NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
10220 | 1pei | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ACE 266 1H1 MET 1 2.248 18.675 1.788 2 2H ACE 266 2H1 MET 1 0.486 18.429 1.804 3 3H ACE 266 3H1 MET 1 1.537 17.274 0.952 4 H VAL 267 H VAL 1 0.256 19.341 -1.893 5 HA VAL 267 HA VAL 1 -0.522 17.449 0.105 6 HB VAL 267 HB VAL 1 -1.496 18.203 -2.473 7 1HG1 VAL 267 1HG2 VAL 1 -1.160 15.120 -2.518 8 2HG1 VAL 267 2HG2 VAL 1 -2.186 16.069 -3.624 9 3HG1 VAL 267 3HG2 VAL 1 -0.444 16.271 -3.671 10 1HG2 VAL 267 2HG1 VAL 1 -2.951 17.788 -0.439 11 2HG2 VAL 267 3HG1 VAL 1 -3.592 16.998 -1.884 12 3HG2 VAL 267 1HG1 VAL 1 -2.748 16.033 -0.646 13 H GLU 268 H GLU 2 -0.004 15.565 0.715 14 HA GLU 268 HA GLU 2 1.520 13.702 -1.059 15 1HB GLU 268 2HB GLU 2 3.593 13.603 0.291 16 2HB GLU 268 1HB GLU 2 3.369 15.212 -0.350 17 1HG GLU 268 2HG GLU 2 2.782 16.152 1.843 18 2HG GLU 268 1HG GLU 2 2.495 14.577 2.540 19 H GLU 269 H GLU 3 -0.936 13.790 0.380 20 HA GLU 269 HA GLU 3 -0.448 11.675 2.490 21 1HB GLU 269 1HB GLU 3 -3.086 13.097 1.766 22 2HB GLU 269 2HB GLU 3 -2.762 12.232 3.249 23 1HG GLU 269 1HG GLU 3 -0.826 14.432 3.084 24 2HG GLU 269 2HG GLU 3 -2.382 15.092 2.651 25 H LYS 270 H LYS 4 -2.039 12.446 -0.369 26 HA LYS 270 HA LYS 4 -3.556 9.937 -0.756 27 1HB LYS 270 1HB LYS 4 -2.445 12.026 -2.749 28 2HB LYS 270 2HB LYS 4 -3.352 10.627 -3.306 29 1HG LYS 270 1HG LYS 4 -5.266 11.396 -1.649 30 2HG LYS 270 2HG LYS 4 -4.350 12.887 -1.442 31 1HD LYS 270 1HD LYS 4 -4.571 12.539 -4.274 32 2HD LYS 270 2HD LYS 4 -6.125 11.964 -3.640 33 1HE LYS 270 1HE LYS 4 -4.951 14.579 -2.519 34 2HE LYS 270 2HE LYS 4 -5.769 14.619 -4.088 35 1HZ LYS 270 2HZ LYS 4 -7.196 13.097 -2.088 36 2HZ LYS 270 3HZ LYS 4 -7.014 14.725 -1.707 37 3HZ LYS 270 1HZ LYS 4 -7.747 14.277 -3.152 38 H SER 271 H SER 5 -0.303 10.935 -1.565 39 HA SER 271 HA SER 5 0.374 8.485 -3.042 40 1HB SER 271 1HB SER 5 1.697 10.921 -2.427 41 2HB SER 271 2HB SER 5 2.681 9.733 -1.589 42 HG SER 271 HG SER 5 2.371 8.568 -3.819 43 H ILE 272 H ILE 6 0.575 9.399 0.338 44 HA ILE 272 HA ILE 6 1.949 6.934 1.152 45 HB ILE 272 HB ILE 6 0.030 8.607 2.857 46 1HG1 ILE 272 2HG1 ILE 6 2.270 9.778 1.686 47 2HG1 ILE 272 1HG1 ILE 6 1.532 10.339 3.176 48 1HG2 ILE 272 2HG2 ILE 6 0.737 6.458 4.012 49 2HG2 ILE 272 3HG2 ILE 6 2.452 6.864 3.763 50 3HG2 ILE 272 1HG2 ILE 6 1.426 7.824 4.851 51 1HD1 ILE 272 2HD1 ILE 6 3.272 8.859 4.444 52 2HD1 ILE 272 3HD1 ILE 6 4.011 8.477 2.868 53 3HD1 ILE 272 1HD1 ILE 6 3.986 10.149 3.450 54 H ASP 273 H ASP 7 -1.160 7.518 0.233 55 HA ASP 273 HA ASP 7 -2.197 5.047 1.604 56 1HB ASP 273 1HB ASP 7 -3.417 7.446 0.203 57 2HB ASP 273 2HB ASP 7 -4.143 5.965 -0.380 58 H LEU 274 H LEU 8 -1.005 6.050 -1.327 59 HA LEU 274 HA LEU 8 -1.830 3.513 -2.728 60 1HB LEU 274 2HB LEU 8 -1.240 6.096 -3.648 61 2HB LEU 274 1HB LEU 8 0.337 5.356 -3.849 62 HG LEU 274 HG LEU 8 -0.671 5.265 -5.998 63 1HD1 LEU 274 2HD1 LEU 8 0.385 3.077 -5.353 64 2HD1 LEU 274 3HD1 LEU 8 -1.183 2.468 -4.769 65 3HD1 LEU 274 1HD1 LEU 8 -0.949 2.832 -6.495 66 1HD2 LEU 274 2HD2 LEU 8 -3.273 4.161 -4.721 67 2HD2 LEU 274 3HD2 LEU 8 -3.038 5.771 -5.445 68 3HD2 LEU 274 1HD2 LEU 8 -2.983 4.336 -6.474 69 H ILE 275 H ILE 9 0.724 4.554 -0.917 70 HA ILE 275 HA ILE 9 2.201 1.983 -1.685 71 HB ILE 275 HB ILE 9 3.681 4.346 -0.453 72 1HG1 ILE 275 2HG1 ILE 9 2.408 4.398 -3.135 73 2HG1 ILE 275 1HG1 ILE 9 3.223 5.681 -2.272 74 1HG2 ILE 275 2HG2 ILE 9 5.015 2.210 -0.641 75 2HG2 ILE 275 3HG2 ILE 9 4.663 2.120 -2.384 76 3HG2 ILE 275 1HG2 ILE 9 5.677 3.416 -1.714 77 1HD1 ILE 275 2HD1 ILE 9 5.474 4.694 -3.207 78 2HD1 ILE 275 3HD1 ILE 9 4.500 3.518 -4.126 79 3HD1 ILE 275 1HD1 ILE 9 4.337 5.250 -4.456 80 H GLN 276 H GLN 10 0.235 2.963 0.497 81 HA GLN 276 HA GLN 10 1.596 1.473 2.794 82 1HB GLN 276 1HB GLN 10 0.712 3.422 3.778 83 2HB GLN 276 2HB GLN 10 -0.407 3.702 2.445 84 1HG GLN 276 1HG GLN 10 -2.141 3.060 3.793 85 2HG GLN 276 2HG GLN 10 -1.528 1.427 3.843 86 1HE2 GLN 276 2HE2 GLN 10 -0.008 3.215 7.106 87 2HE2 GLN 276 1HE2 GLN 10 0.613 3.580 5.402 88 H LYS 277 H LYS 11 -1.284 1.888 0.852 89 HA LYS 277 HA LYS 11 -2.530 -0.669 1.462 90 1HB LYS 277 1HB LYS 11 -2.609 1.501 -0.652 91 2HB LYS 277 2HB LYS 11 -2.549 -0.024 -1.524 92 1HG LYS 277 1HG LYS 11 -4.921 0.361 0.504 93 2HG LYS 277 2HG LYS 11 -4.840 1.303 -0.976 94 1HD LYS 277 1HD LYS 11 -4.706 -0.865 -2.289 95 2HD LYS 277 2HD LYS 11 -4.779 -1.789 -0.775 96 1HE LYS 277 1HE LYS 11 -7.099 -1.656 -1.511 97 2HE LYS 277 2HE LYS 11 -6.978 -0.481 -0.193 98 1HZ LYS 277 1HZ LYS 11 -6.477 0.331 -2.997 99 2HZ LYS 277 2HZ LYS 11 -8.030 0.283 -2.353 100 3HZ LYS 277 3HZ LYS 11 -6.868 1.294 -1.675 101 H TRP 278 H TRP 12 0.259 0.047 -0.146 102 HA TRP 278 HA TRP 12 0.509 -2.589 -1.556 103 1HB TRP 278 1HB TRP 12 2.228 -0.023 -1.116 104 2HB TRP 278 2HB TRP 12 3.050 -1.443 -1.721 105 HD1 TRP 278 HD1 TRP 12 -0.550 -0.499 -2.933 106 HE1 TRP 278 HE1 TRP 12 -0.531 -0.007 -5.549 107 HE3 TRP 278 HE3 TRP 12 4.513 -0.692 -3.522 108 HZ2 TRP 278 HZ2 TRP 12 1.565 0.256 -7.453 109 HZ3 TRP 278 HZ3 TRP 12 5.483 -0.305 -5.767 110 HH2 TRP 278 HH2 TRP 12 4.033 0.155 -7.708 111 H GLU 279 H GLU 13 1.316 -1.280 1.389 112 HA GLU 279 HA GLU 13 3.282 -3.396 2.161 113 1HB GLU 279 2HB GLU 13 3.702 -1.365 3.273 114 2HB GLU 279 1HB GLU 13 2.032 -0.877 3.239 115 1HG GLU 279 2HG GLU 13 1.824 -1.323 5.465 116 2HG GLU 279 1HG GLU 13 1.883 -3.021 5.095 117 H GLU 280 H GLU 14 0.007 -3.081 1.971 118 HA GLU 280 HA GLU 14 -0.506 -5.508 3.750 119 1HB GLU 280 1HB GLU 14 -2.145 -3.181 2.718 120 2HB GLU 280 2HB GLU 14 -2.986 -4.712 2.715 121 1HG GLU 280 2HG GLU 14 -1.642 -4.220 5.357 122 2HG GLU 280 1HG GLU 14 -2.692 -2.896 4.918 123 H LYS 281 H LYS 15 -0.393 -4.240 0.566 124 HA LYS 281 HA LYS 15 -1.545 -6.514 -0.898 125 1HB LYS 281 1HB LYS 15 -1.119 -4.271 -1.971 126 2HB LYS 281 2HB LYS 15 0.608 -4.411 -1.674 127 1HG LYS 281 1HG LYS 15 0.891 -6.121 -3.383 128 2HG LYS 281 2HG LYS 15 -0.815 -6.562 -3.362 129 1HD LYS 281 1HD LYS 15 -0.006 -3.743 -4.230 130 2HD LYS 281 2HD LYS 15 0.331 -5.097 -5.327 131 1HE LYS 281 1HE LYS 15 -2.413 -5.311 -4.149 132 2HE LYS 281 2HE LYS 15 -2.210 -3.789 -5.029 133 1HZ LYS 281 3HZ LYS 15 -1.188 -5.179 -6.860 134 2HZ LYS 281 1HZ LYS 15 -1.775 -6.534 -6.056 135 3HZ LYS 281 2HZ LYS 15 -2.841 -5.360 -6.613 136 H SER 282 H SER 16 1.615 -5.656 0.290 137 HA SER 282 HA SER 16 3.148 -7.776 -0.983 138 1HB SER 282 2HB SER 16 3.712 -5.690 0.852 139 2HB SER 282 1HB SER 16 3.851 -7.110 1.859 140 HG SER 282 HG SER 16 5.791 -6.250 0.532 141 H ARG 283 H ARG 17 1.488 -7.554 1.945 142 HA ARG 283 HA ARG 17 2.017 -10.369 2.795 143 1HB ARG 283 2HB ARG 17 1.431 -8.951 4.604 144 2HB ARG 283 1HB ARG 17 0.173 -8.122 3.709 145 1HG ARG 283 1HG ARG 17 -1.411 -10.063 3.963 146 2HG ARG 283 2HG ARG 17 -0.143 -11.041 4.695 147 1HD ARG 283 1HD ARG 17 -1.792 -8.799 5.882 148 2HD ARG 283 2HD ARG 17 -1.183 -10.293 6.639 149 HE ARG 283 HE ARG 17 0.977 -9.253 7.018 150 1HH1 ARG 283 2HH2 ARG 17 -1.230 -7.029 5.523 151 2HH1 ARG 283 1HH2 ARG 17 -0.189 -5.572 5.972 152 1HH2 ARG 283 2HH1 ARG 17 2.052 -7.632 7.462 153 2HH2 ARG 283 1HH1 ARG 17 1.599 -5.894 7.021 154 H GLU 284 H GLU 18 -0.404 -8.823 0.852 155 HA GLU 284 HA GLU 18 -2.244 -11.106 0.656 156 1HB GLU 284 1HB GLU 18 -1.653 -8.548 -0.821 157 2HB GLU 284 2HB GLU 18 -2.263 -9.799 -1.876 158 1HG GLU 284 1HG GLU 18 -3.785 -9.002 0.702 159 2HG GLU 284 2HG GLU 18 -3.978 -8.089 -0.773 160 H PHE 285 H PHE 19 0.799 -10.338 -0.764 161 HA PHE 285 HA PHE 19 0.944 -12.211 -2.974 162 1HB PHE 285 1HB PHE 19 2.739 -10.491 -1.689 163 2HB PHE 285 2HB PHE 19 3.350 -12.029 -1.148 164 HD1 PHE 285 HD1 PHE 19 2.674 -9.980 -4.198 165 HD2 PHE 285 HD2 PHE 19 4.577 -13.518 -2.674 166 HE1 PHE 285 HE1 PHE 19 3.930 -10.210 -6.302 167 HE2 PHE 285 HE2 PHE 19 5.830 -13.744 -4.785 168 HZ PHE 285 HZ PHE 19 5.513 -12.090 -6.601 169 H ILE 286 H ILE 20 2.803 -12.994 -0.255 170 HA ILE 286 HA ILE 20 2.514 -15.860 -0.657 171 HB ILE 286 HB ILE 20 3.262 -14.939 2.109 172 1HG1 ILE 286 2HG1 ILE 20 4.821 -13.847 -0.287 173 2HG1 ILE 286 1HG1 ILE 20 4.189 -12.948 1.076 174 1HG2 ILE 286 2HG2 ILE 20 3.834 -17.306 1.343 175 2HG2 ILE 286 3HG2 ILE 20 4.845 -16.645 0.036 176 3HG2 ILE 286 1HG2 ILE 20 5.291 -16.433 1.743 177 1HD1 ILE 286 2HD1 ILE 20 5.965 -14.198 2.549 178 2HD1 ILE 286 3HD1 ILE 20 6.601 -14.926 1.051 179 3HD1 ILE 286 1HD1 ILE 20 6.653 -13.169 1.271 180 H GLY 287 H GLY 21 0.423 -13.670 0.881 181 1HA GLY 287 1HA GLY 21 -0.869 -15.604 2.722 182 2HA GLY 287 2HA GLY 21 -1.598 -14.098 2.124 183 H SER 288 H SER 22 -1.295 -14.611 -0.596 184 HA SER 288 HA SER 22 -3.255 -16.946 -0.955 185 1HB SER 288 1HB SER 22 -4.382 -14.689 -1.196 186 2HB SER 288 2HB SER 22 -3.286 -14.256 -2.496 187 HG SER 288 HG SER 22 -4.192 -15.817 -3.784 188 1HN NH2 289 1HXT SER 22 -2.185 -18.712 -1.802 189 2HN NH2 289 2HXT SER 22 -1.112 -18.601 -3.223 No H/Q in entry = 189 Start of MODEL 2 1 1H ACE 266 1H1 MET 1 -0.941 19.875 0.523 2 2H ACE 266 2H1 MET 1 0.589 19.374 1.284 3 3H ACE 266 3H1 MET 1 0.337 21.075 0.828 4 H VAL 267 H VAL 1 0.929 18.324 -2.339 5 HA VAL 267 HA VAL 1 0.390 17.642 0.538 6 HB VAL 267 HB VAL 1 -1.593 18.542 -1.318 7 1HG1 VAL 267 1HG2 VAL 1 -2.075 15.507 -0.895 8 2HG1 VAL 267 2HG2 VAL 1 -3.271 16.671 -1.518 9 3HG1 VAL 267 3HG2 VAL 1 -1.831 16.323 -2.457 10 1HG2 VAL 267 2HG1 VAL 1 -1.796 18.696 1.204 11 2HG2 VAL 267 3HG1 VAL 1 -3.271 18.073 0.458 12 3HG2 VAL 267 1HG1 VAL 1 -2.157 16.955 1.286 13 H GLU 268 H GLU 2 1.119 15.851 1.103 14 HA GLU 268 HA GLU 2 1.228 13.614 -0.996 15 1HB GLU 268 2HB GLU 2 3.444 13.022 0.477 16 2HB GLU 268 1HB GLU 2 3.501 14.020 -0.956 17 1HG GLU 268 1HG GLU 2 3.681 16.099 0.331 18 2HG GLU 268 2HG GLU 2 3.191 15.336 1.823 19 H GLU 269 H GLU 3 -0.894 13.705 0.504 20 HA GLU 269 HA GLU 3 -0.377 11.711 2.722 21 1HB GLU 269 1HB GLU 3 -2.952 13.263 2.076 22 2HB GLU 269 2HB GLU 3 -2.620 12.415 3.567 23 1HG GLU 269 2HG GLU 3 -0.577 14.542 3.145 24 2HG GLU 269 1HG GLU 3 -2.176 15.215 2.955 25 H LYS 270 H LYS 4 -2.243 12.465 0.016 26 HA LYS 270 HA LYS 4 -3.746 9.917 -0.178 27 1HB LYS 270 1HB LYS 4 -3.034 12.124 -2.217 28 2HB LYS 270 2HB LYS 4 -3.886 10.678 -2.743 29 1HG LYS 270 1HG LYS 4 -5.372 11.499 -0.438 30 2HG LYS 270 2HG LYS 4 -4.887 13.029 -1.164 31 1HD LYS 270 1HD LYS 4 -5.825 11.641 -3.395 32 2HD LYS 270 2HD LYS 4 -6.793 10.885 -2.114 33 1HE LYS 270 1HE LYS 4 -6.508 13.961 -2.406 34 2HE LYS 270 2HE LYS 4 -7.848 13.051 -3.119 35 1HZ LYS 270 1HZ LYS 4 -7.213 12.651 -0.267 36 2HZ LYS 270 2HZ LYS 4 -8.073 14.013 -0.751 37 3HZ LYS 270 3HZ LYS 4 -8.679 12.478 -1.074 38 H SER 271 H SER 5 -0.674 11.027 -1.367 39 HA SER 271 HA SER 5 -0.071 8.764 -3.089 40 1HB SER 271 2HB SER 5 1.513 10.955 -1.782 41 2HB SER 271 1HB SER 5 2.431 9.470 -1.968 42 HG SER 271 HG SER 5 0.914 10.262 -4.184 43 H ILE 272 H ILE 6 0.428 9.204 0.371 44 HA ILE 272 HA ILE 6 1.744 6.595 0.698 45 HB ILE 272 HB ILE 6 0.102 8.098 2.801 46 1HG1 ILE 272 2HG1 ILE 6 2.362 9.244 1.603 47 2HG1 ILE 272 1HG1 ILE 6 