NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
640043 | 6ht4 | 30037 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 304 HT1 GLY 304 -0.036 3.482 12.016 2 H2 GLY 304 HT2 GLY 304 -0.937 4.181 13.265 3 H3 GLY 304 HT3 GLY 304 -0.055 5.164 12.207 4 HA2 GLY 304 HA1 GLY 304 -1.463 4.492 10.360 5 HA3 GLY 304 HA2 GLY 304 -2.379 3.473 11.460 6 H PHE 305 HN PHE 305 -2.564 6.238 9.836 7 HA PHE 305 HA PHE 305 -3.867 7.795 11.946 8 HB2 PHE 305 HB2 PHE 305 -2.947 8.518 9.161 9 HB3 PHE 305 HB1 PHE 305 -3.921 9.599 10.152 10 HD1 PHE 305 HD1 PHE 305 -0.634 8.065 9.706 11 HD2 PHE 305 HD2 PHE 305 -2.983 10.691 12.094 12 HE1 PHE 305 HE1 PHE 305 1.412 8.917 10.774 13 HE2 PHE 305 HE2 PHE 305 -0.941 11.549 13.165 14 HZ PHE 305 HZ PHE 305 1.260 10.662 12.506 15 HA PRO 306 HA PRO 306 -7.957 6.867 10.390 16 HB2 PRO 306 HB2 PRO 306 -8.933 9.582 10.826 17 HB3 PRO 306 HB1 PRO 306 -9.310 8.109 11.728 18 HG2 PRO 306 HG2 PRO 306 -7.862 10.111 12.803 19 HG3 PRO 306 HG1 PRO 306 -7.599 8.406 13.224 20 HD2 PRO 306 HD2 PRO 306 -6.047 10.140 11.337 21 HD3 PRO 306 HD1 PRO 306 -5.460 8.988 12.555 22 H ARG 307 HN ARG 307 -6.522 9.861 9.182 23 HA ARG 307 HA ARG 307 -8.243 9.830 6.815 24 HB2 ARG 307 HB2 ARG 307 -6.287 11.850 7.905 25 HB3 ARG 307 HB1 ARG 307 -6.991 11.997 6.302 26 HG2 ARG 307 HG2 ARG 307 -9.227 12.068 7.287 27 HG3 ARG 307 HG1 ARG 307 -8.520 11.917 8.897 28 HD2 ARG 307 HD2 ARG 307 -7.310 14.020 8.555 29 HD3 ARG 307 HD1 ARG 307 -8.028 14.170 6.951 30 HE ARG 307 HE ARG 307 -10.122 13.916 8.754 31 HH11 ARG 307 HH11 ARG 307 -7.558 16.233 8.125 32 HH12 ARG 307 HH12 ARG 307 -8.470 17.578 8.723 33 HH21 ARG 307 HH21 ARG 307 -11.297 15.692 9.532 34 HH22 ARG 307 HH22 ARG 307 -10.585 17.271 9.519 35 H ALA 308 HN ALA 308 -7.502 9.584 4.742 36 HA ALA 308 HA ALA 308 -6.268 8.804 3.009 37 HB1 ALA 308 HB1 ALA 308 -3.921 9.381 2.846 38 HB2 ALA 308 HB2 ALA 308 -3.865 9.747 4.570 39 HB3 ALA 308 HB3 ALA 308 -4.838 10.744 3.488 40 H LEU 309 HN LEU 309 -5.981 6.774 2.467 41 HA LEU 309 HA LEU 309 -4.428 5.001 4.224 42 HB2 LEU 309 HB2 LEU 309 -7.106 4.414 2.964 43 HB3 LEU 309 HB1 LEU 309 -6.067 3.177 3.642 44 HG LEU 309 HG LEU 309 -6.214 4.721 5.795 45 HD11 LEU 309 HD11 LEU 309 -8.442 5.703 6.031 46 HD12 LEU 309 HD12 LEU 309 -8.790 5.319 4.345 47 HD13 LEU 309 HD13 LEU 309 -7.525 6.481 4.741 48 HD21 LEU 309 HD21 LEU 309 -6.882 2.383 5.680 49 HD22 LEU 309 HD22 LEU 309 -8.399 2.843 4.907 50 HD23 LEU 309 HD23 LEU 309 -8.073 3.332 6.570 51 HA PRO 310 HA PRO 310 -2.547 4.478 0.099 52 HB2 PRO 310 HB2 PRO 310 -0.409 3.022 1.439 53 HB3 PRO 310 HB1 PRO 310 -0.339 4.548 0.563 54 HG2 PRO 310 HG2 PRO 310 -0.032 4.386 3.251 55 HG3 PRO 310 HG1 PRO 310 -0.682 5.813 2.421 56 HD2 PRO 310 HD2 PRO 310 -2.134 3.679 3.920 57 HD3 PRO 310 HD1 PRO 310 -2.439 5.427 3.845 58 H ALA 311 HN ALA 311 -1.635 2.546 -1.094 59 HA ALA 311 HA ALA 311 -3.527 0.336 -0.729 60 HB1 ALA 311 HB1 ALA 311 -3.145 -0.199 -3.085 61 HB2 ALA 311 HB2 ALA 311 -1.986 1.125 -3.196 62 HB3 ALA 311 HB3 ALA 311 -3.690 1.467 -2.898 63 H TRP 312 HN TRP 312 -0.419 1.353 -0.919 64 HA TRP 312 HA TRP 312 0.984 -1.133 -1.036 65 HB2 TRP 312 HB2 TRP 312 2.908 0.328 -1.116 66 HB3 TRP 312 HB1 TRP 312 1.598 1.091 -2.022 67 HD1 TRP 312 HD1 TRP 312 1.361 3.530 -1.699 68 HE1 TRP 312 HE1 TRP 312 1.879 5.255 0.131 69 HE3 TRP 312 HE3 TRP 312 3.223 0.395 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.915 5.297 2.742 71 HZ3 TRP 312 HZ3 TRP 312 3.946 1.373 4.045 72 HH2 TRP 312 HH2 TRP 312 3.786 3.769 4.450 73 H ALA 313 HN ALA 313 -0.652 0.572 1.130 74 HA ALA 313 HA ALA 313 0.814 0.119 3.567 75 HB1 ALA 313 HB1 ALA 313 -1.644 1.133 4.207 76 HB2 ALA 313 HB2 ALA 313 -1.440 1.686 2.523 77 HB3 ALA 313 HB3 ALA 313 -0.229 2.104 3.763 78 H ARG 314 HN ARG 314 -0.224 -2.199 1.974 79 HA ARG 314 HA ARG 314 -1.817 -3.486 4.051 80 HB2 ARG 314 HB2 ARG 314 -2.264 -3.560 1.075 81 HB3 ARG 314 HB1 ARG 314 -2.879 -4.823 2.131 82 HG2 ARG 314 HG2 ARG 314 -4.188 -3.174 3.359 83 HG3 ARG 314 HG1 ARG 314 -3.552 -1.892 2.325 84 HD2 ARG 314 HD2 ARG 314 -4.570 -2.964 0.375 85 HD3 ARG 314 HD1 ARG 314 -5.202 -4.246 1.408 86 HE ARG 314 HE ARG 314 -6.119 -1.842 2.448 87 HH11 ARG 314 HH11 ARG 314 -6.530 -3.660 -0.530 88 HH12 ARG 314 HH12 ARG 314 -8.118 -3.033 -0.827 89 HH21 ARG 314 HH21 ARG 314 -9.059 -1.550 0.627 90 HH22 ARG 314 HH22 ARG 314 -8.197 -1.037 2.039 91 HA PRO 315 HA PRO 315 1.971 -6.052 3.903 92 HB2 PRO 315 HB2 PRO 315 0.870 -7.906 5.684 93 HB3 PRO 315 HB1 PRO 315 1.929 -6.555 6.111 94 HG2 PRO 315 HG2 PRO 315 -1.034 -6.742 6.240 95 HG3 PRO 315 HG1 PRO 315 0.090 -5.873 7.303 96 HD2 PRO 315 HD2 PRO 315 -1.388 -4.558 5.523 97 HD3 PRO 315 HD1 PRO 315 0.287 -4.076 5.846 98 H ASP 316 HN ASP 316 -1.235 -7.097 3.464 99 HA ASP 316 HA ASP 316 -0.582 -9.698 2.379 100 HB2 ASP 316 HB2 ASP 316 -2.726 -8.962 3.693 101 HB3 ASP 316 HB1 ASP 316 -3.290 -8.428 2.113 102 H TYR 317 HN TYR 317 -0.399 -6.641 1.162 103 HA TYR 317 HA TYR 317 -0.902 -7.496 -1.611 104 HB2 TYR 317 HB2 TYR 317 -2.394 -5.664 -0.760 105 HB3 TYR 317 HB1 TYR 317 -0.966 -4.670 -0.517 106 HD1 TYR 317 HD1 TYR 317 0.105 -3.572 -2.353 107 HD2 TYR 317 HD2 TYR 317 -3.144 -6.228 -3.055 108 HE1 TYR 317 HE1 TYR 317 -0.064 -2.743 -4.660 109 HE2 TYR 317 HE2 TYR 317 -3.321 -5.408 -5.367 110 HH TYR 317 HH TYR 317 -2.722 -3.396 -6.658 111 H ASN 318 HN ASN 318 0.832 -7.647 -2.858 112 HA ASN 318 HA ASN 318 3.371 -6.523 -1.934 113 HB2 ASN 318 HB2 ASN 318 2.723 -8.675 -3.949 114 HB3 ASN 318 HB1 ASN 318 4.347 -8.035 -3.724 115 HD21 ASN 318 HD21 ASN 318 5.453 -8.471 -1.811 116 HD22 ASN 318 HD22 ASN 318 4.970 -9.742 -0.746 117 HA PRO 319 HA PRO 319 3.359 -3.440 -5.180 118 HB2 PRO 319 HB2 PRO 319 6.261 -3.469 -5.376 119 HB3 PRO 319 HB1 PRO 319 5.214 -2.235 -4.666 120 HG2 PRO 319 HG2 PRO 319 6.871 -3.773 -3.178 121 HG3 PRO 319 HG1 PRO 319 5.337 -3.125 -2.566 122 HD2 PRO 319 HD2 PRO 319 5.957 -5.879 -3.558 123 HD3 PRO 319 HD1 PRO 319 4.983 -5.368 -2.166 124 HA PRO 320 HA PRO 320 3.903 -5.573 -9.071 125 HB2 PRO 320 HB2 PRO 320 3.933 -3.485 -10.812 126 HB3 PRO 320 HB1 PRO 320 2.459 -4.048 -10.010 127 HG2 PRO 320 HG2 PRO 320 4.194 -1.717 -9.332 128 HG3 PRO 320 HG1 PRO 320 2.424 -1.844 -9.320 129 HD2 PRO 320 HD2 PRO 320 3.926 -1.999 -7.063 130 HD3 PRO 320 HD1 PRO 320 2.373 -2.831 -7.252 131 H LEU 321 HN LEU 321 5.708 -6.529 -9.655 132 HA LEU 321 HA LEU 321 8.079 -4.903 -10.302 133 HB2 LEU 321 HB2 LEU 321 7.986 -7.540 -8.836 134 HB3 LEU 321 HB1 LEU 321 9.456 -6.843 -9.485 135 HG LEU 321 HG LEU 321 7.828 -5.214 -7.580 136 HD11 LEU 321 HD11 LEU 321 9.688 -7.446 -6.773 137 HD12 LEU 321 HD12 LEU 321 7.948 -7.384 -6.496 138 HD13 LEU 321 HD13 LEU 321 9.010 -6.232 -5.689 139 HD21 LEU 321 HD21 LEU 321 10.794 -5.524 -8.056 140 HD22 LEU 321 HD22 LEU 321 10.041 -4.389 -6.936 141 HD23 LEU 321 HD23 LEU 321 9.776 -4.222 -8.672 142 H VAL 322 HN VAL 322 9.370 -5.608 -11.998 143 HA VAL 322 HA VAL 322 8.254 -7.773 -13.654 144 HB VAL 322 HB VAL 322 9.136 -6.459 -15.665 145 HG11 VAL 322 HG11 VAL 322 7.078 -5.135 -15.838 146 HG12 VAL 322 HG12 VAL 322 6.781 -5.390 -14.118 147 HG13 VAL 322 HG13 VAL 322 6.776 -6.762 -15.227 148 HG21 VAL 322 HG21 VAL 322 9.207 -4.012 -15.441 149 HG22 VAL 322 HG22 VAL 322 10.472 -4.784 -14.486 150 HG23 VAL 322 HG23 VAL 322 9.022 -4.167 -13.694 151 H GLU 323 HN GLU 323 9.599 -9.386 -13.968 152 HA GLU 323 HA GLU 323 12.499 -8.863 -13.959 153 HB2 GLU 323 HB2 GLU 323 10.972 -11.156 -12.731 154 HB3 GLU 323 HB1 GLU 323 12.693 -11.254 -13.072 155 HG2 GLU 323 HG2 GLU 323 13.093 -9.343 -11.600 156 HG3 GLU 323 HG1 GLU 323 11.367 -9.252 -11.255 Start of MODEL 2 1 H1 GLY 304 HT1 GLY 304 -3.475 14.583 -0.786 2 H2 GLY 304 HT2 GLY 304 -2.753 16.110 -0.881 3 H3 GLY 304 HT3 GLY 304 -3.269 15.331 -2.291 4 HA2 GLY 304 HA1 GLY 304 -4.817 17.075 -1.687 5 HA3 GLY 304 HA2 GLY 304 -5.568 15.489 -1.593 6 H PHE 305 HN PHE 305 -5.822 14.510 0.501 7 HA PHE 305 HA PHE 305 -6.254 16.514 2.591 8 HB2 PHE 305 HB2 PHE 305 -7.376 13.741 2.172 9 HB3 PHE 305 HB1 PHE 305 -7.639 14.662 3.648 10 HD1 PHE 305 HD1 PHE 305 -8.441 14.375 0.093 11 HD2 PHE 305 HD2 PHE 305 -9.084 16.600 3.665 12 HE1 PHE 305 HE1 PHE 305 -10.376 15.481 -0.949 13 HE2 PHE 305 HE2 PHE 305 -11.020 17.711 2.629 14 HZ PHE 305 HZ PHE 305 -11.668 17.152 0.320 15 HA PRO 306 HA PRO 306 -3.000 14.871 5.183 16 HB2 PRO 306 HB2 PRO 306 -4.604 15.075 7.621 17 HB3 PRO 306 HB1 PRO 306 -3.204 16.033 7.126 18 HG2 PRO 306 HG2 PRO 306 -5.670 17.090 7.232 19 HG3 PRO 306 HG1 PRO 306 -4.471 17.597 6.024 20 HD2 PRO 306 HD2 PRO 306 -6.780 15.713 5.706 21 HD3 PRO 306 HD1 PRO 306 -6.224 17.010 4.628 22 H ARG 307 HN ARG 307 -6.211 13.525 5.861 23 HA ARG 307 HA ARG 307 -5.001 11.062 6.889 24 HB2 ARG 307 HB2 ARG 307 -7.820 12.136 6.969 25 HB3 ARG 307 HB1 ARG 307 -7.434 10.483 7.420 26 HG2 ARG 307 HG2 ARG 307 -6.044 11.237 9.225 27 HG3 ARG 307 HG1 ARG 307 -6.219 12.915 8.715 28 HD2 ARG 307 HD2 ARG 307 -7.697 12.640 10.531 29 HD3 ARG 307 HD1 ARG 307 -8.707 12.631 9.086 30 HE ARG 307 HE ARG 307 -7.978 9.989 9.802 31 HH11 ARG 307 HH11 ARG 307 -10.137 12.575 10.799 32 HH12 ARG 307 HH12 ARG 307 -11.290 11.491 11.507 33 HH21 ARG 307 HH21 ARG 307 -9.500 8.593 10.734 34 HH22 ARG 307 HH22 ARG 307 -10.928 9.242 11.470 35 H ALA 308 HN ALA 308 -4.445 9.680 5.352 36 HA ALA 308 HA ALA 308 -6.446 8.867 3.370 37 HB1 ALA 308 HB1 ALA 308 -3.594 9.539 2.647 38 HB2 ALA 308 HB2 ALA 308 -5.014 10.499 2.232 39 HB3 ALA 308 HB3 ALA 308 -4.815 8.881 1.558 40 H LEU 309 HN LEU 309 -6.217 6.750 2.598 41 HA LEU 309 HA LEU 309 -4.436 5.044 4.205 42 HB2 LEU 309 HB2 LEU 309 -7.111 4.449 2.940 43 HB3 LEU 309 HB1 LEU 309 -6.082 3.217 3.640 44 HG LEU 309 HG LEU 309 -6.234 4.786 5.774 45 HD11 LEU 309 HD11 LEU 309 -8.448 5.795 5.986 46 HD12 LEU 309 HD12 LEU 309 -8.801 5.385 4.308 47 HD13 LEU 309 HD13 LEU 309 -7.526 6.544 4.682 48 HD21 LEU 309 HD21 LEU 309 -8.406 2.898 4.875 49 HD22 LEU 309 HD22 LEU 309 -8.138 3.431 6.535 50 HD23 LEU 309 HD23 LEU 309 -6.914 2.463 5.712 51 HA PRO 310 HA PRO 310 -2.540 4.472 0.093 52 HB2 PRO 310 HB2 PRO 310 -0.413 3.017 1.455 53 HB3 PRO 310 HB1 PRO 310 -0.333 4.533 0.563 54 HG2 PRO 310 HG2 PRO 310 -0.034 4.404 3.252 55 HG3 PRO 310 HG1 PRO 310 -0.686 5.819 2.407 56 HD2 PRO 310 HD2 PRO 310 -2.137 3.690 3.917 57 HD3 PRO 310 HD1 PRO 310 -2.443 5.438 3.837 58 H ALA 311 HN ALA 311 -1.640 2.542 -1.095 59 HA ALA 311 HA ALA 311 -3.525 0.326 -0.722 60 HB1 ALA 311 HB1 ALA 311 -3.154 -0.206 -3.079 61 HB2 ALA 311 HB2 ALA 311 -1.990 1.113 -3.194 62 HB3 ALA 311 HB3 ALA 311 -3.693 1.462 -2.891 63 H TRP 312 HN TRP 312 -0.419 1.352 -0.921 64 HA TRP 312 HA TRP 312 0.988 -1.129 -1.039 65 HB2 TRP 312 HB2 TRP 312 2.908 0.337 -1.127 66 HB3 TRP 312 HB1 TRP 312 1.594 1.101 -2.026 67 HD1 TRP 312 HD1 TRP 312 1.363 3.543 -1.695 68 HE1 TRP 312 HE1 TRP 312 1.881 5.259 0.142 69 HE3 TRP 312 HE3 TRP 312 3.223 0.391 1.903 70 HZ2 TRP 312 HZ2 TRP 312 2.915 5.289 2.755 71 HZ3 TRP 312 HZ3 TRP 312 3.945 1.360 4.040 72 HH2 TRP 312 HH2 TRP 312 3.783 3.753 4.457 73 H ALA 313 HN ALA 313 -0.643 0.582 1.128 74 HA ALA 313 HA ALA 313 0.822 0.146 3.565 75 HB1 ALA 313 HB1 ALA 313 -1.450 1.681 2.516 76 HB2 ALA 313 HB2 ALA 313 -0.252 2.114 3.766 77 HB3 ALA 313 HB3 ALA 313 -1.657 1.124 4.195 78 H ARG 314 HN ARG 314 -0.114 -2.215 2.028 79 HA ARG 314 HA ARG 314 -1.742 -3.496 4.086 80 HB2 ARG 314 HB2 ARG 314 -2.067 -3.678 1.096 81 HB3 ARG 314 HB1 ARG 314 -2.702 -4.911 2.173 82 HG2 ARG 314 HG2 ARG 314 -3.427 -2.052 2.635 83 HG3 ARG 314 HG1 ARG 314 -4.224 -2.955 1.346 84 HD2 ARG 314 HD2 ARG 314 -4.081 -3.925 4.197 85 HD3 ARG 314 HD1 ARG 314 -5.403 -2.933 3.584 86 HE ARG 314 HE ARG 314 -5.085 -5.147 1.893 87 HH11 ARG 314 HH11 ARG 314 -6.163 -4.465 5.166 88 HH12 ARG 314 HH12 ARG 314 -7.228 -5.830 5.222 89 HH21 ARG 314 HH21 ARG 314 -7.408 -7.222 3.425 90 HH22 ARG 314 HH22 ARG 314 -6.483 -6.927 1.990 91 HA PRO 315 HA PRO 315 2.143 -5.938 4.116 92 HB2 PRO 315 HB2 PRO 315 1.086 -7.738 5.972 93 HB3 PRO 315 HB1 PRO 315 2.081 -6.324 6.349 94 HG2 PRO 315 HG2 PRO 315 -0.877 -6.624 6.424 95 HG3 PRO 315 HG1 PRO 315 0.189 -5.679 7.482 96 HD2 PRO 315 HD2 PRO 315 -1.284 -4.474 5.629 97 HD3 PRO 315 HD1 PRO 315 0.372 -3.935 5.957 98 H ASP 316 HN ASP 316 -1.028 -7.097 3.705 99 HA ASP 316 HA ASP 316 -0.286 -9.725 2.744 100 HB2 ASP 316 HB2 ASP 316 -2.938 -8.298 2.963 101 HB3 ASP 316 HB1 ASP 316 -2.777 -9.902 2.255 102 H TYR 317 HN TYR 317 -0.249 -6.716 1.367 103 HA TYR 317 HA TYR 317 -0.999 -7.608 -1.318 104 HB2 TYR 317 HB2 TYR 317 -1.913 -5.454 -0.395 105 HB3 TYR 317 HB1 TYR 317 -0.276 -4.816 -0.382 106 HD1 TYR 317 HD1 TYR 317 0.712 -3.951 -2.355 107 HD2 TYR 317 HD2 TYR 317 -3.008 -6.005 -2.589 108 HE1 TYR 317 HE1 TYR 317 0.437 -3.173 -4.669 109 HE2 TYR 317 HE2 TYR 317 -3.291 -5.237 -4.908 110 HH TYR 317 HH TYR 317 -2.496 -3.406 -6.352 111 H ASN 318 HN ASN 318 0.537 -8.436 -2.527 112 HA ASN 318 HA ASN 318 3.315 -7.566 -2.152 113 HB2 ASN 318 HB2 ASN 318 3.949 -9.716 -3.265 114 HB3 ASN 318 HB1 ASN 318 3.117 -9.918 -1.732 115 HD21 ASN 318 HD21 ASN 318 3.467 -11.692 -4.082 116 HD22 ASN 318 HD22 ASN 318 1.872 -12.186 -4.523 117 HA PRO 319 HA PRO 319 2.702 -5.465 -6.151 118 HB2 PRO 319 HB2 PRO 319 5.606 -4.950 -5.900 119 HB3 PRO 319 HB1 PRO 319 4.278 -3.804 -6.127 120 HG2 PRO 319 HG2 PRO 319 5.527 -3.982 -3.787 121 HG3 PRO 319 HG1 PRO 319 3.773 -3.714 -3.878 122 HD2 PRO 319 HD2 PRO 319 5.266 -6.233 -3.266 123 HD3 PRO 319 HD1 PRO 319 3.788 -5.581 -2.526 124 HA PRO 320 HA PRO 320 4.267 -8.746 -8.802 125 HB2 PRO 320 HB2 PRO 320 3.563 -7.716 -11.214 126 HB3 PRO 320 HB1 PRO 320 2.397 -8.450 -10.105 127 HG2 PRO 320 HG2 PRO 320 2.959 -5.566 -10.601 128 HG3 PRO 320 HG1 PRO 320 1.407 -6.380 -10.329 129 HD2 PRO 320 HD2 PRO 320 2.715 -4.978 -8.395 130 HD3 PRO 320 HD1 PRO 320 1.632 -6.338 -8.053 131 H LEU 321 HN LEU 321 6.296 -9.090 -9.275 132 HA LEU 321 HA LEU 321 8.021 -6.902 -10.175 133 HB2 LEU 321 HB2 LEU 321 8.527 -8.512 -8.195 134 HB3 LEU 321 HB1 LEU 321 8.968 -9.658 -9.443 135 HG LEU 321 HG LEU 321 10.530 -7.703 -10.266 136 HD11 LEU 321 HD11 LEU 321 11.427 -6.396 -8.392 137 HD12 LEU 321 HD12 LEU 321 10.165 -7.048 -7.345 138 HD13 LEU 321 HD13 LEU 321 9.733 -6.018 -8.711 139 HD21 LEU 321 HD21 LEU 321 11.120 -9.407 -7.852 140 HD22 LEU 321 HD22 LEU 321 12.326 -8.610 -8.860 141 HD23 LEU 321 HD23 LEU 321 11.309 -9.881 -9.539 142 H VAL 322 HN VAL 322 9.308 -7.041 -12.012 143 HA VAL 322 HA VAL 322 8.747 -9.243 -13.872 144 HB VAL 322 HB VAL 322 8.821 -7.523 -15.762 145 HG11 VAL 322 HG11 VAL 322 6.799 -8.703 -15.145 146 HG12 VAL 322 HG12 VAL 322 6.425 -7.031 -15.565 147 HG13 VAL 322 HG13 VAL 322 6.471 -7.525 -13.873 148 HG21 VAL 322 HG21 VAL 322 8.217 -5.623 -13.486 149 HG22 VAL 322 HG22 VAL 322 8.022 -5.250 -15.198 150 HG23 VAL 322 HG23 VAL 322 9.628 -5.579 -14.546 151 H GLU 323 HN GLU 323 10.478 -10.106 -14.800 152 HA GLU 323 HA GLU 323 12.989 -8.574 -14.855 153 HB2 GLU 323 HB2 GLU 323 12.584 -11.418 -13.927 154 HB3 GLU 323 HB1 GLU 323 14.157 -10.799 -14.403 155 HG2 GLU 323 HG2 GLU 323 12.526 -9.441 -12.284 156 HG3 GLU 323 HG1 GLU 323 13.555 -10.824 -11.913 Start of MODEL 3 1 H1 GLY 304 HT1 GLY 304 -6.554 19.475 2.125 2 H2 GLY 304 HT2 GLY 304 -7.808 20.137 1.204 3 H3 GLY 304 HT3 GLY 304 -6.247 20.047 0.562 4 HA2 GLY 304 HA1 GLY 304 -7.641 18.329 -0.388 5 HA3 GLY 304 HA2 GLY 304 -6.335 17.642 0.563 6 H PHE 305 HN PHE 305 -7.510 15.712 0.815 7 HA PHE 305 HA PHE 305 -9.955 15.850 2.423 8 HB2 PHE 305 HB2 PHE 305 -8.717 13.611 0.822 9 HB3 PHE 305 HB1 PHE 305 -10.101 13.379 1.882 10 HD1 PHE 305 HD1 PHE 305 -12.275 14.273 1.306 11 HD2 PHE 305 HD2 PHE 305 -8.921 14.828 -1.256 12 HE1 PHE 305 HE1 PHE 305 -13.783 14.946 -0.518 13 HE2 PHE 305 HE2 PHE 305 -10.425 15.502 -3.084 14 HZ PHE 305 HZ PHE 305 -12.859 15.563 -2.715 15 HA PRO 306 HA PRO 306 -7.412 14.854 6.053 16 HB2 PRO 306 HB2 PRO 306 -10.007 14.224 7.326 17 HB3 PRO 306 HB1 PRO 306 -8.764 15.383 7.821 18 HG2 PRO 306 HG2 PRO 306 -11.070 16.223 6.798 19 HG3 PRO 306 HG1 PRO 306 -9.541 17.043 6.422 20 HD2 PRO 306 HD2 PRO 306 -11.114 15.125 4.747 21 HD3 PRO 306 HD1 PRO 306 -10.273 16.619 4.278 22 H ARG 307 HN ARG 307 -6.574 13.020 6.890 23 HA ARG 307 HA ARG 307 -6.084 10.836 7.230 24 HB2 ARG 307 HB2 ARG 307 -9.094 10.583 7.245 25 HB3 ARG 307 HB1 ARG 307 -8.022 9.227 7.560 26 HG2 ARG 307 HG2 ARG 307 -7.085 10.394 9.481 27 HG3 ARG 307 HG1 ARG 307 -8.133 11.777 9.158 28 HD2 ARG 307 HD2 ARG 307 -10.100 10.353 9.497 29 HD3 ARG 307 HD1 ARG 307 -9.043 8.983 9.837 30 HE ARG 307 HE ARG 307 -8.297 10.956 11.606 31 HH11 ARG 307 HH11 ARG 307 -11.260 9.184 10.958 32 HH12 ARG 307 HH12 ARG 307 -11.823 9.303 12.592 33 HH21 ARG 307 HH21 ARG 307 -9.054 11.099 13.738 34 HH22 ARG 307 HH22 ARG 307 -10.575 10.386 14.164 35 H ALA 308 HN ALA 308 -5.111 9.581 5.827 36 HA ALA 308 HA ALA 308 -6.520 8.791 3.363 37 HB1 ALA 308 HB1 ALA 308 -4.447 9.026 2.106 38 HB2 ALA 308 HB2 ALA 308 -3.615 9.581 3.559 39 HB3 ALA 308 HB3 ALA 308 -4.902 10.558 2.853 40 H LEU 309 HN LEU 309 -6.010 6.765 2.508 41 HA LEU 309 HA LEU 309 -4.424 4.986 4.233 42 HB2 LEU 309 HB2 LEU 309 -7.104 4.426 2.966 43 HB3 LEU 309 HB1 LEU 309 -6.080 3.179 3.649 44 HG LEU 309 HG LEU 309 -6.874 5.487 5.376 45 HD11 LEU 309 HD11 LEU 309 -8.915 4.301 6.029 46 HD12 LEU 309 HD12 LEU 309 -8.635 3.124 4.745 47 HD13 LEU 309 HD13 LEU 309 -8.963 4.809 4.341 48 HD21 LEU 309 HD21 LEU 309 -6.420 2.548 5.898 49 HD22 LEU 309 HD22 LEU 309 -6.785 3.768 7.118 50 HD23 LEU 309 HD23 LEU 309 -5.271 3.848 6.218 51 HA PRO 310 HA PRO 310 -2.543 4.476 0.103 52 HB2 PRO 310 HB2 PRO 310 -0.407 3.016 1.450 53 HB3 PRO 310 HB1 PRO 310 -0.333 4.537 0.562 54 HG2 PRO 310 HG2 PRO 310 -0.022 4.397 3.249 55 HG3 PRO 310 HG1 PRO 310 -0.681 5.816 2.411 56 HD2 PRO 310 HD2 PRO 310 -2.121 3.685 3.925 57 HD3 PRO 310 HD1 PRO 310 -2.431 5.432 3.845 58 H ALA 311 HN ALA 311 -1.634 2.546 -1.094 59 HA ALA 311 HA ALA 311 -3.526 0.334 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.144 -0.197 -3.086 61 HB2 ALA 311 HB2 ALA 311 -1.991 1.132 -3.196 62 HB3 ALA 311 HB3 ALA 311 -3.696 1.467 -2.893 63 H TRP 312 HN TRP 312 -0.418 1.354 -0.920 64 HA TRP 312 HA TRP 312 0.985 -1.132 -1.038 65 HB2 TRP 312 HB2 TRP 312 2.910 0.329 -1.116 66 HB3 TRP 312 HB1 TRP 312 1.600 1.092 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.365 3.530 -1.703 68 HE1 TRP 312 HE1 TRP 312 1.880 5.256 0.127 69 HE3 TRP 312 HE3 TRP 312 3.217 0.396 1.914 70 HZ2 TRP 312 HZ2 TRP 312 2.910 5.298 2.741 71 HZ3 TRP 312 HZ3 TRP 312 3.936 1.374 4.048 72 HH2 TRP 312 HH2 TRP 312 3.775 3.770 4.451 73 H ALA 313 HN ALA 313 -0.654 0.568 1.130 74 HA ALA 313 HA ALA 313 0.817 0.130 3.563 75 HB1 ALA 313 HB1 ALA 313 -0.247 2.103 3.764 76 HB2 ALA 313 HB2 ALA 313 -1.654 1.122 4.203 77 HB3 ALA 313 HB3 ALA 313 -1.448 1.678 2.520 78 H ARG 314 HN ARG 314 0.042 -2.270 2.150 79 HA ARG 314 HA ARG 314 -1.723 -3.510 4.115 80 HB2 ARG 314 HB2 ARG 314 -2.671 -3.079 1.692 81 HB3 ARG 314 HB1 ARG 314 -1.714 -4.496 1.289 82 HG2 ARG 314 HG2 ARG 314 -2.933 -5.812 2.934 83 HG3 ARG 314 HG1 ARG 314 -3.870 -4.389 3.392 84 HD2 ARG 314 HD2 ARG 314 -3.821 -5.468 0.584 85 HD3 ARG 314 HD1 ARG 314 -4.977 -6.023 1.793 86 HE ARG 314 HE ARG 314 -4.987 -3.187 1.581 87 HH11 ARG 314 HH11 ARG 314 -6.161 -6.067 -0.050 88 HH12 ARG 314 HH12 ARG 314 -7.499 -5.247 -0.782 89 HH21 ARG 314 HH21 ARG 314 -7.829 -3.022 -0.406 90 HH22 ARG 314 HH22 ARG 314 -6.746 -2.134 0.614 91 HA PRO 315 HA PRO 315 2.214 -5.807 4.618 92 HB2 PRO 315 HB2 PRO 315 1.020 -7.595 6.407 93 HB3 PRO 315 HB1 PRO 315 1.940 -6.148 6.839 94 HG2 PRO 315 HG2 PRO 315 -1.002 -6.526 6.646 95 HG3 PRO 315 HG1 PRO 315 -0.064 -5.506 7.756 96 HD2 PRO 315 HD2 PRO 315 -1.395 -4.428 5.719 97 HD3 PRO 315 HD1 PRO 315 0.200 -3.812 6.187 98 H ASP 316 HN ASP 316 -0.848 -7.098 3.898 99 HA ASP 316 HA ASP 316 0.072 -9.728 3.132 100 HB2 ASP 316 HB2 ASP 316 -2.616 -8.365 2.943 101 HB3 ASP 316 HB1 ASP 316 -2.328 -9.989 2.328 102 H TYR 317 HN TYR 317 0.228 -6.773 1.659 103 HA TYR 317 HA TYR 317 0.104 -7.897 -1.059 104 HB2 TYR 317 HB2 TYR 317 -1.491 -6.006 -0.491 105 HB3 TYR 317 HB1 TYR 317 -0.082 -4.973 -0.298 106 HD1 TYR 317 HD1 TYR 317 -2.078 -6.900 -2.738 107 HD2 TYR 317 HD2 TYR 317 1.068 -4.088 -2.192 108 HE1 TYR 317 HE1 TYR 317 -2.123 -6.391 -5.142 109 HE2 TYR 317 HE2 TYR 317 1.031 -3.569 -4.595 110 HH TYR 317 HH TYR 317 -1.480 -4.556 -6.651 111 H ASN 318 HN ASN 318 1.971 -8.136 -2.062 112 HA ASN 318 HA ASN 318 4.377 -6.863 -0.989 113 HB2 ASN 318 HB2 ASN 318 4.091 -9.416 -1.475 114 HB3 ASN 318 HB1 ASN 318 4.394 -8.953 -3.146 115 HD21 ASN 318 HD21 ASN 318 5.728 -9.207 0.051 116 HD22 ASN 318 HD22 ASN 318 7.384 -9.013 -0.403 117 HA PRO 319 HA PRO 319 4.044 -3.916 -4.457 118 HB2 PRO 319 HB2 PRO 319 6.713 -3.054 -3.524 119 HB3 PRO 319 HB1 PRO 319 5.236 -2.103 -3.734 120 HG2 PRO 319 HG2 PRO 319 6.129 -2.698 -1.302 121 HG3 PRO 319 HG1 PRO 319 4.392 -2.680 -1.667 122 HD2 PRO 319 HD2 PRO 319 6.233 -5.021 -1.386 123 HD3 PRO 319 HD1 PRO 319 4.566 -4.812 -0.806 124 HA PRO 320 HA PRO 320 6.739 -5.815 -7.490 125 HB2 PRO 320 HB2 PRO 320 6.681 -3.525 -9.246 126 HB3 PRO 320 HB1 PRO 320 5.777 -5.036 -9.389 127 HG2 PRO 320 HG2 PRO 320 4.616 -2.617 -8.860 128 HG3 PRO 320 HG1 PRO 320 3.917 -4.182 -8.404 129 HD2 PRO 320 HD2 PRO 320 5.410 -2.221 -6.716 130 HD3 PRO 320 HD1 PRO 320 4.009 -3.227 -6.320 131 H LEU 321 HN LEU 321 8.793 -6.021 -6.895 132 HA LEU 321 HA LEU 321 10.557 -3.684 -6.790 133 HB2 LEU 321 HB2 LEU 321 10.875 -6.517 -5.811 134 HB3 LEU 321 HB1 LEU 321 12.203 -5.374 -5.836 135 HG LEU 321 HG LEU 321 10.398 -3.923 -4.461 136 HD11 LEU 321 HD11 LEU 321 8.705 -5.674 -4.499 137 HD12 LEU 321 HD12 LEU 321 