NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
551908 | 2lhr | 17862 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 466 H1 SER 466 30.484 2.252 -9.200 2 H2 SER 466 H2 SER 466 30.031 1.169 -7.973 3 H3 SER 466 H3 SER 466 31.169 0.702 -9.144 4 HA SER 466 HA SER 466 32.750 1.321 -7.745 5 HB2 SER 466 HB2 SER 466 33.036 3.238 -9.068 6 HB3 SER 466 HB3 SER 466 31.509 3.945 -8.548 7 HG SER 466 HG SER 466 33.051 5.005 -7.417 8 H ASP 467 H ASP 467 32.976 1.029 -5.619 9 HA ASP 467 HA ASP 467 31.309 2.468 -3.701 10 HB2 ASP 467 HB2 ASP 467 30.523 0.401 -2.622 11 HB3 ASP 467 HB3 ASP 467 29.933 0.514 -4.281 12 H ASP 468 H ASP 468 31.946 1.796 -1.406 13 HA ASP 468 HA ASP 468 33.622 1.707 0.178 14 HB2 ASP 468 HB2 ASP 468 33.500 -0.691 -0.664 15 HB3 ASP 468 HB3 ASP 468 34.882 -0.314 -1.689 16 H TYR 469 H TYR 469 33.807 3.502 -2.154 17 HA TYR 469 HA TYR 469 36.555 3.750 -2.936 18 HB2 TYR 469 HB2 TYR 469 34.488 4.425 -4.228 19 HB3 TYR 469 HB3 TYR 469 34.368 5.804 -3.138 20 HD1 TYR 469 HD1 TYR 469 36.456 4.178 -5.729 21 HD2 TYR 469 HD2 TYR 469 35.874 7.669 -3.293 22 HE1 TYR 469 HE1 TYR 469 38.097 5.419 -7.114 23 HE2 TYR 469 HE2 TYR 469 37.512 8.911 -4.681 24 HH TYR 469 HH TYR 469 38.464 8.821 -6.914 25 H VAL 470 H VAL 470 38.022 5.407 -2.381 26 HA VAL 470 HA VAL 470 37.521 6.692 0.250 27 HB VAL 470 HB VAL 470 40.230 6.190 -0.987 28 HG11 VAL 470 HG11 VAL 470 39.196 6.794 1.790 29 HG12 VAL 470 HG12 VAL 470 40.304 7.748 0.810 30 HG13 VAL 470 HG13 VAL 470 40.828 6.208 1.483 31 HG21 VAL 470 HG21 VAL 470 39.241 4.008 -0.842 32 HG22 VAL 470 HG22 VAL 470 38.531 4.367 0.733 33 HG23 VAL 470 HG23 VAL 470 40.280 4.189 0.572 34 H ASP 471 H ASP 471 38.592 8.797 0.605 35 HA ASP 471 HA ASP 471 37.947 10.645 -1.431 36 HB2 ASP 471 HB2 ASP 471 39.574 10.894 1.096 37 HB3 ASP 471 HB3 ASP 471 39.242 12.262 0.038 38 H GLU 472 H GLU 472 39.241 11.873 -2.784 39 HA GLU 472 HA GLU 472 41.363 10.607 -4.092 40 HB2 GLU 472 HB2 GLU 472 40.499 13.500 -4.025 41 HB3 GLU 472 HB3 GLU 472 41.702 12.861 -5.146 42 HG2 GLU 472 HG2 GLU 472 40.077 11.322 -6.097 43 HG3 GLU 472 HG3 GLU 472 38.876 11.786 -4.890 44 H GLU 473 H GLU 473 41.443 13.195 -1.619 45 HA GLU 473 HA GLU 473 44.240 13.615 -1.763 46 HB2 GLU 473 HB2 GLU 473 43.209 15.381 -0.697 47 HB3 GLU 473 HB3 GLU 473 41.987 14.350 0.034 48 HG2 GLU 473 HG2 GLU 473 43.549 15.359 1.692 49 HG3 GLU 473 HG3 GLU 473 43.541 13.598 1.729 50 H THR 474 H THR 474 42.212 11.623 0.342 51 HA THR 474 HA THR 474 44.278 10.574 1.967 52 HB THR 474 HB THR 474 41.521 9.643 1.198 53 HG1 THR 474 HG1 THR 474 42.652 10.770 3.541 54 HG21 THR 474 HG21 THR 474 41.740 8.093 3.191 55 HG22 THR 474 HG22 THR 474 43.481 8.376 3.108 56 HG23 THR 474 HG23 THR 474 42.640 7.621 1.751 57 H TYR 475 H TYR 475 42.639 9.381 -0.932 58 HA TYR 475 HA TYR 475 43.955 6.913 -1.068 59 HB2 TYR 475 HB2 TYR 475 41.850 7.599 -2.254 60 HB3 TYR 475 HB3 TYR 475 42.856 8.518 -3.377 61 HD1 TYR 475 HD1 TYR 475 42.457 5.148 -1.874 62 HD2 TYR 475 HD2 TYR 475 43.833 7.447 -5.217 63 HE1 TYR 475 HE1 TYR 475 42.925 3.042 -3.121 64 HE2 TYR 475 HE2 TYR 475 44.317 5.358 -6.471 65 HH TYR 475 HH TYR 475 44.483 2.350 -5.037 66 H ASN 476 H ASN 476 44.683 10.007 -2.689 67 HA ASN 476 HA ASN 476 46.932 9.002 -4.110 68 HB2 ASN 476 HB2 ASN 476 46.407 11.850 -3.245 69 HB3 ASN 476 HB3 ASN 476 47.466 11.309 -4.549 70 HD21 ASN 476 HD21 ASN 476 45.361 9.133 -5.210 71 HD22 ASN 476 HD22 ASN 476 44.176 9.979 -6.083 72 H LEU 477 H LEU 477 46.460 10.409 -0.923 73 HA LEU 477 HA LEU 477 49.143 10.842 -0.226 74 HB2 LEU 477 HB2 LEU 477 47.318 11.680 1.124 75 HB3 LEU 477 HB3 LEU 477 46.746 10.049 1.434 76 HG LEU 477 HG LEU 477 48.803 9.526 2.657 77 HD11 LEU 477 HD11 LEU 477 50.269 11.615 3.210 78 HD12 LEU 477 HD12 LEU 477 49.569 12.297 1.742 79 HD13 LEU 477 HD13 LEU 477 50.509 10.807 1.661 80 HD21 LEU 477 HD21 LEU 477 47.685 12.164 3.626 81 HD22 LEU 477 HD22 LEU 477 48.360 10.860 4.602 82 HD23 LEU 477 HD23 LEU 477 46.821 10.633 3.772 83 H GLN 478 H GLN 478 47.029 7.990 0.137 84 HA GLN 478 HA GLN 478 48.924 6.262 1.318 85 HB2 GLN 478 HB2 GLN 478 46.514 5.708 -0.422 86 HB3 GLN 478 HB3 GLN 478 47.431 4.455 0.412 87 HG2 GLN 478 HG2 GLN 478 46.141 6.813 1.803 88 HG3 GLN 478 HG3 GLN 478 45.394 5.225 1.662 89 HE21 GLN 478 HE21 GLN 478 46.699 6.915 3.977 90 HE22 GLN 478 HE22 GLN 478 47.658 5.759 4.773 91 H LYS 479 H LYS 479 48.154 7.053 -1.996 92 HA LYS 479 HA LYS 479 49.662 5.057 -3.301 93 HB2 LYS 479 HB2 LYS 479 47.836 6.648 -4.187 94 HB3 LYS 479 HB3 LYS 479 49.131 7.829 -4.361 95 HG2 LYS 479 HG2 LYS 479 50.331 6.376 -5.886 96 HG3 LYS 479 HG3 LYS 479 49.203 5.054 -5.582 97 HD2 LYS 479 HD2 LYS 479 48.602 6.106 -7.691 98 HD3 LYS 479 HD3 LYS 479 47.359 6.477 -6.498 99 HE2 LYS 479 HE2 LYS 479 48.116 8.699 -6.226 100 HE3 LYS 479 HE3 LYS 479 49.678 8.350 -6.966 101 HZ1 LYS 479 HZ1 LYS 479 47.846 7.685 -8.875 102 HZ2 LYS 479 HZ2 LYS 479 48.783 9.101 -8.832 103 HZ3 LYS 479 HZ3 LYS 479 47.212 9.099 -8.188 104 H LEU 480 H LEU 480 50.437 8.308 -2.184 105 HA LEU 480 HA LEU 480 52.954 8.570 -3.410 106 HB2 LEU 480 HB2 LEU 480 51.605 9.822 -1.036 107 HB3 LEU 480 HB3 LEU 480 53.280 10.215 -1.413 108 HG LEU 480 HG LEU 480 51.284 10.332 -3.661 109 HD11 LEU 480 HD11 LEU 480 51.048 12.871 -2.890 110 HD12 LEU 480 HD12 LEU 480 51.337 12.189 -1.290 111 HD13 LEU 480 HD13 LEU 480 49.967 11.636 -2.247 112 HD21 LEU 480 HD21 LEU 480 53.724 10.731 -3.992 113 HD22 LEU 480 HD22 LEU 480 53.629 12.086 -2.868 114 HD23 LEU 480 HD23 LEU 480 52.754 12.149 -4.396 115 H LEU 481 H LEU 481 52.040 7.306 -0.219 116 HA LEU 481 HA LEU 481 54.685 6.987 0.749 117 HB2 LEU 481 HB2 LEU 481 52.295 5.350 1.596 118 HB3 LEU 481 HB3 LEU 481 53.703 5.807 2.556 119 HG LEU 481 HG LEU 481 51.607 7.674 1.475 120 HD11 LEU 481 HD11 LEU 481 51.237 8.130 3.923 121 HD12 LEU 481 HD12 LEU 481 52.267 6.737 4.258 122 HD13 LEU 481 HD13 LEU 481 50.751 6.523 3.383 123 HD21 LEU 481 HD21 LEU 481 53.582 8.927 1.386 124 HD22 LEU 481 HD22 LEU 481 54.229 8.156 2.830 125 HD23 LEU 481 HD23 LEU 481 52.918 9.326 2.969 126 H ALA 482 H ALA 482 52.553 4.782 -1.018 127 HA ALA 482 HA ALA 482 53.521 2.333 -0.715 128 HB1 ALA 482 HB1 ALA 482 53.489 2.450 -3.492 129 HB2 ALA 482 HB2 ALA 482 52.498 3.822 -3.009 130 HB3 ALA 482 HB3 ALA 482 52.084 2.204 -2.455 131 HA PRO 483 HA PRO 483 57.367 2.756 -3.766 132 HB2 PRO 483 HB2 PRO 483 58.297 5.488 -3.508 133 HB3 PRO 483 HB3 PRO 483 57.715 4.675 -4.965 134 HG2 PRO 483 HG2 PRO 483 56.295 6.502 -3.148 135 HG3 PRO 483 HG3 PRO 483 55.974 6.136 -4.848 136 HD2 PRO 483 HD2 PRO 483 54.355 5.258 -2.854 137 HD3 PRO 483 HD3 PRO 483 54.618 4.315 -4.337 138 H TYR 484 H TYR 484 57.340 5.134 -1.093 139 HA TYR 484 HA TYR 484 59.924 4.323 -0.153 140 HB2 TYR 484 HB2 TYR 484 59.463 6.539 0.336 141 HB3 TYR 484 HB3 TYR 484 57.775 6.209 0.751 142 HD1 TYR 484 HD1 TYR 484 61.291 5.789 1.951 143 HD2 TYR 484 HD2 TYR 484 57.126 5.722 2.992 144 HE1 TYR 484 HE1 TYR 484 61.888 5.601 4.351 145 HE2 TYR 484 HE2 TYR 484 57.725 5.539 5.386 146 HH TYR 484 HH TYR 484 61.138 5.398 6.419 147 H HIS 485 H HIS 485 56.624 3.416 0.481 148 HA HIS 485 HA HIS 485 56.955 2.114 2.968 149 HB2 HIS 485 HB2 HIS 485 54.788 2.769 1.837 150 HB3 HIS 485 HB3 HIS 485 55.003 1.366 0.794 151 HD1 HIS 485 HD1 HIS 485 54.931 -1.002 1.938 152 HD2 HIS 485 HD2 HIS 485 53.934 2.166 4.459 153 HE1 HIS 485 HE1 HIS 485 53.826 -2.027 3.973 154 H LYS 486 H LYS 486 57.328 1.033 -0.376 155 HA LYS 486 HA LYS 486 57.900 -1.713 0.411 156 HB2 LYS 486 HB2 LYS 486 58.195 -2.064 -2.020 157 HB3 LYS 486 HB3 LYS 486 56.677 -1.229 -1.683 158 HG2 LYS 486 HG2 LYS 486 57.702 0.912 -2.203 159 HG3 LYS 486 HG3 LYS 486 59.256 0.148 -2.485 160 HD2 LYS 486 HD2 LYS 486 58.313 0.474 -4.636 161 HD3 LYS 486 HD3 LYS 486 58.092 -1.238 -4.283 162 HE2 LYS 486 HE2 LYS 486 55.785 -0.971 -3.847 163 HE3 LYS 486 HE3 LYS 486 55.930 0.772 -3.631 164 HZ1 LYS 486 HZ1 LYS 486 55.034 0.527 -5.742 165 HZ2 LYS 486 HZ2 LYS 486 56.035 -0.789 -6.135 166 HZ3 LYS 486 HZ3 LYS 486 56.684 0.780 -6.048 167 H ALA 487 H ALA 487 59.598 1.220 -0.091 168 HA ALA 487 HA ALA 487 62.104 0.255 -0.922 169 HB1 ALA 487 HB1 ALA 487 62.938 2.427 -0.249 170 HB2 ALA 487 HB2 ALA 487 61.504 2.712 0.737 171 HB3 ALA 487 HB3 ALA 487 61.365 2.626 -1.019 172 H LYS 488 H LYS 488 63.011 -1.375 0.173 173 HA LYS 488 HA LYS 488 63.137 -1.357 3.104 174 HB2 LYS 488 HB2 LYS 488 64.121 -3.594 2.838 175 HB3 LYS 488 HB3 LYS 488 62.591 -3.463 1.967 176 HG2 LYS 488 HG2 LYS 488 63.891 -2.942 -0.111 177 HG3 LYS 488 HG3 LYS 488 65.373 -3.251 0.788 178 HD2 LYS 488 HD2 LYS 488 64.627 -5.550 1.254 179 HD3 LYS 488 HD3 LYS 488 63.133 -5.247 0.365 180 HE2 LYS 488 HE2 LYS 488 64.443 -4.796 -1.681 181 HE3 LYS 488 HE3 LYS 488 65.934 -5.109 -0.793 182 HZ1 LYS 488 HZ1 LYS 488 65.602 -7.306 -0.845 183 HZ2 LYS 488 HZ2 LYS 488 64.551 -6.969 -2.138 184 HZ3 LYS 488 HZ3 LYS 488 63.934 -7.178 -0.569 185 H THR 489 H THR 489 64.961 -0.153 0.556 186 HA THR 489 HA THR 489 67.524 -0.501 1.994 187 HB THR 489 HB THR 489 68.335 0.610 -0.251 188 HG1 THR 489 HG1 THR 489 65.773 -0.414 -0.921 189 HG21 THR 489 HG21 THR 489 67.377 -2.207 0.223 190 HG22 THR 489 HG22 THR 489 69.028 -1.593 0.082 191 HG23 THR 489 HG23 THR 489 68.023 -1.752 -1.358 192 H LEU 490 H LEU 490 68.565 1.192 2.935 193 HA LEU 490 HA LEU 490 67.211 3.554 3.602 194 HB2 LEU 490 HB2 LEU 490 70.092 2.684 3.678 195 HB3 LEU 490 HB3 LEU 490 69.634 4.313 4.170 196 HG LEU 490 HG LEU 490 68.029 3.350 5.796 197 HD11 LEU 490 HD11 LEU 490 68.387 0.845 6.278 198 HD12 LEU 490 HD12 LEU 490 69.126 0.768 4.680 199 HD13 LEU 490 HD13 LEU 490 67.439 1.255 4.849 200 HD21 LEU 490 HD21 LEU 490 69.754 2.409 7.347 201 HD22 LEU 490 HD22 LEU 490 70.284 3.897 6.562 202 HD23 LEU 490 HD23 LEU 490 70.883 2.339 5.993 203 H GLU 491 H GLU 491 69.702 2.958 1.119 204 HA GLU 491 HA GLU 491 70.022 5.567 0.163 205 HB2 GLU 491 HB2 GLU 491 71.509 3.782 -0.501 206 HB3 GLU 491 HB3 GLU 491 70.183 2.905 -1.258 207 HG2 GLU 491 HG2 GLU 491 71.515 4.060 -2.951 208 HG3 GLU 491 HG3 GLU 491 69.902 4.750 -2.889 209 H ARG 492 H ARG 492 67.684 3.101 -0.662 210 HA ARG 492 HA ARG 492 66.395 4.584 -2.742 211 HB2 ARG 492 HB2 ARG 492 66.289 2.135 -2.596 212 HB3 ARG 492 HB3 ARG 492 65.422 2.264 -1.071 213 HG2 ARG 492 HG2 ARG 492 63.717 1.903 -2.657 214 HG3 ARG 492 HG3 ARG 492 63.659 3.638 -2.398 215 HD2 ARG 492 HD2 ARG 492 64.920 4.042 -4.436 216 HD3 ARG 492 HD3 ARG 492 65.208 2.316 -4.650 217 HE ARG 492 HE ARG 492 62.422 2.803 -4.525 218 HH11 ARG 492 HH11 ARG 492 63.798 4.954 -6.384 219 HH12 ARG 492 HH12 ARG 492 63.508 4.227 -7.929 220 HH21 ARG 492 HH21 ARG 492 62.620 1.146 -6.624 221 HH22 ARG 492 HH22 ARG 492 62.844 2.083 -8.064 222 H GLN 493 H GLN 493 65.723 4.035 0.705 223 HA GLN 493 HA GLN 493 63.241 5.299 0.818 224 HB2 GLN 493 HB2 GLN 493 65.441 4.959 2.849 225 HB3 GLN 493 HB3 GLN 493 63.915 5.744 3.251 226 HG2 GLN 493 HG2 GLN 493 62.663 3.756 2.664 227 HG3 GLN 493 HG3 GLN 493 64.106 2.976 2.028 228 HE21 GLN 493 HE21 GLN 493 64.639 1.335 3.477 229 HE22 GLN 493 HE22 GLN 493 64.703 1.516 5.164 230 H VAL 494 H VAL 494 66.502 6.664 1.243 231 HA VAL 494 HA VAL 494 65.678 9.299 1.787 232 HB VAL 494 HB VAL 494 68.184 8.207 0.491 233 HG11 VAL 494 HG11 VAL 494 67.536 10.992 1.492 234 HG12 VAL 494 HG12 VAL 494 67.977 10.535 -0.155 235 HG13 VAL 494 HG13 VAL 494 69.167 10.425 1.138 236 HG21 VAL 494 HG21 VAL 494 67.899 7.450 2.768 237 HG22 VAL 494 HG22 VAL 494 67.460 9.072 3.304 238 HG23 VAL 494 HG23 VAL 494 69.110 8.733 2.780 239 H TYR 495 H TYR 495 66.498 7.663 -1.254 240 HA TYR 495 HA TYR 495 66.161 9.835 -2.999 241 HB2 TYR 495 HB2 TYR 495 67.255 7.803 -3.686 242 HB3 TYR 495 HB3 TYR 495 65.792 6.866 -3.402 243 HD1 TYR 495 HD1 TYR 495 67.208 9.629 -5.485 244 HD2 TYR 495 HD2 TYR 495 64.141 6.646 -5.082 245 HE1 TYR 495 HE1 TYR 495 66.485 10.054 -7.821 246 HE2 TYR 495 HE2 TYR 495 63.420 7.071 -7.419 247 HH TYR 495 HH TYR 495 65.295 9.023 -9.589 248 H GLU 496 H GLU 496 63.820 7.313 -2.026 249 HA GLU 496 HA GLU 496 61.671 8.319 -3.565 250 HB2 GLU 496 HB2 GLU 496 61.689 6.639 -1.057 251 HB3 GLU 496 HB3 GLU 496 60.261 6.949 -2.043 252 HG2 GLU 496 HG2 GLU 496 62.808 5.692 -3.108 253 HG3 GLU 496 HG3 GLU 496 61.400 4.772 -2.584 254 H LEU 497 H LEU 497 62.757 8.946 -0.271 255 HA LEU 497 HA LEU 497 60.575 10.519 0.548 256 HB2 LEU 497 HB2 LEU 497 63.431 10.297 1.428 257 HB3 LEU 497 HB3 LEU 497 62.334 11.451 2.182 258 HG LEU 497 HG LEU 497 61.674 8.503 1.895 259 HD11 LEU 497 HD11 LEU 497 62.500 8.059 4.046 260 HD12 LEU 497 HD12 LEU 497 62.585 9.766 4.467 261 HD13 LEU 497 HD13 LEU 497 63.755 9.079 3.343 262 HD21 LEU 497 HD21 LEU 497 60.347 10.870 3.162 263 HD22 LEU 497 HD22 LEU 497 60.230 9.338 4.019 264 HD23 LEU 497 HD23 LEU 497 59.630 9.470 2.370 265 H GLU 498 H GLU 498 63.586 11.326 -1.132 266 HA GLU 498 HA GLU 498 63.401 14.129 -1.023 267 HB2 GLU 498 HB2 GLU 498 64.665 12.212 -2.972 268 HB3 GLU 498 HB3 GLU 498 64.768 13.959 -3.203 269 HG2 GLU 498 HG2 GLU 498 65.933 14.258 -1.137 270 HG3 GLU 498 HG3 GLU 498 65.587 12.612 -0.617 271 H LYS 499 H LYS 499 62.276 11.878 -3.567 272 HA LYS 499 HA LYS 499 61.050 13.900 -5.188 273 HB2 LYS 499 HB2 LYS 499 60.920 10.895 -5.001 274 HB3 LYS 499 HB3 LYS 499 59.758 11.746 -6.018 275 HG2 LYS 499 HG2 LYS 499 61.788 11.009 -7.265 276 HG3 LYS 499 HG3 LYS 499 61.557 12.755 -7.307 277 HD2 LYS 499 HD2 LYS 499 63.230 13.059 -5.552 278 HD3 LYS 499 HD3 LYS 499 63.398 11.314 -5.375 279 HE2 LYS 499 HE2 LYS 499 65.219 12.113 -6.748 280 HE3 LYS 499 HE3 LYS 499 64.110 11.209 -7.779 281 HZ1 LYS 499 HZ1 LYS 499 64.742 14.029 -7.770 282 HZ2 LYS 499 HZ2 LYS 499 63.084 13.681 -7.899 283 HZ3 LYS 499 HZ3 LYS 499 64.180 13.047 -9.033 284 H LEU 500 H LEU 500 59.868 11.695 -2.697 285 HA LEU 500 HA LEU 500 57.151 12.330 -2.892 286 HB2 LEU 500 HB2 LEU 500 58.888 11.266 -0.707 287 HB3 LEU 500 HB3 LEU 500 57.181 11.536 -0.430 288 HG LEU 500 HG LEU 500 58.107 9.927 -2.814 289 HD11 LEU 500 HD11 LEU 500 58.041 7.898 -1.525 290 HD12 LEU 500 HD12 LEU 500 57.400 8.738 -0.116 291 HD13 LEU 500 HD13 LEU 500 59.069 9.003 -0.611 292 HD21 LEU 500 HD21 LEU 500 55.646 10.831 -2.293 293 HD22 LEU 500 HD22 LEU 500 55.612 9.471 -1.187 294 HD23 LEU 500 HD23 LEU 500 55.881 9.198 -2.906 295 H GLN 501 H GLN 501 59.728 13.743 -0.900 296 HA GLN 501 HA GLN 501 58.193 15.466 0.651 297 HB2 GLN 501 HB2 GLN 501 61.009 15.262 -0.223 298 HB3 GLN 501 HB3 GLN 501 60.524 16.907 0.169 299 HG2 GLN 501 HG2 GLN 501 61.458 15.674 2.123 300 HG3 GLN 501 HG3 GLN 501 59.802 16.218 2.385 301 HE21 GLN 501 HE21 GLN 501 60.913 14.043 3.868 302 HE22 GLN 501 HE22 GLN 501 60.099 12.623 3.423 303 H GLU 502 H GLU 502 59.137 15.712 -2.706 304 HA GLU 502 HA GLU 502 58.367 18.478 -2.983 305 HB2 GLU 502 HB2 GLU 502 60.036 17.879 -4.491 306 HB3 GLU 502 HB3 GLU 502 59.349 16.285 -4.776 307 HG2 GLU 502 HG2 GLU 502 57.647 17.149 -6.171 308 HG3 GLU 502 HG3 GLU 502 57.967 18.812 -5.678 309 H LYS 503 H LYS 503 56.815 15.384 -3.203 310 HA LYS 503 HA LYS 503 54.426 16.582 -4.502 311 HB2 LYS 503 HB2 LYS 503 55.283 13.723 -4.092 312 HB3 LYS 503 HB3 LYS 503 53.785 14.219 -4.883 313 HG2 LYS 503 HG2 LYS 503 55.089 15.504 -6.546 314 HG3 LYS 503 HG3 LYS 503 56.584 14.983 -5.772 315 HD2 LYS 503 HD2 LYS 503 54.538 13.030 -6.851 316 HD3 LYS 503 HD3 LYS 503 55.876 13.638 -7.824 317 HE2 LYS 503 HE2 LYS 503 57.416 12.828 -5.928 318 HE3 LYS 503 HE3 LYS 503 56.014 11.950 -5.318 319 HZ1 LYS 503 HZ1 LYS 503 57.730 11.243 -7.410 320 HZ2 LYS 503 HZ2 LYS 503 56.177 11.492 -8.056 321 HZ3 LYS 503 HZ3 LYS 503 56.407 10.381 -6.789 322 H LEU 504 H LEU 504 55.535 15.285 -1.496 323 HA LEU 504 HA LEU 504 53.097 14.431 -0.429 324 HB2 LEU 504 HB2 LEU 504 55.820 14.920 0.500 325 HB3 LEU 504 HB3 LEU 504 54.619 15.222 1.740 326 HG LEU 504 HG LEU 504 55.600 12.853 1.585 327 HD11 LEU 504 HD11 LEU 504 53.022 11.953 1.705 328 HD12 LEU 504 HD12 LEU 504 52.777 13.684 1.936 329 HD13 LEU 504 HD13 LEU 504 53.853 12.790 3.012 330 HD21 LEU 504 HD21 LEU 504 53.525 12.309 -0.520 331 HD22 LEU 504 HD22 LEU 504 54.954 11.395 -0.097 332 HD23 LEU 504 HD23 LEU 504 55.111 12.880 -1.025 333 HA PRO 505 HA PRO 505 51.032 18.509 -0.267 334 HB2 PRO 505 HB2 PRO 505 49.425 17.395 1.893 335 HB3 PRO 505 HB3 PRO 505 48.927 17.755 0.232 336 HG2 PRO 505 HG2 PRO 505 49.891 15.182 1.373 337 HG3 PRO 505 HG3 PRO 505 48.771 15.468 0.036 338 HD2 PRO 505 HD2 PRO 505 51.175 14.596 -0.452 339 HD3 PRO 505 HD3 PRO 505 50.530 15.901 -1.461 340 H GLU 506 H GLU 506 51.221 20.211 1.083 341 HA GLU 506 HA GLU 506 53.348 20.704 2.612 342 HB2 GLU 506 HB2 GLU 506 50.575 21.797 3.091 343 HB3 GLU 506 HB3 GLU 506 52.064 22.517 3.693 344 HG2 GLU 506 HG2 GLU 506 51.735 23.722 1.712 345 HG3 GLU 506 HG3 GLU 506 52.815 22.442 1.165 346 H LYS 507 H LYS 507 50.238 20.019 4.257 347 HA LYS 507 HA LYS 507 51.241 19.842 6.841 348 HB2 LYS 507 HB2 LYS 507 49.205 18.642 7.388 349 HB3 LYS 507 HB3 LYS 507 48.822 19.862 6.171 350 HG2 LYS 507 HG2 LYS 507 49.254 18.003 4.432 351 HG3 LYS 507 HG3 LYS 507 49.163 16.889 5.793 352 HD2 LYS 507 HD2 LYS 507 46.990 18.887 5.119 353 HD3 LYS 507 HD3 LYS 507 46.986 17.216 4.564 354 HE2 LYS 507 HE2 LYS 507 47.211 16.543 7.020 355 HE3 LYS 507 HE3 LYS 507 46.843 18.224 7.409 356 HZ1 LYS 507 HZ1 LYS 507 44.948 16.479 7.212 357 HZ2 LYS 507 HZ2 LYS 507 45.102 16.769 5.545 358 HZ3 LYS 507 HZ3 LYS 507 44.725 18.045 6.602 359 H TYR 508 H TYR 508 51.271 17.402 4.317 360 HA TYR 508 HA TYR 508 52.350 15.401 6.180 361 HB2 TYR 508 HB2 TYR 508 51.609 15.292 3.248 362 HB3 TYR 508 HB3 TYR 508 52.300 13.952 4.158 363 HD1 TYR 508 HD1 TYR 508 51.119 13.298 6.375 364 HD2 TYR 508 HD2 TYR 508 49.275 15.563 3.252 365 HE1 TYR 508 HE1 TYR 508 48.886 12.666 7.235 366 HE2 TYR 508 HE2 TYR 508 47.039 14.919 4.077 367 HH TYR 508 HH TYR 508 46.364 12.514 5.861 368 H LYS 509 H LYS 509 53.368 17.809 4.012 369 HA LYS 509 HA LYS 509 55.807 16.703 3.084 370 HB2 LYS 509 HB2 LYS 509 54.620 18.782 2.247 371 HB3 LYS 509 HB3 LYS 509 55.218 19.599 3.683 372 HG2 LYS 509 HG2 LYS 509 57.518 19.177 3.044 373 HG3 LYS 509 HG3 LYS 509 56.985 18.234 1.646 374 HD2 LYS 509 HD2 LYS 509 55.827 20.224 0.749 375 HD3 LYS 509 HD3 LYS 509 56.383 21.164 2.131 376 HE2 LYS 509 HE2 LYS 509 58.715 20.794 1.469 377 HE3 LYS 509 HE3 LYS 509 58.182 19.808 0.105 378 HZ1 LYS 509 HZ1 LYS 509 58.507 22.539 0.138 379 HZ2 LYS 509 HZ2 LYS 509 56.825 22.297 0.163 380 HZ3 LYS 509 HZ3 LYS 509 57.766 21.616 -1.078 381 H ALA 510 H ALA 510 54.962 18.754 5.848 382 HA ALA 510 HA ALA 510 57.536 19.011 6.933 383 HB1 ALA 510 HB1 ALA 510 56.463 19.709 8.955 384 HB2 ALA 510 HB2 ALA 510 54.961 18.904 8.495 385 HB3 ALA 510 HB3 ALA 510 55.514 20.323 7.602 386 H GLU 511 H GLU 511 54.945 16.704 7.767 387 HA GLU 511 HA GLU 511 56.374 15.278 9.734 388 HB2 GLU 511 HB2 GLU 511 53.945 15.074 9.240 389 HB3 GLU 511 HB3 GLU 511 54.347 14.171 7.781 390 HG2 GLU 511 HG2 GLU 511 53.859 12.553 9.478 391 HG3 GLU 511 HG3 GLU 511 55.606 12.533 9.270 392 H TYR 512 H TYR 512 56.237 14.692 6.226 393 HA TYR 512 HA TYR 512 57.946 12.387 6.411 394 HB2 TYR 512 HB2 TYR 512 56.626 13.927 4.210 395 HB3 TYR 512 HB3 TYR 512 57.944 12.828 3.795 396 HD1 TYR 512 HD1 TYR 512 54.656 13.019 5.572 397 HD2 TYR 512 HD2 TYR 512 57.632 10.496 3.787 398 HE1 TYR 512 HE1 TYR 512 53.147 11.074 5.815 399 HE2 TYR 512 HE2 TYR 512 56.136 8.552 4.041 400 HH TYR 512 HH TYR 512 53.646 8.393 6.015 401 H LYS 513 H LYS 513 58.452 15.798 5.908 402 HA LYS 513 HA LYS 513 61.062 15.599 4.795 403 HB2 LYS 513 HB2 LYS 513 59.623 17.624 4.726 404 HB3 LYS 513 HB3 LYS 513 59.893 17.843 6.451 405 HG2 LYS 513 HG2 LYS 513 62.253 18.129 6.127 406 HG3 LYS 513 HG3 LYS 513 62.143 17.646 4.437 407 HD2 LYS 513 HD2 LYS 513 60.648 20.040 5.515 408 HD3 LYS 513 HD3 LYS 513 62.306 20.162 4.932 409 HE2 LYS 513 HE2 LYS 513 61.479 19.073 2.765 410 HE3 LYS 513 HE3 LYS 513 59.846 19.373 3.353 411 HZ1 LYS 513 HZ1 LYS 513 60.799 21.126 1.900 412 HZ2 LYS 513 HZ2 LYS 513 61.898 21.486 3.145 413 HZ3 LYS 513 HZ3 LYS 513 60.228 21.673 3.399 414 H LYS 514 H LYS 514 59.724 15.524 8.007 415 HA LYS 514 HA LYS 514 62.117 15.806 9.499 416 HB2 LYS 514 HB2 LYS 514 59.638 15.825 10.250 417 HB3 LYS 514 HB3 LYS 514 59.781 14.072 10.298 418 HG2 LYS 514 HG2 LYS 514 61.637 14.222 11.873 419 HG3 LYS 514 HG3 LYS 514 61.615 15.981 11.775 420 HD2 LYS 514 HD2 LYS 514 59.169 14.423 12.625 421 HD3 LYS 514 HD3 LYS 514 60.413 14.883 13.788 422 HE2 LYS 514 HE2 LYS 514 60.125 17.279 12.978 423 HE3 LYS 514 HE3 LYS 514 58.711 16.726 12.086 424 HZ1 LYS 514 HZ1 LYS 514 59.094 16.373 14.999 425 HZ2 LYS 514 HZ2 LYS 514 57.703 15.995 14.101 426 HZ3 LYS 514 HZ3 LYS 514 58.182 17.613 14.290 427 H LYS 515 H LYS 515 60.333 13.050 8.181 428 HA LYS 515 HA LYS 515 62.042 10.986 9.096 429 HB2 LYS 515 HB2 LYS 515 60.228 11.133 6.685 430 HB3 LYS 515 HB3 LYS 515 61.039 9.663 7.220 431 HG2 LYS 515 HG2 LYS 515 59.902 10.128 9.519 432 HG3 LYS 515 HG3 LYS 515 58.854 11.226 8.614 433 HD2 LYS 515 HD2 LYS 515 59.270 8.342 7.767 434 HD3 LYS 515 HD3 LYS 515 58.002 8.821 8.890 435 HE2 LYS 515 HE2 LYS 515 57.049 10.334 7.218 436 HE3 LYS 515 HE3 LYS 515 58.352 9.944 6.097 437 HZ1 LYS 515 HZ1 LYS 515 57.421 8.010 5.559 438 HZ2 LYS 515 HZ2 LYS 515 55.998 8.648 6.234 439 HZ3 LYS 515 HZ3 LYS 515 57.002 7.639 7.160 440 H LEU 516 H LEU 516 62.050 12.949 6.146 441 HA LEU 516 HA LEU 516 63.997 11.601 4.657 442 HB2 LEU 516 HB2 LEU 516 62.740 13.338 3.636 443 HB3 LEU 516 HB3 LEU 516 63.169 14.487 4.887 444 HG LEU 516 HG LEU 516 65.487 14.529 4.107 445 HD11 LEU 516 HD11 LEU 516 65.922 13.360 1.863 446 HD12 LEU 516 HD12 LEU 516 64.477 12.410 2.210 447 HD13 LEU 516 HD13 LEU 516 65.867 12.332 3.295 448 HD21 LEU 516 HD21 LEU 516 63.696 15.992 3.084 449 HD22 LEU 516 HD22 LEU 516 63.623 14.833 1.750 450 HD23 LEU 516 HD23 LEU 516 65.115 15.719 2.067 451 H ASP 517 H ASP 517 64.350 14.247 6.999 452 HA ASP 517 HA ASP 517 67.144 14.467 6.898 453 HB2 ASP 517 HB2 ASP 517 65.137 15.047 9.073 454 HB3 ASP 517 HB3 ASP 517 66.846 15.457 9.207 455 H GLN 518 H GLN 518 65.017 12.569 9.024 456 HA GLN 518 HA GLN 518 67.093 11.430 10.590 457 HB2 GLN 518 HB2 GLN 518 64.282 10.507 10.013 458 HB3 GLN 518 HB3 GLN 518 65.345 9.764 11.212 459 HG2 GLN 518 HG2 GLN 518 65.520 11.861 12.431 460 HG3 GLN 518 HG3 GLN 518 64.600 12.703 11.186 461 HE21 GLN 518 HE21 GLN 518 64.289 11.169 14.181 462 HE22 GLN 518 HE22 GLN 518 62.615 10.887 14.141 463 H THR 519 H THR 519 65.539 10.391 7.603 464 HA THR 519 HA THR 519 66.602 7.781 7.497 465 HB THR 519 HB THR 519 65.964 9.580 5.150 466 HG1 THR 519 HG1 THR 519 63.951 9.411 5.676 467 HG21 THR 519 HG21 THR 519 65.686 7.621 3.909 468 HG22 THR 519 HG22 THR 519 65.438 6.630 5.346 469 HG23 THR 519 HG23 THR 519 67.056 7.198 4.935 470 H ARG 520 H ARG 520 67.777 10.885 6.265 471 HA ARG 520 HA ARG 520 70.057 9.923 4.905 472 HB2 ARG 520 HB2 ARG 520 69.381 12.588 6.150 473 HB3 ARG 520 HB3 ARG 520 70.852 12.311 5.214 474 HG2 ARG 520 HG2 ARG 520 69.525 11.669 3.261 475 HG3 ARG 520 HG3 ARG 520 68.034 11.828 4.191 476 HD2 ARG 520 HD2 ARG 520 69.987 14.093 3.749 477 HD3 ARG 520 HD3 ARG 520 68.559 13.824 2.755 478 HE ARG 520 HE ARG 520 67.532 13.890 5.262 479 HH11 ARG 520 HH11 ARG 520 70.225 15.613 5.399 480 HH12 ARG 520 HH12 ARG 520 69.527 17.199 5.394 481 HH21 ARG 520 HH21 ARG 520 66.377 16.101 4.457 482 HH22 ARG 520 HH22 ARG 520 67.353 17.475 4.862 483 H VAL 521 H VAL 521 69.484 10.870 8.252 484 HA VAL 521 HA VAL 521 72.155 10.956 9.145 485 HB VAL 521 HB VAL 521 69.548 10.338 10.544 486 HG11 VAL 521 HG11 VAL 521 72.335 10.661 11.658 487 HG12 VAL 521 HG12 VAL 521 71.202 9.333 11.923 488 HG13 VAL 521 HG13 VAL 521 70.888 10.915 12.633 489 HG21 VAL 521 HG21 VAL 521 70.141 12.668 9.502 490 HG22 VAL 521 HG22 VAL 521 71.241 12.812 10.871 491 HG23 VAL 521 HG23 VAL 521 69.511 12.603 11.146 492 H GLU 522 H GLU 522 69.769 8.312 9.141 493 HA GLU 522 HA GLU 522 71.419 6.357 10.348 494 HB2 GLU 522 HB2 GLU 522 69.103 6.082 8.419 495 HB3 GLU 522 HB3 GLU 522 69.796 4.759 9.358 496 HG2 GLU 522 HG2 GLU 522 68.645 7.286 10.579 497 HG3 GLU 522 HG3 GLU 522 67.756 5.772 10.412 498 H LEU 523 H LEU 523 70.748 7.164 6.977 499 HA LEU 523 HA LEU 523 72.291 5.134 5.757 500 HB2 LEU 523 HB2 LEU 523 70.581 6.375 4.583 501 HB3 LEU 523 HB3 LEU 523 71.478 7.876 4.789 502 HG LEU 523 HG LEU 523 73.101 5.711 3.562 503 HD11 LEU 523 HD11 LEU 523 71.978 6.079 1.309 504 HD12 LEU 523 HD12 LEU 523 70.596 6.707 2.203 505 HD13 LEU 523 HD13 LEU 523 71.117 5.040 2.443 506 HD21 LEU 523 HD21 LEU 523 72.436 8.470 2.512 507 HD22 LEU 523 HD22 LEU 523 73.858 7.490 2.155 508 HD23 LEU 523 HD23 LEU 523 73.650 8.190 3.760 509 H ALA 524 H ALA 524 73.095 8.474 6.703 510 HA ALA 524 HA ALA 524 75.655 8.561 5.533 511 HB1 ALA 524 HB1 ALA 524 74.757 9.983 8.042 512 HB2 ALA 524 HB2 ALA 524 74.367 10.519 6.406 513 HB3 ALA 524 HB3 ALA 524 76.047 10.469 6.943 514 H ASP 525 H ASP 525 74.556 7.468 8.717 515 HA ASP 525 HA ASP 525 77.137 7.043 9.826 516 HB2 ASP 525 HB2 ASP 525 74.922 7.196 11.048 517 HB3 ASP 525 HB3 ASP 525 74.593 5.558 10.490 518 H GLN 526 H GLN 526 74.915 5.060 7.955 519 HA GLN 526 HA GLN 526 76.282 2.582 8.162 520 HB2 GLN 526 HB2 GLN 526 73.918 2.890 7.450 521 HB3 GLN 526 HB3 GLN 526 74.494 3.619 5.954 522 HG2 GLN 526 HG2 GLN 526 75.730 1.512 5.445 523 HG3 GLN 526 HG3 GLN 526 75.035 0.789 6.897 524 HE21 GLN 526 HE21 GLN 526 73.083 -0.299 6.561 525 HE22 GLN 526 HE22 GLN 526 72.033 -0.018 5.257 526 H VAL 527 H VAL 527 76.440 5.278 5.910 527 HA VAL 527 HA VAL 527 78.210 4.077 4.028 528 HB VAL 527 HB VAL 527 77.441 6.934 4.634 529 HG11 VAL 527 HG11 VAL 527 79.242 5.802 2.490 530 HG12 VAL 527 HG12 VAL 527 79.595 7.100 3.633 531 HG13 VAL 527 HG13 VAL 527 78.438 7.362 2.329 532 HG21 VAL 527 HG21 VAL 527 76.773 5.271 2.204 533 HG22 VAL 527 HG22 VAL 527 75.983 6.738 2.781 534 HG23 VAL 527 HG23 VAL 527 75.777 5.223 3.659 535 H LYS 528 H LYS 528 78.627 6.213 6.805 536 HA LYS 528 HA LYS 528 81.401 6.687 6.519 537 HB2 LYS 528 HB2 LYS 528 79.913 8.075 7.878 538 HB3 LYS 528 HB3 LYS 528 79.630 6.711 8.958 539 HG2 LYS 528 HG2 LYS 528 81.979 6.674 9.608 540 HG3 LYS 528 HG3 LYS 528 82.347 7.945 8.438 541 HD2 LYS 528 HD2 LYS 528 82.126 8.973 10.625 542 HD3 LYS 528 HD3 LYS 528 80.735 9.442 9.648 543 HE2 LYS 528 HE2 LYS 528 79.275 8.015 10.806 544 HE3 LYS 528 HE3 LYS 528 80.588 7.019 11.435 545 HZ1 LYS 528 HZ1 LYS 528 80.045 8.286 13.243 546 HZ2 LYS 528 HZ2 LYS 528 79.663 9.661 12.320 547 HZ3 LYS 528 HZ3 LYS 528 81.287 9.224 12.567 548 H SER 529 H SER 529 79.571 4.323 8.458 549 HA SER 529 HA SER 529 81.910 3.161 9.613 550 HB2 SER 529 HB2 SER 529 79.146 1.969 9.339 551 HB3 SER 529 HB3 SER 529 80.401 1.468 10.469 552 HG SER 529 HG SER 529 80.105 4.047 10.822 553 H ALA 530 H ALA 530 79.779 2.321 6.907 554 HA ALA 530 HA ALA 530 81.236 -0.078 6.258 555 HB1 ALA 530 HB1 ALA 530 79.677 -0.334 4.495 556 HB2 ALA 530 HB2 ALA 530 79.287 1.387 4.491 557 HB3 ALA 530 HB3 ALA 530 78.764 0.368 5.830 558 H VAL 531 H VAL 531 82.283 2.911 6.157 559 HA VAL 531 HA VAL 531 83.102 3.321 3.455 560 HB VAL 531 HB VAL 531 82.897 5.010 5.378 561 HG11 VAL 531 HG11 VAL 531 85.753 4.217 5.932 562 HG12 VAL 531 HG12 VAL 531 84.413 3.548 6.863 563 HG13 VAL 531 HG13 VAL 531 84.711 5.286 6.872 564 HG21 VAL 531 HG21 VAL 531 83.786 5.696 3.245 565 HG22 VAL 531 HG22 VAL 531 85.332 4.919 3.587 566 HG23 VAL 531 HG23 VAL 531 84.841 6.350 4.496 567 H THR 532 H THR 532 84.733 2.289 2.346 568 HA THR 532 HA THR 532 87.186 1.599 3.639 569 HB THR 532 HB THR 532 86.001 -0.221 4.567 570 HG1 THR 532 HG1 THR 532 87.606 -0.747 2.350 571 HG21 THR 532 HG21 THR 532 83.982 -0.463 3.419 572 HG22 THR 532 HG22 THR 532 84.876 -1.873 2.855 573 HG23 THR 532 HG23 THR 532 84.757 -0.441 1.839 574 H GLU 533 H GLU 533 85.102 1.074 0.803 575 HA GLU 533 HA GLU 533 87.507 1.330 -0.912 576 HB2 GLU 533 HB2 GLU 533 85.278 -0.707 -1.176 577 HB3 GLU 533 HB3 GLU 533 86.474 -0.381 -2.434 578 HG2 GLU 533 HG2 GLU 533 88.287 -1.047 -0.952 579 HG3 GLU 533 HG3 GLU 533 87.168 -1.225 0.397 580 H PHE 534 H PHE 534 84.479 0.561 -2.279 581 HA PHE 534 HA PHE 534 83.245 1.733 -3.825 582 HB2 PHE 534 HB2 PHE 534 83.239 3.484 -1.378 583 HB3 PHE 534 HB3 PHE 534 82.138 3.703 -2.738 584 HD1 PHE 534 HD1 PHE 534 80.425 2.025 -3.255 585 HD2 PHE 534 HD2 PHE 534 83.050 1.586 0.114 586 HE1 PHE 534 HE1 PHE 534 78.948 0.259 -2.334 587 HE2 PHE 534 HE2 PHE 534 81.575 -0.180 1.037 588 HZ PHE 534 HZ PHE 534 79.523 -0.843 -0.188 589 H GLU 535 H GLU 535 84.646 2.326 -5.507 590 HA GLU 535 HA GLU 535 86.605 4.230 -5.624 591 HB2 GLU 535 HB2 GLU 535 86.038 4.482 -7.998 592 HB3 GLU 535 HB3 GLU 535 85.921 2.789 -7.511 593 HG2 GLU 535 HG2 GLU 535 83.458 3.140 -7.131 594 HG3 GLU 535 HG3 GLU 535 83.628 4.748 -7.829 595 H ASN 536 H ASN 536 86.664 6.469 -6.238 596 HA ASN 536 HA ASN 536 86.031 8.665 -6.084 597 HB2 ASN 536 HB2 ASN 536 84.434 7.699 -7.870 598 HB3 ASN 536 HB3 ASN 536 83.206 7.757 -6.609 599 HD21 ASN 536 HD21 ASN 536 83.173 10.053 -5.430 600 HD22 ASN 536 HD22 ASN 536 83.288 11.392 -6.467 601 H VAL 537 H VAL 537 86.287 7.528 -3.615 602 HA VAL 537 HA VAL 537 83.991 7.742 -1.972 603 HB VAL 537 HB VAL 537 85.691 7.837 -0.128 604 HG11 VAL 537 HG11 VAL 537 84.819 5.698 -1.281 605 HG12 VAL 537 HG12 VAL 537 86.310 5.558 -0.353 606 HG13 VAL 537 HG13 VAL 537 86.376 5.670 -2.111 607 HG21 VAL 537 HG21 VAL 537 88.028 7.656 -0.657 608 HG22 VAL 537 HG22 VAL 537 87.399 9.046 -1.541 609 HG23 VAL 537 HG23 VAL 537 87.676 7.520 -2.380 610 H THR 538 H THR 538 83.250 9.404 -0.700 611 HA THR 538 HA THR 538 84.590 12.024 -0.815 612 HB THR 538 HB THR 538 81.651 11.787 -1.445 613 HG1 THR 538 HG1 THR 538 82.170 11.742 -3.577 614 HG21 THR 538 HG21 THR 538 82.683 13.976 -0.703 615 HG22 THR 538 HG22 THR 538 81.933 14.025 -2.299 616 HG23 THR 538 HG23 THR 538 83.687 13.917 -2.150 617 HA PRO 539 HA PRO 539 82.635 10.453 3.314 618 HB2 PRO 539 HB2 PRO 539 84.934 11.753 4.529 619 HB3 PRO 539 HB3 PRO 539 84.546 10.023 4.500 620 HG2 PRO 539 HG2 PRO 539 86.360 11.571 2.749 621 HG3 PRO 539 HG3 PRO 539 86.388 9.847 3.161 622 HD2 PRO 539 HD2 PRO 539 85.642 10.673 0.714 623 HD3 PRO 539 HD3 PRO 539 84.841 9.291 1.491 624 H THR 540 H THR 540 83.849 13.408 1.919 625 HA THR 540 HA THR 540 83.345 15.624 2.284 626 HB THR 540 HB THR 540 80.701 14.286 2.916 627 HG1 THR 540 HG1 THR 540 80.313 14.861 0.723 628 HG21 THR 540 HG21 THR 540 81.425 17.170 2.376 629 HG22 THR 540 HG22 THR 540 80.556 16.513 3.764 630 HG23 THR 540 HG23 THR 540 79.789 16.547 2.175 631 H ASN 541 H ASN 541 84.698 16.058 4.089 632 HA ASN 541 HA ASN 541 83.755 15.525 6.765 633 HB2 ASN 541 HB2 ASN 541 86.106 17.112 5.722 634 HB3 ASN 541 HB3 ASN 541 85.779 16.829 7.433 635 HD21 ASN 541 HD21 ASN 541 84.779 14.097 7.127 636 HD22 ASN 541 HD22 ASN 541 86.106 13.129 6.704 637 H ASP 542 H ASP 542 82.772 16.838 8.148 638 HA ASP 542 HA ASP 542 81.649 19.349 7.137 639 HB2 ASP 542 HB2 ASP 542 80.207 19.125 9.174 640 HB3 ASP 542 HB3 ASP 542 80.102 17.745 8.079 641 H GLN 543 H GLN 543 84.384 18.497 8.791 642 HA GLN 543 HA GLN 543 84.348 20.325 10.974 643 HB2 GLN 543 HB2 GLN 543 85.853 18.353 10.772 644 HB3 GLN 543 HB3 GLN 543 86.729 19.196 9.496 645 HG2 GLN 543 HG2 GLN 543 87.904 19.529 11.587 646 HG3 GLN 543 HG3 GLN 543 87.174 21.061 11.113 647 HE21 GLN 543 HE21 GLN 543 86.884 21.910 13.252 648 HE22 GLN 543 HE22 GLN 543 85.842 21.197 14.387 Start of MODEL 2 1 H1 SER 466 H1 SER 466 32.240 6.378 4.739 2 H2 SER 466 H2 SER 466 31.917 7.523 5.951 3 H3 SER 466 H3 SER 466 32.056 8.014 4.332 4 HA SER 466 HA SER 466 29.867 6.508 5.624 5 HB2 SER 466 HB2 SER 466 28.541 8.270 4.436 6 HB3 SER 466 HB3 SER 466 29.674 8.931 5.611 7 HG SER 466 HG SER 466 30.980 9.581 3.997 8 H ASP 467 H ASP 467 31.970 5.915 3.268 9 HA ASP 467 HA ASP 467 30.045 4.440 1.640 10 HB2 ASP 467 HB2 ASP 467 30.855 5.453 -0.453 11 HB3 ASP 467 HB3 ASP 467 30.137 6.670 0.603 12 H ASP 468 H ASP 468 31.280 3.159 -0.091 13 HA ASP 468 HA ASP 468 33.480 1.802 1.212 14 HB2 ASP 468 HB2 ASP 468 32.055 1.340 -1.418 15 HB3 ASP 468 HB3 ASP 468 33.343 0.304 -0.800 16 H TYR 469 H TYR 469 33.183 4.437 -0.680 17 HA TYR 469 HA TYR 469 35.571 4.152 -2.312 18 HB2 TYR 469 HB2 TYR 469 33.365 5.242 -2.955 19 HB3 TYR 469 HB3 TYR 469 33.821 6.568 -1.889 20 HD1 TYR 469 HD1 TYR 469 34.676 4.731 -4.973 21 HD2 TYR 469 HD2 TYR 469 35.586 8.084 -2.458 22 HE1 TYR 469 HE1 TYR 469 36.060 5.706 -6.781 23 HE2 TYR 469 HE2 TYR 469 36.968 9.067 -4.261 24 HH TYR 469 HH TYR 469 38.292 7.958 -6.357 25 H VAL 470 H VAL 470 37.372 5.549 -2.169 26 HA VAL 470 HA VAL 470 37.890 6.658 0.541 27 HB VAL 470 HB VAL 470 39.945 5.869 -1.529 28 HG11 VAL 470 HG11 VAL 470 41.354 5.696 0.561 29 HG12 VAL 470 HG12 VAL 470 40.061 6.560 1.394 30 HG13 VAL 470 HG13 VAL 470 40.905 7.322 0.045 31 HG21 VAL 470 HG21 VAL 470 38.770 4.250 0.741 32 HG22 VAL 470 HG22 VAL 470 40.222 3.800 -0.154 33 HG23 VAL 470 HG23 VAL 470 38.667 3.885 -0.981 34 H ASP 471 H ASP 471 38.330 8.763 0.773 35 HA ASP 471 HA ASP 471 37.863 10.696 -1.154 36 HB2 ASP 471 HB2 ASP 471 39.622 10.787 1.303 37 HB3 ASP 471 HB3 ASP 471 39.257 12.205 0.323 38 H GLU 472 H GLU 472 39.149 11.934 -2.460 39 HA GLU 472 HA GLU 472 41.137 10.667 -3.961 40 HB2 GLU 472 HB2 GLU 472 40.353 13.592 -3.706 41 HB3 GLU 472 HB3 GLU 472 41.508 13.001 -4.903 42 HG2 GLU 472 HG2 GLU 472 39.367 13.051 -5.991 43 HG3 GLU 472 HG3 GLU 472 39.719 11.358 -5.656 44 H GLU 473 H GLU 473 41.450 13.049 -1.343 45 HA GLU 473 HA GLU 473 44.232 13.446 -1.576 46 HB2 GLU 473 HB2 GLU 473 43.061 15.084 -0.368 47 HB3 GLU 473 HB3 GLU 473 42.145 13.898 0.556 48 HG2 GLU 473 HG2 GLU 473 44.052 13.341 1.880 49 HG3 GLU 473 HG3 GLU 473 45.127 14.275 0.837 50 H THR 474 H THR 474 42.280 11.270 0.399 51 HA THR 474 HA THR 474 44.404 10.083 1.847 52 HB THR 474 HB THR 474 41.599 9.223 1.113 53 HG1 THR 474 HG1 THR 474 42.758 9.914 3.599 54 HG21 THR 474 HG21 THR 474 42.803 7.162 1.406 55 HG22 THR 474 HG22 THR 474 41.874 7.453 2.871 56 HG23 THR 474 HG23 THR 474 43.608 7.774 2.846 57 H TYR 475 H TYR 475 42.696 9.203 -1.100 58 HA TYR 475 HA TYR 475 43.950 6.745 -1.544 59 HB2 TYR 475 HB2 TYR 475 41.848 7.698 -2.598 60 HB3 TYR 475 HB3 TYR 475 42.897 8.629 -3.665 61 HD1 TYR 475 HD1 TYR 475 42.406 5.171 -2.383 62 HD2 TYR 475 HD2 TYR 475 43.582 7.650 -5.678 63 HE1 TYR 475 HE1 TYR 475 42.643 3.147 -3.815 64 HE2 TYR 475 HE2 TYR 475 43.831 5.634 -7.114 65 HH TYR 475 HH TYR 475 43.930 3.389 -7.112 66 H ASN 476 H ASN 476 44.738 9.985 -2.810 67 HA ASN 476 HA ASN 476 46.957 9.086 -4.366 68 HB2 ASN 476 HB2 ASN 476 46.507 11.853 -3.209 69 HB3 ASN 476 HB3 ASN 476 47.497 11.412 -4.607 70 HD21 ASN 476 HD21 ASN 476 45.165 9.321 -5.150 71 HD22 ASN 476 HD22 ASN 476 44.021 10.262 -5.982 72 H LEU 477 H LEU 477 46.508 10.163 -1.070 73 HA LEU 477 HA LEU 477 49.197 10.498 -0.306 74 HB2 LEU 477 HB2 LEU 477 47.260 11.172 1.085 75 HB3 LEU 477 HB3 LEU 477 46.837 9.485 1.321 76 HG LEU 477 HG LEU 477 49.030 9.101 2.403 77 HD11 LEU 477 HD11 LEU 477 49.375 12.003 1.684 78 HD12 LEU 477 HD12 LEU 477 50.542 10.682 1.594 79 HD13 LEU 477 HD13 LEU 477 50.133 11.387 3.152 80 HD21 LEU 477 HD21 LEU 477 48.463 10.322 4.476 81 HD22 LEU 477 HD22 LEU 477 47.023 9.648 3.717 82 HD23 LEU 477 HD23 LEU 477 47.377 11.366 3.556 83 H GLN 478 H GLN 478 47.031 7.652 -0.294 84 HA GLN 478 HA GLN 478 48.797 5.761 0.782 85 HB2 GLN 478 HB2 GLN 478 46.523 5.542 -1.207 86 HB3 GLN 478 HB3 GLN 478 47.369 4.127 -0.589 87 HG2 GLN 478 HG2 GLN 478 46.116 6.223 1.190 88 HG3 GLN 478 HG3 GLN 478 45.270 4.765 0.680 89 HE21 GLN 478 HE21 GLN 478 46.630 5.853 3.340 90 HE22 GLN 478 HE22 GLN 478 47.433 4.472 3.913 91 H LYS 479 H LYS 479 48.297 6.841 -2.515 92 HA LYS 479 HA LYS 479 50.068 5.045 -3.801 93 HB2 LYS 479 HB2 LYS 479 48.916 7.749 -4.556 94 HB3 LYS 479 HB3 LYS 479 49.934 6.800 -5.644 95 HG2 LYS 479 HG2 LYS 479 48.276 4.851 -5.158 96 HG3 LYS 479 HG3 LYS 479 47.213 6.106 -4.525 97 HD2 LYS 479 HD2 LYS 479 48.444 6.217 -7.281 98 HD3 LYS 479 HD3 LYS 479 46.873 5.504 -6.956 99 HE2 LYS 479 HE2 LYS 479 46.145 7.662 -5.954 100 HE3 LYS 479 HE3 LYS 479 47.693 8.368 -6.453 101 HZ1 LYS 479 HZ1 LYS 479 45.402 8.061 -7.980 102 HZ2 LYS 479 HZ2 LYS 479 46.535 6.958 -8.600 103 HZ3 LYS 479 HZ3 LYS 479 46.922 8.610 -8.495 104 H LEU 480 H LEU 480 50.447 8.265 -2.497 105 HA LEU 480 HA LEU 480 53.007 8.832 -3.495 106 HB2 LEU 480 HB2 LEU 480 51.286 9.793 -1.233 107 HB3 LEU 480 HB3 LEU 480 52.944 10.372 -1.349 108 HG LEU 480 HG LEU 480 51.224 10.447 -3.821 109 HD11 LEU 480 HD11 LEU 480 49.688 11.503 -2.367 110 HD12 LEU 480 HD12 LEU 480 50.600 12.847 -3.053 111 HD13 LEU 480 HD13 LEU 480 50.966 12.272 -1.425 112 HD21 LEU 480 HD21 LEU 480 53.602 11.056 -3.953 113 HD22 LEU 480 HD22 LEU 480 53.382 12.253 -2.677 114 HD23 LEU 480 HD23 LEU 480 52.598 12.473 -4.241 115 H LEU 481 H LEU 481 51.975 7.399 -0.414 116 HA LEU 481 HA LEU 481 54.592 7.195 0.707 117 HB2 LEU 481 HB2 LEU 481 52.062 5.704 1.429 118 HB3 LEU 481 HB3 LEU 481 53.466 5.965 2.467 119 HG LEU 481 HG LEU 481 51.713 8.140 1.319 120 HD11 LEU 481 HD11 LEU 481 51.952 7.122 4.148 121 HD12 LEU 481 HD12 LEU 481 50.596 6.817 3.061 122 HD13 LEU 481 HD13 LEU 481 50.932 8.458 3.608 123 HD21 LEU 481 HD21 LEU 481 54.197 8.181 2.974 124 HD22 LEU 481 HD22 LEU 481 53.015 9.489 3.103 125 HD23 LEU 481 HD23 LEU 481 53.793 9.157 1.565 126 H ALA 482 H ALA 482 52.478 4.982 -0.999 127 HA ALA 482 HA ALA 482 53.361 2.527 -0.677 128 HB1 ALA 482 HB1 ALA 482 52.401 4.003 -3.016 129 HB2 ALA 482 HB2 ALA 482 51.972 2.394 -2.469 130 HB3 ALA 482 HB3 ALA 482 53.401 2.625 -3.471 131 HA PRO 483 HA PRO 483 57.246 2.801 -3.707 132 HB2 PRO 483 HB2 PRO 483 58.261 5.492 -3.470 133 HB3 PRO 483 HB3 PRO 483 57.578 4.723 -4.916 134 HG2 PRO 483 HG2 PRO 483 56.270 6.502 -2.940 135 HG3 PRO 483 HG3 PRO 483 55.954 6.321 -4.672 136 HD2 PRO 483 HD2 PRO 483 54.259 5.337 -2.867 137 HD3 PRO 483 HD3 PRO 483 54.614 4.418 -4.348 138 H TYR 484 H TYR 484 57.253 5.190 -1.053 139 HA TYR 484 HA TYR 484 59.799 4.359 -0.041 140 HB2 TYR 484 HB2 TYR 484 59.342 6.590 0.455 141 HB3 TYR 484 HB3 TYR 484 57.654 6.270 0.879 142 HD1 TYR 484 HD1 TYR 484 57.077 5.294 3.088 143 HD2 TYR 484 HD2 TYR 484 61.135 6.284 2.088 144 HE1 TYR 484 HE1 TYR 484 57.707 5.121 5.475 145 HE2 TYR 484 HE2 TYR 484 61.755 6.114 4.482 146 HH TYR 484 HH TYR 484 59.417 5.059 6.923 147 H HIS 485 H HIS 485 56.494 3.488 0.538 148 HA HIS 485 HA HIS 485 56.747 2.209 3.039 149 HB2 HIS 485 HB2 HIS 485 54.614 2.890 1.857 150 HB3 HIS 485 HB3 HIS 485 54.816 1.476 0.830 151 HD1 HIS 485 HD1 HIS 485 53.578 -0.478 1.630 152 HD2 HIS 485 HD2 HIS 485 54.761 1.962 4.792 153 HE1 HIS 485 HE1 HIS 485 52.653 -1.539 3.731 154 H LYS 486 H LYS 486 57.188 1.072 -0.270 155 HA LYS 486 HA LYS 486 57.667 -1.684 0.538 156 HB2 LYS 486 HB2 LYS 486 58.045 -1.999 -1.904 157 HB3 LYS 486 HB3 LYS 486 56.532 -1.153 -1.582 158 HG2 LYS 486 HG2 LYS 486 57.481 0.961 -2.126 159 HG3 LYS 486 HG3 LYS 486 59.112 0.309 -2.186 160 HD2 LYS 486 HD2 LYS 486 58.384 0.556 -4.442 161 HD3 LYS 486 HD3 LYS 486 58.343 -1.170 -4.084 162 HE2 LYS 486 HE2 LYS 486 55.976 -1.173 -3.862 163 HE3 LYS 486 HE3 LYS 486 55.901 0.588 -3.763 164 HZ1 LYS 486 HZ1 LYS 486 57.228 -0.209 -6.124 165 HZ2 LYS 486 HZ2 LYS 486 55.820 0.728 -5.950 166 HZ3 LYS 486 HZ3 LYS 486 55.713 -0.965 -6.034 167 H ALA 487 H ALA 487 59.429 1.200 0.054 168 HA ALA 487 HA ALA 487 61.998 0.268 -0.657 169 HB1 ALA 487 HB1 ALA 487 62.724 2.483 -0.037 170 HB2 ALA 487 HB2 ALA 487 61.266 2.737 0.918 171 HB3 ALA 487 HB3 ALA 487 61.159 2.615 -0.838 172 H LYS 488 H LYS 488 62.814 -1.351 0.591 173 HA LYS 488 HA LYS 488 62.836 -1.160 3.511 174 HB2 LYS 488 HB2 LYS 488 63.860 -3.253 1.594 175 HB3 LYS 488 HB3 LYS 488 63.927 -3.391 3.353 176 HG2 LYS 488 HG2 LYS 488 61.473 -3.066 3.451 177 HG3 LYS 488 HG3 LYS 488 61.423 -3.034 1.689 178 HD2 LYS 488 HD2 LYS 488 62.560 -5.344 3.274 179 HD3 LYS 488 HD3 LYS 488 60.879 -5.274 2.752 180 HE2 LYS 488 HE2 LYS 488 61.804 -4.915 0.373 181 HE3 LYS 488 HE3 LYS 488 63.362 -5.419 1.032 182 HZ1 LYS 488 HZ1 LYS 488 62.161 -7.290 0.125 183 HZ2 LYS 488 HZ2 LYS 488 60.847 -6.983 1.157 184 HZ3 LYS 488 HZ3 LYS 488 62.346 -7.460 1.801 185 H THR 489 H THR 489 64.776 -0.055 1.026 186 HA THR 489 HA THR 489 67.304 -0.266 2.555 187 HB THR 489 HB THR 489 68.197 0.658 0.291 188 HG1 THR 489 HG1 THR 489 66.756 0.904 -1.207 189 HG21 THR 489 HG21 THR 489 67.944 -1.667 -0.745 190 HG22 THR 489 HG22 THR 489 66.976 -2.079 0.671 191 HG23 THR 489 HG23 THR 489 68.667 -1.608 0.863 192 H LEU 490 H LEU 490 68.208 1.454 3.458 193 HA LEU 490 HA LEU 490 66.808 3.826 3.929 194 HB2 LEU 490 HB2 LEU 490 69.671 2.965 4.262 195 HB3 LEU 490 HB3 LEU 490 69.215 4.627 4.621 196 HG LEU 490 HG LEU 490 67.571 2.381 5.774 197 HD11 LEU 490 HD11 LEU 490 69.044 2.283 7.741 198 HD12 LEU 490 HD12 LEU 490 70.177 3.387 6.956 199 HD13 LEU 490 HD13 LEU 490 69.903 1.777 6.289 200 HD21 LEU 490 HD21 LEU 490 67.401 4.045 7.656 201 HD22 LEU 490 HD22 LEU 490 66.737 4.606 6.131 202 HD23 LEU 490 HD23 LEU 490 68.312 5.178 6.663 203 H GLU 491 H GLU 491 69.407 3.133 1.644 204 HA GLU 491 HA GLU 491 69.888 5.680 0.636 205 HB2 GLU 491 HB2 GLU 491 71.284 3.771 0.103 206 HB3 GLU 491 HB3 GLU 491 69.950 2.962 -0.712 207 HG2 GLU 491 HG2 GLU 491 71.460 3.978 -2.341 208 HG3 GLU 491 HG3 GLU 491 69.900 4.789 -2.393 209 H ARG 492 H ARG 492 67.516 3.276 -0.319 210 HA ARG 492 HA ARG 492 66.399 4.789 -2.458 211 HB2 ARG 492 HB2 ARG 492 66.221 2.362 -2.409 212 HB3 ARG 492 HB3 ARG 492 65.287 2.431 -0.912 213 HG2 ARG 492 HG2 ARG 492 63.459 3.534 -1.996 214 HG3 ARG 492 HG3 ARG 492 64.424 3.832 -3.449 215 HD2 ARG 492 HD2 ARG 492 64.518 1.478 -3.957 216 HD3 ARG 492 HD3 ARG 492 63.756 1.064 -2.418 217 HE ARG 492 HE ARG 492 61.981 2.759 -3.676 218 HH11 ARG 492 HH11 ARG 492 63.418 1.127 -5.993 219 HH12 ARG 492 HH12 ARG 492 62.179 -0.045 -6.301 220 HH21 ARG 492 HH21 ARG 492 60.437 0.654 -3.377 221 HH22 ARG 492 HH22 ARG 492 60.483 -0.313 -4.812 222 H GLN 493 H GLN 493 65.552 4.314 0.922 223 HA GLN 493 HA GLN 493 63.063 5.558 0.977 224 HB2 GLN 493 HB2 GLN 493 65.298 5.341 3.002 225 HB3 GLN 493 HB3 GLN 493 63.780 6.140 3.386 226 HG2 GLN 493 HG2 GLN 493 62.524 4.130 2.908 227 HG3 GLN 493 HG3 GLN 493 63.956 3.322 2.293 228 HE21 GLN 493 HE21 GLN 493 62.984 1.808 4.194 229 HE22 GLN 493 HE22 GLN 493 63.706 2.053 5.711 230 H VAL 494 H VAL 494 66.310 6.995 1.348 231 HA VAL 494 HA VAL 494 65.453 9.653 1.722 232 HB VAL 494 HB VAL 494 67.995 8.460 0.569 233 HG11 VAL 494 HG11 VAL 494 67.395 11.336 1.313 234 HG12 VAL 494 HG12 VAL 494 67.817 10.737 -0.288 235 HG13 VAL 494 HG13 VAL 494 69.009 10.701 1.011 236 HG21 VAL 494 HG21 VAL 494 68.861 9.150 2.825 237 HG22 VAL 494 HG22 VAL 494 67.595 7.928 2.901 238 HG23 VAL 494 HG23 VAL 494 67.217 9.611 3.265 239 H TYR 495 H TYR 495 66.361 7.855 -1.203 240 HA TYR 495 HA TYR 495 66.011 9.896 -3.093 241 HB2 TYR 495 HB2 TYR 495 67.131 7.882 -3.678 242 HB3 TYR 495 HB3 TYR 495 65.753 6.892 -3.224 243 HD1 TYR 495 HD1 TYR 495 66.741 9.638 -5.574 244 HD2 TYR 495 HD2 TYR 495 64.229 6.222 -4.867 245 HE1 TYR 495 HE1 TYR 495 65.905 9.767 -7.905 246 HE2 TYR 495 HE2 TYR 495 63.397 6.348 -7.191 247 HH TYR 495 HH TYR 495 64.595 8.856 -9.435 248 H GLU 496 H GLU 496 63.678 7.443 -1.977 249 HA GLU 496 HA GLU 496 61.528 8.303 -3.606 250 HB2 GLU 496 HB2 GLU 496 61.546 6.791 -0.983 251 HB3 GLU 496 HB3 GLU 496 60.132 6.984 -2.024 252 HG2 GLU 496 HG2 GLU 496 62.757 5.783 -2.943 253 HG3 GLU 496 HG3 GLU 496 61.374 4.826 -2.427 254 H LEU 497 H LEU 497 62.528 9.087 -0.341 255 HA LEU 497 HA LEU 497 60.344 10.722 0.350 256 HB2 LEU 497 HB2 LEU 497 63.196 10.501 1.272 257 HB3 LEU 497 HB3 LEU 497 62.115 11.713 1.969 258 HG LEU 497 HG LEU 497 61.479 8.755 1.821 259 HD11 LEU 497 HD11 LEU 497 63.467 9.548 3.351 260 HD12 LEU 497 HD12 LEU 497 62.267 8.422 3.973 261 HD13 LEU 497 HD13 LEU 497 62.164 10.128 4.392 262 HD21 LEU 497 HD21 LEU 497 60.003 11.151 2.805 263 HD22 LEU 497 HD22 LEU 497 59.916 9.710 3.818 264 HD23 LEU 497 HD23 LEU 497 59.389 9.635 2.140 265 H GLU 498 H GLU 498 63.406 11.425 -1.257 266 HA GLU 498 HA GLU 498 63.291 14.216 -1.282 267 HB2 GLU 498 HB2 GLU 498 64.465 12.153 -3.139 268 HB3 GLU 498 HB3 GLU 498 64.596 13.866 -3.518 269 HG2 GLU 498 HG2 GLU 498 65.759 14.301 -1.473 270 HG3 GLU 498 HG3 GLU 498 65.427 12.689 -0.871 271 H LYS 499 H LYS 499 62.130 11.932 -3.772 272 HA LYS 499 HA LYS 499 60.920 13.921 -5.441 273 HB2 LYS 499 HB2 LYS 499 60.564 10.937 -5.066 274 HB3 LYS 499 HB3 LYS 499 59.728 11.843 -6.329 275 HG2 LYS 499 HG2 LYS 499 61.633 12.094 -7.595 276 HG3 LYS 499 HG3 LYS 499 62.656 12.378 -6.190 277 HD2 LYS 499 HD2 LYS 499 63.331 10.314 -7.247 278 HD3 LYS 499 HD3 LYS 499 62.570 9.920 -5.707 279 HE2 LYS 499 HE2 LYS 499 61.725 8.448 -7.510 280 HE3 LYS 499 HE3 LYS 499 60.440 9.485 -6.887 281 HZ1 LYS 499 HZ1 LYS 499 61.846 10.799 -8.956 282 HZ2 LYS 499 HZ2 LYS 499 60.195 10.406 -8.863 283 HZ3 LYS 499 HZ3 LYS 499 61.303 9.289 -9.500 284 H LEU 500 H LEU 500 59.637 11.764 -2.945 285 HA LEU 500 HA LEU 500 56.937 12.486 -3.211 286 HB2 LEU 500 HB2 LEU 500 58.532 11.389 -0.893 287 HB3 LEU 500 HB3 LEU 500 56.779 11.500 -0.898 288 HG LEU 500 HG LEU 500 58.279 10.093 -3.110 289 HD11 LEU 500 HD11 LEU 500 57.925 7.990 -1.932 290 HD12 LEU 500 HD12 LEU 500 57.115 8.830 -0.609 291 HD13 LEU 500 HD13 LEU 500 58.839 9.078 -0.888 292 HD21 LEU 500 HD21 LEU 500 56.077 8.873 -3.267 293 HD22 LEU 500 HD22 LEU 500 55.988 10.565 -3.699 294 HD23 LEU 500 HD23 LEU 500 55.413 10.037 -2.119 295 H GLN 501 H GLN 501 59.514 13.757 -1.178 296 HA GLN 501 HA GLN 501 58.084 15.513 0.417 297 HB2 GLN 501 HB2 GLN 501 60.881 15.423 -0.677 298 HB3 GLN 501 HB3 GLN 501 60.360 16.877 0.175 299 HG2 GLN 501 HG2 GLN 501 60.053 14.095 1.334 300 HG3 GLN 501 HG3 GLN 501 61.462 15.112 1.640 301 HE21 GLN 501 HE21 GLN 501 58.920 14.175 3.278 302 HE22 GLN 501 HE22 GLN 501 58.443 15.610 4.048 303 H GLU 502 H GLU 502 58.926 15.753 -2.938 304 HA GLU 502 HA GLU 502 58.395 18.574 -3.194 305 HB2 GLU 502 HB2 GLU 502 59.986 17.345 -4.654 306 HB3 GLU 502 HB3 GLU 502 58.655 16.390 -5.289 307 HG2 GLU 502 HG2 GLU 502 59.110 18.124 -6.856 308 HG3 GLU 502 HG3 GLU 502 57.594 18.542 -6.061 309 H LYS 503 H LYS 503 56.667 15.575 -3.569 310 HA LYS 503 HA LYS 503 54.292 16.938 -4.692 311 HB2 LYS 503 HB2 LYS 503 55.166 14.054 -4.475 312 HB3 LYS 503 HB3 LYS 503 53.583 14.544 -5.091 313 HG2 LYS 503 HG2 LYS 503 54.579 15.818 -6.867 314 HG3 LYS 503 HG3 LYS 503 56.188 15.632 -6.171 315 HD2 LYS 503 HD2 LYS 503 55.945 14.075 -8.020 316 HD3 LYS 503 HD3 LYS 503 56.012 13.177 -6.504 317 HE2 LYS 503 HE2 LYS 503 53.711 12.702 -6.532 318 HE3 LYS 503 HE3 LYS 503 53.358 13.998 -7.680 319 HZ1 LYS 503 HZ1 LYS 503 54.298 11.309 -8.160 320 HZ2 LYS 503 HZ2 LYS 503 55.098 12.509 -9.061 321 HZ3 LYS 503 HZ3 LYS 503 53.410 12.347 -9.165 322 H LEU 504 H LEU 504 55.436 15.493 -1.812 323 HA LEU 504 HA LEU 504 53.017 14.634 -0.690 324 HB2 LEU 504 HB2 LEU 504 55.727 15.290 0.388 325 HB3 LEU 504 HB3 LEU 504 54.398 15.028 1.519 326 HG LEU 504 HG LEU 504 55.151 13.096 -0.683 327 HD11 LEU 504 HD11 LEU 504 55.955 13.244 2.211 328 HD12 LEU 504 HD12 LEU 504 56.996 13.112 0.798 329 HD13 LEU 504 HD13 LEU 504 56.019 11.734 1.307 330 HD21 LEU 504 HD21 LEU 504 53.806 11.632 1.216 331 HD22 LEU 504 HD22 LEU 504 53.036 12.360 -0.188 332 HD23 LEU 504 HD23 LEU 504 52.985 13.185 1.359 333 HA PRO 505 HA PRO 505 51.062 18.780 -0.264 334 HB2 PRO 505 HB2 PRO 505 49.496 17.601 1.878 335 HB3 PRO 505 HB3 PRO 505 48.964 18.008 0.240 336 HG2 PRO 505 HG2 PRO 505 50.005 15.415 1.282 337 HG3 PRO 505 HG3 PRO 505 48.770 15.713 0.050 338 HD2 PRO 505 HD2 PRO 505 51.093 14.890 -0.722 339 HD3 PRO 505 HD3 PRO 505 50.420 16.300 -1.563 340 H GLU 506 H GLU 506 51.380 20.391 1.163 341 HA GLU 506 HA GLU 506 53.573 20.680 2.644 342 HB2 GLU 506 HB2 GLU 506 52.024 22.336 4.080 343 HB3 GLU 506 HB3 GLU 506 52.430 22.662 2.396 344 HG2 GLU 506 HG2 GLU 506 50.345 21.821 1.615 345 HG3 GLU 506 HG3 GLU 506 49.957 21.111 3.176 346 H LYS 507 H LYS 507 50.498 19.993 4.350 347 HA LYS 507 HA LYS 507 51.552 19.641 6.873 348 HB2 LYS 507 HB2 LYS 507 49.482 18.510 7.398 349 HB3 LYS 507 HB3 LYS 507 49.125 19.750 6.194 350 HG2 LYS 507 HG2 LYS 507 49.454 17.935 4.429 351 HG3 LYS 507 HG3 LYS 507 49.419 16.779 5.758 352 HD2 LYS 507 HD2 LYS 507 47.231 18.799 5.212 353 HD3 LYS 507 HD3 LYS 507 47.190 17.127 4.656 354 HE2 LYS 507 HE2 LYS 507 47.551 16.474 7.118 355 HE3 LYS 507 HE3 LYS 507 47.145 18.151 7.494 356 HZ1 LYS 507 HZ1 LYS 507 45.152 17.655 5.914 357 HZ2 LYS 507 HZ2 LYS 507 45.095 17.186 7.546 358 HZ3 LYS 507 HZ3 LYS 507 45.463 16.045 6.343 359 H TYR 508 H TYR 508 51.597 17.459 4.173 360 HA TYR 508 HA TYR 508 52.522 15.197 5.799 361 HB2 TYR 508 HB2 TYR 508 51.767 15.592 2.892 362 HB3 TYR 508 HB3 TYR 508 52.643 14.154 3.416 363 HD1 TYR 508 HD1 TYR 508 51.681 12.681 5.155 364 HD2 TYR 508 HD2 TYR 508 49.431 15.849 3.366 365 HE1 TYR 508 HE1 TYR 508 49.592 11.668 6.004 366 HE2 TYR 508 HE2 TYR 508 47.327 14.832 4.181 367 HH TYR 508 HH TYR 508 47.155 12.678 6.578 368 H LYS 509 H LYS 509 53.702 17.739 3.778 369 HA LYS 509 HA LYS 509 56.175 16.627 3.003 370 HB2 LYS 509 HB2 LYS 509 55.144 18.703 2.082 371 HB3 LYS 509 HB3 LYS 509 55.492 19.522 3.598 372 HG2 LYS 509 HG2 LYS 509 57.883 19.156 3.276 373 HG3 LYS 509 HG3 LYS 509 57.558 18.267 1.781 374 HD2 LYS 509 HD2 LYS 509 56.451 20.257 0.837 375 HD3 LYS 509 HD3 LYS 509 56.793 21.149 2.318 376 HE2 LYS 509 HE2 LYS 509 59.209 20.860 1.942 377 HE3 LYS 509 HE3 LYS 509 58.872 19.954 0.465 378 HZ1 LYS 509 HZ1 LYS 509 58.722 21.859 -0.620 379 HZ2 LYS 509 HZ2 LYS 509 59.020 22.731 0.806 380 HZ3 LYS 509 HZ3 LYS 509 57.427 22.341 0.363 381 H ALA 510 H ALA 510 55.269 18.685 5.754 382 HA ALA 510 HA ALA 510 57.765 18.876 6.988 383 HB1 ALA 510 HB1 ALA 510 56.092 20.304 7.826 384 HB2 ALA 510 HB2 ALA 510 56.310 19.133 9.132 385 HB3 ALA 510 HB3 ALA 510 54.937 18.991 8.029 386 H GLU 511 H GLU 511 55.134 16.578 7.678 387 HA GLU 511 HA GLU 511 56.416 15.108 9.689 388 HB2 GLU 511 HB2 GLU 511 54.042 14.902 9.149 389 HB3 GLU 511 HB3 GLU 511 54.424 14.229 7.568 390 HG2 GLU 511 HG2 GLU 511 55.417 12.260 8.604 391 HG3 GLU 511 HG3 GLU 511 55.174 12.949 10.211 392 H TYR 512 H TYR 512 56.442 14.570 6.176 393 HA TYR 512 HA TYR 512 58.151 12.257 6.394 394 HB2 TYR 512 HB2 TYR 512 56.886 13.832 4.168 395 HB3 TYR 512 HB3 TYR 512 58.156 12.660 3.787 396 HD1 TYR 512 HD1 TYR 512 54.876 13.013 5.582 397 HD2 TYR 512 HD2 TYR 512 57.716 10.354 3.794 398 HE1 TYR 512 HE1 TYR 512 53.306 11.129 5.901 399 HE2 TYR 512 HE2 TYR 512 56.171 8.464 4.149 400 HH TYR 512 HH TYR 512 52.871 8.958 5.097 401 H LYS 513 H LYS 513 58.588 15.662 5.924 402 HA LYS 513 HA LYS 513 61.221 15.578 4.869 403 HB2 LYS 513 HB2 LYS 513 59.746 17.594 4.855 404 HB3 LYS 513 HB3 LYS 513 59.886 17.700 6.604 405 HG2 LYS 513 HG2 LYS 513 61.526 19.210 5.905 406 HG3 LYS 513 HG3 LYS 513 62.475 17.740 6.096 407 HD2 LYS 513 HD2 LYS 513 63.153 18.418 3.969 408 HD3 LYS 513 HD3 LYS 513 61.826 17.343 3.558 409 HE2 LYS 513 HE2 LYS 513 60.301 19.233 3.324 410 HE3 LYS 513 HE3 LYS 513 61.564 20.346 3.859 411 HZ1 LYS 513 HZ1 LYS 513 62.155 18.569 1.617 412 HZ2 LYS 513 HZ2 LYS 513 62.695 20.152 1.919 413 HZ3 LYS 513 HZ3 LYS 513 61.125 19.884 1.331 414 H LYS 514 H LYS 514 59.799 15.484 8.052 415 HA LYS 514 HA LYS 514 62.155 15.733 9.590 416 HB2 LYS 514 HB2 LYS 514 59.645 15.834 10.274 417 HB3 LYS 514 HB3 LYS 514 59.751 14.077 10.372 418 HG2 LYS 514 HG2 LYS 514 61.407 14.180 12.090 419 HG3 LYS 514 HG3 LYS 514 61.674 15.905 11.827 420 HD2 LYS 514 HD2 LYS 514 60.239 15.422 13.831 421 HD3 LYS 514 HD3 LYS 514 59.458 16.443 12.620 422 HE2 LYS 514 HE2 LYS 514 58.026 14.748 11.901 423 HE3 LYS 514 HE3 LYS 514 59.062 13.460 12.541 424 HZ1 LYS 514 HZ1 LYS 514 57.577 15.441 14.181 425 HZ2 LYS 514 HZ2 LYS 514 58.531 14.167 14.776 426 HZ3 LYS 514 HZ3 LYS 514 57.100 13.833 13.925 427 H LYS 515 H LYS 515 60.369 12.998 8.279 428 HA LYS 515 HA LYS 515 62.015 10.915 9.259 429 HB2 LYS 515 HB2 LYS 515 60.163 11.114 6.872 430 HB3 LYS 515 HB3 LYS 515 60.998 9.626 7.308 431 HG2 LYS 515 HG2 LYS 515 59.966 9.983 9.669 432 HG3 LYS 515 HG3 LYS 515 58.892 11.133 8.872 433 HD2 LYS 515 HD2 LYS 515 59.242 8.289 7.887 434 HD3 LYS 515 HD3 LYS 515 58.024 8.746 9.075 435 HE2 LYS 515 HE2 LYS 515 57.138 10.432 7.473 436 HE3 LYS 515 HE3 LYS 515 58.298 9.852 6.271 437 HZ1 LYS 515 HZ1 LYS 515 55.808 8.767 6.937 438 HZ2 LYS 515 HZ2 LYS 515 57.003 7.640 7.374 439 HZ3 LYS 515 HZ3 LYS 515 56.920 8.220 5.779 440 H LEU 516 H LEU 516 62.036 12.779 6.268 441 HA LEU 516 HA LEU 516 63.983 11.407 4.811 442 HB2 LEU 516 HB2 LEU 516 62.678 13.149 3.803 443 HB3 LEU 516 HB3 LEU 516 63.218 14.328 4.986 444 HG LEU 516 HG LEU 516 65.447 14.323 4.090 445 HD11 LEU 516 HD11 LEU 516 64.447 11.952 2.527 446 HD12 LEU 516 HD12 LEU 516 65.889 12.071 3.529 447 HD13 LEU 516 HD13 LEU 516 65.828 12.887 1.970 448 HD21 LEU 516 HD21 LEU 516 63.516 15.552 2.887 449 HD22 LEU 516 HD22 LEU 516 63.638 14.278 1.671 450 HD23 LEU 516 HD23 LEU 516 65.015 15.332 1.984 451 H ASP 517 H ASP 517 64.324 14.121 7.059 452 HA ASP 517 HA ASP 517 67.104 14.394 6.964 453 HB2 ASP 517 HB2 ASP 517 65.040 14.962 9.112 454 HB3 ASP 517 HB3 ASP 517 66.735 15.432 9.270 455 H GLN 518 H GLN 518 65.042 12.526 9.157 456 HA GLN 518 HA GLN 518 67.116 11.454 10.756 457 HB2 GLN 518 HB2 GLN 518 64.309 10.483 10.187 458 HB3 GLN 518 HB3 GLN 518 65.379 9.760 11.395 459 HG2 GLN 518 HG2 GLN 518 65.570 11.885 12.567 460 HG3 GLN 518 HG3 GLN 518 64.611 12.689 11.324 461 HE21 GLN 518 HE21 GLN 518 63.286 9.671 11.603 462 HE22 GLN 518 HE22 GLN 518 62.080 9.995 12.751 463 H THR 519 H THR 519 65.602 10.309 7.798 464 HA THR 519 HA THR 519 66.695 7.707 7.753 465 HB THR 519 HB THR 519 66.023 9.466 5.367 466 HG1 THR 519 HG1 THR 519 64.373 7.908 7.062 467 HG21 THR 519 HG21 THR 519 65.550 6.508 5.642 468 HG22 THR 519 HG22 THR 519 67.125 7.114 5.131 469 HG23 THR 519 HG23 THR 519 65.687 7.473 4.174 470 H ARG 520 H ARG 520 67.817 10.790 6.449 471 HA ARG 520 HA ARG 520 70.112 9.870 5.112 472 HB2 ARG 520 HB2 ARG 520 69.358 12.518 6.357 473 HB3 ARG 520 HB3 ARG 520 70.866 12.288 5.466 474 HG2 ARG 520 HG2 ARG 520 69.571 11.510 3.508 475 HG3 ARG 520 HG3 ARG 520 68.073 11.791 4.400 476 HD2 ARG 520 HD2 ARG 520 70.148 13.932 3.932 477 HD3 ARG 520 HD3 ARG 520 68.767 13.676 2.866 478 HE ARG 520 HE ARG 520 67.626 13.889 5.330 479 HH11 ARG 520 HH11 ARG 520 70.345 15.593 5.448 480 HH12 ARG 520 HH12 ARG 520 69.658 17.178 5.314 481 HH21 ARG 520 HH21 ARG 520 66.538 16.021 4.317 482 HH22 ARG 520 HH22 ARG 520 67.494 17.420 4.673 483 H VAL 521 H VAL 521 69.533 10.811 8.457 484 HA VAL 521 HA VAL 521 72.207 10.894 9.354 485 HB VAL 521 HB VAL 521 69.609 10.238 10.767 486 HG11 VAL 521 HG11 VAL 521 72.371 10.715 11.882 487 HG12 VAL 521 HG12 VAL 521 71.318 9.325 12.148 488 HG13 VAL 521 HG13 VAL 521 70.899 10.890 12.840 489 HG21 VAL 521 HG21 VAL 521 71.206 12.779 10.993 490 HG22 VAL 521 HG22 VAL 521 69.482 12.521 11.277 491 HG23 VAL 521 HG23 VAL 521 70.113 12.540 9.633 492 H GLU 522 H GLU 522 69.827 8.258 9.343 493 HA GLU 522 HA GLU 522 71.462 6.299 10.561 494 HB2 GLU 522 HB2 GLU 522 69.144 6.003 8.625 495 HB3 GLU 522 HB3 GLU 522 69.812 4.701 9.611 496 HG2 GLU 522 HG2 GLU 522 69.311 6.030 11.648 497 HG3 GLU 522 HG3 GLU 522 68.590 7.276 10.630 498 H LEU 523 H LEU 523 70.842 7.168 7.223 499 HA LEU 523 HA LEU 523 72.306 5.126 5.951 500 HB2 LEU 523 HB2 LEU 523 70.625 6.696 4.927 501 HB3 LEU 523 HB3 LEU 523 71.858 7.951 4.978 502 HG LEU 523 HG LEU 523 73.305 6.054 3.729 503 HD11 LEU 523 HD11 LEU 523 70.469 5.472 2.846 504 HD12 LEU 523 HD12 LEU 523 71.438 4.414 3.862 505 HD13 LEU 523 HD13 LEU 523 71.939 4.734 2.202 506 HD21 LEU 523 HD21 LEU 523 72.836 8.307 2.863 507 HD22 LEU 523 HD22 LEU 523 71.217 7.799 2.386 508 HD23 LEU 523 HD23 LEU 523 72.630 7.111 1.586 509 H ALA 524 H ALA 524 73.234 8.399 6.978 510 HA ALA 524 HA ALA 524 75.789 8.474 5.832 511 HB1 ALA 524 HB1 ALA 524 76.221 10.289 7.406 512 HB2 ALA 524 HB2 ALA 524 74.852 9.789 8.402 513 HB3 ALA 524 HB3 ALA 524 74.578 10.426 6.780 514 H ASP 525 H ASP 525 74.653 7.254 8.941 515 HA ASP 525 HA ASP 525 77.201 6.694 10.070 516 HB2 ASP 525 HB2 ASP 525 75.156 6.826 11.408 517 HB3 ASP 525 HB3 ASP 525 74.461 5.459 10.544 518 H GLN 526 H GLN 526 74.893 4.744 8.214 519 HA GLN 526 HA GLN 526 76.369 2.315 8.258 520 HB2 GLN 526 HB2 GLN 526 73.967 2.412 7.813 521 HB3 GLN 526 HB3 GLN 526 74.249 3.334 6.339 522 HG2 GLN 526 HG2 GLN 526 75.468 1.443 5.369 523 HG3 GLN 526 HG3 GLN 526 75.269 0.530 6.867 524 HE21 GLN 526 HE21 GLN 526 74.006 0.644 3.852 525 HE22 GLN 526 HE22 GLN 526 72.394 0.228 4.179 526 H VAL 527 H VAL 527 76.212 5.044 6.059 527 HA VAL 527 HA VAL 527 77.827 3.953 3.985 528 HB VAL 527 HB VAL 527 76.965 6.760 4.750 529 HG11 VAL 527 HG11 VAL 527 79.053 7.120 3.647 530 HG12 VAL 527 HG12 VAL 527 77.810 7.355 2.416 531 HG13 VAL 527 HG13 VAL 527 78.728 5.849 2.466 532 HG21 VAL 527 HG21 VAL 527 75.436 6.530 2.959 533 HG22 VAL 527 HG22 VAL 527 75.381 4.972 3.783 534 HG23 VAL 527 HG23 VAL 527 76.295 5.146 2.286 535 H LYS 528 H LYS 528 78.453 6.026 6.759 536 HA LYS 528 HA LYS 528 81.182 6.555 6.231 537 HB2 LYS 528 HB2 LYS 528 79.817 7.900 7.743 538 HB3 LYS 528 HB3 LYS 528 79.618 6.518 8.818 539 HG2 LYS 528 HG2 LYS 528 82.020 6.473 9.268 540 HG3 LYS 528 HG3 LYS 528 82.276 7.776 8.100 541 HD2 LYS 528 HD2 LYS 528 82.215 8.792 10.284 542 HD3 LYS 528 HD3 LYS 528 80.709 9.199 9.467 543 HE2 LYS 528 HE2 LYS 528 79.440 7.716 10.769 544 HE3 LYS 528 HE3 LYS 528 80.854 6.769 11.246 545 HZ1 LYS 528 HZ1 LYS 528 81.092 8.056 13.011 546 HZ2 LYS 528 HZ2 LYS 528 79.697 8.923 12.577 547 HZ3 LYS 528 HZ3 LYS 528 81.223 9.436 12.035 548 H SER 529 H SER 529 79.497 3.988 7.936 549 HA SER 529 HA SER 529 81.789 2.910 9.233 550 HB2 SER 529 HB2 SER 529 80.304 0.945 9.601 551 HB3 SER 529 HB3 SER 529 79.513 2.461 10.027 552 HG SER 529 HG SER 529 78.314 0.910 8.657 553 H ALA 530 H ALA 530 80.237 2.429 6.146 554 HA ALA 530 HA ALA 530 81.686 0.055 5.419 555 HB1 ALA 530 HB1 ALA 530 80.570 0.268 3.307 556 HB2 ALA 530 HB2 ALA 530 80.204 1.969 3.598 557 HB3 ALA 530 HB3 ALA 530 79.410 0.716 4.555 558 H VAL 531 H VAL 531 82.896 2.871 6.051 559 HA VAL 531 HA VAL 531 84.323 3.640 3.701 560 HB VAL 531 HB VAL 531 83.783 5.127 5.610 561 HG11 VAL 531 HG11 VAL 531 84.356 3.307 7.329 562 HG12 VAL 531 HG12 VAL 531 84.847 4.957 7.708 563 HG13 VAL 531 HG13 VAL 531 86.037 3.799 7.113 564 HG21 VAL 531 HG21 VAL 531 85.888 6.332 5.656 565 HG22 VAL 531 HG22 VAL 531 85.641 5.680 4.040 566 HG23 VAL 531 HG23 VAL 531 86.776 4.903 5.144 567 H THR 532 H THR 532 84.570 0.917 5.532 568 HA THR 532 HA THR 532 87.499 0.668 5.440 569 HB THR 532 HB THR 532 85.930 -0.038 7.402 570 HG1 THR 532 HG1 THR 532 87.589 -1.129 7.998 571 HG21 THR 532 HG21 THR 532 85.652 -2.506 5.653 572 HG22 THR 532 HG22 THR 532 84.358 -1.352 5.978 573 HG23 THR 532 HG23 THR 532 85.049 -2.296 7.294 574 H GLU 533 H GLU 533 88.497 -0.301 3.764 575 HA GLU 533 HA GLU 533 88.807 -1.375 1.753 576 HB2 GLU 533 HB2 GLU 533 86.964 -3.262 3.212 577 HB3 GLU 533 HB3 GLU 533 87.822 -3.680 1.726 578 HG2 GLU 533 HG2 GLU 533 89.189 -2.658 4.221 579 HG3 GLU 533 HG3 GLU 533 89.004 -4.372 3.854 580 H PHE 534 H PHE 534 86.208 0.298 2.313 581 HA PHE 534 HA PHE 534 84.326 0.903 1.145 582 HB2 PHE 534 HB2 PHE 534 86.274 0.054 -0.979 583 HB3 PHE 534 HB3 PHE 534 84.745 0.845 -1.359 584 HD1 PHE 534 HD1 PHE 534 87.780 1.233 0.821 585 HD2 PHE 534 HD2 PHE 534 84.642 3.200 -1.362 586 HE1 PHE 534 HE1 PHE 534 88.817 3.436 1.310 587 HE2 PHE 534 HE2 PHE 534 85.678 5.399 -0.865 588 HZ PHE 534 HZ PHE 534 87.764 5.518 0.468 589 H GLU 535 H GLU 535 82.780 0.133 -0.657 590 HA GLU 535 HA GLU 535 81.591 -2.284 0.139 591 HB2 GLU 535 HB2 GLU 535 80.194 -1.984 -1.895 592 HB3 GLU 535 HB3 GLU 535 80.360 -0.484 -0.983 593 HG2 GLU 535 HG2 GLU 535 82.216 0.200 -2.471 594 HG3 GLU 535 HG3 GLU 535 81.983 -1.267 -3.418 595 H ASN 536 H ASN 536 81.017 -3.429 -2.466 596 HA ASN 536 HA ASN 536 83.011 -5.426 -2.617 597 HB2 ASN 536 HB2 ASN 536 80.525 -5.495 -3.353 598 HB3 ASN 536 HB3 ASN 536 81.086 -4.758 -4.848 599 HD21 ASN 536 HD21 ASN 536 81.517 -6.263 -6.428 600 HD22 ASN 536 HD22 ASN 536 82.055 -7.849 -6.157 601 H VAL 537 H VAL 537 85.069 -4.704 -3.092 602 HA VAL 537 HA VAL 537 85.547 -2.841 -5.281 603 HB VAL 537 HB VAL 537 87.592 -4.362 -3.634 604 HG11 VAL 537 HG11 VAL 537 88.598 -3.304 -5.543 605 HG12 VAL 537 HG12 VAL 537 88.919 -2.250 -4.166 606 HG13 VAL 537 HG13 VAL 537 87.645 -1.841 -5.315 607 HG21 VAL 537 HG21 VAL 537 86.059 -1.806 -3.081 608 HG22 VAL 537 HG22 VAL 537 87.590 -2.178 -2.286 609 HG23 VAL 537 HG23 VAL 537 86.196 -3.232 -2.053 610 H THR 538 H THR 538 85.984 -3.369 -7.307 611 HA THR 538 HA THR 538 86.204 -6.201 -8.040 612 HB THR 538 HB THR 538 85.977 -5.040 -10.412 613 HG1 THR 538 HG1 THR 538 86.359 -2.952 -9.548 614 HG21 THR 538 HG21 THR 538 83.479 -4.833 -10.007 615 HG22 THR 538 HG22 THR 538 83.810 -5.149 -8.303 616 HG23 THR 538 HG23 THR 538 84.186 -6.373 -9.515 617 HA PRO 539 HA PRO 539 90.474 -6.496 -9.186 618 HB2 PRO 539 HB2 PRO 539 90.104 -6.583 -12.062 619 HB3 PRO 539 HB3 PRO 539 90.393 -7.946 -10.968 620 HG2 PRO 539 HG2 PRO 539 87.827 -6.888 -12.019 621 HG3 PRO 539 HG3 PRO 539 88.261 -8.547 -11.574 622 HD2 PRO 539 HD2 PRO 539 86.646 -7.153 -10.005 623 HD3 PRO 539 HD3 PRO 539 87.935 -8.132 -9.267 624 H THR 540 H THR 540 92.079 -5.103 -9.680 625 HA THR 540 HA THR 540 91.375 -2.370 -10.351 626 HB THR 540 HB THR 540 94.055 -3.653 -9.766 627 HG1 THR 540 HG1 THR 540 91.978 -2.654 -8.174 628 HG21 THR 540 HG21 THR 540 94.290 -1.511 -10.858 629 HG22 THR 540 HG22 THR 540 94.646 -1.306 -9.143 630 HG23 THR 540 HG23 THR 540 93.088 -0.789 -9.788 631 H ASN 541 H ASN 541 91.570 -1.489 -12.318 632 HA ASN 541 HA ASN 541 92.535 -3.130 -14.527 633 HB2 ASN 541 HB2 ASN 541 90.429 -1.613 -14.533 634 HB3 ASN 541 HB3 ASN 541 91.560 -0.281 -14.778 635 HD21 ASN 541 HD21 ASN 541 91.040 -3.607 -16.128 636 HD22 ASN 541 HD22 ASN 541 91.304 -3.145 -17.740 637 H ASP 542 H ASP 542 94.630 -3.267 -14.674 638 HA ASP 542 HA ASP 542 96.453 -1.116 -14.018 639 HB2 ASP 542 HB2 ASP 542 96.802 -3.535 -13.477 640 HB3 ASP 542 HB3 ASP 542 97.003 -3.844 -15.199 641 H GLN 543 H GLN 543 94.734 -1.906 -16.752 642 HA GLN 543 HA GLN 543 96.694 -1.509 -18.782 643 HB2 GLN 543 HB2 GLN 543 93.674 -1.386 -18.792 644 HB3 GLN 543 HB3 GLN 543 94.670 -1.269 -20.244 645 HG2 GLN 543 HG2 GLN 543 95.647 -3.453 -19.816 646 HG3 GLN 543 HG3 GLN 543 94.799 -3.568 -18.276 647 HE21 GLN 543 HE21 GLN 543 94.103 -5.665 -19.669 648 HE22 GLN 543 HE22 GLN 543 92.644 -5.478 -20.515 Start of MODEL 3 1 H1 SER 466 H1 SER 466 33.422 5.157 -7.234 2 H2 SER 466 H2 SER 466 34.007 6.726 -6.948 3 H3 SER 466 H3 SER 466 33.121 6.390 -8.357 4 HA SER 466 HA SER 466 32.124 7.367 -5.999 5 HB2 SER 466 HB2 SER 466 31.271 7.549 -8.382 6 HB3 SER 466 HB3 SER 466 30.589 5.937 -8.183 7 HG SER 466 HG SER 466 29.719 8.341 -7.243 8 H ASP 467 H ASP 467 32.545 4.072 -6.958 9 HA ASP 467 HA ASP 467 30.651 3.052 -4.959 10 HB2 ASP 467 HB2 ASP 467 30.892 2.078 -7.286 11 HB3 ASP 467 HB3 ASP 467 32.472 1.482 -6.782 12 H ASP 468 H ASP 468 31.426 3.120 -2.905 13 HA ASP 468 HA ASP 468 32.868 2.868 -1.114 14 HB2 ASP 468 HB2 ASP 468 33.632 0.530 -2.878 15 HB3 ASP 468 HB3 ASP 468 34.241 0.741 -1.236 16 H TYR 469 H TYR 469 33.637 4.614 -3.259 17 HA TYR 469 HA TYR 469 36.453 4.355 -3.800 18 HB2 TYR 469 HB2 TYR 469 34.671 5.449 -5.248 19 HB3 TYR 469 HB3 TYR 469 34.721 6.799 -4.118 20 HD1 TYR 469 HD1 TYR 469 36.640 4.862 -6.605 21 HD2 TYR 469 HD2 TYR 469 36.597 8.304 -4.040 22 HE1 TYR 469 HE1 TYR 469 38.619 5.766 -7.789 23 HE2 TYR 469 HE2 TYR 469 38.575 9.214 -5.225 24 HH TYR 469 HH TYR 469 39.723 7.864 -8.182 25 H VAL 470 H VAL 470 38.107 5.756 -3.076 26 HA VAL 470 HA VAL 470 37.632 6.924 -0.395 27 HB VAL 470 HB VAL 470 40.349 6.290 -1.539 28 HG11 VAL 470 HG11 VAL 470 40.877 6.037 0.868 29 HG12 VAL 470 HG12 VAL 470 39.207 6.440 1.263 30 HG13 VAL 470 HG13 VAL 470 40.245 7.640 0.495 31 HG21 VAL 470 HG21 VAL 470 38.361 4.415 -0.236 32 HG22 VAL 470 HG22 VAL 470 40.095 4.095 -0.258 33 HG23 VAL 470 HG23 VAL 470 39.200 4.204 -1.773 34 H ASP 471 H ASP 471 38.154 9.041 0.030 35 HA ASP 471 HA ASP 471 38.038 11.000 -1.868 36 HB2 ASP 471 HB2 ASP 471 39.552 10.987 0.745 37 HB3 ASP 471 HB3 ASP 471 39.333 12.438 -0.231 38 H GLU 472 H GLU 472 39.461 12.177 -3.098 39 HA GLU 472 HA GLU 472 41.595 10.853 -4.336 40 HB2 GLU 472 HB2 GLU 472 40.244 12.741 -5.276 41 HB3 GLU 472 HB3 GLU 472 41.138 13.833 -4.224 42 HG2 GLU 472 HG2 GLU 472 42.203 13.868 -6.385 43 HG3 GLU 472 HG3 GLU 472 43.262 12.996 -5.283 44 H GLU 473 H GLU 473 41.651 13.373 -1.812 45 HA GLU 473 HA GLU 473 44.471 13.670 -1.782 46 HB2 GLU 473 HB2 GLU 473 44.142 14.903 0.244 47 HB3 GLU 473 HB3 GLU 473 42.768 15.253 -0.800 48 HG2 GLU 473 HG2 GLU 473 41.551 13.365 0.407 49 HG3 GLU 473 HG3 GLU 473 42.863 13.412 1.589 50 H THR 474 H THR 474 42.248 11.735 0.105 51 HA THR 474 HA THR 474 44.140 10.515 1.834 52 HB THR 474 HB THR 474 41.444 9.622 0.803 53 HG1 THR 474 HG1 THR 474 41.154 11.356 2.060 54 HG21 THR 474 HG21 THR 474 42.467 7.633 1.515 55 HG22 THR 474 HG22 THR 474 41.512 8.161 2.902 56 HG23 THR 474 HG23 THR 474 43.257 8.422 2.883 57 H TYR 475 H TYR 475 42.653 9.491 -1.205 58 HA TYR 475 HA TYR 475 43.926 6.995 -1.346 59 HB2 TYR 475 HB2 TYR 475 41.906 7.730 -2.636 60 HB3 TYR 475 HB3 TYR 475 42.973 8.699 -3.655 61 HD1 TYR 475 HD1 TYR 475 42.597 5.256 -2.292 62 HD2 TYR 475 HD2 TYR 475 43.946 7.708 -5.541 63 HE1 TYR 475 HE1 TYR 475 43.130 3.211 -3.612 64 HE2 TYR 475 HE2 TYR 475 44.487 5.678 -6.862 65 HH TYR 475 HH TYR 475 43.355 2.633 -6.088 66 H ASN 476 H ASN 476 44.804 10.133 -2.822 67 HA ASN 476 HA ASN 476 47.118 9.094 -4.115 68 HB2 ASN 476 HB2 ASN 476 46.619 11.940 -3.234 69 HB3 ASN 476 HB3 ASN 476 47.776 11.391 -4.448 70 HD21 ASN 476 HD21 ASN 476 45.268 9.328 -4.909 71 HD22 ASN 476 HD22 ASN 476 44.361 10.202 -6.050 72 H LEU 477 H LEU 477 46.477 10.393 -0.929 73 HA LEU 477 HA LEU 477 49.126 10.758 -0.063 74 HB2 LEU 477 HB2 LEU 477 47.227 11.584 1.217 75 HB3 LEU 477 HB3 LEU 477 46.630 9.947 1.450 76 HG LEU 477 HG LEU 477 48.673 9.392 2.733 77 HD11 LEU 477 HD11 LEU 477 50.366 10.812 1.910 78 HD12 LEU 477 HD12 LEU 477 50.004 11.509 3.486 79 HD13 LEU 477 HD13 LEU 477 49.348 12.249 2.026 80 HD21 LEU 477 HD21 LEU 477 48.140 10.865 4.688 81 HD22 LEU 477 HD22 LEU 477 46.718 10.141 3.942 82 HD23 LEU 477 HD23 LEU 477 47.116 11.828 3.621 83 H GLN 478 H GLN 478 46.939 7.948 0.113 84 HA GLN 478 HA GLN 478 48.714 6.131 1.335 85 HB2 GLN 478 HB2 GLN 478 46.414 5.702 -0.587 86 HB3 GLN 478 HB3 GLN 478 47.250 4.389 0.240 87 HG2 GLN 478 HG2 GLN 478 45.923 6.708 1.660 88 HG3 GLN 478 HG3 GLN 478 45.152 5.147 1.395 89 HE21 GLN 478 HE21 GLN 478 46.469 6.743 3.831 90 HE22 GLN 478 HE22 GLN 478 47.300 5.502 4.642 91 H LYS 479 H LYS 479 48.158 7.029 -1.990 92 HA LYS 479 HA LYS 479 49.754 5.065 -3.247 93 HB2 LYS 479 HB2 LYS 479 47.988 6.483 -4.313 94 HB3 LYS 479 HB3 LYS 479 49.084 7.856 -4.197 95 HG2 LYS 479 HG2 LYS 479 50.705 6.747 -5.639 96 HG3 LYS 479 HG3 LYS 479 49.732 5.276 -5.652 97 HD2 LYS 479 HD2 LYS 479 49.137 6.299 -7.681 98 HD3 LYS 479 HD3 LYS 479 47.839 6.805 -6.605 99 HE2 LYS 479 HE2 LYS 479 48.629 8.726 -7.884 100 HE3 LYS 479 HE3 LYS 479 49.067 8.945 -6.194 101 HZ1 LYS 479 HZ1 LYS 479 51.178 9.075 -6.792 102 HZ2 LYS 479 HZ2 LYS 479 50.749 8.874 -8.423 103 HZ3 LYS 479 HZ3 LYS 479 51.112 7.519 -7.465 104 H LEU 480 H LEU 480 50.451 8.300 -2.019 105 HA LEU 480 HA LEU 480 53.040 8.595 -3.092 106 HB2 LEU 480 HB2 LEU 480 51.531 9.810 -0.795 107 HB3 LEU 480 HB3 LEU 480 53.229 10.215 -1.033 108 HG LEU 480 HG LEU 480 51.396 10.369 -3.417 109 HD11 LEU 480 HD11 LEU 480 51.082 12.873 -2.659 110 HD12 LEU 480 HD12 LEU 480 51.330 12.217 -1.040 111 HD13 LEU 480 HD13 LEU 480 50.000 11.631 -2.039 112 HD21 LEU 480 HD21 LEU 480 53.683 12.121 -2.455 113 HD22 LEU 480 HD22 LEU 480 52.918 12.175 -4.044 114 HD23 LEU 480 HD23 LEU 480 53.866 10.765 -3.568 115 H LEU 481 H LEU 481 51.963 7.283 0.043 116 HA LEU 481 HA LEU 481 54.592 6.920 1.083 117 HB2 LEU 481 HB2 LEU 481 52.131 5.402 1.942 118 HB3 LEU 481 HB3 LEU 481 53.542 5.830 2.911 119 HG LEU 481 HG LEU 481 51.496 7.715 1.766 120 HD11 LEU 481 HD11 LEU 481 51.183 8.296 4.189 121 HD12 LEU 481 HD12 LEU 481 52.207 6.913 4.579 122 HD13 LEU 481 HD13 LEU 481 50.670 6.669 3.748 123 HD21 LEU 481 HD21 LEU 481 54.163 8.213 3.035 124 HD22 LEU 481 HD22 LEU 481 52.876 9.417 3.142 125 HD23 LEU 481 HD23 LEU 481 53.496 8.924 1.570 126 H ALA 482 H ALA 482 52.403 4.811 -0.693 127 HA ALA 482 HA ALA 482 53.311 2.315 -0.299 128 HB1 ALA 482 HB1 ALA 482 53.128 2.328 -3.069 129 HB2 ALA 482 HB2 ALA 482 52.203 3.756 -2.605 130 HB3 ALA 482 HB3 ALA 482 51.765 2.179 -1.956 131 HA PRO 483 HA PRO 483 56.956 2.576 -3.577 132 HB2 PRO 483 HB2 PRO 483 57.940 5.287 -3.450 133 HB3 PRO 483 HB3 PRO 483 57.272 4.439 -4.850 134 HG2 PRO 483 HG2 PRO 483 55.983 6.332 -3.009 135 HG3 PRO 483 HG3 PRO 483 55.563 5.932 -4.679 136 HD2 PRO 483 HD2 PRO 483 54.062 5.137 -2.567 137 HD3 PRO 483 HD3 PRO 483 54.213 4.149 -4.033 138 H TYR 484 H TYR 484 57.377 5.179 -1.159 139 HA TYR 484 HA TYR 484 59.894 4.285 -0.239 140 HB2 TYR 484 HB2 TYR 484 59.500 6.502 0.285 141 HB3 TYR 484 HB3 TYR 484 57.805 6.212 0.707 142 HD1 TYR 484 HD1 TYR 484 61.309 5.556 1.885 143 HD2 TYR 484 HD2 TYR 484 57.166 5.927 2.970 144 HE1 TYR 484 HE1 TYR 484 61.909 5.393 4.287 145 HE2 TYR 484 HE2 TYR 484 57.777 5.766 5.359 146 HH TYR 484 HH TYR 484 59.442 5.225 6.799 147 H HIS 485 H HIS 485 56.613 3.649 0.855 148 HA HIS 485 HA HIS 485 57.206 2.267 3.226 149 HB2 HIS 485 HB2 HIS 485 54.948 3.076 2.538 150 HB3 HIS 485 HB3 HIS 485 54.893 1.793 1.332 151 HD1 HIS 485 HD1 HIS 485 54.926 -0.699 2.265 152 HD2 HIS 485 HD2 HIS 485 54.315 2.260 5.137 153 HE1 HIS 485 HE1 HIS 485 54.027 -1.873 4.320 154 H LYS 486 H LYS 486 57.311 1.322 -0.127 155 HA LYS 486 HA LYS 486 57.636 -1.522 0.494 156 HB2 LYS 486 HB2 LYS 486 57.635 0.044 -2.102 157 HB3 LYS 486 HB3 LYS 486 57.871 -1.700 -2.006 158 HG2 LYS 486 HG2 LYS 486 55.684 -2.004 -1.008 159 HG3 LYS 486 HG3 LYS 486 55.445 -0.263 -0.898 160 HD2 LYS 486 HD2 LYS 486 55.552 -0.100 -3.368 161 HD3 LYS 486 HD3 LYS 486 55.761 -1.849 -3.463 162 HE2 LYS 486 HE2 LYS 486 53.577 -2.183 -2.382 163 HE3 LYS 486 HE3 LYS 486 53.371 -0.437 -2.238 164 HZ1 LYS 486 HZ1 LYS 486 53.580 -2.001 -4.752 165 HZ2 LYS 486 HZ2 LYS 486 53.552 -0.304 -4.679 166 HZ3 LYS 486 HZ3 LYS 486 52.204 -1.201 -4.164 167 H ALA 487 H ALA 487 59.581 1.256 0.092 168 HA ALA 487 HA ALA 487 61.934 0.113 -0.986 169 HB1 ALA 487 HB1 ALA 487 63.012 2.158 -0.300 170 HB2 ALA 487 HB2 ALA 487 61.692 2.526 0.811 171 HB3 ALA 487 HB3 ALA 487 61.411 2.548 -0.928 172 H LYS 488 H LYS 488 63.007 -1.475 -0.066 173 HA LYS 488 HA LYS 488 63.118 -1.744 2.861 174 HB2 LYS 488 HB2 LYS 488 64.033 -3.583 0.643 175 HB3 LYS 488 HB3 LYS 488 64.196 -3.935 2.361 176 HG2 LYS 488 HG2 LYS 488 61.741 -3.733 2.627 177 HG3 LYS 488 HG3 LYS 488 61.585 -3.441 0.897 178 HD2 LYS 488 HD2 LYS 488 62.895 -5.924 2.039 179 HD3 LYS 488 HD3 LYS 488 61.180 -5.847 1.640 180 HE2 LYS 488 HE2 LYS 488 61.941 -5.081 -0.706 181 HE3 LYS 488 HE3 LYS 488 63.545 -5.633 -0.229 182 HZ1 LYS 488 HZ1 LYS 488 62.933 -7.774 -0.280 183 HZ2 LYS 488 HZ2 LYS 488 61.738 -7.212 -1.348 184 HZ3 LYS 488 HZ3 LYS 488 61.366 -7.471 0.291 185 H THR 489 H THR 489 64.949 -0.349 0.395 186 HA THR 489 HA THR 489 67.518 -0.724 1.830 187 HB THR 489 HB THR 489 68.283 0.569 -0.377 188 HG1 THR 489 HG1 THR 489 66.742 0.771 -1.755 189 HG21 THR 489 HG21 THR 489 68.498 -1.621 -1.523 190 HG22 THR 489 HG22 THR 489 67.414 -2.334 -0.326 191 HG23 THR 489 HG23 THR 489 68.985 -1.702 0.169 192 H LEU 490 H LEU 490 68.402 0.898 2.960 193 HA LEU 490 HA LEU 490 66.972 3.210 3.643 194 HB2 LEU 490 HB2 LEU 490 69.855 2.374 3.925 195 HB3 LEU 490 HB3 LEU 490 69.312 3.959 4.467 196 HG LEU 490 HG LEU 490 67.596 2.872 5.880 197 HD11 LEU 490 HD11 LEU 490 67.989 0.351 6.263 198 HD12 LEU 490 HD12 LEU 490 68.856 0.383 4.727 199 HD13 LEU 490 HD13 LEU 490 67.147 0.818 4.786 200 HD21 LEU 490 HD21 LEU 490 69.217 1.862 7.517 201 HD22 LEU 490 HD22 LEU 490 69.730 3.433 6.899 202 HD23 LEU 490 HD23 LEU 490 70.458 1.955 6.267 203 H GLU 491 H GLU 491 69.634 2.732 1.348 204 HA GLU 491 HA GLU 491 70.080 5.368 0.549 205 HB2 GLU 491 HB2 GLU 491 71.573 3.599 -0.107 206 HB3 GLU 491 HB3 GLU 491 70.286 2.763 -0.972 207 HG2 GLU 491 HG2 GLU 491 70.150 4.529 -2.608 208 HG3 GLU 491 HG3 GLU 491 71.268 5.535 -1.685 209 H ARG 492 H ARG 492 67.765 3.025 -0.597 210 HA ARG 492 HA ARG 492 66.666 4.686 -2.656 211 HB2 ARG 492 HB2 ARG 492 66.514 2.296 -2.860 212 HB3 ARG 492 HB3 ARG 492 65.671 2.175 -1.317 213 HG2 ARG 492 HG2 ARG 492 63.728 3.316 -2.198 214 HG3 ARG 492 HG3 ARG 492 64.587 3.705 -3.694 215 HD2 ARG 492 HD2 ARG 492 63.093 1.757 -3.985 216 HD3 ARG 492 HD3 ARG 492 64.783 1.324 -4.233 217 HE ARG 492 HE ARG 492 64.010 0.916 -1.511 218 HH11 ARG 492 HH11 ARG 492 61.968 -0.373 -3.541 219 HH12 ARG 492 HH12 ARG 492 62.545 -2.007 -3.532 220 HH21 ARG 492 HH21 ARG 492 65.547 -1.209 -1.990 221 HH22 ARG 492 HH22 ARG 492 64.575 -2.481 -2.653 222 H GLN 493 H GLN 493 65.835 3.974 0.695 223 HA GLN 493 HA GLN 493 63.302 5.166 0.761 224 HB2 GLN 493 HB2 GLN 493 65.454 4.784 2.841 225 HB3 GLN 493 HB3 GLN 493 63.939 5.587 3.234 226 HG2 GLN 493 HG2 GLN 493 62.660 3.641 2.620 227 HG3 GLN 493 HG3 GLN 493 64.078 2.853 1.941 228 HE21 GLN 493 HE21 GLN 493 63.106 1.197 3.697 229 HE22 GLN 493 HE22 GLN 493 63.814 1.309 5.235 230 H VAL 494 H VAL 494 66.521 6.577 1.352 231 HA VAL 494 HA VAL 494 65.631 9.186 1.913 232 HB VAL 494 HB VAL 494 68.217 8.155 0.717 233 HG11 VAL 494 HG11 VAL 494 67.485 10.927 1.703 234 HG12 VAL 494 HG12 VAL 494 67.990 10.488 0.072 235 HG13 VAL 494 HG13 VAL 494 69.135 10.385 1.402 236 HG21 VAL 494 HG21 VAL 494 69.030 8.690 3.048 237 HG22 VAL 494 HG22 VAL 494 67.843 7.387 2.981 238 HG23 VAL 494 HG23 VAL 494 67.354 9.000 3.499 239 H TYR 495 H TYR 495 66.650 7.656 -1.128 240 HA TYR 495 HA TYR 495 66.298 9.879 -2.818 241 HB2 TYR 495 HB2 TYR 495 67.517 7.977 -3.585 242 HB3 TYR 495 HB3 TYR 495 66.162 6.898 -3.276 243 HD1 TYR 495 HD1 TYR 495 67.222 9.815 -5.374 244 HD2 TYR 495 HD2 TYR 495 64.577 6.454 -4.947 245 HE1 TYR 495 HE1 TYR 495 66.416 10.150 -7.700 246 HE2 TYR 495 HE2 TYR 495 63.775 6.789 -7.266 247 HH TYR 495 HH TYR 495 64.398 9.603 -9.045 248 H GLU 496 H GLU 496 64.062 7.245 -2.015 249 HA GLU 496 HA GLU 496 61.923 8.114 -3.621 250 HB2 GLU 496 HB2 GLU 496 62.322 5.855 -2.398 251 HB3 GLU 496 HB3 GLU 496 61.546 6.642 -1.026 252 HG2 GLU 496 HG2 GLU 496 59.827 5.506 -2.230 253 HG3 GLU 496 HG3 GLU 496 59.629 7.223 -2.577 254 H LEU 497 H LEU 497 62.784 8.760 -0.270 255 HA LEU 497 HA LEU 497 60.485 10.237 0.423 256 HB2 LEU 497 HB2 LEU 497 63.298 10.105 1.468 257 HB3 LEU 497 HB3 LEU 497 62.138 11.234 2.164 258 HG LEU 497 HG LEU 497 61.620 8.262 1.861 259 HD11 LEU 497 HD11 LEU 497 63.560 8.902 3.410 260 HD12 LEU 497 HD12 LEU 497 62.271 7.922 4.107 261 HD13 LEU 497 HD13 LEU 497 62.336 9.652 4.436 262 HD21 LEU 497 HD21 LEU 497 59.995 9.068 3.881 263 HD22 LEU 497 HD22 LEU 497 59.496 9.094 2.192 264 HD23 LEU 497 HD23 LEU 497 60.070 10.569 2.961 265 H GLU 498 H GLU 498 63.559 11.208 -1.070 266 HA GLU 498 HA GLU 498 63.222 13.994 -0.921 267 HB2 GLU 498 HB2 GLU 498 64.674 12.217 -2.880 268 HB3 GLU 498 HB3 GLU 498 64.685 13.972 -3.037 269 HG2 GLU 498 HG2 GLU 498 65.735 14.246 -0.901 270 HG3 GLU 498 HG3 GLU 498 65.484 12.554 -0.485 271 H LYS 499 H LYS 499 62.237 11.688 -3.476 272 HA LYS 499 HA LYS 499 61.017 13.676 -5.142 273 HB2 LYS 499 HB2 LYS 499 60.946 10.677 -4.939 274 HB3 LYS 499 HB3 LYS 499 59.721 11.468 -5.921 275 HG2 LYS 499 HG2 LYS 499 61.691 10.830 -7.270 276 HG3 LYS 499 HG3 LYS 499 61.469 12.578 -7.246 277 HD2 LYS 499 HD2 LYS 499 63.190 12.782 -5.494 278 HD3 LYS 499 HD3 LYS 499 63.401 11.030 -5.488 279 HE2 LYS 499 HE2 LYS 499 65.138 12.007 -6.877 280 HE3 LYS 499 HE3 LYS 499 63.998 11.159 -7.925 281 HZ1 LYS 499 HZ1 LYS 499 62.845 13.357 -8.173 282 HZ2 LYS 499 HZ2 LYS 499 64.375 13.251 -8.903 283 HZ3 LYS 499 HZ3 LYS 499 64.190 14.072 -7.428 284 H LEU 500 H LEU 500 59.729 11.465 -2.687 285 HA LEU 500 HA LEU 500 57.029 12.193 -2.961 286 HB2 LEU 500 HB2 LEU 500 58.552 11.079 -0.607 287 HB3 LEU 500 HB3 LEU 500 56.798 11.212 -0.677 288 HG LEU 500 HG LEU 500 58.394 9.764 -2.793 289 HD11 LEU 500 HD11 LEU 500 58.890 8.559 -0.811 290 HD12 LEU 500 HD12 LEU 500 57.546 7.685 -1.544 291 HD13 LEU 500 HD13 LEU 500 57.256 8.765 -0.180 292 HD21 LEU 500 HD21 LEU 500 55.464 9.950 -2.066 293 HD22 LEU 500 HD22 LEU 500 56.090 8.590 -2.983 294 HD23 LEU 500 HD23 LEU 500 56.224 10.208 -3.637 295 H GLN 501 H GLN 501 59.597 13.531 -0.942 296 HA GLN 501 HA GLN 501 58.062 15.246 0.642 297 HB2 GLN 501 HB2 GLN 501 60.890 14.994 -0.171 298 HB3 GLN 501 HB3 GLN 501 60.431 16.649 0.222 299 HG2 GLN 501 HG2 GLN 501 61.275 15.444 2.213 300 HG3 GLN 501 HG3 GLN 501 59.584 15.910 2.408 301 HE21 GLN 501 HE21 GLN 501 60.871 13.703 3.823 302 HE22 GLN 501 HE22 GLN 501 60.074 12.285 3.349 303 H GLU 502 H GLU 502 59.081 15.505 -2.675 304 HA GLU 502 HA GLU 502 58.440 18.299 -2.964 305 HB2 GLU 502 HB2 GLU 502 60.173 17.235 -4.325 306 HB3 GLU 502 HB3 GLU 502 58.999 16.099 -4.972 307 HG2 GLU 502 HG2 GLU 502 59.412 17.859 -6.584 308 HG3 GLU 502 HG3 GLU 502 57.759 17.987 -5.998 309 H LYS 503 H LYS 503 56.733 15.303 -3.181 310 HA LYS 503 HA LYS 503 54.451 16.564 -4.608 311 HB2 LYS 503 HB2 LYS 503 54.966 13.660 -3.962 312 HB3 LYS 503 HB3 LYS 503 53.747 14.301 -5.066 313 HG2 LYS 503 HG2 LYS 503 55.465 15.190 -6.527 314 HG3 LYS 503 HG3 LYS 503 56.729 14.713 -5.397 315 HD2 LYS 503 HD2 LYS 503 55.800 12.313 -5.678 316 HD3 LYS 503 HD3 LYS 503 54.978 12.953 -7.103 317 HE2 LYS 503 HE2 LYS 503 57.307 13.897 -7.758 318 HE3 LYS 503 HE3 LYS 503 57.927 12.765 -6.560 319 HZ1 LYS 503 HZ1 LYS 503 56.952 10.954 -7.729 320 HZ2 LYS 503 HZ2 LYS 503 57.845 11.868 -8.848 321 HZ3 LYS 503 HZ3 LYS 503 56.151 11.993 -8.804 322 H LEU 504 H LEU 504 55.376 15.129 -1.584 323 HA LEU 504 HA LEU 504 52.849 14.525 -0.553 324 HB2 LEU 504 HB2 LEU 504 55.542 15.033 0.604 325 HB3 LEU 504 HB3 LEU 504 54.172 15.011 1.715 326 HG LEU 504 HG LEU 504 54.491 12.783 -0.299 327 HD11 LEU 504 HD11 LEU 504 56.666 12.962 0.835 328 HD12 LEU 504 HD12 LEU 504 55.796 11.521 1.372 329 HD13 LEU 504 HD13 LEU 504 55.851 12.949 2.392 330 HD21 LEU 504 HD21 LEU 504 53.060 11.601 1.123 331 HD22 LEU 504 HD22 LEU 504 52.461 13.244 1.346 332 HD23 LEU 504 HD23 LEU 504 53.533 12.526 2.548 333 HA PRO 505 HA PRO 505 51.130 18.784 -0.346 334 HB2 PRO 505 HB2 PRO 505 49.460 17.827 1.852 335 HB3 PRO 505 HB3 PRO 505 48.971 18.264 0.205 336 HG2 PRO 505 HG2 PRO 505 49.617 15.596 1.319 337 HG3 PRO 505 HG3 PRO 505 48.589 16.022 -0.050 338 HD2 PRO 505 HD2 PRO 505 50.919 14.858 -0.437 339 HD3 PRO 505 HD3 PRO 505 50.408 16.170 -1.519 340 H GLU 506 H GLU 506 51.446 20.485 1.000 341 HA GLU 506 HA GLU 506 53.648 20.835 2.467 342 HB2 GLU 506 HB2 GLU 506 50.944 22.090 2.950 343 HB3 GLU 506 HB3 GLU 506 52.441 22.689 3.663 344 HG2 GLU 506 HG2 GLU 506 53.394 23.057 1.444 345 HG3 GLU 506 HG3 GLU 506 51.965 22.359 0.685 346 H LYS 507 H LYS 507 50.544 20.294 4.176 347 HA LYS 507 HA LYS 507 51.623 20.013 6.721 348 HB2 LYS 507 HB2 LYS 507 49.513 18.735 7.223 349 HB3 LYS 507 HB3 LYS 507 49.249 20.279 6.406 350 HG2 LYS 507 HG2 LYS 507 49.195 19.054 4.225 351 HG3 LYS 507 HG3 LYS 507 49.304 17.545 5.125 352 HD2 LYS 507 HD2 LYS 507 47.185 17.911 6.175 353 HD3 LYS 507 HD3 LYS 507 47.118 19.577 5.594 354 HE2 LYS 507 HE2 LYS 507 46.886 18.867 3.317 355 HE3 LYS 507 HE3 LYS 507 47.250 17.198 3.736 356 HZ1 LYS 507 HZ1 LYS 507 45.017 17.032 3.771 357 HZ2 LYS 507 HZ2 LYS 507 44.780 18.694 4.034 358 HZ3 LYS 507 HZ3 LYS 507 45.177 17.674 5.332 359 H TYR 508 H TYR 508 51.565 17.740 4.091 360 HA TYR 508 HA TYR 508 52.385 15.518 5.835 361 HB2 TYR 508 HB2 TYR 508 51.600 15.790 2.940 362 HB3 TYR 508 HB3 TYR 508 52.483 14.366 3.486 363 HD1 TYR 508 HD1 TYR 508 51.569 13.004 5.380 364 HD2 TYR 508 HD2 TYR 508 49.275 16.030 3.395 365 HE1 TYR 508 HE1 TYR 508 49.492 12.005 6.275 366 HE2 TYR 508 HE2 TYR 508 47.182 15.010 4.269 367 HH TYR 508 HH TYR 508 46.297 13.371 5.458 368 H LYS 509 H LYS 509 53.653 17.901 3.696 369 HA LYS 509 HA LYS 509 56.096 16.687 2.982 370 HB2 LYS 509 HB2 LYS 509 55.143 18.737 1.946 371 HB3 LYS 509 HB3 LYS 509 55.484 19.618 3.431 372 HG2 LYS 509 HG2 LYS 509 57.871 19.156 3.186 373 HG3 LYS 509 HG3 LYS 509 57.549 18.223 1.722 374 HD2 LYS 509 HD2 LYS 509 56.575 20.223 0.659 375 HD3 LYS 509 HD3 LYS 509 56.912 21.160 2.112 376 HE2 LYS 509 HE2 LYS 509 59.320 20.748 1.835 377 HE3 LYS 509 HE3 LYS 509 58.995 19.786 0.391 378 HZ1 LYS 509 HZ1 LYS 509 57.643 22.059 -0.100 379 HZ2 LYS 509 HZ2 LYS 509 59.204 21.721 -0.679 380 HZ3 LYS 509 HZ3 LYS 509 58.999 22.647 0.731 381 H ALA 510 H ALA 510 55.194 18.816 5.671 382 HA ALA 510 HA ALA 510 57.696 19.010 6.909 383 HB1 ALA 510 HB1 ALA 510 55.005 18.985 8.280 384 HB2 ALA 510 HB2 ALA 510 55.701 20.388 7.470 385 HB3 ALA 510 HB3 ALA 510 56.495 19.705 8.888 386 H GLU 511 H GLU 511 55.020 16.773 7.642 387 HA GLU 511 HA GLU 511 56.309 15.329 9.681 388 HB2 GLU 511 HB2 GLU 511 53.927 15.137 9.200 389 HB3 GLU 511 HB3 GLU 511 54.271 14.424 7.626 390 HG2 GLU 511 HG2 GLU 511 55.303 12.484 8.700 391 HG3 GLU 511 HG3 GLU 511 55.059 13.213 10.288 392 H TYR 512 H TYR 512 56.306 14.715 6.192 393 HA TYR 512 HA TYR 512 58.013 12.407 6.485 394 HB2 TYR 512 HB2 TYR 512 56.768 13.914 4.214 395 HB3 TYR 512 HB3 TYR 512 58.058 12.756 3.874 396 HD1 TYR 512 HD1 TYR 512 54.734 13.118 5.552 397 HD2 TYR 512 HD2 TYR 512 57.663 10.420 3.953 398 HE1 TYR 512 HE1 TYR 512 53.154 11.231 5.853 399 HE2 TYR 512 HE2 TYR 512 56.097 8.530 4.275 400 HH TYR 512 HH TYR 512 52.757 9.065 5.281 401 H LYS 513 H LYS 513 58.496 15.804 6.231 402 HA LYS 513 HA LYS 513 61.075 15.787 5.026 403 HB2 LYS 513 HB2 LYS 513 59.697 17.866 5.402 404 HB3 LYS 513 HB3 LYS 513 60.025 17.712 7.124 405 HG2 LYS 513 HG2 LYS 513 61.924 18.926 6.775 406 HG3 LYS 513 HG3 LYS 513 62.580 17.525 5.936 407 HD2 LYS 513 HD2 LYS 513 60.917 19.688 4.601 408 HD3 LYS 513 HD3 LYS 513 62.679 19.642 4.595 409 HE2 LYS 513 HE2 LYS 513 62.420 17.261 3.624 410 HE3 LYS 513 HE3 LYS 513 60.752 17.725 3.294 411 HZ1 LYS 513 HZ1 LYS 513 62.814 19.618 2.499 412 HZ2 LYS 513 HZ2 LYS 513 61.370 19.189 1.714 413 HZ3 LYS 513 HZ3 LYS 513 62.733 18.180 1.602 414 H LYS 514 H LYS 514 59.837 15.437 8.300 415 HA LYS 514 HA LYS 514 62.307 15.311 9.677 416 HB2 LYS 514 HB2 LYS 514 59.563 14.161 10.248 417 HB3 LYS 514 HB3 LYS 514 60.924 13.966 11.356 418 HG2 LYS 514 HG2 LYS 514 61.166 16.357 11.558 419 HG3 LYS 514 HG3 LYS 514 59.907 16.626 10.347 420 HD2 LYS 514 HD2 LYS 514 58.298 15.406 11.831 421 HD3 LYS 514 HD3 LYS 514 59.563 15.316 13.059 422 HE2 LYS 514 HE2 LYS 514 59.700 17.754 13.137 423 HE3 LYS 514 HE3 LYS 514 58.501 17.876 11.849 424 HZ1 LYS 514 HZ1 LYS 514 57.971 16.507 14.421 425 HZ2 LYS 514 HZ2 LYS 514 56.846 16.957 13.229 426 HZ3 LYS 514 HZ3 LYS 514 57.622 18.147 14.162 427 H LYS 515 H LYS 515 60.246 12.852 8.146 428 HA LYS 515 HA LYS 515 61.783 10.605 8.908 429 HB2 LYS 515 HB2 LYS 515 60.080 11.070 6.454 430 HB3 LYS 515 HB3 LYS 515 60.761 9.508 6.897 431 HG2 LYS 515 HG2 LYS 515 59.551 9.618 9.063 432 HG3 LYS 515 HG3 LYS 515 58.830 11.153 8.564 433 HD2 LYS 515 HD2 LYS 515 57.785 10.085 6.645 434 HD3 LYS 515 HD3 LYS 515 58.558 8.552 7.032 435 HE2 LYS 515 HE2 LYS 515 56.205 8.647 7.794 436 HE3 LYS 515 HE3 LYS 515 57.332 8.437 9.138 437 HZ1 LYS 515 HZ1 LYS 515 56.247 11.047 8.245 438 HZ2 LYS 515 HZ2 LYS 515 57.219 10.767 9.609 439 HZ3 LYS 515 HZ3 LYS 515 55.633 10.158 9.552 440 H LEU 516 H LEU 516 61.950 12.677 6.044 441 HA LEU 516 HA LEU 516 63.964 11.323 4.638 442 HB2 LEU 516 HB2 LEU 516 62.677 13.043 3.575 443 HB3 LEU 516 HB3 LEU 516 63.144 14.230 4.788 444 HG LEU 516 HG LEU 516 65.446 14.204 3.986 445 HD11 LEU 516 HD11 LEU 516 64.425 11.969 2.235 446 HD12 LEU 516 HD12 LEU 516 65.807 11.949 3.329 447 HD13 LEU 516 HD13 LEU 516 65.883 12.871 1.827 448 HD21 LEU 516 HD21 LEU 516 65.035 14.995 1.629 449 HD22 LEU 516 HD22 LEU 516 63.996 15.743 2.841 450 HD23 LEU 516 HD23 LEU 516 63.364 14.459 1.808 451 H ASP 517 H ASP 517 64.225 14.133 6.801 452 HA ASP 517 HA ASP 517 67.022 14.333 6.784 453 HB2 ASP 517 HB2 ASP 517 64.951 15.153 8.826 454 HB3 ASP 517 HB3 ASP 517 66.657 15.573 8.961 455 H GLN 518 H GLN 518 64.852 12.726 9.093 456 HA GLN 518 HA GLN 518 66.882 11.781 10.821 457 HB2 GLN 518 HB2 GLN 518 64.076 10.788 10.313 458 HB3 GLN 518 HB3 GLN 518 65.114 10.197 11.609 459 HG2 GLN 518 HG2 GLN 518 64.450 13.138 11.260 460 HG3 GLN 518 HG3 GLN 518 63.499 12.061 12.278 461 HE21 GLN 518 HE21 GLN 518 65.422 14.409 12.927 462 HE22 GLN 518 HE22 GLN 518 66.465 13.753 14.096 463 H THR 519 H THR 519 65.359 10.346 7.974 464 HA THR 519 HA THR 519 66.492 7.765 8.216 465 HB THR 519 HB THR 519 65.604 9.291 5.746 466 HG1 THR 519 HG1 THR 519 63.742 7.908 6.098 467 HG21 THR 519 HG21 THR 519 67.067 7.365 5.191 468 HG22 THR 519 HG22 THR 519 65.402 7.072 4.703 469 HG23 THR 519 HG23 THR 519 66.036 6.318 6.164 470 H ARG 520 H ARG 520 67.579 10.715 6.576 471 HA ARG 520 HA ARG 520 69.874 9.653 5.341 472 HB2 ARG 520 HB2 ARG 520 69.161 12.434 6.273 473 HB3 ARG 520 HB3 ARG 520 70.687 12.079 5.466 474 HG2 ARG 520 HG2 ARG 520 69.483 11.201 3.528 475 HG3 ARG 520 HG3 ARG 520 67.939 11.491 4.327 476 HD2 ARG 520 HD2 ARG 520 69.965 13.676 3.810 477 HD3 ARG 520 HD3 ARG 520 68.666 13.297 2.686 478 HE ARG 520 HE ARG 520 67.345 13.671 5.032 479 HH11 ARG 520 HH11 ARG 520 70.006 15.392 5.322 480 HH12 ARG 520 HH12 ARG 520 69.356 16.965 5.001 481 HH21 ARG 520 HH21 ARG 520 66.364 15.766 3.735 482 HH22 ARG 520 HH22 ARG 520 67.297 17.177 4.104 483 H VAL 521 H VAL 521 69.322 10.911 8.586 484 HA VAL 521 HA VAL 521 72.004 11.072 9.428 485 HB VAL 521 HB VAL 521 69.447 10.535 10.960 486 HG11 VAL 521 HG11 VAL 521 72.269 11.019 11.913 487 HG12 VAL 521 HG12 VAL 521 71.167 9.720 12.371 488 HG13 VAL 521 HG13 VAL 521 70.866 11.367 12.925 489 HG21 VAL 521 HG21 VAL 521 69.353 12.849 11.334 490 HG22 VAL 521 HG22 VAL 521 69.929 12.768 9.670 491 HG23 VAL 521 HG23 VAL 521 71.068 13.081 10.979 492 H GLU 522 H GLU 522 69.634 8.424 9.698 493 HA GLU 522 HA GLU 522 71.337 6.585 11.019 494 HB2 GLU 522 HB2 GLU 522 69.012 6.060 9.144 495 HB3 GLU 522 HB3 GLU 522 69.695 4.900 10.283 496 HG2 GLU 522 HG2 GLU 522 69.102 6.379 12.162 497 HG3 GLU 522 HG3 GLU 522 68.445 7.562 11.028 498 H LEU 523 H LEU 523 70.519 6.969 7.596 499 HA LEU 523 HA LEU 523 72.182 4.934 6.598 500 HB2 LEU 523 HB2 LEU 523 70.350 5.856 5.302 501 HB3 LEU 523 HB3 LEU 523 71.115 7.440 5.287 502 HG LEU 523 HG LEU 523 72.983 6.576 3.972 503 HD11 LEU 523 HD11 LEU 523 72.642 4.153 3.054 504 HD12 LEU 523 HD12 LEU 523 71.624 3.932 4.477 505 HD13 LEU 523 HD13 LEU 523 73.325 4.357 4.667 506 HD21 LEU 523 HD21 LEU 523 71.785 6.087 1.911 507 HD22 LEU 523 HD22 LEU 523 70.905 7.313 2.820 508 HD23 LEU 523 HD23 LEU 523 70.338 5.640 2.821 509 H ALA 524 H ALA 524 72.765 8.372 7.154 510 HA ALA 524 HA ALA 524 75.205 8.600 5.802 511 HB1 ALA 524 HB1 ALA 524 75.614 10.511 7.405 512 HB2 ALA 524 HB2 ALA 524 74.119 10.051 8.218 513 HB3 ALA 524 HB3 ALA 524 74.079 10.583 6.538 514 H ASP 525 H ASP 525 74.466 7.585 9.108 515 HA ASP 525 HA ASP 525 77.157 7.369 9.978 516 HB2 ASP 525 HB2 ASP 525 75.264 7.444 11.533 517 HB3 ASP 525 HB3 ASP 525 74.676 5.904 10.908 518 H GLN 526 H GLN 526 74.899 5.139 8.455 519 HA GLN 526 HA GLN 526 76.533 2.816 8.557 520 HB2 GLN 526 HB2 GLN 526 74.136 2.683 8.219 521 HB3 GLN 526 HB3 GLN 526 74.259 3.609 6.727 522 HG2 GLN 526 HG2 GLN 526 75.532 1.817 5.673 523 HG3 GLN 526 HG3 GLN 526 75.564 0.913 7.189 524 HE21 GLN 526 HE21 GLN 526 73.978 0.945 4.282 525 HE22 GLN 526 HE22 GLN 526 72.471 0.327 4.767 526 H VAL 527 H VAL 527 76.286 5.496 6.324 527 HA VAL 527 HA VAL 527 77.813 4.310 4.206 528 HB VAL 527 HB VAL 527 76.934 7.121 4.873 529 HG11 VAL 527 HG11 VAL 527 77.730 7.644 2.497 530 HG12 VAL 527 HG12 VAL 527 78.684 6.164 2.599 531 HG13 VAL 527 HG13 VAL 527 78.989 7.489 3.722 532 HG21 VAL 527 HG21 VAL 527 76.238 5.447 2.459 533 HG22 VAL 527 HG22 VAL 527 75.362 6.819 3.137 534 HG23 VAL 527 HG23 VAL 527 75.363 5.271 3.981 535 H LYS 528 H LYS 528 78.538 6.056 7.116 536 HA LYS 528 HA LYS 528 81.157 6.948 6.482 537 HB2 LYS 528 HB2 LYS 528 79.802 7.833 8.326 538 HB3 LYS 528 HB3 LYS 528 79.941 6.291 9.167 539 HG2 LYS 528 HG2 LYS 528 82.405 6.536 9.202 540 HG3 LYS 528 HG3 LYS 528 82.253 8.097 8.389 541 HD2 LYS 528 HD2 LYS 528 80.821 7.525 10.982 