NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
579937 | 2msu | 25131 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 339 HT1 SER 339 1.374 2.050 6.280 2 H2 SER 339 HT2 SER 339 0.824 1.123 4.967 3 H3 SER 339 HT3 SER 339 -0.220 2.226 5.728 4 HA SER 339 HA SER 339 0.508 3.938 4.533 5 HB2 SER 339 HB2 SER 339 2.527 4.166 5.824 6 HB3 SER 339 HB1 SER 339 3.249 2.758 5.051 7 HG SER 339 HG SER 339 2.385 4.697 3.307 8 H ASP 340 HN ASP 340 2.693 1.261 3.557 9 HA ASP 340 HA ASP 340 1.218 0.864 1.072 10 HB2 ASP 340 HB2 ASP 340 3.196 1.459 -0.381 11 HB3 ASP 340 HB1 ASP 340 2.418 2.845 0.385 12 H LYS 341 HN LYS 341 2.550 -0.727 -0.365 13 HA LYS 341 HA LYS 341 4.613 -2.278 0.881 14 HB2 LYS 341 HB2 LYS 341 3.488 -4.095 1.781 15 HB3 LYS 341 HB1 LYS 341 2.316 -2.819 2.080 16 HG2 LYS 341 HG2 LYS 341 0.930 -4.387 1.090 17 HG3 LYS 341 HG1 LYS 341 1.436 -3.483 -0.318 18 HD2 LYS 341 HD2 LYS 341 1.990 -5.560 -1.147 19 HD3 LYS 341 HD1 LYS 341 3.464 -5.316 -0.211 20 HE2 LYS 341 HE2 LYS 341 2.782 -7.403 0.569 21 HE3 LYS 341 HE1 LYS 341 2.022 -6.337 1.750 22 HZ1 LYS 341 HZ1 LYS 341 -0.038 -6.644 0.850 23 HZ2 LYS 341 HZ2 LYS 341 0.646 -8.167 0.534 24 HZ3 LYS 341 HZ3 LYS 341 0.554 -7.001 -0.698 25 H GLU 342 HN GLU 342 2.270 -1.844 -1.536 26 HA GLU 342 HA GLU 342 2.643 -3.838 -3.391 27 HB2 GLU 342 HB2 GLU 342 2.796 -1.597 -5.041 28 HB3 GLU 342 HB1 GLU 342 1.297 -2.315 -4.447 29 HG2 GLU 342 HG2 GLU 342 1.201 -0.822 -2.605 30 HG3 GLU 342 HG1 GLU 342 2.854 -0.284 -2.865 31 H VAL 343 HN VAL 343 4.467 -0.895 -4.044 32 HA VAL 343 HA VAL 343 6.797 -2.553 -4.817 33 HB VAL 343 HB VAL 343 5.784 -0.521 -6.177 34 HG11 VAL 343 HG11 VAL 343 6.003 0.915 -4.052 35 HG12 VAL 343 HG12 VAL 343 6.576 1.635 -5.559 36 HG13 VAL 343 HG13 VAL 343 7.731 0.962 -4.402 37 HG21 VAL 343 HG21 VAL 343 8.133 0.075 -6.947 38 HG22 VAL 343 HG22 VAL 343 7.766 -1.650 -6.958 39 HG23 VAL 343 HG23 VAL 343 8.737 -0.964 -5.656 40 H ASP 344 HN ASP 344 5.584 -1.255 -2.206 41 HA ASP 344 HA ASP 344 6.487 -1.003 -0.082 42 HB2 ASP 344 HB2 ASP 344 8.198 -2.648 -1.195 43 HB3 ASP 344 HB1 ASP 344 9.244 -1.261 -1.167 44 H GLU 345 HN GLU 345 8.462 0.344 0.905 45 HA GLU 345 HA GLU 345 8.021 3.091 -0.022 46 HB2 GLU 345 HB2 GLU 345 9.450 1.790 2.274 47 HB3 GLU 345 HB1 GLU 345 9.529 3.532 2.007 48 HG2 GLU 345 HG2 GLU 345 6.947 3.444 1.972 49 HG3 GLU 345 HG1 GLU 345 7.115 1.829 2.654 50 H VAL 346 HN VAL 346 9.968 4.522 -0.143 51 HA VAL 346 HA VAL 346 12.255 3.158 -1.498 52 HB VAL 346 HB VAL 346 10.766 5.690 -2.162 53 HG11 VAL 346 HG11 VAL 346 13.640 5.019 -2.793 54 HG12 VAL 346 HG12 VAL 346 12.990 6.503 -2.096 55 HG13 VAL 346 HG13 VAL 346 12.699 6.126 -3.795 56 HG21 VAL 346 HG21 VAL 346 10.845 4.751 -4.437 57 HG22 VAL 346 HG22 VAL 346 10.158 3.581 -3.311 58 HG23 VAL 346 HG23 VAL 346 11.826 3.405 -3.857 59 H ASP 347 HN ASP 347 11.253 4.686 1.105 60 HA ASP 347 HA ASP 347 13.748 6.229 1.571 61 HB2 ASP 347 HB2 ASP 347 11.201 6.782 2.209 62 HB3 ASP 347 HB1 ASP 347 11.612 5.868 3.652 63 H ALA 348 HN ALA 348 13.257 3.288 1.455 64 HA ALA 348 HA ALA 348 14.855 2.579 3.877 65 HB1 ALA 348 HB1 ALA 348 12.884 0.695 2.587 66 HB2 ALA 348 HB2 ALA 348 12.358 1.829 3.834 67 HB3 ALA 348 HB3 ALA 348 13.595 0.618 4.200 68 H ALA 349 HN ALA 349 14.360 2.842 0.634 69 HA ALA 349 HA ALA 349 15.954 0.629 -0.366 70 HB1 ALA 349 HB1 ALA 349 15.895 2.182 -2.453 71 HB2 ALA 349 HB2 ALA 349 14.784 3.168 -1.488 72 HB3 ALA 349 HB3 ALA 349 14.372 1.495 -1.886 73 H LEU 350 HN LEU 350 16.390 3.939 0.624 74 HA LEU 350 HA LEU 350 19.053 4.294 -0.405 75 HB2 LEU 350 HB2 LEU 350 18.902 6.401 0.572 76 HB3 LEU 350 HB1 LEU 350 17.201 5.977 0.365 77 HG LEU 350 HG LEU 350 18.721 5.534 2.929 78 HD11 LEU 350 HD11 LEU 350 18.447 7.940 2.267 79 HD12 LEU 350 HD12 LEU 350 17.620 7.500 3.761 80 HD13 LEU 350 HD13 LEU 350 16.706 7.669 2.262 81 HD21 LEU 350 HD21 LEU 350 16.827 4.026 2.645 82 HD22 LEU 350 HD22 LEU 350 15.831 5.377 2.127 83 HD23 LEU 350 HD23 LEU 350 16.382 5.289 3.796 84 H SER 351 HN SER 351 17.735 2.428 1.993 85 HA SER 351 HA SER 351 20.336 2.233 3.495 86 HB2 SER 351 HB2 SER 351 18.327 2.975 4.840 87 HB3 SER 351 HB1 SER 351 17.582 1.435 4.419 88 HG SER 351 HG SER 351 18.645 0.670 6.059 89 H ASP 352 HN ASP 352 19.166 1.074 1.049 90 HA ASP 352 HA ASP 352 19.413 -1.822 1.687 91 HB2 ASP 352 HB2 ASP 352 17.215 -0.734 0.996 92 HB3 ASP 352 HB1 ASP 352 17.949 -0.497 -0.561 93 H LEU 353 HN LEU 353 20.987 0.564 0.666 94 HA LEU 353 HA LEU 353 22.232 -0.671 -1.749 95 HB2 LEU 353 HB2 LEU 353 21.255 1.332 -2.388 96 HB3 LEU 353 HB1 LEU 353 21.447 2.015 -0.776 97 HG LEU 353 HG LEU 353 23.890 2.175 -1.199 98 HD11 LEU 353 HD11 LEU 353 23.024 1.279 -3.947 99 HD12 LEU 353 HD12 LEU 353 24.090 0.405 -2.849 100 HD13 LEU 353 HD13 LEU 353 24.622 1.926 -3.569 101 HD21 LEU 353 HD21 LEU 353 22.032 3.495 -3.131 102 HD22 LEU 353 HD22 LEU 353 23.673 4.041 -2.779 103 HD23 LEU 353 HD23 LEU 353 22.446 4.041 -1.505 104 H GLU 354 HN GLU 354 22.845 1.657 0.782 105 HA GLU 354 HA GLU 354 25.598 1.369 1.043 106 HB2 GLU 354 HB2 GLU 354 25.208 2.323 3.303 107 HB3 GLU 354 HB1 GLU 354 24.370 3.196 2.028 108 HG2 GLU 354 HG2 GLU 354 22.359 1.769 2.479 109 HG3 GLU 354 HG1 GLU 354 23.211 1.123 3.873 110 H ILE 355 HN ILE 355 22.984 -0.343 2.332 111 HA ILE 355 HA ILE 355 24.353 -1.835 4.297 112 HB ILE 355 HB ILE 355 21.808 -1.270 3.758 113 HG12 ILE 355 HG12 ILE 355 21.202 -3.277 5.199 114 HG13 ILE 355 HG11 ILE 355 22.898 -3.696 4.997 115 HG21 ILE 355 HG21 ILE 355 20.580 -3.213 2.964 116 HG22 ILE 355 HG22 ILE 355 22.084 -4.004 2.544 117 HG23 ILE 355 HG23 ILE 355 21.612 -2.510 1.726 118 HD11 ILE 355 HD11 ILE 355 22.496 -0.903 5.880 119 HD12 ILE 355 HD12 ILE 355 23.606 -2.131 6.496 120 HD13 ILE 355 HD13 ILE 355 21.931 -2.113 7.037 121 H THR 356 HN THR 356 23.778 -2.154 1.046 122 HA THR 356 HA THR 356 24.936 -4.884 0.944 123 HB THR 356 HB THR 356 22.723 -4.744 0.073 124 HG1 THR 356 HG1 THR 356 24.762 -5.559 -1.305 125 HG21 THR 356 HG21 THR 356 23.813 -2.491 -1.617 126 HG22 THR 356 HG22 THR 356 22.648 -2.360 -0.301 127 HG23 THR 356 HG23 THR 356 22.203 -3.183 -1.792 128 H LEU 357 HN LEU 357 25.647 -1.724 0.255 129 HA LEU 357 HA LEU 357 27.694 -2.415 -1.802 130 HB2 LEU 357 HB2 LEU 357 26.146 -0.680 -2.572 131 HB3 LEU 357 HB1 LEU 357 26.361 0.220 -1.074 132 HG LEU 357 HG LEU 357 28.641 0.737 -1.621 133 HD11 LEU 357 HD11 LEU 357 29.505 -1.230 -2.604 134 HD12 LEU 357 HD12 LEU 357 29.487 -0.087 -3.943 135 HD13 LEU 357 HD13 LEU 357 28.217 -1.304 -3.802 136 HD21 LEU 357 HD21 LEU 357 26.999 2.184 -2.686 137 HD22 LEU 357 HD22 LEU 357 26.818 1.049 -4.024 138 HD23 LEU 357 HD23 LEU 357 28.335 1.923 -3.808 139 H GLU 358 HN GLU 358 27.081 -1.979 1.270 140 HA GLU 358 HA GLU 358 28.847 -0.383 2.596 141 HB2 GLU 358 HB2 GLU 358 29.104 -2.513 4.163 142 HB3 GLU 358 HB1 GLU 358 27.562 -1.689 4.027 143 HG2 GLU 358 HG2 GLU 358 27.325 -4.146 3.781 144 HG3 GLU 358 HG1 GLU 358 26.834 -3.288 2.319 Start of MODEL 2 1 H1 SER 339 HT1 SER 339 6.683 0.731 5.644 2 H2 SER 339 HT2 SER 339 6.817 1.518 7.144 3 H3 SER 339 HT3 SER 339 8.002 1.753 5.949 4 HA SER 339 HA SER 339 5.776 3.309 6.402 5 HB2 SER 339 HB2 SER 339 7.698 3.102 4.069 6 HB3 SER 339 HB1 SER 339 6.572 4.437 4.293 7 HG SER 339 HG SER 339 8.956 3.981 5.468 8 H ASP 340 HN ASP 340 6.006 2.973 3.045 9 HA ASP 340 HA ASP 340 3.202 2.216 2.847 10 HB2 ASP 340 HB2 ASP 340 5.166 2.317 0.551 11 HB3 ASP 340 HB1 ASP 340 3.427 2.616 0.516 12 H LYS 341 HN LYS 341 2.854 0.461 0.902 13 HA LYS 341 HA LYS 341 4.630 -1.781 0.897 14 HB2 LYS 341 HB2 LYS 341 3.737 -3.237 2.464 15 HB3 LYS 341 HB1 LYS 341 3.413 -1.699 3.251 16 HG2 LYS 341 HG2 LYS 341 1.312 -2.660 3.404 17 HG3 LYS 341 HG1 LYS 341 1.163 -1.816 1.882 18 HD2 LYS 341 HD2 LYS 341 0.467 -3.867 1.094 19 HD3 LYS 341 HD1 LYS 341 2.197 -4.182 0.979 20 HE2 LYS 341 HE2 LYS 341 1.490 -6.029 2.211 21 HE3 LYS 341 HE1 LYS 341 1.920 -4.908 3.503 22 HZ1 LYS 341 HZ1 LYS 341 -0.573 -6.055 2.967 23 HZ2 LYS 341 HZ2 LYS 341 -0.712 -4.379 2.725 24 HZ3 LYS 341 HZ3 LYS 341 -0.158 -4.984 4.214 25 H GLU 342 HN GLU 342 1.596 -0.397 0.256 26 HA GLU 342 HA GLU 342 0.204 -2.216 -1.270 27 HB2 GLU 342 HB2 GLU 342 0.018 0.044 -2.891 28 HB3 GLU 342 HB1 GLU 342 -0.983 -0.267 -1.471 29 HG2 GLU 342 HG2 GLU 342 0.455 0.992 -0.065 30 HG3 GLU 342 HG1 GLU 342 1.717 1.047 -1.287 31 H VAL 343 HN VAL 343 2.082 0.124 -3.111 32 HA VAL 343 HA VAL 343 2.812 -1.971 -5.048 33 HB VAL 343 HB VAL 343 2.124 0.493 -5.562 34 HG11 VAL 343 HG11 VAL 343 3.836 2.142 -5.467 35 HG12 VAL 343 HG12 VAL 343 5.080 0.931 -5.133 36 HG13 VAL 343 HG13 VAL 343 3.881 1.329 -3.901 37 HG21 VAL 343 HG21 VAL 343 4.630 -0.655 -6.829 38 HG22 VAL 343 HG22 VAL 343 3.534 0.511 -7.571 39 HG23 VAL 343 HG23 VAL 343 2.983 -1.132 -7.245 40 H ASP 344 HN ASP 344 3.755 -1.489 -2.225 41 HA ASP 344 HA ASP 344 5.654 -2.300 -1.126 42 HB2 ASP 344 HB2 ASP 344 6.106 -3.322 -3.495 43 HB3 ASP 344 HB1 ASP 344 7.274 -2.040 -3.607 44 H GLU 345 HN GLU 345 8.137 -1.485 -1.086 45 HA GLU 345 HA GLU 345 7.998 1.501 -0.960 46 HB2 GLU 345 HB2 GLU 345 9.542 -0.523 0.651 47 HB3 GLU 345 HB1 GLU 345 9.680 1.219 0.845 48 HG2 GLU 345 HG2 GLU 345 7.099 1.153 1.179 49 HG3 GLU 345 HG1 GLU 345 7.331 -0.572 1.451 50 H VAL 346 HN VAL 346 10.005 2.581 -1.363 51 HA VAL 346 HA VAL 346 12.152 1.115 -2.717 52 HB VAL 346 HB VAL 346 10.345 3.090 -4.091 53 HG11 VAL 346 HG11 VAL 346 13.228 2.444 -4.701 54 HG12 VAL 346 HG12 VAL 346 12.473 4.029 -4.534 55 HG13 VAL 346 HG13 VAL 346 12.123 3.030 -5.947 56 HG21 VAL 346 HG21 VAL 346 9.798 0.748 -4.424 57 HG22 VAL 346 HG22 VAL 346 11.473 0.371 -4.826 58 HG23 VAL 346 HG23 VAL 346 10.507 1.368 -5.914 59 H ASP 347 HN ASP 347 11.103 3.480 -0.780 60 HA ASP 347 HA ASP 347 13.488 5.211 -1.135 61 HB2 ASP 347 HB2 ASP 347 10.927 5.850 -0.672 62 HB3 ASP 347 HB1 ASP 347 11.414 5.620 1.000 63 H ALA 348 HN ALA 348 13.138 2.459 -0.004 64 HA ALA 348 HA ALA 348 14.746 2.891 2.487 65 HB1 ALA 348 HB1 ALA 348 13.046 0.458 1.962 66 HB2 ALA 348 HB2 ALA 348 12.333 1.914 2.662 67 HB3 ALA 348 HB3 ALA 348 13.648 1.078 3.501 68 H ALA 349 HN ALA 349 14.351 1.784 -0.624 69 HA ALA 349 HA ALA 349 16.224 -0.425 -0.709 70 HB1 ALA 349 HB1 ALA 349 14.633 -0.321 -2.458 71 HB2 ALA 349 HB2 ALA 349 16.130 0.218 -3.218 72 HB3 ALA 349 HB3 ALA 349 14.914 1.404 -2.717 73 H LEU 350 HN LEU 350 16.351 3.036 -0.882 74 HA LEU 350 HA LEU 350 19.046 3.187 -1.959 75 HB2 LEU 350 HB2 LEU 350 18.637 5.468 -2.038 76 HB3 LEU 350 HB1 LEU 350 16.984 4.849 -2.001 77 HG LEU 350 HG LEU 350 18.468 5.691 0.481 78 HD11 LEU 350 HD11 LEU 350 18.139 7.563 -1.114 79 HD12 LEU 350 HD12 LEU 350 17.189 7.747 0.361 80 HD13 LEU 350 HD13 LEU 350 16.415 7.198 -1.126 81 HD21 LEU 350 HD21 LEU 350 16.211 5.637 1.440 82 HD22 LEU 350 HD22 LEU 350 16.606 4.059 0.744 83 HD23 LEU 350 HD23 LEU 350 15.577 5.185 -0.136 84 H SER 351 HN SER 351 17.666 2.414 0.972 85 HA SER 351 HA SER 351 20.160 3.133 2.488 86 HB2 SER 351 HB2 SER 351 18.228 4.191 3.515 87 HB3 SER 351 HB1 SER 351 17.321 2.683 3.431 88 HG SER 351 HG SER 351 19.510 2.083 4.688 89 H ASP 352 HN ASP 352 19.010 0.913 0.779 90 HA ASP 352 HA ASP 352 19.531 -1.464 2.497 91 HB2 ASP 352 HB2 ASP 352 17.428 -0.991 1.162 92 HB3 ASP 352 HB1 ASP 352 18.395 -1.183 -0.268 93 H LEU 353 HN LEU 353 20.988 0.607 0.780 94 HA LEU 353 HA LEU 353 22.693 -1.085 -0.900 95 HB2 LEU 353 HB2 LEU 353 21.719 0.725 -2.017 96 HB3 LEU 353 HB1 LEU 353 21.766 1.717 -0.557 97 HG LEU 353 HG LEU 353 24.374 0.841 -1.625 98 HD11 LEU 353 HD11 LEU 353 22.616 2.777 -3.066 99 HD12 LEU 353 HD12 LEU 353 23.404 1.338 -3.711 100 HD13 LEU 353 HD13 LEU 353 24.367 2.750 -3.268 101 HD21 LEU 353 HD21 LEU 353 25.063 2.458 -0.228 102 HD22 LEU 353 HD22 LEU 353 23.419 2.981 0.083 103 HD23 LEU 353 HD23 LEU 353 24.322 3.668 -1.253 104 H GLU 354 HN GLU 354 22.681 1.611 1.300 105 HA GLU 354 HA GLU 354 25.337 1.890 1.904 106 HB2 GLU 354 HB2 GLU 354 24.546 2.956 3.941 107 HB3 GLU 354 HB1 GLU 354 23.474 3.363 2.610 108 HG2 GLU 354 HG2 GLU 354 22.116 1.291 3.305 109 HG3 GLU 354 HG1 GLU 354 23.063 1.352 4.793 110 H ILE 355 HN ILE 355 23.009 -0.255 3.053 111 HA ILE 355 HA ILE 355 24.463 -1.433 5.229 112 HB ILE 355 HB ILE 355 22.444 -3.056 3.693 113 HG12 ILE 355 HG12 ILE 355 21.832 -0.532 5.217 114 HG13 ILE 355 HG11 ILE 355 21.501 -0.934 3.529 115 HG21 ILE 355 HG21 ILE 355 23.579 -3.725 5.829 116 HG22 ILE 355 HG22 ILE 355 21.819 -3.772 5.847 117 HG23 ILE 355 HG23 ILE 355 22.673 -2.429 6.615 118 HD11 ILE 355 HD11 ILE 355 20.048 -2.831 4.333 119 HD12 ILE 355 HD12 ILE 355 19.429 -1.255 4.809 120 HD13 ILE 355 HD13 ILE 355 20.276 -2.250 5.979 121 H THR 356 HN THR 356 24.624 -1.723 1.917 122 HA THR 356 HA THR 356 26.215 -4.218 2.174 123 HB THR 356 HB THR 356 24.070 -4.788 1.399 124 HG1 THR 356 HG1 THR 356 26.238 -5.073 -0.092 125 HG21 THR 356 HG21 THR 356 23.340 -2.555 0.799 126 HG22 THR 356 HG22 THR 356 23.111 -3.620 -0.592 127 HG23 THR 356 HG23 THR 356 24.486 -2.515 -0.544 128 H LEU 357 HN LEU 357 26.274 -1.115 1.130 129 HA LEU 357 HA LEU 357 28.288 -1.616 -1.013 130 HB2 LEU 357 HB2 LEU 357 26.502 -0.063 -1.638 131 HB3 LEU 357 HB1 LEU 357 26.753 0.861 -0.162 132 HG LEU 357 HG LEU 357 28.831 1.714 -0.926 133 HD11 LEU 357 HD11 LEU 357 29.929 -0.203 -1.820 134 HD12 LEU 357 HD12 LEU 357 29.755 0.897 -3.186 135 HD13 LEU 357 HD13 LEU 357 28.653 -0.468 -3.006 136 HD21 LEU 357 HD21 LEU 357 27.143 1.577 -3.430 137 HD22 LEU 357 HD22 LEU 357 28.230 2.875 -2.936 138 HD23 LEU 357 HD23 LEU 357 26.730 2.596 -2.050 139 H GLU 358 HN GLU 358 28.128 -1.735 1.978 140 HA GLU 358 HA GLU 358 30.180 0.157 2.892 141 HB2 GLU 358 HB2 GLU 358 29.742 -1.309 5.065 142 HB3 GLU 358 HB1 GLU 358 28.578 -0.094 4.557 143 HG2 GLU 358 HG2 GLU 358 27.524 -2.294 5.097 144 HG3 GLU 358 HG1 GLU 358 27.237 -1.780 3.434 Start of MODEL 3 1 H1 SER 339 HT1 SER 339 4.785 1.388 6.662 2 H2 SER 339 HT2 SER 339 4.550 0.718 5.118 3 H3 SER 339 HT3 SER 339 3.908 -0.054 6.489 4 HA SER 339 HA SER 339 2.127 1.286 6.608 5 HB2 SER 339 HB2 SER 339 2.237 3.696 6.077 6 HB3 SER 339 HB1 SER 339 3.520 3.236 7.193 7 HG SER 339 HG SER 339 4.512 2.842 4.827 8 H ASP 340 HN ASP 340 3.881 2.463 3.710 9 HA ASP 340 HA ASP 340 1.708 2.510 1.953 10 HB2 ASP 340 HB2 ASP 340 4.566 1.708 1.323 11 HB3 ASP 340 HB1 ASP 340 3.367 2.214 0.134 12 H LYS 341 HN LYS 341 4.048 -0.012 1.252 13 HA LYS 341 HA LYS 341 3.806 -2.288 0.914 14 HB2 LYS 341 HB2 LYS 341 2.669 -3.386 2.555 15 HB3 LYS 341 HB1 LYS 341 2.201 -1.796 3.130 16 HG2 LYS 341 HG2 LYS 341 0.128 -2.839 2.944 17 HG3 LYS 341 HG1 LYS 341 0.240 -2.049 1.393 18 HD2 LYS 341 HD2 LYS 341 -0.314 -4.166 0.641 19 HD3 LYS 341 HD1 LYS 341 1.436 -4.363 0.709 20 HE2 LYS 341 HE2 LYS 341 0.774 -6.220 1.937 21 HE3 LYS 341 HE1 LYS 341 0.912 -5.031 3.232 22 HZ1 LYS 341 HZ1 LYS 341 -1.394 -6.385 2.284 23 HZ2 LYS 341 HZ2 LYS 341 -1.612 -4.702 2.192 24 HZ3 LYS 341 HZ3 LYS 341 -1.208 -5.430 3.673 25 H GLU 342 HN GLU 342 1.304 -0.145 0.052 26 HA GLU 342 HA GLU 342 -0.266 -1.623 -1.718 27 HB2 GLU 342 HB2 GLU 342 0.112 0.724 -3.159 28 HB3 GLU 342 HB1 GLU 342 -1.068 0.521 -1.864 29 HG2 GLU 342 HG2 GLU 342 0.403 1.423 -0.242 30 HG3 GLU 342 HG1 GLU 342 1.784 1.304 -1.325 31 H VAL 343 HN VAL 343 2.222 0.452 -3.098 32 HA VAL 343 HA VAL 343 2.942 -1.714 -5.003 33 HB VAL 343 HB VAL 343 2.398 0.794 -5.628 34 HG11 VAL 343 HG11 VAL 343 4.211 2.327 -5.478 35 HG12 VAL 343 HG12 VAL 343 5.353 1.047 -5.054 36 HG13 VAL 343 HG13 VAL 343 4.127 1.557 -3.892 37 HG21 VAL 343 HG21 VAL 343 4.125 0.673 -7.479 38 HG22 VAL 343 HG22 VAL 343 3.131 -0.774 -7.313 39 HG23 VAL 343 HG23 VAL 343 4.778 -0.759 -6.682 40 H ASP 344 HN ASP 344 3.618 -1.028 -2.109 41 HA ASP 344 HA ASP 344 5.361 -1.736 -0.742 42 HB2 ASP 344 HB2 ASP 344 5.843 -3.155 -2.899 43 HB3 ASP 344 HB1 ASP 344 7.163 -2.046 -3.086 44 H GLU 345 HN GLU 345 7.895 -1.124 -0.609 45 HA GLU 345 HA GLU 345 8.039 1.835 -1.045 46 HB2 GLU 345 HB2 GLU 345 9.181 0.062 1.107 47 HB3 GLU 345 HB1 GLU 345 9.483 1.789 0.974 48 HG2 GLU 345 HG2 GLU 345 6.866 1.978 0.968 49 HG3 GLU 345 HG1 GLU 345 6.921 0.357 1.653 50 H VAL 346 HN VAL 346 10.185 2.655 -1.348 51 HA VAL 346 HA VAL 346 12.289 0.784 -2.198 52 HB VAL 346 HB VAL 346 10.814 2.671 -4.017 53 HG11 VAL 346 HG11 VAL 346 12.752 2.295 -5.649 54 HG12 VAL 