9.264 -5.369 -2.855 138 HD13 LEU 321 HD13 LEU 321 9.831 -6.792 -3.729 139 HD21 LEU 321 HD21 LEU 321 12.249 -6.016 -3.330 140 HD22 LEU 321 HD22 LEU 321 11.575 -4.654 -2.436 141 HD23 LEU 321 HD23 LEU 321 12.684 -4.366 -3.776 142 H VAL 322 HN VAL 322 12.297 -3.411 -8.100 143 HA VAL 322 HA VAL 322 12.914 -5.480 -10.081 144 HB VAL 322 HB VAL 322 13.168 -3.633 -11.832 145 HG11 VAL 322 HG11 VAL 322 10.808 -3.778 -12.484 146 HG12 VAL 322 HG12 VAL 322 10.412 -4.392 -10.879 147 HG13 VAL 322 HG13 VAL 322 11.448 -5.334 -11.953 148 HG21 VAL 322 HG21 VAL 322 12.963 -1.677 -10.382 149 HG22 VAL 322 HG22 VAL 322 11.323 -2.158 -9.944 150 HG23 VAL 322 HG23 VAL 322 11.688 -1.682 -11.602 151 H GLU 323 HN GLU 323 15.014 -5.793 -10.407 152 HA GLU 323 HA GLU 323 16.903 -3.916 -9.165 153 HB2 GLU 323 HB2 GLU 323 17.094 -6.863 -9.784 154 HB3 GLU 323 HB1 GLU 323 18.506 -5.903 -9.364 155 HG2 GLU 323 HG2 GLU 323 17.490 -5.340 -7.216 156 HG3 GLU 323 HG1 GLU 323 16.071 -6.299 -7.638 Start of MODEL 4 1 H1 GLY 304 HT1 GLY 304 -6.257 18.758 5.612 2 H2 GLY 304 HT2 GLY 304 -6.768 17.246 6.176 3 H3 GLY 304 HT3 GLY 304 -6.730 18.571 7.227 4 HA2 GLY 304 HA1 GLY 304 -8.457 19.678 5.949 5 HA3 GLY 304 HA2 GLY 304 -8.499 18.302 4.858 6 H PHE 305 HN PHE 305 -10.375 17.313 5.175 7 HA PHE 305 HA PHE 305 -11.172 16.697 7.939 8 HB2 PHE 305 HB2 PHE 305 -12.903 17.395 5.572 9 HB3 PHE 305 HB1 PHE 305 -13.544 16.597 7.002 10 HD1 PHE 305 HD1 PHE 305 -13.732 17.777 9.104 11 HD2 PHE 305 HD2 PHE 305 -12.178 19.698 5.638 12 HE1 PHE 305 HE1 PHE 305 -14.011 19.964 10.196 13 HE2 PHE 305 HE2 PHE 305 -12.453 21.887 6.725 14 HZ PHE 305 HZ PHE 305 -13.371 22.023 9.007 15 HA PRO 306 HA PRO 306 -12.207 12.732 5.381 16 HB2 PRO 306 HB2 PRO 306 -10.850 12.861 2.816 17 HB3 PRO 306 HB1 PRO 306 -12.576 12.662 3.141 18 HG2 PRO 306 HG2 PRO 306 -11.565 14.899 2.004 19 HG3 PRO 306 HG1 PRO 306 -13.008 14.908 3.038 20 HD2 PRO 306 HD2 PRO 306 -10.185 15.622 3.745 21 HD3 PRO 306 HD1 PRO 306 -11.693 16.465 4.149 22 H ARG 307 HN ARG 307 -11.080 10.811 5.472 23 HA ARG 307 HA ARG 307 -8.189 11.045 5.933 24 HB2 ARG 307 HB2 ARG 307 -10.232 9.003 6.802 25 HB3 ARG 307 HB1 ARG 307 -8.503 8.724 6.958 26 HG2 ARG 307 HG2 ARG 307 -8.314 10.696 8.392 27 HG3 ARG 307 HG1 ARG 307 -10.051 10.971 8.238 28 HD2 ARG 307 HD2 ARG 307 -10.479 8.791 9.272 29 HD3 ARG 307 HD1 ARG 307 -8.743 8.527 9.431 30 HE ARG 307 HE ARG 307 -9.364 10.939 10.689 31 HH11 ARG 307 HH11 ARG 307 -10.017 7.518 11.155 32 HH12 ARG 307 HH12 ARG 307 -10.172 7.666 12.874 33 HH21 ARG 307 HH21 ARG 307 -9.571 11.105 12.942 34 HH22 ARG 307 HH22 ARG 307 -9.920 9.694 13.884 35 H ALA 308 HN ALA 308 -6.706 9.783 4.879 36 HA ALA 308 HA ALA 308 -7.700 8.113 2.663 37 HB1 ALA 308 HB1 ALA 308 -5.311 9.952 2.580 38 HB2 ALA 308 HB2 ALA 308 -6.867 10.251 1.806 39 HB3 ALA 308 HB3 ALA 308 -5.863 8.903 1.275 40 H LEU 309 HN LEU 309 -6.667 6.214 2.282 41 HA LEU 309 HA LEU 309 -4.406 5.514 4.032 42 HB2 LEU 309 HB2 LEU 309 -6.789 3.825 3.281 43 HB3 LEU 309 HB1 LEU 309 -5.343 3.174 4.026 44 HG LEU 309 HG LEU 309 -5.878 5.009 5.865 45 HD11 LEU 309 HD11 LEU 309 -8.287 5.238 6.215 46 HD12 LEU 309 HD12 LEU 309 -8.590 4.410 4.688 47 HD13 LEU 309 HD13 LEU 309 -7.782 5.977 4.696 48 HD21 LEU 309 HD21 LEU 309 -7.323 2.374 5.623 49 HD22 LEU 309 HD22 LEU 309 -7.099 3.290 7.114 50 HD23 LEU 309 HD23 LEU 309 -5.702 2.620 6.273 51 HA PRO 310 HA PRO 310 -2.518 4.487 0.085 52 HB2 PRO 310 HB2 PRO 310 -0.411 3.014 1.440 53 HB3 PRO 310 HB1 PRO 310 -0.321 4.557 0.595 54 HG2 PRO 310 HG2 PRO 310 -0.054 4.337 3.287 55 HG3 PRO 310 HG1 PRO 310 -0.678 5.785 2.477 56 HD2 PRO 310 HD2 PRO 310 -2.177 3.621 3.890 57 HD3 PRO 310 HD1 PRO 310 -2.453 5.375 3.878 58 H ALA 311 HN ALA 311 -1.625 2.547 -1.090 59 HA ALA 311 HA ALA 311 -3.526 0.344 -0.724 60 HB1 ALA 311 HB1 ALA 311 -3.145 -0.196 -3.079 61 HB2 ALA 311 HB2 ALA 311 -1.983 1.125 -3.192 62 HB3 ALA 311 HB3 ALA 311 -3.686 1.472 -2.895 63 H TRP 312 HN TRP 312 -0.414 1.354 -0.920 64 HA TRP 312 HA TRP 312 0.984 -1.132 -1.041 65 HB2 TRP 312 HB2 TRP 312 2.910 0.327 -1.118 66 HB3 TRP 312 HB1 TRP 312 1.601 1.088 -2.027 67 HD1 TRP 312 HD1 TRP 312 1.366 3.529 -1.706 68 HE1 TRP 312 HE1 TRP 312 1.880 5.255 0.123 69 HE3 TRP 312 HE3 TRP 312 3.214 0.395 1.913 70 HZ2 TRP 312 HZ2 TRP 312 2.906 5.297 2.738 71 HZ3 TRP 312 HZ3 TRP 312 3.930 1.375 4.049 72 HH2 TRP 312 HH2 TRP 312 3.768 3.770 4.451 73 H ALA 313 HN ALA 313 -0.647 0.562 1.135 74 HA ALA 313 HA ALA 313 0.828 0.114 3.565 75 HB1 ALA 313 HB1 ALA 313 -0.248 2.075 3.795 76 HB2 ALA 313 HB2 ALA 313 -1.662 1.086 4.196 77 HB3 ALA 313 HB3 ALA 313 -1.429 1.668 2.525 78 H ARG 314 HN ARG 314 -0.415 -2.128 1.841 79 HA ARG 314 HA ARG 314 -1.784 -3.527 4.000 80 HB2 ARG 314 HB2 ARG 314 -2.601 -3.388 1.103 81 HB3 ARG 314 HB1 ARG 314 -3.129 -4.692 2.156 82 HG2 ARG 314 HG2 ARG 314 -4.126 -2.990 3.669 83 HG3 ARG 314 HG1 ARG 314 -3.707 -1.754 2.482 84 HD2 ARG 314 HD2 ARG 314 -5.959 -2.287 2.055 85 HD3 ARG 314 HD1 ARG 314 -5.036 -3.121 0.806 86 HE ARG 314 HE ARG 314 -5.298 -4.982 2.772 87 HH11 ARG 314 HH11 ARG 314 -7.622 -3.038 0.995 88 HH12 ARG 314 HH12 ARG 314 -8.881 -4.221 1.123 89 HH21 ARG 314 HH21 ARG 314 -8.505 -6.187 2.215 90 HH22 ARG 314 HH22 ARG 314 -6.959 -6.515 2.926 91 HA PRO 315 HA PRO 315 1.869 -6.166 3.241 92 HB2 PRO 315 HB2 PRO 315 0.822 -8.173 4.903 93 HB3 PRO 315 HB1 PRO 315 2.004 -6.941 5.362 94 HG2 PRO 315 HG2 PRO 315 -0.929 -6.991 5.797 95 HG3 PRO 315 HG1 PRO 315 0.350 -6.265 6.790 96 HD2 PRO 315 HD2 PRO 315 -1.261 -4.748 5.300 97 HD3 PRO 315 HD1 PRO 315 0.455 -4.347 5.487 98 H ASP 316 HN ASP 316 -1.391 -7.071 2.932 99 HA ASP 316 HA ASP 316 -0.864 -9.533 1.480 100 HB2 ASP 316 HB2 ASP 316 -3.417 -8.128 2.279 101 HB3 ASP 316 HB1 ASP 316 -3.404 -9.576 1.276 102 H TYR 317 HN TYR 317 -0.379 -6.573 0.557 103 HA TYR 317 HA TYR 317 -1.341 -6.962 -2.190 104 HB2 TYR 317 HB2 TYR 317 -2.708 -5.246 -0.955 105 HB3 TYR 317 HB1 TYR 317 -1.244 -4.296 -0.747 106 HD1 TYR 317 HD1 TYR 317 -0.452 -2.888 -2.471 107 HD2 TYR 317 HD2 TYR 317 -3.620 -5.610 -3.276 108 HE1 TYR 317 HE1 TYR 317 -0.854 -1.769 -4.620 109 HE2 TYR 317 HE2 TYR 317 -4.032 -4.501 -5.432 110 HH TYR 317 HH TYR 317 -1.861 -2.278 -6.802 111 H ASN 318 HN ASN 318 0.112 -6.454 -3.770 112 HA ASN 318 HA ASN 318 2.874 -6.106 -2.949 113 HB2 ASN 318 HB2 ASN 318 1.594 -6.741 -5.608 114 HB3 ASN 318 HB1 ASN 318 3.326 -6.481 -5.418 115 HD21 ASN 318 HD21 ASN 318 0.646 -8.577 -4.731 116 HD22 ASN 318 HD22 ASN 318 1.578 -9.943 -4.234 117 HA PRO 319 HA PRO 319 3.107 -1.767 -4.001 118 HB2 PRO 319 HB2 PRO 319 5.877 -2.030 -4.884 119 HB3 PRO 319 HB1 PRO 319 5.243 -1.233 -3.439 120 HG2 PRO 319 HG2 PRO 319 6.688 -3.505 -3.308 121 HG3 PRO 319 HG1 PRO 319 5.402 -3.117 -2.147 122 HD2 PRO 319 HD2 PRO 319 5.317 -4.960 -4.504 123 HD3 PRO 319 HD1 PRO 319 4.650 -5.174 -2.873 124 HA PRO 320 HA PRO 320 2.601 -1.726 -8.480 125 HB2 PRO 320 HB2 PRO 320 1.789 0.831 -8.783 126 HB3 PRO 320 HB1 PRO 320 0.739 -0.417 -8.096 127 HG2 PRO 320 HG2 PRO 320 2.298 1.708 -6.698 128 HG3 PRO 320 HG1 PRO 320 0.665 1.101 -6.359 129 HD2 PRO 320 HD2 PRO 320 2.890 0.339 -4.954 130 HD3 PRO 320 HD1 PRO 320 1.433 -0.654 -5.126 131 H LEU 321 HN LEU 321 4.247 -1.705 -9.817 132 HA LEU 321 HA LEU 321 6.106 0.584 -9.821 133 HB2 LEU 321 HB2 LEU 321 6.660 -2.349 -10.193 134 HB3 LEU 321 HB1 LEU 321 7.767 -1.127 -10.789 135 HG LEU 321 HG LEU 321 7.574 -0.292 -8.251 136 HD11 LEU 321 HD11 LEU 321 6.014 -2.038 -7.582 137 HD12 LEU 321 HD12 LEU 321 7.555 -2.211 -6.741 138 HD13 LEU 321 HD13 LEU 321 7.163 -3.274 -8.093 139 HD21 LEU 321 HD21 LEU 321 9.647 -1.528 -7.818 140 HD22 LEU 321 HD22 LEU 321 9.639 -0.794 -9.420 141 HD23 LEU 321 HD23 LEU 321 9.342 -2.524 -9.240 142 H VAL 322 HN VAL 322 6.761 1.406 -11.778 143 HA VAL 322 HA VAL 322 5.655 0.227 -14.219 144 HB VAL 322 HB VAL 322 5.078 2.589 -15.022 145 HG11 VAL 322 HG11 VAL 322 2.836 2.490 -14.028 146 HG12 VAL 322 HG12 VAL 322 3.420 1.307 -12.857 147 HG13 VAL 322 HG13 VAL 322 3.398 0.910 -14.575 148 HG21 VAL 322 HG21 VAL 322 6.140 3.875 -13.229 149 HG22 VAL 322 HG22 VAL 322 5.050 3.145 -12.048 150 HG23 VAL 322 HG23 VAL 322 4.409 4.208 -13.301 151 H GLU 323 HN GLU 323 7.197 -0.035 -15.656 152 HA GLU 323 HA GLU 323 9.537 1.752 -15.593 153 HB2 GLU 323 HB2 GLU 323 9.658 -0.866 -15.200 154 HB3 GLU 323 HB1 GLU 323 9.601 -0.914 -16.956 155 HG2 GLU 323 HG2 GLU 323 11.618 0.769 -15.502 156 HG3 GLU 323 HG1 GLU 323 11.891 -0.944 -15.811 Start of MODEL 5 1 H1 GLY 304 HT1 GLY 304 -16.089 11.665 -4.073 2 H2 GLY 304 HT2 GLY 304 -17.208 10.591 -3.399 3 H3 GLY 304 HT3 GLY 304 -16.774 10.447 -5.028 4 HA2 GLY 304 HA1 GLY 304 -14.975 10.010 -2.705 5 HA3 GLY 304 HA2 GLY 304 -15.687 8.746 -3.699 6 H PHE 305 HN PHE 305 -13.354 11.348 -3.583 7 HA PHE 305 HA PHE 305 -12.000 10.171 -5.911 8 HB2 PHE 305 HB2 PHE 305 -12.419 13.097 -5.316 9 HB3 PHE 305 HB1 PHE 305 -11.169 12.530 -6.414 10 HD1 PHE 305 HD1 PHE 305 -14.759 12.950 -5.895 11 HD2 PHE 305 HD2 PHE 305 -11.740 11.576 -8.562 12 HE1 PHE 305 HE1 PHE 305 -16.404 12.894 -7.723 13 HE2 PHE 305 HE2 PHE 305 -13.382 11.517 -10.394 14 HZ PHE 305 HZ PHE 305 -15.716 12.176 -9.976 15 HA PRO 306 HA PRO 306 -8.545 11.812 -2.952 16 HB2 PRO 306 HB2 PRO 306 -9.721 12.384 -0.355 17 HB3 PRO 306 HB1 PRO 306 -8.789 13.457 -1.405 18 HG2 PRO 306 HG2 PRO 306 -11.420 13.836 -0.925 19 HG3 PRO 306 HG1 PRO 306 -10.646 14.287 -2.457 20 HD2 PRO 306 HD2 PRO 306 -12.265 11.847 -1.813 21 HD3 PRO 306 HD1 PRO 306 -12.341 12.901 -3.239 22 H ARG 307 HN ARG 307 -7.259 10.667 -1.444 23 HA ARG 307 HA ARG 307 -8.544 8.346 -0.163 24 HB2 ARG 307 HB2 ARG 307 -6.052 8.399 -1.860 25 HB3 ARG 307 HB1 ARG 307 -6.390 7.093 -0.734 26 HG2 ARG 307 HG2 ARG 307 -8.463 6.593 -1.928 27 HG3 ARG 307 HG1 ARG 307 -8.128 7.908 -3.056 28 HD2 ARG 307 HD2 ARG 307 -6.067 6.781 -3.749 29 HD3 ARG 307 HD1 ARG 307 -6.409 5.467 -2.625 30 HE ARG 307 HE ARG 307 -8.607 5.769 -4.330 31 HH11 ARG 307 HH11 ARG 307 -5.262 4.714 -4.522 32 HH12 ARG 307 HH12 ARG 307 -5.556 3.646 -5.853 33 HH21 ARG 307 HH21 ARG 307 -8.968 4.366 -6.072 34 HH22 ARG 307 HH22 ARG 307 -7.654 3.451 -6.729 35 H ALA 308 HN ALA 308 -7.729 7.707 1.799 36 HA ALA 308 HA ALA 308 -5.761 9.524 3.026 37 HB1 ALA 308 HB1 ALA 308 -8.069 8.033 4.260 38 HB2 ALA 308 HB2 ALA 308 -7.876 9.779 4.092 39 HB3 ALA 308 HB3 ALA 308 -6.833 8.878 5.194 40 H LEU 309 HN LEU 309 -6.796 6.138 2.812 41 HA LEU 309 HA LEU 309 -4.361 5.267 4.181 42 HB2 LEU 309 HB2 LEU 309 -6.846 3.778 3.345 43 HB3 LEU 309 HB1 LEU 309 -5.439 2.991 4.031 44 HG LEU 309 HG LEU 309 -5.860 4.775 5.971 45 HD11 LEU 309 HD11 LEU 309 -7.767 5.816 4.829 46 HD12 LEU 309 HD12 LEU 309 -8.229 5.098 6.372 47 HD13 LEU 309 HD13 LEU 309 -8.618 4.272 4.864 48 HD21 LEU 309 HD21 LEU 309 -7.368 2.186 5.630 49 HD22 LEU 309 HD22 LEU 309 -7.111 3.030 7.158 50 HD23 LEU 309 HD23 LEU 309 -5.736 2.370 6.272 51 HA PRO 310 HA PRO 310 -2.543 4.475 0.122 52 HB2 PRO 310 HB2 PRO 310 -0.401 3.015 1.466 53 HB3 PRO 310 HB1 PRO 310 -0.326 4.522 0.557 54 HG2 PRO 310 HG2 PRO 310 0.003 4.432 3.237 55 HG3 PRO 310 HG1 PRO 310 -0.686 5.830 2.390 56 HD2 PRO 310 HD2 PRO 310 -2.077 3.691 3.939 57 HD3 PRO 310 HD1 PRO 310 -2.408 5.434 3.856 58 H ALA 311 HN ALA 311 -1.633 2.547 -1.091 59 HA ALA 311 HA ALA 311 -3.524 0.336 -0.724 60 HB1 ALA 311 HB1 ALA 311 -3.146 -0.193 -3.085 61 HB2 ALA 311 HB2 ALA 311 -1.991 1.137 -3.193 62 HB3 ALA 311 HB3 ALA 311 -3.695 1.472 -2.887 63 H TRP 312 HN TRP 312 -0.415 1.352 -0.920 64 HA TRP 312 HA TRP 312 0.985 -1.134 -1.041 65 HB2 TRP 312 HB2 TRP 312 2.911 0.326 -1.116 66 HB3 TRP 312 HB1 TRP 312 1.603 1.087 -2.027 67 HD1 TRP 312 HD1 TRP 312 1.379 3.528 -1.714 68 HE1 TRP 312 HE1 TRP 312 1.890 5.256 0.114 69 HE3 TRP 312 HE3 TRP 312 3.203 0.398 1.921 70 HZ2 TRP 312 HZ2 TRP 312 2.903 5.303 2.733 71 HZ3 TRP 312 HZ3 TRP 312 3.913 1.381 4.056 72 HH2 TRP 312 HH2 TRP 312 3.756 3.777 4.452 73 H ALA 313 HN ALA 313 -0.649 0.572 1.126 74 HA ALA 313 HA ALA 313 0.823 0.150 3.554 75 HB1 ALA 313 HB1 ALA 313 -1.664 1.104 4.195 76 HB2 ALA 313 HB2 ALA 313 -1.455 1.670 2.517 77 HB3 ALA 313 HB3 ALA 313 -0.264 2.103 3.771 78 H ARG 314 HN ARG 314 -0.516 -2.081 1.818 79 HA ARG 314 HA ARG 314 -1.754 -3.498 4.055 80 HB2 ARG 314 HB2 ARG 314 -2.811 -3.086 1.300 81 HB3 ARG 314 HB1 ARG 314 -3.069 -4.660 2.037 82 HG2 ARG 314 HG2 ARG 314 -4.990 -3.565 2.641 83 HG3 ARG 314 HG1 ARG 314 -3.976 -3.250 4.047 84 HD2 ARG 314 HD2 ARG 314 -3.369 -1.059 3.074 85 HD3 ARG 314 HD1 ARG 314 -4.459 -1.382 1.726 86 HE ARG 314 HE ARG 314 -5.658 -1.520 4.360 87 HH11 ARG 314 HH11 ARG 314 -5.032 0.518 1.568 88 HH12 ARG 314 HH12 ARG 314 -6.307 1.626 1.950 89 HH21 ARG 314 HH21 ARG 314 -7.599 1.300 3.800 90 HH22 ARG 314 HH22 ARG 314 -7.319 -0.058 4.839 91 HA PRO 315 HA PRO 315 1.871 -6.102 2.960 92 HB2 PRO 315 HB2 PRO 315 1.194 -7.996 4.895 93 HB3 PRO 315 HB1 PRO 315 2.333 -6.660 5.109 94 HG2 PRO 315 HG2 PRO 315 -0.532 -6.841 5.892 95 HG3 PRO 315 HG1 PRO 315 0.816 -6.037 6.722 96 HD2 PRO 315 HD2 PRO 315 -0.981 -4.615 5.382 97 HD3 PRO 315 HD1 PRO 315 0.737 -4.179 5.331 98 H ASP 316 HN ASP 316 -1.371 -7.069 3.301 99 HA ASP 316 HA ASP 316 -1.040 -9.595 1.897 100 HB2 ASP 316 HB2 ASP 316 -3.437 -8.251 3.146 101 HB3 ASP 316 HB1 ASP 316 -3.560 -9.743 2.220 102 H TYR 317 HN TYR 317 -2.274 -6.367 1.311 103 HA TYR 317 HA TYR 317 -2.930 -5.222 -0.528 104 HB2 TYR 317 HB2 TYR 317 -0.763 -6.416 -1.397 105 HB3 TYR 317 HB1 TYR 317 -1.893 -7.362 -2.359 106 HD1 TYR 317 HD1 TYR 317 -0.374 -4.073 -1.870 107 HD2 TYR 317 HD2 TYR 317 -3.185 -6.312 -4.148 108 HE1 TYR 317 HE1 TYR 317 -0.423 -2.285 -3.556 109 HE2 TYR 317 HE2 TYR 317 -3.241 -4.531 -5.841 110 HH TYR 317 HH TYR 317 -0.971 -2.004 -5.928 111 H ASN 318 HN ASN 318 -4.927 -4.962 -1.188 112 HA ASN 318 HA ASN 318 -6.577 -7.320 -1.759 113 HB2 ASN 318 HB2 ASN 318 -7.298 -4.517 -0.896 114 HB3 ASN 318 HB1 ASN 318 -8.498 -5.682 -1.446 115 HD21 ASN 318 HD21 ASN 318 -6.255 -4.842 1.065 116 HD22 ASN 318 HD22 ASN 318 -6.852 -5.948 2.248 117 HA PRO 319 HA PRO 319 -6.967 -6.302 -6.092 118 HB2 PRO 319 HB2 PRO 319 -9.885 -6.742 -5.989 119 HB3 PRO 319 HB1 PRO 319 -8.651 -7.611 -6.911 120 HG2 PRO 319 HG2 PRO 319 -9.848 -8.750 -4.822 121 HG3 PRO 319 HG1 PRO 319 -8.130 -9.027 -5.170 122 HD2 PRO 319 HD2 PRO 319 -9.371 -7.228 -3.126 123 HD3 PRO 319 HD1 PRO 319 -7.961 -8.298 -2.986 124 HA PRO 320 HA PRO 320 -8.353 -2.039 -6.194 125 HB2 PRO 320 HB2 PRO 320 -8.058 -1.527 -8.846 126 HB3 PRO 320 HB1 PRO 320 -6.689 -1.644 -7.730 127 HG2 PRO 320 HG2 PRO 320 -7.727 -3.675 -9.652 128 HG3 PRO 320 HG1 PRO 320 -6.048 -3.258 -9.251 129 HD2 PRO 320 HD2 PRO 320 -7.317 -5.439 -8.233 130 HD3 PRO 320 HD1 PRO 320 -6.028 -4.574 -7.377 131 H LEU 321 HN LEU 321 -10.369 -1.431 -5.988 132 HA LEU 321 HA LEU 321 -12.339 -2.135 -8.060 133 HB2 LEU 321 HB2 LEU 321 -12.486 -3.381 -5.780 134 HB3 LEU 321 HB1 LEU 321 -13.097 -1.859 -5.166 135 HG LEU 321 HG LEU 321 -14.805 -2.100 -7.168 136 HD11 LEU 321 HD11 LEU 321 -13.789 -4.094 -8.133 137 HD12 LEU 321 HD12 LEU 321 -15.424 -4.432 -7.565 138 HD13 LEU 321 HD13 LEU 321 -14.035 -4.965 -6.618 139 HD21 LEU 321 HD21 LEU 321 -15.412 -1.979 -4.818 140 HD22 LEU 321 HD22 LEU 321 -14.991 -3.678 -4.605 141 HD23 LEU 321 HD23 LEU 321 -16.350 -3.230 -5.635 142 H VAL 322 HN VAL 322 -13.478 -0.478 -8.850 143 HA VAL 322 HA VAL 322 -13.628 2.030 -7.340 144 HB VAL 322 HB VAL 322 -13.279 3.290 -9.540 145 HG11 VAL 322 HG11 VAL 322 -11.689 3.359 -7.712 146 HG12 VAL 322 HG12 VAL 322 -10.843 3.319 -9.259 147 HG13 VAL 322 HG13 VAL 322 -10.947 1.860 -8.273 148 HG21 VAL 322 HG21 VAL 322 -13.384 1.402 -11.093 149 HG22 VAL 322 HG22 VAL 322 -11.957 0.689 -10.342 150 HG23 VAL 322 HG23 VAL 322 -11.825 2.220 -11.207 151 H GLU 323 HN GLU 323 -15.551 2.998 -7.387 152 HA GLU 323 HA GLU 323 -17.564 1.993 -9.292 153 HB2 GLU 323 HB2 GLU 323 -17.851 2.800 -6.400 154 HB3 GLU 323 HB1 GLU 323 -19.233 2.674 -7.476 155 HG2 GLU 323 HG2 GLU 323 -18.718 0.319 -7.868 156 HG3 GLU 323 HG1 GLU 323 -17.330 0.446 -6.790 Start of MODEL 6 1 H1 GLY 304 HT1 GLY 304 -15.382 4.233 -6.052 2 H2 GLY 304 HT2 GLY 304 -13.717 4.053 -6.292 3 H3 GLY 304 HT3 GLY 304 -14.642 4.920 -7.410 4 HA2 GLY 304 HA1 GLY 304 -15.127 6.609 -5.750 5 HA3 GLY 304 HA2 GLY 304 -14.166 5.709 -4.588 6 H PHE 305 HN PHE 305 -13.851 8.445 -5.607 7 HA PHE 305 HA PHE 305 -11.340 8.282 -7.090 8 HB2 PHE 305 HB2 PHE 305 -13.197 10.583 -6.505 9 HB3 PHE 305 HB1 PHE 305 -11.591 10.821 -7.180 10 HD1 PHE 305 HD1 PHE 305 -14.964 9.566 -7.797 11 HD2 PHE 305 HD2 PHE 305 -11.083 10.144 -9.445 12 HE1 PHE 305 HE1 PHE 305 -15.865 9.163 -10.052 13 HE2 PHE 305 HE2 PHE 305 -11.976 9.742 -11.702 14 HZ PHE 305 HZ PHE 305 -14.370 9.250 -12.007 15 HA PRO 306 HA PRO 306 -9.903 10.640 -3.121 16 HB2 PRO 306 HB2 PRO 306 -11.826 10.158 -0.994 17 HB3 PRO 306 HB1 PRO 306 -11.256 11.701 -1.637 18 HG2 PRO 306 HG2 PRO 306 -13.793 10.846 -1.986 19 HG3 PRO 306 HG1 PRO 306 -12.946 11.855 -3.176 20 HD2 PRO 306 HD2 PRO 306 -13.374 8.888 -3.194 21 HD3 PRO 306 HD1 PRO 306 -13.562 10.058 -4.515 22 H ARG 307 HN ARG 307 -8.560 9.838 -1.505 23 HA ARG 307 HA ARG 307 -8.978 7.037 -0.697 24 HB2 ARG 307 HB2 ARG 307 -6.465 8.319 -1.762 25 HB3 ARG 307 HB1 ARG 307 -6.433 6.831 -0.827 26 HG2 ARG 307 HG2 ARG 307 -7.837 5.740 -2.497 27 HG3 ARG 307 HG1 ARG 307 -7.892 7.237 -3.430 28 HD2 ARG 307 HD2 ARG 307 -5.460 7.148 -3.704 29 HD3 ARG 307 HD1 ARG 307 -5.412 5.649 -2.778 30 HE ARG 307 HE ARG 307 -7.181 5.282 -4.902 31 HH11 ARG 307 HH11 ARG 307 -3.736 5.803 -4.456 32 HH12 ARG 307 HH12 ARG 307 -3.303 4.955 -5.902 33 HH21 ARG 307 HH21 ARG 307 -6.591 4.174 -6.790 34 HH22 ARG 307 HH22 ARG 307 -4.919 4.033 -7.222 35 H ALA 308 HN ALA 308 -8.578 6.558 1.388 36 HA ALA 308 HA ALA 308 -7.835 8.772 3.159 37 HB1 ALA 308 HB1 ALA 308 -9.956 7.749 3.667 38 HB2 ALA 308 HB2 ALA 308 -8.811 7.371 4.954 39 HB3 ALA 308 HB3 ALA 308 -9.211 6.152 3.743 40 H LEU 309 HN LEU 309 -7.032 5.377 2.490 41 HA LEU 309 HA LEU 309 -4.472 5.771 3.891 42 HB2 LEU 309 HB2 LEU 309 -6.256 3.343 3.869 43 HB3 LEU 309 HB1 LEU 309 -4.574 3.272 4.351 44 HG LEU 309 HG LEU 309 -5.316 5.180 6.028 45 HD11 LEU 309 HD11 LEU 309 -7.885 3.683 5.522 46 HD12 LEU 309 HD12 LEU 309 -7.588 5.395 5.215 47 HD13 LEU 309 HD13 LEU 309 -7.589 4.782 6.869 48 HD21 LEU 309 HD21 LEU 309 -5.737 3.440 7.708 49 HD22 LEU 309 HD22 LEU 309 -4.364 3.044 6.676 50 HD23 LEU 309 HD23 LEU 309 -5.917 2.251 6.418 51 HA PRO 310 HA PRO 310 -2.541 4.481 0.093 52 HB2 PRO 310 HB2 PRO 310 -0.409 3.023 1.439 53 HB3 PRO 310 HB1 PRO 310 -0.336 4.553 0.569 54 HG2 PRO 310 HG2 PRO 310 -0.042 4.378 3.260 55 HG3 PRO 310 HG1 PRO 310 -0.680 5.810 2.433 56 HD2 PRO 310 HD2 PRO 310 -2.151 3.678 3.915 57 HD3 PRO 310 HD1 PRO 310 -2.448 5.425 3.846 58 H ALA 311 HN ALA 311 -1.633 2.546 -1.095 59 HA ALA 311 HA ALA 311 -3.526 0.336 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.146 -0.201 -3.083 61 HB2 ALA 311 HB2 ALA 311 -1.988 1.125 -3.197 62 HB3 ALA 311 HB3 ALA 311 -3.693 1.466 -2.896 63 H TRP 312 HN TRP 312 -0.418 1.352 -0.920 64 HA TRP 312 HA TRP 312 0.985 -1.132 -1.037 65 HB2 TRP 312 HB2 TRP 312 2.909 0.327 -1.117 66 HB3 TRP 312 HB1 TRP 312 1.598 1.092 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.361 3.530 -1.699 68 HE1 TRP 312 HE1 TRP 312 1.876 5.254 0.132 69 HE3 TRP 312 HE3 TRP 312 3.224 0.394 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.912 5.295 2.744 71 HZ3 TRP 312 HZ3 TRP 312 3.947 1.372 4.045 72 HH2 TRP 312 HH2 TRP 312 3.783 3.767 4.451 73 H ALA 313 HN ALA 313 -0.648 0.576 1.132 74 HA ALA 313 HA ALA 313 0.823 0.136 3.566 75 HB1 ALA 313 HB1 ALA 313 -1.435 1.686 2.520 76 HB2 ALA 313 HB2 ALA 313 -0.241 2.106 3.779 77 HB3 ALA 313 HB3 ALA 313 -1.655 1.125 4.196 78 H ARG 314 HN ARG 314 -0.316 -2.160 1.918 79 HA ARG 314 HA ARG 314 -1.786 -3.489 4.058 80 HB2 ARG 314 HB2 ARG 314 -2.436 -3.461 1.118 81 HB3 ARG 314 HB1 ARG 314 -2.985 -4.759 2.169 82 HG2 ARG 314 HG2 ARG 314 -4.152 -3.102 3.568 83 HG3 ARG 314 HG1 ARG 314 -3.643 -1.833 2.452 84 HD2 ARG 314 HD2 ARG 314 -4.857 -2.932 0.641 85 HD3 ARG 314 HD1 ARG 314 -5.347 -4.219 1.741 86 HE ARG 314 HE ARG 314 -6.123 -1.628 2.672 87 HH11 ARG 314 HH11 ARG 314 -7.077 -4.219 0.500 88 HH12 ARG 314 HH12 ARG 314 -8.753 -3.786 0.536 89 HH21 ARG 314 HH21 ARG 314 -9.456 -2.009 1.781 90 HH22 ARG 314 HH22 ARG 314 -8.321 -1.080 2.703 91 HA PRO 315 HA PRO 315 1.948 -6.094 3.592 92 HB2 PRO 315 HB2 PRO 315 0.928 -7.992 5.377 93 HB3 PRO 315 HB1 PRO 315 2.037 -6.674 5.779 94 HG2 PRO 315 HG2 PRO 315 -0.914 -6.819 6.094 95 HG3 PRO 315 HG1 PRO 315 0.291 -5.998 7.106 96 HD2 PRO 315 HD2 PRO 315 -1.281 -4.611 5.465 97 HD3 PRO 315 HD1 PRO 315 0.419 -4.159 5.694 98 H ASP 316 HN ASP 316 -1.293 -7.082 3.314 99 HA ASP 316 HA ASP 316 -0.737 -9.651 2.100 100 HB2 ASP 316 HB2 ASP 316 -3.303 -8.146 2.611 101 HB3 ASP 316 HB1 ASP 316 -3.257 -9.691 1.770 102 H TYR 317 HN TYR 317 -0.751 -6.511 0.994 103 HA TYR 317 HA TYR 317 -1.527 -7.235 -1.744 104 HB2 TYR 317 HB2 TYR 317 -2.692 -5.295 -0.680 105 HB3 TYR 317 HB1 TYR 317 -1.142 -4.480 -0.534 106 HD1 TYR 317 HD1 TYR 317 -3.687 -5.675 -2.938 107 HD2 TYR 317 HD2 TYR 317 -0.165 -3.352 -2.388 108 HE1 TYR 317 HE1 TYR 317 -3.989 -4.695 -5.173 109 HE2 TYR 317 HE2 TYR 317 -0.457 -2.365 -4.619 110 HH TYR 317 HH TYR 317 -3.328 -2.672 -6.402 111 H ASN 318 HN ASN 318 0.051 -7.669 -3.103 112 HA ASN 318 HA ASN 318 2.740 -6.589 -2.605 113 HB2 ASN 318 HB2 ASN 318 2.210 -9.155 -2.715 114 HB3 ASN 318 HB1 ASN 318 2.208 -8.891 -4.455 115 HD21 ASN 318 HD21 ASN 318 4.123 -8.933 -1.559 116 HD22 ASN 318 HD22 ASN 318 5.666 -8.912 -2.334 117 HA PRO 319 HA PRO 319 2.235 -4.231 -6.401 118 HB2 PRO 319 HB2 PRO 