU 139 HA LEU 139 -0.773 8.363 6.771 480 1HB LEU 139 1HB LEU 139 -0.720 8.911 3.819 481 2HB LEU 139 2HB LEU 139 -1.656 9.916 4.908 482 HG LEU 139 HG LEU 139 0.370 11.061 4.634 483 1HD1 LEU 139 1HD1 LEU 139 -0.418 10.489 7.053 484 2HD1 LEU 139 2HD1 LEU 139 1.071 9.545 7.104 485 3HD1 LEU 139 3HD1 LEU 139 1.137 11.279 6.791 486 1HD2 LEU 139 1HD2 LEU 139 1.557 9.133 3.586 487 2HD2 LEU 139 2HD2 LEU 139 2.547 10.078 4.699 488 3HD2 LEU 139 3HD2 LEU 139 1.888 8.524 5.207 489 H VAL 140 H VAL 140 -2.051 6.387 4.181 490 HA VAL 140 HA VAL 140 -4.749 7.033 4.312 491 HB VAL 140 HB VAL 140 -3.414 4.399 3.703 492 1HG1 VAL 140 1HG1 VAL 140 -6.191 4.932 4.218 493 2HG1 VAL 140 2HG1 VAL 140 -5.961 4.436 2.541 494 3HG1 VAL 140 3HG1 VAL 140 -5.393 3.401 3.852 495 1HG2 VAL 140 1HG2 VAL 140 -4.651 6.520 1.950 496 2HG2 VAL 140 2HG2 VAL 140 -2.930 6.177 2.126 497 3HG2 VAL 140 3HG2 VAL 140 -3.995 4.984 1.382 498 H GLU 141 H GLU 141 -2.806 5.040 6.435 499 HA GLU 141 HA GLU 141 -3.211 4.195 8.506 500 1HB GLU 141 1HB GLU 141 -5.436 6.134 8.181 501 2HB GLU 141 2HB GLU 141 -5.627 4.916 9.434 502 1HG GLU 141 1HG GLU 141 -3.244 5.656 10.148 503 2HG GLU 141 2HG GLU 141 -3.612 7.103 9.211 504 H SER 142 H SER 142 -3.292 2.072 7.888 505 HA SER 142 HA SER 142 -5.085 0.643 6.500 506 1HB SER 142 1HB SER 142 -4.008 -1.153 7.334 507 2HB SER 142 2HB SER 142 -3.041 0.013 8.238 508 HG SER 142 HG SER 142 -4.711 -1.833 9.180 509 H GLY 143 H GLY 143 -6.887 -0.807 7.153 510 1HA GLY 143 1HA GLY 143 -8.945 -1.173 8.106 511 2HA GLY 143 2HA GLY 143 -8.332 -0.383 9.550 512 H GLN 144 H GLN 144 -7.957 1.620 6.898 513 HA GLN 144 HA GLN 144 -10.492 3.002 7.488 514 1HB GLN 144 1HB GLN 144 -8.360 4.112 8.311 515 2HB GLN 144 2HB GLN 144 -7.933 4.345 6.622 516 1HG GLN 144 1HG GLN 144 -10.533 5.337 7.730 517 2HG GLN 144 2HG GLN 144 -9.048 6.277 7.866 518 1HE2 GLN 144 2HE2 GLN 144 -7.808 6.200 5.621 519 2HE2 GLN 144 1HE2 GLN 144 -8.781 6.687 4.279 520 HA PRO 145 HA PRO 145 -11.466 2.439 3.208 521 1HB PRO 145 1HB PRO 145 -13.261 4.509 2.986 522 2HB PRO 145 2HB PRO 145 -13.648 2.928 3.671 523 1HG PRO 145 1HG PRO 145 -12.955 5.482 5.066 524 2HG PRO 145 2HG PRO 145 -14.188 4.275 5.481 525 1HD PRO 145 1HD PRO 145 -11.835 4.397 6.775 526 2HD PRO 145 2HD PRO 145 -12.643 2.849 6.452 527 H VAL 146 H VAL 146 -9.860 2.976 1.847 528 HA VAL 146 HA VAL 146 -8.558 5.474 1.759 529 HB VAL 146 HB VAL 146 -7.505 4.713 -0.278 530 1HG1 VAL 146 1HG1 VAL 146 -7.464 3.335 2.152 531 2HG1 VAL 146 2HG1 VAL 146 -7.498 2.089 0.904 532 3HG1 VAL 146 3HG1 VAL 146 -6.232 3.316 0.890 533 1HG2 VAL 146 1HG2 VAL 146 -9.757 2.730 -0.327 534 2HG2 VAL 146 2HG2 VAL 146 -9.228 3.840 -1.593 535 3HG2 VAL 146 3HG2 VAL 146 -8.246 2.431 -1.189 536 H GLU 147 H GLU 147 -8.656 7.144 0.221 537 HA GLU 147 HA GLU 147 -11.102 7.229 -1.412 538 1HB GLU 147 1HB GLU 147 -10.121 9.774 -0.234 539 2HB GLU 147 2HB GLU 147 -11.764 9.264 -0.604 540 1HG GLU 147 1HG GLU 147 -11.936 8.014 1.376 541 2HG GLU 147 2HG GLU 147 -10.198 8.076 1.661 542 H PHE 148 H PHE 148 -10.990 8.496 -3.307 543 HA PHE 148 HA PHE 148 -8.909 8.265 -4.957 544 1HB PHE 148 1HB PHE 148 -11.244 9.528 -5.191 545 2HB PHE 148 2HB PHE 148 -10.198 10.935 -5.051 546 HD1 PHE 148 HD1 PHE 148 -8.130 10.985 -6.630 547 HD2 PHE 148 HD2 PHE 148 -11.580 8.559 -7.260 548 HE1 PHE 148 HE1 PHE 148 -7.564 10.809 -9.023 549 HE2 PHE 148 HE2 PHE 148 -11.020 8.377 -9.654 550 HZ PHE 148 HZ PHE 148 -9.010 9.504 -10.537 551 H ASP 149 H ASP 149 -6.825 8.730 -4.824 552 HA ASP 149 HA ASP 149 -4.889 9.905 -4.542 553 1HB ASP 149 1HB ASP 149 -6.801 11.912 -4.928 554 2HB ASP 149 2HB ASP 149 -5.923 12.396 -3.479 555 H GLU 150 H GLU 150 -4.838 8.311 -2.721 556 HA GLU 150 HA GLU 150 -4.519 9.764 -0.192 557 1HB GLU 150 1HB GLU 150 -6.602 7.990 -0.645 558 2HB GLU 150 2HB GLU 150 -5.407 7.015 0.198 559 1HG GLU 150 1HG GLU 150 -6.942 9.376 1.142 560 2HG GLU 150 2HG GLU 150 -6.606 7.847 1.953 561 HA PRO 151 HA PRO 151 -0.440 7.952 -0.823 562 1HB PRO 151 1HB PRO 151 -0.267 8.924 1.994 563 2HB PRO 151 2HB PRO 151 0.869 9.142 0.656 564 1HG PRO 151 1HG PRO 151 -0.716 11.136 1.420 565 2HG PRO 151 2HG PRO 151 -0.376 10.853 -0.297 566 1HD PRO 151 1HD PRO 151 -2.841 10.258 1.271 567 2HD PRO 151 2HD PRO 151 -2.672 10.758 -0.423 568 H LEU 152 H LEU 152 -1.295 5.787 -0.831 569 HA LEU 152 HA LEU 152 -2.109 4.381 1.450 570 1HB LEU 152 1HB LEU 152 -0.747 3.287 -1.012 571 2HB LEU 152 2HB LEU 152 -1.673 2.355 0.152 572 HG LEU 152 HG LEU 152 -3.099 4.611 -1.123 573 1HD1 LEU 152 1HD1 LEU 152 -2.143 2.202 -2.637 574 2HD1 LEU 152 2HD1 LEU 152 -3.603 3.078 -3.093 575 3HD1 LEU 152 3HD1 LEU 152 -2.043 3.902 -3.094 576 1HD2 LEU 152 1HD2 LEU 152 -3.889 2.705 0.523 577 2HD2 LEU 152 2HD2 LEU 152 -4.946 3.323 -0.747 578 3HD2 LEU 152 3HD2 LEU 152 -4.075 1.807 -0.983 579 H VAL 153 H VAL 153 1.080 4.475 -0.136 580 HA VAL 153 HA VAL 153 2.397 4.172 2.414 581 HB VAL 153 HB VAL 153 3.222 2.119 0.419 582 1HG1 VAL 153 1HG1 VAL 153 3.817 2.811 3.117 583 2HG1 VAL 153 2HG1 VAL 153 3.149 1.179 3.086 584 3HG1 VAL 153 3HG1 VAL 153 4.559 1.573 2.103 585 1HG2 VAL 153 1HG2 VAL 153 0.805 1.815 0.536 586 2HG2 VAL 153 2HG2 VAL 153 1.644 0.491 1.344 587 3HG2 VAL 153 3HG2 VAL 153 0.887 1.768 2.297 588 H VAL 154 H VAL 154 3.949 5.647 2.310 589 HA VAL 154 HA VAL 154 5.079 6.425 -0.247 590 HB VAL 154 HB VAL 154 6.034 8.281 0.844 591 1HG1 VAL 154 1HG1 VAL 154 3.570 8.334 0.654 592 2HG1 VAL 154 2HG1 VAL 154 3.456 7.735 2.309 593 3HG1 VAL 154 3HG1 VAL 154 4.179 9.312 1.989 594 1HG2 VAL 154 1HG2 VAL 154 5.565 6.817 3.439 595 2HG2 VAL 154 2HG2 VAL 154 7.120 7.179 2.688 596 3HG2 VAL 154 3HG2 VAL 154 6.118 8.487 3.317 597 H ILE 155 H ILE 155 6.938 5.696 -1.037 598 HA ILE 155 HA ILE 155 8.703 4.157 0.742 599 HB ILE 155 HB ILE 155 8.710 4.094 -2.271 600 1HG1 ILE 155 1HG1 ILE 155 7.609 1.705 -1.315 601 2HG1 ILE 155 2HG1 ILE 155 6.791 2.974 -0.409 602 1HG2 ILE 155 1HG2 ILE 155 10.266 2.838 -0.166 603 2HG2 ILE 155 2HG2 ILE 155 9.565 1.666 -1.282 604 3HG2 ILE 155 3HG2 ILE 155 10.592 2.961 -1.896 605 1HD1 ILE 155 1HD1 ILE 155 6.702 3.960 -2.941 606 2HD1 ILE 155 2HD1 ILE 155 6.569 2.224 -3.221 607 3HD1 ILE 155 3HD1 ILE 155 5.416 3.039 -2.163 608 H GLU 156 H GLU 156 10.838 4.642 0.939 609 HA GLU 156 HA GLU 156 11.795 7.025 -0.506 610 1HB GLU 156 1HB GLU 156 11.502 7.648 1.776 611 2HB GLU 156 2HB GLU 156 12.270 6.173 2.347 612 1HG GLU 156 1HG GLU 156 14.389 6.929 1.872 613 2HG GLU 156 2HG GLU 156 13.823 8.079 0.662 614 1H10 BTN 222 1H10 BTN 122 -10.355 -13.134 0.877 615 2H10 BTN 222 2H10 BTN 122 -11.182 -13.386 2.412 616 1H9 BTN 222 1H9 BTN 122 -9.405 -12.132 3.114 617 2H9 BTN 222 2H9 BTN 122 -10.581 -10.856 2.787 618 1H8 BTN 222 1H8 BTN 122 -9.549 -10.254 0.779 619 2H8 BTN 222 2H8 BTN 122 -8.664 -11.776 0.673 620 1H7 BTN 222 1H7 BTN 122 -6.935 -10.662 1.509 621 2H7 BTN 222 2H7 BTN 122 -7.781 -10.737 3.046 622 H2 BTN 222 H2 BTN 122 -8.124 -8.470 1.079 623 1H6 BTN 222 1H6 BTN 122 -6.822 -5.911 3.878 624 2H6 BTN 222 2H6 BTN 122 -7.540 -5.858 2.275 625 H5 BTN 222 H5 BTN 122 -9.438 -6.309 3.571 626 HN1 BTN 222 HN2 BTN 122 -8.281 -6.779 5.799 627 HN2 BTN 222 HN1 BTN 122 -9.227 -10.226 4.056 628 H4 BTN 222 H4 BTN 122 -9.957 -8.307 2.532 Start of MODEL 16 1 1H GLU 77 H GLU 77 18.732 16.901 -1.034 2 HA GLU 77 HA GLU 77 16.505 16.634 -1.507 3 1HB GLU 77 1HB GLU 77 17.174 18.353 -3.433 4 2HB GLU 77 2HB GLU 77 16.874 16.944 -4.444 5 1HG GLU 77 1HG GLU 77 14.653 16.820 -3.050 6 2HG GLU 77 2HG GLU 77 14.984 18.533 -2.790 7 H ILE 78 H ILE 78 15.822 14.615 -1.303 8 HA ILE 78 HA ILE 78 17.089 12.447 -2.711 9 HB ILE 78 HB ILE 78 15.384 11.052 -1.475 10 1HG1 ILE 78 1HG1 ILE 78 14.825 13.233 0.405 11 2HG1 ILE 78 2HG1 ILE 78 14.065 13.443 -1.170 12 1HG2 ILE 78 1HG2 ILE 78 17.698 11.502 -0.684 13 2HG2 ILE 78 2HG2 ILE 78 17.065 12.849 0.262 14 3HG2 ILE 78 3HG2 ILE 78 16.547 11.200 0.617 15 1HD1 ILE 78 1HD1 ILE 78 13.826 10.853 0.299 16 2HD1 ILE 78 2HD1 ILE 78 12.781 12.219 0.691 17 3HD1 ILE 78 3HD1 ILE 78 12.771 11.541 -0.937 18 H SER 79 H SER 79 15.343 10.648 -3.413 19 HA SER 79 HA SER 79 13.565 11.984 -5.338 20 1HB SER 79 1HB SER 79 13.897 9.546 -6.447 21 2HB SER 79 2HB SER 79 14.942 10.920 -6.807 22 HG SER 79 HG SER 79 16.281 9.264 -6.253 23 H GLY 80 H GLY 80 13.876 9.543 -2.925 24 1HA GLY 80 1HA GLY 80 12.370 7.925 -2.162 25 2HA GLY 80 2HA GLY 80 11.411 9.381 -1.948 26 H HIS 81 H HIS 81 9.510 8.149 -2.243 27 HA HIS 81 HA HIS 81 8.447 8.209 -4.820 28 1HB HIS 81 1HB HIS 81 9.762 6.383 -5.495 29 2HB HIS 81 2HB HIS 81 9.565 5.552 -3.960 30 HD1 HIS 81 HD1 HIS 81 6.702 5.090 -3.600 31 HD2 HIS 81 HD2 HIS 81 8.421 5.058 -7.376 32 HE1 HIS 81 HE1 HIS 81 5.111 3.794 -5.048 33 HE2 HIS 81 HE2 HIS 81 6.128 3.862 -7.351 34 H ILE 82 H ILE 82 6.630 9.032 -3.888 35 HA ILE 82 HA ILE 82 5.344 7.595 -1.710 36 HB ILE 82 HB ILE 82 4.503 10.141 -3.099 37 1HG1 ILE 82 1HG1 ILE 82 6.249 9.552 -0.745 38 2HG1 ILE 82 2HG1 ILE 82 6.437 10.773 -1.999 39 1HG2 ILE 82 1HG2 ILE 82 2.798 8.612 -1.830 40 2HG2 ILE 82 2HG2 ILE 82 3.552 9.315 -0.398 41 3HG2 ILE 82 3HG2 ILE 82 2.783 10.360 -1.593 42 1HD1 ILE 82 1HD1 ILE 82 4.467 11.955 -0.960 43 2HD1 ILE 82 2HD1 ILE 82 4.628 10.836 0.393 44 3HD1 ILE 82 3HD1 ILE 82 5.953 11.928 -0.010 45 H VAL 83 H VAL 83 3.470 6.468 -1.845 46 HA VAL 83 HA VAL 83 2.385 6.045 -4.548 47 HB VAL 83 HB VAL 83 1.872 4.189 -2.249 48 1HG1 VAL 83 1HG1 VAL 83 1.828 4.005 -5.242 49 2HG1 VAL 83 2HG1 VAL 83 1.899 2.561 -4.233 50 3HG1 VAL 83 3HG1 VAL 83 0.534 3.669 -4.091 51 1HG2 VAL 83 1HG2 VAL 83 4.441 4.741 -3.418 52 2HG2 VAL 83 2HG2 VAL 83 4.023 3.650 -2.097 53 3HG2 VAL 83 3HG2 VAL 83 3.948 3.084 -3.765 54 H ARG 84 H ARG 84 0.489 6.949 -4.947 55 HA ARG 84 HA ARG 84 -1.300 7.553 -2.696 56 1HB ARG 84 1HB ARG 84 -0.959 8.773 -5.423 57 2HB ARG 84 2HB ARG 84 -2.422 9.039 -4.486 58 1HG ARG 84 1HG ARG 84 -1.416 10.464 -3.079 59 2HG ARG 84 2HG ARG 84 0.074 9.519 -3.024 60 1HD ARG 84 1HD ARG 84 -0.793 11.425 -5.194 61 2HD ARG 84 2HD ARG 84 0.525 11.654 -4.045 62 HE ARG 84 HE ARG 84 0.898 9.285 -5.560 63 1HH1 ARG 84 1HH1 ARG 84 1.125 12.754 -5.756 64 2HH1 ARG 84 2HH1 ARG 84 2.352 12.735 -6.978 65 1HH2 ARG 84 1HH2 ARG 84 2.514 9.248 -7.171 66 2HH2 ARG 84 2HH2 ARG 84 3.141 10.741 -7.783 67 H SER 85 H SER 85 -3.071 6.373 -2.442 68 HA SER 85 HA SER 85 -3.786 4.162 -3.864 69 1HB SER 85 1HB SER 85 -4.788 5.377 -1.665 70 2HB SER 85 2HB SER 85 -6.079 5.716 -2.816 71 HG SER 85 HG SER 85 -5.612 3.254 -3.247 72 HA PRO 86 HA PRO 86 -4.848 6.161 -7.794 73 1HB PRO 86 1HB PRO 86 -5.339 3.303 -8.445 74 2HB PRO 86 2HB PRO 86 -4.388 4.508 -9.318 75 1HG PRO 86 1HG PRO 86 -3.191 2.587 -7.912 76 2HG PRO 86 2HG PRO 86 -2.538 4.237 -7.948 77 1HD PRO 86 1HD PRO 86 -4.093 2.859 -5.799 78 2HD PRO 86 2HD PRO 86 -2.733 3.993 -5.658 79 H MET 87 H MET 87 -6.663 3.348 -6.550 80 HA MET 87 HA MET 87 -9.149 4.777 -7.234 81 1HB MET 87 1HB MET 87 -8.842 2.834 -8.676 82 2HB MET 87 2HB MET 87 -8.622 1.800 -7.271 83 1HG MET 87 1HG MET 87 -10.934 2.340 -6.570 84 2HG MET 87 2HG MET 87 -11.136 3.250 -8.066 85 1HE MET 87 1HE MET 87 -10.679 2.459 -10.208 86 2HE MET 87 2HE MET 87 -10.053 0.857 -10.597 87 3HE MET 87 3HE MET 87 -11.783 1.181 -10.719 88 H VAL 88 H VAL 88 -11.026 4.191 -5.890 89 HA VAL 88 HA VAL 88 -10.361 4.342 -3.119 90 HB VAL 88 HB VAL 88 -13.000 4.086 -4.553 91 1HG1 VAL 88 1HG1 VAL 88 -13.125 3.008 -2.335 92 2HG1 VAL 88 2HG1 VAL 88 -12.573 4.511 -1.599 93 3HG1 VAL 88 3HG1 VAL 88 -14.119 4.459 -2.445 94 1HG2 VAL 88 1HG2 VAL 88 -11.404 6.228 -4.398 95 2HG2 VAL 88 2HG2 VAL 88 -13.164 6.342 -4.419 96 3HG2 VAL 88 3HG2 VAL 88 -12.293 6.424 -2.888 97 H GLY 89 H GLY 89 -11.081 2.882 -1.454 98 1HA GLY 89 1HA GLY 89 -12.188 0.368 -1.820 99 2HA GLY 89 2HA GLY 89 -10.455 0.171 -2.030 100 H THR 90 H THR 90 -9.486 -0.526 -0.258 101 HA THR 90 HA THR 90 -9.879 0.783 2.267 102 HB THR 90 HB THR 90 -10.557 -2.156 2.143 103 HG1 THR 90 HG1 THR 90 -12.420 -0.068 2.506 104 1HG2 THR 90 1HG2 THR 90 -9.830 -0.691 4.304 105 2HG2 THR 90 2HG2 THR 90 -11.583 -0.500 4.321 106 3HG2 THR 90 3HG2 THR 90 -10.872 -2.113 4.352 107 H PHE 91 H PHE 91 -7.774 1.118 2.640 108 HA PHE 91 HA PHE 91 -5.681 -0.582 1.848 109 1HB PHE 91 1HB PHE 91 -5.113 1.674 2.256 110 2HB PHE 91 2HB PHE 91 -5.853 1.657 3.856 111 HD1 PHE 91 HD1 PHE 91 -3.146 -0.081 1.957 112 HD2 PHE 91 HD2 PHE 91 -4.465 1.524 5.681 113 HE1 PHE 91 HE1 PHE 91 -0.956 -0.612 2.957 114 HE2 PHE 91 HE2 PHE 91 -2.278 0.995 6.687 115 HZ PHE 91 HZ PHE 91 -0.523 -0.073 5.325 116 H TYR 92 H TYR 92 -4.211 -1.804 3.209 117 HA TYR 92 HA TYR 92 -5.031 -2.588 5.841 118 1HB TYR 92 1HB TYR 92 -5.710 -4.249 3.496 119 2HB TYR 92 2HB TYR 92 -5.015 -5.103 4.870 120 HD1 TYR 92 HD1 TYR 92 -6.111 -4.094 7.218 121 HD2 TYR 92 HD2 TYR 92 -8.004 -4.356 3.407 122 HE1 TYR 92 HE1 TYR 92 -8.314 -4.107 8.320 123 HE2 TYR 92 HE2 TYR 92 -10.213 -4.370 4.498 124 HH TYR 92 HH TYR 92 -11.103 -5.047 6.848 125 H ARG 93 H ARG 93 -3.612 -4.431 6.655 126 HA ARG 93 HA ARG 93 -0.980 -4.407 5.348 127 1HB ARG 93 1HB ARG 93 -1.037 -4.398 8.318 128 2HB ARG 93 2HB ARG 93 0.146 -3.710 7.213 129 1HG ARG 93 1HG ARG 93 -2.132 -2.202 6.770 130 2HG ARG 93 2HG ARG 93 -2.116 -2.462 8.516 131 1HD ARG 93 1HD ARG 93 0.434 -1.692 7.204 132 2HD ARG 93 2HD ARG 93 -0.810 -0.452 7.365 133 HE ARG 93 HE ARG 93 -0.474 -1.755 9.835 134 1HH1 ARG 93 1HH1 ARG 93 1.194 0.428 7.695 135 2HH1 ARG 93 2HH1 ARG 93 2.082 1.202 8.966 136 1HH2 ARG 93 1HH2 ARG 93 0.689 -0.743 11.516 137 2HH2 ARG 93 2HH2 ARG 93 1.794 0.536 11.138 138 H THR 94 H THR 94 -3.168 -5.949 7.641 139 HA THR 94 HA THR 94 -1.724 -8.480 7.214 140 HB THR 94 HB THR 94 -2.917 -9.072 9.473 141 HG1 THR 94 HG1 THR 94 -2.577 -6.339 9.970 142 1HG2 THR 94 1HG2 THR 94 -0.554 -7.215 9.383 143 2HG2 THR 94 2HG2 THR 94 -1.048 -8.176 10.777 144 3HG2 THR 94 3HG2 THR 94 -0.516 -8.978 9.300 145 HA PRO 95 HA PRO 95 -5.824 -9.108 5.264 146 1HB PRO 95 1HB PRO 95 -4.928 -11.105 3.630 147 2HB PRO 95 2HB PRO 95 -4.833 -9.390 3.222 148 1HG PRO 95 1HG PRO 95 -2.716 -11.198 4.318 149 2HG PRO 95 2HG PRO 95 -2.585 -9.950 3.064 150 1HD PRO 95 1HD PRO 95 -1.768 -9.530 5.603 151 2HD PRO 95 2HD PRO 95 -2.460 -8.235 4.605 152 H SER 96 H SER 96 -7.183 -10.218 6.513 153 HA SER 96 HA SER 96 -6.800 -12.081 8.379 154 1HB SER 96 1HB SER 96 -9.077 -13.125 7.367 155 2HB SER 96 2HB SER 96 -9.028 -11.612 8.275 156 HG SER 96 HG SER 96 -10.134 -11.253 6.371 157 HA PRO 97 HA PRO 97 -7.067 -15.825 5.252 158 1HB PRO 97 1HB PRO 97 -6.440 -15.104 2.658 159 2HB PRO 97 2HB PRO 97 -8.078 -15.354 3.269 160 1HG PRO 97 1HG PRO 97 -6.566 -12.807 2.881 161 2HG PRO 97 2HG PRO 97 -8.278 -13.155 2.575 162 1HD PRO 97 1HD PRO 97 -7.485 -11.804 4.753 163 2HD PRO 97 2HD PRO 97 -8.850 -12.940 4.811 164 H ASP 98 H ASP 98 -5.059 -15.469 6.726 165 HA ASP 98 HA ASP 98 -2.877 -16.151 6.929 166 1HB ASP 98 1HB ASP 98 -3.409 -16.997 4.413 167 2HB ASP 98 2HB ASP 98 -2.167 -15.793 4.080 168 H ALA 99 H ALA 99 -3.567 -13.581 7.458 169 HA ALA 99 HA ALA 99 -2.242 -11.551 6.098 170 1HB ALA 99 1HB ALA 99 -3.022 -11.861 8.980 171 2HB ALA 99 2HB ALA 99 -2.224 -10.407 8.381 172 3HB ALA 99 3HB ALA 99 -3.790 -10.886 7.728 173 H LYS 100 H LYS 100 -0.184 -12.096 5.442 174 HA LYS 100 HA LYS 100 1.779 -12.896 7.442 175 1HB LYS 100 1HB LYS 100 3.273 -13.286 5.584 176 2HB LYS 100 2HB LYS 100 1.718 -14.026 5.235 177 1HG LYS 100 1HG LYS 100 1.690 -11.374 4.218 178 2HG LYS 100 2HG LYS 100 3.173 -12.167 3.683 179 1HD LYS 100 1HD LYS 100 1.772 -14.096 2.928 180 2HD LYS 100 2HD LYS 100 0.342 -13.131 3.300 181 1HE LYS 100 1HE LYS 100 1.193 -11.392 1.734 182 2HE LYS 100 2HE LYS 100 2.496 -12.492 1.289 183 1HZ LYS 100 1HZ LYS 100 0.233 -13.987 1.006 184 2HZ LYS 100 2HZ LYS 100 -0.231 -12.466 0.429 185 3HZ LYS 100 3HZ LYS 100 1.104 -13.255 -0.247 186 H ALA 101 H ALA 101 0.615 -10.226 7.523 187 HA ALA 101 HA ALA 101 1.226 -8.051 7.796 188 1HB ALA 101 1HB ALA 101 2.908 -9.386 9.246 189 2HB ALA 101 2HB ALA 101 4.079 -8.925 8.011 190 3HB ALA 101 3HB ALA 101 3.219 -7.681 8.918 191 H PHE 102 H PHE 102 0.736 -7.338 5.711 192 HA PHE 102 HA PHE 102 2.240 -7.604 3.416 193 1HB PHE 102 1HB PHE 102 0.238 -5.652 4.396 194 2HB PHE 102 2HB PHE 102 1.234 -5.125 3.043 195 HD1 PHE 102 HD1 PHE 102 1.547 -7.226 1.267 196 HD2 PHE 102 HD2 PHE 102 -1.813 -6.444 3.773 197 HE1 PHE 102 HE1 PHE 102 0.103 -8.483 -0.285 198 HE2 PHE 102 HE2 PHE 102 -3.264 -7.700 2.226 199 HZ PHE 102 HZ PHE 102 -2.306 -8.721 0.194 200 H ILE 103 H ILE 103 2.993 -5.182 2.424 201 HA ILE 103 HA ILE 103 5.586 -4.867 3.488 202 HB ILE 103 HB ILE 103 4.277 -2.764 1.795 203 1HG1 ILE 103 1HG1 ILE 103 3.588 -4.618 0.570 204 2HG1 ILE 103 2HG1 ILE 103 5.159 -4.270 -0.145 205 1HG2 ILE 103 1HG2 ILE 103 7.060 -3.854 2.101 206 2HG2 ILE 103 2HG2 ILE 103 6.586 -2.824 0.750 207 3HG2 ILE 103 3HG2 ILE 103 6.486 -2.215 2.402 208 1HD1 ILE 103 1HD1 ILE 103 5.804 -5.995 1.874 209 2HD1 ILE 103 2HD1 ILE 103 4.245 -6.609 1.324 210 3HD1 ILE 103 3HD1 ILE 103 5.575 -6.431 0.180 211 H GLU 104 H GLU 104 4.834 -4.531 5.764 212 HA GLU 104 HA GLU 104 3.553 -2.193 6.615 213 1HB GLU 104 1HB GLU 104 4.915 -4.414 7.823 214 2HB GLU 104 2HB GLU 104 5.399 -2.919 8.618 215 1HG GLU 104 1HG GLU 104 2.929 -2.395 8.815 216 2HG GLU 104 2HG GLU 104 2.640 -4.067 8.335 217 H VAL 105 H VAL 105 4.725 -0.580 8.126 218 HA VAL 105 HA VAL 105 6.465 0.973 6.536 219 HB VAL 105 HB VAL 105 5.825 1.188 9.480 220 1HG1 VAL 105 1HG1 VAL 105 7.478 2.885 7.664 221 2HG1 VAL 105 2HG1 VAL 105 6.559 3.638 8.966 222 3HG1 VAL 105 3HG1 VAL 105 7.771 2.412 9.337 223 1HG2 VAL 105 1HG2 VAL 105 4.616 2.329 6.992 224 2HG2 VAL 105 2HG2 VAL 105 3.825 1.574 8.376 225 3HG2 VAL 105 3HG2 VAL 105 4.496 3.198 8.522 226 H GLY 106 H GLY 106 8.648 1.575 6.919 227 1HA GLY 106 1HA GLY 106 10.854 1.199 7.433 228 2HA GLY 106 2HA GLY 106 10.291 0.369 8.875 229 H GLN 107 H GLN 107 8.903 -1.005 6.155 230 HA GLN 107 HA GLN 107 10.652 -3.313 6.383 231 1HB GLN 107 1HB GLN 107 8.273 -3.741 6.383 232 2HB GLN 107 2HB GLN 107 8.076 -2.874 4.866 233 1HG GLN 107 1HG GLN 107 9.284 -4.561 3.672 234 2HG GLN 107 2HG GLN 107 9.705 -5.383 5.174 235 1HE2 GLN 107 2HE2 GLN 107 8.369 -6.523 2.935 236 2HE2 GLN 107 1HE2 GLN 107 6.804 -7.027 3.464 237 H LYS 108 H LYS 108 11.237 -4.478 4.307 238 HA LYS 108 HA LYS 108 12.373 -2.516 2.446 239 1HB LYS 108 1HB LYS 108 13.666 -4.696 1.725 240 2HB LYS 108 2HB LYS 108 14.152 -3.791 3.152 241 1HG LYS 108 1HG LYS 108 12.204 -6.035 3.414 242 2HG LYS 108 2HG LYS 108 13.929 -6.374 3.261 243 1HD LYS 108 1HD LYS 108 13.825 -4.357 5.148 244 2HD LYS 108 2HD LYS 108 12.422 -5.357 5.532 245 1HE LYS 108 1HE LYS 108 13.716 -6.933 6.415 246 2HE LYS 108 2HE LYS 108 14.694 -7.015 4.951 247 1HZ LYS 108 1HZ LYS 108 15.797 -4.913 5.870 248 2HZ LYS 108 2HZ LYS 108 15.103 -5.348 7.350 249 3HZ LYS 108 3HZ LYS 108 16.192 -6.394 6.586 250 H VAL 109 H VAL 109 11.966 -2.556 0.288 251 HA VAL 109 HA VAL 109 10.695 -4.748 -1.030 252 HB VAL 109 HB VAL 109 8.753 -2.962 -1.678 253 1HG1 VAL 109 1HG1 VAL 109 8.722 -5.432 -0.889 254 2HG1 VAL 109 2HG1 VAL 109 8.354 -4.741 0.692 255 3HG1 VAL 109 3HG1 VAL 109 7.281 -4.437 -0.675 256 1HG2 VAL 109 1HG2 VAL 109 9.783 -1.598 0.323 257 2HG2 VAL 109 2HG2 VAL 109 8.037 -1.670 0.074 258 3HG2 VAL 109 3HG2 VAL 109 8.799 -2.699 1.288 259 H ASN 110 H ASN 110 9.872 -3.929 -3.293 260 HA ASN 110 HA ASN 110 11.053 -1.585 -4.369 261 1HB ASN 110 1HB ASN 110 12.825 -3.747 -4.077 262 2HB ASN 110 2HB ASN 110 12.402 -3.703 -5.785 263 1HD2 ASN 110 1HD2 ASN 110 13.401 -2.286 -7.045 264 2HD2 ASN 110 2HD2 ASN 110 14.393 -0.982 -6.496 265 H VAL 111 H VAL 111 11.503 -2.613 -7.003 266 HA VAL 111 HA VAL 111 8.866 -2.552 -8.005 267 HB VAL 111 HB VAL 111 11.269 -3.562 -9.518 268 1HG1 VAL 111 1HG1 VAL 111 8.588 -3.199 -10.226 269 2HG1 VAL 111 2HG1 VAL 111 9.460 -1.850 -10.954 270 3HG1 VAL 111 3HG1 VAL 111 9.951 -3.507 -11.304 271 1HG2 VAL 111 1HG2 VAL 111 11.281 -1.195 -8.197 272 2HG2 VAL 111 2HG2 VAL 111 12.160 -1.504 -9.695 273 3HG2 VAL 111 3HG2 VAL 111 10.583 -0.714 -9.743 274 H GLY 112 H GLY 112 7.452 -4.123 -8.520 275 1HA GLY 112 1HA GLY 112 6.621 -6.237 -8.961 276 2HA GLY 112 2HA GLY 112 8.271 -6.840 -8.983 277 H ASP 113 H ASP 113 7.539 -5.058 -6.192 278 HA ASP 113 HA ASP 113 7.347 -7.550 -4.655 279 1HB ASP 113 1HB ASP 113 8.774 -5.082 -4.283 280 2HB ASP 113 2HB ASP 113 7.724 -5.381 -2.901 281 H THR 114 H THR 114 5.375 -8.125 -4.053 282 HA THR 114 HA THR 114 3.010 -6.928 -4.296 283 HB THR 114 HB THR 114 3.219 -8.133 -1.629 284 HG1 THR 114 HG1 THR 114 3.896 -10.128 -2.352 285 1HG2 THR 114 1HG2 THR 114 1.264 -7.950 -3.501 286 2HG2 THR 114 2HG2 THR 114 1.854 -9.592 -3.760 287 3HG2 THR 114 3HG2 THR 114 1.283 -9.101 -2.165 288 H LEU 115 H LEU 115 1.589 -5.657 -3.018 289 HA LEU 115 HA LEU 115 2.981 -3.834 -1.168 290 1HB LEU 115 1HB LEU 115 2.218 -2.870 -3.373 291 2HB LEU 115 2HB LEU 115 0.571 -3.172 -2.854 292 HG LEU 115 HG LEU 115 1.557 -1.747 -0.738 293 1HD1 LEU 115 1HD1 LEU 115 3.011 -0.945 -3.218 294 2HD1 LEU 115 2HD1 LEU 115 2.548 0.281 -2.038 295 3HD1 LEU 115 3HD1 LEU 115 3.594 -1.056 -1.557 296 1HD2 LEU 115 1HD2 LEU 115 0.056 -0.947 -3.209 297 2HD2 LEU 115 2HD2 LEU 115 -0.561 -1.247 -1.584 298 3HD2 LEU 115 3HD2 LEU 115 0.382 0.206 -1.915 299 H CYS 116 H CYS 116 -0.435 -4.469 -1.944 300 HA CYS 116 HA CYS 116 -1.126 -5.840 0.373 301 1HB CYS 116 1HB CYS 116 -1.889 -4.244 1.905 302 2HB CYS 116 2HB CYS 116 -0.363 -3.570 1.344 303 HG CYS 116 HG CYS 116 -1.576 -1.716 0.178 304 H ILE 117 H ILE 117 -3.445 -6.048 0.662 305 HA ILE 117 HA ILE 117 -4.834 -5.950 -1.838 306 HB ILE 117 HB ILE 117 -5.701 -6.785 0.924 307 1HG1 ILE 117 1HG1 ILE 117 -5.806 -8.727 -1.251 308 2HG1 ILE 117 2HG1 ILE 117 -4.187 -8.077 -1.007 309 1HG2 ILE 117 1HG2 ILE 117 -7.280 -6.753 -1.638 310 2HG2 ILE 117 2HG2 ILE 117 -7.724 -7.719 -0.230 311 3HG2 ILE 117 3HG2 ILE 117 -7.676 -5.959 -0.113 312 1HD1 ILE 117 1HD1 ILE 117 -5.151 -8.653 1.546 313 2HD1 ILE 117 2HD1 ILE 117 -5.628 -10.017 0.535 314 3HD1 ILE 117 3HD1 ILE 117 -3.933 -9.539 0.631 315 H VAL 118 H VAL 118 -6.611 -4.739 -2.421 316 HA VAL 118 HA VAL 118 -6.957 -2.240 -0.932 317 HB VAL 118 HB VAL 118 -8.060 -2.906 -3.662 318 1HG1 VAL 118 1HG1 VAL 118 -7.925 -0.473 -1.963 319 2HG1 VAL 118 2HG1 VAL 118 -7.768 -0.277 -3.708 320 3HG1 VAL 118 3HG1 VAL 118 -9.208 -1.038 -3.033 321 1HG2 VAL 118 1HG2 VAL 118 -5.394 -2.806 -3.096 322 2HG2 VAL 118 2HG2 VAL 118 -6.111 -2.426 -4.663 323 3HG2 VAL 118 3HG2 VAL 118 -5.734 -1.130 -3.527 324 H GLU 119 H GLU 119 -8.571 -5.170 -1.768 325 HA GLU 119 HA GLU 119 -10.775 -5.839 -1.599 326 1HB GLU 119 1HB GLU 119 -9.891 -6.338 0.578 327 2HB GLU 119 2HB GLU 119 -10.102 -4.674 1.104 328 1HG GLU 119 1HG GLU 119 -12.632 -5.552 0.279 329 2HG GLU 119 2HG GLU 119 -11.936 -6.868 1.223 330 H ALA 120 H ALA 120 -11.037 -3.714 -3.085 331 HA ALA 120 HA ALA 120 -12.515 -1.565 -1.943 332 1HB ALA 120 1HB ALA 120 -11.187 -1.771 -4.219 333 2HB ALA 120 2HB ALA 120 -12.781 -2.213 -4.833 334 3HB ALA 120 3HB ALA 120 -12.543 -0.657 -4.039 335 H MET 121 H MET 121 -13.326 -4.741 -2.847 336 HA MET 121 HA MET 121 -15.911 -4.678 -1.868 337 1HB MET 121 1HB MET 121 -17.298 -4.693 -3.867 338 2HB MET 121 2HB MET 121 -16.399 -3.185 -3.769 339 1HG MET 121 1HG MET 121 -14.694 -4.538 -5.276 340 2HG MET 121 2HG MET 121 -16.160 -5.421 -5.697 341 1HE MET 121 1HE MET 121 -14.614 -4.065 -7.982 342 2HE MET 121 2HE MET 121 -16.199 -4.805 -8.209 343 3HE MET 121 3HE MET 121 -15.884 -3.185 -8.832 344 H LYS 122 H LYS 122 -13.946 -6.452 -1.558 345 HA LYS 122 HA LYS 122 -13.551 -8.691 -1.516 346 1HB LYS 122 1HB LYS 122 -16.290 -8.567 -2.667 347 2HB LYS 122 2HB LYS 122 -15.412 -10.080 -2.844 348 1HG LYS 122 1HG LYS 122 -16.247 -8.690 -0.321 349 2HG LYS 122 2HG LYS 122 -16.666 -10.311 -0.880 350 1HD LYS 122 1HD LYS 122 -15.048 -10.909 0.589 351 2HD LYS 122 2HD LYS 122 -13.997 -10.551 -0.782 352 1HE LYS 122 1HE LYS 122 -12.938 -9.270 0.754 353 2HE LYS 122 2HE LYS 122 -14.168 -8.102 0.278 354 H MET 123 H MET 123 -12.465 -7.004 -3.560 355 HA MET 123 HA MET 123 -12.302 -8.817 -5.866 356 1HB MET 123 1HB MET 123 -12.846 -6.674 -6.645 357 2HB MET 123 2HB MET 123 -11.765 -5.883 -5.507 358 1HG MET 123 1HG MET 123 -9.871 -7.004 -6.802 359 2HG MET 123 2HG MET 123 -11.083 -7.329 -8.040 360 1HE MET 123 1HE MET 123 -10.047 -4.736 -5.581 361 2HE MET 123 2HE MET 123 -9.621 -3.307 -6.523 362 3HE MET 123 3HE MET 123 -11.306 -3.613 -6.098 363 H MET 124 H MET 124 -10.591 -7.720 -3.131 364 HA MET 124 HA MET 124 -8.473 -8.011 -2.366 365 1HB MET 124 1HB MET 124 -8.086 -10.324 -4.210 366 2HB MET 124 2HB MET 124 -7.672 -10.168 -2.508 367 1HG MET 124 1HG MET 124 -10.536 -10.220 -3.340 368 2HG MET 124 2HG MET 124 -9.617 -11.721 -3.245 369 1HE MET 124 1HE MET 124 -12.112 -10.215 -1.962 370 2HE MET 124 2HE MET 124 -12.201 -10.741 -0.280 371 3HE MET 124 3HE MET 124 -11.632 -9.118 -0.667 372 H ASN 125 H ASN 125 -8.616 -6.130 -4.385 373 HA ASN 125 HA ASN 125 -6.697 -6.589 -6.440 374 1HB ASN 125 1HB ASN 125 -8.255 -4.906 -6.939 375 2HB ASN 125 2HB ASN 125 -8.069 -4.136 -5.365 376 1HD2 ASN 125 2HD2 ASN 125 -7.865 -2.217 -6.753 377 2HD2 ASN 125 1HD2 ASN 125 -6.300 -1.807 -7.360 378 H GLN 126 H GLN 126 -5.030 -7.498 -4.997 379 HA GLN 126 HA GLN 126 -3.639 -5.709 -3.228 380 1HB GLN 126 1HB GLN 126 -2.195 -7.543 -2.754 381 2HB GLN 126 2HB GLN 126 -3.826 -8.190 -2.881 382 1HG GLN 126 1HG GLN 126 -3.299 -8.844 -5.231 383 2HG GLN 126 2HG GLN 126 -1.630 -8.361 -4.929 384 1HE2 GLN 126 2HE2 GLN 126 -3.903 -10.836 -4.712 385 2HE2 GLN 126 1HE2 GLN 126 -2.969 -11.956 -3.786 386 H ILE 127 H ILE 127 -2.411 -4.133 -3.980 387 HA ILE 127 HA ILE 127 -1.276 -4.167 -6.608 388 HB ILE 127 HB ILE 127 -0.628 -2.240 -4.381 389 1HG1 ILE 127 1HG1 ILE 127 -3.085 -2.437 -4.756 390 2HG1 ILE 127 2HG1 ILE 127 -2.445 -0.847 -5.161 391 1HG2 ILE 127 1HG2 ILE 127 -0.067 -2.384 -7.270 392 2HG2 ILE 127 2HG2 ILE 127 -0.551 -0.806 -6.652 393 3HG2 ILE 127 3HG2 ILE 127 0.851 -1.629 -5.969 394 1HD1 ILE 127 1HD1 ILE 127 -3.040 -3.026 -7.149 395 2HD1 ILE 127 2HD1 ILE 127 -4.092 -1.657 -6.787 396 3HD1 ILE 127 3HD1 ILE 127 -2.508 -1.385 -7.512 397 H GLU 128 H GLU 128 0.994 -3.955 -7.094 398 HA GLU 128 HA GLU 128 2.751 -5.174 -5.069 399 1HB GLU 128 1HB GLU 128 3.706 -6.623 -6.614 400 2HB GLU 128 2HB GLU 128 2.008 -6.650 -7.066 401 1HG GLU 128 1HG GLU 128 2.757 -4.710 -8.679 402 2HG GLU 128 2HG GLU 128 4.336 -5.473 -8.484 403 H ALA 129 H ALA 129 4.164 -3.690 -4.452 404 HA ALA 129 HA ALA 129 4.772 -1.279 -5.474 405 1HB ALA 129 1HB ALA 129 5.667 -2.166 -3.358 406 2HB ALA 129 2HB ALA 129 6.827 -3.131 -4.273 407 3HB ALA 129 3HB ALA 129 6.903 -1.369 -4.332 408 H ASP 130 H ASP 130 5.257 -0.685 -7.478 409 HA ASP 130 HA ASP 130 6.980 -2.411 -9.111 410 1HB ASP 130 1HB ASP 130 6.098 -1.276 -11.037 411 2HB ASP 130 2HB ASP 130 4.738 -1.713 -10.003 412 H LYS 131 H LYS 131 7.812 -0.487 -6.952 413 HA LYS 131 HA LYS 131 10.225 0.355 -7.907 414 1HB LYS 131 1HB LYS 131 8.185 1.944 -9.047 415 2HB LYS 131 2HB LYS 131 8.991 2.950 -7.850 416 1HG LYS 131 1HG LYS 131 11.160 2.024 -9.012 417 2HG LYS 131 2HG LYS 131 10.051 1.770 -10.362 418 1HD LYS 131 1HD LYS 131 9.498 4.338 -9.375 419 2HD LYS 131 2HD LYS 131 11.256 4.206 -9.428 420 1HE LYS 131 1HE LYS 131 11.300 4.240 -11.666 421 2HE LYS 131 2HE LYS 131 9.944 3.119 -11.795 422 1HZ LYS 131 1HZ LYS 131 8.500 5.081 -11.197 423 2HZ LYS 131 2HZ LYS 131 9.853 6.060 -11.471 424 3HZ LYS 131 3HZ LYS 131 9.215 5.128 -12.729 425 H SER 132 H SER 132 10.364 -0.449 -5.691 426 HA SER 132 HA SER 132 9.940 1.718 -3.743 427 1HB SER 132 1HB SER 132 8.545 -0.593 -3.664 428 2HB SER 132 2HB SER 132 9.955 -1.057 -2.714 429 HG SER 132 HG SER 132 7.974 0.103 -1.723 430 H GLY 133 H GLY 133 11.162 0.180 -1.617 431 1HA GLY 133 1HA GLY 133 13.684 -0.816 -2.101 432 2HA GLY 133 2HA GLY 133 13.879 0.930 -2.062 433 H THR 134 H THR 134 12.332 1.807 -0.107 434 HA THR 134 HA THR 134 12.600 0.175 2.266 435 HB THR 134 HB THR 134 14.204 2.705 1.881 436 HG1 THR 134 HG1 THR 134 15.310 0.893 1.243 437 1HG2 THR 134 1HG2 THR 134 13.777 1.178 4.438 438 2HG2 THR 134 2HG2 THR 134 14.916 2.502 4.195 439 3HG2 THR 134 3HG2 THR 134 13.181 2.799 4.086 440 H VAL 135 H VAL 135 10.323 0.413 2.264 441 HA VAL 135 HA VAL 135 8.801 2.666 2.080 442 HB VAL 135 HB VAL 135 8.409 0.407 4.050 443 1HG1 VAL 135 1HG1 VAL 135 6.661 2.689 3.224 444 2HG1 VAL 135 2HG1 VAL 135 5.945 1.147 3.696 445 3HG1 VAL 135 3HG1 VAL 135 6.961 2.033 4.834 446 1HG2 VAL 135 1HG2 VAL 135 7.814 0.762 1.159 447 2HG2 VAL 135 2HG2 VAL 135 8.324 -0.676 2.043 448 3HG2 VAL 135 3HG2 VAL 135 6.652 -0.125 2.145 449 H LYS 136 H LYS 136 8.696 4.538 3.124 450 HA LYS 136 HA LYS 136 10.228 4.933 5.540 451 1HB LYS 136 1HB LYS 136 9.508 6.550 3.402 452 2HB LYS 136 2HB LYS 136 8.542 7.167 4.736 453 1HG LYS 136 1HG LYS 136 11.533 6.818 4.752 454 2HG LYS 136 2HG LYS 136 10.670 8.341 4.530 455 1HD LYS 136 1HD LYS 136 10.594 6.578 6.978 456 2HD LYS 136 2HD LYS 136 11.431 8.125 6.829 457 1HE LYS 136 1HE LYS 136 9.131 9.093 6.246 458 2HE LYS 136 2HE LYS 136 8.478 7.582 6.879 459 1HZ LYS 136 1HZ LYS 136 10.404 8.959 8.569 460 2HZ LYS 136 2HZ LYS 136 8.906 9.722 8.382 461 3HZ LYS 136 3HZ LYS 136 8.982 8.144 8.989 462 H ALA 137 H ALA 137 6.808 5.237 4.592 463 HA ALA 137 HA ALA 137 5.772 4.172 6.939 464 1HB ALA 137 1HB ALA 137 6.269 7.112 7.049 465 2HB ALA 137 2HB ALA 137 4.868 6.429 7.872 466 3HB ALA 137 3HB ALA 137 6.490 5.888 8.297 467 H ILE 138 H ILE 138 3.420 4.651 7.229 468 HA ILE 138 HA ILE 138 2.187 5.294 4.629 469 HB ILE 138 HB ILE 138 1.385 3.293 6.735 470 1HG1 ILE 138 1HG1 ILE 138 2.111 3.145 3.811 471 2HG1 ILE 138 2HG1 ILE 138 2.923 2.376 5.170 472 1HG2 ILE 138 1HG2 ILE 138 -0.591 4.605 6.030 473 2HG2 ILE 138 2HG2 ILE 138 -0.272 4.132 4.362 474 3HG2 ILE 138 3HG2 ILE 138 -0.681 2.906 5.562 475 1HD1 ILE 138 1HD1 ILE 138 0.149 1.695 4.227 476 2HD1 ILE 138 2HD1 ILE 138 1.612 0.811 3.792 477 3HD1 ILE 138 3HD1 ILE 138 1.082 0.864 5.473 478 H LEU 139 H LEU 139 0.121 6.352 4.668 479 HA LEU 139 HA LEU 139 -0.380 7.837 7.165 480 1HB LEU 139 1HB LEU 139 -0.643 8.803 4.319 481 2HB LEU 139 2HB LEU 139 -1.169 9.706 5.727 482 HG LEU 139 HG LEU 139 0.881 10.668 5.277 483 1HD1 LEU 139 1HD1 LEU 139 0.683 9.650 7.613 484 2HD1 LEU 139 2HD1 LEU 139 1.834 8.440 7.044 485 3HD1 LEU 139 3HD1 LEU 139 2.287 10.144 7.069 486 1HD2 LEU 139 1HD2 LEU 139 1.591 7.970 4.279 487 2HD2 LEU 139 2HD2 LEU 139 1.890 9.558 3.573 488 3HD2 LEU 139 3HD2 LEU 139 2.900 8.978 4.897 489 H VAL 140 H VAL 140 -1.714 6.040 4.517 490 HA VAL 140 HA VAL 140 -4.395 6.720 4.628 491 HB VAL 140 HB VAL 140 -3.087 4.065 4.051 492 1HG1 VAL 140 1HG1 VAL 140 -5.970 4.794 4.181 493 2HG1 VAL 140 2HG1 VAL 140 -5.431 3.700 2.907 494 3HG1 VAL 140 3HG1 VAL 140 -5.168 3.280 4.599 495 1HG2 VAL 140 1HG2 VAL 140 -2.629 5.875 2.471 496 2HG2 VAL 140 2HG2 VAL 140 -3.624 4.618 1.733 497 3HG2 VAL 140 3HG2 VAL 140 -4.361 6.132 2.260 498 H