346 HG12 VAL 346 13.697 1.808 -4.242 55 HG13 VAL 346 HG13 VAL 346 13.032 3.440 -4.337 56 HG21 VAL 346 HG21 VAL 346 11.030 0.727 -5.576 57 HG22 VAL 346 HG22 VAL 346 10.174 0.321 -4.089 58 HG23 VAL 346 HG23 VAL 346 11.857 -0.164 -4.298 59 H ASP 347 HN ASP 347 11.364 3.351 -0.581 60 HA ASP 347 HA ASP 347 13.795 4.974 -0.987 61 HB2 ASP 347 HB2 ASP 347 11.245 5.650 -0.424 62 HB3 ASP 347 HB1 ASP 347 11.837 5.497 1.224 63 H ALA 348 HN ALA 348 13.418 2.247 0.267 64 HA ALA 348 HA ALA 348 15.089 2.745 2.705 65 HB1 ALA 348 HB1 ALA 348 13.406 0.291 2.244 66 HB2 ALA 348 HB2 ALA 348 12.693 1.756 2.926 67 HB3 ALA 348 HB3 ALA 348 14.023 0.944 3.764 68 H ALA 349 HN ALA 349 14.753 1.629 -0.391 69 HA ALA 349 HA ALA 349 16.643 -0.582 -0.382 70 HB1 ALA 349 HB1 ALA 349 15.040 -0.591 -2.130 71 HB2 ALA 349 HB2 ALA 349 16.532 -0.071 -2.914 72 HB3 ALA 349 HB3 ALA 349 15.300 1.122 -2.476 73 H LEU 350 HN LEU 350 16.660 2.875 -0.923 74 HA LEU 350 HA LEU 350 19.340 3.049 -1.948 75 HB2 LEU 350 HB2 LEU 350 18.884 5.315 -2.070 76 HB3 LEU 350 HB1 LEU 350 17.243 4.675 -1.960 77 HG LEU 350 HG LEU 350 18.802 5.593 0.447 78 HD11 LEU 350 HD11 LEU 350 18.360 7.415 -1.210 79 HD12 LEU 350 HD12 LEU 350 17.536 7.639 0.334 80 HD13 LEU 350 HD13 LEU 350 16.643 7.045 -1.067 81 HD21 LEU 350 HD21 LEU 350 15.894 5.058 -0.038 82 HD22 LEU 350 HD22 LEU 350 16.603 5.512 1.506 83 HD23 LEU 350 HD23 LEU 350 16.965 3.936 0.793 84 H SER 351 HN SER 351 18.041 2.266 1.003 85 HA SER 351 HA SER 351 20.532 3.058 2.494 86 HB2 SER 351 HB2 SER 351 18.363 4.022 3.353 87 HB3 SER 351 HB1 SER 351 17.819 2.365 3.601 88 HG SER 351 HG SER 351 20.077 3.627 4.778 89 H ASP 352 HN ASP 352 19.694 0.834 0.753 90 HA ASP 352 HA ASP 352 20.219 -1.466 2.570 91 HB2 ASP 352 HB2 ASP 352 17.967 -1.061 1.435 92 HB3 ASP 352 HB1 ASP 352 18.781 -1.421 -0.056 93 H LEU 353 HN LEU 353 21.592 0.459 0.675 94 HA LEU 353 HA LEU 353 23.133 -1.492 -0.974 95 HB2 LEU 353 HB2 LEU 353 21.998 -0.078 -2.417 96 HB3 LEU 353 HB1 LEU 353 21.988 1.226 -1.234 97 HG LEU 353 HG LEU 353 24.428 1.520 -1.633 98 HD11 LEU 353 HD11 LEU 353 25.440 0.410 -3.545 99 HD12 LEU 353 HD12 LEU 353 23.910 -0.394 -3.908 100 HD13 LEU 353 HD13 LEU 353 24.796 -0.806 -2.442 101 HD21 LEU 353 HD21 LEU 353 24.109 2.554 -3.832 102 HD22 LEU 353 HD22 LEU 353 22.793 2.889 -2.700 103 HD23 LEU 353 HD23 LEU 353 22.580 1.685 -3.976 104 H GLU 354 HN GLU 354 23.297 1.726 0.366 105 HA GLU 354 HA GLU 354 26.038 1.962 0.766 106 HB2 GLU 354 HB2 GLU 354 25.368 3.685 2.426 107 HB3 GLU 354 HB1 GLU 354 24.525 3.836 0.891 108 HG2 GLU 354 HG2 GLU 354 22.670 2.467 1.844 109 HG3 GLU 354 HG1 GLU 354 23.492 2.525 3.396 110 H ILE 355 HN ILE 355 23.589 0.503 2.547 111 HA ILE 355 HA ILE 355 24.977 0.177 5.001 112 HB ILE 355 HB ILE 355 22.430 0.157 4.263 113 HG12 ILE 355 HG12 ILE 355 21.982 -1.176 6.397 114 HG13 ILE 355 HG11 ILE 355 23.729 -1.383 6.390 115 HG21 ILE 355 HG21 ILE 355 21.452 -2.067 4.319 116 HG22 ILE 355 HG22 ILE 355 23.050 -2.783 4.278 117 HG23 ILE 355 HG23 ILE 355 22.477 -1.818 2.914 118 HD11 ILE 355 HD11 ILE 355 23.966 0.623 7.410 119 HD12 ILE 355 HD12 ILE 355 22.226 0.880 7.333 120 HD13 ILE 355 HD13 ILE 355 23.252 1.411 5.997 121 H THR 356 HN THR 356 24.762 -1.451 2.135 122 HA THR 356 HA THR 356 26.157 -3.854 3.193 123 HB THR 356 HB THR 356 23.988 -4.371 2.361 124 HG1 THR 356 HG1 THR 356 26.232 -5.285 1.228 125 HG21 THR 356 HG21 THR 356 23.644 -2.369 1.046 126 HG22 THR 356 HG22 THR 356 23.374 -3.774 0.018 127 HG23 THR 356 HG23 THR 356 24.877 -2.868 -0.110 128 H LEU 357 HN LEU 357 26.560 -1.244 1.147 129 HA LEU 357 HA LEU 357 28.606 -2.578 -0.548 130 HB2 LEU 357 HB2 LEU 357 26.980 -1.157 -1.715 131 HB3 LEU 357 HB1 LEU 357 27.322 0.172 -0.614 132 HG LEU 357 HG LEU 357 29.455 0.551 -1.555 133 HD11 LEU 357 HD11 LEU 357 29.144 -2.195 -2.778 134 HD12 LEU 357 HD12 LEU 357 30.398 -1.643 -1.668 135 HD13 LEU 357 HD13 LEU 357 30.371 -1.056 -3.330 136 HD21 LEU 357 HD21 LEU 357 29.021 0.814 -3.959 137 HD22 LEU 357 HD22 LEU 357 27.597 1.260 -3.018 138 HD23 LEU 357 HD23 LEU 357 27.659 -0.300 -3.839 139 H GLU 358 HN GLU 358 28.463 -1.803 2.303 140 HA GLU 358 HA GLU 358 30.781 0.037 2.584 141 HB2 GLU 358 HB2 GLU 358 29.942 -0.156 5.070 142 HB3 GLU 358 HB1 GLU 358 29.045 0.834 3.927 143 HG2 GLU 358 HG2 GLU 358 27.548 -0.643 5.224 144 HG3 GLU 358 HG1 GLU 358 27.513 -1.001 3.499 Start of MODEL 4 1 H1 SER 339 HT1 SER 339 1.829 -0.427 7.510 2 H2 SER 339 HT2 SER 339 1.022 -0.855 6.077 3 H3 SER 339 HT3 SER 339 0.887 0.723 6.692 4 HA SER 339 HA SER 339 2.468 1.186 5.183 5 HB2 SER 339 HB2 SER 339 4.761 0.842 6.157 6 HB3 SER 339 HB1 SER 339 3.614 1.557 7.286 7 HG SER 339 HG SER 339 3.768 -0.164 8.484 8 H ASP 340 HN ASP 340 1.250 -1.263 4.416 9 HA ASP 340 HA ASP 340 3.258 -3.273 3.842 10 HB2 ASP 340 HB2 ASP 340 0.602 -2.833 2.448 11 HB3 ASP 340 HB1 ASP 340 1.542 -4.324 2.486 12 H LYS 341 HN LYS 341 3.441 -3.915 1.359 13 HA LYS 341 HA LYS 341 4.602 -1.530 0.020 14 HB2 LYS 341 HB2 LYS 341 4.860 -4.517 -0.314 15 HB3 LYS 341 HB1 LYS 341 5.310 -3.448 -1.639 16 HG2 LYS 341 HG2 LYS 341 7.341 -3.622 -0.502 17 HG3 LYS 341 HG1 LYS 341 6.669 -2.168 0.214 18 HD2 LYS 341 HD2 LYS 341 7.310 -3.359 2.120 19 HD3 LYS 341 HD1 LYS 341 5.618 -3.828 1.968 20 HE2 LYS 341 HE2 LYS 341 6.541 -5.940 2.155 21 HE3 LYS 341 HE1 LYS 341 6.718 -5.734 0.413 22 HZ1 LYS 341 HZ1 LYS 341 8.953 -4.939 0.743 23 HZ2 LYS 341 HZ2 LYS 341 8.777 -6.459 1.480 24 HZ3 LYS 341 HZ3 LYS 341 8.788 -5.049 2.427 25 H GLU 342 HN GLU 342 3.380 -0.436 -1.181 26 HA GLU 342 HA GLU 342 1.245 -1.708 -2.856 27 HB2 GLU 342 HB2 GLU 342 0.946 1.057 -3.142 28 HB3 GLU 342 HB1 GLU 342 -0.001 0.052 -2.044 29 HG2 GLU 342 HG2 GLU 342 1.453 0.501 -0.222 30 HG3 GLU 342 HG1 GLU 342 2.665 1.213 -1.280 31 H VAL 343 HN VAL 343 2.934 1.330 -3.298 32 HA VAL 343 HA VAL 343 4.031 0.351 -5.873 33 HB VAL 343 HB VAL 343 2.984 2.747 -5.422 34 HG11 VAL 343 HG11 VAL 343 5.847 3.266 -4.603 35 HG12 VAL 343 HG12 VAL 343 4.559 3.022 -3.421 36 HG13 VAL 343 HG13 VAL 343 4.478 4.384 -4.543 37 HG21 VAL 343 HG21 VAL 343 3.992 2.176 -7.555 38 HG22 VAL 343 HG22 VAL 343 5.612 2.294 -6.866 39 HG23 VAL 343 HG23 VAL 343 4.625 3.744 -7.054 40 H ASP 344 HN ASP 344 4.532 -0.022 -2.873 41 HA ASP 344 HA ASP 344 6.339 -1.074 -1.825 42 HB2 ASP 344 HB2 ASP 344 7.345 -1.123 -4.199 43 HB3 ASP 344 HB1 ASP 344 8.209 0.291 -3.681 44 H GLU 345 HN GLU 345 8.520 -0.150 -0.855 45 HA GLU 345 HA GLU 345 7.848 2.526 0.290 46 HB2 GLU 345 HB2 GLU 345 9.486 0.204 1.292 47 HB3 GLU 345 HB1 GLU 345 9.341 1.740 2.139 48 HG2 GLU 345 HG2 GLU 345 6.761 1.306 1.942 49 HG3 GLU 345 HG1 GLU 345 7.239 -0.363 1.644 50 H VAL 346 HN VAL 346 9.722 3.855 0.838 51 HA VAL 346 HA VAL 346 12.084 3.451 -0.928 52 HB VAL 346 HB VAL 346 10.311 5.868 -0.649 53 HG11 VAL 346 HG11 VAL 346 12.426 6.822 -0.146 54 HG12 VAL 346 HG12 VAL 346 12.186 7.118 -1.870 55 HG13 VAL 346 HG13 VAL 346 13.251 5.816 -1.337 56 HG21 VAL 346 HG21 VAL 346 10.586 5.910 -3.116 57 HG22 VAL 346 HG22 VAL 346 9.942 4.366 -2.557 58 HG23 VAL 346 HG23 VAL 346 11.641 4.500 -3.010 59 H ASP 347 HN ASP 347 10.922 3.750 2.033 60 HA ASP 347 HA ASP 347 13.264 5.213 3.139 61 HB2 ASP 347 HB2 ASP 347 10.673 5.317 3.821 62 HB3 ASP 347 HB1 ASP 347 11.127 3.959 4.839 63 H ALA 348 HN ALA 348 13.031 2.519 1.917 64 HA ALA 348 HA ALA 348 14.654 1.067 3.957 65 HB1 ALA 348 HB1 ALA 348 12.823 -0.336 2.011 66 HB2 ALA 348 HB2 ALA 348 12.223 0.209 3.579 67 HB3 ALA 348 HB3 ALA 348 13.547 -0.961 3.494 68 H ALA 349 HN ALA 349 14.127 2.473 1.030 69 HA ALA 349 HA ALA 349 15.869 0.917 -0.688 70 HB1 ALA 349 HB1 ALA 349 14.238 2.202 -1.810 71 HB2 ALA 349 HB2 ALA 349 15.710 3.149 -2.025 72 HB3 ALA 349 HB3 ALA 349 14.530 3.614 -0.788 73 H LEU 350 HN LEU 350 16.069 3.662 1.453 74 HA LEU 350 HA LEU 350 18.702 4.541 0.732 75 HB2 LEU 350 HB2 LEU 350 18.408 6.086 2.453 76 HB3 LEU 350 HB1 LEU 350 16.743 5.676 2.032 77 HG LEU 350 HG LEU 350 18.261 4.362 4.278 78 HD11 LEU 350 HD11 LEU 350 16.109 6.464 4.403 79 HD12 LEU 350 HD12 LEU 350 17.827 6.806 4.602 80 HD13 LEU 350 HD13 LEU 350 16.994 5.771 5.762 81 HD21 LEU 350 HD21 LEU 350 15.919 3.671 4.888 82 HD22 LEU 350 HD22 LEU 350 16.497 2.955 3.382 83 HD23 LEU 350 HD23 LEU 350 15.406 4.332 3.342 84 H SER 351 HN SER 351 17.532 1.809 2.198 85 HA SER 351 HA SER 351 20.151 1.232 3.566 86 HB2 SER 351 HB2 SER 351 18.113 1.282 5.060 87 HB3 SER 351 HB1 SER 351 17.462 -0.026 4.076 88 HG SER 351 HG SER 351 18.528 -1.212 5.469 89 H ASP 352 HN ASP 352 19.054 1.008 0.846 90 HA ASP 352 HA ASP 352 19.506 -1.893 0.348 91 HB2 ASP 352 HB2 ASP 352 17.223 -0.775 0.089 92 HB3 ASP 352 HB1 ASP 352 17.919 0.069 -1.262 93 H LEU 353 HN LEU 353 20.890 0.800 0.339 94 HA LEU 353 HA LEU 353 22.178 0.689 -2.350 95 HB2 LEU 353 HB2 LEU 353 21.073 2.719 -2.160 96 HB3 LEU 353 HB1 LEU 353 21.248 2.723 -0.407 97 HG LEU 353 HG LEU 353 23.669 3.185 -0.705 98 HD11 LEU 353 HD11 LEU 353 24.446 3.858 -2.940 99 HD12 LEU 353 HD12 LEU 353 22.856 3.465 -3.599 100 HD13 LEU 353 HD13 LEU 353 23.879 2.187 -2.945 101 HD21 LEU 353 HD21 LEU 353 21.717 5.040 -1.998 102 HD22 LEU 353 HD22 LEU 353 23.324 5.501 -1.430 103 HD23 LEU 353 HD23 LEU 353 22.108 4.929 -0.280 104 H GLU 354 HN GLU 354 22.678 1.862 0.902 105 HA GLU 354 HA GLU 354 25.445 1.687 1.063 106 HB2 GLU 354 HB2 GLU 354 25.024 1.623 3.512 107 HB3 GLU 354 HB1 GLU 354 24.106 2.872 2.681 108 HG2 GLU 354 HG2 GLU 354 22.207 1.251 2.496 109 HG3 GLU 354 HG1 GLU 354 23.124 0.154 3.517 110 H ILE 355 HN ILE 355 22.984 -0.581 1.518 111 HA ILE 355 HA ILE 355 24.488 -2.635 2.735 112 HB ILE 355 HB ILE 355 21.902 -2.088 2.444 113 HG12 ILE 355 HG12 ILE 355 21.467 -4.545 2.938 114 HG13 ILE 355 HG11 ILE 355 23.184 -4.723 2.601 115 HG21 ILE 355 HG21 ILE 355 22.342 -4.062 0.224 116 HG22 ILE 355 HG22 ILE 355 21.751 -2.407 0.083 117 HG23 ILE 355 HG23 ILE 355 20.793 -3.621 0.919 118 HD11 ILE 355 HD11 ILE 355 22.147 -4.175 5.098 119 HD12 ILE 355 HD12 ILE 355 22.608 -2.564 4.538 120 HD13 ILE 355 HD13 ILE 355 23.809 -3.857 4.614 121 H THR 356 HN THR 356 23.887 -1.658 -0.375 122 HA THR 356 HA THR 356 25.237 -4.027 -1.550 123 HB THR 356 HB THR 356 23.004 -3.721 -2.319 124 HG1 THR 356 HG1 THR 356 25.142 -3.300 -3.985 125 HG21 THR 356 HG21 THR 356 23.882 -0.900 -2.950 126 HG22 THR 356 HG22 THR 356 22.744 -1.399 -1.701 127 HG23 THR 356 HG23 THR 356 22.324 -1.587 -3.400 128 H LEU 357 HN LEU 357 25.698 -0.814 -0.905 129 HA LEU 357 HA LEU 357 27.742 -0.457 -3.047 130 HB2 LEU 357 HB2 LEU 357 26.056 1.318 -3.068 131 HB3 LEU 357 HB1 LEU 357 26.229 1.547 -1.330 132 HG LEU 357 HG LEU 357 28.458 2.411 -1.590 133 HD11 LEU 357 HD11 LEU 357 28.137 1.414 -4.420 134 HD12 LEU 357 HD12 LEU 357 29.441 1.088 -3.283 135 HD13 LEU 357 HD13 LEU 357 29.312 2.673 -4.037 136 HD21 LEU 357 HD21 LEU 357 28.023 4.391 -2.994 137 HD22 LEU 357 HD22 LEU 357 26.602 3.987 -2.031 138 HD23 LEU 357 HD23 LEU 357 26.657 3.565 -3.742 139 H GLU 358 HN GLU 358 27.166 -1.342 -0.064 140 HA GLU 358 HA GLU 358 28.843 -0.289 1.808 141 HB2 GLU 358 HB2 GLU 358 29.285 -2.845 2.386 142 HB3 GLU 358 HB1 GLU 358 27.688 -2.149 2.585 143 HG2 GLU 358 HG2 GLU 358 27.614 -4.310 1.369 144 HG3 GLU 358 HG1 GLU 358 27.029 -2.975 0.374 Start of MODEL 5 1 H1 SER 339 HT1 SER 339 -0.894 -0.314 3.599 2 H2 SER 339 HT2 SER 339 -0.320 -1.757 2.909 3 H3 SER 339 HT3 SER 339 -1.955 -1.612 3.345 4 HA SER 339 HA SER 339 -2.046 -1.304 1.075 5 HB2 SER 339 HB2 SER 339 -1.630 1.445 2.286 6 HB3 SER 339 HB1 SER 339 -2.425 1.121 0.748 7 HG SER 339 HG SER 339 -3.353 0.866 3.312 8 H ASP 340 HN ASP 340 0.894 -0.127 2.523 9 HA ASP 340 HA ASP 340 2.090 0.817 0.046 10 HB2 ASP 340 HB2 ASP 340 3.575 -0.088 2.522 11 HB3 ASP 340 HB1 ASP 340 4.092 1.094 1.319 12 H LYS 341 HN LYS 341 4.632 -0.741 0.769 13 HA LYS 341 HA LYS 341 5.680 -2.700 0.183 14 HB2 LYS 341 HB2 LYS 341 3.048 -4.077 -0.123 15 HB3 LYS 341 HB1 LYS 341 4.591 -4.697 0.423 16 HG2 LYS 341 HG2 LYS 341 4.209 -2.790 2.323 17 HG3 LYS 341 HG1 LYS 341 2.542 -3.197 1.943 18 HD2 LYS 341 HD2 LYS 341 3.028 -5.579 2.370 19 HD3 LYS 341 HD1 LYS 341 4.707 -5.152 2.715 20 HE2 LYS 341 HE2 LYS 341 3.307 -5.419 4.786 21 HE3 LYS 341 HE1 LYS 341 4.029 -3.817 4.631 22 HZ1 LYS 341 HZ1 LYS 341 1.545 -4.008 5.203 23 HZ2 LYS 341 HZ2 LYS 341 1.339 -4.353 3.552 24 HZ3 LYS 341 HZ3 LYS 341 2.024 -2.875 4.035 25 H GLU 342 HN GLU 342 2.779 -2.085 -1.582 26 HA GLU 342 HA GLU 342 2.973 -3.331 -3.977 27 HB2 GLU 342 HB2 GLU 342 2.506 -0.755 -4.917 28 HB3 GLU 342 HB1 GLU 342 1.269 -1.833 -4.272 29 HG2 GLU 342 HG2 GLU 342 1.414 -0.878 -2.117 30 HG3 GLU 342 HG1 GLU 342 2.924 -0.060 -2.493 31 H VAL 343 HN VAL 343 4.310 -0.070 -4.021 32 HA VAL 343 HA VAL 343 6.559 -1.054 -5.693 33 HB VAL 343 HB VAL 343 5.034 1.041 -6.232 34 HG11 VAL 343 HG11 VAL 343 5.673 3.081 -5.187 35 HG12 VAL 343 HG12 VAL 343 7.133 2.358 -4.498 36 HG13 VAL 343 HG13 VAL 343 5.548 1.918 -3.862 37 HG21 VAL 343 HG21 VAL 343 7.050 0.376 -7.526 38 HG22 VAL 343 HG22 VAL 343 8.064 1.222 -6.357 39 HG23 VAL 343 HG23 VAL 343 6.934 2.128 -7.364 40 H ASP 344 HN ASP 344 5.800 -0.579 -2.638 41 HA ASP 344 HA ASP 344 7.090 -0.627 -0.718 42 HB2 ASP 344 HB2 ASP 344 8.609 -1.863 -2.446 43 HB3 ASP 344 HB1 ASP 344 9.568 -0.417 -2.352 44 H GLU 345 HN GLU 345 9.159 0.682 0.142 45 HA GLU 345 HA GLU 345 8.525 3.549 -0.352 46 HB2 GLU 345 HB2 GLU 345 9.859 2.049 1.892 47 HB3 GLU 345 HB1 GLU 345 9.747 3.807 1.838 48 HG2 GLU 345 HG2 GLU 345 7.182 3.378 1.521 49 HG3 GLU 345 HG1 GLU 345 7.543 1.770 2.140 50 H VAL 346 HN VAL 346 10.428 5.013 -0.182 51 HA VAL 346 HA VAL 346 12.837 3.837 -1.499 52 HB VAL 346 HB VAL 346 11.422 6.472 -1.855 53 HG11 VAL 346 HG11 VAL 346 14.325 5.836 -2.381 54 HG12 VAL 346 HG12 VAL 346 13.648 7.207 -1.503 55 HG13 VAL 346 HG13 VAL 346 13.477 7.112 -3.257 56 HG21 VAL 346 HG21 VAL 346 10.858 4.609 -3.373 57 HG22 VAL 346 HG22 VAL 346 12.560 4.439 -3.802 58 HG23 VAL 346 HG23 VAL 346 11.679 5.901 -4.247 59 H ASP 347 HN ASP 347 11.619 5.030 1.211 60 HA ASP 347 HA ASP 347 14.122 6.368 2.101 61 HB2 ASP 347 HB2 ASP 347 11.545 6.999 2.531 62 HB3 ASP 347 HB1 ASP 347 11.761 5.918 3.899 63 H ALA 348 HN ALA 348 13.519 3.518 1.565 64 HA ALA 348 HA ALA 348 14.840 2.410 3.996 65 HB1 ALA 348 HB1 ALA 348 13.421 0.520 4.005 66 HB2 ALA 348 HB2 ALA 348 12.802 0.865 2.389 67 HB3 ALA 348 HB3 ALA 348 12.309 1.869 3.755 68 H ALA 349 HN ALA 349 14.597 3.091 0.803 69 HA ALA 349 HA ALA 349 16.068 0.872 -0.366 70 HB1 ALA 349 HB1 ALA 349 16.240 2.631 -2.266 71 HB2 ALA 349 HB2 ALA 349 15.173 3.614 -1.248 72 HB3 ALA 349 HB3 ALA 349 14.632 2.039 -1.845 73 H LEU 350 HN LEU 350 16.652 4.044 0.958 74 HA LEU 350 HA LEU 350 19.390 4.322 0.161 75 HB2 LEU 350 HB2 LEU 350 19.316 6.288 1.415 76 HB3 LEU 350 HB1 LEU 350 17.617 6.027 1.018 77 HG LEU 350 HG LEU 350 18.885 5.155 3.610 78 HD11 LEU 350 HD11 LEU 350 17.809 7.061 4.605 79 HD12 LEU 350 HD12 LEU 350 17.041 7.475 3.072 80 HD13 LEU 350 HD13 LEU 350 18.787 7.633 3.253 81 HD21 LEU 350 HD21 LEU 350 16.405 5.042 4.225 82 HD22 LEU 350 HD22 LEU 350 16.974 3.787 3.125 83 HD23 LEU 350 HD23 LEU 350 16.088 5.170 2.499 84 H SER 351 HN SER 351 17.815 2.266 2.216 85 HA SER 351 HA SER 351 20.294 1.709 3.831 86 HB2 SER 351 HB2 SER 351 18.257 2.413 5.143 87 HB3 SER 351 HB1 SER 351 17.438 1.005 4.472 88 HG SER 351 HG SER 351 19.637 0.043 5.375 89 H ASP 352 HN ASP 352 19.256 0.951 1.192 90 HA ASP 352 HA ASP 352 19.336 -2.013 1.457 91 HB2 ASP 352 HB2 ASP 352 17.182 -0.737 0.872 92 HB3 ASP 352 HB1 ASP 352 17.964 -0.374 -0.639 93 H LEU 353 HN LEU 353 20.965 0.470 0.749 94 HA LEU 353 HA LEU 353 22.245 -0.507 -1.765 95 HB2 LEU 353 HB2 LEU 353 21.315 1.578 -2.184 96 HB3 LEU 353 HB1 LEU 353 21.490 2.064 -0.501 97 HG LEU 353 HG LEU 353 23.939 2.224 -0.855 98 HD11 LEU 353 HD11 LEU 353 24.767 2.179 -3.177 99 HD12 LEU 353 HD12 LEU 353 23.151 1.729 -3.728 100 HD13 LEU 353 HD13 LEU 353 24.076 0.623 -2.714 101 HD21 LEU 353 HD21 LEU 353 22.155 3.789 -2.671 102 HD22 LEU 353 HD22 LEU 353 23.792 4.261 -2.212 103 HD23 LEU 353 HD23 LEU 353 22.528 4.137 -0.981 104 H GLU 354 HN GLU 354 22.829 1.495 1.037 105 HA GLU 354 HA GLU 354 25.573 1.148 1.312 106 HB2 GLU 354 HB2 GLU 354 25.147 1.831 3.661 107 HB3 GLU 354 HB1 GLU 354 24.341 2.857 2.483 108 HG2 GLU 354 HG2 GLU 354 22.308 1.420 