319 5.121 -4.020 -6.712 119 HB3 PRO 319 HB1 PRO 319 3.965 -2.765 -6.255 120 HG2 PRO 319 HG2 PRO 319 5.792 -3.746 -4.524 121 HG3 PRO 319 HG1 PRO 319 4.199 -3.152 -4.014 122 HD2 PRO 319 HD2 PRO 319 5.115 -5.973 -4.420 123 HD3 PRO 319 HD1 PRO 319 4.123 -5.281 -3.120 124 HA PRO 320 HA PRO 320 2.942 -6.969 -9.869 125 HB2 PRO 320 HB2 PRO 320 3.435 -4.711 -11.677 126 HB3 PRO 320 HB1 PRO 320 2.084 -5.850 -11.659 127 HG2 PRO 320 HG2 PRO 320 1.770 -3.280 -10.953 128 HG3 PRO 320 HG1 PRO 320 0.844 -4.592 -10.197 129 HD2 PRO 320 HD2 PRO 320 3.233 -3.126 -9.147 130 HD3 PRO 320 HD1 PRO 320 1.761 -3.642 -8.307 131 H LEU 321 HN LEU 321 4.772 -8.075 -9.785 132 HA LEU 321 HA LEU 321 7.337 -6.757 -10.316 133 HB2 LEU 321 HB2 LEU 321 6.665 -9.474 -9.187 134 HB3 LEU 321 HB1 LEU 321 8.298 -8.965 -9.565 135 HG LEU 321 HG LEU 321 6.660 -7.293 -7.702 136 HD11 LEU 321 HD11 LEU 321 7.444 -8.641 -5.811 137 HD12 LEU 321 HD12 LEU 321 8.101 -9.828 -6.937 138 HD13 LEU 321 HD13 LEU 321 6.361 -9.553 -6.862 139 HD21 LEU 321 HD21 LEU 321 9.598 -7.965 -7.869 140 HD22 LEU 321 HD22 LEU 321 8.859 -6.859 -6.711 141 HD23 LEU 321 HD23 LEU 321 8.839 -6.475 -8.433 142 H VAL 322 HN VAL 322 8.679 -7.338 -11.972 143 HA VAL 322 HA VAL 322 7.536 -9.133 -14.010 144 HB VAL 322 HB VAL 322 8.974 -7.814 -15.665 145 HG11 VAL 322 HG11 VAL 322 6.631 -6.462 -14.337 146 HG12 VAL 322 HG12 VAL 322 6.558 -7.670 -15.619 147 HG13 VAL 322 HG13 VAL 322 7.256 -6.083 -15.941 148 HG21 VAL 322 HG21 VAL 322 10.378 -6.591 -14.082 149 HG22 VAL 322 HG22 VAL 322 8.956 -5.781 -13.425 150 HG23 VAL 322 HG23 VAL 322 9.457 -5.473 -15.088 151 H GLU 323 HN GLU 323 8.574 -10.958 -14.297 152 HA GLU 323 HA GLU 323 10.145 -12.582 -14.403 153 HB2 GLU 323 HB2 GLU 323 11.955 -10.225 -14.928 154 HB3 GLU 323 HB1 GLU 323 12.529 -11.885 -14.957 155 HG2 GLU 323 HG2 GLU 323 10.947 -12.403 -16.747 156 HG3 GLU 323 HG1 GLU 323 10.372 -10.736 -16.717 Start of MODEL 7 1 H1 GLY 304 HT1 GLY 304 -3.744 14.139 1.784 2 H2 GLY 304 HT2 GLY 304 -2.845 12.724 1.548 3 H3 GLY 304 HT3 GLY 304 -2.554 13.694 2.903 4 HA2 GLY 304 HA1 GLY 304 -4.763 13.216 3.762 5 HA3 GLY 304 HA2 GLY 304 -5.065 12.207 2.355 6 H PHE 305 HN PHE 305 -4.217 12.158 5.526 7 HA PHE 305 HA PHE 305 -2.953 9.519 5.260 8 HB2 PHE 305 HB2 PHE 305 -2.209 11.730 7.170 9 HB3 PHE 305 HB1 PHE 305 -1.754 10.056 7.445 10 HD1 PHE 305 HD1 PHE 305 -1.209 13.029 5.400 11 HD2 PHE 305 HD2 PHE 305 -0.105 8.970 6.046 12 HE1 PHE 305 HE1 PHE 305 0.772 13.345 3.974 13 HE2 PHE 305 HE2 PHE 305 1.878 9.279 4.622 14 HZ PHE 305 HZ PHE 305 2.318 11.468 3.584 15 HA PRO 306 HA PRO 306 -5.723 9.354 9.215 16 HB2 PRO 306 HB2 PRO 306 -7.506 11.647 9.233 17 HB3 PRO 306 HB1 PRO 306 -6.352 11.139 10.469 18 HG2 PRO 306 HG2 PRO 306 -6.019 13.399 9.023 19 HG3 PRO 306 HG1 PRO 306 -4.660 12.437 9.638 20 HD2 PRO 306 HD2 PRO 306 -5.853 12.463 6.888 21 HD3 PRO 306 HD1 PRO 306 -4.145 12.487 7.371 22 H ARG 307 HN ARG 307 -7.226 10.966 6.439 23 HA ARG 307 HA ARG 307 -9.602 9.271 6.666 24 HB2 ARG 307 HB2 ARG 307 -8.974 11.712 5.018 25 HB3 ARG 307 HB1 ARG 307 -10.396 10.726 4.715 26 HG2 ARG 307 HG2 ARG 307 -11.168 11.149 7.003 27 HG3 ARG 307 HG1 ARG 307 -9.751 12.161 7.284 28 HD2 ARG 307 HD2 ARG 307 -10.470 13.662 5.490 29 HD3 ARG 307 HD1 ARG 307 -11.885 12.649 5.208 30 HE ARG 307 HE ARG 307 -11.835 13.447 7.906 31 HH11 ARG 307 HH11 ARG 307 -12.419 14.826 4.728 32 HH12 ARG 307 HH12 ARG 307 -13.473 16.061 5.333 33 HH21 ARG 307 HH21 ARG 307 -13.215 15.073 8.672 34 HH22 ARG 307 HH22 ARG 307 -13.923 16.199 7.562 35 H ALA 308 HN ALA 308 -6.941 9.982 4.443 36 HA ALA 308 HA ALA 308 -7.819 7.858 2.628 37 HB1 ALA 308 HB1 ALA 308 -6.146 8.724 1.087 38 HB2 ALA 308 HB2 ALA 308 -5.583 9.859 2.315 39 HB3 ALA 308 HB3 ALA 308 -7.208 10.017 1.644 40 H LEU 309 HN LEU 309 -6.863 5.933 2.510 41 HA LEU 309 HA LEU 309 -4.404 5.493 4.064 42 HB2 LEU 309 HB2 LEU 309 -6.662 4.363 4.701 43 HB3 LEU 309 HB1 LEU 309 -6.335 3.317 3.335 44 HG LEU 309 HG LEU 309 -4.178 3.598 5.362 45 HD11 LEU 309 HD11 LEU 309 -6.146 3.395 6.771 46 HD12 LEU 309 HD12 LEU 309 -5.212 1.899 6.794 47 HD13 LEU 309 HD13 LEU 309 -6.691 2.001 5.837 48 HD21 LEU 309 HD21 LEU 309 -5.304 1.272 3.805 49 HD22 LEU 309 HD22 LEU 309 -3.889 1.219 4.855 50 HD23 LEU 309 HD23 LEU 309 -3.864 2.202 3.389 51 HA PRO 310 HA PRO 310 -2.544 4.478 0.101 52 HB2 PRO 310 HB2 PRO 310 -0.410 3.020 1.451 53 HB3 PRO 310 HB1 PRO 310 -0.336 4.541 0.564 54 HG2 PRO 310 HG2 PRO 310 -0.029 4.402 3.250 55 HG3 PRO 310 HG1 PRO 310 -0.689 5.820 2.413 56 HD2 PRO 310 HD2 PRO 310 -2.127 3.680 3.920 57 HD3 PRO 310 HD1 PRO 310 -2.436 5.425 3.850 58 H ALA 311 HN ALA 311 -1.634 2.546 -1.092 59 HA ALA 311 HA ALA 311 -3.526 0.338 -0.729 60 HB1 ALA 311 HB1 ALA 311 -1.988 1.133 -3.195 61 HB2 ALA 311 HB2 ALA 311 -3.694 1.465 -2.895 62 HB3 ALA 311 HB3 ALA 311 -3.141 -0.197 -3.087 63 H TRP 312 HN TRP 312 -0.417 1.353 -0.920 64 HA TRP 312 HA TRP 312 0.985 -1.134 -1.036 65 HB2 TRP 312 HB2 TRP 312 2.909 0.327 -1.116 66 HB3 TRP 312 HB1 TRP 312 1.599 1.090 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.362 3.529 -1.702 68 HE1 TRP 312 HE1 TRP 312 1.879 5.255 0.128 69 HE3 TRP 312 HE3 TRP 312 3.221 0.396 1.914 70 HZ2 TRP 312 HZ2 TRP 312 2.912 5.298 2.740 71 HZ3 TRP 312 HZ3 TRP 312 3.942 1.375 4.047 72 HH2 TRP 312 HH2 TRP 312 3.780 3.771 4.450 73 H ALA 313 HN ALA 313 -0.652 0.569 1.129 74 HA ALA 313 HA ALA 313 0.817 0.129 3.565 75 HB1 ALA 313 HB1 ALA 313 -1.647 1.129 4.205 76 HB2 ALA 313 HB2 ALA 313 -1.446 1.681 2.522 77 HB3 ALA 313 HB3 ALA 313 -0.239 2.106 3.760 78 H ARG 314 HN ARG 314 0.109 -2.282 2.212 79 HA ARG 314 HA ARG 314 -1.722 -3.503 4.127 80 HB2 ARG 314 HB2 ARG 314 -1.670 -3.860 1.140 81 HB3 ARG 314 HB1 ARG 314 -2.353 -5.087 2.198 82 HG2 ARG 314 HG2 ARG 314 -3.937 -3.425 3.076 83 HG3 ARG 314 HG1 ARG 314 -3.269 -2.227 1.964 84 HD2 ARG 314 HD2 ARG 314 -3.931 -3.614 0.065 85 HD3 ARG 314 HD1 ARG 314 -4.579 -4.826 1.170 86 HE ARG 314 HE ARG 314 -5.748 -2.264 1.607 87 HH11 ARG 314 HH11 ARG 314 -5.923 -5.062 -0.508 88 HH12 ARG 314 HH12 ARG 314 -7.576 -4.778 -0.938 89 HH21 ARG 314 HH21 ARG 314 -8.699 -2.995 -0.068 90 HH22 ARG 314 HH22 ARG 314 -7.912 -1.910 1.030 91 HA PRO 315 HA PRO 315 2.197 -5.758 4.852 92 HB2 PRO 315 HB2 PRO 315 0.909 -7.545 6.585 93 HB3 PRO 315 HB1 PRO 315 1.813 -6.101 7.058 94 HG2 PRO 315 HG2 PRO 315 -1.114 -6.471 6.731 95 HG3 PRO 315 HG1 PRO 315 -0.226 -5.433 7.864 96 HD2 PRO 315 HD2 PRO 315 -1.470 -4.395 5.751 97 HD3 PRO 315 HD1 PRO 315 0.097 -3.763 6.284 98 H ASP 316 HN ASP 316 -0.806 -7.079 3.962 99 HA ASP 316 HA ASP 316 0.157 -9.716 3.290 100 HB2 ASP 316 HB2 ASP 316 -2.494 -8.343 2.854 101 HB3 ASP 316 HB1 ASP 316 -2.164 -9.978 2.291 102 H TYR 317 HN TYR 317 0.062 -6.701 1.717 103 HA TYR 317 HA TYR 317 0.518 -7.950 -0.913 104 HB2 TYR 317 HB2 TYR 317 -1.523 -6.479 -0.718 105 HB3 TYR 317 HB1 TYR 317 -0.449 -5.128 -0.377 106 HD1 TYR 317 HD1 TYR 317 0.809 -4.069 -2.127 107 HD2 TYR 317 HD2 TYR 317 -1.584 -7.484 -2.971 108 HE1 TYR 317 HE1 TYR 317 1.032 -3.621 -4.533 109 HE2 TYR 317 HE2 TYR 317 -1.367 -7.047 -5.382 110 HH TYR 317 HH TYR 317 0.884 -4.853 -6.658 111 H ASN 318 HN ASN 318 2.523 -7.810 -1.648 112 HA ASN 318 HA ASN 318 4.388 -5.927 -0.407 113 HB2 ASN 318 HB2 ASN 318 4.827 -8.433 -2.031 114 HB3 ASN 318 HB1 ASN 318 6.136 -7.353 -1.565 115 HD21 ASN 318 HD21 ASN 318 3.782 -9.652 -0.460 116 HD22 ASN 318 HD22 ASN 318 4.460 -9.898 1.111 117 HA PRO 319 HA PRO 319 4.585 -3.452 -4.135 118 HB2 PRO 319 HB2 PRO 319 7.358 -2.723 -3.636 119 HB3 PRO 319 HB1 PRO 319 5.907 -1.729 -3.471 120 HG2 PRO 319 HG2 PRO 319 7.375 -2.525 -1.342 121 HG3 PRO 319 HG1 PRO 319 5.625 -2.241 -1.262 122 HD2 PRO 319 HD2 PRO 319 7.105 -4.834 -1.477 123 HD3 PRO 319 HD1 PRO 319 5.690 -4.414 -0.491 124 HA PRO 320 HA PRO 320 6.688 -5.856 -7.259 125 HB2 PRO 320 HB2 PRO 320 6.783 -4.106 -9.328 126 HB3 PRO 320 HB1 PRO 320 5.283 -4.884 -8.802 127 HG2 PRO 320 HG2 PRO 320 6.270 -2.129 -8.226 128 HG3 PRO 320 HG1 PRO 320 4.628 -2.677 -8.614 129 HD2 PRO 320 HD2 PRO 320 5.450 -2.131 -6.077 130 HD3 PRO 320 HD1 PRO 320 4.191 -3.318 -6.459 131 H LEU 321 HN LEU 321 8.740 -6.399 -7.228 132 HA LEU 321 HA LEU 321 10.825 -4.332 -7.122 133 HB2 LEU 321 HB2 LEU 321 10.872 -7.267 -6.428 134 HB3 LEU 321 HB1 LEU 321 12.317 -6.277 -6.499 135 HG LEU 321 HG LEU 321 10.840 -4.791 -4.801 136 HD11 LEU 321 HD11 LEU 321 10.027 -7.647 -4.273 137 HD12 LEU 321 HD12 LEU 321 8.963 -6.345 -4.810 138 HD13 LEU 321 HD13 LEU 321 9.716 -6.269 -3.217 139 HD21 LEU 321 HD21 LEU 321 13.118 -5.541 -4.424 140 HD22 LEU 321 HD22 LEU 321 12.545 -7.172 -4.080 141 HD23 LEU 321 HD23 LEU 321 12.128 -5.843 -2.997 142 H VAL 322 HN VAL 322 12.624 -4.397 -8.488 143 HA VAL 322 HA VAL 322 12.268 -5.996 -10.939 144 HB VAL 322 HB VAL 322 13.597 -4.135 -12.094 145 HG11 VAL 322 HG11 VAL 322 11.250 -4.526 -12.523 146 HG12 VAL 322 HG12 VAL 322 11.576 -2.793 -12.484 147 HG13 VAL 322 HG13 VAL 322 10.805 -3.575 -11.105 148 HG21 VAL 322 HG21 VAL 322 14.374 -2.928 -10.111 149 HG22 VAL 322 HG22 VAL 322 12.706 -2.560 -9.671 150 HG23 VAL 322 HG23 VAL 322 13.398 -1.880 -11.142 151 H GLU 323 HN GLU 323 13.761 -7.470 -11.261 152 HA GLU 323 HA GLU 323 16.490 -7.002 -10.252 153 HB2 GLU 323 HB2 GLU 323 14.853 -9.535 -10.200 154 HB3 GLU 323 HB1 GLU 323 16.603 -9.545 -10.026 155 HG2 GLU 323 HG2 GLU 323 16.414 -8.132 -8.042 156 HG3 GLU 323 HG1 GLU 323 14.660 -8.124 -8.216 Start of MODEL 8 1 H1 GLY 304 HT1 GLY 304 -7.800 18.889 12.664 2 H2 GLY 304 HT2 GLY 304 -7.366 17.611 11.645 3 H3 GLY 304 HT3 GLY 304 -8.378 18.840 11.074 4 HA2 GLY 304 HA1 GLY 304 -6.594 20.455 11.290 5 HA3 GLY 304 HA2 GLY 304 -5.541 19.179 11.882 6 H PHE 305 HN PHE 305 -4.931 17.481 10.441 7 HA PHE 305 HA PHE 305 -4.823 18.379 7.657 8 HB2 PHE 305 HB2 PHE 305 -3.152 16.402 9.217 9 HB3 PHE 305 HB1 PHE 305 -3.001 16.619 7.477 10 HD1 PHE 305 HD1 PHE 305 -2.376 18.096 10.758 11 HD2 PHE 305 HD2 PHE 305 -2.022 18.630 6.550 12 HE1 PHE 305 HE1 PHE 305 -0.802 19.950 11.129 13 HE2 PHE 305 HE2 PHE 305 -0.446 20.485 6.915 14 HZ PHE 305 HZ PHE 305 0.166 21.146 9.206 15 HA PRO 306 HA PRO 306 -7.466 15.048 6.262 16 HB2 PRO 306 HB2 PRO 306 -5.910 14.578 3.846 17 HB3 PRO 306 HB1 PRO 306 -7.493 15.344 4.011 18 HG2 PRO 306 HG2 PRO 306 -5.292 16.728 3.286 19 HG3 PRO 306 HG1 PRO 306 -6.618 17.451 4.220 20 HD2 PRO 306 HD2 PRO 306 -3.974 16.430 5.186 21 HD3 PRO 306 HD1 PRO 306 -4.844 17.911 5.632 22 H ARG 307 HN ARG 307 -7.658 12.813 6.028 23 HA ARG 307 HA ARG 307 -5.207 11.270 6.574 24 HB2 ARG 307 HB2 ARG 307 -8.048 10.848 7.497 25 HB3 ARG 307 HB1 ARG 307 -6.833 9.580 7.588 26 HG2 ARG 307 HG2 ARG 307 -5.465 10.985 9.041 27 HG3 ARG 307 HG1 ARG 307 -6.671 12.268 8.941 28 HD2 ARG 307 HD2 ARG 307 -8.328 10.778 9.960 29 HD3 ARG 307 HD1 ARG 307 -7.110 9.506 10.074 30 HE ARG 307 HE ARG 307 -6.066 11.712 11.376 31 HH11 ARG 307 HH11 ARG 307 -8.840 9.600 11.802 32 HH12 ARG 307 HH12 ARG 307 -8.886 9.820 13.520 33 HH21 ARG 307 HH21 ARG 307 -6.151 11.989 13.624 34 HH22 ARG 307 HH22 ARG 307 -7.365 11.171 14.548 35 H ALA 308 HN ALA 308 -4.602 9.829 5.114 36 HA ALA 308 HA ALA 308 -6.596 8.754 3.230 37 HB1 ALA 308 HB1 ALA 308 -4.975 8.917 1.416 38 HB2 ALA 308 HB2 ALA 308 -3.807 9.654 2.512 39 HB3 ALA 308 HB3 ALA 308 -5.299 10.505 2.111 40 H LEU 309 HN LEU 309 -6.405 6.630 2.695 41 HA LEU 309 HA LEU 309 -4.424 5.074 4.202 42 HB2 LEU 309 HB2 LEU 309 -7.078 4.300 2.996 43 HB3 LEU 309 HB1 LEU 309 -5.965 3.144 3.700 44 HG LEU 309 HG LEU 309 -6.174 4.745 5.806 45 HD11 LEU 309 HD11 LEU 309 -7.589 6.398 4.708 46 HD12 LEU 309 HD12 LEU 309 -8.446 5.617 6.039 47 HD13 LEU 309 HD13 LEU 309 -8.796 5.156 4.373 48 HD21 LEU 309 HD21 LEU 309 -6.715 2.375 5.778 49 HD22 LEU 309 HD22 LEU 309 -8.256 2.719 4.995 50 HD23 LEU 309 HD23 LEU 309 -7.957 3.283 6.639 51 HA PRO 310 HA PRO 310 -2.540 4.479 0.099 52 HB2 PRO 310 HB2 PRO 310 -0.409 3.019 1.444 53 HB3 PRO 310 HB1 PRO 310 -0.334 4.546 0.570 54 HG2 PRO 310 HG2 PRO 310 -0.035 4.378 3.260 55 HG3 PRO 310 HG1 PRO 310 -0.675 5.810 2.430 56 HD2 PRO 310 HD2 PRO 310 -2.142 3.683 3.924 57 HD3 PRO 310 HD1 PRO 310 -2.441 5.431 3.843 58 H ALA 311 HN ALA 311 -1.632 2.547 -1.092 59 HA ALA 311 HA ALA 311 -3.526 0.340 -0.729 60 HB1 ALA 311 HB1 ALA 311 -1.989 1.141 -3.195 61 HB2 ALA 311 HB2 ALA 311 -3.698 1.464 -2.895 62 HB3 ALA 311 HB3 ALA 311 -3.134 -0.196 -3.087 63 H TRP 312 HN TRP 312 -0.416 1.353 -0.920 64 HA TRP 312 HA TRP 312 0.984 -1.134 -1.037 65 HB2 TRP 312 HB2 TRP 312 2.910 0.326 -1.116 66 HB3 TRP 312 HB1 TRP 312 1.600 1.089 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.359 3.526 -1.700 68 HE1 TRP 312 HE1 TRP 312 1.875 5.253 0.127 69 HE3 TRP 312 HE3 TRP 312 3.222 0.396 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.909 5.298 2.740 71 HZ3 TRP 312 HZ3 TRP 312 3.943 1.375 4.046 72 HH2 TRP 312 HH2 TRP 312 3.780 3.772 4.449 73 H ALA 313 HN ALA 313 -0.648 0.572 1.131 74 HA ALA 313 HA ALA 313 0.819 0.122 3.565 75 HB1 ALA 313 HB1 ALA 313 -1.438 1.683 2.523 76 HB2 ALA 313 HB2 ALA 313 -0.234 2.099 3.773 77 HB3 ALA 313 HB3 ALA 313 -1.649 1.124 4.202 78 H ARG 314 HN ARG 314 -0.339 -2.156 1.901 79 HA ARG 314 HA ARG 314 -1.816 -3.491 4.036 80 HB2 ARG 314 HB2 ARG 314 -2.455 -3.469 1.092 81 HB3 ARG 314 HB1 ARG 314 -3.038 -4.738 2.161 82 HG2 ARG 314 HG2 ARG 314 -4.199 -3.058 3.513 83 HG3 ARG 314 HG1 ARG 314 -3.624 -1.794 2.424 84 HD2 ARG 314 HD2 ARG 314 -4.819 -2.850 0.569 85 HD3 ARG 314 HD1 ARG 314 -5.390 -4.116 1.655 86 HE ARG 314 HE ARG 314 -6.150 -1.641 2.715 87 HH11 ARG 314 HH11 ARG 314 -6.927 -3.650 -0.059 88 HH12 ARG 314 HH12 ARG 314 -8.541 -3.036 -0.195 89 HH21 ARG 314 HH21 ARG 314 -9.295 -1.451 1.262 90 HH22 ARG 314 HH22 ARG 314 -8.263 -0.850 2.516 91 HA PRO 315 HA PRO 315 1.935 -6.091 3.574 92 HB2 PRO 315 HB2 PRO 315 0.823 -8.030 5.285 93 HB3 PRO 315 HB1 PRO 315 1.991 -6.779 5.729 94 HG2 PRO 315 HG2 PRO 315 -0.954 -6.811 6.065 95 HG3 PRO 315 HG1 PRO 315 0.289 -6.027 7.058 96 HD2 PRO 315 HD2 PRO 315 -1.276 -4.598 5.443 97 HD3 PRO 315 HD1 PRO 315 0.433 -4.182 5.660 98 H ASP 316 HN ASP 316 -1.295 -7.034 3.148 99 HA ASP 316 HA ASP 316 -0.670 -9.554 1.835 100 HB2 ASP 316 HB2 ASP 316 -2.680 -9.057 3.427 101 HB3 ASP 316 HB1 ASP 316 -3.428 -8.361 1.994 102 H TYR 317 HN TYR 317 0.269 -7.094 0.612 103 HA TYR 317 HA TYR 317 -1.382 -6.701 -1.754 104 HB2 TYR 317 HB2 TYR 317 -0.186 -4.831 -0.435 105 HB3 TYR 317 HB1 TYR 317 1.286 -5.398 -1.213 106 HD1 TYR 317 HD1 TYR 317 1.796 -4.786 -3.443 107 HD2 TYR 317 HD2 TYR 317 -2.058 -3.929 -1.855 108 HE1 TYR 317 HE1 TYR 317 1.315 -3.366 -5.390 109 HE2 TYR 317 HE2 TYR 317 -2.550 -2.509 -3.801 110 HH TYR 317 HH TYR 317 -1.321 -1.237 -5.511 111 H ASN 318 HN ASN 318 -1.181 -8.070 -3.360 112 HA ASN 318 HA ASN 318 1.475 -9.150 -4.036 113 HB2 ASN 318 HB2 ASN 318 -1.251 -10.427 -4.274 114 HB3 ASN 318 HB1 ASN 318 0.175 -11.068 -5.080 115 HD21 ASN 318 HD21 ASN 318 1.825 -11.981 -3.848 116 HD22 ASN 318 HD22 ASN 318 1.580 -12.467 -2.208 117 HA PRO 319 HA PRO 319 1.060 -7.264 -8.061 118 HB2 PRO 319 HB2 PRO 319 2.283 -9.572 -9.383 119 HB3 PRO 319 HB1 PRO 319 2.919 -7.934 -9.187 120 HG2 PRO 319 HG2 PRO 319 3.976 -10.025 -7.877 121 HG3 PRO 319 HG1 PRO 319 3.911 -8.397 -7.172 122 HD2 PRO 319 HD2 PRO 319 2.141 -10.751 -6.640 123 HD3 PRO 319 HD1 PRO 319 2.832 -9.576 -5.506 124 HA PRO 320 HA PRO 320 -2.571 -9.330 -9.827 125 HB2 PRO 320 HB2 PRO 320 -2.794 -7.186 -11.773 126 HB3 PRO 320 HB1 PRO 320 -3.832 -7.526 -10.385 127 HG2 PRO 320 HG2 PRO 320 -2.234 -5.343 -10.515 128 HG3 PRO 320 HG1 PRO 320 -2.678 -6.135 -8.990 129 HD2 PRO 320 HD2 PRO 320 -0.144 -6.367 -10.566 130 HD3 PRO 320 HD1 PRO 320 -0.377 -6.210 -8.814 131 H LEU 321 HN LEU 321 0.318 -9.551 -11.022 132 HA LEU 321 HA LEU 321 -0.370 -10.148 -13.809 133 HB2 LEU 321 HB2 LEU 321 2.296 -9.985 -12.403 134 HB3 LEU 321 HB1 LEU 321 2.104 -10.460 -14.076 135 HG LEU 321 HG LEU 321 0.835 -8.096 -14.166 136 HD11 LEU 321 HD11 LEU 321 1.285 -7.723 -11.739 137 HD12 LEU 321 HD12 LEU 321 1.895 -6.453 -12.801 138 HD13 LEU 321 HD13 LEU 321 3.004 -7.647 -12.127 139 HD21 LEU 321 HD21 LEU 321 2.660 -8.791 -15.617 140 HD22 LEU 321 HD22 LEU 321 3.820 -8.497 -14.321 141 HD23 LEU 321 HD23 LEU 321 2.924 -7.151 -15.026 142 H VAL 322 HN VAL 322 -0.148 -12.162 -14.718 143 HA VAL 322 HA VAL 322 -0.150 -14.424 -14.912 144 HB VAL 322 HB VAL 322 1.505 -14.630 -12.381 145 HG11 VAL 322 HG11 VAL 322 1.344 -16.391 -14.830 146 HG12 VAL 322 HG12 VAL 322 0.671 -16.751 -13.241 147 HG13 VAL 322 HG13 VAL 322 2.417 -16.642 -13.453 148 HG21 VAL 322 HG21 VAL 322 3.513 -14.499 -13.788 149 HG22 VAL 322 HG22 VAL 322 2.588 -12.998 -13.833 150 HG23 VAL 322 HG23 VAL 322 2.505 -14.126 -15.187 151 H GLU 323 HN GLU 323 -1.647 -15.915 -14.481 152 HA GLU 323 HA GLU 323 -3.255 -15.591 -12.052 153 HB2 GLU 323 HB2 GLU 323 -3.823 -16.881 -14.719 154 HB3 GLU 323 HB1 GLU 323 -4.874 -17.105 -13.331 155 HG2 GLU 323 HG2 GLU 323 -5.250 -14.693 -13.222 156 HG3 GLU 323 HG1 GLU 323 -4.193 -14.469 -14.615 Start of MODEL 9 1 H1 GLY 304 HT1 GLY 304 -11.865 18.854 6.231 2 H2 GLY 304 HT2 GLY 304 -11.956 18.262 7.813 3 H3 GLY 304 HT3 GLY 304 -13.363 18.423 6.888 4 HA2 GLY 304 HA1 GLY 304 -12.582 16.733 5.345 5 HA3 GLY 304 HA2 GLY 304 -11.122 16.566 6.307 6 H PHE 305 HN PHE 305 -14.080 15.263 5.701 7 HA PHE 305 HA PHE 305 -14.430 14.186 8.406 8 HB2 PHE 305 HB2 PHE 305 -16.328 15.242 6.858 9 HB3 PHE 305 HB1 PHE 305 -16.408 13.588 6.262 10 HD1 PHE 305 HD1 PHE 305 -17.153 11.780 7.689 11 HD2 PHE 305 HD2 PHE 305 -16.992 15.787 9.115 12 HE1 PHE 305 HE1 PHE 305 -18.560 11.149 9.606 13 HE2 PHE 305 HE2 PHE 305 -18.396 15.162 11.037 14 HZ PHE 305 HZ PHE 305 -19.181 12.841 11.285 15 HA PRO 306 HA PRO 306 -14.094 10.165 5.748 16 HB2 PRO 306 HB2 PRO 306 -12.982 10.806 3.145 17 HB3 PRO 306 HB1 PRO 306 -14.519 10.017 3.523 18 HG2 PRO 306 HG2 PRO 306 -14.389 12.488 2.428 19 HG3 PRO 306 HG1 PRO 306 -15.702 11.979 3.510 20 HD2 PRO 306 HD2 PRO 306 -13.266 13.608 4.144 21 HD3 PRO 306 HD1 PRO 306 -14.954 13.875 4.629 22 H ARG 307 HN ARG 307 -12.342 8.722 5.489 23 HA ARG 307 HA ARG 307 -9.683 9.953 5.814 24 HB2 ARG 307 HB2 ARG 307 -10.851 7.449 7.020 25 HB3 ARG 307 HB1 ARG 307 -9.120 7.758 6.996 26 HG2 ARG 307 HG2 ARG 307 -9.469 9.808 8.286 27 HG3 ARG 307 HG1 ARG 307 -11.204 9.491 8.315 28 HD2 ARG 307 HD2 ARG 307 -10.390 8.724 10.387 29 HD3 ARG 307 HD1 ARG 307 -10.637 7.276 9.413 30 HE ARG 307 HE ARG 307 -7.972 8.207 9.160 31 HH11 ARG 307 HH11 ARG 307 -10.059 6.511 11.420 32 HH12 ARG 307 HH12 ARG 307 -8.749 5.667 12.174 33 HH21 ARG 307 HH21 ARG 307 -6.273 7.089 10.163 34 HH22 ARG 307 HH22 ARG 307 -6.607 5.994 11.462 35 H ALA 308 HN ALA 308 -7.942 9.101 4.717 36 HA ALA 308 HA ALA 308 -8.512 7.014 2.716 37 HB1 ALA 308 HB1 ALA 308 -6.887 9.513 2.248 38 HB2 ALA 308 HB2 ALA 308 -8.514 9.215 1.637 39 HB3 ALA 308 HB3 ALA 308 -7.167 8.220 1.083 40 H LEU 309 HN LEU 309 -7.014 5.456 2.491 41 HA LEU 309 HA LEU 309 -4.453 5.769 3.906 42 HB2 LEU 309 HB2 LEU 309 -6.252 3.350 3.811 43 HB3 LEU 309 HB1 LEU 309 -4.592 3.296 4.374 44 HG LEU 309 HG LEU 309 -5.453 5.201 6.011 45 HD11 LEU 309 HD11 LEU 309 -7.743 4.769 6.746 46 HD12 LEU 309 HD12 LEU 309 -7.951 3.613 5.430 47 HD13 LEU 309 HD13 LEU 309 -7.698 5.321 5.072 48 HD21 LEU 309 HD21 LEU 309 -5.980 2.256 6.386 49 HD22 LEU 309 HD22 LEU 309 -5.892 3.454 7.676 50 HD23 LEU 309 HD23 LEU 309 -4.462 3.097 6.706 51 HA PRO 310 HA PRO 310 -2.534 4.483 0.099 52 HB2 PRO 310 HB2 PRO 310 -0.408 3.019 1.440 53 HB3 PRO 310 HB1 PRO 310 -0.333 4.556 0.585 54 HG2 PRO 310 HG2 PRO 310 -0.042 4.356 3.276 55 HG3 PRO 310 HG1 PRO 310 -0.676 5.797 2.460 56 HD2 PRO 310 HD2 PRO 310 -2.157 3.648 3.912 57 HD3 PRO 310 HD1 PRO 310 -2.446 5.397 3.869 58 H ALA 311 HN ALA 311 -1.630 2.548 -1.090 59 HA ALA 311 HA ALA 311 -3.526 0.340 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.690 1.473 -2.894 61 HB2 ALA 311 HB2 ALA 311 -3.143 -0.193 -3.084 62 HB3 ALA 311 HB3 ALA 311 -1.985 1.132 -3.194 63 H TRP 312 HN TRP 312 -0.415 1.352 -0.919 64 HA TRP 312 HA TRP 312 0.984 -1.134 -1.038 65 HB2 TRP 312 HB2 TRP 312 2.910 0.326 -1.115 66 HB3 TRP 312 HB1 TRP 312 1.600 1.087 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.360 3.527 -1.702 68 HE1 TRP 312 HE1 TRP 312 1.874 5.253 0.128 69 HE3 TRP 312 HE3 TRP 312 3.220 0.395 1.913 70 HZ2 TRP 312 HZ2 TRP 312 2.906 5.298 2.739 71 HZ3 TRP 312 HZ3 TRP 312 3.940 1.376 4.047 72 HH2 TRP 312 HH2 TRP 312 3.776 3.772 4.449 73 H ALA 313 HN ALA 313 -0.656 0.555 1.134 74 HA ALA 313 HA ALA 313 0.825 0.120 3.563 75 HB1 ALA 313 HB1 ALA 313 -0.243 2.087 3.782 76 HB2 ALA 313 HB2 ALA 313 -1.657 1.105 4.198 77 HB3 ALA 313 HB3 ALA 313 -1.431 1.675 2.522 78 H ARG 314 HN ARG 314 -0.133 -2.238 2.027 79 HA ARG 314 HA ARG 314 -1.747 -3.509 4.103 80 HB2 ARG 314 HB2 ARG 314 -2.122 -3.668 1.122 81 HB3 ARG 314 HB1 ARG 314 -2.725 -4.925 2.191 82 HG2 ARG 314 HG2 ARG 314 -4.073 -3.247 3.377 83 HG3 ARG 314 HG1 ARG 314 -3.494 -2.014 2.255 84 HD2 ARG 314 HD2 ARG 314 -4.496 -3.228 0.393 85 HD3 ARG 314 HD1 ARG 314 -5.048 -4.486 1.498 86 HE ARG 314 HE ARG 314 -6.003 -1.922 2.277 87 HH11 ARG 314 HH11 ARG 314 -6.619 -4.509 -0.017 88 HH12 ARG 314 HH12 ARG 314 -8.294 -4.108 -0.195 89 HH21 ARG 314 HH21 ARG 314 -9.187 -2.359 0.965 90 HH22 ARG 314 HH22 ARG 314 -8.199 -1.417 2.030 91 HA PRO 315 HA PRO 315 2.115 -5.985 4.095 92 HB2 PRO 315 HB2 PRO 315 1.060 -7.768 5.968 93 HB3 PRO 315 HB1 PRO 315 2.075 -6.364 6.330 94 HG2 PRO 315 HG2 PRO 315 -0.885 -6.637 6.444 95 HG3 PRO 315 HG1 PRO 315 0.204 -5.695 7.483 96 HD2 PRO 315 HD2 PRO 315 -1.286 -4.489 5.640 97 HD3 PRO 315 HD1 PRO 315 0.378 -3.959 5.951 98 H ASP 316 HN ASP 316 -1.071 -7.112 3.720 