1.738 9.678 3.183 48 1HG2 ILE 272 2HG2 ILE 6 0.729 5.755 3.563 49 2HG2 ILE 272 3HG2 ILE 6 2.445 6.079 3.217 50 3HG2 ILE 272 1HG2 ILE 6 1.591 6.929 4.523 51 1HD1 ILE 272 2HD1 ILE 6 3.412 7.937 4.181 52 2HD1 ILE 272 3HD1 ILE 6 4.048 7.691 2.534 53 3HD1 ILE 272 1HD1 ILE 6 4.181 9.281 3.304 54 H ASP 273 H ASP 7 -1.405 7.420 0.199 55 HA ASP 273 HA ASP 7 -2.533 4.987 1.500 56 1HB ASP 273 1HB ASP 7 -3.622 7.387 0.020 57 2HB ASP 273 2HB ASP 7 -4.390 5.930 -0.570 58 H LEU 274 H LEU 8 -1.273 5.809 -1.464 59 HA LEU 274 HA LEU 8 -2.095 3.130 -2.632 60 1HB LEU 274 2HB LEU 8 -2.055 5.363 -4.049 61 2HB LEU 274 1HB LEU 8 -0.298 5.218 -3.985 62 HG LEU 274 HG LEU 8 -1.570 2.686 -4.943 63 1HD1 LEU 274 3HD2 LEU 8 -3.234 4.422 -5.888 64 2HD1 LEU 274 1HD2 LEU 8 -1.904 5.163 -6.783 65 3HD1 LEU 274 2HD2 LEU 8 -2.381 3.479 -7.135 66 1HD2 LEU 274 2HD1 LEU 8 0.901 3.301 -5.096 67 2HD2 LEU 274 3HD1 LEU 8 0.204 2.887 -6.682 68 3HD2 LEU 274 1HD1 LEU 8 0.501 4.588 -6.248 69 H ILE 275 H ILE 9 0.486 4.540 -1.114 70 HA ILE 275 HA ILE 9 2.240 2.173 -1.948 71 HB ILE 275 HB ILE 9 3.373 4.615 -0.508 72 1HG1 ILE 275 2HG1 ILE 9 2.268 4.642 -3.257 73 2HG1 ILE 275 1HG1 ILE 9 2.894 5.971 -2.308 74 1HG2 ILE 275 2HG2 ILE 9 4.958 2.656 -0.684 75 2HG2 ILE 275 3HG2 ILE 9 4.727 2.602 -2.448 76 3HG2 ILE 275 1HG2 ILE 9 5.538 3.976 -1.666 77 1HD1 ILE 275 2HD1 ILE 9 5.283 5.259 -3.135 78 2HD1 ILE 275 3HD1 ILE 9 4.492 4.026 -4.151 79 3HD1 ILE 275 1HD1 ILE 9 4.166 5.745 -4.431 80 H GLN 276 H GLN 10 0.194 3.019 0.302 81 HA GLN 276 HA GLN 10 1.536 1.303 2.443 82 1HB GLN 276 1HB GLN 10 -0.949 3.134 2.472 83 2HB GLN 276 2HB GLN 10 -0.636 1.974 3.761 84 1HG GLN 276 2HG GLN 10 1.452 4.171 3.046 85 2HG GLN 276 1HG GLN 10 0.069 4.539 4.038 86 1HE2 GLN 276 2HE2 GLN 10 2.819 2.259 5.989 87 2HE2 GLN 276 1HE2 GLN 10 2.474 1.863 4.219 88 H LYS 277 H LYS 11 -1.168 1.706 0.243 89 HA LYS 277 HA LYS 11 -2.420 -0.856 0.828 90 1HB LYS 277 1HB LYS 11 -2.132 0.930 -1.712 91 2HB LYS 277 2HB LYS 11 -2.880 -0.648 -1.909 92 1HG LYS 277 2HG LYS 11 -4.771 -0.043 -0.442 93 2HG LYS 277 1HG LYS 11 -3.953 1.392 0.170 94 1HD LYS 277 1HD LYS 11 -4.688 2.719 -1.463 95 2HD LYS 277 2HD LYS 11 -4.166 1.603 -2.740 96 1HE LYS 277 1HE LYS 11 -6.636 1.745 -2.864 97 2HE LYS 277 2HE LYS 11 -6.226 0.127 -2.274 98 1HZ LYS 277 1HZ LYS 11 -6.329 1.448 0.034 99 2HZ LYS 277 2HZ LYS 11 -7.444 2.348 -0.847 100 3HZ LYS 277 3HZ LYS 11 -7.658 0.690 -0.664 101 H TRP 278 H TRP 12 0.416 -0.051 -0.701 102 HA TRP 278 HA TRP 12 0.857 -2.725 -1.959 103 1HB TRP 278 1HB TRP 12 2.573 -0.179 -1.405 104 2HB TRP 278 2HB TRP 12 3.392 -1.619 -1.966 105 HD1 TRP 278 HD1 TRP 12 -0.087 -0.473 -3.367 106 HE1 TRP 278 HE1 TRP 12 0.111 0.128 -5.951 107 HE3 TRP 278 HE3 TRP 12 4.977 -0.967 -3.684 108 HZ2 TRP 278 HZ2 TRP 12 2.320 0.297 -7.731 109 HZ3 TRP 278 HZ3 TRP 12 6.097 -0.547 -5.851 110 HH2 TRP 278 HH2 TRP 12 4.791 0.074 -7.849 111 H GLU 279 H GLU 13 1.500 -1.296 1.002 112 HA GLU 279 HA GLU 13 3.324 -3.442 1.967 113 1HB GLU 279 2HB GLU 13 2.263 -0.787 2.771 114 2HB GLU 279 1HB GLU 13 1.743 -1.881 4.010 115 1HG GLU 279 1HG GLU 13 4.773 -1.502 3.335 116 2HG GLU 279 2HG GLU 13 3.887 -0.393 4.340 117 H GLU 280 H GLU 14 0.097 -3.145 1.497 118 HA GLU 280 HA GLU 14 -0.547 -5.577 3.227 119 1HB GLU 280 1HB GLU 14 -2.196 -3.390 1.855 120 2HB GLU 280 2HB GLU 14 -2.953 -4.938 2.138 121 1HG GLU 280 1HG GLU 14 -1.851 -4.297 4.699 122 2HG GLU 280 2HG GLU 14 -2.331 -2.733 4.090 123 H LYS 281 H LYS 15 -0.060 -4.334 0.082 124 HA LYS 281 HA LYS 15 -1.024 -6.564 -1.542 125 1HB LYS 281 1HB LYS 15 -0.292 -4.331 -2.494 126 2HB LYS 281 2HB LYS 15 1.358 -4.606 -1.953 127 1HG LYS 281 1HG LYS 15 1.819 -6.170 -3.701 128 2HG LYS 281 2HG LYS 15 0.148 -6.718 -3.811 129 1HD LYS 281 1HD LYS 15 0.892 -3.861 -4.629 130 2HD LYS 281 2HD LYS 15 1.311 -5.208 -5.705 131 1HE LYS 281 1HE LYS 15 -1.063 -5.991 -5.784 132 2HE LYS 281 2HE LYS 15 -1.555 -4.797 -4.573 133 1HZ LYS 281 1HZ LYS 15 -0.773 -3.039 -6.111 134 2HZ LYS 281 2HZ LYS 15 -0.478 -4.210 -7.282 135 3HZ LYS 281 3HZ LYS 15 -2.044 -3.953 -6.725 136 H SER 282 H SER 16 1.937 -5.871 0.156 137 HA SER 282 HA SER 16 3.487 -8.162 -0.780 138 1HB SER 282 1HB SER 16 3.917 -6.009 0.973 139 2HB SER 282 2HB SER 16 3.836 -7.345 2.095 140 HG SER 282 HG SER 16 5.448 -7.898 -0.110 141 H ARG 283 H ARG 17 1.431 -7.629 1.839 142 HA ARG 283 HA ARG 17 1.548 -10.407 2.912 143 1HB ARG 283 1HB ARG 17 0.844 -8.762 4.495 144 2HB ARG 283 2HB ARG 17 -0.218 -7.959 3.356 145 1HG ARG 283 1HG ARG 17 -2.045 -9.470 3.821 146 2HG ARG 283 2HG ARG 17 -0.973 -10.809 4.217 147 1HD ARG 283 1HD ARG 17 -0.592 -10.021 6.440 148 2HD ARG 283 2HD ARG 17 -0.956 -8.328 6.016 149 HE ARG 283 HE ARG 17 -3.297 -10.018 5.511 150 1HH1 ARG 283 2HH2 ARG 17 -1.578 -8.539 8.139 151 2HH1 ARG 283 1HH2 ARG 17 -3.082 -8.506 9.209 152 1HH2 ARG 283 2HH1 ARG 17 -4.880 -9.948 6.724 153 2HH2 ARG 283 1HH1 ARG 17 -4.880 -9.271 8.446 154 H GLU 284 H GLU 18 -0.228 -8.910 0.376 155 HA GLU 284 HA GLU 18 -2.297 -11.027 0.149 156 1HB GLU 284 1HB GLU 18 -1.242 -8.707 -1.504 157 2HB GLU 284 2HB GLU 18 -1.995 -9.983 -2.429 158 1HG GLU 284 1HG GLU 18 -3.602 -8.921 -0.054 159 2HG GLU 284 2HG GLU 18 -3.370 -7.809 -1.379 160 H PHE 285 H PHE 19 0.952 -10.550 -0.968 161 HA PHE 285 HA PHE 19 1.076 -12.844 -2.839 162 1HB PHE 285 1HB PHE 19 2.837 -10.789 -1.998 163 2HB PHE 285 2HB PHE 19 3.555 -12.209 -1.290 164 HD1 PHE 285 HD2 PHE 19 4.458 -14.061 -2.765 165 HD2 PHE 285 HD1 PHE 19 2.780 -10.483 -4.452 166 HE1 PHE 285 HE2 PHE 19 5.504 -14.584 -4.935 167 HE2 PHE 285 HE1 PHE 19 3.837 -11.004 -6.609 168 HZ PHE 285 HZ PHE 19 5.197 -13.057 -6.861 169 H ILE 286 H ILE 20 3.014 -12.802 -0.069 170 HA ILE 286 HA ILE 20 2.976 -15.648 0.348 171 HB ILE 286 HB ILE 20 3.436 -13.909 2.771 172 1HG1 ILE 286 2HG1 ILE 20 5.144 -13.524 0.256 173 2HG1 ILE 286 1HG1 ILE 20 4.344 -12.269 1.175 174 1HG2 ILE 286 2HG2 ILE 20 4.183 -16.345 2.812 175 2HG2 ILE 286 3HG2 ILE 20 5.254 -16.048 1.421 176 3HG2 ILE 286 1HG2 ILE 20 5.559 -15.290 2.999 177 1HD1 ILE 286 2HD1 ILE 20 6.014 -12.833 3.125 178 2HD1 ILE 286 3HD1 ILE 20 6.831 -13.953 2.004 179 3HD1 ILE 286 1HD1 ILE 20 6.770 -12.221 1.636 180 H GLY 287 H GLY 21 0.557 -13.402 1.152 181 1HA GLY 287 1HA GLY 21 -0.642 -15.105 3.322 182 2HA GLY 287 2HA GLY 21 -1.412 -13.707 2.544 183 H SER 288 H SER 22 -1.181 -14.407 -0.071 184 HA SER 288 HA SER 22 -2.127 -15.773 -1.772 185 1HB SER 288 1HB SER 22 -1.840 -18.024 -1.575 186 2HB SER 288 2HB SER 22 -1.246 -17.748 0.055 187 HG SER 288 HG SER 22 -3.848 -18.485 -0.812 188 1HN NH2 289 1HXT SER 22 -4.157 -15.944 -2.842 189 2HN NH2 289 2HXT SER 22 -5.677 -15.607 -1.970 No H/Q in entry = 189 Start of MODEL 3 1 1H ACE 266 1H1 MET 1 1.525 19.162 0.531 2 2H ACE 266 2H1 MET 1 2.610 18.975 1.925 3 3H ACE 266 3H1 MET 1 1.911 17.539 1.150 4 H VAL 267 H VAL 1 -1.405 17.983 2.814 5 HA VAL 267 HA VAL 1 -1.827 16.923 0.683 6 HB VAL 267 HB VAL 1 0.640 18.008 -0.664 7 1HG1 VAL 267 2HG1 VAL 1 -1.230 16.717 -1.869 8 2HG1 VAL 267 3HG1 VAL 1 -2.294 18.107 -1.632 9 3HG1 VAL 267 1HG1 VAL 1 -0.822 18.276 -2.623 10 1HG2 VAL 267 3HG2 VAL 1 -0.211 20.133 0.647 11 2HG2 VAL 267 1HG2 VAL 1 -0.108 20.300 -1.122 12 3HG2 VAL 267 2HG2 VAL 1 -1.676 20.044 -0.315 13 H GLU 268 H GLU 2 -0.259 15.754 -0.989 14 HA GLU 268 HA GLU 2 1.102 13.801 -1.186 15 1HB GLU 268 2HB GLU 2 2.788 14.639 1.202 16 2HB GLU 268 1HB GLU 2 3.303 13.925 -0.306 17 1HG GLU 268 2HG GLU 2 3.483 15.995 -1.444 18 2HG GLU 268 1HG GLU 2 2.184 16.744 -0.551 19 H GLU 269 H GLU 3 -1.225 13.806 0.441 20 HA GLU 269 HA GLU 3 -0.470 11.770 2.551 21 1HB GLU 269 1HB GLU 3 -3.226 13.041 2.004 22 2HB GLU 269 2HB GLU 3 -2.745 12.232 3.476 23 1HG GLU 269 2HG GLU 3 -0.945 14.532 3.111 24 2HG GLU 269 1HG GLU 3 -2.568 15.084 2.785 25 H LYS 270 H LYS 4 -2.306 12.388 -0.196 26 HA LYS 270 HA LYS 4 -3.704 9.789 -0.409 27 1HB LYS 270 1HB LYS 4 -2.916 11.942 -2.476 28 2HB LYS 270 2HB LYS 4 -3.675 10.449 -3.009 29 1HG LYS 270 1HG LYS 4 -5.291 11.408 -0.784 30 2HG LYS 270 2HG LYS 4 -4.901 12.832 -1.746 31 1HD LYS 270 1HD LYS 4 -6.766 12.190 -2.935 32 2HD LYS 270 2HD LYS 4 -5.681 11.032 -3.730 33 1HE LYS 270 1HE LYS 4 -7.022 10.298 -1.047 34 2HE LYS 270 2HE LYS 4 -7.902 10.076 -2.567 35 1HZ LYS 270 2HZ LYS 4 -5.705 8.936 -3.320 36 2HZ LYS 270 3HZ LYS 4 -5.428 8.763 -1.671 37 3HZ LYS 270 1HZ LYS 4 -6.809 8.100 -2.366 38 H SER 271 H SER 5 -0.584 10.939 -1.462 39 HA SER 271 HA SER 5 0.133 8.557 -3.005 40 1HB SER 271 1HB SER 5 1.395 11.018 -2.350 41 2HB SER 271 2HB SER 5 2.456 9.833 -1.605 42 HG SER 271 HG SER 5 1.671 10.071 -4.330 43 H ILE 272 H ILE 6 0.376 9.338 0.399 44 HA ILE 272 HA ILE 6 1.917 6.920 1.057 45 HB ILE 272 HB ILE 6 -0.056 8.309 2.948 46 1HG1 ILE 272 2HG1 ILE 6 1.832 9.852 1.636 47 2HG1 ILE 272 1HG1 ILE 6 1.166 10.243 3.207 48 1HG2 ILE 272 2HG2 ILE 6 1.076 6.272 3.960 49 2HG2 ILE 272 3HG2 ILE 6 2.678 6.954 3.589 50 3HG2 ILE 272 1HG2 ILE 6 1.609 7.712 4.789 51 1HD1 ILE 272 2HD1 ILE 6 3.250 9.044 4.244 52 2HD1 ILE 272 3HD1 ILE 6 3.878 8.834 2.589 53 3HD1 ILE 272 1HD1 ILE 6 3.639 10.463 3.244 54 H ASP 273 H ASP 7 -1.242 7.400 0.260 55 HA ASP 273 HA ASP 7 -2.120 4.783 1.458 56 1HB ASP 273 1HB ASP 7 -3.492 7.245 0.375 57 2HB ASP 273 2HB ASP 7 -4.152 5.820 -0.396 58 H LEU 274 H LEU 8 -1.073 6.112 -1.400 59 HA LEU 274 HA LEU 8 -1.797 3.683 -3.018 60 1HB LEU 274 2HB LEU 8 -1.440 6.211 -3.885 61 2HB LEU 274 1HB LEU 8 0.274 5.832 -3.790 62 HG LEU 274 HG LEU 8 -0.898 5.690 -6.112 63 1HD1 LEU 274 3HD2 LEU 8 1.434 4.729 -5.577 64 2HD1 LEU 274 1HD2 LEU 8 0.680 3.161 -5.272 65 3HD1 LEU 274 2HD2 LEU 8 0.592 3.887 -6.901 66 1HD2 LEU 274 2HD1 LEU 8 -2.896 4.343 -5.295 67 2HD2 LEU 274 3HD1 LEU 8 -2.068 3.559 -6.662 68 3HD2 LEU 274 1HD1 LEU 8 -1.828 2.958 -5.004 69 H ILE 275 H ILE 9 0.675 4.578 -1.035 70 HA ILE 275 HA ILE 9 2.200 2.093 -1.955 71 HB ILE 275 HB ILE 9 3.609 4.339 -0.452 72 1HG1 ILE 275 2HG1 ILE 9 2.462 4.633 -3.176 73 2HG1 ILE 275 1HG1 ILE 9 3.228 5.833 -2.162 74 1HG2 ILE 275 2HG2 ILE 9 4.959 2.229 -0.770 75 2HG2 ILE 275 3HG2 ILE 9 4.689 2.297 -2.529 76 3HG2 ILE 275 1HG2 ILE 9 5.665 3.528 -1.698 77 1HD1 ILE 275 2HD1 ILE 9 5.527 4.938 -3.074 78 2HD1 ILE 275 3HD1 ILE 9 4.604 3.849 -4.141 79 3HD1 ILE 275 1HD1 ILE 9 4.447 5.604 -4.321 80 H GLN 276 H GLN 10 0.156 2.968 0.231 81 HA GLN 276 HA GLN 10 1.437 1.261 2.420 82 1HB GLN 276 1HB GLN 10 -0.631 3.468 2.398 83 2HB GLN 276 2HB GLN 10 -1.017 2.109 3.451 84 1HG GLN 276 2HG GLN 10 1.795 3.021 3.838 85 2HG GLN 276 1HG GLN 10 0.669 4.370 3.972 86 1HE2 GLN 276 2HE2 GLN 10 0.695 3.103 7.522 87 2HE2 GLN 276 1HE2 GLN 10 1.880 3.979 6.426 88 H LYS 277 H LYS 11 -1.300 1.757 0.313 89 HA LYS 277 HA LYS 11 -2.558 -0.825 0.825 90 1HB LYS 277 1HB LYS 11 -2.331 1.167 -1.586 91 2HB LYS 277 2HB LYS 11 -2.942 -0.429 -1.995 92 1HG LYS 277 1HG LYS 11 -4.952 0.051 -0.265 93 2HG LYS 277 2HG LYS 11 -4.311 1.689 -0.165 94 1HD LYS 277 1HD LYS 11 -5.708 2.077 -1.924 95 2HD LYS 277 2HD LYS 11 -4.491 1.276 -2.937 96 1HE LYS 277 1HE