2.726 109 HG3 GLU 354 HG1 GLU 354 23.126 0.589 4.042 110 H ILE 355 HN ILE 355 22.921 -0.683 2.329 111 HA ILE 355 HA ILE 355 24.239 -2.413 4.128 112 HB ILE 355 HB ILE 355 21.712 -1.774 3.628 113 HG12 ILE 355 HG12 ILE 355 21.080 -3.966 4.765 114 HG13 ILE 355 HG11 ILE 355 22.784 -4.341 4.552 115 HG21 ILE 355 HG21 ILE 355 21.541 -2.723 1.443 116 HG22 ILE 355 HG22 ILE 355 20.483 -3.580 2.558 117 HG23 ILE 355 HG23 ILE 355 21.989 -4.316 2.053 118 HD11 ILE 355 HD11 ILE 355 22.648 -1.721 5.718 119 HD12 ILE 355 HD12 ILE 355 23.286 -3.202 6.440 120 HD13 ILE 355 HD13 ILE 355 21.586 -2.792 6.642 121 H THR 356 HN THR 356 23.749 -2.320 0.849 122 HA THR 356 HA THR 356 24.900 -5.024 0.436 123 HB THR 356 HB THR 356 22.701 -4.779 -0.443 124 HG1 THR 356 HG1 THR 356 24.804 -5.331 -1.925 125 HG21 THR 356 HG21 THR 356 23.808 -2.336 -1.835 126 HG22 THR 356 HG22 THR 356 22.630 -2.363 -0.525 127 HG23 THR 356 HG23 THR 356 22.200 -3.000 -2.107 128 H LEU 357 HN LEU 357 25.626 -1.806 0.136 129 HA LEU 357 HA LEU 357 27.692 -2.250 -1.969 130 HB2 LEU 357 HB2 LEU 357 26.165 -0.429 -2.542 131 HB3 LEU 357 HB1 LEU 357 26.349 0.277 -0.940 132 HG LEU 357 HG LEU 357 28.644 0.850 -1.377 133 HD11 LEU 357 HD11 LEU 357 29.514 -0.977 -2.599 134 HD12 LEU 357 HD12 LEU 357 29.519 0.333 -3.775 135 HD13 LEU 357 HD13 LEU 357 28.243 -0.885 -3.814 136 HD21 LEU 357 HD21 LEU 357 26.937 1.473 -3.807 137 HD22 LEU 357 HD22 LEU 357 28.373 2.367 -3.306 138 HD23 LEU 357 HD23 LEU 357 26.931 2.376 -2.292 139 H GLU 358 HN GLU 358 27.050 -2.194 1.127 140 HA GLU 358 HA GLU 358 28.811 -0.781 2.654 141 HB2 GLU 358 HB2 GLU 358 29.040 -3.097 3.948 142 HB3 GLU 358 HB1 GLU 358 27.511 -2.237 3.911 143 HG2 GLU 358 HG2 GLU 358 27.258 -4.651 3.356 144 HG3 GLU 358 HG1 GLU 358 26.752 -3.599 2.034 Start of MODEL 6 1 H1 SER 339 HT1 SER 339 0.567 -2.287 4.735 2 H2 SER 339 HT2 SER 339 1.574 -2.463 3.378 3 H3 SER 339 HT3 SER 339 0.107 -3.316 3.468 4 HA SER 339 HA SER 339 -0.630 -1.653 2.162 5 HB2 SER 339 HB2 SER 339 -1.787 -0.020 3.469 6 HB3 SER 339 HB1 SER 339 -1.694 -1.460 4.479 7 HG SER 339 HG SER 339 -1.062 0.375 5.646 8 H ASP 340 HN ASP 340 2.430 -1.491 2.849 9 HA ASP 340 HA ASP 340 2.953 1.382 2.611 10 HB2 ASP 340 HB2 ASP 340 4.800 -1.017 2.407 11 HB3 ASP 340 HB1 ASP 340 5.332 0.665 2.432 12 H LYS 341 HN LYS 341 1.880 -0.884 0.490 13 HA LYS 341 HA LYS 341 3.330 -0.781 -1.844 14 HB2 LYS 341 HB2 LYS 341 0.372 -0.312 -1.827 15 HB3 LYS 341 HB1 LYS 341 1.337 -1.219 -2.992 16 HG2 LYS 341 HG2 LYS 341 1.999 -2.608 -0.771 17 HG3 LYS 341 HG1 LYS 341 0.425 -2.007 -0.260 18 HD2 LYS 341 HD2 LYS 341 -0.602 -2.976 -2.281 19 HD3 LYS 341 HD1 LYS 341 0.996 -3.511 -2.815 20 HE2 LYS 341 HE2 LYS 341 -0.106 -5.402 -1.776 21 HE3 LYS 341 HE1 LYS 341 1.172 -4.855 -0.691 22 HZ1 LYS 341 HZ1 LYS 341 -1.472 -3.663 -0.363 23 HZ2 LYS 341 HZ2 LYS 341 -0.305 -4.056 0.807 24 HZ3 LYS 341 HZ3 LYS 341 -1.285 -5.272 0.137 25 H GLU 342 HN GLU 342 1.126 1.590 -0.657 26 HA GLU 342 HA GLU 342 0.837 3.501 -2.551 27 HB2 GLU 342 HB2 GLU 342 1.631 5.130 -0.424 28 HB3 GLU 342 HB1 GLU 342 0.006 4.489 -0.666 29 HG2 GLU 342 HG2 GLU 342 0.445 2.611 0.721 30 HG3 GLU 342 HG1 GLU 342 2.170 2.946 0.743 31 H VAL 343 HN VAL 343 3.506 4.145 -0.339 32 HA VAL 343 HA VAL 343 5.069 5.261 -2.573 33 HB VAL 343 HB VAL 343 4.851 6.282 -0.172 34 HG11 VAL 343 HG11 VAL 343 5.481 3.965 0.785 35 HG12 VAL 343 HG12 VAL 343 6.273 5.372 1.506 36 HG13 VAL 343 HG13 VAL 343 7.140 4.366 0.336 37 HG21 VAL 343 HG21 VAL 343 6.394 7.199 -1.829 38 HG22 VAL 343 HG22 VAL 343 7.535 5.887 -1.536 39 HG23 VAL 343 HG23 VAL 343 7.228 7.084 -0.279 40 H ASP 344 HN ASP 344 4.616 2.425 -1.064 41 HA ASP 344 HA ASP 344 5.648 0.374 -1.332 42 HB2 ASP 344 HB2 ASP 344 6.088 1.547 -3.612 43 HB3 ASP 344 HB1 ASP 344 7.727 1.652 -3.034 44 H GLU 345 HN GLU 345 8.244 -0.355 -1.441 45 HA GLU 345 HA GLU 345 9.582 1.015 0.846 46 HB2 GLU 345 HB2 GLU 345 9.296 -1.925 0.295 47 HB3 GLU 345 HB1 GLU 345 10.162 -1.226 1.657 48 HG2 GLU 345 HG2 GLU 345 7.879 -0.039 2.164 49 HG3 GLU 345 HG1 GLU 345 7.198 -1.288 1.125 50 H VAL 346 HN VAL 346 9.892 0.913 -2.175 51 HA VAL 346 HA VAL 346 12.451 -0.446 -2.571 52 HB VAL 346 HB VAL 346 10.645 1.242 -4.295 53 HG11 VAL 346 HG11 VAL 346 12.756 2.149 -4.885 54 HG12 VAL 346 HG12 VAL 346 12.432 0.921 -6.112 55 HG13 VAL 346 HG13 VAL 346 13.548 0.576 -4.788 56 HG21 VAL 346 HG21 VAL 346 10.568 -0.713 -5.686 57 HG22 VAL 346 HG22 VAL 346 10.387 -1.277 -4.026 58 HG23 VAL 346 HG23 VAL 346 11.938 -1.441 -4.847 59 H ASP 347 HN ASP 347 11.364 2.133 -1.121 60 HA ASP 347 HA ASP 347 13.657 3.899 -1.658 61 HB2 ASP 347 HB2 ASP 347 11.003 4.377 -1.237 62 HB3 ASP 347 HB1 ASP 347 11.592 4.522 0.417 63 H ALA 348 HN ALA 348 13.304 1.284 -0.193 64 HA ALA 348 HA ALA 348 14.804 2.004 2.298 65 HB1 ALA 348 HB1 ALA 348 13.200 -0.510 1.798 66 HB2 ALA 348 HB2 ALA 348 12.475 0.941 2.494 67 HB3 ALA 348 HB3 ALA 348 13.793 0.116 3.339 68 H ALA 349 HN ALA 349 14.702 0.657 -0.737 69 HA ALA 349 HA ALA 349 16.692 -1.443 -0.468 70 HB1 ALA 349 HB1 ALA 349 15.179 -1.651 -2.285 71 HB2 ALA 349 HB2 ALA 349 16.692 -1.136 -3.030 72 HB3 ALA 349 HB3 ALA 349 15.396 0.038 -2.754 73 H LEU 350 HN LEU 350 16.589 1.959 -1.312 74 HA LEU 350 HA LEU 350 19.314 2.171 -2.193 75 HB2 LEU 350 HB2 LEU 350 18.771 4.394 -2.533 76 HB3 LEU 350 HB1 LEU 350 17.152 3.698 -2.443 77 HG LEU 350 HG LEU 350 18.555 4.873 -0.054 78 HD11 LEU 350 HD11 LEU 350 18.166 6.546 -1.847 79 HD12 LEU 350 HD12 LEU 350 17.199 6.847 -0.403 80 HD13 LEU 350 HD13 LEU 350 16.459 6.109 -1.825 81 HD21 LEU 350 HD21 LEU 350 15.685 4.234 -0.621 82 HD22 LEU 350 HD22 LEU 350 16.330 4.787 0.918 83 HD23 LEU 350 HD23 LEU 350 16.739 3.177 0.313 84 H SER 351 HN SER 351 17.870 1.580 0.742 85 HA SER 351 HA SER 351 20.233 2.610 2.295 86 HB2 SER 351 HB2 SER 351 17.961 3.496 2.962 87 HB3 SER 351 HB1 SER 351 17.507 1.831 3.317 88 HG SER 351 HG SER 351 19.877 2.470 4.450 89 H ASP 352 HN ASP 352 19.606 0.230 0.683 90 HA ASP 352 HA ASP 352 20.214 -1.906 2.668 91 HB2 ASP 352 HB2 ASP 352 17.961 -1.699 1.441 92 HB3 ASP 352 HB1 ASP 352 18.842 -2.160 0.019 93 H LEU 353 HN LEU 353 21.500 -0.013 0.711 94 HA LEU 353 HA LEU 353 23.191 -1.913 -0.842 95 HB2 LEU 353 HB2 LEU 353 22.017 -0.573 -2.331 96 HB3 LEU 353 HB1 LEU 353 21.935 0.751 -1.173 97 HG LEU 353 HG LEU 353 24.367 1.131 -1.524 98 HD11 LEU 353 HD11 LEU 353 25.434 0.022 -3.442 99 HD12 LEU 353 HD12 LEU 353 23.960 -0.915 -3.707 100 HD13 LEU 353 HD13 LEU 353 24.909 -1.160 -2.242 101 HD21 LEU 353 HD21 LEU 353 22.715 2.411 -2.666 102 HD22 LEU 353 HD22 LEU 353 22.576 1.167 -3.916 103 HD23 LEU 353 HD23 LEU 353 24.068 2.097 -3.756 104 H GLU 354 HN GLU 354 23.148 1.331 0.454 105 HA GLU 354 HA GLU 354 25.859 1.716 0.911 106 HB2 GLU 354 HB2 GLU 354 25.066 3.420 2.536 107 HB3 GLU 354 HB1 GLU 354 24.244 3.506 0.985 108 HG2 GLU 354 HG2 GLU 354 22.455 2.033 1.931 109 HG3 GLU 354 HG1 GLU 354 23.241 2.187 3.496 110 H ILE 355 HN ILE 355 23.435 0.217 2.720 111 HA ILE 355 HA ILE 355 24.799 -0.047 5.175 112 HB ILE 355 HB ILE 355 22.271 -0.248 4.372 113 HG12 ILE 355 HG12 ILE 355 21.844 -1.572 6.502 114 HG13 ILE 355 HG11 ILE 355 23.598 -1.705 6.546 115 HG21 ILE 355 HG21 ILE 355 23.105 -3.132 4.420 116 HG22 ILE 355 HG22 ILE 355 22.491 -2.219 3.042 117 HG23 ILE 355 HG23 ILE 355 21.455 -2.537 4.425 118 HD11 ILE 355 HD11 ILE 355 22.665 1.073 6.161 119 HD12 ILE 355 HD12 ILE 355 23.877 0.435 7.276 120 HD13 ILE 355 HD13 ILE 355 22.171 0.357 7.700 121 H THR 356 HN THR 356 24.665 -1.762 2.343 122 HA THR 356 HA THR 356 26.251 -4.015 3.448 123 HB THR 356 HB THR 356 24.152 -4.690 2.546 124 HG1 THR 356 HG1 THR 356 24.896 -6.194 1.143 125 HG21 THR 356 HG21 THR 356 23.565 -4.164 0.189 126 HG22 THR 356 HG22 THR 356 25.012 -3.168 0.082 127 HG23 THR 356 HG23 THR 356 23.719 -2.732 1.197 128 H LEU 357 HN LEU 357 26.496 -1.346 1.516 129 HA LEU 357 HA LEU 357 28.814 -2.399 -0.037 130 HB2 LEU 357 HB2 LEU 357 27.108 -1.408 -1.478 131 HB3 LEU 357 HB1 LEU 357 27.013 0.017 -0.447 132 HG LEU 357 HG LEU 357 29.236 0.703 -1.069 133 HD11 LEU 357 HD11 LEU 357 30.482 -1.305 -1.196 134 HD12 LEU 357 HD12 LEU 357 30.424 -0.755 -2.868 135 HD13 LEU 357 HD13 LEU 357 29.346 -2.041 -2.322 136 HD21 LEU 357 HD21 LEU 357 28.926 1.093 -3.450 137 HD22 LEU 357 HD22 LEU 357 27.352 1.174 -2.659 138 HD23 LEU 357 HD23 LEU 357 27.811 -0.269 -3.563 139 H GLU 358 HN GLU 358 27.844 -0.896 2.582 140 HA GLU 358 HA GLU 358 29.257 1.366 3.180 141 HB2 GLU 358 HB2 GLU 358 29.592 0.156 5.507 142 HB3 GLU 358 HB1 GLU 358 27.978 0.566 4.955 143 HG2 GLU 358 HG2 GLU 358 28.122 -1.776 5.778 144 HG3 GLU 358 HG1 GLU 358 27.677 -1.695 4.072 Start of MODEL 7 1 H1 SER 339 HT1 SER 339 3.801 4.665 -2.339 2 H2 SER 339 HT2 SER 339 4.812 3.309 -2.174 3 H3 SER 339 HT3 SER 339 4.717 4.460 -0.927 4 HA SER 339 HA SER 339 2.235 3.874 -0.859 5 HB2 SER 339 HB2 SER 339 2.126 2.541 -2.867 6 HB3 SER 339 HB1 SER 339 3.470 1.537 -2.335 7 HG SER 339 HG SER 339 0.800 1.528 -1.575 8 H ASP 340 HN ASP 340 2.025 3.394 1.267 9 HA ASP 340 HA ASP 340 4.299 2.261 2.736 10 HB2 ASP 340 HB2 ASP 340 2.860 2.644 4.725 11 HB3 ASP 340 HB1 ASP 340 3.008 4.093 3.730 12 H LYS 341 HN LYS 341 4.536 0.153 3.171 13 HA LYS 341 HA LYS 341 4.126 -2.112 3.276 14 HB2 LYS 341 HB2 LYS 341 1.654 -0.866 4.490 15 HB3 LYS 341 HB1 LYS 341 1.858 -2.600 4.399 16 HG2 LYS 341 HG2 LYS 341 2.766 -2.208 6.497 17 HG3 LYS 341 HG1 LYS 341 4.198 -2.100 5.499 18 HD2 LYS 341 HD2 LYS 341 4.388 -0.157 6.781 19 HD3 LYS 341 HD1 LYS 341 3.586 0.452 5.336 20 HE2 LYS 341 HE2 LYS 341 2.169 1.332 6.945 21 HE3 LYS 341 HE1 LYS 341 1.400 -0.238 6.721 22 HZ1 LYS 341 HZ1 LYS 341 2.227 -1.034 8.673 23 HZ2 LYS 341 HZ2 LYS 341 2.054 0.605 9.087 24 HZ3 LYS 341 HZ3 LYS 341 3.580 -0.011 8.664 25 H GLU 342 HN GLU 342 1.884 -3.620 2.919 26 HA GLU 342 HA GLU 342 0.552 -4.616 1.323 27 HB2 GLU 342 HB2 GLU 342 0.575 -2.107 -0.311 28 HB3 GLU 342 HB1 GLU 342 -0.719 -3.270 -0.057 29 HG2 GLU 342 HG2 GLU 342 -0.390 -2.411 2.480 30 HG3 GLU 342 HG1 GLU 342 0.108 -0.978 1.626 31 H VAL 343 HN VAL 343 2.496 -2.249 -0.356 32 HA VAL 343 HA VAL 343 3.776 -4.422 -1.965 33 HB VAL 343 HB VAL 343 2.471 -2.267 -2.968 34 HG11 VAL 343 HG11 VAL 343 4.159 -0.778 -1.754 35 HG12 VAL 343 HG12 VAL 343 3.926 -0.447 -3.473 36 HG13 VAL 343 HG13 VAL 343 5.347 -1.340 -2.929 37 HG21 VAL 343 HG21 VAL 343 4.008 -2.476 -4.996 38 HG22 VAL 343 HG22 VAL 343 3.298 -3.984 -4.422 39 HG23 VAL 343 HG23 VAL 343 4.973 -3.595 -4.034 40 H ASP 344 HN ASP 344 4.171 -2.871 0.679 41 HA ASP 344 HA ASP 344 6.030 -2.730 2.065 42 HB2 ASP 344 HB2 ASP 344 6.895 -4.457 0.285 43 HB3 ASP 344 HB1 ASP 344 7.869 -3.115 -0.237 44 H GLU 345 HN GLU 345 8.344 -1.512 1.847 45 HA GLU 345 HA GLU 345 7.663 1.246 0.935 46 HB2 GLU 345 HB2 GLU 345 9.544 0.137 3.010 47 HB3 GLU 345 HB1 GLU 345 9.469 1.845 2.585 48 HG2 GLU 345 HG2 GLU 345 6.911 1.594 3.094 49 HG3 GLU 345 HG1 GLU 345 7.394 0.131 3.947 50 H VAL 346 HN VAL 346 9.563 2.516 0.237 51 HA VAL 346 HA VAL 346 11.625 0.906 -1.195 52 HB VAL 346 HB VAL 346 9.812 3.080 -2.217 53 HG11 VAL 346 HG11 VAL 346 12.606 2.458 -3.175 54 HG12 VAL 346 HG12 VAL 346 11.920 4.027 -2.750 55 HG13 VAL 346 HG13 VAL 346 11.398 3.205 -4.222 56 HG21 VAL 346 HG21 VAL 346 9.459 1.588 -4.049 57 HG22 VAL 346 HG22 VAL 346 9.432 0.581 -2.601 58 HG23 VAL 346 HG23 VAL 346 10.869 0.619 -3.623 59 H ASP 347 HN ASP 347 10.994 2.959 1.108 60 HA ASP 347 HA ASP 347 13.262 4.797 0.682 61 HB2 ASP 347 HB2 ASP 347 10.880 5.103 1.913 62 HB3 ASP 347 HB1 ASP 347 11.821 4.588 3.305 63 H ALA 348 HN ALA 348 13.243 1.816 1.223 64 HA ALA 348 HA ALA 348 15.384 1.828 3.321 65 HB1 ALA 348 HB1 ALA 348 13.704 -0.560 2.580 66 HB2 ALA 348 HB2 ALA 348 13.124 0.623 3.756 67 HB3 ALA 348 HB3 ALA 348 14.624 -0.267 4.058 68 H ALA 349 HN ALA 349 14.442 1.509 0.167 69 HA ALA 349 HA ALA 349 16.364 -0.473 -0.769 70 HB1 ALA 349 HB1 ALA 349 14.573 1.585 -2.063 71 HB2 ALA 349 HB2 ALA 349 14.409 -0.176 -2.094 72 HB3 ALA 349 HB3 ALA 349 15.700 0.603 -3.009 73 H LEU 350 HN LEU 350 16.156 2.983 -0.328 74 HA LEU 350 HA LEU 350 18.548 3.642 -1.801 75 HB2 LEU 350 HB2 LEU 350 17.994 5.823 -1.256 76 HB3 LEU 350 HB1 LEU 350 16.436 5.035 -0.995 77 HG LEU 350 HG LEU 350 18.431 5.478 1.215 78 HD11 LEU 350 HD11 LEU 350 15.974 7.073 0.518 79 HD12 LEU 350 HD12 LEU 350 17.628 7.604 0.216 80 HD13 LEU 350 HD13 LEU 350 17.066 7.368 1.871 81 HD21 LEU 350 HD21 LEU 350 16.505 4.960 2.624 82 HD22 LEU 350 HD22 LEU 350 16.757 3.638 1.476 83 HD23 LEU 350 HD23 LEU 350 15.503 4.840 1.186 84 H SER 351 HN SER 351 17.917 2.072 1.062 85 HA SER 351 HA SER 351 20.633 2.708 2.192 86 HB2 SER 351 HB2 SER 351 18.631 3.200 3.669 87 HB3 SER 351 HB1 SER 351 18.268 1.477 3.605 88 HG SER 351 HG SER 351 20.262 1.070 4.572 89 H ASP 352 HN ASP 352 19.480 0.899 0.151 90 HA ASP 352 HA ASP 352 20.517 -1.722 1.126 91 HB2 ASP 352 HB2 ASP 352 18.068 -1.263 0.558 92 HB3 ASP 352 HB1 ASP 352 18.589 -1.129 -1.092 93 H LEU 353 HN LEU 353 21.441 0.750 -0.265 94 HA LEU 353 HA LEU 353 22.666 -0.388 -2.728 95 HB2 LEU 353 HB2 LEU 353 21.288 1.381 -3.322 96 HB3 LEU 353 HB1 LEU 353 21.518 2.167 -1.763 97 HG LEU 353 HG LEU 353 23.847 2.719 -2.457 98 HD11 LEU 353 HD11 LEU 353 22.870 1.660 -5.111 99 HD12 LEU 353 HD12 LEU 353 24.082 0.888 -4.089 100 HD13 LEU 353 HD13 LEU 353 24.422 2.454 -4.830 101 HD21 LEU 353 HD21 LEU 353 23.137 4.454 -4.041 102 HD22 LEU 353 HD22 LEU 353 22.074 4.295 -2.637 103 HD23 LEU 353 HD23 LEU 353 21.590 3.619 -4.197 104 H GLU 354 HN GLU 354 23.080 2.120 -0.332 105 HA GLU 354 HA GLU 354 25.842 2.382 -0.354 106 HB2 GLU 354 HB2 GLU 354 25.500 3.306 1.931 107 HB3 GLU 354 HB1 GLU 354 24.380 3.957 0.743 108 HG2 GLU 354 HG2 GLU 354 22.753 2.169 1.411 109 HG3 GLU 354 HG1 GLU 354 23.852 1.751 2.718 110 H ILE 355 HN ILE 355 23.771 0.248 1.254 111 HA ILE 355 HA ILE 355 25.601 -0.911 3.055 112 HB ILE 355 HB ILE 355 22.956 -0.867 2.802 113 HG12 ILE 355 HG12 ILE 355 22.943 -2.958 4.286 114 HG13 ILE 355 HG11 ILE 355 24.666 -2.959 3.935 115 HG21 ILE 355 HG21 ILE 355 23.618 -3.524 1.564 116 HG22 ILE 355 HG22 ILE 355 22.782 -2.171 0.804 117 HG23 ILE 355 HG23 ILE 355 22.040 -3.024 2.149 118 HD11 ILE 355 HD11 ILE 355 24.084 -0.295 4.720 119 HD12 ILE 355 HD12 ILE 355 24.967 -1.510 5.650 120 HD13 ILE 355 HD13 ILE 355 23.227 -1.342 5.857 121 H THR 356 HN THR 356 24.788 -1.408 -0.119 122 HA THR 356 HA THR 356 26.449 -3.862 -0.322 123 HB THR 356 HB THR 356 24.174 -4.212 -0.931 124 HG1 THR 356 HG1 THR 356 25.643 -5.238 -2.293 125 HG21 THR 356 HG21 THR 356 23.122 -2.850 -2.723 126 HG22 THR 356 HG22 THR 356 24.566 -1.843 -2.765 127 HG23 THR 356 HG23 THR 356 23.572 -1.900 -1.311 128 H LEU 357 HN LEU 357 26.427 -0.653 -1.097 129 HA LEU 357 HA LEU 357 28.290 -0.962 -3.404 130 HB2 LEU 357 HB2 LEU 357 26.387 0.476 -3.934 131 HB3 LEU 357 HB1 LEU 357 26.608 1.381 -2.438 132 HG LEU 357 HG LEU 357 28.698 2.294 -3.222 133 HD11 LEU 357 HD11 LEU 357 28.337 0.272 -5.432 134 HD12 LEU 357 HD12 LEU 357 29.739 0.531 -4.399 135 HD13 LEU 357 HD13 LEU 357 29.359 1.691 -5.668 136 HD21 LEU 357 HD21 LEU 357 26.513 3.280 -4.046 137 HD22 LEU 357 HD22 LEU 357 26.758 2.385 -5.546 138 HD23 LEU 357 HD23 LEU 357 27.910 3.631 -5.065 139 H GLU 358 HN GLU 358 27.984 -0.589 -0.257 140 HA GLU 358 HA GLU 358 29.650 1.292 0.816 141 HB2 GLU 358 HB2 GLU 358 30.363 -0.695 2.402 142 HB3 GLU 358 HB1 GLU 358 28.702 -0.132 2.397 143 HG2 GLU 358 HG2 GLU 358 28.840 -2.604 2.252 144 HG3 GLU 358 HG1 GLU 358 28.085 -1.903 0.820 Start of MODEL 8 1 H1 SER 339 HT1 SER 339 -0.120 3.229 1.686 2 H2 SER 339 HT2 SER 339 -1.226 4.514 1.803 3 H3 SER 339 HT3 SER 339 0.384 4.726 2.303 4 HA SER 339 HA SER 339 -0.655 4.431 -0.452 5 HB2 SER 339 HB2 SER 339 0.947 6.513 1.048 6 HB3 SER 339 HB1 SER 339 0.793 6.513 -0.706 7 HG SER 339 HG SER 339 -1.357 6.534 1.154 8 H ASP 340 HN ASP 340 1.510 2.950 1.482 9 HA ASP 340 HA ASP 340 3.216 2.209 -0.777 10 HB2 ASP 340 HB2 ASP 340 4.300 3.787 1.567 11 HB3 ASP 340 HB1 ASP 340 5.327 2.803 0.523 12 H LYS 341 HN LYS 341 5.042 0.681 0.175 13 HA LYS 341 HA LYS 341 5.586 -1.208 1.413 14 HB2 LYS 341 HB2 LYS 341 5.222 -1.076 3.664 15 HB3 LYS 341 HB1 LYS 341 4.392 0.425 3.304 16 HG2 LYS 341 HG2 LYS 341 2.748 -0.663 4.523 17 HG3 LYS 341 HG1 LYS 341 2.316 -1.180 2.915 18 HD2 