GLU 141 H GLU 141 -2.711 4.193 6.492 499 HA GLU 141 HA GLU 141 -3.108 3.495 8.652 500 1HB GLU 141 1HB GLU 141 -5.723 4.993 8.628 501 2HB GLU 141 2HB GLU 141 -4.779 4.474 10.018 502 1HG GLU 141 1HG GLU 141 -3.592 6.346 10.027 503 2HG GLU 141 2HG GLU 141 -3.267 6.237 8.298 504 H SER 142 H SER 142 -3.363 1.383 8.151 505 HA SER 142 HA SER 142 -5.172 0.084 6.644 506 1HB SER 142 1HB SER 142 -3.975 -1.619 7.476 507 2HB SER 142 2HB SER 142 -3.453 -0.632 8.842 508 HG SER 142 HG SER 142 -5.362 -1.223 9.920 509 H GLY 143 H GLY 143 -7.120 -1.212 7.198 510 1HA GLY 143 1HA GLY 143 -9.236 -1.440 8.073 511 2HA GLY 143 2HA GLY 143 -8.664 -0.598 9.506 512 H GLN 144 H GLN 144 -7.982 1.301 6.878 513 HA GLN 144 HA GLN 144 -10.506 2.789 7.187 514 1HB GLN 144 1HB GLN 144 -8.525 3.922 8.170 515 2HB GLN 144 2HB GLN 144 -7.769 3.921 6.583 516 1HG GLN 144 1HG GLN 144 -9.810 5.213 5.789 517 2HG GLN 144 2HG GLN 144 -10.187 5.439 7.496 518 1HE2 GLN 144 2HE2 GLN 144 -7.674 5.940 5.072 519 2HE2 GLN 144 1HE2 GLN 144 -6.990 7.346 5.809 520 HA PRO 145 HA PRO 145 -11.115 2.250 2.847 521 1HB PRO 145 1HB PRO 145 -12.774 4.355 2.379 522 2HB PRO 145 2HB PRO 145 -13.296 2.877 3.195 523 1HG PRO 145 1HG PRO 145 -12.491 5.508 4.374 524 2HG PRO 145 2HG PRO 145 -13.845 4.451 4.816 525 1HD PRO 145 1HD PRO 145 -11.543 4.520 6.231 526 2HD PRO 145 2HD PRO 145 -12.502 3.036 6.050 527 H VAL 146 H VAL 146 -9.835 2.756 1.191 528 HA VAL 146 HA VAL 146 -8.303 5.226 1.257 529 HB VAL 146 HB VAL 146 -6.919 4.296 -0.423 530 1HG1 VAL 146 1HG1 VAL 146 -7.537 2.840 1.940 531 2HG1 VAL 146 2HG1 VAL 146 -7.150 1.688 0.661 532 3HG1 VAL 146 3HG1 VAL 146 -5.998 2.955 1.086 533 1HG2 VAL 146 1HG2 VAL 146 -9.215 2.431 -0.922 534 2HG2 VAL 146 2HG2 VAL 146 -8.377 3.489 -2.057 535 3HG2 VAL 146 3HG2 VAL 146 -7.581 2.035 -1.453 536 H GLU 147 H GLU 147 -8.209 6.714 -0.473 537 HA GLU 147 HA GLU 147 -10.390 6.556 -2.432 538 1HB GLU 147 1HB GLU 147 -9.725 9.151 -1.068 539 2HB GLU 147 2HB GLU 147 -11.157 8.736 -2.004 540 1HG GLU 147 1HG GLU 147 -12.191 8.336 -0.092 541 2HG GLU 147 2HG GLU 147 -11.142 6.935 0.115 542 H PHE 148 H PHE 148 -10.081 7.915 -4.310 543 HA PHE 148 HA PHE 148 -7.678 7.692 -5.559 544 1HB PHE 148 1HB PHE 148 -10.073 8.703 -6.285 545 2HB PHE 148 2HB PHE 148 -9.130 10.184 -6.187 546 HD1 PHE 148 HD1 PHE 148 -6.549 9.558 -7.187 547 HD2 PHE 148 HD2 PHE 148 -10.333 8.070 -8.475 548 HE1 PHE 148 HE1 PHE 148 -5.608 9.110 -9.422 549 HE2 PHE 148 HE2 PHE 148 -9.399 7.620 -10.711 550 HZ PHE 148 HZ PHE 148 -7.035 8.140 -11.186 551 H ASP 149 H ASP 149 -5.716 8.471 -5.194 552 HA ASP 149 HA ASP 149 -4.035 9.959 -4.744 553 1HB ASP 149 1HB ASP 149 -6.108 12.027 -4.025 554 2HB ASP 149 2HB ASP 149 -4.451 12.288 -4.561 555 H GLU 150 H GLU 150 -4.311 8.200 -2.917 556 HA GLU 150 HA GLU 150 -4.318 9.666 -0.366 557 1HB GLU 150 1HB GLU 150 -6.012 7.494 -1.146 558 2HB GLU 150 2HB GLU 150 -4.952 6.950 0.147 559 1HG GLU 150 1HG GLU 150 -6.784 9.336 0.220 560 2HG GLU 150 2HG GLU 150 -7.020 7.800 1.053 561 HA PRO 151 HA PRO 151 -0.064 8.252 -0.394 562 1HB PRO 151 1HB PRO 151 -0.377 8.977 2.479 563 2HB PRO 151 2HB PRO 151 0.885 9.442 1.332 564 1HG PRO 151 1HG PRO 151 -1.011 11.173 2.039 565 2HG PRO 151 2HG PRO 151 -0.417 11.102 0.369 566 1HD PRO 151 1HD PRO 151 -2.975 10.082 1.517 567 2HD PRO 151 2HD PRO 151 -2.654 10.789 -0.079 568 H LEU 152 H LEU 152 -0.835 6.034 -0.691 569 HA LEU 152 HA LEU 152 -1.660 4.413 1.476 570 1HB LEU 152 1HB LEU 152 -0.782 3.978 -1.317 571 2HB LEU 152 2HB LEU 152 -0.616 2.610 -0.230 572 HG LEU 152 HG LEU 152 -3.200 4.104 -0.687 573 1HD1 LEU 152 1HD1 LEU 152 -2.006 2.613 -2.570 574 2HD1 LEU 152 2HD1 LEU 152 -2.847 1.347 -1.675 575 3HD1 LEU 152 3HD1 LEU 152 -3.755 2.695 -2.360 576 1HD2 LEU 152 1HD2 LEU 152 -2.719 2.779 1.490 577 2HD2 LEU 152 2HD2 LEU 152 -4.236 2.508 0.633 578 3HD2 LEU 152 3HD2 LEU 152 -2.910 1.357 0.464 579 H VAL 153 H VAL 153 1.494 4.913 -0.072 580 HA VAL 153 HA VAL 153 2.854 4.292 2.387 581 HB VAL 153 HB VAL 153 3.689 2.569 0.089 582 1HG1 VAL 153 1HG1 VAL 153 4.129 2.705 3.020 583 2HG1 VAL 153 2HG1 VAL 153 4.155 1.115 2.257 584 3HG1 VAL 153 3HG1 VAL 153 5.269 2.371 1.717 585 1HG2 VAL 153 1HG2 VAL 153 1.274 2.153 0.413 586 2HG2 VAL 153 2HG2 VAL 153 2.271 0.760 0.836 587 3HG2 VAL 153 3HG2 VAL 153 1.591 1.776 2.107 588 H VAL 154 H VAL 154 4.491 5.672 2.512 589 HA VAL 154 HA VAL 154 5.503 6.899 0.062 590 HB VAL 154 HB VAL 154 6.395 8.636 1.386 591 1HG1 VAL 154 1HG1 VAL 154 3.681 7.881 1.619 592 2HG1 VAL 154 2HG1 VAL 154 4.181 8.540 3.177 593 3HG1 VAL 154 3HG1 VAL 154 4.378 9.499 1.710 594 1HG2 VAL 154 1HG2 VAL 154 6.097 6.715 3.670 595 2HG2 VAL 154 2HG2 VAL 154 7.535 7.576 3.122 596 3HG2 VAL 154 3HG2 VAL 154 6.246 8.451 3.946 597 H ILE 155 H ILE 155 7.376 6.349 -0.811 598 HA ILE 155 HA ILE 155 9.146 4.540 0.650 599 HB ILE 155 HB ILE 155 8.999 5.306 -2.261 600 1HG1 ILE 155 1HG1 ILE 155 8.790 2.533 -1.154 601 2HG1 ILE 155 2HG1 ILE 155 7.399 3.611 -1.058 602 1HG2 ILE 155 1HG2 ILE 155 11.348 5.009 -1.501 603 2HG2 ILE 155 2HG2 ILE 155 10.932 3.369 -1.007 604 3HG2 ILE 155 3HG2 ILE 155 10.830 3.830 -2.707 605 1HD1 ILE 155 1HD1 ILE 155 8.516 3.670 -3.697 606 2HD1 ILE 155 2HD1 ILE 155 8.173 2.010 -3.209 607 3HD1 ILE 155 3HD1 ILE 155 6.892 3.222 -3.173 608 H GLU 156 H GLU 156 11.280 4.962 1.071 609 HA GLU 156 HA GLU 156 12.144 7.746 0.643 610 1HB GLU 156 1HB GLU 156 12.013 7.481 2.957 611 2HB GLU 156 2HB GLU 156 12.593 5.822 2.899 612 1HG GLU 156 1HG GLU 156 14.793 6.449 2.748 613 2HG GLU 156 2HG GLU 156 14.410 8.021 2.050 614 1H10 BTN 222 1H10 BTN 122 -13.655 -11.596 1.774 615 2H10 BTN 222 2H10 BTN 122 -14.131 -12.073 3.403 616 1H9 BTN 222 1H9 BTN 122 -11.989 -11.729 3.939 617 2H9 BTN 222 2H9 BTN 122 -12.401 -10.014 3.895 618 1H8 BTN 222 1H8 BTN 122 -11.447 -9.698 1.818 619 2H8 BTN 222 2H8 BTN 122 -11.610 -11.397 1.371 620 1H7 BTN 222 1H7 BTN 122 -9.553 -11.820 2.061 621 2H7 BTN 222 2H7 BTN 122 -9.937 -11.210 3.664 622 H2 BTN 222 H2 BTN 122 -9.080 -9.460 1.353 623 1H6 BTN 222 1H6 BTN 122 -6.071 -8.128 3.688 624 2H6 BTN 222 2H6 BTN 122 -6.765 -7.747 2.119 625 H5 BTN 222 H5 BTN 122 -8.332 -6.731 3.519 626 HN1 BTN 222 HN2 BTN 122 -7.482 -7.623 5.755 627 HN2 BTN 222 HN1 BTN 122 -10.638 -9.748 4.600 628 H4 BTN 222 H4 BTN 122 -10.132 -7.980 2.824 Start of MODEL 17 1 1H GLU 77 H GLU 77 19.550 10.948 1.197 2 HA GLU 77 HA GLU 77 18.557 13.154 -0.129 3 1HB GLU 77 1HB GLU 77 20.620 11.851 -1.636 4 2HB GLU 77 2HB GLU 77 19.084 11.659 -2.475 5 1HG GLU 77 1HG GLU 77 19.107 13.764 -3.158 6 2HG GLU 77 2HG GLU 77 19.411 14.359 -1.527 7 H ILE 78 H ILE 78 16.575 12.736 -1.245 8 HA ILE 78 HA ILE 78 15.529 10.028 -0.741 9 HB ILE 78 HB ILE 78 14.512 11.885 0.610 10 1HG1 ILE 78 1HG1 ILE 78 13.384 9.668 -0.217 11 2HG1 ILE 78 2HG1 ILE 78 12.410 10.907 0.565 12 1HG2 ILE 78 1HG2 ILE 78 14.619 13.563 -1.238 13 2HG2 ILE 78 2HG2 ILE 78 13.271 12.723 -2.003 14 3HG2 ILE 78 3HG2 ILE 78 13.059 13.473 -0.421 15 1HD1 ILE 78 1HD1 ILE 78 12.667 10.512 -2.406 16 2HD1 ILE 78 2HD1 ILE 78 11.316 9.976 -1.408 17 3HD1 ILE 78 3HD1 ILE 78 11.646 11.699 -1.594 18 H SER 79 H SER 79 14.991 8.877 -2.466 19 HA SER 79 HA SER 79 14.276 10.299 -4.945 20 1HB SER 79 1HB SER 79 16.498 8.630 -4.535 21 2HB SER 79 2HB SER 79 15.348 7.663 -5.457 22 HG SER 79 HG SER 79 16.895 9.152 -6.611 23 H GLY 80 H GLY 80 12.952 8.643 -2.562 24 1HA GLY 80 1HA GLY 80 11.593 6.513 -3.873 25 2HA GLY 80 2HA GLY 80 11.164 7.217 -2.321 26 H HIS 81 H HIS 81 8.949 7.119 -2.809 27 HA HIS 81 HA HIS 81 7.971 9.423 -4.222 28 1HB HIS 81 1HB HIS 81 6.612 8.265 -5.847 29 2HB HIS 81 2HB HIS 81 8.286 7.763 -6.055 30 HD1 HIS 81 HD1 HIS 81 7.027 5.694 -7.298 31 HD2 HIS 81 HD2 HIS 81 6.705 5.877 -3.160 32 HE1 HIS 81 HE1 HIS 81 6.317 3.394 -6.575 33 HE2 HIS 81 HE2 HIS 81 6.035 3.555 -4.079 34 H ILE 82 H ILE 82 5.309 8.621 -4.517 35 HA ILE 82 HA ILE 82 4.477 7.633 -1.898 36 HB ILE 82 HB ILE 82 3.679 10.326 -2.994 37 1HG1 ILE 82 1HG1 ILE 82 5.295 9.368 -0.661 38 2HG1 ILE 82 2HG1 ILE 82 5.643 10.667 -1.796 39 1HG2 ILE 82 1HG2 ILE 82 2.514 8.746 -0.709 40 2HG2 ILE 82 2HG2 ILE 82 2.216 10.462 -0.982 41 3HG2 ILE 82 3HG2 ILE 82 1.690 9.275 -2.175 42 1HD1 ILE 82 1HD1 ILE 82 3.518 10.764 0.330 43 2HD1 ILE 82 2HD1 ILE 82 5.127 11.472 0.464 44 3HD1 ILE 82 3HD1 ILE 82 3.997 12.077 -0.747 45 H VAL 83 H VAL 83 3.160 6.009 -2.378 46 HA VAL 83 HA VAL 83 1.736 5.820 -4.839 47 HB VAL 83 HB VAL 83 1.380 4.182 -2.326 48 1HG1 VAL 83 1HG1 VAL 83 -0.405 4.199 -4.220 49 2HG1 VAL 83 2HG1 VAL 83 0.782 3.232 -5.095 50 3HG1 VAL 83 3HG1 VAL 83 0.147 2.663 -3.551 51 1HG2 VAL 83 1HG2 VAL 83 3.635 4.370 -3.910 52 2HG2 VAL 83 2HG2 VAL 83 3.233 3.042 -2.822 53 3HG2 VAL 83 3HG2 VAL 83 2.806 2.942 -4.531 54 H ARG 84 H ARG 84 -0.006 6.983 -5.299 55 HA ARG 84 HA ARG 84 -1.726 7.980 -3.180 56 1HB ARG 84 1HB ARG 84 -0.944 8.946 -5.683 57 2HB ARG 84 2HB ARG 84 -2.644 8.537 -5.873 58 1HG ARG 84 1HG ARG 84 -2.803 10.703 -5.170 59 2HG ARG 84 2HG ARG 84 -2.896 9.856 -3.625 60 1HD ARG 84 1HD ARG 84 -0.989 10.763 -2.905 61 2HD ARG 84 2HD ARG 84 -0.159 10.399 -4.417 62 HE ARG 84 HE ARG 84 -1.140 12.912 -3.622 63 1HH1 ARG 84 1HH1 ARG 84 -0.971 10.845 -6.419 64 2HH1 ARG 84 2HH1 ARG 84 -0.998 12.156 -7.551 65 1HH2 ARG 84 1HH2 ARG 84 -1.175 14.646 -5.102 66 2HH2 ARG 84 2HH2 ARG 84 -1.113 14.318 -6.802 67 H SER 85 H SER 85 -3.793 7.347 -2.791 68 HA SER 85 HA SER 85 -4.598 4.761 -3.562 69 1HB SER 85 1HB SER 85 -5.299 6.318 -1.526 70 2HB SER 85 2HB SER 85 -6.633 6.724 -2.605 71 HG SER 85 HG SER 85 -7.470 4.950 -1.846 72 HA PRO 86 HA PRO 86 -5.981 5.891 -7.705 73 1HB PRO 86 1HB PRO 86 -6.942 3.081 -7.538 74 2HB PRO 86 2HB PRO 86 -5.975 3.868 -8.790 75 1HG PRO 86 1HG PRO 86 -4.853 2.175 -7.066 76 2HG PRO 86 2HG PRO 86 -4.001 3.637 -7.596 77 1HD PRO 86 1HD PRO 86 -5.393 3.086 -5.011 78 2HD PRO 86 2HD PRO 86 -3.900 3.994 -5.317 79 H MET 87 H MET 87 -8.070 3.514 -6.071 80 HA MET 87 HA MET 87 -10.332 5.363 -6.463 81 1HB MET 87 1HB MET 87 -10.429 2.342 -6.512 82 2HB MET 87 2HB MET 87 -11.778 3.434 -6.795 83 1HG MET 87 1HG MET 87 -10.145 4.330 -8.688 84 2HG MET 87 2HG MET 87 -9.533 2.681 -8.570 85 1HE MET 87 1HE MET 87 -10.377 3.946 -10.928 86 2HE MET 87 2HE MET 87 -11.344 2.725 -11.757 87 3HE MET 87 3HE MET 87 -12.089 4.236 -11.234 88 H VAL 88 H VAL 88 -12.279 4.278 -5.030 89 HA VAL 88 HA VAL 88 -11.301 4.543 -2.301 90 HB VAL 88 HB VAL 88 -14.126 4.415 -3.364 91 1HG1 VAL 88 1HG1 VAL 88 -13.126 4.071 -0.720 92 2HG1 VAL 88 2HG1 VAL 88 -13.993 5.605 -0.801 93 3HG1 VAL 88 3HG1 VAL 88 -14.800 4.108 -1.273 94 1HG2 VAL 88 1HG2 VAL 88 -12.426 6.449 -3.727 95 2HG2 VAL 88 2HG2 VAL 88 -14.154 6.680 -3.463 96 3HG2 VAL 88 3HG2 VAL 88 -13.025 6.862 -2.120 97 H GLY 89 H GLY 89 -11.576 3.020 -0.688 98 1HA GLY 89 1HA GLY 89 -13.029 0.607 -1.006 99 2HA GLY 89 2HA GLY 89 -11.329 0.331 -1.354 100 H THR 90 H THR 90 -10.185 -0.370 0.310 101 HA THR 90 HA THR 90 -10.422 0.823 2.913 102 HB THR 90 HB THR 90 -10.993 -2.131 2.757 103 HG1 THR 90 HG1 THR 90 -12.955 -0.141 3.157 104 1HG2 THR 90 1HG2 THR 90 -10.331 -0.566 4.901 105 2HG2 THR 90 2HG2 THR 90 -12.094 -0.594 4.964 106 3HG2 THR 90 3HG2 THR 90 -11.186 -2.106 4.969 107 H PHE 91 H PHE 91 -8.382 1.043 3.526 108 HA PHE 91 HA PHE 91 -6.250 -0.426 2.368 109 1HB PHE 91 1HB PHE 91 -6.453 1.946 3.732 110 2HB PHE 91 2HB PHE 91 -5.662 0.908 4.916 111 HD1 PHE 91 HD1 PHE 91 -5.286 0.713 1.238 112 HD2 PHE 91 HD2 PHE 91 -3.513 1.862 4.943 113 HE1 PHE 91 HE1 PHE 91 -3.128 1.055 0.096 114 HE2 PHE 91 HE2 PHE 91 -1.353 2.208 3.806 115 HZ PHE 91 HZ PHE 91 -1.159 1.805 1.380 116 H TYR 92 H TYR 92 -4.644 -1.684 3.591 117 HA TYR 92 HA TYR 92 -5.339 -2.873 6.083 118 1HB TYR 92 1HB TYR 92 -5.820 -4.418 3.558 119 2HB TYR 92 2HB TYR 92 -5.480 -5.231 5.082 120 HD1 TYR 92 HD1 TYR 92 -6.974 -3.709 7.040 121 HD2 TYR 92 HD2 TYR 92 -8.055 -4.750 3.050 122 HE1 TYR 92 HE1 TYR 92 -9.357 -3.555 7.650 123 HE2 TYR 92 HE2 TYR 92 -10.439 -4.598 3.649 124 HH TYR 92 HH TYR 92 -11.533 -3.163 6.499 125 H ARG 93 H ARG 93 -3.718 -4.128 3.168 126 HA ARG 93 HA ARG 93 -1.494 -4.469 2.718 127 1HB ARG 93 1HB ARG 93 -0.728 -3.449 5.432 128 2HB ARG 93 2HB ARG 93 0.184 -3.384 3.930 129 1HG ARG 93 1HG ARG 93 -0.721 -1.432 3.329 130 2HG ARG 93 2HG ARG 93 -2.340 -1.918 3.836 131 1HD ARG 93 1HD ARG 93 -1.504 -0.023 5.147 132 2HD ARG 93 2HD ARG 93 -1.778 -1.445 6.151 133 HE ARG 93 HE ARG 93 0.927 -1.173 5.200 134 1HH1 ARG 93 1HH1 ARG 93 -1.343 -0.350 7.708 135 2HH1 ARG 93 2HH1 ARG 93 -0.121 -0.070 8.903 136 1HH2 ARG 93 1HH2 ARG 93 2.546 -0.806 6.764 137 2HH2 ARG 93 2HH2 ARG 93 2.091 -0.327 8.366 138 H THR 94 H THR 94 -3.190 -6.434 3.881 139 HA THR 94 HA THR 94 -1.142 -8.168 5.007 140 HB THR 94 HB THR 94 -2.331 -8.769 6.958 141 HG1 THR 94 HG1 THR 94 -4.480 -7.711 5.593 142 1HG2 THR 94 1HG2 THR 94 -2.419 -5.802 6.555 143 2HG2 THR 94 2HG2 THR 94 -2.943 -6.558 8.060 144 3HG2 THR 94 3HG2 THR 94 -1.283 -6.761 7.504 145 HA PRO 95 HA PRO 95 -3.477 -10.612 2.021 146 1HB PRO 95 1HB PRO 95 -1.607 -12.547 1.755 147 2HB PRO 95 2HB PRO 95 -1.473 -10.979 0.952 148 1HG PRO 95 1HG PRO 95 -0.161 -11.937 3.468 149 2HG PRO 95 2HG PRO 95 0.534 -11.006 2.128 150 1HD PRO 95 1HD PRO 95 -0.267 -9.864 4.459 151 2HD PRO 95 2HD PRO 95 -0.325 -9.015 2.901 152 H SER 96 H SER 96 -4.394 -10.772 4.586 153 HA SER 96 HA SER 96 -5.579 -13.188 4.831 154 1HB SER 96 1HB SER 96 -4.057 -14.698 5.485 155 2HB SER 96 2HB SER 96 -2.799 -13.460 5.473 156 HG SER 96 HG SER 96 -3.231 -14.558 7.542 157 HA PRO 97 HA PRO 97 -7.736 -10.731 7.810 158 1HB PRO 97 1HB PRO 97 -8.334 -13.437 8.935 159 2HB PRO 97 2HB PRO 97 -9.433 -12.095 8.591 160 1HG PRO 97 1HG PRO 97 -9.300 -14.188 6.951 161 2HG PRO 97 2HG PRO 97 -9.482 -12.544 6.315 162 1HD PRO 97 1HD PRO 97 -7.091 -14.316 6.331 163 2HD PRO 97 2HD PRO 97 -7.577 -13.080 5.152 164 H ASP 98 H ASP 98 -5.380 -13.161 8.609 165 HA ASP 98 HA ASP 98 -4.595 -11.628 10.954 166 1HB ASP 98 1HB ASP 98 -4.498 -13.620 12.397 167 2HB ASP 98 2HB ASP 98 -6.145 -13.286 11.870 168 H ALA 99 H ALA 99 -3.065 -11.360 8.966 169 HA ALA 99 HA ALA 99 -0.998 -13.454 9.040 170 1HB ALA 99 1HB ALA 99 -2.219 -12.266 6.867 171 2HB ALA 99 2HB ALA 99 -0.664 -11.441 6.973 172 3HB ALA 99 3HB ALA 99 -0.723 -13.200 6.842 173 H LYS 100 H LYS 100 0.992 -11.725 7.850 174 HA LYS 100 HA LYS 100 1.628 -10.052 10.191 175 1HB LYS 100 1HB LYS 100 3.098 -12.150 8.974 176 2HB LYS 100 2HB LYS 100 3.959 -10.654 8.639 177 1HG LYS 100 1HG LYS 100 4.737 -11.747 10.689 178 2HG LYS 100 2HG LYS 100 4.067 -10.144 10.999 179 1HD LYS 100 1HD LYS 100 1.917 -11.242 11.626 180 2HD LYS 100 2HD LYS 100 2.722 -12.803 11.466 181 1HE LYS 100 1HE LYS 100 3.054 -12.495 13.688 182 2HE LYS 100 2HE LYS 100 4.461 -11.611 13.099 183 1HZ LYS 100 1HZ LYS 100 3.068 -9.570 13.193 184 2HZ LYS 100 2HZ LYS 100 1.859 -10.472 13.958 185 3HZ LYS 100 3HZ LYS 100 3.364 -10.269 14.704 186 H ALA 101 H ALA 101 0.125 -9.256 7.811 187 HA ALA 101 HA ALA 101 -0.022 -7.518 6.351 188 1HB ALA 101 1HB ALA 101 0.667 -6.323 8.453 189 2HB ALA 101 2HB ALA 101 2.314 -6.327 7.825 190 3HB ALA 101 3HB ALA 101 1.039 -5.483 6.948 191 H PHE 102 H PHE 102 0.695 -6.986 4.338 192 HA PHE 102 HA PHE 102 2.546 -8.544 3.036 193 1HB PHE 102 1HB PHE 102 1.151 -6.013 2.445 194 2HB PHE 102 2HB PHE 102 2.619 -6.287 1.516 195 HD1 PHE 102 HD1 PHE 102 2.572 -9.197 1.144 196 HD2 PHE 102 HD2 PHE 102 -0.590 -6.342 0.953 197 HE1 PHE 102 HE1 PHE 102 1.329 -10.681 -0.383 198 HE2 PHE 102 HE2 PHE 102 -1.838 -7.820 -0.574 199 HZ PHE 102 HZ PHE 102 -0.879 -9.992 -1.243 200 H ILE 103 H ILE 103 3.333 -5.151 2.824 201 HA ILE 103 HA ILE 103 6.038 -5.775 3.812 202 HB ILE 103 HB ILE 103 5.114 -3.808 1.724 203 1HG1 ILE 103 1HG1 ILE 103 6.598 -5.013 0.262 204 2HG1 ILE 103 2HG1 ILE 103 7.261 -5.932 1.608 205 1HG2 ILE 103 1HG2 ILE 103 7.305 -3.522 3.558 206 2HG2 ILE 103 2HG2 ILE 103 7.907 -3.681 1.907 207 3HG2 ILE 103 3HG2 ILE 103 6.744 -2.415 2.304 208 1HD1 ILE 103 1HD1 ILE 103 4.363 -6.105 0.888 209 2HD1 ILE 103 2HD1 ILE 103 5.582 -7.079 0.066 210 3HD1 ILE 103 3HD1 ILE 103 5.349 -7.242 1.806 211 H GLU 104 H GLU 104 5.066 -5.345 5.975 212 HA GLU 104 HA GLU 104 3.932 -3.124 6.967 213 1HB GLU 104 1HB GLU 104 5.678 -5.149 8.010 214 2HB GLU 104 2HB GLU 104 6.071 -3.599 8.746 215 1HG GLU 104 1HG GLU 104 3.863 -3.338 9.571 216 2HG GLU 104 2HG GLU 104 3.278 -4.702 8.620 217 H VAL 105 H VAL 105 4.669 -1.135 7.902 218 HA VAL 105 HA VAL 105 6.323 0.375 6.218 219 HB VAL 105 HB VAL 105 5.400 0.931 9.038 220 1HG1 VAL 105 1HG1 VAL 105 7.418 2.210 8.582 221 2HG1 VAL 105 2HG1 VAL 105 6.720 2.800 7.072 222 3HG1 VAL 105 3HG1 VAL 105 6.008 3.268 8.617 223 1HG2 VAL 105 1HG2 VAL 105 3.616 0.738 7.373 224 2HG2 VAL 105 2HG2 VAL 105 3.776 2.395 7.956 225 3HG2 VAL 105 3HG2 VAL 105 4.416 1.951 6.374 226 H GLY 106 H GLY 106 8.420 1.098 6.379 227 1HA GLY 106 1HA GLY 106 10.542 1.347 7.346 228 2HA GLY 106 2HA GLY 106 10.044 0.292 8.660 229 H GLN 107 H GLN 107 9.003 -1.576 6.432 230 HA GLN 107 HA GLN 107 11.323 -3.232 6.370 231 1HB GLN 107 1HB GLN 107 9.114 -4.231 6.475 232 2HB GLN 107 2HB GLN 107 8.663 -3.474 4.953 233 1HG GLN 107 1HG GLN 107 10.085 -4.873 3.713 234 2HG GLN 107 2HG GLN 107 10.942 -5.416 5.155 235 1HE2 GLN 107 2HE2 GLN 107 10.072 -7.306 3.498 236 2HE2 GLN 107 1HE2 GLN 107 8.701 -8.131 4.148 237 H LYS 108 H LYS 108 12.087 -4.223 4.254 238 HA LYS 108 HA LYS 108 12.075 -2.306 2.042 239 1HB LYS 108 1HB LYS 108 14.671 -3.561 2.849 240 2HB LYS 108 2HB LYS 108 14.388 -2.111 1.898 241 1HG LYS 108 1HG LYS 108 13.297 -1.458 4.328 242 2HG LYS 108 2HG LYS 108 14.699 -2.433 4.772 243 1HD LYS 108 1HD LYS 108 15.330 -0.567 2.653 244 2HD LYS 108 2HD LYS 108 14.692 0.260 4.075 245 1HE LYS 108 1HE LYS 108 16.787 0.150 4.853 246 2HE LYS 108 2HE LYS 108 16.419 -1.541 5.188 247 1HZ LYS 108 1HZ LYS 108 17.231 -1.172 2.486 248 2HZ LYS 108 2HZ LYS 108 18.405 -0.587 3.551 249 3HZ LYS 108 3HZ LYS 108 17.880 -2.191 3.669 250 H VAL 109 H VAL 109 12.199 -3.211 0.035 251 HA VAL 109 HA VAL 109 12.860 -6.041 -0.222 252 HB VAL 109 HB VAL 109 10.404 -5.265 -1.673 253 1HG1 VAL 109 1HG1 VAL 109 11.789 -7.576 -1.262 254 2HG1 VAL 109 2HG1 VAL 109 10.486 -7.721 -0.081 255 3HG1 VAL 109 3HG1 VAL 109 10.107 -7.485 -1.788 256 1HG2 VAL 109 1HG2 VAL 109 10.002 -4.269 0.542 257 2HG2 VAL 109 2HG2 VAL 109 8.935 -5.636 0.223 258 3HG2 VAL 109 3HG2 VAL 109 10.325 -5.833 1.290 259 H ASN 110 H ASN 110 11.755 -6.230 -2.879 260 HA ASN 110 HA ASN 110 13.230 -4.183 -4.366 261 1HB ASN 110 1HB ASN 110 14.132 -6.061 -5.841 262 2HB ASN 110 2HB ASN 110 14.869 -5.885 -4.251 263 1HD2 ASN 110 2HD2 ASN 110 14.571 -8.193 -6.114 264 2HD2 ASN 110 1HD2 ASN 110 13.867 -9.446 -5.156 265 H VAL 111 H VAL 111 12.411 -3.714 -6.377 266 HA VAL 111 HA VAL 111 9.800 -3.815 -6.945 267 HB VAL 111 HB VAL 111 11.973 -4.146 -9.018 268 1HG1 VAL 111 1HG1 VAL 111 9.056 -3.581 -9.206 269 2HG1 VAL 111 2HG1 VAL 111 10.149 -2.799 -10.347 270 3HG1 VAL 111 3HG1 VAL 111 10.086 -4.559 -10.252 271 1HG2 VAL 111 1HG2 VAL 111 10.862 -1.787 -7.556 272 2HG2 VAL 111 2HG2 VAL 111 12.539 -2.194 -7.920 273 3HG2 VAL 111 3HG2 VAL 111 11.481 -1.595 -9.197 274 H GLY 112 H GLY 112 8.300 -5.319 -7.281 275 1HA GLY 112 1HA GLY 112 7.686 -7.237 -8.747 276 2HA GLY 112 2HA GLY 112 9.193 -7.974 -8.225 277 H ASP 113 H ASP 113 8.566 -6.750 -5.466 278 HA ASP 113 HA ASP 113 7.076 -9.064 -4.527 279 1HB ASP 113 1HB ASP 113 9.139 -7.383 -3.462 280 2HB ASP 113 2HB ASP 113 7.770 -7.391 -2.356 281 H THR 114 H THR 114 5.210 -8.954 -3.260 282 HA THR 114 HA THR 114 3.222 -7.224 -4.018 283 HB THR 114 HB THR 114 3.105 -8.186 -1.211 284 HG1 THR 114 HG1 THR 114 3.360 -9.904 -3.445 285 1HG2 THR 114 1HG2 THR 114 1.279 -7.843 -3.467 286 2HG2 THR 114 2HG2 THR 114 1.042 -9.328 -2.548 287 3HG2 THR 114 3HG2 THR 114 0.976 -7.767 -1.731 288 H LEU 115 H LEU 115 1.959 -5.926 -2.134 289 HA LEU 115 HA LEU 115 3.778 -4.230 -0.631 290 1HB LEU 115 1HB LEU 115 3.745 -3.121 -2.778 291 2HB LEU 115 2HB LEU 115 1.992 -3.168 -2.819 292 HG LEU 115 HG LEU 115 2.508 -1.806 -0.478 293 1HD1 LEU 115 1HD1 LEU 115 4.917 -1.737 -1.246 294 2HD1 LEU 115 2HD1 LEU 115 4.371 -0.685 -2.552 295 3HD1 LEU 115 3HD1 LEU 115 4.170 -0.183 -0.874 296 1HD2 LEU 115 1HD2 LEU 115 1.950 -0.789 -3.260 297 2HD2 LEU 115 2HD2 LEU 115 0.770 -1.221 -2.022 298 3HD2 LEU 115 3HD2 LEU 115 1.808 0.186 -1.797 299 H CYS 116 H CYS 116 0.448 -3.718 -1.757 300 HA CYS 116 HA CYS 116 -0.673 -4.483 0.789 301 1HB CYS 116 1HB CYS 116 -1.043 -1.607 -0.031 302 2HB CYS 116 2HB CYS 116 -1.469 -2.367 1.498 303 HG CYS 116 HG CYS 116 1.308 -2.596 1.694 304 H ILE 117 H ILE 117 -3.009 -4.427 0.804 305 HA ILE 117 HA ILE 117 -4.112 -4.637 -1.909 306 HB ILE 117 HB ILE 117 -5.066 -5.750 0.728 307 1HG1 ILE 117 1HG1 ILE 117 -4.858 -7.572 -1.517 308 2HG1 ILE 117 2HG1 ILE 117 -3.329 -6.746 -1.226 309 1HG2 ILE 117 1HG2 ILE 117 -6.468 -5.614 -1.924 310 2HG2 ILE 117 2HG2 ILE 117 -6.864 -6.829 -0.709 311 3HG2 ILE 117 3HG2 ILE 117 -7.062 -5.116 -0.340 312 1HD1 ILE 117 1HD1 ILE 117 -4.802 -7.984 1.052 313 2HD1 ILE 117 2HD1 ILE 117 -3.839 -8.988 -0.033 314 3HD1 ILE 117 3HD1 ILE 117 -3.076 -7.675 0.864 315 H VAL 118 H VAL 118 -5.639 -3.285 -2.635 316 HA VAL 118 HA VAL 118 -6.345 -0.989 -1.059 317 HB VAL 118 HB VAL 118 -7.443 -1.773 -3.761 318 1HG1 VAL 118 1HG1 VAL 118 -8.307 0.186 -2.110 319 2HG1 VAL 118 2HG1 VAL 118 -7.074 1.050 -3.028 320 3HG1 VAL 118 3HG1 VAL 118 -8.406 0.257 -3.869 321 1HG2 VAL 118 1HG2 VAL 118 -4.793 -1.349 -3.207 322 2HG2 VAL 118 2HG2 VAL 118 -5.560 -1.116 -4.778 323 3HG2 VAL 118 3HG2 VAL 118 -5.344 0.256 -3.692 324 H GLU 119 H GLU 119 -7.728 -4.058 -1.734 325 HA GLU 119 HA GLU 119 -9.763 -5.006 -1.316 326 1HB GLU 119 1HB GLU 119 -8.800 -4.627 0.963 327 2HB GLU 119 2HB GLU 119 -9.713 -3.126 1.051 328 1HG GLU 119 1HG GLU 119 -11.345 -4.310 1.969 329 2HG GLU 119 2HG GLU 119 -11.616 -5.008 0.373 330 H ALA 120 H ALA 120 -9.940 -2.876 -3.140 331 HA ALA 120 HA ALA 120 -11.910 -0.973 -2.566 332 1HB ALA 120 1HB ALA 120 -10.629 -2.042 -4.972 333 2HB ALA 120 2HB ALA 120 -12.265 -1.436 -5.231 334 3HB ALA 120 3HB ALA 120 -11.032 -0.379 -4.542 335 H MET 121 H MET 121 -12.716 -3.270 -5.067 336 HA MET 121 HA MET 121 -15.350 -3.611 -3.885 337 1HB MET 121 1HB MET 121 -16.000 -4.546 -6.027 338 2HB MET 121 2HB MET 121 -15.150 -3.029 -6.280 339 1HG MET 121 1HG MET 121 -13.352 -4.032 -7.250 340 2HG MET 121 2HG MET 121 -13.570 -5.538 -6.361 341 1HE MET 121 1HE MET 121 -16.664 -4.001 -7.697 342 2HE MET 121 2HE MET 121 -15.746 -3.371 -9.065 343 3HE MET 121 3HE MET 121 -16.919 -4.666 -9.311 344 H LYS 122 H LYS 122 -12.914 -4.899 -2.798 345 HA LYS 122 HA LYS 122 -12.473 -6.859 -1.718 346 1HB LYS 122 1HB LYS 122 -15.200 -7.046 -2.219 347 2HB LYS 122 2HB LYS 122 -14.548 -8.536 -2.887 348 1HG LYS 122 1HG LYS 122 -14.651 -7.599 -0.074 349 2HG LYS 122 2HG LYS 122 -14.954 -9.201 -0.748 350 1HD LYS 122 1HD LYS 122 -12.410 -9.157 -1.296 351 2HD LYS 122 2HD LYS 122 -12.352 -7.889 -0.070 352 1HE LYS 122 1HE LYS 122 -13.822 -10.361 0.628 353 2HE LYS 122 2HE LYS 122 -12.068 -10.489 0.498 354 H MET 123 H MET 123 -11.637 -6.136 -4.467 355 HA MET 123 HA MET 123 -11.263 -8.751 -5.713 356 1HB MET 123 1HB MET 123 -10.827 -7.653 -7.690 357 2HB MET 123 2HB MET 123 -11.906 -6.504 -6.915 358 1HG MET 123 1HG MET 123 -8.907 -6.324 -6.798 359 2HG MET 123 2HG MET 123 -9.900 -5.502 -8.000 360 1HE MET 123 1HE MET 123 -9.287 -3.487 -7.811 361 2HE MET 123 2HE MET 123 -10.339 -2.402 -6.904 362 3HE MET 123 3HE MET 123 -8.691 -2.699 -6.351 363 H MET 124 H MET 124 -9.854 -7.473 -3.238 364 HA MET 124 HA MET 124 -7.761 -7.352 -2.338 365 1HB MET 124 1HB MET 124 -7.762 -9.848 -4.002 366 2HB MET 124 2HB MET 124 -6.311 -9.376 -3.127 367 1HG MET 124 1HG MET 124 -7.754 -10.999 -1.928 368 2HG MET 124 2HG MET 124 -7.435 -9.511 -1.036 369 1HE MET 124 1HE MET 124 -8.814 -7.657 -0.801 370 2HE MET 124 2HE MET 124 -10.573 -7.591 -0.915 371 3HE MET 124 3HE MET 124 -9.806 -8.514 0.379 372 H ASN 125 H ASN 125 -7.590 -5.344 -3.801 373 HA ASN 125 HA ASN 125 -5.877 -5.501 -6.080 374 1HB ASN 125 1HB ASN 125 -7.593 -3.609 -5.133 375 2HB ASN 125 2HB ASN 125 -6.042 -2.920 -4.656 376 1HD2 ASN 125 2HD2 ASN 125 -7.644 -4.416 -7.441 377 2HD2 ASN 125 1HD2 ASN 125 -6.914 -3.395 -8.627 378 H GLN 126 H GLN 126 -4.461 -6.924 -4.459 379 HA GLN 126 HA GLN 126 -2.716 -5.567 -2.697 380 1HB GLN 126 1HB GLN 126 -1.448 -7.624 -2.644 381 2HB GLN 126 2HB GLN 126 -3.166 -7.999 -2.607 382 1HG GLN 126 1HG GLN 126 -2.679 -8.082 -5.268 383 2HG GLN 126 2HG GLN 126 -1.134 -8.634 -4.622 384 1HE2 GLN 126 2HE2 GLN 126 -1.001 -10.600 -3.628 385 2HE2 GLN 126 1HE2 GLN 126 -2.296 -11.745 -3.606 386 H ILE 127 H ILE 127 -1.657 -3.854 -3.563 387 HA ILE 127 HA ILE 127 -0.482 -3.821 -6.140 388 HB ILE 127 HB ILE 127 0.312 -2.091 -3.799 389 1HG1 ILE 127 1HG1 ILE 127 -2.108 -2.008 -4.026 390 2HG1 ILE 127 2HG1 ILE 127 -1.407 -0.503 -4.611 391 1HG2 ILE 127 1HG2 ILE 127 0.561 -1.833 -6.780 392 2HG2 ILE 127 2HG2 ILE 127 0.676 -0.440 -5.704 393 3HG2 ILE 127 3HG2 ILE 127 1.831 -1.765 -5.558 394 1HD1 ILE 127 1HD1 ILE 127 -1.538 -2.073 -6.871 395 2HD1 ILE 127 2HD1 ILE 127 -3.020 -2.464 -5.998 396 3HD1 ILE 127 3HD1 ILE 127 -2.660 -0.790 -6.418 397 H GLU 128 H GLU 128 1.765 -3.789 -6.683 398 HA GLU 128 HA GLU 128 3.472 -5.239 -4.768 399 1HB GLU 128 1HB GLU 128 3.211 -5.596 -7.751 400 2HB GLU 128 2HB GLU 128 4.585 -6.210 -6.841 401 1HG GLU 128 1HG GLU 128 3.423 -7.928 -6.000 402 2HG GLU 128 2HG GLU 128 1.973 -6.955 -5.747 403 H ALA 129 H ALA 129 5.013 -3.923 -4.066 404 HA ALA 129 HA ALA 129 5.773 -1.482 -4.840 405 1HB ALA 129 1HB ALA 129 6.723 -2.983 -2.970 406 2HB ALA 129 2HB ALA 129 7.945 -3.430 -4.161 407 3HB ALA 129 3HB ALA 129 7.765 -1.744 -3.672 408 H ASP 130 H ASP 130 6.211 -0.658 -6.771 409 HA ASP 130 HA ASP 130 7.632 -2.295 -8.744 410 1HB ASP 130 1HB ASP 130 6.728 -0.892 -10.425 411 2HB ASP 130 2HB ASP 130 5.413 -1.154 -9.280 412 H LYS 131 H LYS 131 8.063 0.351 -6.629 413 HA LYS 131 HA LYS 131 10.671 0.910 -7.869 414 1HB LYS 131 1HB LYS 131 8.478 2.758 -7.326 415 2HB LYS 131 2HB LYS 131 9.991 3.269 -6.593 416 1HG LYS 131 1HG LYS 131 11.097 3.251 -8.719 417 2HG LYS 131 2HG LYS 131 9.680 2.544 -9.497 418 1HD LYS 131 1HD LYS 131 8.843 4.890 -8.143 419 2HD LYS 131 2HD LYS 131 10.294 5.291 -9.065 420 1HE LYS 131 1HE LYS 131 7.964 3.806 -10.252 421 2HE LYS 131 2HE LYS 131 8.079 5.565 -10.266 422 1HZ LYS 131 1HZ LYS 131 10.486 4.385 -11.202 423 2HZ LYS 131 2HZ LYS 131 9.167 3.820 -12.097 424 3HZ LYS 131 3HZ LYS 131 9.459 5.482 -11.981 425 H SER 132 H SER 132 11.657 -0.487 -6.375 426 HA SER 132 HA SER 132 12.757 -1.017 -4.457 427 1HB SER 132 1HB SER 132 13.709 0.718 -3.284 428 2HB SER 132 2HB SER 132 13.172 1.600 -4.713 429 HG SER 132 HG SER 132 12.487 2.707 -2.899 430 H GLY 133 H GLY 133 12.269 -1.997 -2.544 431 1HA GLY 133 1HA GLY 133 9.471 -1.829 -1.712 432 2HA GLY 133 2HA GLY 133 10.608 -3.095 -1.276 433 H THR 134 H THR 134 11.727 0.136 -0.986 434 HA THR 134 HA THR 134 11.814 -0.155 1.905 435 HB THR 134 HB THR 134 12.957 2.033 0.158 436 HG1 THR 134 HG1 THR 134 13.723 -0.300 -0.006 437 1HG2 THR 134 1HG2 THR 134 12.690 2.019 2.900 438 2HG2 THR 134 2HG2 THR 134 14.337 1.448 2.633 439 3HG2 THR 134 3HG2 THR 134 13.821 2.993 1.959 440 H VAL 135 H VAL 135 9.598 0.130 2.390 441 HA VAL 135 HA VAL 135 8.205 2.516 1.624 442 HB VAL 135 HB VAL 135 7.542 0.368 3.637 443 1HG1 VAL 135 1HG1 VAL 135 5.885 2.727 2.750 444 2HG1 VAL 135 2HG1 VAL 135 5.281 1.362 3.692 445 3HG1 VAL 135 3HG1 VAL 135 6.513 2.427 4.371 446 1HG2 VAL 135 1HG2 VAL 135 7.537 0.061 1.020 447 2HG2 VAL 135 2HG2 VAL 135 6.252 -0.616 2.021 448 3HG2 VAL 135 3HG2 VAL 135 5.988 0.897 1.154 449 H LYS 136 H LYS 136 7.966 4.388 2.714 450 HA LYS 136 HA LYS 136 9.670 4.822 5.023 451 1HB LYS 136 1HB LYS 136 8.852 6.397 2.861 452 2HB LYS 136 2HB LYS 136 8.050 7.099 4.259 453 1HG LYS 136 1HG LYS 136 11.006 6.626 3.945 454 2HG LYS 136 2HG LYS 136 10.174 8.180 3.881 455 1HD LYS 136 1HD LYS 136 10.428 6.344 6.258 456 2HD LYS 136 2HD LYS 136 11.171 7.930 6.053 457 1HE LYS 136 1HE LYS 136 8.229 7.322 6.307 458 2HE LYS 136 2HE LYS 136 9.250 8.125 7.499 459 1HZ LYS 136 1HZ LYS 136 9.643 9.855 5.720 460 2HZ LYS 136 2HZ LYS 136 8.361 9.153 4.869 461 3HZ LYS 136 3HZ LYS 136 8.096 9.823 6.401 462 H ALA 137 H ALA 137 6.226 5.074 4.201 463 HA ALA 137 HA ALA 137 5.226 4.145 6.587 464 1HB ALA 137 1HB ALA 137 5.933 7.035 6.691 465 2HB ALA 137 2HB ALA 137 4.462 6.494 7.499 466 3HB ALA 137 3HB ALA 137 6.021 5.804 7.950 467 H ILE 138 H ILE 138 2.902 4.983 7.008 468 HA ILE 138 HA ILE 138 1.641 5.572 4.408 469 HB ILE 138 HB ILE 138 0.667 3.760 6.615 470 1HG1 ILE 138 1HG1 ILE 138 1.257 3.209 3.699 471 2HG1 ILE 138 2HG1 ILE 138 2.340 2.823 5.031 472 1HG2 ILE 138 1HG2 ILE 138 -1.191 5.082 5.762 473 2HG2 ILE 138 2HG2 ILE 138 -0.773 4.625 4.111 474 3HG2 ILE 138 3HG2 ILE 138 -1.331 3.401 5.251 475 1HD1 ILE 138 1HD1 ILE 138 -0.285 1.732 5.486 476 2HD1 ILE 138 2HD1 ILE 138 0.377 1.198 3.941 477 3HD1 ILE 138 3HD1 ILE 138 1.281 0.923 5.430 478 H LEU 139 H LEU 139 -0.405 6.706 4.498 479 HA LEU 139 HA LEU 139 -0.674 8.367 6.920 480 1HB LEU 139 1HB LEU 139 -0.936 9.105 4.017 481 2HB LEU 139 2HB LEU 139 -1.624 10.095 5.290 482 HG LEU 139 HG LEU 139 0.419 11.119 4.835 483 1HD1 LEU 139 1HD1 LEU 139 -0.021 10.195 7.293 484 2HD1 LEU 139 2HD1 LEU 139 1.502 9.370 6.962 485 3HD1 LEU 139 3HD1 LEU 139 1.414 11.129 6.871 486 1HD2 LEU 139 1HD2 LEU 139 1.328 9.371 3.393 487 2HD2 LEU 139 2HD2 LEU 139 2.529 9.924 4.559 488 3HD2 LEU 139 3HD2 LEU 139 1.700 8.388 4.809 489 H VAL 140 H VAL 140 -2.307 6.632 4.351 490 HA VAL 140 HA VAL 140 -4.941 7.388 4.814 491 HB VAL 140 HB VAL 140 -3.938 4.661 3.986 492 1HG1 VAL 140 1HG1 VAL 140 -6.553 5.545 4.608 493 2HG1 VAL 140 2HG1 VAL 140 -6.462 5.341 2.859 494 3HG1 VAL 140 3HG1 VAL 140 -6.055 3.998 3.925 495 1HG2 VAL 140 1HG2 VAL 140 -4.373 7.216 2.527 496 2HG2 VAL 140 2HG2 VAL 140 -3.122 5.992 2.314 497 3HG2 VAL 140 3HG2 VAL 140 -4.750 5.704 1.702 498 H GLU 141 H GLU 141 -2.994 4.903 6.411 499 HA GLU 141 HA GLU 141 -3.192 4.125 8.576 500 1HB GLU 141 1HB GLU 141 -5.986 5.240 8.707 501 2HB GLU 141 2HB GLU 141 -4.909 4.840 10.039 502 1HG GLU 141 1HG GLU 141 -3.683 6.807 8.357 503 2HG GLU 141 2HG GLU 141 -5.299 7.334 8.825 504 H SER 142 H SER 142 -3.197 1.997 8.109 505 HA SER 142 HA SER 142 -4.989 0.547 6.632 506 1HB SER 142 1HB SER 142 -3.153 -0.720 7.180 507 2HB SER 142 2HB SER 142 -3.113 -0.137 8.843 508 HG SER 142 HG SER 142 -4.053 -1.952 9.305 509 H GLY 143 H GLY 143 -6.598 -1.100 7.374 510 1HA GLY 143 1HA GLY 143 -8.486 -1.718 8.536 511 2HA GLY 143 2HA GLY 143 -7.874 -0.802 9.905 512 H GLN 144 H GLN 144 -7.881 1.263 7.337 513 HA GLN 144 HA GLN 144 -10.607 2.199 7.949 514 1HB GLN 144 1HB GLN 144 -8.050 3.571 8.107 515 2HB GLN 144 2HB GLN 144 -9.182 4.419 7.063 516 1HG GLN 144 1HG GLN 144 -10.845 4.125 9.011 517 2HG GLN 144 2HG