LYS 11 -6.656 0.120 -3.331 97 2HE LYS 277 2HE LYS 11 -5.596 -0.997 -2.457 98 1HZ LYS 277 1HZ LYS 11 -7.094 0.729 -0.699 99 2HZ LYS 277 2HZ LYS 11 -8.066 -0.249 -1.662 100 3HZ LYS 277 3HZ LYS 11 -6.897 -0.941 -0.671 101 H TRP 278 H TRP 12 0.271 -0.012 -0.648 102 HA TRP 278 HA TRP 12 0.622 -2.640 -2.048 103 1HB TRP 278 1HB TRP 12 2.427 -0.167 -1.419 104 2HB TRP 278 2HB TRP 12 3.165 -1.597 -2.105 105 HD1 TRP 278 HD1 TRP 12 -0.346 -0.431 -3.345 106 HE1 TRP 278 HE1 TRP 12 -0.239 0.184 -5.930 107 HE3 TRP 278 HE3 TRP 12 4.716 -0.814 -3.816 108 HZ2 TRP 278 HZ2 TRP 12 1.912 0.427 -7.770 109 HZ3 TRP 278 HZ3 TRP 12 5.757 -0.386 -6.020 110 HH2 TRP 278 HH2 TRP 12 4.380 0.228 -7.971 111 H GLU 279 H GLU 13 1.358 -1.301 0.937 112 HA GLU 279 HA GLU 13 3.128 -3.534 1.812 113 1HB GLU 279 2HB GLU 13 2.199 -0.843 2.687 114 2HB GLU 279 1HB GLU 13 1.690 -1.939 3.929 115 1HG GLU 279 2HG GLU 13 4.708 -1.669 3.141 116 2HG GLU 279 1HG GLU 13 3.900 -0.530 4.178 117 H GLU 280 H GLU 14 -0.098 -3.080 1.463 118 HA GLU 280 HA GLU 14 -0.821 -5.467 3.224 119 1HB GLU 280 1HB GLU 14 -2.701 -4.213 3.573 120 2HB GLU 280 2HB GLU 14 -2.147 -2.996 2.448 121 1HG GLU 280 1HG GLU 14 -4.086 -3.476 1.297 122 2HG GLU 280 2HG GLU 14 -3.216 -4.826 0.616 123 H LYS 281 H LYS 15 -0.514 -4.197 0.039 124 HA LYS 281 HA LYS 15 -1.600 -6.360 -1.575 125 1HB LYS 281 1HB LYS 15 -0.865 -4.220 -2.612 126 2HB LYS 281 2HB LYS 15 0.771 -4.403 -1.997 127 1HG LYS 281 1HG LYS 15 1.018 -6.511 -3.518 128 2HG LYS 281 2HG LYS 15 -0.574 -6.151 -4.182 129 1HD LYS 281 1HD LYS 15 0.702 -5.042 -5.761 130 2HD LYS 281 2HD LYS 15 0.691 -3.719 -4.579 131 1HE LYS 281 1HE LYS 15 2.982 -3.893 -4.362 132 2HE LYS 281 2HE LYS 15 2.782 -5.510 -3.671 133 1HZ LYS 281 3HZ LYS 15 2.583 -5.204 -6.592 134 2HZ LYS 281 1HZ LYS 15 4.099 -5.178 -5.865 135 3HZ LYS 281 2HZ LYS 15 3.101 -6.520 -5.682 136 H SER 282 H SER 16 1.479 -5.806 -0.035 137 HA SER 282 HA SER 16 2.837 -8.191 -1.067 138 1HB SER 282 2HB SER 16 3.547 -6.016 0.616 139 2HB SER 282 1HB SER 16 3.473 -7.350 1.740 140 HG SER 282 HG SER 16 4.851 -8.305 -0.314 141 H ARG 283 H ARG 17 1.065 -7.497 1.719 142 HA ARG 283 HA ARG 17 1.253 -10.252 2.856 143 1HB ARG 283 2HB ARG 17 0.610 -7.850 3.964 144 2HB ARG 283 1HB ARG 17 -1.030 -8.330 3.571 145 1HG ARG 283 1HG ARG 17 -1.159 -9.951 5.258 146 2HG ARG 283 2HG ARG 17 0.512 -10.464 5.050 147 1HD ARG 283 1HD ARG 17 1.359 -8.711 6.462 148 2HD ARG 283 2HD ARG 17 -0.089 -7.693 6.237 149 HE ARG 283 HE ARG 17 -0.553 -10.383 7.496 150 1HH1 ARG 283 2HH2 ARG 17 -0.115 -6.987 8.065 151 2HH1 ARG 283 1HH2 ARG 17 -0.855 -7.094 9.753 152 1HH2 ARG 283 2HH1 ARG 17 -1.344 -10.420 9.328 153 2HH2 ARG 283 1HH1 ARG 17 -1.525 -8.957 10.445 154 H GLU 284 H GLU 18 -0.651 -8.946 0.374 155 HA GLU 284 HA GLU 18 -2.930 -10.880 0.685 156 1HB GLU 284 1HB GLU 18 -3.615 -9.043 -0.598 157 2HB GLU 284 2HB GLU 18 -2.005 -8.707 -1.185 158 1HG GLU 284 1HG GLU 18 -2.638 -9.517 -3.237 159 2HG GLU 284 2HG GLU 18 -2.707 -11.126 -2.566 160 H PHE 285 H PHE 19 -0.190 -10.429 -1.460 161 HA PHE 285 HA PHE 19 -0.189 -12.947 -2.860 162 1HB PHE 285 1HB PHE 19 1.574 -10.739 -2.609 163 2HB PHE 285 2HB PHE 19 2.508 -12.036 -1.919 164 HD1 PHE 285 HD1 PHE 19 0.165 -11.997 -4.905 165 HD2 PHE 285 HD2 PHE 19 4.141 -12.746 -3.455 166 HE1 PHE 285 HE1 PHE 19 0.856 -12.698 -7.159 167 HE2 PHE 285 HE2 PHE 19 4.821 -13.463 -5.712 168 HZ PHE 285 HZ PHE 19 3.186 -13.423 -7.576 169 H ILE 286 H ILE 20 2.181 -12.432 -0.488 170 HA ILE 286 HA ILE 20 2.457 -15.275 0.123 171 HB ILE 286 HB ILE 20 3.448 -13.315 2.178 172 1HG1 ILE 286 1HG1 ILE 20 4.189 -12.888 -0.750 173 2HG1 ILE 286 2HG1 ILE 20 3.817 -11.694 0.473 174 1HG2 ILE 286 2HG2 ILE 20 4.373 -15.689 2.121 175 2HG2 ILE 286 3HG2 ILE 20 4.984 -15.419 0.471 176 3HG2 ILE 286 1HG2 ILE 20 5.657 -14.537 1.859 177 1HD1 ILE 286 2HD1 ILE 20 6.004 -12.134 1.672 178 2HD1 ILE 286 3HD1 ILE 20 6.470 -13.255 0.367 179 3HD1 ILE 286 1HD1 ILE 20 6.201 -11.542 0.007 180 H GLY 287 H GLY 21 0.320 -12.902 1.352 181 1HA GLY 287 1HA GLY 21 -0.287 -14.214 3.925 182 2HA GLY 287 2HA GLY 21 -1.382 -13.131 3.041 183 H SER 288 H SER 22 -1.392 -14.575 0.639 184 HA SER 288 HA SER 22 -2.363 -17.335 1.157 185 1HB SER 288 1HB SER 22 -4.742 -17.081 0.851 186 2HB SER 288 2HB SER 22 -4.317 -15.912 2.091 187 HG SER 288 HG SER 22 -5.552 -14.813 0.674 188 1HN NH2 289 1HXT SER 22 -1.577 -18.508 -0.551 189 2HN NH2 289 2HXT SER 22 -1.644 -17.943 -2.242 No H/Q in entry = 189 Start of MODEL 4 1 1H ACE 266 1H1 MET 1 4.473 17.895 -0.020 2 2H ACE 266 2H1 MET 1 2.993 17.452 -0.905 3 3H ACE 266 3H1 MET 1 3.984 18.822 -1.458 4 H VAL 267 H VAL 1 1.847 19.432 2.150 5 HA VAL 267 HA VAL 1 3.503 17.199 1.565 6 HB VAL 267 HB VAL 1 2.011 17.986 3.807 7 1HG1 VAL 267 2HG1 VAL 1 -0.049 16.694 2.929 8 2HG1 VAL 267 3HG1 VAL 1 0.866 15.195 3.123 9 3HG1 VAL 267 1HG1 VAL 1 0.494 16.197 4.549 10 1HG2 VAL 267 3HG2 VAL 1 4.218 16.572 3.835 11 2HG2 VAL 267 1HG2 VAL 1 3.048 16.223 5.130 12 3HG2 VAL 267 2HG2 VAL 1 3.212 15.139 3.726 13 H GLU 268 H GLU 2 2.631 14.876 1.762 14 HA GLU 268 HA GLU 2 0.485 14.580 -0.414 15 1HB GLU 268 2HB GLU 2 2.978 12.806 -0.145 16 2HB GLU 268 1HB GLU 2 1.805 12.763 -1.439 17 1HG GLU 268 1HG GLU 2 3.727 15.143 -0.945 18 2HG GLU 268 2HG GLU 2 4.025 13.868 -2.099 19 H GLU 269 H GLU 3 -1.198 13.693 0.395 20 HA GLU 269 HA GLU 3 -0.833 11.560 2.513 21 1HB GLU 269 1HB GLU 3 -3.335 13.178 1.785 22 2HB GLU 269 2HB GLU 3 -3.155 12.174 3.203 23 1HG GLU 269 1HG GLU 3 -1.089 14.350 3.108 24 2HG GLU 269 2HG GLU 3 -2.705 15.002 3.015 25 H LYS 270 H LYS 4 -2.681 12.520 -0.155 26 HA LYS 270 HA LYS 4 -4.179 10.059 -0.658 27 1HB LYS 270 1HB LYS 4 -3.138 12.220 -2.625 28 2HB LYS 270 2HB LYS 4 -4.270 10.961 -3.097 29 1HG LYS 270 1HG LYS 4 -6.064 11.893 -1.789 30 2HG LYS 270 2HG LYS 4 -4.970 12.681 -0.655 31 1HD LYS 270 1HD LYS 4 -4.995 14.613 -1.907 32 2HD LYS 270 2HD LYS 4 -4.681 13.744 -3.423 33 1HE LYS 270 1HE LYS 4 -7.004 14.865 -3.354 34 2HE LYS 270 2HE LYS 4 -7.063 13.129 -3.699 35 1HZ LYS 270 2HZ LYS 4 -7.138 13.954 -0.883 36 2HZ LYS 270 3HZ LYS 4 -8.516 14.185 -1.819 37 3HZ LYS 270 1HZ LYS 4 -7.866 12.643 -1.644 38 H SER 271 H SER 5 -0.987 11.097 -1.659 39 HA SER 271 HA SER 5 -0.530 8.787 -3.427 40 1HB SER 271 2HB SER 5 1.236 10.952 -2.215 41 2HB SER 271 1HB SER 5 2.037 9.498 -2.798 42 HG SER 271 HG SER 5 0.236 11.105 -4.325 43 H ILE 272 H ILE 6 -0.037 9.389 -0.027 44 HA ILE 272 HA ILE 6 1.509 6.916 0.401 45 HB ILE 272 HB ILE 6 -0.284 8.227 2.515 46 1HG1 ILE 272 2HG1 ILE 6 1.594 9.786 1.091 47 2HG1 ILE 272 1HG1 ILE 6 0.853 10.205 2.619 48 1HG2 ILE 272 2HG2 ILE 6 0.961 6.164 3.325 49 2HG2 ILE 272 3HG2 ILE 6 2.514 6.891 2.845 50 3HG2 ILE 272 1HG2 ILE 6 1.546 7.574 4.170 51 1HD1 ILE 272 2HD1 ILE 6 2.911 9.070 3.777 52 2HD1 ILE 272 3HD1 ILE 6 3.613 8.828 2.157 53 3HD1 ILE 272 1HD1 ILE 6 3.319 10.469 2.758 54 H ASP 273 H ASP 7 -1.687 7.500 -0.124 55 HA ASP 273 HA ASP 7 -2.607 4.935 1.119 56 1HB ASP 273 1HB ASP 7 -3.905 7.393 -0.028 57 2HB ASP 273 2HB ASP 7 -4.597 5.981 -0.794 58 H LEU 274 H LEU 8 -1.545 6.101 -1.807 59 HA LEU 274 HA LEU 8 -2.323 3.588 -3.276 60 1HB LEU 274 2HB LEU 8 -1.964 6.083 -4.275 61 2HB LEU 274 1HB LEU 8 -0.261 5.651 -4.259 62 HG LEU 274 HG LEU 8 -1.409 5.436 -6.510 63 1HD1 LEU 274 2HD1 LEU 8 0.742 4.244 -6.006 64 2HD1 LEU 274 3HD1 LEU 8 -0.157 2.830 -5.402 65 3HD1 LEU 274 1HD1 LEU 8 -0.266 3.298 -7.116 66 1HD2 LEU 274 2HD2 LEU 8 -2.835 3.007 -5.210 67 2HD2 LEU 274 3HD2 LEU 8 -3.606 4.473 -5.864 68 3HD2 LEU 274 1HD2 LEU 8 -2.790 3.354 -6.961 69 H ILE 275 H ILE 9 0.196 4.640 -1.423 70 HA ILE 275 HA ILE 9 1.733 2.119 -2.206 71 HB ILE 275 HB ILE 9 3.068 4.456 -0.764 72 1HG1 ILE 275 2HG1 ILE 9 2.021 4.582 -3.533 73 2HG1 ILE 275 1HG1 ILE 9 2.759 5.842 -2.571 74 1HG2 ILE 275 2HG2 ILE 9 4.458 2.351 -0.901 75 2HG2 ILE 275 3HG2 ILE 9 4.260 2.311 -2.670 76 3HG2 ILE 275 1HG2 ILE 9 5.184 3.603 -1.874 77 1HD1 ILE 275 2HD1 ILE 9 5.081 4.897 -3.361 78 2HD1 ILE 275 3HD1 ILE 9 4.190 3.744 -4.387 79 3HD1 ILE 275 1HD1 ILE 9 4.039 5.485 -4.676 80 H GLN 276 H GLN 10 -0.329 3.111 -0.066 81 HA GLN 276 HA GLN 10 0.901 1.467 2.194 82 1HB GLN 276 1HB GLN 10 -1.152 3.680 2.062 83 2HB GLN 276 2HB GLN 10 -1.589 2.353 3.135 84 1HG GLN 276 2HG GLN 10 1.214 3.209 3.619 85 2HG GLN 276 1HG GLN 10 0.137 4.606 3.635 86 1HE2 GLN 276 2HE2 GLN 10 0.016 3.390 7.237 87 2HE2 GLN 276 1HE2 GLN 10 1.211 4.280 6.163 88 H LYS 277 H LYS 11 -1.727 1.831 -0.071 89 HA LYS 277 HA LYS 11 -3.040 -0.704 0.594 90 1HB LYS 277 1HB LYS 11 -2.891 1.325 -1.707 91 2HB LYS 277 2HB LYS 11 -2.952 -0.295 -2.386 92 1HG LYS 277 1HG LYS 11 -5.303 0.504 -0.473 93 2HG LYS 277 2HG LYS 11 -5.123 1.309 -2.024 94 1HD LYS 277 1HD LYS 11 -5.168 -0.973 -3.150 95 2HD LYS 277 2HD LYS 11 -5.395 -1.742 -1.567 96 1HE LYS 277 1HE LYS 11 -7.662 -1.415 -2.380 97 2HE LYS 277 2HE LYS 11 -7.435 -0.118 -1.197 98 1HZ LYS 277 2HZ LYS 11 -6.604 0.454 -3.944 99 2HZ LYS 277 3HZ LYS 11 -8.256 0.350 -3.644 100 3HZ LYS 277 1HZ LYS 11 -7.315 1.457 -2.797 101 H TRP 278 H TRP 12 -0.144 0.035 -0.781 102 HA TRP 278 HA TRP 12 0.310 -2.622 -2.085 103 1HB TRP 278 1HB TRP 12 1.974 -0.054 -1.453 104 2HB TRP 278 2HB TRP 12 2.830 -1.472 -2.014 105 HD1 TRP 278 HD1 TRP 12 -0.629 -0.316 -3.465 106 HE1 TRP 278 HE1 TRP 12 -0.418 0.085 -6.086 107 HE3 TRP 278 HE3 TRP 12 4.415 -1.024 -3.755 108 HZ2 TRP 278 HZ2 TRP 12 1.791 0.061 -7.875 109 HZ3 TRP 278 HZ3 TRP 12 5.534 -0.834 -5.954 110 HH2 TRP 278 HH2 TRP 12 4.246 -0.296 -7.986 111 H GLU 279 H GLU 13 0.743 -1.266 0.920 112 HA GLU 279 HA GLU 13 2.627 -3.352 1.941 113 1HB GLU 279 1HB GLU 13 2.898 -1.327 3.087 114 2HB GLU 279 2HB GLU 13 1.250 -0.832 2.830 115 1HG GLU 279 2HG GLU 13 0.786 -1.246 5.033 116 2HG GLU 279 1HG GLU 13 0.851 -2.948 4.680 117 H GLU 280 H GLU 14 -0.576 -3.159 1.281 118 HA GLU 280 HA GLU 14 -1.285 -5.526 3.077 119 1HB GLU 280 1HB GLU 14 -2.795 -3.282 1.736 120 2HB GLU 280 2HB GLU 14 -3.587 -4.833 1.608 121 1HG GLU 280 2HG GLU 14 -2.734 -4.334 4.431 122 2HG GLU 280 1HG GLU 14 -3.665 -2.988 3.827 123 H LYS 281 H LYS 15 -0.855 -4.346 -0.133 124 HA LYS 281 HA LYS 15 -1.606 -6.722 -1.662 125 1HB LYS 281 1HB LYS 15 -1.103 -4.502 -2.741 126 2HB LYS 281 2HB LYS 15 0.551 -4.535 -2.145 127 1HG LYS 281 1HG LYS 15 1.166 -6.376 -3.687 128 2HG LYS 281 2HG LYS 15 -0.521 -6.720 -4.063 129 1HD LYS 281 1HD LYS 15 1.043 -4.157 -4.794 130 2HD LYS 281 2HD LYS 15 0.729 -5.515 -5.892 131 1HE LYS 281 1HE LYS 15 -1.416 -3.705 -4.570 132 2HE LYS 281 2HE LYS 15 -1.018 -3.761 -6.294 133 1HZ LYS 281 2HZ LYS 15 -1.509 -6.377 -5.641 134 2HZ LYS 281 3HZ LYS 15 -2.671 -5.524 -4.776 135 3HZ LYS 281 1HZ LYS 15 -2.552 -5.329 -6.442 136 H SER 282 H SER 16 1.296 -5.687 -0.035 137 HA SER 282 HA SER 16 3.057 -7.834 -0.924 138 1HB SER 282 1HB SER 16 3.284 -5.593 0.762 139 2HB SER 282 2HB SER 16 3.363 -6.897 1.921 140 HG SER 282 HG SER 16 4.994 -7.388 -0.266 141 H ARG 283 H ARG 17 0.981 -7.437 1.704 142 HA ARG 283 HA ARG 17 1.493 -10.126 2.894 143 1HB ARG 283 1HB ARG 