LYS 341 HD2 LYS 341 2.360 -3.267 3.911 19 HD3 LYS 341 HD1 LYS 341 4.069 -3.156 3.494 20 HE2 LYS 341 HE2 LYS 341 4.237 -3.684 5.749 21 HE3 LYS 341 HE1 LYS 341 4.209 -1.923 5.846 22 HZ1 LYS 341 HZ1 LYS 341 2.380 -2.070 7.055 23 HZ2 LYS 341 HZ2 LYS 341 2.374 -3.763 6.909 24 HZ3 LYS 341 HZ3 LYS 341 1.570 -2.804 5.759 25 H GLU 342 HN GLU 342 2.559 -0.516 0.224 26 HA GLU 342 HA GLU 342 1.036 -2.821 0.462 27 HB2 GLU 342 HB2 GLU 342 0.740 -2.245 -2.255 28 HB3 GLU 342 HB1 GLU 342 -0.171 -1.485 -0.951 29 HG2 GLU 342 HG2 GLU 342 1.342 0.341 -0.828 30 HG3 GLU 342 HG1 GLU 342 2.523 -0.485 -1.836 31 H VAL 343 HN VAL 343 2.903 -2.372 -2.497 32 HA VAL 343 HA VAL 343 3.399 -5.263 -2.654 33 HB VAL 343 HB VAL 343 2.821 -3.730 -4.641 34 HG11 VAL 343 HG11 VAL 343 4.537 -2.009 -3.905 35 HG12 VAL 343 HG12 VAL 343 4.591 -2.447 -5.613 36 HG13 VAL 343 HG13 VAL 343 5.780 -3.117 -4.492 37 HG21 VAL 343 HG21 VAL 343 4.187 -5.032 -6.168 38 HG22 VAL 343 HG22 VAL 343 3.716 -6.075 -4.827 39 HG23 VAL 343 HG23 VAL 343 5.342 -5.396 -4.887 40 H ASP 344 HN ASP 344 4.671 -2.796 -1.124 41 HA ASP 344 HA ASP 344 6.589 -3.456 0.389 42 HB2 ASP 344 HB2 ASP 344 7.513 -5.121 -1.087 43 HB3 ASP 344 HB1 ASP 344 7.861 -3.900 -2.302 44 H GLU 345 HN GLU 345 8.558 -2.083 0.610 45 HA GLU 345 HA GLU 345 7.971 0.663 -0.378 46 HB2 GLU 345 HB2 GLU 345 9.688 -0.421 1.850 47 HB3 GLU 345 HB1 GLU 345 9.567 1.288 1.449 48 HG2 GLU 345 HG2 GLU 345 6.984 0.898 1.718 49 HG3 GLU 345 HG1 GLU 345 7.474 -0.544 2.607 50 H VAL 346 HN VAL 346 9.837 1.976 -0.958 51 HA VAL 346 HA VAL 346 12.211 0.502 -1.933 52 HB VAL 346 HB VAL 346 10.279 2.110 -3.586 53 HG11 VAL 346 HG11 VAL 346 13.241 1.766 -4.063 54 HG12 VAL 346 HG12 VAL 346 12.302 3.261 -4.057 55 HG13 VAL 346 HG13 VAL 346 12.109 2.103 -5.374 56 HG21 VAL 346 HG21 VAL 346 10.443 0.257 -5.109 57 HG22 VAL 346 HG22 VAL 346 10.263 -0.429 -3.494 58 HG23 VAL 346 HG23 VAL 346 11.849 -0.390 -4.265 59 H ASP 347 HN ASP 347 10.957 2.893 -0.233 60 HA ASP 347 HA ASP 347 13.133 4.844 -0.758 61 HB2 ASP 347 HB2 ASP 347 10.520 5.217 -0.238 62 HB3 ASP 347 HB1 ASP 347 11.097 5.188 1.421 63 H ALA 348 HN ALA 348 13.181 2.166 0.535 64 HA ALA 348 HA ALA 348 14.851 2.949 2.886 65 HB1 ALA 348 HB1 ALA 348 12.540 1.836 3.363 66 HB2 ALA 348 HB2 ALA 348 13.976 1.178 4.161 67 HB3 ALA 348 HB3 ALA 348 13.300 0.366 2.748 68 H ALA 349 HN ALA 349 14.348 1.565 -0.070 69 HA ALA 349 HA ALA 349 16.356 -0.533 -0.079 70 HB1 ALA 349 HB1 ALA 349 14.646 -0.736 -1.700 71 HB2 ALA 349 HB2 ALA 349 16.029 -0.158 -2.628 72 HB3 ALA 349 HB3 ALA 349 14.754 0.972 -2.143 73 H LEU 350 HN LEU 350 16.199 2.887 -0.542 74 HA LEU 350 HA LEU 350 18.756 3.163 -1.889 75 HB2 LEU 350 HB2 LEU 350 18.204 5.422 -2.009 76 HB3 LEU 350 HB1 LEU 350 16.613 4.670 -1.875 77 HG LEU 350 HG LEU 350 18.132 5.754 0.490 78 HD11 LEU 350 HD11 LEU 350 15.838 6.959 -1.046 79 HD12 LEU 350 HD12 LEU 350 17.511 7.501 -1.158 80 HD13 LEU 350 HD13 LEU 350 16.635 7.656 0.365 81 HD21 LEU 350 HD21 LEU 350 15.318 4.807 0.038 82 HD22 LEU 350 HD22 LEU 350 15.868 5.570 1.525 83 HD23 LEU 350 HD23 LEU 350 16.516 4.000 1.040 84 H SER 351 HN SER 351 17.739 2.526 1.224 85 HA SER 351 HA SER 351 20.316 3.525 2.411 86 HB2 SER 351 HB2 SER 351 18.367 4.506 3.529 87 HB3 SER 351 HB1 SER 351 17.657 2.905 3.723 88 HG SER 351 HG SER 351 18.968 2.522 5.341 89 H ASP 352 HN ASP 352 19.136 1.094 1.007 90 HA ASP 352 HA ASP 352 20.039 -1.094 2.819 91 HB2 ASP 352 HB2 ASP 352 17.766 -0.869 1.703 92 HB3 ASP 352 HB1 ASP 352 18.587 -1.115 0.189 93 H LEU 353 HN LEU 353 21.158 0.930 0.843 94 HA LEU 353 HA LEU 353 22.764 -0.737 -0.959 95 HB2 LEU 353 HB2 LEU 353 21.594 0.963 -2.058 96 HB3 LEU 353 HB1 LEU 353 21.659 1.992 -0.624 97 HG LEU 353 HG LEU 353 24.341 1.551 -1.572 98 HD11 LEU 353 HD11 LEU 353 22.410 2.540 -3.612 99 HD12 LEU 353 HD12 LEU 353 23.459 1.129 -3.727 100 HD13 LEU 353 HD13 LEU 353 24.159 2.749 -3.711 101 HD21 LEU 353 HD21 LEU 353 24.280 4.050 -1.841 102 HD22 LEU 353 HD22 LEU 353 23.809 3.469 -0.252 103 HD23 LEU 353 HD23 LEU 353 22.577 3.979 -1.399 104 H GLU 354 HN GLU 354 22.851 2.104 1.021 105 HA GLU 354 HA GLU 354 25.518 2.550 1.299 106 HB2 GLU 354 HB2 GLU 354 24.904 3.725 3.344 107 HB3 GLU 354 HB1 GLU 354 23.663 3.969 2.125 108 HG2 GLU 354 HG2 GLU 354 22.536 1.874 3.127 109 HG3 GLU 354 HG1 GLU 354 23.631 2.125 4.484 110 H ILE 355 HN ILE 355 23.491 0.348 2.836 111 HA ILE 355 HA ILE 355 25.249 -0.560 4.925 112 HB ILE 355 HB ILE 355 23.164 -2.396 3.766 113 HG12 ILE 355 HG12 ILE 355 22.585 0.206 5.166 114 HG13 ILE 355 HG11 ILE 355 22.077 -0.350 3.567 115 HG21 ILE 355 HG21 ILE 355 22.840 -2.976 6.023 116 HG22 ILE 355 HG22 ILE 355 23.697 -1.538 6.587 117 HG23 ILE 355 HG23 ILE 355 24.579 -2.846 5.786 118 HD11 ILE 355 HD11 ILE 355 20.858 -2.252 4.691 119 HD12 ILE 355 HD12 ILE 355 20.197 -0.677 5.109 120 HD13 ILE 355 HD13 ILE 355 21.238 -1.516 6.244 121 H THR 356 HN THR 356 24.989 -1.175 1.645 122 HA THR 356 HA THR 356 26.677 -3.606 1.922 123 HB THR 356 HB THR 356 24.499 -4.247 1.365 124 HG1 THR 356 HG1 THR 356 24.943 -5.323 -0.455 125 HG21 THR 356 HG21 THR 356 24.663 -2.047 -0.705 126 HG22 THR 356 HG22 THR 356 23.655 -2.059 0.747 127 HG23 THR 356 HG23 THR 356 23.322 -3.184 -0.571 128 H LEU 357 HN LEU 357 26.479 -0.601 0.451 129 HA LEU 357 HA LEU 357 28.368 -1.296 -1.720 130 HB2 LEU 357 HB2 LEU 357 26.227 0.325 -1.700 131 HB3 LEU 357 HB1 LEU 357 27.432 1.491 -1.182 132 HG LEU 357 HG LEU 357 27.200 1.551 -3.569 133 HD11 LEU 357 HD11 LEU 357 29.520 1.202 -4.235 134 HD12 LEU 357 HD12 LEU 357 29.771 0.154 -2.841 135 HD13 LEU 357 HD13 LEU 357 29.447 1.872 -2.606 136 HD21 LEU 357 HD21 LEU 357 27.135 -0.249 -4.996 137 HD22 LEU 357 HD22 LEU 357 26.554 -1.065 -3.548 138 HD23 LEU 357 HD23 LEU 357 28.247 -1.205 -4.021 139 H GLU 358 HN GLU 358 28.547 -1.129 1.256 140 HA GLU 358 HA GLU 358 30.664 0.883 1.700 141 HB2 GLU 358 HB2 GLU 358 30.335 -0.138 4.118 142 HB3 GLU 358 HB1 GLU 358 29.154 0.989 3.469 143 HG2 GLU 358 HG2 GLU 358 28.106 -1.040 4.471 144 HG3 GLU 358 HG1 GLU 358 27.735 -0.849 2.757 Start of MODEL 9 1 H1 SER 339 HT1 SER 339 3.182 -4.066 -0.966 2 H2 SER 339 HT2 SER 339 3.854 -4.197 -2.520 3 H3 SER 339 HT3 SER 339 3.231 -5.573 -1.743 4 HA SER 339 HA SER 339 1.694 -4.804 -3.428 5 HB2 SER 339 HB2 SER 339 0.875 -4.411 -0.541 6 HB3 SER 339 HB1 SER 339 -0.279 -4.399 -1.872 7 HG SER 339 HG SER 339 0.402 -6.497 -2.395 8 H ASP 340 HN ASP 340 2.385 -2.342 -0.943 9 HA ASP 340 HA ASP 340 2.120 -0.228 -2.950 10 HB2 ASP 340 HB2 ASP 340 0.111 -0.524 -0.702 11 HB3 ASP 340 HB1 ASP 340 0.379 0.998 -1.553 12 H LYS 341 HN LYS 341 2.154 1.991 -1.549 13 HA LYS 341 HA LYS 341 4.578 1.715 0.138 14 HB2 LYS 341 HB2 LYS 341 3.199 3.979 -1.312 15 HB3 LYS 341 HB1 LYS 341 4.339 4.348 -0.030 16 HG2 LYS 341 HG2 LYS 341 5.676 4.358 -1.966 17 HG3 LYS 341 HG1 LYS 341 5.961 2.778 -1.275 18 HD2 LYS 341 HD2 LYS 341 5.609 2.510 -3.654 19 HD3 LYS 341 HD1 LYS 341 4.227 1.826 -2.810 20 HE2 LYS 341 HE2 LYS 341 2.789 3.482 -3.550 21 HE3 LYS 341 HE1 LYS 341 4.056 4.708 -3.574 22 HZ1 LYS 341 HZ1 LYS 341 4.684 4.156 -5.649 23 HZ2 LYS 341 HZ2 LYS 341 3.088 3.584 -5.762 24 HZ3 LYS 341 HZ3 LYS 341 4.360 2.504 -5.443 25 H GLU 342 HN GLU 342 4.218 4.014 1.720 26 HA GLU 342 HA GLU 342 3.295 4.742 3.701 27 HB2 GLU 342 HB2 GLU 342 0.808 3.163 3.186 28 HB3 GLU 342 HB1 GLU 342 0.999 4.756 3.901 29 HG2 GLU 342 HG2 GLU 342 1.956 5.259 1.424 30 HG3 GLU 342 HG1 GLU 342 0.833 3.981 1.044 31 H VAL 343 HN VAL 343 1.947 1.579 3.077 32 HA VAL 343 HA VAL 343 2.516 0.551 5.713 33 HB VAL 343 HB VAL 343 0.702 -0.263 4.117 34 HG11 VAL 343 HG11 VAL 343 2.962 -1.903 2.969 35 HG12 VAL 343 HG12 VAL 343 2.368 -0.432 2.198 36 HG13 VAL 343 HG13 VAL 343 1.293 -1.815 2.405 37 HG21 VAL 343 HG21 VAL 343 0.781 -2.514 4.974 38 HG22 VAL 343 HG22 VAL 343 1.469 -1.469 6.215 39 HG23 VAL 343 HG23 VAL 343 2.529 -2.429 5.184 40 H ASP 344 HN ASP 344 4.421 1.408 3.357 41 HA ASP 344 HA ASP 344 6.755 0.192 4.449 42 HB2 ASP 344 HB2 ASP 344 5.946 -1.851 3.624 43 HB3 ASP 344 HB1 ASP 344 5.371 -1.126 2.146 44 H GLU 345 HN GLU 345 8.607 0.395 2.820 45 HA GLU 345 HA GLU 345 8.219 2.584 0.858 46 HB2 GLU 345 HB2 GLU 345 10.306 2.539 3.034 47 HB3 GLU 345 HB1 GLU 345 10.069 3.799 1.834 48 HG2 GLU 345 HG2 GLU 345 7.641 3.921 2.794 49 HG3 GLU 345 HG1 GLU 345 8.329 3.078 4.178 50 H VAL 346 HN VAL 346 10.045 2.770 -0.587 51 HA VAL 346 HA VAL 346 11.893 0.445 -0.659 52 HB VAL 346 HB VAL 346 9.987 1.375 -2.792 53 HG11 VAL 346 HG11 VAL 346 12.671 0.052 -3.203 54 HG12 VAL 346 HG12 VAL 346 12.043 1.509 -3.976 55 HG13 VAL 346 HG13 VAL 346 11.370 -0.068 -4.389 56 HG21 VAL 346 HG21 VAL 346 9.481 -0.961 -2.998 57 HG22 VAL 346 HG22 VAL 346 9.545 -0.615 -1.269 58 HG23 VAL 346 HG23 VAL 346 10.903 -1.416 -2.059 59 H ASP 347 HN ASP 347 11.493 3.594 -0.519 60 HA ASP 347 HA ASP 347 13.812 4.322 -2.217 61 HB2 ASP 347 HB2 ASP 347 11.492 5.600 -1.751 62 HB3 ASP 347 HB1 ASP 347 12.412 6.270 -0.412 63 H ALA 348 HN ALA 348 13.605 2.824 0.390 64 HA ALA 348 HA ALA 348 15.856 4.237 1.773 65 HB1 ALA 348 HB1 ALA 348 13.919 2.378 3.144 66 HB2 ALA 348 HB2 ALA 348 13.534 4.090 2.944 67 HB3 ALA 348 HB3 ALA 348 14.970 3.605 3.856 68 H ALA 349 HN ALA 349 14.613 1.715 0.043 69 HA ALA 349 HA ALA 349 16.237 -0.491 1.010 70 HB1 ALA 349 HB1 ALA 349 15.507 -1.420 -1.289 71 HB2 ALA 349 HB2 ALA 349 14.552 0.063 -1.430 72 HB3 ALA 349 HB3 ALA 349 14.234 -1.077 -0.117 73 H LEU 350 HN LEU 350 16.442 2.055 -1.368 74 HA LEU 350 HA LEU 350 18.746 1.044 -2.768 75 HB2 LEU 350 HB2 LEU 350 18.503 2.952 -4.062 76 HB3 LEU 350 HB1 LEU 350 16.888 2.824 -3.361 77 HG LEU 350 HG LEU 350 19.062 4.525 -2.159 78 HD11 LEU 350 HD11 LEU 350 18.385 5.247 -4.453 79 HD12 LEU 350 HD12 LEU 350 17.980 6.412 -3.192 80 HD13 LEU 350 HD13 LEU 350 16.729 5.366 -3.863 81 HD21 LEU 350 HD21 LEU 350 16.091 4.364 -1.783 82 HD22 LEU 350 HD22 LEU 350 17.150 5.491 -0.944 83 HD23 LEU 350 HD23 LEU 350 17.273 3.755 -0.631 84 H SER 351 HN SER 351 18.228 2.276 0.274 85 HA SER 351 HA SER 351 21.095 3.138 0.584 86 HB2 SER 351 HB2 SER 351 19.355 4.889 1.100 87 HB3 SER 351 HB1 SER 351 18.732 3.798 2.335 88 HG SER 351 HG SER 351 20.384 4.258 3.574 89 H ASP 352 HN ASP 352 19.580 0.610 0.612 90 HA ASP 352 HA ASP 352 20.380 -0.450 3.280 91 HB2 ASP 352 HB2 ASP 352 17.948 -0.195 2.519 92 HB3 ASP 352 HB1 ASP 352 18.293 -1.469 1.389 93 H LEU 353 HN LEU 353 21.379 -0.135 0.462 94 HA LEU 353 HA LEU 353 22.189 -2.935 -0.157 95 HB2 LEU 353 HB2 LEU 353 20.923 -2.118 -1.920 96 HB3 LEU 353 HB1 LEU 353 21.400 -0.459 -1.575 97 HG LEU 353 HG LEU 353 23.676 -1.008 -2.437 98 HD11 LEU 353 HD11 LEU 353 22.296 -3.553 -3.293 99 HD12 LEU 353 HD12 LEU 353 23.511 -3.441 -2.021 100 HD13 LEU 353 HD13 LEU 353 23.952 -3.088 -3.693 101 HD21 LEU 353 HD21 LEU 353 22.028 0.090 -3.771 102 HD22 LEU 353 HD22 LEU 353 21.332 -1.468 -4.233 103 HD23 LEU 353 HD23 LEU 353 22.955 -1.030 -4.773 104 H GLU 354 HN GLU 354 23.111 0.398 -0.634 105 HA GLU 354 HA GLU 354 25.868 0.111 -0.870 106 HB2 GLU 354 HB2 GLU 354 25.895 2.509 -0.216 107 HB3 GLU 354 HB1 GLU 354 24.703 2.142 -1.454 108 HG2 GLU 354 HG2 GLU 354 23.008 1.848 0.367 109 HG3 GLU 354 HG1 GLU 354 24.215 2.440 1.499 110 H ILE 355 HN ILE 355 23.810 0.375 1.791 111 HA ILE 355 HA ILE 355 25.727 0.832 3.810 112 HB ILE 355 HB ILE 355 23.084 1.068 3.605 113 HG12 ILE 355 HG12 ILE 355 23.026 1.031 6.151 114 HG13 ILE 355 HG11 ILE 355 24.666 0.415 5.990 115 HG21 ILE 355 HG21 ILE 355 21.894 -0.593 4.921 116 HG22 ILE 355 HG22 ILE 355 23.334 -1.587 4.989 117 HG23 ILE 355 HG23 ILE 355 22.556 -1.261 3.437 118 HD11 ILE 355 HD11 ILE 355 25.533 2.460 5.473 119 HD12 ILE 355 HD12 ILE 355 24.040 3.091 6.157 120 HD13 ILE 355 HD13 ILE 355 24.181 2.871 4.411 121 H THR 356 HN THR 356 24.498 -1.831 2.276 122 HA THR 356 HA THR 356 25.850 -3.717 4.126 123 HB THR 356 HB THR 356 23.500 -4.059 3.978 124 HG1 THR 356 HG1 THR 356 25.054 -5.906 3.735 125 HG21 THR 356 HG21 THR 356 22.421 -4.483 1.780 126 HG22 THR 356 HG22 THR 356 23.954 -4.123 0.994 127 HG23 THR 356 HG23 THR 356 23.115 -2.871 1.908 128 H LEU 357 HN LEU 357 26.027 -2.445 1.046 129 HA LEU 357 HA LEU 357 27.551 -4.719 -0.078 130 HB2 LEU 357 HB2 LEU 357 25.754 -3.754 -1.450 131 HB3 LEU 357 HB1 LEU 357 26.476 -2.162 -1.296 132 HG LEU 357 HG LEU 357 26.884 -3.468 -3.439 133 HD11 LEU 357 HD11 LEU 357 28.560 -1.638 -2.070 134 HD12 LEU 357 HD12 LEU 357 28.500 -1.967 -3.793 135 HD13 LEU 357 HD13 LEU 357 29.623 -2.856 -2.775 136 HD21 LEU 357 HD21 LEU 357 29.014 -4.888 -1.851 137 HD22 LEU 357 HD22 LEU 357 28.537 -5.174 -3.521 138 HD23 LEU 357 HD23 LEU 357 27.446 -5.615 -2.211 139 H GLU 358 HN GLU 358 27.708 -1.947 1.561 140 HA GLU 358 HA GLU 358 29.807 -0.370 0.823 141 HB2 GLU 358 HB2 GLU 358 30.341 -0.379 3.387 142 HB3 GLU 358 HB1 GLU 358 28.786 0.219 2.840 143 HG2 GLU 358 HG2 GLU 358 28.525 -1.342 4.735 144 HG3 GLU 358 HG1 GLU 358 27.783 -1.986 3.272 Start of MODEL 10 1 H1 SER 339 HT1 SER 339 -1.696 -0.812 2.139 2 H2 SER 339 HT2 SER 339 -2.848 -0.406 0.959 3 H3 SER 339 HT3 SER 339 -1.592 0.676 1.332 4 HA SER 339 HA SER 339 -0.679 -1.933 0.515 5 HB2 SER 339 HB2 SER 339 -2.646 -1.733 -0.946 6 HB3 SER 339 HB1 SER 339 -2.146 -0.112 -1.419 7 HG SER 339 HG SER 339 -0.060 -1.431 -1.915 8 H ASP 340 HN ASP 340 1.468 -1.489 0.587 9 HA ASP 340 HA ASP 340 2.656 0.568 -1.018 10 HB2 ASP 340 HB2 ASP 340 3.636 1.796 1.085 11 HB3 ASP 340 HB1 ASP 340 2.015 2.215 0.532 12 H LYS 341 HN LYS 341 2.934 -1.607 1.727 13 HA LYS 341 HA LYS 341 5.669 -1.875 2.043 14 HB2 LYS 341 HB2 LYS 341 5.221 -3.954 3.029 15 HB3 LYS 341 HB1 LYS 341 3.668 -3.134 3.117 16 HG2 LYS 341 HG2 LYS 341 2.950 -5.127 2.193 17 HG3 LYS 341 HG1 LYS 341 3.313 -4.233 0.731 18 HD2 LYS 341 HD2 LYS 341 4.584 -6.080 0.202 19 HD3 LYS 341 HD1 LYS 341 5.784 -5.310 1.240 20 HE2 LYS 341 HE2 LYS 341 5.689 -7.429 2.193 21 HE3 LYS 341 HE1 LYS 341 4.473 -6.588 3.154 22 HZ1 LYS 341 HZ1 LYS 341 4.070 -8.455 0.903 23 HZ2 LYS 341 HZ2 LYS 341 2.851 -7.369 1.373 24 HZ3 LYS 341 HZ3 LYS 341 3.427 -8.532 2.470 25 H GLU 342 HN GLU 342 3.805 -2.613 -0.640 26 HA GLU 342 HA GLU 342 4.983 -4.536 -2.147 27 HB2 GLU 342 HB2 GLU 342 4.728 -1.894 -3.537 28 HB3 GLU 342 HB1 GLU 342 4.234 -3.497 -4.066 29 HG2 GLU 342 HG2 GLU 342 2.936 -1.822 -1.925 30 HG3 GLU 342 HG1 GLU 342 2.322 -2.205 -3.509 31 H VAL 343 HN VAL 343 6.154 -1.264 -2.757 32 HA VAL 343 HA VAL 343 8.924 -2.347 -3.007 33 HB VAL 343 HB VAL 343 7.597 -0.753 -4.764 34 HG11 VAL 343 HG11 VAL 343 7.487 1.024 -2.926 35 HG12 VAL 343 HG12 VAL 343 8.131 1.561 -4.480 36 HG13 VAL 343 HG13 VAL 343 9.229 1.212 -3.140 37 HG21 VAL 343 HG21 VAL 343 10.549 -0.737 -4.081 38 HG22 VAL 343 HG22 VAL 343 9.897 0.055 -5.516 39 HG23 VAL 343 HG23 VAL 343 9.736 -1.691 -5.323 40 H ASP 344 HN ASP 344 7.008 -1.097 -0.820 41 HA ASP 344 HA ASP 344 7.442 -0.259 1.298 42 HB2 ASP 344 HB2 ASP 344 9.563 -1.715 0.759 43 HB3 ASP 344 HB1 ASP 344 10.352 -0.168 0.704 44 H GLU 345 HN GLU 345 9.015 1.577 2.271 45 HA GLU 345 HA GLU 345 8.193 4.036 1.021 46 HB2 GLU 345 HB2 GLU 345 9.912 3.199 3.294 47 HB3 GLU 345 HB1 GLU 345 9.982 4.885 2.775 48 HG2 GLU 345 HG2 GLU 345 7.317 3.543 3.267 49 HG3 GLU 345 HG1 GLU 345 8.247 4.190 4.605 50 H VAL 346 HN VAL 346 9.993 5.756 0.671 51 HA VAL 346 HA VAL 346 12.094 4.575 -1.087 52 HB VAL 346 HB VAL 346 10.537 7.150 -1.220 53 HG11 VAL 346 HG11 VAL 346 13.257 6.548 -2.380 54 HG12 VAL 346 HG12 VAL 346 12.752 7.955 -1.446 55 HG13 VAL 346 HG13 VAL 346 12.185 7.749 -3.105 56 HG21 VAL 346 HG21 VAL 346 11.295 5.183 -3.398 57 HG22 VAL 346 HG22 VAL 346 10.077 6.456 -3.480 58 HG23 VAL 346 HG23 VAL 346 9.815 5.049 -2.449 59 H ASP 347 HN ASP 347 11.469 5.905 1.752 60 HA ASP 347 HA ASP 347 14.115 7.272 2.006 61 HB2 ASP 347 HB2 ASP 347 11.673 8.043 2.847 62 HB3 ASP 347 HB1 ASP 347 12.124 7.081 4.248 63 H ALA 348 HN ALA 348 13.274 4.421 1.866 64 HA ALA 348 HA ALA 348 14.949 3.438 4.140 65 HB1 ALA 348 HB1 ALA 348 13.497 1.612 4.465 66 HB2 ALA 348 HB2 ALA 348 12.712 1.836 2.900 67 HB3 ALA 348 HB3 ALA 348 12.385 2.962 4.220 68 H ALA 349 HN ALA 349 14.259 3.881 0.939 69 HA ALA 349 HA ALA 349 15.532 1.568 -0.256 70 HB1 ALA 349 HB1 ALA 349 15.533 3.218 -2.264 71 HB2 ALA 349 HB2 ALA 349 14.626 4.290 -1.185 72 HB3 ALA 349 HB3 ALA 349 13.972 