GLN 144 -9.406 3.798 9.977 518 1HE2 GLN 144 2HE2 GLN 144 -7.796 5.618 8.300 519 2HE2 GLN 144 1HE2 GLN 144 -8.223 7.213 8.810 520 HA PRO 145 HA PRO 145 -11.491 2.178 3.641 521 1HB PRO 145 1HB PRO 145 -13.119 4.325 3.374 522 2HB PRO 145 2HB PRO 145 -13.621 2.846 4.201 523 1HG PRO 145 1HG PRO 145 -12.637 5.425 5.364 524 2HG PRO 145 2HG PRO 145 -13.990 4.404 5.889 525 1HD PRO 145 1HD PRO 145 -11.567 4.366 7.106 526 2HD PRO 145 2HD PRO 145 -12.612 2.935 7.005 527 H VAL 146 H VAL 146 -10.484 2.817 1.830 528 HA VAL 146 HA VAL 146 -8.780 5.180 1.949 529 HB VAL 146 HB VAL 146 -7.700 4.340 -0.034 530 1HG1 VAL 146 1HG1 VAL 146 -7.797 2.984 2.416 531 2HG1 VAL 146 2HG1 VAL 146 -7.809 1.735 1.171 532 3HG1 VAL 146 3HG1 VAL 146 -6.514 2.931 1.208 533 1HG2 VAL 146 1HG2 VAL 146 -9.670 3.537 -1.223 534 2HG2 VAL 146 2HG2 VAL 146 -8.434 2.280 -1.142 535 3HG2 VAL 146 3HG2 VAL 146 -9.836 2.208 -0.075 536 H GLU 147 H GLU 147 -8.917 6.912 0.563 537 HA GLU 147 HA GLU 147 -11.337 7.030 -1.117 538 1HB GLU 147 1HB GLU 147 -11.593 8.518 0.759 539 2HB GLU 147 2HB GLU 147 -9.998 9.211 0.488 540 1HG GLU 147 1HG GLU 147 -10.737 10.615 -1.086 541 2HG GLU 147 2HG GLU 147 -11.798 9.408 -1.809 542 H PHE 148 H PHE 148 -11.201 8.075 -3.116 543 HA PHE 148 HA PHE 148 -8.966 7.662 -4.647 544 1HB PHE 148 1HB PHE 148 -10.865 8.064 -5.896 545 2HB PHE 148 2HB PHE 148 -11.328 9.455 -4.930 546 HD1 PHE 148 HD1 PHE 148 -8.388 8.485 -7.026 547 HD2 PHE 148 HD2 PHE 148 -11.312 11.438 -6.072 548 HE1 PHE 148 HE1 PHE 148 -7.427 9.982 -8.733 549 HE2 PHE 148 HE2 PHE 148 -10.358 12.941 -7.778 550 HZ PHE 148 HZ PHE 148 -8.413 12.213 -9.110 551 H ASP 149 H ASP 149 -6.986 8.465 -4.505 552 HA ASP 149 HA ASP 149 -5.332 10.074 -4.572 553 1HB ASP 149 1HB ASP 149 -7.216 11.658 -5.327 554 2HB ASP 149 2HB ASP 149 -7.306 12.149 -3.638 555 H GLU 150 H GLU 150 -5.331 8.427 -2.572 556 HA GLU 150 HA GLU 150 -4.813 10.105 -0.215 557 1HB GLU 150 1HB GLU 150 -6.910 8.328 -0.361 558 2HB GLU 150 2HB GLU 150 -5.655 7.369 0.410 559 1HG GLU 150 1HG GLU 150 -6.415 8.278 2.299 560 2HG GLU 150 2HG GLU 150 -5.483 9.691 1.805 561 HA PRO 151 HA PRO 151 -0.732 8.365 -0.705 562 1HB PRO 151 1HB PRO 151 -0.633 9.114 2.180 563 2HB PRO 151 2HB PRO 151 0.514 9.473 0.885 564 1HG PRO 151 1HG PRO 151 -1.141 11.352 1.785 565 2HG PRO 151 2HG PRO 151 -0.764 11.224 0.057 566 1HD PRO 151 1HD PRO 151 -3.234 10.423 1.523 567 2HD PRO 151 2HD PRO 151 -3.055 11.079 -0.117 568 H LEU 152 H LEU 152 -1.583 6.202 -0.899 569 HA LEU 152 HA LEU 152 -2.345 4.618 1.302 570 1HB LEU 152 1HB LEU 152 -1.167 3.773 -1.347 571 2HB LEU 152 2HB LEU 152 -1.962 2.703 -0.206 572 HG LEU 152 HG LEU 152 -3.276 4.996 -1.668 573 1HD1 LEU 152 1HD1 LEU 152 -3.006 2.100 -2.215 574 2HD1 LEU 152 2HD1 LEU 152 -4.582 2.835 -2.508 575 3HD1 LEU 152 3HD1 LEU 152 -3.152 3.458 -3.329 576 1HD2 LEU 152 1HD2 LEU 152 -4.007 3.960 0.750 577 2HD2 LEU 152 2HD2 LEU 152 -5.102 4.725 -0.401 578 3HD2 LEU 152 3HD2 LEU 152 -4.939 2.969 -0.373 579 H VAL 153 H VAL 153 0.754 4.842 -0.440 580 HA VAL 153 HA VAL 153 2.182 4.210 2.002 581 HB VAL 153 HB VAL 153 2.822 2.498 -0.375 582 1HG1 VAL 153 1HG1 VAL 153 3.278 2.221 2.594 583 2HG1 VAL 153 2HG1 VAL 153 3.734 1.020 1.385 584 3HG1 VAL 153 3HG1 VAL 153 4.484 2.615 1.369 585 1HG2 VAL 153 1HG2 VAL 153 0.765 1.921 1.750 586 2HG2 VAL 153 2HG2 VAL 153 0.515 2.000 0.007 587 3HG2 VAL 153 3HG2 VAL 153 1.471 0.691 0.702 588 H VAL 154 H VAL 154 3.945 5.440 2.096 589 HA VAL 154 HA VAL 154 4.932 6.651 -0.386 590 HB VAL 154 HB VAL 154 5.805 8.433 0.873 591 1HG1 VAL 154 1HG1 VAL 154 3.106 7.508 1.690 592 2HG1 VAL 154 2HG1 VAL 154 3.805 8.871 2.564 593 3HG1 VAL 154 3HG1 VAL 154 3.591 8.961 0.816 594 1HG2 VAL 154 1HG2 VAL 154 5.657 6.522 3.158 595 2HG2 VAL 154 2HG2 VAL 154 6.979 7.573 2.651 596 3HG2 VAL 154 3HG2 VAL 154 5.581 8.253 3.484 597 H ILE 155 H ILE 155 6.768 5.961 -1.242 598 HA ILE 155 HA ILE 155 8.448 4.109 0.214 599 HB ILE 155 HB ILE 155 8.794 5.186 -2.586 600 1HG1 ILE 155 1HG1 ILE 155 6.662 4.013 -2.350 601 2HG1 ILE 155 2HG1 ILE 155 7.787 3.061 -3.315 602 1HG2 ILE 155 1HG2 ILE 155 10.178 3.078 -0.988 603 2HG2 ILE 155 2HG2 ILE 155 10.056 2.913 -2.738 604 3HG2 ILE 155 3HG2 ILE 155 10.859 4.318 -2.040 605 1HD1 ILE 155 1HD1 ILE 155 7.189 2.616 -0.398 606 2HD1 ILE 155 2HD1 ILE 155 6.516 1.690 -1.740 607 3HD1 ILE 155 3HD1 ILE 155 8.247 1.634 -1.411 608 H GLU 156 H GLU 156 10.807 4.355 0.247 609 HA GLU 156 HA GLU 156 11.523 7.031 1.099 610 1HB GLU 156 1HB GLU 156 12.145 4.722 2.200 611 2HB GLU 156 2HB GLU 156 13.467 4.759 1.040 612 1HG GLU 156 1HG GLU 156 14.053 7.030 1.949 613 2HG GLU 156 2HG GLU 156 12.887 6.724 3.236 614 1H10 BTN 222 1H10 BTN 122 -11.403 -10.765 3.617 615 2H10 BTN 222 2H10 BTN 122 -12.778 -11.211 4.626 616 1H9 BTN 222 1H9 BTN 122 -12.559 -9.380 5.986 617 2H9 BTN 222 2H9 BTN 122 -11.792 -8.405 4.732 618 1H8 BTN 222 1H8 BTN 122 -10.555 -10.619 6.355 619 2H8 BTN 222 2H8 BTN 122 -10.126 -8.907 6.360 620 1H7 BTN 222 1H7 BTN 122 -9.719 -9.363 3.797 621 2H7 BTN 222 2H7 BTN 122 -9.517 -11.017 4.355 622 H2 BTN 222 H2 BTN 122 -7.695 -10.364 5.814 623 1H6 BTN 222 1H6 BTN 122 -6.855 -6.431 3.983 624 2H6 BTN 222 2H6 BTN 122 -8.420 -7.075 3.508 625 H5 BTN 222 H5 BTN 122 -5.727 -8.240 3.119 626 HN1 BTN 222 HN2 BTN 122 -7.375 -7.913 1.201 627 HN2 BTN 222 HN1 BTN 122 -8.031 -11.442 2.917 628 H4 BTN 222 H4 BTN 122 -6.122 -10.264 4.145 Start of MODEL 18 1 1H GLU 77 H GLU 77 18.227 16.298 -3.175 2 HA GLU 77 HA GLU 77 16.639 16.067 -1.564 3 1HB GLU 77 1HB GLU 77 16.497 18.457 -1.494 4 2HB GLU 77 2HB GLU 77 15.526 18.500 -2.962 5 1HG GLU 77 1HG GLU 77 13.665 18.356 -1.784 6 2HG GLU 77 2HG GLU 77 14.220 16.870 -1.015 7 H ILE 78 H ILE 78 16.361 14.169 -3.290 8 HA ILE 78 HA ILE 78 14.096 14.003 -4.891 9 HB ILE 78 HB ILE 78 14.330 11.614 -4.801 10 1HG1 ILE 78 1HG1 ILE 78 16.430 11.736 -2.683 11 2HG1 ILE 78 2HG1 ILE 78 14.742 11.793 -2.185 12 1HG2 ILE 78 1HG2 ILE 78 16.418 13.385 -5.415 13 2HG2 ILE 78 2HG2 ILE 78 17.161 11.998 -4.619 14 3HG2 ILE 78 3HG2 ILE 78 16.157 11.760 -6.050 15 1HD1 ILE 78 1HD1 ILE 78 14.655 9.697 -3.856 16 2HD1 ILE 78 2HD1 ILE 78 16.320 9.570 -3.290 17 3HD1 ILE 78 3HD1 ILE 78 14.991 9.561 -2.130 18 H SER 79 H SER 79 12.276 12.348 -4.404 19 HA SER 79 HA SER 79 11.244 12.798 -1.684 20 1HB SER 79 1HB SER 79 9.973 14.303 -2.986 21 2HB SER 79 2HB SER 79 9.830 13.160 -4.321 22 HG SER 79 HG SER 79 7.966 13.481 -2.787 23 H GLY 80 H GLY 80 12.578 10.501 -3.140 24 1HA GLY 80 1HA GLY 80 12.370 8.218 -3.276 25 2HA GLY 80 2HA GLY 80 11.270 8.388 -1.917 26 H HIS 81 H HIS 81 9.328 7.556 -2.239 27 HA HIS 81 HA HIS 81 8.017 7.886 -4.820 28 1HB HIS 81 1HB HIS 81 7.991 5.145 -3.606 29 2HB HIS 81 2HB HIS 81 7.671 5.627 -5.268 30 HD1 HIS 81 HD1 HIS 81 10.726 6.033 -3.022 31 HD2 HIS 81 HD2 HIS 81 9.663 4.644 -6.791 32 HE1 HIS 81 HE1 HIS 81 12.877 5.300 -4.100 33 HE2 HIS 81 HE2 HIS 81 12.221 4.557 -6.416 34 H ILE 82 H ILE 82 5.879 8.230 -4.625 35 HA ILE 82 HA ILE 82 4.620 7.630 -2.028 36 HB ILE 82 HB ILE 82 4.218 10.100 -3.722 37 1HG1 ILE 82 1HG1 ILE 82 5.054 11.281 -1.715 38 2HG1 ILE 82 2HG1 ILE 82 5.332 9.729 -0.930 39 1HG2 ILE 82 1HG2 ILE 82 2.311 8.838 -2.199 40 2HG2 ILE 82 2HG2 ILE 82 2.962 10.049 -1.095 41 3HG2 ILE 82 3HG2 ILE 82 2.307 10.542 -2.656 42 1HD1 ILE 82 1HD1 ILE 82 6.615 9.980 -3.540 43 2HD1 ILE 82 2HD1 ILE 82 7.182 11.140 -2.338 44 3HD1 ILE 82 3HD1 ILE 82 7.261 9.410 -2.001 45 H VAL 83 H VAL 83 3.584 5.781 -2.730 46 HA VAL 83 HA VAL 83 1.929 5.880 -5.120 47 HB VAL 83 HB VAL 83 1.902 3.547 -3.257 48 1HG1 VAL 83 1HG1 VAL 83 0.535 3.676 -5.352 49 2HG1 VAL 83 2HG1 VAL 83 2.045 3.674 -6.263 50 3HG1 VAL 83 3HG1 VAL 83 1.618 2.287 -5.261 51 1HG2 VAL 83 1HG2 VAL 83 4.269 4.574 -4.709 52 2HG2 VAL 83 2HG2 VAL 83 4.171 3.616 -3.232 53 3HG2 VAL 83 3HG2 VAL 83 3.963 2.839 -4.802 54 H ARG 84 H ARG 84 -0.144 6.425 -5.099 55 HA ARG 84 HA ARG 84 -1.557 6.492 -2.526 56 1HB ARG 84 1HB ARG 84 -3.210 7.907 -3.945 57 2HB ARG 84 2HB ARG 84 -1.694 8.629 -3.423 58 1HG ARG 84 1HG ARG 84 -1.869 7.298 -6.089 59 2HG ARG 84 2HG ARG 84 -2.495 8.934 -5.868 60 1HD ARG 84 1HD ARG 84 0.156 8.539 -4.715 61 2HD ARG 84 2HD ARG 84 0.107 8.269 -6.456 62 HE ARG 84 HE ARG 84 0.045 10.761 -5.171 63 1HH1 ARG 84 1HH1 ARG 84 -1.545 9.046 -7.750 64 2HH1 ARG 84 2HH1 ARG 84 -1.921 10.479 -8.647 65 1HH2 ARG 84 1HH2 ARG 84 -0.445 12.655 -6.342 66 2HH2 ARG 84 2HH2 ARG 84 -1.295 12.531 -7.846 67 H SER 85 H SER 85 -4.004 6.145 -2.769 68 HA SER 85 HA SER 85 -4.400 3.684 -4.329 69 1HB SER 85 1HB SER 85 -4.689 3.914 -1.688 70 2HB SER 85 2HB SER 85 -6.297 4.458 -2.165 71 HG SER 85 HG SER 85 -5.100 1.951 -2.448 72 HA PRO 86 HA PRO 86 -7.146 6.208 -6.811 73 1HB PRO 86 1HB PRO 86 -7.818 4.263 -8.574 74 2HB PRO 86 2HB PRO 86 -6.268 5.110 -8.632 75 1HG PRO 86 1HG PRO 86 -6.916 2.421 -7.488 76 2HG PRO 86 2HG PRO 86 -5.522 2.914 -8.467 77 1HD PRO 86 1HD PRO 86 -5.405 2.648 -5.768 78 2HD PRO 86 2HD PRO 86 -4.416 3.819 -6.663 79 H MET 87 H MET 87 -9.237 6.649 -6.497 80 HA MET 87 HA MET 87 -11.433 6.448 -5.938 81 1HB MET 87 1HB MET 87 -11.645 4.801 -7.663 82 2HB MET 87 2HB MET 87 -10.891 3.568 -6.661 83 1HG MET 87 1HG MET 87 -12.785 3.469 -5.223 84 2HG MET 87 2HG MET 87 -13.508 4.884 -5.985 85 1HE MET 87 1HE MET 87 -11.881 1.614 -6.713 86 2HE MET 87 2HE MET 87 -13.040 0.692 -7.670 87 3HE MET 87 3HE MET 87 -11.973 1.854 -8.458 88 H VAL 88 H VAL 88 -12.905 5.552 -4.266 89 HA VAL 88 HA VAL 88 -11.511 5.317 -1.774 90 HB VAL 88 HB VAL 88 -14.472 5.007 -2.284 91 1HG1 VAL 88 1HG1 VAL 88 -13.216 4.343 -0.037 92 2HG1 VAL 88 2HG1 VAL 88 -13.364 6.076 0.250 93 3HG1 VAL 88 3HG1 VAL 88 -14.807 5.103 -0.037 94 1HG2 VAL 88 1HG2 VAL 88 -13.491 7.153 -3.130 95 2HG2 VAL 88 2HG2 VAL 88 -14.714 7.344 -1.875 96 3HG2 VAL 88 3HG2 VAL 88 -13.006 7.511 -1.472 97 H GLY 89 H GLY 89 -11.444 3.578 -0.363 98 1HA GLY 89 1HA GLY 89 -12.753 1.093 -0.944 99 2HA GLY 89 2HA GLY 89 -11.041 1.051 -1.340 100 H THR 90 H THR 90 -10.396 -0.380 0.215 101 HA THR 90 HA THR 90 -10.391 0.656 2.950 102 HB THR 90 HB THR 90 -11.117 -2.204 2.295 103 HG1 THR 90 HG1 THR 90 -13.039 -1.436 2.045 104 1HG2 THR 90 1HG2 THR 90 -10.170 -1.083 4.678 105 2HG2 THR 90 2HG2 THR 90 -11.904 -1.317 4.894 106 3HG2 THR 90 3HG2 THR 90 -10.881 -2.678 4.437 107 H PHE 91 H PHE 91 -8.308 0.871 3.413 108 HA PHE 91 HA PHE 91 -6.287 -0.730 2.149 109 1HB PHE 91 1HB PHE 91 -6.044 1.710 2.803 110 2HB PHE 91 2HB PHE 91 -5.910 1.162 4.473 111 HD1 PHE 91 HD1 PHE 91 -4.459 0.098 1.192 112 HD2 PHE 91 HD2 PHE 91 -3.760 1.182 5.256 113 HE1 PHE 91 HE1 PHE 91 -2.043 -0.272 0.870 114 HE2 PHE 91 HE2 PHE 91 -1.343 0.815 4.943 115 HZ PHE 91 HZ PHE 91 -0.483 0.087 2.748 116 H TYR 92 H TYR 92 -4.490 -1.648 3.619 117 HA TYR 92 HA TYR 92 -5.209 -2.660 6.171 118 1HB TYR 92 1HB TYR 92 -5.516 -4.451 3.790 119 2HB TYR 92 2HB TYR 92 -5.125 -5.113 5.373 120 HD1 TYR 92 HD1 TYR 92 -6.741 -3.746 7.256 121 HD2 TYR 92 HD2 TYR 92 -7.726 -4.824 3.251 122 HE1 TYR 92 HE1 TYR 92 -9.133 -3.738 7.848 123 HE2 TYR 92 HE2 TYR 92 -10.120 -4.817 3.831 124 HH TYR 92 HH TYR 92 -11.508 -5.102 5.927 125 H ARG 93 H ARG 93 -3.575 -4.249 6.987 126 HA ARG 93 HA ARG 93 -0.982 -3.868 5.639 127 1HB ARG 93 1HB ARG 93 -1.302 -4.143 8.621 128 2HB ARG 93 2HB ARG 93 0.105 -3.588 7.724 129 1HG ARG 93 1HG ARG 93 -1.969 -1.838 7.041 130 2HG ARG 93 2HG ARG 93 -2.088 -2.079 8.786 131 1HD ARG 93 1HD ARG 93 0.659 -1.744 7.961 132 2HD ARG 93 2HD ARG 93 -0.333 -0.387 7.427 133 HE ARG 93 HE ARG 93 -0.659 0.221 9.633 134 1HH1 ARG 93 1HH1 ARG 93 0.951 -2.860 9.450 135 2HH1 ARG 93 2HH1 ARG 93 1.368 -2.889 11.130 136 1HH2 ARG 93 1HH2 ARG 93 -0.114 0.195 11.847 137 2HH2 ARG 93 2HH2 ARG 93 0.762 -1.151 12.494 138 H THR 94 H THR 94 -3.078 -5.989 7.462 139 HA THR 94 HA THR 94 -1.385 -8.253 6.663 140 HB THR 94 HB THR 94 -2.082 -9.342 8.859 141 HG1 THR 94 HG1 THR 94 -3.460 -8.202 9.944 142 1HG2 THR 94 1HG2 THR 94 -0.164 -7.076 8.673 143 2HG2 THR 94 2HG2 THR 94 -0.481 -7.826 10.238 144 3HG2 THR 94 3HG2 THR 94 0.139 -8.799 8.903 145 HA PRO 95 HA PRO 95 -5.611 -9.033 5.106 146 1HB PRO 95 1HB PRO 95 -4.793 -10.577 3.027 147 2HB PRO 95 2HB PRO 95 -4.826 -8.811 2.958 148 1HG PRO 95 1HG PRO 95 -2.514 -10.644 3.470 149 2HG PRO 95 2HG PRO 95 -2.588 -9.192 2.455 150 1HD PRO 95 1HD PRO 95 -1.519 -9.179 4.943 151 2HD PRO 95 2HD PRO 95 -2.348 -7.770 4.253 152 H SER 96 H SER 96 -6.290 -11.401 4.096 153 HA SER 96 HA SER 96 -7.140 -13.355 5.014 154 1HB SER 96 1HB SER 96 -5.815 -14.840 3.995 155 2HB SER 96 2HB SER 96 -4.582 -13.585 3.842 156 HG SER 96 HG SER 96 -3.555 -15.076 4.999 157 HA PRO 97 HA PRO 97 -7.073 -12.584 9.489 158 1HB PRO 97 1HB PRO 97 -8.268 -15.307 9.087 159 2HB PRO 97 2HB PRO 97 -8.766 -14.020 10.193 160 1HG PRO 97 1HG PRO 97 -9.991 -14.456 7.812 161 2HG PRO 97 2HG PRO 97 -9.869 -12.853 8.554 162 1HD PRO 97 1HD PRO 97 -8.576 -13.859 6.146 163 2HD PRO 97 2HD PRO 97 -8.661 -12.196 6.751 164 H ASP 98 H ASP 98 -4.771 -12.744 9.538 165 HA ASP 98 HA ASP 98 -3.032 -13.682 10.781 166 1HB ASP 98 1HB ASP 98 -4.192 -16.415 10.234 167 2HB ASP 98 2HB ASP 98 -2.988 -15.972 11.440 168 H ALA 99 H ALA 99 -3.027 -12.909 8.143 169 HA ALA 99 HA ALA 99 -1.878 -14.939 6.468 170 1HB ALA 99 1HB ALA 99 -3.219 -13.015 5.614 171 2HB ALA 99 2HB ALA 99 -1.872 -11.955 6.032 172 3HB ALA 99 3HB ALA 99 -1.657 -13.216 4.819 173 H LYS 100 H LYS 100 0.130 -13.027 5.336 174 HA LYS 100 HA LYS 100 2.244 -13.530 7.318 175 1HB LYS 100 1HB LYS 100 2.165 -14.474 4.813 176 2HB LYS 100 2HB LYS 100 2.935 -12.926 4.493 177 1HG LYS 100 1HG LYS 100 4.733 -14.337 4.807 178 2HG LYS 100 2HG LYS 100 4.545 -13.593 6.397 179 1HD LYS 100 1HD LYS 100 4.829 -15.876 6.847 180 2HD LYS 100 2HD LYS 100 3.087 -15.616 6.972 181 1HE LYS 100 1HE LYS 100 3.113 -16.272 4.439 182 2HE LYS 100 2HE LYS 100 4.655 -17.021 4.854 183 1HZ LYS 100 1HZ LYS 100 2.224 -17.568 6.438 184 2HZ LYS 100 2HZ LYS 100 2.545 -18.428 5.017 185 3HZ LYS 100 3HZ LYS 100 3.634 -18.492 6.311 186 H ALA 101 H ALA 101 0.366 -11.132 6.838 187 HA ALA 101 HA ALA 101 0.469 -8.866 7.016 188 1HB ALA 101 1HB ALA 101 2.180 -9.753 8.814 189 2HB ALA 101 2HB ALA 101 3.347 -8.955 7.760 190 3HB ALA 101 3HB ALA 101 2.024 -8.030 8.469 191 H PHE 102 H PHE 102 0.679 -7.268 5.569 192 HA PHE 102 HA PHE 102 2.128 -7.730 3.154 193 1HB PHE 102 1HB PHE 102 0.200 -5.763 4.166 194 2HB PHE 102 2HB PHE 102 1.392 -5.079 3.067 195 HD1 PHE 102 HD1 PHE 102 1.838 -6.797 0.968 196 HD2 PHE 102 HD2 PHE 102 -1.779 -6.348 3.182 197 HE1 PHE 102 HE1 PHE 102 0.558 -7.655 -0.956 198 HE2 PHE 102 HE2 PHE 102 -3.065 -7.207 1.263 199 HZ PHE 102 HZ PHE 102 -1.896 -7.861 -0.810 200 H ILE 103 H ILE 103 3.139 -5.282 2.430 201 HA ILE 103 HA ILE 103 5.686 -5.317 3.699 202 HB ILE 103 HB ILE 103 4.612 -3.203 1.832 203 1HG1 ILE 103 1HG1 ILE 103 4.334 -5.243 0.664 204 2HG1 ILE 103 2HG1 ILE 103 5.864 -4.591 0.091 205 1HG2 ILE 103 1HG2 ILE 103 6.869 -3.079 3.256 206 2HG2 ILE 103 2HG2 ILE 103 7.460 -3.994 1.869 207 3HG2 ILE 103 3HG2 ILE 103 6.722 -2.409 1.632 208 1HD1 ILE 103 1HD1 ILE 103 6.959 -6.078 1.841 209 2HD1 ILE 103 2HD1 ILE 103 5.392 -6.879 1.962 210 3HD1 ILE 103 3HD1 ILE 103 6.259 -6.865 0.426 211 H GLU 104 H GLU 104 4.967 -4.911 5.914 212 HA GLU 104 HA GLU 104 3.714 -2.583 6.785 213 1HB GLU 104 1HB GLU 104 5.116 -4.788 7.972 214 2HB GLU 104 2HB GLU 104 5.607 -3.290 8.755 215 1HG GLU 104 1HG GLU 104 3.478 -2.845 9.531 216 2HG GLU 104 2HG GLU 104 2.711 -3.875 8.323 217 H VAL 105 H VAL 105 4.533 -0.661 7.730 218 HA VAL 105 HA VAL 105 6.515 0.639 6.250 219 HB VAL 105 HB VAL 105 5.366 1.318 8.959 220 1HG1 VAL 105 1HG1 VAL 105 7.130 2.966 7.151 221 2HG1 VAL 105 2HG1 VAL 105 6.244 3.599 8.540 222 3HG1 VAL 105 3HG1 VAL 105 7.512 2.395 8.776 223 1HG2 VAL 105 1HG2 VAL 105 4.761 2.296 6.170 224 2HG2 VAL 105 2HG2 VAL 105 3.710 1.339 7.214 225 3HG2 VAL 105 3HG2 VAL 105 4.100 3.004 7.645 226 H GLY 106 H GLY 106 8.593 1.432 6.883 227 1HA GLY 106 1HA GLY 106 10.576 1.426 8.127 228 2HA GLY 106 2HA GLY 106 9.871 0.227 9.202 229 H GLN 107 H GLN 107 9.104 -1.222 6.555 230 HA GLN 107 HA GLN 107 11.594 -2.745 6.435 231 1HB GLN 107 1HB GLN 107 9.591 -4.036 6.843 232 2HB GLN 107 2HB GLN 107 8.810 -3.349 5.426 233 1HG GLN 107 1HG GLN 107 10.349 -4.482 3.968 234 2HG GLN 107 2HG GLN 107 11.276 -5.071 5.347 235 1HE2 GLN 107 2HE2 GLN 107 8.204 -5.284 3.671 236 2HE2 GLN 107 1HE2 GLN 107 7.766 -6.843 4.273 237 H LYS 108 H LYS 108 12.175 -3.657 4.228 238 HA LYS 108 HA LYS 108 12.225 -1.439 2.327 239 1HB LYS 108 1HB LYS 108 14.186 -2.320 1.475 240 2HB LYS 108 2HB LYS 108 14.291 -2.801 3.163 241 1HG LYS 108 1HG LYS 108 14.765 -4.812 2.300 242 2HG LYS 108 2HG LYS 108 13.013 -4.940 2.125 243 1HD LYS 108 1HD LYS 108 13.414 -5.315 -0.043 244 2HD LYS 108 2HD LYS 108 13.764 -3.589 -0.151 245 1HE LYS 108 1HE LYS 108 15.847 -5.642 0.557 246 2HE LYS 108 2HE LYS 108 15.513 -5.152 -1.103 247 1HZ LYS 108 1HZ LYS 108 15.988 -2.838 -0.400 248 2HZ LYS 108 2HZ LYS 108 16.480 -3.426 1.108 249 3HZ LYS 108 3HZ LYS 108 17.326 -3.868 -0.288 250 H VAL 109 H VAL 109 12.101 -2.004 -0.021 251 HA VAL 109 HA VAL 109 10.379 -4.293 -0.605 252 HB VAL 109 HB VAL 109 9.003 -2.703 -2.105 253 1HG1 VAL 109 1HG1 VAL 109 8.744 -2.764 0.895 254 2HG1 VAL 109 2HG1 VAL 109 7.493 -2.150 -0.184 255 3HG1 VAL 109 3HG1 VAL 109 7.984 -3.841 -0.276 256 1HG2 VAL 109 1HG2 VAL 109 10.372 -0.778 -0.257 257 2HG2 VAL 109 2HG2 VAL 109 10.157 -0.678 -2.005 258 3HG2 VAL 109 3HG2 VAL 109 8.781 -0.426 -0.931 259 H ASN 110 H ASN 110 11.507 -5.357 -2.095 260 HA ASN 110 HA ASN 110 13.075 -3.872 -4.065 261 1HB ASN 110 1HB ASN 110 13.770 -6.336 -4.655 262 2HB ASN 110 2HB ASN 110 14.432 -5.548 -3.225 263 1HD2 ASN 110 2HD2 ASN 110 14.617 -6.996 -1.682 264 2HD2 ASN 110 1HD2 ASN 110 13.424 -8.162 -1.230 265 H VAL 111 H VAL 111 12.603 -3.804 -6.190 266 HA VAL 111 HA VAL 111 10.091 -4.100 -7.189 267 HB VAL 111 HB VAL 111 12.683 -4.482 -8.689 268 1HG1 VAL 111 1HG1 VAL 111 9.862 -4.162 -9.675 269 2HG1 VAL 111 2HG1 VAL 111 11.266 -3.792 -10.674 270 3HG1 VAL 111 3HG1 VAL 111 11.022 -5.430 -10.069 271 1HG2 VAL 111 1HG2 VAL 111 10.958 -2.099 -8.088 272 2HG2 VAL 111 2HG2 VAL 111 12.678 -2.321 -7.770 273 3HG2 VAL 111 3HG2 VAL 111 12.107 -2.107 -9.426 274 H GLY 112 H GLY 112 8.852 -5.861 -6.941 275 1HA GLY 112 1HA GLY 112 8.538 -7.976 -8.375 276 2HA GLY 112 2HA GLY 112 10.014 -8.493 -7.573 277 H ASP 113 H ASP 113 8.628 -6.753 -5.267 278 HA ASP 113 HA ASP 113 7.269 -9.092 -4.127 279 1HB ASP 113 1HB ASP 113 9.092 -7.134 -3.066 280 2HB ASP 113 2HB ASP 113 7.598 -7.132 -2.136 281 H THR 114 H THR 114 5.336 -8.748 -2.845 282 HA THR 114 HA THR 114 3.396 -7.223 -4.190 283 HB THR 114 HB THR 114 2.767 -7.882 -1.399 284 HG1 THR 114 HG1 THR 114 3.299 -9.924 -1.426 285 1HG2 THR 114 1HG2 THR 114 1.092 -7.449 -3.203 286 2HG2 THR 114 2HG2 THR 114 1.577 -8.982 -3.927 287 3HG2 THR 114 3HG2 THR 114 0.866 -8.955 -2.314 288 H LEU 115 H LEU 115 1.905 -6.076 -2.077 289 HA LEU 115 HA LEU 115 3.539 -4.097 -0.767 290 1HB LEU 115 1HB LEU 115 3.213 -3.316 -3.175 291 2HB LEU 115 2HB LEU 115 1.520 -3.105 -2.768 292 HG LEU 115 HG LEU 115 2.934 -1.752 -0.759 293 1HD1 LEU 115 1HD1 LEU 115 4.932 -1.857 -2.165 294 2HD1 LEU 115 2HD1 LEU 115 4.041 -1.103 -3.487 295 3HD1 LEU 115 3HD1 LEU 115 4.340 -0.204 -2.000 296 1HD2 LEU 115 1HD2 LEU 115 0.747 -1.303 -2.142 297 2HD2 LEU 115 2HD2 LEU 115 1.643 0.027 -1.407 298 3HD2 LEU 115 3HD2 LEU 115 1.832 -0.319 -3.126 299 H CYS 116 H CYS 116 0.170 -4.164 -1.931 300 HA CYS 116 HA CYS 116 -1.000 -4.983 0.472 301 1HB CYS 116 1HB CYS 116 -0.337 -2.113 0.298 302 2HB CYS 116 2HB CYS 116 -1.988 -2.468 0.793 303 HG CYS 116 HG CYS 116 0.358 -2.603 2.580 304 H ILE 117 H ILE 117 -3.334 -4.811 0.456 305 HA ILE 117 HA ILE 117 -4.364 -4.512 -2.280 306 HB ILE 117 HB ILE 117 -5.359 -6.096 0.084 307 1HG1 ILE 117 1HG1 ILE 117 -5.204 -7.346 -2.557 308 2HG1 ILE 117 2HG1 ILE 117 -3.651 -6.739 -1.987 309 1HG2 ILE 117 1HG2 ILE 117 -7.289 -5.011 -0.931 310 2HG2 ILE 117 2HG2 ILE 117 -6.801 -5.607 -2.518 311 3HG2 ILE 117 3HG2 ILE 117 -7.296 -6.743 -1.262 312 1HD1 ILE 117 1HD1 ILE 117 -4.479 -8.004 0.225 313 2HD1 ILE 117 2HD1 ILE 117 -5.291 -8.974 -1.004 314 3HD1 ILE 117 3HD1 ILE 117 -3.540 -8.779 -1.050 315 H VAL 118 H VAL 118 -6.367 -3.465 -2.651 316 HA VAL 118 HA VAL 118 -6.916 -1.330 -0.718 317 HB VAL 118 HB VAL 118 -8.015 -1.460 -3.515 318 1HG1 VAL 118 1HG1 VAL 118 -8.989 0.178 -1.988 319 2HG1 VAL 118 2HG1 VAL 118 -7.387 0.841 -1.669 320 3HG1 VAL 118 3HG1 VAL 118 -8.089 0.969 -3.281 321 1HG2 VAL 118 1HG2 VAL 118 -5.401 -1.661 -3.238 322 2HG2 VAL 118 2HG2 VAL 118 -6.112 -0.610 -4.463 323 3HG2 VAL 118 3HG2 VAL 118 -5.529 0.073 -2.945 324 H GLU 119 H GLU 119 -8.318 -4.123 -2.218 325 HA GLU 119 HA GLU 119 -10.436 -5.014 -2.185 326 1HB GLU 119 1HB GLU 119 -9.459 -5.564 0.037 327 2HB GLU 119 2HB GLU 119 -10.222 -4.123 0.697 328 1HG GLU 119 1HG GLU 119 -12.407 -5.186 -0.225 329 2HG GLU 119 2HG GLU 119 -11.465 -6.677 -0.211 330 H ALA 120 H ALA 120 -10.933 -2.882 -3.463 331 HA ALA 120 HA ALA 120 -12.749 -1.112 -2.039 332 1HB ALA 120 1HB ALA 120 -11.006 -0.602 -4.010 333 2HB ALA 120 2HB ALA 120 -12.460 -0.879 -4.970 334 3HB ALA 120 3HB ALA 120 -12.450 0.369 -3.723 335 H MET 121 H MET 121 -12.930 -4.016 -3.735 336 HA MET 121 HA MET 121 -15.775 -4.079 -3.575 337 1HB MET 121 1HB MET 121 -16.403 -4.046 -5.812 338 2HB MET 121 2HB MET 121 -15.190 -2.775 -5.740 339 1HG MET 121 1HG MET 121 -13.546 -4.656 -6.431 340 2HG MET 121 2HG MET 121 -15.006 -5.496 -6.949 341 1HE MET 121 1HE MET 121 -16.823 -3.276 -7.635 342 2HE MET 121 2HE MET 121 -15.910 -1.770 -7.570 343 3HE MET 121 3HE MET 121 -16.453 -2.404 -9.123 344 H LYS 122 H LYS 122 -13.545 -5.606 -2.616 345 HA LYS 122 HA LYS 122 -13.047 -7.791 -2.212 346 1HB LYS 122 1HB LYS 122 -15.678 -7.891 -3.442 347 2HB LYS 122 2HB LYS 122 -14.729 -9.323 -3.818 348 1HG LYS 122 1HG LYS 122 -15.587 -8.298 -1.137 349 2HG LYS 122 2HG LYS 122 -15.902 -9.870 -1.875 350 1HD LYS 122 1HD LYS 122 -14.202 -10.560 -0.572 351 2HD LYS 122 2HD LYS 122 -13.188 -9.851 -1.831 352 1HE LYS 122 1HE LYS 122 -12.294 -8.820 -0.003 353 2HE LYS 122 2HE LYS 122 -13.564 -7.662 -0.400 354 H MET 123 H MET 123 -12.369 -6.201 -4.834 355 HA MET 123 HA MET 123 -11.643 -8.317 -6.652 356 1HB MET 123 1HB MET 123 -10.929 -6.631 -8.118 357 2HB MET 123 2HB MET 123 -12.292 -5.911 -7.272 358 1HG MET 123 1HG MET 123 -10.431 -5.010 -5.671 359 2HG MET 123 2HG MET 123 -9.389 -5.296 -7.062 360 1HE MET 123 1HE MET 123 -9.972 -2.855 -5.405 361 2HE MET 123 2HE MET 123 -9.272 -1.990 -6.774 362 3HE MET 123 3HE MET 123 -10.869 -1.544 -6.172 363 H MET 124 H MET 124 -10.267 -6.877 -3.904 364 HA MET 124 HA MET 124 -8.277 -7.126 -2.847 365 1HB MET 124 1HB MET 124 -8.233 -9.442 -4.751 366 2HB MET 124 2HB MET 124 -6.819 -9.086 -3.768 367 1HG MET 124 1HG MET 124 -8.367 -10.798 -2.822 368 2HG MET 124 2HG MET 124 -8.015 -9.438 -1.758 369 1HE MET 124 1HE MET 124 -9.906 -10.985 -0.742 370 2HE MET 124 2HE MET 124 -10.508 -9.445 -0.127 371 3HE MET 124 3HE MET 124 -11.615 -10.578 -0.903 372 H ASN 125 H ASN 125 -8.132 -5.001 -4.254 373 HA ASN 125 HA ASN 125 -6.333 -4.919 -6.422 374 1HB ASN 125 1HB ASN 125 -7.961 -3.110 -5.776 375 2HB ASN 125 2HB ASN 125 -6.878 -2.692 -4.449 376 1HD2 ASN 125 2HD2 ASN 125 -7.459 -0.767 -6.191 377 2HD2 ASN 125 1HD2 ASN 125 -6.117 -0.431 -7.224 378 H GLN 126 H GLN 126 -4.836 -6.518 -5.269 379 HA GLN 126 HA GLN 126 -3.094 -5.478 -3.250 380 1HB GLN 126 1HB GLN 126 -2.000 -7.555 -3.325 381 2HB GLN 126 2HB GLN 126 -3.683 -7.927 -3.673 382 1HG GLN 126 1HG GLN 126 -2.821 -7.612 -6.168 383 2HG GLN 126 2HG GLN 126 -1.298 -8.087 -5.416 384 1HE2 GLN 126 2HE2 GLN 126 -0.966 -10.140 -5.891 385 2HE2 GLN 126 1HE2 GLN 126 -2.121 -11.416 -5.744 386 H ILE 127 H ILE 127 -1.472 -4.125 -3.546 387 HA ILE 127 HA ILE 127 -0.482 -3.608 -6.231 388 HB ILE 127 HB ILE 127 0.007 -2.239 -3.588 389 1HG1 ILE 127 1HG1 ILE 127 -1.389 -0.552 -4.344 390 2HG1 ILE 127 2HG1 ILE 127 -1.104 -0.931 -6.039 391 1HG2 ILE 127 1HG2 ILE 127 1.535 -2.117 -6.086 392 2HG2 ILE 127 2HG2 ILE 127 1.044 -0.548 -5.447 393 3HG2 ILE 127 3HG2 ILE 127 1.992 -1.649 -4.448 394 1HD1 ILE 127 1HD1 ILE 127 -2.718 -2.638 -4.164 395 2HD1 ILE 127 2HD1 ILE 127 -3.394 -1.437 -5.264 396 3HD1 ILE 127 3HD1 ILE 127 -2.541 -2.842 -5.907 397 H GLU 128 H GLU 128 1.619 -3.902 -6.907 398 HA GLU 128 HA GLU 128 3.319 -5.528 -5.130 399 1HB GLU 128 1HB GLU 128 2.771 -5.684 -8.069 400 2HB GLU 128 2HB GLU 128 4.328 -6.227 -7.455 401 1HG GLU 128 1HG GLU 128 2.298 -7.350 -5.821 402 2HG GLU 128 2HG GLU 128 1.861 -7.615 -7.510 403 H ALA 129 H ALA 129 4.988 -4.409 -4.385 404 HA ALA 129 HA ALA 129 5.857 -1.933 -5.259 405 1HB ALA 129 1HB ALA 129 7.039 -4.066 -3.565 406 2HB ALA 129 2HB ALA 129 8.091 -2.760 -4.107 407 3HB ALA 129 3HB ALA 129 6.644 -2.393 -3.169 408 H ASP 130 H ASP 130 6.944 -1.265 -6.984 409 HA ASP 130 HA ASP 130 8.915 -3.011 -8.237 410 1HB ASP 130 1HB ASP 130 7.999 -2.692 -10.473 411 2HB ASP 130 2HB ASP 130 6.796 -3.453 -9.432 412 H LYS 131 H LYS 131 8.836 -0.455 -6.685 413 HA LYS 131 HA LYS 131 10.070 1.318 -8.688 414 1HB LYS 131 1HB LYS 131 9.431 2.503 -6.085 415 2HB LYS 131 2HB LYS 131 9.109 3.103 -7.706 416 1HG LYS 131 1HG LYS 131 7.178 1.584 -7.858 417 2HG LYS 131 2HG LYS 131 7.485 1.063 -6.201 418 1HD LYS 131 1HD LYS 131 6.251 2.763 -5.476 419 2HD LYS 131 2HD LYS 131 7.434 3.878 -6.162 420 1HE LYS 131 1HE LYS 131 5.035 2.718 -7.575 421 2HE LYS 131 2HE LYS 131 5.207 4.375 -6.998 422 1HZ LYS 131 1HZ LYS 131 7.355 4.189 -8.535 423 2HZ LYS 131 2HZ LYS 131 6.348 3.100 -9.350 424 3HZ LYS 131 3HZ LYS 131 5.852 4.700 -9.119 425 H SER 132 H SER 132 10.709 -0.705 -6.080 426 HA SER 132 HA SER 132 12.591 -1.172 -4.891 427 1HB SER 132 1HB SER 132 14.441 0.644 -6.212 428 2HB SER 132 2HB SER 132 14.456 -1.118 -6.145 429 HG SER 132 HG SER 132 14.159 -0.076 -8.281 430 H GLY 133 H GLY 133 13.389 -0.464 -2.985 431 1HA GLY 133 1HA GLY 133 14.500 1.660 -2.009 432 2HA GLY 133 2HA GLY 133 12.930 2.371 -2.350 433 H THR 134 H THR 134 13.152 2.789 0.037 434 HA THR 134 HA THR 134 12.178 0.464 1.565 435 HB THR 134 HB THR 134 13.499 2.882 2.782 436 HG1 THR 134 HG1 THR 134 15.369 1.393 2.857 437 1HG2 THR 134 1HG2 THR 134 13.059 0.070 3.743 438 2HG2 THR 134 2HG2 THR 134 14.105 1.239 4.549 439 3HG2 THR 134 3HG2 THR 134 12.376 1.556 4.403 440 H VAL 135 H VAL 135 10.185 0.587 2.366 441 HA VAL 135 HA VAL 135 8.441 2.695 1.791 442 HB VAL 135 HB VAL 135 8.220 0.482 3.829 443 1HG1 VAL 135 1HG1 VAL 135 6.424 2.761 3.245 444 2HG1 VAL 135 2HG1 VAL 135 5.673 1.179 3.452 445 3HG1 VAL 135 3HG1 VAL 135 6.665 1.859 4.741 446 1HG2 VAL 135 1HG2 VAL 135 8.286 -0.233 1.492 447 2HG2 VAL 135 2HG2 VAL 135 6.695 -0.511 2.201 448 3HG2 VAL 135 3HG2 VAL 135 6.950 0.857 1.117 449 H LYS 136 H LYS 136 8.449 4.678 2.600 450 HA LYS 136 HA LYS 136 9.816 5.384 4.989 451 1HB LYS 136 1HB LYS 136 9.013 6.760 2.789 452 2HB LYS 136 2HB LYS 136 7.793 7.267 3.949 453 1HG LYS 136 1HG LYS 136 10.775 7.577 4.178 454 2HG LYS 136 2HG LYS 136 9.567 8.851 4.001 455 1HD LYS 136 1HD LYS 136 8.714 8.464 6.184 456 2HD LYS 136 2HD LYS 136 9.631 6.966 6.347 457 1HE LYS 136 1HE LYS 136 10.630 8.823 7.617 458 2HE LYS 136 2HE LYS 136 11.711 8.202 6.372 459 1HZ LYS 136 1HZ LYS 136 10.211 10.243 5.223 460 2HZ LYS 136 2HZ LYS 136 10.754 10.825 6.716 461 3HZ LYS 136 3HZ LYS 136 11.865 10.247 5.578 462 H ALA 137 H ALA 137 6.347 5.562 4.163 463 HA ALA 137 HA ALA 137 5.477 4.431 6.592 464 1HB ALA 137 1HB ALA 137 5.563 7.430 6.481 465 2HB ALA 137 2HB ALA 137 4.432 6.561 7.519 466 3HB ALA 137 3HB ALA 137 6.169 6.356 7.742 467 H ILE 138 H ILE 138 3.060 4.897 6.947 468 HA ILE 138 HA ILE 138 1.759 5.140 4.312 469 HB ILE 138 HB ILE 138 1.015 3.399 6.661 470 1HG1 ILE 138 1HG1 ILE 138 2.018 2.887 3.870 471 2HG1 ILE 138 2HG1 ILE 138 2.676 2.307 5.396 472 1HG2 ILE 138 1HG2 ILE 138 -0.993 4.408 5.697 473 2HG2 ILE 138 2HG2 ILE 138 -0.512 3.837 4.099 474 3HG2 ILE 138 3HG2 ILE 138 -0.918 2.678 5.364 475 1HD1 ILE 138 1HD1 ILE 138 0.581 0.941 5.648 476 2HD1 ILE 138 2HD1 ILE 138 0.199 1.378 3.982 477 3HD1 ILE 138 3HD1 ILE 138 1.662 0.461 4.340 478 H LEU 139 H LEU 139 -0.054 6.397 4.126 479 HA LEU 139 HA LEU 139 -0.743 8.005 6.493 480 1HB LEU 139 1HB LEU 139 -0.598 8.612 3.579 481 2HB LEU 139 2HB LEU 139 -1.769 9.483 4.551 482 HG LEU 139 HG LEU 139 0.167 10.121 6.074 483 1HD1 LEU 139 1HD1 LEU 139 1.656 8.883 3.785 484 2HD1 LEU 139 2HD1 LEU 139 2.377 10.142 4.786 485 3HD1 LEU 139 3HD1 LEU 139 1.866 8.619 5.516 486 1HD2 LEU 139 1HD2 LEU 139 -0.871 11.685 4.517 487 2HD2 LEU 139 2HD2 LEU 139 0.870 11.948 4.610 488 3HD2 LEU 139 3HD2 LEU 139 0.179 11.106 3.223 489 H VAL 140 H VAL 140 -2.059 6.133 3.827 490 HA VAL 140 HA VAL 140 -4.742 6.676 3.999 491 HB VAL 140 HB VAL 140 -3.408 4.012 3.510 492 1HG1 VAL 140 1HG1 VAL 140 -6.286 4.824 3.405 493 2HG1 VAL 140 2HG1 VAL 140 -5.670 3.578 2.319 494 3HG1 VAL 140 3HG1 VAL 140 -5.560 3.359 4.065 495 1HG2 VAL 140 1HG2 VAL 140 -4.011 6.377 1.875 496 2HG2 VAL 140 2HG2 VAL 140 -2.790 5.124 1.656 497 3HG2 VAL 140 3HG2 VAL 140 -4.453 4.833 1.145 498 H GLU 141 H GLU 141 -2.777 4.759 6.177 499 HA GLU 141 HA GLU 141 -3.176 3.964 8.271 500 1HB GLU 141 1HB GLU 141 -5.374 5.926 7.911 501 2HB GLU 141 2HB GLU 141 -5.566 4.751 9.205 502 1HG GLU 141 1HG GLU 141 -3.946 5.669 10.467 503 2HG GLU 141 2HG GLU 141 -2.950 6.093 9.075 504 H SER 142 H SER 142 -3.293 1.827 7.621 505 HA SER 142 HA SER 142 -5.197 0.430 6.336 506 1HB SER 142 1HB SER 142 -3.985 -1.326 7.026 507 2HB SER 142 2HB SER 142 -3.075 -0.217 8.052 508 HG SER 142 HG SER 142 -4.724 -0.597 9.666 509 H GLY 143 H GLY 143 -6.944 -1.033 7.148 510 1HA GLY 143 1HA GLY 143 -8.945 -1.357 8.225 511 2HA GLY 143 2HA GLY 143 -8.210 -0.601 9.632 512 H GLN 144 H GLN 144 -8.024 1.416 6.957 513 HA GLN 144 HA GLN 144 -10.438 2.873 7.815 514 1HB GLN 144 1HB GLN 144 -8.151 3.912 8.302 515 2HB GLN 144 2HB GLN 144 -8.005 4.140 6.565 516 1HG GLN 144 1HG GLN 144 -10.007 5.520 6.563 517 2HG GLN 144 2HG GLN 144 -10.192 5.270 8.298 518 1HE2 GLN 144 2HE2 GLN 144 -7.522 6.146 6.125 519 2HE2 GLN 144 1HE2 GLN 144 -7.013 7.527 7.030 520 HA PRO 145 HA PRO 145 -12.022 2.389 3.726 521 1HB PRO 145 1HB PRO 145 -13.529 4.682 3.593 522 2HB PRO 145 2HB PRO 145 -14.035 3.209 4.427 523 1HG PRO 145 1HG PRO 145 -12.814 5.698 5.549 524 2HG PRO 145 2HG PRO 145 -14.140 4.712 6.193 525 1HD PRO 145 1HD PRO 145 -11.648 4.540 7.181 526 2HD PRO 145 2HD PRO 145 -12.701 3.115 7.057 527 H VAL 146 H VAL 146 -10.165 2.630 2.470 528 HA VAL 146 HA VAL 146 -8.570 4.732 1.961 529 HB VAL 146 HB VAL 146 -9.725 2.870 -0.118 530 1HG1 VAL 146 1HG1 VAL 146 -7.359 4.733 -0.283 531 2HG1 VAL 146 2HG1 VAL 146 -7.722 3.464 -1.453 532 3HG1 VAL 146 3HG1 VAL 146 -8.841 4.810 -1.237 533 1HG2 VAL 146 1HG2 VAL 146 -8.319 2.070 1.947 534 2HG2 VAL 146 2HG2 VAL 146 -8.003 1.417 0.340 535 3HG2 VAL 146 3HG2 VAL 146 -6.964 