17 0.252 -7.814 3.802 144 2HB ARG 283 2HB ARG 17 -1.179 -8.722 3.353 145 1HG ARG 283 1HG ARG 17 -1.014 -10.104 5.247 146 2HG ARG 283 2HG ARG 17 0.717 -10.349 5.035 147 1HD ARG 283 1HD ARG 17 1.250 -8.248 6.186 148 2HD ARG 283 2HD ARG 17 -0.439 -7.686 6.084 149 HE ARG 283 HE ARG 17 -0.423 -10.264 7.414 150 1HH1 ARG 283 2HH2 ARG 17 0.568 -7.002 8.067 151 2HH1 ARG 283 1HH2 ARG 17 0.375 -7.224 9.889 152 1HH2 ARG 283 2HH1 ARG 17 -0.607 -10.430 9.394 153 2HH2 ARG 283 1HH1 ARG 17 -0.264 -9.084 10.617 154 H GLU 284 H GLU 18 -0.582 -8.972 0.390 155 HA GLU 284 HA GLU 18 -2.314 -11.372 0.310 156 1HB GLU 284 1HB GLU 18 -1.668 -8.995 -1.450 157 2HB GLU 284 2HB GLU 18 -2.212 -10.405 -2.326 158 1HG GLU 284 1HG GLU 18 -3.891 -9.357 0.043 159 2HG GLU 284 2HG GLU 18 -3.964 -8.523 -1.489 160 H PHE 285 H PHE 19 0.786 -10.492 -0.966 161 HA PHE 285 HA PHE 19 1.214 -12.797 -2.767 162 1HB PHE 285 1HB PHE 19 2.665 -10.511 -2.086 163 2HB PHE 285 2HB PHE 19 3.548 -11.716 -1.191 164 HD1 PHE 285 HD1 PHE 19 4.731 -13.588 -2.380 165 HD2 PHE 285 HD2 PHE 19 2.824 -10.411 -4.555 166 HE1 PHE 285 HE1 PHE 19 5.977 -14.225 -4.403 167 HE2 PHE 285 HE2 PHE 19 4.073 -11.057 -6.579 168 HZ PHE 285 HZ PHE 19 5.650 -12.965 -6.507 169 H ILE 286 H ILE 20 3.173 -12.456 -0.031 170 HA ILE 286 HA ILE 20 3.457 -15.302 0.409 171 HB ILE 286 HB ILE 20 3.895 -13.500 2.783 172 1HG1 ILE 286 1HG1 ILE 20 5.125 -12.768 0.105 173 2HG1 ILE 286 2HG1 ILE 20 4.582 -11.724 1.402 174 1HG2 ILE 286 2HG2 ILE 20 4.921 -15.832 2.753 175 2HG2 ILE 286 3HG2 ILE 20 5.848 -15.413 1.292 176 3HG2 ILE 286 1HG2 ILE 20 6.176 -14.624 2.850 177 1HD1 ILE 286 2HD1 ILE 20 6.576 -12.339 2.834 178 2HD1 ILE 286 3HD1 ILE 20 7.224 -13.305 1.483 179 3HD1 ILE 286 1HD1 ILE 20 7.008 -11.557 1.296 180 H GLY 287 H GLY 21 0.893 -13.260 1.287 181 1HA GLY 287 1HA GLY 21 -0.067 -14.883 3.591 182 2HA GLY 287 2HA GLY 21 -1.048 -13.748 2.641 183 H SER 288 H SER 22 -0.729 -14.715 0.151 184 HA SER 288 HA SER 22 -1.623 -17.632 0.268 185 1HB SER 288 1HB SER 22 -3.166 -15.764 -1.579 186 2HB SER 288 2HB SER 22 -3.688 -17.290 -0.883 187 HG SER 288 HG SER 22 -4.561 -15.207 -0.019 188 1HN NH2 289 1HXT SER 22 0.328 -18.491 -0.600 189 2HN NH2 289 2HXT SER 22 0.817 -18.133 -2.278 No H/Q in entry = 189 Start of MODEL 5 1 1H ACE 266 1H1 MET 1 3.632 18.448 1.412 2 2H ACE 266 2H1 MET 1 2.722 17.124 0.655 3 3H ACE 266 3H1 MET 1 2.405 18.809 0.178 4 H VAL 267 H VAL 1 -0.309 17.713 2.759 5 HA VAL 267 HA VAL 1 -1.072 16.798 0.653 6 HB VAL 267 HB VAL 1 1.293 17.781 -0.938 7 1HG1 VAL 267 1HG2 VAL 1 -1.739 17.990 -1.536 8 2HG1 VAL 267 2HG2 VAL 1 -0.430 18.468 -2.646 9 3HG1 VAL 267 3HG2 VAL 1 -0.611 16.782 -2.196 10 1HG2 VAL 267 2HG1 VAL 1 0.907 19.845 0.517 11 2HG2 VAL 267 3HG1 VAL 1 0.507 20.151 -1.177 12 3HG2 VAL 267 1HG1 VAL 1 -0.798 19.885 0.008 13 H GLU 268 H GLU 2 0.447 15.762 -1.325 14 HA GLU 268 HA GLU 2 1.469 13.640 -1.717 15 1HB GLU 268 1HB GLU 2 3.747 13.777 -1.386 16 2HB GLU 268 2HB GLU 2 3.367 15.416 -0.916 17 1HG GLU 268 1HG GLU 2 3.187 14.042 1.571 18 2HG GLU 268 2HG GLU 2 4.442 13.140 0.758 19 H GLU 269 H GLU 3 -0.584 13.812 0.301 20 HA GLU 269 HA GLU 3 0.272 11.705 2.285 21 1HB GLU 269 1HB GLU 3 -0.944 13.249 3.550 22 2HB GLU 269 2HB GLU 3 -1.680 13.938 2.124 23 1HG GLU 269 2HG GLU 3 -3.680 13.033 2.776 24 2HG GLU 269 1HG GLU 3 -3.075 11.438 2.416 25 H LYS 270 H LYS 4 -2.103 12.505 0.019 26 HA LYS 270 HA LYS 4 -3.597 10.021 -0.111 27 1HB LYS 270 1HB LYS 4 -2.951 12.156 -2.239 28 2HB LYS 270 2HB LYS 4 -3.867 10.728 -2.699 29 1HG LYS 270 1HG LYS 4 -5.336 11.451 -0.464 30 2HG LYS 270 2HG LYS 4 -4.663 13.032 -0.856 31 1HD LYS 270 1HD LYS 4 -5.670 11.889 -3.326 32 2HD LYS 270 2HD LYS 4 -6.874 11.525 -2.074 33 1HE LYS 270 1HE LYS 4 -5.755 14.314 -2.821 34 2HE LYS 270 2HE LYS 4 -7.437 13.774 -2.941 35 1HZ LYS 270 2HZ LYS 4 -7.097 13.307 -0.394 36 2HZ LYS 270 3HZ LYS 4 -5.896 14.473 -0.548 37 3HZ LYS 270 1HZ LYS 4 -7.484 14.843 -0.959 38 H SER 271 H SER 5 -0.575 10.901 -1.636 39 HA SER 271 HA SER 5 -0.408 8.505 -3.321 40 1HB SER 271 1HB SER 5 1.173 10.834 -2.927 41 2HB SER 271 2HB SER 5 2.252 9.546 -2.418 42 HG SER 271 HG SER 5 1.684 8.495 -4.480 43 H ILE 272 H ILE 6 0.643 9.209 -0.064 44 HA ILE 272 HA ILE 6 1.941 6.587 0.282 45 HB ILE 272 HB ILE 6 0.719 8.249 2.551 46 1HG1 ILE 272 2HG1 ILE 6 2.532 9.428 0.715 47 2HG1 ILE 272 1HG1 ILE 6 2.081 10.062 2.282 48 1HG2 ILE 272 2HG2 ILE 6 1.826 6.085 3.313 49 2HG2 ILE 272 3HG2 ILE 6 3.348 6.564 2.525 50 3HG2 ILE 272 1HG2 ILE 6 2.720 7.449 3.932 51 1HD1 ILE 272 2HD1 ILE 6 4.130 8.756 3.256 52 2HD1 ILE 272 3HD1 ILE 6 4.554 8.296 1.588 53 3HD1 ILE 272 1HD1 ILE 6 4.553 10.003 2.060 54 H ASP 273 H ASP 7 -1.212 7.496 0.252 55 HA ASP 273 HA ASP 7 -2.155 5.300 2.035 56 1HB ASP 273 1HB ASP 7 -3.370 7.684 0.684 57 2HB ASP 273 2HB ASP 7 -4.314 6.279 0.241 58 H LEU 274 H LEU 8 -1.508 5.755 -1.192 59 HA LEU 274 HA LEU 8 -2.719 3.121 -2.013 60 1HB LEU 274 1HB LEU 8 -1.947 5.528 -3.384 61 2HB LEU 274 2HB LEU 8 -0.710 4.393 -3.839 62 HG LEU 274 HG LEU 8 -3.181 2.921 -4.229 63 1HD1 LEU 274 3HD2 LEU 8 -4.263 5.264 -4.440 64 2HD1 LEU 274 1HD2 LEU 8 -3.212 5.583 -5.824 65 3HD1 LEU 274 2HD2 LEU 8 -4.400 4.252 -5.899 66 1HD2 LEU 274 2HD1 LEU 8 -0.934 2.616 -5.382 67 2HD2 LEU 274 3HD1 LEU 8 -2.293 2.702 -6.530 68 3HD2 LEU 274 1HD1 LEU 8 -1.217 4.102 -6.306 69 H ILE 275 H ILE 9 0.182 4.606 -1.217 70 HA ILE 275 HA ILE 9 1.691 2.034 -1.866 71 HB ILE 275 HB ILE 9 3.022 4.491 -0.611 72 1HG1 ILE 275 2HG1 ILE 9 1.945 4.290 -3.353 73 2HG1 ILE 275 1HG1 ILE 9 2.677 5.669 -2.560 74 1HG2 ILE 275 2HG2 ILE 9 4.477 2.425 -0.541 75 2HG2 ILE 275 3HG2 ILE 9 4.261 2.190 -2.292 76 3HG2 ILE 275 1HG2 ILE 9 5.152 3.587 -1.652 77 1HD1 ILE 275 2HD1 ILE 9 4.995 4.683 -3.274 78 2HD1 ILE 275 3HD1 ILE 9 4.112 3.408 -4.153 79 3HD1 ILE 275 1HD1 ILE 9 3.921 5.104 -4.628 80 H GLN 276 H GLN 10 -0.175 3.042 0.451 81 HA GLN 276 HA GLN 10 1.156 1.288 2.563 82 1HB GLN 276 1HB GLN 10 -0.902 3.538 2.607 83 2HB GLN 276 2HB GLN 10 -1.107 2.256 3.798 84 1HG GLN 276 2HG GLN 10 1.703 3.243 3.747 85 2HG GLN 276 1HG GLN 10 0.570 4.583 3.927 86 1HE2 GLN 276 2HE2 GLN 10 1.151 3.507 7.519 87 2HE2 GLN 276 1HE2 GLN 10 2.101 4.395 6.222 88 H LYS 277 H LYS 11 -1.617 1.815 0.484 89 HA LYS 277 HA LYS 11 -2.993 -0.663 1.231 90 1HB LYS 277 1HB LYS 11 -2.796 1.064 -1.360 91 2HB LYS 277 2HB LYS 11 -3.662 -0.463 -1.449 92 1HG LYS 277 1HG LYS 11 -5.380 0.307 0.147 93 2HG LYS 277 2HG LYS 11 -4.407 1.684 0.657 94 1HD LYS 277 1HD LYS 11 -4.932 2.896 -1.343 95 2HD LYS 277 2HD LYS 11 -5.289 1.424 -2.268 96 1HE LYS 277 1HE LYS 11 -6.986 2.125 0.214 97 2HE LYS 277 2HE LYS 11 -7.356 2.877 -1.345 98 1HZ LYS 277 2HZ LYS 11 -6.975 0.238 -1.965 99 2HZ LYS 277 3HZ LYS 11 -7.797 0.184 -0.499 100 3HZ LYS 277 1HZ LYS 11 -8.451 1.025 -1.800 101 H TRP 278 H TRP 12 -0.261 0.032 -0.533 102 HA TRP 278 HA TRP 12 0.007 -2.599 -1.890 103 1HB TRP 278 1HB TRP 12 1.809 -0.120 -1.320 104 2HB TRP 278 2HB TRP 12 2.588 -1.557 -1.942 105 HD1 TRP 278 HD1 TRP 12 -0.917 -0.294 -3.173 106 HE1 TRP 278 HE1 TRP 12 -0.804 0.423 -5.731 107 HE3 TRP 278 HE3 TRP 12 4.110 -0.965 -3.733 108 HZ2 TRP 278 HZ2 TRP 12 1.333 0.558 -7.607 109 HZ3 TRP 278 HZ3 TRP 12 5.151 -0.498 -5.929 110 HH2 TRP 278 HH2 TRP 12 3.786 0.247 -7.843 111 H GLU 279 H GLU 13 0.718 -1.421 1.133 112 HA GLU 279 HA GLU 13 2.568 -3.636 1.917 113 1HB GLU 279 2HB GLU 13 2.954 -1.716 3.199 114 2HB GLU 279 1HB GLU 13 1.315 -1.154 3.052 115 1HG GLU 279 2HG GLU 13 0.960 -1.680 5.241 116 2HG GLU 279 1HG GLU 13 0.851 -3.344 4.748 117 H GLU 280 H GLU 14 -0.613 -3.365 1.306 118 HA GLU 280 HA GLU 14 -1.403 -5.783 2.993 119 1HB GLU 280 1HB GLU 14 -3.306 -4.520 3.193 120 2HB GLU 280 2HB GLU 14 -2.733 -3.355 2.024 121 1HG GLU 280 2HG GLU 14 -4.549 -3.969 0.747 122 2HG GLU 280 1HG GLU 14 -3.651 -5.394 0.291 123 H LYS 281 H LYS 15 -0.888 -4.486 -0.163 124 HA LYS 281 HA LYS 15 -1.659 -6.784 -1.799 125 1HB LYS 281 1HB LYS 15 -1.141 -4.580 -2.836 126 2HB LYS 281 2HB LYS 15 0.472 -4.552 -2.138 127 1HG LYS 281 1HG LYS 15 1.043 -6.641 -3.615 128 2HG LYS 281 2HG LYS 15 -0.535 -6.451 -4.377 129 1HD LYS 281 1HD LYS 15 0.570 -5.105 -5.867 130 2HD LYS 281 2HD LYS 15 0.619 -3.872 -4.592 131 1HE LYS 281 1HE LYS 15 2.926 -4.051 -4.610 132 2HE LYS 281 2HE LYS 15 2.738 -5.634 -3.839 133 1HZ LYS 281 1HZ LYS 15 2.206 -6.244 -6.395 134 2HZ LYS 281 2HZ LYS 15 3.321 -5.003 -6.604 135 3HZ LYS 281 3HZ LYS 15 3.728 -6.354 -5.689 136 H SER 282 H SER 16 1.253 -5.848 -0.128 137 HA SER 282 HA SER 16 2.951 -8.023 -1.123 138 1HB SER 282 2HB SER 16 3.324 -5.754 0.544 139 2HB SER 282 1HB SER 16 3.421 -7.076 1.681 140 HG SER 282 HG SER 16 5.478 -6.861 0.998 141 H ARG 283 H ARG 17 1.040 -7.539 1.616 142 HA ARG 283 HA ARG 17 1.508 -10.242 2.800 143 1HB ARG 283 2HB ARG 17 0.744 -8.306 4.187 144 2HB ARG 283 1HB ARG 17 -0.736 -8.171 3.256 145 1HG ARG 283 1HG ARG 17 -1.792 -10.015 4.323 146 2HG ARG 283 2HG ARG 17 -0.276 -10.866 4.600 147 1HD ARG 283 2HD ARG 17 -1.582 -9.744 6.637 148 2HD ARG 283 1HD ARG 17 0.198 -9.653 6.590 149 HE ARG 283 HE ARG 17 0.059 -7.323 6.234 150 1HH1 ARG 283 2HH2 ARG 17 -3.043 -8.680 5.467 151 2HH1 ARG 283 1HH2 ARG 17 -3.804 -7.013 5.239 152 1HH2 ARG 283 2HH1 ARG 17 -0.834 -5.557 5.975 153 2HH2 ARG 283 1HH1 ARG 17 -2.608 -5.312 5.514 154 H GLU 284 H GLU 18 -0.522 -9.058 0.300 155 HA GLU 284 HA GLU 18 -2.417 -11.347 0.359 156 1HB GLU 284 1HB GLU 18 -1.694 -9.068 -1.513 157 2HB GLU 284 2HB GLU 18 -2.429 -10.456 -2.278 158 1HG GLU 284 1HG GLU 18 -4.337 -10.157 -0.373 159 2HG GLU 284 2HG GLU 18 -3.675 -8.551 -0.196 160 H PHE 285 H PHE 19 0.645 -10.624 -1.134 161 HA PHE 285 HA PHE 19 0.836 -13.066 -2.798 162 1HB PHE 285 1HB PHE 19 2.347 -10.767 -2.590 163 2HB PHE 285 2HB PHE 19 3.311 -11.810 -1.582 164 HD1 PHE 285 HD1 PHE 19 1.593 -12.037 -4.952 165 HD2 PHE 285 HD2 PHE 19 5.095 -12.950 -2.635 166 HE1 PHE 285 HE1 PHE 19 2.685 -12.946 -6.960 167 HE2 PHE 285 HE2 PHE 19 6.189 -13.844 -4.655 168 HZ PHE 285 HZ PHE 19 4.988 -13.840 -6.822 169 H ILE 286 H ILE 20 3.022 -12.447 -0.283 170 HA ILE 286 HA ILE 20 3.402 -15.247 0.397 171 HB ILE 286 HB ILE 20 4.039 -13.233 2.536 172 1HG1 ILE 286 1HG1 ILE 20 5.194 -12.785 -0.272 173 2HG1 ILE 286 2HG1 ILE 20 4.383 -11.621 0.754 174 1HG2 ILE 286 2HG2 ILE 20 5.140 -15.536 2.563 175 2HG2 ILE 286 3HG2 ILE 20 5.895 -15.200 0.986 176 3HG2 ILE 286 1HG2 ILE 20 6.354 -14.289 2.441 177 1HD1 ILE 286 2HD1 ILE 20 6.285 -11.649 2.422 178 2HD1 ILE 286 3HD1 ILE 20 7.196 -12.731 1.338 179 3HD1 ILE 286 1HD1 ILE 20 6.760 -11.101 0.798 180 H GLY 287 H GLY 21 0.932 -13.113 1.318 181 1HA GLY 287 1HA GLY 21 0.248 -14.532 3.868 182 2HA GLY 287 2HA GLY 21 -0.780 -13.363 3.013 183 H SER 288 H SER 22 -0.646 -14.692 0.505 184 HA SER 288 HA SER 22 -2.944 -16.229 0.370 185 1HB SER 288 1HB SER 22 -0.309 -16.634 -1.162 186 2HB SER 288 2HB SER 22 -1.708 -17.622 -1.548 187 HG SER 288 HG SER 22 -1.226 -15.389 -2.597 188 1HN NH2 289 1HXT SER 22 0.136 -18.308 0.137 189 2HN NH2 289 2HXT SER 22 -0.479 -19.602 1.201 No H/Q in entry = 189 Start of MODEL 6 1 1H ACE 266 1H1 MET 1 -0.233 20.272 0.895 2 2H ACE 266 2H1 MET 1 0.944 20.093 -0.428 3 3H ACE 266 3H1 MET 1 -0.097 21.534 -0.352 4 H VAL 267 H VAL 1 -1.925 17.879 -1.476 5 HA VAL 267 HA VAL 1 0.881 18.197 -0.462 6 HB VAL 267 HB VAL 1 -1.411 18.467 1.208 7 1HG1 VAL 267 1HG2 VAL 1 -0.207 15.683 1.854 8 2HG1 VAL 267 2HG2 VAL 1 -1.312 16.605 2.903 9 3HG1 VAL 267 3HG2 VAL 1 -1.884 16.011 1.355 10 1HG2 VAL 267 2HG1 VAL 1 0.899 19.347 1.771 11 2HG2 VAL 267 3HG1 VAL 1 0.152 18.521 3.143 12 3HG2 VAL 267 1HG1 VAL 1 1.425 17.702 2.201 13 H GLU 268 H GLU 2 1.770 16.235 0.488 14 HA GLU 268 HA GLU 2 1.028 13.951 -1.408 15 1HB GLU 268 1HB GLU 2 3.580 14.097 0.270 16 2HB GLU 268 2HB GLU 2 3.319 13.226 -1.222 17 1HG GLU 268 1HG GLU 2 3.641 16.299 -0.946 18 2HG GLU 268 2HG GLU 2 4.833 15.199 -1.593 19 H GLU 269 H GLU 3 -0.779 14.036 0.400 20 HA GLU 269 HA GLU 3 -0.004 12.087 2.574 21 1HB GLU 269 1HB GLU 3 -1.342 13.664 3.660 22 2HB GLU 269 2HB GLU 3 -1.997 14.247 2.150 23 1HG GLU 269 2HG GLU 3 -4.012 13.309 2.707 24 2HG GLU 269 1HG GLU 3 -3.330 11.717 2.508 25 H LYS 270 H LYS 4 -2.246 12.687 0.119 26 HA LYS 270 HA LYS 4 -3.552 10.066 -0.004 27 1HB LYS 270 1HB LYS 4 -3.089 12.302 -2.075 28 2HB LYS 270 2HB LYS 4 -3.836 10.798 -2.593 29 1HG LYS 270 1HG LYS 4 -5.291 11.489 -0.214 30 2HG LYS 270 2HG LYS 4 -4.982 13.046 -0.980 31 1HD LYS 270 1HD LYS 4 -6.281 12.437 -2.911 32 2HD LYS 270 2HD LYS 4 -6.097 10.697 -2.613 33 1HE LYS 270 1HE LYS 4 -7.442 12.351 -0.414 34 2HE LYS 270 2HE LYS 4 -8.391 12.031 -1.873 35 1HZ LYS 270 2HZ LYS 4 -6.927 9.863 -0.475 36 2HZ LYS 270 3HZ LYS 4 -8.492 10.313 -0.054 37 3HZ LYS 270 1HZ LYS 4 -8.171 9.730 -1.599 38 H SER 271 H SER 5 -0.602 11.269 -1.381 39 HA SER 271 HA SER 5 0.003 9.069 -3.153 40 1HB SER 271 2HB SER 5 1.604 11.214 -1.777 41 2HB SER 271 1HB SER 5 2.527 9.755 -2.105 42 HG SER 271 HG SER 5 0.896 10.758 -4.170 43 H ILE 272 H ILE 6 0.511 9.356 0.314 44 HA ILE 272 HA ILE 6 1.977 6.813 0.470 45 HB ILE 272 HB ILE 6 0.353 8.126 2.713 46 1HG1 ILE 272 2HG1 ILE 6 2.629 9.323 1.464 47 2HG1 ILE 272 1HG1 ILE 6 1.895 9.809 2.983 48 1HG2 ILE 272 2HG2 ILE 6 1.102 5.779 3.333 49 2HG2 ILE 272 3HG2 ILE 6 2.788 6.189 2.935 50 3HG2 ILE 272 1HG2 ILE 6 1.956 6.943 4.312 51 1HD1 ILE 272 2HD1 ILE 6 3.545 8.160 4.157 52 2HD1 ILE 272 3HD1 ILE 6 4.289 7.861 2.565 53 3HD1 ILE 272 1HD1 ILE 6 4.332 9.486 3.271 54 H ASP 273 H ASP 7 -1.250 7.493 0.195 55 HA ASP 273 HA ASP 7 -2.183 4.885 1.284 56 1HB ASP 273 1HB ASP 7 -3.452 7.332 0.046 57 2HB ASP 273 2HB ASP 7 -4.150 5.885 -0.645 58 H LEU 274 H LEU 8 -1.044 6.058 -1.610 59 HA LEU 274 HA LEU 8 -1.779 3.563 -3.124 60 1HB LEU 274 2HB LEU 8 -1.399 6.096 -4.049 61 2HB LEU 274 1HB LEU 8 0.301 5.655 -4.009 62 HG LEU 274 HG LEU 8 -1.023 5.511 -6.275 63 1HD1 LEU 274 3HD2 LEU 8 1.348 4.587 -5.863 64 2HD1 LEU 274 1HD2 LEU 8 0.633 3.014 -5.495 65 3HD1 LEU 274 2HD2 LEU 8 0.441 3.717 -7.125 66 1HD2 LEU 274 2HD1 LEU 8 -2.953 4.153 -5.324 67 2HD2 LEU 274 3HD1 LEU 8 -2.196 3.361 -6.728 68 3HD2 LEU 274 1HD1 LEU 8 -1.852 2.784 -5.079 69 H ILE 275 H ILE 9 0.689 4.549 -1.183 70 HA ILE 275 HA ILE 9 2.213 2.026 -2.000 71 HB ILE 275 HB ILE 9 3.644 4.366 -0.671 72 1HG1 ILE 275 2HG1 ILE 9 2.419 4.493 -3.372 73 2HG1 ILE 275 1HG1 ILE 9 3.205 5.753 -2.452 74 1HG2 ILE 275 2HG2 ILE 9 5.004 2.250 -0.901 75 2HG2 ILE 275 3HG2 ILE 9 4.686 2.212 -2.652 76 3HG2 ILE 275 1HG2 ILE 9 5.673 3.496 -1.922 77 1HD1 ILE 275 2HD1 ILE 9 5.484 4.821 -3.379 78 2HD1 ILE 275 3HD1 ILE 9 4.539 3.666 -4.353 79 3HD1 ILE 275 1HD1 ILE 9 4.364 5.407 -4.630 80 H GLN 276 H GLN 10 0.196 2.930 0.169 81 HA GLN 276 HA GLN 10 1.612 1.429 2.425 82 1HB GLN 276 1HB GLN 10 -0.832 3.328 2.398 83 2HB GLN 276 2HB GLN 10 -0.507 2.267 3.767 84 1HG GLN 276 1HG GLN 10 1.679 4.283 2.867 85 2HG GLN 276 2HG GLN 10 0.266 4.869 3.700 86 1HE2 GLN 276 2HE2 GLN 10 2.740 2.624 6.083 87 2HE2 GLN 276 1HE2 GLN 10 2.460 2.061 4.348 88 H LYS 277 H LYS 11 -1.292 1.797 0.468 89 HA LYS 277 HA LYS 11 -2.488 -0.746 1.251 90 1HB LYS 277 1HB LYS 11 -2.462 0.973 -1.360 91 2HB LYS 277 2HB LYS 11 -3.231 -0.605 -1.436 92 1HG LYS 277 2HG LYS 11 -4.954 0.071 0.238 93 2HG LYS 277 1HG LYS 11 -4.105 1.574 0.610 94 1HD LYS 277 1HD LYS 11 -4.941 2.714 -1.138 95 2HD LYS 277 2HD LYS 11 -4.724 1.371 -2.277 96 1HE LYS 277 1HE LYS 11 -6.971 1.522 -0.137 97 2HE LYS 277 2HE LYS 11 -7.205 1.849 -1.861 98 1HZ LYS 277 2HZ LYS 11 -6.200 -0.452 -2.224 99 2HZ LYS 277 3HZ LYS 11 -6.469 -0.718 -0.586 100 3HZ LYS 277 1HZ LYS 11 -7.761 -0.369 -1.605 101 H TRP 278 H TRP 12 0.160 0.028 -0.598 102 HA TRP 278 HA TRP 12 0.509 -2.621 -1.895 103 1HB TRP 278 1HB TRP 12 2.294 -0.113 -1.350 104 2HB TRP 278 2HB TRP 12 3.041 -1.535 -2.043 105 HD1 TRP 278 HD1 TRP 12 -0.523 -0.341 -3.138 106 HE1 TRP 278 HE1 TRP 12 -0.527 0.237 -5.736 107 HE3 TRP 278 HE3 TRP 12 4.501 -0.855 -3.853 108 HZ2 TRP 278 HZ2 TRP 12 1.537 0.402 -7.684 109 HZ3 TRP 278 HZ3 TRP 12 5.445 -0.464 -6.107 110 HH2 TRP 278 HH2 TRP 12 3.988 0.149 -8.000 111 H GLU 279 H GLU 13 1.301 -1.310 1.072 112 HA GLU 279 HA GLU 13 3.234 -3.439 1.879 113 1HB GLU 279 1HB GLU 13 3.621 -1.442 3.055 114 2HB GLU 279 2HB GLU 13 1.960 -0.935 2.948 115 1HG GLU 279 2HG GLU 13 1.644 -1.433 5.161 116 2HG GLU 279 1HG GLU 13 1.744 -3.124 4.770 117 H GLU 280 H GLU 14 -0.028 -3.113 1.567 118 HA GLU 280 HA GLU 14 -0.654 -5.583 3.242 119 1HB GLU 280 1HB GLU 14 -2.325 -3.415 1.840 120 2HB GLU 280 2HB GLU 14 -3.067 -4.936 2.275 121 1HG GLU 280 1HG GLU 14 -1.612 -3.276 4.431 122 2HG GLU 280 2HG GLU 14 -3.216 -2.808 3.927 123 H LYS 281 H LYS 15 -0.169 -4.303 0.113 124 HA LYS 281 HA LYS 15 -1.160 -6.490 -1.548 125 1HB LYS 281 1HB LYS 15 -0.400 -4.309 -2.523 126 2HB LYS 281 2HB LYS 15 1.224 -4.528 -1.887 127 1HG LYS 281 1HG LYS 15 1.590 -6.501 -3.445 128 2HG LYS 281 2HG LYS 15 -0.075 -6.385 -4.010 129 1HD LYS 281 1HD LYS 15 0.996 -5.224 -5.715 130 2HD LYS 281 2HD LYS 15 0.763 -3.847 -4.619 131 1HE LYS 281 1HE LYS 15 3.080 -3.603 -4.761 132 2HE LYS 281 2HE LYS 15 3.123 -4.888 -3.544 133 1HZ LYS 281 3HZ LYS 15 2.840 -5.776 -6.308 134 2HZ LYS 281 1HZ LYS 15 4.317 -5.088 -5.893 135 3HZ LYS 281 2HZ LYS 15 3.744 -6.423 -5.047 136 H SER 282 H SER 16 1.828 -5.875 0.146 137 HA SER 282 HA SER 16 3.294 -8.224 -0.787 138 1HB SER 282 2HB SER 16 3.829 -6.079 0.980 139 2HB SER 282 1HB SER 16 3.663 -7.426 2.080 140 HG SER 282 HG SER 16 5.699 -7.755 1.599 141 H ARG 283 H ARG 17 1.294 -7.609 1.858 142 HA ARG 283 HA ARG 17 1.330 -10.366 2.972 143 1HB ARG 283 2HB ARG 17 0.635 -8.739 4.544 144 2HB ARG 283 1HB ARG 17 -0.324 -7.847 3.380 145 1HG ARG 283 1HG ARG 17 -2.260 -9.287 3.622 146 2HG ARG 283 2HG ARG 17 -1.308 -10.622 4.262 147 1HD ARG 283 2HD ARG 17 -0.783 -9.015 6.304 148 2HD ARG 283 1HD ARG 17 -2.110 -8.005 5.673 149 HE ARG 283 HE ARG 17 -2.773 -10.910 5.889 150 1HH1 ARG 283 2HH2 ARG 17 -2.859 -7.865 7.553 151 2HH1 ARG 283 1HH2 ARG 17 -4.180 -8.442 8.706 152 1HH2 ARG 283 2HH1 ARG 17 -4.197 -11.464 7.172 153 2HH2 ARG 283 1HH1 ARG 17 -4.912 -10.398 8.504 154 H GLU 284 H GLU 18 -0.390 -8.907 0.379 155 HA GLU 284 HA GLU 18 -2.492 -11.009 0.233 156 1HB GLU 284 1HB GLU 18 -1.449 -8.747 -1.531 157 2HB GLU 284 2HB GLU 18 -2.371 -9.998 -2.328 158 1HG GLU 284 1HG GLU 18 -3.524 -8.516 0.131 159 2HG GLU 284 2HG GLU 18 -3.614 -7.800 -1.458 160 H PHE 285 H PHE 19 0.713 -10.532 -1.036 161 HA PHE 285 HA PHE 19 0.662 -12.770 -2.947 162 1HB PHE 285 1HB PHE 19 2.447 -10.721 -2.457 163 2HB PHE 285 2HB PHE 19 3.241 -11.989 -1.566 164 HD1 PHE 285 HD1 PHE 19 1.476 -11.873 -4.922 165 HD2 PHE 285 HD2 PHE 19 5.019 -12.972 -2.753 166 HE1 PHE 285 HE1 PHE 19 2.506 -12.669 -7.008 167 HE2 PHE 285 HE2 PHE 19 6.036 -13.792 -4.846 168 HZ PHE 285 HZ PHE 19 4.793 -13.623 -6.981 169 H ILE 286 H ILE 20 2.669 -12.562 -0.205 170 HA ILE 286 HA ILE 20 2.889 -15.453 0.165 171 HB ILE 286 HB ILE 20 3.439 -13.680 2.537 172 1HG1 ILE 286 2HG1 ILE 20 4.809 -13.122 -0.141 173 2HG1 ILE 286 1HG1 ILE 20 4.104 -11.952 0.950 174 1HG2 ILE 286 2HG2 ILE 20 4.364 -16.051 2.489 175 2HG2 ILE 286 3HG2 ILE 20 5.282 -15.672 1.012 176 3HG2 ILE 286 1HG2 ILE 20 5.671 -14.898 2.563 177 1HD1 ILE 286 2HD1 ILE 20 6.074 -12.529 2.602 178 2HD1 ILE 286 3HD1 ILE 20 6.755 -13.553 1.312 179 3HD1 ILE 286 1HD1 ILE 20 6.571 -11.810 1.053 180 H GLY 287 H GLY 21 0.492 -13.234 1.156 181 1HA GLY 287 1HA GLY 21 -0.711 -15.503 2.876 182 2HA GLY 287 2HA GLY 21 -1.003 -13.781 3.198 183 H SER 288 H SER 22 -0.821 -15.075 -0.010 184 HA SER 288 HA SER 22 -3.428 -14.073 -0.813 185 1HB SER 288 1HB SER 22 -3.081 -15.146 -2.918 186 2HB SER 288 2HB SER 22 -1.447 -14.819 -2.367 187 HG SER 288 HG SER 22 -1.556 -17.074 -1.478 188 1HN NH2 289 1HXT SER 22 -5.574 -14.896 -1.175 189 2HN NH2 289 2HXT SER 22 -6.106 -16.397 -0.370 No H/Q in entry = 189 Start of MODEL 7 1 1H ACE 266 1H1 MET 1 2.178 17.955 -1.152 2 2H ACE 266 2H1 MET 1 2.616 19.598 -1.677 3 3H ACE 266 3H1 MET 1 1.664 19.363 -0.192 4 H VAL 267 H VAL 1 -1.465 18.524 -2.080 5 HA VAL 267 HA VAL 1 0.132 18.119 0.240 6 HB VAL 267 HB VAL 1 -1.945 15.971 -0.227 7 1HG1 VAL 267 1HG2 VAL 1 -1.695 17.981 2.120 8 2HG1 VAL 267 2HG2 VAL 1 -2.861 16.638 2.020 9 3HG1 VAL 267 3HG2 VAL 1 -1.146 16.288 2.123 10 1HG2 VAL 267 2HG1 VAL 1 -3.060 17.894 -1.455 11 2HG2 VAL 267 3HG1 VAL 1 -3.945 17.433 0.004 12 3HG2 VAL 267 1HG1 VAL 1 -2.935 18.902 0.006 13 H GLU 268 H GLU 2 0.163 15.780 1.228 14 HA GLU 268 HA GLU 2 1.322 13.807 -0.734 15 1HB GLU 268 2HB GLU 2 3.207 14.378 1.550 16 2HB GLU 268 1HB GLU 2 3.569 13.900 -0.091 17 1HG GLU 268 2HG GLU 2 3.109 16.323 -0.874 18 2HG GLU 268 1HG GLU 2 2.848 16.783 0.790 19 H GLU 269 H GLU 3 -0.912 13.969 1.043 20 HA GLU 269 HA GLU 3 -0.218 11.901 3.132 21 1HB GLU 269 1HB GLU 3 -1.631 13.391 4.245 22 2HB GLU 269 2HB GLU 3 -2.219 14.060 2.742 23 1HG GLU 269 2HG GLU 3 -4.245 13.063 3.128 24 2HG GLU 269 1HG GLU 3 -3.527 11.493 2.880 25 H LYS 270 H LYS 4 -2.348 12.628 0.611 26 HA LYS 270 HA LYS 4 -3.568 9.969 0.271 27 1HB LYS 270 1HB LYS 4 -3.175 12.380 -1.612 28 2HB LYS 270 2HB LYS 4 -3.873 10.896 -2.241 29 1HG LYS 270 1HG LYS 4 -5.356 11.356 0.171 30 2HG LYS 270 2HG LYS 4 -5.089 12.979 -0.462 31 1HD LYS 270 1HD LYS 4 -6.034 12.011 -2.728 32 2HD LYS 270 2HD LYS 4 -6.507 10.585 -1.784 33 1HE LYS 270 1HE LYS 4 -8.318 12.475 -1.962 34 2HE LYS 270 2HE LYS 4 -8.002 11.859 -0.333 35 1HZ LYS 270 1HZ LYS 4 -6.233 14.005 -1.136 36 2HZ LYS 270 2HZ LYS 4 -7.854 14.442 -1.036 37 3HZ LYS 270 3HZ LYS 4 -7.079 13.774 0.299 38 H SER 271 H SER 5 -0.665 11.426 -0.958 39 HA SER 271 HA SER 5 0.063 9.390 -2.882 40 1HB SER 271 2HB SER 5 1.548 11.518 -1.350 41 2HB SER 271 1HB SER 5 2.544 10.142 -1.801 42 HG SER 271 HG SER 5 2.079 12.064 -3.338 43 H ILE 272 H ILE 6 0.511 9.484 0.600 44 HA ILE 272 HA ILE 6 2.112 7.015 0.593 45 HB ILE 272 HB ILE 6 0.399 7.925 2.969 46 1HG1 ILE 272 2HG1 ILE 6 2.152 9.747 1.716 47 2HG1 ILE 272 1HG1 ILE 6 1.502 9.891 3.335 48 1HG2 ILE 272 2HG2 ILE 6 1.727 5.800 3.384 49 2HG2 ILE 