542 HD3 LYS 528 HD3 LYS 528 82.482 8.109 10.961 543 HE2 LYS 528 HE2 LYS 528 81.693 10.046 9.537 544 HE3 LYS 528 HE3 LYS 528 80.042 9.506 9.826 545 HZ1 LYS 528 HZ1 LYS 528 80.616 9.605 12.254 546 HZ2 LYS 528 HZ2 LYS 528 80.482 11.099 11.457 547 HZ3 LYS 528 HZ3 LYS 528 82.014 10.454 11.809 548 H SER 529 H SER 529 79.944 4.051 8.137 549 HA SER 529 HA SER 529 82.597 3.021 8.541 550 HB2 SER 529 HB2 SER 529 79.819 1.920 8.956 551 HB3 SER 529 HB3 SER 529 81.250 0.913 9.183 552 HG SER 529 HG SER 529 80.430 3.224 10.564 553 H ALA 530 H ALA 530 80.339 2.980 5.975 554 HA ALA 530 HA ALA 530 81.224 0.511 4.768 555 HB1 ALA 530 HB1 ALA 530 79.741 1.066 2.980 556 HB2 ALA 530 HB2 ALA 530 79.723 2.770 3.439 557 HB3 ALA 530 HB3 ALA 530 78.937 1.569 4.468 558 H VAL 531 H VAL 531 82.692 3.401 5.175 559 HA VAL 531 HA VAL 531 83.752 4.101 2.680 560 HB VAL 531 HB VAL 531 84.881 4.333 5.470 561 HG11 VAL 531 HG11 VAL 531 86.238 6.206 4.403 562 HG12 VAL 531 HG12 VAL 531 85.798 5.509 2.844 563 HG13 VAL 531 HG13 VAL 531 86.740 4.564 3.998 564 HG21 VAL 531 HG21 VAL 531 83.667 6.520 3.778 565 HG22 VAL 531 HG22 VAL 531 83.875 6.467 5.530 566 HG23 VAL 531 HG23 VAL 531 82.649 5.463 4.756 567 H THR 532 H THR 532 84.421 2.281 1.452 568 HA THR 532 HA THR 532 87.050 1.274 2.132 569 HB THR 532 HB THR 532 85.329 -0.153 3.398 570 HG1 THR 532 HG1 THR 532 86.903 -1.503 3.381 571 HG21 THR 532 HG21 THR 532 84.188 -1.876 2.184 572 HG22 THR 532 HG22 THR 532 84.969 -1.419 0.672 573 HG23 THR 532 HG23 THR 532 83.775 -0.347 1.407 574 H GLU 533 H GLU 533 84.299 1.275 -0.083 575 HA GLU 533 HA GLU 533 86.180 0.823 -2.328 576 HB2 GLU 533 HB2 GLU 533 84.502 -0.581 -3.417 577 HB3 GLU 533 HB3 GLU 533 84.992 -1.264 -1.870 578 HG2 GLU 533 HG2 GLU 533 82.984 -0.180 -0.823 579 HG3 GLU 533 HG3 GLU 533 82.464 0.308 -2.436 580 H PHE 534 H PHE 534 84.401 2.988 -0.975 581 HA PHE 534 HA PHE 534 82.438 4.008 -2.564 582 HB2 PHE 534 HB2 PHE 534 83.331 6.280 -1.857 583 HB3 PHE 534 HB3 PHE 534 83.024 5.130 -0.552 584 HD1 PHE 534 HD1 PHE 534 84.880 3.886 0.492 585 HD2 PHE 534 HD2 PHE 534 85.569 6.961 -2.414 586 HE1 PHE 534 HE1 PHE 534 87.265 3.978 1.162 587 HE2 PHE 534 HE2 PHE 534 87.956 7.061 -1.750 588 HZ PHE 534 HZ PHE 534 88.804 5.568 0.040 589 H GLU 535 H GLU 535 82.302 5.372 -4.351 590 HA GLU 535 HA GLU 535 83.777 4.904 -6.603 591 HB2 GLU 535 HB2 GLU 535 82.465 7.500 -5.758 592 HB3 GLU 535 HB3 GLU 535 83.029 7.160 -7.393 593 HG2 GLU 535 HG2 GLU 535 81.508 5.273 -7.579 594 HG3 GLU 535 HG3 GLU 535 81.010 5.468 -5.899 595 H ASN 536 H ASN 536 85.406 6.129 -7.749 596 HA ASN 536 HA ASN 536 87.582 6.909 -7.820 597 HB2 ASN 536 HB2 ASN 536 87.779 9.211 -7.170 598 HB3 ASN 536 HB3 ASN 536 86.151 8.957 -7.794 599 HD21 ASN 536 HD21 ASN 536 88.005 9.755 -4.936 600 HD22 ASN 536 HD22 ASN 536 86.675 10.042 -3.918 601 H VAL 537 H VAL 537 87.763 4.889 -6.156 602 HA VAL 537 HA VAL 537 88.403 5.416 -3.465 603 HB VAL 537 HB VAL 537 89.343 3.238 -5.341 604 HG11 VAL 537 HG11 VAL 537 89.854 2.046 -3.120 605 HG12 VAL 537 HG12 VAL 537 89.802 3.647 -2.382 606 HG13 VAL 537 HG13 VAL 537 90.992 3.290 -3.634 607 HG21 VAL 537 HG21 VAL 537 87.197 3.419 -3.211 608 HG22 VAL 537 HG22 VAL 537 87.723 1.900 -3.935 609 HG23 VAL 537 HG23 VAL 537 86.970 3.139 -4.939 610 H THR 538 H THR 538 90.536 5.105 -6.293 611 HA THR 538 HA THR 538 92.367 7.099 -5.380 612 HB THR 538 HB THR 538 93.509 4.305 -5.358 613 HG1 THR 538 HG1 THR 538 92.930 5.704 -3.010 614 HG21 THR 538 HG21 THR 538 94.397 6.981 -4.249 615 HG22 THR 538 HG22 THR 538 95.100 6.124 -5.621 616 HG23 THR 538 HG23 THR 538 95.253 5.461 -3.994 617 HA PRO 539 HA PRO 539 91.919 5.577 -9.922 618 HB2 PRO 539 HB2 PRO 539 92.141 8.413 -10.545 619 HB3 PRO 539 HB3 PRO 539 90.763 7.335 -10.822 620 HG2 PRO 539 HG2 PRO 539 91.253 9.216 -8.600 621 HG3 PRO 539 HG3 PRO 539 89.722 8.554 -9.199 622 HD2 PRO 539 HD2 PRO 539 90.755 7.778 -6.838 623 HD3 PRO 539 HD3 PRO 539 89.889 6.630 -7.882 624 H THR 540 H THR 540 93.678 5.292 -11.226 625 HA THR 540 HA THR 540 96.241 6.516 -10.364 626 HB THR 540 HB THR 540 97.306 4.497 -11.264 627 HG1 THR 540 HG1 THR 540 96.140 2.959 -12.234 628 HG21 THR 540 HG21 THR 540 96.533 2.938 -9.573 629 HG22 THR 540 HG22 THR 540 94.990 3.783 -9.444 630 HG23 THR 540 HG23 THR 540 96.473 4.568 -8.901 631 H ASN 541 H ASN 541 94.021 7.137 -12.549 632 HA ASN 541 HA ASN 541 95.201 6.883 -15.077 633 HB2 ASN 541 HB2 ASN 541 93.350 9.015 -13.995 634 HB3 ASN 541 HB3 ASN 541 93.744 8.816 -15.704 635 HD21 ASN 541 HD21 ASN 541 93.841 5.865 -15.619 636 HD22 ASN 541 HD22 ASN 541 92.242 5.335 -15.427 637 H ASP 542 H ASP 542 97.163 7.482 -15.577 638 HA ASP 542 HA ASP 542 98.455 9.779 -14.332 639 HB2 ASP 542 HB2 ASP 542 99.577 7.560 -14.688 640 HB3 ASP 542 HB3 ASP 542 99.519 7.873 -16.422 641 H GLN 543 H GLN 543 98.173 11.757 -15.175 642 HA GLN 543 HA GLN 543 97.031 12.428 -17.604 643 HB2 GLN 543 HB2 GLN 543 97.488 14.011 -15.732 644 HB3 GLN 543 HB3 GLN 543 99.196 13.988 -16.169 645 HG2 GLN 543 HG2 GLN 543 98.151 15.940 -17.176 646 HG3 GLN 543 HG3 GLN 543 98.577 14.804 -18.453 647 HE21 GLN 543 HE21 GLN 543 95.750 14.899 -16.203 648 HE22 GLN 543 HE22 GLN 543 94.588 14.880 -17.440 Start of MODEL 4 1 H1 SER 466 H1 SER 466 27.881 -1.033 2.458 2 H2 SER 466 H2 SER 466 29.205 -0.443 3.345 3 H3 SER 466 H3 SER 466 29.411 -0.941 1.732 4 HA SER 466 HA SER 466 28.214 0.880 0.888 5 HB2 SER 466 HB2 SER 466 27.598 1.723 3.727 6 HB3 SER 466 HB3 SER 466 26.878 2.320 2.235 7 HG SER 466 HG SER 466 25.415 0.889 2.896 8 H ASP 467 H ASP 467 28.741 3.383 1.443 9 HA ASP 467 HA ASP 467 30.475 4.898 1.542 10 HB2 ASP 467 HB2 ASP 467 30.934 3.252 4.034 11 HB3 ASP 467 HB3 ASP 467 31.807 4.743 3.681 12 H ASP 468 H ASP 468 30.976 2.640 -0.125 13 HA ASP 468 HA ASP 468 33.555 1.523 0.332 14 HB2 ASP 468 HB2 ASP 468 33.376 0.754 -1.984 15 HB3 ASP 468 HB3 ASP 468 31.845 0.503 -1.143 16 H TYR 469 H TYR 469 35.025 1.838 -1.888 17 HA TYR 469 HA TYR 469 36.580 3.187 -2.887 18 HB2 TYR 469 HB2 TYR 469 34.353 3.988 -3.823 19 HB3 TYR 469 HB3 TYR 469 34.478 5.333 -2.695 20 HD1 TYR 469 HD1 TYR 469 36.073 3.677 -5.600 21 HD2 TYR 469 HD2 TYR 469 36.005 7.139 -3.063 22 HE1 TYR 469 HE1 TYR 469 37.543 4.873 -7.196 23 HE2 TYR 469 HE2 TYR 469 37.479 8.338 -4.655 24 HH TYR 469 HH TYR 469 39.217 6.827 -7.046 25 H VAL 470 H VAL 470 38.095 4.919 -2.523 26 HA VAL 470 HA VAL 470 38.047 6.002 0.239 27 HB VAL 470 HB VAL 470 40.580 5.546 -1.325 28 HG11 VAL 470 HG11 VAL 470 40.699 6.855 0.738 29 HG12 VAL 470 HG12 VAL 470 41.499 5.298 0.950 30 HG13 VAL 470 HG13 VAL 470 39.891 5.564 1.623 31 HG21 VAL 470 HG21 VAL 470 39.511 3.388 -1.417 32 HG22 VAL 470 HG22 VAL 470 38.993 3.511 0.264 33 HG23 VAL 470 HG23 VAL 470 40.704 3.327 -0.120 34 H ASP 471 H ASP 471 38.344 8.149 0.532 35 HA ASP 471 HA ASP 471 37.882 10.038 -1.376 36 HB2 ASP 471 HB2 ASP 471 39.614 10.224 1.092 37 HB3 ASP 471 HB3 ASP 471 39.192 11.623 0.107 38 H GLU 472 H GLU 472 39.110 11.349 -2.705 39 HA GLU 472 HA GLU 472 41.196 10.166 -4.149 40 HB2 GLU 472 HB2 GLU 472 40.282 13.037 -3.941 41 HB3 GLU 472 HB3 GLU 472 41.462 12.467 -5.123 42 HG2 GLU 472 HG2 GLU 472 39.848 10.922 -6.074 43 HG3 GLU 472 HG3 GLU 472 38.680 11.308 -4.812 44 H GLU 473 H GLU 473 41.328 12.692 -1.639 45 HA GLU 473 HA GLU 473 44.111 13.185 -1.852 46 HB2 GLU 473 HB2 GLU 473 43.861 14.420 0.170 47 HB3 GLU 473 HB3 GLU 473 42.375 14.641 -0.747 48 HG2 GLU 473 HG2 GLU 473 41.417 12.693 0.603 49 HG3 GLU 473 HG3 GLU 473 42.827 12.861 1.653 50 H THR 474 H THR 474 42.204 11.107 0.221 51 HA THR 474 HA THR 474 44.305 10.060 1.819 52 HB THR 474 HB THR 474 41.608 8.969 1.007 53 HG1 THR 474 HG1 THR 474 42.586 10.288 3.320 54 HG21 THR 474 HG21 THR 474 41.915 7.509 3.064 55 HG22 THR 474 HG22 THR 474 43.631 7.913 2.981 56 HG23 THR 474 HG23 THR 474 42.854 7.061 1.640 57 H TYR 475 H TYR 475 42.710 8.925 -1.113 58 HA TYR 475 HA TYR 475 44.071 6.487 -1.338 59 HB2 TYR 475 HB2 TYR 475 41.978 7.136 -2.512 60 HB3 TYR 475 HB3 TYR 475 42.934 8.191 -3.555 61 HD1 TYR 475 HD1 TYR 475 42.773 4.701 -2.299 62 HD2 TYR 475 HD2 TYR 475 43.906 7.314 -5.501 63 HE1 TYR 475 HE1 TYR 475 43.347 2.724 -3.703 64 HE2 TYR 475 HE2 TYR 475 44.491 5.350 -6.912 65 HH TYR 475 HH TYR 475 44.914 3.095 -6.838 66 H ASN 476 H ASN 476 44.746 9.655 -2.834 67 HA ASN 476 HA ASN 476 47.047 8.764 -4.268 68 HB2 ASN 476 HB2 ASN 476 46.450 11.571 -3.307 69 HB3 ASN 476 HB3 ASN 476 47.489 11.087 -4.649 70 HD21 ASN 476 HD21 ASN 476 45.177 8.891 -5.007 71 HD22 ASN 476 HD22 ASN 476 44.049 9.731 -5.957 72 H LEU 477 H LEU 477 46.466 10.058 -1.051 73 HA LEU 477 HA LEU 477 49.126 10.558 -0.277 74 HB2 LEU 477 HB2 LEU 477 47.152 11.249 1.028 75 HB3 LEU 477 HB3 LEU 477 46.782 9.564 1.365 76 HG LEU 477 HG LEU 477 48.975 9.336 2.515 77 HD11 LEU 477 HD11 LEU 477 50.418 10.948 1.636 78 HD12 LEU 477 HD12 LEU 477 49.960 11.702 3.161 79 HD13 LEU 477 HD13 LEU 477 49.192 12.216 1.658 80 HD21 LEU 477 HD21 LEU 477 47.211 11.587 3.513 81 HD22 LEU 477 HD22 LEU 477 48.311 10.626 4.502 82 HD23 LEU 477 HD23 LEU 477 46.908 9.868 3.753 83 H GLN 478 H GLN 478 47.081 7.640 -0.069 84 HA GLN 478 HA GLN 478 48.945 5.916 1.144 85 HB2 GLN 478 HB2 GLN 478 46.659 5.415 -0.770 86 HB3 GLN 478 HB3 GLN 478 47.584 4.114 -0.024 87 HG2 GLN 478 HG2 GLN 478 46.213 6.296 1.552 88 HG3 GLN 478 HG3 GLN 478 45.469 4.738 1.205 89 HE21 GLN 478 HE21 GLN 478 46.627 6.113 3.760 90 HE22 GLN 478 HE22 GLN 478 47.585 4.890 4.448 91 H LYS 479 H LYS 479 48.361 6.756 -2.201 92 HA LYS 479 HA LYS 479 50.106 4.900 -3.431 93 HB2 LYS 479 HB2 LYS 479 48.240 6.175 -4.497 94 HB3 LYS 479 HB3 LYS 479 49.223 7.631 -4.382 95 HG2 LYS 479 HG2 LYS 479 50.899 6.710 -5.845 96 HG3 LYS 479 HG3 LYS 479 50.130 5.123 -5.824 97 HD2 LYS 479 HD2 LYS 479 49.474 6.194 -7.883 98 HD3 LYS 479 HD3 LYS 479 48.069 6.211 -6.818 99 HE2 LYS 479 HE2 LYS 479 48.340 8.512 -6.314 100 HE3 LYS 479 HE3 LYS 479 49.985 8.542 -6.950 101 HZ1 LYS 479 HZ1 LYS 479 49.238 8.466 -9.115 102 HZ2 LYS 479 HZ2 LYS 479 48.078 9.464 -8.376 103 HZ3 LYS 479 HZ3 LYS 479 47.722 7.833 -8.696 104 H LEU 480 H LEU 480 50.516 8.187 -2.254 105 HA LEU 480 HA LEU 480 53.070 8.712 -3.307 106 HB2 LEU 480 HB2 LEU 480 51.412 9.793 -1.057 107 HB3 LEU 480 HB3 LEU 480 53.069 10.353 -1.255 108 HG LEU 480 HG LEU 480 51.302 10.324 -3.692 109 HD11 LEU 480 HD11 LEU 480 50.990 12.182 -1.335 110 HD12 LEU 480 HD12 LEU 480 49.746 11.441 -2.341 111 HD13 LEU 480 HD13 LEU 480 50.702 12.779 -2.972 112 HD21 LEU 480 HD21 LEU 480 53.698 10.949 -3.812 113 HD22 LEU 480 HD22 LEU 480 53.410 12.239 -2.644 114 HD23 LEU 480 HD23 LEU 480 52.657 12.308 -4.238 115 H LEU 481 H LEU 481 52.088 7.371 -0.169 116 HA LEU 481 HA LEU 481 54.719 7.240 0.901 117 HB2 LEU 481 HB2 LEU 481 52.286 5.657 1.735 118 HB3 LEU 481 HB3 LEU 481 53.691 6.059 2.725 119 HG LEU 481 HG LEU 481 51.708 8.006 1.558 120 HD11 LEU 481 HD11 LEU 481 51.280 8.501 3.993 121 HD12 LEU 481 HD12 LEU 481 52.239 7.070 4.369 122 HD13 LEU 481 HD13 LEU 481 50.741 6.912 3.451 123 HD21 LEU 481 HD21 LEU 481 53.050 9.601 3.118 124 HD22 LEU 481 HD22 LEU 481 53.684 9.222 1.522 125 HD23 LEU 481 HD23 LEU 481 54.328 8.395 2.937 126 H ALA 482 H ALA 482 52.658 4.932 -0.773 127 HA ALA 482 HA ALA 482 53.645 2.518 -0.383 128 HB1 ALA 482 HB1 ALA 482 52.623 3.897 -2.738 129 HB2 ALA 482 HB2 ALA 482 52.289 2.263 -2.173 130 HB3 ALA 482 HB3 ALA 482 53.704 2.574 -3.180 131 HA PRO 483 HA PRO 483 57.549 2.899 -3.382 132 HB2 PRO 483 HB2 PRO 483 58.448 5.635 -3.119 133 HB3 PRO 483 HB3 PRO 483 57.893 4.812 -4.587 134 HG2 PRO 483 HG2 PRO 483 56.413 6.589 -2.747 135 HG3 PRO 483 HG3 PRO 483 56.155 6.295 -4.473 136 HD2 PRO 483 HD2 PRO 483 54.463 5.332 -2.624 137 HD3 PRO 483 HD3 PRO 483 54.861 4.394 -4.080 138 H TYR 484 H TYR 484 57.572 5.435 -0.862 139 HA TYR 484 HA TYR 484 60.076 4.662 0.225 140 HB2 TYR 484 HB2 TYR 484 59.486 6.876 0.646 141 HB3 TYR 484 HB3 TYR 484 57.831 6.456 1.112 142 HD1 TYR 484 HD1 TYR 484 61.400 6.242 2.214 143 HD2 TYR 484 HD2 TYR 484 57.279 5.971 3.409 144 HE1 TYR 484 HE1 TYR 484 62.086 6.133 4.597 145 HE2 TYR 484 HE2 TYR 484 57.975 5.860 5.780 146 HH TYR 484 HH TYR 484 61.203 5.319 6.730 147 H HIS 485 H HIS 485 56.761 3.748 0.868 148 HA HIS 485 HA HIS 485 57.109 2.460 3.353 149 HB2 HIS 485 HB2 HIS 485 54.943 3.139 2.226 150 HB3 HIS 485 HB3 HIS 485 55.117 1.703 1.220 151 HD1 HIS 485 HD1 HIS 485 54.975 -0.627 2.415 152 HD2 HIS 485 HD2 HIS 485 54.142 2.628 4.881 153 HE1 HIS 485 HE1 HIS 485 53.858 -1.564 4.487 154 H LYS 486 H LYS 486 57.337 1.274 0.024 155 HA LYS 486 HA LYS 486 57.900 -1.451 0.872 156 HB2 LYS 486 HB2 LYS 486 57.937 -1.947 -1.511 157 HB3 LYS 486 HB3 LYS 486 56.553 -0.914 -1.169 158 HG2 LYS 486 HG2 LYS 486 57.778 1.046 -1.903 159 HG3 LYS 486 HG3 LYS 486 59.223 0.084 -2.200 160 HD2 LYS 486 HD2 LYS 486 57.865 -1.269 -3.838 161 HD3 LYS 486 HD3 LYS 486 56.574 -0.083 -3.651 162 HE2 LYS 486 HE2 LYS 486 57.609 1.311 -5.131 163 HE3 LYS 486 HE3 LYS 486 59.082 1.310 -4.162 164 HZ1 LYS 486 HZ1 LYS 486 58.902 0.262 -6.608 165 HZ2 LYS 486 HZ2 LYS 486 58.589 -1.118 -5.666 166 HZ3 LYS 486 HZ3 LYS 486 60.029 -0.243 -5.445 167 H ALA 487 H ALA 487 59.641 1.393 0.396 168 HA ALA 487 HA ALA 487 62.075 0.474 -0.674 169 HB1 ALA 487 HB1 ALA 487 61.364 2.851 -0.560 170 HB2 ALA 487 HB2 ALA 487 62.977 2.589 0.103 171 HB3 ALA 487 HB3 ALA 487 61.601 2.810 1.186 172 H LYS 488 H LYS 488 63.174 -1.149 0.247 173 HA LYS 488 HA LYS 488 63.355 -1.417 3.163 174 HB2 LYS 488 HB2 LYS 488 64.441 -3.140 0.927 175 HB3 LYS 488 HB3 LYS 488 64.438 -3.554 2.642 176 HG2 LYS 488 HG2 LYS 488 61.998 -3.482 2.687 177 HG3 LYS 488 HG3 LYS 488 61.967 -2.973 1.000 178 HD2 LYS 488 HD2 LYS 488 63.163 -5.095 0.401 179 HD3 LYS 488 HD3 LYS 488 62.972 -5.613 2.077 180 HE2 LYS 488 HE2 LYS 488 60.465 -5.139 1.754 181 HE3 LYS 488 HE3 LYS 488 60.829 -5.084 0.028 182 HZ1 LYS 488 HZ1 LYS 488 60.251 -7.318 1.398 183 HZ2 LYS 488 HZ2 LYS 488 61.950 -7.347 1.421 184 HZ3 LYS 488 HZ3 LYS 488 61.118 -7.284 -0.060 185 H THR 489 H THR 489 65.124 0.008 0.640 186 HA THR 489 HA THR 489 67.691 -0.234 2.090 187 HB THR 489 HB THR 489 68.744 0.374 0.016 188 HG1 THR 489 HG1 THR 489 67.714 1.484 -1.427 189 HG21 THR 489 HG21 THR 489 67.967 -1.439 -1.431 190 HG22 THR 489 HG22 THR 489 66.436 -1.510 -0.550 191 HG23 THR 489 HG23 THR 489 67.939 -1.966 0.252 192 H LEU 490 H LEU 490 68.588 1.501 3.068 193 HA LEU 490 HA LEU 490 67.125 3.821 3.627 194 HB2 LEU 490 HB2 LEU 490 70.018 3.037 3.874 195 HB3 LEU 490 HB3 LEU 490 69.511 4.674 4.293 196 HG LEU 490 HG LEU 490 67.838 3.725 5.860 197 HD11 LEU 490 HD11 LEU 490 67.327 1.605 4.937 198 HD12 LEU 490 HD12 LEU 490 68.199 1.244 6.427 199 HD13 LEU 490 HD13 LEU 490 69.026 1.133 4.872 200 HD21 LEU 490 HD21 LEU 490 70.078 4.325 6.697 201 HD22 LEU 490 HD22 LEU 490 70.674 2.721 6.271 202 HD23 LEU 490 HD23 LEU 490 69.468 2.903 7.544 203 H GLU 491 H GLU 491 69.670 3.240 1.229 204 HA GLU 491 HA GLU 491 70.076 5.823 0.276 205 HB2 GLU 491 HB2 GLU 491 71.470 3.964 -0.396 206 HB3 GLU 491 HB3 GLU 491 70.098 3.153 -1.145 207 HG2 GLU 491 HG2 GLU 491 71.496 4.237 -2.837 208 HG3 GLU 491 HG3 GLU 491 69.910 4.992 -2.788 209 H ARG 492 H ARG 492 67.604 3.471 -0.558 210 HA ARG 492 HA ARG 492 66.417 5.108 -2.601 211 HB2 ARG 492 HB2 ARG 492 66.282 2.678 -2.678 212 HB3 ARG 492 HB3 ARG 492 65.404 2.667 -1.150 213 HG2 ARG 492 HG2 ARG 492 63.500 3.737 -2.104 214 HG3 ARG 492 HG3 ARG 492 64.381 4.149 -3.584 215 HD2 ARG 492 HD2 ARG 492 62.928 2.169 -3.918 216 HD3 ARG 492 HD3 ARG 492 64.631 1.766 -4.119 217 HE ARG 492 HE ARG 492 63.751 1.362 -1.424 218 HH11 ARG 492 HH11 ARG 492 61.916 -0.048 -3.595 219 HH12 ARG 492 HH12 ARG 492 62.576 -1.648 -3.520 220 HH21 ARG 492 HH21 ARG 492 65.410 -0.684 -1.778 221 HH22 ARG 492 HH22 ARG 492 64.555 -2.010 -2.490 222 H GLN 493 H GLN 493 65.853 4.524 0.818 223 HA GLN 493 HA GLN 493 63.314 5.664 1.043 224 HB2 GLN 493 HB2 GLN 493 65.632 5.493 2.962 225 HB3 GLN 493 HB3 GLN 493 64.076 6.173 3.424 226 HG2 GLN 493 HG2 GLN 493 62.943 4.098 2.935 227 HG3 GLN 493 HG3 GLN 493 64.392 3.419 2.215 228 HE21 GLN 493 HE21 GLN 493 63.639 1.761 4.066 229 HE22 GLN 493 HE22 GLN 493 64.414 1.977 5.562 230 H VAL 494 H VAL 494 66.518 7.225 1.388 231 HA VAL 494 HA VAL 494 65.512 9.807 1.890 232 HB VAL 494 HB VAL 494 67.956 8.770 2.021 233 HG11 VAL 494 HG11 VAL 494 68.120 10.269 -0.602 234 HG12 VAL 494 HG12 VAL 494 68.088 8.515 -0.479 235 HG13 VAL 494 HG13 VAL 494 69.417 9.416 0.231 236 HG21 VAL 494 HG21 VAL 494 67.437 10.932 2.960 237 HG22 VAL 494 HG22 VAL 494 67.313 11.653 1.355 238 HG23 VAL 494 HG23 VAL 494 68.879 11.115 1.961 239 H TYR 495 H TYR 495 66.422 8.164 -1.104 240 HA TYR 495 HA TYR 495 66.030 10.273 -2.905 241 HB2 TYR 495 HB2 TYR 495 67.163 8.276 -3.562 242 HB3 TYR 495 HB3 TYR 495 65.765 7.281 -3.172 243 HD1 TYR 495 HD1 TYR 495 66.891 10.056 -5.416 244 HD2 TYR 495 HD2 TYR 495 64.141 6.809 -4.807 245 HE1 TYR 495 HE1 TYR 495 66.068 10.313 -7.742 246 HE2 TYR 495 HE2 TYR 495 63.320 7.068 -7.135 247 HH TYR 495 HH TYR 495 63.369 8.354 -8.965 248 H GLU 496 H GLU 496 63.720 7.743 -1.854 249 HA GLU 496 HA GLU 496 61.566 8.667 -3.439 250 HB2 GLU 496 HB2 GLU 496 61.623 7.060 -0.889 251 HB3 GLU 496 HB3 GLU 496 60.172 7.333 -1.855 252 HG2 GLU 496 HG2 GLU 496 62.718 6.099 -2.938 253 HG3 GLU 496 HG3 GLU 496 61.335 5.164 -2.379 254 H LEU 497 H LEU 497 62.579 9.393 -0.145 255 HA LEU 497 HA LEU 497 60.377 10.993 0.553 256 HB2 LEU 497 HB2 LEU 497 63.228 10.880 1.495 257 HB3 LEU 497 HB3 LEU 497 62.045 11.968 2.221 258 HG LEU 497 HG LEU 497 61.624 8.977 1.937 259 HD11 LEU 497 HD11 LEU 497 63.577 9.736 3.465 260 HD12 LEU 497 HD12 LEU 497 62.365 8.659 4.157 261 HD13 LEU 497 HD13 LEU 497 62.315 10.384 4.512 262 HD21 LEU 497 HD21 LEU 497 60.019 9.738 3.976 263 HD22 LEU 497 HD22 LEU 497 59.494 9.757 2.294 264 HD23 LEU 497 HD23 LEU 497 60.037 11.247 3.064 265 H GLU 498 H GLU 498 63.430 11.770 -1.047 266 HA GLU 498 HA GLU 498 63.217 14.561 -1.026 267 HB2 GLU 498 HB2 GLU 498 64.511 12.586 -2.898 268 HB3 GLU 498 HB3 GLU 498 64.597 14.320 -3.207 269 HG2 GLU 498 HG2 GLU 498 65.730 14.725 -1.138 270 HG3 GLU 498 HG3 GLU 498 65.400 13.099 -0.557 271 H LYS 499 H LYS 499 62.149 12.249 -3.521 272 HA LYS 499 HA LYS 499 60.909 14.209 -5.203 273 HB2 LYS 499 HB2 LYS 499 60.879 11.213 -4.953 274 HB3 LYS 499 HB3 LYS 499 59.677 11.981 -5.985 275 HG2 LYS 499 HG2 LYS 499 61.704 11.335 -7.249 276 HG3 LYS 499 HG3 LYS 499 61.453 13.079 -7.271 277 HD2 LYS 499 HD2 LYS 499 63.117 13.376 -5.510 278 HD3 LYS 499 HD3 LYS 499 63.317 11.630 -5.370 279 HE2 LYS 499 HE2 LYS 499 65.118 12.468 -6.742 280 HE3 LYS 499 HE3 LYS 499 64.001 11.592 -7.791 281 HZ1 LYS 499 HZ1 LYS 499 64.849 14.127 -8.197 282 HZ2 LYS 499 HZ2 LYS 499 63.341 14.372 -7.455 283 HZ3 LYS 499 HZ3 LYS 499 63.451 13.448 -8.876 284 H LEU 500 H LEU 500 59.675 11.985 -2.746 285 HA LEU 500 HA LEU 500 56.955 12.637 -3.029 286 HB2 LEU 500 HB2 LEU 500 58.543 11.549 -0.718 287 HB3 LEU 500 HB3 LEU 500 56.790 11.642 -0.732 288 HG LEU 500 HG LEU 500 58.320 10.255 -2.942 289 HD11 LEU 500 HD11 LEU 500 57.156 8.988 -0.444 290 HD12 LEU 500 HD12 LEU 500 58.878 9.244 -0.723 291 HD13 LEU 500 HD13 LEU 500 57.971 8.149 -1.764 292 HD21 LEU 500 HD21 LEU 500 55.450 10.234 -1.983 293 HD22 LEU 500 HD22 LEU 500 56.106 9.001 -3.057 294 HD23 LEU 500 HD23 LEU 500 56.060 10.672 -3.579 295 H GLN 501 H GLN 501 59.490 13.977 -0.974 296 HA GLN 501 HA GLN 501 57.970 15.674 0.626 297 HB2 GLN 501 HB2 GLN 501 60.780 15.700 -0.414 298 HB3 GLN 501 HB3 GLN 501 60.186 17.141 0.410 299 HG2 GLN 501 HG2 GLN 501 59.977 14.364 1.598 300 HG3 GLN 501 HG3 GLN 501 61.339 15.446 1.908 301 HE21 GLN 501 HE21 GLN 501 58.413 14.507 3.173 302 HE22 GLN 501 HE22 GLN 501 58.036 15.903 4.055 303 H GLU 502 H GLU 502 58.870 15.965 -2.722 304 HA GLU 502 HA GLU 502 58.199 18.761 -2.975 305 HB2 GLU 502 HB2 GLU 502 59.904 17.648 -4.374 306 HB3 GLU 502 HB3 GLU 502 58.658 16.607 -5.050 307 HG2 GLU 502 HG2 GLU 502 59.050 18.379 -6.607 308 HG3 GLU 502 HG3 GLU 502 57.478 18.671 -5.874 309 H LYS 503 H LYS 503 56.609 15.684 -3.402 310 HA LYS 503 HA LYS 503 54.229 16.962 -4.611 311 HB2 LYS 503 HB2 LYS 503 55.171 14.114 -4.356 312 HB3 LYS 503 HB3 LYS 503 53.619 14.579 -5.059 313 HG2 LYS 503 HG2 LYS 503 54.676 15.825 -6.805 314 HG3 LYS 503 HG3 LYS 503 56.248 15.734 -6.011 315 HD2 LYS 503 HD2 LYS 503 56.190 14.129 -7.833 316 HD3 LYS 503 HD3 LYS 503 56.209 13.258 -6.302 317 HE2 LYS 503 HE2 LYS 503 53.926 12.690 -6.460 318 HE3 LYS 503 HE3 LYS 503 53.606 13.933 -7.669 319 HZ1 LYS 503 HZ1 LYS 503 55.622 12.185 -8.585 320 HZ2 LYS 503 HZ2 LYS 503 54.103 12.518 -9.271 321 HZ3 LYS 503 HZ3 LYS 503 54.265 11.283 -8.115 322 H LEU 504 H LEU 504 55.316 15.547 -1.670 323 HA LEU 504 HA LEU 504 52.893 14.578 -0.681 324 HB2 LEU 504 HB2 LEU 504 55.502 15.383 0.522 325 HB3 LEU 504 HB3 LEU 504 54.141 15.051 1.593 326 HG LEU 504 HG LEU 504 55.077 13.142 -0.567 327 HD11 LEU 504 HD11 LEU 504 55.975 11.851 1.463 328 HD12 LEU 504 HD12 LEU 504 55.778 13.352 2.359 329 HD13 LEU 504 HD13 LEU 504 56.887 13.288 0.993 330 HD21 LEU 504 HD21 LEU 504 52.970 12.353 -0.094 331 HD22 LEU 504 HD22 LEU 504 52.905 13.115 1.489 332 HD23 LEU 504 HD23 LEU 504 53.791 11.606 1.272 333 HA PRO 505 HA PRO 505 50.677 18.572 -0.288 334 HB2 PRO 505 HB2 PRO 505 49.186 17.349 1.896 335 HB3 PRO 505 HB3 PRO 505 48.617 17.720 0.260 336 HG2 PRO 505 HG2 PRO 505 49.752 15.177 1.316 337 HG3 PRO 505 HG3 PRO 505 48.550 15.425 0.044 338 HD2 PRO 505 HD2 PRO 505 50.952 14.689 -0.613 339 HD3 PRO 505 HD3 PRO 505 50.212 16.016 -1.531 340 H GLU 506 H GLU 506 50.883 20.251 1.109 341 HA GLU 506 HA GLU 506 53.048 20.737 2.568 342 HB2 GLU 506 HB2 GLU 506 50.255 21.713 3.177 343 HB3 GLU 506 HB3 GLU 506 51.725 22.433 3.837 344 HG2 GLU 506 HG2 GLU 506 51.163 22.119 0.874 345 HG3 GLU 506 HG3 GLU 506 50.886 23.602 1.783 346 H LYS 507 H LYS 507 50.056 19.869 4.327 347 HA LYS 507 HA LYS 507 51.187 19.610 6.841 348 HB2 LYS 507 HB2 LYS 507 49.237 18.326 7.435 349 HB3 LYS 507 HB3 LYS 507 48.743 19.549 6.262 350 HG2 LYS 507 HG2 LYS 507 49.139 17.764 4.462 351 HG3 LYS 507 HG3 LYS 507 49.230 16.605 5.785 352 HD2 LYS 507 HD2 LYS 507 46.878 18.466 5.357 353 HD3 LYS 507 HD3 LYS 507 46.941 16.818 4.737 354 HE2 LYS 507 HE2 LYS 507 47.416 16.085 7.146 355 HE3 LYS 507 HE3 LYS 507 46.951 17.718 7.623 356 HZ1 LYS 507 HZ1 LYS 507 44.807 17.298 7.236 357 HZ2 LYS 507 HZ2 LYS 507 45.247 15.658 7.286 358 HZ3 LYS 507 HZ3 LYS 507 45.116 16.461 5.794 359 H TYR 508 H TYR 508 51.270 17.349 4.176 360 HA TYR 508 HA TYR 508 52.416 15.225 5.852 361 HB2 TYR 508 HB2 TYR 508 51.559 15.427 2.963 362 HB3 TYR 508 HB3 TYR 508 52.478 14.049 3.570 363 HD1 TYR 508 HD1 TYR 508 51.571 12.765 5.543 364 HD2 TYR 508 HD2 TYR 508 49.219 15.566 3.332 365 HE1 TYR 508 HE1 TYR 508 49.512 11.748 6.454 366 HE2 TYR 508 HE2 TYR 508 47.145 14.543 4.205 367 HH TYR 508 HH TYR 508 46.665 11.940 5.226 368 H LYS 509 H LYS 509 53.365 17.841 3.884 369 HA LYS 509 HA LYS 509 55.845 16.831 2.925 370 HB2 LYS 509 HB2 LYS 509 54.632 18.849 2.071 371 HB3 LYS 509 HB3 LYS 509 55.077 19.680 3.553 372 HG2 LYS 509 HG2 LYS 509 57.438 19.429 3.050 373 HG3 LYS 509 HG3 LYS 509 57.059 18.484 1.604 374 HD2 LYS 509 HD2 LYS 509 55.810 20.403 0.682 375 HD3 LYS 509 HD3 LYS 509 56.209 21.349 2.115 376 HE2 LYS 509 HE2 LYS 509 58.603 21.152 1.590 377 HE3 LYS 509 HE3 LYS 509 58.216 20.184 0.167 378 HZ1 LYS 509 HZ1 LYS 509 56.893 22.065 -0.659 379 HZ2 LYS 509 HZ2 LYS 509 58.536 22.460 -0.478 380 HZ3 LYS 509 HZ3 LYS 509 57.398 22.993 0.667 381 H ALA 510 H ALA 510 54.964 18.882 5.695 382 HA ALA 510 HA ALA 510 57.526 19.183 6.793 383 HB1 ALA 510 HB1 ALA 510 55.866 20.616 7.624 384 HB2 ALA 510 HB2 ALA 510 56.194 19.529 8.975 385 HB3 ALA 510 HB3 ALA 510 54.762 19.288 7.971 386 H GLU 511 H GLU 511 54.994 16.821 7.630 387 HA GLU 511 HA GLU 511 56.358 15.459 9.667 388 HB2 GLU 511 HB2 GLU 511 53.993 15.168 9.172 389 HB3 GLU 511 HB3 GLU 511 54.381 14.444 7.614 390 HG2 GLU 511 HG2 GLU 511 55.463 12.559 8.712 391 HG3 GLU 511 HG3 GLU 511 55.204 13.293 10.295 392 H TYR 512 H TYR 512 56.376 14.782 6.182 393 HA TYR 512 HA TYR 512 58.149 12.532 6.494 394 HB2 TYR 512 HB2 TYR 512 56.876 14.000 4.220 395 HB3 TYR 512 HB3 TYR 512 58.186 12.864 3.884 396 HD1 TYR 512 HD1 TYR 512 54.869 13.164 5.612 397 HD2 TYR 512 HD2 TYR 512 57.807 10.543 3.913 398 HE1 TYR 512 HE1 TYR 512 53.319 11.248 5.887 399 HE2 TYR 512 HE2 TYR 512 56.272 8.630 4.199 400 HH TYR 512 HH TYR 512 53.997 8.369 6.089 401 H LYS 513 H LYS 513 58.552 15.931 6.089 402 HA LYS 513 HA LYS 513 61.162 15.900 4.937 403 HB2 LYS 513 HB2 LYS 513 59.506 17.857 5.243 404 HB3 LYS 513 HB3 LYS 513 60.171 18.006 6.861 405 HG2 LYS 513 HG2 LYS 513 62.417 18.283 5.919 406 HG3 LYS 513 HG3 LYS 513 61.780 18.063 4.289 407 HD2 LYS 513 HD2 LYS 513 60.902 20.262 6.177 408 HD3 LYS 513 HD3 LYS 513 62.114 20.458 4.912 409 HE2 LYS 513 HE2 LYS 513 60.266 19.556 3.314 410 HE3 LYS 513 HE3 LYS 513 59.153 19.964 4.621 411 HZ1 LYS 513 HZ1 LYS 513 59.189 22.015 3.857 412 HZ2 LYS 513 HZ2 LYS 513 60.460 21.681 2.781 413 HZ3 LYS 513 HZ3 LYS 513 60.797 22.137 4.383 414 H LYS 514 H LYS 514 59.821 15.658 8.148 415 HA LYS 514 HA LYS 514 62.211 15.859 9.655 416 HB2 LYS 514 HB2 LYS 514 59.724 15.866 10.389 417 HB3 LYS 514 HB3 LYS 514 59.858 14.113 10.374 418 HG2 LYS 514 HG2 LYS 514 61.664 14.177 11.990 419 HG3 LYS 514 HG3 LYS 514 61.711 15.939 11.936 420 HD2 LYS 514 HD2 LYS 514 59.161 14.492 12.675 421 HD3 LYS 514 HD3 LYS 514 60.408 14.789 13.888 422 HE2 LYS 514 HE2 LYS 514 60.314 17.242 13.231 423 HE3 LYS 514 HE3 LYS 514 58.894 16.852 12.263 424 HZ1 LYS 514 HZ1 LYS 514 57.732 17.125 14.107 425 HZ2 LYS 514 HZ2 LYS 514 59.125 17.187 15.078 426 HZ3 LYS 514 HZ3 LYS 514 58.423 15.690 14.688 427 H LYS 515 H LYS 515 60.416 13.192 8.189 428 HA LYS 515 HA LYS 515 62.096 11.064 9.016 429 HB2 LYS 515 HB2 LYS 515 60.333 11.340 6.578 430 HB3 LYS 515 HB3 LYS 515 61.093 9.839 7.094 431 HG2 LYS 515 HG2 LYS 515 59.912 10.013 9.273 432 HG3 LYS 515 HG3 LYS 515 59.107 11.477 8.699 433 HD2 LYS 515 HD2 LYS 515 58.098 10.221 6.849 434 HD3 LYS 515 HD3 LYS 515 58.918 8.754 7.385 435 HE2 LYS 515 HE2 LYS 515 56.559 8.885 8.175 436 HE3 LYS 515 HE3 LYS 515 57.725 8.799 9.497 437 HZ1 LYS 515 HZ1 LYS 515 57.363 10.945 10.092 438 HZ2 LYS 515 HZ2 LYS 515 55.829 10.611 9.441 439 HZ3 LYS 515 HZ3 LYS 515 56.985 11.448 8.518 440 H LEU 516 H LEU 516 62.114 13.164 6.180 441 HA LEU 516 HA LEU 516 64.062 11.921 4.614 442 HB2 LEU 516 HB2 LEU 516 62.738 13.740 3.761 443 HB3 LEU 516 HB3 LEU 516 63.305 14.816 5.019 444 HG LEU 516 HG LEU 516 65.575 14.752 4.075 445 HD11 LEU 516 HD11 LEU 516 65.708 13.721 1.704 446 HD12 LEU 516 HD12 LEU 516 64.266 12.823 2.168 447 HD13 LEU 516 HD13 LEU 516 65.761 12.619 3.078 448 HD21 LEU 516 HD21 LEU 516 63.708 16.352 3.273 449 HD22 LEU 516 HD22 LEU 516 63.652 15.335 1.829 450 HD23 LEU 516 HD23 LEU 516 65.136 16.183 2.248 451 H ASP 517 H ASP 517 64.408 14.449 7.075 452 HA ASP 517 HA ASP 517 67.200 14.719 7.004 453 HB2 ASP 517 HB2 ASP 517 65.685 16.294 8.122 454 HB3 ASP 517 HB3 ASP 517 65.269 15.062 9.310 455 H GLN 518 H GLN 518 65.114 12.698 9.051 456 HA GLN 518 HA GLN 518 67.253 11.482 10.480 457 HB2 GLN 518 HB2 GLN 518 64.388 10.663 10.049 458 HB3 GLN 518 HB3 GLN 518 65.500 9.821 11.133 459 HG2 GLN 518 HG2 GLN 518 65.872 11.876 12.403 460 HG3 GLN 518 HG3 GLN 518 64.847 12.774 11.285 461 HE21 GLN 518 HE21 GLN 518 63.903 13.053 13.712 462 HE22 GLN 518 HE22 GLN 518 62.616 12.006 14.069 463 H THR 519 H THR 519 65.684 10.734 7.449 464 HA THR 519 HA THR 519 66.492 8.044 7.187 465 HB THR 519 HB THR 519 65.943 10.149 5.072 466 HG1 THR 519 HG1 THR 519 64.275 8.162 6.223 467 HG21 THR 519 HG21 THR 519 67.113 8.202 4.127 468 HG22 THR 519 HG22 THR 519 65.427 8.223 3.618 469 HG23 THR 519 HG23 THR 519 65.948 7.123 4.894 470 H ARG 520 H ARG 520 67.941 11.024 5.884 471 HA ARG 520 HA ARG 520 70.172 9.800 4.660 472 HB2 ARG 520 HB2 ARG 520 71.148 12.106 4.752 473 HB3 ARG 520 HB3 ARG 520 69.512 12.056 4.079 474 HG2 ARG 520 HG2 ARG 520 68.573 12.659 6.233 475 HG3 ARG 520 HG3 ARG 520 70.165 12.657 6.976 476 HD2 ARG 520 HD2 ARG 520 70.791 14.456 5.306 477 HD3 ARG 520 HD3 ARG 520 69.072 14.556 4.916 478 HE ARG 520 HE ARG 520 69.353 14.681 7.713 479 HH11 ARG 520 HH11 ARG 520 71.568 16.438 6.206 480 HH12 ARG 520 HH12 ARG 520 70.855 18.001 6.431 481 HH21 ARG 520 HH21 ARG 520 67.793 16.737 7.464 482 HH22 ARG 520 HH22 ARG 520 68.712 18.171 7.145 483 H VAL 521 H VAL 521 69.523 10.830 7.946 484 HA VAL 521 HA VAL 521 72.155 10.889 8.963 485 HB VAL 521 HB VAL 521 69.454 10.366 10.194 486 HG11 VAL 521 HG11 VAL 521 70.651 10.742 12.413 487 HG12 VAL 521 HG12 VAL 521 72.151 10.389 11.553 488 HG13 VAL 521 HG13 VAL 521 70.883 9.165 11.663 489 HG21 VAL 521 HG21 VAL 521 71.305 12.668 10.777 490 HG22 VAL 521 HG22 VAL 521 69.546 12.593 10.897 491 HG23 VAL 521 HG23 VAL 521 70.319 12.676 9.316 492 H GLU 522 H GLU 522 69.754 8.258 8.857 493 HA GLU 522 HA GLU 522 71.347 6.290 10.121 494 HB2 GLU 522 HB2 GLU 522 69.152 5.992 8.060 495 HB3 GLU 522 HB3 GLU 522 69.782 4.692 9.072 496 HG2 GLU 522 HG2 GLU 522 69.119 5.954 11.094 497 HG3 GLU 522 HG3 GLU 522 68.484 7.236 10.067 498 H LEU 523 H LEU 523 70.912 7.211 6.759 499 HA LEU 523 HA LEU 523 72.420 5.174 5.530 500 HB2 LEU 523 HB2 LEU 523 70.820 6.806 4.448 501 HB3 LEU 523 HB3 LEU 523 72.082 8.026 4.596 502 HG LEU 523 HG LEU 523 73.564 6.151 3.393 503 HD11 LEU 523 HD11 LEU 523 72.219 4.909 1.733 504 HD12 LEU 523 HD12 LEU 523 70.743 5.537 2.470 505 HD13 LEU 523 HD13 LEU 523 71.794 4.455 3.381 506 HD21 LEU 523 HD21 LEU 523 72.934 7.173 1.206 507 HD22 LEU 523 HD22 LEU 523 73.194 8.370 2.473 508 HD23 LEU 523 HD23 LEU 523 71.551 7.936 1.995 509 H ALA 524 H ALA 524 73.330 8.407 6.711 510 HA ALA 524 HA ALA 524 75.948 8.475 5.700 511 HB1 ALA 524 HB1 ALA 524 74.603 9.794 8.044 512 HB2 ALA 524 HB2 ALA 524 75.112 10.510 6.515 513 HB3 ALA 524 HB3 ALA 524 76.318 10.051 7.717 514 H ASP 525 H ASP 525 74.686 7.300 8.797 515 HA ASP 525 HA ASP 525 77.216 6.582 9.892 516 HB2 ASP 525 HB2 ASP 525 74.339 5.930 10.451 517 HB3 ASP 525 HB3 ASP 525 75.593 4.993 11.262 518 H GLN 526 H GLN 526 74.794 4.878 7.976 519 HA GLN 526 HA GLN 526 75.975 2.291 8.064 520 HB2 GLN 526 HB2 GLN 526 73.622 2.766 7.439 521 HB3 GLN 526 HB3 GLN 526 74.191 3.545 5.966 522 HG2 GLN 526 HG2 GLN 526 75.261 1.402 5.282 523 HG3 GLN 526 HG3 GLN 526 74.586 0.634 6.722 524 HE21 GLN 526 HE21 GLN 526 72.548 -0.286 6.438 525 HE22 GLN 526 HE22 GLN 526 71.460 0.129 5.203 526 H VAL 527 H VAL 527 76.240 5.032 5.878 527 HA VAL 527 HA VAL 527 77.887 3.780 3.917 528 HB VAL 527 HB VAL 527 77.206 6.645 4.588 529 HG11 VAL 527 HG11 VAL 527 79.056 5.557 2.450 530 HG12 VAL 527 HG12 VAL 527 79.383 6.832 3.626 531 HG13 VAL 527 HG13 VAL 527 78.256 7.124 2.303 532 HG21 VAL 527 HG21 VAL 527 75.781 6.519 2.717 533 HG22 VAL 527 HG22 VAL 527 75.560 4.966 3.521 534 HG23 VAL 527 HG23 VAL 527 76.579 5.077 2.086 535 H LYS 528 H LYS 528 78.508 5.832 6.709 536 HA LYS 528 HA LYS 528 81.299 6.148 6.337 537 HB2 LYS 528 HB2 LYS 528 79.920 7.599 7.756 538 HB3 LYS 528 HB3 LYS 528 79.608 6.239 8.834 539 HG2 LYS 528 HG2 LYS 528 81.961 6.080 9.410 540 HG3 LYS 528 HG3 LYS 528 82.370 7.327 8.228 541 HD2 LYS 528 HD2 LYS 528 82.270 8.389 10.399 542 HD3 LYS 528 HD3 LYS 528 80.858 8.905 9.479 543 HE2 LYS 528 HE2 LYS 528 79.394 7.544 10.711 544 HE3 LYS 528 HE3 LYS 528 80.695 6.509 11.301 545 HZ1 LYS 528 HZ1 LYS 528 80.317 9.363 12.030 546 HZ2 LYS 528 HZ2 LYS 528 81.512 8.320 12.640 547 HZ3 LYS 528 HZ3 LYS 528 79.876 8.042 13.000 548 H SER 529 H SER 529 79.382 3.893 8.306 549 HA SER 529 HA SER 529 81.714 2.570 9.338 550 HB2 SER 529 HB2 SER 529 79.543 2.705 10.560 551 HB3 SER 529 HB3 SER 529 78.833 1.652 9.340 552 HG SER 529 HG SER 529 80.017 0.877 11.481 553 H ALA 530 H ALA 530 80.015 2.440 6.418 554 HA ALA 530 HA ALA 530 80.369 -0.358 5.828 555 HB1 ALA 530 HB1 ALA 530 79.847 0.567 3.442 556 HB2 ALA 530 HB2 ALA 530 79.492 2.071 4.293 557 HB3 ALA 530 HB3 ALA 530 78.582 0.608 4.673 558 H VAL 531 H VAL 531 82.535 2.031 6.203 559 HA VAL 531 HA VAL 531 84.209 1.834 3.935 560 HB VAL 531 HB VAL 531 84.709 2.667 6.794 561 HG11 VAL 531 HG11 VAL 531 86.877 2.136 5.917 562 HG12 VAL 531 HG12 VAL 531 86.694 3.879 5.772 563 HG13 VAL 531 HG13 VAL 531 86.487 2.855 4.352 564 HG21 VAL 531 HG21 VAL 531 83.060 3.928 5.274 565 HG22 VAL 531 HG22 VAL 531 84.473 4.387 4.322 566 HG23 VAL 531 HG23 VAL 531 84.349 4.878 6.010 567 H THR 532 H THR 532 83.381 -0.535 6.073 568 HA THR 532 HA THR 532 85.985 -1.938 5.788 569 HB THR 532 HB THR 532 85.802 -1.825 8.087 570 HG1 THR 532 HG1 THR 532 85.252 -4.072 7.069 571 HG21 THR 532 HG21 THR 532 83.850 -0.536 8.365 572 HG22 THR 532 HG22 THR 532 83.483 -2.044 9.203 573 HG23 THR 532 HG23 THR 532 82.828 -1.750 7.592 574 H GLU 533 H GLU 533 82.469 -2.212 5.555 575 HA GLU 533 HA GLU 533 82.765 -4.922 4.381 576 HB2 GLU 533 HB2 GLU 533 80.264 -5.011 4.733 577 HB3 GLU 533 HB3 GLU 533 81.234 -4.955 6.207 578 HG2 GLU 533 HG2 GLU 533 80.839 -2.591 6.458 579 HG3 GLU 533 HG3 GLU 533 80.043 -2.508 4.886 580 H PHE 534 H PHE 534 82.487 -1.783 3.472 581 HA PHE 534 HA PHE 534 81.808 -0.700 1.578 582 HB2 PHE 534 HB2 PHE 534 82.508 -3.439 0.551 583 HB3 PHE 534 HB3 PHE 534 82.170 -2.068 -0.506 584 HD1 PHE 534 HD1 PHE 534 84.461 -3.427 2.052 585 HD2 PHE 534 HD2 PHE 534 83.723 -0.222 -0.710 586 HE1 PHE 534 HE1 PHE 534 86.792 -2.635 2.350 587 HE2 PHE 534 HE2 PHE 534 86.052 0.571 -0.412 588 HZ PHE 534 HZ PHE 534 87.589 -0.637 1.115 589 H GLU 535 H GLU 535 79.632 -0.212 1.846 590 HA GLU 535 HA GLU 535 77.410 -1.753 1.903 591 HB2 GLU 535 HB2 GLU 535 77.617 0.771 2.026 592 HB3 GLU 535 HB3 GLU 535 77.650 0.778 0.264 593 HG2 GLU 535 HG2 GLU 535 75.460 -0.297 0.191 594 HG3 GLU 535 HG3 GLU 535 75.435 -0.400 1.949 595 H ASN 536 H ASN 536 75.796 -2.296 0.213 596 HA ASN 536 HA ASN 536 75.165 -3.292 -1.752 597 HB2 ASN 536 HB2 ASN 536 76.031 -0.969 -2.526 598 HB3 ASN 536 HB3 ASN 536 77.426 -1.857 -3.126 599 HD21 ASN 536 HD21 ASN 536 75.268 -4.189 -3.546 600 HD22 ASN 536 HD22 ASN 536 74.610 -3.777 -5.056 601 H VAL 537 H VAL 537 76.775 -4.882 -0.176 602 HA VAL 537 HA VAL 537 78.965 -5.964 -1.702 603 HB VAL 537 HB VAL 537 77.534 -7.028 0.746 604 HG11 VAL 537 HG11 VAL 537 79.648 -8.351 1.022 605 HG12 VAL 537 HG12 VAL 537 80.134 -7.840 -0.594 606 HG13 VAL 537 HG13 VAL 537 78.700 -8.845 -0.378 607 HG21 VAL 537 HG21 VAL 537 79.672 -6.169 1.838 608 HG22 VAL 537 HG22 VAL 537 78.566 -4.929 1.249 609 HG23 VAL 537 HG23 VAL 537 80.007 -5.340 0.315 610 H THR 538 H THR 538 78.923 -7.522 -3.191 611 HA THR 538 HA THR 538 76.364 -8.631 -3.981 612 HB THR 538 HB THR 538 77.511 -7.924 -5.869 613 HG1 THR 538 HG1 THR 538 78.293 -10.606 -5.403 614 HG21 THR 538 HG21 THR 538 80.024 -8.464 -6.108 615 HG22 THR 538 HG22 THR 538 79.978 -8.843 -4.387 616 HG23 THR 538 HG23 THR 538 79.573 -7.218 -4.944 617 HA PRO 539 HA PRO 539 77.263 -12.699 -2.418 618 HB2 PRO 539 HB2 PRO 539 75.924 -14.123 -4.580 619 HB3 PRO 539 HB3 PRO 539 75.296 -13.750 -2.965 620 HG2 PRO 539 HG2 PRO 539 74.302 -12.627 -5.242 621 HG3 PRO 539 HG3 PRO 539 74.275 -11.817 -3.663 622 HD2 PRO 539 HD2 PRO 539 76.252 -11.471 -5.910 623 HD3 PRO 539 HD3 PRO 539 75.404 -10.229 -4.961 624 H THR 540 H THR 540 78.704 -14.403 -2.582 625 HA THR 540 HA THR 540 80.457 -14.415 -4.968 626 HB THR 540 HB THR 540 81.023 -15.529 -2.215 627 HG1 THR 540 HG1 THR 540 81.908 -13.060 -3.264 628 HG21 THR 540 HG21 THR 540 83.363 -15.355 -2.980 629 HG22 THR 540 HG22 THR 540 82.806 -14.765 -4.544 630 HG23 THR 540 HG23 THR 540 82.420 -16.410 -4.037 631 H ASN 541 H ASN 541 79.058 -15.834 -6.188 632 HA ASN 541 HA ASN 541 79.567 -18.608 -5.662 633 HB2 ASN 541 HB2 ASN 541 77.121 -19.216 -5.534 634 HB3 ASN 541 HB3 ASN 541 77.757 -18.395 -4.108 635 HD21 ASN 541 HD21 ASN 541 77.618 -16.184 -6.622 636 HD22 ASN 541 HD22 ASN 541 76.116 -15.471 -6.267 637 H ASP 542 H ASP 542 80.384 -18.719 -7.665 638 HA ASP 542 HA ASP 542 79.078 -17.786 -10.031 639 HB2 ASP 542 HB2 ASP 542 80.914 -18.994 -11.156 640 HB3 ASP 542 HB3 ASP 542 81.513 -17.984 -9.839 641 H GLN 543 H GLN 543 78.095 -19.030 -11.682 642 HA GLN 543 HA GLN 543 76.643 -20.664 -12.444 643 HB2 GLN 543 HB2 GLN 543 78.859 -21.699 -12.786 644 HB3 GLN 543 HB3 GLN 543 78.780 -22.390 -11.167 645 HG2 GLN 543 HG2 GLN 543 76.752 -23.658 -11.817 646 HG3 GLN 543 HG3 GLN 543 76.874 -22.991 -13.446 647 HE21 GLN 543 HE21 GLN 543 77.939 -24.378 -14.871 648 HE22 GLN 543 HE22 GLN 543 79.154 -25.478 -14.431 Start of MODEL 5 1 H1 SER 466 H1 SER 466 27.196 7.698 4.178 2 H2 SER 466 H2 SER 466 26.949 6.051 3.840 3 H3 SER 466 H3 SER 466 26.469 7.234 2.718 4 HA SER 466 HA SER 466 28.519 7.511 1.880 5 HB2 SER 466 HB2 SER 466 30.566 7.394 3.280 6 HB3 SER 466 HB3 SER 466 29.376 8.492 3.964 7 HG SER 466 HG SER 466 30.111 5.896 4.779 8 H ASP 467 H ASP 467 30.812 5.764 2.670 9 HA ASP 467 HA ASP 467 29.805 3.048 2.457 10 HB2 ASP 467 HB2 ASP 467 29.740 4.037 0.117 11 HB3 ASP 467 HB3 ASP 467 31.497 4.138 0.204 12 H ASP 468 H ASP 468 31.874 1.568 1.945 13 HA ASP 468 HA ASP 468 33.760 2.145 4.057 14 HB2 ASP 468 HB2 ASP 468 33.554 -0.107 2.043 15 HB3 ASP 468 HB3 ASP 468 34.774 -0.039 3.312 16 H TYR 469 H TYR 469 33.440 3.208 1.025 17 HA TYR 469 HA TYR 469 35.919 3.010 -0.244 18 HB2 TYR 469 HB2 TYR 469 33.675 3.871 -1.080 19 HB3 TYR 469 HB3 TYR 469 34.087 5.398 -0.306 20 HD1 TYR 469 HD1 TYR 469 34.988 3.018 -2.982 21 HD2 TYR 469 HD2 TYR 469 35.835 6.827 -1.186 22 HE1 TYR 469 HE1 TYR 469 36.332 3.653 -4.965 23 HE2 TYR 469 HE2 TYR 469 37.181 7.461 -3.170 24 HH TYR 469 HH TYR 469 37.577 6.913 -5.371 25 H VAL 470 H VAL 470 37.591 4.652 -0.508 26 HA VAL 470 HA VAL 470 38.098 6.171 1.992 27 HB VAL 470 HB VAL 470 40.235 5.429 0.004 28 HG11 VAL 470 HG11 VAL 470 40.194 5.857 3.002 29 HG12 VAL 470 HG12 VAL 470 40.775 7.011 1.801 30 HG13 VAL 470 HG13 VAL 470 41.624 5.482 2.039 31 HG21 VAL 470 HG21 VAL 470 39.013 3.681 2.153 32 HG22 VAL 470 HG22 VAL 470 40.616 3.398 1.472 33 HG23 VAL 470 HG23 VAL 470 39.190 3.311 0.438 34 H ASP 471 H ASP 471 38.441 8.328 1.915 35 HA ASP 471 HA ASP 471 37.590 9.905 -0.177 36 HB2 ASP 471 HB2 ASP 471 39.614 10.498 1.990 37 HB3 ASP 471 HB3 ASP 471 39.022 11.722 0.870 38 H GLU 472 H GLU 472 38.593 11.020 -1.845 39 HA GLU 472 HA GLU 472 40.547 9.658 -3.335 40 HB2 GLU 472 HB2 GLU 472 39.396 12.442 -3.480 41 HB3 GLU 472 HB3 GLU 472 40.624 11.896 -4.622 42 HG2 GLU 472 HG2 GLU 472 38.463 11.503 -5.605 43 HG3 GLU 472 HG3 GLU 472 39.152 9.940 -5.174 44 H GLU 473 H GLU 473 40.851 12.498 -1.202 45 HA GLU 473 HA GLU 473 43.536 13.104 -1.884 46 HB2 GLU 473 HB2 GLU 473 43.522 14.513 0.054 47 HB3 GLU 473 HB3 GLU 473 41.921 14.606 -0.671 48 HG2 GLU 473 HG2 GLU 473 41.244 12.748 0.954 49 HG3 GLU 473 HG3 GLU 473 42.767 13.073 1.788 50 H THR 474 H THR 474 42.091 11.172 0.644 51 HA THR 474 HA THR 474 44.454 10.416 2.008 52 HB THR 474 HB THR 474 41.702 9.197 1.757 53 HG1 THR 474 HG1 THR 474 41.382 10.157 3.669 54 HG21 THR 474 HG21 THR 474 43.068 7.308 2.206 55 HG22 THR 474 HG22 THR 474 42.413 7.803 3.766 56 HG23 THR 474 HG23 THR 474 44.077 8.213 3.340 57 H TYR 475 H TYR 475 42.546 8.946 -0.558 58 HA TYR 475 HA TYR 475 43.910 6.520 -0.755 59 HB2 TYR 475 HB2 TYR 475 41.683 7.143 -1.755 60 HB3 TYR 475 HB3 TYR 475 42.570 7.998 -3.020 61 HD1 TYR 475 HD1 TYR 475 42.462 4.714 -1.270 62 HD2 TYR 475 HD2 TYR 475 43.240 6.810 -4.929 63 HE1 TYR 475 HE1 TYR 475 42.817 2.542 -2.431 64 HE2 TYR 475 HE2 TYR 475 43.607 4.646 -6.100 65 HH TYR 475 HH TYR 475 43.541 1.566 -4.322 66 H ASN 476 H ASN 476 44.420 9.575 -2.517 67 HA ASN 476 HA ASN 476 46.543 8.571 -4.143 68 HB2 ASN 476 HB2 ASN 476 46.092 11.437 -3.293 69 HB3 ASN 476 HB3 ASN 476 46.961 10.850 -4.716 70 HD21 ASN 476 HD21 ASN 476 44.936 8.715 -5.260 71 HD22 ASN 476 HD22 ASN 476 43.574 9.518 -5.881 72 H LEU 477 H LEU 477 46.300 9.997 -0.958 73 HA LEU 477 HA LEU 477 49.032 10.524 -0.525 74 HB2 LEU 477 HB2 LEU 477 46.860 11.067 0.896 75 HB3 LEU 477 HB3 LEU 477 47.242 9.545 1.688 76 HG LEU 477 HG LEU 477 48.297 11.323 2.931 77 HD11 LEU 477 HD11 LEU 477 50.552 10.158 1.317 78 HD12 LEU 477 HD12 LEU 477 49.589 9.158 2.407 79 HD13 LEU 477 HD13 LEU 477 50.498 10.528 3.039 80 HD21 LEU 477 HD21 LEU 477 48.377 12.786 0.679 81 HD22 LEU 477 HD22 LEU 477 50.032 12.179 0.633 82 HD23 LEU 477 HD23 LEU 477 49.473 13.089 2.013 83 H GLN 478 H GLN 478 47.012 7.660 0.062 84 HA GLN 478 HA GLN 478 48.960 6.024 1.236 85 HB2 GLN 478 HB2 GLN 478 46.571 5.350 -0.498 86 HB3 GLN 478 HB3 GLN 478 47.553 4.134 0.317 87 HG2 GLN 478 HG2 GLN 478 46.230 6.438 1.762 88 HG3 GLN 478 HG3 GLN 478 45.485 4.851 1.585 89 HE21 GLN 478 HE21 GLN 478 47.000 6.547 3.876 90 HE22 GLN 478 HE22 GLN 478 47.900 5.328 4.641 91 H LYS 479 H LYS 479 48.146 6.652 -2.126 92 HA LYS 479 HA LYS 479 49.902 4.753 -3.300 93 HB2 LYS 479 HB2 LYS 479 48.457 7.226 -4.268 94 HB3 LYS 479 HB3 LYS 479 49.603 6.383 -5.318 95 HG2 LYS 479 HG2 LYS 479 48.349 4.350 -5.235 96 HG3 LYS 479 HG3 LYS 479 47.351 4.933 -3.904 97 HD2 LYS 479 HD2 LYS 479 46.188 5.008 -6.126 98 HD3 LYS 479 HD3 LYS 479 46.306 6.584 -5.351 99 HE2 LYS 479 HE2 LYS 479 47.997 7.317 -6.806 100 HE3 LYS 479 HE3 LYS 479 48.428 5.675 -7.288 101 HZ1 LYS 479 HZ1 LYS 479 45.693 6.457 -7.847 102 HZ2 LYS 479 HZ2 LYS 479 46.802 5.602 -8.809 103 HZ3 LYS 479 HZ3 LYS 479 46.874 7.296 -8.730 104 H LEU 480 H LEU 480 50.248 8.132 -2.362 105 HA LEU 480 HA LEU 480 52.706 8.647 -3.611 106 HB2 LEU 480 HB2 LEU 480 51.188 9.837 -1.319 107 HB3 LEU 480 HB3 LEU 480 52.836 10.384 -1.612 108 HG LEU 480 HG LEU 480 51.007 10.249 -3.991 109 HD11 LEU 480 HD11 LEU 480 49.431 11.367 -2.675 110 HD12 LEU 480 HD12 LEU 480 50.358 12.719 -3.319 111 HD13 LEU 480 HD13 LEU 480 50.655 12.149 -1.677 112 HD21 LEU 480 HD21 LEU 480 52.930 12.412 -3.111 113 HD22 LEU 480 HD22 LEU 480 52.339 12.085 -4.740 114 HD23 LEU 480 HD23 LEU 480 53.463 10.966 -3.967 115 H LEU 481 H LEU 481 51.997 7.412 -0.356 116 HA LEU 481 HA LEU 481 54.718 7.388 0.493 117 HB2 LEU 481 HB2 LEU 481 52.412 5.781 1.599 118 HB3 LEU 481 HB3 LEU 481 53.894 6.252 2.433 119 HG LEU 481 HG LEU 481 51.849 8.192 1.345 120 HD11 LEU 481 HD11 LEU 481 51.557 8.631 3.878 121 HD12 LEU 481 HD12 LEU 481 52.293 7.042 4.086 122 HD13 LEU 481 HD13 LEU 481 50.785 7.206 3.185 123 HD21 LEU 481 HD21 LEU 481 53.224 9.724 2.937 124 HD22 LEU 481 HD22 LEU 481 53.867 9.352 1.345 125 HD23 LEU 481 HD23 LEU 481 54.477 8.495 2.759 126 H ALA 482 H ALA 482 52.576 4.930 -0.876 127 HA ALA 482 HA ALA 482 53.669 2.572 -0.476 128 HB1 ALA 482 HB1 ALA 482 52.179 2.189 -2.123 129 HB2 ALA 482 HB2 ALA 482 53.482 2.492 -3.266 130 HB3 ALA 482 HB3 ALA 482 52.410 3.805 -2.789 131 HA PRO 483 HA PRO 483 57.300 2.915 -3.810 132 HB2 PRO 483 HB2 PRO 483 58.109 5.689 -3.742 133 HB3 PRO 483 HB3 PRO 483 57.497 4.782 -5.120 134 HG2 PRO 483 HG2 PRO 483 56.090 6.625 -3.302 135 HG3 PRO 483 HG3 PRO 483 55.708 6.177 -4.971 136 HD2 PRO 483 HD2 PRO 483 54.221 5.306 -2.891 137 HD3 PRO 483 HD3 PRO 483 54.499 4.294 -4.325 138 H TYR 484 H TYR 484 57.325 5.400 -1.233 139 HA TYR 484 HA TYR 484 59.993 4.769 -0.391 140 HB2 TYR 484 HB2 TYR 484 59.414 6.976 0.053 141 HB3 TYR 484 HB3 TYR 484 57.776 6.553 0.577 142 HD1 TYR 484 HD1 TYR 484 61.389 6.289 1.579 143 HD2 TYR 484 HD2 TYR 484 57.292 6.218 2.889 144 HE1 TYR 484 HE1 TYR 484 62.127 6.228 3.947 145 HE2 TYR 484 HE2 TYR 484 58.045 6.152 5.244 146 HH TYR 484 HH TYR 484 61.360 6.661 6.136 147 H HIS 485 H HIS 485 56.763 3.782 0.497 148 HA HIS 485 HA HIS 485 57.315 2.539 2.974 149 HB2 HIS 485 HB2 HIS 485 55.052 3.125 1.965 150 HB3 HIS 485 HB3 HIS 485 55.215 1.662 0.998 151 HD1 HIS 485 HD1 HIS 485 54.703 -0.545 2.124 152 HD2 HIS 485 HD2 HIS 485 55.004 2.592 4.855 153 HE1 HIS 485 HE1 HIS 485 53.932 -1.460 4.356 154 H LYS 486 H LYS 486 57.451 1.374 -0.363 155 HA LYS 486 HA LYS 486 58.124 -1.348 0.436 156 HB2 LYS 486 HB2 LYS 486 58.215 -1.774 -1.989 157 HB3 LYS 486 HB3 LYS 486 56.731 -0.910 -1.576 158 HG2 LYS 486 HG2 LYS 486 57.754 1.206 -2.235 159 HG3 LYS 486 HG3 LYS 486 59.262 0.400 -2.621 160 HD2 LYS 486 HD2 LYS 486 58.165 0.681 -4.700 161 HD3 LYS 486 HD3 LYS 486 57.920 -1.011 -4.278 162 HE2 LYS 486 HE2 LYS 486 55.662 -0.669 -3.702 163 HE3 LYS 486 HE3 LYS 486 55.871 1.070 -3.499 164 HZ1 LYS 486 HZ1 LYS 486 55.059 1.198 -5.551 165 HZ2 LYS 486 HZ2 LYS 486 55.326 -0.447 -5.879 166 HZ3 