2.681 0.997 536 H GLU 147 H GLU 147 -8.489 6.312 0.181 537 HA GLU 147 HA GLU 147 -11.091 7.232 -0.776 538 1HB GLU 147 1HB GLU 147 -9.576 8.503 1.333 539 2HB GLU 147 2HB GLU 147 -9.745 9.584 -0.047 540 1HG GLU 147 1HG GLU 147 -11.680 10.135 0.926 541 2HG GLU 147 2HG GLU 147 -12.272 8.656 0.172 542 H PHE 148 H PHE 148 -11.028 8.224 -2.742 543 HA PHE 148 HA PHE 148 -9.187 7.720 -4.613 544 1HB PHE 148 1HB PHE 148 -11.090 8.759 -5.430 545 2HB PHE 148 2HB PHE 148 -10.994 10.068 -4.263 546 HD1 PHE 148 HD1 PHE 148 -8.339 8.823 -6.539 547 HD2 PHE 148 HD2 PHE 148 -11.047 11.979 -5.597 548 HE1 PHE 148 HE1 PHE 148 -7.262 10.249 -8.237 549 HE2 PHE 148 HE2 PHE 148 -9.976 13.410 -7.294 550 HZ PHE 148 HZ PHE 148 -8.080 12.546 -8.615 551 H ASP 149 H ASP 149 -7.082 8.063 -4.833 552 HA ASP 149 HA ASP 149 -5.031 9.053 -4.780 553 1HB ASP 149 1HB ASP 149 -6.780 11.173 -5.174 554 2HB ASP 149 2HB ASP 149 -5.811 11.684 -3.796 555 H GLU 150 H GLU 150 -5.264 7.535 -2.767 556 HA GLU 150 HA GLU 150 -4.592 9.116 -0.372 557 1HB GLU 150 1HB GLU 150 -6.447 6.919 -0.750 558 2HB GLU 150 2HB GLU 150 -5.254 6.541 0.486 559 1HG GLU 150 1HG GLU 150 -7.151 8.872 0.421 560 2HG GLU 150 2HG GLU 150 -7.141 7.518 1.551 561 HA PRO 151 HA PRO 151 -0.496 7.448 -1.142 562 1HB PRO 151 1HB PRO 151 -0.233 8.357 1.688 563 2HB PRO 151 2HB PRO 151 0.828 8.656 0.306 564 1HG PRO 151 1HG PRO 151 -0.801 10.562 1.200 565 2HG PRO 151 2HG PRO 151 -0.524 10.341 -0.538 566 1HD PRO 151 1HD PRO 151 -2.890 9.597 1.118 567 2HD PRO 151 2HD PRO 151 -2.819 10.156 -0.565 568 H LEU 152 H LEU 152 -0.897 5.244 -1.194 569 HA LEU 152 HA LEU 152 -1.703 3.724 1.060 570 1HB LEU 152 1HB LEU 152 -0.398 2.938 -1.542 571 2HB LEU 152 2HB LEU 152 -0.913 1.773 -0.334 572 HG LEU 152 HG LEU 152 -2.743 3.719 -1.742 573 1HD1 LEU 152 1HD1 LEU 152 -1.661 1.186 -2.568 574 2HD1 LEU 152 2HD1 LEU 152 -3.413 1.083 -2.381 575 3HD1 LEU 152 3HD1 LEU 152 -2.709 2.300 -3.447 576 1HD2 LEU 152 1HD2 LEU 152 -3.056 1.944 0.550 577 2HD2 LEU 152 2HD2 LEU 152 -4.072 3.277 -0.001 578 3HD2 LEU 152 3HD2 LEU 152 -4.254 1.674 -0.715 579 H VAL 153 H VAL 153 1.453 4.022 -0.572 580 HA VAL 153 HA VAL 153 2.816 3.778 1.971 581 HB VAL 153 HB VAL 153 3.139 1.693 -0.186 582 1HG1 VAL 153 1HG1 VAL 153 4.942 2.439 2.090 583 2HG1 VAL 153 2HG1 VAL 153 4.917 0.803 1.433 584 3HG1 VAL 153 3HG1 VAL 153 5.349 2.164 0.397 585 1HG2 VAL 153 1HG2 VAL 153 1.333 1.387 1.511 586 2HG2 VAL 153 2HG2 VAL 153 2.556 0.116 1.515 587 3HG2 VAL 153 3HG2 VAL 153 2.580 1.368 2.758 588 H VAL 154 H VAL 154 4.170 5.443 1.874 589 HA VAL 154 HA VAL 154 5.331 6.232 -0.685 590 HB VAL 154 HB VAL 154 5.942 8.289 0.327 591 1HG1 VAL 154 1HG1 VAL 154 3.232 7.294 1.117 592 2HG1 VAL 154 2HG1 VAL 154 3.743 8.931 1.527 593 3HG1 VAL 154 3HG1 VAL 154 3.678 8.425 -0.160 594 1HG2 VAL 154 1HG2 VAL 154 5.755 6.733 2.829 595 2HG2 VAL 154 2HG2 VAL 154 6.879 8.012 2.366 596 3HG2 VAL 154 3HG2 VAL 154 5.255 8.422 2.921 597 H ILE 155 H ILE 155 7.206 5.359 -1.256 598 HA ILE 155 HA ILE 155 8.976 4.183 0.697 599 HB ILE 155 HB ILE 155 9.569 4.514 -2.235 600 1HG1 ILE 155 1HG1 ILE 155 8.376 1.971 -1.328 601 2HG1 ILE 155 2HG1 ILE 155 7.272 3.342 -1.358 602 1HG2 ILE 155 1HG2 ILE 155 11.321 3.729 -0.584 603 2HG2 ILE 155 2HG2 ILE 155 10.341 2.278 -0.380 604 3HG2 ILE 155 3HG2 ILE 155 11.017 2.672 -1.961 605 1HD1 ILE 155 1HD1 ILE 155 8.938 3.002 -3.755 606 2HD1 ILE 155 2HD1 ILE 155 7.744 1.739 -3.460 607 3HD1 ILE 155 3HD1 ILE 155 7.232 3.420 -3.600 608 H GLU 156 H GLU 156 11.177 4.745 0.995 609 HA GLU 156 HA GLU 156 12.267 7.138 -0.143 610 1HB GLU 156 1HB GLU 156 10.672 7.434 2.166 611 2HB GLU 156 2HB GLU 156 12.342 7.596 2.696 612 1HG GLU 156 1HG GLU 156 12.697 9.325 0.990 613 2HG GLU 156 2HG GLU 156 11.004 9.182 0.515 614 1H10 BTN 222 1H10 BTN 122 -13.663 -11.634 3.085 615 2H10 BTN 222 2H10 BTN 122 -13.327 -10.024 3.720 616 1H9 BTN 222 1H9 BTN 122 -11.471 -9.762 2.190 617 2H9 BTN 222 2H9 BTN 122 -11.833 -11.321 1.447 618 1H8 BTN 222 1H8 BTN 122 -11.311 -12.476 3.499 619 2H8 BTN 222 2H8 BTN 122 -11.088 -10.943 4.344 620 1H7 BTN 222 1H7 BTN 122 -9.369 -12.209 2.248 621 2H7 BTN 222 2H7 BTN 122 -8.923 -11.663 3.858 622 H2 BTN 222 H2 BTN 122 -9.645 -9.872 1.529 623 1H6 BTN 222 1H6 BTN 122 -6.297 -7.782 2.320 624 2H6 BTN 222 2H6 BTN 122 -7.681 -7.679 1.240 625 H5 BTN 222 H5 BTN 122 -8.645 -6.904 3.227 626 HN1 BTN 222 HN2 BTN 122 -6.728 -7.447 4.825 627 HN2 BTN 222 HN1 BTN 122 -9.527 -10.256 5.124 628 H4 BTN 222 H4 BTN 122 -10.258 -8.550 3.365 Start of MODEL 19 1 1H GLU 77 H GLU 77 18.174 15.862 -2.596 2 HA GLU 77 HA GLU 77 15.758 16.596 -3.797 3 1HB GLU 77 1HB GLU 77 17.569 16.602 -5.744 4 2HB GLU 77 2HB GLU 77 17.237 14.873 -5.729 5 1HG GLU 77 1HG GLU 77 14.993 16.839 -5.863 6 2HG GLU 77 2HG GLU 77 15.904 16.418 -7.312 7 H ILE 78 H ILE 78 14.893 15.347 -2.171 8 HA ILE 78 HA ILE 78 15.663 12.755 -1.472 9 HB ILE 78 HB ILE 78 14.260 13.930 0.035 10 1HG1 ILE 78 1HG1 ILE 78 12.762 11.649 -1.267 11 2HG1 ILE 78 2HG1 ILE 78 13.867 11.555 0.100 12 1HG2 ILE 78 1HG2 ILE 78 13.026 14.925 -2.219 13 2HG2 ILE 78 2HG2 ILE 78 11.774 13.937 -1.467 14 3HG2 ILE 78 3HG2 ILE 78 12.546 15.229 -0.550 15 1HD1 ILE 78 1HD1 ILE 78 11.237 13.012 0.130 16 2HD1 ILE 78 2HD1 ILE 78 11.493 11.376 0.735 17 3HD1 ILE 78 3HD1 ILE 78 12.315 12.736 1.498 18 H SER 79 H SER 79 15.456 10.860 -2.461 19 HA SER 79 HA SER 79 13.849 10.694 -4.886 20 1HB SER 79 1HB SER 79 16.042 9.834 -5.179 21 2HB SER 79 2HB SER 79 15.965 8.914 -3.678 22 HG SER 79 HG SER 79 15.054 8.271 -6.184 23 H GLY 80 H GLY 80 12.103 10.909 -2.928 24 1HA GLY 80 1HA GLY 80 11.372 8.270 -1.927 25 2HA GLY 80 2HA GLY 80 10.590 9.791 -1.522 26 H HIS 81 H HIS 81 8.879 7.880 -1.952 27 HA HIS 81 HA HIS 81 7.669 8.595 -4.502 28 1HB HIS 81 1HB HIS 81 7.892 5.690 -3.718 29 2HB HIS 81 2HB HIS 81 7.315 6.357 -5.241 30 HD1 HIS 81 HD1 HIS 81 10.579 6.654 -3.285 31 HD2 HIS 81 HD2 HIS 81 9.182 5.984 -7.140 32 HE1 HIS 81 HE1 HIS 81 12.635 6.368 -4.705 33 HE2 HIS 81 HE2 HIS 81 11.766 6.058 -7.049 34 H ILE 82 H ILE 82 5.758 9.371 -3.903 35 HA ILE 82 HA ILE 82 4.405 8.286 -1.559 36 HB ILE 82 HB ILE 82 3.339 10.511 -3.257 37 1HG1 ILE 82 1HG1 ILE 82 5.353 11.528 -2.908 38 2HG1 ILE 82 2HG1 ILE 82 4.591 11.918 -1.369 39 1HG2 ILE 82 1HG2 ILE 82 2.083 9.374 -1.328 40 2HG2 ILE 82 2HG2 ILE 82 3.198 10.251 -0.280 41 3HG2 ILE 82 3HG2 ILE 82 2.131 11.137 -1.370 42 1HD1 ILE 82 1HD1 ILE 82 5.715 9.502 -0.844 43 2HD1 ILE 82 2HD1 ILE 82 6.878 10.218 -1.958 44 3HD1 ILE 82 3HD1 ILE 82 6.441 11.065 -0.475 45 H VAL 83 H VAL 83 3.785 6.255 -2.417 46 HA VAL 83 HA VAL 83 2.237 5.996 -4.789 47 HB VAL 83 HB VAL 83 2.360 4.065 -2.469 48 1HG1 VAL 83 1HG1 VAL 83 0.768 4.012 -4.705 49 2HG1 VAL 83 2HG1 VAL 83 2.143 3.016 -5.180 50 3HG1 VAL 83 3HG1 VAL 83 1.222 2.613 -3.731 51 1HG2 VAL 83 1HG2 VAL 83 4.582 4.865 -3.551 52 2HG2 VAL 83 2HG2 VAL 83 4.306 3.139 -3.315 53 3HG2 VAL 83 3HG2 VAL 83 4.078 3.859 -4.910 54 H ARG 84 H ARG 84 0.574 7.559 -4.545 55 HA ARG 84 HA ARG 84 -1.292 7.395 -2.370 56 1HB ARG 84 1HB ARG 84 -2.610 9.024 -3.791 57 2HB ARG 84 2HB ARG 84 -1.000 9.549 -3.319 58 1HG ARG 84 1HG ARG 84 -0.958 8.147 -5.846 59 2HG ARG 84 2HG ARG 84 -2.061 9.525 -5.876 60 1HD ARG 84 1HD ARG 84 -0.121 10.823 -4.792 61 2HD ARG 84 2HD ARG 84 0.886 9.479 -5.328 62 HE ARG 84 HE ARG 84 0.734 10.272 -7.466 63 1HH1 ARG 84 1HH1 ARG 84 -1.772 11.730 -5.539 64 2HH1 ARG 84 2HH1 ARG 84 -2.266 12.832 -6.781 65 1HH2 ARG 84 1HH2 ARG 84 0.092 11.717 -9.110 66 2HH2 ARG 84 2HH2 ARG 84 -1.206 12.824 -8.812 67 H SER 85 H SER 85 -3.480 6.773 -2.489 68 HA SER 85 HA SER 85 -3.967 4.388 -3.894 69 1HB SER 85 1HB SER 85 -5.077 5.413 -1.724 70 2HB SER 85 2HB SER 85 -6.247 6.038 -2.886 71 HG SER 85 HG SER 85 -5.651 3.412 -3.308 72 HA PRO 86 HA PRO 86 -5.165 6.150 -7.806 73 1HB PRO 86 1HB PRO 86 -5.822 3.835 -9.030 74 2HB PRO 86 2HB PRO 86 -4.144 4.300 -8.725 75 1HG PRO 86 1HG PRO 86 -5.898 2.420 -7.191 76 2HG PRO 86 2HG PRO 86 -4.196 2.235 -7.654 77 1HD PRO 86 1HD PRO 86 -4.984 3.020 -5.170 78 2HD PRO 86 2HD PRO 86 -3.451 3.527 -5.904 79 H MET 87 H MET 87 -7.190 4.046 -5.864 80 HA MET 87 HA MET 87 -9.543 5.498 -6.790 81 1HB MET 87 1HB MET 87 -10.829 3.452 -7.162 82 2HB MET 87 2HB MET 87 -9.440 3.525 -8.240 83 1HG MET 87 1HG MET 87 -8.384 2.151 -6.174 84 2HG MET 87 2HG MET 87 -10.067 1.636 -6.079 85 1HE MET 87 1HE MET 87 -10.993 1.884 -8.972 86 2HE MET 87 2HE MET 87 -10.575 0.397 -9.823 87 3HE MET 87 3HE MET 87 -11.333 0.321 -8.232 88 H VAL 88 H VAL 88 -11.523 4.225 -5.509 89 HA VAL 88 HA VAL 88 -10.759 4.532 -2.693 90 HB VAL 88 HB VAL 88 -13.432 4.685 -4.081 91 1HG1 VAL 88 1HG1 VAL 88 -12.825 4.055 -1.302 92 2HG1 VAL 88 2HG1 VAL 88 -13.867 5.466 -1.482 93 3HG1 VAL 88 3HG1 VAL 88 -14.343 3.922 -2.189 94 1HG2 VAL 88 1HG2 VAL 88 -11.441 6.592 -3.389 95 2HG2 VAL 88 2HG2 VAL 88 -13.005 6.861 -4.159 96 3HG2 VAL 88 3HG2 VAL 88 -12.870 6.897 -2.402 97 H GLY 89 H GLY 89 -11.282 3.003 -1.134 98 1HA GLY 89 1HA GLY 89 -12.833 0.706 -1.528 99 2HA GLY 89 2HA GLY 89 -11.169 0.300 -1.926 100 H THR 90 H THR 90 -9.890 -0.344 -0.320 101 HA THR 90 HA THR 90 -10.083 0.698 2.332 102 HB THR 90 HB THR 90 -10.825 -2.210 1.974 103 HG1 THR 90 HG1 THR 90 -12.477 0.001 2.626 104 1HG2 THR 90 1HG2 THR 90 -9.722 -1.639 4.113 105 2HG2 THR 90 2HG2 THR 90 -11.015 -0.480 4.424 106 3HG2 THR 90 3HG2 THR 90 -11.385 -2.200 4.296 107 H PHE 91 H PHE 91 -8.073 0.742 3.071 108 HA PHE 91 HA PHE 91 -6.026 -0.865 1.805 109 1HB PHE 91 1HB PHE 91 -5.768 1.587 2.416 110 2HB PHE 91 2HB PHE 91 -5.668 1.069 4.098 111 HD1 PHE 91 HD1 PHE 91 -4.172 -0.080 0.865 112 HD2 PHE 91 HD2 PHE 91 -3.534 1.092 4.915 113 HE1 PHE 91 HE1 PHE 91 -1.753 -0.478 0.595 114 HE2 PHE 91 HE2 PHE 91 -1.114 0.699 4.652 115 HZ PHE 91 HZ PHE 91 -0.223 -0.088 2.490 116 H TYR 92 H TYR 92 -4.261 -1.745 3.378 117 HA TYR 92 HA TYR 92 -5.085 -2.707 5.916 118 1HB TYR 92 1HB TYR 92 -5.563 -4.405 3.546 119 2HB TYR 92 2HB TYR 92 -4.836 -5.200 4.937 120 HD1 TYR 92 HD1 TYR 92 -6.054 -4.668 7.245 121 HD2 TYR 92 HD2 TYR 92 -7.864 -4.343 3.400 122 HE1 TYR 92 HE1 TYR 92 -8.279 -4.882 8.282 123 HE2 TYR 92 HE2 TYR 92 -10.094 -4.555 4.425 124 HH TYR 92 HH TYR 92 -11.171 -4.228 6.581 125 H ARG 93 H ARG 93 -3.537 -4.677 6.531 126 HA ARG 93 HA ARG 93 -0.932 -4.476 5.269 127 1HB ARG 93 1HB ARG 93 -0.881 -4.039 8.207 128 2HB ARG 93 2HB ARG 93 0.227 -3.467 6.965 129 1HG ARG 93 1HG ARG 93 -1.722 -1.939 6.246 130 2HG ARG 93 2HG ARG 93 -2.380 -2.299 7.844 131 1HD ARG 93 1HD ARG 93 0.462 -1.447 7.641 132 2HD ARG 93 2HD ARG 93 -0.793 -0.226 7.429 133 HE ARG 93 HE ARG 93 -1.359 -1.706 9.740 134 1HH1 ARG 93 1HH1 ARG 93 0.977 0.582 8.540 135 2HH1 ARG 93 2HH1 ARG 93 1.332 1.236 10.104 136 1HH2 ARG 93 1HH2 ARG 93 -0.899 -0.851 11.805 137 2HH2 ARG 93 2HH2 ARG 93 0.266 0.422 11.960 138 H THR 94 H THR 94 -3.150 -6.453 6.113 139 HA THR 94 HA THR 94 -1.345 -8.591 6.753 140 HB THR 94 HB THR 94 -2.852 -9.218 8.796 141 HG1 THR 94 HG1 THR 94 -3.050 -6.403 8.921 142 1HG2 THR 94 1HG2 THR 94 -0.428 -8.617 8.890 143 2HG2 THR 94 2HG2 THR 94 -0.925 -6.946 9.171 144 3HG2 THR 94 3HG2 THR 94 -1.363 -8.205 10.328 145 HA PRO 95 HA PRO 95 -4.809 -10.131 4.268 146 1HB PRO 95 1HB PRO 95 -3.406 -12.090 3.054 147 2HB PRO 95 2HB PRO 95 -3.299 -10.402 2.543 148 1HG PRO 95 1HG PRO 95 -1.426 -11.984 4.256 149 2HG PRO 95 2HG PRO 95 -1.055 -10.833 2.961 150 1HD PRO 95 1HD PRO 95 -0.942 -10.199 5.614 151 2HD PRO 95 2HD PRO 95 -1.296 -9.014 4.342 152 H SER 96 H SER 96 -6.233 -11.258 5.430 153 HA SER 96 HA SER 96 -6.096 -12.799 7.554 154 1HB SER 96 1HB SER 96 -8.251 -12.633 6.724 155 2HB SER 96 2HB SER 96 -7.777 -13.145 5.102 156 HG SER 96 HG SER 96 -8.716 -14.921 5.867 157 HA PRO 97 HA PRO 97 -5.038 -16.940 5.161 158 1HB PRO 97 1HB PRO 97 -3.770 -16.416 2.742 159 2HB PRO 97 2HB PRO 97 -5.450 -16.929 2.926 160 1HG PRO 97 1HG PRO 97 -4.335 -14.189 2.522 161 2HG PRO 97 2HG PRO 97 -5.813 -14.910 1.860 162 1HD PRO 97 1HD PRO 97 -5.898 -13.176 3.901 163 2HD PRO 97 2HD PRO 97 -7.009 -14.560 3.819 164 H ASP 98 H ASP 98 -3.603 -16.239 7.027 165 HA ASP 98 HA ASP 98 -1.532 -16.316 7.966 166 1HB ASP 98 1HB ASP 98 -0.537 -16.816 5.153 167 2HB ASP 98 2HB ASP 98 0.360 -17.100 6.641 168 H ALA 99 H ALA 99 -2.496 -13.848 7.643 169 HA ALA 99 HA ALA 99 -1.109 -12.017 6.095 170 1HB ALA 99 1HB ALA 99 -2.247 -11.625 8.860 171 2HB ALA 99 2HB ALA 99 -1.786 -10.334 7.751 172 3HB ALA 99 3HB ALA 99 -3.109 -11.423 7.335 173 H LYS 100 H LYS 100 1.074 -12.235 5.949 174 HA LYS 100 HA LYS 100 2.672 -12.377 8.383 175 1HB LYS 100 1HB LYS 100 3.015 -13.183 5.629 176 2HB LYS 100 2HB LYS 100 4.379 -12.211 6.164 177 1HG LYS 100 1HG LYS 100 4.915 -13.716 7.885 178 2HG LYS 100 2HG LYS 100 3.361 -14.542 7.755 179 1HD LYS 100 1HD LYS 100 4.431 -14.777 5.221 180 2HD LYS 100 2HD LYS 100 5.831 -14.967 6.277 181 1HE LYS 100 1HE LYS 100 3.599 -16.441 7.319 182 2HE LYS 100 2HE LYS 100 3.884 -16.887 5.637 183 1HZ LYS 100 1HZ LYS 100 6.274 -16.705 7.246 184 2HZ LYS 100 2HZ LYS 100 5.203 -17.917 7.739 185 3HZ LYS 100 3HZ LYS 100 5.792 -17.904 6.153 186 H ALA 101 H ALA 101 1.262 -9.971 8.008 187 HA ALA 101 HA ALA 101 1.536 -7.715 8.064 188 1HB ALA 101 1HB ALA 101 3.534 -8.749 9.547 189 2HB ALA 101 2HB ALA 101 4.465 -7.838 8.358 190 3HB ALA 101 3HB ALA 101 3.255 -7.020 9.347 191 H PHE 102 H PHE 102 1.057 -7.044 6.026 192 HA PHE 102 HA PHE 102 2.539 -7.430 3.715 193 1HB PHE 102 1HB PHE 102 0.326 -5.729 4.552 194 2HB PHE 102 2HB PHE 102 1.349 -4.943 3.354 195 HD1 PHE 102 HD1 PHE 102 2.191 -7.203 1.689 196 HD2 PHE 102 HD2 PHE 102 -1.605 -6.326 3.421 197 HE1 PHE 102 HE1 PHE 102 1.083 -8.489 -0.099 198 HE2 PHE 102 HE2 PHE 102 -2.720 -7.609 1.636 199 HZ PHE 102 HZ PHE 102 -1.376 -8.691 -0.126 200 H ILE 103 H ILE 103 3.050 -4.970 2.569 201 HA ILE 103 HA ILE 103 5.649 -4.412 3.580 202 HB ILE 103 HB ILE 103 4.173 -2.645 1.645 203 1HG1 ILE 103 1HG1 ILE 103 3.776 -4.757 0.691 204 2HG1 ILE 103 2HG1 ILE 103 5.240 -4.197 -0.113 205 1HG2 ILE 103 1HG2 ILE 103 6.987 -3.134 2.415 206 2HG2 ILE 103 2HG2 ILE 103 6.666 -2.812 0.711 207 3HG2 ILE 103 3HG2 ILE 103 6.183 -1.639 1.937 208 1HD1 ILE 103 1HD1 ILE 103 6.390 -5.524 1.860 209 2HD1 ILE 103 2HD1 ILE 103 4.860 -6.401 1.825 210 3HD1 ILE 103 3HD1 ILE 103 5.864 -6.320 0.377 211 H GLU 104 H GLU 104 5.314 -3.729 5.736 212 HA GLU 104 HA GLU 104 3.875 -1.223 6.143 213 1HB GLU 104 1HB GLU 104 4.459 -3.524 7.754 214 2HB GLU 104 2HB GLU 104 5.054 -2.076 8.560 215 1HG GLU 104 1HG GLU 104 2.956 -1.185 8.804 216 2HG GLU 104 2HG GLU 104 2.299 -2.075 7.432 217 H VAL 105 H VAL 105 4.959 0.340 7.725 218 HA VAL 105 HA VAL 105 7.115 1.565 6.566 219 HB VAL 105 HB VAL 105 6.773 1.668 9.547 220 1HG1 VAL 105 1HG1 VAL 105 7.744 3.499 7.400 221 2HG1 VAL 105 2HG1 VAL 105 7.087 4.175 8.889 222 3HG1 VAL 105 3HG1 VAL 105 8.479 3.095 8.951 223 1HG2 VAL 105 1HG2 VAL 105 4.849 2.522 7.445 224 2HG2 VAL 105 2HG2 VAL 105 4.547 1.877 9.058 225 3HG2 VAL 105 3HG2 VAL 105 5.063 3.553 8.860 226 H GLY 106 H GLY 106 9.319 1.521 6.771 227 1HA GLY 106 1HA GLY 106 11.391 0.851 7.628 228 2HA GLY 106 2HA GLY 106 10.562 -0.260 8.706 229 H GLN 107 H GLN 107 9.160 -1.891 7.150 230 HA GLN 107 HA GLN 107 11.170 -3.528 5.956 231 1HB GLN 107 1HB GLN 107 9.339 -4.605 7.070 232 2HB GLN 107 2HB GLN 107 8.161 -3.758 6.076 233 1HG GLN 107 1HG GLN 107 8.893 -4.985 4.118 234 2HG GLN 107 2HG GLN 107 10.136 -5.795 5.070 235 1HE2 GLN 107 2HE2 GLN 107 8.019 -7.008 3.563 236 2HE2 GLN 107 1HE2 GLN 107 7.052 -7.905 4.680 237 H LYS 108 H LYS 108 10.818 -4.488 3.715 238 HA LYS 108 HA LYS 108 9.396 -3.318 1.680 239 1HB LYS 108 1HB LYS 108 11.376 -1.535 2.626 240 2HB LYS 108 2HB LYS 108 11.915 -2.112 1.056 241 1HG LYS 108 1HG LYS 108 9.451 -0.575 1.754 242 2HG LYS 108 2HG LYS 108 10.685 -0.215 0.548 243 1HD LYS 108 1HD LYS 108 9.537 -2.731 -0.095 244 2HD LYS 108 2HD LYS 108 8.222 -1.596 0.215 245 1HE LYS 108 1HE LYS 108 10.542 -0.956 -1.590 246 2HE LYS 108 2HE LYS 108 9.064 -1.722 -2.171 247 1HZ LYS 108 1HZ LYS 108 9.012 0.828 -0.673 248 2HZ LYS 108 2HZ LYS 108 9.219 0.788 -2.351 249 3HZ LYS 108 3HZ LYS 108 7.808 0.163 -1.658 250 H VAL 109 H VAL 109 11.332 -3.164 -0.380 251 HA VAL 109 HA VAL 109 13.181 -5.232 -0.473 252 HB VAL 109 HB VAL 109 10.900 -6.491 -0.144 253 1HG1 VAL 109 1HG1 VAL 109 10.248 -5.172 -2.437 254 2HG1 VAL 109 2HG1 VAL 109 10.737 -6.754 -3.049 255 3HG1 VAL 109 3HG1 VAL 109 9.457 -6.632 -1.842 256 1HG2 VAL 109 1HG2 VAL 109 13.351 -7.128 -1.544 257 2HG2 VAL 109 2HG2 VAL 109 12.414 -8.099 -0.409 258 3HG2 VAL 109 3HG2 VAL 109 11.994 -8.094 -2.122 259 H ASN 110 H ASN 110 12.509 -6.178 -3.174 260 HA ASN 110 HA ASN 110 13.096 -3.697 -4.629 261 1HB ASN 110 1HB ASN 110 14.160 -5.107 -6.315 262 2HB ASN 110 2HB ASN 110 14.838 -5.445 -4.725 263 1HD2 ASN 110 2HD2 ASN 110 14.303 -6.962 -7.375 264 2HD2 ASN 110 1HD2 ASN 110 13.689 -8.481 -6.826 265 H VAL 111 H VAL 111 12.358 -3.722 -6.964 266 HA VAL 111 HA VAL 111 9.583 -3.788 -7.103 267 HB VAL 111 HB VAL 111 11.398 -4.078 -9.495 268 1HG1 VAL 111 1HG1 VAL 111 8.594 -3.149 -9.049 269 2HG1 VAL 111 2HG1 VAL 111 9.532 -2.493 -10.391 270 3HG1 VAL 111 3HG1 VAL 111 9.236 -4.229 -10.286 271 1HG2 VAL 111 1HG2 VAL 111 10.790 -1.667 -7.808 272 2HG2 VAL 111 2HG2 VAL 111 12.360 -2.291 -8.309 273 3HG2 VAL 111 3HG2 VAL 111 11.296 -1.530 -9.491 274 H GLY 112 H GLY 112 8.098 -5.295 -7.611 275 1HA GLY 112 1HA GLY 112 7.627 -7.283 -9.051 276 2HA GLY 112 2HA GLY 112 9.107 -7.962 -8.391 277 H ASP 113 H ASP 113 8.558 -6.920 -5.697 278 HA ASP 113 HA ASP 113 7.026 -9.138 -4.749 279 1HB ASP 113 1HB ASP 113 8.811 -7.176 -3.638 280 2HB ASP 113 2HB ASP 113 7.367 -7.305 -2.641 281 H THR 114 H THR 114 5.228 -8.855 -3.162 282 HA THR 114 HA THR 114 3.109 -7.397 -4.357 283 HB THR 114 HB THR 114 2.638 -8.204 -1.591 284 HG1 THR 114 HG1 THR 114 3.829 -9.925 -1.670 285 1HG2 THR 114 1HG2 THR 114 1.463 -8.907 -4.254 286 2HG2 THR 114 2HG2 THR 114 0.991 -9.738 -2.772 287 3HG2 THR 114 3HG2 THR 114 0.737 -8.001 -2.928 288 H LEU 115 H LEU 115 1.619 -6.188 -2.544 289 HA LEU 115 HA LEU 115 3.277 -4.260 -1.098 290 1HB LEU 115 1HB LEU 115 2.791 -3.374 -3.390 291 2HB LEU 115 2HB LEU 115 1.085 -3.415 -2.989 292 HG LEU 115 HG LEU 115 2.188 -1.962 -0.909 293 1HD1 LEU 115 1HD1 LEU 115 3.653 -1.419 -3.467 294 2HD1 LEU 115 2HD1 LEU 115 3.400 -0.154 -2.266 295 3HD1 LEU 115 3HD1 LEU 115 4.297 -1.610 -1.837 296 1HD2 LEU 115 1HD2 LEU 115 0.073 -1.597 -2.197 297 2HD2 LEU 115 2HD2 LEU 115 0.977 -0.128 -1.834 298 3HD2 LEU 115 3HD2 LEU 115 1.042 -0.825 -3.451 299 H CYS 116 H CYS 116 -0.167 -4.436 -1.989 300 HA CYS 116 HA CYS 116 -1.080 -5.393 0.492 301 1HB CYS 116 1HB CYS 116 -0.528 -2.528 0.357 302 2HB CYS 116 2HB CYS 116 -2.192 -2.879 0.810 303 HG CYS 116 HG CYS 116 0.247 -3.280 2.564 304 H ILE 117 H ILE 117 -3.411 -5.393 0.662 305 HA ILE 117 HA ILE 117 -4.662 -5.346 -1.972 306 HB ILE 117 HB ILE 117 -5.523 -6.516 0.667 307 1HG1 ILE 117 1HG1 ILE 117 -5.481 -8.186 -1.737 308 2HG1 ILE 117 2HG1 ILE 117 -3.906 -7.506 -1.336 309 1HG2 ILE 117 1HG2 ILE 117 -7.079 -6.308 -1.901 310 2HG2 ILE 117 2HG2 ILE 117 -7.484 -7.421 -0.594 311 3HG2 ILE 117 3HG2 ILE 117 -7.528 -5.679 -0.315 312 1HD1 ILE 117 1HD1 ILE 117 -4.538 -8.376 1.071 313 2HD1 ILE 117 2HD1 ILE 117 -5.558 -9.472 0.140 314 3HD1 ILE 117 3HD1 ILE 117 -3.818 -9.435 -0.141 315 H VAL 118 H VAL 118 -6.192 -3.949 -2.594 316 HA VAL 118 HA VAL 118 -6.795 -1.703 -0.860 317 HB VAL 118 HB VAL 118 -7.866 -2.143 -3.642 318 1HG1 VAL 118 1HG1 VAL 118 -8.224 -0.125 -1.726 319 2HG1 VAL 118 2HG1 VAL 118 -7.163 0.553 -2.961 320 3HG1 VAL 118 3HG1 VAL 118 -8.733 -0.111 -3.414 321 1HG2 VAL 118 1HG2 VAL 118 -5.169 -2.065 -2.997 322 2HG2 VAL 118 2HG2 VAL 118 -5.883 -1.768 -4.582 323 3HG2 VAL 118 3HG2 VAL 118 -5.546 -0.417 -3.500 324 H GLU 119 H GLU 119 -8.208 -4.668 -1.729 325 HA GLU 119 HA GLU 119 -10.300 -5.564 -1.525 326 1HB GLU 119 1HB GLU 119 -9.540 -5.421 0.814 327 2HB GLU 119 2HB GLU 119 -10.255 -3.820 0.946 328 1HG GLU 119 1HG GLU 119 -12.346 -5.380 0.057 329 2HG GLU 119 2HG GLU 119 -11.486 -6.439 1.172 330 H ALA 120 H ALA 120 -10.262 -3.299 -3.212 331 HA ALA 120 HA ALA 120 -12.303 -1.442 -2.631 332 1HB ALA 120 1HB ALA 120 -10.687 -2.177 -4.962 333 2HB ALA 120 2HB ALA 120 -12.280 -1.532 -5.354 334 3HB ALA 120 3HB ALA 120 -11.164 -0.588 -4.366 335 H MET 121 H MET 121 -14.269 -2.190 -2.065 336 HA MET 121 HA MET 121 -16.268 -3.282 -2.150 337 1HB MET 121 1HB MET 121 -17.415 -3.198 -4.223 338 2HB MET 121 2HB MET 121 -16.332 -1.814 -4.216 339 1HG MET 121 1HG MET 121 -14.983 -2.681 -5.845 340 2HG MET 121 2HG MET 121 -15.390 -4.349 -5.449 341 1HE MET 121 1HE MET 121 -17.070 -1.142 -6.086 342 2HE MET 121 2HE MET 121 -17.190 -1.192 -7.845 343 3HE MET 121 3HE MET 121 -18.588 -1.606 -6.853 344 H LYS 122 H LYS 122 -13.805 -4.883 -2.070 345 HA LYS 122 HA LYS 122 -13.384 -7.125 -1.863 346 1HB LYS 122 1HB LYS 122 -15.931 -7.303 -1.667 347 2HB LYS 122 2HB LYS 122 -15.922 -7.708 -3.377 348 1HG LYS 122 1HG LYS 122 -15.984 -9.650 -1.783 349 2HG LYS 122 2HG LYS 122 -14.710 -9.697 -3.002 350 1HD LYS 122 1HD LYS 122 -13.897 -10.355 -0.772 351 2HD LYS 122 2HD LYS 122 -13.086 -8.909 -1.379 352 1HE LYS 122 1HE LYS 122 -14.403 -7.496 0.025 353 2HE LYS 122 2HE LYS 122 -15.449 -8.837 0.489 354 H MET 123 H MET 123 -11.887 -6.029 -3.578 355 HA MET 123 HA MET 123 -12.078 -7.624 -6.046 356 1HB MET 123 1HB MET 123 -12.368 -5.545 -6.951 357 2HB MET 123 2HB MET 123 -11.518 -4.736 -5.644 358 1HG MET 123 1HG MET 123 -9.393 -5.343 -6.570 359 2HG MET 123 2HG MET 123 -10.166 -6.348 -7.795 360 1HE MET 123 1HE MET 123 -9.588 -3.113 -6.250 361 2HE MET 123 2HE MET 123 -8.762 -2.393 -7.632 362 3HE MET 123 3HE MET 123 -10.411 -1.906 -7.239 363 H MET 124 H MET 124 -10.410 -7.229 -3.239 364 HA MET 124 HA MET 124 -8.277 -7.655 -2.523 365 1HB MET 124 1HB MET 124 -8.675 -9.791 -4.623 366 2HB MET 124 2HB MET 124 -7.376 -9.804 -3.438 367 1HG MET 124 1HG MET 124 -10.318 -9.850 -2.802 368 2HG MET 124 2HG MET 124 -9.246 -11.249 -2.799 369 1HE MET 124 1HE MET 124 -11.093 -10.650 -0.760 370 2HE MET 124 2HE MET 124 -10.276 -10.667 0.804 371 3HE MET 124 3HE MET 124 -10.877 -9.148 0.139 372 H ASN 125 H ASN 125 -8.303 -5.580 -4.412 373 HA ASN 125 HA ASN 125 -6.438 -5.929 -6.499 374 1HB ASN 125 1HB ASN 125 -7.890 -4.048 -6.618 375 2HB ASN 125 2HB ASN 125 -7.401 -3.481 -5.022 376 1HD2 ASN 125 2HD2 ASN 125 -7.225 -1.541 -6.577 377 2HD2 ASN 125 1HD2 ASN 125 -5.649 -1.257 -7.225 378 H GLN 126 H GLN 126 -4.994 -7.259 -4.963 379 HA GLN 126 HA GLN 126 -3.322 -5.849 -3.138 380 1HB GLN 126 1HB GLN 126 -2.091 -7.889 -2.937 381 2HB GLN 126 2HB GLN 126 -3.796 -8.306 -3.050 382 1HG GLN 126 1HG GLN 126 -3.370 -8.662 -5.536 383 2HG GLN 126 2HG GLN 126 -1.657 -8.609 -5.128 384 1HE2 GLN 126 2HE2 GLN 126 -3.713 -10.732 -6.013 385 2HE2 GLN 126 1HE2 GLN 126 -3.370 -12.065 -4.969 386 H ILE 127 H ILE 127 -2.128 -4.219 -3.913 387 HA ILE 127 HA ILE 127 -0.931 -4.242 -6.507 388 HB ILE 127 HB ILE 127 -0.211 -2.397 -4.236 389 1HG1 ILE 127 1HG1 ILE 127 -2.674 -2.493 -4.545 390 2HG1 ILE 127 2HG1 ILE 127 -1.995 -0.922 -4.961 391 1HG2 ILE 127 1HG2 ILE 127 0.237 -2.452 -7.161 392 2HG2 ILE 127 2HG2 ILE 127 -0.102 -0.884 -6.427 393 3HG2 ILE 127 3HG2 ILE 127 1.267 -1.844 -5.865 394 1HD1 ILE 127 1HD1 ILE 127 -2.709 -3.066 -6.946 395 2HD1 ILE 127 2HD1 ILE 127 -3.719 -1.680 -6.539 396 3HD1 ILE 127 3HD1 ILE 127 -2.152 -1.433 -7.309 397 H GLU 128 H GLU 128 1.388 -3.976 -6.891 398 HA GLU 128 HA GLU 128 3.018 -5.483 -4.953 399 1HB GLU 128 1HB GLU 128 3.220 -5.555 -7.970 400 2HB GLU 128 2HB GLU 128 4.266 -6.419 -6.852 401 1HG GLU 128 1HG GLU 128 1.985 -7.409 -5.999 402 2HG GLU 128 2HG GLU 128 1.446 -6.957 -7.618 403 H ALA 129 H ALA 129 4.774 -4.471 -4.234 404 HA ALA 129 HA ALA 129 5.410 -1.885 -4.472 405 1HB ALA 129 1HB ALA 129 6.926 -4.276 -3.785 406 2HB ALA 129 2HB ALA 129 7.937 -2.962 -4.389 407 3HB ALA 129 3HB ALA 129 6.881 -2.696 -3.001 408 H ASP 130 H ASP 130 5.072 -1.001 -6.508 409 HA ASP 130 HA ASP 130 6.432 -1.957 -8.836 410 1HB ASP 130 1HB ASP 130 5.612 0.236 -9.825 411 2HB ASP 130 2HB ASP 130 4.363 -0.844 -9.208 412 H LYS 131 H LYS 131 7.262 0.088 -6.230 413 HA LYS 131 HA LYS 131 9.660 0.991 -7.685 414 1HB LYS 131 1HB LYS 131 7.941 2.433 -5.687 415 2HB LYS 131 2HB LYS 131 9.625 2.884 -5.914 416 1HG LYS 131 1HG LYS 131 9.009 4.171 -7.602 417 2HG LYS 131 2HG LYS 131 8.505 2.726 -8.483 418 1HD LYS 131 1HD LYS 131 6.281 2.913 -7.715 419 2HD LYS 131 2HD LYS 131 6.726 4.092 -6.479 420 1HE LYS 131 1HE LYS 131 7.565 5.269 -8.831 421 2HE LYS 131 2HE LYS 131 6.052 4.485 -9.283 422 1HZ LYS 131 1HZ LYS 131 6.393 6.355 -7.000 423 2HZ LYS 131 2HZ LYS 131 5.710 6.754 -8.495 424 3HZ LYS 131 3HZ LYS 131 4.942 5.635 -7.487 425 H SER 132 H SER 132 11.469 0.125 -6.945 426 HA SER 132 HA SER 132 11.565 -1.466 -4.604 427 1HB SER 132 1HB SER 132 13.067 -2.134 -6.269 428 2HB SER 132 2HB SER 132 13.626 -0.487 -6.559 429 HG SER 132 HG SER 132 14.394 -2.314 -4.612 430 H GLY 133 H GLY 133 13.399 -1.124 -2.960 431 1HA GLY 133 1HA GLY 133 14.736 0.589 -1.810 432 2HA GLY 133 2HA GLY 133 13.427 1.715 -2.140 433 H THR 134 H THR 134 13.563 2.107 0.187 434 HA THR 134 HA THR 134 12.197 0.031 1.762 435 HB THR 134 HB THR 134 13.894 2.321 2.764 436 HG1 THR 134 HG1 THR 134 15.533 1.005 2.701 437 1HG2 THR 134 1HG2 THR 134 12.045 1.139 4.240 438 2HG2 THR 134 2HG2 THR 134 13.318 -0.069 4.408 439 3HG2 THR 134 3HG2 THR 134 13.618 1.600 4.892 440 H VAL 135 H VAL 135 10.377 0.539 2.939 441 HA VAL 135 HA VAL 135 8.865 2.797 2.017 442 HB VAL 135 HB VAL 135 8.278 0.642 4.042 443 1HG1 VAL 135 1HG1 VAL 135 7.185 2.724 4.753 444 2HG1 VAL 135 2HG1 VAL 135 6.434 2.862 3.163 445 3HG1 VAL 135 3HG1 VAL 135 6.016 1.515 4.220 446 1HG2 VAL 135 1HG2 VAL 135 7.963 0.909 1.205 447 2HG2 VAL 135 2HG2 VAL 135 7.641 -0.485 2.237 448 3HG2 VAL 135 3HG2 VAL 135 6.385 0.723 1.969 449 H LYS 136 H LYS 136 8.589 4.725 2.960 450 HA LYS 136 HA LYS 136 10.135 5.348 5.319 451 1HB LYS 136 1HB LYS 136 9.138 6.789 3.079 452 2HB LYS 136 2HB LYS 136 8.472 7.531 4.527 453 1HG LYS 136 1HG LYS 136 11.398 7.000 4.062 454 2HG LYS 136 2HG LYS 136 10.594 8.548 3.796 455 1HD LYS 136 1HD LYS 136 11.073 9.022 5.924 456 2HD LYS 136 2HD LYS 136 9.842 7.836 6.364 457 1HE LYS 136 1HE LYS 136 11.793 7.242 7.561 458 2HE LYS 136 2HE LYS 136 11.653 6.086 6.237 459 1HZ LYS 136 1HZ LYS 136 13.155 8.068 5.168 460 2HZ LYS 136 2HZ LYS 136 13.708 8.022 6.766 461 3HZ LYS 136 3HZ LYS 136 13.758 6.625 5.813 462 H ALA 137 H ALA 137 6.710 5.276 4.397 463 HA ALA 137 HA ALA 137 5.742 4.428 6.838 464 1HB ALA 137 1HB ALA 137 6.587 7.120 6.999 465 2HB ALA 137 2HB ALA 137 4.825 7.116 7.059 466 3HB ALA 137 3HB ALA 137 5.749 6.162 8.220 467 H ILE 138 H ILE 138 3.404 4.558 7.028 468 HA ILE 138 HA ILE 138 2.121 5.054 4.422 469 HB ILE 138 HB ILE 138 1.514 3.025 6.565 470 1HG1 ILE 138 1HG1 ILE 138 2.339 2.945 3.678 471 2HG1 ILE 138 2HG1 ILE 138 3.061 2.125 5.058 472 1HG2 ILE 138 1HG2 ILE 138 -0.251 3.922 4.296 473 2HG2 ILE 138 2HG2 ILE 138 -0.461 2.393 5.150 474 3HG2 ILE 138 3HG2 ILE 138 -0.622 3.918 6.020 475 1HD1 ILE 138 1HD1 ILE 138 1.049 0.686 5.186 476 2HD1 ILE 138 2HD1 ILE 138 0.460 1.448 3.708 477 3HD1 ILE 138 3HD1 ILE 138 1.956 0.513 3.683 478 H LEU 139 H LEU 139 0.351 6.339 4.314 479 HA LEU 139 HA LEU 139 -0.427 7.721 6.782 480 1HB LEU 139 1HB LEU 139 -0.441 8.437 3.892 481 2HB LEU 139 2HB LEU 139 -1.651 9.171 4.926 482 HG LEU 139 HG LEU 139 0.194 10.008 6.392 483 1HD1 LEU 139 1HD1 LEU 139 1.871 8.327 5.702 484 2HD1 LEU 139 2HD1 LEU 139 1.974 9.118 4.129 485 3HD1 LEU 139 3HD1 LEU 139 2.462 9.985 5.585 486 1HD2 LEU 139 1HD2 LEU 139 -0.748 10.990 3.957 487 2HD2 LEU 139 2HD2 LEU 139 0.053 11.901 5.236 488 3HD2 LEU 139 3HD2 LEU 139 0.999 11.229 3.909 489 H VAL 140 H VAL 140 -1.854 6.225 3.895 490 HA VAL 140 HA VAL 140 -4.489 6.446 4.216 491 HB VAL 140 HB VAL 140 -2.974 3.915 3.595 492 1HG1 VAL 140 1HG1 VAL 140 -5.852 4.325 4.005 493 2HG1 VAL 140 2HG1 VAL 140 -5.425 3.526 2.492 494 3HG1 VAL 140 3HG1 VAL 140 -4.900 2.841 4.031 495 1HG2 VAL 140 1HG2 VAL 140 -2.728 5.768 2.011 496 2HG2 VAL 140 2HG2 VAL 140 -3.612 4.420 1.297 497 3HG2 VAL 140 3HG2 VAL 140 -4.481 5.855 1.842 498 H GLU 141 H GLU 141 -5.990 6.052 5.684 499 HA GLU 141 HA GLU 141 -5.351 5.090 8.263 500 1HB GLU 141 1HB GLU 141 -8.164 5.247 7.225 501 2HB GLU 141 2HB GLU 141 -7.567 5.570 8.846 502 1HG GLU 141 1HG GLU 141 -7.757 7.715 8.281 503 2HG GLU 141 2HG GLU 141 -6.258 7.461 7.388 504 H SER 142 H SER 142 -4.396 3.099 7.080 505 HA SER 142 HA SER 142 -5.627 1.026 5.964 506 1HB SER 142 1HB SER 142 -3.688 0.042 6.467 507 2HB SER 142 2HB SER 142 -3.329 1.379 7.560 508 HG SER 142 HG SER 142 -3.409 -0.125 9.032 509 H GLY 143 H GLY 143 -6.633 -0.976 6.758 510 1HA GLY 143 1HA GLY 143 -8.153 -2.151 8.027 511 2HA GLY 143 2HA GLY 143 -7.745 -1.105 9.381 512 H GLN 144 H GLN 144 -8.545 0.811 6.801 513 HA GLN 144 HA GLN 144 -11.420 0.800 7.350 514 1HB GLN 144 1HB GLN 144 -9.581 2.748 8.356 515 2HB GLN 144 2HB GLN 144 -10.616 3.518 7.163 516 1HG GLN 144 1HG GLN 144 -12.523 2.315 8.491 517 2HG GLN 144 2HG GLN 144 -11.320 2.293 9.780 518 1HE2 GLN 144 2HE2 GLN 144 -10.146 4.820 8.698 519 2HE2 GLN 144 1HE2 GLN 144 -11.206 6.068 9.248 520 HA PRO 145 HA PRO 145 -12.183 1.862 3.144 521 1HB PRO 145 1HB PRO 145 -13.142 4.587 3.830 522 2HB PRO 145 2HB PRO 145 -13.975 3.282 2.980 523 1HG PRO 145 1HG PRO 145 -14.616 3.907 5.493 524 2HG PRO 145 2HG PRO 145 -14.600 2.221 4.943 525 1HD PRO 145 1HD PRO 145 -12.594 3.697 6.598 526 2HD PRO 145 2HD PRO 145 -13.160 2.019 6.741 527 H VAL 146 H VAL 146 -11.474 3.116 1.327 528 HA VAL 146 HA VAL 146 -9.238 4.936 1.946 529 HB VAL 146 HB VAL 146 -9.452 2.964 -0.332 530 1HG1 VAL 146 1HG1 VAL 146 -7.479 5.158 0.225 531 2HG1 VAL 146 2HG1 VAL 146 -7.072 3.763 -0.775 532 3HG1 VAL 146 3HG1 VAL 146 -8.385 4.839 -1.255 533 1HG2 VAL 146 1HG2 VAL 146 -8.758 2.316 2.125 534 2HG2 VAL 146 2HG2 VAL 146 -7.899 1.659 0.732 535 3HG2 VAL 146 3HG2 VAL 146 -7.216 3.014 1.632 536 H GLU 147 H GLU 147 -8.784 6.574 0.330 537 HA GLU 147 HA GLU 147 -11.129 7.262 -1.316 538 1HB GLU 147 1HB GLU 147 -9.932 8.741 0.857 539 2HB GLU 147 2HB GLU 147 -9.845 9.667 -0.638 540 1HG GLU 147 1HG GLU 147 -11.939 10.285 -0.315 541 2HG GLU 147 2HG GLU 147 -12.433 8.609 -0.551 542 H PHE 148 H PHE 148 -10.698 8.511 -3.211 543 HA PHE 148 HA PHE 148 -8.492 7.656 -4.687 544 1HB PHE 148 1HB PHE 148 -10.337 8.335 -5.950 545 2HB PHE 148 2HB PHE 148 -10.490 9.849 -5.071 546 HD1 PHE 148 HD1 PHE 148 -8.158 8.047 -7.348 547 HD2 PHE 148 HD2 PHE 148 -9.683 11.799 -6.015 548 HE1 PHE 148 HE1 PHE 148 -6.870 9.191 -9.111 549 HE2 PHE 148 HE2 PHE 148 -8.398 12.951 -7.775 550 HZ PHE 148 HZ PHE 148 -6.990 11.647 -9.325 551 H ASP 149 H ASP 149 -6.428 8.223 -4.591 552 HA ASP 149 HA ASP 149 -4.574 9.583 -4.545 553 1HB ASP 149 1HB ASP 149 -6.397 11.412 -5.198 554 2HB ASP 149 2HB ASP 149 -6.079 