272 3HG2 ILE 6 3.236 6.639 2.951 50 3HG2 ILE 272 1HG2 ILE 6 2.322 7.080 4.409 51 1HD1 ILE 272 2HD1 ILE 6 3.650 8.649 4.168 52 2HD1 ILE 272 3HD1 ILE 6 4.254 8.692 2.492 53 3HD1 ILE 272 1HD1 ILE 6 3.964 10.205 3.367 54 H ASP 273 H ASP 7 -1.133 7.580 0.355 55 HA ASP 273 HA ASP 7 -2.000 4.891 1.265 56 1HB ASP 273 1HB ASP 7 -3.295 7.377 0.102 57 2HB ASP 273 2HB ASP 7 -3.969 5.937 -0.626 58 H LEU 274 H LEU 8 -0.805 6.225 -1.525 59 HA LEU 274 HA LEU 8 -1.544 3.868 -3.228 60 1HB LEU 274 2HB LEU 8 -0.900 6.453 -3.910 61 2HB LEU 274 1HB LEU 8 0.735 5.813 -3.906 62 HG LEU 274 HG LEU 8 -0.637 6.001 -6.167 63 1HD1 LEU 274 3HD2 LEU 8 1.675 4.897 -5.875 64 2HD1 LEU 274 1HD2 LEU 8 0.864 3.348 -5.626 65 3HD1 LEU 274 2HD2 LEU 8 0.698 4.195 -7.189 66 1HD2 LEU 274 2HD1 LEU 8 -2.639 4.693 -5.298 67 2HD2 LEU 274 3HD1 LEU 8 -1.951 3.975 -6.776 68 3HD2 LEU 274 1HD1 LEU 8 -1.626 3.242 -5.187 69 H ILE 275 H ILE 9 0.890 4.580 -1.117 70 HA ILE 275 HA ILE 9 2.261 1.990 -1.990 71 HB ILE 275 HB ILE 9 3.810 4.162 -0.517 72 1HG1 ILE 275 2HG1 ILE 9 2.691 4.493 -3.247 73 2HG1 ILE 275 1HG1 ILE 9 3.531 5.652 -2.246 74 1HG2 ILE 275 2HG2 ILE 9 5.022 1.963 -0.800 75 2HG2 ILE 275 3HG2 ILE 9 4.762 2.024 -2.560 76 3HG2 ILE 275 1HG2 ILE 9 5.814 3.200 -1.742 77 1HD1 ILE 275 2HD1 ILE 9 5.770 4.599 -3.142 78 2HD1 ILE 275 3HD1 ILE 9 4.780 3.558 -4.197 79 3HD1 ILE 275 1HD1 ILE 9 4.738 5.317 -4.399 80 H GLN 276 H GLN 10 0.276 3.043 0.164 81 HA GLN 276 HA GLN 10 1.411 1.320 2.425 82 1HB GLN 276 1HB GLN 10 -0.616 3.601 2.268 83 2HB GLN 276 2HB GLN 10 -0.787 2.406 3.552 84 1HG GLN 276 2HG GLN 10 1.872 2.980 3.922 85 2HG GLN 276 1HG GLN 10 1.450 4.490 3.158 86 1HE2 GLN 276 2HE2 GLN 10 -0.715 5.269 6.129 87 2HE2 GLN 276 1HE2 GLN 10 -1.026 5.069 4.317 88 H LYS 277 H LYS 11 -1.277 1.962 0.296 89 HA LYS 277 HA LYS 11 -2.730 -0.506 0.876 90 1HB LYS 277 1HB LYS 11 -2.386 1.315 -1.642 91 2HB LYS 277 2HB LYS 11 -3.280 -0.186 -1.831 92 1HG LYS 277 1HG LYS 11 -5.047 0.579 -0.240 93 2HG LYS 277 2HG LYS 11 -4.077 1.965 0.265 94 1HD LYS 277 1HD LYS 11 -5.151 3.170 -1.348 95 2HD LYS 277 2HD LYS 11 -4.370 2.179 -2.596 96 1HE LYS 277 1HE LYS 11 -6.781 1.896 -2.954 97 2HE LYS 277 2HE LYS 11 -6.217 0.378 -2.238 98 1HZ LYS 277 2HZ LYS 11 -7.136 2.560 -0.473 99 2HZ LYS 277 3HZ LYS 11 -8.250 1.555 -1.235 100 3HZ LYS 277 1HZ LYS 11 -7.103 0.902 -0.192 101 H TRP 278 H TRP 12 0.093 0.161 -0.751 102 HA TRP 278 HA TRP 12 0.336 -2.478 -2.108 103 1HB TRP 278 1HB TRP 12 2.251 -0.104 -1.444 104 2HB TRP 278 2HB TRP 12 2.935 -1.567 -2.116 105 HD1 TRP 278 HD1 TRP 12 -0.482 -0.131 -3.378 106 HE1 TRP 278 HE1 TRP 12 -0.318 0.429 -5.975 107 HE3 TRP 278 HE3 TRP 12 4.520 -1.007 -3.843 108 HZ2 TRP 278 HZ2 TRP 12 1.846 0.432 -7.819 109 HZ3 TRP 278 HZ3 TRP 12 5.597 -0.715 -6.053 110 HH2 TRP 278 HH2 TRP 12 4.283 -0.004 -8.015 111 H GLU 279 H GLU 13 1.127 -1.213 0.898 112 HA GLU 279 HA GLU 13 2.784 -3.526 1.765 113 1HB GLU 279 2HB GLU 13 1.943 -0.837 2.677 114 2HB GLU 279 1HB GLU 13 1.334 -1.929 3.877 115 1HG GLU 279 2HG GLU 13 4.386 -1.761 3.198 116 2HG GLU 279 1HG GLU 13 3.580 -0.642 4.257 117 H GLU 280 H GLU 14 -0.347 -3.162 1.120 118 HA GLU 280 HA GLU 14 -1.215 -5.480 2.911 119 1HB GLU 280 1HB GLU 14 -3.166 -4.291 2.983 120 2HB GLU 280 2HB GLU 14 -2.499 -3.076 1.919 121 1HG GLU 280 2HG GLU 14 -4.296 -3.637 0.560 122 2HG GLU 280 1HG GLU 14 -3.254 -4.914 -0.014 123 H LYS 281 H LYS 15 -0.764 -4.269 -0.305 124 HA LYS 281 HA LYS 15 -1.458 -6.500 -1.961 125 1HB LYS 281 1HB LYS 15 -0.620 -4.323 -2.885 126 2HB LYS 281 2HB LYS 15 0.946 -4.536 -2.114 127 1HG LYS 281 1HG LYS 15 1.429 -6.532 -3.623 128 2HG LYS 281 2HG LYS 15 -0.174 -6.389 -4.341 129 1HD LYS 281 1HD LYS 15 1.008 -5.203 -5.936 130 2HD LYS 281 2HD LYS 15 0.812 -3.844 -4.812 131 1HE LYS 281 1HE LYS 15 3.147 -3.758 -4.844 132 2HE LYS 281 2HE LYS 15 3.037 -5.062 -3.652 133 1HZ LYS 281 2HZ LYS 15 2.780 -6.456 -5.912 134 2HZ LYS 281 3HZ LYS 15 3.755 -5.201 -6.462 135 3HZ LYS 281 1HZ LYS 15 4.255 -6.148 -5.165 136 H SER 282 H SER 16 1.376 -5.860 -0.029 137 HA SER 282 HA SER 16 2.861 -8.277 -0.810 138 1HB SER 282 2HB SER 16 3.366 -6.014 0.845 139 2HB SER 282 1HB SER 16 3.185 -7.305 2.007 140 HG SER 282 HG SER 16 5.296 -7.425 1.534 141 H ARG 283 H ARG 17 0.749 -7.443 1.683 142 HA ARG 283 HA ARG 17 0.735 -10.131 2.982 143 1HB ARG 283 2HB ARG 17 -0.080 -7.660 3.818 144 2HB ARG 283 1HB ARG 17 -1.637 -8.208 3.222 145 1HG ARG 283 1HG ARG 17 -2.027 -9.293 5.204 146 2HG ARG 283 2HG ARG 17 -0.721 -10.411 4.823 147 1HD ARG 283 1HD ARG 17 0.230 -7.755 5.901 148 2HD ARG 283 2HD ARG 17 -0.801 -8.681 7.023 149 HE ARG 283 HE ARG 17 1.931 -9.350 6.235 150 1HH1 ARG 283 2HH2 ARG 17 -1.083 -10.918 6.951 151 2HH1 ARG 283 1HH2 ARG 17 -0.241 -12.481 7.456 152 1HH2 ARG 283 2HH1 ARG 17 2.770 -11.072 6.797 153 2HH2 ARG 283 1HH1 ARG 17 1.853 -12.571 7.375 154 H GLU 284 H GLU 18 -0.648 -9.042 0.118 155 HA GLU 284 HA GLU 18 -2.983 -10.943 0.162 156 1HB GLU 284 1HB GLU 18 -3.450 -9.170 -1.296 157 2HB GLU 284 2HB GLU 18 -1.766 -8.848 -1.628 158 1HG GLU 284 1HG GLU 18 -2.081 -9.734 -3.724 159 2HG GLU 284 2HG GLU 18 -2.212 -11.320 -3.005 160 H PHE 285 H PHE 19 0.060 -10.569 -1.558 161 HA PHE 285 HA PHE 19 0.283 -13.108 -2.845 162 1HB PHE 285 1HB PHE 19 2.014 -10.945 -2.375 163 2HB PHE 285 2HB PHE 19 2.771 -12.191 -1.424 164 HD1 PHE 285 HD1 PHE 19 2.327 -14.647 -3.103 165 HD2 PHE 285 HD2 PHE 19 3.480 -10.665 -4.237 166 HE1 PHE 285 HE1 PHE 19 3.455 -15.541 -5.097 167 HE2 PHE 285 HE2 PHE 19 4.616 -11.570 -6.228 168 HZ PHE 285 HZ PHE 19 4.595 -14.006 -6.670 169 H ILE 286 H ILE 20 2.126 -12.543 -0.043 170 HA ILE 286 HA ILE 20 2.323 -15.380 0.638 171 HB ILE 286 HB ILE 20 2.831 -13.370 2.823 172 1HG1 ILE 286 2HG1 ILE 20 4.264 -13.101 0.132 173 2HG1 ILE 286 1HG1 ILE 20 3.525 -11.821 1.067 174 1HG2 ILE 286 2HG2 ILE 20 3.749 -15.731 3.044 175 2HG2 ILE 286 3HG2 ILE 20 4.698 -15.511 1.554 176 3HG2 ILE 286 1HG2 ILE 20 5.058 -14.578 3.023 177 1HD1 ILE 286 2HD1 ILE 20 5.451 -12.197 2.823 178 2HD1 ILE 286 3HD1 ILE 20 6.171 -13.354 1.675 179 3HD1 ILE 286 1HD1 ILE 20 5.988 -11.652 1.218 180 H GLY 287 H GLY 21 -0.047 -13.018 1.383 181 1HA GLY 287 1HA GLY 21 -1.213 -14.283 3.753 182 2HA GLY 287 2HA GLY 21 -2.120 -13.314 2.574 183 H SER 288 H SER 22 -1.507 -14.833 0.323 184 HA SER 288 HA SER 22 -2.549 -16.581 -0.904 185 1HB SER 288 1HB SER 22 -1.845 -18.770 -0.354 186 2HB SER 288 2HB SER 22 -0.632 -17.799 0.465 187 HG SER 288 HG SER 22 -1.271 -18.681 2.254 188 1HN NH2 289 1HXT SER 22 -4.376 -14.834 0.661 189 2HN NH2 289 2HXT SER 22 -5.812 -15.832 1.017 No H/Q in entry = 189 Start of MODEL 8 1 1H ACE 266 1H1 MET 1 -2.894 19.863 0.589 2 2H ACE 266 2H1 MET 1 -1.816 18.692 -0.207 3 3H ACE 266 3H1 MET 1 -2.924 18.151 1.076 4 H VAL 267 H VAL 1 0.705 18.723 2.438 5 HA VAL 267 HA VAL 1 -1.059 16.932 0.787 6 HB VAL 267 HB VAL 1 1.544 17.508 -0.538 7 1HG1 VAL 267 1HG2 VAL 1 -1.319 17.960 -1.641 8 2HG1 VAL 267 2HG2 VAL 1 0.188 18.038 -2.589 9 3HG1 VAL 267 3HG2 VAL 1 -0.315 16.511 -1.886 10 1HG2 VAL 267 2HG1 VAL 1 1.282 19.825 0.460 11 2HG2 VAL 267 3HG1 VAL 1 1.170 19.841 -1.303 12 3HG2 VAL 267 1HG1 VAL 1 -0.309 19.984 -0.319 13 H GLU 268 H GLU 2 0.846 15.565 -0.550 14 HA GLU 268 HA GLU 2 2.208 13.624 -0.263 15 1HB GLU 268 1HB GLU 2 3.368 15.669 1.373 16 2HB GLU 268 2HB GLU 2 3.267 14.296 2.450 17 1HG GLU 268 2HG GLU 2 5.432 14.779 0.800 18 2HG GLU 268 1HG GLU 2 5.035 13.195 1.418 19 H GLU 269 H GLU 3 -0.474 13.753 0.603 20 HA GLU 269 HA GLU 3 -0.503 11.887 3.012 21 1HB GLU 269 1HB GLU 3 -2.748 13.461 1.653 22 2HB GLU 269 2HB GLU 3 -2.939 12.478 3.084 23 1HG GLU 269 1HG GLU 3 -0.990 14.869 3.112 24 2HG GLU 269 2HG GLU 3 -2.702 15.159 3.282 25 H LYS 270 H LYS 4 -2.727 12.281 0.500 26 HA LYS 270 HA LYS 4 -3.476 9.555 0.114 27 1HB LYS 270 1HB LYS 4 -3.303 11.913 -1.868 28 2HB LYS 270 2HB LYS 4 -3.854 10.342 -2.432 29 1HG LYS 270 1HG LYS 4 -5.472 10.616 -0.171 30 2HG LYS 270 2HG LYS 4 -5.216 12.316 -0.557 31 1HD LYS 270 1HD LYS 4 -6.482 12.148 -2.539 32 2HD LYS 270 2HD LYS 4 -6.020 10.459 -2.831 33 1HE LYS 270 1HE LYS 4 -8.297 10.234 -2.086 34 2HE LYS 270 2HE LYS 4 -7.380 9.881 -0.613 35 1HZ LYS 270 1HZ LYS 4 -8.408 12.581 -1.327 36 2HZ LYS 270 2HZ LYS 4 -9.152 11.510 -0.266 37 3HZ LYS 270 3HZ LYS 4 -7.640 12.147 0.105 38 H SER 271 H SER 5 -0.725 11.247 -1.186 39 HA SER 271 HA SER 5 0.162 9.348 -3.131 40 1HB SER 271 1HB SER 5 1.266 11.656 -1.931 41 2HB SER 271 2HB SER 5 2.429 10.420 -1.476 42 HG SER 271 HG SER 5 2.332 9.815 -3.824 43 H ILE 272 H ILE 6 1.078 9.407 0.301 44 HA ILE 272 HA ILE 6 2.497 6.883 0.081 45 HB ILE 272 HB ILE 6 1.427 8.139 2.597 46 1HG1 ILE 272 1HG1 ILE 6 4.412 7.905 2.113 47 2HG1 ILE 272 2HG1 ILE 6 3.623 8.948 0.956 48 1HG2 ILE 272 3HG2 ILE 6 3.347 5.709 2.341 49 2HG2 ILE 272 1HG2 ILE 6 3.001 6.562 3.860 50 3HG2 ILE 272 2HG2 ILE 6 1.722 5.681 3.066 51 1HD1 ILE 272 2HD1 ILE 6 2.646 10.376 2.802 52 2HD1 ILE 272 3HD1 ILE 6 3.559 9.421 3.998 53 3HD1 ILE 272 1HD1 ILE 6 4.424 10.352 2.765 54 H ASP 273 H ASP 7 -0.709 7.649 0.454 55 HA ASP 273 HA ASP 7 -1.617 5.130 1.671 56 1HB ASP 273 1HB ASP 7 -2.866 7.672 0.577 57 2HB ASP 273 2HB ASP 7 -3.827 6.278 0.139 58 H LEU 274 H LEU 8 -0.925 6.100 -1.425 59 HA LEU 274 HA LEU 8 -2.222 3.615 -2.578 60 1HB LEU 274 2HB LEU 8 -2.009 5.879 -3.930 61 2HB LEU 274 1HB LEU 8 -0.315 5.426 -4.151 62 HG LEU 274 HG LEU 8 -2.248 3.230 -4.892 63 1HD1 LEU 274 3HD2 LEU 8 -3.512 5.344 -5.675 64 2HD1 LEU 274 1HD2 LEU 8 -2.139 5.747 -6.712 65 3HD1 LEU 274 2HD2 LEU 8 -3.058 4.243 -6.999 66 1HD2 LEU 274 2HD1 LEU 8 0.269 3.207 -5.322 67 2HD2 LEU 274 3HD1 LEU 8 -0.672 3.012 -6.821 68 3HD2 LEU 274 1HD1 LEU 8 0.086 4.576 -6.434 69 H ILE 275 H ILE 9 0.750 4.585 -1.445 70 HA ILE 275 HA ILE 9 1.928 1.920 -2.380 71 HB ILE 275 HB ILE 9 3.652 4.175 -1.259 72 1HG1 ILE 275 2HG1 ILE 9 2.183 4.311 -3.824 73 2HG1 ILE 275 1HG1 ILE 9 3.165 5.531 -3.049 74 1HG2 ILE 275 2HG2 ILE 9 4.837 1.960 -1.530 75 2HG2 ILE 275 3HG2 ILE 9 4.353 1.887 -3.241 76 3HG2 ILE 275 1HG2 ILE 9 5.489 3.122 -2.656 77 1HD1 ILE 275 2HD1 ILE 9 5.245 4.371 -4.159 78 2HD1 ILE 275 3HD1 ILE 9 4.111 3.269 -4.981 79 3HD1 ILE 275 1HD1 ILE 9 4.052 5.008 -5.314 80 H GLN 276 H GLN 10 0.220 3.009 -0.067 81 HA GLN 276 HA GLN 10 1.576 1.532 2.242 82 1HB GLN 276 1HB GLN 10 0.771 3.576 3.097 83 2HB GLN 276 2HB GLN 10 -0.399 3.779 1.795 84 1HG GLN 276 2HG GLN 10 -2.112 3.132 3.193 85 2HG GLN 276 1HG GLN 10 -1.377 1.568 3.448 86 1HE2 GLN 276 2HE2 GLN 10 -0.438 4.170 6.429 87 2HE2 GLN 276 1HE2 GLN 10 -0.423 4.789 4.687 88 H LYS 277 H LYS 11 -1.307 1.951 0.293 89 HA LYS 277 HA LYS 11 -2.596 -0.553 1.054 90 1HB LYS 277 1HB LYS 11 -2.510 1.191 -1.541 91 2HB LYS 277 2HB LYS 11 -3.332 -0.359 -1.642 92 1HG LYS 277 2HG LYS 11 -5.032 0.362 0.058 93 2HG LYS 277 1HG LYS 11 -4.138 1.843 0.410 94 1HD LYS 277 1HD LYS 11 -5.456 2.891 -1.044 95 2HD LYS 277 2HD LYS 11 -4.473 2.142 -2.318 96 1HE LYS 277 1HE LYS 11 -6.994 1.711 -2.613 97 2HE LYS 277 2HE LYS 11 -6.031 0.226 -2.557 98 1HZ LYS 277 3HZ LYS 11 -6.919 1.196 0.038 99 2HZ LYS 277 1HZ LYS 11 -8.139 0.684 -1.000 100 3HZ LYS 277 2HZ LYS 11 -6.890 -0.364 -0.590 101 H TRP 278 H TRP 12 0.069 0.111 -0.818 102 HA TRP 278 HA TRP 12 0.227 -2.587 -2.096 103 1HB TRP 278 1HB TRP 12 2.052 -0.080 -1.849 104 2HB TRP 278 2HB TRP 12 2.792 -1.559 -2.419 105 HD1 TRP 278 HD1 TRP 12 -0.777 -0.277 -3.480 106 HE1 TRP 278 HE1 TRP 12 -0.856 0.116 -6.111 107 HE3 TRP 278 HE3 TRP 12 4.148 -1.261 -4.358 108 HZ2 TRP 278 HZ2 TRP 12 1.115 -0.065 -8.154 109 HZ3 TRP 278 HZ3 TRP 12 5.016 -1.113 -6.671 110 HH2 TRP 278 HH2 TRP 12 3.525 -0.521 -8.545 111 H GLU 279 H GLU 13 1.307 -1.139 0.726 112 HA GLU 279 HA GLU 13 3.143 -3.348 1.505 113 1HB GLU 279 1HB GLU 13 2.303 -0.646 2.386 114 2HB GLU 279 2HB GLU 13 1.869 -1.700 3.692 115 1HG GLU 279 2HG GLU 13 4.822 -1.458 2.666 116 2HG GLU 279 1HG GLU 13 4.093 -0.307 3.747 117 H GLU 280 H GLU 14 -0.064 -3.090 1.242 118 HA GLU 280 HA GLU 14 -0.614 -5.360 3.210 119 1HB GLU 280 1HB GLU 14 -2.478 -4.071 3.569 120 2HB GLU 280 2HB GLU 14 -2.112 -3.030 2.216 121 1HG GLU 280 1HG GLU 14 -4.017 -3.799 1.209 122 2HG GLU 280 2HG GLU 14 -3.240 -5.334 0.919 123 H LYS 281 H LYS 15 -0.546 -4.294 -0.074 124 HA LYS 281 HA LYS 15 -1.455 -6.652 -1.485 125 1HB LYS 281 1HB LYS 15 -0.896 -4.528 -2.679 126 2HB LYS 281 2HB LYS 15 0.771 -4.581 -2.123 127 1HG LYS 281 1HG LYS 15 1.151 -6.698 -3.526 128 2HG LYS 281 2HG LYS 15 -0.526 -6.632 -4.062 129 1HD LYS 281 1HD LYS 15 0.420 -5.519 -5.851 130 2HD LYS 281 2HD LYS 15 0.342 -4.099 -4.791 131 1HE LYS 281 1HE LYS 15 2.648 -3.964 -4.977 132 2HE LYS 281 2HE LYS 15 2.726 -5.362 -3.893 133 1HZ LYS 281 2HZ LYS 15 2.191 -6.565 -6.223 134 2HZ LYS 281 3HZ LYS 15 3.087 -5.250 -6.766 135 3HZ LYS 281 1HZ LYS 15 3.742 -6.302 -5.629 136 H SER 282 H SER 16 1.594 -5.773 -0.049 137 HA SER 282 HA SER 16 3.167 -8.052 -0.946 138 1HB SER 282 1HB SER 16 3.598 -5.822 0.711 139 2HB SER 282 2HB SER 16 3.607 -7.117 1.883 140 HG SER 282 HG SER 16 5.411 -8.003 0.914 141 H ARG 283 H ARG 17 1.187 -7.487 1.722 142 HA ARG 283 HA ARG 17 1.517 -10.204 2.911 143 1HB ARG 283 1HB ARG 17 0.863 -8.578 4.513 144 2HB ARG 283 2HB ARG 17 -0.214 -7.753 3.404 145 1HG ARG 283 1HG ARG 17 -1.886 -9.759 3.684 146 2HG ARG 283 2HG ARG 17 -0.796 -10.411 4.904 147 1HD ARG 283 2HD ARG 17 -1.024 -8.037 6.078 148 2HD ARG 283 1HD ARG 17 -2.413 -7.794 4.988 149 HE ARG 283 HE ARG 17 -2.478 -10.440 6.318 150 1HH1 ARG 283 2HH2 ARG 17 -3.315 -7.103 6.780 151 2HH1 ARG 283 1HH2 ARG 17 -4.600 -7.517 8.039 152 1HH2 ARG 283 2HH1 ARG 17 -3.881 -10.811 7.688 153 2HH2 ARG 283 1HH1 ARG 17 -4.913 -9.531 8.536 154 H GLU 284 H GLU 18 -0.479 -8.948 0.424 155 HA GLU 284 HA GLU 18 -2.517 -11.121 0.548 156 1HB GLU 284 1HB GLU 18 -1.689 -8.903 -1.351 157 2HB GLU 284 2HB GLU 18 -2.473 -10.267 -2.111 158 1HG GLU 284 1HG GLU 18 -3.904 -9.087 0.320 159 2HG GLU 284 2HG GLU 18 -3.825 -8.060 -1.089 160 H PHE 285 H PHE 19 0.561 -10.573 -0.961 161 HA PHE 285 HA PHE 19 0.664 -13.067 -2.584 162 1HB PHE 285 1HB PHE 19 2.236 -10.806 -2.433 163 2HB PHE 285 2HB PHE 19 3.167 -11.838 -1.384 164 HD1 PHE 285 HD2 PHE 19 2.015 -11.388 -4.905 165 HD2 PHE 285 HD1 PHE 19 4.466 -13.715 -2.252 166 HE1 PHE 285 HE2 PHE 19 3.106 -12.461 -6.840 167 HE2 PHE 285 HE1 PHE 19 5.541 -14.789 -4.185 168 HZ PHE 285 HZ PHE 19 4.868 -14.164 -6.486 169 H ILE 286 H ILE 20 2.941 -12.527 -0.150 170 HA ILE 286 HA ILE 20 3.186 -15.304 0.601 171 HB ILE 286 HB ILE 20 3.879 -13.271 2.709 172 1HG1 ILE 286 1HG1 ILE 20 5.084 -12.973 -0.097 173 2HG1 ILE 286 2HG1 ILE 20 4.327 -11.737 0.884 174 1HG2 ILE 286 2HG2 ILE 20 4.863 -15.622 2.829 175 2HG2 ILE 286 3HG2 ILE 20 5.655 -15.377 1.253 176 3HG2 ILE 286 1HG2 ILE 20 6.140 -14.442 2.684 177 1HD1 ILE 286 2HD1 ILE 20 6.219 -11.815 2.571 178 2HD1 ILE 286 3HD1 ILE 20 7.076 -12.977 1.526 179 3HD1 ILE 286 1HD1 ILE 20 6.733 -11.342 0.935 180 H GLY 287 H GLY 21 0.809 -13.040 1.507 181 1HA GLY 287 1HA GLY 21 0.012 -14.413 4.033 182 2HA GLY 287 2HA GLY 21 -0.982 -13.262 3.115 183 H SER 288 H SER 22 -1.083 -14.406 0.685 184 HA SER 288 HA SER 22 -2.692 -16.934 1.290 185 1HB SER 288 1HB SER 22 -2.974 -14.704 -0.753 186 2HB SER 288 2HB SER 22 -3.476 -16.300 -1.286 187 HG SER 288 HG SER 22 -4.646 -14.572 0.494 188 1HN NH2 289 1HXT SER 22 -1.431 -15.939 -2.039 189 2HN NH2 289 2HXT SER 22 -0.400 -17.378 -2.260 No H/Q in entry = 189 Start of MODEL 9 1 1H ACE 266 1H1 MET 1 -0.539 19.447 2.156 2 2H ACE 266 2H1 MET 1 0.035 20.334 0.725 3 3H ACE 266 3H1 MET 1 -1.548 20.724 1.437 4 H VAL 267 H VAL 1 -1.745 16.843 -0.052 5 HA VAL 267 HA VAL 1 0.590 18.012 1.434 6 HB VAL 267 HB VAL 1 -1.590 18.053 2.895 7 1HG1 VAL 267 2HG1 VAL 1 -2.542 15.831 1.990 8 2HG1 VAL 267 3HG1 VAL 1 -1.326 14.975 2.945 9 3HG1 VAL 267 1HG1 VAL 1 -2.556 15.973 3.763 10 1HG2 VAL 267 3HG2 VAL 1 0.767 17.820 4.024 11 2HG2 VAL 267 1HG2 VAL 1 -0.625 17.258 4.980 12 3HG2 VAL 267 2HG2 VAL 1 0.447 16.100 4.154 13 H GLU 268 H GLU 2 0.175 16.006 -0.773 14 HA GLU 268 HA GLU 2 0.941 13.809 -1.319 15 1HB GLU 268 1HB GLU 2 3.164 14.006 0.720 16 2HB GLU 268 2HB GLU 2 3.256 13.611 -0.979 17 1HG GLU 268 2HG GLU 2 3.261 16.398 0.329 18 2HG GLU 268 1HG GLU 2 4.422 15.711 -0.779 19 H GLU 269 H GLU 3 -1.087 13.778 0.495 20 HA GLU 269 HA GLU 3 -0.346 11.695 2.539 21 1HB GLU 269 1HB GLU 3 -1.914 13.075 3.588 22 2HB GLU 269 2HB GLU 3 -2.480 13.706 2.060 23 1HG GLU 269 2HG GLU 3 -4.448 12.578 2.385 24 2HG GLU 269 1HG GLU 3 -3.618 11.069 2.109 25 H LYS 270 H LYS 4 -2.385 12.283 -0.089 26 HA LYS 270 HA LYS 4 -3.477 9.582 -0.469 27 1HB LYS 270 1HB LYS 4 -2.980 11.935 -2.402 28 2HB LYS 270 2HB LYS 4 -3.596 10.411 -3.024 29 1HG LYS 270 1HG LYS 4 -5.354 10.799 -0.879 30 2HG LYS 270 2HG LYS 4 -4.957 12.474 -1.253 31 1HD LYS 270 1HD LYS 4 -5.764 12.108 -3.608 32 2HD LYS 270 2HD LYS 4 -6.022 10.385 -3.271 33 1HE LYS 270 1HE LYS 4 -8.196 11.607 -3.002 34 2HE LYS 270 2HE LYS 4 -7.687 10.959 -1.435 35 1HZ LYS 270 1HZ LYS 4 -6.524 13.219 -1.153 36 2HZ LYS 270 2HZ LYS 4 -7.527 13.745 -2.396 37 3HZ LYS 270 3HZ LYS 4 -8.194 13.142 -0.976 38 H SER 271 H SER 5 -0.520 11.087 -1.515 39 HA SER 271 HA SER 5 0.416 8.998 -3.287 40 1HB SER 271 1HB SER 5 1.510 11.387 -2.181 41 2HB SER 271 2HB SER 5 2.624 10.147 -1.630 42 HG SER 271 HG SER 5 1.820 9.957 -4.304 43 H ILE 272 H ILE 6 0.703 9.296 0.214 44 HA ILE 272 HA ILE 6 2.274 6.821 0.423 45 HB ILE 272 HB ILE 6 0.457 7.882 2.656 46 1HG1 ILE 272 2HG1 ILE 6 2.348 9.586 1.380 47 2HG1 ILE 272 1HG1 ILE 6 1.525 9.883 2.895 48 1HG2 ILE 272 2HG2 ILE 6 1.750 5.780 3.259 49 2HG2 ILE 272 3HG2 ILE 6 3.284 6.586 2.851 50 3HG2 ILE 272 1HG2 ILE 6 2.303 7.115 4.235 51 1HD1 ILE 272 2HD1 ILE 6 3.543 8.708 4.075 52 2HD1 ILE 272 3HD1 ILE 6 4.332 8.593 2.481 53 3HD1 ILE 272 1HD1 ILE 6 3.972 10.182 3.177 54 H ASP 273 H ASP 7 -0.950 7.387 -0.005 55 HA ASP 273 HA ASP 7 -1.846 4.743 1.036 56 1HB ASP 273 1HB ASP 7 -3.133 7.209 -0.104 57 2HB ASP 273 2HB ASP 7 -3.756 5.812 -0.953 58 H LEU 274 H LEU 8 -0.647 5.982 -1.798 59 HA LEU 274 HA LEU 8 -1.391 3.559 -3.410 60 1HB LEU 274 2HB LEU 8 -0.839 6.086 -4.248 61 2HB LEU 274 1HB LEU 8 0.833 5.556 -4.147 62 HG LEU 274 HG LEU 8 -0.373 5.524 -6.471 63 1HD1 LEU 274 3HD2 LEU 8 1.901 4.423 -5.959 64 2HD1 LEU 274 1HD2 LEU 8 1.056 2.902 -5.655 65 3HD1 LEU 274 2HD2 LEU 8 0.999 3.639 -7.280 66 1HD2 LEU 274 2HD1 LEU 8 -2.443 4.297 -5.642 67 2HD2 LEU 274 3HD1 LEU 8 -1.674 3.471 -7.020 68 3HD2 LEU 274 1HD1 LEU 8 -1.457 2.849 -5.366 69 H ILE 275 H ILE 9 1.048 4.364 -1.344 70 HA ILE 275 HA ILE 9 2.431 1.754 -2.137 71 HB ILE 275 HB ILE 9 3.975 3.989 -0.753 72 1HG1 ILE 275 2HG1 ILE 9 2.834 4.212 -3.485 73 2HG1 ILE 275 1HG1 ILE 9 3.674 5.412 -2.533 74 1HG2 ILE 275 2HG2 ILE 9 5.203 1.791 -0.963 75 2HG2 ILE 275 3HG2 ILE 9 4.930 1.784 -2.723 76 3HG2 ILE 275 1HG2 ILE 9 5.978 2.997 -1.957 77 1HD1 ILE 275 2HD1 ILE 9 5.913 4.339 -3.410 78 2HD1 ILE 275 3HD1 ILE 9 4.920 3.254 -4.417 79 3HD1 ILE 275 1HD1 ILE 9 4.865 5.005 -4.685 80 H GLN 276 H GLN 10 0.472 2.897 0.009 81 HA GLN 276 HA GLN 10 1.633 1.230 2.297 82 1HB GLN 276 1HB GLN 10 -0.400 3.497 2.122 83 2HB GLN 276 2HB GLN 10 -0.596 2.306 3.406 84 1HG GLN 276 1HG GLN 10 2.112 2.917 3.724 85 2HG GLN 276 2HG GLN 10 1.571 4.443 3.076 86 1HE2 GLN 276 2HE2 GLN 10 -0.438 4.797 6.273 87 2HE2 GLN 276 1HE2 GLN 10 -0.820 4.839 4.466 88 H LYS 277 H LYS 11 -1.055 1.781 0.148 89 HA LYS 277 HA LYS 11 -2.507 -0.667 0.797 90 1HB LYS 277 1HB LYS 11 -2.143 1.065 -1.773 91 2HB LYS 277 2HB LYS 11 -3.031 -0.445 -1.917 92 1HG LYS 277 1HG LYS 11 -4.818 0.355 -0.398 93 2HG LYS 277 2HG LYS 11 -3.852 1.726 0.142 94 1HD LYS 277 1HD LYS 11 -4.723 2.993 -1.549 95 2HD LYS 277 2HD LYS 11 -4.154 1.844 -2.775 96 1HE LYS 277 1HE LYS 11 -6.595 1.851 -2.984 97 2HE LYS 277 2HE LYS 11 -6.190 0.318 -2.195 98 1HZ LYS 277 1HZ LYS 11 -6.448 1.677 -0.028 99 2HZ LYS 277 2HZ LYS 11 -7.310 2.761 -0.983 100 3HZ LYS 277 3HZ LYS 11 -7.823 1.165 -0.850 101 H TRP 278 H TRP 12 0.333 -0.046 -0.825 102 HA TRP 278 HA TRP 12 0.610 -2.734 -2.077 103 1HB TRP 278 1HB TRP 12 2.473 -0.294 -1.514 104 2HB TRP 278 2HB TRP 12 3.202 -1.773 -2.098 105 HD1 TRP 278 HD1 TRP 12 -0.200 -0.341 -3.450 106 HE1 TRP 278 HE1 TRP 12 -0.027 0.046 -6.077 107 HE3 TRP 278 HE3 TRP 12 4.751 -1.484 -3.877 108 HZ2 TRP 278 HZ2 TRP 12 2.122 -0.168 -7.926 109 HZ3 TRP 278 HZ3 TRP 12 5.824 -1.390 -6.106 110 HH2 TRP 278 HH2 TRP 12 4.533 -0.736 -8.103 111 H GLU 279 H GLU 13 1.346 -1.352 0.885 112 HA GLU 279 HA GLU 13 3.029 -3.618 1.841 113 1HB GLU 279 2HB GLU 13 2.163 -0.890 2.646 114 2HB GLU 279 1HB GLU 13 1.582 -1.945 3.892 115 1HG GLU 279 2HG GLU 13 4.627 -1.780 3.185 116 2HG GLU 279 1HG GLU 13 3.823 -0.606 4.186 117 H GLU 280 H GLU 14 -0.147 -3.161 1.308 118 HA GLU 280 HA GLU 14 -0.987 -5.458 3.135 119 1HB GLU 280 1HB GLU 14 -2.484 -3.305 1.528 120 2HB GLU 280 2HB GLU 14 -3.322 -4.756 2.023 121 1HG GLU 280 1HG GLU 14 -2.286 -3.966 4.494 122 2HG GLU 280 2HG GLU 14 -2.378 -2.404 3.721 123 H LYS 281 H LYS 15 -0.406 -4.375 -0.067 124 HA LYS 281 HA LYS 15 -1.452 -6.643 -1.597 125 1HB LYS 281 1HB LYS 15 -0.699 -4.534 -2.713 126 2HB LYS 281 2HB LYS 15 0.927 -4.703 -2.067 127 1HG LYS 281 1HG LYS 15 1.301 -6.769 -3.500 128 2HG LYS 281 2HG LYS 15 -0.364 -6.693 -4.072 129 1HD LYS 281 1HD LYS 15 0.543 -5.526 -5.830 130 2HD LYS 281 2HD LYS 15 0.621 -4.139 -4.725 131 1HE LYS 281 1HE LYS 15 2.932 -4.389 -4.293 132 2HE LYS 281 2HE LYS 15 2.899 -6.152 -4.456 133 1HZ LYS 281 2HZ LYS 15 2.263 -4.616 -6.861 134 2HZ LYS 281 3HZ LYS 15 3.858 -4.580 -6.331 135 3HZ LYS 281 1HZ LYS 15 3.123 -6.050 -6.687 136 H SER 282 H SER 16 1.543 -5.937 0.041 137 HA SER 282 HA SER 16 3.040 -8.289 -0.824 138 1HB SER 282 2HB SER 16 3.555 -6.066 0.855 139 2HB SER 282 1HB SER 16 3.436 -7.375 2.006 140 HG SER 282 HG SER 16 5.005 -8.215 -0.043 141 H ARG 283 H ARG 17 1.066 -7.615 1.830 142 HA ARG 283 HA ARG 17 1.249 -10.333 3.037 143 1HB ARG 283 1HB ARG 17 0.622 -8.683 4.613 144 2HB ARG 283 2HB ARG 17 -0.386 -7.812 3.475 145 1HG ARG 283 1HG ARG 17 -2.332 -8.980 4.117 146 2HG ARG 283 2HG ARG 17 -1.505 -10.534 4.155 147 1HD ARG 283 1HD ARG 17 -2.440 -9.364 6.397 148 2HD ARG 283 2HD ARG 17 -0.951 -10.342 6.432 149 HE ARG 283 HE ARG 17 0.237 -8.400 6.997 150 1HH1 ARG 283 2HH2 ARG 17 -2.580 -7.365 5.253 151 2HH1 ARG 283 1HH2 ARG 17 -2.167 -5.581 5.488 152 1HH2 ARG 283 2HH1 ARG 17 0.616 -6.454 7.215 153 2HH2 ARG 283 1HH1 ARG 17 -0.432 -5.079 6.556 154 H GLU 284 H GLU 18 -0.667 -8.995 0.516 155 HA GLU 284 HA GLU 18 -2.727 -11.154 0.591 156 1HB GLU 284 1HB GLU 18 -2.016 -8.773 -1.067 157 2HB GLU 284 2HB GLU 18 -2.518 -10.108 -2.075 158 1HG GLU 284 1HG GLU 18 -4.437 -9.721 0.186 159 2HG GLU 284 2HG GLU 18 -4.212 -8.225 -0.686 160 H PHE 285 H PHE 19 0.394 -10.641 -0.837 161 HA PHE 285 HA PHE 19 0.350 -12.966 -2.685 162 1HB PHE 285 1HB PHE 19 2.189 -10.848 -1.987 163 2HB PHE 285 2HB PHE 19 3.012 -12.329 -1.586 164 HD1 PHE 285 HD1 PHE 19 1.389 -10.478 -4.399 165 HD2 PHE 285 HD2 PHE 19 3.900 -13.803 -3.348 166 HE1 PHE 285 HE1 PHE 19 2.076 -10.704 -6.749 167 HE2 PHE 285 HE2 PHE 19 4.589 -14.019 -5.705 168 HZ PHE 285 HZ PHE 19 3.682 -12.467 -7.411 169 H ILE 286 H ILE 20 2.516 -12.667 -0.090 170 HA ILE 286 HA ILE 20 2.675 -15.531 0.411 171 HB ILE 286 HB ILE 20 3.409 -13.690 2.676 172 1HG1 ILE 286 1HG1 ILE 20 4.600 -13.193 -0.099 173 2HG1 ILE 286 2HG1 ILE 20 3.989 -12.020 1.047 174 1HG2 ILE 286 2HG2 ILE 20 4.298 -16.079 2.634 175 2HG2 ILE 286 3HG2 ILE 20 5.125 -15.751 1.092 176 3HG2 ILE 286 1HG2 ILE 20 5.622 -14.943 2.595 177 1HD1 ILE 286 2HD1 ILE 20 5.928 -12.441 2.622 178 2HD1 ILE 286 3HD1 ILE 20 6.645 -13.538 1.413 179 3HD1 ILE 286 1HD1 ILE 20 6.415 -11.824 1.026 180 H GLY 287 H GLY 21 0.408 -13.207 1.471 181 1HA GLY 287 1HA GLY 21 -0.536 -14.774 3.833 182 2HA GLY 287 2HA GLY 21 -1.417 -13.453 3.038 183 H SER 288 H SER 22 -1.317 -14.498 0.449 184 HA SER 288 HA SER 22 -1.968 -16.592 -0.762 185 1HB SER 288 1HB SER 22 -2.516 -17.932 1.341 186 2HB SER 288 2HB SER 22 -4.043 -17.076 1.486 187 HG SER 288 HG SER 22 -3.455 -18.237 -1.009 188 1HN NH2 289 1HXT SER 22 -4.939 -15.245 1.091 189 2HN NH2 289 2HXT SER 22 -5.645 -14.444 -0.339 No H/Q in entry = 189 Start of MODEL 10 1 1H ACE 266 1H1 MET 1 -2.522 20.163 -0.218 2 2H ACE 266 2H1 MET 1 -2.564 18.603 -1.072 3 3H ACE 266 3H1 MET 1 -1.953 18.687 0.597 4 H VAL 267 H VAL 1 1.142 18.547 -1.599 5 HA VAL 267 HA VAL 1 -0.752 17.139 0.249 6 HB VAL 267 HB VAL 1 -1.516 17.707 -2.376 7 1HG1 VAL 267 1HG2 VAL 1 -0.464 14.796 -2.574 8 2HG1 VAL 267 2HG2 VAL 1 -1.542 15.594 -3.748 9 3HG1 VAL 267 3HG2 VAL 1 0.097 16.184 -3.538 10 1HG2 VAL 267 2HG1 VAL 1 -3.069 16.785 -0.595 11 2HG2 VAL 267 3HG1 VAL 1 -3.327 16.014 -2.164 12 3HG2 VAL 267 1HG1 VAL 1 -2.436 15.147 -0.887 13 H GLU 268 H GLU 2 0.105 15.625 1.249 14 HA GLU 268 HA GLU 2 1.998 13.762 -0.200 15 1HB GLU 268 2HB GLU 2 3.895 14.114 1.226 16 2HB GLU 268 1HB GLU 2 3.368 15.722 0.787 17 1HG GLU 268 1HG GLU 2 1.982 15.457 3.189 18 2HG GLU 268 2HG GLU 2 3.320 14.389 3.526 19 H GLU 269 H GLU 3 -0.683 13.817 1.147 20 HA GLU 269 HA GLU 3 -0.136 11.602 3.136 21 1HB GLU 269 1HB GLU 3 -2.759 13.126 2.617 22 2HB GLU 269 2HB GLU 3 -2.412 12.139 4.016 23 1HG GLU 269 2HG GLU 3 -0.440 14.359 3.869 24 2HG GLU 269 1HG GLU 3 -2.051 15.006 3.690 25 H LYS 270 H LYS 4 -1.949 12.583 0.469 26 HA LYS 270 HA LYS 4 -3.409 10.022 0.025 27 1HB LYS 270 1HB LYS 4 -2.754 12.423 -1.808 28 2HB LYS 270 2HB LYS 4 -3.597 11.015 -2.438 29 1HG LYS 270 1HG LYS 4 -4.910 11.862 0.076 30 2HG LYS 270 2HG LYS 4 -4.696 13.272 -0.959 31 1HD LYS 270 1HD LYS 4 -6.742 12.537 -1.763 32 2HD LYS 270 2HD LYS 4 -5.731 11.514 -2.803 33 1HE LYS 270 1HE LYS 4 -6.175 10.339 -0.058 34 2HE LYS 270 2HE LYS 4 -7.672 10.520 -0.985 35 1HZ LYS 270 2HZ LYS 4 -6.181 9.548 -2.899 36 2HZ LYS 270 3HZ LYS 4 -5.302 8.915 -1.612 37 3HZ LYS 270 1HZ LYS 4 -6.935 8.546 -1.778 38 H SER 271 H SER 5 -0.384 11.371 -1.061 39 HA SER 271 HA SER 5 0.278 9.279 -2.979 40 1HB SER 271 2HB SER 5 1.794 11.444 -1.544 41 2HB SER 271 1HB SER 5 2.774 10.030 -1.900 42 HG SER 271 HG SER 5 1.165 11.387 -3.829 43 H ILE 272 H ILE 6 0.759 9.498 0.493 44 HA ILE 272 HA ILE 6 2.320 7.030 0.627 45 HB ILE 272 HB ILE 6 0.481 8.019 2.874 46 1HG1 ILE 272 2HG1 ILE 6 2.519 9.681 1.706 47 2HG1 ILE 272 1HG1 ILE 6 1.599 9.995 3.166 48 1HG2 ILE 272 2HG2 ILE 6 1.690 5.853 3.411 49 2HG2 ILE 272 3HG2 ILE 6 3.258 6.622 3.065 50 3HG2 ILE 272 1HG2 ILE 6 2.270 7.127 4.452 51 1HD1 ILE 272 2HD1 ILE 6 3.469 8.710 4.464 52 2HD1 ILE 272 3HD1 ILE 6 4.366 8.582 2.929 53 3HD1 ILE 272 1HD1 ILE 6 4.027 10.176 3.625 54 H ASP 273 H ASP 7 -0.913 7.542 0.196 55 HA ASP 273 HA ASP 7 -1.757 4.874 1.229 56 1HB ASP 273 1HB ASP 7 -3.104 7.350 0.151 57 2HB ASP 273 2HB ASP 7 -3.770 5.938 -0.636 58 H LEU 274 H LEU 8 -0.689 6.185 -1.628 59 HA LEU 274 HA LEU 8 -1.466 3.774 -3.249 60 1HB LEU 274 2HB LEU 8 -1.005 6.310 -4.090 61 2HB LEU 274 1HB LEU 8 0.686 5.833 -4.035 62 HG LEU 274 HG LEU 8 -0.620 5.762 -6.325 63 1HD1 LEU 274 3HD2 LEU 8 1.743 4.816 -5.908 64 2HD1 LEU 274 1HD2 LEU 8 1.015 3.241 -5.577 65 3HD1 LEU 274 2HD2 LEU 8 0.844 3.975 -7.196 66 1HD2 LEU 274 2HD1 LEU 8 -2.566 4.396 -5.422 67 2HD2 LEU 274 3HD1 LEU 8 -1.799 3.626 -6.832 68 3HD2 LEU 274 1HD1 LEU 8 -1.475 3.017 -5.191 69 H ILE 275 H ILE 9 1.026 4.598 -1.259 70 HA ILE 275 HA ILE 9 2.438 2.028 -2.124 71 HB ILE 275 HB ILE 9 3.976 4.271 -0.755 72 1HG1 ILE 275 2HG1 ILE 9 2.751 4.517 -3.450 73 2HG1 ILE 275 1HG1 ILE 9 3.593 5.719 -2.501 74 1HG2 ILE 275 2HG2 ILE 9 5.233 2.099 -1.041 75 2HG2 ILE 275 3HG2 ILE 9 4.907 2.118 -2.791 76 3HG2 ILE 275 1HG2 ILE 9 5.957 3.336 -2.036 77 1HD1 ILE 275 2HD1 ILE 9 5.828 4.710 -3.455 78 2HD1 ILE 275 3HD1 ILE 9 4.831 3.621 -4.454 79 3HD1 ILE 275 1HD1 ILE 9 4.733 5.374 -4.689 80 H GLN 276 H GLN 10 0.402 2.918 -0.008 81 HA GLN 276 HA GLN 10 1.705 1.455 2.343 82 1HB GLN 276 1HB GLN 10 0.810 3.388 3.340 83 2HB GLN 276 2HB GLN 10 -0.240 3.723 1.964 84 1HG GLN 276 1HG GLN 10 -2.052 3.099 3.215 85 2HG GLN 276 2HG GLN 10 -1.484 1.450 3.272 86 1HE2 GLN 276 2HE2 GLN 10 -0.105 3.138 6.643 87 2HE2 GLN 276 1HE2 GLN 10 0.614 3.536 4.986 88 H LYS 277 H LYS 11 -1.161 1.919 0.384 89 HA LYS 277 HA LYS 11 -2.388 -0.659 0.983 90 1HB LYS 277 1HB LYS 11 -2.335 1.399 -1.374 91 2HB LYS 277 2HB LYS 11 -2.794 -0.213 -1.901 92 1HG LYS 277 1HG LYS 11 -4.835 0.292 0.111 93 2HG LYS 277 2HG LYS 11 -4.438 1.901 -0.487 94 1HD LYS 277 1HD LYS 11 -5.244 1.394 -2.630 95 2HD LYS 277 2HD LYS 11 -4.805 -0.322 -2.531 96 1HE LYS 277 1HE LYS 11 -7.125 1.038 -0.975 97 2HE LYS 277 2HE LYS 11 -7.321 -0.076 -2.337 98 1HZ LYS 277 1HZ LYS 11 -5.653 -1.389 -0.565 99 2HZ LYS 277 2HZ LYS 11 -6.838 -0.677 0.393 100 3HZ LYS 277 3HZ LYS 11 -7.278 -1.703 -0.865 101 H TRP 278 H TRP 12 0.332 0.125 -0.704 102 HA TRP 278 HA TRP 12 0.574 -2.474 -2.164 103 1HB TRP 278 1HB TRP 12 2.386 0.007 -1.599 104 2HB TRP 278 2HB TRP 12 3.121 -1.407 -2.320 105 HD1 TRP 278 HD1 TRP 12 -0.452 -0.204 -3.377 106 HE1 TRP 278 HE1 TRP 12 -0.462 0.461 -5.954 107 HE3 TRP 278 HE3 TRP 12 4.579 -0.631 -4.105 108 HZ2 TRP 278 HZ2 TRP 12 1.602 0.717 -7.894 109 HZ3 TRP 278 HZ3 TRP 12 5.521 -0.142 -6.342 110 HH2 TRP 278 HH2 TRP 12 4.056 0.516 -8.213 111 H GLU 279 H GLU 13 1.431 -1.237 0.814 112 HA GLU 279 HA GLU 13 3.348 -3.398 1.551 113 1HB GLU 279 2HB GLU 13 3.746 -1.439 2.783 114 2HB GLU 279 1HB GLU 13 2.084 -0.929 2.706 115 1HG GLU 279 1HG GLU 13 1.830 -1.436 4.904 116 2HG GLU 279 2HG GLU 13 1.787 -3.118 4.461 117 H GLU 280 H GLU 14 0.094 -3.127 1.226 118 HA GLU 280 HA GLU 14 -0.479 -5.602 2.915 119 1HB GLU 280 1HB GLU 14 -2.099 -3.309 1.801 120 2HB GLU 280 2HB GLU 14 -2.881 -4.864 1.652 121 1HG GLU 280 1HG GLU 14 -1.839 -4.513 4.423 122 2HG GLU 280 2HG GLU 14 -2.809 -3.132 3.976 123 H LYS 281 H LYS 15 -0.291 -4.224 -0.244 124 HA LYS 281 HA LYS 15 -1.123 -6.416 -1.921 125 1HB LYS 281 1HB LYS 15 -0.399 -4.139 -2.776 126 2HB LYS 281 2HB LYS 15 1.254 -4.439 -2.261 127 1HG LYS 281 1HG LYS 15 1.688 -5.962 -4.065 128 2HG LYS 281 2HG LYS 15 0.000 -6.446 -4.213 129 1HD LYS 281 1HD LYS 15 1.034 -3.636 -4.949 130 2HD LYS 281 2HD LYS 15 1.068 -4.991 -6.094 131 1HE LYS 281 1HE LYS 15 -1.227 -4.925 -6.459 132 2HE LYS 281 2HE LYS 15 -1.598 -4.783 -4.734 133 1HZ LYS 281 1HZ LYS 15 -0.429 -2.499 -6.210 134 2HZ LYS 281 2HZ LYS 15 -2.084 -2.798 -6.225 135 3HZ LYS 281 3HZ LYS 15 -1.298 -2.494 -4.770 136 H SER 282 H SER 16 1.862 -5.767 -0.231 137 HA SER 282 HA SER 16 3.301 -8.138 -1.236 138 1HB SER 282 2HB SER 16 3.967 -5.883 0.367 139 2HB SER 282 1HB SER 16 3.940 -7.186 1.531 140 HG SER 282 HG SER 16 5.715 -6.778 -0.616 141 H ARG 283 H ARG 17 1.511 -7.360 1.517 142 HA ARG 283 HA ARG 17 1.631 -10.110 2.691 143 1HB ARG 283 2HB ARG 17 1.298 -8.099 4.125 144 2HB ARG 283 1HB ARG 17 -0.181 -7.684 3.281 145 1HG ARG 283 1HG ARG 17 -1.021 -10.137 4.163 146 2HG ARG 283 2HG ARG 17 0.249 -9.886 5.357 147 1HD ARG 283 1HD ARG 17 -1.185 -7.381 5.225 148 2HD ARG 283 2HD ARG 17 -2.428 -8.658 5.173 149 HE ARG 283 HE ARG 17 -0.231 -9.001 7.205 150 1HH1 ARG 283 2HH2 ARG 17 -3.519 -8.042 6.640 151 2HH1 ARG 283 1HH2 ARG 17 -3.951 -8.180 8.429 152 1HH2 ARG 283 2HH1 ARG 17 -0.770 -9.123 9.123 153 2HH2 ARG 283 1HH1 ARG 17 -2.461 -8.767 9.784 154 H GLU 284 H GLU 18 -0.004 -8.935 0.058 155 HA GLU 284 HA GLU 18 -2.378 -10.782 0.422 156 1HB GLU 284 1HB GLU 18 -1.503 -8.643 -1.557 157 2HB GLU 284 2HB GLU 18 -2.498 -9.921 -2.212 158 1HG GLU 284 1HG GLU 18 -3.444 -8.394 0.297 159 2HG GLU 284 2HG GLU 18 -3.611 -7.648 -1.272 160 H PHE 285 H PHE 19 0.649 -10.460 -1.253 161 HA PHE 285 HA PHE 19 0.485 -12.870 -2.928 162 1HB PHE 285 1HB PHE 19 2.364 -10.856 -2.598 163 2HB PHE 285 2HB PHE 19 3.127 -12.118 -1.673 164 HD1 PHE 285 HD2 PHE 19 1.251 -13.767 -4.221 165 HD2 PHE 285 HD1 PHE 19 4.828 -11.453 -3.662 166 HE1 PHE 285 HE2 PHE 19 2.229 -14.774 -6.248 167 HE2 PHE 285 HE1 PHE 19 5.796 -12.460 -5.687 168 HZ PHE 285 HZ PHE 19 4.505 -14.129 -6.982 169 H ILE 286 H ILE 20 2.679 -12.663 -0.348 170 HA ILE 286 HA ILE 20 2.658 -15.516 0.199 171 HB ILE 286 HB ILE 20 3.509 -13.688 2.436 172 1HG1 ILE 286 2HG1 ILE 20 4.759 -13.367 -0.337 173 2HG1 ILE 286 1HG1 ILE 20 4.176 -12.097 0.715 174 1HG2 ILE 286 2HG2 ILE 20 4.241 -16.128 2.442 175 2HG2 ILE 286 3HG2 ILE 20 5.086 -15.885 0.894 176 3HG2 ILE 286 1HG2 ILE 20 5.635 -15.080 2.380 177 1HD1 ILE 286 2HD1 ILE 20 6.180 -12.695 2.309 178 2HD1 ILE 286 3HD1 ILE 20 6.740 -13.837 1.060 179 3HD1 ILE 286 1HD1 ILE 20 6.652 -12.105 0.699 180 H GLY 287 H GLY 21 0.553 -13.038 1.272 181 1HA GLY 287 1HA GLY 21 -0.462 -14.479 3.665 182 2HA GLY 287 2HA GLY 21 -1.311 -13.181 2.800 183 H SER 288 H SER 22 -1.325 -14.273 0.281 184 HA SER 288 HA SER 22 -2.789 -15.594 -1.045 185 1HB SER 288 1HB SER 22 -0.958 -17.314 0.001 186 2HB SER 288 2HB SER 22 -2.368 -18.024 0.771 187 HG SER 288 HG SER 22 -3.281 -18.354 -1.269 188 1HN NH2 289 1HXT SER 22 -4.647 -14.172 -0.433 189 2HN NH2 289 2HXT SER 22 -5.961 -14.904 0.526 No H/Q in entry = 189
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