LYS 486 HZ3 LYS 486 56.586 0.676 -6.075 167 H ALA 487 H ALA 487 59.752 1.598 -0.184 168 HA ALA 487 HA ALA 487 62.179 0.677 -1.259 169 HB1 ALA 487 HB1 ALA 487 63.087 2.815 -0.585 170 HB2 ALA 487 HB2 ALA 487 61.755 3.074 0.540 171 HB3 ALA 487 HB3 ALA 487 61.451 3.058 -1.198 172 H LYS 488 H LYS 488 63.249 -0.934 -0.342 173 HA LYS 488 HA LYS 488 63.553 -1.134 2.569 174 HB2 LYS 488 HB2 LYS 488 64.637 -3.284 2.070 175 HB3 LYS 488 HB3 LYS 488 63.051 -3.178 1.303 176 HG2 LYS 488 HG2 LYS 488 64.198 -2.431 -0.802 177 HG3 LYS 488 HG3 LYS 488 65.745 -2.733 -0.012 178 HD2 LYS 488 HD2 LYS 488 65.119 -5.094 0.329 179 HD3 LYS 488 HD3 LYS 488 63.571 -4.798 -0.462 180 HE2 LYS 488 HE2 LYS 488 64.751 -4.146 -2.533 181 HE3 LYS 488 HE3 LYS 488 66.299 -4.447 -1.743 182 HZ1 LYS 488 HZ1 LYS 488 64.394 -6.628 -1.607 183 HZ2 LYS 488 HZ2 LYS 488 66.064 -6.656 -1.925 184 HZ3 LYS 488 HZ3 LYS 488 64.965 -6.272 -3.163 185 H THR 489 H THR 489 65.159 0.334 0.016 186 HA THR 489 HA THR 489 67.821 0.018 1.271 187 HB THR 489 HB THR 489 68.421 1.331 -0.956 188 HG1 THR 489 HG1 THR 489 66.911 1.292 -2.444 189 HG21 THR 489 HG21 THR 489 68.276 -0.972 -2.169 190 HG22 THR 489 HG22 THR 489 67.697 -1.575 -0.612 191 HG23 THR 489 HG23 THR 489 69.295 -0.830 -0.737 192 H LEU 490 H LEU 490 68.723 1.643 2.392 193 HA LEU 490 HA LEU 490 67.292 3.920 3.177 194 HB2 LEU 490 HB2 LEU 490 70.194 3.116 3.292 195 HB3 LEU 490 HB3 LEU 490 69.675 4.693 3.878 196 HG LEU 490 HG LEU 490 68.057 3.598 5.386 197 HD11 LEU 490 HD11 LEU 490 69.199 1.110 4.120 198 HD12 LEU 490 HD12 LEU 490 67.506 1.580 4.275 199 HD13 LEU 490 HD13 LEU 490 68.410 1.070 5.697 200 HD21 LEU 490 HD21 LEU 490 69.728 2.584 6.930 201 HD22 LEU 490 HD22 LEU 490 70.305 4.098 6.237 202 HD23 LEU 490 HD23 LEU 490 70.898 2.559 5.611 203 H GLU 491 H GLU 491 69.830 3.529 0.725 204 HA GLU 491 HA GLU 491 70.178 6.195 -0.041 205 HB2 GLU 491 HB2 GLU 491 71.673 4.477 -0.800 206 HB3 GLU 491 HB3 GLU 491 70.361 3.615 -1.598 207 HG2 GLU 491 HG2 GLU 491 70.094 5.369 -3.220 208 HG3 GLU 491 HG3 GLU 491 71.216 6.420 -2.353 209 H ARG 492 H ARG 492 67.836 3.814 -1.089 210 HA ARG 492 HA ARG 492 66.608 5.481 -3.072 211 HB2 ARG 492 HB2 ARG 492 66.510 3.080 -3.287 212 HB3 ARG 492 HB3 ARG 492 65.724 2.942 -1.716 213 HG2 ARG 492 HG2 ARG 492 63.726 4.012 -2.507 214 HG3 ARG 492 HG3 ARG 492 64.513 4.478 -4.024 215 HD2 ARG 492 HD2 ARG 492 63.076 2.485 -4.324 216 HD3 ARG 492 HD3 ARG 492 64.769 2.112 -4.638 217 HE ARG 492 HE ARG 492 64.055 1.597 -1.909 218 HH11 ARG 492 HH11 ARG 492 62.084 0.274 -4.015 219 HH12 ARG 492 HH12 ARG 492 62.743 -1.327 -4.049 220 HH21 ARG 492 HH21 ARG 492 65.684 -0.446 -2.445 221 HH22 ARG 492 HH22 ARG 492 64.776 -1.733 -3.164 222 H GLN 493 H GLN 493 65.990 4.729 0.317 223 HA GLN 493 HA GLN 493 63.418 5.815 0.530 224 HB2 GLN 493 HB2 GLN 493 65.702 5.519 2.474 225 HB3 GLN 493 HB3 GLN 493 64.180 6.254 2.960 226 HG2 GLN 493 HG2 GLN 493 62.949 4.251 2.390 227 HG3 GLN 493 HG3 GLN 493 64.376 3.522 1.667 228 HE21 GLN 493 HE21 GLN 493 63.531 1.847 3.459 229 HE22 GLN 493 HE22 GLN 493 64.292 1.991 4.970 230 H VAL 494 H VAL 494 66.608 7.339 0.915 231 HA VAL 494 HA VAL 494 65.682 9.924 1.553 232 HB VAL 494 HB VAL 494 68.196 9.034 0.119 233 HG11 VAL 494 HG11 VAL 494 67.347 11.683 1.301 234 HG12 VAL 494 HG12 VAL 494 67.964 11.360 -0.320 235 HG13 VAL 494 HG13 VAL 494 69.044 11.261 1.071 236 HG21 VAL 494 HG21 VAL 494 69.162 9.430 2.429 237 HG22 VAL 494 HG22 VAL 494 68.082 8.044 2.300 238 HG23 VAL 494 HG23 VAL 494 67.504 9.547 3.020 239 H TYR 495 H TYR 495 66.575 8.425 -1.540 240 HA TYR 495 HA TYR 495 66.069 10.632 -3.218 241 HB2 TYR 495 HB2 TYR 495 67.317 8.774 -4.033 242 HB3 TYR 495 HB3 TYR 495 66.015 7.653 -3.663 243 HD1 TYR 495 HD1 TYR 495 66.953 10.523 -5.874 244 HD2 TYR 495 HD2 TYR 495 64.277 7.225 -5.209 245 HE1 TYR 495 HE1 TYR 495 66.031 10.802 -8.164 246 HE2 TYR 495 HE2 TYR 495 63.354 7.511 -7.492 247 HH TYR 495 HH TYR 495 63.920 8.455 -9.593 248 H GLU 496 H GLU 496 63.967 7.929 -2.263 249 HA GLU 496 HA GLU 496 61.744 8.682 -3.812 250 HB2 GLU 496 HB2 GLU 496 62.336 6.502 -2.423 251 HB3 GLU 496 HB3 GLU 496 61.398 7.305 -1.168 252 HG2 GLU 496 HG2 GLU 496 59.889 5.945 -2.408 253 HG3 GLU 496 HG3 GLU 496 59.565 7.611 -2.888 254 H LEU 497 H LEU 497 62.649 9.430 -0.481 255 HA LEU 497 HA LEU 497 60.322 10.860 0.216 256 HB2 LEU 497 HB2 LEU 497 63.153 10.876 1.220 257 HB3 LEU 497 HB3 LEU 497 61.911 11.896 1.944 258 HG LEU 497 HG LEU 497 61.621 8.896 1.592 259 HD11 LEU 497 HD11 LEU 497 63.544 9.673 3.135 260 HD12 LEU 497 HD12 LEU 497 62.360 8.559 3.814 261 HD13 LEU 497 HD13 LEU 497 62.271 10.278 4.193 262 HD21 LEU 497 HD21 LEU 497 59.457 9.623 1.966 263 HD22 LEU 497 HD22 LEU 497 59.965 11.079 2.818 264 HD23 LEU 497 HD23 LEU 497 59.990 9.521 3.640 265 H GLU 498 H GLU 498 63.364 11.848 -1.309 266 HA GLU 498 HA GLU 498 62.988 14.630 -1.211 267 HB2 GLU 498 HB2 GLU 498 64.444 12.795 -3.111 268 HB3 GLU 498 HB3 GLU 498 64.416 14.538 -3.374 269 HG2 GLU 498 HG2 GLU 498 65.256 13.317 -0.735 270 HG3 GLU 498 HG3 GLU 498 66.404 13.628 -2.038 271 H LYS 499 H LYS 499 61.946 12.226 -3.623 272 HA LYS 499 HA LYS 499 60.715 14.121 -5.379 273 HB2 LYS 499 HB2 LYS 499 60.785 11.150 -5.057 274 HB3 LYS 499 HB3 LYS 499 59.436 11.811 -5.978 275 HG2 LYS 499 HG2 LYS 499 61.299 11.278 -7.474 276 HG3 LYS 499 HG3 LYS 499 61.032 13.020 -7.433 277 HD2 LYS 499 HD2 LYS 499 62.867 13.278 -5.807 278 HD3 LYS 499 HD3 LYS 499 63.122 11.534 -5.814 279 HE2 LYS 499 HE2 LYS 499 63.687 11.596 -8.192 280 HE3 LYS 499 HE3 LYS 499 63.372 13.331 -8.239 281 HZ1 LYS 499 HZ1 LYS 499 65.698 13.028 -7.984 282 HZ2 LYS 499 HZ2 LYS 499 65.490 11.927 -6.708 283 HZ3 LYS 499 HZ3 LYS 499 65.106 13.567 -6.489 284 H LEU 500 H LEU 500 59.473 11.949 -2.871 285 HA LEU 500 HA LEU 500 56.770 12.700 -3.136 286 HB2 LEU 500 HB2 LEU 500 58.260 11.492 -0.806 287 HB3 LEU 500 HB3 LEU 500 56.504 11.604 -0.928 288 HG LEU 500 HG LEU 500 58.206 10.258 -3.045 289 HD11 LEU 500 HD11 LEU 500 58.583 9.027 -1.010 290 HD12 LEU 500 HD12 LEU 500 57.417 8.114 -1.965 291 HD13 LEU 500 HD13 LEU 500 56.870 9.081 -0.595 292 HD21 LEU 500 HD21 LEU 500 55.242 10.385 -2.441 293 HD22 LEU 500 HD22 LEU 500 55.930 9.077 -3.402 294 HD23 LEU 500 HD23 LEU 500 56.070 10.732 -3.956 295 H GLN 501 H GLN 501 59.404 14.008 -1.234 296 HA GLN 501 HA GLN 501 58.005 15.629 0.544 297 HB2 GLN 501 HB2 GLN 501 60.712 15.679 -0.723 298 HB3 GLN 501 HB3 GLN 501 60.188 17.149 0.092 299 HG2 GLN 501 HG2 GLN 501 60.103 14.416 1.393 300 HG3 GLN 501 HG3 GLN 501 61.461 15.528 1.557 301 HE21 GLN 501 HE21 GLN 501 58.872 14.551 3.266 302 HE22 GLN 501 HE22 GLN 501 58.455 15.997 4.049 303 H GLU 502 H GLU 502 59.010 16.357 -2.802 304 HA GLU 502 HA GLU 502 57.860 19.023 -2.699 305 HB2 GLU 502 HB2 GLU 502 58.441 19.003 -5.170 306 HB3 GLU 502 HB3 GLU 502 59.802 18.757 -4.069 307 HG2 GLU 502 HG2 GLU 502 59.717 16.365 -4.392 308 HG3 GLU 502 HG3 GLU 502 58.237 16.506 -5.321 309 H LYS 503 H LYS 503 56.707 15.863 -3.422 310 HA LYS 503 HA LYS 503 54.435 16.918 -5.008 311 HB2 LYS 503 HB2 LYS 503 55.611 14.182 -4.579 312 HB3 LYS 503 HB3 LYS 503 53.982 14.360 -5.221 313 HG2 LYS 503 HG2 LYS 503 54.850 15.756 -7.062 314 HG3 LYS 503 HG3 LYS 503 56.481 15.581 -6.436 315 HD2 LYS 503 HD2 LYS 503 54.779 13.195 -7.188 316 HD3 LYS 503 HD3 LYS 503 55.840 13.997 -8.343 317 HE2 LYS 503 HE2 LYS 503 57.733 13.629 -6.656 318 HE3 LYS 503 HE3 LYS 503 56.628 12.560 -5.795 319 HZ1 LYS 503 HZ1 LYS 503 57.329 10.989 -7.167 320 HZ2 LYS 503 HZ2 LYS 503 58.080 12.099 -8.210 321 HZ3 LYS 503 HZ3 LYS 503 56.426 11.753 -8.383 322 H LEU 504 H LEU 504 55.196 15.593 -1.859 323 HA LEU 504 HA LEU 504 52.639 14.647 -1.182 324 HB2 LEU 504 HB2 LEU 504 55.089 15.401 0.349 325 HB3 LEU 504 HB3 LEU 504 53.602 15.088 1.234 326 HG LEU 504 HG LEU 504 54.658 13.136 -0.822 327 HD11 LEU 504 HD11 LEU 504 55.390 13.446 2.099 328 HD12 LEU 504 HD12 LEU 504 56.473 13.332 0.710 329 HD13 LEU 504 HD13 LEU 504 55.568 11.914 1.242 330 HD21 LEU 504 HD21 LEU 504 52.633 13.066 1.429 331 HD22 LEU 504 HD22 LEU 504 53.395 11.582 0.878 332 HD23 LEU 504 HD23 LEU 504 52.446 12.546 -0.241 333 HA PRO 505 HA PRO 505 50.636 18.456 -0.114 334 HB2 PRO 505 HB2 PRO 505 49.086 17.241 2.045 335 HB3 PRO 505 HB3 PRO 505 48.530 17.763 0.446 336 HG2 PRO 505 HG2 PRO 505 48.685 15.137 1.210 337 HG3 PRO 505 HG3 PRO 505 48.790 15.685 -0.462 338 HD2 PRO 505 HD2 PRO 505 51.005 14.834 1.357 339 HD3 PRO 505 HD3 PRO 505 50.796 14.577 -0.373 340 H GLU 506 H GLU 506 50.784 20.122 1.356 341 HA GLU 506 HA GLU 506 52.999 20.611 2.750 342 HB2 GLU 506 HB2 GLU 506 50.217 21.556 3.420 343 HB3 GLU 506 HB3 GLU 506 51.684 22.252 4.113 344 HG2 GLU 506 HG2 GLU 506 52.514 22.829 1.898 345 HG3 GLU 506 HG3 GLU 506 51.145 22.020 1.140 346 H LYS 507 H LYS 507 50.076 19.620 4.545 347 HA LYS 507 HA LYS 507 51.188 19.461 7.064 348 HB2 LYS 507 HB2 LYS 507 49.333 17.971 7.625 349 HB3 LYS 507 HB3 LYS 507 48.774 19.256 6.552 350 HG2 LYS 507 HG2 LYS 507 49.176 17.669 4.614 351 HG3 LYS 507 HG3 LYS 507 49.435 16.402 5.810 352 HD2 LYS 507 HD2 LYS 507 46.913 18.060 5.519 353 HD3 LYS 507 HD3 LYS 507 47.107 16.385 5.010 354 HE2 LYS 507 HE2 LYS 507 46.145 16.062 7.100 355 HE3 LYS 507 HE3 LYS 507 47.849 16.050 7.551 356 HZ1 LYS 507 HZ1 LYS 507 47.396 18.634 7.689 357 HZ2 LYS 507 HZ2 LYS 507 47.088 17.598 8.999 358 HZ3 LYS 507 HZ3 LYS 507 45.814 18.099 7.993 359 H TYR 508 H TYR 508 51.393 17.090 4.491 360 HA TYR 508 HA TYR 508 52.652 15.120 6.272 361 HB2 TYR 508 HB2 TYR 508 51.924 15.123 3.350 362 HB3 TYR 508 HB3 TYR 508 52.707 13.774 4.145 363 HD1 TYR 508 HD1 TYR 508 51.568 13.044 6.440 364 HD2 TYR 508 HD2 TYR 508 49.602 15.087 3.223 365 HE1 TYR 508 HE1 TYR 508 49.388 12.229 7.275 366 HE2 TYR 508 HE2 TYR 508 47.394 14.274 4.060 367 HH TYR 508 HH TYR 508 46.615 13.457 6.681 368 H LYS 509 H LYS 509 53.355 17.358 3.683 369 HA LYS 509 HA LYS 509 55.900 16.577 2.921 370 HB2 LYS 509 HB2 LYS 509 54.582 18.431 1.926 371 HB3 LYS 509 HB3 LYS 509 54.875 19.385 3.377 372 HG2 LYS 509 HG2 LYS 509 57.266 19.373 2.975 373 HG3 LYS 509 HG3 LYS 509 57.066 18.295 1.593 374 HD2 LYS 509 HD2 LYS 509 55.668 20.015 0.475 375 HD3 LYS 509 HD3 LYS 509 55.921 21.092 1.846 376 HE2 LYS 509 HE2 LYS 509 58.347 21.089 1.416 377 HE3 LYS 509 HE3 LYS 509 58.106 19.991 0.055 378 HZ1 LYS 509 HZ1 LYS 509 56.430 21.829 -0.681 379 HZ2 LYS 509 HZ2 LYS 509 58.091 22.002 -1.001 380 HZ3 LYS 509 HZ3 LYS 509 57.385 22.825 0.307 381 H ALA 510 H ALA 510 54.922 18.731 5.603 382 HA ALA 510 HA ALA 510 57.502 19.205 6.608 383 HB1 ALA 510 HB1 ALA 510 55.709 20.559 7.393 384 HB2 ALA 510 HB2 ALA 510 56.287 19.638 8.780 385 HB3 ALA 510 HB3 ALA 510 54.807 19.149 7.955 386 H GLU 511 H GLU 511 55.078 16.777 7.616 387 HA GLU 511 HA GLU 511 56.611 15.518 9.616 388 HB2 GLU 511 HB2 GLU 511 54.181 15.188 9.207 389 HB3 GLU 511 HB3 GLU 511 54.575 14.250 7.769 390 HG2 GLU 511 HG2 GLU 511 54.190 12.686 9.553 391 HG3 GLU 511 HG3 GLU 511 55.924 12.702 9.261 392 H TYR 512 H TYR 512 56.461 14.815 6.136 393 HA TYR 512 HA TYR 512 58.221 12.541 6.369 394 HB2 TYR 512 HB2 TYR 512 56.886 14.009 4.114 395 HB3 TYR 512 HB3 TYR 512 58.213 12.902 3.749 396 HD1 TYR 512 HD1 TYR 512 58.069 10.525 4.390 397 HD2 TYR 512 HD2 TYR 512 54.758 13.169 4.905 398 HE1 TYR 512 HE1 TYR 512 56.567 8.578 4.684 399 HE2 TYR 512 HE2 TYR 512 53.240 11.240 5.202 400 HH TYR 512 HH TYR 512 53.158 9.014 5.542 401 H LYS 513 H LYS 513 58.648 15.950 5.909 402 HA LYS 513 HA LYS 513 61.240 15.843 4.729 403 HB2 LYS 513 HB2 LYS 513 59.616 17.845 4.985 404 HB3 LYS 513 HB3 LYS 513 60.312 18.039 6.585 405 HG2 LYS 513 HG2 LYS 513 62.551 18.234 5.610 406 HG3 LYS 513 HG3 LYS 513 61.897 17.956 3.999 407 HD2 LYS 513 HD2 LYS 513 60.994 20.244 5.753 408 HD3 LYS 513 HD3 LYS 513 62.334 20.382 4.615 409 HE2 LYS 513 HE2 LYS 513 60.735 19.593 2.802 410 HE3 LYS 513 HE3 LYS 513 59.432 19.782 3.968 411 HZ1 LYS 513 HZ1 LYS 513 60.255 21.716 2.359 412 HZ2 LYS 513 HZ2 LYS 513 61.209 22.048 3.726 413 HZ3 LYS 513 HZ3 LYS 513 59.515 21.993 3.859 414 H LYS 514 H LYS 514 59.955 15.758 7.975 415 HA LYS 514 HA LYS 514 62.379 15.979 9.416 416 HB2 LYS 514 HB2 LYS 514 59.904 16.032 10.214 417 HB3 LYS 514 HB3 LYS 514 60.035 14.278 10.269 418 HG2 LYS 514 HG2 LYS 514 61.908 14.415 11.817 419 HG3 LYS 514 HG3 LYS 514 61.923 16.173 11.700 420 HD2 LYS 514 HD2 LYS 514 59.448 14.683 12.597 421 HD3 LYS 514 HD3 LYS 514 60.719 15.112 13.744 422 HE2 LYS 514 HE2 LYS 514 60.484 17.518 12.886 423 HE3 LYS 514 HE3 LYS 514 59.019 16.981 12.071 424 HZ1 LYS 514 HZ1 LYS 514 58.787 17.961 14.375 425 HZ2 LYS 514 HZ2 LYS 514 59.442 16.504 14.952 426 HZ3 LYS 514 HZ3 LYS 514 57.984 16.498 14.076 427 H LYS 515 H LYS 515 60.528 13.273 8.109 428 HA LYS 515 HA LYS 515 62.194 11.166 9.002 429 HB2 LYS 515 HB2 LYS 515 60.379 11.335 6.579 430 HB3 LYS 515 HB3 LYS 515 61.095 9.850 7.203 431 HG2 LYS 515 HG2 LYS 515 59.934 10.177 9.355 432 HG3 LYS 515 HG3 LYS 515 59.242 11.682 8.758 433 HD2 LYS 515 HD2 LYS 515 57.530 10.043 8.434 434 HD3 LYS 515 HD3 LYS 515 58.234 10.300 6.841 435 HE2 LYS 515 HE2 LYS 515 59.394 8.276 6.875 436 HE3 LYS 515 HE3 LYS 515 59.276 8.114 8.626 437 HZ1 LYS 515 HZ1 LYS 515 56.922 8.058 6.825 438 HZ2 LYS 515 HZ2 LYS 515 56.976 7.651 8.474 439 HZ3 LYS 515 HZ3 LYS 515 57.744 6.663 7.326 440 H LEU 516 H LEU 516 62.165 13.119 6.057 441 HA LEU 516 HA LEU 516 64.052 11.761 4.507 442 HB2 LEU 516 HB2 LEU 516 62.773 13.533 3.548 443 HB3 LEU 516 HB3 LEU 516 63.293 14.670 4.773 444 HG LEU 516 HG LEU 516 65.598 14.586 3.875 445 HD11 LEU 516 HD11 LEU 516 65.814 13.516 1.561 446 HD12 LEU 516 HD12 LEU 516 64.323 12.667 1.944 447 HD13 LEU 516 HD13 LEU 516 65.755 12.408 2.932 448 HD21 LEU 516 HD21 LEU 516 65.194 15.992 2.046 449 HD22 LEU 516 HD22 LEU 516 63.727 16.156 3.012 450 HD23 LEU 516 HD23 LEU 516 63.735 15.122 1.578 451 H ASP 517 H ASP 517 64.486 14.381 6.866 452 HA ASP 517 HA ASP 517 67.283 14.590 6.688 453 HB2 ASP 517 HB2 ASP 517 65.345 15.149 8.938 454 HB3 ASP 517 HB3 ASP 517 67.059 15.554 9.011 455 H GLN 518 H GLN 518 65.196 12.662 8.829 456 HA GLN 518 HA GLN 518 67.339 11.485 10.286 457 HB2 GLN 518 HB2 GLN 518 64.469 10.655 9.883 458 HB3 GLN 518 HB3 GLN 518 65.590 9.814 10.962 459 HG2 GLN 518 HG2 GLN 518 65.975 11.869 12.225 460 HG3 GLN 518 HG3 GLN 518 64.951 12.773 11.113 461 HE21 GLN 518 HE21 GLN 518 63.997 13.104 13.499 462 HE22 GLN 518 HE22 GLN 518 62.717 12.062 13.892 463 H THR 519 H THR 519 65.726 10.621 7.294 464 HA THR 519 HA THR 519 66.585 7.939 7.086 465 HB THR 519 HB THR 519 66.076 9.921 4.854 466 HG1 THR 519 HG1 THR 519 63.961 8.506 5.266 467 HG21 THR 519 HG21 THR 519 65.469 6.973 4.846 468 HG22 THR 519 HG22 THR 519 67.056 7.573 4.368 469 HG23 THR 519 HG23 THR 519 65.621 8.072 3.480 470 H ARG 520 H ARG 520 67.983 10.913 5.694 471 HA ARG 520 HA ARG 520 70.211 9.647 4.477 472 HB2 ARG 520 HB2 ARG 520 71.149 11.964 4.404 473 HB3 ARG 520 HB3 ARG 520 69.495 11.867 3.786 474 HG2 ARG 520 HG2 ARG 520 68.628 12.559 5.965 475 HG3 ARG 520 HG3 ARG 520 70.259 12.661 6.614 476 HD2 ARG 520 HD2 ARG 520 70.717 14.348 4.748 477 HD3 ARG 520 HD3 ARG 520 68.966 14.382 4.515 478 HE ARG 520 HE ARG 520 69.453 14.718 7.254 479 HH11 ARG 520 HH11 ARG 520 71.571 16.347 5.466 480 HH12 ARG 520 HH12 ARG 520 70.894 17.929 5.653 481 HH21 ARG 520 HH21 ARG 520 67.923 16.781 7.014 482 HH22 ARG 520 HH22 ARG 520 68.827 18.175 6.529 483 H VAL 521 H VAL 521 69.595 10.868 7.701 484 HA VAL 521 HA VAL 521 72.241 11.009 8.665 485 HB VAL 521 HB VAL 521 69.559 10.553 9.966 486 HG11 VAL 521 HG11 VAL 521 71.013 9.437 11.479 487 HG12 VAL 521 HG12 VAL 521 70.797 11.056 12.141 488 HG13 VAL 521 HG13 VAL 521 72.278 10.650 11.275 489 HG21 VAL 521 HG21 VAL 521 70.458 12.822 8.949 490 HG22 VAL 521 HG22 VAL 521 71.392 12.888 10.440 491 HG23 VAL 521 HG23 VAL 521 69.631 12.819 10.506 492 H GLU 522 H GLU 522 69.871 8.346 8.760 493 HA GLU 522 HA GLU 522 71.528 6.482 10.106 494 HB2 GLU 522 HB2 GLU 522 69.236 6.049 8.174 495 HB3 GLU 522 HB3 GLU 522 69.924 4.817 9.233 496 HG2 GLU 522 HG2 GLU 522 68.750 7.425 10.224 497 HG3 GLU 522 HG3 GLU 522 67.859 5.908 10.160 498 H LEU 523 H LEU 523 71.000 7.260 6.721 499 HA LEU 523 HA LEU 523 72.396 5.128 5.519 500 HB2 LEU 523 HB2 LEU 523 70.869 6.603 4.333 501 HB3 LEU 523 HB3 LEU 523 71.956 7.960 4.576 502 HG LEU 523 HG LEU 523 73.272 5.592 3.344 503 HD11 LEU 523 HD11 LEU 523 70.965 6.986 1.996 504 HD12 LEU 523 HD12 LEU 523 71.260 5.254 2.144 505 HD13 LEU 523 HD13 LEU 523 72.257 6.231 1.064 506 HD21 LEU 523 HD21 LEU 523 74.164 7.989 3.616 507 HD22 LEU 523 HD22 LEU 523 73.073 8.429 2.304 508 HD23 LEU 523 HD23 LEU 523 74.360 7.253 2.025 509 H ALA 524 H ALA 524 73.494 8.385 6.475 510 HA ALA 524 HA ALA 524 76.125 8.118 5.474 511 HB1 ALA 524 HB1 ALA 524 74.921 9.862 7.622 512 HB2 ALA 524 HB2 ALA 524 75.383 10.309 5.979 513 HB3 ALA 524 HB3 ALA 524 76.626 9.950 7.178 514 H ASP 525 H ASP 525 74.670 7.329 8.596 515 HA ASP 525 HA ASP 525 77.079 6.712 9.964 516 HB2 ASP 525 HB2 ASP 525 74.952 7.148 11.106 517 HB3 ASP 525 HB3 ASP 525 74.259 5.697 10.385 518 H GLN 526 H GLN 526 74.797 4.803 8.070 519 HA GLN 526 HA GLN 526 75.957 2.248 8.523 520 HB2 GLN 526 HB2 GLN 526 73.661 2.554 7.734 521 HB3 GLN 526 HB3 GLN 526 74.255 3.299 6.251 522 HG2 GLN 526 HG2 GLN 526 75.327 1.228 5.574 523 HG3 GLN 526 HG3 GLN 526 74.923 0.470 7.115 524 HE21 GLN 526 HE21 GLN 526 73.934 0.446 3.970 525 HE22 GLN 526 HE22 GLN 526 72.275 0.157 4.184 526 H VAL 527 H VAL 527 76.418 4.747 6.091 527 HA VAL 527 HA VAL 527 78.133 3.256 4.362 528 HB VAL 527 HB VAL 527 77.593 6.209 4.726 529 HG11 VAL 527 HG11 VAL 527 79.796 6.120 3.806 530 HG12 VAL 527 HG12 VAL 527 78.712 6.388 2.443 531 HG13 VAL 527 HG13 VAL 527 79.373 4.780 2.741 532 HG21 VAL 527 HG21 VAL 527 75.849 4.518 3.782 533 HG22 VAL 527 HG22 VAL 527 76.890 4.469 2.360 534 HG23 VAL 527 HG23 VAL 527 76.162 5.994 2.868 535 H LYS 528 H LYS 528 78.654 5.567 6.978 536 HA LYS 528 HA LYS 528 81.483 5.738 6.783 537 HB2 LYS 528 HB2 LYS 528 80.047 7.380 7.919 538 HB3 LYS 528 HB3 LYS 528 79.688 6.187 9.164 539 HG2 LYS 528 HG2 LYS 528 82.129 6.025 9.673 540 HG3 LYS 528 HG3 LYS 528 82.430 7.306 8.494 541 HD2 LYS 528 HD2 LYS 528 80.563 7.603 10.854 542 HD3 LYS 528 HD3 LYS 528 82.255 8.087 10.894 543 HE2 LYS 528 HE2 LYS 528 81.699 9.488 8.785 544 HE3 LYS 528 HE3 LYS 528 80.012 9.240 9.236 545 HZ1 LYS 528 HZ1 LYS 528 80.419 10.246 11.352 546 HZ2 LYS 528 HZ2 LYS 528 80.960 11.297 10.132 547 HZ3 LYS 528 HZ3 LYS 528 82.078 10.386 11.028 548 H SER 529 H SER 529 79.305 3.749 8.760 549 HA SER 529 HA SER 529 81.449 2.534 10.216 550 HB2 SER 529 HB2 SER 529 78.560 1.677 9.901 551 HB3 SER 529 HB3 SER 529 79.691 1.041 11.089 552 HG SER 529 HG SER 529 79.610 2.896 12.179 553 H ALA 530 H ALA 530 80.465 2.186 7.060 554 HA ALA 530 HA ALA 530 80.672 -0.670 6.780 555 HB1 ALA 530 HB1 ALA 530 79.373 0.839 5.239 556 HB2 ALA 530 HB2 ALA 530 80.481 -0.256 4.418 557 HB3 ALA 530 HB3 ALA 530 80.917 1.440 4.630 558 H VAL 531 H VAL 531 82.911 1.572 7.541 559 HA VAL 531 HA VAL 531 85.096 0.414 5.918 560 HB VAL 531 HB VAL 531 84.734 2.889 6.030 561 HG11 VAL 531 HG11 VAL 531 85.929 2.991 8.768 562 HG12 VAL 531 HG12 VAL 531 84.220 2.576 8.668 563 HG13 VAL 531 HG13 VAL 531 84.799 4.099 7.995 564 HG21 VAL 531 HG21 VAL 531 87.092 3.423 6.308 565 HG22 VAL 531 HG22 VAL 531 86.960 1.837 5.548 566 HG23 VAL 531 HG23 VAL 531 87.344 1.962 7.264 567 H THR 532 H THR 532 85.663 -1.503 6.943 568 HA THR 532 HA THR 532 87.163 -1.272 9.352 569 HB THR 532 HB THR 532 85.133 -1.261 10.512 570 HG1 THR 532 HG1 THR 532 86.542 -2.810 11.317 571 HG21 THR 532 HG21 THR 532 83.453 -1.757 8.967 572 HG22 THR 532 HG22 THR 532 83.433 -3.190 9.991 573 HG23 THR 532 HG23 THR 532 84.239 -3.237 8.426 574 H GLU 533 H GLU 533 85.535 -4.253 9.186 575 HA GLU 533 HA GLU 533 87.951 -5.522 8.098 576 HB2 GLU 533 HB2 GLU 533 85.510 -6.646 9.491 577 HB3 GLU 533 HB3 GLU 533 86.877 -7.608 8.929 578 HG2 GLU 533 HG2 GLU 533 87.134 -5.283 10.860 579 HG3 GLU 533 HG3 GLU 533 87.024 -6.969 11.364 580 H PHE 534 H PHE 534 88.014 -5.729 5.970 581 HA PHE 534 HA PHE 534 85.587 -6.057 4.393 582 HB2 PHE 534 HB2 PHE 534 88.513 -5.766 3.701 583 HB3 PHE 534 HB3 PHE 534 87.276 -6.086 2.486 584 HD1 PHE 534 HD1 PHE 534 88.550 -3.640 4.937 585 HD2 PHE 534 HD2 PHE 534 85.597 -4.409 1.915 586 HE1 PHE 534 HE1 PHE 534 87.958 -1.236 4.907 587 HE2 PHE 534 HE2 PHE 534 85.002 -2.003 1.888 588 HZ PHE 534 HZ PHE 534 86.182 -0.415 3.384 589 H GLU 535 H GLU 535 84.979 -7.880 3.300 590 HA GLU 535 HA GLU 535 85.847 -10.409 4.299 591 HB2 GLU 535 HB2 GLU 535 84.105 -9.677 1.933 592 HB3 GLU 535 HB3 GLU 535 84.309 -11.308 2.569 593 HG2 GLU 535 HG2 GLU 535 83.326 -8.991 4.250 594 HG3 GLU 535 HG3 GLU 535 82.246 -10.096 3.399 595 H ASN 536 H ASN 536 87.288 -11.834 3.485 596 HA ASN 536 HA ASN 536 88.971 -12.692 2.192 597 HB2 ASN 536 HB2 ASN 536 86.934 -12.758 0.614 598 HB3 ASN 536 HB3 ASN 536 87.662 -11.361 -0.174 599 HD21 ASN 536 HD21 ASN 536 89.547 -11.714 -1.482 600 HD22 ASN 536 HD22 ASN 536 90.175 -13.263 -1.779 601 H VAL 537 H VAL 537 89.943 -10.605 3.477 602 HA VAL 537 HA VAL 537 90.797 -8.410 1.895 603 HB VAL 537 HB VAL 537 92.182 -9.551 4.334 604 HG11 VAL 537 HG11 VAL 537 91.957 -6.663 3.465 605 HG12 VAL 537 HG12 VAL 537 93.274 -7.697 2.913 606 HG13 VAL 537 HG13 VAL 537 93.073 -7.368 4.632 607 HG21 VAL 537 HG21 VAL 537 89.768 -7.742 4.065 608 HG22 VAL 537 HG22 VAL 537 90.709 -7.874 5.550 609 HG23 VAL 537 HG23 VAL 537 89.869 -9.287 4.912 610 H THR 538 H THR 538 92.403 -8.215 0.469 611 HA THR 538 HA THR 538 94.458 -10.343 0.282 612 HB THR 538 HB THR 538 93.246 -10.975 -1.535 613 HG1 THR 538 HG1 THR 538 95.101 -10.356 -2.492 614 HG21 THR 538 HG21 THR 538 92.328 -8.101 -1.704 615 HG22 THR 538 HG22 THR 538 91.367 -9.518 -1.277 616 HG23 THR 538 HG23 THR 538 91.936 -9.305 -2.932 617 HA PRO 539 HA PRO 539 96.500 -6.129 0.767 618 HB2 PRO 539 HB2 PRO 539 98.937 -7.712 0.910 619 HB3 PRO 539 HB3 PRO 539 98.167 -6.770 2.195 620 HG2 PRO 539 HG2 PRO 539 97.964 -9.662 1.595 621 HG3 PRO 539 HG3 PRO 539 97.754 -8.812 3.137 622 HD2 PRO 539 HD2 PRO 539 95.645 -9.814 1.885 623 HD3 PRO 539 HD3 PRO 539 95.533 -8.229 2.662 624 H THR 540 H THR 540 97.702 -5.000 -0.750 625 HA THR 540 HA THR 540 97.963 -6.263 -3.395 626 HB THR 540 HB THR 540 98.244 -3.846 -4.114 627 HG1 THR 540 HG1 THR 540 97.914 -2.299 -2.620 628 HG21 THR 540 HG21 THR 540 96.086 -4.948 -4.335 629 HG22 THR 540 HG22 THR 540 95.820 -3.316 -3.720 630 HG23 THR 540 HG23 THR 540 95.743 -4.693 -2.624 631 H ASN 541 H ASN 541 99.881 -6.054 -0.828 632 HA ASN 541 HA ASN 541 102.212 -4.780 -1.773 633 HB2 ASN 541 HB2 ASN 541 101.852 -6.961 0.295 634 HB3 ASN 541 HB3 ASN 541 103.361 -6.089 0.013 635 HD21 ASN 541 HD21 ASN 541 102.139 -3.493 -0.524 636 HD22 ASN 541 HD22 ASN 541 101.503 -2.929 0.943 637 H ASP 542 H ASP 542 103.896 -5.431 -2.925 638 HA ASP 542 HA ASP 542 103.619 -7.851 -4.527 639 HB2 ASP 542 HB2 ASP 542 104.257 -5.543 -5.412 640 HB3 ASP 542 HB3 ASP 542 105.817 -5.779 -4.631 641 H GLN 543 H GLN 543 104.431 -9.727 -3.729 642 HA GLN 543 HA GLN 543 107.169 -9.881 -2.858 643 HB2 GLN 543 HB2 GLN 543 106.039 -8.984 -0.832 644 HB3 GLN 543 HB3 GLN 543 104.999 -10.405 -0.815 645 HG2 GLN 543 HG2 GLN 543 106.998 -11.851 -0.608 646 HG3 GLN 543 HG3 GLN 543 108.021 -10.413 -0.578 647 HE21 GLN 543 HE21 GLN 543 108.702 -10.306 1.609 648 HE22 GLN 543 HE22 GLN 543 107.635 -10.301 2.929 Start of MODEL 6 1 H1 SER 466 H1 SER 466 30.351 0.157 -4.912 2 H2 SER 466 H2 SER 466 29.654 0.648 -3.443 3 H3 SER 466 H3 SER 466 31.232 0.020 -3.469 4 HA SER 466 HA SER 466 31.992 1.911 -4.762 5 HB2 SER 466 HB2 SER 466 30.520 3.722 -5.295 6 HB3 SER 466 HB3 SER 466 29.689 2.254 -5.800 7 HG SER 466 HG SER 466 29.203 3.955 -3.627 8 H ASP 467 H ASP 467 30.009 1.433 -1.958 9 HA ASP 467 HA ASP 467 30.782 3.748 -0.485 10 HB2 ASP 467 HB2 ASP 467 28.772 2.325 -0.026 11 HB3 ASP 467 HB3 ASP 467 29.852 1.072 0.575 12 H ASP 468 H ASP 468 32.481 0.955 -1.367 13 HA ASP 468 HA ASP 468 34.223 0.878 0.970 14 HB2 ASP 468 HB2 ASP 468 35.402 -0.886 -0.353 15 HB3 ASP 468 HB3 ASP 468 33.686 -1.222 -0.123 16 H TYR 469 H TYR 469 33.911 2.881 -1.541 17 HA TYR 469 HA TYR 469 36.511 3.186 -2.612 18 HB2 TYR 469 HB2 TYR 469 34.343 3.989 -3.552 19 HB3 TYR 469 HB3 TYR 469 34.349 5.255 -2.329 20 HD1 TYR 469 HD1 TYR 469 36.254 3.853 -5.205 21 HD2 TYR 469 HD2 TYR 469 35.654 7.217 -2.602 22 HE1 TYR 469 HE1 TYR 469 37.688 5.246 -6.672 23 HE2 TYR 469 HE2 TYR 469 37.082 8.610 -4.071 24 HH TYR 469 HH TYR 469 37.866 8.669 -6.343 25 H VAL 470 H VAL 470 38.124 4.702 -2.177 26 HA VAL 470 HA VAL 470 38.085 5.845 0.566 27 HB VAL 470 HB VAL 470 40.533 5.212 -1.098 28 HG11 VAL 470 HG11 VAL 470 41.537 5.213 1.243 29 HG12 VAL 470 HG12 VAL 470 40.045 5.982 1.774 30 HG13 VAL 470 HG13 VAL 470 41.070 6.776 0.579 31 HG21 VAL 470 HG21 VAL 470 40.735 3.215 0.415 32 HG22 VAL 470 HG22 VAL 470 39.376 3.119 -0.705 33 HG23 VAL 470 HG23 VAL 470 39.097 3.542 0.984 34 H ASP 471 H ASP 471 38.479 7.981 0.875 35 HA ASP 471 HA ASP 471 38.018 9.873 -1.076 36 HB2 ASP 471 HB2 ASP 471 39.662 10.071 1.453 37 HB3 ASP 471 HB3 ASP 471 39.270 11.465 0.448 38 H GLU 472 H GLU 472 39.269 11.129 -2.405 39 HA GLU 472 HA GLU 472 41.452 9.950 -3.714 40 HB2 GLU 472 HB2 GLU 472 40.449 12.802 -3.682 41 HB3 GLU 472 HB3 GLU 472 41.691 12.211 -4.787 42 HG2 GLU 472 HG2 GLU 472 40.147 10.580 -5.724 43 HG3 GLU 472 HG3 GLU 472 38.912 11.019 -4.545 44 H GLU 473 H GLU 473 41.370 12.439 -1.173 45 HA GLU 473 HA GLU 473 44.110 13.124 -1.326 46 HB2 GLU 473 HB2 GLU 473 42.936 14.723 -0.143 47 HB3 GLU 473 HB3 GLU 473 41.841 13.541 0.556 48 HG2 GLU 473 HG2 GLU 473 43.347 14.613 2.230 49 HG3 GLU 473 HG3 GLU 473 43.503 12.861 2.177 50 H THR 474 H THR 474 42.318 10.838 0.683 51 HA THR 474 HA THR 474 44.504 9.889 2.211 52 HB THR 474 HB THR 474 41.801 8.791 1.455 53 HG1 THR 474 HG1 THR 474 41.253 9.749 3.227 54 HG21 THR 474 HG21 THR 474 42.223 7.062 3.261 55 HG22 THR 474 HG22 THR 474 43.933 7.481 3.144 56 HG23 THR 474 HG23 THR 474 43.090 6.808 1.747 57 H TYR 475 H TYR 475 42.933 8.740 -0.725 58 HA TYR 475 HA TYR 475 44.452 6.411 -1.046 59 HB2 TYR 475 HB2 TYR 475 42.268 7.052 -2.165 60 HB3 TYR 475 HB3 TYR 475 43.222 8.056 -3.258 61 HD1 TYR 475 HD1 TYR 475 42.905 4.619 -1.913 62 HD2 TYR 475 HD2 TYR 475 44.289 7.100 -5.119 63 HE1 TYR 475 HE1 TYR 475 43.422 2.585 -3.254 64 HE2 TYR 475 HE2 TYR 475 44.824 5.081 -6.471 65 HH TYR 475 HH TYR 475 43.670 2.004 -5.681 66 H ASN 476 H ASN 476 44.882 9.655 -2.462 67 HA ASN 476 HA ASN 476 47.184 8.955 -3.972 68 HB2 ASN 476 HB2 ASN 476 46.414 11.686 -2.930 69 HB3 ASN 476 HB3 ASN 476 47.504 11.328 -4.273 70 HD21 ASN 476 HD21 ASN 476 45.572 8.989 -4.986 71 HD22 ASN 476 HD22 ASN 476 44.319 9.766 -5.828 72 H LEU 477 H LEU 477 46.638 10.109 -0.712 73 HA LEU 477 HA LEU 477 49.266 10.773 0.007 74 HB2 LEU 477 HB2 LEU 477 47.317 11.308 1.393 75 HB3 LEU 477 HB3 LEU 477 47.009 9.598 1.648 76 HG LEU 477 HG LEU 477 49.181 9.378 2.786 77 HD11 LEU 477 HD11 LEU 477 50.583 11.042 1.888 78 HD12 LEU 477 HD12 LEU 477 50.209 11.669 3.487 79 HD13 LEU 477 HD13 LEU 477 49.363 12.302 2.077 80 HD21 LEU 477 HD21 LEU 477 47.222 9.797 4.138 81 HD22 LEU 477 HD22 LEU 477 47.331 11.530 3.829 82 HD23 LEU 477 HD23 LEU 477 48.564 10.727 4.800 83 H GLN 478 H GLN 478 47.471 7.711 0.104 84 HA GLN 478 HA GLN 478 49.531 6.098 1.196 85 HB2 GLN 478 HB2 GLN 478 47.163 5.450 -0.572 86 HB3 GLN 478 HB3 GLN 478 48.212 4.222 0.134 87 HG2 GLN 478 HG2 GLN 478 46.746 6.316 1.751 88 HG3 GLN 478 HG3 GLN 478 46.130 4.691 1.469 89 HE21 GLN 478 HE21 GLN 478 47.302 6.232 3.932 90 HE22 GLN 478 HE22 GLN 478 48.383 5.104 4.597 91 H LYS 479 H LYS 479 48.612 7.001 -2.046 92 HA LYS 479 HA LYS 479 50.354 5.317 -3.493 93 HB2 LYS 479 HB2 LYS 479 48.293 6.689 -4.229 94 HB3 LYS 479 HB3 LYS 479 49.410 8.035 -4.407 95 HG2 LYS 479 HG2 LYS 479 50.755 6.767 -5.996 96 HG3 LYS 479 HG3 LYS 479 49.756 5.337 -5.755 97 HD2 LYS 479 HD2 LYS 479 48.630 7.970 -6.740 98 HD3 LYS 479 HD3 LYS 479 49.217 6.723 -7.835 99 HE2 LYS 479 HE2 LYS 479 47.603 5.134 -6.555 100 HE3 LYS 479 HE3 LYS 479 46.859 6.614 -5.955 101 HZ1 LYS 479 HZ1 LYS 479 46.535 5.392 -8.454 102 HZ2 LYS 479 HZ2 LYS 479 47.239 6.920 -8.691 103 HZ3 LYS 479 HZ3 LYS 479 45.773 6.778 -7.844 104 H LEU 480 H LEU 480 50.648 8.576 -2.225 105 HA LEU 480 HA LEU 480 53.083 9.303 -3.444 106 HB2 LEU 480 HB2 LEU 480 51.527 10.193 -1.033 107 HB3 LEU 480 HB3 LEU 480 53.124 10.876 -1.332 108 HG LEU 480 HG LEU 480 51.185 10.797 -3.635 109 HD11 LEU 480 HD11 LEU 480 49.676 11.729 -2.088 110 HD12 LEU 480 HD12 LEU 480 50.435 13.149 -2.803 111 HD13 LEU 480 HD13 LEU 480 50.946 12.581 -1.213 112 HD21 LEU 480 HD21 LEU 480 53.559 11.612 -3.817 113 HD22 LEU 480 HD22 LEU 480 53.155 12.902 -2.685 114 HD23 LEU 480 HD23 LEU 480 52.363 12.831 -4.259 115 H LEU 481 H LEU 481 52.498 8.163 -0.102 116 HA LEU 481 HA LEU 481 55.326 7.861 0.401 117 HB2 LEU 481 HB2 LEU 481 54.549 7.025 2.594 118 HB3 LEU 481 HB3 LEU 481 53.848 8.583 2.169 119 HG LEU 481 HG LEU 481 52.002 6.795 1.064 120 HD11 LEU 481 HD11 LEU 481 53.344 5.006 2.340 121 HD12 LEU 481 HD12 LEU 481 51.594 5.016 2.546 122 HD13 LEU 481 HD13 LEU 481 52.633 5.696 3.798 123 HD21 LEU 481 HD21 LEU 481 51.591 8.863 2.493 124 HD22 LEU 481 HD22 LEU 481 51.819 7.826 3.900 125 HD23 LEU 481 HD23 LEU 481 50.507 7.504 2.784 126 H ALA 482 H ALA 482 52.969 5.935 -1.056 127 HA ALA 482 HA ALA 482 53.382 3.377 -0.160 128 HB1 ALA 482 HB1 ALA 482 51.848 3.145 -1.807 129 HB2 ALA 482 HB2 ALA 482 53.184 3.095 -2.954 130 HB3 ALA 482 HB3 ALA 482 52.393 4.622 -2.587 131 HA PRO 483 HA PRO 483 57.009 2.650 -3.447 132 HB2 PRO 483 HB2 PRO 483 58.411 5.188 -3.533 133 HB3 PRO 483 HB3 PRO 483 57.635 4.330 -4.869 134 HG2 PRO 483 HG2 PRO 483 56.605 6.550 -3.224 135 HG3 PRO 483 HG3 PRO 483 56.181 6.085 -4.875 136 HD2 PRO 483 HD2 PRO 483 54.485 5.684 -2.825 137 HD3 PRO 483 HD3 PRO 483 54.598 4.519 -4.159 138 H TYR 484 H TYR 484 57.480 5.239 -1.037 139 HA TYR 484 HA TYR 484 59.979 4.280 -0.099 140 HB2 TYR 484 HB2 TYR 484 59.684 6.509 0.433 141 HB3 TYR 484 HB3 TYR 484 57.966 6.309 0.787 142 HD1 TYR 484 HD1 TYR 484 57.247 5.233 2.929 143 HD2 TYR 484 HD2 TYR 484 61.348 6.288 2.194 144 HE1 TYR 484 HE1 TYR 484 57.728 5.041 5.350 145 HE2 TYR 484 HE2 TYR 484 61.824 6.089 4.626 146 HH TYR 484 HH TYR 484 60.180 4.512 6.699 147 H HIS 485 H HIS 485 56.642 3.740 0.876 148 HA HIS 485 HA HIS 485 57.048 2.432 3.319 149 HB2 HIS 485 HB2 HIS 485 54.862 3.235 2.340 150 HB3 HIS 485 HB3 HIS 485 54.877 1.804 1.315 151 HD1 HIS 485 HD1 HIS 485 54.818 -0.547 2.579 152 HD2 HIS 485 HD2 HIS 485 54.012 2.778 4.962 153 HE1 HIS 485 HE1 HIS 485 53.726 -1.425 4.688 154 H LYS 486 H LYS 486 57.076 1.188 0.008 155 HA LYS 486 HA LYS 486 57.479 -1.564 0.899 156 HB2 LYS 486 HB2 LYS 486 57.562 -2.039 -1.541 157 HB3 LYS 486 HB3 LYS 486 56.119 -1.128 -1.093 158 HG2 LYS 486 HG2 LYS 486 57.074 0.930 -1.872 159 HG3 LYS 486 HG3 LYS 486 58.649 0.189 -2.117 160 HD2 LYS 486 HD2 LYS 486 57.491 0.437 -4.255 161 HD3 LYS 486 HD3 LYS 486 57.699 -1.268 -3.867 162 HE2 LYS 486 HE2 LYS 486 55.388 -0.522 -4.729 163 HE3 LYS 486 HE3 LYS 486 55.417 -1.523 -3.281 164 HZ1 LYS 486 HZ1 LYS 486 55.432 1.426 -3.119 165 HZ2 LYS 486 HZ2 LYS 486 54.999 0.300 -1.923 166 HZ3 LYS 486 HZ3 LYS 486 53.981 0.558 -3.258 167 H ALA 487 H ALA 487 59.361 1.170 0.137 168 HA ALA 487 HA ALA 487 61.696 -0.024 -0.898 169 HB1 ALA 487 HB1 ALA 487 62.746 2.103 -0.430 170 HB2 ALA 487 HB2 ALA 487 61.453 2.543 0.680 171 HB3 ALA 487 HB3 ALA 487 61.120 2.395 -1.046 172 H LYS 488 H LYS 488 62.740 -1.561 0.142 173 HA LYS 488 HA LYS 488 63.031 -1.524 3.063 174 HB2 LYS 488 HB2 LYS 488 63.837 -3.569 0.991 175 HB3 LYS 488 HB3 LYS 488 64.024 -3.770 2.734 176 HG2 LYS 488 HG2 LYS 488 61.584 -3.485 3.024 177 HG3 LYS 488 HG3 LYS 488 61.398 -3.321 1.280 178 HD2 LYS 488 HD2 LYS 488 62.667 -5.755 2.559 179 HD3 LYS 488 HD3 LYS 488 60.936 -5.649 2.244 180 HE2 LYS 488 HE2 LYS 488 61.578 -5.098 -0.190 181 HE3 LYS 488 HE3 LYS 488 63.200 -5.641 0.237 182 HZ1 LYS 488 HZ1 LYS 488 60.703 -7.225 0.455 183 HZ2 LYS 488 HZ2 LYS 488 62.235 -7.747 0.970 184 HZ3 LYS 488 HZ3 LYS 488 61.945 -7.451 -0.678 185 H THR 489 H THR 489 64.679 -0.300 0.438 186 HA THR 489 HA THR 489 67.358 -0.676 1.641 187 HB THR 489 HB THR 489 67.946 0.527 -0.639 188 HG1 THR 489 HG1 THR 489 65.378 -0.571 -1.125 189 HG21 THR 489 HG21 THR 489 68.644 -1.724 -0.302 190 HG22 THR 489 HG22 THR 489 67.715 -1.745 -1.801 191 HG23 THR 489 HG23 THR 489 66.983 -2.316 -0.302 192 H LEU 490 H LEU 490 68.409 0.966 2.610 193 HA LEU 490 HA LEU 490 67.094 3.269 3.489 194 HB2 LEU 490 HB2 LEU 490 69.985 2.434 3.336 195 HB3 LEU 490 HB3 LEU 490 69.542 4.020 3.960 196 HG LEU 490 HG LEU 490 68.046 2.931 5.613 197 HD11 LEU 490 HD11 LEU 490 69.118 0.446 4.273 198 HD12 LEU 490 HD12 LEU 490 67.437 0.882 4.581 199 HD13 LEU 490 HD13 LEU 490 68.483 0.407 5.918 200 HD21 LEU 490 HD21 LEU 490 69.849 2.029 7.035 201 HD22 LEU 490 HD22 LEU 490 70.394 3.478 6.192 202 HD23 LEU 490 HD23 LEU 490 70.895 1.887 5.623 203 H GLU 491 H GLU 491 69.535 2.938 0.908 204 HA GLU 491 HA GLU 491 69.670 5.619 0.119 205 HB2 GLU 491 HB2 GLU 491 70.496 4.726 -2.039 206 HB3 GLU 491 HB3 GLU 491 71.286 3.978 -0.647 207 HG2 GLU 491 HG2 GLU 491 69.623 2.129 -0.762 208 HG3 GLU 491 HG3 GLU 491 68.980 2.842 -2.236 209 H ARG 492 H ARG 492 67.407 3.119 -0.640 210 HA ARG 492 HA ARG 492 66.095 4.515 -2.773 211 HB2 ARG 492 HB2 ARG 492 66.066 2.048 -2.480 212 HB3 ARG 492 HB3 ARG 492 65.065 2.260 -1.045 213 HG2 ARG 492 HG2 ARG 492 63.407 1.907 -2.642 214 HG3 ARG 492 HG3 ARG 492 63.525 3.661 -2.730 215 HD2 ARG 492 HD2 ARG 492 63.566 2.737 -4.981 216 HD3 ARG 492 HD3 ARG 492 65.147 3.414 -4.610 217 HE ARG 492 HE ARG 492 66.035 1.224 -4.489 218 HH11 ARG 492 HH11 ARG 492 63.157 0.276 -3.415 219 HH12 ARG 492 HH12 ARG 492 62.836 -0.955 -4.591 220 HH21 ARG 492 HH21 ARG 492 65.383 0.038 -6.721 221 HH22 ARG 492 HH22 ARG 492 64.095 -1.089 -6.460 222 H GLN 493 H GLN 493 65.462 4.069 0.686 223 HA GLN 493 HA GLN 493 62.957 5.304 0.792 224 HB2 GLN 493 HB2 GLN 493 65.189 5.101 2.815 225 HB3 GLN 493 HB3 GLN 493 63.618 5.803 3.194 226 HG2 GLN 493 HG2 GLN 493 62.487 3.736 2.639 227 HG3 GLN 493 HG3 GLN 493 63.980 3.026 2.039 228 HE21 GLN 493 HE21 GLN 493 64.501 1.417 3.540 229 HE22 GLN 493 HE22 GLN 493 64.566 1.657 5.220 230 H VAL 494 H VAL 494 66.210 6.690 1.160 231 HA VAL 494 HA VAL 494 65.393 9.350 1.601 232 HB VAL 494 HB VAL 494 67.911 8.221 0.359 233 HG11 VAL 494 HG11 VAL 494 68.873 10.458 1.022 234 HG12 VAL 494 HG12 VAL 494 67.224 11.016 1.297 235 HG13 VAL 494 HG13 VAL 494 67.732 10.527 -0.320 236 HG21 VAL 494 HG21 VAL 494 67.650 7.477 2.628 237 HG22 VAL 494 HG22 VAL 494 67.125 9.076 3.155 238 HG23 VAL 494 HG23 VAL 494 68.799 8.814 2.668 239 H TYR 495 H TYR 495 66.237 7.605 -1.368 240 HA TYR 495 HA TYR 495 65.987 9.691 -3.210 241 HB2 TYR 495 HB2 TYR 495 66.980 7.572 -3.789 242 HB3 TYR 495 HB3 TYR 495 65.473 6.726 -3.460 243 HD1 TYR 495 HD1 TYR 495 67.004 9.328 -5.671 244 HD2 TYR 495 HD2 TYR 495 63.854 6.451 -5.152 245 HE1 TYR 495 HE1 TYR 495 66.316 9.649 -8.034 246 HE2 TYR 495 HE2 TYR 495 63.174 6.767 -7.512 247 HH TYR 495 HH TYR 495 64.522 9.309 -9.492 248 H GLU 496 H GLU 496 63.535 7.338 -2.130 249 HA GLU 496 HA GLU 496 61.426 8.347 -3.712 250 HB2 GLU 496 HB2 GLU 496 61.393 6.796 -1.130 251 HB3 GLU 496 HB3 GLU 496 59.960 7.128 -2.105 252 HG2 GLU 496 HG2 GLU 496 62.430 5.694 -3.124 253 HG3 GLU 496 HG3 GLU 496 60.966 4.880 -2.578 254 H LEU 497 H LEU 497 62.422 9.022 -0.392 255 HA LEU 497 HA LEU 497 60.307 10.782 0.225 256 HB2 LEU 497 HB2 LEU 497 63.094 10.483 1.307 257 HB3 LEU 497 HB3 LEU 497 61.934 11.623 1.988 258 HG LEU 497 HG LEU 497 61.388 8.659 1.649 259 HD11 LEU 497 HD11 LEU 497 61.973 8.302 3.905 260 HD12 LEU 497 HD12 LEU 497 62.009 10.025 4.260 261 HD13 LEU 497 HD13 LEU 497 63.280 9.301 3.277 262 HD21 LEU 497 HD21 LEU 497 59.693 9.459 3.596 263 HD22 LEU 497 HD22 LEU 497 59.268 9.547 1.891 264 HD23 LEU 497 HD23 LEU 497 59.839 10.988 2.728 265 H GLU 498 H GLU 498 63.492 11.317 -1.219 266 HA GLU 498 HA GLU 498 63.577 14.103 -1.167 267 HB2 GLU 498 HB2 GLU 498 64.653 12.033 -3.071 268 HB3 GLU 498 HB3 GLU 498 64.914 13.749 -3.379 269 HG2 GLU 498 HG2 GLU 498 65.582 12.495 -0.720 270 HG3 GLU 498 HG3 GLU 498 66.730 12.502 -2.053 271 H LYS 499 H LYS 499 62.256 11.962 -3.692 272 HA LYS 499 HA LYS 499 61.294 14.095 -5.333 273 HB2 LYS 499 HB2 LYS 499 60.629 11.158 -5.145 274 HB3 LYS 499 HB3 LYS 499 59.975 12.218 -6.396 275 HG2 LYS 499 HG2 LYS 499 62.000 12.408 -7.498 276 HG3 LYS 499 HG3 LYS 499 62.945 12.325 -6.013 277 HD2 LYS 499 HD2 LYS 499 63.295 10.330 -7.400 278 HD3 LYS 499 HD3 LYS 499 62.535 9.911 -5.867 279 HE2 LYS 499 HE2 LYS 499 60.406 9.613 -6.878 280 HE3 LYS 499 HE3 LYS 499 60.892 10.456 -8.347 281 HZ1 LYS 499 HZ1 LYS 499 61.147 8.352 -9.070 282 HZ2 LYS 499 HZ2 LYS 499 61.399 7.714 -7.516 283 HZ3 LYS 499 HZ3 LYS 499 62.666 8.501 -8.330 284 H LEU 500 H LEU 500 59.744 11.954 -2.996 285 HA LEU 500 HA LEU 500 57.137 12.966 -3.279 286 HB2 LEU 500 HB2 LEU 500 58.473 11.549 -0.988 287 HB3 LEU 500 HB3 LEU 500 56.740 11.790 -1.132 288 HG LEU 500 HG LEU 500 58.315 10.449 -3.335 289 HD11 LEU 500 HD11 LEU 500 57.806 8.299 -2.359 290 HD12 LEU 500 HD12 LEU 500 56.881 9.048 -1.061 291 HD13 LEU 500 HD13 LEU 500 58.630 9.251 -1.133 292 HD21 LEU 500 HD21 LEU 500 56.040 9.387 -3.717 293 HD22 LEU 500 HD22 LEU 500 56.099 11.111 -4.023 294 HD23 LEU 500 HD23 LEU 500 55.388 10.510 -2.527 295 H GLN 501 H GLN 501 59.899 14.165 -1.585 296 HA GLN 501 HA GLN 501 58.711 15.682 0.432 297 HB2 GLN 501 HB2 GLN 501 61.301 15.368 -0.721 298 HB3 GLN 501 HB3 GLN 501 60.982 17.093 -0.725 299 HG2 GLN 501 HG2 GLN 501 62.082 16.418 1.365 300 HG3 GLN 501 HG3 GLN 501 60.450 16.999 1.683 301 HE21 GLN 501 HE21 GLN 501 59.219 15.651 2.994 302 HE22 GLN 501 HE22 GLN 501 59.498 13.991 3.211 303 H GLU 502 H GLU 502 59.337 16.564 -2.954 304 HA GLU 502 HA GLU 502 58.221 19.216 -2.633 305 HB2 GLU 502 HB2 GLU 502 58.504 19.223 -5.180 306 HB3 GLU 502 HB3 GLU 502 59.977 19.028 -4.223 307 HG2 GLU 502 HG2 GLU 502 60.011 16.667 -4.571 308 HG3 GLU 502 HG3 GLU 502 58.379 16.676 -5.233 309 H LYS 503 H LYS 503 56.990 16.080 -3.383 310 HA LYS 503 HA LYS 503 54.584 17.206 -4.700 311 HB2 LYS 503 HB2 LYS 503 55.749 14.450 -4.430 312 HB3 LYS 503 HB3 LYS 503 54.076 14.668 -4.932 313 HG2 LYS 503 HG2 LYS 503 54.760 16.003 -6.832 314 HG3 LYS 503 HG3 LYS 503 56.441 15.977 -6.305 315 HD2 LYS 503 HD2 LYS 503 55.013 13.360 -6.750 316 HD3 LYS 503 HD3 LYS 503 55.591 14.262 -8.148 317 HE2 LYS 503 HE2 LYS 503 57.311 13.412 -5.793 318 HE3 LYS 503 HE3 LYS 503 57.270 12.619 -7.365 319 HZ1 LYS 503 HZ1 LYS 503 58.635 14.994 -6.572 320 HZ2 LYS 503 HZ2 LYS 503 57.664 15.256 -7.942 321 HZ3 LYS 503 HZ3 LYS 503 58.848 14.038 -7.956 322 H LEU 504 H LEU 504 55.603 15.715 -1.717 323 HA LEU 504 HA LEU 504 53.097 14.841 -0.826 324 HB2 LEU 504 HB2 LEU 504 55.682 15.480 0.501 325 HB3 LEU 504 HB3 LEU 504 54.268 15.156 1.498 326 HG LEU 504 HG LEU 504 55.067 13.286 -0.739 327 HD11 LEU 504 HD11 LEU 504 56.100 13.400 2.085 328 HD12 LEU 504 HD12 LEU 504 57.044 13.364 0.605 329 HD13 LEU 504 HD13 LEU 504 56.165 11.929 1.131 330 HD21 LEU 504 HD21 LEU 504 53.344 13.095 1.745 331 HD22 LEU 504 HD22 LEU 504 53.956 11.652 0.953 332 HD23 LEU 504 HD23 LEU 504 52.899 12.749 0.078 333 HA PRO 505 HA PRO 505 51.064 18.915 -0.361 334 HB2 PRO 505 HB2 PRO 505 49.530 17.766 1.834 335 HB3 PRO 505 HB3 PRO 505 48.973 18.184 0.208 336 HG2 PRO 505 HG2 PRO 505 49.916 15.564 1.242 337 HG3 PRO 505 HG3 PRO 505 48.767 15.913 -0.055 338 HD2 PRO 505 HD2 PRO 505 51.147 14.997 -0.628 339 HD3 PRO 505 HD3 PRO 505 50.486 16.323 -1.601 340 H GLU 506 H GLU 506 51.401 20.588 0.989 341 HA GLU 506 HA GLU 506 53.592 20.947 2.464 342 HB2 GLU 506 HB2 GLU 506 52.437 22.808 3.623 343 HB3 GLU 506 HB3 GLU 506 52.108 22.770 1.890 344 HG2 GLU 506 HG2 GLU 506 50.018 21.309 2.631 345 HG3 GLU 506 HG3 GLU 506 50.281 22.097 4.186 346 H LYS 507 H LYS 507 50.504 20.306 4.162 347 HA LYS 507 HA LYS 507 51.560 20.038 6.713 348 HB2 LYS 507 HB2 LYS 507 49.505 18.478 7.056 349 HB3 LYS 507 HB3 LYS 507 49.216 20.152 6.578 350 HG2 LYS 507 HG2 LYS 507 48.948 19.515 4.260 351 HG3 LYS 507 HG3 LYS 507 49.439 17.861 4.614 352 HD2 LYS 507 HD2 LYS 507 47.456 17.571 6.034 353 HD3 LYS 507 HD3 LYS 507 46.973 19.238 5.710 354 HE2 LYS 507 HE2 LYS 507 46.715 18.772 3.351 355 HE3 LYS 507 HE3 LYS 507 47.386 17.157 3.553 356 HZ1 LYS 507 HZ1 LYS 507 45.140 16.740 3.593 357 HZ2 LYS 507 HZ2 LYS 507 44.762 18.202 4.371 358 HZ3 LYS 507 HZ3 LYS 507 45.450 16.922 5.250 359 H TYR 508 H TYR 508 51.576 17.755 4.078 360 HA TYR 508 HA TYR 508 52.489 15.578 5.819 361 HB2 TYR 508 HB2 TYR 508 51.710 15.807 2.922 362 HB3 TYR 508 HB3 TYR 508 52.593 14.399 3.506 363 HD1 TYR 508 HD1 TYR 508 51.669 13.142 5.507 364 HD2 TYR 508 HD2 TYR 508 49.380 15.967 3.255 365 HE1 TYR 508 HE1 TYR 508 49.583 12.132 6.374 366 HE2 TYR 508 HE2 TYR 508 47.282 14.942 4.091 367 HH TYR 508 HH TYR 508 46.407 13.509 5.581 368 H LYS 509 H LYS 509 53.660 18.008 3.690 369 HA LYS 509 HA LYS 509 56.112 16.862 2.905 370 HB2 LYS 509 HB2 LYS 509 55.085 18.937 1.961 371 HB3 LYS 509 HB3 LYS 509 55.473 19.764 3.462 372 HG2 LYS 509 HG2 LYS 509 57.842 19.399 3.119 373 HG3 LYS 509 HG3 LYS 509 57.513 18.443 1.672 374 HD2 LYS 509 HD2 LYS 509 56.429 20.401 0.628 375 HD3 LYS 509 HD3 LYS 509 56.780 21.357 2.066 376 HE2 LYS 509 HE2 LYS 509 59.194 21.022 1.704 377 HE3 LYS 509 HE3 LYS 509 58.847 20.057 0.267 378 HZ1 LYS 509 HZ1 LYS 509 57.424 22.453 0.074 379 HZ2 LYS 509 HZ2 LYS 509 58.709 21.915 -0.901 380 HZ3 LYS 509 HZ3 LYS 509 59.022 22.845 0.486 381 H ALA 510 H ALA 510 55.215 18.940 5.638 382 HA ALA 510 HA ALA 510 57.734 19.125 6.843 383 HB1 ALA 510 HB1 ALA 510 56.475 19.644 8.922 384 HB2 ALA 510 HB2 ALA 510 54.988 19.180 8.094 385 HB3 ALA 510 HB3 ALA 510 55.918 20.568 7.525 386 H GLU 511 H GLU 511 55.063 16.881 7.561 387 HA GLU 511 HA GLU 511 56.349 15.403 9.582 388 HB2 GLU 511 HB2 GLU 511 53.957 15.272 9.083 389 HB3 GLU 511 HB3 GLU 511 54.305 14.515 7.533 390 HG2 GLU 511 HG2 GLU 511 55.304 12.584 8.669 391 HG3 GLU 511 HG3 GLU 511 55.042 13.357 10.234 392 H TYR 512 H TYR 512 56.347 14.873 6.079 393 HA TYR 512 HA TYR 512 57.942 12.485 6.279 394 HB2 TYR 512 HB2 TYR 512 56.758 14.138 4.097 395 HB3 TYR 512 HB3 TYR 512 58.024 12.983 3.674 396 HD1 TYR 512 HD1 TYR 512 54.849 13.246 5.643 397 HD2 TYR 512 HD2 TYR 512 57.454 10.737 3.329 398 HE1 TYR 512 HE1 TYR 512 53.225 11.390 5.828 399 HE2 TYR 512 HE2 TYR 512 55.834 8.877 3.527 400 HH TYR 512 HH TYR 512 53.348 8.858 5.742 401 H LYS 513 H LYS 513 58.586 15.873 5.941 402 HA LYS 513 HA LYS 513 61.204 15.639 4.852 403 HB2 LYS 513 HB2 LYS 513 59.818 17.726 4.946 404 HB3 LYS 513 HB3 LYS 513 60.165 17.820 6.669 405 HG2 LYS 513 HG2 LYS 513 62.576 17.877 6.171 406 HG3 LYS 513 HG3 LYS 513 62.223 17.772 4.447 407 HD2 LYS 513 HD2 LYS 513 61.301 20.000 6.279 408 HD3 LYS 513 HD3 LYS 513 62.658 20.096 5.157 409 HE2 LYS 513 HE2 LYS 513 60.901 19.398 3.348 410 HE3 LYS 513 HE3 LYS 513 59.713 19.925 4.539 411 HZ1 LYS 513 HZ1 LYS 513 61.642 21.889 4.463 412 HZ2 LYS 513 HZ2 LYS 513 60.056 21.972 3.860 413 HZ3 LYS 513 HZ3 LYS 513 61.330 21.493 2.843 414 H LYS 514 H LYS 514 59.778 15.478 8.023 415 HA LYS 514 HA LYS 514 62.135 15.552 9.591 416 HB2 LYS 514 HB2 LYS 514 59.617 15.674 10.263 417 HB3 LYS 514 HB3 LYS 514 59.697 13.918 10.283 418 HG2 LYS 514 HG2 LYS 514 61.490 13.967 11.925 419 HG3 LYS 514 HG3 LYS 514 61.558 15.726 11.848 420 HD2 LYS 514 HD2 LYS 514 59.016 14.266 12.596 421 HD3 LYS 514 HD3 LYS 514 60.229 14.684 13.806 422 HE2 LYS 514 HE2 LYS 514 60.048 17.097 12.917 423 HE3 LYS 514 HE3 LYS 514 58.597 16.557 12.078 424 HZ1 LYS 514 HZ1 LYS 514 58.315 17.547 14.371 425 HZ2 LYS 514 HZ2 LYS 514 58.968 16.097 14.967 426 HZ3 LYS 514 HZ3 LYS 514 57.530 16.077 14.064 427 H LYS 515 H LYS 515 60.211 12.958 8.148 428 HA LYS 515 HA LYS 515 61.794 10.772 9.011 429 HB2 LYS 515 HB2 LYS 515 59.989 11.099 6.607 430 HB3 LYS 515 HB3 LYS 515 60.741 9.571 7.060 431 HG2 LYS 515 HG2 LYS 515 59.640 9.967 9.389 432 HG3 LYS 515 HG3 LYS 515 58.638 11.158 8.553 433 HD2 LYS 515 HD2 LYS 515 58.922 8.290 7.597 434 HD3 LYS 515 HD3 LYS 515 57.652 8.815 8.699 435 HE2 LYS 515 