11.956 -3.554 555 H GLU 150 H GLU 150 -4.956 7.922 -2.545 556 HA GLU 150 HA GLU 150 -4.447 9.499 -0.107 557 1HB GLU 150 1HB GLU 150 -6.484 7.744 -0.421 558 2HB GLU 150 2HB GLU 150 -5.236 6.661 0.180 559 1HG GLU 150 1HG GLU 150 -6.269 7.323 2.118 560 2HG GLU 150 2HG GLU 150 -4.921 8.454 2.024 561 HA PRO 151 HA PRO 151 -0.242 8.028 -0.794 562 1HB PRO 151 1HB PRO 151 -0.237 8.863 2.080 563 2HB PRO 151 2HB PRO 151 0.958 9.184 0.817 564 1HG PRO 151 1HG PRO 151 -0.782 11.065 1.557 565 2HG PRO 151 2HG PRO 151 -0.308 10.871 -0.140 566 1HD PRO 151 1HD PRO 151 -2.860 10.169 1.201 567 2HD PRO 151 2HD PRO 151 -2.556 10.617 -0.488 568 H LEU 152 H LEU 152 -0.932 5.814 -0.956 569 HA LEU 152 HA LEU 152 -1.646 4.208 1.235 570 1HB LEU 152 1HB LEU 152 -0.221 3.323 -1.273 571 2HB LEU 152 2HB LEU 152 -1.173 2.316 -0.196 572 HG LEU 152 HG LEU 152 -2.501 4.643 -1.510 573 1HD1 LEU 152 1HD1 LEU 152 -1.363 2.314 -2.896 574 2HD1 LEU 152 2HD1 LEU 152 -3.055 2.656 -3.254 575 3HD1 LEU 152 3HD1 LEU 152 -1.829 3.896 -3.521 576 1HD2 LEU 152 1HD2 LEU 152 -3.238 2.267 -0.039 577 2HD2 LEU 152 2HD2 LEU 152 -4.199 3.692 -0.434 578 3HD2 LEU 152 3HD2 LEU 152 -4.084 2.360 -1.583 579 H VAL 153 H VAL 153 1.505 4.535 -0.404 580 HA VAL 153 HA VAL 153 2.860 4.101 2.128 581 HB VAL 153 HB VAL 153 3.617 2.344 -0.195 582 1HG1 VAL 153 1HG1 VAL 153 4.600 2.823 2.507 583 2HG1 VAL 153 2HG1 VAL 153 4.344 1.116 2.149 584 3HG1 VAL 153 3HG1 VAL 153 5.402 2.083 1.122 585 1HG2 VAL 153 1HG2 VAL 153 1.657 1.803 2.018 586 2HG2 VAL 153 2HG2 VAL 153 1.438 1.597 0.281 587 3HG2 VAL 153 3HG2 VAL 153 2.501 0.507 1.172 588 H VAL 154 H VAL 154 4.333 5.655 2.233 589 HA VAL 154 HA VAL 154 5.385 6.832 -0.214 590 HB VAL 154 HB VAL 154 6.179 8.630 1.099 591 1HG1 VAL 154 1HG1 VAL 154 3.548 7.659 2.204 592 2HG1 VAL 154 2HG1 VAL 154 4.186 9.287 2.438 593 3HG1 VAL 154 3HG1 VAL 154 3.800 8.717 0.815 594 1HG2 VAL 154 1HG2 VAL 154 6.056 6.662 3.320 595 2HG2 VAL 154 2HG2 VAL 154 7.302 7.846 2.923 596 3HG2 VAL 154 3HG2 VAL 154 5.811 8.365 3.709 597 H ILE 155 H ILE 155 7.164 6.041 -1.093 598 HA ILE 155 HA ILE 155 9.004 4.419 0.441 599 HB ILE 155 HB ILE 155 9.200 5.253 -2.454 600 1HG1 ILE 155 1HG1 ILE 155 8.196 2.592 -1.477 601 2HG1 ILE 155 2HG1 ILE 155 7.096 3.954 -1.669 602 1HG2 ILE 155 1HG2 ILE 155 10.569 3.112 -0.839 603 2HG2 ILE 155 2HG2 ILE 155 10.590 3.169 -2.602 604 3HG2 ILE 155 3HG2 ILE 155 11.308 4.481 -1.669 605 1HD1 ILE 155 1HD1 ILE 155 8.557 3.825 -4.046 606 2HD1 ILE 155 2HD1 ILE 155 8.140 2.159 -3.643 607 3HD1 ILE 155 3HD1 ILE 155 6.872 3.376 -3.791 608 H GLU 156 H GLU 156 11.292 4.803 0.517 609 HA GLU 156 HA GLU 156 11.905 7.636 0.829 610 1HB GLU 156 1HB GLU 156 12.425 5.767 2.550 611 2HB GLU 156 2HB GLU 156 13.778 5.383 1.494 612 1HG GLU 156 1HG GLU 156 14.196 7.996 1.739 613 2HG GLU 156 2HG GLU 156 13.341 7.718 3.255 614 1H10 BTN 222 1H10 BTN 122 -13.964 -9.964 3.833 615 2H10 BTN 222 2H10 BTN 122 -13.617 -8.455 4.675 616 1H9 BTN 222 1H9 BTN 122 -11.438 -9.275 2.940 617 2H9 BTN 222 2H9 BTN 122 -11.820 -10.486 4.167 618 1H8 BTN 222 1H8 BTN 122 -11.507 -8.913 5.931 619 2H8 BTN 222 2H8 BTN 122 -11.395 -7.570 4.791 620 1H7 BTN 222 1H7 BTN 122 -9.466 -9.647 4.213 621 2H7 BTN 222 2H7 BTN 122 -9.296 -9.040 5.853 622 H2 BTN 222 H2 BTN 122 -8.739 -6.890 5.146 623 1H6 BTN 222 1H6 BTN 122 -9.617 -8.687 1.591 624 2H6 BTN 222 2H6 BTN 122 -8.957 -7.292 0.749 625 H5 BTN 222 H5 BTN 122 -6.883 -7.555 1.714 626 HN1 BTN 222 HN2 BTN 122 -7.335 -10.013 1.189 627 HN2 BTN 222 HN1 BTN 122 -7.095 -9.528 5.129 628 H4 BTN 222 H4 BTN 122 -6.785 -7.255 3.995 Start of MODEL 20 1 1H GLU 77 H GLU 77 14.430 19.483 -3.491 2 HA GLU 77 HA GLU 77 15.303 17.101 -2.384 3 1HB GLU 77 1HB GLU 77 12.652 18.478 -1.910 4 2HB GLU 77 2HB GLU 77 13.390 17.284 -0.849 5 1HG GLU 77 1HG GLU 77 14.339 18.962 0.234 6 2HG GLU 77 2HG GLU 77 15.346 19.228 -1.189 7 H ILE 78 H ILE 78 14.293 15.059 -2.084 8 HA ILE 78 HA ILE 78 12.298 14.369 -4.140 9 HB ILE 78 HB ILE 78 14.357 13.471 -4.937 10 1HG1 ILE 78 1HG1 ILE 78 13.120 11.112 -3.542 11 2HG1 ILE 78 2HG1 ILE 78 12.238 11.984 -4.791 12 1HG2 ILE 78 1HG2 ILE 78 14.738 12.316 -2.179 13 2HG2 ILE 78 2HG2 ILE 78 15.772 11.989 -3.570 14 3HG2 ILE 78 3HG2 ILE 78 15.670 13.622 -2.912 15 1HD1 ILE 78 1HD1 ILE 78 14.991 10.931 -5.297 16 2HD1 ILE 78 2HD1 ILE 78 13.568 9.901 -5.456 17 3HD1 ILE 78 3HD1 ILE 78 13.727 11.347 -6.454 18 H SER 79 H SER 79 10.526 13.422 -3.373 19 HA SER 79 HA SER 79 10.530 12.500 -0.593 20 1HB SER 79 1HB SER 79 8.418 13.502 -2.460 21 2HB SER 79 2HB SER 79 7.945 12.437 -1.136 22 HG SER 79 HG SER 79 9.164 13.969 0.230 23 H GLY 80 H GLY 80 11.213 11.116 -3.385 24 1HA GLY 80 1HA GLY 80 11.378 8.861 -3.898 25 2HA GLY 80 2HA GLY 80 10.412 8.499 -2.476 26 H HIS 81 H HIS 81 8.776 7.273 -3.160 27 HA HIS 81 HA HIS 81 7.044 8.363 -5.260 28 1HB HIS 81 1HB HIS 81 6.878 5.596 -5.593 29 2HB HIS 81 2HB HIS 81 7.648 6.742 -6.684 30 HD1 HIS 81 HD1 HIS 81 10.279 7.322 -5.671 31 HD2 HIS 81 HD2 HIS 81 8.575 3.587 -5.027 32 HE1 HIS 81 HE1 HIS 81 12.206 5.778 -5.194 33 HE2 HIS 81 HE2 HIS 81 11.144 3.542 -4.722 34 H ILE 82 H ILE 82 5.268 8.828 -4.120 35 HA ILE 82 HA ILE 82 4.385 7.106 -1.960 36 HB ILE 82 HB ILE 82 3.061 9.590 -3.053 37 1HG1 ILE 82 1HG1 ILE 82 5.209 9.180 -0.995 38 2HG1 ILE 82 2HG1 ILE 82 5.130 10.368 -2.292 39 1HG2 ILE 82 1HG2 ILE 82 2.663 7.991 -0.534 40 2HG2 ILE 82 2HG2 ILE 82 2.038 9.625 -0.755 41 3HG2 ILE 82 3HG2 ILE 82 1.488 8.322 -1.808 42 1HD1 ILE 82 1HD1 ILE 82 3.044 11.199 -0.894 43 2HD1 ILE 82 2HD1 ILE 82 3.938 10.425 0.414 44 3HD1 ILE 82 3HD1 ILE 82 4.690 11.713 -0.526 45 H VAL 83 H VAL 83 2.728 5.698 -2.024 46 HA VAL 83 HA VAL 83 1.387 5.323 -4.609 47 HB VAL 83 HB VAL 83 1.579 3.425 -2.264 48 1HG1 VAL 83 1HG1 VAL 83 0.229 3.277 -4.922 49 2HG1 VAL 83 2HG1 VAL 83 0.880 1.809 -4.193 50 3HG1 VAL 83 3HG1 VAL 83 -0.343 2.750 -3.339 51 1HG2 VAL 83 1HG2 VAL 83 3.670 4.039 -3.721 52 2HG2 VAL 83 2HG2 VAL 83 3.336 2.360 -3.296 53 3HG2 VAL 83 3HG2 VAL 83 2.907 2.968 -4.895 54 H ARG 84 H ARG 84 -0.228 6.891 -4.413 55 HA ARG 84 HA ARG 84 -2.049 6.752 -2.147 56 1HB ARG 84 1HB ARG 84 -3.010 8.766 -2.962 57 2HB ARG 84 2HB ARG 84 -1.270 8.934 -3.157 58 1HG ARG 84 1HG ARG 84 -1.887 7.936 -5.565 59 2HG ARG 84 2HG ARG 84 -3.400 8.762 -5.188 60 1HD ARG 84 1HD ARG 84 -2.486 10.727 -5.665 61 2HD ARG 84 2HD ARG 84 -1.207 10.451 -4.484 62 HE ARG 84 HE ARG 84 -0.539 8.999 -6.749 63 1HH1 ARG 84 1HH1 ARG 84 -1.028 12.333 -5.871 64 2HH1 ARG 84 2HH1 ARG 84 0.089 12.941 -7.046 65 1HH2 ARG 84 1HH2 ARG 84 0.935 9.788 -8.299 66 2HH2 ARG 84 2HH2 ARG 84 1.205 11.495 -8.428 67 H SER 85 H SER 85 -4.210 6.187 -2.275 68 HA SER 85 HA SER 85 -4.871 4.244 -4.262 69 1HB SER 85 1HB SER 85 -5.647 3.994 -1.953 70 2HB SER 85 2HB SER 85 -6.580 5.485 -2.091 71 HG SER 85 HG SER 85 -7.096 3.615 -4.047 72 HA PRO 86 HA PRO 86 -6.259 7.299 -7.265 73 1HB PRO 86 1HB PRO 86 -7.299 4.788 -8.482 74 2HB PRO 86 2HB PRO 86 -6.342 6.080 -9.213 75 1HG PRO 86 1HG PRO 86 -5.216 3.753 -8.579 76 2HG PRO 86 2HG PRO 86 -4.348 5.280 -8.337 77 1HD PRO 86 1HD PRO 86 -5.689 3.522 -6.330 78 2HD PRO 86 2HD PRO 86 -4.198 4.474 -6.181 79 H MET 87 H MET 87 -8.278 4.565 -6.203 80 HA MET 87 HA MET 87 -10.579 6.403 -6.163 81 1HB MET 87 1HB MET 87 -12.000 4.384 -6.668 82 2HB MET 87 2HB MET 87 -10.971 4.925 -7.987 83 1HG MET 87 1HG MET 87 -9.761 3.038 -7.996 84 2HG MET 87 2HG MET 87 -9.779 2.894 -6.239 85 1HE MET 87 1HE MET 87 -11.858 2.771 -9.394 86 2HE MET 87 2HE MET 87 -11.192 1.140 -9.475 87 3HE MET 87 3HE MET 87 -12.918 1.376 -9.198 88 H VAL 88 H VAL 88 -12.405 5.430 -4.762 89 HA VAL 88 HA VAL 88 -11.416 5.180 -2.121 90 HB VAL 88 HB VAL 88 -14.172 4.844 -3.289 91 1HG1 VAL 88 1HG1 VAL 88 -13.367 4.690 -0.387 92 2HG1 VAL 88 2HG1 VAL 88 -15.024 4.808 -0.978 93 3HG1 VAL 88 3HG1 VAL 88 -14.052 3.387 -1.358 94 1HG2 VAL 88 1HG2 VAL 88 -12.605 7.065 -2.448 95 2HG2 VAL 88 2HG2 VAL 88 -14.244 7.054 -3.098 96 3HG2 VAL 88 3HG2 VAL 88 -13.983 6.905 -1.359 97 H GLY 89 H GLY 89 -11.981 3.399 -0.624 98 1HA GLY 89 1HA GLY 89 -12.776 0.858 -1.284 99 2HA GLY 89 2HA GLY 89 -11.067 0.901 -1.690 100 H THR 90 H THR 90 -10.154 -0.328 -0.152 101 HA THR 90 HA THR 90 -10.245 0.662 2.582 102 HB THR 90 HB THR 90 -10.718 -2.269 2.060 103 HG1 THR 90 HG1 THR 90 -12.553 -1.352 1.320 104 1HG2 THR 90 1HG2 THR 90 -9.874 -1.263 4.326 105 2HG2 THR 90 2HG2 THR 90 -11.575 -0.839 4.516 106 3HG2 THR 90 3HG2 THR 90 -11.106 -2.523 4.290 107 H PHE 91 H PHE 91 -8.223 0.809 3.274 108 HA PHE 91 HA PHE 91 -6.115 -0.645 1.909 109 1HB PHE 91 1HB PHE 91 -5.915 1.791 2.463 110 2HB PHE 91 2HB PHE 91 -5.874 1.350 4.170 111 HD1 PHE 91 HD1 PHE 91 -4.212 -0.054 1.131 112 HD2 PHE 91 HD2 PHE 91 -3.761 1.662 5.008 113 HE1 PHE 91 HE1 PHE 91 -1.772 -0.375 0.985 114 HE2 PHE 91 HE2 PHE 91 -1.321 1.345 4.869 115 HZ PHE 91 HZ PHE 91 -0.324 0.324 2.856 116 H TYR 92 H TYR 92 -4.284 -1.489 3.371 117 HA TYR 92 HA TYR 92 -5.051 -2.527 5.931 118 1HB TYR 92 1HB TYR 92 -5.186 -4.227 3.503 119 2HB TYR 92 2HB TYR 92 -4.510 -4.950 4.959 120 HD1 TYR 92 HD1 TYR 92 -5.996 -4.435 7.153 121 HD2 TYR 92 HD2 TYR 92 -7.440 -4.519 3.143 122 HE1 TYR 92 HE1 TYR 92 -8.271 -4.880 7.988 123 HE2 TYR 92 HE2 TYR 92 -9.720 -4.961 3.967 124 HH TYR 92 HH TYR 92 -11.036 -5.078 5.776 125 H ARG 93 H ARG 93 -3.312 -4.207 6.660 126 HA ARG 93 HA ARG 93 -0.692 -3.525 5.531 127 1HB ARG 93 1HB ARG 93 -0.909 -3.696 8.494 128 2HB ARG 93 2HB ARG 93 0.204 -2.764 7.502 129 1HG ARG 93 1HG ARG 93 -2.170 -1.578 6.910 130 2HG ARG 93 2HG ARG 93 -2.406 -2.033 8.599 131 1HD ARG 93 1HD ARG 93 0.198 -0.978 8.400 132 2HD ARG 93 2HD ARG 93 -0.857 0.110 7.500 133 HE ARG 93 HE ARG 93 -2.121 -0.423 9.907 134 1HH1 ARG 93 1HH1 ARG 93 0.836 1.057 8.817 135 2HH1 ARG 93 2HH1 ARG 93 0.935 2.150 10.157 136 1HH2 ARG 93 1HH2 ARG 93 -2.002 1.013 11.675 137 2HH2 ARG 93 2HH2 ARG 93 -0.679 2.126 11.783 138 H THR 94 H THR 94 -2.755 -5.901 6.104 139 HA THR 94 HA THR 94 -0.655 -7.886 6.295 140 HB THR 94 HB THR 94 -2.008 -9.131 8.080 141 HG1 THR 94 HG1 THR 94 -3.707 -7.324 7.796 142 1HG2 THR 94 1HG2 THR 94 -0.464 -6.642 8.707 143 2HG2 THR 94 2HG2 THR 94 -1.109 -7.695 9.967 144 3HG2 THR 94 3HG2 THR 94 0.060 -8.324 8.805 145 HA PRO 95 HA PRO 95 -3.370 -9.458 3.096 146 1HB PRO 95 1HB PRO 95 -1.680 -11.862 3.543 147 2HB PRO 95 2HB PRO 95 -2.057 -11.015 2.040 148 1HG PRO 95 1HG PRO 95 0.339 -10.768 3.177 149 2HG PRO 95 2HG PRO 95 -0.451 -9.384 2.399 150 1HD PRO 95 1HD PRO 95 -0.159 -10.016 5.303 151 2HD PRO 95 2HD PRO 95 -0.106 -8.444 4.478 152 H SER 96 H SER 96 -3.600 -12.360 3.103 153 HA SER 96 HA SER 96 -5.962 -12.871 4.220 154 1HB SER 96 1HB SER 96 -5.062 -15.261 4.698 155 2HB SER 96 2HB SER 96 -5.031 -14.662 3.038 156 HG SER 96 HG SER 96 -2.980 -15.416 4.617 157 HA PRO 97 HA PRO 97 -6.239 -12.195 8.550 158 1HB PRO 97 1HB PRO 97 -7.213 -14.898 8.964 159 2HB PRO 97 2HB PRO 97 -8.094 -13.375 9.080 160 1HG PRO 97 1HG PRO 97 -7.981 -15.287 6.867 161 2HG PRO 97 2HG PRO 97 -9.133 -13.973 7.154 162 1HD PRO 97 1HD PRO 97 -7.289 -13.915 5.162 163 2HD PRO 97 2HD PRO 97 -7.867 -12.446 5.980 164 H ASP 98 H ASP 98 -4.733 -15.088 7.251 165 HA ASP 98 HA ASP 98 -2.960 -15.154 9.604 166 1HB ASP 98 1HB ASP 98 -4.299 -17.370 8.115 167 2HB ASP 98 2HB ASP 98 -2.702 -17.663 8.795 168 H ALA 99 H ALA 99 -2.025 -13.494 7.906 169 HA ALA 99 HA ALA 99 -0.266 -14.934 6.040 170 1HB ALA 99 1HB ALA 99 -1.861 -13.033 5.288 171 2HB ALA 99 2HB ALA 99 -0.643 -11.968 5.991 172 3HB ALA 99 3HB ALA 99 -0.206 -13.063 4.679 173 H LYS 100 H LYS 100 1.488 -12.616 5.778 174 HA LYS 100 HA LYS 100 2.860 -12.702 8.384 175 1HB LYS 100 1HB LYS 100 4.988 -12.913 7.290 176 2HB LYS 100 2HB LYS 100 3.935 -14.187 6.691 177 1HG LYS 100 1HG LYS 100 4.215 -13.508 4.605 178 2HG LYS 100 2HG LYS 100 3.696 -11.873 5.021 179 1HD LYS 100 1HD LYS 100 5.803 -11.099 5.099 180 2HD LYS 100 2HD LYS 100 6.399 -12.538 5.930 181 1HE LYS 100 1HE LYS 100 6.749 -13.692 3.940 182 2HE LYS 100 2HE LYS 100 5.660 -12.646 3.030 183 1HZ LYS 100 1HZ LYS 100 7.358 -10.832 3.519 184 2HZ LYS 100 2HZ LYS 100 8.414 -12.085 3.938 185 3HZ LYS 100 3HZ LYS 100 7.780 -12.001 2.371 186 H ALA 101 H ALA 101 1.076 -10.680 7.298 187 HA ALA 101 HA ALA 101 0.916 -8.418 7.150 188 1HB ALA 101 1HB ALA 101 2.899 -8.946 9.038 189 2HB ALA 101 2HB ALA 101 3.560 -7.671 8.015 190 3HB ALA 101 3HB ALA 101 2.008 -7.440 8.820 191 H PHE 102 H PHE 102 1.124 -6.975 5.540 192 HA PHE 102 HA PHE 102 2.850 -7.611 3.335 193 1HB PHE 102 1HB PHE 102 0.602 -5.767 3.853 194 2HB PHE 102 2HB PHE 102 1.778 -5.201 2.673 195 HD1 PHE 102 HD1 PHE 102 2.552 -7.848 1.488 196 HD2 PHE 102 HD2 PHE 102 -1.253 -6.203 2.491 197 HE1 PHE 102 HE1 PHE 102 1.493 -9.253 -0.239 198 HE2 PHE 102 HE2 PHE 102 -2.318 -7.606 0.767 199 HZ PHE 102 HZ PHE 102 -0.945 -9.132 -0.600 200 H ILE 103 H ILE 103 3.601 -5.191 2.299 201 HA ILE 103 HA ILE 103 5.969 -4.635 3.764 202 HB ILE 103 HB ILE 103 4.920 -2.798 1.639 203 1HG1 ILE 103 1HG1 ILE 103 4.499 -4.917 0.646 204 2HG1 ILE 103 2HG1 ILE 103 6.038 -4.372 -0.014 205 1HG2 ILE 103 1HG2 ILE 103 7.054 -2.353 2.874 206 2HG2 ILE 103 2HG2 ILE 103 7.705 -3.823 2.148 207 3HG2 ILE 103 3HG2 ILE 103 7.222 -2.472 1.122 208 1HD1 ILE 103 1HD1 ILE 103 7.076 -5.772 1.892 209 2HD1 ILE 103 2HD1 ILE 103 5.491 -6.546 1.955 210 3HD1 ILE 103 3HD1 ILE 103 6.436 -6.590 0.466 211 H GLU 104 H GLU 104 5.492 -3.844 5.794 212 HA GLU 104 HA GLU 104 3.805 -1.487 6.049 213 1HB GLU 104 1HB GLU 104 5.158 -2.265 8.479 214 2HB GLU 104 2HB GLU 104 3.434 -2.193 8.136 215 1HG GLU 104 1HG GLU 104 3.583 -4.419 7.089 216 2HG GLU 104 2HG GLU 104 5.286 -4.489 7.536 217 H VAL 105 H VAL 105 4.799 0.060 7.901 218 HA VAL 105 HA VAL 105 6.832 1.524 6.628 219 HB VAL 105 HB VAL 105 6.022 1.700 9.532 220 1HG1 VAL 105 1HG1 VAL 105 7.687 3.373 7.731 221 2HG1 VAL 105 2HG1 VAL 105 6.653 4.195 8.899 222 3HG1 VAL 105 3HG1 VAL 105 7.865 3.040 9.454 223 1HG2 VAL 105 1HG2 VAL 105 4.769 2.758 7.033 224 2HG2 VAL 105 2HG2 VAL 105 4.009 2.016 8.440 225 3HG2 VAL 105 3HG2 VAL 105 4.632 3.663 8.540 226 H GLY 106 H GLY 106 9.007 1.584 6.850 227 1HA GLY 106 1HA GLY 106 11.070 1.217 7.937 228 2HA GLY 106 2HA GLY 106 10.270 0.094 9.026 229 H GLN 107 H GLN 107 9.046 -0.905 6.278 230 HA GLN 107 HA GLN 107 11.021 -3.008 5.977 231 1HB GLN 107 1HB GLN 107 8.743 -3.731 6.073 232 2HB GLN 107 2HB GLN 107 8.263 -2.593 4.821 233 1HG GLN 107 1HG GLN 107 8.316 -4.684 3.777 234 2HG GLN 107 2HG GLN 107 9.795 -3.873 3.265 235 1HE2 GLN 107 1HE2 GLN 107 8.449 -6.587 4.790 236 2HE2 GLN 107 2HE2 GLN 107 9.922 -7.359 5.253 237 H LYS 108 H LYS 108 11.811 -3.671 3.840 238 HA LYS 108 HA LYS 108 11.663 -1.723 1.701 239 1HB LYS 108 1HB LYS 108 14.434 -2.445 2.522 240 2HB LYS 108 2HB LYS 108 13.851 -1.015 1.682 241 1HG LYS 108 1HG LYS 108 14.524 -0.259 3.790 242 2HG LYS 108 2HG LYS 108 12.764 -0.354 3.879 243 1HD LYS 108 1HD LYS 108 12.830 -1.909 5.486 244 2HD LYS 108 2HD LYS 108 14.072 -2.840 4.646 245 1HE LYS 108 1HE LYS 108 14.614 -0.332 6.227 246 2HE LYS 108 2HE LYS 108 14.762 -1.962 6.882 247 1HZ LYS 108 1HZ LYS 108 16.317 -2.336 4.893 248 2HZ LYS 108 2HZ LYS 108 16.399 -0.649 4.812 249 3HZ LYS 108 3HZ LYS 108 16.901 -1.453 6.214 250 H VAL 109 H VAL 109 10.914 -3.208 0.272 251 HA VAL 109 HA VAL 109 12.509 -5.649 -0.130 252 HB VAL 109 HB VAL 109 10.510 -6.440 -1.455 253 1HG1 VAL 109 1HG1 VAL 109 11.062 -6.983 0.978 254 2HG1 VAL 109 2HG1 VAL 109 9.786 -5.840 1.396 255 3HG1 VAL 109 3HG1 VAL 109 9.407 -7.272 0.439 256 1HG2 VAL 109 1HG2 VAL 109 9.513 -4.235 -1.857 257 2HG2 VAL 109 2HG2 VAL 109 8.376 -5.333 -1.076 258 3HG2 VAL 109 3HG2 VAL 109 9.178 -4.077 -0.133 259 H ASN 110 H ASN 110 12.609 -6.413 -2.435 260 HA ASN 110 HA ASN 110 13.263 -4.128 -4.154 261 1HB ASN 110 1HB ASN 110 14.575 -5.802 -5.469 262 2HB ASN 110 2HB ASN 110 15.123 -5.619 -3.806 263 1HD2 ASN 110 2HD2 ASN 110 14.932 -7.306 -2.395 264 2HD2 ASN 110 1HD2 ASN 110 14.459 -8.896 -2.877 265 H VAL 111 H VAL 111 12.674 -4.141 -6.380 266 HA VAL 111 HA VAL 111 10.109 -4.452 -7.052 267 HB VAL 111 HB VAL 111 12.359 -5.179 -8.933 268 1HG1 VAL 111 1HG1 VAL 111 9.716 -5.473 -9.400 269 2HG1 VAL 111 2HG1 VAL 111 9.950 -3.803 -9.916 270 3HG1 VAL 111 3HG1 VAL 111 10.902 -5.095 -10.649 271 1HG2 VAL 111 1HG2 VAL 111 11.970 -2.788 -7.572 272 2HG2 VAL 111 2HG2 VAL 111 12.965 -3.037 -9.006 273 3HG2 VAL 111 3HG2 VAL 111 11.295 -2.500 -9.176 274 H GLY 112 H GLY 112 8.665 -6.016 -7.574 275 1HA GLY 112 1HA GLY 112 8.177 -8.210 -8.493 276 2HA GLY 112 2HA GLY 112 9.668 -8.785 -7.763 277 H ASP 113 H ASP 113 8.853 -7.074 -5.330 278 HA ASP 113 HA ASP 113 7.419 -9.224 -4.011 279 1HB ASP 113 1HB ASP 113 9.266 -7.176 -3.216 280 2HB ASP 113 2HB ASP 113 7.819 -7.078 -2.219 281 H THR 114 H THR 114 5.602 -8.730 -2.546 282 HA THR 114 HA THR 114 3.563 -7.304 -3.933 283 HB THR 114 HB THR 114 3.010 -7.959 -1.128 284 HG1 THR 114 HG1 THR 114 3.056 -10.280 -1.745 285 1HG2 THR 114 1HG2 THR 114 1.637 -7.959 -3.607 286 2HG2 THR 114 2HG2 THR 114 1.568 -9.586 -2.930 287 3HG2 THR 114 3HG2 THR 114 0.994 -8.211 -1.984 288 H LEU 115 H LEU 115 2.055 -5.923 -2.291 289 HA LEU 115 HA LEU 115 3.729 -3.977 -0.882 290 1HB LEU 115 1HB LEU 115 3.247 -3.283 -3.296 291 2HB LEU 115 2HB LEU 115 1.580 -3.089 -2.790 292 HG LEU 115 HG LEU 115 2.920 -1.623 -0.899 293 1HD1 LEU 115 1HD1 LEU 115 4.825 -2.057 -2.845 294 2HD1 LEU 115 2HD1 LEU 115 4.176 -0.466 -3.246 295 3HD1 LEU 115 3HD1 LEU 115 4.838 -0.769 -1.639 296 1HD2 LEU 115 1HD2 LEU 115 1.673 -0.820 -3.517 297 2HD2 LEU 115 2HD2 LEU 115 0.927 -0.849 -1.919 298 3HD2 LEU 115 3HD2 LEU 115 2.174 0.344 -2.289 299 H CYS 116 H CYS 116 0.308 -4.115 -1.870 300 HA CYS 116 HA CYS 116 -0.715 -4.913 0.616 301 1HB CYS 116 1HB CYS 116 -0.091 -2.054 0.353 302 2HB CYS 116 2HB CYS 116 -1.740 -2.384 0.868 303 HG CYS 116 HG CYS 116 0.395 -2.288 2.747 304 H ILE 117 H ILE 117 -3.031 -4.879 0.697 305 HA ILE 117 HA ILE 117 -4.211 -4.892 -1.957 306 HB ILE 117 HB ILE 117 -5.231 -5.800 0.730 307 1HG1 ILE 117 1HG1 ILE 117 -5.111 -7.553 -1.664 308 2HG1 ILE 117 2HG1 ILE 117 -3.571 -7.083 -0.948 309 1HG2 ILE 117 1HG2 ILE 117 -6.688 -5.804 -1.907 310 2HG2 ILE 117 2HG2 ILE 117 -7.234 -6.612 -0.437 311 3HG2 ILE 117 3HG2 ILE 117 -7.106 -4.853 -0.480 312 1HD1 ILE 117 1HD1 ILE 117 -5.793 -8.270 0.677 313 2HD1 ILE 117 2HD1 ILE 117 -4.598 -9.258 -0.162 314 3HD1 ILE 117 3HD1 ILE 117 -4.084 -8.125 1.089 315 H VAL 118 H VAL 118 -5.981 -3.684 -2.597 316 HA VAL 118 HA VAL 118 -6.385 -1.205 -1.089 317 HB VAL 118 HB VAL 118 -7.424 -1.749 -3.860 318 1HG1 VAL 118 1HG1 VAL 118 -7.550 0.435 -2.061 319 2HG1 VAL 118 2HG1 VAL 118 -6.529 0.913 -3.416 320 3HG1 VAL 118 3HG1 VAL 118 -8.169 0.335 -3.709 321 1HG2 VAL 118 1HG2 VAL 118 -4.782 -1.983 -3.301 322 2HG2 VAL 118 2HG2 VAL 118 -5.427 -1.427 -4.845 323 3HG2 VAL 118 3HG2 VAL 118 -4.902 -0.257 -3.636 324 H GLU 119 H GLU 119 -7.950 -4.127 -1.983 325 HA GLU 119 HA GLU 119 -10.116 -4.864 -1.853 326 1HB GLU 119 1HB GLU 119 -9.421 -5.023 0.455 327 2HB GLU 119 2HB GLU 119 -9.787 -3.326 0.726 328 1HG GLU 119 1HG GLU 119 -11.921 -3.756 1.156 329 2HG GLU 119 2HG GLU 119 -12.082 -4.786 -0.266 330 H ALA 120 H ALA 120 -9.949 -2.529 -3.415 331 HA ALA 120 HA ALA 120 -11.832 -0.556 -2.682 332 1HB ALA 120 1HB ALA 120 -10.126 -1.087 -4.893 333 2HB ALA 120 2HB ALA 120 -11.747 -0.766 -5.508 334 3HB ALA 120 3HB ALA 120 -10.947 0.415 -4.471 335 H MET 121 H MET 121 -12.255 -2.728 -5.453 336 HA MET 121 HA MET 121 -15.112 -2.845 -4.853 337 1HB MET 121 1HB MET 121 -15.498 -3.252 -7.107 338 2HB MET 121 2HB MET 121 -14.102 -2.185 -7.157 339 1HG MET 121 1HG MET 121 -13.067 -3.693 -8.393 340 2HG MET 121 2HG MET 121 -13.058 -4.769 -6.998 341 1HE MET 121 1HE MET 121 -13.061 -4.898 -10.134 342 2HE MET 121 2HE MET 121 -13.330 -6.630 -9.928 343 3HE MET 121 3HE MET 121 -14.462 -5.669 -10.880 344 H LYS 122 H LYS 122 -13.284 -4.367 -3.277 345 HA LYS 122 HA LYS 122 -13.030 -6.449 -2.404 346 1HB LYS 122 1HB LYS 122 -15.658 -6.261 -3.005 347 2HB LYS 122 2HB LYS 122 -15.218 -7.640 -4.003 348 1HG LYS 122 1HG LYS 122 -15.308 -7.381 -1.053 349 2HG LYS 122 2HG LYS 122 -15.797 -8.721 -2.091 350 1HD LYS 122 1HD LYS 122 -13.272 -8.971 -2.573 351 2HD LYS 122 2HD LYS 122 -13.055 -7.979 -1.129 352 1HE LYS 122 1HE LYS 122 -14.940 -10.199 -0.803 353 2HE LYS 122 2HE LYS 122 -13.284 -10.698 -1.151 354 H MET 123 H MET 123 -11.464 -5.826 -4.612 355 HA MET 123 HA MET 123 -11.293 -8.412 -6.014 356 1HB MET 123 1HB MET 123 -10.597 -7.357 -7.954 357 2HB MET 123 2HB MET 123 -11.762 -6.204 -7.320 358 1HG MET 123 1HG MET 123 -9.433 -5.370 -6.160 359 2HG MET 123 2HG MET 123 -8.890 -5.937 -7.739 360 1HE MET 123 1HE MET 123 -9.377 -3.267 -5.888 361 2HE MET 123 2HE MET 123 -8.635 -2.499 -7.293 362 3HE MET 123 3HE MET 123 -10.231 -1.984 -6.745 363 H MET 124 H MET 124 -10.062 -7.202 -3.433 364 HA MET 124 HA MET 124 -8.013 -7.045 -2.410 365 1HB MET 124 1HB MET 124 -7.545 -9.604 -3.942 366 2HB MET 124 2HB MET 124 -6.847 -9.147 -2.395 367 1HG MET 124 1HG MET 124 -9.800 -9.503 -2.796 368 2HG MET 124 2HG MET 124 -8.730 -10.828 -2.343 369 1HE MET 124 1HE MET 124 -10.926 -8.262 -1.548 370 2HE MET 124 2HE MET 124 -11.001 -8.236 0.214 371 3HE MET 124 3HE MET 124 -9.966 -7.091 -0.641 372 H ASN 125 H ASN 125 -7.949 -5.403 -4.589 373 HA ASN 125 HA ASN 125 -5.924 -5.886 -6.464 374 1HB ASN 125 1HB ASN 125 -7.596 -4.066 -6.653 375 2HB ASN 125 2HB ASN 125 -6.794 -3.215 -5.333 376 1HD2 ASN 125 2HD2 ASN 125 -6.879 -1.646 -7.266 377 2HD2 ASN 125 1HD2 ASN 125 -5.456 -1.600 -8.243 378 H GLN 126 H GLN 126 -4.347 -6.933 -5.042 379 HA GLN 126 HA GLN 126 -2.890 -5.267 -3.190 380 1HB GLN 126 1HB GLN 126 -1.522 -7.251 -2.797 381 2HB GLN 126 2HB GLN 126 -3.235 -7.637 -2.700 382 1HG GLN 126 1HG GLN 126 -3.046 -9.166 -4.286 383 2HG GLN 126 2HG GLN 126 -2.280 -8.017 -5.380 384 1HE2 GLN 126 2HE2 GLN 126 -1.791 -10.540 -3.065 385 2HE2 GLN 126 1HE2 GLN 126 -0.101 -10.759 -3.347 386 H ILE 127 H ILE 127 -1.463 -3.837 -3.860 387 HA ILE 127 HA ILE 127 -0.269 -3.955 -6.465 388 HB ILE 127 HB ILE 127 0.508 -2.108 -4.213 389 1HG1 ILE 127 1HG1 ILE 127 -1.979 -2.148 -4.675 390 2HG1 ILE 127 2HG1 ILE 127 -1.198 -0.586 -4.896 391 1HG2 ILE 127 1HG2 ILE 127 0.862 -2.093 -7.187 392 2HG2 ILE 127 2HG2 ILE 127 0.901 -0.594 -6.259 393 3HG2 ILE 127 3HG2 ILE 127 2.068 -1.871 -5.920 394 1HD1 ILE 127 1HD1 ILE 127 -1.502 -2.377 -7.248 395 2HD1 ILE 127 2HD1 ILE 127 -2.909 -1.501 -6.645 396 3HD1 ILE 127 3HD1 ILE 127 -1.474 -0.616 -7.163 397 H GLU 128 H GLU 128 1.924 -4.194 -6.969 398 HA GLU 128 HA GLU 128 3.525 -5.531 -4.886 399 1HB GLU 128 1HB GLU 128 3.772 -5.965 -7.864 400 2HB GLU 128 2HB GLU 128 4.528 -6.899 -6.580 401 1HG GLU 128 1HG GLU 128 2.354 -7.725 -5.876 402 2HG GLU 128 2HG GLU 128 1.570 -6.757 -7.127 403 H ALA 129 H ALA 129 5.141 -4.300 -4.207 404 HA ALA 129 HA ALA 129 6.021 -1.914 -5.027 405 1HB ALA 129 1HB ALA 129 7.674 -4.191 -3.960 406 2HB ALA 129 2HB ALA 129 8.311 -2.560 -4.174 407 3HB ALA 129 3HB ALA 129 6.967 -2.844 -3.068 408 H ASP 130 H ASP 130 6.114 -1.425 -7.169 409 HA ASP 130 HA ASP 130 7.889 -3.018 -8.880 410 1HB ASP 130 1HB ASP 130 6.755 -2.069 -10.766 411 2HB ASP 130 2HB ASP 130 5.522 -2.581 -9.616 412 H LYS 131 H LYS 131 9.014 -1.279 -6.939 413 HA LYS 131 HA LYS 131 11.020 -0.029 -8.323 414 1HB LYS 131 1HB LYS 131 8.591 1.493 -8.462 415 2HB LYS 131 2HB LYS 131 9.785 2.392 -7.536 416 1HG LYS 131 1HG LYS 131 11.330 2.360 -9.344 417 2HG LYS 131 2HG LYS 131 10.336 1.215 -10.248 418 1HD LYS 131 1HD LYS 131 8.617 2.857 -10.559 419 2HD LYS 131 2HD LYS 131 9.433 3.987 -9.476 420 1HE LYS 131 1HE LYS 131 9.953 4.751 -11.627 421 2HE LYS 131 2HE LYS 131 11.390 3.871 -11.107 422 1HZ LYS 131 1HZ LYS 131 10.100 1.916 -12.305 423 2HZ LYS 131 2HZ LYS 131 9.453 3.206 -13.187 424 3HZ LYS 131 3HZ LYS 131 11.127 2.963 -13.149 425 H SER 132 H SER 132 11.370 -1.365 -6.199 426 HA SER 132 HA SER 132 12.441 -1.308 -4.181 427 1HB SER 132 1HB SER 132 13.378 0.882 -4.976 428 2HB SER 132 2HB SER 132 12.012 1.687 -4.203 429 HG SER 132 HG SER 132 13.807 -0.030 -2.835 430 H GLY 133 H GLY 133 11.601 -1.892 -2.272 431 1HA GLY 133 1HA GLY 133 8.886 -0.936 -1.650 432 2HA GLY 133 2HA GLY 133 9.577 -2.455 -1.104 433 H THR 134 H THR 134 11.418 0.495 -0.969 434 HA THR 134 HA THR 134 11.793 0.215 1.852 435 HB THR 134 HB THR 134 12.564 2.586 0.150 436 HG1 THR 134 HG1 THR 134 13.753 1.215 -0.889 437 1HG2 THR 134 1HG2 THR 134 12.847 2.404 2.783 438 2HG2 THR 134 2HG2 THR 134 14.297 1.527 2.293 439 3HG2 THR 134 3HG2 THR 134 14.041 3.184 1.747 440 H VAL 135 H VAL 135 9.281 0.346 2.015 441 HA VAL 135 HA VAL 135 7.838 2.680 1.787 442 HB VAL 135 HB VAL 135 7.623 0.571 3.940 443 1HG1 VAL 135 1HG1 VAL 135 5.878 2.913 3.266 444 2HG1 VAL 135 2HG1 VAL 135 5.207 1.459 4.005 445 3HG1 VAL 135 3HG1 VAL 135 6.459 2.376 4.842 446 1HG2 VAL 135 1HG2 VAL 135 6.345 0.925 1.244 447 2HG2 VAL 135 2HG2 VAL 135 7.256 -0.455 1.856 448 3HG2 VAL 135 3HG2 VAL 135 5.645 -0.112 2.487 449 H LYS 136 H LYS 136 8.401 4.636 2.477 450 HA LYS 136 HA LYS 136 10.103 5.069 4.729 451 1HB LYS 136 1HB LYS 136 9.348 6.544 2.511 452 2HB LYS 136 2HB LYS 136 8.580 7.396 3.844 453 1HG LYS 136 1HG LYS 136 11.510 6.730 3.631 454 2HG LYS 136 2HG LYS 136 10.778 8.312 3.353 455 1HD LYS 136 1HD LYS 136 10.142 8.511 5.635 456 2HD LYS 136 2HD LYS 136 10.529 6.819 5.957 457 1HE LYS 136 1HE LYS 136 12.758 7.217 6.111 458 2HE LYS 136 2HE LYS 136 12.720 8.505 4.909 459 1HZ LYS 136 1HZ LYS 136 11.395 9.710 6.812 460 2HZ LYS 136 2HZ LYS 136 12.261 8.640 7.795 461 3HZ LYS 136 3HZ LYS 136 13.087 9.714 6.782 462 H ALA 137 H ALA 137 6.658 5.028 4.202 463 HA ALA 137 HA ALA 137 5.906 4.633 6.802 464 1HB ALA 137 1HB ALA 137 6.566 7.438 6.286 465 2HB ALA 137 2HB ALA 137 4.982 7.188 7.019 466 3HB ALA 137 3HB ALA 137 6.429 6.564 7.812 467 H ILE 138 H ILE 138 3.589 4.917 7.187 468 HA ILE 138 HA ILE 138 2.080 5.155 4.664 469 HB ILE 138 HB ILE 138 1.723 3.246 6.963 470 1HG1 ILE 138 1HG1 ILE 138 2.240 3.045 4.018 471 2HG1 ILE 138 2HG1 ILE 138 3.061 2.238 5.350 472 1HG2 ILE 138 1HG2 ILE 138 -0.312 3.903 4.836 473 2HG2 ILE 138 2HG2 ILE 138 -0.419 2.557 5.969 474 3HG2 ILE 138 3HG2 ILE 138 -0.463 4.215 6.565 475 1HD1 ILE 138 1HD1 ILE 138 0.934 0.922 5.689 476 2HD1 ILE 138 2HD1 ILE 138 0.391 1.582 4.146 477 3HD1 ILE 138 3HD1 ILE 138 1.840 0.579 4.216 478 H LEU 139 H LEU 139 0.371 6.499 4.621 479 HA LEU 139 HA LEU 139 -0.270 7.938 7.100 480 1HB LEU 139 1HB LEU 139 -0.601 8.646 4.195 481 2HB LEU 139 2HB LEU 139 -1.385 9.554 5.473 482 HG LEU 139 HG LEU 139 0.909 9.967 6.450 483 1HD1 LEU 139 1HD1 LEU 139 1.682 8.634 3.877 484 2HD1 LEU 139 2HD1 LEU 139 2.744 9.793 4.676 485 3HD1 LEU 139 3HD1 LEU 139 2.265 8.316 5.511 486 1HD2 LEU 139 1HD2 LEU 139 -0.431 11.201 4.270 487 2HD2 LEU 139 2HD2 LEU 139 0.631 11.936 5.471 488 3HD2 LEU 139 3HD2 LEU 139 1.305 11.292 3.974 489 H VAL 140 H VAL 140 -1.821 6.518 4.240 490 HA VAL 140 HA VAL 140 -4.451 6.824 4.760 491 HB VAL 140 HB VAL 140 -3.045 4.361 3.737 492 1HG1 VAL 140 1HG1 VAL 140 -5.898 4.793 4.354 493 2HG1 VAL 140 2HG1 VAL 140 -5.541 4.074 2.783 494 3HG1 VAL 140 3HG1 VAL 140 -4.969 3.297 4.259 495 1HG2 VAL 140 1HG2 VAL 140 -3.021 6.570 2.468 496 2HG2 VAL 140 2HG2 VAL 140 -3.582 5.148 1.588 497 3HG2 VAL 140 3HG2 VAL 140 -4.747 6.313 2.216 498 H GLU 141 H GLU 141 -5.817 6.322 6.319 499 HA GLU 141 HA GLU 141 -5.005 5.054 8.704 500 1HB GLU 141 1HB GLU 141 -7.756 5.771 7.675 501 2HB GLU 141 2HB GLU 141 -7.441 5.172 9.299 502 1HG GLU 141 1HG GLU 141 -6.317 7.704 8.120 503 2HG GLU 141 2HG GLU 141 -7.678 7.603 9.236 504 H SER 142 H SER 142 -4.202 3.186 7.238 505 HA SER 142 HA SER 142 -5.578 1.268 6.017 506 1HB SER 142 1HB SER 142 -3.614 0.231 6.231 507 2HB SER 142 2HB SER 142 -3.150 1.403 7.465 508 HG SER 142 HG SER 142 -4.145 0.034 9.013 509 H GLY 143 H GLY 143 -6.556 -0.794 6.680 510 1HA GLY 143 1HA GLY 143 -7.895 -2.120 8.027 511 2HA GLY 143 2HA GLY 143 -7.508 -1.071 9.385 512 H GLN 144 H GLN 144 -8.413 1.003 7.074 513 HA GLN 144 HA GLN 144 -11.291 0.777 7.622 514 1HB GLN 144 1HB GLN 144 -9.469 2.859 8.500 515 2HB GLN 144 2HB GLN 144 -10.760 3.515 7.503 516 1HG GLN 144 1HG GLN 144 -12.339 2.188 9.018 517 2HG GLN 144 2HG GLN 144 -10.957 2.048 10.104 518 1HE2 GLN 144 2HE2 GLN 144 -9.978 4.713 9.182 519 2HE2 GLN 144 1HE2 GLN 144 -10.958 5.859 10.023 520 HA PRO 145 HA PRO 145 -12.068 1.918 3.439 521 1HB PRO 145 1HB PRO 145 -13.578 4.346 4.102 522 2HB PRO 145 2HB PRO 145 -14.146 2.837 3.385 523 1HG PRO 145 1HG PRO 145 -14.782 3.550 5.904 524 2HG PRO 145 2HG PRO 145 -14.544 1.857 5.432 525 1HD PRO 145 1HD PRO 145 -12.679 3.705 6.874 526 2HD PRO 145 2HD PRO 145 -13.016 1.986 7.171 527 H VAL 146 H VAL 146 -10.919 2.890 1.879 528 HA VAL 146 HA VAL 146 -9.334 5.244 2.582 529 HB VAL 146 HB VAL 146 -7.994 4.775 0.635 530 1HG1 VAL 146 1HG1 VAL 146 -8.634 2.321 2.258 531 2HG1 VAL 146 2HG1 VAL 146 -7.258 2.438 1.161 532 3HG1 VAL 146 3HG1 VAL 146 -7.368 3.512 2.556 533 1HG2 VAL 146 1HG2 VAL 146 -10.138 3.916 -0.621 534 2HG2 VAL 146 2HG2 VAL 146 -8.533 3.342 -1.073 535 3HG2 VAL 146 3HG2 VAL 146 -9.571 2.344 -0.056 536 H GLU 147 H GLU 147 -8.905 6.671 0.488 537 HA GLU 147 HA GLU 147 -11.407 7.170 -0.942 538 1HB GLU 147 1HB GLU 147 -11.211 8.592 1.195 539 2HB GLU 147 2HB GLU 147 -9.930 9.453 0.349 540 1HG GLU 147 1HG GLU 147 -11.362 10.461 -1.091 541 2HG GLU 147 2HG GLU 147 -12.505 9.119 -1.071 542 H PHE 148 H PHE 148 -11.112 8.779 -2.711 543 HA PHE 148 HA PHE 148 -9.035 8.055 -4.406 544 1HB PHE 148 1HB PHE 148 -10.863 8.968 -5.498 545 2HB PHE 148 2HB PHE 148 -10.983 10.314 -4.376 546 HD1 PHE 148 HD1 PHE 148 -7.899 9.226 -6.091 547 HD2 PHE 148 HD2 PHE 148 -11.046 12.097 -5.922 548 HE1 PHE 148 HE1 PHE 148 -6.674 10.654 -7.684 549 HE2 PHE 148 HE2 PHE 148 -9.828 13.532 -7.515 550 HZ PHE 148 HZ PHE 148 -7.639 12.811 -8.397 551 H ASP 149 H ASP 149 -6.937 8.494 -4.339 552 HA ASP 149 HA ASP 149 -4.984 9.673 -4.162 553 1HB ASP 149 1HB ASP 149 -6.725 11.660 -4.707 554 2HB ASP 149 2HB ASP 149 -6.234 12.135 -3.084 555 H GLU 150 H GLU 150 -5.064 8.028 -2.312 556 HA GLU 150 HA GLU 150 -4.611 9.481 0.205 557 1HB GLU 150 1HB GLU 150 -6.726 7.775 -0.192 558 2HB GLU 150 2HB GLU 150 -5.522 6.712 0.524 559 1HG GLU 150 1HG GLU 150 -6.549 7.463 2.405 560 2HG GLU 150 2HG GLU 150 -5.288 8.685 2.246 561 HA PRO 151 HA PRO 151 -0.562 7.643 -0.566 562 1HB PRO 151 1HB PRO 151 -0.239 8.710 2.199 563 2HB PRO 151 2HB PRO 151 0.815 8.893 0.791 564 1HG PRO 151 1HG PRO 151 -0.736 10.903 1.592 565 2HG PRO 151 2HG PRO 151 -0.489 10.574 -0.132 566 1HD PRO 151 1HD PRO 151 -2.859 10.001 1.588 567 2HD PRO 151 2HD PRO 151 -2.790 10.474 -0.122 568 H LEU 152 H LEU 152 -1.438 5.484 -0.448 569 HA LEU 152 HA LEU 152 -2.026 4.207 2.015 570 1HB LEU 152 1HB LEU 152 -1.173 2.934 -0.586 571 2HB LEU 152 2HB LEU 152 -1.998 2.138 0.744 572 HG LEU 152 HG LEU 152 -3.314 4.474 -0.571 573 1HD1 LEU 152 1HD1 LEU 152 -2.741 1.868 -1.827 574 2HD1 LEU 152 2HD1 LEU 152 -4.402 2.449 -1.952 575 3HD1 LEU 152 3HD1 LEU 152 -3.074 3.437 -2.559 576 1HD2 LEU 152 1HD2 LEU 152 -3.991 2.739 1.464 577 2HD2 LEU 152 2HD2 LEU 152 -5.099 3.783 0.572 578 3HD2 LEU 152 3HD2 LEU 152 -4.871 2.108 0.072 579 H VAL 153 H VAL 153 0.803 3.968 -0.140 580 HA VAL 153 HA VAL 153 2.483 3.477 2.203 581 HB VAL 153 HB VAL 153 2.691 1.735 -0.252 582 1HG1 VAL 153 1HG1 VAL 153 4.604 2.274 1.546 583 2HG1 VAL 153 2HG1 VAL 153 3.799 0.937 2.369 584 3HG1 VAL 153 3HG1 VAL 153 4.446 0.711 0.743 585 1HG2 VAL 153 1HG2 VAL 153 1.079 1.421 2.223 586 2HG2 VAL 153 2HG2 VAL 153 0.740 0.891 0.576 587 3HG2 VAL 153 3HG2 VAL 153 1.884 -0.008 1.572 588 H VAL 154 H VAL 154 3.936 5.060 2.117 589 HA VAL 154 HA VAL 154 4.834 6.068 -0.472 590 HB VAL 154 HB VAL 154 5.576 8.003 0.602 591 1HG1 VAL 154 1HG1 VAL 154 2.992 7.081 1.095 592 2HG1 VAL 154 2HG1 VAL 154 3.533 7.774 2.623 593 3HG1 VAL 154 3HG1 VAL 154 3.558 8.750 1.154 594 1HG2 VAL 154 1HG2 VAL 154 5.852 6.248 2.986 595 2HG2 VAL 154 2HG2 VAL 154 6.968 7.442 2.326 596 3HG2 VAL 154 3HG2 VAL 154 5.559 7.967 3.247 597 H ILE 155 H ILE 155 6.593 5.241 -1.361 598 HA ILE 155 HA ILE 155 8.506 3.758 0.235 599 HB ILE 155 HB ILE 155 8.782 4.305 -2.706 600 1HG1 ILE 155 1HG1 ILE 155 7.484 1.785 -2.127 601 2HG1 ILE 155 2HG1 ILE 155 6.522 3.129 -1.522 602 1HG2 ILE 155 1HG2 ILE 155 10.465 3.069 -1.066 603 2HG2 ILE 155 2HG2 ILE 155 9.408 1.704 -1.426 604 3HG2 ILE 155 3HG2 ILE 155 10.230 2.551 -2.735 605 1HD1 ILE 155 1HD1 ILE 155 7.034 4.097 -3.927 606 2HD1 ILE 155 2HD1 ILE 155 7.205 2.383 -4.302 607 3HD1 ILE 155 3HD1 ILE 155 5.695 2.991 -3.625 608 H GLU 156 H GLU 156 10.678 4.248 0.472 609 HA GLU 156 HA GLU 156 11.326 7.020 0.572 610 1HB GLU 156 1HB GLU 156 12.228 5.463 2.214 611 2HB GLU 156 2HB GLU 156 13.059 4.571 0.947 612 1HG GLU 156 1HG GLU 156 14.763 6.016 0.874 613 2HG GLU 156 2HG GLU 156 13.711 7.421 1.040 614 1H10 BTN 222 1H10 BTN 122 -13.349 -11.542 3.238 615 2H10 BTN 222 2H10 BTN 122 -13.659 -9.869 3.696 616 1H9 BTN 222 1H9 BTN 122 -11.658 -9.111 2.733 617 2H9 BTN 222 2H9 BTN 122 -11.439 -10.602 1.815 618 1H8 BTN 222 1H8 BTN 122 -11.103 -11.825 3.929 619 2H8 BTN 222 2H8 BTN 122 -11.246 -10.303 4.810 620 1H7 BTN 222 1H7 BTN 122 -9.360 -9.658 2.988 621 2H7 BTN 222 2H7 BTN 122 -9.023 -11.369 3.210 622 H2 BTN 222 H2 BTN 122 -8.927 -10.927 5.700 623 1H6 BTN 222 1H6 BTN 122 -8.156 -7.486 3.654 624 2H6 BTN 222 2H6 BTN 122 -7.377 -6.835 5.089 625 H5 BTN 222 H5 BTN 122 -5.826 -8.535 5.152 626 HN1 BTN 222 HN2 BTN 122 -5.764 -8.095 2.638 627 HN2 BTN 222 HN1 BTN 122 -7.134 -11.770 3.299 628 H4 BTN 222 H4 BTN 122 -6.652 -10.648 5.548 Start of MODEL 21 1 1H GLU 77 H GLU 77 19.539 13.673 -3.745 2 HA GLU 77 HA GLU 77 19.020 12.730 -1.159 3 1HB GLU 77 1HB GLU 77 18.502 15.121 -0.732 4 2HB GLU 77 2HB GLU 77 17.253 15.046 -1.971 5 1HG GLU 77 1HG GLU 77 15.820 13.887 -0.655 6 2HG GLU 77 2HG GLU 77 17.110 13.047 0.204 7 H ILE 78 H ILE 78 16.935 11.600 -1.003 8 HA ILE 78 HA ILE 78 15.404 11.267 -3.434 9 HB ILE 78 HB ILE 78 17.178 9.740 -3.951 10 1HG1 ILE 78 1HG1 ILE 78 15.916 7.527 -3.835 11 2HG1 ILE 78 2HG1 ILE 78 14.672 8.395 -2.941 12 1HG2 ILE 78 1HG2 ILE 78 17.794 9.562 -1.429 13 2HG2 ILE 78 2HG2 ILE 78 16.725 8.160 -1.458 14 3HG2 ILE 78 3HG2 ILE 78 18.137 8.214 -2.514 15 1HD1 ILE 78 1HD1 ILE 78 15.461 9.680 -5.443 16 2HD1 ILE 78 2HD1 ILE 78 14.737 8.084 -5.637 17 3HD1 ILE 78 3HD1 ILE 78 13.858 9.353 -4.784 18 H SER 79 H SER 79 13.356 11.112 -2.831 19 HA SER 79 HA SER 79 12.748 9.922 -0.206 20 1HB SER 79 1HB SER 79 10.579 11.324 -0.479 21 2HB SER 79 2HB SER 79 12.068 12.156 -0.035 22 HG SER 79 HG SER 79 10.853 13.157 -1.765 23 H GLY 80 H GLY 80 12.878 8.915 -3.165 24 1HA GLY 80 1HA GLY 80 11.805 7.294 -4.383 25 2HA GLY 80 2HA GLY 80 10.963 6.881 -2.896 26 H HIS 81 H HIS 81 8.852 7.391 -2.688 27 HA HIS 81 HA HIS 81 7.567 9.493 -4.079 28 1HB HIS 81 1HB HIS 81 6.241 8.249 -5.671 29 2HB HIS 81 2HB HIS 81 7.945 7.931 -5.983 30 HD1 HIS 81 HD1 HIS 81 4.776 6.259 -5.372 31 HD2 HIS 81 HD2 HIS 81 8.802 5.326 -4.938 32 HE1 HIS 81 HE1 HIS 81 4.866 3.755 -5.159 33 HE2 HIS 81 HE2 HIS 81 7.302 3.223 -4.803 34 H ILE 82 H ILE 82 4.990 8.545 -4.246 35 HA ILE 82 HA ILE 82 4.383 7.373 -1.631 36 HB ILE 82 HB ILE 82 3.166 9.949 -2.633 37 1HG1 ILE 82 1HG1 ILE 82 5.130 9.300 -0.444 38 2HG1 ILE 82 2HG1 ILE 82 5.275 10.495 -1.729 39 1HG2 ILE 82 1HG2 ILE 82 2.061 7.966 -0.979 40 2HG2 ILE 82 2HG2 ILE 82 2.525 9.297 0.081 41 3HG2 ILE 82 3HG2 ILE 82 1.444 9.590 -1.281 42 1HD1 ILE 82 1HD1 ILE 82 2.990 11.100 -0.126 43 2HD1 ILE 82 2HD1 ILE 82 4.403 10.882 0.906 44 3HD1 ILE 82 3HD1 ILE 82 4.444 12.057 -0.408 45 H VAL 83 H VAL 83 3.154 5.665 -2.041 46 HA VAL 83 HA VAL 83 1.695 5.343 -4.469 47 HB VAL 83 HB VAL 83 1.309 3.679 -1.989 48 1HG1 VAL 83 1HG1 VAL 83 0.781 3.366 -4.898 49 2HG1 VAL 83 2HG1 VAL 83 1.219 1.933 -3.969 50 3HG1 VAL 83 3HG1 VAL 83 -0.196 2.882 -3.512 51 1HG2 VAL 83 1HG2 VAL 83 3.750 4.117 -3.398 52 2HG2 VAL 83 2HG2 VAL 83 3.433 3.035 -2.041 53 3HG2 VAL 83 3HG2 VAL 83 3.208 2.466 -3.696 54 H ARG 84 H ARG 84 0.093 6.837 -4.717 55 HA ARG 84 HA ARG 84 -1.826 7.272 -2.573 56 1HB ARG 84 1HB ARG 84 -0.865 8.800 -4.775 57 2HB ARG 84 2HB ARG 84 -2.599 8.593 -4.979 58 1HG ARG 84 1HG ARG 84 -3.107 9.808 -3.119 59 2HG ARG 84 2HG ARG 84 -1.596 9.401 -2.304 60 1HD ARG 84 1HD ARG 84 -1.878 11.803 -3.105 61 2HD ARG 84 2HD ARG 84 -0.377 10.985 -3.532 62 HE ARG 84 HE ARG 84 -2.546 11.726 -5.336 63 1HH1 ARG 84 1HH1 ARG 84 0.525 10.128 -4.884 64 2HH1 ARG 84 2HH1 ARG 84 0.901 10.105 -6.573 65 1HH2 ARG 84 1HH2 ARG 84 -2.051 11.693 -7.556 66 2HH2 ARG 84 2HH2 ARG 84 -0.559 10.993 -8.090 67 H SER 85 H SER 85 -3.709 6.252 -2.428 68 HA SER 85 HA SER 85 -4.460 4.092 -3.953 69 1HB SER 85 1HB SER 85 -5.408 4.708 -1.723 70 2HB SER 85 2HB SER 85 -6.376 5.946 -2.522 71 HG SER 85 HG SER 85 -7.598 4.429 -3.439 72 HA PRO 86 HA PRO 86 -5.416 6.202 -7.829 73 1HB PRO 86 1HB PRO 86 -6.327 3.432 -8.428 74 2HB PRO 86 2HB PRO 86 -5.270 4.496 -9.363 75 1HG PRO 86 1HG PRO 86 -4.268 2.447 -7.988 76 2HG PRO 86 2HG PRO 86 -3.407 3.995 -8.076 77 1HD PRO 86 1HD PRO 86 -5.002 2.835 -5.833 78 2HD PRO 86 2HD PRO 86 -3.523 3.816 -5.780 79 H MET 87 H MET 87 -7.529 3.863 -6.200 80 HA MET 87 HA MET 87 -9.821 5.580 -6.861 81 1HB MET 87 1HB MET 87 -10.335 2.669 -6.681 82 2HB MET 87 2HB MET 87 -11.081 3.883 -7.710 83 1HG MET 87 1HG MET 87 -8.279 2.913 -8.156 84 2HG MET 87 2HG MET 87 -9.683 2.094 -8.840 85 1HE MET 87 1HE MET 87 -9.161 2.066 -10.902 86 2HE MET 87 2HE MET 87 -10.064 3.211 -11.895 87 3HE MET 87 3HE MET 87 -8.303 3.297 -11.829 88 H VAL 88 H VAL 88 -11.773 4.129 -5.535 89 HA VAL 88 HA VAL 88 -10.976 4.598 -2.763 90 HB VAL 88 HB VAL 88 -13.690 4.241 -4.034 91 1HG1 VAL 88 1HG1 VAL 88 -12.887 4.408 -1.147 92 2HG1 VAL 88 2HG1 VAL 88 -14.480 4.934 -1.692 93 3HG1 VAL 88 3HG1 VAL 88 -13.973 3.262 -1.932 94 1HG2 VAL 88 1HG2 VAL 88 -12.189 6.438 -4.080 95 2HG2 VAL 88 2HG2 VAL 88 -13.942 6.500 -3.900 96 3HG2 VAL 88 3HG2 VAL 88 -12.904 6.644 -2.482 97 H GLY 89 H GLY 89 -11.543 3.105 -1.081 98 1HA GLY 89 1HA GLY 89 -12.606 0.567 -1.396 99 2HA GLY 89 2HA GLY 89 -10.887 0.414 -1.725 100 H THR 90 H THR 90 -9.970 -0.489 -0.002 101 HA THR 90 HA THR 90 -10.138 0.867 2.548 102 HB THR 90 HB THR 90 -10.672 -2.073 2.650 103 HG1 THR 90 HG1 THR 90 -12.257 -1.135 1.238 104 1HG2 THR 90 1HG2 THR 90 -10.809 0.188 4.480 105 2HG2 THR 90 2HG2 THR 90 -12.233 -0.851 4.521 106 3HG2 THR 90 3HG2 THR 90 -10.634 -1.536 4.808 107 H PHE 91 H PHE 91 -8.076 1.097 3.089 108 HA PHE 91 HA PHE 91 -5.984 -0.493 2.035 109 1HB PHE 91 1HB PHE 91 -5.838 1.916 2.847 110 2HB PHE 91 2HB PHE 91 -5.787 1.261 4.482 111 HD1 PHE 91 HD1 PHE 91 -4.107 0.695 1.189 112 HD2 PHE 91 HD2 PHE 91 -3.714 1.009 5.423 113 HE1 PHE 91 HE1 PHE 91 -1.670 0.387 0.981 114 HE2 PHE 91 HE2 PHE 91 -1.275 0.703 5.223 115 HZ PHE 91 HZ PHE 91 -0.253 0.391 3.000 116 H TYR 92 H TYR 92 -4.315 -1.538 3.520 117 HA TYR 92 HA TYR 92 -5.164 -2.645 5.991 118 1HB TYR 92 1HB TYR 92 -5.612 -4.202 3.510 119 2HB TYR 92 2HB TYR 92 -4.987 -5.073 4.905 120 HD1 TYR 92 HD1 TYR 92 -6.371 -3.836 7.149 121 HD2 TYR 92 HD2 TYR 92 -7.836 -4.799 3.263 122 HE1 TYR 92 HE1 TYR 92 -8.654 -4.006 8.058 123 HE2 TYR 92 HE2 TYR 92 -10.123 -4.971 4.161 124 HH TYR 92 HH TYR 92 -10.778 -4.515 7.627 125 H ARG 93 H ARG 93 -3.580 -4.118 6.914 126 HA ARG 93 HA ARG 93 -0.928 -3.759 5.685 127 1HB ARG 93 1HB ARG 93 -1.904 -3.538 8.456 128 2HB ARG 93 2HB ARG 93 -0.387 -4.411 8.276 129 1HG ARG 93 1HG ARG 93 0.620 -2.436 8.294 130 2HG ARG 93 2HG ARG 93 -0.061 -2.169 6.687 131 1HD ARG 93 1HD ARG 93 -0.529 -0.310 8.236 132 2HD ARG 93 2HD ARG 93 -1.996 -1.087 7.647 133 HE ARG 93 HE ARG 93 -1.570 -2.374 9.963 134 1HH1 ARG 93 1HH1 ARG 93 -1.608 1.011 9.149 135 2HH1 ARG 93 2HH1 ARG 93 -2.162 1.513 10.711 136 1HH2 ARG 93 1HH2 ARG 93 -2.300 -1.724 12.023 137 2HH2 ARG 93 2HH2 ARG 93 -2.556 -0.042 12.345 138 H THR 94 H THR 94 -3.241 -6.032 6.837 139 HA THR 94 HA THR 94 -1.411 -8.216 6.126 140 HB THR 94 HB THR 94 -2.576 -9.550 7.982 141 HG1 THR 94 HG1 THR 94 -4.188 -8.309 8.680 142 1HG2 THR 94 1HG2 THR 94 -0.240 -8.756 8.152 143 2HG2 THR 94 2HG2 THR 94 -0.837 -7.284 8.917 144 3HG2 THR 94 3HG2 THR 94 -1.076 -8.846 9.702 145 HA PRO 95 HA PRO 95 -5.636 -8.257 3.986 146 1HB PRO 95 1HB PRO 95 -3.852 -8.626 1.650 147 2HB PRO 95 2HB PRO 95 -5.271 -7.589 1.832 148 1HG PRO 95 1HG PRO 95 -2.826 -6.546 1.807 149 2HG PRO 95 2HG PRO 95 -4.073 -5.913 2.898 150 1HD PRO 95 1HD PRO 95 -1.781 -7.751 3.511 151 2HD PRO 95 2HD PRO 95 -2.411 -6.382 4.451 152 H SER 96 H SER 96 -5.118 -10.314 5.422 153 HA SER 96 HA SER 96 -5.980 -12.559 4.279 154 1HB SER 96 1HB SER 96 -3.146 -12.125 3.512 155 2HB SER 96 2HB SER 96 -3.579 -13.761 4.016 156 HG SER 96 HG SER 96 -4.777 -12.230 1.948 157 HA PRO 97 HA PRO 97 -5.606 -13.074 8.748 158 1HB PRO 97 1HB PRO 97 -6.880 -15.635 7.877 159 2HB PRO 97 2HB PRO 97 -7.307 -14.566 9.219 160 1HG PRO 97 1HG PRO 97 -8.741 -14.551 6.981 161 2HG PRO 97 2HG PRO 97 -8.382 -13.041 7.838 162 1HD PRO 97 1HD PRO 97 -7.213 -14.115 5.317 163 2HD PRO 97 2HD PRO 97 -7.511 -12.432 5.799 164 H ASP 98 H ASP 98 -4.454 -15.108 6.179 165 HA ASP 98 HA ASP 98 -2.782 -16.640 8.036 166 1HB ASP 98 1HB ASP 98 -4.072 -17.242 5.533 167 2HB ASP 98 2HB ASP 98 -2.338 -17.523 5.394 168 H ALA 99 H ALA 99 -2.551 -13.777 6.668 169 HA ALA 99 HA ALA 99 0.069 -14.001 5.448 170 1HB ALA 99 1HB ALA 99 -1.986 -12.335 4.965 171 2HB ALA 99 2HB ALA 99 -1.031 -11.332 6.057 172 3HB ALA 99 3HB ALA 99 -0.310 -11.953 4.572 173 H LYS 100 H LYS 100 0.837 -11.306 6.496 174 HA LYS 100 HA LYS 100 1.296 -11.764 9.320 175 1HB LYS 100 1HB LYS 100 3.653 -11.867 9.249 176 2HB LYS 100 2HB LYS 100 3.102 -13.010 8.031 177 1HG LYS 100 1HG LYS 100 3.536 -11.363 6.283 178 2HG LYS 100 2HG LYS 100 4.085 -10.213 7.504 179 1HD LYS 100 1HD LYS 100 5.361 -12.896 7.444 180 2HD LYS 100 2HD LYS 100 5.777 -11.755 6.163 181 1HE LYS 100 1HE LYS 100 5.815 -10.819 8.991 182 2HE LYS 100 2HE LYS 100 7.137 -11.835 8.417 183 1HZ LYS 100 1HZ LYS 100 6.455 -9.668 6.641 184 2HZ LYS 100 2HZ LYS 100 7.021 -9.159 8.150 185 3HZ LYS 100 3HZ LYS 100 7.971 -10.180 7.193 186 H ALA 101 H ALA 101 2.212 -9.799 6.506 187 HA ALA 101 HA ALA 101 1.127 -7.426 7.214 188 1HB ALA 101 1HB ALA 101 3.378 -8.061 8.936 189 2HB ALA 101 2HB ALA 101 3.551 -6.501 8.131 190 3HB ALA 101 3HB ALA 101 2.126 -6.831 9.116 191 H PHE 102 H PHE 102 1.096 -6.942 5.080 192 HA PHE 102 HA PHE 102 3.072 -7.356 3.196 193 1HB PHE 102 1HB PHE 102 0.705 -5.596 3.414 194 2HB PHE 102 2HB PHE 102 1.908 -5.105 2.227 195 HD1 PHE 102 HD1 PHE 102 2.880 -7.584 1.122 196 HD2 PHE 102 HD2 PHE 102 -1.075 -6.516 2.299 197 HE1 PHE 102 HE1 PHE 102 1.966 -9.225 -0.476 198 HE2 PHE 102 HE2 PHE 102 -1.998 -8.155 0.705 199 HZ PHE 102 HZ PHE 102 -0.476 -9.511 -0.685 200 H ILE 103 H ILE 103 3.737 -5.002 1.963 201 HA ILE 103 HA ILE 103 6.024 -4.197 3.379 202 HB ILE 103 HB ILE 103 4.678 -2.680 1.144 203 1HG1 ILE 103 1HG1 ILE 103 6.378 -5.143 1.166 204 2HG1 ILE 103 2HG1 ILE 103 4.978 -4.760 0.167 205 1HG2 ILE 103 1HG2 ILE 103 6.611 -1.699 2.600 206 2HG2 ILE 103 2HG2 ILE 103 7.620 -2.773 1.631 207 3HG2 ILE 103 3HG2 ILE 103 6.648 -1.528 0.845 208 1HD1 ILE 103 1HD1 ILE 103 7.655 -3.428 -0.130 209 2HD1 ILE 103 2HD1 ILE 103 7.146 -4.842 -1.051 210 3HD1 ILE 103 3HD1 ILE 103 6.270 -3.321 -1.216 211 H GLU 104 H GLU 104 6.041 -3.055 5.190 212 HA GLU 104 HA GLU 104 4.225 -0.747 5.409 213 1HB GLU 104 1HB GLU 104 4.460 -3.033 7.131 214 2HB GLU 104 2HB GLU 104 4.904 -1.578 8.015 215 1HG GLU 104 1HG GLU 104 2.364 -1.840 6.431 216 2HG GLU 104 2HG GLU 104 2.490 -2.241 8.143 217 H VAL 105 H VAL 105 5.113 0.526 7.558 218 HA VAL 105 HA VAL 105 7.364 1.908 6.718 219 HB VAL 105 HB VAL 105 6.693 1.689 9.636 220 1HG1 VAL 105 1HG1 VAL 105 7.680 3.893 7.836 221 2HG1 VAL 105 2HG1 VAL 105 7.167 4.152 9.504 222 3HG1 VAL 105 3HG1 VAL 105 8.544 3.106 9.157 223 1HG2 VAL 105 1HG2 VAL 105 5.010 2.798 7.441 224 2HG2 VAL 105 2HG2 VAL 105 4.531 1.955 8.915 225 3HG2 VAL 105 3HG2 VAL 105 5.051 3.639 8.992 226 H GLY 106 H GLY 106 9.472 1.489 6.742 227 1HA GLY 106 1HA GLY 106 11.483 0.801 7.806 228 2HA GLY 106 2HA GLY 106 10.551 -0.324 8.781 229 H GLN 107 H GLN 107 9.132 -1.717 6.900 230 HA GLN 107 HA GLN 107 10.844 -3.698 6.095 231 1HB GLN 107 1HB GLN 107 8.478 -4.086 6.110 232 2HB GLN 107 2HB GLN 107 8.209 -2.846 4.893 233 1HG GLN 107 1HG GLN 107 8.881 -4.184 3.177 234 2HG GLN 107 2HG GLN 107 9.969 -5.130 4.191 235 1HE2 GLN 107 2HE2 GLN 107 7.865 -5.938 2.281 236 2HE2 GLN 107 1HE2 GLN 107 6.808 -6.973 3.174 237 H LYS 108 H LYS 108 11.817 -4.289 4.083 238 HA LYS 108 HA LYS 108 11.895 -2.281 1.976 239 1HB LYS 108 1HB LYS 108 14.469 -3.337 3.138 240 2HB LYS 108 2HB LYS 108 14.267 -2.059 1.947 241 1HG LYS 108 1HG LYS 108 12.840 -1.108 4.082 242 2HG LYS 108 2HG LYS 108 14.191 -1.940 4.855 243 1HD LYS 108 1HD LYS 108 14.639 -0.057 2.565 244 2HD LYS 108 2HD LYS 108 14.470 0.544 4.215 245 1HE LYS 108 1HE LYS 108 16.301 -1.700 4.043 246 2HE LYS 108 2HE LYS 108 16.798 -0.357 3.014 247 1HZ LYS 108 1HZ LYS 108 16.171 -0.162 5.912 248 2HZ LYS 108 2HZ LYS 108 17.726 -0.183 5.244 249 3HZ LYS 108 3HZ LYS 108 16.685 1.110 4.923 250 H VAL 109 H VAL 109 11.146 -3.547 0.373 251 HA VAL 109 HA VAL 109 12.469 -6.146 -0.045 252 HB VAL 109 HB VAL 109 9.911 -6.032 0.349 253 1HG1 VAL 109 1HG1 VAL 109 10.105 -5.024 -2.481 254 2HG1 VAL 109 2HG1 VAL 109 8.654 -5.772 -1.817 255 3HG1 VAL 109 3HG1 VAL 109 9.276 -4.280 -1.114 256 1HG2 VAL 109 1HG2 VAL 109 11.560 -7.784 -1.007 257 2HG2 VAL 109 2HG2 VAL 109 9.911 -8.105 -0.469 258 3HG2 VAL 109 3HG2 VAL 109 10.208 -7.539 -2.114 259 H ASN 110 H ASN 110 12.252 -6.793 -2.503 260 HA ASN 110 HA ASN 110 13.524 -4.623 -3.990 261 1HB ASN 110 1HB ASN 110 13.956 -7.431 -3.798 262 2HB ASN 110 2HB ASN 110 13.535 -7.054 -5.465 263 1HD2 ASN 110 2HD2 ASN 110 15.821 -7.863 -5.644 264 2HD2 ASN 110 1HD2 ASN 110 17.076 -6.678 -5.554 265 H VAL 111 H VAL 111 12.927 -4.125 -6.145 266 HA VAL 111 HA VAL 111 10.250 -3.728 -6.628 267 HB VAL 111 HB VAL 111 12.144 -4.198 -8.911 268 1HG1 VAL 111 1HG1 VAL 111 9.546 -3.317 -8.789 269 2HG1 VAL 111 2HG1 VAL 111 10.465 -1.814 -8.877 270 3HG1 VAL 111 3HG1 VAL 111 10.665 -3.044 -10.126 271 1HG2 VAL 111 1HG2 VAL 111 12.520 -2.370 -6.704 272 2HG2 VAL 111 2HG2 VAL 111 13.597 -2.748 -8.048 273 3HG2 VAL 111 3HG2 VAL 111 12.356 -1.508 -8.233 274 H GLY 112 H GLY 112 8.616 -4.816 -7.634 275 1HA GLY 112 1HA GLY 112 7.843 -6.544 -9.144 276 2HA GLY 112 2HA GLY 112 9.223 -7.515 -8.655 277 H ASP 113 H ASP 113 8.977 -7.064 -5.844 278 HA ASP 113 HA ASP 113 7.191 -9.134 -5.176 279 1HB ASP 113 1HB ASP 113 9.125 -7.494 -3.824 280 2HB ASP 113 2HB ASP 113 7.670 -7.630 -2.843 281 H THR 114 H THR 114 5.356 -8.991 -3.683 282 HA THR 114 HA THR 114 3.350 -7.292 -4.622 283 HB THR 114 HB THR 114 2.994 -8.265 -1.867 284 HG1 THR 114 HG1 THR 114 4.168 -9.989 -2.362 285 1HG2 THR 114 1HG2 THR 114 1.369 -7.772 -4.080 286 2HG2 THR 114 2HG2 THR 114 1.340 -9.519 -3.839 287 3HG2 THR 114 3HG2 THR 114 0.892 -8.441 -2.519 288 H LEU 115 H LEU 115 2.022 -5.850 -3.095 289 HA LEU 115 HA LEU 115 3.817 -4.178 -1.470 290 1HB LEU 115 1HB LEU 115 3.371 -3.178 -3.714 291 2HB LEU 115 2HB LEU 115 1.664 -3.139 -3.311 292 HG LEU 115 HG LEU 115 2.810 -1.817 -1.184 293 1HD1 LEU 115 1HD1 LEU 115 4.370 -1.261 -3.687 294 2HD1 LEU 115 2HD1 LEU 115 4.201 -0.064 -2.402 295 3HD1 LEU 115 3HD1 LEU 115 4.971 -1.615 -2.067 296 1HD2 LEU 115 1HD2 LEU 115 1.590 -0.823 -3.749 297 2HD2 LEU 115 2HD2 LEU 115 0.801 -1.077 -2.191 298 3HD2 LEU 115 3HD2 LEU 115 1.963 0.235 -2.388 299 H CYS 116 H CYS 116 0.352 -4.450 -2.300 300 HA CYS 116 HA CYS 116 -0.522 -5.268 0.212 301 1HB CYS 116 1HB CYS 116 0.097 -2.433 0.050 302 2HB CYS 116 2HB CYS 116 -1.591 -2.707 0.468 303 HG CYS 116 HG CYS 116 -0.463 -4.319 2.425 304 H ILE 117 H ILE 117 -2.853 -5.218 0.441 305 HA ILE 117 HA ILE 117 -4.175 -5.063 -2.174 306 HB ILE 117 HB ILE 117 -4.768 -6.618 0.326 307 1HG1 ILE 117 1HG1 ILE 117 -4.993 -7.763 -2.397 308 2HG1 ILE 117 2HG1 ILE 117 -3.376 -7.288 -1.885 309 1HG2 ILE 117 1HG2 ILE 117 -6.876 -5.551 -0.364 310 2HG2 ILE 117 2HG2 ILE 117 -6.683 -6.253 -1.972 311 3HG2 ILE 117 3HG2 ILE 117 -6.908 -7.302 -0.574 312 1HD1 ILE 117 1HD1 ILE 117 -4.869 -8.841 0.097 313 2HD1 ILE 117 2HD1 ILE 117 -4.514 -9.698 -1.403 314 3HD1 ILE 117 3HD1 ILE 117 -3.202 -8.999 -0.455 315 H VAL 118 H VAL 118 -5.832 -3.715 -2.572 316 HA VAL 118 HA VAL 118 -6.430 -1.678 -0.594 317 HB VAL 118 HB VAL 118 -7.669 -1.884 -3.330 318 1HG1 VAL 118 1HG1 VAL 118 -8.048 -0.120 -1.250 319 2HG1 VAL 118 2HG1 VAL 118 -6.915 0.730 -2.301 320 3HG1 VAL 118 3HG1 VAL 118 -8.458 0.167 -2.942 321 1HG2 VAL 118 1HG2 VAL 118 -4.912 -1.736 -2.822 322 2HG2 VAL 118 2HG2 VAL 118 -5.744 -1.463 -4.354 323 3HG2 VAL 118 3HG2 VAL 118 -5.417 -0.107 -3.274 324 H GLU 119 H GLU 119 -7.755 -4.602 -1.726 325 HA GLU 119 HA GLU 119 -9.803 -5.609 -1.534 326 1HB GLU 119 1HB GLU 119 -8.706 -5.447 0.828 327 2HB GLU 119 2HB GLU 119 -9.992 -4.294 1.155 328 1HG GLU 119 1HG GLU 119 -10.255 -7.195 0.431 329 2HG GLU 119 2HG GLU 119 -10.728 -6.400 1.931 330 H ALA 120 H ALA 120 -10.280 -3.547 -3.085 331 HA ALA 120 HA ALA 120 -12.350 -1.850 -1.951 332 1HB ALA 120 1HB ALA 120 -10.493 -1.508 -3.977 333 2HB ALA 120 2HB ALA 120 -12.031 -1.667 -4.825 334 3HB ALA 120 3HB ALA 120 -11.831 -0.429 -3.586 335 H MET 121 H MET 121 -14.307 -2.712 -1.719 336 HA MET 121 HA MET 121 -16.182 -3.960 -2.078 337 1HB MET 121 1HB MET 121 -17.192 -3.702 -4.276 338 2HB MET 121 2HB MET 121 -16.468 -2.185 -3.763 339 1HG MET 121 1HG MET 121 -14.667 -2.418 -5.256 340 2HG MET 121 2HG MET 121 -15.038 -4.115 -5.559 341 1HE MET 121 1HE MET 121 -14.395 -1.783 -7.544 342 2HE MET 121 2HE MET 121 -15.734 -1.283 -8.577 343 3HE MET 121 3HE MET 121 -15.491 -0.507 -7.013 344 H LYS 122 H LYS 122 -13.917 -5.524 -1.845 345 HA LYS 122 HA LYS 122 -13.162 -7.639 -2.175 346 1HB LYS 122 1HB LYS 122 -16.002 -7.741 -2.990 347 2HB LYS 122 2HB LYS 122 -14.999 -9.069 -3.557 348 1HG LYS 122 1HG LYS 122 -15.216 -8.219 -0.678 349 2HG LYS 122 2HG LYS 122 -16.160 -9.516 -1.413 350 1HD LYS 122 1HD LYS 122 -14.490 -10.930 -1.025 351 2HD LYS 122 2HD LYS 122 -13.443 -9.966 -2.069 352 1HE LYS 122 1HE LYS 122 -12.745 -10.405 0.393 353 2HE LYS 122 2HE LYS 122 -12.531 -8.797 -0.299 354 H MET 123 H MET 123 -11.755 -6.289 -3.726 355 HA MET 123 HA MET 123 -12.014 -7.419 -6.433 356 1HB MET 123 1HB MET 123 -12.316 -5.158 -6.821 357 2HB MET 123 2HB MET 123 -11.243 -4.682 -5.513 358 1HG MET 123 1HG MET 123 -9.314 -5.360 -6.836 359 2HG MET 123 2HG MET 123 -10.382 -5.870 -8.142 360 1HE MET 123 1HE MET 123 -10.173 -3.153 -5.650 361 2HE MET 123 2HE MET 123 -8.981 -2.154 -6.485 362 3HE MET 123 3HE MET 123 -10.686 -1.702 -6.512 363 H MET 124 H MET 124 -10.046 -7.041 -3.647 364 HA MET 124 HA MET 124 -7.972 -7.786 -3.092 365 1HB MET 124 1HB MET 124 -7.903 -9.522 -5.528 366 2HB MET 124 2HB MET 124 -7.345 -9.869 -3.896 367 1HG MET 124 1HG MET 124 -10.256 -9.480 -4.391 368 2HG MET 124 2HG MET 124 -9.492 -11.004 -4.843 369 1HE MET 124 1HE MET 124 -11.388 -9.225 -2.736 370 2HE MET 124 2HE MET 124 -11.700 -10.449 -1.506 371 3HE MET 124 3HE MET 124 -10.648 -9.081 -1.141 372 H ASN 125 H ASN 125 -8.125 -5.444 -4.647 373 HA ASN 125 HA ASN 125 -6.273 -5.461 -6.797 374 1HB ASN 125 1HB ASN 125 -7.922 -3.694 -6.620 375 2HB ASN 125 2HB ASN 125 -7.272 -3.197 -5.058 376 1HD2 ASN 125 2HD2 ASN 125 -7.257 -1.127 -6.312 377 2HD2 ASN 125 1HD2 ASN 125 -5.818 -0.750 -7.189 378 H GLN 126 H GLN 126 -4.645 -6.789 -5.613 379 HA GLN 126 HA GLN 126 -3.070 -5.438 -3.605 380 1HB GLN 126 1HB GLN 126 -1.852 -7.449 -3.406 381 2HB GLN 126 2HB GLN 126 -3.516 -7.940 -3.696 382 1HG GLN 126 1HG GLN 126 -2.926 -8.210 -6.109 383 2HG GLN 126 2HG GLN 126 -1.243 -7.930 -5.663 384 1HE2 GLN 126 2HE2 GLN 126 -3.204 -10.278 -6.506 385 2HE2 GLN 126 1HE2 GLN 126 -2.601 -11.589 -5.556 386 H ILE 127 H ILE 127 -1.492 -4.063 -4.025 387 HA ILE 127 HA ILE 127 -0.473 -3.793 -6.729 388 HB ILE 127 HB ILE 127 0.449 -2.179 -4.369 389 1HG1 ILE 127 1HG1 ILE 127 -2.036 -2.221 -4.392 390 2HG1 ILE 127 2HG1 ILE 127 -1.377 -0.624 -4.733 391 1HG2 ILE 127 1HG2 ILE 127 0.536 -1.955 -7.321 392 2HG2 ILE 127 2HG2 ILE 127 0.336 -0.464 -6.400 393 3HG2 ILE 127 3HG2 ILE 127 1.735 -1.498 -6.111 394 1HD1 ILE 127 1HD1 ILE 127 -1.675 -1.209 -7.189 395 2HD1 ILE 127 2HD1 ILE 127 -2.663 -2.556 -6.624 396 3HD1 ILE 127 3HD1 ILE 127 -3.132 -0.899 -6.245 397 H GLU 128 H GLU 128 1.907 -3.459 -7.035 398 HA GLU 128 HA GLU 128 3.520 -5.124 -5.231 399 1HB GLU 128 1HB GLU 128 3.622 -5.307 -8.246 400 2HB GLU 128 2HB GLU 128 4.566 -6.254 -7.106 401 1HG GLU 128 1HG GLU 128 2.991 -7.803 -7.306 402 2HG GLU 128 2HG GLU 128 1.976 -6.743 -6.326 403 H ALA 129 H ALA 129 5.334 -4.146 -4.630 404 HA ALA 129 HA ALA 129 6.073 -1.595 -5.127 405 1HB ALA 129 1HB ALA 129 7.110 -3.134 -3.459 406 2HB ALA 129 2HB ALA 129 8.083 -3.811 -4.764 407 3HB ALA 129 3HB ALA 129 8.263 -2.114 -4.319 408 H ASP 130 H ASP 130 6.494 -0.518 -6.929 409 HA ASP 130 HA ASP 130 7.703 -1.948 -9.194 410 1HB ASP 130 1HB ASP 130 6.928 0.285 -10.376 411 2HB ASP 130 2HB ASP 130 5.781 -1.015 -10.058 412 H LYS 131 H LYS 131 8.398 0.287 -6.765 413 HA LYS 131 HA LYS 131 10.952 0.911 -8.031 414 1HB LYS 131 1HB LYS 131 9.080 3.012 -6.924 415 2HB LYS 131 2HB LYS 131 10.759 3.303 -7.359 416 1HG LYS 131 1HG LYS 131 10.195 2.578 -9.684 417 2HG LYS 131 2HG LYS 131 8.500 2.543 -9.194 418 1HD LYS 131 1HD LYS 131 9.001 4.981 -8.379 419 2HD LYS 131 2HD LYS 131 10.338 4.873 -9.525 420 1HE LYS 131 1HE LYS 131 7.420 4.433 -10.149 421 2HE LYS 131 2HE LYS 131 8.363 5.864 -10.562 422 1HZ LYS 131 1HZ LYS 131 9.705 3.603 -11.531 423 2HZ LYS 131 2HZ LYS 131 8.090 3.497 -12.022 424 3HZ LYS 131 3HZ LYS 131 9.004 4.865 -12.414 425 H SER 132 H SER 132 11.334 -0.802 -6.333 426 HA SER 132 HA SER 132 12.489 -1.292 -4.422 427 1HB SER 132 1HB SER 132 13.749 0.393 -3.650 428 2HB SER 132 2HB SER 132 12.794 1.508 -4.626 429 HG SER 132 HG SER 132 12.932 1.803 -2.207 430 H GLY 133 H GLY 133 12.096 -1.504 -2.051 431 1HA GLY 133 1HA GLY 133 9.213 -1.228 -1.461 432 2HA GLY 133 2HA GLY 133 10.145 -2.646 -1.009 433 H THR 134 H THR 134 11.559 0.510 -0.750 434 HA THR 134 HA THR 134 11.801 0.164 2.119 435 HB THR 134 HB THR 134 12.866 2.349 0.319 436 HG1 THR 134 HG1 THR 134 14.313 0.948 -0.193 437 1HG2 THR 134 1HG2 THR 134 13.372 1.700 3.197 438 2HG2 THR 134 2HG2 THR 134 14.563 2.548 2.209 439 3HG2 THR 134 3HG2 THR 134 12.966 3.252 2.462 440 H VAL 135 H VAL 135 9.562 0.444 2.659 441 HA VAL 135 HA VAL 135 8.147 2.836 2.067 442 HB VAL 135 HB VAL 135 7.691 0.726 4.175 443 1HG1 VAL 135 1HG1 VAL 135 6.778 2.872 4.926 444 2HG1 VAL 135 2HG1 VAL 135 5.889 3.021 3.410 445 3HG1 VAL 135 3HG1 VAL 135 5.498 1.723 4.538 446 1HG2 VAL 135 1HG2 VAL 135 7.402 0.004 1.847 447 2HG2 VAL 135 2HG2 VAL 135 5.871 0.018 2.724 448 3HG2 VAL 135 3HG2 VAL 135 6.250 1.315 1.590 449 H LYS 136 H LYS 136 7.942 4.710 3.186 450 HA LYS 136 HA LYS 136 9.824 5.124 5.387 451 1HB LYS 136 1HB LYS 136 9.039 6.683 3.159 452 2HB LYS 136 2HB LYS 136 8.480 7.529 4.595 453 1HG LYS 136 1HG LYS 136 11.303 6.591 4.131 454 2HG LYS 136 2HG LYS 136 10.720 8.237 3.881 455 1HD LYS 136 1HD LYS 136 10.700 8.698 6.087 456 2HD LYS 136 2HD LYS 136 10.119 7.088 6.520 457 1HE LYS 136 1HE LYS 136 12.174 6.450 7.073 458 2HE LYS 136 2HE LYS 136 12.780 6.903 5.481 459 1HZ LYS 136 1HZ LYS 136 12.514 9.290 6.695 460 2HZ LYS 136 2HZ LYS 136 12.979 8.306 7.991 461 3HZ LYS 136 3HZ LYS 136 13.956 8.408 6.613 462 H ALA 137 H ALA 137 6.409 5.231 4.620 463 HA ALA 137 HA ALA 137 5.504 4.758 7.181 464 1HB ALA 137 1HB ALA 137 6.015 7.636 6.643 465 2HB ALA 137 2HB ALA 137 4.577 7.199 7.566 466 3HB ALA 137 3HB ALA 137 6.174 6.718 8.140 467 H ILE 138 H ILE 138 3.177 5.008 7.425 468 HA ILE 138 HA ILE 138 1.823 5.222 4.817 469 HB ILE 138 HB ILE 138 1.152 3.518 7.213 470 1HG1 ILE 138 1HG1 ILE 138 2.093 2.973 4.408 471 2HG1 ILE 138 2HG1 ILE 138 2.776 2.405 5.928 472 1HG2 ILE 138 1HG2 ILE 138 -0.461 4.028 4.720 473 2HG2 ILE 138 2HG2 ILE 138 -0.776 2.722 5.862 474 3HG2 ILE 138 3HG2 ILE 138 -0.916 4.401 6.381 475 1HD1 ILE 138 1HD1 ILE 138 0.591 1.104 6.200 476 2HD1 ILE 138 2HD1 ILE 138 0.344 1.431 4.484 477 3HD1 ILE 138 3HD1 ILE 138 1.762 0.527 5.015 478 H LEU 139 H LEU 139 -0.003 6.456 4.630 479 HA LEU 139 HA LEU 139 -0.663 8.129 6.957 480 1HB LEU 139 1HB LEU 139 -1.077 8.614 4.008 481 2HB LEU 139 2HB LEU 139 -1.636 9.689 5.275 482 HG LEU 139 HG LEU 139 0.794 9.891 5.995 483 1HD1 LEU 139 1HD1 LEU 139 1.071 8.245 3.537 484 2HD1 LEU 139 2HD1 LEU 139 2.281 9.489 3.857 485 3HD1 LEU 139 3HD1 LEU 139 1.999 8.208 5.036 486 1HD2 LEU 139 1HD2 LEU 139 -0.705 11.252 4.086 487 2HD2 LEU 139 2HD2 LEU 139 0.751 11.826 4.900 488 3HD2 LEU 139 3HD2 LEU 139 0.875 11.018 3.338 489 H VAL 140 H VAL 140 -2.088 6.219 4.348 490 HA VAL 140 HA VAL 140 -4.771 6.666 4.766 491 HB VAL 140 HB VAL 140 -3.386 4.096 3.997 492 1HG1 VAL 140 1HG1 VAL 140 -6.226 4.690 4.478 493 2HG1 VAL 140 2HG1 VAL 140 -5.872 3.873 2.955 494 3HG1 VAL 140 3HG1 VAL 140 -5.369 3.149 4.483 495 1HG2 VAL 140 1HG2 VAL 140 -4.731 6.268 2.393 496 2HG2 VAL 140 2HG2 VAL 140 -3.013 5.865 2.411 497 3HG2 VAL 140 3HG2 VAL 140 -4.178 4.731 1.727 498 H GLU 141 H GLU 141 -2.879 4.003 6.212 499 HA GLU 141 HA GLU 141 -2.981 3.164 8.361 500 1HB GLU 141 1HB GLU 141 -5.552 4.618 8.886 501 2HB GLU 141 2HB GLU 141 -4.315 4.113 10.027 502 1HG GLU 141 1HG GLU 141 -3.033 5.889 8.305 503 2HG GLU 141 2HG GLU 141 -4.612 6.606 8.627 504 H SER 142 H SER 142 -3.360 1.110 7.657 505 HA SER 142 HA SER 142 -5.451 -0.006 6.378 506 1HB SER 142 1HB SER 142 -3.768 -1.529 6.828 507 2HB SER 142 2HB SER 142 -3.652 -1.060 8.524 508 HG SER 142 HG SER 142 -4.895 -2.697 8.909 509 H GLY 143 H GLY 143 -7.270 -1.379 7.173 510 1HA GLY 143 1HA GLY 143 -9.145 -1.746 8.464 511 2HA GLY 143 2HA GLY 143 -8.355 -0.885 9.776 512 H GLN 144 H GLN 144 -8.141 1.169 7.261 513 HA GLN 144 HA GLN 144 -10.715 2.448 7.910 514 1HB GLN 144 1HB GLN 144 -8.015 3.451 8.031 515 2HB GLN 144 2HB GLN 144 -8.964 4.406 6.901 516 1HG GLN 144 1HG GLN 144 -10.714 4.430 8.832 517 2HG GLN 144 2HG GLN 144 -9.319 4.037 9.835 518 1HE2 GLN 144 2HE2 GLN 144 -7.535 5.537 8.012 519 2HE2 GLN 144 1HE2 GLN 144 -7.791 7.203 8.393 520 HA PRO 145 HA PRO 145 -11.788 2.323 3.643 521 1HB PRO 145 1HB PRO 145 -13.268 4.600 3.431 522 2HB PRO 145 2HB PRO 145 -13.853 3.133 4.224 523 1HG PRO 145 1HG PRO 145 -12.692 5.609 5.441 524 2HG PRO 145 2HG PRO 145 -14.093 4.657 5.964 525 1HD PRO 145 1HD PRO 145 -11.682 4.435 7.153 526 2HD PRO 145 2HD PRO 145 -12.783 3.052 6.984 527 H VAL 146 H VAL 146 -10.670 2.806 1.865 528 HA VAL 146 HA VAL 146 -8.795 4.998 1.879 529 HB VAL 146 HB VAL 146 -9.418 3.074 -0.364 530 1HG1 VAL 146 1HG1 VAL 146 -7.342 5.165 0.073 531 2HG1 VAL 146 2HG1 VAL 146 -6.913 3.710 -0.827 532 3HG1 VAL 146 3HG1 VAL 146 -8.227 4.741 -1.393 533 1HG2 VAL 146 1HG2 VAL 146 -7.769 2.814 2.084 534 2HG2 VAL 146 2HG2 VAL 146 -8.643 1.586 1.167 535 3HG2 VAL 146 3HG2 VAL 146 -7.090 2.182 0.584 536 H GLU 147 H GLU 147 -8.687 6.649 0.273 537 HA GLU 147 HA GLU 147 -11.217 7.200 -1.117 538 1HB GLU 147 1HB GLU 147 -9.660 9.031 0.692 539 2HB GLU 147 2HB GLU 147 -10.723 9.670 -0.556 540 1HG GLU 147 1HG GLU 147 -11.698 7.690 1.471 541 2HG GLU 147 2HG GLU 147 -11.648 9.420 1.812 542 H PHE 148 H PHE 148 -11.031 8.000 -3.145 543 HA PHE 148 HA PHE 148 -8.957 7.578 -4.771 544 1HB PHE 148 1HB PHE 148 -10.876 8.328 -5.844 545 2HB PHE 148 2HB PHE 148 -11.010 9.746 -4.815 546 HD1 PHE 148 HD1 PHE 148 -8.102 8.505 -6.773 547 HD2 PHE 148 HD2 PHE 148 -11.038 11.556 -6.268 548 HE1 PHE 148 HE1 PHE 148 -6.988 9.857 -8.506 549 HE2 PHE 148 HE2 PHE 148 -9.929 12.915 -8.001 550 HZ PHE 148 HZ PHE 148 -7.901 12.066 -9.121 551 H ASP 149 H ASP 149 -6.874 8.065 -4.640 552 HA ASP 149 HA ASP 149 -4.978 9.353 -4.613 553 1HB ASP 149 1HB ASP 149 -6.940 11.251 -5.130 554 2HB ASP 149 2HB ASP 149 -6.110 11.881 -3.711 555 H GLU 150 H GLU 150 -5.037 7.850 -2.620 556 HA GLU 150 HA GLU 150 -4.614 9.527 -0.240 557 1HB GLU 150 1HB GLU 150 -6.609 7.595 -0.528 558 2HB GLU 150 2HB GLU 150 -5.360 6.804 0.424 559 1HG GLU 150 1HG GLU 150 -5.425 8.607 2.047 560 2HG GLU 150 2HG GLU 150 -6.633 9.451 1.080 561 HA PRO 151 HA PRO 151 -0.494 7.846 -0.582 562 1HB PRO 151 1HB PRO 151 -0.405 8.710 2.262 563 2HB PRO 151 2HB PRO 151 0.698 9.089 0.936 564 1HG PRO 151 1HG PRO 151 -1.030 10.908 1.832 565 2HG PRO 151 2HG PRO 151 -0.669 10.765 0.101 566 1HD PRO 151 1HD PRO 151 -3.071 9.842 1.621 567 2HD PRO 151 2HD PRO 151 -2.963 10.529 -0.013 568 H LEU 152 H LEU 152 -1.510 5.674 -0.645 569 HA LEU 152 HA LEU 152 -2.206 4.191 1.606 570 1HB LEU 152 1HB LEU 152 -0.872 3.127 -0.884 571 2HB LEU 152 2HB LEU 152 -1.862 2.219 0.246 572 HG LEU 152 HG LEU 152 -3.138 4.559 -1.054 573 1HD1 LEU 152 1HD1 LEU 152 -1.891 2.416 -2.560 574 2HD1 LEU 152 2HD1 LEU 152 -3.631 2.507 -2.835 575 3HD1 LEU 152 3HD1 LEU 152 -2.617 3.921 -3.123 576 1HD2 LEU 152 1HD2 LEU 152 -3.999 1.758 -0.351 577 2HD2 LEU 152 2HD2 LEU 152 -4.401 3.243 0.510 578 3HD2 LEU 152 3HD2 LEU 152 -5.037 2.964 -1.111 579 H VAL 153 H VAL 153 0.942 4.464 -0.021 580 HA VAL 153 HA VAL 153 2.316 4.019 2.475 581 HB VAL 153 HB VAL 153 2.710 2.036 0.228 582 1HG1 VAL 153 1HG1 VAL 153 4.754 2.647 1.505 583 2HG1 VAL 153 2HG1 VAL 153 3.954 2.084 2.974 584 3HG1 VAL 153 3HG1 VAL 153 4.295 0.951 1.666 585 1HG2 VAL 153 1HG2 VAL 153 1.432 1.717 2.941 586 2HG2 VAL 153 2HG2 VAL 153 0.644 1.562 1.370 587 3HG2 VAL 153 3HG2 VAL 153 1.856 0.382 1.869 588 H VAL 154 H VAL 154 3.864 5.502 2.452 589 HA VAL 154 HA VAL 154 4.922 6.473 -0.079 590 HB VAL 154 HB VAL 154 5.797 8.316 1.087 591 1HG1 VAL 154 1HG1 VAL 154 3.109 7.577 1.414 592 2HG1 VAL 154 2HG1 VAL 154 3.621 8.272 2.952 593 3HG1 