99 HA ASP 316 HA ASP 316 -0.369 -9.752 2.768 100 HB2 ASP 316 HB2 ASP 316 -3.000 -8.290 3.000 101 HB3 ASP 316 HB1 ASP 316 -2.867 -9.897 2.292 102 H TYR 317 HN TYR 317 -0.186 -6.795 1.372 103 HA TYR 317 HA TYR 317 -1.023 -7.643 -1.304 104 HB2 TYR 317 HB2 TYR 317 -1.787 -5.431 -0.380 105 HB3 TYR 317 HB1 TYR 317 -0.111 -4.903 -0.382 106 HD1 TYR 317 HD1 TYR 317 0.921 -4.113 -2.365 107 HD2 TYR 317 HD2 TYR 317 -2.933 -5.904 -2.564 108 HE1 TYR 317 HE1 TYR 317 0.680 -3.321 -4.679 109 HE2 TYR 317 HE2 TYR 317 -3.185 -5.118 -4.881 110 HH TYR 317 HH TYR 317 -2.279 -3.352 -6.336 111 H ASN 318 HN ASN 318 0.448 -8.569 -2.526 112 HA ASN 318 HA ASN 318 3.288 -7.981 -2.108 113 HB2 ASN 318 HB2 ASN 318 3.672 -10.071 -3.471 114 HB3 ASN 318 HB1 ASN 318 2.870 -10.320 -1.927 115 HD21 ASN 318 HD21 ASN 318 0.697 -10.921 -1.896 116 HD22 ASN 318 HD22 ASN 318 -0.099 -11.550 -3.293 117 HA PRO 319 HA PRO 319 2.873 -5.498 -5.927 118 HB2 PRO 319 HB2 PRO 319 5.726 -4.924 -5.452 119 HB3 PRO 319 HB1 PRO 319 4.367 -3.802 -5.600 120 HG2 PRO 319 HG2 PRO 319 5.549 -4.226 -3.247 121 HG3 PRO 319 HG1 PRO 319 3.797 -3.963 -3.375 122 HD2 PRO 319 HD2 PRO 319 5.294 -6.529 -3.009 123 HD3 PRO 319 HD1 PRO 319 3.794 -5.970 -2.237 124 HA PRO 320 HA PRO 320 4.780 -8.288 -8.853 125 HB2 PRO 320 HB2 PRO 320 4.763 -6.792 -11.109 126 HB3 PRO 320 HB1 PRO 320 3.289 -7.473 -10.407 127 HG2 PRO 320 HG2 PRO 320 4.344 -4.689 -10.224 128 HG3 PRO 320 HG1 PRO 320 2.674 -5.248 -10.441 129 HD2 PRO 320 HD2 PRO 320 3.672 -4.426 -8.039 130 HD3 PRO 320 HD1 PRO 320 2.363 -5.607 -8.205 131 H LEU 321 HN LEU 321 6.823 -8.850 -8.877 132 HA LEU 321 HA LEU 321 8.881 -6.903 -9.669 133 HB2 LEU 321 HB2 LEU 321 8.911 -8.755 -7.302 134 HB3 LEU 321 HB1 LEU 321 10.406 -8.209 -8.036 135 HG LEU 321 HG LEU 321 9.270 -5.821 -7.664 136 HD11 LEU 321 HD11 LEU 321 8.084 -5.762 -5.530 137 HD12 LEU 321 HD12 LEU 321 8.121 -7.524 -5.457 138 HD13 LEU 321 HD13 LEU 321 7.204 -6.713 -6.728 139 HD21 LEU 321 HD21 LEU 321 10.689 -7.424 -5.540 140 HD22 LEU 321 HD22 LEU 321 10.536 -5.667 -5.570 141 HD23 LEU 321 HD23 LEU 321 11.449 -6.494 -6.832 142 H VAL 322 HN VAL 322 10.593 -7.702 -10.858 143 HA VAL 322 HA VAL 322 10.538 -10.544 -11.583 144 HB VAL 322 HB VAL 322 11.070 -9.847 -13.990 145 HG11 VAL 322 HG11 VAL 322 8.307 -9.383 -12.883 146 HG12 VAL 322 HG12 VAL 322 9.000 -10.930 -13.366 147 HG13 VAL 322 HG13 VAL 322 8.691 -9.685 -14.577 148 HG21 VAL 322 HG21 VAL 322 10.124 -7.718 -14.760 149 HG22 VAL 322 HG22 VAL 322 11.447 -7.455 -13.622 150 HG23 VAL 322 HG23 VAL 322 9.775 -7.265 -13.092 151 H GLU 323 HN GLU 323 12.465 -11.490 -11.665 152 HA GLU 323 HA GLU 323 14.845 -9.814 -11.305 153 HB2 GLU 323 HB2 GLU 323 14.286 -12.713 -10.692 154 HB3 GLU 323 HB1 GLU 323 15.911 -12.047 -10.659 155 HG2 GLU 323 HG2 GLU 323 15.229 -10.458 -8.936 156 HG3 GLU 323 HG1 GLU 323 13.596 -11.120 -8.972 Start of MODEL 10 1 H1 GLY 304 HT1 GLY 304 -2.167 8.274 -9.463 2 H2 GLY 304 HT2 GLY 304 -3.145 9.509 -8.846 3 H3 GLY 304 HT3 GLY 304 -3.779 8.404 -9.960 4 HA2 GLY 304 HA1 GLY 304 -4.552 7.887 -7.740 5 HA3 GLY 304 HA2 GLY 304 -3.538 6.604 -8.381 6 H PHE 305 HN PHE 305 -3.075 9.693 -6.662 7 HA PHE 305 HA PHE 305 -0.985 8.438 -5.038 8 HB2 PHE 305 HB2 PHE 305 -1.692 11.326 -5.554 9 HB3 PHE 305 HB1 PHE 305 -0.526 10.836 -4.329 10 HD1 PHE 305 HD1 PHE 305 -1.188 11.132 -7.909 11 HD2 PHE 305 HD2 PHE 305 1.633 9.937 -4.953 12 HE1 PHE 305 HE1 PHE 305 0.581 11.088 -9.619 13 HE2 PHE 305 HE2 PHE 305 3.406 9.891 -6.659 14 HZ PHE 305 HZ PHE 305 2.881 10.466 -8.995 15 HA PRO 306 HA PRO 306 -4.255 8.201 -1.832 16 HB2 PRO 306 HB2 PRO 306 -2.165 6.833 -0.273 17 HB3 PRO 306 HB1 PRO 306 -3.765 6.254 -0.752 18 HG2 PRO 306 HG2 PRO 306 -1.546 5.254 -1.855 19 HG3 PRO 306 HG1 PRO 306 -3.039 5.471 -2.790 20 HD2 PRO 306 HD2 PRO 306 -0.577 7.171 -2.751 21 HD3 PRO 306 HD1 PRO 306 -1.579 6.657 -4.126 22 H ARG 307 HN ARG 307 -4.530 9.059 0.286 23 HA ARG 307 HA ARG 307 -2.336 10.736 1.295 24 HB2 ARG 307 HB2 ARG 307 -5.166 11.609 0.734 25 HB3 ARG 307 HB1 ARG 307 -4.113 12.489 1.833 26 HG2 ARG 307 HG2 ARG 307 -2.534 12.894 0.031 27 HG3 ARG 307 HG1 ARG 307 -3.542 11.962 -1.078 28 HD2 ARG 307 HD2 ARG 307 -5.367 13.564 -0.752 29 HD3 ARG 307 HD1 ARG 307 -4.346 14.499 0.340 30 HE ARG 307 HE ARG 307 -2.941 14.285 -2.026 31 HH11 ARG 307 HH11 ARG 307 -6.017 15.668 -1.048 32 HH12 ARG 307 HH12 ARG 307 -5.989 16.890 -2.273 33 HH21 ARG 307 HH21 ARG 307 -2.924 15.896 -3.622 34 HH22 ARG 307 HH22 ARG 307 -4.238 17.018 -3.730 35 H ALA 308 HN ALA 308 -5.477 9.227 1.984 36 HA ALA 308 HA ALA 308 -4.985 9.469 4.860 37 HB1 ALA 308 HB1 ALA 308 -7.183 10.152 3.963 38 HB2 ALA 308 HB2 ALA 308 -7.297 8.876 5.172 39 HB3 ALA 308 HB3 ALA 308 -7.467 8.486 3.461 40 H LEU 309 HN LEU 309 -5.821 6.940 2.472 41 HA LEU 309 HA LEU 309 -4.478 4.975 4.200 42 HB2 LEU 309 HB2 LEU 309 -7.159 4.684 2.857 43 HB3 LEU 309 HB1 LEU 309 -6.230 3.306 3.413 44 HG LEU 309 HG LEU 309 -6.269 4.656 5.702 45 HD11 LEU 309 HD11 LEU 309 -7.446 6.591 4.813 46 HD12 LEU 309 HD12 LEU 309 -8.422 5.766 6.029 47 HD13 LEU 309 HD13 LEU 309 -8.788 5.562 4.315 48 HD21 LEU 309 HD21 LEU 309 -8.235 3.341 6.342 49 HD22 LEU 309 HD22 LEU 309 -7.096 2.394 5.387 50 HD23 LEU 309 HD23 LEU 309 -8.566 3.017 4.640 51 HA PRO 310 HA PRO 310 -2.530 4.484 0.096 52 HB2 PRO 310 HB2 PRO 310 -0.410 3.019 1.440 53 HB3 PRO 310 HB1 PRO 310 -0.331 4.564 0.598 54 HG2 PRO 310 HG2 PRO 310 -0.058 4.340 3.289 55 HG3 PRO 310 HG1 PRO 310 -0.687 5.787 2.482 56 HD2 PRO 310 HD2 PRO 310 -2.177 3.623 3.901 57 HD3 PRO 310 HD1 PRO 310 -2.464 5.376 3.881 58 H ALA 311 HN ALA 311 -1.628 2.548 -1.089 59 HA ALA 311 HA ALA 311 -3.527 0.341 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.145 -0.196 -3.083 61 HB2 ALA 311 HB2 ALA 311 -1.983 1.126 -3.195 62 HB3 ALA 311 HB3 ALA 311 -3.686 1.474 -2.896 63 H TRP 312 HN TRP 312 -0.415 1.352 -0.919 64 HA TRP 312 HA TRP 312 0.984 -1.135 -1.039 65 HB2 TRP 312 HB2 TRP 312 2.910 0.326 -1.115 66 HB3 TRP 312 HB1 TRP 312 1.601 1.087 -2.025 67 HD1 TRP 312 HD1 TRP 312 1.357 3.526 -1.703 68 HE1 TRP 312 HE1 TRP 312 1.871 5.252 0.128 69 HE3 TRP 312 HE3 TRP 312 3.223 0.397 1.913 70 HZ2 TRP 312 HZ2 TRP 312 2.904 5.297 2.740 71 HZ3 TRP 312 HZ3 TRP 312 3.941 1.376 4.047 72 HH2 TRP 312 HH2 TRP 312 3.774 3.772 4.450 73 H ALA 313 HN ALA 313 -0.654 0.555 1.135 74 HA ALA 313 HA ALA 313 0.828 0.120 3.562 75 HB1 ALA 313 HB1 ALA 313 -1.663 1.092 4.192 76 HB2 ALA 313 HB2 ALA 313 -1.426 1.675 2.523 77 HB3 ALA 313 HB3 ALA 313 -0.245 2.078 3.797 78 H ARG 314 HN ARG 314 -0.081 -2.246 2.047 79 HA ARG 314 HA ARG 314 -1.717 -3.528 4.096 80 HB2 ARG 314 HB2 ARG 314 -2.031 -3.701 1.108 81 HB3 ARG 314 HB1 ARG 314 -2.635 -4.967 2.170 82 HG2 ARG 314 HG2 ARG 314 -4.047 -3.324 3.314 83 HG3 ARG 314 HG1 ARG 314 -3.451 -2.068 2.227 84 HD2 ARG 314 HD2 ARG 314 -4.363 -3.290 0.315 85 HD3 ARG 314 HD1 ARG 314 -4.956 -4.547 1.401 86 HE ARG 314 HE ARG 314 -5.971 -2.041 2.199 87 HH11 ARG 314 HH11 ARG 314 -6.395 -4.422 -0.347 88 HH12 ARG 314 HH12 ARG 314 -8.044 -3.982 -0.641 89 HH21 ARG 314 HH21 ARG 314 -9.025 -2.318 0.570 90 HH22 ARG 314 HH22 ARG 314 -8.131 -1.481 1.797 91 HA PRO 315 HA PRO 315 2.171 -5.952 4.182 92 HB2 PRO 315 HB2 PRO 315 1.082 -7.768 6.008 93 HB3 PRO 315 HB1 PRO 315 2.071 -6.358 6.411 94 HG2 PRO 315 HG2 PRO 315 -0.887 -6.661 6.444 95 HG3 PRO 315 HG1 PRO 315 0.163 -5.709 7.512 96 HD2 PRO 315 HD2 PRO 315 -1.295 -4.518 5.632 97 HD3 PRO 315 HD1 PRO 315 0.349 -3.963 5.993 98 H ASP 316 HN ASP 316 -0.984 -7.124 3.693 99 HA ASP 316 HA ASP 316 -0.188 -9.735 2.714 100 HB2 ASP 316 HB2 ASP 316 -2.870 -8.365 2.937 101 HB3 ASP 316 HB1 ASP 316 -2.670 -9.955 2.207 102 H TYR 317 HN TYR 317 -0.298 -6.678 1.398 103 HA TYR 317 HA TYR 317 -0.871 -7.598 -1.326 104 HB2 TYR 317 HB2 TYR 317 -2.090 -5.592 -0.399 105 HB3 TYR 317 HB1 TYR 317 -0.546 -4.754 -0.332 106 HD1 TYR 317 HD1 TYR 317 -3.037 -6.250 -2.635 107 HD2 TYR 317 HD2 TYR 317 0.377 -3.739 -2.259 108 HE1 TYR 317 HE1 TYR 317 -3.352 -5.485 -4.950 109 HE2 TYR 317 HE2 TYR 317 0.072 -2.966 -4.571 110 HH TYR 317 HH TYR 317 -0.987 -3.757 -6.653 111 H ASN 318 HN ASN 318 0.793 -8.127 -2.536 112 HA ASN 318 HA ASN 318 3.356 -6.723 -2.193 113 HB2 ASN 318 HB2 ASN 318 3.176 -9.184 -1.333 114 HB3 ASN 318 HB1 ASN 318 3.255 -9.601 -3.042 115 HD21 ASN 318 HD21 ASN 318 4.962 -8.256 -0.332 116 HD22 ASN 318 HD22 ASN 318 6.539 -8.313 -1.037 117 HA PRO 319 HA PRO 319 2.304 -6.005 -6.597 118 HB2 PRO 319 HB2 PRO 319 4.598 -4.173 -6.551 119 HB3 PRO 319 HB1 PRO 319 2.902 -3.829 -6.911 120 HG2 PRO 319 HG2 PRO 319 4.055 -2.960 -4.655 121 HG3 PRO 319 HG1 PRO 319 2.353 -3.457 -4.713 122 HD2 PRO 319 HD2 PRO 319 4.722 -4.971 -3.688 123 HD3 PRO 319 HD1 PRO 319 3.090 -4.822 -3.003 124 HA PRO 320 HA PRO 320 5.430 -8.491 -8.619 125 HB2 PRO 320 HB2 PRO 320 5.114 -7.034 -11.138 126 HB3 PRO 320 HB1 PRO 320 4.652 -8.694 -10.748 127 HG2 PRO 320 HG2 PRO 320 2.822 -6.766 -11.164 128 HG3 PRO 320 HG1 PRO 320 2.561 -8.106 -10.028 129 HD2 PRO 320 HD2 PRO 320 3.351 -5.278 -9.453 130 HD3 PRO 320 HD1 PRO 320 2.210 -6.330 -8.602 131 H LEU 321 HN LEU 321 7.430 -8.114 -7.958 132 HA LEU 321 HA LEU 321 8.916 -5.849 -9.124 133 HB2 LEU 321 HB2 LEU 321 9.207 -7.125 -6.406 134 HB3 LEU 321 HB1 LEU 321 10.382 -6.013 -7.079 135 HG LEU 321 HG LEU 321 7.532 -5.134 -6.855 136 HD11 LEU 321 HD11 LEU 321 8.008 -6.093 -4.674 137 HD12 LEU 321 HD12 LEU 321 7.960 -4.334 -4.579 138 HD13 LEU 321 HD13 LEU 321 9.509 -5.174 -4.581 139 HD21 LEU 321 HD21 LEU 321 9.149 -3.705 -8.002 140 HD22 LEU 321 HD22 LEU 321 10.182 -3.713 -6.573 141 HD23 LEU 321 HD23 LEU 321 8.592 -2.955 -6.508 142 H VAL 322 HN VAL 322 10.796 -6.264 -10.135 143 HA VAL 322 HA VAL 322 11.721 -9.059 -10.185 144 HB VAL 322 HB VAL 322 12.752 -8.441 -12.445 145 HG11 VAL 322 HG11 VAL 322 9.752 -8.554 -12.169 146 HG12 VAL 322 HG12 VAL 322 10.855 -9.929 -12.225 147 HG13 VAL 322 HG13 VAL 322 10.660 -8.897 -13.642 148 HG21 VAL 322 HG21 VAL 322 11.646 -6.659 -13.718 149 HG22 VAL 322 HG22 VAL 322 12.508 -6.007 -12.325 150 HG23 VAL 322 HG23 VAL 322 10.754 -6.176 -12.276 151 H GLU 323 HN GLU 323 13.580 -9.423 -9.236 152 HA GLU 323 HA GLU 323 15.657 -7.336 -9.274 153 HB2 GLU 323 HB2 GLU 323 14.347 -7.842 -7.027 154 HB3 GLU 323 HB1 GLU 323 15.458 -9.201 -6.945 155 HG2 GLU 323 HG2 GLU 323 17.353 -7.662 -7.056 156 HG3 GLU 323 HG1 GLU 323 16.238 -6.298 -7.144 Start of MODEL 11 1 H1 GLY 304 HT1 GLY 304 -18.368 8.387 2.195 2 H2 GLY 304 HT2 GLY 304 -17.111 8.460 1.065 3 H3 GLY 304 HT3 GLY 304 -18.636 9.079 0.674 4 HA2 GLY 304 HA1 GLY 304 -17.112 10.874 1.173 5 HA3 GLY 304 HA2 GLY 304 -18.417 10.798 2.348 6 H PHE 305 HN PHE 305 -15.079 9.754 1.777 7 HA PHE 305 HA PHE 305 -14.614 9.816 4.684 8 HB2 PHE 305 HB2 PHE 305 -13.249 8.221 2.516 9 HB3 PHE 305 HB1 PHE 305 -12.612 8.359 4.151 10 HD1 PHE 305 HD1 PHE 305 -13.711 7.265 6.011 11 HD2 PHE 305 HD2 PHE 305 -15.231 6.922 2.050 12 HE1 PHE 305 HE1 PHE 305 -15.122 5.378 6.721 13 HE2 PHE 305 HE2 PHE 305 -16.644 5.035 2.753 14 HZ PHE 305 HZ PHE 305 -16.592 4.261 5.090 15 HA PRO 306 HA PRO 306 -12.190 13.530 3.613 16 HB2 PRO 306 HB2 PRO 306 -11.390 13.402 6.457 17 HB3 PRO 306 HB1 PRO 306 -12.156 14.722 5.565 18 HG2 PRO 306 HG2 PRO 306 -13.533 13.312 7.349 19 HG3 PRO 306 HG1 PRO 306 -14.282 13.878 5.843 20 HD2 PRO 306 HD2 PRO 306 -13.288 11.144 6.541 21 HD3 PRO 306 HD1 PRO 306 -14.757 11.628 5.669 22 H ARG 307 HN ARG 307 -10.932 10.837 5.549 23 HA ARG 307 HA ARG 307 -8.214 11.421 4.584 24 HB2 ARG 307 HB2 ARG 307 -9.219 9.908 6.986 25 HB3 ARG 307 HB1 ARG 307 -7.566 9.741 6.414 26 HG2 ARG 307 HG2 ARG 307 -7.260 12.177 6.700 27 HG3 ARG 307 HG1 ARG 307 -8.891 12.272 7.368 28 HD2 ARG 307 HD2 ARG 307 -8.250 10.759 9.171 29 HD3 ARG 307 HD1 ARG 307 -6.628 10.623 8.493 30 HE ARG 307 HE ARG 307 -7.365 13.331 9.050 31 HH11 ARG 307 HH11 ARG 307 -6.097 10.412 10.537 32 HH12 ARG 307 HH12 ARG 307 -5.302 11.271 11.814 33 HH21 ARG 307 HH21 ARG 307 -6.315 14.434 10.730 34 HH22 ARG 307 HH22 ARG 307 -5.425 13.546 11.921 35 H ALA 308 HN ALA 308 -6.987 9.852 3.589 36 HA ALA 308 HA ALA 308 -8.358 7.352 2.848 37 HB1 ALA 308 HB1 ALA 308 -8.428 8.920 0.966 38 HB2 ALA 308 HB2 ALA 308 -7.420 7.518 0.603 39 HB3 ALA 308 HB3 ALA 308 -6.671 9.060 1.020 40 H LEU 309 HN LEU 309 -7.133 5.518 2.803 41 HA LEU 309 HA LEU 309 -4.442 5.734 3.929 42 HB2 LEU 309 HB2 LEU 309 -6.350 3.408 3.721 43 HB3 LEU 309 HB1 LEU 309 -4.712 3.260 4.324 44 HG LEU 309 HG LEU 309 -5.524 5.155 5.994 45 HD11 LEU 309 HD11 LEU 309 -8.080 3.713 5.293 46 HD12 LEU 309 HD12 LEU 309 -7.734 5.419 5.006 47 HD13 LEU 309 HD13 LEU 309 -7.855 4.808 6.656 48 HD21 LEU 309 HD21 LEU 309 -6.197 2.227 6.257 49 HD22 LEU 309 HD22 LEU 309 -6.105 3.378 7.590 50 HD23 LEU 309 HD23 LEU 309 -4.659 2.992 6.658 51 HA PRO 310 HA PRO 310 -2.540 4.486 0.096 52 HB2 PRO 310 HB2 PRO 310 -0.407 3.026 1.432 53 HB3 PRO 310 HB1 PRO 310 -0.339 4.571 0.588 54 HG2 PRO 310 HG2 PRO 310 -0.050 4.353 3.277 55 HG3 PRO 310 HG1 PRO 310 -0.695 5.797 2.473 56 HD2 PRO 310 HD2 PRO 310 -2.161 3.617 3.896 57 HD3 PRO 310 HD1 PRO 310 -2.457 5.365 3.886 58 H ALA 311 HN ALA 311 -1.627 2.549 -1.091 59 HA ALA 311 HA ALA 311 -3.527 0.344 -0.730 60 HB1 ALA 311 HB1 ALA 311 -3.685 1.476 -2.898 61 HB2 ALA 311 HB2 ALA 311 -3.143 -0.192 -3.086 62 HB3 ALA 311 HB3 ALA 311 -1.981 1.131 -3.196 63 H TRP 312 HN TRP 312 -0.415 1.353 -0.919 64 HA TRP 312 HA TRP 312 0.984 -1.134 -1.036 65 HB2 TRP 312 HB2 TRP 312 2.910 0.324 -1.110 66 HB3 TRP 312 HB1 TRP 312 1.603 1.086 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.353 3.525 -1.698 68 HE1 TRP 312 HE1 TRP 312 1.868 5.251 0.130 69 HE3 TRP 312 HE3 TRP 312 3.228 0.396 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.906 5.297 2.740 71 HZ3 TRP 312 HZ3 TRP 312 3.949 1.377 4.044 72 HH2 TRP 312 HH2 TRP 312 3.782 3.773 4.449 73 H ALA 313 HN ALA 313 -0.657 0.556 1.134 74 HA ALA 313 HA ALA 313 0.822 0.115 3.564 75 HB1 ALA 313 HB1 ALA 313 -1.653 1.111 4.199 76 HB2 ALA 313 HB2 ALA 313 -1.426 1.681 2.523 77 HB3 ALA 313 HB3 ALA 313 -0.233 2.085 3.784 78 H ARG 314 HN ARG 314 -0.126 -2.242 2.039 79 HA ARG 314 HA ARG 314 -1.767 -3.501 4.099 80 HB2 ARG 314 HB2 ARG 314 -2.097 -3.695 1.110 81 HB3 ARG 314 HB1 ARG 314 -2.738 -4.920 2.193 82 HG2 ARG 314 HG2 ARG 314 -3.442 -2.052 2.636 83 HG3 ARG 314 HG1 ARG 314 -4.254 -2.967 1.365 84 HD2 ARG 314 HD2 ARG 314 -4.957 -4.634 3.011 85 HD3 ARG 314 HD1 ARG 314 -4.128 -3.736 4.282 86 HE ARG 314 HE ARG 314 -5.985 -2.063 2.964 87 HH11 ARG 314 HH11 ARG 314 -5.903 -4.726 5.255 88 HH12 ARG 314 HH12 ARG 314 -7.396 -4.274 6.008 89 HH21 ARG 314 HH21 ARG 314 -8.545 -2.445 5.280 90 HH22 ARG 314 HH22 ARG 314 -7.936 -1.489 3.968 91 HA PRO 315 HA PRO 315 2.088 -5.983 4.151 92 HB2 PRO 315 HB2 PRO 315 1.007 -7.761 6.014 93 HB3 PRO 315 HB1 PRO 315 2.017 -6.357 6.386 94 HG2 PRO 315 HG2 PRO 315 -0.944 -6.625 6.463 95 HG3 PRO 315 HG1 PRO 315 0.132 -5.679 7.512 96 HD2 PRO 315 HD2 PRO 315 -1.333 -4.480 5.644 97 HD3 PRO 315 HD1 PRO 315 0.326 -3.948 5.977 98 H ASP 316 HN ASP 316 -1.094 -7.109 3.738 99 HA ASP 316 HA ASP 316 -0.383 -9.751 2.802 100 HB2 ASP 316 HB2 ASP 316 -3.013 -8.282 2.990 101 HB3 ASP 316 HB1 ASP 316 -2.873 -9.891 2.287 102 H TYR 317 HN TYR 317 -0.283 -6.756 1.405 103 HA TYR 317 HA TYR 317 -1.010 -7.652 -1.285 104 HB2 TYR 317 HB2 TYR 317 -1.899 -5.476 -0.390 105 HB3 TYR 317 HB1 TYR 317 -0.250 -4.870 -0.353 106 HD1 TYR 317 HD1 TYR 317 -2.973 -6.001 -2.595 107 HD2 TYR 317 HD2 TYR 317 0.799 -4.051 -2.319 108 HE1 TYR 317 HE1 TYR 317 -3.203 -5.236 -4.921 109 HE2 TYR 317 HE2 TYR 317 0.580 -3.281 -4.642 110 HH TYR 317 HH TYR 317 -2.339 -3.446 -6.367 111 H ASN 318 HN ASN 318 0.527 -8.505 -2.474 112 HA ASN 318 HA ASN 318 3.294 -7.532 -2.201 113 HB2 ASN 318 HB2 ASN 318 2.687 -9.952 -1.422 114 HB3 ASN 318 HB1 ASN 318 2.659 -10.310 -3.146 115 HD21 ASN 318 HD21 ASN 318 4.628 -9.408 -0.433 116 HD22 ASN 318 HD22 ASN 318 6.156 -9.719 -1.176 117 HA PRO 319 HA PRO 319 2.532 -6.351 -6.537 118 HB2 PRO 319 HB2 PRO 319 5.437 -5.792 -6.554 119 HB3 PRO 319 HB1 PRO 319 4.083 -4.714 -6.924 120 HG2 PRO 319 HG2 PRO 319 5.474 -4.424 -4.675 121 HG3 PRO 319 HG1 PRO 319 3.717 -4.168 -4.714 122 HD2 PRO 319 HD2 PRO 319 5.254 -6.526 -3.702 123 HD3 PRO 319 HD1 PRO 319 3.825 -5.724 -3.018 124 HA PRO 320 HA PRO 320 4.011 -10.083 -8.553 125 HB2 PRO 320 HB2 PRO 320 3.250 -9.546 -11.098 126 HB3 PRO 320 HB1 PRO 320 2.095 -9.988 -9.832 127 HG2 PRO 320 HG2 PRO 320 2.749 -7.287 -10.918 128 HG3 PRO 320 HG1 PRO 320 1.171 -7.971 -10.477 129 HD2 PRO 320 HD2 PRO 320 2.554 -6.265 -8.869 130 HD3 PRO 320 HD1 PRO 320 1.438 -7.497 -8.256 131 H LEU 321 HN LEU 321 5.393 -10.761 -10.373 132 HA LEU 321 HA LEU 321 7.369 -10.825 -11.484 133 HB2 LEU 321 HB2 LEU 321 6.826 -7.881 -11.891 134 HB3 LEU 321 HB1 LEU 321 8.133 -8.752 -12.668 135 HG LEU 321 HG LEU 321 5.335 -9.745 -13.027 136 HD11 LEU 321 HD11 LEU 321 6.545 -7.424 -14.522 137 HD12 LEU 321 HD12 LEU 321 5.150 -7.359 -13.446 138 HD13 LEU 321 HD13 LEU 321 5.056 -8.262 -14.957 139 HD21 LEU 321 HD21 LEU 321 6.219 -10.406 -15.212 140 HD22 LEU 321 HD22 LEU 321 7.202 -11.055 -13.901 141 HD23 LEU 321 HD23 LEU 321 7.766 -9.657 -14.817 142 H VAL 322 HN VAL 322 9.284 -11.161 -10.640 143 HA VAL 322 HA VAL 322 10.580 -9.087 -9.040 144 HB VAL 322 HB VAL 322 11.345 -10.882 -7.385 145 HG11 VAL 322 HG11 VAL 322 9.827 -9.090 -6.785 146 HG12 VAL 322 HG12 VAL 322 9.359 -10.590 -5.982 147 HG13 VAL 322 HG13 VAL 322 8.457 -10.023 -7.388 148 HG21 VAL 322 HG21 VAL 322 8.919 -12.327 -8.468 149 HG22 VAL 322 HG22 VAL 322 9.802 -12.761 -7.005 150 HG23 VAL 322 HG23 VAL 322 10.591 -12.875 -8.578 151 H GLU 323 HN GLU 323 12.549 -8.761 -9.769 152 HA GLU 323 HA GLU 323 13.987 -10.984 -11.063 153 HB2 GLU 323 HB2 GLU 323 13.215 -8.810 -12.371 154 HB3 GLU 323 HB1 GLU 323 14.671 -8.134 -11.655 155 HG2 GLU 323 HG2 GLU 323 16.008 -9.889 -12.692 156 HG3 GLU 323 HG1 GLU 323 14.551 -10.594 -13.391 Start of MODEL 12 1 H1 GLY 304 HT1 GLY 304 -9.124 13.507 13.732 2 H2 GLY 304 HT2 GLY 304 -10.425 14.388 14.356 3 H3 GLY 304 HT3 GLY 304 -10.669 13.318 13.070 4 HA2 GLY 304 HA1 GLY 304 -9.869 12.564 15.829 5 HA3 GLY 304 HA2 GLY 304 -11.475 12.369 15.143 6 H PHE 305 HN PHE 305 -11.115 11.325 12.729 7 HA PHE 305 HA PHE 305 -9.534 8.879 13.164 8 HB2 PHE 305 HB2 PHE 305 -12.287 9.175 11.954 9 HB3 PHE 305 HB1 PHE 305 -11.317 7.716 11.782 10 HD1 PHE 305 HD1 PHE 305 -10.936 6.244 13.666 11 HD2 PHE 305 HD2 PHE 305 -13.278 9.774 14.075 12 HE1 PHE 305 HE1 PHE 305 -11.805 5.414 15.812 13 HE2 PHE 305 HE2 PHE 305 -14.152 8.949 16.222 14 HZ PHE 305 HZ PHE 305 -13.415 6.767 17.094 15 HA PRO 306 HA PRO 306 -7.679 9.671 9.171 16 HB2 PRO 306 HB2 PRO 306 -7.623 6.847 8.437 17 HB3 PRO 306 HB1 PRO 306 -6.279 7.900 8.892 18 HG2 PRO 306 HG2 PRO 306 -7.112 5.882 10.473 19 HG3 PRO 306 HG1 PRO 306 -6.438 7.391 11.123 20 HD2 PRO 306 HD2 PRO 306 -9.307 6.560 10.884 21 HD3 PRO 306 HD1 PRO 306 -8.468 7.347 12.236 22 H ARG 307 HN ARG 307 -7.984 9.653 6.900 23 HA ARG 307 HA ARG 307 -10.595 8.634 5.991 24 HB2 ARG 307 HB2 ARG 307 -9.321 11.313 5.459 25 HB3 ARG 307 HB1 ARG 307 -10.599 10.669 4.439 26 HG2 ARG 307 HG2 ARG 307 -12.095 10.574 6.369 27 HG3 ARG 307 HG1 ARG 307 -10.813 11.225 7.391 28 HD2 ARG 307 HD2 ARG 307 -10.767 13.261 6.034 29 HD3 ARG 307 HD1 ARG 307 -12.048 12.608 5.010 30 HE ARG 307 HE ARG 307 -12.917 12.601 7.681 31 HH11 ARG 307 HH11 ARG 307 -12.223 14.909 5.125 32 HH12 ARG 307 HH12 ARG 307 -13.341 16.087 5.727 33 HH21 ARG 307 HH21 ARG 307 -14.375 14.158 8.451 34 HH22 ARG 307 HH22 ARG 307 -14.557 15.661 7.609 35 H ALA 308 HN ALA 308 -7.321 9.597 5.022 36 HA ALA 308 HA ALA 308 -7.596 8.047 2.542 37 HB1 ALA 308 HB1 ALA 308 -5.465 10.029 3.332 38 HB2 ALA 308 HB2 ALA 308 -6.848 10.363 2.291 39 HB3 ALA 308 HB3 ALA 308 -5.607 9.223 1.769 40 H LEU 309 HN LEU 309 -6.621 6.157 2.299 41 HA LEU 309 HA LEU 309 -4.403 5.430 4.086 42 HB2 LEU 309 HB2 LEU 309 -6.769 4.423 4.584 43 HB3 LEU 309 HB1 LEU 309 -6.418 3.391 3.212 44 HG LEU 309 HG LEU 309 -4.387 3.530 5.392 45 HD11 LEU 309 HD11 LEU 309 -6.969 1.988 5.595 46 HD12 LEU 309 HD12 LEU 309 -6.466 3.323 6.631 47 HD13 LEU 309 HD13 LEU 309 -5.576 1.801 6.658 48 HD21 LEU 309 HD21 LEU 309 -3.961 2.212 3.380 49 HD22 LEU 309 HD22 LEU 309 -5.445 1.297 3.659 50 HD23 LEU 309 HD23 LEU 309 -4.106 1.173 4.799 51 HA PRO 310 HA PRO 310 -2.540 4.478 0.097 52 HB2 PRO 310 HB2 PRO 310 -0.410 3.018 1.444 53 HB3 PRO 310 HB1 PRO 310 -0.333 4.544 0.567 54 HG2 PRO 310 HG2 PRO 310 -0.033 4.384 3.255 55 HG3 PRO 310 HG1 PRO 310 -0.679 5.811 2.423 56 HD2 PRO 310 HD2 PRO 310 -2.137 3.679 3.917 57 HD3 PRO 310 HD1 PRO 310 -2.436 5.426 3.847 58 H ALA 311 HN ALA 311 -1.634 2.546 -1.094 59 HA ALA 311 HA ALA 311 -3.527 0.337 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.144 -0.199 -3.084 61 HB2 ALA 311 HB2 ALA 311 -1.990 1.129 -3.195 62 HB3 ALA 311 HB3 ALA 311 -3.694 1.465 -2.894 63 H TRP 312 HN TRP 312 -0.417 1.353 -0.920 64 HA TRP 312 HA TRP 312 0.984 -1.133 -1.037 65 HB2 TRP 312 HB2 TRP 312 2.908 0.327 -1.117 66 HB3 TRP 312 HB1 TRP 312 1.599 1.091 -2.024 67 HD1 TRP 312 HD1 TRP 312 1.364 3.531 -1.703 68 HE1 TRP 312 HE1 TRP 312 1.881 5.256 0.128 69 HE3 TRP 312 HE3 TRP 312 3.220 0.396 1.913 70 HZ2 TRP 312 HZ2 TRP 312 2.911 5.298 2.740 71 HZ3 TRP 312 HZ3 TRP 312 3.940 1.375 4.046 72 HH2 TRP 312 HH2 TRP 312 3.779 3.770 4.450 73 H ALA 313 HN ALA 313 -0.652 0.569 1.133 74 HA ALA 313 HA ALA 313 0.825 0.137 3.564 75 HB1 ALA 313 HB1 ALA 313 -1.653 1.119 4.201 76 HB2 ALA 313 HB2 ALA 313 -1.443 1.679 2.522 77 HB3 ALA 313 HB3 ALA 313 -0.244 2.105 3.769 78 H ARG 314 HN ARG 314 -0.049 -2.243 2.080 79 HA ARG 314 HA ARG 