HE2 LYS 515 56.929 10.504 7.024 436 HE3 LYS 515 HE3 LYS 515 58.150 9.890 5.908 437 HZ1 LYS 515 HZ1 LYS 515 57.027 7.961 5.583 438 HZ2 LYS 515 HZ2 LYS 515 55.709 8.988 5.876 439 HZ3 LYS 515 HZ3 LYS 515 56.291 7.980 7.109 440 H LEU 516 H LEU 516 61.925 12.829 6.149 441 HA LEU 516 HA LEU 516 63.825 11.443 4.632 442 HB2 LEU 516 HB2 LEU 516 62.617 13.278 3.683 443 HB3 LEU 516 HB3 LEU 516 63.162 14.363 4.943 444 HG LEU 516 HG LEU 516 65.440 14.284 4.105 445 HD11 LEU 516 HD11 LEU 516 65.708 12.085 3.269 446 HD12 LEU 516 HD12 LEU 516 65.738 13.101 1.826 447 HD13 LEU 516 HD13 LEU 516 64.275 12.217 2.250 448 HD21 LEU 516 HD21 LEU 516 63.575 14.693 1.773 449 HD22 LEU 516 HD22 LEU 516 65.094 15.526 2.098 450 HD23 LEU 516 HD23 LEU 516 63.684 15.835 3.119 451 H ASP 517 H ASP 517 64.241 14.004 7.050 452 HA ASP 517 HA ASP 517 67.037 14.143 7.031 453 HB2 ASP 517 HB2 ASP 517 65.603 15.808 8.114 454 HB3 ASP 517 HB3 ASP 517 65.092 14.609 9.300 455 H GLN 518 H GLN 518 64.826 12.236 9.050 456 HA GLN 518 HA GLN 518 66.815 10.968 10.615 457 HB2 GLN 518 HB2 GLN 518 64.007 10.101 9.918 458 HB3 GLN 518 HB3 GLN 518 65.021 9.330 11.142 459 HG2 GLN 518 HG2 GLN 518 64.336 12.278 11.157 460 HG3 GLN 518 HG3 GLN 518 63.426 11.066 12.054 461 HE21 GLN 518 HE21 GLN 518 65.442 13.373 12.815 462 HE22 GLN 518 HE22 GLN 518 66.459 12.609 13.940 463 H THR 519 H THR 519 65.326 10.072 7.547 464 HA THR 519 HA THR 519 66.345 7.440 7.381 465 HB THR 519 HB THR 519 65.792 9.305 5.066 466 HG1 THR 519 HG1 THR 519 63.887 9.392 5.929 467 HG21 THR 519 HG21 THR 519 65.250 6.348 5.242 468 HG22 THR 519 HG22 THR 519 66.841 6.949 4.777 469 HG23 THR 519 HG23 THR 519 65.428 7.350 3.802 470 H ARG 520 H ARG 520 67.558 10.566 6.290 471 HA ARG 520 HA ARG 520 69.862 9.659 4.941 472 HB2 ARG 520 HB2 ARG 520 69.167 12.275 6.269 473 HB3 ARG 520 HB3 ARG 520 70.661 12.026 5.365 474 HG2 ARG 520 HG2 ARG 520 69.386 11.461 3.359 475 HG3 ARG 520 HG3 ARG 520 67.873 11.606 4.256 476 HD2 ARG 520 HD2 ARG 520 68.279 13.674 3.030 477 HD3 ARG 520 HD3 ARG 520 68.438 13.971 4.760 478 HE ARG 520 HE ARG 520 70.965 13.306 3.663 479 HH11 ARG 520 HH11 ARG 520 69.354 15.442 1.921 480 HH12 ARG 520 HH12 ARG 520 70.147 16.882 2.463 481 HH21 ARG 520 HH21 ARG 520 71.672 15.339 5.169 482 HH22 ARG 520 HH22 ARG 520 71.460 16.823 4.303 483 H VAL 521 H VAL 521 69.227 10.457 8.307 484 HA VAL 521 HA VAL 521 71.876 10.528 9.255 485 HB VAL 521 HB VAL 521 69.248 9.824 10.569 486 HG11 VAL 521 HG11 VAL 521 70.850 8.732 11.934 487 HG12 VAL 521 HG12 VAL 521 70.547 10.280 12.721 488 HG13 VAL 521 HG13 VAL 521 72.008 10.052 11.762 489 HG21 VAL 521 HG21 VAL 521 69.182 12.052 11.276 490 HG22 VAL 521 HG22 VAL 521 69.895 12.210 9.673 491 HG23 VAL 521 HG23 VAL 521 70.924 12.267 11.101 492 H GLU 522 H GLU 522 69.529 7.867 9.065 493 HA GLU 522 HA GLU 522 71.182 5.871 10.201 494 HB2 GLU 522 HB2 GLU 522 68.912 5.638 8.208 495 HB3 GLU 522 HB3 GLU 522 69.593 4.300 9.135 496 HG2 GLU 522 HG2 GLU 522 68.379 6.785 10.376 497 HG3 GLU 522 HG3 GLU 522 67.515 5.264 10.161 498 H LEU 523 H LEU 523 70.517 6.809 6.866 499 HA LEU 523 HA LEU 523 72.159 4.899 5.579 500 HB2 LEU 523 HB2 LEU 523 70.391 6.110 4.446 501 HB3 LEU 523 HB3 LEU 523 71.225 7.635 4.708 502 HG LEU 523 HG LEU 523 72.925 5.580 3.389 503 HD11 LEU 523 HD11 LEU 523 71.751 6.046 1.152 504 HD12 LEU 523 HD12 LEU 523 70.364 6.542 2.120 505 HD13 LEU 523 HD13 LEU 523 70.973 4.891 2.236 506 HD21 LEU 523 HD21 LEU 523 73.664 7.442 2.111 507 HD22 LEU 523 HD22 LEU 523 73.341 8.102 3.714 508 HD23 LEU 523 HD23 LEU 523 72.179 8.344 2.411 509 H ALA 524 H ALA 524 72.768 8.238 6.619 510 HA ALA 524 HA ALA 524 75.328 8.498 5.482 511 HB1 ALA 524 HB1 ALA 524 73.958 10.388 6.325 512 HB2 ALA 524 HB2 ALA 524 75.596 10.392 6.981 513 HB3 ALA 524 HB3 ALA 524 74.252 9.831 7.974 514 H ASP 525 H ASP 525 74.255 7.304 8.631 515 HA ASP 525 HA ASP 525 76.845 6.983 9.765 516 HB2 ASP 525 HB2 ASP 525 74.641 7.044 10.997 517 HB3 ASP 525 HB3 ASP 525 74.339 5.414 10.402 518 H GLN 526 H GLN 526 74.721 4.937 7.854 519 HA GLN 526 HA GLN 526 76.157 2.500 8.064 520 HB2 GLN 526 HB2 GLN 526 73.803 2.713 7.301 521 HB3 GLN 526 HB3 GLN 526 74.370 3.516 5.840 522 HG2 GLN 526 HG2 GLN 526 75.700 1.475 5.281 523 HG3 GLN 526 HG3 GLN 526 75.004 0.679 6.693 524 HE21 GLN 526 HE21 GLN 526 73.123 -0.500 6.244 525 HE22 GLN 526 HE22 GLN 526 72.076 -0.190 4.943 526 H VAL 527 H VAL 527 76.269 5.214 5.839 527 HA VAL 527 HA VAL 527 78.127 4.093 3.993 528 HB VAL 527 HB VAL 527 77.227 6.917 4.590 529 HG11 VAL 527 HG11 VAL 527 79.401 7.184 3.654 530 HG12 VAL 527 HG12 VAL 527 78.277 7.397 2.312 531 HG13 VAL 527 HG13 VAL 527 79.144 5.873 2.502 532 HG21 VAL 527 HG21 VAL 527 75.842 6.669 2.681 533 HG22 VAL 527 HG22 VAL 527 75.665 5.151 3.560 534 HG23 VAL 527 HG23 VAL 527 76.707 5.229 2.140 535 H LYS 528 H LYS 528 78.390 6.242 6.770 536 HA LYS 528 HA LYS 528 81.164 6.784 6.574 537 HB2 LYS 528 HB2 LYS 528 79.596 8.177 7.837 538 HB3 LYS 528 HB3 LYS 528 79.305 6.840 8.946 539 HG2 LYS 528 HG2 LYS 528 81.631 6.872 9.675 540 HG3 LYS 528 HG3 LYS 528 82.014 8.110 8.475 541 HD2 LYS 528 HD2 LYS 528 81.702 9.222 10.605 542 HD3 LYS 528 HD3 LYS 528 80.319 9.607 9.580 543 HE2 LYS 528 HE2 LYS 528 78.878 8.178 10.760 544 HE3 LYS 528 HE3 LYS 528 80.206 7.256 11.465 545 HZ1 LYS 528 HZ1 LYS 528 78.908 9.553 12.467 546 HZ2 LYS 528 HZ2 LYS 528 80.560 9.883 12.252 547 HZ3 LYS 528 HZ3 LYS 528 80.071 8.575 13.218 548 H SER 529 H SER 529 79.294 4.389 8.408 549 HA SER 529 HA SER 529 81.560 3.345 9.793 550 HB2 SER 529 HB2 SER 529 78.761 2.305 9.334 551 HB3 SER 529 HB3 SER 529 79.962 1.421 10.273 552 HG SER 529 HG SER 529 78.755 3.918 10.776 553 H ALA 530 H ALA 530 79.901 2.591 6.797 554 HA ALA 530 HA ALA 530 81.301 0.122 6.328 555 HB1 ALA 530 HB1 ALA 530 79.088 0.463 5.377 556 HB2 ALA 530 HB2 ALA 530 80.262 0.276 4.076 557 HB3 ALA 530 HB3 ALA 530 79.656 1.879 4.494 558 H VAL 531 H VAL 531 82.512 3.043 6.563 559 HA VAL 531 HA VAL 531 83.956 3.345 4.098 560 HB VAL 531 HB VAL 531 83.274 5.161 5.776 561 HG11 VAL 531 HG11 VAL 531 85.887 4.472 7.112 562 HG12 VAL 531 HG12 VAL 531 84.363 3.808 7.697 563 HG13 VAL 531 HG13 VAL 531 84.612 5.554 7.674 564 HG21 VAL 531 HG21 VAL 531 84.730 5.618 3.861 565 HG22 VAL 531 HG22 VAL 531 86.131 5.041 4.762 566 HG23 VAL 531 HG23 VAL 531 85.300 6.505 5.274 567 H THR 532 H THR 532 84.224 1.074 6.448 568 HA THR 532 HA THR 532 87.170 0.949 6.413 569 HB THR 532 HB THR 532 86.141 0.790 8.615 570 HG1 THR 532 HG1 THR 532 87.946 -0.443 8.356 571 HG21 THR 532 HG21 THR 532 83.978 -0.293 7.554 572 HG22 THR 532 HG22 THR 532 84.450 -0.705 9.200 573 HG23 THR 532 HG23 THR 532 84.819 -1.807 7.878 574 H GLU 533 H GLU 533 86.412 -2.067 7.063 575 HA GLU 533 HA GLU 533 87.168 -3.068 4.515 576 HB2 GLU 533 HB2 GLU 533 87.669 -4.177 6.689 577 HB3 GLU 533 HB3 GLU 533 85.956 -4.552 6.849 578 HG2 GLU 533 HG2 GLU 533 86.028 -5.846 4.760 579 HG3 GLU 533 HG3 GLU 533 87.735 -5.451 4.567 580 H PHE 534 H PHE 534 85.985 -3.949 2.889 581 HA PHE 534 HA PHE 534 83.052 -3.612 3.082 582 HB2 PHE 534 HB2 PHE 534 84.720 -2.457 1.302 583 HB3 PHE 534 HB3 PHE 534 84.380 -3.942 0.422 584 HD1 PHE 534 HD1 PHE 534 82.776 -1.111 2.202 585 HD2 PHE 534 HD2 PHE 534 82.322 -4.205 -0.735 586 HE1 PHE 534 HE1 PHE 534 80.567 -0.168 1.549 587 HE2 PHE 534 HE2 PHE 534 80.117 -3.272 -1.392 588 HZ PHE 534 HZ PHE 534 79.239 -1.252 -0.248 589 H GLU 535 H GLU 535 84.055 -5.994 4.143 590 HA GLU 535 HA GLU 535 83.818 -8.289 4.009 591 HB2 GLU 535 HB2 GLU 535 81.670 -7.355 2.105 592 HB3 GLU 535 HB3 GLU 535 81.819 -9.009 2.695 593 HG2 GLU 535 HG2 GLU 535 81.491 -8.295 4.977 594 HG3 GLU 535 HG3 GLU 535 81.562 -6.597 4.508 595 H ASN 536 H ASN 536 85.560 -9.258 3.100 596 HA ASN 536 HA ASN 536 87.040 -10.002 1.473 597 HB2 ASN 536 HB2 ASN 536 85.898 -11.411 -0.222 598 HB3 ASN 536 HB3 ASN 536 85.319 -11.706 1.415 599 HD21 ASN 536 HD21 ASN 536 84.474 -10.184 -1.675 600 HD22 ASN 536 HD22 ASN 536 82.814 -10.048 -1.346 601 H VAL 537 H VAL 537 87.515 -7.614 0.991 602 HA VAL 537 HA VAL 537 86.362 -6.360 -1.270 603 HB VAL 537 HB VAL 537 89.085 -6.018 0.011 604 HG11 VAL 537 HG11 VAL 537 89.038 -3.791 -1.156 605 HG12 VAL 537 HG12 VAL 537 87.638 -4.355 -2.069 606 HG13 VAL 537 HG13 VAL 537 89.195 -5.161 -2.256 607 HG21 VAL 537 HG21 VAL 537 86.891 -5.543 1.307 608 HG22 VAL 537 HG22 VAL 537 86.682 -4.195 0.191 609 HG23 VAL 537 HG23 VAL 537 88.092 -4.254 1.246 610 H THR 538 H THR 538 86.610 -6.700 -3.376 611 HA THR 538 HA THR 538 88.603 -8.680 -4.287 612 HB THR 538 HB THR 538 86.567 -9.455 -5.095 613 HG1 THR 538 HG1 THR 538 86.302 -8.669 -7.256 614 HG21 THR 538 HG21 THR 538 84.743 -7.867 -5.847 615 HG22 THR 538 HG22 THR 538 85.742 -6.549 -5.237 616 HG23 THR 538 HG23 THR 538 85.138 -7.781 -4.130 617 HA PRO 539 HA PRO 539 91.182 -6.010 -6.687 618 HB2 PRO 539 HB2 PRO 539 90.311 -6.893 -9.325 619 HB3 PRO 539 HB3 PRO 539 91.798 -7.321 -8.461 620 HG2 PRO 539 HG2 PRO 539 89.244 -8.805 -8.659 621 HG3 PRO 539 HG3 PRO 539 90.883 -9.413 -8.357 622 HD2 PRO 539 HD2 PRO 539 89.060 -9.365 -6.397 623 HD3 PRO 539 HD3 PRO 539 90.757 -8.979 -6.057 624 H THR 540 H THR 540 90.992 -3.960 -7.443 625 HA THR 540 HA THR 540 88.288 -2.935 -7.988 626 HB THR 540 HB THR 540 89.293 -0.749 -7.556 627 HG1 THR 540 HG1 THR 540 91.465 -0.566 -7.187 628 HG21 THR 540 HG21 THR 540 90.221 -2.811 -5.535 629 HG22 THR 540 HG22 THR 540 88.576 -2.185 -5.649 630 HG23 THR 540 HG23 THR 540 89.902 -1.107 -5.214 631 H ASN 541 H ASN 541 87.714 -2.918 -10.080 632 HA ASN 541 HA ASN 541 89.733 -2.786 -12.172 633 HB2 ASN 541 HB2 ASN 541 86.717 -2.971 -12.313 634 HB3 ASN 541 HB3 ASN 541 87.806 -3.039 -13.702 635 HD21 ASN 541 HD21 ASN 541 89.920 -4.564 -12.302 636 HD22 ASN 541 HD22 ASN 541 89.315 -6.135 -12.094 637 H ASP 542 H ASP 542 90.319 -1.077 -13.263 638 HA ASP 542 HA ASP 542 89.219 1.538 -12.564 639 HB2 ASP 542 HB2 ASP 542 91.217 2.331 -13.855 640 HB3 ASP 542 HB3 ASP 542 91.618 1.290 -12.489 641 H GLN 543 H GLN 543 88.450 -0.721 -14.848 642 HA GLN 543 HA GLN 543 87.190 1.250 -16.547 643 HB2 GLN 543 HB2 GLN 543 88.368 0.645 -18.593 644 HB3 GLN 543 HB3 GLN 543 89.527 1.226 -17.395 645 HG2 GLN 543 HG2 GLN 543 89.849 -1.216 -16.719 646 HG3 GLN 543 HG3 GLN 543 88.956 -1.640 -18.177 647 HE21 GLN 543 HE21 GLN 543 91.132 -2.693 -18.757 648 HE22 GLN 543 HE22 GLN 543 92.305 -1.712 -19.495 Start of MODEL 7 1 H1 SER 466 H1 SER 466 27.621 4.575 0.885 2 H2 SER 466 H2 SER 466 28.405 3.893 -0.458 3 H3 SER 466 H3 SER 466 27.238 5.108 -0.678 4 HA SER 466 HA SER 466 29.465 5.996 -0.951 5 HB2 SER 466 HB2 SER 466 27.620 7.390 0.007 6 HB3 SER 466 HB3 SER 466 28.147 6.922 1.621 7 HG SER 466 HG SER 466 30.202 7.830 1.082 8 H ASP 467 H ASP 467 29.074 3.713 1.458 9 HA ASP 467 HA ASP 467 31.173 4.302 3.253 10 HB2 ASP 467 HB2 ASP 467 31.065 1.862 3.780 11 HB3 ASP 467 HB3 ASP 467 29.486 2.649 3.800 12 H ASP 468 H ASP 468 31.086 2.598 0.171 13 HA ASP 468 HA ASP 468 33.776 1.622 0.285 14 HB2 ASP 468 HB2 ASP 468 31.875 0.739 -1.155 15 HB3 ASP 468 HB3 ASP 468 32.124 2.145 -2.185 16 H TYR 469 H TYR 469 35.115 2.285 -1.862 17 HA TYR 469 HA TYR 469 36.487 3.878 -2.806 18 HB2 TYR 469 HB2 TYR 469 34.151 4.490 -3.622 19 HB3 TYR 469 HB3 TYR 469 34.175 5.766 -2.409 20 HD1 TYR 469 HD1 TYR 469 35.664 4.543 -5.546 21 HD2 TYR 469 HD2 TYR 469 35.687 7.672 -2.602 22 HE1 TYR 469 HE1 TYR 469 36.972 5.981 -7.083 23 HE2 TYR 469 HE2 TYR 469 36.998 9.109 -4.141 24 HH TYR 469 HH TYR 469 38.640 8.634 -6.152 25 H VAL 470 H VAL 470 37.725 5.851 -2.369 26 HA VAL 470 HA VAL 470 37.507 6.842 0.425 27 HB VAL 470 HB VAL 470 40.125 6.186 -0.925 28 HG11 VAL 470 HG11 VAL 470 39.261 6.983 1.856 29 HG12 VAL 470 HG12 VAL 470 40.480 7.726 0.825 30 HG13 VAL 470 HG13 VAL 470 40.789 6.159 1.568 31 HG21 VAL 470 HG21 VAL 470 40.128 4.174 0.567 32 HG22 VAL 470 HG22 VAL 470 38.887 4.106 -0.686 33 HG23 VAL 470 HG23 VAL 470 38.445 4.520 0.970 34 H ASP 471 H ASP 471 38.601 8.889 0.803 35 HA ASP 471 HA ASP 471 38.028 10.817 -1.187 36 HB2 ASP 471 HB2 ASP 471 39.659 10.943 1.351 37 HB3 ASP 471 HB3 ASP 471 39.362 12.349 0.332 38 H GLU 472 H GLU 472 39.364 11.988 -2.538 39 HA GLU 472 HA GLU 472 41.477 10.683 -3.811 40 HB2 GLU 472 HB2 GLU 472 40.559 13.546 -3.782 41 HB3 GLU 472 HB3 GLU 472 41.928 13.029 -4.768 42 HG2 GLU 472 HG2 GLU 472 39.237 11.661 -4.879 43 HG3 GLU 472 HG3 GLU 472 39.653 13.015 -5.927 44 H GLU 473 H GLU 473 41.571 13.136 -1.247 45 HA GLU 473 HA GLU 473 44.347 13.614 -1.364 46 HB2 GLU 473 HB2 GLU 473 43.124 15.225 -0.211 47 HB3 GLU 473 HB3 GLU 473 42.152 14.026 0.633 48 HG2 GLU 473 HG2 GLU 473 43.936 13.470 2.099 49 HG3 GLU 473 HG3 GLU 473 45.102 14.375 1.133 50 H THR 474 H THR 474 42.405 11.475 0.686 51 HA THR 474 HA THR 474 44.573 10.275 2.078 52 HB THR 474 HB THR 474 41.709 9.543 1.515 53 HG1 THR 474 HG1 THR 474 43.201 10.548 3.662 54 HG21 THR 474 HG21 THR 474 42.019 7.728 3.256 55 HG22 THR 474 HG22 THR 474 43.758 7.915 3.015 56 HG23 THR 474 HG23 THR 474 42.730 7.400 1.675 57 H TYR 475 H TYR 475 42.696 9.377 -0.765 58 HA TYR 475 HA TYR 475 43.852 6.870 -1.202 59 HB2 TYR 475 HB2 TYR 475 41.731 7.828 -2.198 60 HB3 TYR 475 HB3 TYR 475 42.759 8.721 -3.322 61 HD1 TYR 475 HD1 TYR 475 42.297 5.298 -1.936 62 HD2 TYR 475 HD2 TYR 475 43.306 7.692 -5.349 63 HE1 TYR 475 HE1 TYR 475 42.445 3.242 -3.329 64 HE2 TYR 475 HE2 TYR 475 43.463 5.646 -6.748 65 HH TYR 475 HH TYR 475 42.703 3.379 -6.777 66 H ASN 476 H ASN 476 44.693 10.041 -2.608 67 HA ASN 476 HA ASN 476 46.835 8.994 -4.186 68 HB2 ASN 476 HB2 ASN 476 46.521 11.817 -3.144 69 HB3 ASN 476 HB3 ASN 476 47.468 11.286 -4.538 70 HD21 ASN 476 HD21 ASN 476 44.710 9.392 -4.522 71 HD22 ASN 476 HD22 ASN 476 43.737 10.323 -5.557 72 H LEU 477 H LEU 477 46.547 10.309 -0.923 73 HA LEU 477 HA LEU 477 49.258 10.568 -0.276 74 HB2 LEU 477 HB2 LEU 477 47.413 11.319 1.185 75 HB3 LEU 477 HB3 LEU 477 46.952 9.648 1.464 76 HG LEU 477 HG LEU 477 49.219 9.230 2.449 77 HD11 LEU 477 HD11 LEU 477 50.642 10.887 1.572 78 HD12 LEU 477 HD12 LEU 477 50.348 11.467 3.208 79 HD13 LEU 477 HD13 LEU 477 49.474 12.177 1.852 80 HD21 LEU 477 HD21 LEU 477 47.538 11.424 3.680 81 HD22 LEU 477 HD22 LEU 477 48.730 10.457 4.550 82 HD23 LEU 477 HD23 LEU 477 47.295 9.689 3.875 83 H GLN 478 H GLN 478 47.070 7.745 -0.143 84 HA GLN 478 HA GLN 478 48.908 5.896 0.907 85 HB2 GLN 478 HB2 GLN 478 46.554 5.553 -0.956 86 HB3 GLN 478 HB3 GLN 478 47.463 4.193 -0.301 87 HG2 GLN 478 HG2 GLN 478 46.199 6.331 1.422 88 HG3 GLN 478 HG3 GLN 478 45.390 4.823 1.002 89 HE21 GLN 478 HE21 GLN 478 46.818 6.062 3.569 90 HE22 GLN 478 HE22 GLN 478 47.677 4.723 4.163 91 H LYS 479 H LYS 479 48.232 6.896 -2.412 92 HA LYS 479 HA LYS 479 49.960 5.037 -3.686 93 HB2 LYS 479 HB2 LYS 479 48.899 7.734 -4.570 94 HB3 LYS 479 HB3 LYS 479 49.774 6.614 -5.626 95 HG2 LYS 479 HG2 LYS 479 48.002 4.861 -4.924 96 HG3 LYS 479 HG3 LYS 479 47.067 6.230 -4.326 97 HD2 LYS 479 HD2 LYS 479 48.136 6.054 -7.156 98 HD3 LYS 479 HD3 LYS 479 46.527 5.519 -6.696 99 HE2 LYS 479 HE2 LYS 479 45.952 7.773 -5.954 100 HE3 LYS 479 HE3 LYS 479 47.581 8.334 -6.317 101 HZ1 LYS 479 HZ1 LYS 479 46.188 6.976 -8.467 102 HZ2 LYS 479 HZ2 LYS 479 47.200 8.340 -8.515 103 HZ3 LYS 479 HZ3 LYS 479 45.576 8.498 -8.037 104 H LEU 480 H LEU 480 50.397 8.350 -2.541 105 HA LEU 480 HA LEU 480 52.942 8.811 -3.645 106 HB2 LEU 480 HB2 LEU 480 51.300 10.007 -1.450 107 HB3 LEU 480 HB3 LEU 480 53.012 10.413 -1.491 108 HG LEU 480 HG LEU 480 52.741 11.138 -3.863 109 HD11 LEU 480 HD11 LEU 480 49.761 11.121 -3.420 110 HD12 LEU 480 HD12 LEU 480 50.562 9.737 -4.157 111 HD13 LEU 480 HD13 LEU 480 50.653 11.311 -4.924 112 HD21 LEU 480 HD21 LEU 480 52.729 12.841 -2.218 113 HD22 LEU 480 HD22 LEU 480 51.108 12.415 -1.665 114 HD23 LEU 480 HD23 LEU 480 51.333 13.191 -3.236 115 H LEU 481 H LEU 481 51.985 7.466 -0.504 116 HA LEU 481 HA LEU 481 54.617 7.294 0.563 117 HB2 LEU 481 HB2 LEU 481 52.100 5.807 1.338 118 HB3 LEU 481 HB3 LEU 481 53.546 5.987 2.329 119 HG LEU 481 HG LEU 481 51.929 8.323 1.298 120 HD11 LEU 481 HD11 LEU 481 51.190 8.480 3.729 121 HD12 LEU 481 HD12 LEU 481 51.793 6.833 3.917 122 HD13 LEU 481 HD13 LEU 481 50.478 7.166 2.791 123 HD21 LEU 481 HD21 LEU 481 54.250 8.035 3.184 124 HD22 LEU 481 HD22 LEU 481 53.158 9.417 3.274 125 HD23 LEU 481 HD23 LEU 481 54.075 9.123 1.808 126 H ALA 482 H ALA 482 52.507 4.978 -1.073 127 HA ALA 482 HA ALA 482 53.473 2.553 -0.718 128 HB1 ALA 482 HB1 ALA 482 52.096 2.318 -2.490 129 HB2 ALA 482 HB2 ALA 482 53.488 2.643 -3.521 130 HB3 ALA 482 HB3 ALA 482 52.424 3.959 -3.033 131 HA PRO 483 HA PRO 483 57.349 2.919 -3.769 132 HB2 PRO 483 HB2 PRO 483 58.282 5.639 -3.396 133 HB3 PRO 483 HB3 PRO 483 57.757 4.863 -4.897 134 HG2 PRO 483 HG2 PRO 483 56.243 6.602 -3.062 135 HG3 PRO 483 HG3 PRO 483 56.011 6.329 -4.794 136 HD2 PRO 483 HD2 PRO 483 54.291 5.351 -2.976 137 HD3 PRO 483 HD3 PRO 483 54.699 4.420 -4.435 138 H TYR 484 H TYR 484 57.504 5.394 -1.198 139 HA TYR 484 HA TYR 484 59.957 4.536 -0.110 140 HB2 TYR 484 HB2 TYR 484 59.335 6.729 0.398 141 HB3 TYR 484 HB3 TYR 484 57.697 6.264 0.879 142 HD1 TYR 484 HD1 TYR 484 61.298 6.056 1.888 143 HD2 TYR 484 HD2 TYR 484 57.205 5.675 3.146 144 HE1 TYR 484 HE1 TYR 484 62.027 5.854 4.251 145 HE2 TYR 484 HE2 TYR 484 57.946 5.469 5.498 146 HH TYR 484 HH TYR 484 59.809 4.998 6.807 147 H HIS 485 H HIS 485 56.623 3.714 0.664 148 HA HIS 485 HA HIS 485 57.088 2.233 3.013 149 HB2 HIS 485 HB2 HIS 485 54.863 3.005 2.210 150 HB3 HIS 485 HB3 HIS 485 54.946 1.803 0.925 151 HD1 HIS 485 HD1 HIS 485 54.611 -0.669 1.566 152 HD2 HIS 485 HD2 HIS 485 54.451 1.920 4.832 153 HE1 HIS 485 HE1 HIS 485 53.687 -2.013 3.502 154 H LYS 486 H LYS 486 57.389 1.437 -0.378 155 HA LYS 486 HA LYS 486 57.790 -1.413 0.130 156 HB2 LYS 486 HB2 LYS 486 57.946 0.275 -2.385 157 HB3 LYS 486 HB3 LYS 486 58.143 -1.476 -2.345 158 HG2 LYS 486 HG2 LYS 486 55.885 -1.760 -1.481 159 HG3 LYS 486 HG3 LYS 486 55.673 -0.017 -1.354 160 HD2 LYS 486 HD2 LYS 486 55.941 0.192 -3.803 161 HD3 LYS 486 HD3 LYS 486 56.131 -1.558 -3.928 162 HE2 LYS 486 HE2 LYS 486 53.877 -1.879 -2.989 163 HE3 LYS 486 HE3 LYS 486 53.688 -0.132 -2.834 164 HZ1 LYS 486 HZ1 LYS 486 53.083 -1.673 -5.031 165 HZ2 LYS 486 HZ2 LYS 486 54.499 -0.838 -5.459 166 HZ3 LYS 486 HZ3 LYS 486 53.122 0.021 -4.954 167 H ALA 487 H ALA 487 59.645 1.439 0.042 168 HA ALA 487 HA ALA 487 62.098 0.443 -0.968 169 HB1 ALA 487 HB1 ALA 487 63.056 2.485 -0.145 170 HB2 ALA 487 HB2 ALA 487 61.701 2.741 0.951 171 HB3 ALA 487 HB3 ALA 487 61.459 2.860 -0.791 172 H LYS 488 H LYS 488 63.082 -1.222 -0.072 173 HA LYS 488 HA LYS 488 63.136 -1.580 2.846 174 HB2 LYS 488 HB2 LYS 488 64.170 -3.756 2.318 175 HB3 LYS 488 HB3 LYS 488 62.640 -3.542 1.466 176 HG2 LYS 488 HG2 LYS 488 63.923 -2.755 -0.532 177 HG3 LYS 488 HG3 LYS 488 65.414 -3.135 0.326 178 HD2 LYS 488 HD2 LYS 488 64.719 -5.489 0.516 179 HD3 LYS 488 HD3 LYS 488 63.217 -5.115 -0.330 180 HE2 LYS 488 HE2 LYS 488 64.508 -4.392 -2.310 181 HE3 LYS 488 HE3 LYS 488 66.009 -4.779 -1.468 182 HZ1 LYS 488 HZ1 LYS 488 63.837 -6.700 -2.102 183 HZ2 LYS 488 HZ2 LYS 488 65.282 -7.072 -1.290 184 HZ3 LYS 488 HZ3 LYS 488 65.321 -6.583 -2.917 185 H THR 489 H THR 489 65.022 -0.121 0.446 186 HA THR 489 HA THR 489 67.536 -0.513 1.977 187 HB THR 489 HB THR 489 68.460 0.656 -0.198 188 HG1 THR 489 HG1 THR 489 66.876 -0.343 -1.878 189 HG21 THR 489 HG21 THR 489 67.538 -2.183 0.177 190 HG22 THR 489 HG22 THR 489 69.181 -1.536 0.105 191 HG23 THR 489 HG23 THR 489 68.229 -1.688 -1.371 192 H LEU 490 H LEU 490 68.549 1.162 2.960 193 HA LEU 490 HA LEU 490 67.167 3.510 3.637 194 HB2 LEU 490 HB2 LEU 490 70.049 2.647 3.810 195 HB3 LEU 490 HB3 LEU 490 69.559 4.261 4.325 196 HG LEU 490 HG LEU 490 67.888 3.239 5.850 197 HD11 LEU 490 HD11 LEU 490 69.066 0.700 4.720 198 HD12 LEU 490 HD12 LEU 490 67.367 1.157 4.846 199 HD13 LEU 490 HD13 LEU 490 68.271 0.725 6.294 200 HD21 LEU 490 HD21 LEU 490 69.582 2.231 7.435 201 HD22 LEU 490 HD22 LEU 490 70.048 3.802 6.782 202 HD23 LEU 490 HD23 LEU 490 70.763 2.329 6.129 203 H GLU 491 H GLU 491 69.704 2.933 1.214 204 HA GLU 491 HA GLU 491 70.148 5.546 0.328 205 HB2 GLU 491 HB2 GLU 491 71.482 3.582 -0.355 206 HB3 GLU 491 HB3 GLU 491 70.111 2.977 -1.279 207 HG2 GLU 491 HG2 GLU 491 71.595 4.080 -2.815 208 HG3 GLU 491 HG3 GLU 491 70.183 5.109 -2.630 209 H ARG 492 H ARG 492 67.739 3.189 -0.650 210 HA ARG 492 HA ARG 492 66.522 4.823 -2.644 211 HB2 ARG 492 HB2 ARG 492 66.311 2.403 -2.712 212 HB3 ARG 492 HB3 ARG 492 65.462 2.417 -1.166 213 HG2 ARG 492 HG2 ARG 492 63.599 3.638 -2.108 214 HG3 ARG 492 HG3 ARG 492 64.482 3.907 -3.615 215 HD2 ARG 492 HD2 ARG 492 64.384 1.599 -4.198 216 HD3 ARG 492 HD3 ARG 492 63.852 1.138 -2.583 217 HE ARG 492 HE ARG 492 61.956 2.916 -3.661 218 HH11 ARG 492 HH11 ARG 492 62.912 0.907 -5.913 219 HH12 ARG 492 HH12 ARG 492 61.615 -0.238 -5.841 220 HH21 ARG 492 HH21 ARG 492 60.400 0.923 -2.811 221 HH22 ARG 492 HH22 ARG 492 60.196 -0.228 -4.088 222 H GLN 493 H GLN 493 65.843 4.191 0.770 223 HA GLN 493 HA GLN 493 63.348 5.409 0.948 224 HB2 GLN 493 HB2 GLN 493 65.631 5.153 2.895 225 HB3 GLN 493 HB3 GLN 493 64.121 5.933 3.349 226 HG2 GLN 493 HG2 GLN 493 62.861 3.933 2.895 227 HG3 GLN 493 HG3 GLN 493 64.253 3.152 2.158 228 HE21 GLN 493 HE21 GLN 493 63.414 1.558 4.046 229 HE22 GLN 493 HE22 GLN 493 64.232 1.742 5.522 230 H VAL 494 H VAL 494 66.585 6.871 1.256 231 HA VAL 494 HA VAL 494 65.700 9.496 1.766 232 HB VAL 494 HB VAL 494 68.214 8.466 0.433 233 HG11 VAL 494 HG11 VAL 494 67.407 11.225 1.361 234 HG12 VAL 494 HG12 VAL 494 68.013 10.747 -0.226 235 HG13 VAL 494 HG13 VAL 494 69.095 10.751 1.167 236 HG21 VAL 494 HG21 VAL 494 68.047 7.690 2.702 237 HG22 VAL 494 HG22 VAL 494 67.487 9.266 3.262 238 HG23 VAL 494 HG23 VAL 494 69.154 9.064 2.721 239 H TYR 495 H TYR 495 66.509 7.822 -1.258 240 HA TYR 495 HA TYR 495 66.055 9.960 -3.040 241 HB2 TYR 495 HB2 TYR 495 67.218 8.012 -3.769 242 HB3 TYR 495 HB3 TYR 495 65.879 6.966 -3.319 243 HD1 TYR 495 HD1 TYR 495 66.646 9.893 -5.554 244 HD2 TYR 495 HD2 TYR 495 64.359 6.299 -4.960 245 HE1 TYR 495 HE1 TYR 495 65.704 10.108 -7.841 246 HE2 TYR 495 HE2 TYR 495 63.423 6.516 -7.240 247 HH TYR 495 HH TYR 495 64.422 9.177 -9.397 248 H GLU 496 H GLU 496 63.837 7.381 -1.958 249 HA GLU 496 HA GLU 496 61.624 8.276 -3.475 250 HB2 GLU 496 HB2 GLU 496 61.723 6.642 -0.935 251 HB3 GLU 496 HB3 GLU 496 60.284 6.867 -1.932 252 HG2 GLU 496 HG2 GLU 496 62.885 5.724 -2.988 253 HG3 GLU 496 HG3 GLU 496 61.548 4.732 -2.409 254 H LEU 497 H LEU 497 62.739 9.009 -0.204 255 HA LEU 497 HA LEU 497 60.475 10.496 0.589 256 HB2 LEU 497 HB2 LEU 497 63.353 10.463 1.454 257 HB3 LEU 497 HB3 LEU 497 62.204 11.589 2.176 258 HG LEU 497 HG LEU 497 61.719 8.597 2.015 259 HD11 LEU 497 HD11 LEU 497 62.489 9.966 4.573 260 HD12 LEU 497 HD12 LEU 497 63.752 9.439 3.463 261 HD13 LEU 497 HD13 LEU 497 62.621 8.267 4.131 262 HD21 LEU 497 HD21 LEU 497 59.615 9.424 2.459 263 HD22 LEU 497 HD22 LEU 497 60.220 10.933 3.132 264 HD23 LEU 497 HD23 LEU 497 60.222 9.470 4.110 265 H GLU 498 H GLU 498 63.410 11.392 -1.178 266 HA GLU 498 HA GLU 498 63.057 14.182 -1.158 267 HB2 GLU 498 HB2 GLU 498 64.376 12.300 -3.107 268 HB3 GLU 498 HB3 GLU 498 64.366 14.045 -3.363 269 HG2 GLU 498 HG2 GLU 498 65.564 14.440 -1.331 270 HG3 GLU 498 HG3 GLU 498 65.342 12.780 -0.791 271 H LYS 499 H LYS 499 61.902 11.711 -3.479 272 HA LYS 499 HA LYS 499 60.537 13.581 -5.182 273 HB2 LYS 499 HB2 LYS 499 60.554 10.602 -4.783 274 HB3 LYS 499 HB3 LYS 499 59.226 11.298 -5.708 275 HG2 LYS 499 HG2 LYS 499 61.091 10.617 -7.173 276 HG3 LYS 499 HG3 LYS 499 60.823 12.357 -7.242 277 HD2 LYS 499 HD2 LYS 499 62.684 12.702 -5.638 278 HD3 LYS 499 HD3 LYS 499 62.956 10.957 -5.594 279 HE2 LYS 499 HE2 LYS 499 64.509 12.016 -7.175 280 HE3 LYS 499 HE3 LYS 499 63.370 10.986 -8.044 281 HZ1 LYS 499 HZ1 LYS 499 62.041 12.917 -8.558 282 HZ2 LYS 499 HZ2 LYS 499 63.634 13.158 -9.097 283 HZ3 LYS 499 HZ3 LYS 499 63.091 13.919 -7.679 284 H LEU 500 H LEU 500 59.429 11.468 -2.543 285 HA LEU 500 HA LEU 500 56.717 12.212 -2.649 286 HB2 LEU 500 HB2 LEU 500 58.473 10.949 -0.583 287 HB3 LEU 500 HB3 LEU 500 56.854 11.458 -0.136 288 HG LEU 500 HG LEU 500 55.818 9.945 -1.611 289 HD11 LEU 500 HD11 LEU 500 58.444 9.905 -3.077 290 HD12 LEU 500 HD12 LEU 500 56.837 10.193 -3.712 291 HD13 LEU 500 HD13 LEU 500 57.328 8.576 -3.255 292 HD21 LEU 500 HD21 LEU 500 56.814 7.774 -1.057 293 HD22 LEU 500 HD22 LEU 500 56.924 8.865 0.323 294 HD23 LEU 500 HD23 LEU 500 58.345 8.562 -0.675 295 H GLN 501 H GLN 501 59.454 13.587 -0.875 296 HA GLN 501 HA GLN 501 58.046 15.390 0.734 297 HB2 GLN 501 HB2 GLN 501 60.819 15.323 -0.425 298 HB3 GLN 501 HB3 GLN 501 60.275 16.783 0.398 299 HG2 GLN 501 HG2 GLN 501 60.071 14.033 1.650 300 HG3 GLN 501 HG3 GLN 501 61.471 15.083 1.872 301 HE21 GLN 501 HE21 GLN 501 58.470 14.313 3.208 302 HE22 GLN 501 HE22 GLN 501 58.232 15.724 4.115 303 H GLU 502 H GLU 502 58.859 15.512 -2.653 304 HA GLU 502 HA GLU 502 58.178 18.301 -2.989 305 HB2 GLU 502 HB2 GLU 502 59.897 17.150 -4.351 306 HB3 GLU 502 HB3 GLU 502 58.651 16.098 -5.011 307 HG2 GLU 502 HG2 GLU 502 59.060 17.849 -6.599 308 HG3 GLU 502 HG3 GLU 502 57.483 18.151 -5.882 309 H LYS 503 H LYS 503 56.551 15.227 -3.217 310 HA LYS 503 HA LYS 503 54.201 16.472 -4.533 311 HB2 LYS 503 HB2 LYS 503 54.990 13.600 -4.061 312 HB3 LYS 503 HB3 LYS 503 53.511 14.110 -4.876 313 HG2 LYS 503 HG2 LYS 503 54.854 15.322 -6.556 314 HG3 LYS 503 HG3 LYS 503 56.333 14.797 -5.758 315 HD2 LYS 503 HD2 LYS 503 54.261 12.849 -6.792 316 HD3 LYS 503 HD3 LYS 503 55.603 13.414 -7.784 317 HE2 LYS 503 HE2 LYS 503 57.140 12.630 -5.874 318 HE3 LYS 503 HE3 LYS 503 55.729 11.789 -5.233 319 HZ1 LYS 503 HZ1 LYS 503 56.251 11.405 -8.055 320 HZ2 LYS 503 HZ2 LYS 503 55.751 10.290 -6.875 321 HZ3 LYS 503 HZ3 LYS 503 57.389 10.721 -7.001 322 H LEU 504 H LEU 504 55.237 15.142 -1.509 323 HA LEU 504 HA LEU 504 52.757 14.362 -0.491 324 HB2 LEU 504 HB2 LEU 504 55.384 15.043 0.713 325 HB3 LEU 504 HB3 LEU 504 53.996 14.842 1.777 326 HG LEU 504 HG LEU 504 54.956 12.777 -0.230 327 HD11 LEU 504 HD11 LEU 504 55.271 12.996 2.777 328 HD12 LEU 504 HD12 LEU 504 56.562 13.022 1.576 329 HD13 LEU 504 HD13 LEU 504 55.639 11.542 1.851 330 HD21 LEU 504 HD21 LEU 504 52.575 12.981 1.570 331 HD22 LEU 504 HD22 LEU 504 53.383 11.419 1.536 332 HD23 LEU 504 HD23 LEU 504 52.758 12.118 0.051 333 HA PRO 505 HA PRO 505 50.771 18.486 -0.221 334 HB2 PRO 505 HB2 PRO 505 49.245 17.409 2.026 335 HB3 PRO 505 HB3 PRO 505 48.674 17.804 0.396 336 HG2 PRO 505 HG2 PRO 505 49.568 15.191 1.480 337 HG3 PRO 505 HG3 PRO 505 48.443 15.537 0.165 338 HD2 PRO 505 HD2 PRO 505 50.819 14.562 -0.355 339 HD3 PRO 505 HD3 PRO 505 50.177 15.860 -1.376 340 H GLU 506 H GLU 506 51.027 20.200 1.133 341 HA GLU 506 HA GLU 506 53.244 20.677 2.534 342 HB2 GLU 506 HB2 GLU 506 50.479 21.735 3.139 343 HB3 GLU 506 HB3 GLU 506 51.961 22.420 3.809 344 HG2 GLU 506 HG2 GLU 506 52.807 22.873 1.559 345 HG3 GLU 506 HG3 GLU 506 51.388 22.107 0.845 346 H LYS 507 H LYS 507 50.253 19.947 4.360 347 HA LYS 507 HA LYS 507 51.439 19.692 6.851 348 HB2 LYS 507 HB2 LYS 507 49.446 18.090 7.303 349 HB3 LYS 507 HB3 LYS 507 49.090 19.752 6.826 350 HG2 LYS 507 HG2 LYS 507 48.723 19.092 4.533 351 HG3 LYS 507 HG3 LYS 507 49.283 17.457 4.871 352 HD2 LYS 507 HD2 LYS 507 47.388 17.112 6.393 353 HD3 LYS 507 HD3 LYS 507 46.835 18.761 6.084 354 HE2 LYS 507 HE2 LYS 507 46.459 18.270 3.751 355 HE3 LYS 507 HE3 LYS 507 47.206 16.684 3.915 356 HZ1 LYS 507 HZ1 LYS 507 45.222 15.885 4.455 357 HZ2 LYS 507 HZ2 LYS 507 44.533 17.437 4.407 358 HZ3 LYS 507 HZ3 LYS 507 45.218 16.854 5.847 359 H TYR 508 H TYR 508 51.394 17.407 4.203 360 HA TYR 508 HA TYR 508 52.451 15.260 5.906 361 HB2 TYR 508 HB2 TYR 508 51.557 15.458 3.036 362 HB3 TYR 508 HB3 TYR 508 52.521 14.088 3.585 363 HD1 TYR 508 HD1 TYR 508 51.728 12.731 5.532 364 HD2 TYR 508 HD2 TYR 508 49.236 15.572 3.527 365 HE1 TYR 508 HE1 TYR 508 49.728 11.654 6.512 366 HE2 TYR 508 HE2 TYR 508 47.219 14.480 4.482 367 HH TYR 508 HH TYR 508 47.486 11.529 6.434 368 H LYS 509 H LYS 509 53.462 17.752 3.777 369 HA LYS 509 HA LYS 509 55.923 16.682 2.897 370 HB2 LYS 509 HB2 LYS 509 54.790 18.712 1.980 371 HB3 LYS 509 HB3 LYS 509 55.221 19.568 3.457 372 HG2 LYS 509 HG2 LYS 509 57.594 19.196 3.021 373 HG3 LYS 509 HG3 LYS 509 57.193 18.279 1.564 374 HD2 LYS 509 HD2 LYS 509 56.075 20.267 0.619 375 HD3 LYS 509 HD3 LYS 509 56.487 21.183 2.068 376 HE2 LYS 509 HE2 LYS 509 58.171 21.764 0.514 377 HE3 LYS 509 HE3 LYS 509 58.936 20.549 1.540 378 HZ1 LYS 509 HZ1 LYS 509 59.036 20.355 -1.041 379 HZ2 LYS 509 HZ2 LYS 509 57.488 19.682 -0.858 380 HZ3 LYS 509 HZ3 LYS 509 58.823 18.968 -0.087 381 H ALA 510 H ALA 510 55.082 18.785 5.642 382 HA ALA 510 HA ALA 510 57.649 19.051 6.727 383 HB1 ALA 510 HB1 ALA 510 56.521 19.703 8.792 384 HB2 ALA 510 HB2 ALA 510 55.005 19.044 8.177 385 HB3 ALA 510 HB3 ALA 510 55.742 20.440 7.392 386 H GLU 511 H GLU 511 55.078 16.750 7.609 387 HA GLU 511 HA GLU 511 56.435 15.388 9.651 388 HB2 GLU 511 HB2 GLU 511 54.059 15.121 9.176 389 HB3 GLU 511 HB3 GLU 511 54.427 14.378 7.624 390 HG2 GLU 511 HG2 GLU 511 55.500 12.487 8.742 391 HG3 GLU 511 HG3 GLU 511 55.253 13.253 10.313 392 H TYR 512 H TYR 512 56.442 14.683 6.159 393 HA TYR 512 HA TYR 512 58.203 12.418 6.511 394 HB2 TYR 512 HB2 TYR 512 56.933 13.818 4.175 395 HB3 TYR 512 HB3 TYR 512 58.246 12.668 3.892 396 HD1 TYR 512 HD1 TYR 512 54.984 13.044 5.693 397 HD2 TYR 512 HD2 TYR 512 57.816 10.356 3.903 398 HE1 TYR 512 HE1 TYR 512 53.423 11.148 6.065 399 HE2 TYR 512 HE2 TYR 512 56.266 8.463 4.291 400 HH TYR 512 HH TYR 512 52.991 8.986 5.479 401 H LYS 513 H LYS 513 58.626 15.818 6.062 402 HA LYS 513 HA LYS 513 61.229 15.725 4.900 403 HB2 LYS 513 HB2 LYS 513 59.593 17.731 5.207 404 HB3 LYS 513 HB3 LYS 513 60.343 17.907 6.782 405 HG2 LYS 513 HG2 LYS 513 62.546 18.094 5.728 406 HG3 LYS 513 HG3 LYS 513 61.830 17.841 4.140 407 HD2 LYS 513 HD2 LYS 513 61.176 20.146 5.986 408 HD3 LYS 513 HD3 LYS 513 62.258 20.227 4.596 409 HE2 LYS 513 HE2 LYS 513 60.224 19.321 3.240 410 HE3 LYS 513 HE3 LYS 513 59.265 19.842 4.626 411 HZ1 LYS 513 HZ1 LYS 513 59.404 21.569 2.967 412 HZ2 LYS 513 HZ2 LYS 513 61.102 21.561 3.064 413 HZ3 LYS 513 HZ3 LYS 513 60.173 22.049 4.401 414 H LYS 514 H LYS 514 59.906 15.600 8.121 415 HA LYS 514 HA LYS 514 62.311 15.765 9.605 416 HB2 LYS 514 HB2 LYS 514 59.826 15.857 10.365 417 HB3 LYS 514 HB3 LYS 514 59.923 14.101 10.396 418 HG2 LYS 514 HG2 LYS 514 61.753 14.172 11.984 419 HG3 LYS 514 HG3 LYS 514 61.825 15.929 11.881 420 HD2 LYS 514 HD2 LYS 514 59.274 14.530 12.701 421 HD3 LYS 514 HD3 LYS 514 60.537 14.874 13.885 422 HE2 LYS 514 HE2 LYS 514 60.435 17.307 13.068 423 HE3 LYS 514 HE3 LYS 514 58.958 16.854 12.224 424 HZ1 LYS 514 HZ1 LYS 514 58.728 17.790 14.544 425 HZ2 LYS 514 HZ2 LYS 514 59.333 16.304 15.099 426 HZ3 LYS 514 HZ3 LYS 514 57.886 16.357 14.208 427 H LYS 515 H LYS 515 60.440 13.109 8.230 428 HA LYS 515 HA LYS 515 62.064 10.965 9.116 429 HB2 LYS 515 HB2 LYS 515 60.342 11.188 6.630 430 HB3 LYS 515 HB3 LYS 515 60.983 9.687 7.297 431 HG2 LYS 515 HG2 LYS 515 59.732 10.091 9.397 432 HG3 LYS 515 HG3 LYS 515 59.088 11.586 8.724 433 HD2 LYS 515 HD2 LYS 515 57.370 10.009 8.314 434 HD3 LYS 515 HD3 LYS 515 58.213 10.123 6.773 435 HE2 LYS 515 HE2 LYS 515 59.332 8.081 7.095 436 HE3 LYS 515 HE3 LYS 515 58.945 8.028 8.813 437 HZ1 LYS 515 HZ1 LYS 515 56.800 7.406 8.410 438 HZ2 LYS 515 HZ2 LYS 515 57.576 6.647 7.103 439 HZ3 LYS 515 HZ3 LYS 515 56.752 8.113 6.870 440 H LEU 516 H LEU 516 62.130 12.975 6.205 441 HA LEU 516 HA LEU 516 64.094 11.630 4.725 442 HB2 LEU 516 HB2 LEU 516 62.804 13.369 3.709 443 HB3 LEU 516 HB3 LEU 516 63.283 14.524 4.935 444 HG LEU 516 HG LEU 516 65.599 14.474 4.110 445 HD11 LEU 516 HD11 LEU 516 64.444 12.412 2.236 446 HD12 LEU 516 HD12 LEU 516 65.884 12.287 3.252 447 HD13 LEU 516 HD13 LEU 516 65.899 13.322 1.823 448 HD21 LEU 516 HD21 LEU 516 65.229 15.778 2.179 449 HD22 LEU 516 HD22 LEU 516 63.754 15.980 3.130 450 HD23 LEU 516 HD23 LEU 516 63.778 14.876 1.748 451 H ASP 517 H ASP 517 64.394 14.270 7.071 452 HA ASP 517 HA ASP 517 67.181 14.540 6.995 453 HB2 ASP 517 HB2 ASP 517 65.149 15.043 9.168 454 HB3 ASP 517 HB3 ASP 517 66.850 15.470 9.332 455 H GLN 518 H GLN 518 65.094 12.606 9.131 456 HA GLN 518 HA GLN 518 67.200 11.455 10.646 457 HB2 GLN 518 HB2 GLN 518 64.392 10.467 10.126 458 HB3 GLN 518 HB3 GLN 518 65.491 9.796 11.335 459 HG2 GLN 518 HG2 GLN 518 64.673 12.712 11.244 460 HG3 GLN 518 HG3 GLN 518 63.878 11.507 12.253 461 HE21 GLN 518 HE21 GLN 518 65.830 13.946 12.765 462 HE22 GLN 518 HE22 GLN 518 66.941 13.289 13.869 463 H THR 519 H THR 519 65.599 10.439 7.673 464 HA THR 519 HA THR 519 66.690 7.833 7.524 465 HB THR 519 HB THR 519 65.932 9.669 5.236 466 HG1 THR 519 HG1 THR 519 64.413 8.091 7.005 467 HG21 THR 519 HG21 THR 519 65.675 7.738 3.930 468 HG22 THR 519 HG22 THR 519 65.604 6.681 5.339 469 HG23 THR 519 HG23 THR 519 67.138 7.393 4.847 470 H ARG 520 H ARG 520 67.800 10.963 6.321 471 HA ARG 520 HA ARG 520 70.061 10.058 4.902 472 HB2 ARG 520 HB2 ARG 520 69.357 12.685 6.205 473 HB3 ARG 520 HB3 ARG 520 70.835 12.456 5.266 474 HG2 ARG 520 HG2 ARG 520 69.546 11.828 3.308 475 HG3 ARG 520 HG3 ARG 520 68.045 11.884 4.226 476 HD2 ARG 520 HD2 ARG 520 68.365 14.282 4.623 477 HD3 ARG 520 HD3 ARG 520 69.884 14.237 3.727 478 HE ARG 520 HE ARG 520 67.681 13.220 2.187 479 HH11 ARG 520 HH11 ARG 520 67.200 16.097 3.446 480 HH12 ARG 520 HH12 ARG 520 67.561 17.065 2.056 481 HH21 ARG 520 HH21 ARG 520 69.035 14.466 0.299 482 HH22 ARG 520 HH22 ARG 520 68.599 16.143 0.277 483 H VAL 521 H VAL 521 69.555 10.899 8.283 484 HA VAL 521 HA VAL 521 72.252 10.928 9.112 485 HB VAL 521 HB VAL 521 69.682 10.279 10.561 486 HG11 VAL 521 HG11 VAL 521 72.497 10.580 11.597 487 HG12 VAL 521 HG12 VAL 521 71.382 9.237 11.854 488 HG13 VAL 521 HG13 VAL 521 71.080 10.795 12.624 489 HG21 VAL 521 HG21 VAL 521 71.388 12.745 10.869 490 HG22 VAL 521 HG22 VAL 521 69.676 12.531 11.238 491 HG23 VAL 521 HG23 VAL 521 70.210 12.626 9.562 492 H GLU 522 H GLU 522 69.833 8.318 9.032 493 HA GLU 522 HA GLU 522 71.451 6.292 10.158 494 HB2 GLU 522 HB2 GLU 522 69.153 6.105 8.192 495 HB3 GLU 522 HB3 GLU 522 69.816 4.748 9.104 496 HG2 GLU 522 HG2 GLU 522 69.230 5.851 11.215 497 HG3 GLU 522 HG3 GLU 522 68.628 7.254 10.331 498 H LEU 523 H LEU 523 70.842 7.274 6.826 499 HA LEU 523 HA LEU 523 72.337 5.274 5.514 500 HB2 LEU 523 HB2 LEU 523 70.647 6.847 4.508 501 HB3 LEU 523 HB3 LEU 523 71.859 8.118 4.622 502 HG LEU 523 HG LEU 523 73.386 6.343 3.335 503 HD11 LEU 523 HD11 LEU 523 71.802 4.509 3.347 504 HD12 LEU 523 HD12 LEU 523 71.994 5.077 1.690 505 HD13 LEU 523 HD13 LEU 523 70.558 5.521 2.612 506 HD21 LEU 523 HD21 LEU 523 72.685 7.366 1.217 507 HD22 LEU 523 HD22 LEU 523 72.760 8.570 2.500 508 HD23 LEU 523 HD23 LEU 523 71.199 7.937 1.974 509 H ALA 524 H ALA 524 73.223 8.551 6.600 510 HA ALA 524 HA ALA 524 75.817 8.576 5.508 511 HB1 ALA 524 HB1 ALA 524 74.998 9.991 8.042 512 HB2 ALA 524 HB2 ALA 524 74.486 10.536 6.443 513 HB3 ALA 524 HB3 ALA 524 76.201 10.492 6.854 514 H ASP 525 H ASP 525 74.593 7.467 8.632 515 HA ASP 525 HA ASP 525 77.123 6.942 9.815 516 HB2 ASP 525 HB2 ASP 525 75.041 7.144 11.103 517 HB3 ASP 525 HB3 ASP 525 74.406 5.700 10.318 518 H GLN 526 H GLN 526 74.830 4.965 7.981 519 HA GLN 526 HA GLN 526 76.263 2.513 8.134 520 HB2 GLN 526 HB2 GLN 526 73.858 2.681 7.608 521 HB3 GLN 526 HB3 GLN 526 74.254 3.489 6.093 522 HG2 GLN 526 HG2 GLN 526 75.383 1.524 5.258 523 HG3 GLN 526 HG3 GLN 526 75.242 0.723 6.824 524 HE21 GLN 526 HE21 GLN 526 73.872 0.640 3.824 525 HE22 GLN 526 HE22 GLN 526 72.286 0.196 4.238 526 H VAL 527 H VAL 527 76.184 5.166 5.828 527 HA VAL 527 HA VAL 527 77.885 3.967 3.873 528 HB VAL 527 HB VAL 527 76.947 6.789 4.417 529 HG11 VAL 527 HG11 VAL 527 78.854 5.780 2.302 530 HG12 VAL 527 HG12 VAL 527 79.082 7.129 3.417 531 HG13 VAL 527 HG13 VAL 527 77.914 7.259 2.100 532 HG21 VAL 527 HG21 VAL 527 75.565 6.438 2.503 533 HG22 VAL 527 HG22 VAL 527 75.414 4.982 3.486 534 HG23 VAL 527 HG23 VAL 527 76.442 4.976 2.054 535 H LYS 528 H LYS 528 78.368 6.221 6.543 536 HA LYS 528 HA LYS 528 81.125 6.729 6.097 537 HB2 LYS 528 HB2 LYS 528 79.655 8.186 7.417 538 HB3 LYS 528 HB3 LYS 528 79.481 6.904 8.612 539 HG2 LYS 528 HG2 LYS 528 81.869 6.981 9.106 540 HG3 LYS 528 HG3 LYS 528 82.113 8.172 7.824 541 HD2 LYS 528 HD2 LYS 528 81.994 9.400 9.893 542 HD3 LYS 528 HD3 LYS 528 80.476 9.675 9.037 543 HE2 LYS 528 HE2 LYS 528 79.269 8.236 10.457 544 HE3 LYS 528 HE3 LYS 528 80.727 7.448 11.056 545 HZ1 LYS 528 HZ1 LYS 528 79.859 8.969 12.689 546 HZ2 LYS 528 HZ2 LYS 528 79.903 10.251 11.575 547 HZ3 LYS 528 HZ3 LYS 528 81.349 9.542 12.118 548 H SER 529 H SER 529 79.407 4.521 8.304 549 HA SER 529 HA SER 529 81.853 3.462 9.375 550 HB2 SER 529 HB2 SER 529 79.002 2.459 9.565 551 HB3 SER 529 HB3 SER 529 80.357 1.835 10.502 552 HG SER 529 HG SER 529 78.874 3.700 11.288 553 H ALA 530 H ALA 530 80.259 3.009 6.464 554 HA ALA 530 HA ALA 530 80.741 0.184 6.142 555 HB1 ALA 530 HB1 ALA 530 78.974 0.871 4.802 556 HB2 ALA 530 HB2 ALA 530 80.298 0.924 3.639 557 HB3 ALA 530 HB3 ALA 530 79.745 2.406 4.411 558 H VAL 531 H VAL 531 82.849 2.531 6.549 559 HA VAL 531 HA VAL 531 84.684 1.817 4.354 560 HB VAL 531 HB VAL 531 84.258 4.206 4.910 561 HG11 VAL 531 HG11 VAL 531 84.206 3.516 7.512 562 HG12 VAL 531 HG12 VAL 531 84.649 5.141 6.993 563 HG13 VAL 531 HG13 VAL 531 85.905 3.980 7.407 564 HG21 VAL 531 HG21 VAL 531 86.364 3.598 3.855 565 HG22 VAL 531 HG22 VAL 531 87.063 3.176 5.419 566 HG23 VAL 531 HG23 VAL 531 86.671 4.856 5.053 567 H THR 532 H THR 532 85.513 -0.230 4.933 568 HA THR 532 HA THR 532 87.534 -0.201 6.963 569 HB THR 532 HB THR 532 85.590 -0.435 8.422 570 HG1 THR 532 HG1 THR 532 86.383 -2.930 8.798 571 HG21 THR 532 HG21 THR 532 83.889 -1.479 7.185 572 HG22 THR 532 HG22 THR 532 84.411 -2.754 8.285 573 HG23 THR 532 HG23 THR 532 84.952 -2.761 6.612 574 H GLU 533 H GLU 533 87.560 -0.860 4.207 575 HA GLU 533 HA GLU 533 87.926 -2.645 2.704 576 HB2 GLU 533 HB2 GLU 533 90.129 -3.762 3.513 577 HB3 GLU 533 HB3 GLU 533 90.124 -2.027 3.210 578 HG2 GLU 533 HG2 GLU 533 89.881 -1.537 5.559 579 HG3 GLU 533 HG3 GLU 533 89.620 -3.236 5.939 580 H PHE 534 H PHE 534 86.076 -3.945 2.993 581 HA PHE 534 HA PHE 534 85.963 -5.979 5.010 582 HB2 PHE 534 HB2 PHE 534 84.337 -5.405 2.538 583 HB3 PHE 534 HB3 PHE 534 84.031 -6.817 3.550 584 HD1 PHE 534 HD1 PHE 534 83.264 -6.574 5.862 585 HD2 PHE 534 HD2 PHE 534 83.876 -3.141 3.349 586 HE1 PHE 534 HE1 PHE 534 82.006 -5.171 7.472 587 HE2 PHE 534 HE2 PHE 534 82.612 -1.740 4.958 588 HZ PHE 534 HZ PHE 534 81.679 -2.755 7.019 589 H GLU 535 H GLU 535 86.233 -8.188 4.814 590 HA GLU 535 HA GLU 535 88.305 -9.071 3.063 591 HB2 GLU 535 HB2 GLU 535 86.404 -10.611 4.843 592 HB3 GLU 535 HB3 GLU 535 87.814 -11.306 4.046 593 HG2 GLU 535 HG2 GLU 535 87.936 -8.957 5.959 594 HG3 GLU 535 HG3 GLU 535 88.227 -10.629 6.435 595 H ASN 536 H ASN 536 88.192 -10.091 1.126 596 HA ASN 536 HA ASN 536 87.307 -10.928 -0.825 597 HB2 ASN 536 HB2 ASN 536 86.633 -12.680 0.918 598 HB3 ASN 536 HB3 ASN 536 85.028 -11.955 0.862 599 HD21 ASN 536 HD21 ASN 536 83.688 -13.037 -0.580 600 HD22 ASN 536 HD22 ASN 536 84.200 -13.775 -2.020 601 H VAL 537 H VAL 537 86.830 -8.360 -0.872 602 HA VAL 537 HA VAL 537 84.123 -7.511 -0.758 603 HB VAL 537 HB VAL 537 86.419 -6.413 -2.404 604 HG11 VAL 537 HG11 VAL 537 83.736 -5.258 -1.608 605 HG12 VAL 537 HG12 VAL 537 84.339 -5.537 -3.242 606 HG13 VAL 537 HG13 VAL 537 85.069 -4.286 -2.234 607 HG21 VAL 537 HG21 VAL 537 87.073 -6.354 -0.124 608 HG22 VAL 537 HG22 VAL 537 85.450 -5.919 0.415 609 HG23 VAL 537 HG23 VAL 537 86.438 -4.742 -0.452 610 H THR 538 H THR 538 82.483 -7.767 -2.134 611 HA THR 538 HA THR 538 82.922 -9.280 -4.619 612 HB THR 538 HB THR 538 80.270 -9.279 -4.429 613 HG1 THR 538 HG1 THR 538 79.552 -8.373 -2.717 614 HG21 THR 538 HG21 THR 538 80.480 -11.140 -2.687 615 HG22 THR 538 HG22 THR 538 82.201 -10.761 -2.639 616 HG23 THR 538 HG23 THR 538 81.463 -11.323 -4.140 617 HA PRO 539 HA PRO 539 82.184 -6.169 -7.660 618 HB2 PRO 539 HB2 PRO 539 79.520 -7.033 -8.465 619 HB3 PRO 539 HB3 PRO 539 81.057 -7.278 -9.315 620 HG2 PRO 539 HG2 PRO 539 79.591 -9.112 -7.511 621 HG3 PRO 539 HG3 PRO 539 80.738 -9.487 -8.810 622 HD2 PRO 539 HD2 PRO 539 81.433 -9.806 -6.250 623 HD3 PRO 539 HD3 PRO 539 82.605 -9.175 -7.422 624 H THR 540 H THR 540 81.404 -4.121 -7.567 625 HA THR 540 HA THR 540 79.782 -3.321 -5.354 626 HB THR 540 HB THR 540 80.487 -1.636 -7.753 627 HG1 THR 540 HG1 THR 540 82.110 -1.867 -5.486 628 HG21 THR 540 HG21 THR 540 80.360 0.184 -6.210 629 HG22 THR 540 HG22 THR 540 80.334 -0.905 -4.824 630 HG23 THR 540 HG23 THR 540 78.936 -0.808 -5.894 631 H ASN 541 H ASN 541 78.773 -1.397 -7.819 632 HA ASN 541 HA ASN 541 76.088 -2.399 -7.672 633 HB2 ASN 541 HB2 ASN 541 75.575 -0.493 -9.177 634 HB3 ASN 541 HB3 ASN 541 76.499 -0.002 -7.755 635 HD21 ASN 541 HD21 ASN 541 78.624 -1.728 -9.625 636 HD22 ASN 541 HD22 ASN 541 79.317 -0.453 -10.511 637 H ASP 542 H ASP 542 74.769 -2.759 -9.625 638 HA ASP 542 HA ASP 542 76.003 -4.736 -11.337 639 HB2 ASP 542 HB2 ASP 542 73.716 -4.967 -10.376 640 HB3 ASP 542 HB3 ASP 542 73.196 -3.605 -11.365 641 H GLN 543 H GLN 543 75.822 -1.404 -11.501 642 HA GLN 543 HA GLN 543 75.052 -0.804 -14.107 643 HB2 GLN 543 HB2 GLN 543 77.231 0.458 -12.434 644 HB3 GLN 543 HB3 GLN 543 76.519 1.176 -13.880 645 HG2 GLN 543 HG2 GLN 543 74.884 0.324 -11.477 646 HG3 GLN 543 HG3 GLN 543 75.501 1.962 -11.693 647 HE21 GLN 543 HE21 GLN 543 74.463 3.317 -13.257 648 HE22 GLN 543 HE22 GLN 543 73.076 2.834 -14.108 Start of MODEL 8 1 H1 SER 466 H1 SER 466 30.948 0.785 5.502 2 H2 SER 466 H2 SER 466 31.479 -0.754 5.016 3 H3 SER 466 H3 SER 466 30.221 -0.604 6.149 4 HA SER 466 HA SER 466 29.674 -1.138 3.686 5 HB2 SER 466 HB2 SER 466 28.275 0.948 5.386 6 HB3 SER 466 HB3 SER 466 27.570 0.254 3.930 7 HG SER 466 HG SER 466 26.878 -1.130 5.405 8 H ASP 467 H ASP 467 31.549 1.492 4.385 9 HA ASP 467 HA ASP 467 30.725 3.120 2.085 10 HB2 ASP 467 HB2 ASP 467 31.375 4.126 4.322 11 HB3 ASP 467 HB3 ASP 467 33.025 3.612 3.983 12 H ASP 468 H ASP 468 31.411 2.349 0.178 13 HA ASP 468 HA ASP 468 33.895 0.878 -0.089 14 HB2 ASP 468 HB2 ASP 468 31.841 1.834 -2.095 15 HB3 ASP 468 HB3 ASP 468 33.281 0.921 -2.534 16 H TYR 469 H TYR 469 35.418 1.538 -1.891 17 HA TYR 469 HA TYR 469 36.972 3.013 -2.715 18 HB2 TYR 469 HB2 TYR 469 34.832 3.761 -3.830 19 HB3 TYR 469 HB3 TYR 469 34.723 5.021 -2.604 20 HD1 TYR 469 HD1 TYR 469 36.897 3.656 -5.308 21 HD2 TYR 469 HD2 TYR 469 36.020 7.007 -2.767 22 HE1 TYR 469 HE1 TYR 469 38.451 5.066 -6.630 23 HE2 TYR 469 HE2 TYR 469 37.574 8.416 -4.088 24 HH TYR 469 HH TYR 469 38.534 7.853 -7.003 25 H VAL 470 H VAL 470 38.266 4.941 -2.191 26 HA VAL 470 HA VAL 470 37.955 5.766 0.651 27 HB VAL 470 HB VAL 470 40.609 5.630 -0.771 28 HG11 VAL 470 HG11 VAL 470 41.400 5.331 1.557 29 HG12 VAL 470 HG12 VAL 470 39.733 5.416 2.124 30 HG13 VAL 470 HG13 VAL 470 40.478 6.824 1.367 31 HG21 VAL 470 HG21 VAL 470 39.770 3.403 -1.056 32 HG22 VAL 470 HG22 VAL 470 39.071 3.388 0.564 33 HG23 VAL 470 HG23 VAL 470 40.823 3.353 0.359 34 H ASP 471 H ASP 471 38.884 7.869 1.191 35 HA ASP 471 HA ASP 471 37.993 9.905 -0.537 36 HB2 ASP 471 HB2 ASP 471 39.853 9.961 1.841 37 HB3 ASP 471 HB3 ASP 471 39.349 11.418 0.987 38 H GLU 472 H GLU 472 39.080 11.334 -1.844 39 HA GLU 472 HA GLU 472 41.121 10.333 -3.476 40 HB2 GLU 472 HB2 GLU 472 40.136 13.159 -3.052 41 HB3 GLU 472 HB3 GLU 472 41.269 12.698 -4.320 42 HG2 GLU 472 HG2 GLU 472 39.159 12.625 -5.382 43 HG3 GLU 472 HG3 GLU 472 39.504 10.941 -5.006 44 H GLU 473 H GLU 473 41.304 12.663 -0.781 45 HA GLU 473 HA GLU 473 44.060 13.261 -1.127 46 HB2 GLU 473 HB2 GLU 473 43.935 14.221 1.095 47 HB3 GLU 473 HB3 GLU 473 42.472 14.637 0.206 48 HG2 GLU 473 HG2 GLU 473 41.423 12.561 1.290 49 HG3 GLU 473 HG3 GLU 473 42.816 12.567 2.373 50 H THR 474 H THR 474 42.324 10.988 0.882 51 HA THR 474 HA THR 474 44.536 9.837 2.243 52 HB THR 474 HB THR 474 41.817 8.742 1.491 53 HG1 THR 474 HG1 THR 474 41.878 10.576 2.887 54 HG21 THR 474 HG21 THR 474 42.249 7.167 3.430 55 HG22 THR 474 HG22 THR 474 43.948 7.635 3.313 56 HG23 THR 474 HG23 THR 474 43.149 6.843 1.950 57 H TYR 475 H TYR 475 42.727 8.879 -0.638 58 HA TYR 475 HA TYR 475 44.126 6.507 -1.129 59 HB2 TYR 475 HB2 TYR 475 41.927 7.148 -2.102 60 HB3 TYR 475 HB3 TYR 475 42.763 8.306 -3.140 61 HD1 TYR 475 HD1 TYR 475 42.684 4.730 -2.163 62 HD2 TYR 475 HD2 TYR 475 43.740 7.601 -5.165 63 HE1 TYR 475 HE1 TYR 475 43.206 2.877 -3.743 64 HE2 TYR 475 HE2 TYR 475 44.278 5.764 -6.752 65 HH TYR 475 HH TYR 475 44.324 3.563 -7.068 66 H ASN 476 H ASN 476 44.622 9.788 -2.433 67 HA ASN 476 HA ASN 476 46.800 9.038 -4.108 68 HB2 ASN 476 HB2 ASN 476 46.105 11.732 -2.914 69 HB3 ASN 476 HB3 ASN 476 47.286 11.453 -4.195 70 HD21 ASN 476 HD21 ASN 476 44.803 9.214 -4.601 71 HD22 ASN 476 HD22 ASN 476 43.864 10.070 -5.729 72 H LEU 477 H LEU 477 46.524 10.160 -0.781 73 HA LEU 477 HA LEU 477 49.242 10.589 -0.228 74 HB2 LEU 477 HB2 LEU 477 47.391 11.173 1.308 75 HB3 LEU 477 HB3 LEU 477 47.050 9.465 1.550 76 HG LEU 477 HG LEU 477 49.354 9.176 2.468 77 HD11 LEU 477 HD11 LEU 477 49.435 12.135 1.893 78 HD12 LEU 477 HD12 LEU 477 50.669 10.912 1.593 79 HD13 LEU 477 HD13 LEU 477 50.371 11.475 3.235 80 HD21 LEU 477 HD21 LEU 477 47.541 11.220 3.759 81 HD22 LEU 477 HD22 LEU 477 48.860 10.402 4.597 82 HD23 LEU 477 HD23 LEU 477 47.495 9.473 3.982 83 H GLN 478 H GLN 478 47.233 7.640 -0.101 84 HA GLN 478 HA GLN 478 49.257 5.865 0.783 85 HB2 GLN 478 HB2 GLN 478 46.765 5.417 -0.877 86 HB3 GLN 478 HB3 GLN 478 47.788 4.110 -0.286 87 HG2 GLN 478 HG2 GLN 478 46.533 6.194 1.508 88 HG3 GLN 478 HG3 GLN 478 45.805 4.624 1.184 89 HE21 GLN 478 HE21 GLN 478 47.354 6.058 3.583 90 HE22 GLN 478 HE22 GLN 478 48.339 4.797 4.155 91 H LYS 479 H LYS 479 48.269 7.039 -2.353 92 HA LYS 479 HA LYS 479 49.795 5.324 -4.002 93 HB2 LYS 479 HB2 LYS 479 47.856 6.949 -4.551 94 HB3 LYS 479 HB3 LYS 479 49.098 8.185 -4.677 95 HG2 LYS 479 HG2 LYS 479 50.261 6.894 -6.397 96 HG3 LYS 479 HG3 LYS 479 49.091 5.585 -6.241 97 HD2 LYS 479 HD2 LYS 479 48.273 8.412 -6.959 98 HD3 LYS 479 HD3 LYS 479 48.702 7.220 -8.183 99 HE2 LYS 479 HE2 LYS 479 46.936 5.700 -7.100 100 HE3 LYS 479 HE3 LYS 479 46.396 7.129 -6.224 101 HZ1 LYS 479 HZ1 LYS 479 46.506 8.104 -8.676 102 HZ2 LYS 479 HZ2 LYS 479 45.116 7.375 -8.027 103 HZ3 LYS 479 HZ3 LYS 479 46.149 6.487 -9.042 104 H LEU 480 H LEU 480 50.434 8.489 -2.569 105 HA LEU 480 HA LEU 480 52.911 8.975 -3.819 106 HB2 LEU 480 HB2 LEU 480 51.491 10.056 -1.415 107 HB3 LEU 480 HB3 LEU 480 53.206 10.413 -1.570 108 HG LEU 480 HG LEU 480 52.750 11.300 -3.872 109 HD11 LEU 480 HD11 LEU 480 50.541 11.705 -4.640 110 HD12 LEU 480 HD12 LEU 480 49.839 11.298 -3.076 111 HD13 LEU 480 HD13 LEU 480 50.528 10.033 -4.095 112 HD21 LEU 480 HD21 LEU 480 51.536 13.370 -2.995 113 HD22 LEU 480 HD22 LEU 480 52.985 12.885 -2.119 114 HD23 LEU 480 HD23 LEU 480 51.392 12.510 -1.460 115 H LEU 481 H LEU 481 52.121 7.432 -0.723 116 HA LEU 481 HA LEU 481 54.899 7.009 -0.036 117 HB2 LEU 481 HB2 LEU 481 52.447 5.791 1.240 118 HB3 LEU 481 HB3 LEU 481 54.043 6.001 1.963 119 HG LEU 481 HG LEU 481 52.231 8.250 1.065 120 HD11 LEU 481 HD11 LEU 481 51.319 7.222 3.048 121 HD12 LEU 481 HD12 LEU 481 52.103 8.730 3.521 122 HD13 LEU 481 HD13 LEU 481 52.908 7.187 3.808 123 HD21 LEU 481 HD21 LEU 481 53.978 9.553 2.471 124 HD22 LEU 481 HD22 LEU 481 54.410 9.075 0.838 125 HD23 LEU 481 HD23 LEU 481 54.998 8.140 2.210 126 H ALA 482 H ALA 482 52.819 5.438 -2.122 127 HA ALA 482 HA ALA 482 53.097 2.762 -1.635 128 HB1 ALA 482 HB1 ALA 482 52.377 2.405 -3.790 129 HB2 ALA 482 HB2 ALA 482 53.443 3.625 -4.477 130 HB3 ALA 482 HB3 ALA 482 51.975 4.113 -3.630 131 HA PRO 483 HA PRO 483 57.317 2.497 -3.769 132 HB2 PRO 483 HB2 PRO 483 58.581 5.105 -4.017 133 HB3 PRO 483 HB3 PRO 483 58.034 4.024 -5.311 134 HG2 PRO 483 HG2 PRO 483 56.870 6.450 -4.742 135 HG3 PRO 483 HG3 PRO 483 56.034 5.107 -5.542 136 HD2 PRO 483 HD2 PRO 483 55.931 5.927 -2.648 137 HD3 PRO 483 HD3 PRO 483 54.607 5.411 -3.715 138 H TYR 484 H TYR 484 57.472 5.314 -1.567 139 HA TYR 484 HA TYR 484 59.908 4.594 -0.334 140 HB2 TYR 484 HB2 TYR 484 59.249 6.811 -0.015 141 HB3 TYR 484 HB3 TYR 484 57.606 6.364 0.444 142 HD1 TYR 484 HD1 TYR 484 61.156 6.356 1.588 143 HD2 TYR 484 HD2 TYR 484 57.041 5.875 2.720 144 HE1 TYR 484 HE1 TYR 484 61.798 6.383 3.984 145 HE2 TYR 484 HE2 TYR 484 57.693 5.898 5.108 146 HH TYR 484 HH TYR 484 60.870 6.785 6.134 147 H HIS 485 H HIS 485 56.557 3.774 0.331 148 HA HIS 485 HA HIS 485 56.908 2.452 2.797 149 HB2 HIS 485 HB2 HIS 485 54.715 3.152 1.848 150 HB3 HIS 485 HB3 HIS 485 54.862 1.874 0.642 151 HD1 HIS 485 HD1 HIS 485 53.362 2.478 3.809 152 HD2 HIS 485 HD2 HIS 485 55.363 -0.776 2.144 153 HE1 HIS 485 HE1 HIS 485 52.682 0.449 5.167 154 H LYS 486 H LYS 486 57.160 1.352 -0.559 155 HA LYS 486 HA LYS 486 57.651 -1.409 0.224 156 HB2 LYS 486 HB2 LYS 486 57.792 0.038 -2.434 157 HB3 LYS 486 HB3 LYS 486 58.042 -1.696 -2.236 158 HG2 LYS 486 HG2 LYS 486 55.795 -1.995 -1.404 159 HG3 LYS 486 HG3 LYS 486 55.527 -0.255 -1.350 160 HD2 LYS 486 HD2 LYS 486 55.801 -0.148 -3.813 161 HD3 LYS 486 HD3 LYS 486 56.033 -1.896 -3.855 162 HE2 LYS 486 HE2 LYS 486 53.785 -2.224 -2.900 163 HE3 LYS 486 HE3 LYS 486 53.554 -0.477 -2.838 164 HZ1 LYS 486 HZ1 LYS 486 52.523 -1.338 -4.803 165 HZ2 LYS 486 HZ2 LYS 486 53.952 -2.127 -5.273 166 HZ3 LYS 486 HZ3 LYS 486 53.880 -0.431 -5.263 167 H ALA 487 H ALA 487 59.503 1.414 0.018 168 HA ALA 487 HA ALA 487 61.971 0.363 -0.924 169 HB1 ALA 487 HB1 ALA 487 62.928 2.435 -0.248 170 HB2 ALA 487 HB2 ALA 487 61.618 2.747 0.892 171 HB3 ALA 487 HB3 ALA 487 61.312 2.803 -0.844 172 H LYS 488 H LYS 488 62.998 -1.215 0.076 173 HA LYS 488 HA LYS 488 62.901 -1.485 3.007 174 HB2 LYS 488 HB2 LYS 488 64.107 -3.297 0.904 175 HB3 LYS 488 HB3 LYS 488 63.950 -3.662 2.622 176 HG2 LYS 488 HG2 LYS 488 61.521 -3.528 2.465 177 HG3 LYS 488 HG3 LYS 488 61.634 -3.071 0.765 178 HD2 LYS 488 HD2 LYS 488 62.807 -5.243 0.322 179 HD3 LYS 488 HD3 LYS 488 62.486 -5.705 1.997 180 HE2 LYS 488 HE2 LYS 488 60.082 -5.449 1.631 181 HE3 LYS 488 HE3 LYS 488 60.378 -4.917 -0.023 182 HZ1 LYS 488 HZ1 LYS 488 61.008 -7.584 1.116 183 HZ2 LYS 488 HZ2 LYS 488 61.438 -7.075 -0.448 184 HZ3 LYS 488 HZ3 LYS 488 59.801 -7.229 -0.021 185 H THR 489 H THR 489 64.889 -0.149 0.609 186 HA THR 489 HA THR 489 67.333 -0.445 2.258 187 HB THR 489 HB THR 489 68.581 -0.049 0.281 188 HG1 THR 489 HG1 THR 489 67.143 0.383 -1.681 189 HG21 THR 489 HG21 THR 489 67.788 -1.792 -1.211 190 HG22 THR 489 HG22 THR 489 66.147 -1.646 -0.578 191 HG23 THR 489 HG23 THR 489 67.435 -2.280 0.445 192 H LEU 490 H LEU 490 68.265 1.280 3.201 193 HA LEU 490 HA LEU 490 66.851 3.655 3.620 194 HB2 LEU 490 HB2 LEU 490 69.712 2.822 4.062 195 HB3 LEU 490 HB3 LEU 490 69.189 4.466 4.428 196 HG LEU 490 HG LEU 490 67.423 3.570 5.905 197 HD11 LEU 490 HD11 LEU 490 66.904 1.451 4.981 198 HD12 LEU 490 HD12 LEU 490 67.690 1.080 6.513 199 HD13 LEU 490 HD13 LEU 490 68.591 0.936 5.005 200 HD21 LEU 490 HD21 LEU 490 68.993 2.572 7.641 201 HD22 LEU 490 HD22 LEU 490 69.508 4.122 6.976 202 HD23 LEU 490 HD23 LEU 490 70.257 2.629 6.413 203 H GLU 491 H GLU 491 69.527 2.953 1.389 204 HA GLU 491 HA GLU 491 70.053 5.512 0.439 205 HB2 GLU 491 HB2 GLU 491 70.966 4.432 -1.527 206 HB3 GLU 491 HB3 GLU 491 71.342 3.444 -0.113 207 HG2 GLU 491 HG2 GLU 491 69.184 2.168 -0.620 208 HG3 GLU 491 HG3 GLU 491 69.191 2.990 -2.179 209 H ARG 492 H ARG 492 67.578 3.230 -0.520 210 HA ARG 492 HA ARG 492 66.566 4.871 -2.651 211 HB2 ARG 492 HB2 ARG 492 66.338 2.476 -2.791 212 HB3 ARG 492 HB3 ARG 492 65.448 2.433 -1.270 213 HG2 ARG 492 HG2 ARG 492 63.576 3.597 -2.221 214 HG3 ARG 492 HG3 ARG 492 64.494 3.986 -3.685 215 HD2 ARG 492 HD2 ARG 492 62.953 2.072 -4.041 216 HD3 ARG 492 HD3 ARG 492 64.639 1.615 -4.266 217 HE ARG 492 HE ARG 492 63.782 1.164 -1.571 218 HH11 ARG 492 HH11 ARG 492 61.821 -0.073 -3.724 219 HH12 ARG 492 HH12 ARG 492 62.395 -1.707 -3.726 220 HH21 ARG 492 HH21 ARG 492 65.330 -0.959 -2.042 221 HH22 ARG 492 HH22 ARG 492 64.380 -2.209 -2.774 222 H GLN 493 H GLN 493 65.770 4.348 0.730 223 HA GLN 493 HA GLN 493 63.258 5.582 0.792 224 HB2 GLN 493 HB2 GLN 493 65.458 5.349 2.841 225 HB3 GLN 493 HB3 GLN 493 63.919 6.112 3.205 226 HG2 GLN 493 HG2 GLN 493 62.706 4.093 2.729 227 HG3 GLN 493 HG3 GLN 493 64.135 3.326 2.051 228 HE21 GLN 493 HE21 GLN 493 63.278 1.716 3.894 229 HE22 GLN 493 HE22 GLN 493 64.014 1.921 5.409 230 H VAL 494 H VAL 494 66.515 7.015 1.233 231 HA VAL 494 HA VAL 494 65.591 9.641 1.663 232 HB VAL 494 HB VAL 494 68.019 8.527 1.834 233 HG11 VAL 494 HG11 VAL 494 68.253 10.075 -0.753 234 HG12 VAL 494 HG12 VAL 494 68.192 8.320 -0.674 235 HG13 VAL 494 HG13 VAL 494 69.520 9.183 0.085 236 HG21 VAL 494 HG21 VAL 494 67.431 11.426 1.199 237 HG22 VAL 494 HG22 VAL 494 68.979 10.854 1.819 238 HG23 VAL 494 HG23 VAL 494 67.519 10.679 2.795 239 H TYR 495 H TYR 495 66.510 7.924 -1.284 240 HA TYR 495 HA TYR 495 66.172 10.021 -3.128 241 HB2 TYR 495 HB2 TYR 495 67.301 7.978 -3.715 242 HB3 TYR 495 HB3 TYR 495 65.859 7.028 -3.381 243 HD1 TYR 495 HD1 TYR 495 67.204 9.713 -5.606 244 HD2 TYR 495 HD2 TYR 495 64.247 6.645 -5.059 245 HE1 TYR 495 HE1 TYR 495 66.487 9.983 -7.966 246 HE2 TYR 495 HE2 TYR 495 63.527 6.918 -7.416 247 HH TYR 495 HH TYR 495 63.636 8.387 -9.217 248 H GLU 496 H GLU 496 63.852 7.502 -2.101 249 HA GLU 496 HA GLU 496 61.720 8.417 -3.719 250 HB2 GLU 496 HB2 GLU 496 61.688 6.826 -1.147 251 HB3 GLU 496 HB3 GLU 496 60.275 7.103 -2.163 252 HG2 GLU 496 HG2 GLU 496 62.834 5.813 -3.145 253 HG3 GLU 496 HG3 GLU 496 61.418 4.910 -2.614 254 H LEU 497 H LEU 497 62.754 9.216 -0.446 255 HA LEU 497 HA LEU 497 60.510 10.791 0.240 256 HB2 LEU 497 HB2 LEU 497 63.373 10.763 1.174 257 HB3 LEU 497 HB3 LEU 497 62.195 11.897 1.831 258 HG LEU 497 HG LEU 497 61.719 8.907 1.736 259 HD11 LEU 497 HD11 LEU 497 63.737 9.745 3.190 260 HD12 LEU 497 HD12 LEU 497 62.567 8.627 3.887 261 HD13 LEU 497 HD13 LEU 497 62.472 10.345 4.263 262 HD21 LEU 497 HD21 LEU 497 60.229 11.271 2.796 263 HD22 LEU 497 HD22 LEU 497 60.190 9.808 3.776 264 HD23 LEU 497 HD23 LEU 497 59.620 9.765 2.111 265 H GLU 498 H GLU 498 63.547 11.583 -1.432 266 HA GLU 498 HA GLU 498 63.209 14.357 -1.490 267 HB2 GLU 498 HB2 GLU 498 64.507 12.458 -3.448 268 HB3 GLU 498 HB3 GLU 498 64.524 14.206 -3.680 269 HG2 GLU 498 HG2 GLU 498 65.721 14.559 -1.640 270 HG3 GLU 498 HG3 GLU 498 65.478 12.893 -1.126 271 H LYS 499 H LYS 499 61.989 11.866 -3.748 272 HA LYS 499 HA LYS 499 60.677 13.767 -5.461 273 HB2 LYS 499 HB2 LYS 499 60.562 10.788 -5.066 274 HB3 LYS 499 HB3 LYS 499 59.321 11.562 -6.045 275 HG2 LYS 499 HG2 LYS 499 61.257 10.755 -7.396 276 HG3 LYS 499 HG3 LYS 499 61.007 12.493 -7.535 277 HD2 LYS 499 HD2 LYS 499 62.805 12.909 -5.920 278 HD3 LYS 499 HD3 LYS 499 63.016 11.175 -5.678 279 HE2 LYS 499 HE2 LYS 499 64.709 11.977 -7.240 280 HE3 LYS 499 HE3 LYS 499 63.566 10.951 -8.107 281 HZ1 LYS 499 HZ1 LYS 499 64.264 13.484 -8.797 282 HZ2 LYS 499 HZ2 LYS 499 62.765 13.702 -8.027 283 HZ3 LYS 499 HZ3 LYS 499 62.897 12.651 -9.355 284 H LEU 500 H LEU 500 59.453 11.610 -2.902 285 HA LEU 500 HA LEU 500 56.769 12.502 -2.999 286 HB2 LEU 500 HB2 LEU 500 58.456 11.030 -1.009 287 HB3 LEU 500 HB3 LEU 500 56.841 11.532 -0.560 288 HG LEU 500 HG LEU 500 55.810 10.187 -2.215 289 HD11 LEU 500 HD11 LEU 500 58.539 10.041 -3.491 290 HD12 LEU 500 HD12 LEU 500 57.024 10.568 -4.209 291 HD13 LEU 500 HD13 LEU 500 57.294 8.862 -3.867 292 HD21 LEU 500 HD21 LEU 500 58.164 8.792 -0.926 293 HD22 LEU 500 HD22 LEU 500 56.985 7.911 -1.889 294 HD23 LEU 500 HD23 LEU 500 56.470 8.770 -0.440 295 H GLN 501 H GLN 501 59.480 13.515 -0.938 296 HA GLN 501 HA GLN 501 58.158 15.282 0.732 297 HB2 GLN 501 HB2 GLN 501 60.530 14.475 0.921 298 HB3 GLN 501 HB3 GLN 501 60.963 15.596 -0.372 299 HG2 GLN 501 HG2 GLN 501 61.425 16.642 1.730 300 HG3 GLN 501 HG3 GLN 501 59.991 17.423 1.047 301 HE21 GLN 501 HE21 GLN 501 58.078 17.331 2.275 302 HE22 GLN 501 HE22 GLN 501 57.899 16.414 3.690 303 H GLU 502 H GLU 502 58.951 15.520 -2.601 304 HA GLU 502 HA GLU 502 58.714 18.392 -2.817 305 HB2 GLU 502 HB2 GLU 502 60.066 16.795 -4.317 306 HB3 GLU 502 HB3 GLU 502 58.526 16.382 -5.062 307 HG2 GLU 502 HG2 GLU 502 59.644 19.187 -4.851 308 HG3 GLU 502 HG3 GLU 502 59.731 18.165 -6.285 309 H LYS 503 H LYS 503 56.717 15.557 -3.532 310 HA LYS 503 HA LYS 503 54.461 17.280 -4.341 311 HB2 LYS 503 HB2 LYS 503 54.825 14.298 -4.518 312 HB3 LYS 503 HB3 LYS 503 53.522 15.233 -5.253 313 HG2 LYS 503 HG2 LYS 503 55.175 16.510 -6.568 314 HG3 LYS 503 HG3 LYS 503 56.476 15.566 -5.852 315 HD2 LYS 503 HD2 LYS 503 54.204 14.351 -7.445 316 HD3 LYS 503 HD3 LYS 503 55.764 14.796 -8.142 317 HE2 LYS 503 HE2 LYS 503 56.808 13.307 -6.310 318 HE3 LYS 503 HE3 LYS 503 55.182 12.673 -6.069 319 HZ1 LYS 503 HZ1 LYS 503 56.037 12.799 -8.822 320 HZ2 LYS 503 HZ2 LYS 503 55.230 11.560 -7.983 321 HZ3 LYS 503 HZ3 LYS 503 56.917 11.716 -7.858 322 H LEU 504 H LEU 504 55.523 15.680 -1.592 323 HA LEU 504 HA LEU 504 53.140 14.604 -0.585 324 HB2 LEU 504 HB2 LEU 504 55.785 15.346 0.502 325 HB3 LEU 504 HB3 LEU 504 54.489 15.158 1.677 326 HG LEU 504 HG LEU 504 55.180 13.084 -0.422 327 HD11 LEU 504 HD11 LEU 504 57.065 13.217 1.034 328 HD12 LEU 504 HD12 LEU 504 56.105 11.862 1.634 329 HD13 LEU 504 HD13 LEU 504 56.034 13.421 2.443 330 HD21 LEU 504 HD21 LEU 504 53.107 12.346 0.177 331 HD22 LEU 504 HD22 LEU 504 53.056 13.331 1.634 332 HD23 LEU 504 HD23 LEU 504 53.896 11.783 1.648 333 HA PRO 505 HA PRO 505 50.817 18.505 0.007 334 HB2 PRO 505 HB2 PRO 505 49.408 17.150 2.169 335 HB3 PRO 505 HB3 PRO 505 48.792 17.601 0.573 336 HG2 PRO 505 HG2 PRO 505 49.924 15.010 1.472 337 HG3 PRO 505 HG3 PRO 505 48.755 15.340 0.194 338 HD2 PRO 505 HD2 PRO 505 51.200 14.616 -0.405 339 HD3 PRO 505 HD3 PRO 505 50.434 15.917 -1.336 340 H GLU 506 H GLU 506 50.963 20.123 1.423 341 HA GLU 506 HA GLU 506 53.102 20.689 2.872 342 HB2 GLU 506 HB2 GLU 506 51.155 22.182 2.326 343 HB3 GLU 506 HB3 GLU 506 50.339 21.521 3.746 344 HG2 GLU 506 HG2 GLU 506 52.165 22.250 5.173 345 HG3 GLU 506 HG3 GLU 506 53.048 22.841 3.770 346 H LYS 507 H LYS 507 50.127 19.653 4.575 347 HA LYS 507 HA LYS 507 51.205 19.412 7.115 348 HB2 LYS 507 HB2 LYS 507 49.294 18.022 7.647 349 HB3 LYS 507 HB3 LYS 507 48.774 19.263 6.505 350 HG2 LYS 507 HG2 LYS 507 49.217 17.580 4.650 351 HG3 LYS 507 HG3 LYS 507 49.408 16.365 5.914 352 HD2 LYS 507 HD2 LYS 507 46.938 18.061 5.459 353 HD3 LYS 507 HD3 LYS 507 47.109 16.359 5.039 354 HE2 LYS 507 HE2 LYS 507 46.074 16.169 7.111 355 HE3 LYS 507 HE3 LYS 507 47.765 16.131 7.612 356 HZ1 LYS 507 HZ1 LYS 507 47.576 18.101 8.611 357 HZ2 LYS 507 HZ2 LYS 507 45.896 17.867 8.510 358 HZ3 LYS 507 HZ3 LYS 507 46.702 18.788 7.331 359 H TYR 508 H TYR 508 51.417 17.176 4.434 360 HA TYR 508 HA TYR 508 52.625 15.095 6.126 361 HB2 TYR 508 HB2 TYR 508 51.816 15.240 3.217 362 HB3 TYR 508 HB3 TYR 508 52.769 13.903 3.863 363 HD1 TYR 508 HD1 TYR 508 51.861 12.659 5.899 364 HD2 TYR 508 HD2 TYR 508 49.478 15.254 3.477 365 HE1 TYR 508 HE1 TYR 508 49.812 11.572 6.759 366 HE2 TYR 508 HE2 TYR 508 47.418 14.161 4.305 367 HH TYR 508 HH TYR 508 47.000 12.709 6.792 368 H LYS 509 H LYS 509 53.434 17.680 4.021 369 HA LYS 509 HA LYS 509 55.973 16.826 3.138 370 HB2 LYS 509 HB2 LYS 509 54.508 18.863 2.446 371 HB3 LYS 509 HB3 LYS 509 55.283 19.686 3.794 372 HG2 LYS 509 HG2 LYS 509 57.484 19.275 2.827 373 HG3 LYS 509 HG3 LYS 509 56.762 18.331 1.521 374 HD2 LYS 509 HD2 LYS 509 55.496 20.310 0.780 375 HD3 LYS 509 HD3 LYS 509 56.211 21.259 2.081 376 HE2 LYS 509 HE2 LYS 509 58.450 20.897 1.136 377 HE3 LYS 509 HE3 LYS 509 57.756 19.913 -0.154 378 HZ1 LYS 509 HZ1 LYS 509 57.847 21.949 -1.159 379 HZ2 LYS 509 HZ2 LYS 509 57.578 22.809 0.281 380 HZ3 LYS 509 HZ3 LYS 509 56.288 22.021 -0.495 381 H ALA 510 H ALA 510 54.951 18.772 5.939 382 HA ALA 510 HA ALA 510 57.483 19.192 7.061 383 HB1 ALA 510 HB1 ALA 510 56.351 19.806 9.065 384 HB2 ALA 510 HB2 ALA 510 54.942 18.834 8.644 385 HB3 ALA 510 HB3 ALA 510 55.307 20.297 7.730 386 H GLU 511 H GLU 511 55.073 16.698 7.869 387 HA GLU 511 HA GLU 511 56.575 15.339 9.811 388 HB2 GLU 511 HB2 GLU 511 54.192 14.955 9.400 389 HB3 GLU 511 HB3 GLU 511 54.562 14.247 7.830 390 HG2 GLU 511 HG2 GLU 511 55.805 12.430 8.909 391 HG3 GLU 511 HG3 GLU 511 55.525 13.161 10.491 392 H TYR 512 H TYR 512 56.537 14.912 6.306 393 HA TYR 512 HA TYR 512 58.346 12.674 6.405 394 HB2 TYR 512 HB2 TYR 512 56.989 14.276 4.286 395 HB3 TYR 512 HB3 TYR 512 58.363 13.273 3.822 396 HD1 TYR 512 HD1 TYR 512 55.187 13.085 5.846 397 HD2 TYR 512 HD2 TYR 512 58.007 11.011 3.382 398 HE1 TYR 512 HE1 TYR 512 53.783 11.043 5.947 399 HE2 TYR 512 HE2 TYR 512 56.642 8.973 3.513 400 HH TYR 512 HH TYR 512 54.697 8.184 5.501 401 H LYS 513 H LYS 513 58.710 16.136 6.285 402 HA LYS 513 HA LYS 513 61.316 16.090 5.140 403 HB2 LYS 513 HB2 LYS 513 59.837 18.111 6.791 404 HB3 LYS 513 HB3 LYS 513 61.574 18.295 6.561 405 HG2 LYS 513 HG2 LYS 513 61.122 18.061 4.045 406 HG3 LYS 513 HG3 LYS 513 59.418 18.264 4.436 407 HD2 LYS 513 HD2 LYS 513 59.974 20.391 5.594 408 HD3 LYS 513 HD3 LYS 513 61.651 20.179 5.090 409 HE2 LYS 513 HE2 LYS 513 60.694 20.009 2.685 410 HE3 LYS 513 HE3 LYS 513 59.235 20.723 3.375 411 HZ1 LYS 513 HZ1 LYS 513 61.916 21.891 3.099 412 HZ2 LYS 513 HZ2 LYS 513 60.935 22.392 4.393 413 HZ3 LYS 513 HZ3 LYS 513 60.401 22.592 2.793 414 H LYS 514 H LYS 514 60.007 15.710 8.377 415 HA LYS 514 HA LYS 514 62.489 15.712 9.743 416 HB2 LYS 514 HB2 LYS 514 59.728 14.728 10.304 417 HB3 LYS 514 HB3 LYS 514 61.015 13.960 11.231 418 HG2 LYS 514 HG2 LYS 514 60.089 15.931 12.392 419 HG3 LYS 514 HG3 LYS 514 61.803 16.125 12.006 420 HD2 LYS 514 HD2 LYS 514 61.406 17.763 10.409 421 HD3 LYS 514 HD3 LYS 514 59.830 17.109 9.965 422 HE2 LYS 514 HE2 LYS 514 58.746 18.135 11.765 423 HE3 LYS 514 HE3 LYS 514 60.238 18.325 12.691 424 HZ1 LYS 514 HZ1 LYS 514 60.270 20.384 11.894 425 HZ2 LYS 514 HZ2 LYS 514 59.081 20.056 10.726 426 HZ3 LYS 514 HZ3 LYS 514 60.712 19.710 10.402 427 H LYS 515 H LYS 515 60.563 13.136 8.246 428 HA LYS 515 HA LYS 515 62.346 11.021 8.859 429 HB2 LYS 515 HB2 LYS 515 60.367 11.344 6.604 430 HB3 LYS 515 HB3 LYS 515 61.259 9.858 6.910 431 HG2 LYS 515 HG2 LYS 515 60.309 9.977 9.305 432 HG3 LYS 515 HG3 LYS 515 59.203 11.203 8.682 433 HD2 LYS 515 HD2 LYS 515 59.494 8.474 7.390 434 HD3 LYS 515 HD3 LYS 515 58.323 8.804 8.665 435 HE2 LYS 515 HE2 LYS 515 57.421 10.681 7.257 436 HE3 LYS 515 HE3 LYS 515 58.492 10.152 5.962 437 HZ1 LYS 515 HZ1 LYS 515 57.112 7.930 6.975 438 HZ2 LYS 515 HZ2 LYS 515 57.047 8.596 5.415 439 HZ3 LYS 515 HZ3 LYS 515 55.983 9.145 6.622 440 H LEU 516 H LEU 516 62.143 13.206 6.081 441 HA LEU 516 HA LEU 516 64.063 12.030 4.413 442 HB2 LEU 516 HB2 LEU 516 62.637 13.801 3.635 443 HB3 LEU 516 HB3 LEU 516 63.217 14.881 4.892 444 HG LEU 516 HG LEU 516 65.398 15.007 3.860 445 HD11 LEU 516 HD11 LEU 516 65.638 13.894 1.547 446 HD12 LEU 516 HD12 LEU 516 64.278 12.886 2.036 447 HD13 LEU 516 HD13 LEU 516 65.778 12.849 2.960 448 HD21 LEU 516 HD21 LEU 516 63.342 15.293 1.669 449 HD22 LEU 516 HD22 LEU 516 64.794 16.259 1.923 450 HD23 LEU 516 HD23 LEU 516 63.431 16.410 3.037 451 H ASP 517 H ASP 517 64.444 14.617 6.822 452 HA ASP 517 HA ASP 517 67.240 14.882 6.648 453 HB2 ASP 517 HB2 ASP 517 65.795 16.549 7.711 454 HB3 ASP 517 HB3 ASP 517 65.376 15.396 8.977 455 H GLN 518 H GLN 518 65.216 13.025 8.896 456 HA GLN 518 HA GLN 518 67.381 11.893 10.328 457 HB2 GLN 518 HB2 GLN 518 64.505 11.027 10.045 458 HB3 GLN 518 HB3 GLN 518 65.659 10.283 11.154 459 HG2 GLN 518 HG2 GLN 518 66.034 12.439 12.261 460 HG3 GLN 518 HG3 GLN 518 64.945 13.240 11.131 461 HE21 GLN 518 HE21 GLN 518 63.999 13.728 13.461 462 HE22 GLN 518 HE22 GLN 518 62.791 12.656 13.983 463 H THR 519 H THR 519 65.719 10.921 7.393 464 HA THR 519 HA THR 519 66.580 8.232 7.275 465 HB THR 519 HB THR 519 65.798 10.204 5.122 466 HG1 THR 519 HG1 THR 519 64.489 8.653 6.892 467 HG21 THR 519 HG21 THR 519 65.429 8.099 3.743 468 HG22 THR 519 HG22 THR 519 66.409 7.250 4.938 469 HG23 THR 519 HG23 THR 519 67.110 8.563 3.993 470 H ARG 520 H ARG 520 67.947 11.145 5.733 471 HA ARG 520 HA ARG 520 70.135 9.818 4.525 472 HB2 ARG 520 HB2 ARG 520 71.111 12.120 4.363 473 HB3 ARG 520 HB3 ARG 520 69.452 12.022 3.766 474 HG2 ARG 520 HG2 ARG 520 68.611 12.805 5.910 475 HG3 ARG 520 HG3 ARG 520 70.246 12.898 6.550 476 HD2 ARG 520 HD2 ARG 520 70.750 14.528 4.680 477 HD3 ARG 520 HD3 ARG 520 69.014 14.558 4.361 478 HE ARG 520 HE ARG 520 69.447 14.981 7.119 479 HH11 ARG 520 HH11 ARG 520 71.414 16.680 5.222 480 HH12 ARG 520 HH12 ARG 520 70.626 18.216 5.361 481 HH21 ARG 520 HH21 ARG 520 67.772 16.911 6.833 482 HH22 ARG 520 HH22 ARG 520 68.562 18.347 6.276 483 H VAL 521 H VAL 521 69.594 11.170 7.709 484 HA VAL 521 HA VAL 521 72.253 11.311 8.628 485 HB VAL 521 HB VAL 521 69.587 10.936 9.993 486 HG11 VAL 521 HG11 VAL 521 71.060 9.871 11.521 487 HG12 VAL 521 HG12 VAL 521 70.876 11.518 12.122 488 HG13 VAL 521 HG13 VAL 521 72.334 11.057 11.240 489 HG21 VAL 521 HG21 VAL 521 69.715 13.224 10.464 490 HG22 VAL 521 HG22 VAL 521 70.453 13.144 8.867 491 HG23 VAL 521 HG23 VAL 521 71.473 13.267 10.299 492 H GLU 522 H GLU 522 69.862 8.679 8.876 493 HA GLU 522 HA GLU 522 71.512 6.854 10.274 494 HB2 GLU 522 HB2 GLU 522 69.191 6.368 8.392 495 HB3 GLU 522 HB3 GLU 522 69.889 5.160 9.469 496 HG2 GLU 522 HG2 GLU 522 68.756 7.803 10.414 497 HG3 GLU 522 HG3 GLU 522 67.843 6.296 10.398 498 H LEU 523 H LEU 523 70.901 7.422 6.864 499 HA LEU 523 HA LEU 523 72.312 5.235 5.787 500 HB2 LEU 523 HB2 LEU 523 70.689 6.762 4.593 501 HB3 LEU 523 HB3 LEU 523 71.963 7.977 4.563 502 HG LEU 523 HG LEU 523 73.381 5.949 3.503 503 HD11 LEU 523 HD11 LEU 523 71.955 4.594 2.017 504 HD12 LEU 523 HD12 LEU 523 70.516 5.337 2.712 505 HD13 LEU 523 HD13 LEU 523 71.551 4.312 3.708 506 HD21 LEU 523 HD21 LEU 523 71.411 7.782 2.125 507 HD22 LEU 523 HD22 LEU 523 72.520 6.751 1.219 508 HD23 LEU 523 HD23 LEU 523 73.153 7.988 2.306 509 H ALA 524 H ALA 524 73.348 8.560 6.553 510 HA ALA 524 HA ALA 524 75.923 8.379 5.424 511 HB1 ALA 524 HB1 ALA 524 75.280 10.035 7.857 512 HB2 ALA 524 HB2 ALA 524 74.679 10.466 6.256 513 HB3 ALA 524 HB3 ALA 524 76.416 10.386 6.552 514 H ASP 525 H ASP 525 74.744 7.722 8.692 515 HA ASP 525 HA ASP 525 77.278 7.117 9.817 516 HB2 ASP 525 HB2 ASP 525 74.438 6.395 10.544 517 HB3 ASP 525 HB3 ASP 525 75.818 5.889 11.522 518 H GLN 526 H GLN 526 74.770 5.193 8.251 519 HA GLN 526 HA GLN 526 75.902 2.623 8.672 520 HB2 GLN 526 HB2 GLN 526 73.535 3.085 8.040 521 HB3 GLN 526 HB3 GLN 526 74.092 3.587 6.446 522 HG2 GLN 526 HG2 GLN 526 75.098 1.319 6.132 523 HG3 GLN 526 HG3 GLN 526 74.397 0.835 7.677 524 HE21 GLN 526 HE21 GLN 526 72.318 -0.038 7.548 525 HE22 GLN 526 HE22 GLN 526 71.250 0.204 6.252 526 H VAL 527 H VAL 527 76.097 4.982 6.069 527 HA VAL 527 HA VAL 527 77.681 3.407 4.296 528 HB VAL 527 HB VAL 527 77.015 6.352 4.473 529 HG11 VAL 527 HG11 VAL 527 77.985 6.418 2.110 530 HG12 VAL 527 HG12 VAL 527 78.776 4.889 2.496 531 HG13 VAL 527 HG13 VAL 527 79.159 6.339 3.425 532 HG21 VAL 527 HG21 VAL 527 76.298 4.326 2.346 533 HG22 VAL 527 HG22 VAL 527 75.558 5.898 2.648 534 HG23 VAL 527 HG23 VAL 527 75.306 4.572 3.782 535 H LYS 528 H LYS 528 78.375 5.935 6.652 536 HA LYS 528 HA LYS 528 81.152 6.168 6.147 537 HB2 LYS 528 HB2 LYS 528 79.819 7.877 7.297 538 HB3 LYS 528 HB3 LYS 528 79.550 6.759 8.631 539 HG2 LYS 528 HG2 LYS 528 81.940 6.702 9.122 540 HG3 LYS 528 HG3 LYS 528 82.272 7.720 7.719 541 HD2 LYS 528 HD2 LYS 528 82.254 9.157 9.665 542 HD3 LYS 528 HD3 LYS 528 80.791 9.485 8.738 543 HE2 LYS 528 HE2 LYS 528 79.410 8.357 10.264 544 HE3 LYS 528 HE3 LYS 528 80.751 7.450 10.963 545 HZ1 LYS 528 HZ1 LYS 528 80.621 9.014 12.542 546 HZ2 LYS 528 HZ2 LYS 528 79.811 10.126 11.545 547 HZ3 LYS 528 HZ3 LYS 528 81.500 9.967 11.450 548 H SER 529 H SER 529 79.300 4.344 8.578 549 HA SER 529 HA SER 529 81.648 3.256 9.799 550 HB2 SER 529 HB2 SER 529 79.525 3.540 11.028 551 HB3 SER 529 HB3 SER 529 78.765 2.348 9.978 552 HG SER 529 HG SER 529 80.827 2.012 11.876 553 H ALA 530 H ALA 530 79.743 2.452 7.057 554 HA ALA 530 HA ALA 530 80.424 -0.349 6.979 555 HB1 ALA 530 HB1 ALA 530 78.395 0.211 5.895 556 HB2 ALA 530 HB2 ALA 530 79.532 -0.106 4.582 557 HB3 ALA 530 HB3 ALA 530 79.137 1.554 5.029 558 H VAL 531 H VAL 531 82.411 2.089 6.885 559 HA VAL 531 HA VAL 531 83.911 1.358 4.465 560 HB VAL 531 HB VAL 531 83.395 3.768 5.214 561 HG11 VAL 531 HG11 VAL 531 84.643 4.749 6.935 562 HG12 VAL 531 HG12 VAL 531 85.830 3.444 6.953 563 HG13 VAL 531 HG13 VAL 531 84.218 3.179 7.611 564 HG21 VAL 531 HG21 VAL 531 85.521 4.577 4.336 565 HG22 VAL 531 HG22 VAL 531 85.038 3.134 3.446 566 HG23 VAL 531 HG23 VAL 531 86.289 3.031 4.683 567 H THR 532 H THR 532 83.673 -0.008 7.357 568 HA THR 532 HA THR 532 86.548 -0.695 7.446 569 HB THR 532 HB THR 532 86.584 0.614 9.326 570 HG1 THR 532 HG1 THR 532 86.058 -0.764 11.157 571 HG21 THR 532 HG21 THR 532 84.642 1.031 10.788 572 HG22 THR 532 HG22 THR 532 83.667 -0.063 9.818 573 HG23 THR 532 HG23 THR 532 84.275 1.429 9.117 574 H GLU 533 H GLU 533 83.635 -1.692 9.289 575 HA GLU 533 HA GLU 533 84.396 -4.495 8.830 576 HB2 GLU 533 HB2 GLU 533 82.480 -3.198 10.781 577 HB3 GLU 533 HB3 GLU 533 82.700 -4.941 10.626 578 HG2 GLU 533 HG2 GLU 533 84.950 -2.998 11.226 579 HG3 GLU 533 HG3 GLU 533 84.080 -3.909 12.459 580 H PHE 534 H PHE 534 82.659 -2.340 7.198 581 HA PHE 534 HA PHE 534 80.871 -2.405 5.768 582 HB2 PHE 534 HB2 PHE 534 81.776 -5.278 5.775 583 HB3 PHE 534 HB3 PHE 534 80.589 -4.640 4.637 584 HD1 PHE 534 HD1 PHE 534 81.240 -2.993 2.930 585 HD2 PHE 534 HD2 PHE 534 84.109 -4.622 5.680 586 HE1 PHE 534 HE1 PHE 534 83.086 -2.112 1.527 587 HE2 PHE 534 HE2 PHE 534 85.954 -3.743 4.278 588 HZ PHE 534 HZ PHE 534 85.443 -2.486 2.202 589 H GLU 535 H GLU 535 78.932 -1.973 6.646 590 HA GLU 535 HA GLU 535 77.700 -3.511 8.692 591 HB2 GLU 535 HB2 GLU 535 76.565 -1.477 6.776 592 HB3 GLU 535 HB3 GLU 535 75.713 -2.110 8.183 593 HG2 GLU 535 HG2 GLU 535 78.398 -0.710 8.320 594 HG3 GLU 535 HG3 GLU 535 76.855 0.096 8.599 595 H ASN 536 H ASN 536 78.415 -5.024 6.246 596 HA ASN 536 HA ASN 536 75.944 -6.491 5.973 597 HB2 ASN 536 HB2 ASN 536 75.556 -4.835 4.272 598 HB3 ASN 536 HB3 ASN 536 77.183 -5.038 3.631 599 HD21 ASN 536 HD21 ASN 536 75.825 -8.040 4.581 600 HD22 ASN 536 HD22 ASN 536 75.328 -8.557 3.041 601 H VAL 537 H VAL 537 77.827 -7.717 7.159 602 HA VAL 537 HA VAL 537 79.624 -9.055 5.238 603 HB VAL 537 HB VAL 537 79.544 -9.433 8.243 604 HG11 VAL 537 HG11 VAL 537 82.045 -9.857 7.746 605 HG12 VAL 537 HG12 VAL 537 81.559 -9.989 6.058 606 HG13 VAL 537 HG13 VAL 537 80.902 -11.095 7.257 607 HG21 VAL 537 HG21 VAL 537 81.511 -7.750 8.155 608 HG22 VAL 537 HG22 VAL 537 79.876 -7.104 8.044 609 HG23 VAL 537 HG23 VAL 537 80.852 -7.272 6.588 610 H THR 538 H THR 538 79.106 -11.012 4.441 611 HA THR 538 HA THR 538 77.523 -12.908 6.012 612 HB THR 538 HB THR 538 75.918 -13.215 4.104 613 HG1 THR 538 HG1 THR 538 76.591 -12.234 2.371 614 HG21 THR 538 HG21 THR 538 75.833 -10.393 5.184 615 HG22 THR 538 HG22 THR 538 75.482 -11.796 6.193 616 HG23 THR 538 HG23 THR 538 74.475 -11.446 4.789 617 HA PRO 539 HA PRO 539 80.635 -14.811 3.148 618 HB2 PRO 539 HB2 PRO 539 81.835 -16.146 5.448 619 HB3 PRO 539 HB3 PRO 539 82.555 -14.919 4.392 620 HG2 PRO 539 HG2 PRO 539 81.909 -14.478 7.022 621 HG3 PRO 539 HG3 PRO 539 81.998 -13.200 5.797 622 HD2 PRO 539 HD2 PRO 539 79.567 -14.605 6.877 623 HD3 PRO 539 HD3 PRO 539 79.795 -12.886 6.497 624 H THR 540 H THR 540 80.718 -17.030 2.448 625 HA THR 540 HA THR 540 78.533 -18.694 3.548 626 HB THR 540 HB THR 540 78.117 -18.328 1.263 627 HG1 THR 540 HG1 THR 540 78.546 -20.658 2.037 628 HG21 THR 540 HG21 THR 540 79.977 -18.639 -0.436 629 HG22 THR 540 HG22 THR 540 81.099 -18.700 0.922 630 HG23 THR 540 HG23 THR 540 80.155 -17.239 0.625 631 H ASN 541 H ASN 541 81.913 -18.482 3.292 632 HA ASN 541 HA ASN 541 83.640 -19.939 3.766 633 HB2 ASN 541 HB2 ASN 541 82.288 -19.916 5.940 634 HB3 ASN 541 HB3 ASN 541 81.601 -21.450 5.410 635 HD21 ASN 541 HD21 ASN 541 84.799 -19.883 5.982 636 HD22 ASN 541 HD22 ASN 541 85.579 -21.317 6.444 637 H ASP 542 H ASP 542 83.163 -20.492 1.403 638 HA ASP 542 HA ASP 542 81.761 -22.791 0.640 639 HB2 ASP 542 HB2 ASP 542 84.126 -21.415 -0.641 640 HB3 ASP 542 HB3 ASP 542 83.190 -22.693 -1.415 641 H GLN 543 H GLN 543 82.279 -24.897 0.328 642 HA GLN 543 HA GLN 543 84.085 -26.182 2.028 643 HB2 GLN 543 HB2 GLN 543 82.156 -27.299 0.971 644 HB3 GLN 543 HB3 GLN 543 82.944 -27.170 -0.601 645 HG2 GLN 543 HG2 GLN 543 84.773 -28.592 0.141 646 HG3 GLN 543 HG3 GLN 543 84.126 -28.627 1.781 647 HE21 GLN 543 HE21 GLN 543 84.525 -31.044 0.259 648 HE22 GLN 543 HE22 GLN 543 83.000 -31.715 -0.066 Start of MODEL 9 1 H1 SER 466 H1 SER 466 30.949 6.386 3.493 2 H2 SER 466 H2 SER 466 31.062 5.686 1.949 3 H3 SER 466 H3 SER 466 30.878 7.367 2.111 4 HA SER 466 HA SER 466 33.124 7.159 1.655 5 HB2 SER 466 HB2 SER 466 32.785 8.514 3.668 6 HB3 SER 466 HB3 SER 466 32.790 7.063 4.670 7 HG SER 466 HG SER 466 34.927 7.997 3.042 8 H ASP 467 H ASP 467 31.664 4.460 3.081 9 HA ASP 467 HA ASP 467 33.877 2.903 3.867 10 HB2 ASP 467 HB2 ASP 467 31.120 2.176 2.874 11 HB3 ASP 467 HB3 ASP 467 32.285 0.971 3.420 12 H ASP 468 H ASP 468 32.260 3.288 0.741 13 HA ASP 468 HA ASP 468 33.879 1.306 -0.575 14 HB2 ASP 468 HB2 ASP 468 31.994 3.438 -1.585 15 HB3 ASP 468 HB3 ASP 468 32.809 2.278 -2.634 16 H TYR 469 H TYR 469 33.424 4.537 -1.743 17 HA TYR 469 HA TYR 469 36.089 4.771 -2.728 18 HB2 TYR 469 HB2 TYR 469 33.985 5.718 -3.699 19 HB3 TYR 469 HB3 TYR 469 33.986 6.895 -2.390 20 HD1 TYR 469 HD1 TYR 469 35.870 5.682 -5.352 21 HD2 TYR 469 HD2 TYR 469 35.479 8.766 -2.389 22 HE1 TYR 469 HE1 TYR 469 37.435 7.113 -6.635 23 HE2 TYR 469 HE2 TYR 469 37.040 10.200 -3.675 24 HH TYR 469 HH TYR 469 38.919 9.004 -6.282 25 H VAL 470 H VAL 470 37.728 6.206 -2.053 26 HA VAL 470 HA VAL 470 37.518 7.131 0.760 27 HB VAL 470 HB VAL 470 40.097 6.561 -0.692 28 HG11 VAL 470 HG11 VAL 470 40.813 6.125 1.695 29 HG12 VAL 470 HG12 VAL 470 39.251 6.753 2.211 30 HG13 VAL 470 HG13 VAL 470 40.378 7.796 1.345 31 HG21 VAL 470 HG21 VAL 470 38.295 4.653 0.817 32 HG22 VAL 470 HG22 VAL 470 40.001 4.334 0.507 33 HG23 VAL 470 HG23 VAL 470 38.876 4.494 -0.841 34 H ASP 471 H ASP 471 38.785 9.044 1.335 35 HA ASP 471 HA ASP 471 38.255 11.225 -0.368 36 HB2 ASP 471 HB2 ASP 471 40.010 10.958 2.075 37 HB3 ASP 471 HB3 ASP 471 39.752 12.488 1.243 38 H GLU 472 H GLU 472 39.591 12.492 -1.617 39 HA GLU 472 HA GLU 472 41.526 11.235 -3.197 40 HB2 GLU 472 HB2 GLU 472 40.948 14.159 -2.694 41 HB3 GLU 472 HB3 GLU 472 42.054 13.581 -3.941 42 HG2 GLU 472 HG2 GLU 472 40.272 12.331 -5.021 43 HG3 GLU 472 HG3 GLU 472 39.154 12.729 -3.718 44 H GLU 473 H GLU 473 41.951 13.435 -0.418 45 HA GLU 473 HA GLU 473 44.766 13.659 -0.641 46 HB2 GLU 473 HB2 GLU 473 44.671 14.553 1.602 47 HB3 GLU 473 HB3 GLU 473 43.306 15.174 0.680 48 HG2 GLU 473 HG2 GLU 473 41.969 13.209 1.657 49 HG3 GLU 473 HG3 GLU 473 43.308 13.013 2.788 50 H THR 474 H THR 474 42.685 11.552 1.243 51 HA THR 474 HA THR 474 44.714 10.097 2.602 52 HB THR 474 HB THR 474 41.837 9.532 1.884 53 HG1 THR 474 HG1 THR 474 41.495 10.443 3.736 54 HG21 THR 474 HG21 THR 474 42.032 7.653 3.588 55 HG22 THR 474 HG22 THR 474 43.782 7.782 3.392 56 HG23 THR 474 HG23 THR 474 42.765 7.353 2.013 57 H TYR 475 H TYR 475 42.881 9.529 -0.353 58 HA TYR 475 HA TYR 475 43.880 6.982 -0.937 59 HB2 TYR 475 HB2 TYR 475 41.871 8.178 -1.921 60 HB3 TYR 475 HB3 TYR 475 43.000 9.042 -2.962 61 HD1 TYR 475 HD1 TYR 475 42.076 5.620 -1.843 62 HD2 TYR 475 HD2 TYR 475 43.679 8.061 -4.980 63 HE1 TYR 475 HE1 TYR 475 42.104 3.643 -3.360 64 HE2 TYR 475 HE2 TYR 475 43.720 6.096 -6.502 65 HH TYR 475 HH TYR 475 43.842 3.427 -6.061 66 H ASN 476 H ASN 476 44.984 10.192 -2.047 67 HA ASN 476 HA ASN 476 47.072 9.156 -3.696 68 HB2 ASN 476 HB2 ASN 476 46.943 11.880 -2.379 69 HB3 ASN 476 HB3 ASN 476 47.857 11.414 -3.819 70 HD21 ASN 476 HD21 ASN 476 45.382 9.647 -4.532 71 HD22 ASN 476 HD22 ASN 476 44.305 10.754 -5.237 72 H LEU 477 H LEU 477 46.810 10.087 -0.314 73 HA LEU 477 HA LEU 477 49.539 10.106 0.368 74 HB2 LEU 477 HB2 LEU 477 47.814 10.922 1.880 75 HB3 LEU 477 HB3 LEU 477 47.092 9.324 1.975 76 HG LEU 477 HG LEU 477 49.133 8.448 3.030 77 HD11 LEU 477 HD11 LEU 477 50.761 10.326 3.861 78 HD12 LEU 477 HD12 LEU 477 50.100 11.260 2.520 79 HD13 LEU 477 HD13 LEU 477 50.924 9.733 2.210 80 HD21 LEU 477 HD21 LEU 477 48.939 9.727 5.167 81 HD22 LEU 477 HD22 LEU 477 47.373 9.298 4.478 82 HD23 LEU 477 HD23 LEU 477 47.989 10.943 4.313 83 H GLN 478 H GLN 478 47.123 7.502 0.206 84 HA GLN 478 HA GLN 478 48.742 5.397 1.159 85 HB2 GLN 478 HB2 GLN 478 46.401 5.456 -0.755 86 HB3 GLN 478 HB3 GLN 478 47.146 3.963 -0.189 87 HG2 GLN 478 HG2 GLN 478 46.074 6.094 1.666 88 HG3 GLN 478 HG3 GLN 478 45.128 4.705 1.132 89 HE21 GLN 478 HE21 GLN 478 46.608 5.626 3.798 90 HE22 GLN 478 HE22 GLN 478 47.327 4.175 4.311 91 H LYS 479 H LYS 479 48.204 6.724 -2.062 92 HA LYS 479 HA LYS 479 49.772 4.837 -3.495 93 HB2 LYS 479 HB2 LYS 479 48.861 7.656 -4.127 94 HB3 LYS 479 HB3 LYS 479 49.723 6.627 -5.277 95 HG2 LYS 479 HG2 LYS 479 47.884 4.863 -4.808 96 HG3 LYS 479 HG3 LYS 479 46.998 6.177 -4.042 97 HD2 LYS 479 HD2 LYS 479 48.066 6.356 -6.862 98 HD3 LYS 479 HD3 LYS 479 46.455 5.766 -6.487 99 HE2 LYS 479 HE2 LYS 479 45.998 7.919 -5.307 100 HE3 LYS 479 HE3 LYS 479 47.567 8.509 -5.875 101 HZ1 LYS 479 HZ1 LYS 479 45.806 9.187 -7.363 102 HZ2 LYS 479 HZ2 LYS 479 45.327 7.574 -7.584 103 HZ3 LYS 479 HZ3 LYS 479 46.842 8.098 -8.149 104 H LEU 480 H LEU 480 50.464 7.947 -2.037 105 HA LEU 480 HA LEU 480 53.038 8.347 -3.095 106 HB2 LEU 480 HB2 LEU 480 51.528 9.347 -0.698 107 HB3 LEU 480 HB3 LEU 480 53.208 9.816 -0.944 108 HG LEU 480 HG LEU 480 51.270 10.084 -3.251 109 HD11 LEU 480 HD11 LEU 480 50.000 11.237 -1.622 110 HD12 LEU 480 HD12 LEU 480 50.935 12.507 -2.409 111 HD13 LEU 480 HD13 LEU 480 51.435 11.890 -0.834 112 HD21 LEU 480 HD21 LEU 480 53.726 11.606 -2.322 113 HD22 LEU 480 HD22 LEU 480 52.764 12.047 -3.729 114 HD23 LEU 480 HD23 LEU 480 53.624 10.510 -3.696 115 H LEU 481 H LEU 481 51.918 6.607 -0.257 116 HA LEU 481 HA LEU 481 54.440 6.245 0.976 117 HB2 LEU 481 HB2 LEU 481 51.802 4.795 1.182 118 HB3 LEU 481 HB3 LEU 481 53.188 4.424 2.203 119 HG LEU 481 HG LEU 481 52.045 7.208 1.921 120 HD11 LEU 481 HD11 LEU 481 51.075 6.688 4.243 121 HD12 LEU 481 HD12 LEU 481 51.342 4.991 3.844 122 HD13 LEU 481 HD13 LEU 481 50.256 5.968 2.856 123 HD21 LEU 481 HD21 LEU 481 53.950 7.725 3.013 124 HD22 LEU 481 HD22 LEU 481 54.348 6.038 3.327 125 HD23 LEU 481 HD23 LEU 481 53.280 6.906 4.420 126 H ALA 482 H ALA 482 52.539 4.232 -1.236 127 HA ALA 482 HA ALA 482 53.705 1.829 -1.146 128 HB1 ALA 482 HB1 ALA 482 53.575 2.197 -3.899 129 HB2 ALA 482 HB2 ALA 482 52.463 3.411 -3.271 130 HB3 ALA 482 HB3 ALA 482 52.234 1.717 -2.859 131 HA PRO 483 HA PRO 483 57.341 2.866 -4.310 132 HB2 PRO 483 HB2 PRO 483 58.045 5.615 -3.786 133 HB3 PRO 483 HB3 PRO 483 57.456 4.923 -5.298 134 HG2 PRO 483 HG2 PRO 483 55.996 6.346 -3.178 135 HG3 PRO 483 HG3 PRO 483 55.630 6.228 -4.902 136 HD2 PRO 483 HD2 PRO 483 54.174 4.944 -3.051 137 HD3 PRO 483 HD3 PRO 483 54.501 4.205 -4.633 138 H TYR 484 H TYR 484 57.470 5.135 -1.542 139 HA TYR 484 HA TYR 484 60.060 4.386 -0.674 140 HB2 TYR 484 HB2 TYR 484 59.438 6.473 0.103 141 HB3 TYR 484 HB3 TYR 484 57.770 5.975 0.422 142 HD1 TYR 484 HD1 TYR 484 57.179 4.772 2.479 143 HD2 TYR 484 HD2 TYR 484 61.207 6.089 1.778 144 HE1 TYR 484 HE1 TYR 484 57.731 4.347 4.863 145 HE2 TYR 484 HE2 TYR 484 61.748 5.669 4.165 146 HH TYR 484 HH TYR 484 59.287 4.820 6.504 147 H HIS 485 H HIS 485 56.832 3.298 0.227 148 HA HIS 485 HA HIS 485 57.520 1.660 2.411 149 HB2 HIS 485 HB2 HIS 485 55.215 2.383 1.687 150 HB3 HIS 485 HB3 HIS 485 55.305 1.164 0.421 151 HD1 HIS 485 HD1 HIS 485 54.220 1.598 3.818 152 HD2 HIS 485 HD2 HIS 485 55.907 -1.543 1.665 153 HE1 HIS 485 HE1 HIS 485 53.711 -0.516 5.119 154 H LYS 486 H LYS 486 57.805 1.205 -1.036 155 HA LYS 486 HA LYS 486 58.296 -1.663 -0.843 156 HB2 LYS 486 HB2 LYS 486 58.347 0.344 -3.104 157 HB3 LYS 486 HB3 LYS 486 58.787 -1.349 -3.320 158 HG2 LYS 486 HG2 LYS 486 56.576 -2.067 -2.579 159 HG3 LYS 486 HG3 LYS 486 56.127 -0.405 -2.203 160 HD2 LYS 486 HD2 LYS 486 56.399 0.208 -4.582 161 HD3 LYS 486 HD3 LYS 486 56.838 -1.458 -4.958 162 HE2 LYS 486 HE2 LYS 486 54.630 -2.221 -4.169 163 HE3 LYS 486 HE3 LYS 486 54.192 -0.558 -3.779 164 HZ1 LYS 486 HZ1 LYS 486 54.402 -1.865 -6.370 165 HZ2 LYS 486 HZ2 LYS 486 54.950 -0.258 -6.295 166 HZ3 LYS 486 HZ3 LYS 486 53.353 -0.636 -5.856 167 H ALA 487 H ALA 487 60.058 1.252 -0.634 168 HA ALA 487 HA ALA 487 62.584 0.445 -1.606 169 HB1 ALA 487 HB1 ALA 487 63.390 2.450 -0.626 170 HB2 ALA 487 HB2 ALA 487 62.097 2.480 0.566 171 HB3 ALA 487 HB3 ALA 487 61.741 2.811 -1.130 172 H LYS 488 H LYS 488 63.673 -1.230 -0.809 173 HA LYS 488 HA LYS 488 63.498 -1.980 2.026 174 HB2 LYS 488 HB2 LYS 488 64.926 -3.295 -0.298 175 HB3 LYS 488 HB3 LYS 488 64.732 -3.979 1.317 176 HG2 LYS 488 HG2 LYS 488 62.300 -3.991 1.055 177 HG3 LYS 488 HG3 LYS 488 62.449 -3.220 -0.525 178 HD2 LYS 488 HD2 LYS 488 63.800 -5.175 -1.300 179 HD3 LYS 488 HD3 LYS 488 63.480 -5.960 0.249 180 HE2 LYS 488 HE2 LYS 488 61.078 -5.860 -0.162 181 HE3 LYS 488 HE3 LYS 488 61.357 -4.997 -1.675 182 HZ1 LYS 488 HZ1 LYS 488 61.218 -7.100 -2.467 183 HZ2 LYS 488 HZ2 LYS 488 61.779 -7.813 -1.031 184 HZ3 LYS 488 HZ3 LYS 488 62.876 -7.087 -2.108 185 H THR 489 H THR 489 65.460 -0.061 0.054 186 HA THR 489 HA THR 489 67.834 -0.466 1.790 187 HB THR 489 HB THR 489 69.183 0.159 -0.007 188 HG1 THR 489 HG1 THR 489 68.613 1.701 -1.295 189 HG21 THR 489 HG21 THR 489 66.811 -1.035 -1.455 190 HG22 THR 489 HG22 THR 489 67.852 -1.979 -0.390 191 HG23 THR 489 HG23 THR 489 68.522 -1.229 -1.840 192 H LEU 490 H LEU 490 68.692 1.248 2.905 193 HA LEU 490 HA LEU 490 67.065 3.424 3.617 194 HB2 LEU 490 HB2 LEU 490 69.993 2.786 3.920 195 HB3 LEU 490 HB3 LEU 490 69.356 4.332 4.482 196 HG LEU 490 HG LEU 490 67.685 3.109 5.855 197 HD11 LEU 490 HD11 LEU 490 68.225 0.612 6.189 198 HD12 LEU 490 HD12 LEU 490 69.112 0.730 4.670 199 HD13 LEU 490 HD13 LEU 490 67.379 1.062 4.710 200 HD21 LEU 490 HD21 LEU 490 69.385 2.091 7.462 201 HD22 LEU 490 HD22 LEU 490 69.696 3.762 6.992 202 HD23 LEU 490 HD23 LEU 490 70.614 2.451 6.249 203 H GLU 491 H GLU 491 69.780 3.214 1.331 204 HA GLU 491 HA GLU 491 70.035 5.902 0.618 205 HB2 GLU 491 HB2 GLU 491 71.660 4.317 -0.112 206 HB3 GLU 491 HB3 GLU 491 70.441 3.332 -0.914 207 HG2 GLU 491 HG2 GLU 491 70.094 4.990 -2.606 208 HG3 GLU 491 HG3 GLU 491 71.072 6.178 -1.739 209 H ARG 492 H ARG 492 67.833 3.424 -0.531 210 HA ARG 492 HA ARG 492 66.646 4.975 -2.616 211 HB2 ARG 492 HB2 ARG 492 66.604 2.524 -2.597 212 HB3 ARG 492 HB3 ARG 492 65.647 2.540 -1.124 213 HG2 ARG 492 HG2 ARG 492 64.047 2.209 -2.826 214 HG3 ARG 492 HG3 ARG 492 63.917 3.931 -2.499 215 HD2 ARG 492 HD2 ARG 492 65.309 4.440 -4.433 216 HD3 ARG 492 HD3 ARG 492 65.622 2.726 -4.700 217 HE ARG 492 HE ARG 492 62.833 3.165 -4.708 218 HH11 ARG 492 HH11 ARG 492 64.288 5.439 -6.370 219 HH12 ARG 492 HH12 ARG 492 64.074 4.801 -7.966 220 HH21 ARG 492 HH21 ARG 492 63.153 1.644 -6.870 221 HH22 ARG 492 HH22 ARG 492 63.432 2.654 -8.249 222 H GLN 493 H GLN 493 65.843 4.342 0.779 223 HA GLN 493 HA GLN 493 63.286 5.455 0.830 224 HB2 GLN 493 HB2 GLN 493 65.461 5.325 2.922 225 HB3 GLN 493 HB3 GLN 493 63.840 5.922 3.261 226 HG2 GLN 493 HG2 GLN 493 62.859 3.798 2.594 227 HG3 GLN 493 HG3 GLN 493 64.428 3.202 2.067 228 HE21 GLN 493 HE21 GLN 493 63.546 1.483 3.797 229 HE22 GLN 493 HE22 GLN 493 64.102 1.729 5.382 230 H VAL 494 H VAL 494 66.436 7.030 1.414 231 HA VAL 494 HA VAL 494 65.429 9.630 1.873 232 HB VAL 494 HB VAL 494 68.062 8.614 0.776 233 HG11 VAL 494 HG11 VAL 494 67.227 11.432 1.527 234 HG12 VAL 494 HG12 VAL 494 67.848 10.881 -0.029 235 HG13 VAL 494 HG13 VAL 494 68.906 10.915 1.376 236 HG21 VAL 494 HG21 VAL 494 68.821 9.293 3.071 237 HG22 VAL 494 HG22 VAL 494 67.633 7.991 3.080 238 HG23 VAL 494 HG23 VAL 494 67.141 9.637 3.478 239 H TYR 495 H TYR 495 66.569 8.051 -1.101 240 HA TYR 495 HA TYR 495 66.192 10.203 -2.867 241 HB2 TYR 495 HB2 TYR 495 67.491 8.215 -3.398 242 HB3 TYR 495 HB3 TYR 495 66.038 7.223 -3.333 243 HD1 TYR 495 HD1 TYR 495 67.492 10.199 -5.078 244 HD2 TYR 495 HD2 TYR 495 64.765 6.882 -5.279 245 HE1 TYR 495 HE1 TYR 495 67.091 10.676 -7.477 246 HE2 TYR 495 HE2 TYR 495 64.371 7.357 -7.684 247 HH TYR 495 HH TYR 495 66.017 8.688 -9.584 248 H GLU 496 H GLU 496 64.010 7.512 -2.038 249 HA GLU 496 HA GLU 496 61.906 8.317 -3.747 250 HB2 GLU 496 HB2 GLU 496 62.386 6.075 -2.408 251 HB3 GLU 496 HB3 GLU 496 61.350 6.834 -1.205 252 HG2 GLU 496 HG2 GLU 496 59.951 5.526 -2.633 253 HG3 GLU 496 HG3 GLU 496 59.654 7.213 -3.042 254 H LEU 497 H LEU 497 62.676 8.999 -0.382 255 HA LEU 497 HA LEU 497 60.311 10.374 0.278 256 HB2 LEU 497 HB2 LEU 497 63.114 10.368 1.380 257 HB3 LEU 497 HB3 LEU 497 61.884 11.436 2.049 258 HG LEU 497 HG LEU 497 61.504 8.445 1.747 259 HD11 LEU 497 HD11 LEU 497 62.040 9.818 4.359 260 HD12 LEU 497 HD12 LEU 497 63.374 9.229 3.367 261 HD13 LEU 497 HD13 LEU 497 62.158 8.107 3.972 262 HD21 LEU 497 HD21 LEU 497 59.836 10.689 2.780 263 HD22 LEU 497 HD22 LEU 497 59.802 9.196 3.709 264 HD23 LEU 497 HD23 LEU 497 59.352 9.181 2.011 265 H GLU 498 H GLU 498 63.345 11.433 -1.190 266 HA GLU 498 HA GLU 498 62.970 14.207 -1.052 267 HB2 GLU 498 HB2 GLU 498 64.384 12.410 -3.019 268 HB3 GLU 498 HB3 GLU 498 64.389 14.158 -3.209 269 HG2 GLU 498 HG2 GLU 498 65.188 12.844 -0.620 270 HG3 GLU 498 HG3 GLU 498 66.345 13.107 -1.917 271 H LYS 499 H LYS 499 62.025 11.885 -3.571 272 HA LYS 499 HA LYS 499 60.767 13.782 -5.301 273 HB2 LYS 499 HB2 LYS 499 60.559 10.792 -4.923 274 HB3 LYS 499 HB3 LYS 499 59.662 11.651 -6.178 275 HG2 LYS 499 HG2 LYS 499 61.576 12.240 -7.356 276 HG3 LYS 499 HG3 LYS 499 62.613 12.182 -5.931 277 HD2 LYS 499 HD2 LYS 499 62.947 9.905 -6.070 278 HD3 LYS 499 HD3 LYS 499 61.366 9.600 -6.806 279 HE2 LYS 499 HE2 LYS 499 63.711 10.922 -8.201 280 HE3 LYS 499 HE3 LYS 499 63.209 9.246 -8.432 281 HZ1 LYS 499 HZ1 LYS 499 60.956 10.848 -8.745 282 HZ2 LYS 499 HZ2 LYS 499 61.764 9.938 -9.932 283 HZ3 LYS 499 HZ3 LYS 499 62.195 11.559 -9.660 284 H LEU 500 H LEU 500 59.534 11.619 -2.793 285 HA LEU 500 HA LEU 500 56.800 12.196 -3.108 286 HB2 LEU 500 HB2 LEU 500 58.413 11.251 -0.739 287 HB3 LEU 500 HB3 LEU 500 56.657 11.299 -0.769 288 HG LEU 500 HG LEU 500 58.234 9.863 -2.912 289 HD11 LEU 500 HD11 LEU 500 58.929 8.772 -0.905 290 HD12 LEU 500 HD12 LEU 500 57.627 7.775 -1.553 291 HD13 LEU 500 HD13 LEU 500 57.313 8.871 -0.206 292 HD21 LEU 500 HD21 LEU 500 56.004 8.554 -2.904 293 HD22 LEU 500 HD22 LEU 500 55.990 10.154 -3.601 294 HD23 LEU 500 HD23 LEU 500 55.359 9.893 -1.977 295 H GLN 501 H GLN 501 59.296 13.663 -1.092 296 HA GLN 501 HA GLN 501 57.716 15.387 0.439 297 HB2 GLN 501 HB2 GLN 501 60.549 15.181 -0.378 298 HB3 GLN 501 HB3 GLN 501 60.049 16.819 0.028 299 HG2 GLN 501 HG2 GLN 501 60.923 15.643 2.005 300 HG3 GLN 501 HG3 GLN 501 59.213 16.024 2.207 301 HE21 GLN 501 HE21 GLN 501 60.650 13.888 3.571 302 HE22 GLN 501 HE22 GLN 501 59.932 12.426 3.106 303 H GLU 502 H GLU 502 58.736 15.587 -2.892 304 HA GLU 502 HA GLU 502 58.056 18.372 -3.238 305 HB2 GLU 502 HB2 GLU 502 59.810 17.303 -4.566 306 HB3 GLU 502 HB3 GLU 502 58.646 16.148 -5.205 307 HG2 GLU 502 HG2 GLU 502 59.032 17.895 -6.835 308 HG3 GLU 502 HG3 GLU 502 57.387 18.024 -6.239 309 H LYS 503 H LYS 503 56.434 15.319 -3.404 310 HA LYS 503 HA LYS 503 54.132 16.499 -4.852 311 HB2 LYS 503 HB2 LYS 503 54.897 13.668 -4.183 312 HB3 LYS 503 HB3 LYS 503 53.433 14.128 -5.056 313 HG2 LYS 503 HG2 LYS 503 54.846 15.279 -6.757 314 HG3 LYS 503 HG3 LYS 503 56.283 14.719 -5.907 315 HD2 LYS 503 HD2 LYS 503 54.157 12.839 -6.959 316 HD3 LYS 503 HD3 LYS 503 55.579 13.297 -7.891 317 HE2 LYS 503 HE2 LYS 503 56.971 12.498 -5.891 318 HE3 LYS 503 HE3 LYS 503 55.485 11.764 -5.285 319 HZ1 LYS 503 HZ1 LYS 503 57.222 10.723 -7.158 320 HZ2 LYS 503 HZ2 LYS 503 55.821 11.154 -8.017 321 HZ3 LYS 503 HZ3 LYS 503 55.717 10.098 -6.689 322 H LEU 504 H LEU 504 55.073 15.257 -1.734 323 HA LEU 504 HA LEU 504 52.531 14.630 -0.747 324 HB2 LEU 504 HB2 LEU 504 55.196 15.230 0.447 325 HB3 LEU 504 HB3 LEU 504 53.796 15.159 1.516 326 HG LEU 504 HG LEU 504 54.219 12.932 -0.475 327 HD11 LEU 504 HD11 LEU 504 55.546 11.734 1.292 328 HD12 LEU 504 HD12 LEU 504 55.624 13.259 2.165 329 HD13 LEU 504 HD13 LEU 504 56.388 13.123 0.602 330 HD21 LEU 504 HD21 LEU 504 52.867 11.691 1.002 331 HD22 LEU 504 HD22 LEU 504 52.177 13.308 1.146 332 HD23 LEU 504 HD23 LEU 504 53.275 12.706 2.385 333 HA PRO 505 HA PRO 505 50.762 18.870 -0.680 334 HB2 PRO 505 HB2 PRO 505 49.175 18.015 1.613 335 HB3 PRO 505 HB3 PRO 505 48.626 18.323 -0.043 336 HG2 PRO 505 HG2 PRO 505 49.429 15.756 1.220 337 HG3 PRO 505 HG3 PRO 505 48.290 16.050 -0.098 338 HD2 PRO 505 HD2 PRO 505 50.608 14.961 -0.624 339 HD3 PRO 505 HD3 PRO 505 50.020 16.252 -1.687 340 H GLU 506 H GLU 506 51.106 20.652 0.591 341 HA GLU 506 HA GLU 506 53.336 21.074 1.982 342 HB2 GLU 506 HB2 GLU 506 50.624 22.294 2.527 343 HB3 GLU 506 HB3 GLU 506 52.137 22.932 3.175 344 HG2 GLU 506 HG2 GLU 506 53.018 23.256 0.924 345 HG3 GLU 506 HG3 GLU 506 51.586 22.502 0.226 346 H LYS 507 H LYS 507 50.314 20.595 3.838 347 HA LYS 507 HA LYS 507 51.472 20.375 6.357 348 HB2 LYS 507 HB2 LYS 507 49.366 18.796 6.760 349 HB3 LYS 507 HB3 LYS 507 49.147 20.516 6.427 350 HG2 LYS 507 HG2 LYS 507 48.608 20.133 4.156 351 HG3 LYS 507 HG3 LYS 507 49.241 18.495 4.193 352 HD2 LYS 507 HD2 LYS 507 47.423 17.833 5.728 353 HD3 LYS 507 HD3 LYS 507 46.779 19.476 5.656 354 HE2 LYS 507 HE2 LYS 507 47.207 17.739 3.215 355 HE3 LYS 507 HE3 LYS 507 45.668 17.846 4.070 356 HZ1 LYS 507 HZ1 LYS 507 47.140 20.080 2.781 357 HZ2 LYS 507 HZ2 LYS 507 45.733 20.269 3.715 358 HZ3 LYS 507 HZ3 LYS 507 45.678 19.398 2.257 359 H TYR 508 H TYR 508 51.333 18.000 3.792 360 HA TYR 508 HA TYR 508 52.216 15.839 5.567 361 HB2 TYR 508 HB2 TYR 508 51.390 16.038 2.677 362 HB3 TYR 508 HB3 TYR 508 52.273 14.626 3.247 363 HD1 TYR 508 HD1 TYR 508 51.333 13.204 5.032 364 HD2 TYR 508 HD2 TYR 508 49.104 16.408 3.295 365 HE1 TYR 508 HE1 TYR 508 49.253 12.258 5.976 366 HE2 TYR 508 HE2 TYR 508 47.007 15.463 4.211 367 HH TYR 508 HH TYR 508 47.036 12.420 6.074 368 H LYS 509 H LYS 509 53.439 18.160 3.321 369 HA LYS 509 HA LYS 509 55.865 16.922 2.590 370 HB2 LYS 509 HB2 LYS 509 54.877 18.941 1.532 371 HB3 LYS 509 HB3 LYS 509 55.254 19.855 2.986 372 HG2 LYS 509 HG2 LYS 509 57.633 19.431 2.684 373 HG3 LYS 509 HG3 LYS 509 57.299 18.442 1.262 374 HD2 LYS 509 HD2 LYS 509 56.245 20.387 0.163 375 HD3 LYS 509 HD3 LYS 509 56.604 21.374 1.577 376 HE2 LYS 509 HE2 LYS 509 59.010 21.003 1.241 377 HE3 LYS 509 HE3 LYS 509 58.664 19.989 -0.162 378 HZ1 LYS 509 HZ1 LYS 509 57.303 22.461 -0.366 379 HZ2 LYS 509 HZ2 LYS 509 58.446 21.778 -1.423 380 HZ3 LYS 509 HZ3 LYS 509 58.959 22.736 -0.117 381 H ALA 510 H ALA 510 55.038 19.157 5.231 382 HA ALA 510 HA ALA 510 57.576 19.391 6.390 383 HB1 ALA 510 HB1 ALA 510 54.846 19.506 7.677 384 HB2 ALA 510 HB2 ALA 510 55.754 20.860 7.006 385 HB3 ALA 510 HB3 ALA 510 56.346 20.031 8.445 386 H GLU 511 H GLU 511 54.897 17.215 7.315 387 HA GLU 511 HA GLU 511 56.213 15.854 9.391 388 HB2 GLU 511 HB2 GLU 511 53.802 15.684 8.891 389 HB3 GLU 511 HB3 GLU 511 54.169 14.775 7.429 390 HG2 GLU 511 HG2 GLU 511 53.599 13.177 9.130 391 HG3 GLU 511 HG3 GLU 511 55.345 13.064 8.904 392 H TYR 512 H TYR 512 56.181 15.173 5.917 393 HA TYR 512 HA TYR 512 57.752 12.795 6.225 394 HB2 TYR 512 HB2 TYR 512 56.575 14.330 3.965 395 HB3 TYR 512 HB3 TYR 512 57.856 13.173 3.609 396 HD1 TYR 512 HD1 TYR 512 54.582 13.494 5.386 397 HD2 TYR 512 HD2 TYR 512 57.413 10.869 3.517 398 HE1 TYR 512 HE1 TYR 512 52.970 11.634 5.571 399 HE2 TYR 512 HE2 TYR 512 55.806 8.999 3.717 400 HH TYR 512 HH TYR 512 52.830 9.168 3.964 401 H LYS 513 H LYS 513 58.466 16.113 5.957 402 HA LYS 513 HA LYS 513 61.107 15.781 4.874 403 HB2 LYS 513 HB2 LYS 513 59.642 17.880 4.887 404 HB3 LYS 513 HB3 LYS 513 60.170 18.104 6.549 405 HG2 LYS 513 HG2 LYS 513 62.507 18.123 5.836 406 HG3 LYS 513 HG3 LYS 513 62.033 17.789 4.172 407 HD2 LYS 513 HD2 LYS 513 61.104 20.224 5.710 408 HD3 LYS 513 HD3 LYS 513 62.524 20.219 4.666 409 HE2 LYS 513 HE2 LYS 513 60.907 19.301 2.838 410 HE3 LYS 513 HE3 LYS 513 59.623 19.887 3.895 411 HZ1 LYS 513 HZ1 LYS 513 59.999 21.721 2.653 412 HZ2 LYS 513 HZ2 LYS 513 61.649 21.393 2.430 413 HZ3 LYS 513 HZ3 LYS 513 61.097 22.018 3.911 414 H LYS 514 H LYS 514 59.570 15.676 7.981 415 HA LYS 514 HA LYS 514 61.800 16.007 9.686 416 HB2 LYS 514 HB2 LYS 514 59.231 15.927 10.137 417 HB3 LYS 514 HB3 LYS 514 59.479 14.194 10.317 418 HG2 LYS 514 HG2 LYS 514 61.143 14.582 12.071 419 HG3 LYS 514 HG3 LYS 514 60.988 16.325 11.864 420 HD2 LYS 514 HD2 LYS 514 58.602 14.593 12.540 421 HD3 LYS 514 HD3 LYS 514 59.655 15.237 13.797 422 HE2 LYS 514 HE2 LYS 514 59.239 17.543 12.782 423 HE3 LYS 514 HE3 LYS 514 57.972 16.790 11.816 424 HZ1 LYS 514 HZ1 LYS 514 57.184 15.886 14.080 425 HZ2 LYS 514 HZ2 LYS 514 56.835 17.495 13.657 426 HZ3 LYS 514 HZ3 LYS 514 58.110 17.153 14.727 427 H LYS 515 H LYS 515 60.106 13.056 8.658 428 HA LYS 515 HA LYS 515 61.976 11.219 9.748 429 HB2 LYS 515 HB2 LYS 515 60.851 9.640 8.011 430 HB3 LYS 515 HB3 LYS 515 59.867 10.299 9.314 431 HG2 LYS 515 HG2 LYS 515 58.670 11.675 7.931 432 HG3 LYS 515 HG3 LYS 515 60.061 12.002 6.904 433 HD2 LYS 515 HD2 LYS 515 58.499 10.721 5.586 434 HD3 LYS 515 HD3 LYS 515 59.864 9.689 5.967 435 HE2 LYS 515 HE2 LYS 515 57.434 9.717 7.749 436 HE3 LYS 515 HE3 LYS 515 57.473 8.728 6.289 437 HZ1 LYS 515 HZ1 LYS 515 59.040 8.481 8.741 438 HZ2 LYS 515 HZ2 LYS 515 59.811 8.083 7.280 439 HZ3 LYS 515 HZ3 LYS 515 58.390 7.275 7.742 440 H LEU 516 H LEU 516 61.762 12.929 6.721 441 HA LEU 516 HA LEU 516 63.467 11.470 5.046 442 HB2 LEU 516 HB2 LEU 516 62.171 13.303 4.233 443 HB3 LEU 516 HB3 LEU 516 62.915 14.419 5.342 444 HG LEU 516 HG LEU 516 64.792 13.010 3.529 445 HD11 LEU 516 HD11 LEU 516 62.784 13.598 2.066 446 HD12 LEU 516 HD12 LEU 516 64.321 14.302 1.577 447 HD13 LEU 516 HD13 LEU 516 63.143 15.285 2.442 448 HD21 LEU 516 HD21 LEU 516 64.470 15.863 4.501 449 HD22 LEU 516 HD22 LEU 516 65.704 15.377 3.346 450 HD23 LEU 516 HD23 LEU 516 65.719 14.708 4.970 451 H ASP 517 H ASP 517 64.201 14.181 7.200 452 HA ASP 517 HA ASP 517 66.993 14.197 6.892 453 HB2 ASP 517 HB2 ASP 517 65.187 15.070 9.148 454 HB3 ASP 517 HB3 ASP 517 66.932 15.312 9.180 455 H GLN 518 H GLN 518 64.883 12.521 9.220 456 HA GLN 518 HA GLN 518 66.928 11.371 10.798 457 HB2 GLN 518 HB2 GLN 518 64.089 10.543 10.204 458 HB3 GLN 518 HB3 GLN 518 65.116 9.702 11.370 459 HG2 GLN 518 HG2 GLN 518 65.414 11.749 12.655 460 HG3 GLN 518 HG3 GLN 518 64.522 12.670 11.447 461 HE21 GLN 518 HE21 GLN 518 63.342 13.030 13.735 462 HE22 GLN 518 HE22 GLN 518 62.008 12.014 13.999 463 H THR 519 H THR 519 65.392 10.307 7.815 464 HA THR 519 HA THR 519 66.426 7.680 7.741 465 HB THR 519 HB THR 519 65.809 9.474 5.388 466 HG1 THR 519 HG1 THR 519 64.089 7.911 7.014 467 HG21 THR 519 HG21 THR 519 65.314 6.513 5.623 468 HG22 THR 519 HG22 THR 519 66.894 7.126 5.128 469 HG23 THR 519 HG23 THR 519 65.464 7.499 4.169 470 H ARG 520 H ARG 520 67.623 10.767 6.527 471 HA ARG 520 HA ARG 520 69.905 9.824 5.166 472 HB2 ARG 520 HB2 ARG 520 69.204 12.470 6.440 473 HB3 ARG 520 HB3 ARG 520 70.680 12.215 5.505 474 HG2 ARG 520 HG2 ARG 520 69.358 11.525 3.564 475 HG3 ARG 520 HG3 ARG 520 67.870 11.699 4.491 476 HD2 ARG 520 HD2 ARG 520 68.306 14.093 4.770 477 HD3 ARG 520 HD3 ARG 520 69.822 13.929 3.880 478 HE ARG 520 HE ARG 520 67.499 12.981 2.436 479 HH11 ARG 520 HH11 ARG 520 67.474 16.023 3.385 480 HH12 ARG 520 HH12 ARG 520 67.940 16.773 1.895 481 HH21 ARG 520 HH21 ARG 520 68.978 13.816 0.421 482 HH22 ARG 520 HH22 ARG 520 68.792 15.525 0.219 483 H VAL 521 H VAL 521 69.321 10.693 8.518 484 HA VAL 521 HA VAL 521 71.992 10.784 9.422 485 HB VAL 521 HB VAL 521 69.401 10.082 10.807 486 HG11 VAL 521 HG11 VAL 521 72.175 10.518 11.916 487 HG12 VAL 521 HG12 VAL 521 71.103 9.140 12.172 488 HG13 VAL 521 HG13 VAL 521 70.719 10.703 12.892 489 HG21 VAL 521 HG21 VAL 521 70.987 12.625 11.122 490 HG22 VAL 521 HG22 VAL 521 69.267 12.344 11.398 491 HG23 VAL 521 HG23 VAL 521 69.891 12.431 9.754 492 H GLU 522 H GLU 522 69.615 8.133 9.310 493 HA GLU 522 HA GLU 522 71.251 6.156 10.505 494 HB2 GLU 522 HB2 GLU 522 69.005 5.911 8.488 495 HB3 GLU 522 HB3 GLU 522 69.688 4.570 9.406 496 HG2 GLU 522 HG2 GLU 522 68.478 7.039 10.676 497 HG3 GLU 522 HG3 GLU 522 67.604 5.529 10.425 498 H LEU 523 H LEU 523 70.737 7.115 7.150 499 HA LEU 523 HA LEU 523 72.290 5.126 5.891 500 HB2 LEU 523 HB2 LEU 523 70.623 6.684 4.824 501 HB3 LEU 523 HB3 LEU 523 71.825 7.962 4.969 502 HG LEU 523 HG LEU 523 73.388 6.160 3.751 503 HD11 LEU 523 HD11 LEU 523 70.600 5.427 2.819 504 HD12 LEU 523 HD12 LEU 523 71.679 4.394 3.753 505 HD13 LEU 523 HD13 LEU 523 72.108 4.852 2.108 506 HD21 LEU 523 HD21 LEU 523 71.327 7.980 2.502 507 HD22 LEU 523 HD22 LEU 523 72.520 7.117 1.529 508 HD23 LEU 523 HD23 LEU 523 73.048 8.280 2.746 509 H ALA 524 H ALA 524 73.098 8.400 7.031 510 HA ALA 524 HA ALA 524 75.717 8.511 6.014 511 HB1 ALA 524 HB1 ALA 524 74.635 9.828 8.513 512 HB2 ALA 524 HB2 ALA 524 74.461 10.462 6.875 513 HB3 ALA 524 HB3 ALA 524 76.062 10.319 7.601 514 H ASP 525 H ASP 525 74.449 7.294 9.083 515 HA ASP 525 HA ASP 525 76.960 6.776 10.312 516 HB2 ASP 525 HB2 ASP 525 74.891 6.926 11.587 517 HB3 ASP 525 HB3 ASP 525 74.230 5.539 10.725 518 H GLN 526 H GLN 526 74.734 4.804 8.394 519 HA GLN 526 HA GLN 526 76.200 2.369 8.533 520 HB2 GLN 526 HB2 GLN 526 73.812 2.497 7.981 521 HB3 GLN 526 HB3 GLN 526 74.197 3.367 6.500 522 HG2 GLN 526 HG2 GLN 526 75.355 1.459 5.590 523 HG3 GLN 526 HG3 GLN 526 75.239 0.592 7.123 524 HE21 GLN 526 HE21 GLN 526 73.833 0.641 4.122 525 HE22 GLN 526 HE22 GLN 526 72.265 0.133 4.532 526 H VAL 527 H VAL 527 76.181 5.099 6.322 527 HA VAL 527 HA VAL 527 77.874 3.950 4.326 528 HB VAL 527 HB VAL 527 76.938 6.748 4.972 529 HG11 VAL 527 HG11 VAL 527 77.948 7.329 2.694 530 HG12 VAL 527 HG12 VAL 527 78.899 5.851 2.848 531 HG13 VAL 527 HG13 VAL 527 79.091 7.151 4.026 532 HG21 VAL 527 HG21 VAL 527 76.491 5.078 2.493 533 HG22 VAL 527 HG22 VAL 527 75.584 6.487 3.044 534 HG23 VAL 527 HG23 VAL 527 75.445 4.957 3.909 535 H LYS 528 H LYS 528 78.375 5.948 7.170 536 HA LYS 528 HA LYS 528 81.093 6.624 6.765 537 HB2 LYS 528 HB2 LYS 528 79.578 7.751 8.333 538 HB3 LYS 528 HB3 LYS 528 79.532 6.301 9.331 539 HG2 LYS 528 HG2 LYS 528 82.004 6.455 9.629 540 HG3 LYS 528 HG3 LYS 528 82.001 7.955 8.697 541 HD2 LYS 528 HD2 LYS 528 80.283 7.579 11.150 542 HD3 LYS 528 HD3 LYS 528 81.938 8.165 11.257 543 HE2 LYS 528 HE2 LYS 528 81.272 9.975 9.586 544 HE3 LYS 528 HE3 LYS 528 79.603 9.469 9.840 545 HZ1 LYS 528 HZ1 LYS 528 80.713 9.730 12.348 546 HZ2 LYS 528 HZ2 LYS 528 79.577 10.757 11.611 547 HZ3 LYS 528 HZ3 LYS 528 81.237 11.087 11.477 548 H SER 529 H SER 529 79.544 3.954 8.542 549 HA SER 529 HA SER 529 82.061 2.900 9.435 550 HB2 SER 529 HB2 SER 529 79.278 1.708 9.399 551 HB3 SER 529 HB3 SER 529 80.668 0.979 10.194 552 HG SER 529 HG SER 529 80.815 3.098 11.322 553 H ALA 530 H ALA 530 80.485 2.871 6.487 554 HA ALA 530 HA ALA 530 81.147 0.202 5.636 555 HB1 ALA 530 HB1 ALA 530 80.278 0.858 3.522 556 HB2 ALA 530 HB2 ALA 530 80.529 2.569 3.867 557 HB3 ALA 530 HB3 ALA 530 79.274 1.670 4.721 558 H VAL 531 H VAL 531 83.047 2.696 6.412 559 HA VAL 531 HA VAL 531 84.841 2.816 4.185 560 HB VAL 531 HB VAL 531 85.033 3.731 7.057 561 HG11 VAL 531 HG11 VAL 531 86.864 5.208 6.211 562 HG12 VAL 531 HG12 VAL 531 86.845 4.308 4.696 563 HG13 VAL 531 HG13 VAL 531 87.301 3.505 6.201 564 HG21 VAL 531 HG21 VAL 531 83.271 4.724 5.546 565 HG22 VAL 531 HG22 VAL 531 84.580 5.307 4.515 566 HG23 VAL 531 HG23 VAL 531 84.438 5.888 6.175 567 H THR 532 H THR 532 84.234 0.411 6.405 568 HA THR 532 HA THR 532 86.822 -0.855 5.852 569 HB THR 532 HB THR 532 86.982 0.369 8.056 570 HG1 THR 532 HG1 THR 532 88.390 -1.160 8.229 571 HG21 THR 532 HG21 THR 532 84.498 -0.358 8.584 572 HG22 THR 532 HG22 THR 532 85.676 -0.242 9.890 573 HG23 THR 532 HG23 THR 532 85.274 -1.816 9.204 574 H GLU 533 H GLU 533 83.482 -1.051 6.069 575 HA GLU 533 HA GLU 533 83.319 -3.869 6.770 576 HB2 GLU 533 HB2 GLU 533 81.558 -2.030 7.237 577 HB3 GLU 533 HB3 GLU 533 81.103 -2.232 5.548 578 HG2 GLU 533 HG2 GLU 533 79.675 -3.674 6.849 579 HG3 GLU 533 HG3 GLU 533 80.827 -4.713 6.023 580 H PHE 534 H PHE 534 84.738 -2.676 4.312 581 HA PHE 534 HA PHE 534 83.480 -3.337 1.943 582 HB2 PHE 534 HB2 PHE 534 86.377 -3.413 2.764 583 HB3 PHE 534 HB3 PHE 534 85.874 -3.810 1.120 584 HD1 PHE 534 HD1 PHE 534 84.689 -2.139 -0.267 585 HD2 PHE 534 HD2 PHE 534 86.332 -1.153 3.571 586 HE1 PHE 534 HE1 PHE 534 84.548 0.268 -0.832 587 HE2 PHE 534 HE2 PHE 534 86.199 1.261 3.008 588 HZ PHE 534 HZ PHE 534 85.307 1.971 0.806 589 H GLU 535 H GLU 535 82.298 -5.212 1.871 590 HA GLU 535 HA GLU 535 81.852 -7.473 1.790 591 HB2 GLU 535 HB2 GLU 535 84.598 -7.242 0.575 592 HB3 GLU 535 HB3 GLU 535 83.613 -8.702 0.479 593 HG2 GLU 535 HG2 GLU 535 81.855 -7.507 -0.692 594 HG3 GLU 535 HG3 GLU 535 82.689 -5.972 -0.456 595 H ASN 536 H ASN 536 83.094 -6.558 4.290 596 HA ASN 536 HA ASN 536 83.995 -7.431 6.219 597 HB2 ASN 536 HB2 ASN 536 82.158 -9.059 5.818 598 HB3 ASN 536 HB3 ASN 536 83.288 -10.070 4.919 599 HD21 ASN 536 HD21 ASN 536 84.128 -8.249 7.879 600 HD22 ASN 536 HD22 ASN 536 84.411 -9.624 8.832 601 H VAL 537 H VAL 537 86.140 -6.683 5.610 602 HA VAL 537 HA VAL 537 87.948 -8.365 4.198 603 HB VAL 537 HB VAL 537 89.639 -6.751 5.367 604 HG11 VAL 537 HG11 VAL 537 88.869 -4.877 3.814 605 HG12 VAL 537 HG12 VAL 537 87.490 -5.904 3.420 606 HG13 VAL 537 HG13 VAL 537 89.128 -6.447 3.054 607 HG21 VAL 537 HG21 VAL 537 88.753 -4.820 6.398 608 HG22 VAL 537 HG22 VAL 537 87.814 -6.140 7.092 609 HG23 VAL 537 HG23 VAL 537 87.123 -5.144 5.808 610 H THR 538 H THR 538 89.274 -9.929 4.916 611 HA THR 538 HA THR 538 89.548 -10.379 7.830 612 HB THR 538 HB THR 538 89.004 -12.589 5.844 613 HG1 THR 538 HG1 THR 538 87.061 -11.861 7.657 614 HG21 THR 538 HG21 THR 538 90.155 -13.086 8.044 615 HG22 THR 538 HG22 THR 538 88.628 -13.932 7.797 616 HG23 THR 538 HG23 THR 538 88.692 -12.521 8.853 617 HA PRO 539 HA PRO 539 93.554 -10.921 5.578 618 HB2 PRO 539 HB2 PRO 539 94.783 -8.913 7.284 619 HB3 PRO 539 HB3 PRO 539 94.481 -8.828 5.540 620 HG2 PRO 539 HG2 PRO 539 93.183 -7.273 7.401 621 HG3 PRO 539 HG3 PRO 539 92.520 -7.683 5.808 622 HD2 PRO 539 HD2 PRO 539 91.920 -8.947 8.474 623 HD3 PRO 539 HD3 PRO 539 90.805 -8.524 7.152 624 H THR 540 H THR 540 94.372 -12.796 6.301 625 HA THR 540 HA THR 540 95.000 -13.114 9.179 626 HB THR 540 HB THR 540 94.469 -15.171 7.018 627 HG1 THR 540 HG1 THR 540 92.928 -13.803 8.708 628 HG21 THR 540 HG21 THR 540 96.119 -16.090 8.507 629 HG22 THR 540 HG22 THR 540 94.560 -16.765 8.981 630 HG23 THR 540 HG23 THR 540 95.276 -15.458 9.922 631 H ASN 541 H ASN 541 97.095 -13.139 9.750 632 HA ASN 541 HA ASN 541 99.126 -12.943 7.747 633 HB2 ASN 541 HB2 ASN 541 99.282 -13.214 10.756 634 HB3 ASN 541 HB3 ASN 541 100.674 -12.933 9.711 635 HD21 ASN 541 HD21 ASN 541 99.266 -11.161 7.833 636 HD22 ASN 541 HD22 ASN 541 98.970 -9.708 8.657 637 H ASP 542 H ASP 542 100.455 -14.407 6.956 638 HA ASP 542 HA ASP 542 99.901 -17.212 7.460 639 HB2 ASP 542 HB2 ASP 542 100.090 -16.328 5.175 640 HB3 ASP 542 HB3 ASP 542 101.757 -15.850 5.493 641 H GLN 543 H GLN 543 100.924 -18.192 9.096 642 HA GLN 543 HA GLN 543 103.095 -17.396 10.561 643 HB2 GLN 543 HB2 GLN 543 101.655 -19.353 11.074 644 HB3 GLN 543 HB3 GLN 543 102.445 -20.248 9.779 645 HG2 GLN 543 HG2 GLN 543 104.618 -19.995 10.920 646 HG3 GLN 543 HG3 GLN 543 103.833 -19.097 12.218 647 HE21 GLN 543 HE21 GLN 543 103.865 -20.546 13.979 648 HE22 GLN 543 HE22 GLN 543 103.283 -22.139 13.911 Start of MODEL 10 1 H1 SER 466 H1 SER 466 30.363 -1.264 -1.345 2 H2 SER 466 H2 SER 466 29.316 -2.560 -1.012 3 H3 SER 466 H3 SER 466 30.896 -2.861 -1.559 4 HA SER 466 HA SER 466 30.039 -2.735 1.055 5 HB2 SER 466 HB2 SER 466 32.359 -3.221 1.534 6 HB3 SER 466 HB3 SER 466 31.942 -4.022 0.022 7 HG SER 466 HG SER 466 33.514 -2.918 -0.809 8 H ASP 467 H ASP 467 31.064 -0.158 -0.964 9 HA ASP 467 HA ASP 467 31.554 2.058 -0.572 10 HB2 ASP 467 HB2 ASP 467 29.758 1.421 1.776 11 HB3 ASP 467 HB3 ASP 467 30.291 3.052 1.374 12 H ASP 468 H ASP 468 33.446 0.094 0.423 13 HA ASP 468 HA ASP 468 34.438 1.182 2.958 14 HB2 ASP 468 HB2 ASP 468 36.157 -0.618 2.707 15 HB3 ASP 468 HB3 ASP 468 34.500 -1.224 2.710 16 H TYR 469 H TYR 469 34.527 2.191 -0.073 17 HA TYR 469 HA TYR 469 37.103 2.586 -0.949 18 HB2 TYR 469 HB2 TYR 469 34.914 3.230 -2.033 19 HB3 TYR 469 HB3 TYR 469 34.927 4.673 -1.023 20 HD1 TYR 469 HD1 TYR 469 36.728 2.848 -3.701 21 HD2 TYR 469 HD2 TYR 469 36.381 6.515 -1.496 22 HE1 TYR 469 HE1 TYR 469 38.205 3.972 -5.342 23 HE2 TYR 469 HE2 TYR 469 37.855 7.643 -3.139 24 HH TYR 469 HH TYR 469 38.406 6.733 -6.032 25 H VAL 470 H VAL 470 38.573 4.372 -0.805 26 HA VAL 470 HA VAL 470 38.536 5.748 1.823 27 HB VAL 470 HB VAL 470 41.014 5.333 0.159 28 HG11 VAL 470 HG11 VAL 470 42.063 5.417 2.412 29 HG12 VAL 470 HG12 VAL 470 40.472 5.678 3.122 30 HG13 VAL 470 HG13 VAL 470 41.161 6.883 2.035 31 HG21 VAL 470 HG21 VAL 470 39.714 3.388 2.087 32 HG22 VAL 470 HG22 VAL 470 41.400 3.282 1.574 33 HG23 VAL 470 HG23 VAL 470 40.103 3.106 0.391 34 H ASP 471 H ASP 471 38.777 7.947 1.920 35 HA ASP 471 HA ASP 471 37.998 9.612 -0.104 36 HB2 ASP 471 HB2 ASP 471 39.915 10.148 2.169 37 HB3 ASP 471 HB3 ASP 471 39.321 11.416 1.098 38 H GLU 472 H GLU 472 38.975 10.822 -1.680 39 HA GLU 472 HA GLU 472 41.033 9.666 -3.189 40 HB2 GLU 472 HB2 GLU 472 39.225 11.272 -3.951 41 HB3 GLU 472 HB3 GLU 472 40.215 12.567 -3.284 42 HG2 GLU 472 HG2 GLU 472 40.777 12.417 -5.603 43 HG3 GLU 472 HG3 GLU 472 42.121 11.701 -4.717 44 H GLU 473 H GLU 473 41.133 12.436 -0.943 45 HA GLU 473 HA GLU 473 43.812 13.178 -1.496 46 HB2 GLU 473 HB2 GLU 473 43.653 14.528 0.481 47 HB3 GLU 473 HB3 GLU 473 42.079 14.565 -0.307 48 HG2 GLU 473 HG2 GLU 473 41.424 12.637 1.238 49 HG3 GLU 473 HG3 GLU 473 42.896 13.003 2.142 50 H THR 474 H THR 474 42.359 11.124 0.931 51 HA THR 474 HA THR 474 44.713 10.394 2.328 52 HB THR 474 HB THR 474 42.040 9.042 1.950 53 HG1 THR 474 HG1 THR 474 41.501 10.412 3.420 54 HG21 THR 474 HG21 THR 474 44.398 8.258 3.658 55 HG22 THR 474 HG22 THR 474 43.490 7.266 2.513 56 HG23 THR 474 HG23 THR 474 42.749 7.754 4.037 57 H TYR 475 H TYR 475 42.884 8.914 -0.288 58 HA TYR 475 HA TYR 475 44.395 6.573 -0.539 59 HB2 TYR 475 HB2 TYR 475 42.124 7.036 -1.506 60 HB3 TYR 475 HB3 TYR 475 42.915 8.017 -2.742 61 HD1 TYR 475 HD1 TYR 475 42.939 4.649 -1.183 62 HD2 TYR 475 HD2 TYR 475 43.839 6.996 -4.655 63 HE1 TYR 475 HE1 TYR 475 43.461 2.570 -2.448 64 HE2 TYR 475 HE2 TYR 475 44.370 4.929 -5.928 65 HH TYR 475 HH TYR 475 45.142 2.211 -4.775 66 H ASN 476 H ASN 476 44.682 9.709 -2.228 67 HA ASN 476 HA ASN 476 46.809 8.862 -3.919 68 HB2 ASN 476 HB2 ASN 476 46.239 11.666 -2.921 69 HB3 ASN 476 HB3 ASN 476 47.171 11.212 -4.351 70 HD21 ASN 476 HD21 ASN 476 44.963 8.908 -4.531 71 HD22 ASN 476 HD22 ASN 476 43.712 9.690 -5.370 72 H LEU 477 H LEU 477 46.638 10.121 -0.667 73 HA LEU 477 HA LEU 477 49.345 10.762 -0.250 74 HB2 LEU 477 HB2 LEU 477 47.141 11.039 1.217 75 HB3 LEU 477 HB3 LEU 477 47.662 9.512 1.912 76 HG LEU 477 HG LEU 477 48.587 11.283 3.246 77 HD11 LEU 477 HD11 LEU 477 50.855 10.675 3.250 78 HD12 LEU 477 HD12 LEU 477 50.867 10.388 1.512 79 HD13 LEU 477 HD13 LEU 477 50.007 9.284 2.584 80 HD21 LEU 477 HD21 LEU 477 49.372 13.258 2.426 81 HD22 LEU 477 HD22 LEU 477 48.577 12.809 0.932 82 HD23 LEU 477 HD23 LEU 477 50.296 12.493 1.147 83 H GLN 478 H GLN 478 47.505 7.772 0.225 84 HA GLN 478 HA GLN 478 49.647 6.165 1.150 85 HB2 GLN 478 HB2 GLN 478 47.070 5.444 -0.291 86 HB3 GLN 478 HB3 GLN 478 48.146 4.270 0.468 87 HG2 GLN 478 HG2 GLN 478 46.845 6.590 1.917 88 HG3 GLN 478 HG3 GLN 478 46.227 4.940 1.925 89 HE21 GLN 478 HE21 GLN 478 47.811 6.930 3.913 90 HE22 GLN 478 HE22 GLN 478 48.877 5.849 4.672 91 H LYS 479 H LYS 479 48.365 6.964 -1.991 92 HA LYS 479 HA LYS 479 49.817 5.129 -3.573 93 HB2 LYS 479 HB2 LYS 479 47.755 6.595 -4.134 94 HB3 LYS 479 HB3 LYS 479 48.925 7.869 -4.469 95 HG2 LYS 479 HG2 LYS 479 49.985 6.525 -6.186 96 HG3 LYS 479 HG3 LYS 479 49.008 5.121 -5.758 97 HD2 LYS 479 HD2 LYS 479 48.004 6.120 -7.714 98 HD3 LYS 479 HD3 LYS 479 46.955 6.474 -6.342 99 HE2 LYS 479 HE2 LYS 479 47.715 8.729 -6.208 100 HE3 LYS 479 HE3 LYS 479 49.096 8.406 -7.258 101 HZ1 LYS 479 HZ1 LYS 479 46.722 7.693 -8.586 102 HZ2 LYS 479 HZ2 LYS 479 47.853 8.889 -9.005 103 HZ3 LYS 479 HZ3 LYS 479 46.552 9.269 -7.981 104 H LEU 480 H LEU 480 50.505 8.353 -2.387 105 HA LEU 480 HA LEU 480 52.783 8.904 -3.952 106 HB2 LEU 480 HB2 LEU 480 51.602 9.907 -1.393 107 HB3 LEU 480 HB3 LEU 480 53.239 10.400 -1.778 108 HG LEU 480 HG LEU 480 51.237 10.645 -3.992 109 HD11 LEU 480 HD11 LEU 480 51.075 12.207 -1.425 110 HD12 LEU 480 HD12 LEU 480 49.778 11.591 -2.440 111 HD13 LEU 480 HD13 LEU 480 50.693 13.008 -2.949 112 HD21 LEU 480 HD21 LEU 480 53.364 12.540 -2.939 113 HD22 LEU 480 HD22 LEU 480 52.528 12.653 -4.488 114 HD23 LEU 480 HD23 LEU 480 53.644 11.321 -4.182 115 H LEU 481 H LEU 481 52.631 7.899 -0.523 116 HA LEU 481 HA LEU 481 55.453 7.335 -0.443 117 HB2 LEU 481 HB2 LEU 481 54.953 6.541 1.841 118 HB3 LEU 481 HB3 LEU 481 54.295 8.141 1.518 119 HG LEU 481 HG LEU 481 52.190 6.504 0.715 120 HD11 LEU 481 HD11 LEU 481 51.870 4.845 2.503 121 HD12 LEU 481 HD12 LEU 481 53.450 5.252 3.170 122 HD13 LEU 481 HD13 LEU 481 53.334 4.499 1.581 123 HD21 LEU 481 HD21 LEU 481 51.045 7.262 2.672 124 HD22 LEU 481 HD22 LEU 481 52.173 8.548 2.241 125 HD23 LEU 481 HD23 LEU 481 52.552 7.445 3.564 126 H ALA 482 H ALA 482 53.017 5.631 -1.840 127 HA ALA 482 HA ALA 482 53.125 3.052 -0.963 128 HB1 ALA 482 HB1 ALA 482 53.231 3.379 -3.927 129 HB2 ALA 482 HB2 ALA 482 51.955 4.239 -3.069 130 HB3 ALA 482 HB3 ALA 482 52.085 2.489 -2.928 131 HA PRO 483 HA PRO 483 57.045 2.065 -3.456 132 HB2 PRO 483 HB2 PRO 483 58.504 4.484 -4.151 133 HB3 PRO 483 HB3 PRO 483 57.757 3.302 -5.239 134 HG2 PRO 483 HG2 PRO 483 56.855 5.882 -4.910 135 HG3 PRO 483 HG3 PRO 483 55.850 4.537 -5.476 136 HD2 PRO 483 HD2 PRO 483 56.019 5.735 -2.726 137 HD3 PRO 483 HD3 PRO 483 54.592 5.167 -3.617 138 H TYR 484 H TYR 484 57.384 4.950 -1.425 139 HA TYR 484 HA TYR 484 59.955 4.374 -0.403 140 HB2 TYR 484 HB2 TYR 484 59.320 6.545 0.071 141 HB3 TYR 484 HB3 TYR 484 57.650 6.093 0.415 142 HD1 TYR 484 HD1 TYR 484 61.108 6.145 1.798 143 HD2 TYR 484 HD2 TYR 484 56.947 5.460 2.613 144 HE1 TYR 484 HE1 TYR 484 61.578 6.109 4.237 145 HE2 TYR 484 HE2 TYR 484 57.425 5.423 5.043 146 HH TYR 484 HH TYR 484 60.327 6.519 6.359 147 H HIS 485 H HIS 485 56.703 3.511 0.687 148 HA HIS 485 HA HIS 485 57.449 2.150 3.050 149 HB2 HIS 485 HB2 HIS 485 55.141 2.919 2.488 150 HB3 HIS 485 HB3 HIS 485 55.043 1.632 1.287 151 HD1 HIS 485 HD1 HIS 485 55.107 -0.851 2.201 152 HD2 HIS 485 HD2 HIS 485 54.775 2.081 5.145 153 HE1 HIS 485 HE1 HIS 485 54.381 -2.040 4.316 154 H LYS 486 H LYS 486 57.174 1.142 -0.317 155 HA LYS 486 HA LYS 486 57.637 -1.664 0.297 156 HB2 LYS 486 HB2 LYS 486 57.493 -0.108 -2.299 157 HB3 LYS 486 HB3 LYS 486 57.697 -1.857 -2.204 158 HG2 LYS 486 HG2 LYS 486 55.572 -2.109 -1.066 159 HG3 LYS 486 HG3 LYS 486 55.384 -0.361 -0.940 160 HD2 LYS 486 HD2 LYS 486 55.311 -0.189 -3.403 161 HD3 LYS 486 HD3 LYS 486 55.498 -1.938 -3.531 162 HE2 LYS 486 HE2 LYS 486 53.389 -2.271 -2.317 163 HE3 LYS 486 HE3 LYS 486 53.207 -0.527 -2.129 164 HZ1 LYS 486 HZ1 LYS 486 53.670 -1.109 -4.836 165 HZ2 LYS 486 HZ2 LYS 486 52.288 -0.425 -4.122 166 HZ3 LYS 486 HZ3 LYS 486 52.417 -2.111 -4.282 167 H ALA 487 H ALA 487 59.571 1.061 0.061 168 HA ALA 487 HA ALA 487 61.861 0.090 -1.282 169 HB1 ALA 487 HB1 ALA 487 61.852 2.173 0.891 170 HB2 ALA 487 HB2 ALA 487 61.263 2.504 -0.737 171 HB3 ALA 487 HB3 ALA 487 62.941 2.033 -0.486 172 H LYS 488 H LYS 488 63.107 -1.508 -0.650 173 HA LYS 488 HA LYS 488 63.262 -2.297 2.181 174 HB2 LYS 488 HB2 LYS 488 64.275 -3.615 -0.344 175 HB3 LYS 488 HB3 LYS 488 64.517 -4.264 1.276 176 HG2 LYS 488 HG2 LYS 488 62.053 -4.298 1.607 177 HG3 LYS 488 HG3 LYS 488 61.842 -3.734 -0.048 178 HD2 LYS 488 HD2 LYS 488 63.370 -6.257 0.635 179 HD3 LYS 488 HD3 LYS 488 61.641 -6.259 0.297 180 HE2 LYS 488 HE2 LYS 488 62.226 -5.073 -1.906 181 HE3 LYS 488 HE3 LYS 488 63.902 -5.510 -1.570 182 HZ1 LYS 488 HZ1 LYS 488 63.454 -7.469 -2.458 183 HZ2 LYS 488 HZ2 LYS 488 61.791 -7.132 -2.551 184 HZ3 LYS 488 HZ3 LYS 488 62.448 -7.798 -1.132 185 H THR 489 H THR 489 64.971 -0.365 -0.002 186 HA THR 489 HA THR 489 67.545 -0.749 1.428 187 HB THR 489 HB THR 489 68.302 0.753 -0.630 188 HG1 THR 489 HG1 THR 489 66.801 1.019 -2.040 189 HG21 THR 489 HG21 THR 489 69.154 -1.467 -0.367 190 HG22 THR 489 HG22 THR 489 68.515 -1.365 -2.006 191 HG23 THR 489 HG23 THR 489 67.588 -2.184 -0.748 192 H LEU 490 H LEU 490 68.321 0.825 2.698 193 HA LEU 490 HA LEU 490 66.755 3.004 3.527 194 HB2 LEU 490 HB2 LEU 490 69.663 2.264 3.823 195 HB3 LEU 490 HB3 LEU 490 69.057 3.792 4.463 196 HG LEU 490 HG LEU 490 67.348 2.554 5.752 197 HD11 LEU 490 HD11 LEU 490 68.686 0.189 4.443 198 HD12 LEU 490 HD12 LEU 490 66.968 0.587 4.491 199 HD13 LEU 490 HD13 LEU 490 67.780 0.023 5.948 200 HD21 LEU 490 HD21 LEU 490 70.123 1.439 6.238 201 HD22 LEU 490 HD22 LEU 490 68.854 1.688 7.437 202 HD23 LEU 490 HD23 LEU 490 69.638 3.077 6.682 203 H GLU 491 H GLU 491 69.474 2.812 1.263 204 HA GLU 491 HA GLU 491 69.814 5.524 0.690 205 HB2 GLU 491 HB2 GLU 491 71.387 3.861 -0.083 206 HB3 GLU 491 HB3 GLU 491 70.148 3.070 -1.053 207 HG2 GLU 491 HG2 GLU 491 69.982 4.981 -2.516 208 HG3 GLU 491 HG3 GLU 491 71.052 5.929 -1.480 209 H ARG 492 H ARG 492 67.555 3.165 -0.592 210 HA ARG 492 HA ARG 492 66.462 4.866 -2.602 211 HB2 ARG 492 HB2 ARG 492 66.267 2.489 -2.861 212 HB3 ARG 492 HB3 ARG 492 65.416 2.336 -1.323 213 HG2 ARG 492 HG2 ARG 492 63.500 3.539 -2.179 214 HG3 ARG 492 HG3 ARG 492 64.371 3.973 -3.654 215 HD2 ARG 492 HD2 ARG 492 64.464 1.651 -4.336 216 HD3 ARG 492 HD3 ARG 492 63.757 1.132 -2.807 217 HE ARG 492 HE ARG 492 61.947 2.915 -3.926 218 HH11 ARG 492 HH11 ARG 492 63.274 1.323 -6.320 219 HH12 ARG 492 HH12 ARG 492 62.036 0.143 -6.597 220 HH21 ARG 492 HH21 ARG 492 60.402 0.772 -3.604 221 HH22 ARG 492 HH22 ARG 492 60.408 -0.169 -5.057 222 H GLN 493 H GLN 493 65.600 4.139 0.743 223 HA GLN 493 HA GLN 493 63.064 5.309 0.811 224 HB2 GLN 493 HB2 GLN 493 65.222 5.090 2.918 225 HB3 GLN 493 HB3 GLN 493 63.606 5.699 3.253 226 HG2 GLN 493 HG2 GLN 493 62.596 3.622 2.567 227 HG3 GLN 493 HG3 GLN 493 64.137 3.015 1.970 228 HE21 GLN 493 HE21 GLN 493 63.317 1.238 3.654 229 HE22 GLN 493 HE22 GLN 493 63.908 1.426 5.234 230 H VAL 494 H VAL 494 66.253 6.790 1.414 231 HA VAL 494 HA VAL 494 65.300 9.398 1.927 232 HB VAL 494 HB VAL 494 67.939 8.400 0.825 233 HG11 VAL 494 HG11 VAL 494 67.108 11.173 1.734 234 HG12 VAL 494 HG12 VAL 494 67.702 10.718 0.136 235 HG13 VAL 494 HG13 VAL 494 68.781 10.665 1.525 236 HG21 VAL 494 HG21 VAL 494 67.451 7.668 3.098 237 HG22 VAL 494 HG22 VAL 494 66.995 9.306 3.564 238 HG23 VAL 494 HG23 VAL 494 68.672 8.940 3.163 239 H TYR 495 H TYR 495 66.345 7.795 -1.055 240 HA TYR 495 HA TYR 495 66.116 9.950 -2.833 241 HB2 TYR 495 HB2 TYR 495 67.207 7.948 -3.510 242 HB3 TYR 495 HB3 TYR 495 65.789 6.976 -3.154 243 HD1 TYR 495 HD1 TYR 495 66.914 9.808 -5.346 244 HD2 TYR 495 HD2 TYR 495 64.290 6.436 -4.861 245 HE1 TYR 495 HE1 TYR 495 66.148 10.060 -7.692 246 HE2 TYR 495 HE2 TYR 495 63.520 6.696 -7.199 247 HH TYR 495 HH TYR 495 64.292 9.474 -9.094 248 H GLU 496 H GLU 496 63.668 7.510 -1.922 249 HA GLU 496 HA GLU 496 61.622 8.509 -3.608 250 HB2 GLU 496 HB2 GLU 496 61.479 6.928 -1.028 251 HB3 GLU 496 HB3 GLU 496 60.098 7.240 -2.082 252 HG2 GLU 496 HG2 GLU 496 62.651 5.910 -3.020 253 HG3 GLU 496 HG3 GLU 496 61.226 5.019 -2.490 254 H LEU 497 H LEU 497 62.499 9.180 -0.254 255 HA LEU 497 HA LEU 497 60.340 10.884 0.346 256 HB2 LEU 497 HB2 LEU 497 63.114 10.606 1.462 257 HB3 LEU 497 HB3 LEU 497 61.943 11.734 2.149 258 HG LEU 497 HG LEU 497 61.454 8.763 1.781 259 HD11 LEU 497 HD11 LEU 497 61.862 10.070 4.451 260 HD12 LEU 497 HD12 LEU 497 63.261 9.550 3.510 261 HD13 LEU 497 HD13 LEU 497 62.043 8.380 4.001 262 HD21 LEU 497 HD21 LEU 497 59.306 9.585 1.941 263 HD22 LEU 497 HD22 LEU 497 59.813 11.052 2.777 264 HD23 LEU 497 HD23 LEU 497 59.673 9.536 3.665 265 H GLU 498 H GLU 498 63.494 11.500 -1.118 266 HA GLU 498 HA GLU 498 63.456 14.308 -1.053 267 HB2 GLU 498 HB2 GLU 498 64.718 12.288 -2.905 268 HB3 GLU 498 HB3 GLU 498 64.909 14.018 -3.181 269 HG2 GLU 498 HG2 GLU 498 65.523 12.738 -0.512 270 HG3 GLU 498 HG3 GLU 498 66.735 12.886 -1.784 271 H LYS 499 H LYS 499 62.327 12.085 -3.632 272 HA LYS 499 HA LYS 499 61.293 14.169 -5.316 273 HB2 LYS 499 HB2 LYS 499 61.001 11.173 -5.157 274 HB3 LYS 499 HB3 LYS 499 59.920 12.082 -6.212 275 HG2 LYS 499 HG2 LYS 499 61.947 11.277 -7.403 276 HG3 LYS 499 HG3 LYS 499 61.828 13.035 -7.405 277 HD2 LYS 499 HD2 LYS 499 63.441 13.179 -5.570 278 HD3 LYS 499 HD3 LYS 499 63.507 11.418 -5.462 279 HE2 LYS 499 HE2 LYS 499 65.412 12.121 -6.754 280 HE3 LYS 499 HE3 LYS 499 64.256 11.402 -7.878 281 HZ1 LYS 499 HZ1 LYS 499 65.252 13.600 -8.555 282 HZ2 LYS 499 HZ2 LYS 499 64.323 14.308 -7.321 283 HZ3 LYS 499 HZ3 LYS 499 63.559 13.502 -8.607 284 H LEU 500 H LEU 500 59.828 12.024 -2.913 285 HA LEU 500 HA LEU 500 57.171 12.865 -3.277 286 HB2 LEU 500 HB2 LEU 500 58.609 11.668 -0.920 287 HB3 LEU 500 HB3 LEU 500 56.877 11.913 -0.963 288 HG LEU 500 HG LEU 500 58.336 10.379 -3.118 289 HD11 LEU 500 HD11 LEU 500 58.745 9.260 -0.980 290 HD12 LEU 500 HD12 LEU 500 57.577 8.330 -1.919 291 HD13 LEU 500 HD13 LEU 500 57.028 9.343 -0.584 292 HD21 LEU 500 HD21 LEU 500 55.445 10.723 -2.311 293 HD22 LEU 500 HD22 LEU 500 55.978 9.354 -3.274 294 HD23 LEU 500 HD23 LEU 500 56.171 10.976 -3.891 295 H GLN 501 H GLN 501 59.737 14.072 -1.166 296 HA GLN 501 HA GLN 501 58.262 15.883 0.360 297 HB2 GLN 501 HB2 GLN 501 61.108 15.735 -0.585 298 HB3 GLN 501 HB3 GLN 501 60.562 17.216 0.201 299 HG2 GLN 501 HG2 GLN 501 60.159 14.471 1.408 300 HG3 GLN 501 HG3 GLN 501 61.561 15.480 1.756 301 HE21 GLN 501 HE21 GLN 501 59.066 14.645 3.423 302 HE22 GLN 501 HE22 GLN 501 58.522 16.117 4.059 303 H GLU 502 H GLU 502 59.288 16.051 -2.958 304 HA GLU 502 HA GLU 502 58.763 18.874 -3.266 305 HB2 GLU 502 HB2 GLU 502 60.470 17.693 -4.592 306 HB3 GLU 502 HB3 GLU 502 59.224 16.672 -5.292 307 HG2 GLU 502 HG2 GLU 502 59.731 18.400 -6.870 308 HG3 GLU 502 HG3 GLU 502 58.136 18.743 -6.213 309 H LYS 503 H LYS 503 57.015 15.881 -3.657 310 HA LYS 503 HA LYS 503 54.752 17.275 -4.981 311 HB2 LYS 503 HB2 LYS 503 55.464 14.358 -4.660 312 HB3 LYS 503 HB3 LYS 503 54.003 14.948 -5.456 313 HG2 LYS 503 HG2 LYS 503 55.261 16.068 -7.153 314 HG3 LYS 503 HG3 LYS 503 56.771 15.853 -6.267 315 HD2 LYS 503 HD2 LYS 503 56.701 14.218 -8.054 316 HD3 LYS 503 HD3 LYS 503 56.501 13.375 -6.520 317 HE2 LYS 503 HE2 LYS 503 54.180 13.070 -6.857 318 HE3 LYS 503 HE3 LYS 503 54.120 14.283 -8.138 319 HZ1 LYS 503 HZ1 LYS 503 55.743 11.820 -8.370 320 HZ2 LYS 503 HZ2 LYS 503 55.270 12.887 -9.604 321 HZ3 LYS 503 HZ3 LYS 503 54.121 11.880 -8.862 322 H LEU 504 H LEU 504 55.659 15.831 -1.985 323 HA LEU 504 HA LEU 504 53.133 15.058 -1.053 324 HB2 LEU 504 HB2 LEU 504 55.752 15.685 0.246 325 HB3 LEU 504 HB3 LEU 504 54.329 15.433 1.255 326 HG LEU 504 HG LEU 504 55.257 13.489 -0.872 327 HD11 LEU 504 HD11 LEU 504 55.760 13.594 2.095 328 HD12 LEU 504 HD12 LEU 504 56.965 13.540 0.813 329 HD13 LEU 504 HD13 LEU 504 55.971 12.122 1.158 330 HD21 LEU 504 HD21 LEU 504 53.110 12.785 -0.543 331 HD22 LEU 504 HD22 LEU 504 52.951 13.588 1.015 332 HD23 LEU 504 HD23 LEU 504 53.770 12.032 0.901 333 HA PRO 505 HA PRO 505 51.272 19.230 -0.768 334 HB2 PRO 505 HB2 PRO 505 49.584 18.193 1.368 335 HB3 PRO 505 HB3 PRO 505 49.119 18.613 -0.288 336 HG2 PRO 505 HG2 PRO 505 49.855 15.968 0.833 337 HG3 PRO 505 HG3 PRO 505 48.819 16.353 -0.547 338 HD2 PRO 505 HD2 PRO 505 51.197 15.301 -0.929 339 HD3 PRO 505 HD3 PRO 505 50.648 16.607 -1.992 340 H GLU 506 H GLU 506 51.592 20.914 0.593 341 HA GLU 506 HA GLU 506 53.735 21.242 2.127 342 HB2 GLU 506 HB2 GLU 506 51.018 22.469 2.644 343 HB3 GLU 506 HB3 GLU 506 52.532 23.076 3.313 344 HG2 GLU 506 HG2 GLU 506 51.991 22.747 0.348 345 HG3 GLU 506 HG3 GLU 506 51.824 24.267 1.222 346 H LYS 507 H LYS 507 50.606 20.645 3.768 347 HA LYS 507 HA LYS 507 51.613 20.327 6.332 348 HB2 LYS 507 HB2 LYS 507 49.533 19.232 6.865 349 HB3 LYS 507 HB3 LYS 507 49.193 20.473 5.657 350 HG2 LYS 507 HG2 LYS 507 49.499 18.629 3.904 351 HG3 LYS 507 HG3 LYS 507 49.424 17.495 5.251 352 HD2 LYS 507 HD2 LYS 507 47.284 19.553 4.657 353 HD3 LYS 507 HD3 LYS 507 47.210 17.874 4.122 354 HE2 LYS 507 HE2 LYS 507 47.534 17.241 6.591 355 HE3 LYS 507 HE3 LYS 507 47.178 18.932 6.952 356 HZ1 LYS 507 HZ1 LYS 507 45.117 18.618 5.572 357 HZ2 LYS 507 HZ2 LYS 507 45.142 17.791 7.057 358 HZ3 LYS 507 HZ3 LYS 507 45.433 16.952 5.608 359 H TYR 508 H TYR 508 51.682 18.081 3.672 360 HA TYR 508 HA TYR 508 52.537 15.852 5.399 361 HB2 TYR 508 HB2 TYR 508 51.829 16.143 2.476 362 HB3 TYR 508 HB3 TYR 508 52.663 14.708 3.071 363 HD1 TYR 508 HD1 TYR 508 51.619 13.302 4.821 364 HD2 TYR 508 HD2 TYR 508 49.510 16.508 2.940 365 HE1 TYR 508 HE1 TYR 508 49.483 12.352 5.623 366 HE2 TYR 508 HE2 TYR 508 47.354 15.557 3.716 367 HH TYR 508 HH TYR 508 47.087 12.416 4.966 368 H LYS 509 H LYS 509 53.778 18.328 3.357 369 HA LYS 509 HA LYS 509 56.249 17.166 2.617 370 HB2 LYS 509 HB2 LYS 509 55.279 19.256 1.657 371 HB3 LYS 509 HB3 LYS 509 55.611 20.073 3.181 372 HG2 LYS 509 HG2 LYS 509 58.000 19.609 2.936 373 HG3 LYS 509 HG3 LYS 509 57.688 18.752 1.425 374 HD2 LYS 509 HD2 LYS 509 56.736 20.808 0.452 375 HD3 LYS 509 HD3 LYS 509 57.056 21.669 1.957 376 HE2 LYS 509 HE2 LYS 509 58.842 22.123 0.347 377 HE3 LYS 509 HE3 LYS 509 59.478 21.178 1.695 378 HZ1 LYS 509 HZ1 LYS 509 59.689 19.323 0.421 379 HZ2 LYS 509 HZ2 LYS 509 59.931 20.498 -0.781 380 HZ3 LYS 509 HZ3 LYS 509 58.419 19.740 -0.623 381 H ALA 510 H ALA 510 55.285 19.207 5.361 382 HA ALA 510 HA ALA 510 57.789 19.331 6.635 383 HB1 ALA 510 HB1 ALA 510 54.977 19.507 7.732 384 HB2 ALA 510 HB2 ALA 510 56.058 20.837 7.315 385 HB3 ALA 510 HB3 ALA 510 56.419 19.811 8.702 386 H GLU 511 H GLU 511 55.038 17.141 7.266 387 HA GLU 511 HA GLU 511 56.206 15.643 9.330 388 HB2 GLU 511 HB2 GLU 511 53.855 15.489 8.747 389 HB3 GLU 511 HB3 GLU 511 54.254 14.795 7.178 390 HG2 GLU 511 HG2 GLU 511 55.223 12.815 8.268 391 HG3 GLU 511 HG3 GLU 511 54.912 13.526 9.856 392 H TYR 512 H TYR 512 56.356 15.083 5.833 393 HA TYR 512 HA TYR 512 57.929 12.701 6.140 394 HB2 TYR 512 HB2 TYR 512 56.876 14.318 3.867 395 HB3 TYR 512 HB3 TYR 512 58.138 13.123 3.549 396 HD1 TYR 512 HD1 TYR 512 54.797 13.521 5.209 397 HD2 TYR 512 HD2 TYR 512 57.611 10.839 3.406 398 HE1 TYR 512 HE1 TYR 512 53.159 11.672 5.383 399 HE2 TYR 512 HE2 TYR 512 55.989 8.992 3.597 400 HH TYR 512 HH TYR 512 52.752 9.462 4.148 401 H LYS 513 H LYS 513 58.606 16.051 6.013 402 HA LYS 513 HA LYS 513 61.294 15.820 5.040 403 HB2 LYS 513 HB2 LYS 513 59.923 17.945 5.038 404 HB3 LYS 513 HB3 LYS 513 60.122 18.007 6.782 405 HG2 LYS 513 HG2 LYS 513 61.888 19.357 6.068 406 HG3 LYS 513 HG3 LYS 513 62.685 17.797 6.224 407 HD2 LYS 513 HD2 LYS 513 63.400 18.496 4.105 408 HD3 LYS 513 HD3 LYS 513 62.019 17.488 3.701 409 HE2 LYS 513 HE2 LYS 513 60.596 19.419 3.406 410 HE3 LYS 513 HE3 LYS 513 61.842 20.493 4.048 411 HZ1 LYS 513 HZ1 LYS 513 63.272 19.658 2.165 412 HZ2 LYS 513 HZ2 LYS 513 61.977 20.667 1.731 413 HZ3 LYS 513 HZ3 LYS 513 61.861 18.988 1.500 414 H LYS 514 H LYS 514 59.668 15.611 8.114 415 HA LYS 514 HA LYS 514 61.883 15.789 9.859 416 HB2 LYS 514 HB2 LYS 514 59.315 15.808 10.304 417 HB3 LYS 514 HB3 LYS 514 59.477 14.058 10.395 418 HG2 LYS 514 HG2 LYS 514 61.085 14.236 12.194 419 HG3 LYS 514 HG3 LYS 514 61.133 15.992 12.045 420 HD2 LYS 514 HD2 LYS 514 58.472 14.665 12.530 421 HD3 LYS 514 HD3 LYS 514 59.590 14.831 13.882 422 HE2 LYS 514 HE2 LYS 514 58.780 17.153 12.110 423 HE3 LYS 514 HE3 LYS 514 57.963 16.752 13.620 424 HZ1 LYS 514 HZ1 LYS 514 60.652 16.739 14.204 425 HZ2 LYS 514 HZ2 LYS 514 59.518 17.924 14.646 426 HZ3 LYS 514 HZ3 LYS 514 60.427 18.104 13.222 427 H LYS 515 H LYS 515 60.138 12.905 8.674 428 HA LYS 515 HA LYS 515 61.954 11.021 9.782 429 HB2 LYS 515 HB2 LYS 515 60.872 9.486 7.994 430 HB3 LYS 515 HB3 LYS 515 59.842 10.146 9.263 431 HG2 LYS 515 HG2 LYS 515 58.914 11.766 7.877 432 HG3 LYS 515 HG3 LYS 515 60.235 11.662 6.713 433 HD2 LYS 515 HD2 LYS 515 58.560 10.517 5.574 434 HD3 LYS 515 HD3 LYS 515 59.384 9.189 6.372 435 HE2 LYS 515 HE2 LYS 515 57.067 8.840 6.789 436 HE3 LYS 515 HE3 LYS 515 57.714 9.506 8.290 437 HZ1 LYS 515 HZ1 LYS 515 55.628 10.573 7.540 438 HZ2 LYS 515 HZ2 LYS 515 56.441 11.131 6.156 439 HZ3 LYS 515 HZ3 LYS 515 56.919 11.661 7.698 440 H LEU 516 H LEU 516 61.859 12.786 6.767 441 HA LEU 516 HA LEU 516 63.653 11.309 5.194 442 HB2 LEU 516 HB2 LEU 516 62.441 13.100 4.200 443 HB3 LEU 516 HB3 LEU 516 63.000 14.252 5.399 444 HG LEU 516 HG LEU 516 65.242 14.213 4.500 445 HD11 LEU 516 HD11 LEU 516 65.706 12.015 3.862 446 HD12 LEU 516 HD12 LEU 516 65.525 12.799 2.300 447 HD13 LEU 516 HD13 LEU 516 64.203 11.853 2.970 448 HD21 LEU 516 HD21 LEU 516 64.844 15.330 2.480 449 HD22 LEU 516 HD22 LEU 516 63.296 15.477 3.305 450 HD23 LEU 516 HD23 LEU 516 63.510 14.267 2.039 451 H ASP 517 H ASP 517 64.260 14.006 7.456 452 HA ASP 517 HA ASP 517 67.062 14.034 7.226 453 HB2 ASP 517 HB2 ASP 517 65.199 14.823 9.473 454 HB3 ASP 517 HB3 ASP 517 66.942 15.086 9.535 455 H GLN 518 H GLN 518 64.891 12.293 9.427 456 HA GLN 518 HA GLN 518 66.913 11.048 10.984 457 HB2 GLN 518 HB2 GLN 518 64.030 10.356 10.426 458 HB3 GLN 518 HB3 GLN 518 65.041 9.425 11.536 459 HG2 GLN 518 HG2 GLN 518 65.440 11.374 12.913 460 HG3 GLN 518 HG3 GLN 518 64.630 12.417 11.745 461 HE21 GLN 518 HE21 GLN 518 62.319 12.409 11.687 462 HE22 GLN 518 HE22 GLN 518 61.384 11.620 12.864 463 H THR 519 H THR 519 65.312 10.092 8.000 464 HA THR 519 HA THR 519 66.259 7.433 7.880 465 HB THR 519 HB THR 519 65.698 9.256 5.529 466 HG1 THR 519 HG1 THR 519 63.544 8.398 5.806 467 HG21 THR 519 HG21 THR 519 66.705 6.912 5.227 468 HG22 THR 519 HG22 THR 519 65.217 7.257 4.347 469 HG23 THR 519 HG23 THR 519 65.162 6.300 5.826 470 H ARG 520 H ARG 520 67.546 10.495 6.695 471 HA ARG 520 HA ARG 520 69.797 9.475 5.327 472 HB2 ARG 520 HB2 ARG 520 69.244 12.155 6.608 473 HB3 ARG 520 HB3 ARG 520 70.681 11.816 5.643 474 HG2 ARG 520 HG2 ARG 520 69.268 11.215 3.729 475 HG3 ARG 520 HG3 ARG 520 67.822 11.515 4.695 476 HD2 ARG 520 HD2 ARG 520 68.281 13.485 3.346 477 HD3 ARG 520 HD3 ARG 520 68.587 13.857 5.044 478 HE ARG 520 HE ARG 520 70.881 12.987 3.438 479 HH11 ARG 520 HH11 ARG 520 69.489 15.790 2.893 480 HH12 ARG 520 HH12 ARG 520 70.599 16.821 3.732 481 HH21 ARG 520 HH21 ARG 520 72.154 14.216 5.410 482 HH22 ARG 520 HH22 ARG 520 72.110 15.930 5.159 483 H VAL 521 H VAL 521 69.234 10.359 8.681 484 HA VAL 521 HA VAL 521 71.900 10.378 9.589 485 HB VAL 521 HB VAL 521 69.304 9.691 10.986 486 HG11 VAL 521 HG11 VAL 521 72.098 10.025 12.078 487 HG12 VAL 521 HG12 VAL 521 70.991 8.671 12.309 488 HG13 VAL 521 HG13 VAL 521 70.660 10.222 13.077 489 HG21 VAL 521 HG21 VAL 521 69.911 12.079 9.997 490 HG22 VAL 521 HG22 VAL 521 70.922 12.189 11.434 491 HG23 VAL 521 HG23 VAL 521 69.182 11.938 11.594 492 H GLU 522 H GLU 522 69.485 7.763 9.438 493 HA GLU 522 HA GLU 522 71.103 5.735 10.575 494 HB2 GLU 522 HB2 GLU 522 68.856 5.546 8.547 495 HB3 GLU 522 HB3 GLU 522 69.524 4.184 9.445 496 HG2 GLU 522 HG2 GLU 522 68.313 6.640 10.739 497 HG3 GLU 522 HG3 GLU 522 67.442 5.132 10.474 498 H LEU 523 H LEU 523 70.488 6.635 7.203 499 HA LEU 523 HA LEU 523 72.148 4.704 5.986 500 HB2 LEU 523 HB2 LEU 523 70.359 6.086 4.875 501 HB3 LEU 523 HB3 LEU 523 71.465 7.454 4.940 502 HG LEU 523 HG LEU 523 73.137 5.703 3.775 503 HD11 LEU 523 HD11 LEU 523 71.454 3.861 3.897 504 HD12 LEU 523 HD12 LEU 523 71.970 4.209 2.248 505 HD13 LEU 523 HD13 LEU 523 70.408 4.790 2.826 506 HD21 LEU 523 HD21 LEU 523 72.197 6.525 1.533 507 HD22 LEU 523 HD22 LEU 523 72.633 7.770 2.704 508 HD23 LEU 523 HD23 LEU 523 70.941 7.329 2.476 509 H ALA 524 H ALA 524 72.760 8.058 6.986 510 HA ALA 524 HA ALA 524 75.340 8.300 5.897 511 HB1 ALA 524 HB1 ALA 524 74.095 9.652 8.304 512 HB2 ALA 524 HB2 ALA 524 74.083 10.241 6.640 513 HB3 ALA 524 HB3 ALA 524 75.602 10.153 7.536 514 H ASP 525 H ASP 525 74.219 7.089 9.023 515 HA ASP 525 HA ASP 525 76.788 6.796 10.208 516 HB2 ASP 525 HB2 ASP 525 74.746 6.799 11.539 517 HB3 ASP 525 HB3 ASP 525 74.166 5.357 10.710 518 H GLN 526 H GLN 526 74.688 4.625 8.363 519 HA GLN 526 HA GLN 526 76.345 2.314 8.510 520 HB2 GLN 526 HB2 GLN 526 73.968 2.176 7.995 521 HB3 GLN 526 HB3 GLN 526 74.200 3.137 6.536 522 HG2 GLN 526 HG2 GLN 526 75.550 1.395 5.533 523 HG3 GLN 526 HG3 GLN 526 75.536 0.463 7.031 524 HE21 GLN 526 HE21 GLN 526 73.720 1.188 4.131 525 HE22 GLN 526 HE22 GLN 526 72.373 0.218 4.494 526 H VAL 527 H VAL 527 76.024 4.964 6.226 527 HA VAL 527 HA VAL 527 77.841 3.956 4.262 528 HB VAL 527 HB VAL 527 76.645 6.676 4.832 529 HG11 VAL 527 HG11 VAL 527 77.554 7.220 2.496 530 HG12 VAL 527 HG12 VAL 527 78.633 5.842 2.709 531 HG13 VAL 527 HG13 VAL 527 78.727 7.217 3.812 532 HG21 VAL 527 HG21 VAL 527 75.283 4.719 3.900 533 HG22 VAL 527 HG22 VAL 527 76.283 4.846 2.452 534 HG23 VAL 527 HG23 VAL 527 75.272 6.204 2.946 535 H LYS 528 H LYS 528 78.093 6.202 6.966 536 HA LYS 528 HA LYS 528 80.756 7.050 6.534 537 HB2 LYS 528 HB2 LYS 528 79.152 8.238 7.956 538 HB3 LYS 528 HB3 LYS 528 79.143 6.876 9.076 539 HG2 LYS 528 HG2 LYS 528 81.495 7.202 9.584 540 HG3 LYS 528 HG3 LYS 528 81.622 8.461 8.349 541 HD2 LYS 528 HD2 LYS 528 81.383 9.534 10.518 542 HD3 LYS 528 HD3 LYS 528 79.900 9.784 9.597 543 HE2 LYS 528 HE2 LYS 528 78.689 8.229 10.873 544 HE3 LYS 528 HE3 LYS 528 80.148 7.436 11.472 545 HZ1 LYS 528 HZ1 LYS 528 80.634 9.690 12.542 546 HZ2 LYS 528 HZ2 LYS 528 79.431 8.719 13.246 547 HZ3 LYS 528 HZ3 LYS 528 78.997 10.036 12.266 548 H SER 529 H SER 529 79.359 4.329 8.278 549 HA SER 529 HA SER 529 81.792 3.625 9.605 550 HB2 SER 529 HB2 SER 529 79.316 2.996 10.171 551 HB3 SER 529 HB3 SER 529 79.564 1.676 9.032 552 HG SER 529 HG SER 529 81.515 2.165 10.986 553 H ALA 530 H ALA 530 79.948 2.027 7.026 554 HA ALA 530 HA ALA 530 82.151 0.326 6.308 555 HB1 ALA 530 HB1 ALA 530 80.671 -0.586 4.681 556 HB2 ALA 530 HB2 ALA 530 79.628 0.835 4.738 557 HB3 ALA 530 HB3 ALA 530 79.700 -0.261 6.117 558 H VAL 531 H VAL 531 82.856 3.045 6.175 559 HA VAL 531 HA VAL 531 82.700 4.248 3.655 560 HB VAL 531 HB VAL 531 84.609 4.332 5.967 561 HG11 VAL 531 HG11 VAL 531 85.138 5.570 3.259 562 HG12 VAL 531 HG12 VAL 531 86.201 4.527 4.208 563 HG13 VAL 531 HG13 VAL 531 85.869 6.174 4.745 564 HG21 VAL 531 HG21 VAL 531 83.336 6.710 4.629 565 HG22 VAL 531 HG22 VAL 531 83.699 6.449 6.335 566 HG23 VAL 531 HG23 VAL 531 82.330 5.628 5.595 567 H THR 532 H THR 532 83.492 3.714 1.710 568 HA THR 532 HA THR 532 85.916 2.079 1.504 569 HB THR 532 HB THR 532 84.398 0.303 1.494 570 HG1 THR 532 HG1 THR 532 85.726 0.599 -0.481 571 HG21 THR 532 HG21 THR 532 82.561 1.875 -0.335 572 HG22 THR 532 HG22 THR 532 82.344 1.766 1.408 573 HG23 THR 532 HG23 THR 532 82.228 0.320 0.415 574 H GLU 533 H GLU 533 83.350 3.843 -0.270 575 HA GLU 533 HA GLU 533 85.253 4.286 -2.490 576 HB2 GLU 533 HB2 GLU 533 82.834 3.461 -2.849 577 HB3 GLU 533 HB3 GLU 533 82.350 5.110 -2.460 578 HG2 GLU 533 HG2 GLU 533 82.560 4.971 -4.859 579 HG3 GLU 533 HG3 GLU 533 83.928 5.906 -4.275 580 H PHE 534 H PHE 534 84.234 5.777 0.308 581 HA PHE 534 HA PHE 534 84.327 7.926 1.099 582 HB2 PHE 534 HB2 PHE 534 86.603 7.782 -0.859 583 HB3 PHE 534 HB3 PHE 534 86.344 9.191 0.167 584 HD1 PHE 534 HD1 PHE 534 86.648 5.465 0.334 585 HD2 PHE 534 HD2 PHE 534 87.229 9.212 2.352 586 HE1 PHE 534 HE1 PHE 534 87.773 4.284 2.199 587 HE2 PHE 534 HE2 PHE 534 88.348 8.029 4.223 588 HZ PHE 534 HZ PHE 534 88.621 5.566 4.145 589 H GLU 535 H GLU 535 82.515 9.028 0.562 590 HA GLU 535 HA GLU 535 81.574 9.771 -1.929 591 HB2 GLU 535 HB2 GLU 535 81.359 11.225 0.721 592 HB3 GLU 535 HB3 GLU 535 80.403 11.621 -0.706 593 HG2 GLU 535 HG2 GLU 535 79.402 9.414 -0.722 594 HG3 GLU 535 HG3 GLU 535 80.462 8.882 0.583 595 H ASN 536 H ASN 536 82.053 11.332 -3.395 596 HA ASN 536 HA ASN 536 83.250 12.980 -4.466 597 HB2 ASN 536 HB2 ASN 536 82.005 14.281 -2.694 598 HB3 ASN 536 HB3 ASN 536 83.469 14.210 -1.716 599 HD21 ASN 536 HD21 ASN 536 85.429 15.300 -2.605 600 HD22 ASN 