VAL 154 3HG1 VAL 154 3.796 9.201 1.462 594 1HG2 VAL 154 1HG2 VAL 154 5.700 6.512 3.458 595 2HG2 VAL 154 2HG2 VAL 154 7.010 7.541 2.878 596 3HG2 VAL 154 3HG2 VAL 154 5.626 8.256 3.703 597 H ILE 155 H ILE 155 6.683 5.628 -0.943 598 HA ILE 155 HA ILE 155 8.557 4.150 0.759 599 HB ILE 155 HB ILE 155 8.417 4.225 -2.257 600 1HG1 ILE 155 1HG1 ILE 155 7.584 1.853 -0.645 601 2HG1 ILE 155 2HG1 ILE 155 6.458 3.199 -0.791 602 1HG2 ILE 155 1HG2 ILE 155 10.614 3.631 -1.267 603 2HG2 ILE 155 2HG2 ILE 155 9.834 2.282 -0.439 604 3HG2 ILE 155 3HG2 ILE 155 9.885 2.325 -2.203 605 1HD1 ILE 155 1HD1 ILE 155 7.723 1.944 -3.197 606 2HD1 ILE 155 2HD1 ILE 155 6.258 1.291 -2.463 607 3HD1 ILE 155 3HD1 ILE 155 6.268 2.936 -3.101 608 H GLU 156 H GLU 156 10.835 4.451 0.535 609 HA GLU 156 HA GLU 156 11.532 7.234 0.014 610 1HB GLU 156 1HB GLU 156 12.287 6.382 2.122 611 2HB GLU 156 2HB GLU 156 13.012 4.973 1.359 612 1HG GLU 156 1HG GLU 156 14.820 6.154 0.575 613 2HG GLU 156 2HG GLU 156 13.959 7.694 0.602 614 1H10 BTN 222 1H10 BTN 122 -15.516 -10.640 3.427 615 2H10 BTN 222 2H10 BTN 122 -16.144 -8.993 3.374 616 1H9 BTN 222 1H9 BTN 122 -14.303 -9.090 4.923 617 2H9 BTN 222 2H9 BTN 122 -13.831 -8.138 3.514 618 1H8 BTN 222 1H8 BTN 122 -12.549 -9.939 2.625 619 2H8 BTN 222 2H8 BTN 122 -13.187 -11.063 3.827 620 1H7 BTN 222 1H7 BTN 122 -11.605 -10.515 5.274 621 2H7 BTN 222 2H7 BTN 122 -12.009 -8.809 5.136 622 H2 BTN 222 H2 BTN 122 -10.614 -8.943 2.921 623 1H6 BTN 222 1H6 BTN 122 -7.723 -9.454 2.479 624 2H6 BTN 222 2H6 BTN 122 -6.981 -10.523 3.660 625 H5 BTN 222 H5 BTN 122 -7.461 -7.971 4.268 626 HN1 BTN 222 HN2 BTN 122 -6.747 -9.650 6.056 627 HN2 BTN 222 HN1 BTN 122 -10.597 -8.776 6.533 628 H4 BTN 222 H4 BTN 122 -9.703 -7.485 4.514 Start of MODEL 22 1 1H GLU 77 H GLU 77 11.130 15.019 -5.666 2 HA GLU 77 HA GLU 77 10.739 16.193 -3.151 3 1HB GLU 77 1HB GLU 77 9.360 14.251 -2.177 4 2HB GLU 77 2HB GLU 77 8.506 15.497 -3.081 5 1HG GLU 77 1HG GLU 77 8.783 13.926 -5.096 6 2HG GLU 77 2HG GLU 77 9.155 12.691 -3.894 7 H ILE 78 H ILE 78 12.887 15.812 -2.832 8 HA ILE 78 HA ILE 78 14.860 14.646 -2.681 9 HB ILE 78 HB ILE 78 14.928 13.407 -0.725 10 1HG1 ILE 78 1HG1 ILE 78 12.263 12.700 -0.085 11 2HG1 ILE 78 2HG1 ILE 78 12.538 12.187 -1.746 12 1HG2 ILE 78 1HG2 ILE 78 13.031 15.588 -0.839 13 2HG2 ILE 78 2HG2 ILE 78 12.718 14.500 0.514 14 3HG2 ILE 78 3HG2 ILE 78 14.303 15.254 0.337 15 1HD1 ILE 78 1HD1 ILE 78 14.793 11.457 -0.169 16 2HD1 ILE 78 2HD1 ILE 78 13.320 10.904 0.629 17 3HD1 ILE 78 3HD1 ILE 78 13.656 10.424 -1.033 18 H SER 79 H SER 79 15.227 11.910 -1.988 19 HA SER 79 HA SER 79 14.889 10.737 -4.638 20 1HB SER 79 1HB SER 79 16.410 9.459 -2.381 21 2HB SER 79 2HB SER 79 16.668 9.302 -4.118 22 HG SER 79 HG SER 79 17.524 11.266 -2.361 23 H GLY 80 H GLY 80 12.476 10.731 -3.752 24 1HA GLY 80 1HA GLY 80 11.897 7.944 -3.244 25 2HA GLY 80 2HA GLY 80 11.426 9.024 -1.941 26 H HIS 81 H HIS 81 9.268 8.131 -2.474 27 HA HIS 81 HA HIS 81 7.807 10.009 -4.045 28 1HB HIS 81 1HB HIS 81 6.835 7.790 -5.323 29 2HB HIS 81 2HB HIS 81 7.984 8.930 -6.017 30 HD1 HIS 81 HD1 HIS 81 10.081 7.919 -6.855 31 HD2 HIS 81 HD2 HIS 81 8.259 5.539 -3.978 32 HE1 HIS 81 HE1 HIS 81 11.472 5.829 -6.734 33 HE2 HIS 81 HE2 HIS 81 10.402 4.441 -4.924 34 H ILE 82 H ILE 82 5.584 9.931 -3.647 35 HA ILE 82 HA ILE 82 4.833 8.186 -1.407 36 HB ILE 82 HB ILE 82 3.606 10.777 -2.355 37 1HG1 ILE 82 1HG1 ILE 82 4.423 11.657 -0.210 38 2HG1 ILE 82 2HG1 ILE 82 5.129 10.088 0.168 39 1HG2 ILE 82 1HG2 ILE 82 2.390 8.677 -0.945 40 2HG2 ILE 82 2HG2 ILE 82 2.731 9.939 0.241 41 3HG2 ILE 82 3HG2 ILE 82 1.774 10.310 -1.194 42 1HD1 ILE 82 1HD1 ILE 82 5.973 11.313 -2.374 43 2HD1 ILE 82 2HD1 ILE 82 6.507 12.115 -0.897 44 3HD1 ILE 82 3HD1 ILE 82 6.906 10.419 -1.173 45 H VAL 83 H VAL 83 3.642 6.473 -1.885 46 HA VAL 83 HA VAL 83 2.285 6.216 -4.401 47 HB VAL 83 HB VAL 83 2.118 4.377 -2.010 48 1HG1 VAL 83 1HG1 VAL 83 0.645 4.362 -4.326 49 2HG1 VAL 83 2HG1 VAL 83 1.958 3.242 -4.692 50 3HG1 VAL 83 3HG1 VAL 83 0.935 2.970 -3.282 51 1HG2 VAL 83 1HG2 VAL 83 4.385 5.016 -3.532 52 2HG2 VAL 83 2HG2 VAL 83 4.191 3.678 -2.400 53 3HG2 VAL 83 3HG2 VAL 83 3.839 3.442 -4.111 54 H ARG 84 H ARG 84 0.633 7.717 -4.489 55 HA ARG 84 HA ARG 84 -1.315 7.888 -2.360 56 1HB ARG 84 1HB ARG 84 -0.454 9.619 -4.345 57 2HB ARG 84 2HB ARG 84 -2.061 9.148 -4.883 58 1HG ARG 84 1HG ARG 84 -3.098 10.200 -3.164 59 2HG ARG 84 2HG ARG 84 -1.763 9.925 -2.042 60 1HD ARG 84 1HD ARG 84 -2.115 12.317 -2.707 61 2HD ARG 84 2HD ARG 84 -0.491 11.693 -2.994 62 HE ARG 84 HE ARG 84 -2.218 11.471 -5.276 63 1HH1 ARG 84 1HH1 ARG 84 -0.059 13.568 -3.523 64 2HH1 ARG 84 2HH1 ARG 84 0.322 14.545 -4.903 65 1HH2 ARG 84 1HH2 ARG 84 -1.725 12.751 -7.098 66 2HH2 ARG 84 2HH2 ARG 84 -0.627 14.081 -6.935 67 H SER 85 H SER 85 -3.119 6.737 -2.202 68 HA SER 85 HA SER 85 -3.752 4.527 -3.661 69 1HB SER 85 1HB SER 85 -5.463 4.381 -2.213 70 2HB SER 85 2HB SER 85 -4.941 5.939 -1.573 71 HG SER 85 HG SER 85 -6.874 5.463 -3.591 72 HA PRO 86 HA PRO 86 -4.610 6.297 -7.716 73 1HB PRO 86 1HB PRO 86 -5.643 3.511 -8.015 74 2HB PRO 86 2HB PRO 86 -4.587 4.441 -9.086 75 1HG PRO 86 1HG PRO 86 -3.585 2.534 -7.525 76 2HG PRO 86 2HG PRO 86 -2.703 4.050 -7.789 77 1HD PRO 86 1HD PRO 86 -4.240 3.139 -5.402 78 2HD PRO 86 2HD PRO 86 -2.775 4.138 -5.490 79 H MET 87 H MET 87 -6.960 3.817 -6.699 80 HA MET 87 HA MET 87 -9.095 5.812 -7.082 81 1HB MET 87 1HB MET 87 -10.560 3.917 -7.746 82 2HB MET 87 2HB MET 87 -9.218 4.178 -8.852 83 1HG MET 87 1HG MET 87 -8.252 2.200 -8.369 84 2HG MET 87 2HG MET 87 -8.754 2.241 -6.680 85 1HE MET 87 1HE MET 87 -9.491 1.556 -10.244 86 2HE MET 87 2HE MET 87 -10.875 0.463 -10.268 87 3HE MET 87 3HE MET 87 -11.127 2.203 -10.134 88 H VAL 88 H VAL 88 -11.212 4.928 -5.973 89 HA VAL 88 HA VAL 88 -10.726 4.947 -3.195 90 HB VAL 88 HB VAL 88 -13.237 4.254 -4.723 91 1HG1 VAL 88 1HG1 VAL 88 -12.791 4.664 -1.772 92 2HG1 VAL 88 2HG1 VAL 88 -14.378 4.726 -2.538 93 3HG1 VAL 88 3HG1 VAL 88 -13.437 3.234 -2.578 94 1HG2 VAL 88 1HG2 VAL 88 -12.462 6.540 -5.058 95 2HG2 VAL 88 2HG2 VAL 88 -13.937 6.517 -4.090 96 3HG2 VAL 88 3HG2 VAL 88 -12.376 6.779 -3.312 97 H GLY 89 H GLY 89 -11.504 3.305 -1.647 98 1HA GLY 89 1HA GLY 89 -12.136 0.704 -2.057 99 2HA GLY 89 2HA GLY 89 -10.400 0.727 -2.332 100 H THR 90 H THR 90 -9.848 -0.502 -0.564 101 HA THR 90 HA THR 90 -9.993 0.900 1.989 102 HB THR 90 HB THR 90 -10.525 -2.033 2.069 103 HG1 THR 90 HG1 THR 90 -12.582 -0.134 1.633 104 1HG2 THR 90 1HG2 THR 90 -10.420 -0.062 3.976 105 2HG2 THR 90 2HG2 THR 90 -12.149 -0.280 3.709 106 3HG2 THR 90 3HG2 THR 90 -11.147 -1.658 4.164 107 H PHE 91 H PHE 91 -7.932 1.132 2.542 108 HA PHE 91 HA PHE 91 -5.912 -0.728 1.651 109 1HB PHE 91 1HB PHE 91 -5.483 1.705 1.726 110 2HB PHE 91 2HB PHE 91 -5.670 1.672 3.477 111 HD1 PHE 91 HD1 PHE 91 -3.969 0.663 4.895 112 HD2 PHE 91 HD2 PHE 91 -3.499 0.855 0.661 113 HE1 PHE 91 HE1 PHE 91 -1.568 0.159 5.142 114 HE2 PHE 91 HE2 PHE 91 -1.098 0.350 0.901 115 HZ PHE 91 HZ PHE 91 -0.131 0.001 3.144 116 H TYR 92 H TYR 92 -4.226 -1.458 3.311 117 HA TYR 92 HA TYR 92 -5.103 -1.902 5.993 118 1HB TYR 92 1HB TYR 92 -5.518 -4.000 3.939 119 2HB TYR 92 2HB TYR 92 -4.906 -4.521 5.505 120 HD1 TYR 92 HD1 TYR 92 -6.284 -2.993 7.461 121 HD2 TYR 92 HD2 TYR 92 -7.766 -4.457 3.742 122 HE1 TYR 92 HE1 TYR 92 -8.575 -2.954 8.366 123 HE2 TYR 92 HE2 TYR 92 -10.062 -4.421 4.634 124 HH TYR 92 HH TYR 92 -11.366 -3.589 6.335 125 H ARG 93 H ARG 93 -3.618 -3.801 6.944 126 HA ARG 93 HA ARG 93 -0.896 -3.311 5.928 127 1HB ARG 93 1HB ARG 93 -1.814 -3.624 8.790 128 2HB ARG 93 2HB ARG 93 -0.130 -3.546 8.288 129 1HG ARG 93 1HG ARG 93 -1.683 -1.323 7.261 130 2HG ARG 93 2HG ARG 93 -1.725 -1.421 9.023 131 1HD ARG 93 1HD ARG 93 0.822 -1.554 7.423 132 2HD ARG 93 2HD ARG 93 0.148 -0.045 8.037 133 HE ARG 93 HE ARG 93 1.477 -2.108 9.557 134 1HH1 ARG 93 1HH1 ARG 93 -0.660 0.641 9.656 135 2HH1 ARG 93 2HH1 ARG 93 -0.350 0.985 11.325 136 1HH2 ARG 93 1HH2 ARG 93 1.891 -1.664 11.755 137 2HH2 ARG 93 2HH2 ARG 93 1.099 -0.325 12.518 138 H THR 94 H THR 94 -3.255 -5.619 6.829 139 HA THR 94 HA THR 94 -1.349 -7.770 6.272 140 HB THR 94 HB THR 94 -2.357 -9.137 8.095 141 HG1 THR 94 HG1 THR 94 -3.689 -6.706 8.605 142 1HG2 THR 94 1HG2 THR 94 -0.904 -6.618 8.761 143 2HG2 THR 94 2HG2 THR 94 -1.433 -7.716 10.036 144 3HG2 THR 94 3HG2 THR 94 -0.328 -8.284 8.784 145 HA PRO 95 HA PRO 95 -4.818 -8.806 3.648 146 1HB PRO 95 1HB PRO 95 -3.613 -10.802 2.301 147 2HB PRO 95 2HB PRO 95 -3.222 -9.103 2.009 148 1HG PRO 95 1HG PRO 95 -1.743 -11.136 3.629 149 2HG PRO 95 2HG PRO 95 -1.106 -9.913 2.515 150 1HD PRO 95 1HD PRO 95 -1.134 -9.620 5.236 151 2HD PRO 95 2HD PRO 95 -1.178 -8.258 4.099 152 H SER 96 H SER 96 -5.111 -9.691 6.243 153 HA SER 96 HA SER 96 -6.830 -11.754 6.168 154 1HB SER 96 1HB SER 96 -4.067 -12.761 5.944 155 2HB SER 96 2HB SER 96 -5.055 -13.568 7.162 156 HG SER 96 HG SER 96 -6.122 -14.509 5.624 157 HA PRO 97 HA PRO 97 -7.281 -10.675 10.405 158 1HB PRO 97 1HB PRO 97 -7.884 -13.560 10.847 159 2HB PRO 97 2HB PRO 97 -8.829 -12.132 11.287 160 1HG PRO 97 1HG PRO 97 -9.548 -13.650 9.222 161 2HG PRO 97 2HG PRO 97 -9.693 -11.883 9.146 162 1HD PRO 97 1HD PRO 97 -7.662 -13.677 7.891 163 2HD PRO 97 2HD PRO 97 -8.396 -12.186 7.263 164 H ASP 98 H ASP 98 -5.191 -13.246 9.397 165 HA ASP 98 HA ASP 98 -3.415 -12.690 11.629 166 1HB ASP 98 1HB ASP 98 -4.513 -15.451 11.071 167 2HB ASP 98 2HB ASP 98 -3.117 -15.137 12.098 168 H ALA 99 H ALA 99 -2.858 -11.847 9.201 169 HA ALA 99 HA ALA 99 -1.256 -13.860 7.815 170 1HB ALA 99 1HB ALA 99 -2.787 -11.694 6.941 171 2HB ALA 99 2HB ALA 99 -1.110 -11.234 6.646 172 3HB ALA 99 3HB ALA 99 -1.747 -12.732 5.966 173 H LYS 100 H LYS 100 0.741 -12.380 6.712 174 HA LYS 100 HA LYS 100 2.345 -11.641 9.067 175 1HB LYS 100 1HB LYS 100 2.874 -13.304 6.752 176 2HB LYS 100 2HB LYS 100 4.083 -12.038 6.917 177 1HG LYS 100 1HG LYS 100 3.788 -13.023 9.487 178 2HG LYS 100 2HG LYS 100 3.708 -14.455 8.459 179 1HD LYS 100 1HD LYS 100 5.819 -12.499 7.800 180 2HD LYS 100 2HD LYS 100 6.013 -13.363 9.327 181 1HE LYS 100 1HE LYS 100 5.283 -15.355 7.580 182 2HE LYS 100 2HE LYS 100 6.295 -14.313 6.582 183 1HZ LYS 100 1HZ LYS 100 7.879 -14.424 8.605 184 2HZ LYS 100 2HZ LYS 100 7.009 -15.817 9.008 185 3HZ LYS 100 3HZ LYS 100 7.821 -15.726 7.526 186 H ALA 101 H ALA 101 0.532 -9.911 7.436 187 HA ALA 101 HA ALA 101 0.488 -7.799 6.595 188 1HB ALA 101 1HB ALA 101 2.126 -7.696 8.707 189 2HB ALA 101 2HB ALA 101 3.250 -7.189 7.446 190 3HB ALA 101 3HB ALA 101 1.755 -6.291 7.708 191 H PHE 102 H PHE 102 0.712 -7.064 4.580 192 HA PHE 102 HA PHE 102 2.431 -8.365 2.735 193 1HB PHE 102 1HB PHE 102 0.360 -6.277 2.644 194 2HB PHE 102 2HB PHE 102 1.612 -6.111 1.416 195 HD1 PHE 102 HD1 PHE 102 2.253 -8.842 0.709 196 HD2 PHE 102 HD2 PHE 102 -1.530 -7.087 1.604 197 HE1 PHE 102 HE1 PHE 102 1.137 -10.557 -0.665 198 HE2 PHE 102 HE2 PHE 102 -2.652 -8.800 0.231 199 HZ PHE 102 HZ PHE 102 -1.319 -10.537 -0.905 200 H ILE 103 H ILE 103 2.275 -4.865 2.760 201 HA ILE 103 HA ILE 103 5.213 -4.790 2.990 202 HB ILE 103 HB ILE 103 3.360 -3.075 1.343 203 1HG1 ILE 103 1HG1 ILE 103 4.003 -5.109 0.235 204 2HG1 ILE 103 2HG1 ILE 103 4.930 -3.793 -0.479 205 1HG2 ILE 103 1HG2 ILE 103 6.152 -2.553 2.266 206 2HG2 ILE 103 2HG2 ILE 103 5.625 -1.977 0.685 207 3HG2 ILE 103 3HG2 ILE 103 4.785 -1.446 2.141 208 1HD1 ILE 103 1HD1 ILE 103 6.800 -4.447 1.092 209 2HD1 ILE 103 2HD1 ILE 103 5.871 -5.910 1.423 210 3HD1 ILE 103 3HD1 ILE 103 6.431 -5.573 -0.214 211 H GLU 104 H GLU 104 5.010 -4.564 5.288 212 HA GLU 104 HA GLU 104 3.588 -2.374 6.439 213 1HB GLU 104 1HB GLU 104 5.589 -4.342 7.480 214 2HB GLU 104 2HB GLU 104 5.046 -2.998 8.474 215 1HG GLU 104 1HG GLU 104 2.806 -4.370 7.299 216 2HG GLU 104 2HG GLU 104 3.840 -5.494 8.180 217 H VAL 105 H VAL 105 4.618 -0.645 7.700 218 HA VAL 105 HA VAL 105 6.343 0.912 6.163 219 HB VAL 105 HB VAL 105 5.771 1.067 9.124 220 1HG1 VAL 105 1HG1 VAL 105 7.215 2.973 7.297 221 2HG1 VAL 105 2HG1 VAL 105 6.532 3.454 8.850 222 3HG1 VAL 105 3HG1 VAL 105 7.805 2.235 8.786 223 1HG2 VAL 105 1HG2 VAL 105 4.502 2.233 6.680 224 2HG2 VAL 105 2HG2 VAL 105 3.748 1.464 8.076 225 3HG2 VAL 105 3HG2 VAL 105 4.414 3.090 8.218 226 H GLY 106 H GLY 106 8.528 1.525 6.450 227 1HA GLY 106 1HA GLY 106 10.758 1.158 6.848 228 2HA GLY 106 2HA GLY 106 10.269 0.390 8.350 229 H GLN 107 H GLN 107 8.861 -0.988 5.582 230 HA GLN 107 HA GLN 107 10.801 -3.197 5.698 231 1HB GLN 107 1HB GLN 107 8.424 -3.638 6.462 232 2HB GLN 107 2HB GLN 107 7.925 -3.388 4.795 233 1HG GLN 107 1HG GLN 107 9.709 -5.217 4.283 234 2HG GLN 107 2HG GLN 107 9.503 -5.618 5.987 235 1HE2 GLN 107 2HE2 GLN 107 8.176 -5.791 2.843 236 2HE2 GLN 107 1HE2 GLN 107 6.742 -6.664 3.247 237 H LYS 108 H LYS 108 8.771 -3.876 3.194 238 HA LYS 108 HA LYS 108 8.771 -3.467 0.928 239 1HB LYS 108 1HB LYS 108 9.840 -1.116 1.843 240 2HB LYS 108 2HB LYS 108 11.144 -1.745 0.847 241 1HG LYS 108 1HG LYS 108 9.583 -0.226 -0.345 242 2HG LYS 108 2HG LYS 108 9.739 -1.824 -1.077 243 1HD LYS 108 1HD LYS 108 7.590 -2.355 -0.670 244 2HD LYS 108 2HD LYS 108 7.600 -1.588 0.920 245 1HE LYS 108 1HE LYS 108 7.096 0.508 0.048 246 2HE LYS 108 2HE LYS 108 7.633 0.069 -1.573 247 1HZ LYS 108 1HZ LYS 108 5.645 -1.648 -1.263 248 2HZ LYS 108 2HZ LYS 108 5.072 -0.399 -0.275 249 3HZ LYS 108 3HZ LYS 108 5.422 -0.098 -1.902 250 H VAL 109 H VAL 109 11.028 -3.146 -0.733 251 HA VAL 109 HA VAL 109 13.220 -4.753 -0.092 252 HB VAL 109 HB VAL 109 12.294 -6.627 -1.843 253 1HG1 VAL 109 1HG1 VAL 109 13.199 -6.525 0.766 254 2HG1 VAL 109 2HG1 VAL 109 11.643 -7.346 0.894 255 3HG1 VAL 109 3HG1 VAL 109 12.891 -7.984 -0.177 256 1HG2 VAL 109 1HG2 VAL 109 9.997 -5.362 -1.323 257 2HG2 VAL 109 2HG2 VAL 109 10.085 -7.096 -1.628 258 3HG2 VAL 109 3HG2 VAL 109 10.004 -6.495 0.027 259 H ASN 110 H ASN 110 11.438 -5.365 -3.044 260 HA ASN 110 HA ASN 110 12.774 -3.282 -4.524 261 1HB ASN 110 1HB ASN 110 14.020 -5.816 -4.298 262 2HB ASN 110 2HB ASN 110 13.386 -5.693 -5.935 263 1HD2 ASN 110 2HD2 ASN 110 16.001 -5.107 -4.062 264 2HD2 ASN 110 1HD2 ASN 110 16.763 -3.870 -4.998 265 H VAL 111 H VAL 111 12.315 -3.666 -6.985 266 HA VAL 111 HA VAL 111 9.507 -3.734 -7.289 267 HB VAL 111 HB VAL 111 11.716 -3.787 -9.342 268 1HG1 VAL 111 1HG1 VAL 111 8.893 -4.282 -9.663 269 2HG1 VAL 111 2HG1 VAL 111 9.388 -2.835 -10.541 270 3HG1 VAL 111 3HG1 VAL 111 10.193 -4.373 -10.852 271 1HG2 VAL 111 1HG2 VAL 111 10.548 -1.732 -7.741 272 2HG2 VAL 111 2HG2 VAL 111 11.846 -1.610 -8.927 273 3HG2 VAL 111 3HG2 VAL 111 10.167 -1.431 -9.436 274 H GLY 112 H GLY 112 8.476 -5.612 -6.860 275 1HA GLY 112 1HA GLY 112 8.072 -7.604 -8.606 276 2HA GLY 112 2HA GLY 112 9.545 -8.140 -7.811 277 H ASP 113 H ASP 113 8.644 -6.855 -5.261 278 HA ASP 113 HA ASP 113 7.211 -9.136 -4.251 279 1HB ASP 113 1HB ASP 113 8.832 -7.021 -3.164 280 2HB ASP 113 2HB ASP 113 7.334 -7.159 -2.251 281 H THR 114 H THR 114 5.379 -8.655 -2.616 282 HA THR 114 HA THR 114 3.258 -7.410 -4.098 283 HB THR 114 HB THR 114 2.865 -8.269 -1.274 284 HG1 THR 114 HG1 THR 114 3.161 -10.158 -3.355 285 1HG2 THR 114 1HG2 THR 114 1.293 -8.166 -3.749 286 2HG2 THR 114 2HG2 THR 114 1.036 -9.589 -2.738 287 3HG2 THR 114 3HG2 THR 114 0.793 -7.976 -2.068 288 H LEU 115 H LEU 115 1.651 -6.010 -2.783 289 HA LEU 115 HA LEU 115 3.161 -3.973 -1.285 290 1HB LEU 115 1HB LEU 115 2.434 -3.395 -3.684 291 2HB LEU 115 2HB LEU 115 0.806 -3.332 -3.036 292 HG LEU 115 HG LEU 115 2.280 -1.730 -1.306 293 1HD1 LEU 115 1HD1 LEU 115 3.161 -1.317 -4.155 294 2HD1 LEU 115 2HD1 LEU 115 3.335 -0.109 -2.881 295 3HD1 LEU 115 3HD1 LEU 115 4.175 -1.655 -2.753 296 1HD2 LEU 115 1HD2 LEU 115 -0.051 -1.531 -2.450 297 2HD2 LEU 115 2HD2 LEU 115 0.817 -0.074 -1.967 298 3HD2 LEU 115 3HD2 LEU 115 0.828 -0.589 -3.654 299 H CYS 116 H CYS 116 -0.241 -4.745 -2.044 300 HA CYS 116 HA CYS 116 -1.084 -5.605 0.413 301 1HB CYS 116 1HB CYS 116 -2.200 -3.317 1.143 302 2HB CYS 116 2HB CYS 116 -0.571 -3.744 1.656 303 HG CYS 116 HG CYS 116 -0.006 -1.542 0.728 304 H ILE 117 H ILE 117 -3.405 -5.628 0.668 305 HA ILE 117 HA ILE 117 -4.753 -5.584 -1.895 306 HB ILE 117 HB ILE 117 -5.580 -6.542 0.837 307 1HG1 ILE 117 1HG1 ILE 117 -5.666 -8.281 -1.554 308 2HG1 ILE 117 2HG1 ILE 117 -4.060 -7.759 -1.049 309 1HG2 ILE 117 1HG2 ILE 117 -7.544 -5.574 -0.222 310 2HG2 ILE 117 2HG2 ILE 117 -7.242 -6.522 -1.677 311 3HG2 ILE 117 3HG2 ILE 117 -7.668 -7.332 -0.170 312 1HD1 ILE 117 1HD1 ILE 117 -4.885 -8.550 1.304 313 2HD1 ILE 117 2HD1 ILE 117 -6.018 -9.505 0.349 314 3HD1 ILE 117 3HD1 ILE 117 -4.281 -9.708 0.121 315 H VAL 118 H VAL 118 -6.500 -4.333 -2.453 316 HA VAL 118 HA VAL 118 -6.861 -1.904 -0.856 317 HB VAL 118 HB VAL 118 -7.979 -2.374 -3.611 318 1HG1 VAL 118 1HG1 VAL 118 -7.495 -0.010 -1.850 319 2HG1 VAL 118 2HG1 VAL 118 -7.506 0.191 -3.602 320 3HG1 VAL 118 3HG1 VAL 118 -8.930 -0.444 -2.778 321 1HG2 VAL 118 1HG2 VAL 118 -5.290 -2.518 -3.050 322 2HG2 VAL 118 2HG2 VAL 118 -5.999 -2.108 -4.613 323 3HG2 VAL 118 3HG2 VAL 118 -5.512 -0.828 -3.501 324 H GLU 119 H GLU 119 -8.457 -4.806 -1.746 325 HA GLU 119 HA GLU 119 -10.659 -5.487 -1.626 326 1HB GLU 119 1HB GLU 119 -9.848 -5.889 0.606 327 2HB GLU 119 2HB GLU 119 -10.119 -4.212 1.058 328 1HG GLU 119 1HG GLU 119 -12.578 -5.256 0.127 329 2HG GLU 119 2HG GLU 119 -11.888 -6.421 1.255 330 H ALA 120 H ALA 120 -11.010 -3.561 -3.241 331 HA ALA 120 HA ALA 120 -12.672 -1.450 -2.124 332 1HB ALA 120 1HB ALA 120 -10.915 -1.308 -4.089 333 2HB ALA 120 2HB ALA 120 -12.312 -1.778 -5.057 334 3HB ALA 120 3HB ALA 120 -12.369 -0.310 -4.081 335 H MET 121 H MET 121 -13.108 -4.578 -3.228 336 HA MET 121 HA MET 121 -15.922 -4.446 -3.052 337 1HB MET 121 1HB MET 121 -16.509 -4.967 -5.373 338 2HB MET 121 2HB MET 121 -15.740 -3.391 -5.250 339 1HG MET 121 1HG MET 121 -13.630 -5.103 -5.719 340 2HG MET 121 2HG MET 121 -14.926 -5.752 -6.721 341 1HE MET 121 1HE MET 121 -15.958 -4.580 -8.770 342 2HE MET 121 2HE MET 121 -14.799 -3.684 -9.753 343 3HE MET 121 3HE MET 121 -14.372 -5.271 -9.110 344 H LYS 122 H LYS 122 -13.769 -5.993 -1.995 345 HA LYS 122 HA LYS 122 -13.366 -8.148 -1.382 346 1HB LYS 122 1HB LYS 122 -15.891 -8.284 -1.497 347 2HB LYS 122 2HB LYS 122 -15.705 -8.936 -3.119 348 1HG LYS 122 1HG LYS 122 -16.019 -10.580 -1.192 349 2HG LYS 122 2HG LYS 122 -14.728 -10.903 -2.351 350 1HD LYS 122 1HD LYS 122 -14.025 -11.238 -0.003 351 2HD LYS 122 2HD LYS 122 -13.082 -10.000 -0.833 352 1HE LYS 122 1HE LYS 122 -14.541 -8.275 0.194 353 2HE LYS 122 2HE LYS 122 -15.350 -9.550 1.102 354 H MET 123 H MET 123 -12.597 -6.882 -4.099 355 HA MET 123 HA MET 123 -12.079 -9.236 -5.711 356 1HB MET 123 1HB MET 123 -11.478 -7.791 -7.425 357 2HB MET 123 2HB MET 123 -12.685 -6.856 -6.554 358 1HG MET 123 1HG MET 123 -10.513 -6.003 -5.274 359 2HG MET 123 2HG MET 123 -9.772 -6.428 -6.816 360 1HE MET 123 1HE MET 123 -9.847 -3.860 -5.289 361 2HE MET 123 2HE MET 123 -9.390 -3.169 -6.846 362 3HE MET 123 3HE MET 123 -10.783 -2.531 -5.973 363 H MET 124 H MET 124 -10.603 -7.727 -3.125 364 HA MET 124 HA MET 124 -8.533 -7.807 -2.189 365 1HB MET 124 1HB MET 124 -8.238 -10.304 -3.866 366 2HB MET 124 2HB MET 124 -7.324 -9.903 -2.419 367 1HG MET 124 1HG MET 124 -10.274 -10.011 -2.188 368 2HG MET 124 2HG MET 124 -9.410 -11.534 -2.385 369 1HE MET 124 1HE MET 124 -11.279 -10.289 -0.250 370 2HE MET 124 2HE MET 124 -10.609 -10.512 1.366 371 3HE MET 124 3HE MET 124 -10.486 -8.944 0.569 372 H ASN 125 H ASN 125 -8.725 -6.173 -4.467 373 HA ASN 125 HA ASN 125 -6.741 -6.558 -6.393 374 1HB ASN 125 1HB ASN 125 -8.436 -4.858 -6.685 375 2HB ASN 125 2HB ASN 125 -7.876 -3.995 -5.254 376 1HD2 ASN 125 2HD2 ASN 125 -7.641 -2.141 -6.573 377 2HD2 ASN 125 1HD2 ASN 125 -6.267 -1.956 -7.604 378 H GLN 126 H GLN 126 -5.021 -7.476 -5.082 379 HA GLN 126 HA GLN 126 -3.581 -5.669 -3.327 380 1HB GLN 126 1HB GLN 126 -2.299 -7.525 -2.669 381 2HB GLN 126 2HB GLN 126 -3.916 -8.171 -2.919 382 1HG GLN 126 1HG GLN 126 -3.067 -8.729 -5.294 383 2HG GLN 126 2HG GLN 126 -1.464 -8.519 -4.590 384 1HE2 GLN 126 2HE2 GLN 126 -4.068 -10.612 -5.043 385 2HE2 GLN 126 1HE2 GLN 126 -3.540 -11.895 -4.013 386 H ILE 127 H ILE 127 -1.953 -4.418 -3.934 387 HA ILE 127 HA ILE 127 -0.927 -4.631 -6.648 388 HB ILE 127 HB ILE 127 -0.119 -2.574 -4.605 389 1HG1 ILE 127 1HG1 ILE 127 -2.534 -2.513 -4.676 390 2HG1 ILE 127 2HG1 ILE 127 -1.910 -1.135 -5.577 391 1HG2 ILE 127 1HG2 ILE 127 0.119 -2.893 -7.551 392 2HG2 ILE 127 2HG2 ILE 127 -0.053 -1.266 -6.892 393 3HG2 ILE 127 3HG2 ILE 127 1.290 -2.288 -6.379 394 1HD1 ILE 127 1HD1 ILE 127 -2.167 -3.012 -7.533 395 2HD1 ILE 127 2HD1 ILE 127 -3.524 -3.392 -6.472 396 3HD1 ILE 127 3HD1 ILE 127 -3.358 -1.771 -7.145 397 H GLU 128 H GLU 128 1.457 -4.301 -6.977 398 HA GLU 128 HA GLU 128 3.021 -5.688 -4.904 399 1HB GLU 128 1HB GLU 128 3.598 -6.044 -7.829 400 2HB GLU 128 2HB GLU 128 4.087 -7.058 -6.478 401 1HG GLU 128 1HG GLU 128 2.400 -8.394 -6.988 402 2HG GLU 128 2HG GLU 128 1.312 -7.122 -6.430 403 H ALA 129 H ALA 129 4.701 -4.549 -4.216 404 HA ALA 129 HA ALA 129 5.388 -2.023 -4.897 405 1HB ALA 129 1HB ALA 129 6.376 -3.823 -3.143 406 2HB ALA 129 2HB ALA 129 7.725 -3.699 -4.273 407 3HB ALA 129 3HB ALA 129 7.113 -2.254 -3.469 408 H ASP 130 H ASP 130 6.297 -1.007 -6.563 409 HA ASP 130 HA ASP 130 8.028 -2.500 -8.393 410 1HB ASP 130 1HB ASP 130 6.812 -1.185 -10.281 411 2HB ASP 130 2HB ASP 130 6.064 -2.647 -9.639 412 H LYS 131 H LYS 131 8.275 -0.340 -6.297 413 HA LYS 131 HA LYS 131 9.400 1.797 -7.976 414 1HB LYS 131 1HB LYS 131 8.661 1.836 -5.043 415 2HB LYS 131 2HB LYS 131 9.330 3.191 -5.941 416 1HG LYS 131 1HG LYS 131 7.023 2.204 -7.307 417 2HG LYS 131 2HG LYS 131 6.630 2.492 -5.610 418 1HD LYS 131 1HD LYS 131 7.002 4.742 -5.764 419 2HD LYS 131 2HD LYS 131 8.203 4.566 -7.045 420 1HE LYS 131 1HE LYS 131 6.038 5.629 -7.744 421 2HE LYS 131 2HE LYS 131 6.524 4.222 -8.688 422 1HZ LYS 131 1HZ LYS 131 5.028 2.897 -7.198 423 2HZ LYS 131 2HZ LYS 131 4.436 4.360 -6.590 424 3HZ LYS 131 3HZ LYS 131 4.238 3.982 -8.227 425 H SER 132 H SER 132 10.175 -0.736 -5.789 426 HA SER 132 HA SER 132 12.158 -1.584 -5.064 427 1HB SER 132 1HB SER 132 12.940 -1.292 -7.359 428 2HB SER 132 2HB SER 132 13.333 0.395 -7.032 429 HG SER 132 HG SER 132 15.221 -0.633 -6.745 430 H GLY 133 H GLY 133 13.057 -1.246 -3.140 431 1HA GLY 133 1HA GLY 133 14.669 0.337 -1.978 432 2HA GLY 133 2HA GLY 133 13.434 1.551 -2.275 433 H THR 134 H THR 134 13.371 1.908 0.010 434 HA THR 134 HA THR 134 11.948 -0.206 1.488 435 HB THR 134 HB THR 134 13.725 1.985 2.574 436 HG1 THR 134 HG1 THR 134 15.220 0.455 2.816 437 1HG2 THR 134 1HG2 THR 134 11.921 1.368 4.135 438 2HG2 THR 134 2HG2 THR 134 12.466 -0.308 4.055 439 3HG2 THR 134 3HG2 THR 134 13.527 0.932 4.720 440 H VAL 135 H VAL 135 10.355 0.501 3.053 441 HA VAL 135 HA VAL 135 8.762 2.686 2.008 442 HB VAL 135 HB VAL 135 8.194 0.797 4.298 443 1HG1 VAL 135 1HG1 VAL 135 6.599 2.968 2.997 444 2HG1 VAL 135 2HG1 VAL 135 5.791 1.576 3.718 445 3HG1 VAL 135 3HG1 VAL 135 6.816 2.612 4.711 446 1HG2 VAL 135 1HG2 VAL 135 8.233 0.312 1.537 447 2HG2 VAL 135 2HG2 VAL 135 7.561 -0.719 2.801 448 3HG2 VAL 135 3HG2 VAL 135 6.532 0.457 1.981 449 H LYS 136 H LYS 136 8.479 4.639 2.917 450 HA LYS 136 HA LYS 136 10.187 5.375 5.130 451 1HB LYS 136 1HB LYS 136 9.120 6.705 2.901 452 2HB LYS 136 2HB LYS 136 8.367 7.458 4.300 453 1HG LYS 136 1HG LYS 136 11.335 7.064 4.064 454 2HG LYS 136 2HG LYS 136 10.504 8.506 3.479 455 1HD LYS 136 1HD LYS 136 10.404 9.358 5.534 456 2HD LYS 136 2HD LYS 136 9.678 7.878 6.166 457 1HE LYS 136 1HE LYS 136 11.588 7.748 7.350 458 2HE LYS 136 2HE LYS 136 12.236 7.075 5.855 459 1HZ LYS 136 1HZ LYS 136 12.310 9.976 6.445 460 2HZ LYS 136 2HZ LYS 136 13.549 8.926 6.921 461 3HZ LYS 136 3HZ LYS 136 13.192 9.124 5.280 462 H ALA 137 H ALA 137 6.693 5.516 4.442 463 HA ALA 137 HA ALA 137 5.886 4.644 6.970 464 1HB ALA 137 1HB ALA 137 6.258 7.594 6.711 465 2HB ALA 137 2HB ALA 137 4.938 6.965 7.698 466 3HB ALA 137 3HB ALA 137 6.605 6.531 8.075 467 H ILE 138 H ILE 138 3.645 4.466 7.154 468 HA ILE 138 HA ILE 138 2.182 5.072 4.678 469 HB ILE 138 HB ILE 138 1.724 3.016 6.834 470 1HG1 ILE 138 1HG1 ILE 138 2.418 2.970 3.912 471 2HG1 ILE 138 2HG1 ILE 138 3.213 2.150 5.252 472 1HG2 ILE 138 1HG2 ILE 138 -0.436 4.005 6.307 473 2HG2 ILE 138 2HG2 ILE 138 -0.149 3.748 4.586 474 3HG2 ILE 138 3HG2 ILE 138 -0.329 2.366 5.669 475 1HD1 ILE 138 1HD1 ILE 138 0.490 1.449 4.178 476 2HD1 ILE 138 2HD1 ILE 138 1.992 0.617 3.772 477 3HD1 ILE 138 3HD1 ILE 138 1.388 0.587 5.428 478 H LEU 139 H LEU 139 0.389 6.326 4.673 479 HA LEU 139 HA LEU 139 -0.180 7.846 7.084 480 1HB LEU 139 1HB LEU 139 -1.049 8.079 4.218 481 2HB LEU 139 2HB LEU 139 -1.806 9.024 5.484 482 HG LEU 139 HG LEU 139 0.561 9.850 6.042 483 1HD1 LEU 139 1HD1 LEU 139 1.434 7.967 4.392 484 2HD1 LEU 139 2HD1 LEU 139 1.250 9.270 3.217 485 3HD1 LEU 139 3HD1 LEU 139 2.297 9.488 4.620 486 1HD2 LEU 139 1HD2 LEU 139 -1.283 10.622 3.919 487 2HD2 LEU 139 2HD2 LEU 139 -0.492 11.607 5.150 488 3HD2 LEU 139 3HD2 LEU 139 0.363 11.202 3.663 489 H VAL 140 H VAL 140 -2.063 6.024 4.679 490 HA VAL 140 HA VAL 140 -4.552 6.030 5.584 491 HB VAL 140 HB VAL 140 -3.045 3.513 4.868 492 1HG1 VAL 140 1HG1 VAL 140 -5.610 3.744 5.964 493 2HG1 VAL 140 2HG1 VAL 140 -5.848 3.468 4.238 494 3HG1 VAL 140 3HG1 VAL 140 -4.896 2.329 5.191 495 1HG2 VAL 140 1HG2 VAL 140 -3.417 5.649 3.288 496 2HG2 VAL 140 2HG2 VAL 140 -3.406 3.993 2.682 497 3HG2 VAL 140 3HG2 VAL 140 -4.938 4.804 3.000 498 H GLU 141 H GLU 141 -5.742 5.406 7.275 499 HA GLU 141 HA GLU 141 -4.418 4.719 9.715 500 1HB GLU 141 1HB GLU 141 -7.247 5.333 8.939 501 2HB GLU 141 2HB GLU 141 -6.904 4.624 10.512 502 1HG GLU 141 1HG GLU 141 -7.077 7.183 10.297 503 2HG GLU 141 2HG GLU 141 -5.772 6.489 11.257 504 H SER 142 H SER 142 -3.830 2.679 8.127 505 HA SER 142 HA SER 142 -4.162 0.438 7.641 506 1HB SER 142 1HB SER 142 -2.960 0.223 9.621 507 2HB SER 142 2HB SER 142 -4.285 0.847 10.604 508 HG SER 142 HG SER 142 -3.724 -1.705 9.909 509 H GLY 143 H GLY 143 -6.092 0.214 6.440 510 1HA GLY 143 1HA GLY 143 -8.060 -1.164 6.376 511 2HA GLY 143 2HA GLY 143 -8.388 -0.699 8.039 512 H GLN 144 H GLN 144 -7.743 2.134 7.448 513 HA GLN 144 HA GLN 144 -10.181 3.249 7.182 514 1HB GLN 144 1HB GLN 144 -7.691 4.264 7.299 515 2HB GLN 144 2HB GLN 144 -8.073 4.634 5.624 516 1HG GLN 144 1HG GLN 144 -10.323 5.393 7.102 517 2HG GLN 144 2HG GLN 144 -8.926 5.949 8.023 518 1HE2 GLN 144 2HE2 GLN 144 -9.421 8.104 7.588 519 2HE2 GLN 144 1HE2 GLN 144 -9.141 8.811 6.036 520 HA PRO 145 HA PRO 145 -11.655 2.034 3.170 521 1HB PRO 145 1HB PRO 145 -13.768 3.773 3.076 522 2HB PRO 145 2HB PRO 145 -13.788 2.250 3.971 523 1HG PRO 145 1HG PRO 145 -13.297 5.028 4.969 524 2HG PRO 145 2HG PRO 145 -14.258 3.728 5.699 525 1HD PRO 145 1HD PRO 145 -11.775 4.322 6.559 526 2HD PRO 145 2HD PRO 145 -12.394 2.658 6.552 527 H VAL 146 H VAL 146 -9.826 2.876 2.024 528 HA VAL 146 HA VAL 146 -9.026 5.346 1.418 529 HB VAL 146 HB VAL 146 -9.494 3.186 -0.643 530 1HG1 VAL 146 1HG1 VAL 146 -8.009 5.783 -0.744 531 2HG1 VAL 146 2HG1 VAL 146 -7.498 4.416 -1.734 532 3HG1 VAL 146 3HG1 VAL 146 -9.118 5.085 -1.923 533 1HG2 VAL 146 1HG2 VAL 146 -7.972 2.911 1.518 534 2HG2 VAL 146 2HG2 VAL 146 -7.508 2.247 -0.048 535 3HG2 VAL 146 3HG2 VAL 146 -6.821 3.776 0.500 536 H GLU 147 H GLU 147 -9.475 6.925 -0.222 537 HA GLU 147 HA GLU 147 -12.112 6.863 -1.453 538 1HB GLU 147 1HB GLU 147 -11.539 9.423 -0.111 539 2HB GLU 147 2HB GLU 147 -13.061 8.557 -0.288 540 1HG GLU 147 1HG GLU 147 -12.536 8.656 2.027 541 2HG GLU 147 2HG GLU 147 -12.300 6.992 1.491 542 H PHE 148 H PHE 148 -9.768 6.615 -2.783 543 HA PHE 148 HA PHE 148 -8.633 7.439 -4.574 544 1HB PHE 148 1HB PHE 148 -11.116 8.465 -4.848 545 2HB PHE 148 2HB PHE 148 -10.177 9.947 -4.731 546 HD1 PHE 148 HD1 PHE 148 -7.790 9.558 -6.159 547 HD2 PHE 148 HD2 PHE 148 -11.654 7.972 -7.017 548 HE1 PHE 148 HE1 PHE 148 -7.176 9.360 -8.539 549 HE2 PHE 148 HE2 PHE 148 -11.047 7.770 -9.398 550 HZ PHE 148 HZ PHE 148 -8.806 8.465 -10.160 551 H ASP 149 H ASP 149 -6.657 8.259 -4.450 552 HA ASP 149 HA ASP 149 -4.919 9.666 -4.008 553 1HB ASP 149 1HB ASP 149 -7.230 11.423 -3.997 554 2HB ASP 149 2HB ASP 149 -5.998 11.970 -2.864 555 H GLU 150 H GLU 150 -5.032 7.829 -2.241 556 HA GLU 150 HA GLU 150 -4.834 9.179 0.369 557 1HB GLU 150 1HB GLU 150 -6.544 7.017 -0.371 558 2HB GLU 150 2HB GLU 150 -5.346 6.407 0.762 559 1HG GLU 150 1HG GLU 150 -6.500 8.959 1.563 560 2HG GLU 150 2HG GLU 150 -7.683 7.659 1.423 561 HA PRO 151 HA PRO 151 -0.537 7.937 -0.328 562 1HB PRO 151 1HB PRO 151 -0.565 8.756 2.547 563 2HB PRO 151 2HB PRO 151 0.594 9.159 1.276 564 1HG PRO 151 1HG PRO 151 -1.235 10.931 2.060 565 2HG PRO 151 2HG PRO 151 -0.780 10.782 0.353 566 1HD PRO 151 1HD PRO 151 -3.256 9.891 1.735 567 2HD PRO 151 2HD PRO 151 -3.026 10.428 0.060 568 H LEU 152 H LEU 152 -1.193 5.698 -0.491 569 HA LEU 152 HA LEU 152 -1.768 4.095 1.767 570 1HB LEU 152 1HB LEU 152 -0.569 3.187 -0.848 571 2HB LEU 152 2HB LEU 152 -1.466 2.209 0.301 572 HG LEU 152 HG LEU 152 -2.607 4.474 -1.338 573 1HD1 LEU 152 1HD1 LEU 152 -2.101 1.752 -1.984 574 2HD1 LEU 152 2HD1 LEU 152 -3.845 1.982 -1.851 575 3HD1 LEU 152 3HD1 LEU 152 -2.904 2.987 -2.953 576 1HD2 LEU 152 1HD2 LEU 152 -3.569 3.039 1.004 577 2HD2 LEU 152 2HD2 LEU 152 -4.170 4.518 0.255 578 3HD2 LEU 152 3HD2 LEU 152 -4.679 2.948 -0.364 579 H VAL 153 H VAL 153 1.232 4.701 -0.034 580 HA VAL 153 HA VAL 153 2.801 4.174 2.320 581 HB VAL 153 HB VAL 153 3.640 2.479 0.028 582 1HG1 VAL 153 1HG1 VAL 153 4.810 2.892 2.319 583 2HG1 VAL 153 2HG1 VAL 153 3.644 1.709 2.914 584 3HG1 VAL 153 3HG1 VAL 153 4.773 1.268 1.631 585 1HG2 VAL 153 1HG2 VAL 153 1.202 2.036 0.312 586 2HG2 VAL 153 2HG2 VAL 153 2.230 0.641 0.641 587 3HG2 VAL 153 3HG2 VAL 153 1.533 1.557 1.976 588 H VAL 154 H VAL 154 4.605 5.370 2.293 589 HA VAL 154 HA VAL 154 5.407 6.572 -0.275 590 HB VAL 154 HB VAL 154 6.116 8.525 0.858 591 1HG1 VAL 154 1HG1 VAL 154 3.590 8.036 0.624 592 2HG1 VAL 154 2HG1 VAL 154 3.621 7.877 2.380 593 3HG1 VAL 154 3HG1 VAL 154 4.105 9.395 1.623 594 1HG2 VAL 154 1HG2 VAL 154 5.955 6.813 3.294 595 2HG2 VAL 154 2HG2 VAL 154 7.239 7.900 2.763 596 3HG2 VAL 154 3HG2 VAL 154 5.756 8.559 3.453 597 H ILE 155 H ILE 155 7.255 5.813 -1.046 598 HA ILE 155 HA ILE 155 9.118 4.403 0.660 599 HB ILE 155 HB ILE 155 9.401 5.026 -2.279 600 1HG1 ILE 155 1HG1 ILE 155 8.558 2.329 -1.398 601 2HG1 ILE 155 2HG1 ILE 155 7.347 3.598 -1.242 602 1HG2 ILE 155 1HG2 ILE 155 11.285 4.089 -0.577 603 2HG2 ILE 155 2HG2 ILE 155 10.556 2.581 -1.132 604 3HG2 ILE 155 3HG2 ILE 155 11.229 3.717 -2.300 605 1HD1 ILE 155 1HD1 ILE 155 8.823 3.293 -3.810 606 2HD1 ILE 155 2HD1 ILE 155 7.504 2.189 -3.418 607 3HD1 ILE 155 3HD1 ILE 155 7.204 3.925 -3.506 608 H GLU 156 H GLU 156 11.238 4.981 1.081 609 HA GLU 156 HA GLU 156 11.755 7.783 1.245 610 1HB GLU 156 1HB GLU 156 12.523 6.119 2.935 611 2HB GLU 156 2HB GLU 156 13.653 5.485 1.747 612 