314 -1.718 -3.507 4.112 80 HB2 ARG 314 HB2 ARG 314 -1.975 -3.720 1.120 81 HB3 ARG 314 HB1 ARG 314 -2.588 -4.977 2.185 82 HG2 ARG 314 HG2 ARG 314 -4.015 -3.303 3.295 83 HG3 ARG 314 HG1 ARG 314 -3.434 -2.086 2.158 84 HD2 ARG 314 HD2 ARG 314 -4.334 -3.390 0.298 85 HD3 ARG 314 HD1 ARG 314 -4.901 -4.618 1.427 86 HE ARG 314 HE ARG 314 -5.938 -2.052 2.080 87 HH11 ARG 314 HH11 ARG 314 -6.406 -4.719 -0.157 88 HH12 ARG 314 HH12 ARG 314 -8.082 -4.358 -0.416 89 HH21 ARG 314 HH21 ARG 314 -9.055 -2.593 0.651 90 HH22 ARG 314 HH22 ARG 314 -8.131 -1.599 1.727 91 HA PRO 315 HA PRO 315 2.179 -5.910 4.302 92 HB2 PRO 315 HB2 PRO 315 1.068 -7.709 6.131 93 HB3 PRO 315 HB1 PRO 315 2.040 -6.286 6.533 94 HG2 PRO 315 HG2 PRO 315 -0.915 -6.608 6.516 95 HG3 PRO 315 HG1 PRO 315 0.109 -5.636 7.591 96 HD2 PRO 315 HD2 PRO 315 -1.322 -4.480 5.669 97 HD3 PRO 315 HD1 PRO 315 0.311 -3.908 6.054 98 H ASP 316 HN ASP 316 -0.961 -7.107 3.780 99 HA ASP 316 HA ASP 316 -0.141 -9.725 2.847 100 HB2 ASP 316 HB2 ASP 316 -2.830 -8.360 3.002 101 HB3 ASP 316 HB1 ASP 316 -2.613 -9.960 2.303 102 H TYR 317 HN TYR 317 -0.115 -6.721 1.489 103 HA TYR 317 HA TYR 317 -0.623 -7.691 -1.240 104 HB2 TYR 317 HB2 TYR 317 -1.979 -5.733 -0.405 105 HB3 TYR 317 HB1 TYR 317 -0.483 -4.817 -0.290 106 HD1 TYR 317 HD1 TYR 317 0.524 -3.856 -2.223 107 HD2 TYR 317 HD2 TYR 317 -2.846 -6.420 -2.640 108 HE1 TYR 317 HE1 TYR 317 0.286 -3.149 -4.564 109 HE2 TYR 317 HE2 TYR 317 -3.094 -5.722 -4.984 110 HH TYR 317 HH TYR 317 -0.694 -3.998 -6.654 111 H ASN 318 HN ASN 318 1.083 -8.046 -2.464 112 HA ASN 318 HA ASN 318 3.696 -7.003 -1.673 113 HB2 ASN 318 HB2 ASN 318 3.122 -9.507 -2.225 114 HB3 ASN 318 HB1 ASN 318 3.297 -8.980 -3.894 115 HD21 ASN 318 HD21 ASN 318 4.917 -9.522 -0.871 116 HD22 ASN 318 HD22 ASN 318 6.529 -9.443 -1.487 117 HA PRO 319 HA PRO 319 3.628 -4.024 -5.040 118 HB2 PRO 319 HB2 PRO 319 6.556 -4.141 -5.174 119 HB3 PRO 319 HB1 PRO 319 5.514 -2.794 -4.700 120 HG2 PRO 319 HG2 PRO 319 7.031 -4.084 -2.908 121 HG3 PRO 319 HG1 PRO 319 5.430 -3.439 -2.495 122 HD2 PRO 319 HD2 PRO 319 6.217 -6.257 -3.131 123 HD3 PRO 319 HD1 PRO 319 5.142 -5.642 -1.858 124 HA PRO 320 HA PRO 320 4.292 -6.704 -8.632 125 HB2 PRO 320 HB2 PRO 320 3.327 -4.615 -10.380 126 HB3 PRO 320 HB1 PRO 320 2.504 -6.099 -9.888 127 HG2 PRO 320 HG2 PRO 320 1.691 -3.608 -9.126 128 HG3 PRO 320 HG1 PRO 320 1.378 -5.083 -8.191 129 HD2 PRO 320 HD2 PRO 320 3.469 -2.990 -7.763 130 HD3 PRO 320 HD1 PRO 320 2.476 -3.862 -6.581 131 H LEU 321 HN LEU 321 6.377 -6.932 -9.102 132 HA LEU 321 HA LEU 321 7.929 -4.683 -10.157 133 HB2 LEU 321 HB2 LEU 321 8.723 -7.417 -9.171 134 HB3 LEU 321 HB1 LEU 321 9.849 -6.336 -9.969 135 HG LEU 321 HG LEU 321 8.950 -4.687 -8.040 136 HD11 LEU 321 HD11 LEU 321 8.770 -5.921 -5.943 137 HD12 LEU 321 HD12 LEU 321 8.850 -7.445 -6.827 138 HD13 LEU 321 HD13 LEU 321 7.476 -6.362 -7.056 139 HD21 LEU 321 HD21 LEU 321 10.982 -5.271 -6.796 140 HD22 LEU 321 HD22 LEU 321 11.278 -5.163 -8.532 141 HD23 LEU 321 HD23 LEU 321 11.139 -6.741 -7.758 142 H VAL 322 HN VAL 322 8.941 -4.707 -12.143 143 HA VAL 322 HA VAL 322 8.407 -6.949 -13.948 144 HB VAL 322 HB VAL 322 7.863 -5.264 -15.797 145 HG11 VAL 322 HG11 VAL 322 5.880 -5.709 -13.573 146 HG12 VAL 322 HG12 VAL 322 6.227 -6.808 -14.906 147 HG13 VAL 322 HG13 VAL 322 5.478 -5.244 -15.226 148 HG21 VAL 322 HG21 VAL 322 7.221 -3.497 -13.428 149 HG22 VAL 322 HG22 VAL 322 6.763 -3.178 -15.100 150 HG23 VAL 322 HG23 VAL 322 8.466 -3.197 -14.641 151 H GLU 323 HN GLU 323 10.029 -7.427 -15.295 152 HA GLU 323 HA GLU 323 12.234 -5.498 -15.585 153 HB2 GLU 323 HB2 GLU 323 12.412 -8.440 -14.935 154 HB3 GLU 323 HB1 GLU 323 13.772 -7.537 -15.584 155 HG2 GLU 323 HG2 GLU 323 12.361 -6.643 -13.096 156 HG3 GLU 323 HG1 GLU 323 13.619 -7.876 -13.045 Start of MODEL 13 1 H1 GLY 304 HT1 GLY 304 -5.359 14.239 -9.362 2 H2 GLY 304 HT2 GLY 304 -6.666 14.505 -10.403 3 H3 GLY 304 HT3 GLY 304 -5.409 13.476 -10.872 4 HA2 GLY 304 HA1 GLY 304 -7.333 12.189 -10.208 5 HA3 GLY 304 HA2 GLY 304 -5.975 11.915 -9.128 6 H PHE 305 HN PHE 305 -7.168 11.311 -7.363 7 HA PHE 305 HA PHE 305 -8.748 13.446 -6.101 8 HB2 PHE 305 HB2 PHE 305 -9.385 10.495 -6.230 9 HB3 PHE 305 HB1 PHE 305 -10.156 11.592 -5.090 10 HD1 PHE 305 HD1 PHE 305 -9.886 10.591 -8.592 11 HD2 PHE 305 HD2 PHE 305 -11.756 13.245 -5.842 12 HE1 PHE 305 HE1 PHE 305 -11.557 11.177 -10.300 13 HE2 PHE 305 HE2 PHE 305 -13.431 13.835 -7.545 14 HZ PHE 305 HZ PHE 305 -13.333 12.800 -9.777 15 HA PRO 306 HA PRO 306 -6.164 12.732 -2.519 16 HB2 PRO 306 HB2 PRO 306 -8.331 13.213 -0.631 17 HB3 PRO 306 HB1 PRO 306 -6.956 14.252 -1.026 18 HG2 PRO 306 HG2 PRO 306 -9.486 14.901 -1.701 19 HG3 PRO 306 HG1 PRO 306 -8.080 15.369 -2.679 20 HD2 PRO 306 HD2 PRO 306 -10.006 13.115 -3.108 21 HD3 PRO 306 HD1 PRO 306 -9.332 14.263 -4.283 22 H ARG 307 HN ARG 307 -5.592 11.215 -0.996 23 HA ARG 307 HA ARG 307 -7.515 9.061 -0.422 24 HB2 ARG 307 HB2 ARG 307 -4.660 8.807 -1.354 25 HB3 ARG 307 HB1 ARG 307 -5.485 7.501 -0.516 26 HG2 ARG 307 HG2 ARG 307 -7.195 7.472 -2.278 27 HG3 ARG 307 HG1 ARG 307 -6.322 8.748 -3.127 28 HD2 ARG 307 HD2 ARG 307 -4.379 7.287 -3.336 29 HD3 ARG 307 HD1 ARG 307 -5.234 6.014 -2.465 30 HE ARG 307 HE ARG 307 -6.702 6.862 -4.745 31 HH11 ARG 307 HH11 ARG 307 -3.945 4.883 -3.839 32 HH12 ARG 307 HH12 ARG 307 -4.076 3.861 -5.231 33 HH21 ARG 307 HH21 ARG 307 -6.854 5.511 -6.559 34 HH22 ARG 307 HH22 ARG 307 -5.722 4.217 -6.768 35 H ALA 308 HN ALA 308 -7.376 8.103 1.584 36 HA ALA 308 HA ALA 308 -5.780 9.568 3.566 37 HB1 ALA 308 HB1 ALA 308 -7.364 8.749 5.223 38 HB2 ALA 308 HB2 ALA 308 -8.192 7.805 3.984 39 HB3 ALA 308 HB3 ALA 308 -8.205 9.567 3.906 40 H LEU 309 HN LEU 309 -6.636 6.274 2.555 41 HA LEU 309 HA LEU 309 -4.395 5.240 4.160 42 HB2 LEU 309 HB2 LEU 309 -6.918 3.876 3.226 43 HB3 LEU 309 HB1 LEU 309 -5.571 3.026 3.956 44 HG LEU 309 HG LEU 309 -6.813 5.285 5.466 45 HD11 LEU 309 HD11 LEU 309 -8.455 3.747 6.433 46 HD12 LEU 309 HD12 LEU 309 -7.971 2.507 5.275 47 HD13 LEU 309 HD13 LEU 309 -8.729 3.997 4.710 48 HD21 LEU 309 HD21 LEU 309 -6.197 3.889 7.379 49 HD22 LEU 309 HD22 LEU 309 -4.807 4.198 6.339 50 HD23 LEU 309 HD23 LEU 309 -5.619 2.634 6.282 51 HA PRO 310 HA PRO 310 -2.553 4.477 0.102 52 HB2 PRO 310 HB2 PRO 310 -0.411 3.024 1.449 53 HB3 PRO 310 HB1 PRO 310 -0.340 4.539 0.553 54 HG2 PRO 310 HG2 PRO 310 -0.026 4.415 3.241 55 HG3 PRO 310 HG1 PRO 310 -0.690 5.828 2.397 56 HD2 PRO 310 HD2 PRO 310 -2.120 3.702 3.928 57 HD3 PRO 310 HD1 PRO 310 -2.437 5.446 3.833 58 H ALA 311 HN ALA 311 -1.637 2.546 -1.096 59 HA ALA 311 HA ALA 311 -3.527 0.333 -0.729 60 HB1 ALA 311 HB1 ALA 311 -3.695 1.463 -2.896 61 HB2 ALA 311 HB2 ALA 311 -3.145 -0.200 -3.087 62 HB3 ALA 311 HB3 ALA 311 -1.990 1.128 -3.197 63 H TRP 312 HN TRP 312 -0.419 1.353 -0.919 64 HA TRP 312 HA TRP 312 0.985 -1.132 -1.033 65 HB2 TRP 312 HB2 TRP 312 2.908 0.327 -1.117 66 HB3 TRP 312 HB1 TRP 312 1.598 1.092 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.361 3.531 -1.698 68 HE1 TRP 312 HE1 TRP 312 1.879 5.256 0.133 69 HE3 TRP 312 HE3 TRP 312 3.225 0.394 1.911 70 HZ2 TRP 312 HZ2 TRP 312 2.917 5.296 2.743 71 HZ3 TRP 312 HZ3 TRP 312 3.949 1.371 4.045 72 HH2 TRP 312 HH2 TRP 312 3.788 3.766 4.450 73 H ALA 313 HN ALA 313 -0.652 0.576 1.130 74 HA ALA 313 HA ALA 313 0.814 0.135 3.566 75 HB1 ALA 313 HB1 ALA 313 -1.647 1.140 4.206 76 HB2 ALA 313 HB2 ALA 313 -1.448 1.689 2.520 77 HB3 ALA 313 HB3 ALA 313 -0.237 2.115 3.757 78 H ARG 314 HN ARG 314 -0.256 -2.181 1.961 79 HA ARG 314 HA ARG 314 -1.806 -3.479 4.066 80 HB2 ARG 314 HB2 ARG 314 -2.313 -3.553 1.097 81 HB3 ARG 314 HB1 ARG 314 -2.924 -4.798 2.176 82 HG2 ARG 314 HG2 ARG 314 -4.173 -3.103 3.424 83 HG3 ARG 314 HG1 ARG 314 -3.563 -1.858 2.329 84 HD2 ARG 314 HD2 ARG 314 -4.655 -2.978 0.450 85 HD3 ARG 314 HD1 ARG 314 -5.255 -4.228 1.539 86 HE ARG 314 HE ARG 314 -6.088 -1.709 2.472 87 HH11 ARG 314 HH11 ARG 314 -6.760 -3.922 -0.171 88 HH12 ARG 314 HH12 ARG 314 -8.388 -3.366 -0.373 89 HH21 ARG 314 HH21 ARG 314 -9.213 -1.712 0.963 90 HH22 ARG 314 HH22 ARG 314 -8.221 -0.998 2.189 91 HA PRO 315 HA PRO 315 1.998 -6.031 3.842 92 HB2 PRO 315 HB2 PRO 315 0.858 -7.923 5.579 93 HB3 PRO 315 HB1 PRO 315 1.982 -6.632 6.021 94 HG2 PRO 315 HG2 PRO 315 -0.975 -6.715 6.238 95 HG3 PRO 315 HG1 PRO 315 0.211 -5.876 7.259 96 HD2 PRO 315 HD2 PRO 315 -1.307 -4.528 5.534 97 HD3 PRO 315 HD1 PRO 315 0.386 -4.075 5.805 98 H ASP 316 HN ASP 316 -1.201 -7.039 3.332 99 HA ASP 316 HA ASP 316 -0.495 -9.604 2.159 100 HB2 ASP 316 HB2 ASP 316 -3.138 -8.236 2.672 101 HB3 ASP 316 HB1 ASP 316 -3.016 -9.762 1.799 102 H TYR 317 HN TYR 317 0.362 -7.065 0.879 103 HA TYR 317 HA TYR 317 -1.114 -7.091 -1.649 104 HB2 TYR 317 HB2 TYR 317 -0.537 -4.930 -0.395 105 HB3 TYR 317 HB1 TYR 317 1.127 -5.212 -0.886 106 HD1 TYR 317 HD1 TYR 317 -2.299 -4.611 -2.202 107 HD2 TYR 317 HD2 TYR 317 1.879 -4.569 -3.020 108 HE1 TYR 317 HE1 TYR 317 -2.731 -3.444 -4.322 109 HE2 TYR 317 HE2 TYR 317 1.457 -3.403 -5.142 110 HH TYR 317 HH TYR 317 -0.380 -3.107 -6.747 111 H ASN 318 HN ASN 318 -0.429 -8.406 -3.165 112 HA ASN 318 HA ASN 318 2.418 -9.140 -3.302 113 HB2 ASN 318 HB2 ASN 318 -0.063 -10.572 -4.264 114 HB3 ASN 318 HB1 ASN 318 1.563 -11.065 -4.724 115 HD21 ASN 318 HD21 ASN 318 2.925 -11.960 -3.177 116 HD22 ASN 318 HD22 ASN 318 2.333 -12.561 -1.669 117 HA PRO 319 HA PRO 319 2.748 -6.908 -7.147 118 HB2 PRO 319 HB2 PRO 319 4.901 -8.115 -8.267 119 HB3 PRO 319 HB1 PRO 319 5.029 -7.013 -6.890 120 HG2 PRO 319 HG2 PRO 319 5.079 -9.995 -6.921 121 HG3 PRO 319 HG1 PRO 319 6.054 -8.864 -5.963 122 HD2 PRO 319 HD2 PRO 319 3.892 -10.182 -4.961 123 HD3 PRO 319 HD1 PRO 319 4.426 -8.597 -4.374 124 HA PRO 320 HA PRO 320 0.508 -9.564 -10.061 125 HB2 PRO 320 HB2 PRO 320 0.652 -7.384 -12.005 126 HB3 PRO 320 HB1 PRO 320 -0.765 -8.054 -11.188 127 HG2 PRO 320 HG2 PRO 320 0.167 -5.585 -10.644 128 HG3 PRO 320 HG1 PRO 320 -0.621 -6.604 -9.422 129 HD2 PRO 320 HD2 PRO 320 2.296 -6.088 -9.849 130 HD3 PRO 320 HD1 PRO 320 1.369 -6.183 -8.340 131 H LEU 321 HN LEU 321 1.737 -11.135 -10.837 132 HA LEU 321 HA LEU 321 3.786 -10.499 -12.858 133 HB2 LEU 321 HB2 LEU 321 3.575 -12.837 -10.960 134 HB3 LEU 321 HB1 LEU 321 4.725 -12.765 -12.281 135 HG LEU 321 HG LEU 321 4.716 -10.553 -10.269 136 HD11 LEU 321 HD11 LEU 321 5.986 -13.256 -9.852 137 HD12 LEU 321 HD12 LEU 321 4.669 -12.564 -8.904 138 HD13 LEU 321 HD13 LEU 321 6.270 -11.824 -8.863 139 HD21 LEU 321 HD21 LEU 321 6.890 -11.931 -11.846 140 HD22 LEU 321 HD22 LEU 321 7.110 -10.544 -10.780 141 HD23 LEU 321 HD23 LEU 321 6.143 -10.385 -12.245 142 H VAL 322 HN VAL 322 3.697 -11.427 -14.831 143 HA VAL 322 HA VAL 322 1.718 -13.527 -15.337 144 HB VAL 322 HB VAL 322 1.118 -12.343 -17.525 145 HG11 VAL 322 HG11 VAL 322 0.202 -11.163 -14.908 146 HG12 VAL 322 HG12 VAL 322 -0.448 -12.600 -15.696 147 HG13 VAL 322 HG13 VAL 322 -0.643 -11.018 -16.450 148 HG21 VAL 322 HG21 VAL 322 1.235 -9.889 -17.522 149 HG22 VAL 322 HG22 VAL 322 2.844 -10.612 -17.523 150 HG23 VAL 322 HG23 VAL 322 2.181 -9.936 -16.034 151 H GLU 323 HN GLU 323 2.572 -15.156 -16.403 152 HA GLU 323 HA GLU 323 4.815 -14.659 -18.245 153 HB2 GLU 323 HB2 GLU 323 5.297 -15.767 -15.893 154 HB3 GLU 323 HB1 GLU 323 4.683 -17.212 -16.682 155 HG2 GLU 323 HG2 GLU 323 6.975 -17.364 -16.985 156 HG3 GLU 323 HG1 GLU 323 6.411 -16.699 -18.515 Start of MODEL 14 1 H1 GLY 304 HT1 GLY 304 -2.402 19.402 0.335 2 H2 GLY 304 HT2 GLY 304 -0.855 19.856 -0.174 3 H3 GLY 304 HT3 GLY 304 -1.280 18.221 -0.117 4 HA2 GLY 304 HA1 GLY 304 -2.454 20.261 -1.925 5 HA3 GLY 304 HA2 GLY 304 -1.292 19.029 -2.393 6 H PHE 305 HN PHE 305 -1.948 16.777 -2.191 7 HA PHE 305 HA PHE 305 -4.785 16.455 -2.840 8 HB2 PHE 305 HB2 PHE 305 -2.380 14.704 -3.361 9 HB3 PHE 305 HB1 PHE 305 -4.032 14.189 -3.688 10 HD1 PHE 305 HD1 PHE 305 -5.299 15.157 -5.512 11 HD2 PHE 305 HD2 PHE 305 -1.299 16.379 -4.723 12 HE1 PHE 305 HE1 PHE 305 -5.192 16.222 -7.727 13 HE2 PHE 305 HE2 PHE 305 -1.185 17.448 -6.937 14 HZ PHE 305 HZ PHE 305 -3.134 17.369 -8.442 15 HA PRO 306 HA PRO 306 -5.168 14.736 1.380 16 HB2 PRO 306 HB2 PRO 306 -7.976 14.302 0.581 17 HB3 PRO 306 HB1 PRO 306 -7.327 15.223 1.945 18 HG2 PRO 306 HG2 PRO 306 -8.425 16.463 -0.142 19 HG3 PRO 306 HG1 PRO 306 -7.014 17.136 0.699 20 HD2 PRO 306 HD2 PRO 306 -7.128 15.654 -1.900 21 HD3 PRO 306 HD1 PRO 306 -6.187 17.093 -1.455 22 H ARG 307 HN ARG 307 -4.942 12.709 2.081 23 HA ARG 307 HA ARG 307 -5.957 10.482 0.445 24 HB2 ARG 307 HB2 ARG 307 -3.200 10.798 1.632 25 HB3 ARG 307 HB1 ARG 307 -3.845 9.235 1.157 26 HG2 ARG 307 HG2 ARG 307 -4.070 10.004 -1.143 27 HG3 ARG 307 HG1 ARG 307 -3.470 11.596 -0.677 28 HD2 ARG 307 HD2 ARG 307 -1.887 9.072 -0.260 29 HD3 ARG 307 HD1 ARG 307 -1.794 10.019 -1.744 30 HE ARG 307 HE ARG 307 -1.352 11.728 0.432 31 HH11 ARG 307 HH11 ARG 307 0.273 9.077 -1.201 32 HH12 ARG 307 HH12 ARG 307 1.856 9.626 -0.761 33 HH21 ARG 307 HH21 ARG 307 0.728 12.426 0.997 34 HH22 ARG 307 HH22 ARG 307 2.112 11.521 0.482 35 H ALA 308 HN ALA 308 -6.665 8.679 1.561 36 HA ALA 308 HA ALA 308 -7.092 9.095 4.432 37 HB1 ALA 308 HB1 ALA 308 -8.919 7.500 4.239 38 HB2 ALA 308 HB2 ALA 308 -8.503 7.204 2.550 39 HB3 ALA 308 HB3 ALA 308 -9.093 8.790 3.050 40 H LEU 309 HN LEU 309 -6.400 6.348 2.229 41 HA LEU 309 HA LEU 309 -4.428 5.332 4.104 42 HB2 LEU 309 HB2 LEU 309 -5.417 3.012 3.991 43 HB3 LEU 309 HB1 LEU 309 -6.279 4.167 4.984 44 HG LEU 309 HG LEU 309 -7.660 4.437 2.675 45 HD11 LEU 309 HD11 LEU 309 -6.772 1.557 2.749 46 HD12 LEU 309 HD12 LEU 309 -6.365 2.738 1.504 47 HD13 LEU 309 HD13 LEU 309 -8.039 2.221 1.717 48 HD21 LEU 309 HD21 LEU 309 -8.107 2.345 4.802 49 HD22 LEU 309 HD22 LEU 309 -9.327 2.942 3.678 50 HD23 LEU 309 HD23 LEU 309 -8.617 4.032 4.869 51 HA PRO 310 HA PRO 310 -2.559 4.490 0.094 52 HB2 PRO 310 HB2 PRO 310 -0.415 3.041 1.435 53 HB3 PRO 310 HB1 PRO 310 -0.353 4.577 0.574 54 HG2 PRO 310 HG2 PRO 310 -0.057 4.394 3.261 55 HG3 PRO 310 HG1 PRO 310 -0.718 5.822 2.442 56 HD2 PRO 310 HD2 PRO 310 -2.157 3.655 3.906 57 HD3 PRO 310 HD1 PRO 310 -2.473 5.400 3.861 58 H ALA 311 HN ALA 311 -1.627 2.552 -1.099 59 HA ALA 311 HA ALA 311 -3.527 0.345 -0.739 60 HB1 ALA 311 HB1 ALA 311 -1.973 1.134 -3.200 61 HB2 ALA 311 HB2 ALA 311 -3.681 1.471 -2.909 62 HB3 ALA 311 HB3 ALA 311 -3.130 -0.195 -3.093 63 H TRP 312 HN TRP 312 -0.413 1.353 -0.922 64 HA TRP 312 HA TRP 312 0.982 -1.138 -1.031 65 HB2 TRP 312 HB2 TRP 312 2.910 0.318 -1.111 66 HB3 TRP 312 HB1 TRP 312 1.602 1.083 -2.021 67 HD1 TRP 312 HD1 TRP 312 1.342 3.519 -1.688 68 HE1 TRP 312 HE1 TRP 312 1.864 5.244 0.141 69 HE3 TRP 312 HE3 TRP 312 3.251 0.390 1.902 70 HZ2 TRP 312 HZ2 TRP 312 2.920 5.288 2.743 71 HZ3 TRP 312 HZ3 TRP 312 3.986 1.369 4.032 72 HH2 TRP 312 HH2 TRP 312 3.813 3.762 4.441 73 H ALA 313 HN ALA 313 -0.654 0.569 1.135 74 HA ALA 313 HA ALA 313 0.824 0.130 3.567 75 HB1 ALA 313 HB1 ALA 313 -0.218 2.115 3.763 76 HB2 ALA 313 HB2 ALA 313 -1.636 1.151 4.208 77 HB3 ALA 313 HB3 ALA 313 -1.426 1.697 2.522 78 H ARG 314 HN ARG 314 0.058 -2.279 2.201 79 HA ARG 314 HA ARG 314 -1.753 -3.469 4.160 80 HB2 ARG 314 HB2 ARG 314 -1.761 -3.843 1.173 81 HB3 ARG 314 HB1 ARG 314 -2.460 -5.042 2.253 82 HG2 ARG 314 HG2 ARG 314 -3.974 -3.318 3.149 83 HG3 ARG 314 HG1 ARG 314 -3.303 -2.160 2.000 84 HD2 ARG 314 HD2 ARG 314 -5.283 -2.941 1.003 85 HD3 ARG 314 HD1 ARG 314 -3.981 -3.802 0.183 86 HE ARG 314 HE ARG 314 -4.800 -5.408 2.290 87 HH11 ARG 314 HH11 ARG 314 -6.235 -4.145 -0.657 88 HH12 ARG 314 HH12 ARG 314 -7.321 -5.482 -0.837 89 HH21 ARG 314 HH21 ARG 314 -7.319 -7.179 0.686 90 HH22 ARG 314 HH22 ARG 314 -6.232 -7.147 2.036 91 HA PRO 315 HA PRO 315 2.151 -5.807 4.752 92 HB2 PRO 315 HB2 PRO 315 0.984 -7.458 6.668 93 HB3 PRO 315 HB1 PRO 315 1.886 -5.974 7.001 94 HG2 PRO 315 HG2 PRO 315 -1.056 -6.392 6.818 95 HG3 PRO 315 HG1 PRO 315 -0.132 -5.327 7.898 96 HD2 PRO 315 HD2 PRO 315 -1.440 -4.323 5.816 97 HD3 PRO 315 HD1 PRO 315 0.158 -3.701 6.264 98 H ASP 316 HN ASP 316 -0.963 -7.068 4.208 99 HA ASP 316 HA ASP 316 -0.089 -9.741 3.504 100 HB2 ASP 316 HB2 ASP 316 -2.343 -9.007 4.622 101 HB3 ASP 316 HB1 ASP 316 -2.856 -8.705 2.965 102 H TYR 317 HN TYR 317 0.004 -6.858 1.935 103 HA TYR 317 HA TYR 317 -0.521 -7.969 -0.731 104 HB2 TYR 317 HB2 TYR 317 -1.695 -5.848 -0.030 105 HB3 TYR 317 HB1 TYR 317 -0.123 -5.067 0.043 106 HD1 TYR 317 HD1 TYR 317 0.945 -4.277 -1.925 107 HD2 TYR 317 HD2 TYR 317 -2.585 -6.631 -2.238 108 HE1 TYR 317 HE1 TYR 317 0.778 -3.695 -4.306 109 HE2 TYR 317 HE2 TYR 317 -2.762 -6.059 -4.624 110 HH TYR 317 HH TYR 317 -2.009 -4.303 -6.157 111 H ASN 318 HN ASN 318 1.159 -8.621 -1.857 112 HA ASN 318 HA ASN 318 3.852 -7.749 -1.135 113 HB2 ASN 318 HB2 ASN 318 2.839 -10.036 -2.828 114 HB3 ASN 318 HB1 ASN 318 4.545 -9.622 -2.703 115 HD21 ASN 318 HD21 ASN 318 1.776 -10.909 -1.057 116 HD22 ASN 318 HD22 ASN 318 2.628 -11.566 0.295 117 HA PRO 319 HA PRO 319 4.303 -5.165 -4.751 118 HB2 PRO 319 HB2 PRO 319 7.101 -5.950 -5.088 119 HB3 PRO 319 HB1 PRO 319 6.436 -4.392 -4.584 120 HG2 PRO 319 HG2 PRO 319 7.780 -5.982 -2.880 121 HG3 PRO 319 HG1 PRO 319 6.443 -4.938 -2.358 122 HD2 PRO 319 HD2 PRO 319 6.431 -7.881 -2.898 123 HD3 PRO 319 HD1 PRO 319 5.666 -6.968 -1.583 124 HA PRO 320 HA PRO 320 4.081 -7.732 -8.413 125 HB2 PRO 320 HB2 PRO 320 5.025 -5.569 -10.132 126 HB3 PRO 320 HB1 PRO 320 3.404 -6.262 -10.010 127 HG2 PRO 320 HG2 PRO 320 3.972 -3.761 -9.167 128 HG3 PRO 320 HG1 PRO 320 2.724 -4.772 -8.414 129 HD2 PRO 320 HD2 PRO 320 5.509 -4.210 -7.474 130 HD3 PRO 320 HD1 PRO 320 3.999 -4.308 -6.553 131 H LEU 321 HN LEU 321 5.574 -9.265 -8.519 132 HA LEU 321 HA LEU 321 8.355 -8.594 -9.153 133 HB2 LEU 321 HB2 LEU 321 7.072 -11.133 -8.148 134 HB3 LEU 321 HB1 LEU 321 8.757 -11.030 -8.617 135 HG LEU 321 HG LEU 321 7.711 -9.155 -6.532 136 HD11 LEU 321 HD11 LEU 321 8.524 -12.016 -6.045 137 HD12 LEU 321 HD12 LEU 321 6.915 -11.335 -5.814 138 HD13 LEU 321 HD13 LEU 321 8.252 -10.799 -4.799 139 HD21 LEU 321 HD21 LEU 321 10.008 -9.354 -5.695 140 HD22 LEU 321 HD22 LEU 321 9.972 -8.830 -7.379 141 HD23 LEU 321 HD23 LEU 321 10.375 -10.501 -6.984 142 H VAL 322 HN VAL 322 9.182 -8.894 -11.101 143 HA VAL 322 HA VAL 322 8.023 -10.873 -12.912 144 HB VAL 322 HB VAL 322 8.229 -9.189 -14.830 145 HG11 VAL 322 HG11 VAL 322 5.958 -8.334 -14.461 146 HG12 VAL 322 HG12 VAL 322 6.054 -8.837 -12.773 147 HG13 VAL 322 HG13 VAL 322 6.102 -10.045 -14.058 148 HG21 VAL 322 HG21 VAL 322 9.415 -7.401 -13.654 149 HG22 VAL 322 HG22 VAL 322 8.052 -7.205 -12.553 150 HG23 VAL 322 HG23 VAL 322 7.863 -6.826 -14.265 151 H GLU 323 HN GLU 323 9.465 -11.920 -14.143 152 HA GLU 323 HA GLU 323 12.217 -10.886 -14.268 153 HB2 GLU 323 HB2 GLU 323 11.312 -13.680 -13.571 154 HB3 GLU 323 HB1 GLU 323 12.941 -13.337 -14.134 155 HG2 GLU 323 HG2 GLU 323 11.787 -11.901 -11.771 156 HG3 GLU 323 HG1 GLU 323 12.515 -13.497 -11.607 Start of MODEL 15 1 H1 GLY 304 HT1 GLY 304 -15.094 16.908 9.887 2 H2 GLY 304 HT2 GLY 304 -16.704 17.404 9.744 3 H3 GLY 304 HT3 GLY 304 -15.567 17.885 8.589 4 HA2 GLY 304 HA1 GLY 304 -16.483 15.103 9.076 5 HA3 GLY 304 HA2 GLY 304 -16.967 16.117 7.723 6 H PHE 305 HN PHE 305 -16.041 15.454 5.924 7 HA PHE 305 HA PHE 305 -14.563 14.703 4.381 8 HB2 PHE 305 HB2 PHE 305 -12.587 16.026 6.245 9 HB3 PHE 305 HB1 PHE 305 -12.145 15.366 4.675 10 HD1 PHE 305 HD1 PHE 305 -13.915 18.037 6.431 11 HD2 PHE 305 HD2 PHE 305 -12.847 16.450 2.629 12 HE1 PHE 305 HE1 PHE 305 -14.556 20.162 5.368 13 HE2 PHE 305 HE2 PHE 305 -13.485 18.572 1.559 14 HZ PHE 305 HZ PHE 305 -14.341 20.431 2.929 15 HA PRO 306 HA PRO 306 -13.732 10.606 6.252 16 HB2 PRO 306 HB2 PRO 306 -13.417 9.835 3.412 17 HB3 PRO 306 HB1 PRO 306 -14.468 9.142 4.654 18 HG2 PRO 306 HG2 PRO 306 -15.485 10.611 2.686 19 HG3 PRO 306 HG1 PRO 306 -16.127 10.713 4.338 20 HD2 PRO 306 HD2 PRO 306 -14.296 12.597 2.908 21 HD3 PRO 306 HD1 PRO 306 -15.670 12.946 3.977 22 H ARG 307 HN ARG 307 -11.943 9.172 6.324 23 HA ARG 307 HA ARG 307 -9.421 10.407 5.486 24 HB2 ARG 307 HB2 ARG 307 -10.089 8.329 7.568 25 HB3 ARG 307 HB1 ARG 307 -8.435 8.674 7.085 26 HG2 ARG 307 HG2 ARG 307 -8.694 10.989 7.807 27 HG3 ARG 307 HG1 ARG 307 -10.366 10.661 8.271 28 HD2 ARG 307 HD2 ARG 307 -9.579 9.004 9.898 29 HD3 ARG 307 HD1 ARG 307 -7.912 9.350 9.439 30 HE ARG 307 HE ARG 307 -9.039 11.766 10.178 31 HH11 ARG 307 HH11 ARG 307 -8.365 8.701 11.756 32 HH12 ARG 307 HH12 ARG 307 -8.170 9.419 13.321 33 HH21 ARG 307 HH21 ARG 307 -8.779 12.683 12.235 34 HH22 ARG 307 HH22 ARG 307 -8.405 11.670 13.589 35 H ALA 308 HN ALA 308 -7.831 9.285 4.373 36 HA ALA 308 HA ALA 308 -8.667 6.754 3.114 37 HB1 ALA 308 HB1 ALA 308 -7.125 8.991 1.806 38 HB2 ALA 308 HB2 ALA 308 -8.826 8.618 1.530 39 HB3 ALA 308 HB3 ALA 308 -7.581 7.461 1.056 40 H LEU 309 HN LEU 309 -7.055 5.241 2.651 41 HA LEU 309 HA LEU 309 -4.456 5.714 3.953 42 HB2 LEU 309 HB2 LEU 309 -6.137 3.208 3.946 43 HB3 LEU 309 HB1 LEU 309 -4.462 3.242 4.456 44 HG LEU 309 HG LEU 309 -5.354 5.119 6.101 45 HD11 LEU 309 HD11 LEU 309 -7.631 5.140 5.227 46 HD12 LEU 309 HD12 LEU 309 -7.604 4.604 6.907 47 HD13 LEU 309 HD13 LEU 309 -7.802 3.428 5.609 48 HD21 LEU 309 HD21 LEU 309 -5.683 3.365 7.791 49 HD22 LEU 309 HD22 LEU 309 -4.261 3.068 6.789 50 HD23 LEU 309 HD23 LEU 309 -5.745 2.157 6.506 51 HA PRO 310 HA PRO 310 -2.556 4.476 0.121 52 HB2 PRO 310 HB2 PRO 310 -0.402 3.022 1.452 53 HB3 PRO 310 HB1 PRO 310 -0.341 4.539 0.559 54 HG2 PRO 310 HG2 PRO 310 -0.008 4.416 3.240 55 HG3 PRO 310 HG1 PRO 310 -0.691 5.825 2.405 56 HD2 PRO 310 HD2 PRO 310 -2.092 3.680 3.936 57 HD3 PRO 310 HD1 PRO 310 -2.421 5.420 3.860 58 H ALA 311 HN ALA 311 -1.635 2.548 -1.089 59 HA ALA 311 HA ALA 311 -3.525 0.336 -0.728 