2.706 -1.620 73 H LEU 350 HN LEU 350 16.426 4.763 0.813 74 HA LEU 350 HA LEU 350 19.050 4.836 -0.360 75 HB2 LEU 350 HB2 LEU 350 19.191 6.915 0.676 76 HB3 LEU 350 HB1 LEU 350 17.443 6.683 0.591 77 HG LEU 350 HG LEU 350 19.082 5.975 3.016 78 HD11 LEU 350 HD11 LEU 350 18.183 8.035 3.981 79 HD12 LEU 350 HD12 LEU 350 17.387 8.401 2.450 80 HD13 LEU 350 HD13 LEU 350 19.147 8.389 2.546 81 HD21 LEU 350 HD21 LEU 350 16.143 6.247 2.460 82 HD22 LEU 350 HD22 LEU 350 16.818 5.962 4.059 83 HD23 LEU 350 HD23 LEU 350 16.978 4.737 2.797 84 H SER 351 HN SER 351 17.657 3.043 2.054 85 HA SER 351 HA SER 351 20.299 2.480 3.377 86 HB2 SER 351 HB2 SER 351 18.494 3.425 4.873 87 HB3 SER 351 HB1 SER 351 17.534 2.005 4.467 88 HG SER 351 HG SER 351 18.947 0.732 5.528 89 H ASP 352 HN ASP 352 18.850 1.557 0.988 90 HA ASP 352 HA ASP 352 18.766 -1.371 1.530 91 HB2 ASP 352 HB2 ASP 352 16.684 0.015 1.004 92 HB3 ASP 352 HB1 ASP 352 17.351 0.204 -0.588 93 H LEU 353 HN LEU 353 20.564 0.836 0.492 94 HA LEU 353 HA LEU 353 21.498 -0.439 -2.040 95 HB2 LEU 353 HB2 LEU 353 20.747 1.696 -2.541 96 HB3 LEU 353 HB1 LEU 353 21.119 2.279 -0.922 97 HG LEU 353 HG LEU 353 23.530 2.158 -1.490 98 HD11 LEU 353 HD11 LEU 353 24.131 1.860 -3.865 99 HD12 LEU 353 HD12 LEU 353 22.436 1.532 -4.234 100 HD13 LEU 353 HD13 LEU 353 23.347 0.420 -3.214 101 HD21 LEU 353 HD21 LEU 353 22.292 4.189 -1.657 102 HD22 LEU 353 HD22 LEU 353 21.758 3.756 -3.287 103 HD23 LEU 353 HD23 LEU 353 23.462 4.098 -2.977 104 H GLU 354 HN GLU 354 22.554 1.681 0.530 105 HA GLU 354 HA GLU 354 25.259 1.052 0.602 106 HB2 GLU 354 HB2 GLU 354 25.123 1.938 2.918 107 HB3 GLU 354 HB1 GLU 354 24.317 2.961 1.736 108 HG2 GLU 354 HG2 GLU 354 22.184 1.763 2.260 109 HG3 GLU 354 HG1 GLU 354 23.034 0.948 3.565 110 H ILE 355 HN ILE 355 22.539 -0.401 1.977 111 HA ILE 355 HA ILE 355 23.828 -2.142 3.787 112 HB ILE 355 HB ILE 355 21.347 -1.248 3.443 113 HG12 ILE 355 HG12 ILE 355 20.579 -3.244 4.819 114 HG13 ILE 355 HG11 ILE 355 22.195 -3.855 4.489 115 HG21 ILE 355 HG21 ILE 355 21.211 -3.915 2.070 116 HG22 ILE 355 HG22 ILE 355 20.869 -2.331 1.375 117 HG23 ILE 355 HG23 ILE 355 19.840 -2.982 2.643 118 HD11 ILE 355 HD11 ILE 355 21.553 -2.282 6.661 119 HD12 ILE 355 HD12 ILE 355 22.196 -1.087 5.530 120 HD13 ILE 355 HD13 ILE 355 23.179 -2.473 6.012 121 H THR 356 HN THR 356 23.022 -2.226 0.568 122 HA THR 356 HA THR 356 23.838 -5.064 0.273 123 HB THR 356 HB THR 356 21.606 -4.626 -0.432 124 HG1 THR 356 HG1 THR 356 23.396 -5.655 -1.953 125 HG21 THR 356 HG21 THR 356 21.789 -2.233 -0.700 126 HG22 THR 356 HG22 THR 356 21.153 -2.921 -2.189 127 HG23 THR 356 HG23 THR 356 22.840 -2.429 -2.099 128 H LEU 357 HN LEU 357 24.881 -1.982 -0.339 129 HA LEU 357 HA LEU 357 26.675 -2.808 -2.575 130 HB2 LEU 357 HB2 LEU 357 25.294 -0.878 -3.164 131 HB3 LEU 357 HB1 LEU 357 25.709 -0.075 -1.652 132 HG LEU 357 HG LEU 357 27.996 0.204 -2.343 133 HD11 LEU 357 HD11 LEU 357 28.544 -1.800 -3.470 134 HD12 LEU 357 HD12 LEU 357 28.577 -0.593 -4.751 135 HD13 LEU 357 HD13 LEU 357 27.180 -1.657 -4.575 136 HD21 LEU 357 HD21 LEU 357 26.125 0.829 -4.650 137 HD22 LEU 357 HD22 LEU 357 27.695 1.583 -4.375 138 HD23 LEU 357 HD23 LEU 357 26.380 1.844 -3.230 139 H GLU 358 HN GLU 358 26.346 -2.459 0.549 140 HA GLU 358 HA GLU 358 28.387 -1.139 1.789 141 HB2 GLU 358 HB2 GLU 358 28.497 -3.361 3.249 142 HB3 GLU 358 HB1 GLU 358 27.071 -2.342 3.276 143 HG2 GLU 358 HG2 GLU 358 26.503 -4.739 2.959 144 HG3 GLU 358 HG1 GLU 358 26.000 -3.752 1.586 Start of MODEL 11 1 H1 SER 339 HT1 SER 339 3.800 0.499 -4.806 2 H2 SER 339 HT2 SER 339 4.996 1.513 -5.459 3 H3 SER 339 HT3 SER 339 3.611 1.135 -6.367 4 HA SER 339 HA SER 339 3.993 3.141 -4.333 5 HB2 SER 339 HB2 SER 339 3.378 3.697 -6.632 6 HB3 SER 339 HB1 SER 339 1.959 2.658 -6.531 7 HG SER 339 HG SER 339 1.709 4.188 -4.496 8 H ASP 340 HN ASP 340 3.497 0.899 -2.881 9 HA ASP 340 HA ASP 340 0.817 1.470 -1.758 10 HB2 ASP 340 HB2 ASP 340 1.682 -1.240 -2.800 11 HB3 ASP 340 HB1 ASP 340 0.362 -1.033 -1.648 12 H LYS 341 HN LYS 341 3.978 -0.036 -1.529 13 HA LYS 341 HA LYS 341 5.309 -0.505 0.298 14 HB2 LYS 341 HB2 LYS 341 3.410 1.081 1.990 15 HB3 LYS 341 HB1 LYS 341 5.155 0.895 2.124 16 HG2 LYS 341 HG2 LYS 341 4.959 1.947 -0.403 17 HG3 LYS 341 HG1 LYS 341 3.586 2.686 0.402 18 HD2 LYS 341 HD2 LYS 341 5.057 3.523 2.185 19 HD3 LYS 341 HD1 LYS 341 6.429 2.727 1.406 20 HE2 LYS 341 HE2 LYS 341 6.136 5.233 0.916 21 HE3 LYS 341 HE1 LYS 341 6.327 4.176 -0.483 22 HZ1 LYS 341 HZ1 LYS 341 3.641 4.791 0.559 23 HZ2 LYS 341 HZ2 LYS 341 4.100 4.315 -1.006 24 HZ3 LYS 341 HZ3 LYS 341 4.428 5.891 -0.464 25 H GLU 342 HN GLU 342 3.591 -0.345 2.941 26 HA GLU 342 HA GLU 342 2.684 -1.833 4.435 27 HB2 GLU 342 HB2 GLU 342 1.495 -3.525 2.306 28 HB3 GLU 342 HB1 GLU 342 0.761 -2.849 3.752 29 HG2 GLU 342 HG2 GLU 342 1.140 -0.568 2.455 30 HG3 GLU 342 HG1 GLU 342 1.135 -1.623 1.064 31 H VAL 343 HN VAL 343 3.282 -3.805 1.618 32 HA VAL 343 HA VAL 343 4.525 -5.939 3.116 33 HB VAL 343 HB VAL 343 3.264 -6.119 0.903 34 HG11 VAL 343 HG11 VAL 343 4.467 -5.724 -1.122 35 HG12 VAL 343 HG12 VAL 343 5.973 -5.446 -0.248 36 HG13 VAL 343 HG13 VAL 343 4.661 -4.273 -0.139 37 HG21 VAL 343 HG21 VAL 343 5.988 -7.442 0.948 38 HG22 VAL 343 HG22 VAL 343 4.508 -8.067 0.226 39 HG23 VAL 343 HG23 VAL 343 4.652 -7.957 1.978 40 H ASP 344 HN ASP 344 5.554 -3.045 2.641 41 HA ASP 344 HA ASP 344 8.283 -3.671 3.245 42 HB2 ASP 344 HB2 ASP 344 8.452 -4.442 1.036 43 HB3 ASP 344 HB1 ASP 344 7.471 -3.138 0.417 44 H GLU 345 HN GLU 345 9.675 -1.651 2.890 45 HA GLU 345 HA GLU 345 8.097 0.854 3.257 46 HB2 GLU 345 HB2 GLU 345 10.480 -0.134 4.827 47 HB3 GLU 345 HB1 GLU 345 9.716 1.437 5.023 48 HG2 GLU 345 HG2 GLU 345 7.523 -0.003 5.363 49 HG3 GLU 345 HG1 GLU 345 8.666 -1.286 5.743 50 H VAL 346 HN VAL 346 9.504 2.790 2.979 51 HA VAL 346 HA VAL 346 11.511 2.352 0.820 52 HB VAL 346 HB VAL 346 9.660 4.620 1.525 53 HG11 VAL 346 HG11 VAL 346 11.717 5.796 1.373 54 HG12 VAL 346 HG12 VAL 346 10.967 5.971 -0.215 55 HG13 VAL 346 HG13 VAL 346 12.272 4.808 0.022 56 HG21 VAL 346 HG21 VAL 346 8.953 2.958 -0.157 57 HG22 VAL 346 HG22 VAL 346 10.414 3.277 -1.091 58 HG23 VAL 346 HG23 VAL 346 9.195 4.538 -0.902 59 H ASP 347 HN ASP 347 11.227 2.696 3.948 60 HA ASP 347 HA ASP 347 13.594 4.440 4.352 61 HB2 ASP 347 HB2 ASP 347 11.281 4.209 5.734 62 HB3 ASP 347 HB1 ASP 347 12.221 3.001 6.598 63 H ALA 348 HN ALA 348 13.345 1.686 3.241 64 HA ALA 348 HA ALA 348 15.608 0.480 4.777 65 HB1 ALA 348 HB1 ALA 348 13.583 -1.178 3.286 66 HB2 ALA 348 HB2 ALA 348 13.237 -0.641 4.932 67 HB3 ALA 348 HB3 ALA 348 14.653 -1.651 4.607 68 H ALA 349 HN ALA 349 14.253 1.802 2.086 69 HA ALA 349 HA ALA 349 15.734 0.448 -0.024 70 HB1 ALA 349 HB1 ALA 349 14.932 2.565 -1.277 71 HB2 ALA 349 HB2 ALA 349 14.060 2.945 0.216 72 HB3 ALA 349 HB3 ALA 349 13.695 1.461 -0.674 73 H LEU 350 HN LEU 350 16.197 3.006 2.230 74 HA LEU 350 HA LEU 350 18.393 4.291 0.809 75 HB2 LEU 350 HB2 LEU 350 18.284 5.880 2.503 76 HB3 LEU 350 HB1 LEU 350 16.643 5.231 2.521 77 HG LEU 350 HG LEU 350 18.827 4.252 4.352 78 HD11 LEU 350 HD11 LEU 350 18.193 6.641 4.712 79 HD12 LEU 350 HD12 LEU 350 17.781 5.589 6.067 80 HD13 LEU 350 HD13 LEU 350 16.528 6.108 4.938 81 HD21 LEU 350 HD21 LEU 350 15.849 3.881 4.230 82 HD22 LEU 350 HD22 LEU 350 16.862 3.286 5.540 83 HD23 LEU 350 HD23 LEU 350 17.040 2.627 3.911 84 H SER 351 HN SER 351 17.942 1.526 2.615 85 HA SER 351 HA SER 351 20.853 1.364 3.355 86 HB2 SER 351 HB2 SER 351 19.521 1.066 5.341 87 HB3 SER 351 HB1 SER 351 18.401 0.004 4.487 88 HG SER 351 HG SER 351 19.853 -1.218 5.712 89 H ASP 352 HN ASP 352 18.982 0.818 1.031 90 HA ASP 352 HA ASP 352 19.786 -1.950 0.284 91 HB2 ASP 352 HB2 ASP 352 17.424 -1.042 0.418 92 HB3 ASP 352 HB1 ASP 352 17.834 -0.021 -0.926 93 H LEU 353 HN LEU 353 20.822 0.916 0.225 94 HA LEU 353 HA LEU 353 21.671 1.212 -2.565 95 HB2 LEU 353 HB2 LEU 353 20.559 3.063 -1.642 96 HB3 LEU 353 HB1 LEU 353 21.271 2.758 -0.054 97 HG LEU 353 HG LEU 353 23.101 3.355 -2.300 98 HD11 LEU 353 HD11 LEU 353 22.826 5.821 -1.817 99 HD12 LEU 353 HD12 LEU 353 21.335 5.382 -0.984 100 HD13 LEU 353 HD13 LEU 353 21.506 5.061 -2.709 101 HD21 LEU 353 HD21 LEU 353 24.470 3.302 -0.517 102 HD22 LEU 353 HD22 LEU 353 23.186 3.549 0.649 103 HD23 LEU 353 HD23 LEU 353 23.915 4.919 -0.174 104 H GLU 354 HN GLU 354 22.694 1.545 0.748 105 HA GLU 354 HA GLU 354 25.426 1.724 0.536 106 HB2 GLU 354 HB2 GLU 354 25.450 0.895 2.816 107 HB3 GLU 354 HB1 GLU 354 24.063 1.949 2.593 108 HG2 GLU 354 HG2 GLU 354 22.776 -0.188 1.953 109 HG3 GLU 354 HG1 GLU 354 24.148 -1.045 2.656 110 H ILE 355 HN ILE 355 23.357 -0.941 0.436 111 HA ILE 355 HA ILE 355 25.298 -3.053 0.522 112 HB ILE 355 HB ILE 355 22.711 -3.426 -0.973 113 HG12 ILE 355 HG12 ILE 355 22.936 -2.855 1.974 114 HG13 ILE 355 HG11 ILE 355 22.026 -1.993 0.730 115 HG21 ILE 355 HG21 ILE 355 24.396 -5.207 -0.467 116 HG22 ILE 355 HG22 ILE 355 22.754 -5.536 0.077 117 HG23 ILE 355 HG23 ILE 355 23.978 -5.005 1.236 118 HD11 ILE 355 HD11 ILE 355 21.527 -4.822 1.716 119 HD12 ILE 355 HD12 ILE 355 20.709 -4.107 0.329 120 HD13 ILE 355 HD13 ILE 355 20.462 -3.442 1.938 121 H THR 356 HN THR 356 24.337 -0.902 -1.825 122 HA THR 356 HA THR 356 25.613 -2.566 -3.926 123 HB THR 356 HB THR 356 23.282 -2.757 -4.174 124 HG1 THR 356 HG1 THR 356 23.128 -1.068 -6.091 125 HG21 THR 356 HG21 THR 356 21.862 -0.714 -4.300 126 HG22 THR 356 HG22 THR 356 23.289 0.250 -3.917 127 HG23 THR 356 HG23 THR 356 22.662 -0.904 -2.736 128 H LEU 357 HN LEU 357 25.712 0.316 -2.383 129 HA LEU 357 HA LEU 357 26.764 1.849 -4.702 130 HB2 LEU 357 HB2 LEU 357 25.248 3.067 -3.187 131 HB3 LEU 357 HB1 LEU 357 26.225 2.586 -1.806 132 HG LEU 357 HG LEU 357 28.012 4.002 -2.431 133 HD11 LEU 357 HD11 LEU 357 26.628 4.134 -5.110 134 HD12 LEU 357 HD12 LEU 357 28.270 3.595 -4.763 135 HD13 LEU 357 HD13 LEU 357 27.861 5.306 -4.646 136 HD21 LEU 357 HD21 LEU 357 26.062 5.197 -1.502 137 HD22 LEU 357 HD22 LEU 357 25.449 5.453 -3.136 138 HD23 LEU 357 HD23 LEU 357 26.958 6.214 -2.630 139 H GLU 358 HN GLU 358 27.624 -0.490 -3.000 140 HA GLU 358 HA GLU 358 30.260 0.341 -1.984 141 HB2 GLU 358 HB2 GLU 358 30.199 -2.229 -1.368 142 HB3 GLU 358 HB1 GLU 358 29.247 -1.078 -0.441 143 HG2 GLU 358 HG2 GLU 358 27.952 -3.107 -1.127 144 HG3 GLU 358 HG1 GLU 358 27.262 -1.596 -1.725 Start of MODEL 12 1 H1 SER 339 HT1 SER 339 -1.002 4.621 -1.208 2 H2 SER 339 HT2 SER 339 -1.254 4.693 -2.887 3 H3 SER 339 HT3 SER 339 -0.760 6.079 -2.038 4 HA SER 339 HA SER 339 0.806 3.896 -3.072 5 HB2 SER 339 HB2 SER 339 1.021 6.327 -3.676 6 HB3 SER 339 HB1 SER 339 1.564 6.641 -2.030 7 HG SER 339 HG SER 339 3.326 6.306 -3.428 8 H ASP 340 HN ASP 340 0.239 2.546 -1.021 9 HA ASP 340 HA ASP 340 1.855 3.311 1.352 10 HB2 ASP 340 HB2 ASP 340 -0.524 2.303 1.445 11 HB3 ASP 340 HB1 ASP 340 0.244 0.773 1.029 12 H LYS 341 HN LYS 341 2.619 0.849 2.277 13 HA LYS 341 HA LYS 341 4.863 0.245 0.452 14 HB2 LYS 341 HB2 LYS 341 4.228 -0.354 3.350 15 HB3 LYS 341 HB1 LYS 341 5.576 -1.134 2.533 16 HG2 LYS 341 HG2 LYS 341 6.329 0.898 3.683 17 HG3 LYS 341 HG1 LYS 341 6.499 1.040 1.934 18 HD2 LYS 341 HD2 LYS 341 4.702 2.523 1.728 19 HD3 LYS 341 HD1 LYS 341 3.980 2.015 3.252 20 HE2 LYS 341 HE2 LYS 341 5.588 3.206 4.535 21 HE3 LYS 341 HE1 LYS 341 6.658 3.409 3.147 22 HZ1 LYS 341 HZ1 LYS 341 4.007 4.477 2.768 23 HZ2 LYS 341 HZ2 LYS 341 5.520 5.173 2.429 24 HZ3 LYS 341 HZ3 LYS 341 4.884 5.242 4.003 25 H GLU 342 HN GLU 342 5.167 -2.470 1.569 26 HA GLU 342 HA GLU 342 4.618 -4.652 1.071 27 HB2 GLU 342 HB2 GLU 342 1.821 -3.685 0.555 28 HB3 GLU 342 HB1 GLU 342 2.366 -5.272 1.052 29 HG2 GLU 342 HG2 GLU 342 2.759 -2.822 2.747 30 HG3 GLU 342 HG1 GLU 342 1.364 -3.858 2.837 31 H VAL 343 HN VAL 343 2.384 -2.817 -0.885 32 HA VAL 343 HA VAL 343 2.947 -4.195 -3.330 33 HB VAL 343 HB VAL 343 0.903 -2.756 -2.790 34 HG11 VAL 343 HG11 VAL 343 2.663 -0.531 -3.824 35 HG12 VAL 343 HG12 VAL 343 2.400 -0.800 -2.101 36 HG13 VAL 343 HG13 VAL 343 1.038 -0.407 -3.150 37 HG21 VAL 343 HG21 VAL 343 2.311 -2.216 -5.419 38 HG22 VAL 343 HG22 VAL 343 0.573 -2.160 -5.128 39 HG23 VAL 343 HG23 VAL 343 1.431 -3.699 -5.051 40 H ASP 344 HN ASP 344 4.769 -2.235 -1.560 41 HA ASP 344 HA ASP 344 6.904 -2.146 -3.447 42 HB2 ASP 344 HB2 ASP 344 5.598 -0.616 -4.662 43 HB3 ASP 344 HB1 ASP 344 5.066 0.203 -3.222 44 H GLU 345 HN GLU 345 8.622 -0.634 -2.691 45 HA GLU 345 HA GLU 345 8.499 0.128 0.164 46 HB2 GLU 345 HB2 GLU 345 10.647 -1.622 -1.031 47 HB3 GLU 345 HB1 GLU 345 10.489 -1.138 0.649 48 HG2 GLU 345 HG2 GLU 345 8.189 -2.290 0.580 49 HG3 GLU 345 HG1 GLU 345 8.742 -3.023 -0.921 50 H VAL 346 HN VAL 346 10.244 1.543 0.733 51 HA VAL 346 HA VAL 346 12.080 2.498 -1.303 52 HB VAL 346 HB VAL 346 9.816 4.229 -0.325 53 HG11 VAL 346 HG11 VAL 346 11.088 6.047 -1.645 54 HG12 VAL 346 HG12 VAL 346 12.492 4.986 -1.498 55 HG13 VAL 346 HG13 VAL 346 11.708 5.617 -0.050 56 HG21 VAL 346 HG21 VAL 346 9.731 4.724 -2.853 57 HG22 VAL 346 HG22 VAL 346 9.200 3.123 -2.341 58 HG23 VAL 346 HG23 VAL 346 10.802 3.337 -3.046 59 H ASP 347 HN ASP 347 10.976 2.281 1.809 60 HA ASP 347 HA ASP 347 13.143 3.969 2.913 61 HB2 ASP 347 HB2 ASP 347 10.586 3.606 3.668 62 HB3 ASP 347 HB1 ASP 347 11.300 2.286 4.582 63 H ALA 348 HN ALA 348 13.189 1.333 1.504 64 HA ALA 348 HA ALA 348 14.989 -0.090 3.431 65 HB1 ALA 348 HB1 ALA 348 12.717 -1.160 2.671 66 HB2 ALA 348 HB2 ALA 348 14.187 -2.144 2.635 67 HB3 ALA 348 HB3 ALA 348 13.561 -1.436 1.145 68 H ALA 349 HN ALA 349 14.402 1.556 0.574 69 HA ALA 349 HA ALA 349 16.504 0.545 -1.132 70 HB1 ALA 349 HB1 ALA 349 14.882 3.086 -0.990 71 HB2 ALA 349 HB2 ALA 349 14.741 1.766 -2.159 72 HB3 ALA 349 HB3 ALA 349 16.134 2.847 -2.217 73 H LEU 350 HN LEU 350 16.244 2.842 1.455 74 HA LEU 350 HA LEU 350 18.819 4.109 0.988 75 HB2 LEU 350 HB2 LEU 350 18.146 5.553 2.671 76 HB3 LEU 350 HB1 LEU 350 16.578 4.907 2.178 77 HG LEU 350 HG LEU 350 18.181 3.739 4.445 78 HD11 LEU 350 HD11 LEU 350 17.541 6.092 4.871 79 HD12 LEU 350 HD12 LEU 350 16.692 4.959 5.923 80 HD13 LEU 350 HD13 LEU 350 15.866 5.662 4.532 81 HD21 LEU 350 HD21 LEU 350 16.497 2.290 3.282 82 HD22 LEU 350 HD22 LEU 350 15.298 3.528 3.649 83 HD23 LEU 350 HD23 LEU 350 16.069 2.645 4.961 84 H SER 351 HN SER 351 17.753 1.195 2.189 85 HA SER 351 HA SER 351 20.259 0.783 3.797 86 HB2 SER 351 HB2 SER 351 18.191 0.455 5.122 87 HB3 SER 351 HB1 SER 351 17.620 -0.697 3.918 88 HG SER 351 HG SER 351 19.146 -2.114 4.535 89 H ASP 352 HN ASP 352 19.233 0.579 0.955 90 HA ASP 352 HA ASP 352 20.122 -2.163 0.214 91 HB2 ASP 352 HB2 ASP 352 17.894 -1.097 -0.340 92 HB3 ASP 352 HB1 ASP 352 18.771 0.007 -1.353 93 H LEU 353 HN LEU 353 21.236 0.611 0.807 94 HA LEU 353 HA LEU 353 22.976 1.091 -1.502 95 HB2 LEU 353 HB2 LEU 353 21.707 2.934 -0.806 96 HB3 LEU 353 HB1 LEU 353 21.800 2.428 0.883 97 HG LEU 353 HG LEU 353 24.332 3.092 -0.487 98 HD11 LEU 353 HD11 LEU 353 22.282 5.121 0.299 99 HD12 LEU 353 HD12 LEU 353 23.053 4.921 -1.273 100 HD13 LEU 353 HD13 LEU 353 23.986 5.521 0.101 101 HD21 LEU 353 HD21 LEU 353 23.380 2.966 2.291 102 HD22 LEU 353 HD22 LEU 353 24.295 4.429 1.965 103 HD23 LEU 353 HD23 LEU 353 25.007 2.867 1.644 104 H GLU 354 HN GLU 354 22.876 1.055 1.983 105 HA GLU 354 HA GLU 354 25.538 1.042 2.652 106 HB2 GLU 354 HB2 GLU 354 24.794 0.008 4.722 107 HB3 GLU 354 HB1 GLU 354 23.608 1.191 4.195 108 HG2 GLU 354 HG2 GLU 354 22.484 -0.771 2.951 109 HG3 GLU 354 HG1 GLU 354 23.511 -1.795 3.955 110 H ILE 355 HN ILE 355 23.488 -1.434 1.624 111 HA ILE 355 HA ILE 355 25.181 -3.696 2.096 112 HB ILE 355 HB ILE 355 23.232 -3.694 -0.202 113 HG12 ILE 355 HG12 ILE 355 22.513 -3.444 2.711 114 HG13 ILE 355 HG11 ILE 355 22.085 -2.401 1.352 115 HG21 ILE 355 HG21 ILE 355 24.574 -5.659 0.592 116 HG22 ILE 355 HG22 ILE 355 22.832 -5.901 0.522 117 HG23 ILE 355 HG23 ILE 355 23.619 -5.603 2.076 118 HD11 ILE 355 HD11 ILE 355 21.177 -5.265 1.809 119 HD12 ILE 355 HD12 ILE 355 20.884 -4.374 0.318 120 HD13 ILE 355 HD13 ILE 355 20.155 -3.836 1.826 121 H THR 356 HN THR 356 25.150 -1.273 -0.193 122 HA THR 356 HA THR 356 27.008 -2.829 -1.909 123 HB THR 356 HB THR 356 24.919 -2.789 -2.970 124 HG1 THR 356 HG1 THR 356 26.119 -0.562 -4.181 125 HG21 THR 356 HG21 THR 356 23.900 -1.059 -1.603 126 HG22 THR 356 HG22 THR 356 23.706 -0.640 -3.307 127 HG23 THR 356 HG23 THR 356 24.942 0.164 -2.339 128 H LEU 357 HN LEU 357 26.684 -0.100 -0.116 129 HA LEU 357 HA LEU 357 28.640 1.489 -1.713 130 HB2 LEU 357 HB2 LEU 357 26.413 2.173 -0.065 131 HB3 LEU 357 HB1 LEU 357 27.833 2.700 0.820 132 HG LEU 357 HG LEU 357 28.597 3.780 -1.356 133 HD11 LEU 357 HD11 LEU 357 26.706 2.348 -2.583 134 HD12 LEU 357 HD12 LEU 357 27.186 3.935 -3.186 135 HD13 LEU 357 HD13 LEU 357 25.725 3.769 -2.217 136 HD21 LEU 357 HD21 LEU 357 27.825 5.251 0.331 137 HD22 LEU 357 HD22 LEU 357 26.163 4.678 0.188 138 HD23 LEU 357 HD23 LEU 357 26.861 5.686 -1.080 139 H GLU 358 HN GLU 358 28.612 -0.943 0.033 140 HA GLU 358 HA GLU 358 30.574 -0.365 2.132 141 HB2 GLU 358 HB2 GLU 358 30.393 -3.003 2.264 142 HB3 GLU 358 HB1 GLU 358 29.085 -1.996 2.865 143 HG2 GLU 358 HG2 GLU 358 28.298 -3.857 1.395 144 HG3 GLU 358 HG1 GLU 358 27.863 -2.257 0.791 Start of MODEL 13 1 H1 SER 339 HT1 SER 339 4.437 2.151 2.937 2 H2 SER 339 HT2 SER 339 5.665 1.021 3.256 3 H3 SER 339 HT3 SER 339 5.525 2.421 4.209 4 HA SER 339 HA SER 339 4.677 0.408 5.327 5 HB2 SER 339 HB2 SER 339 2.585 2.499 4.658 6 HB3 SER 339 HB1 SER 339 2.587 1.449 6.071 7 HG SER 339 HG SER 339 3.656 3.075 6.902 8 H ASP 340 HN ASP 340 4.052 0.528 2.101 9 HA ASP 340 HA ASP 340 2.474 -1.918 2.179 10 HB2 ASP 340 HB2 ASP 340 0.612 -0.896 0.756 11 HB3 ASP 340 HB1 ASP 340 0.597 -0.461 2.466 12 H LYS 341 HN LYS 341 1.705 -2.307 -0.273 13 HA LYS 341 HA LYS 341 4.193 -2.054 -1.848 14 HB2 LYS 341 HB2 LYS 341 1.682 -3.718 -2.066 15 HB3 LYS 341 HB1 LYS 341 2.846 -3.642 -3.385 16 HG2 LYS 341 HG2 LYS 341 3.329 -5.553 -1.907 17 HG3 LYS 341 HG1 LYS 341 4.630 -4.362 -1.871 18 HD2 LYS 341 HD2 LYS 341 4.063 -3.587 0.262 19 HD3 LYS 341 HD1 LYS 341 2.411 -4.189 0.151 20 HE2 LYS 341 HE2 LYS 341 3.108 -6.448 0.471 21 HE3 LYS 341 HE1 LYS 341 4.801 -6.041 0.195 22 HZ1 LYS 341 HZ1 LYS 341 4.938 -5.857 2.393 23 HZ2 LYS 341 HZ2 LYS 341 3.251 -5.863 2.596 24 HZ3 LYS 341 HZ3 LYS 341 4.062 -4.412 2.243 25 H GLU 342 HN GLU 342 3.066 -2.210 -4.410 26 HA GLU 342 HA GLU 342 2.255 -0.935 -6.138 27 HB2 GLU 342 HB2 GLU 342 0.639 0.714 -4.241 28 HB3 GLU 342 HB1 GLU 342 0.227 0.110 -5.839 29 HG2 GLU 342 HG2 GLU 342 0.507 -2.238 -4.552 30 HG3 GLU 342 HG1 GLU 342 0.034 -1.241 -3.202 31 H VAL 343 HN VAL 343 2.285 1.215 -3.374 32 HA VAL 343 HA VAL 343 3.827 3.227 -4.859 33 HB VAL 343 HB VAL 343 1.881 3.781 -3.264 34 HG11 VAL 343 HG11 VAL 343 2.363 3.787 -0.914 35 HG12 VAL 343 HG12 VAL 343 4.075 3.443 -1.195 36 HG13 VAL 343 HG13 VAL 343 2.863 2.201 -1.505 37 HG21 VAL 343 HG21 VAL 343 4.555 5.132 -2.771 38 HG22 VAL 343 HG22 VAL 343 2.962 5.844 -2.516 39 HG23 VAL 343 HG23 VAL 343 3.506 5.464 -4.150 40 H ASP 344 HN ASP 344 4.156 1.186 -2.183 41 HA ASP 344 HA ASP 344 6.024 0.435 -1.074 42 HB2 ASP 344 HB2 ASP 344 6.472 0.020 -3.552 43 HB3 ASP 344 HB1 ASP 344 7.569 1.374 -3.438 44 H GLU 345 HN GLU 345 8.478 1.207 -0.713 45 HA GLU 345 HA GLU 345 8.388 4.108 0.019 46 HB2 GLU 345 HB2 GLU 345 9.590 1.752 1.467 47 HB3 GLU 345 HB1 GLU 345 9.731 3.428 1.980 48 HG2 GLU 345 HG2 GLU 345 7.099 3.395 1.843 49 HG3 GLU 345 HG1 GLU 345 7.303 1.649 1.946 50 H VAL 346 HN VAL 346 10.527 5.066 0.200 51 HA VAL 346 HA VAL 346 12.649 3.743 -1.411 52 HB VAL 346 HB VAL 346 11.417 6.464 -1.789 53 HG11 VAL 346 HG11 VAL 346 13.701 7.060 -1.553 54 HG12 VAL 346 HG12 VAL 346 13.440 6.934 -3.294 55 HG13 VAL 346 HG13 VAL 346 14.247 5.627 -2.425 56 HG21 VAL 346 HG21 VAL 346 12.375 4.364 -3.759 57 HG22 VAL 346 HG22 VAL 346 11.458 5.820 -4.145 58 HG23 VAL 346 HG23 VAL 346 10.709 4.532 -3.202 59 H ASP 347 HN ASP 347 11.739 4.981 1.371 60 HA ASP 347 HA ASP 347 14.334 6.235 2.066 61 HB2 ASP 347 HB2 ASP 347 11.820 6.873 2.771 62 HB3 ASP 347 HB1 ASP 347 12.152 5.737 4.069 63 H ALA 348 HN ALA 348 13.558 3.376 1.537 64 HA ALA 348 HA ALA 348 15.027 2.191 3.862 65 HB1 ALA 348 HB1 ALA 348 13.629 0.304 3.793 66 HB2 ALA 348 HB2 ALA 348 13.040 0.680 2.172 67 HB3 ALA 348 HB3 ALA 348 12.498 1.639 3.553 68 H ALA 349 HN ALA 349 14.752 2.994 0.670 69 HA ALA 349 HA ALA 349 16.277 0.864 -0.583 70 HB1 ALA 349 HB1 ALA 349 15.383 3.641 -1.347 71 HB2 ALA 349 HB2 ALA 349 14.839 2.094 -2.009 72 HB3 ALA 349 HB3 ALA 349 16.449 2.700 -2.400 73 H LEU 350 HN LEU 350 16.866 3.937 0.953 74 HA LEU 350 HA LEU 350 19.612 4.224 0.131 75 HB2 LEU 350 HB2 LEU 350 19.521 6.196 1.352 76 HB3 LEU 350 HB1 LEU 350 17.805 5.908 1.060 77 HG LEU 350 HG LEU 350 19.212 5.018 3.569 78 HD11 LEU 350 HD11 LEU 350 18.211 6.950 4.632 79 HD12 LEU 350 HD12 LEU 350 17.461 7.424 3.108 80 HD13 LEU 350 HD13 LEU 350 19.214 7.485 3.284 81 HD21 LEU 350 HD21 LEU 350 17.170 3.771 2.954 82 HD22 LEU 350 HD22 LEU 350 16.333 5.308 2.777 83 HD23 LEU 350 HD23 LEU 350 16.886 4.796 4.366 84 H SER 351 HN SER 351 17.995 2.158 2.166 85 HA SER 351 HA SER 351 20.470 1.552 3.769 86 HB2 SER 351 HB2 SER 351 18.421 2.230 5.088 87 HB3 SER 351 HB1 SER 351 17.611 0.827 4.395 88 HG SER 351 HG SER 351 19.991 0.095 5.370 89 H ASP 352 HN ASP 352 19.378 0.858 1.116 90 HA ASP 352 HA ASP 352 19.416 -2.115 1.299 91 HB2 ASP 352 HB2 ASP 352 17.355 -0.760 0.636 92 HB3 ASP 352 HB1 ASP 352 18.223 -0.357 -0.812 93 H LEU 353 HN LEU 353 21.233 0.234 0.855 94 HA LEU 353 HA LEU 353 22.587 -0.603 -1.663 95 HB2 LEU 353 HB2 LEU 353 21.828 1.579 -1.905 96 HB3 LEU 353 HB1 LEU 353 21.966 1.889 -0.178 97 HG LEU 353 HG LEU 353 24.443 1.863 -0.438 98 HD11 LEU 353 HD11 LEU 353 24.610 0.481 -2.415 99 HD12 LEU 353 HD12 LEU 353 25.290 2.067 -2.785 100 HD13 LEU 353 HD13 LEU 353 23.670 1.644 -3.346 101 HD21 LEU 353 HD21 LEU 353 24.515 4.037 -1.567 102 HD22 LEU 353 HD22 LEU 353 23.199 3.895 -0.394 103 HD23 LEU 353 HD23 LEU 353 22.864 3.759 -2.125 104 H GLU 354 HN GLU 354 23.189 1.104 1.329 105 HA GLU 354 HA GLU 354 25.858 0.491 1.731 106 HB2 GLU 354 HB2 GLU 354 25.329 0.949 4.117 107 HB3 GLU 354 HB1 GLU 354 24.676 2.156 3.018 108 HG2 GLU 354 HG2 GLU 354 22.537 0.850 2.977 109 HG3 GLU 354 HG1 GLU 354 23.208 -0.165 4.245 110 H ILE 355 HN ILE 355 23.027 -1.224 2.394 111 HA ILE 355 HA ILE 355 24.109 -3.231 4.060 112 HB ILE 355 HB ILE 355 21.669 -2.323 3.519 113 HG12 ILE 355 HG12 ILE 355 20.801 -4.538 4.430 114 HG13 ILE 355 HG11 ILE 355 22.472 -5.051 4.238 115 HG21 ILE 355 HG21 ILE 355 20.348 -3.910 2.237 116 HG22 ILE 355 HG22 ILE 355 21.808 -4.739 1.740 117 HG23 ILE 355 HG23 ILE 355 21.530 -3.065 1.250 118 HD11 ILE 355 HD11 ILE 355 23.176 -3.925 6.090 119 HD12 ILE 355 HD12 ILE 355 21.471 -3.877 6.523 120 HD13 ILE 355 HD13 ILE 355 22.209 -2.497 5.705 121 H THR 356 HN THR 356 23.839 -2.760 0.789 122 HA THR 356 HA THR 356 24.729 -5.523 0.160 123 HB THR 356 HB THR 356 22.630 -4.985 -0.774 124 HG1 THR 356 HG1 THR 356 23.152 -5.142 -3.015 125 HG21 THR 356 HG21 THR 356 22.381 -3.013 -2.285 126 HG22 THR 356 HG22 THR 356 24.013 -2.526 -1.837 127 HG23 THR 356 HG23 THR 356 22.744 -2.594 -0.615 128 H LEU 357 HN LEU 357 25.748 -2.332 0.079 129 HA LEU 357 HA LEU 357 27.656 -2.641 -2.127 130 HB2 LEU 357 HB2 LEU 357 26.397 -0.487 -1.264 131 HB3 LEU 357 HB1 LEU 357 27.682 -0.440 -0.065 132 HG LEU 357 HG LEU 357 27.911 -0.257 -3.070 133 HD11 LEU 357 HD11 LEU 357 27.382 1.771 -1.775 134 HD12 LEU 357 HD12 LEU 357 28.999 1.877 -2.478 135 HD13 LEU 357 HD13 LEU 357 28.797 1.489 -0.766 136 HD21 LEU 357 HD21 LEU 357 29.748 -1.679 -2.472 137 HD22 LEU 357 HD22 LEU 357 30.053 -0.773 -0.988 138 HD23 LEU 357 HD23 LEU 357 30.418 -0.053 -2.553 139 H GLU 358 HN GLU 358 27.276 -2.719 1.169 140 HA GLU 358 HA GLU 358 29.815 -2.660 2.295 141 HB2 GLU 358 HB2 GLU 358 28.854 -4.312 3.959 142 HB3 GLU 358 HB1 GLU 358 27.916 -2.850 3.721 143 HG2 GLU 358 HG2 GLU 358 26.339 -4.618 3.648 144 HG3 GLU 358 HG1 GLU 358 26.607 -4.175 1.961 Start of MODEL 14 1 H1 SER 339 HT1 SER 339 -0.101 1.967 3.181 2 H2 SER 339 HT2 SER 339 -0.941 1.356 4.525 3 H3 SER 339 HT3 SER 339 -1.763 1.651 3.068 4 HA SER 339 HA SER 339 -0.481 -0.700 3.903 5 HB2 SER 339 HB2 SER 339 -1.839 0.112 1.316 6 HB3 SER 339 HB1 SER 339 -1.469 -1.546 1.782 7 HG SER 339 HG SER 339 -2.713 -0.987 3.761 8 H ASP 340 HN ASP 340 0.072 1.288 0.969 9 HA ASP 340 HA ASP 340 1.915 1.325 -0.488 10 HB2 ASP 340 HB2 ASP 340 3.460 0.723 2.050 11 HB3 ASP 340 HB1 ASP 340 4.069 1.524 0.601 12 H LYS 341 HN LYS 341 4.379 -0.341 0.439 13 HA LYS 341 HA LYS 341 5.213 -2.476 0.098 14 HB2 LYS 341 HB2 LYS 341 3.974 -4.140 1.029 15 HB3 LYS 341 HB1 LYS 341 2.724 -2.932 1.247 16 HG2 LYS 341 HG2 LYS 341 1.530 -4.565 0.113 17 HG3 LYS 341 HG1 LYS 341 2.071 -3.601 -1.233 18 HD2 LYS 341 HD2 LYS 341 2.620 -5.788 -1.908 19 HD3 LYS 341 HD1 LYS 341 4.143 -5.167 -1.285 20 HE2 LYS 341 HE2 LYS 341 4.021 -6.439 0.672 21 HE3 LYS 341 HE1 LYS 341 2.274 -6.617 0.564 22 HZ1 LYS 341 HZ1 LYS 341 3.098 -7.771 -1.713 23 HZ2 LYS 341 HZ2 LYS 341 2.762 -8.611 -0.275 24 HZ3 LYS 341 HZ3 LYS 341 4.361 -8.182 -0.658 25 H GLU 342 HN GLU 342 2.783 -1.214 -1.918 26 HA GLU 342 HA GLU 342 2.825 -2.788 -4.199 27 HB2 GLU 342 HB2 GLU 342 3.045 -0.236 -5.307 28 HB3 GLU 342 HB1 GLU 342 1.537 -0.982 -4.774 29 HG2 GLU 342 HG2 GLU 342 1.672 0.044 -2.639 30 HG3 GLU 342 HG1 GLU 342 3.342 0.526 -2.899 31 H VAL 343 HN VAL 343 4.824 0.107 -4.307 32 HA VAL 343 HA VAL 343 6.991 -1.474 -5.582 33 HB VAL 343 HB VAL 343 6.011 0.847 -6.419 34 HG11 VAL 343 HG11 VAL 343 7.020 2.785 -5.475 35 HG12 VAL 343 HG12 VAL 343 8.187 1.820 -4.563 36 HG13 VAL 343 HG13 VAL 343 6.487 1.821 -4.095 37 HG21 VAL 343 HG21 VAL 343 7.841 -0.218 -7.578 38 HG22 VAL 343 HG22 VAL 343 8.957 0.152 -6.263 39 HG23 VAL 343 HG23 VAL 343 8.324 1.451 -7.274 40 H ASP 344 HN ASP 344 6.010 -0.911 -2.710 41 HA ASP 344 HA ASP 344 7.049 -1.223 -0.658 42 HB2 ASP 344 HB2 ASP 344 8.787 -2.344 -2.264 43 HB3 ASP 344 HB1 ASP 344 9.733 -0.932 -1.910 44 H GLU 345 HN GLU 345 8.880 -0.033 0.653 45 HA GLU 345 HA GLU 345 8.232 2.821 0.488 46 HB2 GLU 345 HB2 GLU 345 9.686 1.028 2.379 47 HB3 GLU 345 HB1 GLU 345 9.794 2.779 2.563 48 HG2 GLU 345 HG2 GLU 345 7.105 1.433 2.265 49 HG3 GLU 345 HG1 GLU 345 7.906 1.490 3.822 50 H VAL 346 HN VAL 346 10.066 4.370 0.795 51 HA VAL 346 HA VAL 346 12.477 3.599 -0.781 52 HB VAL 346 HB VAL 346 10.721 6.036 -0.978 53 HG11 VAL 346 HG11 VAL 346 13.662 5.819 -1.625 54 HG12 VAL 346 HG12 VAL 346 12.845 7.046 -0.658 55 HG13 VAL 346 HG13 VAL 346 12.617 7.007 -2.408 56 HG21 VAL 346 HG21 VAL 346 10.957 5.598 -3.395 57 HG22 VAL 346 HG22 VAL 346 10.368 4.163 -2.555 58 HG23 VAL 346 HG23 VAL 346 12.058 4.264 -3.049 59 H ASP 347 HN ASP 347 11.258 4.491 2.038 60 HA ASP 347 HA ASP 347 13.636 6.076 2.889 61 HB2 ASP 347 HB2 ASP 347 11.036 6.442 3.441 62 HB3 ASP 347 HB1 ASP 347 11.392 5.311 4.737 63 H ALA 348 HN ALA 348 13.300 3.219 2.236 64 HA ALA 348 HA ALA 348 14.816 2.133 4.560 65 HB1 ALA 348 HB1 ALA 348 12.910 0.445 2.939 66 HB2 ALA 348 HB2 ALA 348 12.334 1.348 4.341 67 HB3 ALA 348 HB3 ALA 348 13.592 0.120 4.533 68 H ALA 349 HN ALA 349 14.318 2.897 1.392 69 HA ALA 349 HA ALA 349 15.965 0.940 0.037 70 HB1 ALA 349 HB1 ALA 349 14.813 3.650 -0.616 71 HB2 ALA 349 HB2 ALA 349 14.383 2.079 -1.308 72 HB3 ALA 349 HB3 ALA 349 15.918 2.836 -1.733 73 H LEU 350 HN LEU 350 16.332 4.061 1.551 74 HA LEU 350 HA LEU 350 19.002 4.626 0.684 75 HB2 LEU 350 HB2 LEU 350 18.807 6.499 2.063 76 HB3 LEU 350 HB1 LEU 350 17.124 6.111 1.704 77 HG LEU 350 HG LEU 350 18.555 5.202 4.194 78 HD11 LEU 350 HD11 LEU 350 17.340 6.940 5.338 79 HD12 LEU 350 HD12 LEU 350 16.507 7.382 3.847 80 HD13 LEU 350 HD13 LEU 350 18.238 7.674 4.009 81 HD21 LEU 350 HD21 LEU 350 15.724 5.058 3.188 82 HD22 LEU 350 HD22 LEU 350 16.135 4.815 4.882 83 HD23 LEU 350 HD23 LEU 350 16.750 3.708 3.656 84 H SER 351 HN SER 351 17.713 2.311 2.668 85 HA SER 351 HA SER 351 20.318 1.896 4.122 86 HB2 SER 351 HB2 SER 351 18.318 2.379 5.591 87 HB3 SER 351 HB1 SER 351 17.572 0.934 4.912 88 HG SER 351 HG SER 351 18.833 0.759 6.972 89 H ASP 352 HN ASP 352 19.158 1.169 1.528 90 HA ASP 352 HA ASP 352 19.465 -1.796 1.632 91 HB2 ASP 352 HB2 ASP 352 17.228 -0.624 1.159 92 HB3 ASP 352 HB1 ASP 352 17.947 -0.126 -0.343 93 H LEU 353 HN LEU 353 20.908 0.831 1.032 94 HA LEU 353 HA LEU 353 22.159 0.150 -1.557 95 HB2 LEU 353 HB2 LEU 353 21.169 2.280 -1.577 96 HB3 LEU 353 HB1 LEU 353 21.530 2.516 0.134 97 HG LEU 353 HG LEU 353 23.990 2.156 -1.374 98 HD11 LEU 353 HD11 LEU 353 23.896 4.281 -2.616 99 HD12 LEU 353 HD12 LEU 353 22.163 4.336 -2.282 100 HD13 LEU 353 HD13 LEU 353 22.833 3.027 -3.251 101 HD21 LEU 353 HD21 LEU 353 24.421 4.517 -0.445 102 HD22 LEU 353 HD22 LEU 353 24.155 3.242 0.725 103 HD23 LEU 353 HD23 LEU 353 22.855 4.361 0.344 104 H GLU 354 HN GLU 354 22.744 1.743 1.490 105 HA GLU 354 HA GLU 354 25.471 1.526 1.602 106 HB2 GLU 354 HB2 GLU 354 25.194 1.820 4.026 107 HB3 GLU 354 HB1 GLU 354 24.123 2.878 3.125 108 HG2 GLU 354 HG2 GLU 354 22.362 1.080 3.321 109 HG3 GLU 354 HG1 GLU 354 23.436 0.267 4.449 110 H ILE 355 HN ILE 355 23.029 -0.647 2.484 111 HA ILE 355 HA ILE 355 24.542 -2.565 3.875 112 HB ILE 355 HB ILE 355 21.982 -2.037 3.651 113 HG12 ILE 355 HG12 ILE 355 21.496 -4.440 4.297 114 HG13 ILE 355 HG11 ILE 355 23.180 -4.706 3.869 115 HG21 ILE 355 HG21 ILE 355 22.245 -4.163 1.549 116 HG22 ILE 355 HG22 ILE 355 21.753 -2.491 1.300 117 HG23 ILE 355 HG23 ILE 355 20.748 -3.570 2.249 118 HD11 ILE 355 HD11 ILE 355 23.962 -3.766 5.796 119 HD12 ILE 355 HD12 ILE 355 22.326 -4.022 6.394 120 HD13 ILE 355 HD13 ILE 355 22.786 -2.448 5.740 121 H THR 356 HN THR 356 23.895 -1.987 0.673 122 HA THR 356 HA THR 356 25.120 -4.545 -0.192 123 HB THR 356 HB THR 356 22.882 -4.254 -0.938 124 HG1 THR 356 HG1 THR 356 23.227 -4.423 -3.131 125 HG21 THR 356 HG21 THR 356 22.259 -2.256 -2.286 126 HG22 THR 356 HG22 THR 356 23.856 -1.586 -1.961 127 HG23 THR 356 HG23 THR 356 22.730 -1.863 -0.638 128 H LEU 357 HN LEU 357 25.645 -1.213 -0.182 129 HA LEU 357 HA LEU 357 27.616 -1.312 -2.382 130 HB2 LEU 357 HB2 LEU 357 25.710 0.534 -1.864 131 HB3 LEU 357 HB1 LEU 357 27.005 1.204 -0.883 132 HG LEU 357 HG LEU 357 27.059 2.163 -3.072 133 HD11 LEU 357 HD11 LEU 357 29.190 1.562 -1.857 134 HD12 LEU 357 HD12 LEU 357 29.362 1.812 -3.594 135 HD13 LEU 357 HD13 LEU 357 29.314 0.176 -2.940 136 HD21 LEU 357 HD21 LEU 357 27.758 -0.369 -4.484 137 HD22 LEU 357 HD22 LEU 357 26.901 1.049 -5.076 138 HD23 LEU 357 HD23 LEU 357 26.056 -0.130 -4.079 139 H GLU 358 HN GLU 358 27.186 -1.714 0.764 140 HA GLU 358 HA GLU 358 29.136 -0.558 2.289 141 HB2 GLU 358 HB2 GLU 358 29.330 -2.970 3.322 142 HB3 GLU 358 HB1 GLU 358 27.815 -2.098 3.438 143 HG2 GLU 358 HG2 GLU 358 27.473 -4.428 2.677 144 HG3 GLU 358 HG1 GLU 358 26.979 -3.264 1.449 Start of MODEL 15 1 H1 SER 339 HT1 SER 339 1.198 4.519 -4.173 2 H2 SER 339 HT2 SER 339 2.714 4.206 -3.473 3 H3 SER 339 HT3 SER 339 2.401 5.715 -4.189 4 HA SER 339 HA SER 339 2.300 5.942 -1.811 5 HB2 SER 339 HB2 SER 339 -0.461 5.953 -3.067 6 HB3 SER 339 HB1 SER 339 0.024 6.848 -1.630 7 HG SER 339 HG SER 339 1.772 7.614 -3.238 8 H ASP 340 HN ASP 340 0.836 5.422 0.133 9 HA ASP 340 HA ASP 340 0.152 3.770 1.662 10 HB2 ASP 340 HB2 ASP 340 -1.131 2.465 -0.749 11 HB3 ASP 340 HB1 ASP 340 -1.661 2.389 0.932 12 H LYS 341 HN LYS 341 -0.175 1.060 1.476 13 HA LYS 341 HA LYS 341 2.626 0.196 0.984 14 HB2 LYS 341 HB2 LYS 341 0.306 -0.898 2.575 15 HB3 LYS 341 HB1 LYS 341 1.706 -1.905 2.202 16 HG2 LYS 341 HG2 LYS 341 2.031 -0.795 4.367 17 HG3 LYS 341 HG1 LYS 341 3.188 -0.190 3.175 18 HD2 LYS 341 HD2 LYS 341 2.108 1.867 2.949 19 HD3 LYS 341 HD1 LYS 341 0.564 1.239 3.515 20 HE2 LYS 341 HE2 LYS 341 1.499 1.021 5.799 21 HE3 LYS 341 HE1 LYS 341 3.032 1.678 5.225 22 HZ1 LYS 341 HZ1 LYS 341 1.728 3.660 4.472 23 HZ2 LYS 341 HZ2 LYS 341 1.827 3.462 6.157 24 HZ3 LYS 341 HZ3 LYS 341 0.403 3.042 5.331 25 H GLU 342 HN GLU 342 3.178 -1.012 -0.570 26 HA GLU 342 HA GLU 342 1.263 -2.718 -2.050 27 HB2 GLU 342 HB2 GLU 342 2.931 -1.782 -4.061 28 HB3 GLU 342 HB1 GLU 342 1.309 -1.187 -3.755 29 HG2 GLU 342 HG2 GLU 342 2.084 0.626 -2.460 30 HG3 GLU 342 HG1 GLU 342 3.696 -0.066 -2.332 31 H VAL 343 HN VAL 343 4.592 -1.606 -2.124 32 HA VAL 343 HA VAL 343 5.570 -4.404 -1.989 33 HB VAL 343 HB VAL 343 6.292 -2.891 -3.943 34 HG11 VAL 343 HG11 VAL 343 8.033 -1.633 -1.807 35 HG12 VAL 343 HG12 VAL 343 6.486 -0.925 -2.265 36 HG13 VAL 343 HG13 VAL 343 7.773 -1.083 -3.466 37 HG21 VAL 343 HG21 