1HG GLU 156 1HG GLU 156 14.315 8.096 1.697 613 2HG GLU 156 2HG GLU 156 13.783 7.931 3.370 614 1H10 BTN 222 1H10 BTN 122 -14.740 -7.503 3.954 615 2H10 BTN 222 2H10 BTN 122 -13.434 -6.937 2.916 616 1H9 BTN 222 1H9 BTN 122 -12.269 -8.509 4.961 617 2H9 BTN 222 2H9 BTN 122 -13.403 -7.393 5.725 618 1H8 BTN 222 1H8 BTN 122 -12.181 -5.570 5.190 619 2H8 BTN 222 2H8 BTN 122 -11.678 -6.234 3.633 620 1H7 BTN 222 1H7 BTN 122 -10.535 -7.788 5.734 621 2H7 BTN 222 2H7 BTN 122 -10.205 -6.087 6.036 622 H2 BTN 222 H2 BTN 122 -9.257 -5.892 3.746 623 1H6 BTN 222 1H6 BTN 122 -8.199 -10.178 3.479 624 2H6 BTN 222 2H6 BTN 122 -9.382 -9.839 4.732 625 H5 BTN 222 H5 BTN 122 -6.633 -8.778 4.424 626 HN1 BTN 222 HN2 BTN 122 -7.438 -9.904 6.571 627 HN2 BTN 222 HN1 BTN 122 -8.314 -6.026 6.703 628 H4 BTN 222 H4 BTN 122 -7.173 -6.541 4.471 Start of MODEL 23 1 1H GLU 77 H GLU 77 16.657 14.943 -9.254 2 HA GLU 77 HA GLU 77 16.842 12.676 -9.194 3 1HB GLU 77 1HB GLU 77 19.538 13.625 -8.654 4 2HB GLU 77 2HB GLU 77 19.217 12.079 -7.878 5 1HG GLU 77 1HG GLU 77 18.231 11.548 -10.301 6 2HG GLU 77 2HG GLU 77 19.433 12.761 -10.742 7 H ILE 78 H ILE 78 15.139 12.440 -7.738 8 HA ILE 78 HA ILE 78 15.911 12.070 -4.918 9 HB ILE 78 HB ILE 78 14.279 13.781 -5.007 10 1HG1 ILE 78 1HG1 ILE 78 13.928 11.694 -3.450 11 2HG1 ILE 78 2HG1 ILE 78 12.693 12.945 -3.544 12 1HG2 ILE 78 1HG2 ILE 78 13.149 12.139 -7.165 13 2HG2 ILE 78 2HG2 ILE 78 11.966 12.928 -6.121 14 3HG2 ILE 78 3HG2 ILE 78 13.181 13.891 -6.965 15 1HD1 ILE 78 1HD1 ILE 78 12.432 10.727 -5.462 16 2HD1 ILE 78 2HD1 ILE 78 12.180 10.328 -3.763 17 3HD1 ILE 78 3HD1 ILE 78 11.202 11.580 -4.530 18 H SER 79 H SER 79 15.546 10.153 -3.935 19 HA SER 79 HA SER 79 14.419 8.007 -5.598 20 1HB SER 79 1HB SER 79 16.834 8.131 -4.235 21 2HB SER 79 2HB SER 79 15.816 7.141 -3.189 22 HG SER 79 HG SER 79 15.728 5.620 -4.681 23 H GLY 80 H GLY 80 12.239 8.363 -5.085 24 1HA GLY 80 1HA GLY 80 11.083 6.889 -3.114 25 2HA GLY 80 2HA GLY 80 11.364 8.441 -2.341 26 H HIS 81 H HIS 81 8.827 7.184 -2.858 27 HA HIS 81 HA HIS 81 7.520 9.414 -4.136 28 1HB HIS 81 1HB HIS 81 6.242 7.964 -5.725 29 2HB HIS 81 2HB HIS 81 7.953 8.110 -6.111 30 HD1 HIS 81 HD1 HIS 81 5.665 5.684 -6.534 31 HD2 HIS 81 HD2 HIS 81 9.159 5.714 -4.287 32 HE1 HIS 81 HE1 HIS 81 6.309 3.269 -6.261 33 HE2 HIS 81 HE2 HIS 81 8.369 3.308 -4.811 34 H ILE 82 H ILE 82 5.087 9.120 -4.073 35 HA ILE 82 HA ILE 82 4.362 7.619 -1.640 36 HB ILE 82 HB ILE 82 3.195 10.185 -2.721 37 1HG1 ILE 82 1HG1 ILE 82 3.999 11.148 -0.619 38 2HG1 ILE 82 2HG1 ILE 82 4.627 9.580 -0.123 39 1HG2 ILE 82 1HG2 ILE 82 1.903 8.175 -1.243 40 2HG2 ILE 82 2HG2 ILE 82 2.243 9.487 -0.114 41 3HG2 ILE 82 3HG2 ILE 82 1.327 9.807 -1.587 42 1HD1 ILE 82 1HD1 ILE 82 5.590 10.681 -2.695 43 2HD1 ILE 82 2HD1 ILE 82 6.155 11.445 -1.210 44 3HD1 ILE 82 3HD1 ILE 82 6.436 9.724 -1.478 45 H VAL 83 H VAL 83 3.309 5.821 -2.183 46 HA VAL 83 HA VAL 83 1.868 5.527 -4.630 47 HB VAL 83 HB VAL 83 1.723 3.712 -2.222 48 1HG1 VAL 83 1HG1 VAL 83 0.686 3.621 -4.939 49 2HG1 VAL 83 2HG1 VAL 83 1.634 2.194 -4.518 50 3HG1 VAL 83 3HG1 VAL 83 0.251 2.658 -3.527 51 1HG2 VAL 83 1HG2 VAL 83 4.071 4.211 -2.941 52 2HG2 VAL 83 2HG2 VAL 83 3.608 2.513 -3.062 53 3HG2 VAL 83 3HG2 VAL 83 3.673 3.516 -4.512 54 H ARG 84 H ARG 84 0.259 7.123 -4.617 55 HA ARG 84 HA ARG 84 -1.673 7.266 -2.494 56 1HB ARG 84 1HB ARG 84 -2.871 8.774 -4.200 57 2HB ARG 84 2HB ARG 84 -1.326 9.318 -3.563 58 1HG ARG 84 1HG ARG 84 -0.196 8.727 -5.563 59 2HG ARG 84 2HG ARG 84 -1.606 7.863 -6.178 60 1HD ARG 84 1HD ARG 84 -2.846 9.998 -6.233 61 2HD ARG 84 2HD ARG 84 -1.386 10.834 -5.706 62 HE ARG 84 HE ARG 84 -0.711 9.402 -7.979 63 1HH1 ARG 84 1HH1 ARG 84 -2.878 11.986 -7.108 64 2HH1 ARG 84 2HH1 ARG 84 -2.830 12.729 -8.673 65 1HH2 ARG 84 1HH2 ARG 84 -0.641 10.372 -10.044 66 2HH2 ARG 84 2HH2 ARG 84 -1.559 11.809 -10.342 67 H SER 85 H SER 85 -3.917 6.789 -2.680 68 HA SER 85 HA SER 85 -4.425 4.476 -4.398 69 1HB SER 85 1HB SER 85 -5.007 4.989 -1.724 70 2HB SER 85 2HB SER 85 -6.561 5.156 -2.541 71 HG SER 85 HG SER 85 -6.056 3.072 -3.529 72 HA PRO 86 HA PRO 86 -6.711 7.458 -6.926 73 1HB PRO 86 1HB PRO 86 -6.900 5.834 -9.090 74 2HB PRO 86 2HB PRO 86 -5.446 6.766 -8.718 75 1HG PRO 86 1HG PRO 86 -6.034 3.880 -8.183 76 2HG PRO 86 2HG PRO 86 -4.545 4.623 -8.795 77 1HD PRO 86 1HD PRO 86 -4.848 3.879 -6.207 78 2HD PRO 86 2HD PRO 86 -3.850 5.265 -6.693 79 H MET 87 H MET 87 -7.484 3.972 -6.991 80 HA MET 87 HA MET 87 -10.317 4.583 -7.233 81 1HB MET 87 1HB MET 87 -8.760 2.555 -8.227 82 2HB MET 87 2HB MET 87 -9.545 1.775 -6.861 83 1HG MET 87 1HG MET 87 -11.123 1.342 -8.404 84 2HG MET 87 2HG MET 87 -11.676 2.954 -7.954 85 1HE MET 87 1HE MET 87 -8.889 1.358 -9.964 86 2HE MET 87 2HE MET 87 -10.159 0.816 -11.061 87 3HE MET 87 3HE MET 87 -9.015 2.054 -11.580 88 H VAL 88 H VAL 88 -11.408 5.043 -5.444 89 HA VAL 88 HA VAL 88 -10.706 4.785 -2.844 90 HB VAL 88 HB VAL 88 -13.465 4.505 -4.032 91 1HG1 VAL 88 1HG1 VAL 88 -12.688 4.860 -1.139 92 2HG1 VAL 88 2HG1 VAL 88 -14.326 4.998 -1.779 93 3HG1 VAL 88 3HG1 VAL 88 -13.479 3.453 -1.849 94 1HG2 VAL 88 1HG2 VAL 88 -11.984 6.655 -4.180 95 2HG2 VAL 88 2HG2 VAL 88 -13.692 6.781 -3.753 96 3HG2 VAL 88 3HG2 VAL 88 -12.460 6.858 -2.493 97 H GLY 89 H GLY 89 -11.363 3.316 -1.126 98 1HA GLY 89 1HA GLY 89 -12.461 0.806 -1.392 99 2HA GLY 89 2HA GLY 89 -10.763 0.601 -1.796 100 H THR 90 H THR 90 -10.534 -0.774 0.032 101 HA THR 90 HA THR 90 -10.439 0.693 2.586 102 HB THR 90 HB THR 90 -10.703 -2.282 2.538 103 HG1 THR 90 HG1 THR 90 -12.974 -2.033 2.471 104 1HG2 THR 90 1HG2 THR 90 -11.103 -0.122 4.458 105 2HG2 THR 90 2HG2 THR 90 -12.399 -1.319 4.431 106 3HG2 THR 90 3HG2 THR 90 -10.736 -1.827 4.717 107 H PHE 91 H PHE 91 -8.468 0.933 3.390 108 HA PHE 91 HA PHE 91 -6.195 -0.306 2.194 109 1HB PHE 91 1HB PHE 91 -5.907 1.896 3.049 110 2HB PHE 91 2HB PHE 91 -6.546 1.443 4.628 111 HD1 PHE 91 HD1 PHE 91 -5.198 0.009 6.138 112 HD2 PHE 91 HD2 PHE 91 -3.627 1.593 2.504 113 HE1 PHE 91 HE1 PHE 91 -2.910 -0.441 6.934 114 HE2 PHE 91 HE2 PHE 91 -1.336 1.144 3.293 115 HZ PHE 91 HZ PHE 91 -0.978 0.126 5.510 116 H TYR 92 H TYR 92 -4.488 -1.406 3.592 117 HA TYR 92 HA TYR 92 -5.327 -2.839 5.902 118 1HB TYR 92 1HB TYR 92 -5.535 -4.149 3.244 119 2HB TYR 92 2HB TYR 92 -4.938 -5.114 4.590 120 HD1 TYR 92 HD1 TYR 92 -6.552 -4.120 6.832 121 HD2 TYR 92 HD2 TYR 92 -7.680 -4.930 2.801 122 HE1 TYR 92 HE1 TYR 92 -8.868 -4.522 7.568 123 HE2 TYR 92 HE2 TYR 92 -10.000 -5.333 3.525 124 HH TYR 92 HH TYR 92 -10.960 -4.945 6.926 125 H ARG 93 H ARG 93 -3.685 -4.862 6.142 126 HA ARG 93 HA ARG 93 -1.059 -4.304 5.080 127 1HB ARG 93 1HB ARG 93 -1.137 -4.331 8.054 128 2HB ARG 93 2HB ARG 93 0.002 -3.548 6.967 129 1HG ARG 93 1HG ARG 93 -1.760 -1.882 6.422 130 2HG ARG 93 2HG ARG 93 -2.774 -2.621 7.663 131 1HD ARG 93 1HD ARG 93 -0.013 -1.795 8.399 132 2HD ARG 93 2HD ARG 93 -1.230 -0.538 8.184 133 HE ARG 93 HE ARG 93 -2.405 -2.393 9.822 134 1HH1 ARG 93 1HH1 ARG 93 0.492 -0.462 9.920 135 2HH1 ARG 93 2HH1 ARG 93 0.518 -0.355 11.649 136 1HH2 ARG 93 1HH2 ARG 93 -2.382 -2.257 12.098 137 2HH2 ARG 93 2HH2 ARG 93 -1.116 -1.375 12.887 138 H THR 94 H THR 94 -3.149 -6.497 5.404 139 HA THR 94 HA THR 94 -1.271 -8.624 5.831 140 HB THR 94 HB THR 94 -2.774 -9.714 7.599 141 HG1 THR 94 HG1 THR 94 -4.449 -8.588 8.114 142 1HG2 THR 94 1HG2 THR 94 -0.534 -8.754 8.099 143 2HG2 THR 94 2HG2 THR 94 -1.337 -7.241 8.519 144 3HG2 THR 94 3HG2 THR 94 -1.671 -8.704 9.446 145 HA PRO 95 HA PRO 95 -4.434 -9.815 2.812 146 1HB PRO 95 1HB PRO 95 -2.826 -11.381 1.331 147 2HB PRO 95 2HB PRO 95 -2.792 -9.618 1.206 148 1HG PRO 95 1HG PRO 95 -0.944 -11.448 2.688 149 2HG PRO 95 2HG PRO 95 -0.558 -10.025 1.704 150 1HD PRO 95 1HD PRO 95 -0.682 -9.989 4.437 151 2HD PRO 95 2HD PRO 95 -0.998 -8.569 3.422 152 H SER 96 H SER 96 -4.620 -10.973 5.281 153 HA SER 96 HA SER 96 -5.767 -13.411 4.853 154 1HB SER 96 1HB SER 96 -2.977 -13.699 4.625 155 2HB SER 96 2HB SER 96 -3.404 -14.388 6.193 156 HG SER 96 HG SER 96 -3.526 -15.823 4.294 157 HA PRO 97 HA PRO 97 -7.152 -12.163 8.894 158 1HB PRO 97 1HB PRO 97 -7.893 -15.061 8.940 159 2HB PRO 97 2HB PRO 97 -8.863 -13.647 9.370 160 1HG PRO 97 1HG PRO 97 -9.240 -14.875 7.044 161 2HG PRO 97 2HG PRO 97 -9.299 -13.106 7.154 162 1HD PRO 97 1HD PRO 97 -7.171 -14.867 6.043 163 2HD PRO 97 2HD PRO 97 -7.675 -13.244 5.533 164 H ASP 98 H ASP 98 -4.997 -14.797 8.198 165 HA ASP 98 HA ASP 98 -3.945 -14.617 10.940 166 1HB ASP 98 1HB ASP 98 -3.361 -17.041 10.774 167 2HB ASP 98 2HB ASP 98 -5.095 -16.731 10.789 168 H ALA 99 H ALA 99 -3.169 -13.280 8.428 169 HA ALA 99 HA ALA 99 -0.701 -14.512 7.590 170 1HB ALA 99 1HB ALA 99 -2.425 -12.463 6.614 171 2HB ALA 99 2HB ALA 99 -0.788 -11.819 6.742 172 3HB ALA 99 3HB ALA 99 -1.092 -13.274 5.793 173 H LYS 100 H LYS 100 1.068 -12.478 7.342 174 HA LYS 100 HA LYS 100 1.837 -12.018 10.125 175 1HB LYS 100 1HB LYS 100 3.310 -12.122 7.523 176 2HB LYS 100 2HB LYS 100 4.009 -11.223 8.862 177 1HG LYS 100 1HG LYS 100 3.684 -13.349 10.235 178 2HG LYS 100 2HG LYS 100 3.414 -14.156 8.688 179 1HD LYS 100 1HD LYS 100 5.613 -14.329 8.424 180 2HD LYS 100 2HD LYS 100 5.729 -12.568 8.395 181 1HE LYS 100 1HE LYS 100 7.061 -12.895 10.185 182 2HE LYS 100 2HE LYS 100 5.526 -12.985 11.047 183 1HZ LYS 100 1HZ LYS 100 5.842 -15.517 10.229 184 2HZ LYS 100 2HZ LYS 100 7.452 -15.066 10.489 185 3HZ LYS 100 3HZ LYS 100 6.326 -14.941 11.745 186 H ALA 101 H ALA 101 2.784 -10.047 7.368 187 HA ALA 101 HA ALA 101 1.092 -7.847 7.926 188 1HB ALA 101 1HB ALA 101 3.793 -7.875 9.211 189 2HB ALA 101 2HB ALA 101 3.065 -6.353 8.700 190 3HB ALA 101 3HB ALA 101 2.240 -7.372 9.879 191 H PHE 102 H PHE 102 0.934 -6.782 6.073 192 HA PHE 102 HA PHE 102 2.446 -7.322 3.809 193 1HB PHE 102 1HB PHE 102 0.400 -5.369 4.583 194 2HB PHE 102 2HB PHE 102 1.493 -4.783 3.333 195 HD1 PHE 102 HD1 PHE 102 2.047 -7.347 1.911 196 HD2 PHE 102 HD2 PHE 102 -1.588 -5.694 3.405 197 HE1 PHE 102 HE1 PHE 102 0.780 -8.608 0.214 198 HE2 PHE 102 HE2 PHE 102 -2.862 -6.953 1.711 199 HZ PHE 102 HZ PHE 102 -1.677 -8.412 0.113 200 H ILE 103 H ILE 103 3.220 -4.947 2.655 201 HA ILE 103 HA ILE 103 5.825 -4.615 3.710 202 HB ILE 103 HB ILE 103 4.358 -2.908 1.694 203 1HG1 ILE 103 1HG1 ILE 103 4.551 -5.235 0.977 204 2HG1 ILE 103 2HG1 ILE 103 5.630 -4.217 0.029 205 1HG2 ILE 103 1HG2 ILE 103 6.446 -1.987 2.928 206 2HG2 ILE 103 2HG2 ILE 103 7.331 -3.117 1.904 207 3HG2 ILE 103 3HG2 ILE 103 6.346 -1.851 1.173 208 1HD1 ILE 103 1HD1 ILE 103 7.284 -4.987 2.021 209 2HD1 ILE 103 2HD1 ILE 103 6.236 -6.399 1.886 210 3HD1 ILE 103 3HD1 ILE 103 7.122 -5.821 0.476 211 H GLU 104 H GLU 104 5.243 -4.044 5.930 212 HA GLU 104 HA GLU 104 3.959 -1.591 6.546 213 1HB GLU 104 1HB GLU 104 5.127 -3.789 7.981 214 2HB GLU 104 2HB GLU 104 5.670 -2.268 8.680 215 1HG GLU 104 1HG GLU 104 2.798 -2.411 8.096 216 2HG GLU 104 2HG GLU 104 3.370 -3.534 9.328 217 H VAL 105 H VAL 105 5.323 -0.077 8.156 218 HA VAL 105 HA VAL 105 7.131 1.330 6.483 219 HB VAL 105 HB VAL 105 6.936 1.762 9.451 220 1HG1 VAL 105 1HG1 VAL 105 7.757 3.334 7.074 221 2HG1 VAL 105 2HG1 VAL 105 6.967 4.197 8.393 222 3HG1 VAL 105 3HG1 VAL 105 8.446 3.288 8.696 223 1HG2 VAL 105 1HG2 VAL 105 4.890 2.370 7.347 224 2HG2 VAL 105 2HG2 VAL 105 4.666 1.645 8.938 225 3HG2 VAL 105 3HG2 VAL 105 5.032 3.364 8.796 226 H GLY 106 H GLY 106 9.333 1.473 6.500 227 1HA GLY 106 1HA GLY 106 11.515 1.099 7.245 228 2HA GLY 106 2HA GLY 106 10.874 0.132 8.565 229 H GLN 107 H GLN 107 9.215 -1.389 6.541 230 HA GLN 107 HA GLN 107 11.024 -3.531 6.165 231 1HB GLN 107 1HB GLN 107 8.678 -3.991 6.434 232 2HB GLN 107 2HB GLN 107 8.272 -3.005 5.036 233 1HG GLN 107 1HG GLN 107 9.227 -4.580 3.541 234 2HG GLN 107 2HG GLN 107 9.957 -5.487 4.866 235 1HE2 GLN 107 2HE2 GLN 107 8.475 -6.833 3.078 236 2HE2 GLN 107 1HE2 GLN 107 6.969 -7.319 3.770 237 H LYS 108 H LYS 108 11.339 -4.581 3.964 238 HA LYS 108 HA LYS 108 12.262 -2.515 2.101 239 1HB LYS 108 1HB LYS 108 13.418 -4.650 1.083 240 2HB LYS 108 2HB LYS 108 14.091 -3.848 2.496 241 1HG LYS 108 1HG LYS 108 12.132 -6.021 2.964 242 2HG LYS 108 2HG LYS 108 13.737 -6.470 2.385 243 1HD LYS 108 1HD LYS 108 13.968 -4.519 4.475 244 2HD LYS 108 2HD LYS 108 12.959 -5.861 5.019 245 1HE LYS 108 1HE LYS 108 15.080 -6.588 5.578 246 2HE LYS 108 2HE LYS 108 14.830 -7.345 4.004 247 1HZ LYS 108 1HZ LYS 108 16.301 -4.805 4.460 248 2HZ LYS 108 2HZ LYS 108 17.023 -6.313 4.205 249 3HZ LYS 108 3HZ LYS 108 16.109 -5.594 2.976 250 H VAL 109 H VAL 109 12.004 -2.863 -0.202 251 HA VAL 109 HA VAL 109 9.969 -4.743 -1.064 252 HB VAL 109 HB VAL 109 9.050 -2.428 -2.276 253 1HG1 VAL 109 1HG1 VAL 109 8.082 -4.208 -0.092 254 2HG1 VAL 109 2HG1 VAL 109 7.157 -2.761 -0.491 255 3HG1 VAL 109 3HG1 VAL 109 7.457 -3.984 -1.725 256 1HG2 VAL 109 1HG2 VAL 109 10.330 -1.092 -0.638 257 2HG2 VAL 109 2HG2 VAL 109 8.589 -0.850 -0.502 258 3HG2 VAL 109 3HG2 VAL 109 9.430 -1.870 0.665 259 H ASN 110 H ASN 110 11.161 -5.668 -2.624 260 HA ASN 110 HA ASN 110 12.647 -3.959 -4.485 261 1HB ASN 110 1HB ASN 110 13.942 -5.847 -5.051 262 2HB ASN 110 2HB ASN 110 13.706 -5.979 -3.311 263 1HD2 ASN 110 2HD2 ASN 110 13.832 -7.736 -5.996 264 2HD2 ASN 110 1HD2 ASN 110 12.750 -9.022 -5.593 265 H VAL 111 H VAL 111 12.252 -3.923 -6.664 266 HA VAL 111 HA VAL 111 9.773 -4.047 -7.699 267 HB VAL 111 HB VAL 111 12.342 -4.752 -9.116 268 1HG1 VAL 111 1HG1 VAL 111 9.551 -4.486 -10.148 269 2HG1 VAL 111 2HG1 VAL 111 10.915 -4.009 -11.160 270 3HG1 VAL 111 3HG1 VAL 111 10.794 -5.666 -10.566 271 1HG2 VAL 111 1HG2 VAL 111 11.277 -2.324 -8.143 272 2HG2 VAL 111 2HG2 VAL 111 12.721 -2.565 -9.125 273 3HG2 VAL 111 3HG2 VAL 111 11.165 -2.275 -9.902 274 H GLY 112 H GLY 112 8.345 -5.646 -7.364 275 1HA GLY 112 1HA GLY 112 7.624 -7.726 -8.557 276 2HA GLY 112 2HA GLY 112 9.179 -8.390 -8.081 277 H ASP 113 H ASP 113 8.033 -6.424 -5.646 278 HA ASP 113 HA ASP 113 7.057 -8.764 -4.162 279 1HB ASP 113 1HB ASP 113 8.846 -6.614 -3.502 280 2HB ASP 113 2HB ASP 113 7.488 -6.623 -2.382 281 H THR 114 H THR 114 5.357 -8.347 -2.529 282 HA THR 114 HA THR 114 3.164 -6.950 -3.745 283 HB THR 114 HB THR 114 2.862 -7.907 -0.968 284 HG1 THR 114 HG1 THR 114 4.089 -9.586 -1.460 285 1HG2 THR 114 1HG2 THR 114 1.365 -8.331 -3.535 286 2HG2 THR 114 2HG2 THR 114 0.969 -9.169 -2.034 287 3HG2 THR 114 3HG2 THR 114 0.865 -7.411 -2.116 288 H LEU 115 H LEU 115 1.703 -5.658 -2.117 289 HA LEU 115 HA LEU 115 3.336 -3.850 -0.490 290 1HB LEU 115 1HB LEU 115 2.909 -2.980 -2.872 291 2HB LEU 115 2HB LEU 115 1.243 -2.781 -2.362 292 HG LEU 115 HG LEU 115 2.685 -1.517 -0.361 293 1HD1 LEU 115 1HD1 LEU 115 4.012 -1.157 -3.023 294 2HD1 LEU 115 2HD1 LEU 115 4.026 0.122 -1.809 295 3HD1 LEU 115 3HD1 LEU 115 4.745 -1.447 -1.444 296 1HD2 LEU 115 1HD2 LEU 115 1.261 -0.486 -2.802 297 2HD2 LEU 115 2HD2 LEU 115 0.629 -0.663 -1.165 298 3HD2 LEU 115 3HD2 LEU 115 1.847 0.565 -1.513 299 H CYS 116 H CYS 116 -0.051 -4.039 -1.602 300 HA CYS 116 HA CYS 116 -1.117 -4.943 0.829 301 1HB CYS 116 1HB CYS 116 -0.663 -2.032 0.628 302 2HB CYS 116 2HB CYS 116 -2.264 -2.511 1.182 303 HG CYS 116 HG CYS 116 -0.725 -2.265 3.254 304 H ILE 117 H ILE 117 -3.421 -5.038 0.836 305 HA ILE 117 HA ILE 117 -4.540 -4.943 -1.850 306 HB ILE 117 HB ILE 117 -5.530 -6.164 0.721 307 1HG1 ILE 117 1HG1 ILE 117 -5.270 -7.734 -1.767 308 2HG1 ILE 117 2HG1 ILE 117 -3.756 -7.129 -1.098 309 1HG2 ILE 117 1HG2 ILE 117 -6.937 -6.036 -1.942 310 2HG2 ILE 117 2HG2 ILE 117 -7.436 -7.034 -0.576 311 3HG2 ILE 117 3HG2 ILE 117 -7.460 -5.275 -0.439 312 1HD1 ILE 117 1HD1 ILE 117 -4.534 -8.143 1.108 313 2HD1 ILE 117 2HD1 ILE 117 -5.736 -8.999 0.143 314 3HD1 ILE 117 3HD1 ILE 117 -4.017 -9.247 -0.167 315 H VAL 118 H VAL 118 -6.659 -4.066 -2.253 316 HA VAL 118 HA VAL 118 -7.217 -1.700 -0.588 317 HB VAL 118 HB VAL 118 -7.956 -2.114 -3.488 318 1HG1 VAL 118 1HG1 VAL 118 -9.025 -0.378 -1.646 319 2HG1 VAL 118 2HG1 VAL 118 -7.800 0.604 -2.450 320 3HG1 VAL 118 3HG1 VAL 118 -9.066 -0.178 -3.397 321 1HG2 VAL 118 1HG2 VAL 118 -5.425 -1.808 -2.655 322 2HG2 VAL 118 2HG2 VAL 118 -6.032 -1.130 -4.166 323 3HG2 VAL 118 3HG2 VAL 118 -5.915 -0.116 -2.727 324 H GLU 119 H GLU 119 -8.479 -4.630 -1.877 325 HA GLU 119 HA GLU 119 -10.606 -5.514 -1.970 326 1HB GLU 119 1HB GLU 119 -9.828 -6.004 0.297 327 2HB GLU 119 2HB GLU 119 -10.462 -4.465 0.862 328 1HG GLU 119 1HG GLU 119 -12.629 -5.704 -0.349 329 2HG GLU 119 2HG GLU 119 -11.798 -6.998 0.513 330 H ALA 120 H ALA 120 -10.881 -3.264 -3.311 331 HA ALA 120 HA ALA 120 -12.867 -1.529 -2.130 332 1HB ALA 120 1HB ALA 120 -10.997 -0.927 -3.842 333 2HB ALA 120 2HB ALA 120 -12.174 -1.479 -5.034 334 3HB ALA 120 3HB ALA 120 -12.574 -0.146 -3.952 335 H MET 121 H MET 121 -13.033 -4.553 -3.366 336 HA MET 121 HA MET 121 -15.807 -4.661 -3.506 337 1HB MET 121 1HB MET 121 -16.317 -4.742 -5.827 338 2HB MET 121 2HB MET 121 -15.389 -3.271 -5.570 339 1HG MET 121 1HG MET 121 -13.694 -3.960 -6.859 340 2HG MET 121 2HG MET 121 -13.785 -5.619 -6.271 341 1HE MET 121 1HE MET 121 -12.885 -5.636 -8.725 342 2HE MET 121 2HE MET 121 -13.957 -6.142 -10.031 343 3HE MET 121 3HE MET 121 -13.629 -4.429 -9.773 344 H LYS 122 H LYS 122 -13.813 -6.205 -2.384 345 HA LYS 122 HA LYS 122 -13.172 -8.366 -2.081 346 1HB LYS 122 1HB LYS 122 -15.683 -8.645 -2.408 347 2HB LYS 122 2HB LYS 122 -15.317 -9.120 -4.061 348 1HG LYS 122 1HG LYS 122 -15.644 -10.955 -2.300 349 2HG LYS 122 2HG LYS 122 -14.272 -11.084 -3.404 350 1HD LYS 122 1HD LYS 122 -13.648 -11.594 -1.079 351 2HD LYS 122 2HD LYS 122 -12.788 -10.186 -1.706 352 1HE LYS 122 1HE LYS 122 -13.968 -8.711 -0.385 353 2HE LYS 122 2HE LYS 122 -15.347 -9.797 -0.222 354 H MET 123 H MET 123 -12.198 -6.716 -4.424 355 HA MET 123 HA MET 123 -11.471 -8.776 -6.349 356 1HB MET 123 1HB MET 123 -10.750 -7.050 -7.764 357 2HB MET 123 2HB MET 123 -12.165 -6.385 -6.960 358 1HG MET 123 1HG MET 123 -10.180 -5.597 -5.284 359 2HG MET 123 2HG MET 123 -9.362 -5.553 -6.845 360 1HE MET 123 1HE MET 123 -9.352 -3.267 -5.273 361 2HE MET 123 2HE MET 123 -9.212 -2.523 -6.866 362 3HE MET 123 3HE MET 123 -10.396 -1.915 -5.709 363 H MET 124 H MET 124 -10.192 -7.260 -3.567 364 HA MET 124 HA MET 124 -8.211 -7.422 -2.475 365 1HB MET 124 1HB MET 124 -7.340 -9.668 -4.244 366 2HB MET 124 2HB MET 124 -7.139 -9.473 -2.508 367 1HG MET 124 1HG MET 124 -9.920 -9.614 -3.086 368 2HG MET 124 2HG MET 124 -9.103 -10.947 -3.900 369 1HE MET 124 1HE MET 124 -9.958 -9.139 -0.708 370 2HE MET 124 2HE MET 124 -11.112 -10.469 -0.814 371 3HE MET 124 3HE MET 124 -9.945 -10.417 0.506 372 H ASN 125 H ASN 125 -8.361 -5.648 -4.677 373 HA ASN 125 HA ASN 125 -6.243 -5.776 -6.476 374 1HB ASN 125 1HB ASN 125 -8.048 -4.117 -6.645 375 2HB ASN 125 2HB ASN 125 -7.452 -3.313 -5.194 376 1HD2 ASN 125 2HD2 ASN 125 -7.237 -1.399 -6.418 377 2HD2 ASN 125 1HD2 ASN 125 -5.896 -1.170 -7.484 378 H GLN 126 H GLN 126 -4.510 -6.694 -5.254 379 HA GLN 126 HA GLN 126 -3.288 -5.056 -3.193 380 1HB GLN 126 1HB GLN 126 -1.743 -6.917 -2.901 381 2HB GLN 126 2HB GLN 126 -3.406 -7.487 -2.892 382 1HG GLN 126 1HG GLN 126 -2.165 -7.523 -5.533 383 2HG GLN 126 2HG GLN 126 -1.370 -8.561 -4.351 384 1HE2 GLN 126 2HE2 GLN 126 -2.420 -10.351 -3.576 385 2HE2 GLN 126 1HE2 GLN 126 -3.902 -10.938 -4.242 386 H ILE 127 H ILE 127 -1.632 -3.721 -3.472 387 HA ILE 127 HA ILE 127 -0.552 -3.362 -6.139 388 HB ILE 127 HB ILE 127 0.224 -1.832 -3.662 389 1HG1 ILE 127 1HG1 ILE 127 -2.149 -1.629 -3.758 390 2HG1 ILE 127 2HG1 ILE 127 -1.496 -0.155 -4.466 391 1HG2 ILE 127 1HG2 ILE 127 0.774 -1.621 -6.529 392 2HG2 ILE 127 2HG2 ILE 127 0.282 -0.108 -5.769 393 3HG2 ILE 127 3HG2 ILE 127 1.676 -0.994 -5.149 394 1HD1 ILE 127 1HD1 ILE 127 -1.814 -1.952 -6.587 395 2HD1 ILE 127 2HD1 ILE 127 -3.272 -2.085 -5.603 396 3HD1 ILE 127 3HD1 ILE 127 -2.773 -0.514 -6.232 397 H GLU 128 H GLU 128 1.537 -3.717 -6.766 398 HA GLU 128 HA GLU 128 3.276 -5.079 -4.814 399 1HB GLU 128 1HB GLU 128 2.860 -5.588 -7.755 400 2HB GLU 128 2HB GLU 128 4.272 -6.186 -6.894 401 1HG GLU 128 1HG GLU 128 3.138 -7.914 -6.112 402 2HG GLU 128 2HG GLU 128 1.887 -6.858 -5.453 403 H ALA 129 H ALA 129 4.880 -3.778 -4.231 404 HA ALA 129 HA ALA 129 5.704 -1.430 -5.300 405 1HB ALA 129 1HB ALA 129 6.510 -2.736 -3.188 406 2HB ALA 129 2HB ALA 129 7.812 -3.265 -4.254 407 3HB ALA 129 3HB ALA 129 7.566 -1.546 -3.949 408 H ASP 130 H ASP 130 7.071 -0.706 -6.875 409 HA ASP 130 HA ASP 130 8.574 -2.622 -8.471 410 1HB ASP 130 1HB ASP 130 7.614 -1.843 -10.587 411 2HB ASP 130 2HB ASP 130 6.371 -2.552 -9.557 412 H LYS 131 H LYS 131 9.225 -0.429 -6.658 413 HA LYS 131 HA LYS 131 10.643 1.329 -8.552 414 1HB LYS 131 1HB LYS 131 8.787 2.124 -6.683 415 2HB LYS 131 2HB LYS 131 10.306 2.379 -5.838 416 1HG LYS 131 1HG LYS 131 10.030 3.390 -8.622 417 2HG LYS 131 2HG LYS 131 9.242 4.265 -7.309 418 1HD LYS 131 1HD LYS 131 11.195 5.278 -6.953 419 2HD LYS 131 2HD LYS 131 11.794 3.731 -6.351 420 1HE LYS 131 1HE LYS 131 13.333 4.464 -8.000 421 2HE LYS 131 2HE LYS 131 12.393 3.161 -8.725 422 1HZ LYS 131 1HZ LYS 131 10.932 5.200 -9.494 423 2HZ LYS 131 2HZ LYS 131 12.408 6.013 -9.354 424 3HZ LYS 131 3HZ LYS 131 12.272 4.679 -10.385 425 H SER 132 H SER 132 10.936 -1.019 -6.171 426 HA SER 132 HA SER 132 12.680 -1.882 -4.992 427 1HB SER 132 1HB SER 132 13.804 -0.843 -7.482 428 2HB SER 132 2HB SER 132 14.990 -0.927 -6.180 429 HG SER 132 HG SER 132 14.911 -2.890 -7.298 430 H GLY 133 H GLY 133 12.340 -0.766 -3.068 431 1HA GLY 133 1HA GLY 133 14.489 0.884 -2.210 432 2HA GLY 133 2HA GLY 133 13.045 1.850 -2.479 433 H THR 134 H THR 134 12.989 2.368 -0.249 434 HA THR 134 HA THR 134 11.964 0.170 1.423 435 HB THR 134 HB THR 134 13.897 2.367 2.121 436 HG1 THR 134 HG1 THR 134 13.878 -0.415 2.099 437 1HG2 THR 134 1HG2 THR 134 11.819 1.344 3.838 438 2HG2 THR 134 2HG2 THR 134 13.425 0.965 4.461 439 3HG2 THR 134 3HG2 THR 134 12.984 2.637 4.118 440 H VAL 135 H VAL 135 10.155 0.569 2.610 441 HA VAL 135 HA VAL 135 8.517 2.766 1.833 442 HB VAL 135 HB VAL 135 8.137 0.687 3.990 443 1HG1 VAL 135 1HG1 VAL 135 6.298 2.851 2.999 444 2HG1 VAL 135 2HG1 VAL 135 5.720 1.415 3.845 445 3HG1 VAL 135 3HG1 VAL 135 6.818 2.533 4.653 446 1HG2 VAL 135 1HG2 VAL 135 7.622 0.793 1.107 447 2HG2 VAL 135 2HG2 VAL 135 7.808 -0.596 2.177 448 3HG2 VAL 135 3HG2 VAL 135 6.257 0.236 2.072 449 H LYS 136 H LYS 136 8.186 4.682 2.787 450 HA LYS 136 HA LYS 136 9.845 5.393 5.054 451 1HB LYS 136 1HB LYS 136 9.020 6.766 2.832 452 2HB LYS 136 2HB LYS 136 7.938 7.397 4.066 453 1HG LYS 136 1HG LYS 136 10.902 7.277 4.493 454 2HG LYS 136 2HG LYS 136 10.133 8.629 3.658 455 1HD LYS 136 1HD LYS 136 9.165 9.424 5.552 456 2HD LYS 136 2HD LYS 136 8.942 7.815 6.241 457 1HE LYS 136 1HE LYS 136 11.642 8.000 6.249 458 2HE LYS 136 2HE LYS 136 11.198 9.690 6.487 459 1HZ LYS 136 1HZ LYS 136 9.660 7.929 8.128 460 2HZ LYS 136 2HZ LYS 136 11.318 7.766 8.419 461 3HZ LYS 136 3HZ LYS 136 10.577 9.279 8.567 462 H ALA 137 H ALA 137 6.380 5.323 4.272 463 HA ALA 137 HA ALA 137 5.605 4.533 6.857 464 1HB ALA 137 1HB ALA 137 5.482 7.478 6.295 465 2HB ALA 137 2HB ALA 137 4.386 6.706 7.442 466 3HB ALA 137 3HB ALA 137 6.128 6.647 7.710 467 H ILE 138 H ILE 138 3.139 4.974 7.171 468 HA ILE 138 HA ILE 138 1.764 4.935 4.575 469 HB ILE 138 HB ILE 138 1.578 2.854 6.743 470 1HG1 ILE 138 1HG1 ILE 138 2.231 2.908 3.820 471 2HG1 ILE 138 2HG1 ILE 138 3.091 2.122 5.140 472 1HG2 ILE 138 1HG2 ILE 138 -0.706 3.643 6.226 473 2HG2 ILE 138 2HG2 ILE 138 -0.428 3.257 4.528 474 3HG2 ILE 138 3HG2 ILE 138 -0.431 1.973 5.736 475 1HD1 ILE 138 1HD1 ILE 138 0.421 1.217 4.087 476 2HD1 ILE 138 2HD1 ILE 138 1.976 0.557 3.577 477 3HD1 ILE 138 3HD1 ILE 138 1.451 0.384 5.252 478 H LEU 139 H LEU 139 -0.083 6.072 4.532 479 HA LEU 139 HA LEU 139 -0.915 7.437 6.962 480 1HB LEU 139 1HB LEU 139 -1.794 7.701 4.087 481 2HB LEU 139 2HB LEU 139 -2.461 8.647 5.403 482 HG LEU 139 HG LEU 139 -0.723 9.824 4.036 483 1HD1 LEU 139 1HD1 LEU 139 -1.311 10.436 6.378 484 2HD1 LEU 139 2HD1 LEU 139 0.048 9.452 6.923 485 3HD1 LEU 139 3HD1 LEU 139 0.334 10.866 5.909 486 1HD2 LEU 139 1HD2 LEU 139 0.679 7.664 3.885 487 2HD2 LEU 139 2HD2 LEU 139 1.517 9.205 4.069 488 3HD2 LEU 139 3HD2 LEU 139 1.305 8.144 5.462 489 H VAL 140 H VAL 140 -2.545 5.635 4.359 490 HA VAL 140 HA VAL 140 -4.947 5.262 5.829 491 HB VAL 140 HB VAL 140 -4.220 3.352 3.664 492 1HG1 VAL 140 1HG1 VAL 140 -6.433 3.332 4.739 493 2HG1 VAL 140 2HG1 VAL 140 -6.695 4.988 4.192 494 3HG1 VAL 140 3HG1 VAL 140 -6.527 3.687 3.014 495 1HG2 VAL 140 1HG2 VAL 140 -4.055 6.248 3.387 496 2HG2 VAL 140 2HG2 VAL 140 -3.495 4.971 2.307 497 3HG2 VAL 140 3HG2 VAL 140 -5.175 5.502 2.248 498 H GLU 141 H GLU 141 -4.889 4.160 7.698 499 HA GLU 141 HA GLU 141 -3.609 1.506 7.665 500 1HB GLU 141 1HB GLU 141 -3.557 3.642 9.765 501 2HB GLU 141 2HB GLU 141 -3.393 1.953 10.225 502 1HG GLU 141 1HG GLU 141 -1.362 1.720 9.155 503 2HG GLU 141 2HG GLU 141 -1.653 3.091 8.085 504 H SER 142 H SER 142 -4.628 -0.165 8.768 505 HA SER 142 HA SER 142 -6.434 -1.414 9.375 506 1HB SER 142 1HB SER 142 -6.228 -0.571 11.536 507 2HB SER 142 2HB SER 142 -6.682 1.062 11.051 508 HG SER 142 HG SER 142 -8.379 0.052 12.165 509 H GLY 143 H GLY 143 -7.308 -1.311 7.168 510 1HA GLY 143 1HA GLY 143 -8.911 -0.761 5.592 511 2HA GLY 143 2HA GLY 143 -9.983 -0.963 6.969 512 H GLN 144 H GLN 144 -7.601 1.572 6.900 513 HA GLN 144 HA GLN 144 -9.364 3.615 7.515 514 1HB GLN 144 1HB GLN 144 -6.594 3.382 6.880 515 2HB GLN 144 2HB GLN 144 -7.252 4.724 5.955 516 1HG GLN 144 1HG GLN 144 -8.296 5.431 8.224 517 2HG GLN 144 2HG GLN 144 -7.060 4.378 8.910 518 1HE2 GLN 144 2HE2 GLN 144 -7.614 7.214 6.924 519 2HE2 GLN 144 1HE2 GLN 144 -6.059 7.924 7.168 520 HA PRO 145 HA PRO 145 -11.774 4.487 3.939 521 1HB PRO 145 1HB PRO 145 -11.241 7.341 4.616 522 2HB PRO 145 2HB PRO 145 -12.781 6.516 4.347 523 1HG PRO 145 1HG PRO 145 -11.997 7.149 6.811 524 2HG PRO 145 2HG PRO 145 -12.823 5.614 6.484 525 1HD PRO 145 1HD PRO 145 -9.929 6.138 6.995 526 2HD PRO 145 2HD PRO 145 -10.930 4.757 7.485 527 H VAL 146 H VAL 146 -10.508 3.891 2.208 528 HA VAL 146 HA VAL 146 -8.266 5.486 1.354 529 HB VAL 146 HB VAL 146 -9.616 3.293 -0.216 530 1HG1 VAL 146 1HG1 VAL 146 -7.788 4.932 -1.142 531 2HG1 VAL 146 2HG1 VAL 146 -6.694 3.879 -0.244 532 3HG1 VAL 146 3HG1 VAL 146 -7.723 3.209 -1.510 533 1HG2 VAL 146 1HG2 VAL 146 -8.573 2.981 2.314 534 2HG2 VAL 146 2HG2 VAL 146 -8.779 1.706 1.114 535 3HG2 VAL 146 3HG2 VAL 146 -7.229 2.533 1.264 536 H GLU 147 H GLU 147 -8.902 7.496 0.715 537 HA GLU 147 HA GLU 147 -11.023 7.699 -1.303 538 1HB GLU 147 1HB GLU 147 -11.314 9.118 0.660 539 2HB GLU 147 2HB GLU 147 -9.725 9.830 0.404 540 1HG GLU 147 1HG GLU 147 -10.427 11.112 -1.351 541 2HG GLU 147 2HG GLU 147 -11.720 9.996 -1.792 542 H PHE 148 H PHE 148 -10.667 8.580 -3.303 543 HA PHE 148 HA PHE 148 -8.430 8.182 -4.709 544 1HB PHE 148 1HB PHE 148 -10.245 8.928 -5.961 545 2HB PHE 148 2HB PHE 148 -10.478 10.346 -4.950 546 HD1 PHE 148 HD1 PHE 148 -9.119 12.341 -5.261 547 HD2 PHE 148 HD2 PHE 148 -8.638 8.915 -7.755 548 HE1 PHE 148 HE1 PHE 148 -7.846 13.701 -6.875 549 HE2 PHE 148 HE2 PHE 148 -7.363 10.268 -9.374 550 HZ PHE 148 HZ PHE 148 -6.967 12.664 -8.935 551 H ASP 149 H ASP 149 -6.378 8.709 -4.413 552 HA ASP 149 HA ASP 149 -4.534 10.090 -4.267 553 1HB ASP 149 1HB ASP 149 -6.476 11.958 -4.717 554 2HB ASP 149 2HB ASP 149 -5.913 12.424 -3.114 555 H GLU 150 H GLU 150 -5.042 8.291 -2.380 556 HA GLU 150 HA GLU 150 -4.489 9.702 0.147 557 1HB GLU 150 1HB GLU 150 -6.537 7.825 -0.440 558 2HB GLU 150 2HB GLU 150 -5.391 7.032 0.633 559 1HG GLU 150 1HG GLU 150 -5.914 9.680 1.577 560 2HG GLU 150 2HG GLU 150 -7.434 8.830 1.307 561 HA PRO 151 HA PRO 151 -0.444 7.844 -0.405 562 1HB PRO 151 1HB PRO 151 -0.395 8.498 2.507 563 2HB PRO 151 2HB PRO 151 0.811 8.835 1.258 564 1HG PRO 151 1HG PRO 151 -0.781 10.768 2.160 565 2HG PRO 151 2HG PRO 151 -0.351 10.669 0.442 566 1HD PRO 151 1HD PRO 151 -2.910 9.969 1.801 567 2HD PRO 151 2HD PRO 151 -2.636 10.637 0.180 568 H LEU 152 H LEU 152 -0.996 5.682 -0.689 569 HA LEU 152 HA LEU 152 -1.966 4.069 1.476 570 1HB LEU 152 1HB LEU 152 -0.896 3.341 -1.250 571 2HB LEU 152 2HB LEU 152 -1.564 2.180 -0.116 572 HG LEU 152 HG LEU 152 -3.145 4.524 -1.157 573 1HD1 LEU 152 1HD1 LEU 152 -2.236 2.353 -2.666 574 2HD1 LEU 152 2HD1 LEU 152 -3.917 1.993 -2.273 575 3HD1 LEU 152 3HD1 LEU 152 -3.506 3.500 -3.091 576 1HD2 LEU 152 1HD2 LEU 152 -3.730 2.082 0.456 577 2HD2 LEU 152 2HD2 LEU 152 -4.250 3.748 0.710 578 3HD2 LEU 152 3HD2 LEU 152 -4.988 2.778 -0.565 579 H VAL 153 H VAL 153 1.089 4.129 -0.361 580 HA VAL 153 HA VAL 153 2.552 3.452 2.058 581 HB VAL 153 HB VAL 153 2.893 1.733 -0.398 582 1HG1 VAL 153 1HG1 VAL 153 3.985 1.594 2.406 583 2HG1 VAL 153 2HG1 VAL 153 4.114 0.280 1.237 584 3HG1 VAL 153 3HG1 VAL 153 4.886 1.831 0.908 585 1HG2 VAL 153 1HG2 VAL 153 1.172 1.358 2.020 586 2HG2 VAL 153 2HG2 VAL 153 0.800 1.049 0.324 587 3HG2 VAL 153 3HG2 VAL 153 1.874 -0.038 1.203 588 H VAL 154 H VAL 154 3.678 5.353 1.941 589 HA VAL 154 HA VAL 154 4.920 6.234 -0.501 590 HB VAL 154 HB VAL 154 5.681 8.122 0.695 591 1HG1 VAL 154 1HG1 VAL 154 3.172 7.824 0.406 592 2HG1 VAL 154 2HG1 VAL 154 3.128 7.444 2.128 593 3HG1 VAL 154 3HG1 VAL 154 3.700 9.022 1.588 594 1HG2 VAL 154 1HG2 VAL 154 5.219 6.504 3.196 595 2HG2 VAL 154 2HG2 VAL 154 6.757 7.092 2.564 596 3HG2 VAL 154 3HG2 VAL 154 5.568 8.233 3.193 597 H ILE 155 H ILE 155 6.793 5.524 -1.258 598 HA ILE 155 HA ILE 155 8.662 4.209 0.591 599 HB ILE 155 HB ILE 155 8.618 4.017 -2.421 600 1HG1 ILE 155 1HG1 ILE 155 7.880 1.606 -0.990 601 2HG1 ILE 155 2HG1 ILE 155 6.776 2.926 -0.618 602 1HG2 ILE 155 1HG2 ILE 155 10.755 3.565 -1.074 603 2HG2 ILE 155 2HG2 ILE 155 9.925 2.115 -0.510 604 3HG2 ILE 155 3HG2 ILE 155 10.230 2.344 -2.233 605 1HD1 ILE 155 1HD1 ILE 155 7.089 3.048 -3.367 606 2HD1 ILE 155 2HD1 ILE 155 7.002 1.324 -3.003 607 3HD1 ILE 155 3HD1 ILE 155 5.706 2.401 -2.483 608 H GLU 156 H GLU 156 10.744 4.881 0.791 609 HA GLU 156 HA GLU 156 11.616 7.142 -0.875 610 1HB GLU 156 1HB GLU 156 10.820 7.703 1.533 611 2HB GLU 156 2HB GLU 156 12.338 6.970 2.034 612 1HG GLU 156 1HG GLU 156 13.458 8.584 0.411 613 2HG GLU 156 2HG GLU 156 11.910 9.427 0.373 614 1H10 BTN 222 1H10 BTN 122 -13.636 -12.903 3.006 615 2H10 BTN 222 2H10 BTN 122 -13.474 -11.253 3.602 616 1H9 BTN 222 1H9 BTN 122 -11.505 -11.272 1.769 617 2H9 BTN 222 2H9 BTN 122 -11.505 -12.974 2.239 618 1H8 BTN 222 1H8 BTN 122 -11.028 -12.475 4.480 619 2H8 BTN 222 2H8 BTN 122 -11.480 -10.780 4.288 620 1H7 BTN 222 1H7 BTN 122 -9.546 -10.593 2.669 621 2H7 BTN 222 2H7 BTN 122 -9.039 -12.179 3.235 622 H2 BTN 222 H2 BTN 122 -8.929 -11.243 5.562 623 1H6 BTN 222 1H6 BTN 122 -8.007 -7.159 4.146 624 2H6 BTN 222 2H6 BTN 122 -8.709 -8.168 2.891 625 H5 BTN 222 H5 BTN 122 -6.224 -8.582 4.446 626 HN1 BTN 222 HN2 BTN 122 -6.278 -8.612 1.897 627 HN2 BTN 222 HN1 BTN 122 -7.078 -12.258 3.274 628 H4 BTN 222 H4 BTN 122 -6.722 -10.680 5.255
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