60 HB1 ALA 311 HB1 ALA 311 -3.142 -0.192 -3.088 61 HB2 ALA 311 HB2 ALA 311 -1.990 1.141 -3.195 62 HB3 ALA 311 HB3 ALA 311 -3.695 1.471 -2.891 63 H TRP 312 HN TRP 312 -0.416 1.353 -0.917 64 HA TRP 312 HA TRP 312 0.985 -1.134 -1.037 65 HB2 TRP 312 HB2 TRP 312 2.911 0.324 -1.106 66 HB3 TRP 312 HB1 TRP 312 1.604 1.083 -2.022 67 HD1 TRP 312 HD1 TRP 312 1.361 3.526 -1.703 68 HE1 TRP 312 HE1 TRP 312 1.878 5.254 0.125 69 HE3 TRP 312 HE3 TRP 312 3.219 0.397 1.916 70 HZ2 TRP 312 HZ2 TRP 312 2.913 5.302 2.737 71 HZ3 TRP 312 HZ3 TRP 312 3.943 1.380 4.048 72 HH2 TRP 312 HH2 TRP 312 3.781 3.776 4.447 73 H ALA 313 HN ALA 313 -0.654 0.569 1.126 74 HA ALA 313 HA ALA 313 0.802 0.100 3.567 75 HB1 ALA 313 HB1 ALA 313 -0.230 2.095 3.757 76 HB2 ALA 313 HB2 ALA 313 -1.646 1.131 4.207 77 HB3 ALA 313 HB3 ALA 313 -1.443 1.681 2.523 78 H ARG 314 HN ARG 314 -0.151 -2.226 2.013 79 HA ARG 314 HA ARG 314 -1.843 -3.492 4.027 80 HB2 ARG 314 HB2 ARG 314 -2.113 -3.657 1.030 81 HB3 ARG 314 HB1 ARG 314 -2.802 -4.871 2.098 82 HG2 ARG 314 HG2 ARG 314 -4.181 -3.181 3.166 83 HG3 ARG 314 HG1 ARG 314 -3.459 -1.931 2.150 84 HD2 ARG 314 HD2 ARG 314 -4.343 -3.053 0.157 85 HD3 ARG 314 HD1 ARG 314 -5.070 -4.291 1.180 86 HE ARG 314 HE ARG 314 -6.073 -1.928 2.125 87 HH11 ARG 314 HH11 ARG 314 -6.097 -3.513 -1.008 88 HH12 ARG 314 HH12 ARG 314 -7.606 -2.806 -1.481 89 HH21 ARG 314 HH21 ARG 314 -8.708 -1.394 -0.070 90 HH22 ARG 314 HH22 ARG 314 -8.048 -1.016 1.486 91 HA PRO 315 HA PRO 315 2.005 -5.987 4.203 92 HB2 PRO 315 HB2 PRO 315 0.668 -7.881 5.817 93 HB3 PRO 315 HB1 PRO 315 1.791 -6.626 6.357 94 HG2 PRO 315 HG2 PRO 315 -1.167 -6.633 6.360 95 HG3 PRO 315 HG1 PRO 315 -0.039 -5.776 7.426 96 HD2 PRO 315 HD2 PRO 315 -1.435 -4.480 5.555 97 HD3 PRO 315 HD1 PRO 315 0.230 -4.015 5.945 98 H ASP 316 HN ASP 316 -1.092 -7.012 3.311 99 HA ASP 316 HA ASP 316 -0.313 -9.621 2.327 100 HB2 ASP 316 HB2 ASP 316 -2.922 -8.101 2.270 101 HB3 ASP 316 HB1 ASP 316 -2.721 -9.675 1.505 102 H TYR 317 HN TYR 317 0.683 -6.945 1.152 103 HA TYR 317 HA TYR 317 -0.201 -7.165 -1.621 104 HB2 TYR 317 HB2 TYR 317 0.126 -4.946 -0.314 105 HB3 TYR 317 HB1 TYR 317 1.844 -5.206 -0.583 106 HD1 TYR 317 HD1 TYR 317 2.755 -5.156 -2.888 107 HD2 TYR 317 HD2 TYR 317 -1.311 -4.202 -2.078 108 HE1 TYR 317 HE1 TYR 317 2.570 -4.095 -5.097 109 HE2 TYR 317 HE2 TYR 317 -1.508 -3.140 -4.285 110 HH TYR 317 HH TYR 317 0.828 -3.517 -6.723 111 H ASN 318 HN ASN 318 0.790 -8.598 -2.853 112 HA ASN 318 HA ASN 318 3.597 -9.271 -2.359 113 HB2 ASN 318 HB2 ASN 318 1.411 -10.718 -3.856 114 HB3 ASN 318 HB1 ASN 318 3.098 -11.222 -3.906 115 HD21 ASN 318 HD21 ASN 318 0.242 -10.945 -1.950 116 HD22 ASN 318 HD22 ASN 318 0.780 -11.961 -0.661 117 HA PRO 319 HA PRO 319 4.708 -7.103 -6.130 118 HB2 PRO 319 HB2 PRO 319 7.178 -8.601 -6.363 119 HB3 PRO 319 HB1 PRO 319 6.953 -6.925 -5.846 120 HG2 PRO 319 HG2 PRO 319 7.787 -8.891 -4.166 121 HG3 PRO 319 HG1 PRO 319 6.880 -7.464 -3.631 122 HD2 PRO 319 HD2 PRO 319 5.892 -10.243 -4.134 123 HD3 PRO 319 HD1 PRO 319 5.488 -9.115 -2.824 124 HA PRO 320 HA PRO 320 3.821 -9.729 -9.646 125 HB2 PRO 320 HB2 PRO 320 5.733 -8.265 -11.335 126 HB3 PRO 320 HB1 PRO 320 3.972 -8.362 -11.464 127 HG2 PRO 320 HG2 PRO 320 5.193 -6.109 -10.689 128 HG3 PRO 320 HG1 PRO 320 3.616 -6.601 -10.036 129 HD2 PRO 320 HD2 PRO 320 6.325 -6.834 -8.786 130 HD3 PRO 320 HD1 PRO 320 4.779 -6.365 -8.061 131 H LEU 321 HN LEU 321 4.552 -11.726 -9.558 132 HA LEU 321 HA LEU 321 7.411 -12.292 -9.778 133 HB2 LEU 321 HB2 LEU 321 6.717 -14.647 -9.203 134 HB3 LEU 321 HB1 LEU 321 6.452 -13.445 -7.960 135 HG LEU 321 HG LEU 321 4.009 -13.425 -9.080 136 HD11 LEU 321 HD11 LEU 321 5.013 -16.238 -9.490 137 HD12 LEU 321 HD12 LEU 321 4.549 -15.104 -10.759 138 HD13 LEU 321 HD13 LEU 321 3.336 -15.708 -9.630 139 HD21 LEU 321 HD21 LEU 321 4.487 -13.766 -6.724 140 HD22 LEU 321 HD22 LEU 321 5.007 -15.419 -7.051 141 HD23 LEU 321 HD23 LEU 321 3.322 -14.961 -7.294 142 H VAL 322 HN VAL 322 8.331 -13.510 -11.371 143 HA VAL 322 HA VAL 322 6.648 -14.515 -13.540 144 HB VAL 322 HB VAL 322 8.317 -13.556 -15.226 145 HG11 VAL 322 HG11 VAL 322 6.467 -11.687 -13.757 146 HG12 VAL 322 HG12 VAL 322 6.026 -12.789 -15.062 147 HG13 VAL 322 HG13 VAL 322 7.104 -11.430 -15.381 148 HG21 VAL 322 HG21 VAL 322 10.054 -12.803 -13.680 149 HG22 VAL 322 HG22 VAL 322 8.921 -11.674 -12.937 150 HG23 VAL 322 HG23 VAL 322 9.420 -11.446 -14.614 151 H GLU 323 HN GLU 323 7.352 -16.349 -14.462 152 HA GLU 323 HA GLU 323 9.813 -17.528 -13.391 153 HB2 GLU 323 HB2 GLU 323 7.359 -18.735 -14.663 154 HB3 GLU 323 HB1 GLU 323 8.825 -19.666 -14.394 155 HG2 GLU 323 HG2 GLU 323 8.664 -19.227 -11.995 156 HG3 GLU 323 HG1 GLU 323 7.193 -18.294 -12.267 Start of MODEL 16 1 H1 GLY 304 HT1 GLY 304 -19.009 4.441 3.003 2 H2 GLY 304 HT2 GLY 304 -17.763 3.342 2.687 3 H3 GLY 304 HT3 GLY 304 -18.603 4.060 1.405 4 HA2 GLY 304 HA1 GLY 304 -16.439 5.087 1.664 5 HA3 GLY 304 HA2 GLY 304 -17.735 6.229 1.992 6 H PHE 305 HN PHE 305 -14.808 5.672 2.935 7 HA PHE 305 HA PHE 305 -15.263 5.734 5.826 8 HB2 PHE 305 HB2 PHE 305 -12.766 5.322 4.175 9 HB3 PHE 305 HB1 PHE 305 -12.734 5.521 5.924 10 HD1 PHE 305 HD1 PHE 305 -13.560 3.782 7.390 11 HD2 PHE 305 HD2 PHE 305 -13.633 3.307 3.161 12 HE1 PHE 305 HE1 PHE 305 -13.955 1.370 7.671 13 HE2 PHE 305 HE2 PHE 305 -14.028 0.894 3.435 14 HZ PHE 305 HZ PHE 305 -14.189 -0.077 5.692 15 HA PRO 306 HA PRO 306 -14.392 10.114 6.073 16 HB2 PRO 306 HB2 PRO 306 -12.881 9.862 8.554 17 HB3 PRO 306 HB1 PRO 306 -14.500 10.525 8.305 18 HG2 PRO 306 HG2 PRO 306 -14.086 8.215 9.633 19 HG3 PRO 306 HG1 PRO 306 -15.542 8.517 8.664 20 HD2 PRO 306 HD2 PRO 306 -13.097 6.943 7.947 21 HD3 PRO 306 HD1 PRO 306 -14.808 6.552 7.683 22 H ARG 307 HN ARG 307 -11.608 8.035 6.781 23 HA ARG 307 HA ARG 307 -9.844 10.053 5.552 24 HB2 ARG 307 HB2 ARG 307 -9.315 8.170 7.846 25 HB3 ARG 307 HB1 ARG 307 -8.013 8.934 6.945 26 HG2 ARG 307 HG2 ARG 307 -8.868 11.135 7.568 27 HG3 ARG 307 HG1 ARG 307 -10.180 10.370 8.467 28 HD2 ARG 307 HD2 ARG 307 -8.542 9.289 9.929 29 HD3 ARG 307 HD1 ARG 307 -7.234 10.054 9.031 30 HE ARG 307 HE ARG 307 -8.961 12.058 9.931 31 HH11 ARG 307 HH11 ARG 307 -6.713 9.735 11.306 32 HH12 ARG 307 HH12 ARG 307 -6.357 10.723 12.684 33 HH21 ARG 307 HH21 ARG 307 -8.478 13.334 11.742 34 HH22 ARG 307 HH22 ARG 307 -7.356 12.759 12.929 35 H ALA 308 HN ALA 308 -8.218 9.337 4.170 36 HA ALA 308 HA ALA 308 -8.712 6.703 2.979 37 HB1 ALA 308 HB1 ALA 308 -8.854 8.644 1.494 38 HB2 ALA 308 HB2 ALA 308 -7.547 7.559 1.019 39 HB3 ALA 308 HB3 ALA 308 -7.182 9.057 1.875 40 H LEU 309 HN LEU 309 -7.056 5.248 2.544 41 HA LEU 309 HA LEU 309 -4.492 5.740 3.905 42 HB2 LEU 309 HB2 LEU 309 -6.155 3.224 3.916 43 HB3 LEU 309 HB1 LEU 309 -4.483 3.275 4.437 44 HG LEU 309 HG LEU 309 -5.404 5.171 6.050 45 HD11 LEU 309 HD11 LEU 309 -7.830 3.446 5.565 46 HD12 LEU 309 HD12 LEU 309 -7.674 5.156 5.166 47 HD13 LEU 309 HD13 LEU 309 -7.651 4.638 6.851 48 HD21 LEU 309 HD21 LEU 309 -4.293 3.136 6.769 49 HD22 LEU 309 HD22 LEU 309 -5.772 2.212 6.505 50 HD23 LEU 309 HD23 LEU 309 -5.715 3.445 7.765 51 HA PRO 310 HA PRO 310 -2.555 4.478 0.102 52 HB2 PRO 310 HB2 PRO 310 -0.412 3.027 1.449 53 HB3 PRO 310 HB1 PRO 310 -0.343 4.544 0.557 54 HG2 PRO 310 HG2 PRO 310 -0.032 4.415 3.243 55 HG3 PRO 310 HG1 PRO 310 -0.694 5.829 2.401 56 HD2 PRO 310 HD2 PRO 310 -2.127 3.703 3.928 57 HD3 PRO 310 HD1 PRO 310 -2.446 5.444 3.833 58 H ALA 311 HN ALA 311 -1.637 2.548 -1.097 59 HA ALA 311 HA ALA 311 -3.527 0.335 -0.732 60 HB1 ALA 311 HB1 ALA 311 -3.141 -0.200 -3.090 61 HB2 ALA 311 HB2 ALA 311 -1.987 1.128 -3.199 62 HB3 ALA 311 HB3 ALA 311 -3.693 1.465 -2.900 63 H TRP 312 HN TRP 312 -0.418 1.353 -0.921 64 HA TRP 312 HA TRP 312 0.985 -1.133 -1.032 65 HB2 TRP 312 HB2 TRP 312 2.908 0.327 -1.114 66 HB3 TRP 312 HB1 TRP 312 1.599 1.091 -2.021 67 HD1 TRP 312 HD1 TRP 312 1.354 3.529 -1.693 68 HE1 TRP 312 HE1 TRP 312 1.874 5.253 0.136 69 HE3 TRP 312 HE3 TRP 312 3.232 0.394 1.909 70 HZ2 TRP 312 HZ2 TRP 312 2.918 5.295 2.745 71 HZ3 TRP 312 HZ3 TRP 312 3.961 1.371 4.040 72 HH2 TRP 312 HH2 TRP 312 3.796 3.766 4.449 73 H ALA 313 HN ALA 313 -0.656 0.575 1.128 74 HA ALA 313 HA ALA 313 0.809 0.125 3.567 75 HB1 ALA 313 HB1 ALA 313 -1.441 1.696 2.521 76 HB2 ALA 313 HB2 ALA 313 -0.225 2.115 3.759 77 HB3 ALA 313 HB3 ALA 313 -1.643 1.153 4.205 78 H ARG 314 HN ARG 314 -0.238 -2.197 1.983 79 HA ARG 314 HA ARG 314 -1.842 -3.460 4.071 80 HB2 ARG 314 HB2 ARG 314 -2.283 -3.550 1.097 81 HB3 ARG 314 HB1 ARG 314 -2.903 -4.808 2.156 82 HG2 ARG 314 HG2 ARG 314 -4.203 -3.143 3.380 83 HG3 ARG 314 HG1 ARG 314 -3.569 -1.873 2.334 84 HD2 ARG 314 HD2 ARG 314 -5.082 -4.249 1.276 85 HD3 ARG 314 HD1 ARG 314 -5.882 -2.762 1.778 86 HE ARG 314 HE ARG 314 -3.808 -2.184 -0.056 87 HH11 ARG 314 HH11 ARG 314 -7.050 -3.533 0.023 88 HH12 ARG 314 HH12 ARG 314 -7.402 -3.081 -1.612 89 HH21 ARG 314 HH21 ARG 314 -5.840 -1.990 -2.865 90 HH22 ARG 314 HH22 ARG 314 -4.290 -1.603 -2.194 91 HA PRO 315 HA PRO 315 1.943 -6.049 3.929 92 HB2 PRO 315 HB2 PRO 315 0.879 -7.836 5.793 93 HB3 PRO 315 HB1 PRO 315 1.942 -6.470 6.157 94 HG2 PRO 315 HG2 PRO 315 -1.021 -6.656 6.337 95 HG3 PRO 315 HG1 PRO 315 0.119 -5.765 7.365 96 HD2 PRO 315 HD2 PRO 315 -1.376 -4.484 5.580 97 HD3 PRO 315 HD1 PRO 315 0.308 -4.007 5.862 98 H ASP 316 HN ASP 316 -1.285 -7.074 3.612 99 HA ASP 316 HA ASP 316 -0.680 -9.710 2.582 100 HB2 ASP 316 HB2 ASP 316 -3.269 -8.194 2.928 101 HB3 ASP 316 HB1 ASP 316 -3.191 -9.790 2.190 102 H TYR 317 HN TYR 317 -0.490 -6.715 1.258 103 HA TYR 317 HA TYR 317 -1.413 -7.483 -1.413 104 HB2 TYR 317 HB2 TYR 317 -2.151 -5.298 -0.437 105 HB3 TYR 317 HB1 TYR 317 -0.473 -4.778 -0.415 106 HD1 TYR 317 HD1 TYR 317 -3.323 -5.629 -2.612 107 HD2 TYR 317 HD2 TYR 317 0.595 -3.981 -2.393 108 HE1 TYR 317 HE1 TYR 317 -3.566 -4.759 -4.899 109 HE2 TYR 317 HE2 TYR 317 0.363 -3.105 -4.676 110 HH TYR 317 HH TYR 317 -2.608 -2.972 -6.303 111 H ASN 318 HN ASN 318 0.012 -8.363 -2.717 112 HA ASN 318 HA ASN 318 2.825 -7.502 -2.594 113 HB2 ASN 318 HB2 ASN 318 1.720 -10.282 -3.005 114 HB3 ASN 318 HB1 ASN 318 3.384 -9.852 -3.381 115 HD21 ASN 318 HD21 ASN 318 1.048 -10.348 -0.864 116 HD22 ASN 318 HD22 ASN 318 2.170 -10.399 0.449 117 HA PRO 319 HA PRO 319 2.491 -6.590 -6.952 118 HB2 PRO 319 HB2 PRO 319 5.184 -7.638 -7.464 119 HB3 PRO 319 HB1 PRO 319 4.593 -5.977 -7.578 120 HG2 PRO 319 HG2 PRO 319 6.281 -6.730 -5.640 121 HG3 PRO 319 HG1 PRO 319 5.016 -5.516 -5.369 122 HD2 PRO 319 HD2 PRO 319 5.044 -8.406 -4.595 123 HD3 PRO 319 HD1 PRO 319 4.495 -6.994 -3.673 124 HA PRO 320 HA PRO 320 1.558 -10.379 -9.149 125 HB2 PRO 320 HB2 PRO 320 2.007 -9.133 -11.746 126 HB3 PRO 320 HB1 PRO 320 0.480 -9.614 -10.998 127 HG2 PRO 320 HG2 PRO 320 1.159 -7.024 -11.379 128 HG3 PRO 320 HG1 PRO 320 0.135 -7.571 -10.036 129 HD2 PRO 320 HD2 PRO 320 3.042 -6.864 -10.018 130 HD3 PRO 320 HD1 PRO 320 1.777 -6.495 -8.833 131 H LEU 321 HN LEU 321 3.070 -11.889 -8.922 132 HA LEU 321 HA LEU 321 4.797 -13.300 -9.334 133 HB2 LEU 321 HB2 LEU 321 4.851 -11.892 -12.006 134 HB3 LEU 321 HB1 LEU 321 5.828 -13.296 -11.621 135 HG LEU 321 HG LEU 321 3.473 -14.359 -11.043 136 HD11 LEU 321 HD11 LEU 321 1.732 -13.575 -12.569 137 HD12 LEU 321 HD12 LEU 321 2.773 -12.243 -13.074 138 HD13 LEU 321 HD13 LEU 321 2.185 -12.324 -11.413 139 HD21 LEU 321 HD21 LEU 321 3.380 -15.222 -13.338 140 HD22 LEU 321 HD22 LEU 321 5.025 -15.216 -12.701 141 HD23 LEU 321 HD23 LEU 321 4.518 -13.972 -13.845 142 H VAL 322 HN VAL 322 6.760 -13.327 -8.508 143 HA VAL 322 HA VAL 322 8.601 -11.109 -9.029 144 HB VAL 322 HB VAL 322 9.315 -11.201 -6.574 145 HG11 VAL 322 HG11 VAL 322 8.199 -9.286 -7.552 146 HG12 VAL 322 HG12 VAL 322 7.621 -9.559 -5.908 147 HG13 VAL 322 HG13 VAL 322 6.626 -10.037 -7.284 148 HG21 VAL 322 HG21 VAL 322 7.576 -11.798 -4.940 149 HG22 VAL 322 HG22 VAL 322 8.093 -13.199 -5.879 150 HG23 VAL 322 HG23 VAL 322 6.561 -12.408 -6.248 151 H GLU 323 HN GLU 323 10.459 -11.859 -9.732 152 HA GLU 323 HA GLU 323 11.457 -14.433 -8.710 153 HB2 GLU 323 HB2 GLU 323 11.364 -13.478 -11.569 154 HB3 GLU 323 HB1 GLU 323 12.459 -14.748 -11.045 155 HG2 GLU 323 HG2 GLU 323 10.554 -16.093 -10.317 156 HG3 GLU 323 HG1 GLU 323 9.455 -14.818 -10.843 Start of MODEL 17 1 H1 GLY 304 HT1 GLY 304 -12.924 16.269 0.922 2 H2 GLY 304 HT2 GLY 304 -13.095 15.318 -0.467 3 H3 GLY 304 HT3 GLY 304 -11.666 15.248 0.436 4 HA2 GLY 304 HA1 GLY 304 -14.348 14.355 1.344 5 HA3 GLY 304 HA2 GLY 304 -13.027 13.302 0.858 6 H PHE 305 HN PHE 305 -11.217 13.075 2.201 7 HA PHE 305 HA PHE 305 -11.517 14.144 4.926 8 HB2 PHE 305 HB2 PHE 305 -12.086 11.615 4.472 9 HB3 PHE 305 HB1 PHE 305 -10.337 11.427 4.460 10 HD1 PHE 305 HD1 PHE 305 -9.077 11.495 6.473 11 HD2 PHE 305 HD2 PHE 305 -13.240 12.384 6.521 12 HE1 PHE 305 HE1 PHE 305 -9.077 11.353 8.930 13 HE2 PHE 305 HE2 PHE 305 -13.246 12.245 8.976 14 HZ PHE 305 HZ PHE 305 -11.162 11.729 10.184 15 HA PRO 306 HA PRO 306 -7.298 15.594 4.380 16 HB2 PRO 306 HB2 PRO 306 -6.869 15.126 7.268 17 HB3 PRO 306 HB1 PRO 306 -6.752 16.630 6.344 18 HG2 PRO 306 HG2 PRO 306 -8.779 16.223 8.013 19 HG3 PRO 306 HG1 PRO 306 -9.015 17.055 6.461 20 HD2 PRO 306 HD2 PRO 306 -9.665 14.229 7.202 21 HD3 PRO 306 HD1 PRO 306 -10.605 15.395 6.247 22 H ARG 307 HN ARG 307 -7.774 12.699 6.378 23 HA ARG 307 HA ARG 307 -5.077 11.754 5.724 24 HB2 ARG 307 HB2 ARG 307 -7.128 10.844 7.738 25 HB3 ARG 307 HB1 ARG 307 -5.692 9.900 7.370 26 HG2 ARG 307 HG2 ARG 307 -4.280 11.761 8.086 27 HG3 ARG 307 HG1 ARG 307 -5.720 12.713 8.450 28 HD2 ARG 307 HD2 ARG 307 -6.399 11.043 10.107 29 HD3 ARG 307 HD1 ARG 307 -4.956 10.098 9.745 30 HE ARG 307 HE ARG 307 -4.149 12.677 10.451 31 HH11 ARG 307 HH11 ARG 307 -5.650 9.900 11.990 32 HH12 ARG 307 HH12 ARG 307 -5.019 10.283 13.558 33 HH21 ARG 307 HH21 ARG 307 -3.335 13.159 12.511 34 HH22 ARG 307 HH22 ARG 307 -3.711 12.128 13.851 35 H ALA 308 HN ALA 308 -4.679 10.033 4.453 36 HA ALA 308 HA ALA 308 -6.979 8.550 3.355 37 HB1 ALA 308 HB1 ALA 308 -6.154 10.174 1.715 38 HB2 ALA 308 HB2 ALA 308 -5.893 8.514 1.178 39 HB3 ALA 308 HB3 ALA 308 -4.546 9.457 1.819 40 H LEU 309 HN LEU 309 -6.624 6.387 2.786 41 HA LEU 309 HA LEU 309 -4.394 5.129 4.204 42 HB2 LEU 309 HB2 LEU 309 -6.996 4.021 3.158 43 HB3 LEU 309 HB1 LEU 309 -5.737 3.026 3.860 44 HG LEU 309 HG LEU 309 -6.831 5.299 5.465 45 HD11 LEU 309 HD11 LEU 309 -8.595 3.837 6.335 46 HD12 LEU 309 HD12 LEU 309 -8.180 2.624 5.123 47 HD13 LEU 309 HD13 LEU 309 -8.820 4.190 4.621 48 HD21 LEU 309 HD21 LEU 309 -5.841 2.535 6.166 49 HD22 LEU 309 HD22 LEU 309 -6.351 3.770 7.316 50 HD23 LEU 309 HD23 LEU 309 -4.923 4.034 6.315 51 HA PRO 310 HA PRO 310 -2.555 4.477 0.104 52 HB2 PRO 310 HB2 PRO 310 -0.409 3.023 1.449 53 HB3 PRO 310 HB1 PRO 310 -0.342 4.536 0.549 54 HG2 PRO 310 HG2 PRO 310 -0.021 4.423 3.234 55 HG3 PRO 310 HG1 PRO 310 -0.692 5.832 2.389 56 HD2 PRO 310 HD2 PRO 310 -2.109 3.707 3.932 57 HD3 PRO 310 HD1 PRO 310 -2.433 5.450 3.830 58 H ALA 311 HN ALA 311 -1.637 2.546 -1.097 59 HA ALA 311 HA ALA 311 -3.527 0.333 -0.730 60 HB1 ALA 311 HB1 ALA 311 -3.695 1.465 -2.898 61 HB2 ALA 311 HB2 ALA 311 -3.146 -0.200 -3.088 62 HB3 ALA 311 HB3 ALA 311 -1.990 1.127 -3.199 63 H TRP 312 HN TRP 312 -0.419 1.352 -0.920 64 HA TRP 312 HA TRP 312 0.984 -1.132 -1.034 65 HB2 TRP 312 HB2 TRP 312 2.908 0.326 -1.111 66 HB3 TRP 312 HB1 TRP 312 1.601 1.091 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.360 3.530 -1.697 68 HE1 TRP 312 HE1 TRP 312 1.879 5.255 0.132 69 HE3 TRP 312 HE3 TRP 312 3.223 0.395 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.916 5.296 2.744 71 HZ3 TRP 312 HZ3 TRP 312 3.948 1.371 4.045 72 HH2 TRP 312 HH2 TRP 312 3.788 3.767 4.450 73 H ALA 313 HN ALA 313 -0.649 0.583 1.128 74 HA ALA 313 HA ALA 313 0.816 0.137 3.562 75 HB1 ALA 313 HB1 ALA 313 -0.234 2.119 3.757 76 HB2 ALA 313 HB2 ALA 313 -1.643 1.144 4.208 77 HB3 ALA 313 HB3 ALA 313 -1.443 1.694 2.522 78 H ARG 314 HN ARG 314 -0.509 -2.086 1.832 79 HA ARG 314 HA ARG 314 -1.858 -3.450 4.040 80 HB2 ARG 314 HB2 ARG 314 -2.720 -3.311 1.157 81 HB3 ARG 314 HB1 ARG 314 -3.262 -4.595 2.228 82 HG2 ARG 314 HG2 ARG 314 -4.257 -2.926 3.719 83 HG3 ARG 314 HG1 ARG 314 -3.725 -1.645 2.629 84 HD2 ARG 314 HD2 ARG 314 -5.095 -2.600 0.843 85 HD3 ARG 314 HD1 ARG 314 -5.620 -3.886 1.929 86 HE ARG 314 HE ARG 314 -6.201 -1.396 3.096 87 HH11 ARG 314 HH11 ARG 314 -7.302 -3.403 0.433 88 HH12 ARG 314 HH12 ARG 314 -8.911 -2.761 0.463 89 HH21 ARG 314 HH21 ARG 314 -9.482 -1.160 1.983 90 HH22 ARG 314 HH22 ARG 314 -8.313 -0.572 3.119 91 HA PRO 315 HA PRO 315 1.752 -6.142 3.096 92 HB2 PRO 315 HB2 PRO 315 0.991 -7.986 5.046 93 HB3 PRO 315 HB1 PRO 315 2.144 -6.664 5.272 94 HG2 PRO 315 HG2 PRO 315 -0.746 -6.786 5.971 95 HG3 PRO 315 HG1 PRO 315 0.590 -5.992 6.829 96 HD2 PRO 315 HD2 PRO 315 -1.140 -4.560 5.411 97 HD3 PRO 315 HD1 PRO 315 0.587 -4.154 5.409 98 H ASP 316 HN ASP 316 -1.516 -7.032 3.382 99 HA ASP 316 HA ASP 316 -1.191 -9.555 1.950 100 HB2 ASP 316 HB2 ASP 316 -3.575 -8.270 3.289 101 HB3 ASP 316 HB1 ASP 316 -3.692 -9.751 2.344 102 H TYR 317 HN TYR 317 -2.470 -6.325 1.492 103 HA TYR 317 HA TYR 317 -3.215 -5.141 -0.285 104 HB2 TYR 317 HB2 TYR 317 -1.021 -6.220 -1.225 105 HB3 TYR 317 HB1 TYR 317 -2.125 -7.172 -2.210 106 HD1 TYR 317 HD1 TYR 317 -0.697 -3.861 -1.634 107 HD2 TYR 317 HD2 TYR 317 -3.504 -6.091 -3.927 108 HE1 TYR 317 HE1 TYR 317 -0.834 -2.014 -3.252 109 HE2 TYR 317 HE2 TYR 317 -3.646 -4.250 -5.552 110 HH TYR 317 HH TYR 317 -1.443 -1.672 -5.609 111 H ASN 318 HN ASN 318 -5.290 -4.983 -0.657 112 HA ASN 318 HA ASN 318 -6.706 -7.181 -1.999 113 HB2 ASN 318 HB2 ASN 318 -7.092 -6.976 0.581 114 HB3 ASN 318 HB1 ASN 318 -8.082 -5.588 0.146 115 HD21 ASN 318 HD21 ASN 318 -7.742 -9.039 -0.032 116 HD22 ASN 318 HD22 ASN 318 -9.360 -9.379 -0.534 117 HA PRO 319 HA PRO 319 -7.574 -3.519 -4.603 118 HB2 PRO 319 HB2 PRO 319 -9.106 -5.466 -6.207 119 HB3 PRO 319 HB1 PRO 319 -7.787 -4.400 -6.701 120 HG2 PRO 319 HG2 PRO 319 -7.403 -7.023 -6.479 121 HG3 PRO 319 HG1 PRO 319 -6.145 -5.861 -6.012 122 HD2 PRO 319 HD2 PRO 319 -8.019 -7.407 -4.269 123 HD3 PRO 319 HD1 PRO 319 -6.292 -7.055 -4.045 124 HA PRO 320 HA PRO 320 -11.730 -2.742 -2.969 125 HB2 PRO 320 HB2 PRO 320 -11.777 -0.314 -4.614 126 HB3 PRO 320 HB1 PRO 320 -11.799 -0.469 -2.853 127 HG2 PRO 320 HG2 PRO 320 -9.661 0.494 -4.160 128 HG3 PRO 320 HG1 PRO 320 -9.513 -0.464 -2.673 129 HD2 PRO 320 HD2 PRO 320 -9.110 -1.320 -5.512 130 HD3 PRO 320 HD1 PRO 320 -8.167 -1.712 -4.064 131 H LEU 321 HN LEU 321 -13.196 -4.058 -3.803 132 HA LEU 321 HA LEU 321 -14.020 -3.738 -6.603 133 HB2 LEU 321 HB2 LEU 321 -15.104 -5.973 -6.329 134 HB3 LEU 321 HB1 LEU 321 -13.361 -5.983 -6.187 135 HG LEU 321 HG LEU 321 -14.951 -5.828 -3.667 136 HD11 LEU 321 HD11 LEU 321 -16.128 -7.543 -4.925 137 HD12 LEU 321 HD12 LEU 321 -15.189 -8.267 -3.619 138 HD13 LEU 321 HD13 LEU 321 -14.601 -8.351 -5.280 139 HD21 LEU 321 HD21 LEU 321 -12.512 -5.745 -3.599 140 HD22 LEU 321 HD22 LEU 321 -12.426 -7.280 -4.462 141 HD23 LEU 321 HD23 LEU 321 -13.113 -7.217 -2.839 142 H VAL 322 HN VAL 322 -15.889 -2.825 -7.076 143 HA VAL 322 HA VAL 322 -18.097 -2.918 -5.160 144 HB VAL 322 HB VAL 322 -18.613 -0.471 -5.696 145 HG11 VAL 322 HG11 VAL 322 -17.895 -1.219 -3.505 146 HG12 VAL 322 HG12 VAL 322 -17.175 0.346 -3.888 147 HG13 VAL 322 HG13 VAL 322 -16.207 -1.124 -4.005 148 HG21 VAL 322 HG21 VAL 322 -16.685 0.979 -6.190 149 HG22 VAL 322 HG22 VAL 322 -17.039 -0.114 -7.527 150 HG23 VAL 322 HG23 VAL 322 -15.684 -0.450 -6.450 151 H GLU 323 HN GLU 323 -19.852 -3.625 -6.125 152 HA GLU 323 HA GLU 323 -20.117 -3.331 -9.035 153 HB2 GLU 323 HB2 GLU 323 -21.303 -5.301 -7.084 154 HB3 GLU 323 HB1 GLU 323 -21.902 -5.139 -8.728 155 HG2 GLU 323 HG2 GLU 323 -19.690 -5.711 -9.594 156 HG3 GLU 323 HG1 GLU 323 -19.089 -5.873 -7.945 Start of MODEL 18 1 H1 GLY 304 HT1 GLY 304 -17.038 16.478 4.317 2 H2 GLY 304 HT2 GLY 304 -18.109 15.193 4.569 3 H3 GLY 304 HT3 GLY 304 -17.534 15.520 3.012 4 HA2 GLY 304 HA1 GLY 304 -15.281 14.957 3.695 5 HA3 GLY 304 HA2 GLY 304 -15.885 14.605 5.307 6 H PHE 305 HN PHE 305 -15.189 13.355 2.267 7 HA PHE 305 HA PHE 305 -16.545 10.836 2.939 8 HB2 PHE 305 HB2 PHE 305 -16.380 12.166 0.240 9 HB3 PHE 305 HB1 PHE 305 -16.725 10.453 0.423 10 HD1 PHE 305 HD1 PHE 305 -17.984 13.849 0.898 11 HD2 PHE 305 HD2 PHE 305 -18.833 9.701 1.342 12 HE1 PHE 305 HE1 PHE 305 -20.365 14.374 1.220 13 HE2 PHE 305 HE2 PHE 305 -21.217 10.220 1.665 14 HZ PHE 305 HZ PHE 305 -21.985 12.559 1.603 15 HA PRO 306 HA PRO 306 -12.411 9.668 0.725 16 HB2 PRO 306 HB2 PRO 306 -10.703 12.017 0.602 17 HB3 PRO 306 HB1 PRO 306 -11.258 10.985 -0.721 18 HG2 PRO 306 HG2 PRO 306 -12.086 13.541 -0.442 19 HG3 PRO 306 HG1 PRO 306 -13.106 12.271 -1.150 20 HD2 PRO 306 HD2 PRO 306 -13.143 13.374 1.637 21 HD3 PRO 306 HD1 PRO 306 -14.500 13.028 0.548 22 H ARG 307 HN ARG 307 -10.698 8.782 1.781 23 HA ARG 307 HA ARG 307 -9.788 10.060 4.275 24 HB2 ARG 307 HB2 ARG 307 -10.580 7.180 3.826 25 HB3 ARG 307 HB1 ARG 307 -9.590 7.684 5.189 26 HG2 ARG 307 HG2 ARG 307 -11.382 9.135 5.975 27 HG3 ARG 307 HG1 ARG 307 -12.375 8.666 4.593 28 HD2 ARG 307 HD2 ARG 307 -12.335 6.341 5.360 29 HD3 ARG 307 HD1 ARG 307 -11.348 6.814 6.742 30 HE ARG 307 HE ARG 307 -13.664 8.369 6.772 31 HH11 ARG 307 HH11 ARG 307 -12.801 4.988 7.184 32 HH12 ARG 307 HH12 ARG 307 -14.143 4.655 8.227 33 HH21 ARG 307 HH21 ARG 307 -15.412 7.907 8.137 34 HH22 ARG 307 HH22 ARG 307 -15.619 6.305 8.765 35 H ALA 308 HN ALA 308 -7.650 9.375 5.001 36 HA ALA 308 HA ALA 308 -5.868 8.959 2.730 37 HB1 ALA 308 HB1 ALA 308 -5.206 9.742 5.566 38 HB2 ALA 308 HB2 ALA 308 -5.450 10.857 4.220 39 HB3 ALA 308 HB3 ALA 308 -4.093 9.732 4.199 40 H LEU 309 HN LEU 309 -5.855 6.825 2.270 41 HA LEU 309 HA LEU 309 -4.489 5.067 4.159 42 HB2 LEU 309 HB2 LEU 309 -7.163 4.463 2.903 43 HB3 LEU 309 HB1 LEU 309 -6.098 3.198 3.482 44 HG LEU 309 HG LEU 309 -6.220 4.741 5.694 45 HD11 LEU 309 HD11 LEU 309 -8.916 5.013 4.375 46 HD12 LEU 309 HD12 LEU 309 -7.776 6.324 4.677 47 HD13 LEU 309 HD13 LEU 309 -8.516 5.471 6.031 48 HD21 LEU 309 HD21 LEU 309 -8.191 2.611 4.874 49 HD22 LEU 309 HD22 LEU 309 -7.883 3.141 6.528 50 HD23 LEU 309 HD23 LEU 309 -6.608 2.345 5.604 51 HA PRO 310 HA PRO 310 -2.538 4.484 0.081 52 HB2 PRO 310 HB2 PRO 310 -0.421 3.027 1.449 53 HB3 PRO 310 HB1 PRO 310 -0.339 4.560 0.586 54 HG2 PRO 310 HG2 PRO 310 -0.075 4.377 3.279 55 HG3 PRO 310 HG1 PRO 310 -0.707 5.812 2.449 56 HD2 PRO 310 HD2 PRO 310 -2.191 3.665 3.902 57 HD3 PRO 310 HD1 PRO 310 -2.487 5.416 3.845 58 H ALA 311 HN ALA 311 -1.624 2.548 -1.095 59 HA ALA 311 HA ALA 311 -3.526 0.343 -0.743 60 HB1 ALA 311 HB1 ALA 311 -1.965 1.124 -3.200 61 HB2 ALA 311 HB2 ALA 311 -3.669 1.477 -2.913 62 HB3 ALA 311 HB3 ALA 311 -3.132 -0.193 -3.096 63 H TRP 312 HN TRP 312 -0.413 1.351 -0.924 64 HA TRP 312 HA TRP 312 0.983 -1.138 -1.031 65 HB2 TRP 312 HB2 TRP 312 2.909 0.321 -1.110 66 HB3 TRP 312 HB1 TRP 312 1.602 1.082 -2.021 67 HD1 TRP 312 HD1 TRP 312 1.340 3.520 -1.690 68 HE1 TRP 312 HE1 TRP 312 1.859 5.247 0.138 69 HE3 TRP 312 HE3 TRP 312 3.245 0.393 1.904 70 HZ2 TRP 312 HZ2 TRP 312 2.911 5.291 2.743 71 HZ3 TRP 312 HZ3 TRP 312 3.975 1.372 4.034 72 HH2 TRP 312 HH2 TRP 312 3.802 3.767 4.443 73 H ALA 313 HN ALA 313 -0.651 0.576 1.134 74 HA ALA 313 HA ALA 313 0.821 0.119 3.562 75 HB1 ALA 313 HB1 ALA 313 -0.217 2.106 3.779 76 HB2 ALA 313 HB2 ALA 313 -1.635 1.139 4.213 77 HB3 ALA 313 HB3 ALA 313 -1.422 1.701 2.533 78 H ARG 314 HN ARG 314 -0.671 -1.999 1.771 79 HA ARG 314 HA ARG 314 -1.883 -3.458 3.987 80 HB2 ARG 314 HB2 ARG 314 -3.493 -2.408 2.185 81 HB3 ARG 314 HB1 ARG 314 -2.979 -3.783 1.222 82 HG2 ARG 314 HG2 ARG 314 -3.769 -5.303 2.970 83 HG3 ARG 314 HG1 ARG 314 -4.297 -3.918 3.927 84 HD2 ARG 314 HD2 ARG 314 -5.838 -3.274 2.140 85 HD3 ARG 314 HD1 ARG 314 -5.304 -4.652 1.179 86 HE ARG 314 HE ARG 314 -6.211 -5.553 3.687 87 HH11 ARG 314 HH11 ARG 314 -7.499 -4.232 0.697 88 HH12 ARG 314 HH12 ARG 314 -9.034 -5.012 0.882 89 HH21 ARG 314 HH21 ARG 314 -9.446 -6.329 2.697 90 HH22 ARG 314 HH22 ARG 314 -8.229 -6.563 3.906 91 HA PRO 315 HA PRO 315 1.549 -6.195 2.655 92 HB2 PRO 315 HB2 PRO 315 0.659 -8.226 4.371 93 HB3 PRO 315 HB1 PRO 315 1.932 -7.048 4.717 94 HG2 PRO 315 HG2 PRO 315 -0.926 -7.026 5.519 95 HG3 PRO 315 HG1 PRO 315 0.493 -6.397 6.377 96 HD2 PRO 315 HD2 PRO 315 -1.214 -4.745 5.177 97 HD3 PRO 315 HD1 PRO 315 0.530 -4.427 5.150 98 H ASP 316 HN ASP 316 -1.759 -6.950 2.764 99 HA ASP 316 HA ASP 316 -1.601 -9.419 1.276 100 HB2 ASP 316 HB2 ASP 316 -3.930 -7.749 2.221 101 HB3 ASP 316 HB1 ASP 316 -4.135 -9.213 1.265 102 H TYR 317 HN TYR 317 -1.158 -6.348 0.307 103 HA TYR 317 HA TYR 317 -2.601 -6.575 -2.231 104 HB2 TYR 317 HB2 TYR 317 -2.857 -4.473 -0.949 105 HB3 TYR 317 HB1 TYR 317 -1.122 -4.214 -1.029 106 HD1 TYR 317 HD1 TYR 317 -0.145 -3.149 -2.891 107 HD2 TYR 317 HD2 TYR 317 -4.208 -4.396 -3.090 108 HE1 TYR 317 HE1 TYR 317 -0.420 -1.888 -4.981 109 HE2 TYR 317 HE2 TYR 317 -4.497 -3.138 -5.185 110 HH TYR 317 HH TYR 317 -1.882 -1.894 -6.957 111 H ASN 318 HN ASN 318 -1.572 -7.421 -3.874 112 HA ASN 318 HA ASN 318 1.363 -7.262 -4.021 113 HB2 ASN 318 HB2 ASN 318 -0.587 -9.290 -5.115 114 HB3 ASN 318 HB1 ASN 318 1.091 -9.215 -5.641 115 HD21 ASN 318 HD21 ASN 318 -1.067 -9.946 -3.023 116 HD22 ASN 318 HD22 ASN 318 0.085 -10.771 -2.035 117 HA PRO 319 HA PRO 319 1.086 -4.705 -7.660 118 HB2 PRO 319 HB2 PRO 319 3.279 -5.516 -9.077 119 HB3 PRO 319 HB1 PRO 319 3.366 -4.465 -7.656 120 HG2 PRO 319 HG2 PRO 319 3.861 -7.401 -7.852 121 HG3 PRO 319 HG1 PRO 319 4.744 -6.170 -6.928 122 HD2 PRO 319 HD2 PRO 319 2.959 -7.830 -5.771 123 HD3 PRO 319 HD1 PRO 319 3.214 -6.166 -5.209 124 HA PRO 320 HA PRO 320 -0.963 -7.072 -10.843 125 HB2 PRO 320 HB2 PRO 320 -0.918 -5.332 -12.923 126 HB3 PRO 320 HB1 PRO 320 -1.960 -5.106 -11.510 127 HG2 PRO 320 HG2 PRO 320 0.644 -3.801 -12.151 128 HG3 PRO 320 HG1 PRO 320 -0.825 -3.095 -11.448 129 HD2 PRO 320 HD2 PRO 320 1.338 -3.799 -9.960 130 HD3 PRO 320 HD1 PRO 320 -0.321 -3.816 -9.335 131 H LEU 321 HN LEU 321 -0.716 -7.909 -13.052 132 HA LEU 321 HA LEU 321 2.086 -8.148 -13.921 133 HB2 LEU 321 HB2 LEU 321 0.060 -10.366 -13.631 134 HB3 LEU 321 HB1 LEU 321 1.560 -10.539 -14.518 135 HG LEU 321 HG LEU 321 2.608 -9.746 -12.209 136 HD11 LEU 321 HD11 LEU 321 0.479 -9.386 -11.090 137 HD12 LEU 321 HD12 LEU 321 1.381 -10.688 -10.315 138 HD13 LEU 321 HD13 LEU 321 0.027 -11.066 -11.380 139 HD21 LEU 321 HD21 LEU 321 2.896 -12.106 -11.621 140 HD22 LEU 321 HD22 LEU 321 3.127 -11.829 -13.348 141 HD23 LEU 321 HD23 LEU 321 1.623 -12.542 -12.763 142 H VAL 322 HN VAL 322 2.429 -8.488 -16.132 143 HA VAL 322 HA VAL 322 0.128 -7.801 -17.833 144 HB VAL 322 HB VAL 322 1.895 -7.031 -19.512 145 HG11 VAL 322 HG11 VAL 322 1.578 -5.518 -16.925 146 HG12 VAL 322 HG12 VAL 322 0.469 -5.491 -18.297 147 HG13 VAL 322 HG13 VAL 322 2.095 -4.826 -18.463 148 HG21 VAL 322 HG21 VAL 322 3.877 -8.036 -18.500 149 HG22 VAL 322 HG22 VAL 322 3.654 -7.056 -17.052 150 HG23 VAL 322 HG23 VAL 322 4.049 -6.283 -18.587 151 H GLU 323 HN GLU 323 -0.633 -9.370 -19.033 152 HA GLU 323 HA GLU 323 1.192 -11.484 -19.975 153 HB2 GLU 323 HB2 GLU 323 -0.773 -11.965 -18.265 154 HB3 GLU 323 HB1 GLU 323 -1.750 -11.965 -19.727 155 HG2 GLU 323 HG2 GLU 323 -0.350 -13.733 -20.666 156 HG3 GLU 323 HG1 GLU 323 0.635 -13.730 -19.205 Start of MODEL 19 1 H1 GLY 304 HT1 GLY 304 -19.005 13.841 10.545 2 H2 GLY 304 HT2 GLY 304 -17.667 13.852 11.582 3 H3 GLY 304 HT3 GLY 304 -18.939 12.772 11.855 4 HA2 GLY 304 HA1 GLY 304 -17.060 11.623 10.880 5 HA3 GLY 304 HA2 GLY 304 -18.451 11.605 9.807 6 H PHE 305 HN PHE 305 -15.181 12.317 10.104 7 HA PHE 305 HA PHE 305 -15.138 14.081 7.768 8 HB2 PHE 305 HB2 PHE 305 -13.014 13.329 9.783 9 HB3 PHE 305 HB1 PHE 305 -12.668 14.268 8.336 10 HD1 PHE 305 HD1 PHE 305 -14.257 14.279 11.623 11 HD2 PHE 305 HD2 PHE 305 -13.438 16.554 8.120 12 HE1 PHE 305 HE1 PHE 305 -14.877 16.337 12.820 13 HE2 PHE 305 HE2 PHE 305 -14.056 18.617 9.311 14 HZ PHE 305 HZ PHE 305 -14.777 18.510 11.664 15 HA PRO 306 HA PRO 306 -13.738 10.805 5.060 16 HB2 PRO 306 HB2 PRO 306 -11.875 12.533 3.631 17 HB3 PRO 306 HB1 PRO 306 -13.427 11.886 3.086 18 HG2 PRO 306 HG2 PRO 306 -13.063 14.512 3.579 19 HG3 PRO 306 HG1 PRO 306 -14.617 13.694 3.835 20 HD2 PRO 306 HD2 PRO 306 -12.524 14.434 5.847 21 HD3 PRO 306 HD1 PRO 306 -14.289 14.599 5.942 22 H ARG 307 HN ARG 307 -12.223 9.244 4.980 23 HA ARG 307 HA ARG 307 -9.517 9.843 5.977 24 HB2 ARG 307 HB2 ARG 307 -11.313 7.536 6.717 25 HB3 ARG 307 HB1 ARG 307 -9.573 7.489 6.965 26 HG2 ARG 307 HG2 ARG 307 -9.728 9.444 8.428 27 HG3 ARG 307 HG1 ARG 307 -11.473 9.491 8.177 28 HD2 ARG 307 HD2 ARG 307 -10.050 7.086 9.292 29 HD3 ARG 307 HD1 ARG 307 -10.663 8.387 10.312 30 HE ARG 307 HE ARG 307 -12.760 7.557 8.685 31 HH11 ARG 307 HH11 ARG 307 -10.796 6.176 11.248 32 HH12 ARG 307 HH12 ARG 307 -12.046 5.104 11.784 33 HH21 ARG 307 HH21 ARG 307 -14.380 6.143 9.402 34 HH22 ARG 307 HH22 ARG 307 -14.072 5.085 10.739 35 H ALA 308 HN ALA 308 -7.904 9.150 4.737 36 HA ALA 308 HA ALA 308 -8.461 7.114 2.679 37 HB1 ALA 308 HB1 ALA 308 -7.051 8.334 1.113 38 HB2 ALA 308 HB2 ALA 308 -6.779 9.592 2.318 39 HB3 ALA 308 HB3 ALA 308 -8.394 9.340 1.657 40 H LEU 309 HN LEU 309 -6.990 5.534 2.445 41 HA LEU 309 HA LEU 309 -4.449 5.760 3.911 42 HB2 LEU 309 HB2 LEU 309 -6.308 3.389 3.763 43 HB3 LEU 309 HB1 LEU 309 -4.658 3.283 4.341 44 HG LEU 309 HG LEU 309 -6.525 5.223 5.645 45 HD11 LEU 309 HD11 LEU 309 -6.439 2.258 6.188 46 HD12 LEU 309 HD12 LEU 309 -7.813 3.173 5.565 47 HD13 LEU 309 HD13 LEU 309 -7.233 3.460 7.205 48 HD21 LEU 309 HD21 LEU 309 -4.235 3.526 6.641 49 HD22 LEU 309 HD22 LEU 309 -5.161 4.669 7.612 50 HD23 LEU 309 HD23 LEU 309 -4.172 5.249 6.273 51 HA PRO 310 HA PRO 310 -2.537 4.484 0.097 52 HB2 PRO 310 HB2 PRO 310 -0.410 3.020 1.436 53 HB3 PRO 310 HB1 PRO 310 -0.336 4.565 0.594 54 HG2 PRO 310 HG2 PRO 310 -0.054 4.342 3.285 55 HG3 PRO 310 HG1 PRO 310 -0.689 5.788 2.479 56 HD2 PRO 310 HD2 PRO 310 -2.171 3.620 3.902 57 HD3 PRO 310 HD1 PRO 310 -2.460 5.370 3.883 58 H ALA 311 HN ALA 311 -1.627 2.548 -1.088 59 HA ALA 311 HA ALA 311 -3.528 0.343 -0.732 60 HB1 ALA 311 HB1 ALA 311 -3.142 -0.188 -3.089 61 HB2 ALA 311 HB2 ALA 311 -1.978 1.132 -3.195 62 HB3 ALA 311 HB3 ALA 311 -3.681 1.480 -2.899 63 H TRP 312 HN TRP 312 -0.415 1.352 -0.918 64 HA TRP 312 HA TRP 312 0.982 -1.136 -1.038 65 HB2 TRP 312 HB2 TRP 312 2.909 0.323 -1.110 66 HB3 TRP 312 HB1 TRP 312 1.602 1.084 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.352 3.521 -1.701 68 HE1 TRP 312 HE1 TRP 312 1.867 5.249 0.126 69 HE3 TRP 312 HE3 TRP 312 3.226 0.398 1.914 70 HZ2 TRP 312 HZ2 TRP 312 2.904 5.299 2.736 71 HZ3 TRP 312 HZ3 TRP 312 3.948 1.380 4.045 72 HH2 TRP 312 HH2 TRP 312 3.780 3.776 4.447 73 H ALA 313 HN ALA 313 -0.653 0.554 1.138 74 HA ALA 313 HA ALA 313 0.830 0.112 3.565 75 HB1 ALA 313 HB1 ALA 313 -1.421 1.674 2.528 76 HB2 ALA 313 HB2 ALA 313 -0.231 2.078 3.796 77 HB3 ALA 313 HB3 ALA 313 -1.652 1.100 4.198 78 H ARG 314 HN ARG 314 -0.271 -2.197 1.943 79 HA ARG 314 HA ARG 314 -1.773 -3.511 4.072 80 HB2 ARG 314 HB2 ARG 314 -2.362 -3.536 1.119 81 HB3 ARG 314 HB1 ARG 314 -2.932 -4.813 2.184 82 HG2 ARG 314 HG2 ARG 314 -4.143 -3.145 3.517 83 HG3 ARG 314 HG1 ARG 314 -3.591 -1.882 2.418 84 HD2 ARG 314 HD2 ARG 314 -5.161 -4.275 1.491 85 HD3 ARG 314 HD1 ARG 314 -5.932 -2.787 2.036 86 HE ARG 314 HE ARG 314 -3.979 -2.273 0.029 87 HH11 ARG 314 HH11 ARG 314 -7.272 -3.423 0.436 88 HH12 ARG 314 HH12 ARG 314 -7.759 -2.943 -1.155 89 HH21 ARG 314 HH21 ARG 314 -6.268 -1.942 -2.560 90 HH22 ARG 314 HH22 ARG 314 -4.638 -1.653 -2.049 91 HA PRO 315 HA PRO 315 1.988 -6.100 3.696 92 HB2 PRO 315 HB2 PRO 315 0.974 -7.964 5.517 93 HB3 PRO 315 HB1 PRO 315 2.062 -6.621 5.900 94 HG2 PRO 315 HG2 PRO 315 -0.892 -6.797 6.184 95 HG3 PRO 315 HG1 PRO 315 0.292 -5.947 7.197 96 HD2 PRO 315 HD2 PRO 315 -1.269 -4.600 5.514 97 HD3 PRO 315 HD1 PRO 315 0.424 -4.133 5.752 98 H ASP 316 HN ASP 316 -1.248 -7.112 3.434 99 HA ASP 316 HA ASP 316 -0.663 -9.695 2.253 100 HB2 ASP 316 HB2 ASP 316 -3.244 -8.230 2.814 101 HB3 ASP 316 HB1 ASP 316 -3.196 -9.774 1.970 102 H TYR 317 HN TYR 317 -0.375 -6.720 1.063 103 HA TYR 317 HA TYR 317 -1.414 -7.344 -1.615 104 HB2 TYR 317 HB2 TYR 317 -2.251 -5.255 -0.484 105 HB3 TYR 317 HB1 TYR 317 -0.604 -4.642 -0.507 106 HD1 TYR 317 HD1 TYR 317 0.311 -3.661 -2.467 107 HD2 TYR 317 HD2 TYR 317 -3.475 -5.596 -2.643 108 HE1 TYR 317 HE1 TYR 317 -0.068 -2.701 -4.697 109 HE2 TYR 317 HE2 TYR 317 -3.864 -4.643 -4.875 110 HH TYR 317 HH TYR 317 -1.412 -3.179 -6.704 111 H ASN 318 HN ASN 318 0.011 -7.892 -3.099 112 HA ASN 318 HA ASN 318 2.863 -7.503 -2.618 113 HB2 ASN 318 HB2 ASN 318 1.340 -9.213 -4.588 114 HB3 ASN 318 HB1 ASN 318 3.093 -9.042 -4.626 115 HD21 ASN 318 HD21 ASN 318 0.370 -10.326 -2.898 116 HD22 ASN 318 HD22 ASN 318 1.267 -11.367 -1.850 117 HA PRO 319 HA PRO 319 2.604 -3.914 -5.444 118 HB2 PRO 319 HB2 PRO 319 5.514 -3.773 -4.971 119 HB3 PRO 319 HB1 PRO 319 4.271 -2.544 -4.694 120 HG2 PRO 319 HG2 PRO 319 5.448 -3.785 -2.651 121 HG3 PRO 319 HG1 PRO 319 3.729 -3.348 -2.604 122 HD2 PRO 319 HD2 PRO 319 4.981 -6.016 -3.123 123 HD3 PRO 319 HD1 PRO 319 3.553 -5.602 -2.149 124 HA PRO 320 HA PRO 320 4.085 -5.861 -9.195 125 HB2 PRO 320 HB2 PRO 320 3.959 -3.766 -10.913 126 HB3 PRO 320 HB1 PRO 320 2.516 -4.598 -10.317 127 HG2 PRO 320 HG2 PRO 320 3.700 -2.013 -9.415 128 HG3 PRO 320 HG1 PRO 320 1.995 -2.448 -9.653 129 HD2 PRO 320 HD2 PRO 320 3.181 -2.392 -7.207 130 HD3 PRO 320 HD1 PRO 320 1.830 -3.466 -7.610 131 H LEU 321 HN LEU 321 5.735 -5.613 -10.908 132 HA LEU 321 HA LEU 321 8.209 -4.479 -9.803 133 HB2 LEU 321 HB2 LEU 321 7.737 -6.628 -11.869 134 HB3 LEU 321 HB1 LEU 321 9.322 -5.981 -11.495 135 HG LEU 321 HG LEU 321 8.653 -6.706 -9.031 136 HD11 LEU 321 HD11 LEU 321 7.389 -8.805 -9.047 137 HD12 LEU 321 HD12 LEU 321 7.052 -8.585 -10.763 138 HD13 LEU 321 HD13 LEU 321 6.406 -7.444 -9.585 139 HD21 LEU 321 HD21 LEU 321 9.810 -8.828 -9.428 140 HD22 LEU 321 HD22 LEU 321 10.606 -7.487 -10.250 141 HD23 LEU 321 HD23 LEU 321 9.602 -8.612 -11.166 142 H VAL 322 HN VAL 322 9.657 -3.314 -11.128 143 HA VAL 322 HA VAL 322 8.557 -2.275 -13.640 144 HB VAL 322 HB VAL 322 8.104 -0.651 -11.807 145 HG11 VAL 322 HG11 VAL 322 11.100 -0.382 -11.615 146 HG12 VAL 322 HG12 VAL 322 10.020 -1.013 -10.372 147 HG13 VAL 322 HG13 VAL 322 9.922 0.683 -10.847 148 HG21 VAL 322 HG21 VAL 322 10.026 0.331 -13.911 149 HG22 VAL 322 HG22 VAL 322 8.930 1.342 -12.970 150 HG23 VAL 322 HG23 VAL 322 8.281 0.142 -14.088 151 H GLU 323 HN GLU 323 9.948 -2.203 -15.281 152 HA GLU 323 HA GLU 323 12.748 -2.913 -14.764 153 HB2 GLU 323 HB2 GLU 323 11.082 -4.206 -16.368 154 HB3 GLU 323 HB1 GLU 323 11.544 -2.951 -17.506 155 HG2 GLU 323 HG2 GLU 323 13.603 -4.599 -16.078 156 HG3 GLU 323 HG1 GLU 323 12.823 -5.169 -17.551 Start of MODEL 20 1 H1 GLY 304 HT1 GLY 304 -2.695 15.089 -6.833 2 H2 GLY 304 HT2 GLY 304 -3.464 16.179 -7.871 3 H3 GLY 304 HT3 GLY 304 -2.344 15.072 -8.487 4 HA2 GLY 304 HA1 GLY 304 -4.586 14.362 -9.003 5 HA3 GLY 304 HA2 GLY 304 -3.786 13.228 -7.924 6 H PHE 305 HN PHE 305 -5.530 12.389 -6.904 7 HA PHE 305 HA PHE 305 -7.419 14.213 -5.605 8 HB2 PHE 305 HB2 PHE 305 -7.541 11.252 -6.197 9 HB3 PHE 305 HB1 PHE 305 -8.735 12.076 -5.200 10 HD1 PHE 305 HD1 PHE 305 -10.320 13.626 -6.180 11 HD2 PHE 305 HD2 PHE 305 -7.451 11.602 -8.584 12 HE1 PHE 305 HE1 PHE 305 -11.585 14.238 -8.198 13 HE2 PHE 305 HE2 PHE 305 -8.710 12.212 -10.607 14 HZ PHE 305 HZ PHE 305 -10.781 13.532 -10.416 15 HA PRO 306 HA PRO 306 -5.760 13.344 -1.541 16 HB2 PRO 306 HB2 PRO 306 -8.392 13.242 -0.288 17 HB3 PRO 306 HB1 PRO 306 -7.153 14.496 -0.163 18 HG2 PRO 306 HG2 PRO 306 -9.487 14.916 -1.442 19 HG3 PRO 306 HG1 PRO 306 -7.970 15.694 -1.938 20 HD2 PRO 306 HD2 PRO 306 -9.332 13.303 -3.120 21 HD3 PRO 306 HD1 PRO 306 -8.573 14.686 -3.933 22 H ARG 307 HN ARG 307 -5.249 11.671 -0.216 23 HA ARG 307 HA ARG 307 -6.917 9.245 -0.317 24 HB2 ARG 307 HB2 ARG 307 -3.928 9.465 -0.657 25 HB3 ARG 307 HB1 ARG 307 -4.710 7.959 -0.196 26 HG2 ARG 307 HG2 ARG 307 -6.004 7.992 -2.267 27 HG3 ARG 307 HG1 ARG 307 -5.231 9.511 -2.727 28 HD2 ARG 307 HD2 ARG 307 -3.051 8.396 -2.721 29 HD3 ARG 307 HD1 ARG 307 -3.827 6.879 -2.267 30 HE ARG 307 HE ARG 307 -5.050 7.783 -4.601 31 HH11 ARG 307 HH11 ARG 307 -1.875 6.640 -3.625 32 HH12 ARG 307 HH12 ARG 307 -1.493 6.016 -5.195 33 HH21 ARG 307 HH21 ARG 307 -4.525 6.962 -6.646 34 HH22 ARG 307 HH22 ARG 307 -2.992 6.200 -6.903 35 H ALA 308 HN ALA 308 -7.220 8.195 1.566 36 HA ALA 308 HA ALA 308 -6.117 9.435 3.982 37 HB1 ALA 308 HB1 ALA 308 -7.941 8.261 5.162 38 HB2 ALA 308 HB2 ALA 308 -8.477 7.591 3.620 39 HB3 ALA 308 HB3 ALA 308 -8.526 9.333 3.891 40 H LEU 309 HN LEU 309 -6.515 6.265 2.435 41 HA LEU 309 HA LEU 309 -4.394 5.212 4.183 42 HB2 LEU 309 HB2 LEU 309 -6.938 3.856 3.311 43 HB3 LEU 309 HB1 LEU 309 -5.561 2.966 3.927 44 HG LEU 309 HG LEU 309 -5.828 4.631 5.971 45 HD11 LEU 309 HD11 LEU 309 -8.611 4.508 4.819 46 HD12 LEU 309 HD12 LEU 309 -7.620 5.951 5.013 47 HD13 LEU 309 HD13 LEU 309 -8.197 5.081 6.434 48 HD21 LEU 309 HD21 LEU 309 -5.932 2.210 6.113 49 HD22 LEU 309 HD22 LEU 309 -7.584 2.226 5.495 50 HD23 LEU 309 HD23 LEU 309 -7.225 2.938 7.068 51 HA PRO 310 HA PRO 310 -2.557 4.472 0.117 52 HB2 PRO 310 HB2 PRO 310 -0.413 3.016 1.464 53 HB3 PRO 310 HB1 PRO 310 -0.343 4.528 0.560 54 HG2 PRO 310 HG2 PRO 310 -0.025 4.421 3.244 55 HG3 PRO 310 HG1 PRO 310 -0.695 5.827 2.396 56 HD2 PRO 310 HD2 PRO 310 -2.112 3.705 3.944 57 HD3 PRO 310 HD1 PRO 310 -2.438 5.446 3.838 58 H ALA 311 HN ALA 311 -1.631 2.546 -1.088 59 HA ALA 311 HA ALA 311 -3.526 0.334 -0.738 60 HB1 ALA 311 HB1 ALA 311 -3.690 1.472 -2.901 61 HB2 ALA 311 HB2 ALA 311 -3.135 -0.189 -3.098 62 HB3 ALA 311 HB3 ALA 311 -1.983 1.142 -3.199 63 H TRP 312 HN TRP 312 -0.417 1.354 -0.922 64 HA TRP 312 HA TRP 312 0.983 -1.133 -1.036 65 HB2 TRP 312 HB2 TRP 312 2.912 0.325 -1.103 66 HB3 TRP 312 HB1 TRP 312 1.608 1.086 -2.022 67 HD1 TRP 312 HD1 TRP 312 1.353 3.525 -1.695 68 HE1 TRP 312 HE1 TRP 312 1.870 5.252 0.134 69 HE3 TRP 312 HE3 TRP 312 3.230 0.394 1.911 70 HZ2 TRP 312 HZ2 TRP 312 2.911 5.296 2.744 71 HZ3 TRP 312 HZ3 TRP 312 3.956 1.373 4.043 72 HH2 TRP 312 HH2 TRP 312 3.789 3.768 4.449 73 H ALA 313 HN ALA 313 -0.648 0.591 1.126 74 HA ALA 313 HA ALA 313 0.811 0.120 3.554 75 HB1 ALA 313 HB1 ALA 313 -1.444 1.697 2.539 76 HB2 ALA 313 HB2 ALA 313 -0.229 2.106 3.780 77 HB3 ALA 313 HB3 ALA 313 -1.641 1.132 4.215 78 H ARG 314 HN ARG 314 -0.903 -1.850 1.691 79 HA ARG 314 HA ARG 314 -1.923 -3.451 3.915 80 HB2 ARG 314 HB2 ARG 314 -3.312 -2.842 1.311 81 HB3 ARG 314 HB1 ARG 314 -3.734 -4.243 2.284 82 HG2 ARG 314 HG2 ARG 314 -4.279 -2.760 4.164 83 HG3 ARG 314 HG1 ARG 314 -3.886 -1.364 3.160 84 HD2 ARG 314 HD2 ARG 314 -5.969 -3.390 2.385 85 HD3 ARG 314 HD1 ARG 314 -6.342 -1.972 3.360 86 HE ARG 314 HE ARG 314 -4.982 -1.193 1.011 87 HH11 ARG 314 HH11 ARG 314 -8.134 -2.351 2.039 88 HH12 ARG 314 HH12 ARG 314 -8.970 -1.589 0.728 89 HH21 ARG 314 HH21 ARG 314 -7.816 -0.373 -0.819 90 HH22 ARG 314 HH22 ARG 314 -6.097 -0.203 -0.696 91 HA PRO 315 HA PRO 315 1.308 -6.113 1.992 92 HB2 PRO 315 HB2 PRO 315 0.527 -8.258 3.644 93 HB3 PRO 315 HB1 PRO 315 1.899 -7.171 3.899 94 HG2 PRO 315 HG2 PRO 315 -0.818 -7.086 5.084 95 HG3 PRO 315 HG1 PRO 315 0.732 -6.565 5.772 96 HD2 PRO 315 HD2 PRO 315 -1.049 -4.780 4.936 97 HD3 PRO 315 HD1 PRO 315 0.686 -4.523 4.671 98 H ASP 316 HN ASP 316 -1.988 -6.804 2.377 99 HA ASP 316 HA ASP 316 -2.002 -9.113 0.613 100 HB2 ASP 316 HB2 ASP 316 -4.169 -7.702 2.169 101 HB3 ASP 316 HB1 ASP 316 -4.513 -9.020 1.054 102 H TYR 317 HN TYR 317 -1.164 -6.577 -0.529 103 HA TYR 317 HA TYR 317 -3.346 -5.707 -2.220 104 HB2 TYR 317 HB2 TYR 317 -1.887 -3.939 -2.959 105 HB3 TYR 317 HB1 TYR 317 -1.777 -4.050 -1.211 106 HD1 TYR 317 HD1 TYR 317 0.030 -4.041 -4.297 107 HD2 TYR 317 HD2 TYR 317 0.280 -5.233 -0.220 108 HE1 TYR 317 HE1 TYR 317 2.477 -4.156 -4.487 109 HE2 TYR 317 HE2 TYR 317 2.729 -5.352 -0.400 110 HH TYR 317 HH TYR 317 4.446 -4.052 -3.022 111 H ASN 318 HN ASN 318 -3.742 -6.467 -4.128 112 HA ASN 318 HA ASN 318 -2.003 -8.408 -5.379 113 HB2 ASN 318 HB2 ASN 318 -4.754 -7.373 -6.071 114 HB3 ASN 318 HB1 ASN 318 -3.892 -8.533 -7.077 115 HD21 ASN 318 HD21 ASN 318 -5.505 -8.001 -4.048 116 HD22 ASN 318 HD22 ASN 318 -5.648 -9.663 -3.600 117 HA PRO 319 HA PRO 319 -0.023 -5.761 -8.380 118 HB2 PRO 319 HB2 PRO 319 -0.582 -7.707 -10.527 119 HB3 PRO 319 HB1 PRO 319 0.973 -7.135 -9.911 120 HG2 PRO 319 HG2 PRO 319 0.136 -9.604 -9.390 121 HG3 PRO 319 HG1 PRO 319 1.010 -8.652 -8.172 122 HD2 PRO 319 HD2 PRO 319 -1.926 -9.191 -8.388 123 HD3 PRO 319 HD1 PRO 319 -0.878 -9.194 -6.956 124 HA PRO 320 HA PRO 320 -3.509 -3.761 -10.467 125 HB2 PRO 320 HB2 PRO 320 -1.721 -1.698 -11.440 126 HB3 PRO 320 HB1 PRO 320 -2.950 -1.584 -10.175 127 HG2 PRO 320 HG2 PRO 320 -0.282 -1.420 -9.675 128 HG3 PRO 320 HG1 PRO 320 -1.471 -2.008 -8.496 129 HD2 PRO 320 HD2 PRO 320 0.386 -3.575 -10.242 130 HD3 PRO 320 HD1 PRO 320 -0.074 -3.836 -8.550 131 H LEU 321 HN LEU 321 -4.154 -4.831 -12.205 132 HA LEU 321 HA LEU 321 -2.695 -4.433 -14.729 133 HB2 LEU 321 HB2 LEU 321 -3.815 -6.986 -13.609 134 HB3 LEU 321 HB1 LEU 321 -3.641 -6.769 -15.339 135 HG LEU 321 HG LEU 321 -1.152 -6.166 -14.690 136 HD11 LEU 321 HD11 LEU 321 -1.490 -6.271 -12.277 137 HD12 LEU 321 HD12 LEU 321 -0.347 -7.503 -12.814 138 HD13 LEU 321 HD13 LEU 321 -2.005 -7.951 -12.414 139 HD21 LEU 321 HD21 LEU 321 -1.814 -7.985 -16.155 140 HD22 LEU 321 HD22 LEU 321 -2.237 -8.977 -14.760 141 HD23 LEU 321 HD23 LEU 321 -0.558 -8.518 -15.037 142 H VAL 322 HN VAL 322 -3.886 -3.700 -16.358 143 HA VAL 322 HA VAL 322 -6.806 -3.986 -16.250 144 HB VAL 322 HB VAL 322 -6.969 -1.630 -17.236 145 HG11 VAL 322 HG11 VAL 322 -6.992 -0.587 -15.016 146 HG12 VAL 322 HG12 VAL 322 -6.123 -1.976 -14.365 147 HG13 VAL 322 HG13 VAL 322 -7.749 -2.179 -15.013 148 HG21 VAL 322 HG21 VAL 322 -4.604 -1.243 -17.725 149 HG22 VAL 322 HG22 VAL 322 -4.216 -1.370 -16.010 150 HG23 VAL 322 HG23 VAL 322 -5.212 -0.037 -16.591 151 H GLU 323 HN GLU 323 -7.640 -4.774 -18.045 152 HA GLU 323 HA GLU 323 -6.203 -4.403 -20.587 153 HB2 GLU 323 HB2 GLU 323 -7.396 -6.939 -19.474 154 HB3 GLU 323 HB1 GLU 323 -7.067 -6.735 -21.189 155 HG2 GLU 323 HG2 GLU 323 -4.702 -6.376 -20.693 156 HG3 GLU 323 HG1 GLU 323 -5.032 -6.578 -18.974 Start of MODEL 21 1 H1 GLY 304 HT1 GLY 304 -15.376 15.525 -0.434 2 H2 GLY 304 HT2 GLY 304 -15.315 15.725 1.244 3 H3 GLY 304 HT3 GLY 304 -15.642 14.202 0.586 4 HA2 GLY 304 HA1 GLY 304 -13.088 15.695 0.329 5 HA3 GLY 304 HA2 GLY 304 -13.366 14.320 1.387 6 H PHE 305 HN PHE 305 -11.702 13.151 0.387 7 HA PHE 305 HA PHE 305 -12.097 12.395 -2.413 8 HB2 PHE 305 HB2 PHE 305 -9.755 12.078 -0.533 9 HB3 PHE 305 HB1 PHE 305 -9.807 11.323 -2.121 10 HD1 PHE 305 HD1 PHE 305 -9.619 12.647 -4.137 11 HD2 PHE 305 HD2 PHE 305 -9.499 14.473 -0.294 12 HE1 PHE 305 HE1 PHE 305 -8.733 14.708 -5.148 13 HE2 PHE 305 HE2 PHE 305 -8.615 16.536 -1.299 14 HZ PHE 305 HZ PHE 305 -8.232 16.657 -3.728 15 HA PRO 306 HA PRO 306 -13.567 8.312 -1.330 16 HB2 PRO 306 HB2 PRO 306 -12.085 7.012 -3.480 17 HB3 PRO 306 HB1 PRO 306 -13.822 7.309 -3.352 18 HG2 PRO 306 HG2 PRO 306 -12.285 8.589 -5.155 19 HG3 PRO 306 HG1 PRO 