VAL 343 8.469 -3.923 -2.091 38 HG22 VAL 343 HG22 VAL 343 8.625 -3.644 -3.825 39 HG23 VAL 343 HG23 VAL 343 7.563 -4.921 -3.229 40 H ASP 344 HN ASP 344 5.613 -1.313 -0.674 41 HA ASP 344 HA ASP 344 6.410 -0.532 1.338 42 HB2 ASP 344 HB2 ASP 344 4.769 -2.393 1.821 43 HB3 ASP 344 HB1 ASP 344 6.174 -3.360 2.193 44 H GLU 345 HN GLU 345 7.953 -1.728 3.316 45 HA GLU 345 HA GLU 345 10.215 -1.998 3.816 46 HB2 GLU 345 HB2 GLU 345 10.078 -3.655 1.332 47 HB3 GLU 345 HB1 GLU 345 11.166 -3.879 2.701 48 HG2 GLU 345 HG2 GLU 345 8.935 -4.087 4.084 49 HG3 GLU 345 HG1 GLU 345 8.220 -4.432 2.515 50 H VAL 346 HN VAL 346 9.449 0.146 1.879 51 HA VAL 346 HA VAL 346 11.688 0.290 0.000 52 HB VAL 346 HB VAL 346 9.361 2.078 0.685 53 HG11 VAL 346 HG11 VAL 346 11.099 3.687 0.546 54 HG12 VAL 346 HG12 VAL 346 10.351 3.685 -1.054 55 HG13 VAL 346 HG13 VAL 346 11.881 2.844 -0.790 56 HG21 VAL 346 HG21 VAL 346 9.018 1.924 -1.794 57 HG22 VAL 346 HG22 VAL 346 8.981 0.353 -0.992 58 HG23 VAL 346 HG23 VAL 346 10.418 0.855 -1.884 59 H ASP 347 HN ASP 347 11.214 0.587 3.102 60 HA ASP 347 HA ASP 347 13.134 2.768 3.590 61 HB2 ASP 347 HB2 ASP 347 10.822 2.028 4.833 62 HB3 ASP 347 HB1 ASP 347 11.978 1.115 5.800 63 H ALA 348 HN ALA 348 13.392 -0.045 2.552 64 HA ALA 348 HA ALA 348 15.727 -0.869 4.239 65 HB1 ALA 348 HB1 ALA 348 13.628 -2.381 4.148 66 HB2 ALA 348 HB2 ALA 348 15.189 -3.130 3.786 67 HB3 ALA 348 HB3 ALA 348 14.090 -2.696 2.475 68 H ALA 349 HN ALA 349 14.427 0.287 1.411 69 HA ALA 349 HA ALA 349 16.346 -0.692 -0.541 70 HB1 ALA 349 HB1 ALA 349 15.338 1.297 -1.837 71 HB2 ALA 349 HB2 ALA 349 14.276 1.500 -0.436 72 HB3 ALA 349 HB3 ALA 349 14.234 0.002 -1.373 73 H LEU 350 HN LEU 350 16.092 1.905 1.739 74 HA LEU 350 HA LEU 350 18.231 3.509 0.581 75 HB2 LEU 350 HB2 LEU 350 17.595 5.083 2.156 76 HB3 LEU 350 HB1 LEU 350 16.122 4.115 2.080 77 HG LEU 350 HG LEU 350 18.290 3.631 4.116 78 HD11 LEU 350 HD11 LEU 350 16.892 4.822 5.685 79 HD12 LEU 350 HD12 LEU 350 15.678 5.094 4.435 80 HD13 LEU 350 HD13 LEU 350 17.250 5.884 4.323 81 HD21 LEU 350 HD21 LEU 350 15.415 2.802 3.944 82 HD22 LEU 350 HD22 LEU 350 16.555 2.297 5.185 83 HD23 LEU 350 HD23 LEU 350 16.753 1.741 3.517 84 H SER 351 HN SER 351 17.979 0.705 2.360 85 HA SER 351 HA SER 351 20.737 1.009 3.515 86 HB2 SER 351 HB2 SER 351 19.064 0.488 5.234 87 HB3 SER 351 HB1 SER 351 18.473 -0.858 4.263 88 HG SER 351 HG SER 351 20.994 -0.556 5.527 89 H ASP 352 HN ASP 352 19.365 0.204 0.942 90 HA ASP 352 HA ASP 352 20.696 -2.395 0.364 91 HB2 ASP 352 HB2 ASP 352 18.222 -1.846 0.112 92 HB3 ASP 352 HB1 ASP 352 18.690 -0.784 -1.179 93 H LEU 353 HN LEU 353 21.243 0.618 0.419 94 HA LEU 353 HA LEU 353 22.485 1.062 -2.198 95 HB2 LEU 353 HB2 LEU 353 20.984 2.730 -1.531 96 HB3 LEU 353 HB1 LEU 353 21.400 2.494 0.168 97 HG LEU 353 HG LEU 353 23.585 3.402 -1.593 98 HD11 LEU 353 HD11 LEU 353 21.922 4.782 -2.527 99 HD12 LEU 353 HD12 LEU 353 22.806 5.785 -1.374 100 HD13 LEU 353 HD13 LEU 353 21.231 5.118 -0.941 101 HD21 LEU 353 HD21 LEU 353 22.998 3.494 1.248 102 HD22 LEU 353 HD22 LEU 353 23.329 5.115 0.669 103 HD23 LEU 353 HD23 LEU 353 24.499 3.841 0.411 104 H GLU 354 HN GLU 354 22.882 1.512 1.231 105 HA GLU 354 HA GLU 354 25.535 2.163 1.435 106 HB2 GLU 354 HB2 GLU 354 25.353 1.326 3.711 107 HB3 GLU 354 HB1 GLU 354 23.860 2.134 3.260 108 HG2 GLU 354 HG2 GLU 354 23.059 -0.183 2.469 109 HG3 GLU 354 HG1 GLU 354 24.434 -0.805 3.384 110 H ILE 355 HN ILE 355 23.993 -0.805 1.053 111 HA ILE 355 HA ILE 355 26.210 -2.571 1.494 112 HB ILE 355 HB ILE 355 24.003 -3.328 -0.412 113 HG12 ILE 355 HG12 ILE 355 23.653 -2.779 2.527 114 HG13 ILE 355 HG11 ILE 355 22.820 -2.066 1.143 115 HG21 ILE 355 HG21 ILE 355 25.854 -4.824 0.379 116 HG22 ILE 355 HG22 ILE 355 24.220 -5.428 0.636 117 HG23 ILE 355 HG23 ILE 355 25.126 -4.733 1.985 118 HD11 ILE 355 HD11 ILE 355 21.952 -4.365 0.567 119 HD12 ILE 355 HD12 ILE 355 21.352 -3.779 2.114 120 HD13 ILE 355 HD13 ILE 355 22.653 -4.955 2.070 121 H THR 356 HN THR 356 25.307 -0.573 -1.011 122 HA THR 356 HA THR 356 27.191 -1.957 -2.844 123 HB THR 356 HB THR 356 25.003 -2.533 -3.476 124 HG1 THR 356 HG1 THR 356 24.931 -0.766 -5.384 125 HG21 THR 356 HG21 THR 356 23.299 -0.749 -3.862 126 HG22 THR 356 HG22 THR 356 24.459 0.428 -3.246 127 HG23 THR 356 HG23 THR 356 23.841 -0.840 -2.183 128 H LEU 357 HN LEU 357 26.517 0.881 -1.358 129 HA LEU 357 HA LEU 357 27.761 2.573 -3.477 130 HB2 LEU 357 HB2 LEU 357 25.694 3.479 -2.528 131 HB3 LEU 357 HB1 LEU 357 26.305 3.233 -0.897 132 HG LEU 357 HG LEU 357 27.897 4.980 -1.120 133 HD11 LEU 357 HD11 LEU 357 28.851 4.600 -3.270 134 HD12 LEU 357 HD12 LEU 357 28.097 6.189 -3.386 135 HD13 LEU 357 HD13 LEU 357 27.291 4.778 -4.071 136 HD21 LEU 357 HD21 LEU 357 25.579 5.762 -0.819 137 HD22 LEU 357 HD22 LEU 357 25.380 5.842 -2.569 138 HD23 LEU 357 HD23 LEU 357 26.518 6.920 -1.761 139 H GLU 358 HN GLU 358 28.602 0.497 -1.472 140 HA GLU 358 HA GLU 358 30.584 1.858 0.207 141 HB2 GLU 358 HB2 GLU 358 31.093 -0.710 0.678 142 HB3 GLU 358 HB1 GLU 358 29.684 0.070 1.382 143 HG2 GLU 358 HG2 GLU 358 29.162 -2.128 0.306 144 HG3 GLU 358 HG1 GLU 358 28.264 -0.778 -0.390 Start of MODEL 16 1 H1 SER 339 HT1 SER 339 -1.396 3.963 -3.530 2 H2 SER 339 HT2 SER 339 -3.019 3.824 -3.047 3 H3 SER 339 HT3 SER 339 -2.199 2.477 -3.680 4 HA SER 339 HA SER 339 -1.568 3.849 -1.124 5 HB2 SER 339 HB2 SER 339 -2.846 1.169 -1.743 6 HB3 SER 339 HB1 SER 339 -2.329 1.681 -0.139 7 HG SER 339 HG SER 339 -4.610 2.065 -0.783 8 H ASP 340 HN ASP 340 0.494 3.753 -2.835 9 HA ASP 340 HA ASP 340 1.921 1.330 -3.129 10 HB2 ASP 340 HB2 ASP 340 3.185 4.027 -2.580 11 HB3 ASP 340 HB1 ASP 340 3.882 2.682 -3.482 12 H LYS 341 HN LYS 341 4.219 1.174 -1.884 13 HA LYS 341 HA LYS 341 5.304 0.717 0.124 14 HB2 LYS 341 HB2 LYS 341 5.174 2.420 1.641 15 HB3 LYS 341 HB1 LYS 341 3.915 3.086 0.621 16 HG2 LYS 341 HG2 LYS 341 2.857 3.026 2.694 17 HG3 LYS 341 HG1 LYS 341 2.319 1.531 1.981 18 HD2 LYS 341 HD2 LYS 341 3.109 0.474 3.847 19 HD3 LYS 341 HD1 LYS 341 4.726 0.788 3.226 20 HE2 LYS 341 HE2 LYS 341 4.803 1.727 5.373 21 HE3 LYS 341 HE1 LYS 341 4.447 3.119 4.353 22 HZ1 LYS 341 HZ1 LYS 341 2.085 1.728 5.158 23 HZ2 LYS 341 HZ2 LYS 341 2.469 3.378 5.299 24 HZ3 LYS 341 HZ3 LYS 341 2.978 2.278 6.490 25 H GLU 342 HN GLU 342 2.237 -0.048 -0.635 26 HA GLU 342 HA GLU 342 1.099 -1.486 1.415 27 HB2 GLU 342 HB2 GLU 342 0.579 -3.213 -0.597 28 HB3 GLU 342 HB1 GLU 342 -0.220 -1.647 -0.465 29 HG2 GLU 342 HG2 GLU 342 1.227 -0.641 -2.017 30 HG3 GLU 342 HG1 GLU 342 2.400 -1.945 -1.908 31 H VAL 343 HN VAL 343 2.759 -3.444 -1.000 32 HA VAL 343 HA VAL 343 3.914 -5.095 1.178 33 HB VAL 343 HB VAL 343 2.392 -6.040 -0.606 34 HG11 VAL 343 HG11 VAL 343 3.053 -6.160 -2.816 35 HG12 VAL 343 HG12 VAL 343 4.763 -6.270 -2.409 36 HG13 VAL 343 HG13 VAL 343 3.948 -4.706 -2.370 37 HG21 VAL 343 HG21 VAL 343 5.124 -7.164 0.006 38 HG22 VAL 343 HG22 VAL 343 3.940 -8.079 -0.924 39 HG23 VAL 343 HG23 VAL 343 3.578 -7.599 0.733 40 H ASP 344 HN ASP 344 5.092 -2.774 0.771 41 HA ASP 344 HA ASP 344 7.798 -3.634 0.214 42 HB2 ASP 344 HB2 ASP 344 7.049 -3.523 -2.018 43 HB3 ASP 344 HB1 ASP 344 6.238 -1.999 -1.742 44 H GLU 345 HN GLU 345 9.290 -1.749 0.198 45 HA GLU 345 HA GLU 345 8.332 0.643 1.657 46 HB2 GLU 345 HB2 GLU 345 10.657 -1.069 2.526 47 HB3 GLU 345 HB1 GLU 345 9.988 0.322 3.363 48 HG2 GLU 345 HG2 GLU 345 7.779 -1.001 3.430 49 HG3 GLU 345 HG1 GLU 345 8.753 -2.400 2.991 50 H VAL 346 HN VAL 346 9.947 2.350 1.613 51 HA VAL 346 HA VAL 346 12.087 2.021 -0.433 52 HB VAL 346 HB VAL 346 9.931 4.109 -0.262 53 HG11 VAL 346 HG11 VAL 346 11.868 5.494 -0.199 54 HG12 VAL 346 HG12 VAL 346 11.359 5.465 -1.889 55 HG13 VAL 346 HG13 VAL 346 12.721 4.477 -1.361 56 HG21 VAL 346 HG21 VAL 346 11.248 2.860 -2.685 57 HG22 VAL 346 HG22 VAL 346 9.701 3.702 -2.610 58 HG23 VAL 346 HG23 VAL 346 9.879 2.117 -1.858 59 H ASP 347 HN ASP 347 11.297 2.667 2.601 60 HA ASP 347 HA ASP 347 13.485 4.634 3.061 61 HB2 ASP 347 HB2 ASP 347 11.017 4.520 4.108 62 HB3 ASP 347 HB1 ASP 347 11.811 3.459 5.262 63 H ALA 348 HN ALA 348 13.505 1.724 2.392 64 HA ALA 348 HA ALA 348 15.547 0.918 4.427 65 HB1 ALA 348 HB1 ALA 348 13.240 -0.321 4.409 66 HB2 ALA 348 HB2 ALA 348 14.727 -1.278 4.442 67 HB3 ALA 348 HB3 ALA 348 13.845 -1.067 2.929 68 H ALA 349 HN ALA 349 14.576 1.697 1.373 69 HA ALA 349 HA ALA 349 16.431 0.138 -0.237 70 HB1 ALA 349 HB1 ALA 349 14.641 2.530 -0.647 71 HB2 ALA 349 HB2 ALA 349 14.498 0.915 -1.354 72 HB3 ALA 349 HB3 ALA 349 15.764 2.009 -1.912 73 H LEU 350 HN LEU 350 16.428 3.077 1.579 74 HA LEU 350 HA LEU 350 18.792 4.221 0.326 75 HB2 LEU 350 HB2 LEU 350 18.360 6.058 1.683 76 HB3 LEU 350 HB1 LEU 350 16.759 5.322 1.570 77 HG LEU 350 HG LEU 350 18.662 4.785 3.844 78 HD11 LEU 350 HD11 LEU 350 16.250 6.585 3.766 79 HD12 LEU 350 HD12 LEU 350 17.914 7.163 3.692 80 HD13 LEU 350 HD13 LEU 350 17.334 6.326 5.133 81 HD21 LEU 350 HD21 LEU 350 16.567 3.926 4.878 82 HD22 LEU 350 HD22 LEU 350 17.014 3.015 3.431 83 HD23 LEU 350 HD23 LEU 350 15.750 4.236 3.352 84 H SER 351 HN SER 351 18.147 1.766 2.491 85 HA SER 351 HA SER 351 20.905 1.904 3.683 86 HB2 SER 351 HB2 SER 351 19.122 1.889 5.390 87 HB3 SER 351 HB1 SER 351 18.427 0.449 4.650 88 HG SER 351 HG SER 351 21.038 0.066 5.113 89 H ASP 352 HN ASP 352 19.422 0.832 1.241 90 HA ASP 352 HA ASP 352 20.429 -1.974 1.155 91 HB2 ASP 352 HB2 ASP 352 18.053 -1.176 0.729 92 HB3 ASP 352 HB1 ASP 352 18.667 -0.379 -0.692 93 H LEU 353 HN LEU 353 21.472 0.839 0.778 94 HA LEU 353 HA LEU 353 22.716 0.715 -1.883 95 HB2 LEU 353 HB2 LEU 353 21.611 2.731 -1.590 96 HB3 LEU 353 HB1 LEU 353 21.741 2.593 0.162 97 HG LEU 353 HG LEU 353 24.389 2.954 -0.884 98 HD11 LEU 353 HD11 LEU 353 23.186 3.928 -2.814 99 HD12 LEU 353 HD12 LEU 353 24.268 5.039 -1.971 100 HD13 LEU 353 HD13 LEU 353 22.524 5.126 -1.706 101 HD21 LEU 353 HD21 LEU 353 22.702 4.939 0.601 102 HD22 LEU 353 HD22 LEU 353 24.460 4.800 0.613 103 HD23 LEU 353 HD23 LEU 353 23.472 3.555 1.370 104 H GLU 354 HN GLU 354 23.269 1.754 1.374 105 HA GLU 354 HA GLU 354 25.974 1.937 1.516 106 HB2 GLU 354 HB2 GLU 354 25.676 1.566 3.905 107 HB3 GLU 354 HB1 GLU 354 24.338 2.516 3.278 108 HG2 GLU 354 HG2 GLU 354 23.163 0.239 2.893 109 HG3 GLU 354 HG1 GLU 354 24.409 -0.395 3.968 110 H ILE 355 HN ILE 355 23.969 -0.772 1.623 111 HA ILE 355 HA ILE 355 25.902 -2.750 2.431 112 HB ILE 355 HB ILE 355 23.565 -3.534 0.708 113 HG12 ILE 355 HG12 ILE 355 23.314 -2.328 3.456 114 HG13 ILE 355 HG11 ILE 355 22.594 -1.802 1.930 115 HG21 ILE 355 HG21 ILE 355 25.181 -5.081 1.853 116 HG22 ILE 355 HG22 ILE 355 23.474 -5.370 2.170 117 HG23 ILE 355 HG23 ILE 355 24.469 -4.549 3.378 118 HD11 ILE 355 HD11 ILE 355 21.408 -4.032 1.811 119 HD12 ILE 355 HD12 ILE 355 20.882 -3.046 3.169 120 HD13 ILE 355 HD13 ILE 355 21.997 -4.373 3.434 121 H THR 356 HN THR 356 25.172 -1.211 -0.447 122 HA THR 356 HA THR 356 26.700 -3.248 -1.981 123 HB THR 356 HB THR 356 24.409 -3.479 -2.437 124 HG1 THR 356 HG1 THR 356 24.894 -3.547 -4.475 125 HG21 THR 356 HG21 THR 356 23.655 -1.386 -1.482 126 HG22 THR 356 HG22 THR 356 23.071 -1.475 -3.147 127 HG23 THR 356 HG23 THR 356 24.471 -0.475 -2.757 128 H LEU 357 HN LEU 357 26.523 -0.006 -1.219 129 HA LEU 357 HA LEU 357 27.963 0.896 -3.640 130 HB2 LEU 357 HB2 LEU 357 26.008 2.062 -2.205 131 HB3 LEU 357 HB1 LEU 357 27.387 2.677 -1.309 132 HG LEU 357 HG LEU 357 26.771 4.227 -3.030 133 HD11 LEU 357 HD11 LEU 357 29.166 3.938 -2.526 134 HD12 LEU 357 HD12 LEU 357 28.904 4.452 -4.192 135 HD13 LEU 357 HD13 LEU 357 29.283 2.768 -3.840 136 HD21 LEU 357 HD21 LEU 357 25.885 2.177 -4.534 137 HD22 LEU 357 HD22 LEU 357 27.456 2.418 -5.300 138 HD23 LEU 357 HD23 LEU 357 26.300 3.743 -5.225 139 H GLU 358 HN GLU 358 28.618 -0.844 -1.286 140 HA GLU 358 HA GLU 358 30.977 0.492 -0.112 141 HB2 GLU 358 HB2 GLU 358 30.907 -1.785 1.219 142 HB3 GLU 358 HB1 GLU 358 29.758 -0.513 1.599 143 HG2 GLU 358 HG2 GLU 358 28.674 -2.739 1.366 144 HG3 GLU 358 HG1 GLU 358 28.072 -1.566 0.193 Start of MODEL 17 1 H1 SER 339 HT1 SER 339 0.595 1.580 6.529 2 H2 SER 339 HT2 SER 339 0.002 1.195 4.985 3 H3 SER 339 HT3 SER 339 0.610 2.750 5.301 4 HA SER 339 HA SER 339 2.556 2.067 4.522 5 HB2 SER 339 HB2 SER 339 2.383 0.307 6.981 6 HB3 SER 339 HB1 SER 339 3.855 0.541 6.044 7 HG SER 339 HG SER 339 3.020 2.031 7.982 8 H ASP 340 HN ASP 340 3.469 0.583 3.078 9 HA ASP 340 HA ASP 340 2.689 -2.206 3.004 10 HB2 ASP 340 HB2 ASP 340 0.661 -0.895 2.068 11 HB3 ASP 340 HB1 ASP 340 1.686 -0.564 0.671 12 H LYS 341 HN LYS 341 3.090 -2.474 0.133 13 HA LYS 341 HA LYS 341 5.941 -1.579 -0.135 14 HB2 LYS 341 HB2 LYS 341 4.633 -4.270 -0.547 15 HB3 LYS 341 HB1 LYS 341 6.016 -3.847 -1.539 16 HG2 LYS 341 HG2 LYS 341 7.085 -4.885 0.243 17 HG3 LYS 341 HG1 LYS 341 7.117 -3.224 0.784 18 HD2 LYS 341 HD2 LYS 341 6.280 -4.278 2.688 19 HD3 LYS 341 HD1 LYS 341 4.783 -3.828 1.875 20 HE2 LYS 341 HE2 LYS 341 4.348 -6.072 2.276 21 HE3 LYS 341 HE1 LYS 341 5.128 -6.195 0.699 22 HZ1 LYS 341 HZ1 LYS 341 7.176 -6.161 2.530 23 HZ2 LYS 341 HZ2 LYS 341 6.609 -7.507 1.661 24 HZ3 LYS 341 HZ3 LYS 341 6.004 -7.179 3.214 25 H GLU 342 HN GLU 342 6.294 -2.530 -2.723 26 HA GLU 342 HA GLU 342 5.935 -2.035 -4.937 27 HB2 GLU 342 HB2 GLU 342 3.143 -1.152 -4.347 28 HB3 GLU 342 HB1 GLU 342 3.769 -2.061 -5.715 29 HG2 GLU 342 HG2 GLU 342 4.308 -3.812 -3.729 30 HG3 GLU 342 HG1 GLU 342 2.914 -3.023 -3.041 31 H VAL 343 HN VAL 343 3.938 0.181 -3.096 32 HA VAL 343 HA VAL 343 5.456 2.492 -4.229 33 HB VAL 343 HB VAL 343 3.278 2.376 -5.219 34 HG11 VAL 343 HG11 VAL 343 2.048 1.052 -3.706 35 HG12 VAL 343 HG12 VAL 343 1.270 2.633 -3.630 36 HG13 VAL 343 HG13 VAL 343 2.382 2.133 -2.356 37 HG21 VAL 343 HG21 VAL 343 4.304 4.636 -4.121 38 HG22 VAL 343 HG22 VAL 343 2.784 4.555 -3.231 39 HG23 VAL 343 HG23 VAL 343 2.771 4.622 -4.990 40 H ASP 344 HN ASP 344 6.368 1.406 -2.134 41 HA ASP 344 HA ASP 344 6.262 3.535 -0.192 42 HB2 ASP 344 HB2 ASP 344 4.179 2.480 0.286 43 HB3 ASP 344 HB1 ASP 344 4.946 0.910 0.347 44 H GLU 345 HN GLU 345 7.510 2.882 1.820 45 HA GLU 345 HA GLU 345 9.609 2.266 2.628 46 HB2 GLU 345 HB2 GLU 345 8.806 -0.246 1.218 47 HB3 GLU 345 HB1 GLU 345 9.968 -0.123 2.531 48 HG2 GLU 345 HG2 GLU 345 7.988 0.967 3.852 49 HG3 GLU 345 HG1 GLU 345 6.986 0.208 2.621 50 H VAL 346 HN VAL 346 9.311 3.208 -0.259 51 HA VAL 346 HA VAL 346 11.581 1.906 -1.593 52 HB VAL 346 HB VAL 346 9.651 4.097 -2.335 53 HG11 VAL 346 HG11 VAL 346 11.018 4.238 -4.514 54 HG12 VAL 346 HG12 VAL 346 12.326 3.489 -3.593 55 HG13 VAL 346 HG13 VAL 346 11.681 5.052 -3.094 56 HG21 VAL 346 HG21 VAL 346 9.113 2.643 -4.176 57 HG22 VAL 346 HG22 VAL 346 9.178 1.632 -2.732 58 HG23 VAL 346 HG23 VAL 346 10.527 1.635 -3.869 59 H ASP 347 HN ASP 347 10.997 4.042 0.684 60 HA ASP 347 HA ASP 347 13.376 5.729 0.230 61 HB2 ASP 347 HB2 ASP 347 10.874 6.299 1.137 62 HB3 ASP 347 HB1 ASP 347 11.657 5.945 2.674 63 H ALA 348 HN ALA 348 12.936 2.868 1.028 64 HA ALA 348 HA ALA 348 14.796 2.800 3.376 65 HB1 ALA 348 HB1 ALA 348 12.897 0.613 2.504 66 HB2 ALA 348 HB2 ALA 348 12.400 1.886 3.622 67 HB3 ALA 348 HB3 ALA 348 13.722 0.791 4.056 68 H ALA 349 HN ALA 349 14.123 2.260 0.151 69 HA ALA 349 HA ALA 349 15.900 0.051 -0.436 70 HB1 ALA 349 HB1 ALA 349 15.631 1.077 -2.800 71 HB2 ALA 349 HB2 ALA 349 14.497 2.193 -2.024 72 HB3 ALA 349 HB3 ALA 349 14.183 0.453 -2.009 73 H LEU 350 HN LEU 350 16.099 3.551 -0.343 74 HA LEU 350 HA LEU 350 18.707 3.770 -1.527 75 HB2 LEU 350 HB2 LEU 350 18.388 6.040 -1.209 76 HB3 LEU 350 HB1 LEU 350 16.722 5.476 -1.071 77 HG LEU 350 HG LEU 350 18.517 5.860 1.314 78 HD11 LEU 350 HD11 LEU 350 17.365 7.954 1.672 79 HD12 LEU 350 HD12 LEU 350 16.367 7.675 0.245 80 HD13 LEU 350 HD13 LEU 350 18.094 7.974 0.066 81 HD21 LEU 350 HD21 LEU 350 16.589 4.269 1.502 82 HD22 LEU 350 HD22 LEU 350 15.548 5.603 1.011 83 HD23 LEU 350 HD23 LEU 350 16.421 5.694 2.536 84 H SER 351 HN SER 351 17.575 2.525 1.336 85 HA SER 351 HA SER 351 20.221 2.900 2.724 86 HB2 SER 351 HB2 SER 351 18.191 3.811 3.923 87 HB3 SER 351 HB1 SER 351 17.561 2.166 3.935 88 HG SER 351 HG SER 351 19.940 1.893 4.844 89 H ASP 352 HN ASP 352 19.096 1.078 0.703 90 HA ASP 352 HA ASP 352 19.599 -1.543 2.026 91 HB2 ASP 352 HB2 ASP 352 17.308 -0.811 1.160 92 HB3 ASP 352 HB1 ASP 352 17.994 -0.942 -0.429 93 