306 -13.707 9.340 -4.406 20 HD2 PRO 306 HD2 PRO 306 -10.812 9.699 -3.724 21 HD3 PRO 306 HD1 PRO 306 -12.095 10.917 -3.876 22 H ARG 307 HN ARG 307 -10.099 8.538 -1.976 23 HA ARG 307 HA ARG 307 -9.571 6.133 -0.392 24 HB2 ARG 307 HB2 ARG 307 -7.842 7.835 -2.182 25 HB3 ARG 307 HB1 ARG 307 -7.164 6.605 -1.125 26 HG2 ARG 307 HG2 ARG 307 -8.514 4.899 -2.258 27 HG3 ARG 307 HG1 ARG 307 -9.163 6.141 -3.331 28 HD2 ARG 307 HD2 ARG 307 -6.908 6.608 -4.153 29 HD3 ARG 307 HD1 ARG 307 -6.256 5.377 -3.074 30 HE ARG 307 HE ARG 307 -8.248 4.254 -4.729 31 HH11 ARG 307 HH11 ARG 307 -4.933 5.402 -4.902 32 HH12 ARG 307 HH12 ARG 307 -4.521 4.362 -6.225 33 HH21 ARG 307 HH21 ARG 307 -7.686 2.901 -6.459 34 HH22 ARG 307 HH22 ARG 307 -6.079 2.948 -7.105 35 H ALA 308 HN ALA 308 -8.430 6.124 1.497 36 HA ALA 308 HA ALA 308 -7.747 8.738 2.675 37 HB1 ALA 308 HB1 ALA 308 -9.766 8.045 3.733 38 HB2 ALA 308 HB2 ALA 308 -8.454 7.777 4.881 39 HB3 ALA 308 HB3 ALA 308 -9.142 6.418 3.994 40 H LEU 309 HN LEU 309 -7.142 5.237 2.750 41 HA LEU 309 HA LEU 309 -4.484 5.753 3.902 42 HB2 LEU 309 HB2 LEU 309 -6.226 3.294 3.923 43 HB3 LEU 309 HB1 LEU 309 -4.533 3.251 4.376 44 HG LEU 309 HG LEU 309 -5.285 5.165 6.050 45 HD11 LEU 309 HD11 LEU 309 -7.530 4.710 6.942 46 HD12 LEU 309 HD12 LEU 309 -7.824 3.601 5.603 47 HD13 LEU 309 HD13 LEU 309 -7.577 5.318 5.288 48 HD21 LEU 309 HD21 LEU 309 -5.624 3.434 7.753 49 HD22 LEU 309 HD22 LEU 309 -4.263 3.061 6.695 50 HD23 LEU 309 HD23 LEU 309 -5.803 2.226 6.481 51 HA PRO 310 HA PRO 310 -2.549 4.479 0.101 52 HB2 PRO 310 HB2 PRO 310 -0.411 3.022 1.446 53 HB3 PRO 310 HB1 PRO 310 -0.340 4.546 0.565 54 HG2 PRO 310 HG2 PRO 310 -0.036 4.395 3.254 55 HG3 PRO 310 HG1 PRO 310 -0.686 5.818 2.418 56 HD2 PRO 310 HD2 PRO 310 -2.137 3.693 3.927 57 HD3 PRO 310 HD1 PRO 310 -2.446 5.436 3.841 58 H ALA 311 HN ALA 311 -1.633 2.547 -1.095 59 HA ALA 311 HA ALA 311 -3.526 0.336 -0.733 60 HB1 ALA 311 HB1 ALA 311 -3.688 1.470 -2.900 61 HB2 ALA 311 HB2 ALA 311 -3.140 -0.197 -3.090 62 HB3 ALA 311 HB3 ALA 311 -1.983 1.130 -3.197 63 H TRP 312 HN TRP 312 -0.417 1.353 -0.921 64 HA TRP 312 HA TRP 312 0.984 -1.134 -1.034 65 HB2 TRP 312 HB2 TRP 312 2.908 0.326 -1.115 66 HB3 TRP 312 HB1 TRP 312 1.599 1.091 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.357 3.529 -1.696 68 HE1 TRP 312 HE1 TRP 312 1.875 5.253 0.134 69 HE3 TRP 312 HE3 TRP 312 3.229 0.394 1.910 70 HZ2 TRP 312 HZ2 TRP 312 2.913 5.295 2.744 71 HZ3 TRP 312 HZ3 TRP 312 3.954 1.372 4.042 72 HH2 TRP 312 HH2 TRP 312 3.789 3.766 4.449 73 H ALA 313 HN ALA 313 -0.652 0.574 1.129 74 HA ALA 313 HA ALA 313 0.816 0.131 3.566 75 HB1 ALA 313 HB1 ALA 313 -1.646 1.138 4.206 76 HB2 ALA 313 HB2 ALA 313 -1.442 1.689 2.521 77 HB3 ALA 313 HB3 ALA 313 -0.233 2.112 3.761 78 H ARG 314 HN ARG 314 -0.159 -2.216 2.021 79 HA ARG 314 HA ARG 314 -1.790 -3.478 4.087 80 HB2 ARG 314 HB2 ARG 314 -2.152 -3.625 1.103 81 HB3 ARG 314 HB1 ARG 314 -2.776 -4.877 2.168 82 HG2 ARG 314 HG2 ARG 314 -4.142 -3.222 3.327 83 HG3 ARG 314 HG1 ARG 314 -3.503 -1.955 2.277 84 HD2 ARG 314 HD2 ARG 314 -4.451 -3.097 0.330 85 HD3 ARG 314 HD1 ARG 314 -5.090 -4.359 1.382 86 HE ARG 314 HE ARG 314 -6.058 -1.918 2.313 87 HH11 ARG 314 HH11 ARG 314 -6.409 -3.915 -0.555 88 HH12 ARG 314 HH12 ARG 314 -8.009 -3.343 -0.897 89 HH21 ARG 314 HH21 ARG 314 -8.992 -1.799 0.461 90 HH22 ARG 314 HH22 ARG 314 -8.152 -1.185 1.846 91 HA PRO 315 HA PRO 315 2.047 -5.992 4.078 92 HB2 PRO 315 HB2 PRO 315 0.971 -7.778 5.937 93 HB3 PRO 315 HB1 PRO 315 1.996 -6.387 6.311 94 HG2 PRO 315 HG2 PRO 315 -0.966 -6.632 6.416 95 HG3 PRO 315 HG1 PRO 315 0.128 -5.705 7.462 96 HD2 PRO 315 HD2 PRO 315 -1.346 -4.478 5.621 97 HD3 PRO 315 HD1 PRO 315 0.319 -3.961 5.941 98 H ASP 316 HN ASP 316 -1.149 -7.091 3.691 99 HA ASP 316 HA ASP 316 -0.441 -9.716 2.683 100 HB2 ASP 316 HB2 ASP 316 -3.088 -8.300 3.015 101 HB3 ASP 316 HB1 ASP 316 -2.945 -9.893 2.281 102 H TYR 317 HN TYR 317 -0.493 -6.671 1.371 103 HA TYR 317 HA TYR 317 -1.278 -7.534 -1.316 104 HB2 TYR 317 HB2 TYR 317 -2.274 -5.447 -0.352 105 HB3 TYR 317 HB1 TYR 317 -0.665 -4.741 -0.309 106 HD1 TYR 317 HD1 TYR 317 -3.347 -5.947 -2.559 107 HD2 TYR 317 HD2 TYR 317 0.309 -3.793 -2.255 108 HE1 TYR 317 HE1 TYR 317 -3.655 -5.110 -4.851 109 HE2 TYR 317 HE2 TYR 317 0.013 -2.948 -4.544 110 HH TYR 317 HH TYR 317 -1.181 -3.577 -6.599 111 H ASN 318 HN ASN 318 0.259 -8.237 -2.599 112 HA ASN 318 HA ASN 318 3.017 -7.273 -2.253 113 HB2 ASN 318 HB2 ASN 318 2.363 -9.792 -2.029 114 HB3 ASN 318 HB1 ASN 318 2.305 -9.754 -3.788 115 HD21 ASN 318 HD21 ASN 318 4.206 -9.437 -4.949 116 HD22 ASN 318 HD22 ASN 318 5.764 -9.638 -4.231 117 HA PRO 319 HA PRO 319 2.049 -5.164 -6.206 118 HB2 PRO 319 HB2 PRO 319 4.806 -4.153 -5.933 119 HB3 PRO 319 HB1 PRO 319 3.294 -3.253 -6.100 120 HG2 PRO 319 HG2 PRO 319 4.602 -3.302 -3.781 121 HG3 PRO 319 HG1 PRO 319 2.829 -3.320 -3.844 122 HD2 PRO 319 HD2 PRO 319 4.718 -5.588 -3.360 123 HD3 PRO 319 HD1 PRO 319 3.180 -5.204 -2.560 124 HA PRO 320 HA PRO 320 4.197 -8.151 -8.853 125 HB2 PRO 320 HB2 PRO 320 3.196 -6.607 -11.143 126 HB3 PRO 320 HB1 PRO 320 2.841 -8.276 -10.679 127 HG2 PRO 320 HG2 PRO 320 1.000 -6.339 -10.467 128 HG3 PRO 320 HG1 PRO 320 1.094 -7.685 -9.314 129 HD2 PRO 320 HD2 PRO 320 2.057 -4.869 -9.002 130 HD3 PRO 320 HD1 PRO 320 1.225 -5.919 -7.841 131 H LEU 321 HN LEU 321 6.315 -7.918 -8.877 132 HA LEU 321 HA LEU 321 7.548 -5.533 -10.058 133 HB2 LEU 321 HB2 LEU 321 8.687 -7.742 -8.345 134 HB3 LEU 321 HB1 LEU 321 9.660 -6.473 -9.061 135 HG LEU 321 HG LEU 321 7.360 -5.695 -7.320 136 HD11 LEU 321 HD11 LEU 321 8.797 -5.837 -5.341 137 HD12 LEU 321 HD12 LEU 321 10.035 -6.645 -6.303 138 HD13 LEU 321 HD13 LEU 321 8.476 -7.427 -6.032 139 HD21 LEU 321 HD21 LEU 321 10.116 -4.551 -7.773 140 HD22 LEU 321 HD22 LEU 321 8.856 -3.839 -6.765 141 HD23 LEU 321 HD23 LEU 321 8.620 -3.972 -8.507 142 H VAL 322 HN VAL 322 8.508 -5.568 -11.975 143 HA VAL 322 HA VAL 322 9.446 -8.092 -13.110 144 HB VAL 322 HB VAL 322 8.461 -7.403 -15.369 145 HG11 VAL 322 HG11 VAL 322 7.685 -9.333 -14.129 146 HG12 VAL 322 HG12 VAL 322 6.325 -8.512 -14.897 147 HG13 VAL 322 HG13 VAL 322 6.614 -8.312 -13.168 148 HG21 VAL 322 HG21 VAL 322 7.751 -5.130 -14.816 149 HG22 VAL 322 HG22 VAL 322 6.633 -5.760 -13.607 150 HG23 VAL 322 HG23 VAL 322 6.371 -6.109 -15.314 151 H GLU 323 HN GLU 323 11.264 -7.938 -14.284 152 HA GLU 323 HA GLU 323 12.473 -5.279 -14.539 153 HB2 GLU 323 HB2 GLU 323 13.653 -8.054 -14.473 154 HB3 GLU 323 HB1 GLU 323 14.593 -6.649 -14.956 155 HG2 GLU 323 HG2 GLU 323 14.187 -5.625 -12.775 156 HG3 GLU 323 HG1 GLU 323 13.238 -7.030 -12.293 Start of MODEL 22 1 H1 GLY 304 HT1 GLY 304 -12.443 4.011 8.136 2 H2 GLY 304 HT2 GLY 304 -11.152 3.479 9.091 3 H3 GLY 304 HT3 GLY 304 -11.844 2.440 7.947 4 HA2 GLY 304 HA1 GLY 304 -10.355 4.940 7.351 5 HA3 GLY 304 HA2 GLY 304 -9.730 3.309 7.157 6 H PHE 305 HN PHE 305 -10.289 5.592 5.260 7 HA PHE 305 HA PHE 305 -12.206 4.327 3.445 8 HB2 PHE 305 HB2 PHE 305 -10.957 7.079 3.473 9 HB3 PHE 305 HB1 PHE 305 -11.951 6.490 2.145 10 HD1 PHE 305 HD1 PHE 305 -11.937 7.585 5.638 11 HD2 PHE 305 HD2 PHE 305 -14.334 6.251 2.385 12 HE1 PHE 305 HE1 PHE 305 -13.957 8.334 6.826 13 HE2 PHE 305 HE2 PHE 305 -16.359 6.999 3.566 14 HZ PHE 305 HZ PHE 305 -16.173 8.042 5.789 15 HA PRO 306 HA PRO 306 -8.978 2.875 0.706 16 HB2 PRO 306 HB2 PRO 306 -10.489 3.549 -1.699 17 HB3 PRO 306 HB1 PRO 306 -10.135 1.956 -1.020 18 HG2 PRO 306 HG2 PRO 306 -12.625 2.976 -1.029 19 HG3 PRO 306 HG1 PRO 306 -12.034 1.916 0.268 20 HD2 PRO 306 HD2 PRO 306 -12.283 4.902 0.246 21 HD3 PRO 306 HD1 PRO 306 -12.718 3.742 1.518 22 H ARG 307 HN ARG 307 -10.270 6.069 0.121 23 HA ARG 307 HA ARG 307 -8.050 6.816 -1.619 24 HB2 ARG 307 HB2 ARG 307 -10.564 8.235 -0.762 25 HB3 ARG 307 HB1 ARG 307 -9.280 9.063 -1.630 26 HG2 ARG 307 HG2 ARG 307 -9.522 7.469 -3.483 27 HG3 ARG 307 HG1 ARG 307 -10.841 6.682 -2.614 28 HD2 ARG 307 HD2 ARG 307 -12.115 8.770 -2.659 29 HD3 ARG 307 HD1 ARG 307 -10.795 9.557 -3.524 30 HE ARG 307 HE ARG 307 -11.568 7.293 -4.973 31 HH11 ARG 307 HH11 ARG 307 -12.893 10.429 -4.112 32 HH12 ARG 307 HH12 ARG 307 -13.885 10.527 -5.530 33 HH21 ARG 307 HH21 ARG 307 -12.873 7.442 -6.819 34 HH22 ARG 307 HH22 ARG 307 -13.873 8.836 -7.061 35 H ALA 308 HN ALA 308 -8.769 6.834 1.690 36 HA ALA 308 HA ALA 308 -7.104 9.154 2.303 37 HB1 ALA 308 HB1 ALA 308 -9.146 8.960 3.560 38 HB2 ALA 308 HB2 ALA 308 -7.777 8.722 4.645 39 HB3 ALA 308 HB3 ALA 308 -8.712 7.335 4.088 40 H LEU 309 HN LEU 309 -7.117 5.633 2.773 41 HA LEU 309 HA LEU 309 -4.430 5.747 3.922 42 HB2 LEU 309 HB2 LEU 309 -6.417 3.493 3.663 43 HB3 LEU 309 HB1 LEU 309 -4.788 3.270 4.267 44 HG LEU 309 HG LEU 309 -5.569 5.202 5.943 45 HD11 LEU 309 HD11 LEU 309 -8.114 3.714 5.307 46 HD12 LEU 309 HD12 LEU 309 -7.794 5.409 4.942 47 HD13 LEU 309 HD13 LEU 309 -7.880 4.871 6.618 48 HD21 LEU 309 HD21 LEU 309 -6.110 3.424 7.549 49 HD22 LEU 309 HD22 LEU 309 -4.671 3.049 6.600 50 HD23 LEU 309 HD23 LEU 309 -6.206 2.267 6.220 51 HA PRO 310 HA PRO 310 -2.529 4.489 0.090 52 HB2 PRO 310 HB2 PRO 310 -0.407 3.024 1.433 53 HB3 PRO 310 HB1 PRO 310 -0.332 4.575 0.602 54 HG2 PRO 310 HG2 PRO 310 -0.059 4.334 3.291 55 HG3 PRO 310 HG1 PRO 310 -0.693 5.785 2.494 56 HD2 PRO 310 HD2 PRO 310 -2.180 3.596 3.884 57 HD3 PRO 310 HD1 PRO 310 -2.465 5.347 3.897 58 H ALA 311 HN ALA 311 -1.625 2.549 -1.089 59 HA ALA 311 HA ALA 311 -3.526 0.346 -0.727 60 HB1 ALA 311 HB1 ALA 311 -3.685 1.476 -2.895 61 HB2 ALA 311 HB2 ALA 311 -3.143 -0.192 -3.082 62 HB3 ALA 311 HB3 ALA 311 -1.981 1.131 -3.194 63 H TRP 312 HN TRP 312 -0.415 1.354 -0.916 64 HA TRP 312 HA TRP 312 0.982 -1.135 -1.037 65 HB2 TRP 312 HB2 TRP 312 2.911 0.324 -1.111 66 HB3 TRP 312 HB1 TRP 312 1.604 1.085 -2.023 67 HD1 TRP 312 HD1 TRP 312 1.356 3.524 -1.702 68 HE1 TRP 312 HE1 TRP 312 1.869 5.252 0.126 69 HE3 TRP 312 HE3 TRP 312 3.224 0.398 1.912 70 HZ2 TRP 312 HZ2 TRP 312 2.904 5.299 2.738 71 HZ3 TRP 312 HZ3 TRP 312 3.943 1.379 4.045 72 HH2 TRP 312 HH2 TRP 312 3.777 3.775 4.448 73 H ALA 313 HN ALA 313 -0.656 0.550 1.137 74 HA ALA 313 HA ALA 313 0.825 0.109 3.566 75 HB1 ALA 313 HB1 ALA 313 -0.241 2.075 3.794 76 HB2 ALA 313 HB2 ALA 313 -1.660 1.095 4.197 77 HB3 ALA 313 HB3 ALA 313 -1.423 1.672 2.526 78 H ARG 314 HN ARG 314 -0.137 -2.237 2.017 79 HA ARG 314 HA ARG 314 -1.745 -3.527 4.080 80 HB2 ARG 314 HB2 ARG 314 -2.140 -3.641 1.098 81 HB3 ARG 314 HB1 ARG 314 -2.730 -4.919 2.151 82 HG2 ARG 314 HG2 ARG 314 -4.075 -3.263 3.377 83 HG3 ARG 314 HG1 ARG 314 -3.510 -2.011 2.271 84 HD2 ARG 314 HD2 ARG 314 -4.919 -4.490 1.318 85 HD3 ARG 314 HD1 ARG 314 -5.792 -3.035 1.794 86 HE ARG 314 HE ARG 314 -3.728 -2.561 -0.153 87 HH11 ARG 314 HH11 ARG 314 -7.102 -3.462 0.247 88 HH12 ARG 314 HH12 ARG 314 -7.547 -2.940 -1.344 89 HH21 ARG 314 HH21 ARG 314 -5.982 -2.047 -2.743 90 HH22 ARG 314 HH22 ARG 314 -4.338 -1.881 -2.228 91 HA PRO 315 HA PRO 315 2.102 -6.006 4.082 92 HB2 PRO 315 HB2 PRO 315 0.949 -7.879 5.820 93 HB3 PRO 315 HB1 PRO 315 1.994 -6.529 6.281 94 HG2 PRO 315 HG2 PRO 315 -0.968 -6.726 6.335 95 HG3 PRO 315 HG1 PRO 315 0.125 -5.829 7.407 96 HD2 PRO 315 HD2 PRO 315 -1.331 -4.562 5.571 97 HD3 PRO 315 HD1 PRO 315 0.328 -4.049 5.932 98 H ASP 316 HN ASP 316 -1.054 -7.117 3.487 99 HA ASP 316 HA ASP 316 -0.338 -9.729 2.502 100 HB2 ASP 316 HB2 ASP 316 -2.930 -8.181 2.493 101 HB3 ASP 316 HB1 ASP 316 -2.773 -9.775 1.766 102 H TYR 317 HN TYR 317 -0.021 -6.706 1.212 103 HA TYR 317 HA TYR 317 -0.184 -7.682 -1.561 104 HB2 TYR 317 HB2 TYR 317 -1.871 -5.904 -0.947 105 HB3 TYR 317 HB1 TYR 317 -0.525 -4.812 -0.650 106 HD1 TYR 317 HD1 TYR 317 -2.386 -6.651 -3.249 107 HD2 TYR 317 HD2 TYR 317 0.663 -3.789 -2.462 108 HE1 TYR 317 HE1 TYR 317 -2.394 -6.000 -5.621 109 HE2 TYR 317 HE2 TYR 317 0.664 -3.129 -4.829 110 HH TYR 317 HH TYR 317 0.037 -4.085 -7.010 111 H ASN 318 HN ASN 318 1.665 -7.675 -2.657 112 HA ASN 318 HA ASN 318 4.047 -6.534 -1.426 113 HB2 ASN 318 HB2 ASN 318 3.659 -8.475 -3.703 114 HB3 ASN 318 HB1 ASN 318 5.235 -7.825 -3.262 115 HD21 ASN 318 HD21 ASN 318 6.175 -8.437 -1.311 116 HD22 ASN 318 HD22 ASN 318 5.637 -9.823 -0.431 117 HA PRO 319 HA PRO 319 4.252 -3.126 -4.315 118 HB2 PRO 319 HB2 PRO 319 7.156 -3.064 -4.221 119 HB3 PRO 319 HB1 PRO 319 6.004 -1.938 -3.497 120 HG2 PRO 319 HG2 PRO 319 7.557 -3.588 -2.017 121 HG3 PRO 319 HG1 PRO 319 5.950 -3.045 -1.499 122 HD2 PRO 319 HD2 PRO 319 6.755 -5.662 -2.705 123 HD3 PRO 319 HD1 PRO 319 5.631 -5.325 -1.373 124 HA PRO 320 HA PRO 320 5.322 -4.655 -8.383 125 HB2 PRO 320 HB2 PRO 320 6.111 -1.990 -9.307 126 HB3 PRO 320 HB1 PRO 320 4.714 -2.964 -9.780 127 HG2 PRO 320 HG2 PRO 320 4.460 -0.720 -8.318 128 HG3 PRO 320 HG1 PRO 320 3.370 -2.107 -8.140 129 HD2 PRO 320 HD2 PRO 320 5.667 -1.284 -6.410 130 HD3 PRO 320 HD1 PRO 320 4.075 -1.913 -5.957 131 H LEU 321 HN LEU 321 7.094 -5.858 -8.442 132 HA LEU 321 HA LEU 321 9.221 -6.568 -8.783 133 HB2 LEU 321 HB2 LEU 321 9.643 -3.743 -9.759 134 HB3 LEU 321 HB1 LEU 321 10.856 -5.002 -9.868 135 HG LEU 321 HG LEU 321 8.927 -6.285 -11.152 136 HD11 LEU 321 HD11 LEU 321 7.599 -4.758 -12.527 137 HD12 LEU 321 HD12 LEU 321 8.240 -3.386 -11.624 138 HD13 LEU 321 HD13 LEU 321 7.224 -4.578 -10.813 139 HD21 LEU 321 HD21 LEU 321 11.110 -5.760 -12.073 140 HD22 LEU 321 HD22 LEU 321 10.608 -4.094 -12.361 141 HD23 LEU 321 HD23 LEU 321 9.845 -5.411 -13.252 142 H VAL 322 HN VAL 322 11.223 -6.746 -7.782 143 HA VAL 322 HA VAL 322 11.822 -4.833 -5.640 144 HB VAL 322 HB VAL 322 12.507 -6.817 -4.179 145 HG11 VAL 322 HG11 VAL 322 10.607 -5.400 -3.673 146 HG12 VAL 322 HG12 VAL 322 10.240 -7.080 -3.284 147 HG13 VAL 322 HG13 VAL 322 9.584 -6.351 -4.749 148 HG21 VAL 322 HG21 VAL 322 10.665 -8.306 -6.061 149 HG22 VAL 322 HG22 VAL 322 11.264 -8.916 -4.518 150 HG23 VAL 322 HG23 VAL 322 12.390 -8.602 -5.839 151 H GLU 323 HN GLU 323 13.826 -4.131 -5.751 152 HA GLU 323 HA GLU 323 15.914 -5.893 -6.843 153 HB2 GLU 323 HB2 GLU 323 15.400 -2.993 -7.490 154 HB3 GLU 323 HB1 GLU 323 16.961 -3.749 -7.769 155 HG2 GLU 323 HG2 GLU 323 15.909 -5.370 -9.265 156 HG3 GLU 323 HG1 GLU 323 14.345 -4.609 -8.986 Start of MODEL 23 1 H1 GLY 304 HT1 GLY 304 -4.715 19.217 8.279 2 H2 GLY 304 HT2 GLY 304 -5.099 17.714 7.605 3 H3 GLY 304 HT3 GLY 304 -3.584 17.959 8.316 4 HA2 GLY 304 HA1 GLY 304 -4.614 18.255 10.484 5 HA3 GLY 304 HA2 GLY 304 -6.187 17.998 9.744 6 H PHE 305 HN PHE 305 -6.956 15.986 9.587 7 HA PHE 305 HA PHE 305 -5.215 13.793 10.461 8 HB2 PHE 305 HB2 PHE 305 -8.221 14.096 10.440 9 HB3 PHE 305 HB1 PHE 305 -7.414 12.577 10.812 10 HD1 PHE 305 HD1 PHE 305 -6.210 12.283 12.890 11 HD2 PHE 305 HD2 PHE 305 -8.158 15.958 11.982 12 HE1 PHE 305 HE1 PHE 305 -6.010 12.966 15.245 13 HE2 PHE 305 HE2 PHE 305 -7.960 16.646 14.336 14 HZ PHE 305 HZ PHE 305 -6.886 15.151 15.971 15 HA PRO 306 HA PRO 306 -5.386 11.868 6.426 16 HB2 PRO 306 HB2 PRO 306 -5.578 9.172 7.518 17 HB3 PRO 306 HB1 PRO 306 -4.199 9.954 6.736 18 HG2 PRO 306 HG2 PRO 306 -4.204 9.343 9.364 19 HG3 PRO 306 HG1 PRO 306 -3.339 10.746 8.706 20 HD2 PRO 306 HD2 PRO 306 -5.994 10.651 10.087 21 HD3 PRO 306 HD1 PRO 306 -4.656 11.801 10.291 22 H ARG 307 HN ARG 307 -6.898 11.408 4.948 23 HA ARG 307 HA ARG 307 -9.545 10.545 5.881 24 HB2 ARG 307 HB2 ARG 307 -8.653 12.053 3.427 25 HB3 ARG 307 HB1 ARG 307 -10.268 11.377 3.574 26 HG2 ARG 307 HG2 ARG 307 -10.661 12.742 5.566 27 HG3 ARG 307 HG1 ARG 307 -9.038 13.420 5.416 28 HD2 ARG 307 HD2 ARG 307 -10.480 15.016 4.456 29 HD3 ARG 307 HD1 ARG 307 -9.726 14.184 3.097 30 HE ARG 307 HE ARG 307 -12.112 12.866 3.644 31 HH11 ARG 307 HH11 ARG 307 -11.137 16.055 2.540 32 HH12 ARG 307 HH12 ARG 307 -12.594 16.314 1.641 33 HH21 ARG 307 HH21 ARG 307 -14.010 13.228 2.461 34 HH22 ARG 307 HH22 ARG 307 -14.220 14.714 1.596 35 H ALA 308 HN ALA 308 -7.110 9.879 3.390 36 HA ALA 308 HA ALA 308 -8.407 7.275 2.898 37 HB1 ALA 308 HB1 ALA 308 -6.804 8.920 0.942 38 HB2 ALA 308 HB2 ALA 308 -8.559 8.752 0.950 39 HB3 ALA 308 HB3 ALA 308 -7.540 7.350 0.622 40 H LEU 309 HN LEU 309 -7.138 5.460 2.831 41 HA LEU 309 HA LEU 309 -4.437 5.756 3.918 42 HB2 LEU 309 HB2 LEU 309 -6.297 3.387 3.777 43 HB3 LEU 309 HB1 LEU 309 -4.646 3.284 4.356 44 HG LEU 309 HG LEU 309 -5.471 5.191 6.006 45 HD11 LEU 309 HD11 LEU 309 -8.007 3.681 5.380 46 HD12 LEU 309 HD12 LEU 309 -7.703 5.386 5.044 47 HD13 LEU 309 HD13 LEU 309 -7.781 4.815 6.711 48 HD21 LEU 309 HD21 LEU 309 -6.081 2.258 6.337 49 HD22 LEU 309 HD22 LEU 309 -5.983 3.437 7.645 50 HD23 LEU 309 HD23 LEU 309 -4.550 3.057 6.690 51 HA PRO 310 HA PRO 310 -2.536 4.481 0.097 52 HB2 PRO 310 HB2 PRO 310 -0.408 3.018 1.435 53 HB3 PRO 310 HB1 PRO 310 -0.333 4.558 0.581 54 HG2 PRO 310 HG2 PRO 310 -0.039 4.355 3.271 55 HG3 PRO 310 HG1 PRO 310 -0.681 5.795 2.458 56 HD2 PRO 310 HD2 PRO 310 -2.152 3.634 3.904 57 HD3 PRO 310 HD1 PRO 310 -2.444 5.384 3.876 58 H ALA 311 HN ALA 311 -1.632 2.547 -1.091 59 HA ALA 311 HA ALA 311 -3.526 0.338 -0.725 60 HB1 ALA 311 HB1 ALA 311 -3.696 1.465 -2.892 61 HB2 ALA 311 HB2 ALA 311 -3.140 -0.198 -3.082 62 HB3 ALA 311 HB3 ALA 311 -1.991 1.133 -3.193 63 H TRP 312 HN TRP 312 -0.417 1.353 -0.919 64 HA TRP 312 HA TRP 312 0.984 -1.132 -1.039 65 HB2 TRP 312 HB2 TRP 312 2.909 0.327 -1.118 66 HB3 TRP 312 HB1 TRP 312 1.600 1.090 -2.025 67 HD1 TRP 312 HD1 TRP 312 1.362 3.529 -1.703 68 HE1 TRP 312 HE1 TRP 312 1.877 5.255 0.128 69 HE3 TRP 312 HE3 TRP 312 3.220 0.395 1.911 70 HZ2 TRP 312 HZ2 TRP 312 2.905 5.296 2.742 71 HZ3 TRP 312 HZ3 TRP 312 3.939 1.373 4.047 72 HH2 TRP 312 HH2 TRP 312 3.773 3.768 4.451 73 H ALA 313 HN ALA 313 -0.647 0.568 1.135 74 HA ALA 313 HA ALA 313 0.830 0.134 3.564 75 HB1 ALA 313 HB1 ALA 313 -1.435 1.674 2.522 76 HB2 ALA 313 HB2 ALA 313 -0.250 2.092 3.789 77 HB3 ALA 313 HB3 ALA 313 -1.660 1.103 4.192 78 H ARG 314 HN ARG 314 0.107 -2.277 2.184 79 HA ARG 314 HA ARG 314 -1.670 -3.527 4.130 80 HB2 ARG 314 HB2 ARG 314 -1.691 -3.854 1.138 81 HB3 ARG 314 HB1 ARG 314 -2.348 -5.089 2.201 82 HG2 ARG 314 HG2 ARG 314 -3.921 -3.452 3.122 83 HG3 ARG 314 HG1 ARG 314 -3.265 -2.222 2.041 84 HD2 ARG 314 HD2 ARG 314 -4.426 -4.809 1.037 85 HD3 ARG 314 HD1 ARG 314 -5.412 -3.374 1.309 86 HE ARG 314 HE ARG 314 -3.130 -2.864 -0.350 87 HH11 ARG 314 HH11 ARG 314 -6.440 -4.037 -0.403 88 HH12 ARG 314 HH12 ARG 314 -6.673 -3.646 -2.075 89 HH21 ARG 314 HH21 ARG 314 -4.985 -2.698 -3.279 90 HH22 ARG 314 HH22 ARG 314 -3.458 -2.361 -2.536 91 HA PRO 315 HA PRO 315 2.278 -5.765 4.738 92 HB2 PRO 315 HB2 PRO 315 1.031 -7.596 6.457 93 HB3 PRO 315 HB1 PRO 315 1.943 -6.159 6.941 94 HG2 PRO 315 HG2 PRO 315 -0.990 -6.532 6.671 95 HG3 PRO 315 HG1 PRO 315 -0.080 -5.508 7.799 96 HD2 PRO 315 HD2 PRO 315 -1.376 -4.443 5.730 97 HD3 PRO 315 HD1 PRO 315 0.200 -3.811 6.240 98 H ASP 316 HN ASP 316 -0.721 -7.100 3.865 99 HA ASP 316 HA ASP 316 0.269 -9.712 3.131 100 HB2 ASP 316 HB2 ASP 316 -2.418 -8.382 2.795 101 HB3 ASP 316 HB1 ASP 316 -2.072 -9.998 2.189 102 H TYR 317 HN TYR 317 0.137 -6.680 1.620 103 HA TYR 317 HA TYR 317 0.549 -7.884 -1.038 104 HB2 TYR 317 HB2 TYR 317 -1.550 -6.517 -0.811 105 HB3 TYR 317 HB1 TYR 317 -0.544 -5.119 -0.452 106 HD1 TYR 317 HD1 TYR 317 -1.596 -7.472 -3.081 107 HD2 TYR 317 HD2 TYR 317 0.659 -3.976 -2.194 108 HE1 TYR 317 HE1 TYR 317 -1.422 -6.982 -5.484 109 HE2 TYR 317 HE2 TYR 317 0.840 -3.473 -4.592 110 HH TYR 317 HH TYR 317 0.720 -4.667 -6.738 111 H ASN 318 HN ASN 318 2.509 -7.609 -1.864 112 HA ASN 318 HA ASN 318 4.327 -5.684 -0.620 113 HB2 ASN 318 HB2 ASN 318 4.818 -8.115 -2.340 114 HB3 ASN 318 HB1 ASN 318 6.095 -6.986 -1.901 115 HD21 ASN 318 HD21 ASN 318 3.902 -9.423 -0.759 116 HD22 ASN 318 HD22 ASN 318 4.660 -9.678 0.771 117 HA PRO 319 HA PRO 319 4.195 -3.109 -4.285 118 HB2 PRO 319 HB2 PRO 319 6.838 -2.035 -3.754 119 HB3 PRO 319 HB1 PRO 319 5.268 -1.253 -3.540 120 HG2 PRO 319 HG2 PRO 319 6.862 -1.936 -1.457 121 HG3 PRO 319 HG1 PRO 319 5.091 -1.870 -1.349 122 HD2 PRO 319 HD2 PRO 319 6.870 -4.255 -1.682 123 HD3 PRO 319 HD1 PRO 319 5.433 -4.047 -0.662 124 HA PRO 320 HA PRO 320 6.688 -5.070 -7.450 125 HB2 PRO 320 HB2 PRO 320 6.609 -2.735 -9.175 126 HB3 PRO 320 HB1 PRO 320 5.730 -4.257 -9.340 127 HG2 PRO 320 HG2 PRO 320 4.509 -1.904 -8.756 128 HG3 PRO 320 HG1 PRO 320 3.888 -3.485 -8.245 129 HD2 PRO 320 HD2 PRO 320 5.409 -1.458 -6.657 130 HD3 PRO 320 HD1 PRO 320 4.043 -2.479 -6.184 131 H LEU 321 HN LEU 321 8.758 -5.354 -7.031 132 HA LEU 321 HA LEU 321 10.600 -3.102 -6.799 133 HB2 LEU 321 HB2 LEU 321 10.943 -6.061 -6.322 134 HB3 LEU 321 HB1 LEU 321 12.263 -4.913 -6.216 135 HG LEU 321 HG LEU 321 10.532 -3.745 -4.516 136 HD11 LEU 321 HD11 LEU 321 8.836 -5.477 -4.781 137 HD12 LEU 321 HD12 LEU 321 9.474 -5.458 -3.137 138 HD13 LEU 321 HD13 LEU 321 9.999 -6.702 -4.272 139 HD21 LEU 321 HD21 LEU 321 12.432 -5.993 -3.859 140 HD22 LEU 321 HD22 LEU 321 11.807 -4.808 -2.712 141 HD23 LEU 321 HD23 LEU 321 12.850 -4.288 -4.036 142 H VAL 322 HN VAL 322 11.970 -2.477 -8.328 143 HA VAL 322 HA VAL 322 12.699 -4.305 -10.491 144 HB VAL 322 HB VAL 322 12.419 -2.382 -12.156 145 HG11 VAL 322 HG11 VAL 322 9.966 -3.677 -10.978 146 HG12 VAL 322 HG12 VAL 322 11.038 -4.372 -12.193 147 HG13 VAL 322 HG13 VAL 322 10.072 -2.948 -12.581 148 HG21 VAL 322 HG21 VAL 322 12.015 -0.553 -10.584 149 HG22 VAL 322 HG22 VAL 322 10.546 -1.347 -10.018 150 HG23 VAL 322 HG23 VAL 322 10.644 -0.751 -11.676 151 H GLU 323 HN GLU 323 14.758 -4.148 -11.137 152 HA GLU 323 HA GLU 323 16.421 -2.086 -9.879 153 HB2 GLU 323 HB2 GLU 323 17.061 -4.817 -10.985 154 HB3 GLU 323 HB1 GLU 323 18.316 -3.653 -10.587 155 HG2 GLU 323 HG2 GLU 323 17.533 -3.604 -8.269 156 HG3 GLU 323 HG1 GLU 323 16.283 -4.781 -8.673
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