H LEU 353 HN LEU 353 20.979 0.622 0.455 94 HA LEU 353 HA LEU 353 22.260 -1.012 -1.687 95 HB2 LEU 353 HB2 LEU 353 21.162 0.772 -2.683 96 HB3 LEU 353 HB1 LEU 353 21.343 1.771 -1.245 97 HG LEU 353 HG LEU 353 23.766 1.970 -1.757 98 HD11 LEU 353 HD11 LEU 353 22.924 0.545 -4.282 99 HD12 LEU 353 HD12 LEU 353 23.976 -0.115 -3.030 100 HD13 LEU 353 HD13 LEU 353 24.514 1.259 -4.000 101 HD21 LEU 353 HD21 LEU 353 21.813 2.773 -3.871 102 HD22 LEU 353 HD22 LEU 353 23.421 3.471 -3.663 103 HD23 LEU 353 HD23 LEU 353 22.204 3.653 -2.392 104 H GLU 354 HN GLU 354 22.771 1.797 0.324 105 HA GLU 354 HA GLU 354 25.539 1.738 0.554 106 HB2 GLU 354 HB2 GLU 354 25.121 3.081 2.604 107 HB3 GLU 354 HB1 GLU 354 24.204 3.637 1.211 108 HG2 GLU 354 HG2 GLU 354 22.303 2.199 1.982 109 HG3 GLU 354 HG1 GLU 354 23.220 1.884 3.448 110 H ILE 355 HN ILE 355 23.073 0.151 2.230 111 HA ILE 355 HA ILE 355 24.570 -0.856 4.397 112 HB ILE 355 HB ILE 355 21.984 -0.553 3.838 113 HG12 ILE 355 HG12 ILE 355 21.536 -2.277 5.656 114 HG13 ILE 355 HG11 ILE 355 23.252 -2.623 5.489 115 HG21 ILE 355 HG21 ILE 355 22.407 -3.450 3.164 116 HG22 ILE 355 HG22 ILE 355 21.828 -2.176 2.090 117 HG23 ILE 355 HG23 ILE 355 20.862 -2.678 3.471 118 HD11 ILE 355 HD11 ILE 355 23.883 -0.755 6.632 119 HD12 ILE 355 HD12 ILE 355 22.222 -0.737 7.214 120 HD13 ILE 355 HD13 ILE 355 22.678 0.259 5.830 121 H THR 356 HN THR 356 23.955 -1.830 1.288 122 HA THR 356 HA THR 356 25.279 -4.457 1.677 123 HB THR 356 HB THR 356 23.047 -4.618 0.860 124 HG1 THR 356 HG1 THR 356 23.682 -6.065 -0.514 125 HG21 THR 356 HG21 THR 356 22.393 -3.471 -1.249 126 HG22 THR 356 HG22 THR 356 23.959 -2.670 -1.261 127 HG23 THR 356 HG23 THR 356 22.818 -2.355 0.043 128 H LEU 357 HN LEU 357 25.768 -1.453 0.370 129 HA LEU 357 HA LEU 357 27.801 -2.398 -1.594 130 HB2 LEU 357 HB2 LEU 357 26.145 -0.900 -2.600 131 HB3 LEU 357 HB1 LEU 357 26.350 0.258 -1.289 132 HG LEU 357 HG LEU 357 28.592 0.771 -1.992 133 HD11 LEU 357 HD11 LEU 357 29.525 -1.292 -2.660 134 HD12 LEU 357 HD12 LEU 357 29.408 -0.400 -4.174 135 HD13 LEU 357 HD13 LEU 357 28.207 -1.631 -3.777 136 HD21 LEU 357 HD21 LEU 357 28.165 1.728 -4.177 137 HD22 LEU 357 HD22 LEU 357 26.668 1.802 -3.248 138 HD23 LEU 357 HD23 LEU 357 26.879 0.561 -4.484 139 H GLU 358 HN GLU 358 27.240 -1.421 1.371 140 HA GLU 358 HA GLU 358 28.985 0.456 2.307 141 HB2 GLU 358 HB2 GLU 358 29.341 -1.298 4.256 142 HB3 GLU 358 HB1 GLU 358 27.761 -0.587 3.989 143 HG2 GLU 358 HG2 GLU 358 27.621 -3.044 4.250 144 HG3 GLU 358 HG1 GLU 358 27.097 -2.533 2.645 Start of MODEL 18 1 H1 SER 339 HT1 SER 339 1.325 5.786 3.524 2 H2 SER 339 HT2 SER 339 -0.037 5.344 4.438 3 H3 SER 339 HT3 SER 339 -0.212 5.781 2.806 4 HA SER 339 HA SER 339 0.660 3.267 3.981 5 HB2 SER 339 HB2 SER 339 -1.509 3.609 2.777 6 HB3 SER 339 HB1 SER 339 -0.600 3.982 1.316 7 HG SER 339 HG SER 339 -0.641 1.563 2.798 8 H ASP 340 HN ASP 340 1.264 5.063 0.932 9 HA ASP 340 HA ASP 340 3.123 5.003 -0.507 10 HB2 ASP 340 HB2 ASP 340 4.719 4.105 1.896 11 HB3 ASP 340 HB1 ASP 340 5.257 5.078 0.527 12 H LYS 341 HN LYS 341 5.416 3.118 0.190 13 HA LYS 341 HA LYS 341 4.297 0.823 -1.279 14 HB2 LYS 341 HB2 LYS 341 7.070 1.702 -0.496 15 HB3 LYS 341 HB1 LYS 341 6.756 0.115 -1.190 16 HG2 LYS 341 HG2 LYS 341 7.293 1.680 -2.992 17 HG3 LYS 341 HG1 LYS 341 5.600 1.181 -3.095 18 HD2 LYS 341 HD2 LYS 341 4.788 3.241 -2.382 19 HD3 LYS 341 HD1 LYS 341 6.266 3.648 -1.518 20 HE2 LYS 341 HE2 LYS 341 7.442 4.041 -3.613 21 HE3 LYS 341 HE1 LYS 341 6.044 3.493 -4.538 22 HZ1 LYS 341 HZ1 LYS 341 6.466 6.028 -4.048 23 HZ2 LYS 341 HZ2 LYS 341 5.643 5.653 -2.609 24 HZ3 LYS 341 HZ3 LYS 341 4.897 5.388 -4.113 25 H GLU 342 HN GLU 342 3.511 -0.776 -0.407 26 HA GLU 342 HA GLU 342 4.398 -1.748 2.278 27 HB2 GLU 342 HB2 GLU 342 1.769 -2.693 1.861 28 HB3 GLU 342 HB1 GLU 342 2.239 -1.392 2.941 29 HG2 GLU 342 HG2 GLU 342 1.858 0.267 1.271 30 HG3 GLU 342 HG1 GLU 342 1.680 -0.961 0.024 31 H VAL 343 HN VAL 343 2.607 -2.608 -0.605 32 HA VAL 343 HA VAL 343 3.394 -5.383 -0.525 33 HB VAL 343 HB VAL 343 1.258 -4.708 -1.451 34 HG11 VAL 343 HG11 VAL 343 1.171 -3.440 -3.558 35 HG12 VAL 343 HG12 VAL 343 2.929 -3.305 -3.541 36 HG13 VAL 343 HG13 VAL 343 1.971 -2.520 -2.284 37 HG21 VAL 343 HG21 VAL 343 2.754 -6.687 -2.442 38 HG22 VAL 343 HG22 VAL 343 2.748 -5.663 -3.879 39 HG23 VAL 343 HG23 VAL 343 1.229 -6.244 -3.204 40 H ASP 344 HN ASP 344 5.267 -3.072 -0.757 41 HA ASP 344 HA ASP 344 7.085 -4.467 -2.577 42 HB2 ASP 344 HB2 ASP 344 5.651 -3.227 -4.016 43 HB3 ASP 344 HB1 ASP 344 5.877 -1.786 -3.061 44 H GLU 345 HN GLU 345 6.357 -1.911 -0.476 45 HA GLU 345 HA GLU 345 7.623 -0.645 1.016 46 HB2 GLU 345 HB2 GLU 345 9.546 -2.939 0.856 47 HB3 GLU 345 HB1 GLU 345 9.177 -1.909 2.234 48 HG2 GLU 345 HG2 GLU 345 6.812 -2.797 2.145 49 HG3 GLU 345 HG1 GLU 345 7.381 -3.976 0.965 50 H VAL 346 HN VAL 346 9.398 0.726 1.166 51 HA VAL 346 HA VAL 346 11.516 0.621 -0.879 52 HB VAL 346 HB VAL 346 9.380 2.716 -0.682 53 HG11 VAL 346 HG11 VAL 346 10.908 4.284 -1.958 54 HG12 VAL 346 HG12 VAL 346 12.249 3.243 -1.484 55 HG13 VAL 346 HG13 VAL 346 11.303 4.080 -0.251 56 HG21 VAL 346 HG21 VAL 346 10.967 1.707 -3.059 57 HG22 VAL 346 HG22 VAL 346 9.471 2.640 -3.098 58 HG23 VAL 346 HG23 VAL 346 9.459 0.980 -2.510 59 H ASP 347 HN ASP 347 10.618 0.947 2.158 60 HA ASP 347 HA ASP 347 12.668 2.908 2.961 61 HB2 ASP 347 HB2 ASP 347 10.230 2.367 3.947 62 HB3 ASP 347 HB1 ASP 347 11.143 1.221 4.918 63 H ALA 348 HN ALA 348 12.954 0.128 1.829 64 HA ALA 348 HA ALA 348 14.991 -0.855 3.796 65 HB1 ALA 348 HB1 ALA 348 14.427 -3.060 3.224 66 HB2 ALA 348 HB2 ALA 348 13.617 -2.569 1.735 67 HB3 ALA 348 HB3 ALA 348 12.856 -2.255 3.299 68 H ALA 349 HN ALA 349 14.181 0.485 0.875 69 HA ALA 349 HA ALA 349 16.339 -0.501 -0.805 70 HB1 ALA 349 HB1 ALA 349 14.363 1.776 -0.920 71 HB2 ALA 349 HB2 ALA 349 14.412 0.321 -1.925 72 HB3 ALA 349 HB3 ALA 349 15.623 1.584 -2.145 73 H LEU 350 HN LEU 350 15.736 2.174 1.370 74 HA LEU 350 HA LEU 350 18.095 3.682 0.703 75 HB2 LEU 350 HB2 LEU 350 17.281 5.176 2.269 76 HB3 LEU 350 HB1 LEU 350 15.815 4.247 1.956 77 HG LEU 350 HG LEU 350 17.707 3.603 4.207 78 HD11 LEU 350 HD11 LEU 350 16.122 4.728 5.658 79 HD12 LEU 350 HD12 LEU 350 15.108 5.124 4.270 80 HD13 LEU 350 HD13 LEU 350 16.703 5.857 4.434 81 HD21 LEU 350 HD21 LEU 350 14.852 2.854 3.695 82 HD22 LEU 350 HD22 LEU 350 15.878 2.218 4.974 83 HD23 LEU 350 HD23 LEU 350 16.200 1.796 3.288 84 H SER 351 HN SER 351 17.542 0.771 2.210 85 HA SER 351 HA SER 351 20.138 0.882 3.729 86 HB2 SER 351 HB2 SER 351 18.065 0.373 5.081 87 HB3 SER 351 HB1 SER 351 17.849 -1.049 4.064 88 HG SER 351 HG SER 351 19.423 -2.014 5.089 89 H ASP 352 HN ASP 352 19.290 0.398 0.945 90 HA ASP 352 HA ASP 352 20.523 -2.274 0.483 91 HB2 ASP 352 HB2 ASP 352 18.060 -1.757 0.055 92 HB3 ASP 352 HB1 ASP 352 18.612 -0.743 -1.240 93 H LEU 353 HN LEU 353 21.223 0.650 0.617 94 HA LEU 353 HA LEU 353 22.658 0.966 -1.978 95 HB2 LEU 353 HB2 LEU 353 21.086 2.659 -1.817 96 HB3 LEU 353 HB1 LEU 353 21.134 2.625 -0.057 97 HG LEU 353 HG LEU 353 23.385 3.681 -0.160 98 HD11 LEU 353 HD11 LEU 353 23.923 2.867 -2.440 99 HD12 LEU 353 HD12 LEU 353 24.132 4.612 -2.290 100 HD13 LEU 353 HD13 LEU 353 22.699 3.956 -3.087 101 HD21 LEU 353 HD21 LEU 353 21.392 4.946 0.205 102 HD22 LEU 353 HD22 LEU 353 21.125 5.066 -1.538 103 HD23 LEU 353 HD23 LEU 353 22.511 5.872 -0.800 104 H GLU 354 HN GLU 354 22.657 2.086 1.327 105 HA GLU 354 HA GLU 354 25.365 2.592 1.696 106 HB2 GLU 354 HB2 GLU 354 24.802 2.327 4.100 107 HB3 GLU 354 HB1 GLU 354 23.659 3.340 3.230 108 HG2 GLU 354 HG2 GLU 354 22.242 1.314 2.865 109 HG3 GLU 354 HG1 GLU 354 23.336 0.428 3.918 110 H ILE 355 HN ILE 355 23.536 -0.222 1.823 111 HA ILE 355 HA ILE 355 25.418 -1.895 3.138 112 HB ILE 355 HB ILE 355 22.792 -1.952 2.730 113 HG12 ILE 355 HG12 ILE 355 22.926 -4.456 3.177 114 HG13 ILE 355 HG11 ILE 355 24.650 -4.212 2.921 115 HG21 ILE 355 HG21 ILE 355 22.829 -2.252 0.355 116 HG22 ILE 355 HG22 ILE 355 22.131 -3.664 1.141 117 HG23 ILE 355 HG23 ILE 355 23.766 -3.738 0.521 118 HD11 ILE 355 HD11 ILE 355 23.377 -3.969 5.369 119 HD12 ILE 355 HD12 ILE 355 23.517 -2.287 4.847 120 HD13 ILE 355 HD13 ILE 355 24.959 -3.299 4.982 121 H THR 356 HN THR 356 24.851 -0.897 0.043 122 HA THR 356 HA THR 356 26.703 -2.903 -1.132 123 HB THR 356 HB THR 356 24.494 -3.124 -1.999 124 HG1 THR 356 HG1 THR 356 26.504 -2.074 -3.577 125 HG21 THR 356 HG21 THR 356 23.373 -1.164 -3.056 126 HG22 THR 356 HG22 THR 356 24.695 -0.147 -2.499 127 HG23 THR 356 HG23 THR 356 23.655 -0.957 -1.329 128 H LEU 357 HN LEU 357 26.363 0.366 -0.520 129 HA LEU 357 HA LEU 357 28.155 1.239 -2.717 130 HB2 LEU 357 HB2 LEU 357 26.228 2.670 -2.221 131 HB3 LEU 357 HB1 LEU 357 26.669 2.714 -0.519 132 HG LEU 357 HG LEU 357 28.537 4.102 -0.923 133 HD11 LEU 357 HD11 LEU 357 28.213 3.295 -3.818 134 HD12 LEU 357 HD12 LEU 357 29.611 3.033 -2.777 135 HD13 LEU 357 HD13 LEU 357 29.218 4.659 -3.330 136 HD21 LEU 357 HD21 LEU 357 26.564 5.057 -3.000 137 HD22 LEU 357 HD22 LEU 357 27.597 6.034 -1.958 138 HD23 LEU 357 HD23 LEU 357 26.236 5.149 -1.270 139 H GLU 358 HN GLU 358 28.523 -0.477 -0.332 140 HA GLU 358 HA GLU 358 30.747 0.901 1.084 141 HB2 GLU 358 HB2 GLU 358 30.326 -1.190 2.631 142 HB3 GLU 358 HB1 GLU 358 29.220 0.176 2.696 143 HG2 GLU 358 HG2 GLU 358 28.005 -1.969 2.547 144 HG3 GLU 358 HG1 GLU 358 27.710 -0.932 1.153 Start of MODEL 19 1 H1 SER 339 HT1 SER 339 3.650 -1.309 4.400 2 H2 SER 339 HT2 SER 339 3.707 -2.906 3.824 3 H3 SER 339 HT3 SER 339 3.116 -2.583 5.383 4 HA SER 339 HA SER 339 1.120 -2.731 4.390 5 HB2 SER 339 HB2 SER 339 1.957 0.009 3.402 6 HB3 SER 339 HB1 SER 339 0.309 -0.544 3.686 7 HG SER 339 HG SER 339 2.314 -0.540 5.689 8 H ASP 340 HN ASP 340 3.448 -1.413 2.023 9 HA ASP 340 HA ASP 340 2.491 -3.340 0.024 10 HB2 ASP 340 HB2 ASP 340 2.306 -0.377 -0.585 11 HB3 ASP 340 HB1 ASP 340 1.809 -1.713 -1.624 12 H LYS 341 HN LYS 341 4.576 -0.609 0.842 13 HA LYS 341 HA LYS 341 6.761 -0.141 0.265 14 HB2 LYS 341 HB2 LYS 341 6.998 -2.983 -0.647 15 HB3 LYS 341 HB1 LYS 341 8.219 -1.926 0.051 16 HG2 LYS 341 HG2 LYS 341 6.290 -1.914 2.032 17 HG3 LYS 341 HG1 LYS 341 6.166 -3.536 1.379 18 HD2 LYS 341 HD2 LYS 341 8.527 -3.946 1.787 19 HD3 LYS 341 HD1 LYS 341 8.752 -2.264 2.277 20 HE2 LYS 341 HE2 LYS 341 7.697 -2.575 4.324 21 HE3 LYS 341 HE1 LYS 341 6.693 -3.896 3.728 22 HZ1 LYS 341 HZ1 LYS 341 8.175 -5.124 4.864 23 HZ2 LYS 341 HZ2 LYS 341 9.401 -3.950 4.780 24 HZ3 LYS 341 HZ3 LYS 341 9.101 -4.966 3.452 25 H GLU 342 HN GLU 342 7.792 -2.087 -1.940 26 HA GLU 342 HA GLU 342 8.552 -1.417 -4.096 27 HB2 GLU 342 HB2 GLU 342 6.266 -2.041 -5.513 28 HB3 GLU 342 HB1 GLU 342 7.436 -3.213 -4.930 29 HG2 GLU 342 HG2 GLU 342 6.177 -3.520 -2.893 30 HG3 GLU 342 HG1 GLU 342 5.076 -2.225 -3.351 31 H VAL 343 HN VAL 343 5.182 -0.516 -4.320 32 HA VAL 343 HA VAL 343 5.888 1.950 -5.745 33 HB VAL 343 HB VAL 343 4.062 0.299 -6.366 34 HG11 VAL 343 HG11 VAL 343 2.025 0.301 -5.224 35 HG12 VAL 343 HG12 VAL 343 2.343 1.854 -4.456 36 HG13 VAL 343 HG13 VAL 343 3.194 0.409 -3.908 37 HG21 VAL 343 HG21 VAL 343 3.677 3.284 -6.230 38 HG22 VAL 343 HG22 VAL 343 2.465 2.253 -6.985 39 HG23 VAL 343 HG23 VAL 343 4.108 2.294 -7.621 40 H ASP 344 HN ASP 344 6.538 1.696 -2.991 41 HA ASP 344 HA ASP 344 5.573 4.285 -2.155 42 HB2 ASP 344 HB2 ASP 344 3.577 3.109 -1.767 43 HB3 ASP 344 HB1 ASP 344 4.437 1.758 -1.060 44 H GLU 345 HN GLU 345 6.119 4.579 0.281 45 HA GLU 345 HA GLU 345 7.801 4.729 1.860 46 HB2 GLU 345 HB2 GLU 345 8.506 1.965 0.969 47 HB3 GLU 345 HB1 GLU 345 8.730 2.681 2.554 48 HG2 GLU 345 HG2 GLU 345 6.200 2.937 2.655 49 HG3 GLU 345 HG1 GLU 345 6.138 1.896 1.235 50 H VAL 346 HN VAL 346 9.968 5.269 1.967 51 HA VAL 346 HA VAL 346 11.781 4.675 -0.252 52 HB VAL 346 HB VAL 346 10.666 7.416 0.294 53 HG11 VAL 346 HG11 VAL 346 12.991 7.854 0.425 54 HG12 VAL 346 HG12 VAL 346 12.549 8.242 -1.239 55 HG13 VAL 346 HG13 VAL 346 13.360 6.719 -0.874 56 HG21 VAL 346 HG21 VAL 346 9.592 6.258 -1.518 57 HG22 VAL 346 HG22 VAL 346 11.140 5.753 -2.198 58 HG23 VAL 346 HG23 VAL 346 10.667 7.450 -2.245 59 H ASP 347 HN ASP 347 11.221 5.166 2.882 60 HA ASP 347 HA ASP 347 13.938 6.107 3.557 61 HB2 ASP 347 HB2 ASP 347 11.550 6.592 4.689 62 HB3 ASP 347 HB1 ASP 347 11.961 5.147 5.601 63 H ALA 348 HN ALA 348 12.960 3.493 2.407 64 HA ALA 348 HA ALA 348 14.509 1.688 4.232 65 HB1 ALA 348 HB1 ALA 348 12.440 0.775 2.242 66 HB2 ALA 348 HB2 ALA 348 11.959 1.328 3.848 67 HB3 ALA 348 HB3 ALA 348 13.044 -0.060 3.675 68 H ALA 349 HN ALA 349 14.182 3.340 1.377 69 HA ALA 349 HA ALA 349 15.627 1.597 -0.441 70 HB1 ALA 349 HB1 ALA 349 14.773 4.488 -0.411 71 HB2 ALA 349 HB2 ALA 349 14.179 3.179 -1.443 72 HB3 ALA 349 HB3 ALA 349 15.789 3.847 -1.710 73 H LEU 350 HN LEU 350 16.344 4.210 1.777 74 HA LEU 350 HA LEU 350 19.073 4.605 0.962 75 HB2 LEU 350 HB2 LEU 350 19.071 6.233 2.607 76 HB3 LEU 350 HB1 LEU 350 17.334 6.038 2.361 77 HG LEU 350 HG LEU 350 18.861 4.560 4.492 78 HD11 LEU 350 HD11 LEU 350 18.883 7.044 4.782 79 HD12 LEU 350 HD12 LEU 350 18.011 6.185 6.051 80 HD13 LEU 350 HD13 LEU 350 17.121 7.001 4.765 81 HD21 LEU 350 HD21 LEU 350 16.732 3.550 3.676 82 HD22 LEU 350 HD22 LEU 350 15.945 5.083 4.033 83 HD23 LEU 350 HD23 LEU 350 16.610 4.120 5.346 84 H SER 351 HN SER 351 17.445 2.137 2.459 85 HA SER 351 HA SER 351 19.927 1.088 3.800 86 HB2 SER 351 HB2 SER 351 17.940 1.456 5.303 87 HB3 SER 351 HB1 SER 351 17.052 0.329 4.281 88 HG SER 351 HG SER 351 17.911 -1.171 5.466 89 H ASP 352 HN ASP 352 18.804 1.104 1.077 90 HA ASP 352 HA ASP 352 18.746 -1.822 0.526 91 HB2 ASP 352 HB2 ASP 352 16.705 -0.301 0.289 92 HB3 ASP 352 HB1 ASP 352 17.541 0.423 -1.049 93 H LEU 353 HN LEU 353 20.598 0.570 0.576 94 HA LEU 353 HA LEU 353 21.863 0.274 -2.111 95 HB2 LEU 353 HB2 LEU 353 21.127 2.463 -1.893 96 HB3 LEU 353 HB1 LEU 353 21.297 2.414 -0.142 97 HG LEU 353 HG LEU 353 23.760 2.447 -0.431 98 HD11 LEU 353 HD11 LEU 353 23.001 2.863 -3.324 99 HD12 LEU 353 HD12 LEU 353 23.824 1.450 -2.667 100 HD13 LEU 353 HD13 LEU 353 24.635 3.018 -2.673 101 HD21 LEU 353 HD21 LEU 353 22.519 4.434 0.005 102 HD22 LEU 353 HD22 LEU 353 22.174 4.629 -1.719 103 HD23 LEU 353 HD23 LEU 353 23.828 4.796 -1.124 104 H GLU 354 HN GLU 354 22.538 1.303 1.157 105 HA GLU 354 HA GLU 354 25.230 0.637 1.329 106 HB2 GLU 354 HB2 GLU 354 24.794 0.634 3.774 107 HB3 GLU 354 HB1 GLU 354 24.108 2.028 2.951 108 HG2 GLU 354 HG2 GLU 354 21.960 0.756 2.745 109 HG3 GLU 354 HG1 GLU 354 22.670 -0.484 3.768 110 H ILE 355 HN ILE 355 22.402 -1.162 1.748 111 HA ILE 355 HA ILE 355 23.517 -3.459 2.952 112 HB ILE 355 HB ILE 355 21.071 -2.468 2.677 113 HG12 ILE 355 HG12 ILE 355 20.208 -4.817 3.121 114 HG13 ILE 355 HG11 ILE 355 21.864 -5.291 2.768 115 HG21 ILE 355 HG21 ILE 355 21.155 -4.442 0.415 116 HG22 ILE 355 HG22 ILE 355 20.871 -2.705 0.307 117 HG23 ILE 355 HG23 ILE 355 19.709 -3.744 1.121 118 HD11 ILE 355 HD11 ILE 355 21.833 -3.117 4.719 119 HD12 ILE 355 HD12 ILE 355 22.568 -4.718 4.844 120 HD13 ILE 355 HD13 ILE 355 20.876 -4.495 5.276 121 H THR 356 HN THR 356 23.106 -2.365 -0.152 122 HA THR 356 HA THR 356 24.009 -4.928 -1.343 123 HB THR 356 HB THR 356 21.868 -4.217 -2.106 124 HG1 THR 356 HG1 THR 356 23.004 -5.048 -3.786 125 HG21 THR 356 HG21 THR 356 22.029 -1.890 -1.476 126 HG22 THR 356 HG22 THR 356 21.594 -1.986 -3.179 127 HG23 THR 356 HG23 THR 356 23.246 -1.597 -2.714 128 H LEU 357 HN LEU 357 25.045 -1.855 -0.674 129 HA LEU 357 HA LEU 357 27.122 -1.862 -2.814 130 HB2 LEU 357 HB2 LEU 357 25.796 0.196 -2.816 131 HB3 LEU 357 HB1 LEU 357 26.009 0.373 -1.076 132 HG LEU 357 HG LEU 357 28.358 0.812 -1.333 133 HD11 LEU 357 HD11 LEU 357 29.083 -0.660 -3.032 134 HD12 LEU 357 HD12 LEU 357 29.251 0.926 -3.778 135 HD13 LEU 357 HD13 LEU 357 27.864 -0.092 -4.168 136 HD21 LEU 357 HD21 LEU 357 26.811 2.700 -1.774 137 HD22 LEU 357 HD22 LEU 357 26.822 2.293 -3.489 138 HD23 LEU 357 HD23 LEU 357 28.301 2.851 -2.705 139 H GLU 358 HN GLU 358 26.394 -2.661 0.159 140 HA GLU 358 HA GLU 358 28.256 -1.947 2.026 141 HB2 GLU 358 HB2 GLU 358 28.193 -4.535 2.608 142 HB3 GLU 358 HB1 GLU 358 26.758 -3.547 2.804 143 HG2 GLU 358 HG2 GLU 358 26.264 -5.653 1.596 144 HG3 GLU 358 HG1 GLU 358 25.958 -4.238 0.589
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