536 HD22 ASN 536 85.252 16.544 -3.746 601 H VAL 537 H VAL 537 84.976 11.281 -4.691 602 HA VAL 537 HA VAL 537 87.258 11.428 -2.934 603 HB VAL 537 HB VAL 537 86.908 10.147 -5.659 604 HG11 VAL 537 HG11 VAL 537 88.925 8.807 -4.882 605 HG12 VAL 537 HG12 VAL 537 89.134 10.010 -3.610 606 HG13 VAL 537 HG13 VAL 537 89.256 10.489 -5.303 607 HG21 VAL 537 HG21 VAL 537 86.824 8.052 -4.240 608 HG22 VAL 537 HG22 VAL 537 85.443 9.129 -4.025 609 HG23 VAL 537 HG23 VAL 537 86.731 9.090 -2.820 610 H THR 538 H THR 538 88.913 12.819 -3.055 611 HA THR 538 HA THR 538 89.855 13.964 -5.515 612 HB THR 538 HB THR 538 88.615 15.921 -3.587 613 HG1 THR 538 HG1 THR 538 86.766 15.506 -4.445 614 HG21 THR 538 HG21 THR 538 88.880 17.477 -5.405 615 HG22 THR 538 HG22 THR 538 89.330 16.183 -6.516 616 HG23 THR 538 HG23 THR 538 90.419 16.638 -5.205 617 HA PRO 539 HA PRO 539 92.557 13.519 -1.542 618 HB2 PRO 539 HB2 PRO 539 94.623 12.732 -3.433 619 HB3 PRO 539 HB3 PRO 539 93.871 11.750 -2.166 620 HG2 PRO 539 HG2 PRO 539 93.251 11.883 -5.049 621 HG3 PRO 539 HG3 PRO 539 92.947 10.578 -3.890 622 HD2 PRO 539 HD2 PRO 539 90.935 12.068 -4.865 623 HD3 PRO 539 HD3 PRO 539 90.917 11.494 -3.184 624 H THR 540 H THR 540 93.819 15.180 -0.873 625 HA THR 540 HA THR 540 94.343 17.378 -2.729 626 HB THR 540 HB THR 540 94.758 17.158 0.265 627 HG1 THR 540 HG1 THR 540 92.652 17.299 0.107 628 HG21 THR 540 HG21 THR 540 96.230 18.839 -0.639 629 HG22 THR 540 HG22 THR 540 94.849 19.672 0.075 630 HG23 THR 540 HG23 THR 540 94.949 19.474 -1.674 631 H ASN 541 H ASN 541 96.293 17.759 -3.618 632 HA ASN 541 HA ASN 541 98.453 15.941 -3.148 633 HB2 ASN 541 HB2 ASN 541 98.219 18.453 -4.809 634 HB3 ASN 541 HB3 ASN 541 99.687 17.475 -4.734 635 HD21 ASN 541 HD21 ASN 541 98.433 14.870 -4.601 636 HD22 ASN 541 HD22 ASN 541 97.674 14.586 -6.091 637 H ASP 542 H ASP 542 100.474 16.337 -2.304 638 HA ASP 542 HA ASP 542 100.575 17.887 0.048 639 HB2 ASP 542 HB2 ASP 542 101.897 15.843 -0.326 640 HB3 ASP 542 HB3 ASP 542 102.832 16.678 -1.565 641 H GLN 543 H GLN 543 100.957 19.992 0.331 642 HA GLN 543 HA GLN 543 101.349 21.857 -1.697 643 HB2 GLN 543 HB2 GLN 543 100.585 22.400 0.608 644 HB3 GLN 543 HB3 GLN 543 102.220 22.107 1.196 645 HG2 GLN 543 HG2 GLN 543 101.917 24.498 0.863 646 HG3 GLN 543 HG3 GLN 543 103.049 23.899 -0.344 647 HE21 GLN 543 HE21 GLN 543 102.566 25.420 -2.016 648 HE22 GLN 543 HE22 GLN 543 101.042 25.527 -2.753 Start of MODEL 11 1 H1 SER 466 H1 SER 466 28.708 0.600 1.989 2 H2 SER 466 H2 SER 466 28.466 -0.223 0.522 3 H3 SER 466 H3 SER 466 27.153 0.081 1.557 4 HA SER 466 HA SER 466 27.846 1.607 -0.563 5 HB2 SER 466 HB2 SER 466 25.665 1.696 0.453 6 HB3 SER 466 HB3 SER 466 26.338 2.268 1.978 7 HG SER 466 HG SER 466 25.384 3.845 0.375 8 H ASP 467 H ASP 467 28.665 3.746 -0.807 9 HA ASP 467 HA ASP 467 30.301 5.339 -0.536 10 HB2 ASP 467 HB2 ASP 467 28.672 5.931 1.297 11 HB3 ASP 467 HB3 ASP 467 29.694 5.026 2.412 12 H ASP 468 H ASP 468 31.299 2.781 -0.842 13 HA ASP 468 HA ASP 468 33.284 2.239 1.204 14 HB2 ASP 468 HB2 ASP 468 34.002 0.444 -0.384 15 HB3 ASP 468 HB3 ASP 468 32.291 0.352 0.035 16 H TYR 469 H TYR 469 33.039 4.499 -1.095 17 HA TYR 469 HA TYR 469 35.575 4.472 -2.401 18 HB2 TYR 469 HB2 TYR 469 33.420 5.627 -3.075 19 HB3 TYR 469 HB3 TYR 469 33.816 6.846 -1.871 20 HD1 TYR 469 HD1 TYR 469 34.879 5.286 -5.052 21 HD2 TYR 469 HD2 TYR 469 35.597 8.422 -2.209 22 HE1 TYR 469 HE1 TYR 469 36.362 6.422 -6.682 23 HE2 TYR 469 HE2 TYR 469 37.081 9.558 -3.835 24 HH TYR 469 HH TYR 469 37.420 9.638 -6.266 25 H VAL 470 H VAL 470 37.419 5.704 -1.994 26 HA VAL 470 HA VAL 470 37.707 6.684 0.792 27 HB VAL 470 HB VAL 470 40.031 6.044 -1.026 28 HG11 VAL 470 HG11 VAL 470 39.600 5.988 1.972 29 HG12 VAL 470 HG12 VAL 470 40.494 7.211 1.068 30 HG13 VAL 470 HG13 VAL 470 41.101 5.558 1.156 31 HG21 VAL 470 HG21 VAL 470 39.992 3.755 0.051 32 HG22 VAL 470 HG22 VAL 470 38.697 4.037 -1.113 33 HG23 VAL 470 HG23 VAL 470 38.363 4.121 0.617 34 H ASP 471 H ASP 471 38.331 8.753 1.195 35 HA ASP 471 HA ASP 471 37.930 10.794 -0.623 36 HB2 ASP 471 HB2 ASP 471 39.726 10.687 1.805 37 HB3 ASP 471 HB3 ASP 471 39.412 12.171 0.908 38 H GLU 472 H GLU 472 39.219 12.013 -1.951 39 HA GLU 472 HA GLU 472 41.196 10.740 -3.471 40 HB2 GLU 472 HB2 GLU 472 39.788 12.602 -4.256 41 HB3 GLU 472 HB3 GLU 472 40.649 13.695 -3.177 42 HG2 GLU 472 HG2 GLU 472 42.748 13.241 -4.354 43 HG3 GLU 472 HG3 GLU 472 41.923 12.088 -5.400 44 H GLU 473 H GLU 473 41.508 13.056 -0.790 45 HA GLU 473 HA GLU 473 44.296 13.473 -1.074 46 HB2 GLU 473 HB2 GLU 473 44.187 14.434 1.140 47 HB3 GLU 473 HB3 GLU 473 42.739 14.906 0.256 48 HG2 GLU 473 HG2 GLU 473 41.620 12.865 1.324 49 HG3 GLU 473 HG3 GLU 473 43.011 12.810 2.406 50 H THR 474 H THR 474 42.406 11.282 0.912 51 HA THR 474 HA THR 474 44.579 9.987 2.215 52 HB THR 474 HB THR 474 41.714 9.230 1.617 53 HG1 THR 474 HG1 THR 474 41.395 9.923 3.603 54 HG21 THR 474 HG21 THR 474 42.749 7.109 1.701 55 HG22 THR 474 HG22 THR 474 42.134 7.377 3.334 56 HG23 THR 474 HG23 THR 474 43.849 7.609 2.990 57 H TYR 475 H TYR 475 42.635 9.216 -0.626 58 HA TYR 475 HA TYR 475 43.852 6.771 -1.227 59 HB2 TYR 475 HB2 TYR 475 41.662 7.716 -2.115 60 HB3 TYR 475 HB3 TYR 475 42.637 8.664 -3.240 61 HD1 TYR 475 HD1 TYR 475 42.116 5.189 -2.011 62 HD2 TYR 475 HD2 TYR 475 43.353 7.703 -5.258 63 HE1 TYR 475 HE1 TYR 475 42.285 3.193 -3.494 64 HE2 TYR 475 HE2 TYR 475 43.524 5.718 -6.740 65 HH TYR 475 HH TYR 475 43.902 2.883 -5.984 66 H ASN 476 H ASN 476 44.543 10.055 -2.444 67 HA ASN 476 HA ASN 476 46.610 9.202 -4.211 68 HB2 ASN 476 HB2 ASN 476 46.194 11.889 -2.883 69 HB3 ASN 476 HB3 ASN 476 47.318 11.554 -4.204 70 HD21 ASN 476 HD21 ASN 476 44.945 9.505 -4.996 71 HD22 ASN 476 HD22 ASN 476 43.939 10.515 -5.921 72 H LEU 477 H LEU 477 46.541 10.238 -0.839 73 HA LEU 477 HA LEU 477 49.292 10.408 -0.362 74 HB2 LEU 477 HB2 LEU 477 47.646 11.116 1.292 75 HB3 LEU 477 HB3 LEU 477 47.023 9.477 1.426 76 HG LEU 477 HG LEU 477 49.205 8.721 2.305 77 HD11 LEU 477 HD11 LEU 477 50.736 10.697 3.071 78 HD12 LEU 477 HD12 LEU 477 49.903 11.618 1.819 79 HD13 LEU 477 HD13 LEU 477 50.823 10.174 1.391 80 HD21 LEU 477 HD21 LEU 477 47.438 9.447 3.840 81 HD22 LEU 477 HD22 LEU 477 48.021 11.105 3.738 82 HD23 LEU 477 HD23 LEU 477 49.027 9.859 4.479 83 H GLN 478 H GLN 478 47.072 7.603 -0.265 84 HA GLN 478 HA GLN 478 48.970 5.683 0.534 85 HB2 GLN 478 HB2 GLN 478 46.472 5.461 -1.160 86 HB3 GLN 478 HB3 GLN 478 47.402 4.062 -0.625 87 HG2 GLN 478 HG2 GLN 478 46.299 6.145 1.268 88 HG3 GLN 478 HG3 GLN 478 45.434 4.668 0.848 89 HE21 GLN 478 HE21 GLN 478 47.105 5.806 3.340 90 HE22 GLN 478 HE22 GLN 478 47.956 4.421 3.832 91 H LYS 479 H LYS 479 48.050 6.888 -2.647 92 HA LYS 479 HA LYS 479 49.640 5.098 -4.165 93 HB2 LYS 479 HB2 LYS 479 48.379 7.792 -4.716 94 HB3 LYS 479 HB3 LYS 479 49.389 6.989 -5.924 95 HG2 LYS 479 HG2 LYS 479 47.939 5.094 -6.033 96 HG3 LYS 479 HG3 LYS 479 47.072 5.584 -4.578 97 HD2 LYS 479 HD2 LYS 479 45.832 6.062 -6.711 98 HD3 LYS 479 HD3 LYS 479 46.110 7.487 -5.711 99 HE2 LYS 479 HE2 LYS 479 47.814 8.292 -7.120 100 HE3 LYS 479 HE3 LYS 479 48.045 6.725 -7.899 101 HZ1 LYS 479 HZ1 LYS 479 46.492 8.768 -8.821 102 HZ2 LYS 479 HZ2 LYS 479 45.367 7.688 -8.149 103 HZ3 LYS 479 HZ3 LYS 479 46.442 7.159 -9.354 104 H LEU 480 H LEU 480 50.235 8.329 -2.853 105 HA LEU 480 HA LEU 480 52.724 8.754 -4.084 106 HB2 LEU 480 HB2 LEU 480 51.278 9.913 -1.733 107 HB3 LEU 480 HB3 LEU 480 52.999 10.253 -1.866 108 HG LEU 480 HG LEU 480 52.577 11.073 -4.209 109 HD11 LEU 480 HD11 LEU 480 49.664 11.175 -3.444 110 HD12 LEU 480 HD12 LEU 480 50.322 9.826 -4.368 111 HD13 LEU 480 HD13 LEU 480 50.394 11.455 -5.023 112 HD21 LEU 480 HD21 LEU 480 51.350 13.181 -3.369 113 HD22 LEU 480 HD22 LEU 480 52.847 12.732 -2.550 114 HD23 LEU 480 HD23 LEU 480 51.285 12.365 -1.808 115 H LEU 481 H LEU 481 51.906 7.322 -0.933 116 HA LEU 481 HA LEU 481 54.666 6.927 -0.201 117 HB2 LEU 481 HB2 LEU 481 52.200 5.696 1.036 118 HB3 LEU 481 HB3 LEU 481 53.786 5.886 1.783 119 HG LEU 481 HG LEU 481 52.034 8.169 0.858 120 HD11 LEU 481 HD11 LEU 481 52.565 7.059 3.617 121 HD12 LEU 481 HD12 LEU 481 51.013 7.137 2.781 122 HD13 LEU 481 HD13 LEU 481 51.803 8.621 3.311 123 HD21 LEU 481 HD21 LEU 481 54.748 8.003 2.135 124 HD22 LEU 481 HD22 LEU 481 53.733 9.425 2.365 125 HD23 LEU 481 HD23 LEU 481 54.235 8.962 0.748 126 H ALA 482 H ALA 482 52.728 5.313 -2.351 127 HA ALA 482 HA ALA 482 53.034 2.632 -1.844 128 HB1 ALA 482 HB1 ALA 482 53.446 3.614 -4.650 129 HB2 ALA 482 HB2 ALA 482 51.902 3.880 -3.844 130 HB3 ALA 482 HB3 ALA 482 52.511 2.240 -4.072 131 HA PRO 483 HA PRO 483 57.358 2.493 -3.793 132 HB2 PRO 483 HB2 PRO 483 58.588 5.128 -3.903 133 HB3 PRO 483 HB3 PRO 483 58.119 4.081 -5.253 134 HG2 PRO 483 HG2 PRO 483 56.889 6.469 -4.662 135 HG3 PRO 483 HG3 PRO 483 56.118 5.142 -5.548 136 HD2 PRO 483 HD2 PRO 483 55.861 5.857 -2.637 137 HD3 PRO 483 HD3 PRO 483 54.599 5.364 -3.789 138 H TYR 484 H TYR 484 57.338 5.242 -1.506 139 HA TYR 484 HA TYR 484 59.717 4.523 -0.165 140 HB2 TYR 484 HB2 TYR 484 59.007 6.725 0.167 141 HB3 TYR 484 HB3 TYR 484 57.353 6.244 0.549 142 HD1 TYR 484 HD1 TYR 484 60.866 5.944 1.819 143 HD2 TYR 484 HD2 TYR 484 56.691 6.019 2.817 144 HE1 TYR 484 HE1 TYR 484 61.433 5.923 4.234 145 HE2 TYR 484 HE2 TYR 484 57.264 5.994 5.220 146 HH TYR 484 HH TYR 484 59.571 5.054 6.552 147 H HIS 485 H HIS 485 56.352 3.639 0.303 148 HA HIS 485 HA HIS 485 56.619 2.246 2.743 149 HB2 HIS 485 HB2 HIS 485 54.457 2.959 1.691 150 HB3 HIS 485 HB3 HIS 485 54.668 1.675 0.501 151 HD1 HIS 485 HD1 HIS 485 54.639 -0.810 1.426 152 HD2 HIS 485 HD2 HIS 485 53.529 2.103 4.193 153 HE1 HIS 485 HE1 HIS 485 53.509 -2.030 3.336 154 H LYS 486 H LYS 486 57.033 1.284 -0.639 155 HA LYS 486 HA LYS 486 57.529 -1.504 0.062 156 HB2 LYS 486 HB2 LYS 486 57.758 0.049 -2.534 157 HB3 LYS 486 HB3 LYS 486 58.040 -1.686 -2.391 158 HG2 LYS 486 HG2 LYS 486 55.772 -2.076 -1.686 159 HG3 LYS 486 HG3 LYS 486 55.453 -0.350 -1.553 160 HD2 LYS 486 HD2 LYS 486 55.836 -0.111 -3.997 161 HD3 LYS 486 HD3 LYS 486 56.099 -1.852 -4.111 162 HE2 LYS 486 HE2 LYS 486 53.819 -2.261 -3.283 163 HE3 LYS 486 HE3 LYS 486 53.557 -0.525 -3.125 164 HZ1 LYS 486 HZ1 LYS 486 54.033 -0.352 -5.540 165 HZ2 LYS 486 HZ2 LYS 486 52.621 -1.225 -5.176 166 HZ3 LYS 486 HZ3 LYS 486 54.040 -2.045 -5.625 167 H ALA 487 H ALA 487 59.312 1.381 -0.045 168 HA ALA 487 HA ALA 487 61.843 0.369 -0.867 169 HB1 ALA 487 HB1 ALA 487 62.732 2.476 -0.134 170 HB2 ALA 487 HB2 ALA 487 61.307 2.792 0.857 171 HB3 ALA 487 HB3 ALA 487 61.177 2.785 -0.902 172 H LYS 488 H LYS 488 62.561 -1.367 0.235 173 HA LYS 488 HA LYS 488 62.563 -1.356 3.175 174 HB2 LYS 488 HB2 LYS 488 63.337 -3.681 2.963 175 HB3 LYS 488 HB3 LYS 488 61.852 -3.416 2.048 176 HG2 LYS 488 HG2 LYS 488 63.246 -3.052 -0.002 177 HG3 LYS 488 HG3 LYS 488 64.674 -3.481 0.940 178 HD2 LYS 488 HD2 LYS 488 63.713 -5.699 1.411 179 HD3 LYS 488 HD3 LYS 488 62.274 -5.274 0.482 180 HE2 LYS 488 HE2 LYS 488 63.668 -4.950 -1.532 181 HE3 LYS 488 HE3 LYS 488 65.103 -5.390 -0.606 182 HZ1 LYS 488 HZ1 LYS 488 63.267 -7.392 -0.158 183 HZ2 LYS 488 HZ2 LYS 488 64.666 -7.483 -1.118 184 HZ3 LYS 488 HZ3 LYS 488 63.173 -7.074 -1.821 185 H THR 489 H THR 489 64.398 0.299 1.306 186 HA THR 489 HA THR 489 66.927 -0.442 2.683 187 HB THR 489 HB THR 489 68.004 0.399 0.441 188 HG1 THR 489 HG1 THR 489 65.765 -0.733 -0.744 189 HG21 THR 489 HG21 THR 489 66.743 -2.287 0.978 190 HG22 THR 489 HG22 THR 489 68.448 -1.826 1.017 191 HG23 THR 489 HG23 THR 489 67.615 -1.990 -0.527 192 H LEU 490 H LEU 490 68.222 1.232 3.301 193 HA LEU 490 HA LEU 490 67.048 3.720 3.875 194 HB2 LEU 490 HB2 LEU 490 69.838 2.617 3.908 195 HB3 LEU 490 HB3 LEU 490 69.584 4.327 4.222 196 HG LEU 490 HG LEU 490 67.870 2.346 5.709 197 HD11 LEU 490 HD11 LEU 490 70.126 1.423 5.977 198 HD12 LEU 490 HD12 LEU 490 69.609 2.186 7.480 199 HD13 LEU 490 HD13 LEU 490 70.745 3.016 6.416 200 HD21 LEU 490 HD21 LEU 490 69.147 5.008 6.400 201 HD22 LEU 490 HD22 LEU 490 68.119 4.074 7.484 202 HD23 LEU 490 HD23 LEU 490 67.457 4.731 5.991 203 H GLU 491 H GLU 491 69.353 2.771 1.346 204 HA GLU 491 HA GLU 491 69.774 5.273 0.170 205 HB2 GLU 491 HB2 GLU 491 71.101 3.268 -0.351 206 HB3 GLU 491 HB3 GLU 491 69.695 2.527 -1.110 207 HG2 GLU 491 HG2 GLU 491 71.072 3.430 -2.853 208 HG3 GLU 491 HG3 GLU 491 69.652 4.459 -2.732 209 H ARG 492 H ARG 492 67.284 2.874 -0.360 210 HA ARG 492 HA ARG 492 66.002 4.331 -2.482 211 HB2 ARG 492 HB2 ARG 492 65.834 1.877 -2.303 212 HB3 ARG 492 HB3 ARG 492 64.973 2.052 -0.779 213 HG2 ARG 492 HG2 ARG 492 63.230 1.754 -2.332 214 HG3 ARG 492 HG3 ARG 492 63.273 3.503 -2.155 215 HD2 ARG 492 HD2 ARG 492 64.566 3.731 -4.203 216 HD3 ARG 492 HD3 ARG 492 64.725 1.984 -4.346 217 HE ARG 492 HE ARG 492 61.978 2.735 -4.238 218 HH11 ARG 492 HH11 ARG 492 63.552 4.525 -6.295 219 HH12 ARG 492 HH12 ARG 492 63.187 3.674 -7.759 220 HH21 ARG 492 HH21 ARG 492 62.005 0.849 -6.146 221 HH22 ARG 492 HH22 ARG 492 62.315 1.601 -7.675 222 H GLN 493 H GLN 493 65.320 3.769 0.949 223 HA GLN 493 HA GLN 493 62.917 5.180 1.086 224 HB2 GLN 493 HB2 GLN 493 65.039 4.572 3.130 225 HB3 GLN 493 HB3 GLN 493 63.576 5.447 3.554 226 HG2 GLN 493 HG2 GLN 493 62.183 3.601 2.883 227 HG3 GLN 493 HG3 GLN 493 63.549 2.752 2.170 228 HE21 GLN 493 HE21 GLN 493 62.510 1.091 3.877 229 HE22 GLN 493 HE22 GLN 493 63.229 1.118 5.415 230 H VAL 494 H VAL 494 66.247 6.319 1.751 231 HA VAL 494 HA VAL 494 65.491 8.956 2.377 232 HB VAL 494 HB VAL 494 67.792 7.723 2.619 233 HG11 VAL 494 HG11 VAL 494 69.421 8.198 0.920 234 HG12 VAL 494 HG12 VAL 494 68.260 9.142 -0.010 235 HG13 VAL 494 HG13 VAL 494 68.058 7.401 0.154 236 HG21 VAL 494 HG21 VAL 494 67.579 10.644 1.854 237 HG22 VAL 494 HG22 VAL 494 68.957 9.919 2.682 238 HG23 VAL 494 HG23 VAL 494 67.380 9.967 3.469 239 H TYR 495 H TYR 495 66.436 7.446 -0.669 240 HA TYR 495 HA TYR 495 66.329 9.717 -2.324 241 HB2 TYR 495 HB2 TYR 495 67.380 7.636 -3.002 242 HB3 TYR 495 HB3 TYR 495 65.834 6.798 -2.922 243 HD1 TYR 495 HD1 TYR 495 63.987 7.437 -4.511 244 HD2 TYR 495 HD2 TYR 495 68.002 8.909 -4.911 245 HE1 TYR 495 HE1 TYR 495 63.534 8.038 -6.875 246 HE2 TYR 495 HE2 TYR 495 67.552 9.505 -7.275 247 HH TYR 495 HH TYR 495 66.100 9.094 -9.024 248 H GLU 496 H GLU 496 63.813 7.242 -1.730 249 HA GLU 496 HA GLU 496 61.862 8.411 -3.410 250 HB2 GLU 496 HB2 GLU 496 61.582 6.604 -0.989 251 HB3 GLU 496 HB3 GLU 496 60.235 7.056 -2.031 252 HG2 GLU 496 HG2 GLU 496 62.761 5.733 -3.053 253 HG3 GLU 496 HG3 GLU 496 61.305 4.840 -2.622 254 H LEU 497 H LEU 497 62.762 8.991 -0.075 255 HA LEU 497 HA LEU 497 60.516 10.538 0.632 256 HB2 LEU 497 HB2 LEU 497 63.328 10.333 1.636 257 HB3 LEU 497 HB3 LEU 497 62.249 11.560 2.294 258 HG LEU 497 HG LEU 497 61.584 8.603 2.173 259 HD11 LEU 497 HD11 LEU 497 62.295 8.337 4.386 260 HD12 LEU 497 HD12 LEU 497 62.288 10.071 4.704 261 HD13 LEU 497 HD13 LEU 497 63.559 9.358 3.709 262 HD21 LEU 497 HD21 LEU 497 60.129 11.045 3.087 263 HD22 LEU 497 HD22 LEU 497 60.002 9.634 4.137 264 HD23 LEU 497 HD23 LEU 497 59.506 9.520 2.451 265 H GLU 498 H GLU 498 63.578 11.345 -0.944 266 HA GLU 498 HA GLU 498 63.291 14.148 -0.939 267 HB2 GLU 498 HB2 GLU 498 64.671 12.312 -2.913 268 HB3 GLU 498 HB3 GLU 498 64.822 14.068 -2.926 269 HG2 GLU 498 HG2 GLU 498 65.850 14.089 -0.765 270 HG3 GLU 498 HG3 GLU 498 65.452 12.396 -0.486 271 H LYS 499 H LYS 499 62.218 11.666 -3.259 272 HA LYS 499 HA LYS 499 61.052 13.508 -5.128 273 HB2 LYS 499 HB2 LYS 499 60.178 10.644 -4.642 274 HB3 LYS 499 HB3 LYS 499 60.077 11.560 -6.143 275 HG2 LYS 499 HG2 LYS 499 62.567 10.499 -4.784 276 HG3 LYS 499 HG3 LYS 499 61.959 10.089 -6.386 277 HD2 LYS 499 HD2 LYS 499 62.264 12.565 -6.952 278 HD3 LYS 499 HD3 LYS 499 63.189 12.668 -5.458 279 HE2 LYS 499 HE2 LYS 499 64.782 11.062 -6.239 280 HE3 LYS 499 HE3 LYS 499 63.807 10.713 -7.668 281 HZ1 LYS 499 HZ1 LYS 499 64.446 12.607 -8.681 282 HZ2 LYS 499 HZ2 LYS 499 65.806 12.448 -7.674 283 HZ3 LYS 499 HZ3 LYS 499 64.539 13.491 -7.237 284 H LEU 500 H LEU 500 59.720 11.566 -2.488 285 HA LEU 500 HA LEU 500 57.027 12.355 -2.767 286 HB2 LEU 500 HB2 LEU 500 58.681 11.252 -0.518 287 HB3 LEU 500 HB3 LEU 500 56.983 11.626 -0.287 288 HG LEU 500 HG LEU 500 57.892 9.916 -2.600 289 HD11 LEU 500 HD11 LEU 500 57.097 8.925 0.153 290 HD12 LEU 500 HD12 LEU 500 58.746 8.940 -0.472 291 HD13 LEU 500 HD13 LEU 500 57.523 7.930 -1.241 292 HD21 LEU 500 HD21 LEU 500 55.306 9.360 -1.283 293 HD22 LEU 500 HD22 LEU 500 55.667 9.637 -2.986 294 HD23 LEU 500 HD23 LEU 500 55.401 10.999 -1.907 295 H GLN 501 H GLN 501 59.684 13.694 -0.838 296 HA GLN 501 HA GLN 501 58.257 15.574 0.646 297 HB2 GLN 501 HB2 GLN 501 61.080 15.420 -0.382 298 HB3 GLN 501 HB3 GLN 501 60.533 16.885 0.432 299 HG2 GLN 501 HG2 GLN 501 60.213 14.123 1.634 300 HG3 GLN 501 HG3 GLN 501 61.615 15.149 1.951 301 HE21 GLN 501 HE21 GLN 501 58.807 14.285 3.391 302 HE22 GLN 501 HE22 GLN 501 58.421 15.733 4.187 303 H GLU 502 H GLU 502 59.185 15.564 -2.699 304 HA GLU 502 HA GLU 502 58.672 18.372 -3.130 305 HB2 GLU 502 HB2 GLU 502 60.354 17.128 -4.430 306 HB3 GLU 502 HB3 GLU 502 59.097 16.071 -5.054 307 HG2 GLU 502 HG2 GLU 502 59.576 17.714 -6.722 308 HG3 GLU 502 HG3 GLU 502 57.989 18.085 -6.058 309 H LYS 503 H LYS 503 56.894 15.379 -3.323 310 HA LYS 503 HA LYS 503 54.621 16.726 -4.677 311 HB2 LYS 503 HB2 LYS 503 55.232 13.815 -4.192 312 HB3 LYS 503 HB3 LYS 503 53.818 14.422 -5.056 313 HG2 LYS 503 HG2 LYS 503 55.272 15.507 -6.708 314 HG3 LYS 503 HG3 LYS 503 56.701 14.932 -5.847 315 HD2 LYS 503 HD2 LYS 503 54.563 13.154 -7.060 316 HD3 LYS 503 HD3 LYS 503 56.136 13.483 -7.786 317 HE2 LYS 503 HE2 LYS 503 56.629 11.502 -6.677 318 HE3 LYS 503 HE3 LYS 503 57.011 12.647 -5.392 319 HZ1 LYS 503 HZ1 LYS 503 55.060 10.633 -5.414 320 HZ2 LYS 503 HZ2 LYS 503 54.268 12.132 -5.305 321 HZ3 LYS 503 HZ3 LYS 503 55.450 11.708 -4.161 322 H LEU 504 H LEU 504 55.550 15.361 -1.637 323 HA LEU 504 HA LEU 504 53.004 14.709 -0.664 324 HB2 LEU 504 HB2 LEU 504 55.627 15.283 0.636 325 HB3 LEU 504 HB3 LEU 504 54.189 15.071 1.630 326 HG LEU 504 HG LEU 504 55.204 13.065 -0.407 327 HD11 LEU 504 HD11 LEU 504 56.722 13.182 1.475 328 HD12 LEU 504 HD12 LEU 504 55.728 11.735 1.672 329 HD13 LEU 504 HD13 LEU 504 55.370 13.185 2.606 330 HD21 LEU 504 HD21 LEU 504 53.514 11.687 1.263 331 HD22 LEU 504 HD22 LEU 504 53.012 12.397 -0.266 332 HD23 LEU 504 HD23 LEU 504 52.722 13.261 1.236 333 HA PRO 505 HA PRO 505 51.333 18.988 -0.431 334 HB2 PRO 505 HB2 PRO 505 49.591 18.017 1.701 335 HB3 PRO 505 HB3 PRO 505 49.154 18.483 0.047 336 HG2 PRO 505 HG2 PRO 505 49.727 15.792 1.146 337 HG3 PRO 505 HG3 PRO 505 48.743 16.253 -0.248 338 HD2 PRO 505 HD2 PRO 505 51.069 15.058 -0.593 339 HD3 PRO 505 HD3 PRO 505 50.601 16.389 -1.668 340 H GLU 506 H GLU 506 51.611 20.659 0.981 341 HA GLU 506 HA GLU 506 53.768 20.969 2.506 342 HB2 GLU 506 HB2 GLU 506 51.041 22.155 3.081 343 HB3 GLU 506 HB3 GLU 506 52.557 22.768 3.739 344 HG2 GLU 506 HG2 GLU 506 51.974 22.502 0.772 345 HG3 GLU 506 HG3 GLU 506 51.798 23.999 1.686 346 H LYS 507 H LYS 507 50.651 20.334 4.155 347 HA LYS 507 HA LYS 507 51.683 19.918 6.700 348 HB2 LYS 507 HB2 LYS 507 49.580 18.834 7.220 349 HB3 LYS 507 HB3 LYS 507 49.258 20.153 6.094 350 HG2 LYS 507 HG2 LYS 507 49.473 18.429 4.227 351 HG3 LYS 507 HG3 LYS 507 49.428 17.205 5.493 352 HD2 LYS 507 HD2 LYS 507 47.290 19.319 5.139 353 HD3 LYS 507 HD3 LYS 507 47.188 17.704 4.441 354 HE2 LYS 507 HE2 LYS 507 47.571 16.824 6.828 355 HE3 LYS 507 HE3 LYS 507 47.236 18.470 7.362 356 HZ1 LYS 507 HZ1 LYS 507 45.369 17.249 5.476 357 HZ2 LYS 507 HZ2 LYS 507 45.073 18.333 6.751 358 HZ3 LYS 507 HZ3 LYS 507 45.338 16.687 7.075 359 H TYR 508 H TYR 508 51.649 17.756 3.967 360 HA TYR 508 HA TYR 508 52.454 15.452 5.610 361 HB2 TYR 508 HB2 TYR 508 51.786 15.861 2.692 362 HB3 TYR 508 HB3 TYR 508 52.614 14.401 3.234 363 HD1 TYR 508 HD1 TYR 508 51.552 12.838 4.751 364 HD2 TYR 508 HD2 TYR 508 49.472 16.285 3.296 365 HE1 TYR 508 HE1 TYR 508 49.418 11.873 5.532 366 HE2 TYR 508 HE2 TYR 508 47.319 15.308 4.046 367 HH TYR 508 HH TYR 508 47.183 12.046 5.453 368 H LYS 509 H LYS 509 53.756 17.981 3.679 369 HA LYS 509 HA LYS 509 56.208 16.794 2.939 370 HB2 LYS 509 HB2 LYS 509 55.111 19.018 2.161 371 HB3 LYS 509 HB3 LYS 509 55.874 19.716 3.587 372 HG2 LYS 509 HG2 LYS 509 58.070 19.029 2.807 373 HG3 LYS 509 HG3 LYS 509 57.353 18.155 1.456 374 HD2 LYS 509 HD2 LYS 509 58.131 20.261 0.596 375 HD3 LYS 509 HD3 LYS 509 56.371 20.336 0.663 376 HE2 LYS 509 HE2 LYS 509 56.394 21.710 2.602 377 HE3 LYS 509 HE3 LYS 509 58.089 21.354 2.934 378 HZ1 LYS 509 HZ1 LYS 509 57.338 22.626 0.398 379 HZ2 LYS 509 HZ2 LYS 509 58.794 22.731 1.266 380 HZ3 LYS 509 HZ3 LYS 509 57.417 23.568 1.806 381 H ALA 510 H ALA 510 55.278 18.798 5.720 382 HA ALA 510 HA ALA 510 57.763 18.893 6.995 383 HB1 ALA 510 HB1 ALA 510 54.994 18.905 8.204 384 HB2 ALA 510 HB2 ALA 510 55.915 20.313 7.676 385 HB3 ALA 510 HB3 ALA 510 56.470 19.363 9.055 386 H GLU 511 H GLU 511 55.068 16.628 7.548 387 HA GLU 511 HA GLU 511 56.266 15.067 9.550 388 HB2 GLU 511 HB2 GLU 511 53.916 14.889 8.906 389 HB3 GLU 511 HB3 GLU 511 54.370 14.264 7.323 390 HG2 GLU 511 HG2 GLU 511 55.347 12.272 8.352 391 HG3 GLU 511 HG3 GLU 511 54.998 12.912 9.959 392 H TYR 512 H TYR 512 56.430 14.572 6.016 393 HA TYR 512 HA TYR 512 58.179 12.296 6.335 394 HB2 TYR 512 HB2 TYR 512 57.067 13.805 3.990 395 HB3 TYR 512 HB3 TYR 512 58.319 12.583 3.763 396 HD1 TYR 512 HD1 TYR 512 54.954 13.110 5.343 397 HD2 TYR 512 HD2 TYR 512 57.756 10.296 3.746 398 HE1 TYR 512 HE1 TYR 512 53.266 11.306 5.546 399 HE2 TYR 512 HE2 TYR 512 56.087 8.493 3.959 400 HH TYR 512 HH TYR 512 54.101 7.946 4.966 401 H LYS 513 H LYS 513 58.608 15.702 6.108 402 HA LYS 513 HA LYS 513 61.246 15.702 5.026 403 HB2 LYS 513 HB2 LYS 513 59.809 17.747 5.207 404 HB3 LYS 513 HB3 LYS 513 59.979 17.680 6.953 405 HG2 LYS 513 HG2 LYS 513 61.650 19.209 6.375 406 HG3 LYS 513 HG3 LYS 513 62.556 17.704 6.438 407 HD2 LYS 513 HD2 LYS 513 63.256 18.644 4.403 408 HD3 LYS 513 HD3 LYS 513 62.004 17.519 3.895 409 HE2 LYS 513 HE2 LYS 513 60.402 19.279 3.616 410 HE3 LYS 513 HE3 LYS 513 61.430 20.439 4.455 411 HZ1 LYS 513 HZ1 LYS 513 61.530 19.516 1.722 412 HZ2 LYS 513 HZ2 LYS 513 63.041 19.590 2.494 413 HZ3 LYS 513 HZ3 LYS 513 62.066 20.978 2.398 414 H LYS 514 H LYS 514 59.822 15.406 8.199 415 HA LYS 514 HA LYS 514 62.176 15.420 9.758 416 HB2 LYS 514 HB2 LYS 514 59.666 15.532 10.439 417 HB3 LYS 514 HB3 LYS 514 59.732 13.774 10.401 418 HG2 LYS 514 HG2 LYS 514 61.522 13.756 12.045 419 HG3 LYS 514 HG3 LYS 514 61.607 15.516 12.021 420 HD2 LYS 514 HD2 LYS 514 59.024 14.097 12.696 421 HD3 LYS 514 HD3 LYS 514 60.249 14.391 13.935 422 HE2 LYS 514 HE2 LYS 514 60.174 16.858 13.199 423 HE3 LYS 514 HE3 LYS 514 58.714 16.431 12.307 424 HZ1 LYS 514 HZ1 LYS 514 58.165 17.247 14.489 425 HZ2 LYS 514 HZ2 LYS 514 59.149 16.069 15.219 426 HZ3 LYS 514 HZ3 LYS 514 57.753 15.606 14.368 427 H LYS 515 H LYS 515 60.325 12.860 8.165 428 HA LYS 515 HA LYS 515 61.870 10.655 9.039 429 HB2 LYS 515 HB2 LYS 515 60.261 11.045 6.504 430 HB3 LYS 515 HB3 LYS 515 60.932 9.502 7.026 431 HG2 LYS 515 HG2 LYS 515 59.627 9.688 9.145 432 HG3 LYS 515 HG3 LYS 515 58.893 11.175 8.532 433 HD2 LYS 515 HD2 LYS 515 57.996 9.954 6.599 434 HD3 LYS 515 HD3 LYS 515 58.741 8.465 7.179 435 HE2 LYS 515 HE2 LYS 515 56.571 10.063 8.563 436 HE3 LYS 515 HE3 LYS 515 56.411 8.461 7.833 437 HZ1 LYS 515 HZ1 LYS 515 57.579 9.231 10.372 438 HZ2 LYS 515 HZ2 LYS 515 58.468 8.083 9.490 439 HZ3 LYS 515 HZ3 LYS 515 56.852 7.770 9.909 440 H LEU 516 H LEU 516 62.117 12.753 6.205 441 HA LEU 516 HA LEU 516 64.174 11.431 4.838 442 HB2 LEU 516 HB2 LEU 516 62.888 13.199 3.807 443 HB3 LEU 516 HB3 LEU 516 63.417 14.347 5.024 444 HG LEU 516 HG LEU 516 65.701 14.245 4.211 445 HD11 LEU 516 HD11 LEU 516 66.057 12.912 2.016 446 HD12 LEU 516 HD12 LEU 516 64.605 12.033 2.484 447 HD13 LEU 516 HD13 LEU 516 66.026 12.005 3.526 448 HD21 LEU 516 HD21 LEU 516 65.386 15.343 2.119 449 HD22 LEU 516 HD22 LEU 516 63.931 15.677 3.057 450 HD23 LEU 516 HD23 LEU 516 63.902 14.448 1.793 451 H ASP 517 H ASP 517 64.306 14.052 7.226 452 HA ASP 517 HA ASP 517 67.086 14.364 7.293 453 HB2 ASP 517 HB2 ASP 517 64.954 14.798 9.388 454 HB3 ASP 517 HB3 ASP 517 66.638 15.261 9.620 455 H GLN 518 H GLN 518 64.947 12.333 9.277 456 HA GLN 518 HA GLN 518 66.983 11.215 10.900 457 HB2 GLN 518 HB2 GLN 518 64.240 10.194 10.177 458 HB3 GLN 518 HB3 GLN 518 65.289 9.451 11.389 459 HG2 GLN 518 HG2 GLN 518 65.348 11.507 12.674 460 HG3 GLN 518 HG3 GLN 518 64.428 12.351 11.431 461 HE21 GLN 518 HE21 GLN 518 63.120 12.595 13.670 462 HE22 GLN 518 HE22 GLN 518 61.876 11.456 13.872 463 H THR 519 H THR 519 65.576 10.160 7.838 464 HA THR 519 HA THR 519 66.814 7.622 7.724 465 HB THR 519 HB THR 519 66.089 9.373 5.363 466 HG1 THR 519 HG1 THR 519 64.032 8.407 5.589 467 HG21 THR 519 HG21 THR 519 65.850 7.326 4.178 468 HG22 THR 519 HG22 THR 519 65.890 6.377 5.663 469 HG23 THR 519 HG23 THR 519 67.358 7.160 5.077 470 H ARG 520 H ARG 520 67.806 10.822 6.608 471 HA ARG 520 HA ARG 520 70.147 10.071 5.236 472 HB2 ARG 520 HB2 ARG 520 69.328 12.612 6.637 473 HB3 ARG 520 HB3 ARG 520 70.849 12.466 5.759 474 HG2 ARG 520 HG2 ARG 520 69.675 11.967 3.701 475 HG3 ARG 520 HG3 ARG 520 68.132 11.905 4.551 476 HD2 ARG 520 HD2 ARG 520 68.384 14.078 3.461 477 HD3 ARG 520 HD3 ARG 520 68.413 14.271 5.210 478 HE ARG 520 HE ARG 520 71.062 13.958 4.226 479 HH11 ARG 520 HH11 ARG 520 69.312 16.035 2.549 480 HH12 ARG 520 HH12 ARG 520 69.906 17.509 3.240 481 HH21 ARG 520 HH21 ARG 520 71.457 15.944 5.915 482 HH22 ARG 520 HH22 ARG 520 71.119 17.457 5.141 483 H VAL 521 H VAL 521 69.519 10.792 8.630 484 HA VAL 521 HA VAL 521 72.184 10.891 9.525 485 HB VAL 521 HB VAL 521 69.632 10.038 10.916 486 HG11 VAL 521 HG11 VAL 521 72.409 10.534 11.992 487 HG12 VAL 521 HG12 VAL 521 71.416 9.091 12.185 488 HG13 VAL 521 HG13 VAL 521 70.968 10.585 13.008 489 HG21 VAL 521 HG21 VAL 521 71.132 12.617 11.350 490 HG22 VAL 521 HG22 VAL 521 69.423 12.261 11.623 491 HG23 VAL 521 HG23 VAL 521 70.033 12.460 9.980 492 H GLU 522 H GLU 522 69.874 8.192 9.373 493 HA GLU 522 HA GLU 522 71.612 6.197 10.388 494 HB2 GLU 522 HB2 GLU 522 69.238 5.944 8.525 495 HB3 GLU 522 HB3 GLU 522 69.961 4.626 9.445 496 HG2 GLU 522 HG2 GLU 522 69.425 5.816 11.549 497 HG3 GLU 522 HG3 GLU 522 68.687 7.118 10.612 498 H LEU 523 H LEU 523 70.703 7.102 7.093 499 HA LEU 523 HA LEU 523 72.295 5.218 5.719 500 HB2 LEU 523 HB2 LEU 523 70.424 6.397 4.701 501 HB3 LEU 523 HB3 LEU 523 71.272 7.928 4.857 502 HG LEU 523 HG LEU 523 72.911 5.877 3.485 503 HD11 LEU 523 HD11 LEU 523 70.993 5.011 2.443 504 HD12 LEU 523 HD12 LEU 523 71.523 6.253 1.311 505 HD13 LEU 523 HD13 LEU 523 70.181 6.575 2.404 506 HD21 LEU 523 HD21 LEU 523 73.253 7.737 1.905 507 HD22 LEU 523 HD22 LEU 523 73.455 8.285 3.568 508 HD23 LEU 523 HD23 LEU 523 71.969 8.656 2.693 509 H ALA 524 H ALA 524 72.930 8.576 6.681 510 HA ALA 524 HA ALA 524 75.396 8.849 5.353 511 HB1 ALA 524 HB1 ALA 524 75.772 10.726 6.931 512 HB2 ALA 524 HB2 ALA 524 74.366 10.201 7.856 513 HB3 ALA 524 HB3 ALA 524 74.164 10.773 6.200 514 H ASP 525 H ASP 525 74.564 7.675 8.583 515 HA ASP 525 HA ASP 525 77.235 7.388 9.513 516 HB2 ASP 525 HB2 ASP 525 75.283 7.458 11.008 517 HB3 ASP 525 HB3 ASP 525 74.710 5.933 10.336 518 H GLN 526 H GLN 526 75.004 5.323 7.771 519 HA GLN 526 HA GLN 526 76.460 2.896 7.884 520 HB2 GLN 526 HB2 GLN 526 74.059 3.101 7.285 521 HB3 GLN 526 HB3 GLN 526 74.522 3.894 5.784 522 HG2 GLN 526 HG2 GLN 526 75.815 1.854 5.150 523 HG3 GLN 526 HG3 GLN 526 75.228 1.067 6.616 524 HE21 GLN 526 HE21 GLN 526 73.338 -0.141 6.304 525 HE22 GLN 526 HE22 GLN 526 72.194 0.148 5.080 526 H VAL 527 H VAL 527 76.411 5.590 5.624 527 HA VAL 527 HA VAL 527 78.149 4.434 3.684 528 HB VAL 527 HB VAL 527 77.312 7.282 4.281 529 HG11 VAL 527 HG11 VAL 527 78.175 7.716 1.933 530 HG12 VAL 527 HG12 VAL 527 79.003 6.162 2.037 531 HG13 VAL 527 HG13 VAL 527 79.421 7.459 3.155 532 HG21 VAL 527 HG21 VAL 527 75.649 5.511 3.434 533 HG22 VAL 527 HG22 VAL 527 76.565 5.540 1.929 534 HG23 VAL 527 HG23 VAL 527 75.765 7.005 2.504 535 H LYS 528 H LYS 528 78.593 6.657 6.389 536 HA LYS 528 HA LYS 528 81.377 7.132 6.018 537 HB2 LYS 528 HB2 LYS 528 79.866 8.606 7.285 538 HB3 LYS 528 HB3 LYS 528 79.700 7.359 8.520 539 HG2 LYS 528 HG2 LYS 528 82.185 7.424 8.850 540 HG3 LYS 528 HG3 LYS 528 82.257 8.770 7.708 541 HD2 LYS 528 HD2 LYS 528 80.559 8.776 10.207 542 HD3 LYS 528 HD3 LYS 528 82.180 9.460 10.133 543 HE2 LYS 528 HE2 LYS 528 81.289 10.849 8.135 544 HE3 LYS 528 HE3 LYS 528 79.686 10.377 8.702 545 HZ1 LYS 528 HZ1 LYS 528 79.812 12.002 10.167 546 HZ2 LYS 528 HZ2 LYS 528 81.419 12.350 9.740 547 HZ3 LYS 528 HZ3 LYS 528 81.085 11.191 10.936 548 H SER 529 H SER 529 79.551 4.912 8.101 549 HA SER 529 HA SER 529 81.945 3.867 9.290 550 HB2 SER 529 HB2 SER 529 79.198 2.603 9.343 551 HB3 SER 529 HB3 SER 529 80.498 2.405 10.513 552 HG SER 529 HG SER 529 80.141 4.947 10.432 553 H ALA 530 H ALA 530 80.511 3.409 6.299 554 HA ALA 530 HA ALA 530 81.058 0.586 6.003 555 HB1 ALA 530 HB1 ALA 530 80.682 1.235 3.500 556 HB2 ALA 530 HB2 ALA 530 80.172 2.790 4.160 557 HB3 ALA 530 HB3 ALA 530 79.316 1.318 4.617 558 H VAL 531 H VAL 531 83.005 3.142 6.347 559 HA VAL 531 HA VAL 531 84.930 2.786 4.268 560 HB VAL 531 HB VAL 531 85.088 4.093 6.992 561 HG11 VAL 531 HG11 VAL 531 87.003 4.069 4.657 562 HG12 VAL 531 HG12 VAL 531 87.344 3.715 6.351 563 HG13 VAL 531 HG13 VAL 531 87.002 5.369 5.853 564 HG21 VAL 531 HG21 VAL 531 84.831 5.395 4.278 565 HG22 VAL 531 HG22 VAL 531 84.585 6.130 5.863 566 HG23 VAL 531 HG23 VAL 531 83.427 4.951 5.246 567 H THR 532 H THR 532 84.025 0.747 6.671 568 HA THR 532 HA THR 532 86.538 -0.135 7.704 569 HB THR 532 HB THR 532 84.497 -0.532 8.953 570 HG1 THR 532 HG1 THR 532 85.897 -2.088 9.419 571 HG21 THR 532 HG21 THR 532 82.835 -0.732 7.257 572 HG22 THR 532 HG22 THR 532 82.899 -2.309 8.040 573 HG23 THR 532 HG23 THR 532 83.678 -2.068 6.477 574 H GLU 533 H GLU 533 86.638 0.016 4.839 575 HA GLU 533 HA GLU 533 87.404 -1.218 3.044 576 HB2 GLU 533 HB2 GLU 533 89.020 -1.956 4.825 577 HB3 GLU 533 HB3 GLU 533 87.974 -3.348 5.106 578 HG2 GLU 533 HG2 GLU 533 88.226 -4.037 2.769 579 HG3 GLU 533 HG3 GLU 533 89.247 -2.635 2.457 580 H PHE 534 H PHE 534 86.053 -1.991 1.615 581 HA PHE 534 HA PHE 534 83.725 -3.520 2.307 582 HB2 PHE 534 HB2 PHE 534 84.925 -2.737 -0.353 583 HB3 PHE 534 HB3 PHE 534 83.388 -3.589 -0.179 584 HD1 PHE 534 HD1 PHE 534 85.185 -0.429 0.442 585 HD2 PHE 534 HD2 PHE 534 81.424 -2.482 0.743 586 HE1 PHE 534 HE1 PHE 534 84.046 1.726 0.899 587 HE2 PHE 534 HE2 PHE 534 80.283 -0.326 1.199 588 HZ PHE 534 HZ PHE 534 81.596 1.777 1.279 589 H GLU 535 H GLU 535 83.241 -5.650 1.812 590 HA GLU 535 HA GLU 535 85.385 -7.513 1.972 591 HB2 GLU 535 HB2 GLU 535 83.623 -9.204 1.723 592 HB3 GLU 535 HB3 GLU 535 83.122 -7.951 2.859 593 HG2 GLU 535 HG2 GLU 535 81.948 -6.792 0.956 594 HG3 GLU 535 HG3 GLU 535 82.316 -8.188 -0.055 595 H ASN 536 H ASN 536 86.170 -8.971 0.435 596 HA ASN 536 HA ASN 536 86.850 -9.678 -1.638 597 HB2 ASN 536 HB2 ASN 536 84.301 -10.067 -1.698 598 HB3 ASN 536 HB3 ASN 536 84.237 -8.633 -2.720 599 HD21 ASN 536 HD21 ASN 536 85.625 -8.725 -4.750 600 HD22 ASN 536 HD22 ASN 536 85.888 -10.238 -5.474 601 H VAL 537 H VAL 537 87.997 -7.310 -1.036 602 HA VAL 537 HA VAL 537 87.480 -5.213 -2.877 603 HB VAL 537 HB VAL 537 89.633 -4.338 -2.143 604 HG11 VAL 537 HG11 VAL 537 88.319 -5.602 0.250 605 HG12 VAL 537 HG12 VAL 537 87.543 -4.305 -0.662 606 HG13 VAL 537 HG13 VAL 537 89.087 -4.021 0.143 607 HG21 VAL 537 HG21 VAL 537 89.949 -7.089 -0.931 608 HG22 VAL 537 HG22 VAL 537 90.937 -5.707 -0.457 609 HG23 VAL 537 HG23 VAL 537 91.004 -6.310 -2.113 610 H THR 538 H THR 538 88.237 -4.848 -4.895 611 HA THR 538 HA THR 538 90.331 -6.603 -6.012 612 HB THR 538 HB THR 538 87.786 -6.075 -7.545 613 HG1 THR 538 HG1 THR 538 87.176 -7.181 -5.697 614 HG21 THR 538 HG21 THR 538 89.959 -8.182 -7.706 615 HG22 THR 538 HG22 THR 538 89.756 -6.816 -8.803 616 HG23 THR 538 HG23 THR 538 88.546 -8.098 -8.759 617 HA PRO 539 HA PRO 539 90.357 -1.844 -6.918 618 HB2 PRO 539 HB2 PRO 539 93.219 -2.091 -6.470 619 HB3 PRO 539 HB3 PRO 539 92.040 -1.163 -5.531 620 HG2 PRO 539 HG2 PRO 539 93.173 -3.834 -4.999 621 HG3 PRO 539 HG3 PRO 539 92.442 -2.675 -3.874 622 HD2 PRO 539 HD2 PRO 539 91.192 -4.973 -4.577 623 HD3 PRO 539 HD3 PRO 539 90.284 -3.477 -4.248 624 H THR 540 H THR 540 91.019 -1.020 -8.877 625 HA THR 540 HA THR 540 91.619 -2.862 -10.975 626 HB THR 540 HB THR 540 91.808 -0.741 -12.338 627 HG1 THR 540 HG1 THR 540 91.746 1.134 -11.344 628 HG21 THR 540 HG21 THR 540 89.673 -1.844 -12.165 629 HG22 THR 540 HG22 THR 540 89.394 -0.115 -11.956 630 HG23 THR 540 HG23 THR 540 89.403 -1.184 -10.551 631 H ASN 541 H ASN 541 93.555 -3.354 -11.915 632 HA ASN 541 HA ASN 541 95.961 -2.566 -10.500 633 HB2 ASN 541 HB2 ASN 541 95.486 -4.367 -12.872 634 HB3 ASN 541 HB3 ASN 541 97.084 -4.044 -12.200 635 HD21 ASN 541 HD21 ASN 541 96.454 -3.977 -9.419 636 HD22 ASN 541 HD22 ASN 541 95.927 -5.519 -8.945 637 H ASP 542 H ASP 542 97.598 -1.303 -11.203 638 HA ASP 542 HA ASP 542 96.959 0.636 -13.290 639 HB2 ASP 542 HB2 ASP 542 99.003 1.772 -12.381 640 HB3 ASP 542 HB3 ASP 542 97.748 1.486 -11.173 641 H GLN 543 H GLN 543 98.434 -2.324 -13.333 642 HA GLN 543 HA GLN 543 99.867 -1.685 -15.788 643 HB2 GLN 543 HB2 GLN 543 102.018 -2.544 -15.002 644 HB3 GLN 543 HB3 GLN 543 101.515 -1.169 -14.013 645 HG2 GLN 543 HG2 GLN 543 100.497 -2.838 -12.399 646 HG3 GLN 543 HG3 GLN 543 101.313 -4.106 -13.314 647 HE21 GLN 543 HE21 GLN 543 101.840 -3.292 -10.496 648 HE22 GLN 543 HE22 GLN 543 103.469 -2.815 -10.448 Start of MODEL 12 1 H1 SER 466 H1 SER 466 35.198 -1.127 -7.061 2 H2 SER 466 H2 SER 466 35.319 -0.096 -5.716 3 H3 SER 466 H3 SER 466 35.647 0.496 -7.274 4 HA SER 466 HA SER 466 33.528 0.974 -7.647 5 HB2 SER 466 HB2 SER 466 32.941 -1.212 -8.329 6 HB3 SER 466 HB3 SER 466 33.148 -1.868 -6.707 7 HG SER 466 HG SER 466 31.106 -0.161 -7.683 8 H ASP 467 H ASP 467 32.690 -1.057 -4.910 9 HA ASP 467 HA ASP 467 31.627 1.220 -3.435 10 HB2 ASP 467 HB2 ASP 467 30.822 -0.530 -1.883 11 HB3 ASP 467 HB3 ASP 467 30.367 -0.893 -3.549 12 H ASP 468 H ASP 468 32.117 1.248 -0.977 13 HA ASP 468 HA ASP 468 33.684 1.616 0.689 14 HB2 ASP 468 HB2 ASP 468 33.684 -0.920 0.421 15 HB3 ASP 468 HB3 ASP 468 35.149 -0.724 -0.535 16 H TYR 469 H TYR 469 33.957 3.030 -1.722 17 HA TYR 469 HA TYR 469 36.602 3.151 -2.735 18 HB2 TYR 469 HB2 TYR 469 34.448 3.967 -3.772 19 HB3 TYR 469 HB3 TYR 469 34.558 5.351 -2.692 20 HD1 TYR 469 HD1 TYR 469 36.194 3.564 -5.488 21 HD2 TYR 469 HD2 TYR 469 36.130 7.106 -3.065 22 HE1 TYR 469 HE1 TYR 469 37.710 4.689 -7.093 23 HE2 TYR 469 HE2 TYR 469 37.647 8.230 -4.664 24 HH TYR 469 HH TYR 469 39.507 6.848 -6.717 25 H VAL 470 H VAL 470 38.249 4.642 -2.372 26 HA VAL 470 HA VAL 470 38.228 5.945 0.293 27 HB VAL 470 HB VAL 470 40.734 5.374 -1.290 28 HG11 VAL 470 HG11 VAL 470 40.099 5.539 1.668 29 HG12 VAL 470 HG12 VAL 470 40.929 6.764 0.710 30 HG13 VAL 470 HG13 VAL 470 41.686 5.196 0.983 31 HG21 VAL 470 HG21 VAL 470 40.848 3.200 -0.025 32 HG22 VAL 470 HG22 VAL 470 39.598 3.241 -1.269 33 HG23 VAL 470 HG23 VAL 470 39.160 3.438 0.428 34 H ASP 471 H ASP 471 38.529 8.080 0.490 35 HA ASP 471 HA ASP 471 38.142 9.909 -1.526 36 HB2 ASP 471 HB2 ASP 471 39.744 10.194 1.026 37 HB3 ASP 471 HB3 ASP 471 39.364 11.550 -0.034 38 H GLU 472 H GLU 472 39.421 11.112 -2.846 39 HA GLU 472 HA GLU 472 41.594 9.888 -4.124 40 HB2 GLU 472 HB2 GLU 472 40.096 11.572 -5.145 41 HB3 GLU 472 HB3 GLU 472 40.816 12.804 -4.117 42 HG2 GLU 472 HG2 GLU 472 42.994 12.459 -5.159 43 HG3 GLU 472 HG3 GLU 472 42.341 11.147 -6.141 44 H GLU 473 H GLU 473 41.538 12.484 -1.715 45 HA GLU 473 HA GLU 473 44.297 13.105 -1.814 46 HB2 GLU 473 HB2 GLU 473 43.904 14.347 0.187 47 HB3 GLU 473 HB3 GLU 473 42.440 14.481 -0.775 48 HG2 GLU 473 HG2 GLU 473 41.552 12.487 0.570 49 HG3 GLU 473 HG3 GLU 473 42.912 12.758 1.661 50 H THR 474 H THR 474 42.406 10.959 0.202 51 HA THR 474 HA THR 474 44.504 10.014 1.880 52 HB THR 474 HB THR 474 41.832 8.880 1.044 53 HG1 THR 474 HG1 THR 474 41.367 10.353 2.484 54 HG21 THR 474 HG21 THR 474 43.880 7.727 2.940 55 HG22 THR 474 HG22 THR 474 43.099 6.937 1.569 56 HG23 THR 474 HG23 THR 474 42.167 7.309 3.019 57 H TYR 475 H TYR 475 42.991 8.774 -1.050 58 HA TYR 475 HA TYR 475 44.494 6.408 -1.243 59 HB2 TYR 475 HB2 TYR 475 42.350 6.959 -2.437 60 HB3 TYR 475 HB3 TYR 475 43.295 7.990 -3.515 61 HD1 TYR 475 HD1 TYR 475 43.016 4.554 -2.186 62 HD2 TYR 475 HD2 TYR 475 44.488 7.063 -5.331 63 HE1 TYR 475 HE1 TYR 475 43.638 2.532 -3.501 64 HE2 TYR 475 HE2 TYR 475 45.123 5.055 -6.653 65 HH TYR 475 HH TYR 475 45.473 2.796 -6.500 66 H ASN 476 H ASN 476 44.968 9.596 -2.781 67 HA ASN 476 HA ASN 476 47.306 8.794 -4.202 68 HB2 ASN 476 HB2 ASN 476 46.524 11.563 -3.268 69 HB3 ASN 476 HB3 ASN 476 47.694 11.173 -4.533 70 HD21 ASN 476 HD21 ASN 476 45.539 8.807 -4.982 71 HD22 ASN 476 HD22 ASN 476 44.451 9.554 -6.050 72 H LEU 477 H LEU 477 46.729 10.234 -1.042 73 HA LEU 477 HA LEU 477 49.339 10.805 -0.260 74 HB2 LEU 477 HB2 LEU 477 47.395 11.400 1.097 75 HB3 LEU 477 HB3 LEU 477 47.011 9.705 1.340 76 HG LEU 477 HG LEU 477 49.137 9.402 2.555 77 HD11 LEU 477 HD11 LEU 477 50.612 11.018 1.683 78 HD12 LEU 477 HD12 LEU 477 50.222 11.653 3.278 79 HD13 LEU 477 HD13 LEU 477 49.433 12.319 1.851 80 HD21 LEU 477 HD21 LEU 477 47.362 11.645 3.541 81 HD22 LEU 477 HD22 LEU 477 48.472 10.721 4.551 82 HD23 LEU 477 HD23 LEU 477 47.099 9.920 3.791 83 H GLN 478 H GLN 478 47.510 7.761 -0.079 84 HA GLN 478 HA GLN 478 49.524 6.151 1.089 85 HB2 GLN 478 HB2 GLN 478 47.193 5.489 -0.721 86 HB3 GLN 478 HB3 GLN 478 48.212 4.259 0.028 87 HG2 GLN 478 HG2 GLN 478 46.752 6.407 1.571 88 HG3 GLN 478 HG3 GLN 478 46.109 4.789 1.313 89 HE21 GLN 478 HE21 GLN 478 47.422 6.470 3.684 90 HE22 GLN 478 HE22 GLN 478 48.411 5.306 4.428 91 H LYS 479 H LYS 479 48.762 7.010 -2.191 92 HA LYS 479 HA LYS 479 50.533 5.268 -3.545 93 HB2 LYS 479 HB2 LYS 479 48.525 6.665 -4.391 94 HB3 LYS 479 HB3 LYS 479 49.680 7.985 -4.513 95 HG2 LYS 479 HG2 LYS 479 51.034 6.773 -6.080 96 HG3 LYS 479 HG3 LYS 479 50.101 5.294 -5.830 97 HD2 LYS 479 HD2 LYS 479 49.342 6.344 -7.890 98 HD3 LYS 479 HD3 LYS 479 48.070 6.491 -6.678 99 HE2 LYS 479 HE2 LYS 479 48.505 8.782 -6.320 100 HE3 LYS 479 HE3 LYS 479 50.106 8.690 -7.058 101 HZ1 LYS 479 HZ1 LYS 479 48.091 7.857 -8.870 102 HZ2 LYS 479 HZ2 LYS 479 49.234 9.102 -9.038 103 HZ3 LYS 479 HZ3 LYS 479 47.744 9.408 -8.279 104 H LEU 480 H LEU 480 50.837 8.536 -2.314 105 HA LEU 480 HA LEU 480 53.333 9.151 -3.473 106 HB2 LEU 480 HB2 LEU 480 51.616 10.246 -1.284 107 HB3 LEU 480 HB3 LEU 480 53.297 10.769 -1.311 108 HG LEU 480 HG LEU 480 52.930 11.375 -3.769 109 HD11 LEU 480 HD11 LEU 480 50.013 11.256 -3.006 110 HD12 LEU 480 HD12 LEU 480 50.812 10.010 -3.971 111 HD13 LEU 480 HD13 LEU 480 50.697 11.658 -4.578 112 HD21 LEU 480 HD21 LEU 480 51.530 13.454 -3.080 113 HD22 LEU 480 HD22 LEU 480 53.086 13.175 -2.299 114 HD23 LEU 480 HD23 LEU 480 51.591 12.761 -1.453 115 H LEU 481 H LEU 481 52.589 8.213 -0.110 116 HA LEU 481 HA LEU 481 55.372 7.907 0.567 117 HB2 LEU 481 HB2 LEU 481 54.436 7.121 2.726 118 HB3 LEU 481 HB3 LEU 481 53.754 8.661 2.197 119 HG LEU 481 HG LEU 481 52.000 6.863 1.002 120 HD11 LEU 481 HD11 LEU 481 53.034 4.949 2.148 121 HD12 LEU 481 HD12 LEU 481 51.388 5.219 2.713 122 HD13 LEU 481 HD13 LEU 481 52.753 5.727 3.706 123 HD21 LEU 481 HD21 LEU 481 51.710 7.964 3.807 124 HD22 LEU 481 HD22 LEU 481 50.416 7.508 2.717 125 HD23 LEU 481 HD23 LEU 481 51.432 8.901 2.340 126 H ALA 482 H ALA 482 53.098 5.944 -0.954 127 HA ALA 482 HA ALA 482 53.495 3.405 0.008 128 HB1 ALA 482 HB1 ALA 482 52.017 3.120 -1.684 129 HB2 ALA 482 HB2 ALA 482 53.391 3.063 -2.786 130 HB3 ALA 482 HB3 ALA 482 52.571 4.590 -2.484 131 HA PRO 483 HA PRO 483 57.229 2.651 -3.169 132 HB2 PRO 483 HB2 PRO 483 58.604 5.195 -3.297 133 HB3 PRO 483 HB3 PRO 483 57.824 4.315 -4.620 134 HG2 PRO 483 HG2 PRO 483 56.783 6.532 -2.967 135 HG3 PRO 483 HG3 PRO 483 56.391 6.098 -4.636 136 HD2 PRO 483 HD2 PRO 483 54.648 5.672 -2.652 137 HD3 PRO 483 HD3 PRO 483 54.811 4.496 -3.971 138 H TYR 484 H TYR 484 57.536 5.278 -0.785 139 HA TYR 484 HA TYR 484 60.064 4.440 0.234 140 HB2 TYR 484 HB2 TYR 484 59.724 6.674 0.706 141 HB3 TYR 484 HB3 TYR 484 57.998 6.461 1.006 142 HD1 TYR 484 HD1 TYR 484 61.385 5.895 2.478 143 HD2 TYR 484 HD2 TYR 484 57.156 6.082 3.233 144 HE1 TYR 484 HE1 TYR 484 61.813 5.783 4.917 145 HE2 TYR 484 HE2 TYR 484 57.591 5.968 5.666 146 HH TYR 484 HH TYR 484 59.613 6.606 7.203 147 H HIS 485 H HIS 485 56.724 3.824 1.120 148 HA HIS 485 HA HIS 485 57.106 2.579 3.607 149 HB2 HIS 485 HB2 HIS 485 54.923 3.330 2.588 150 HB3 HIS 485 HB3 HIS 485 54.987 1.898 1.564 151 HD1 HIS 485 HD1 HIS 485 54.735 -0.428 2.732 152 HD2 HIS 485 HD2 HIS 485 54.245 2.835 5.276 153 HE1 HIS 485 HE1 HIS 485 53.655 -1.321 4.840 154 H LYS 486 H LYS 486 57.228 1.280 0.331 155 HA LYS 486 HA LYS 486 57.643 -1.464 1.231 156 HB2 LYS 486 HB2 LYS 486 57.745 -1.927 -1.216 157 HB3 LYS 486 HB3 LYS 486 56.297 -1.017 -0.779 158 HG2 LYS 486 HG2 LYS 486 57.350 1.067 -1.450 159 HG3 LYS 486 HG3 LYS 486 58.857 0.238 -1.819 160 HD2 LYS 486 HD2 LYS 486 57.810 0.484 -3.918 161 HD3 LYS 486 HD3 LYS 486 57.474 -1.182 -3.457 162 HE2 LYS 486 HE2 LYS 486 55.234 -0.676 -2.850 163 HE3 LYS 486 HE3 LYS 486 55.542 1.058 -2.824 164 HZ1 LYS 486 HZ1 LYS 486 55.920 -0.485 -5.302 165 HZ2 LYS 486 HZ2 LYS 486 55.622 1.176 -5.110 166 HZ3 LYS 486 HZ3 LYS 486 54.374 0.050 -4.854 167 H ALA 487 H ALA 487 59.505 1.289 0.506 168 HA ALA 487 HA ALA 487 61.897 0.175 -0.506 169 HB1 ALA 487 HB1 ALA 487 61.285 2.580 -0.619 170 HB2 ALA 487 HB2 ALA 487 62.892 2.319 0.061 171 HB3 ALA 487 HB3 ALA 487 61.538 2.695 1.123 172 H LYS 488 H LYS 488 62.908 -1.400 0.556 173 HA LYS 488 HA LYS 488 63.148 -1.394 3.474 174 HB2 LYS 488 HB2 LYS 488 64.076 -3.356 1.377 175 HB3 LYS 488 HB3 LYS 488 64.233 -3.596 3.119 176 HG2 LYS 488 HG2 LYS 488 61.775 -3.322 3.347 177 HG3 LYS 488 HG3 LYS 488 61.646 -3.202 1.594 178 HD2 LYS 488 HD2 LYS 488 62.874 -5.578 3.019 179 HD3 LYS 488 HD3 LYS 488 61.182 -5.504 2.538 180 HE2 LYS 488 HE2 LYS 488 62.060 -4.986 0.167 181 HE3 LYS 488 HE3 LYS 488 63.625 -5.534 0.764 182 HZ1 LYS 488 HZ1 LYS 488 61.100 -7.090 0.739 183 HZ2 LYS 488 HZ2 LYS 488 62.547 -7.614 1.455 184 HZ3 LYS 488 HZ3 LYS 488 62.470 -7.367 -0.223 185 H THR 489 H THR 489 64.875 -0.115 0.909 186 HA THR 489 HA THR 489 67.515 -0.405 2.212 187 HB THR 489 HB THR 489 67.909 0.963 -0.187 188 HG1 THR 489 HG1 THR 489 66.593 -0.309 -1.636 189 HG21 THR 489 HG21 THR 489 69.300 -0.883 0.371 190 HG22 THR 489 HG22 THR 489 68.454 -1.373 -1.097 191 HG23 THR 489 HG23 THR 489 67.929 -1.991 0.471 192 H LEU 490 H LEU 490 68.442 1.232 3.242 193 HA LEU 490 HA LEU 490 67.047 3.546 3.975 194 HB2 LEU 490 HB2 LEU 490 69.942 2.721 4.082 195 HB3 LEU 490 HB3 LEU 490 69.448 4.324 4.627 196 HG LEU 490 HG LEU 490 67.822 3.273 6.168 197 HD11 LEU 490 HD11 LEU 490 68.214 0.761 6.579 198 HD12 LEU 490 HD12 LEU 490 68.980 0.751 4.991 199 HD13 LEU 490 HD13 LEU 490 67.284 1.209 5.151 200 HD21 LEU 490 HD21 LEU 490 70.163 3.816 6.890 201 HD22 LEU 490 HD22 LEU 490 70.619 2.154 6.512 202 HD23 LEU 490 HD23 LEU 490 69.453 2.479 7.794 203 H GLU 491 H GLU 491 69.599 3.078 1.569 204 HA GLU 491 HA GLU 491 69.930 5.720 0.712 205 HB2 GLU 491 HB2 GLU 491 71.454 3.943 0.055 206 HB3 GLU 491 HB3 GLU 491 70.163 3.113 -0.807 207 HG2 GLU 491 HG2 GLU 491 70.919 5.938 -1.531 208 HG3 GLU 491 HG3 GLU 491 71.828 4.571 -2.169 209 H ARG 492 H ARG 492 67.642 3.257 -0.226 210 HA ARG 492 HA ARG 492 66.433 4.676 -2.387 211 HB2 ARG 492 HB2 ARG 492 66.322 2.216 -2.172 212 HB3 ARG 492 HB3 ARG 492 65.387 2.392 -0.694 213 HG2 ARG 492 HG2 ARG 492 63.703 2.023 -2.270 214 HG3 ARG 492 HG3 ARG 492 63.728 3.779 -2.219 215 HD2 ARG 492 HD2 ARG 492 65.264 3.769 -4.190 216 HD3 ARG 492 HD3 ARG 492 65.105 2.014 -4.260 217 HE ARG 492 HE ARG 492 62.520 3.025 -4.254 218 HH11 ARG 492 HH11 ARG 492 64.314 5.026 -5.951 219 HH12 ARG 492 HH12 ARG 492 63.897 4.482 -7.540 220 HH21 ARG 492 HH21 ARG 492 62.433 1.538 -6.421 221 HH22 ARG 492 HH22 ARG 492 62.825 2.495 -7.809 222 H GLN 493 H GLN 493 65.640 4.229 1.026 223 HA GLN 493 HA GLN 493 63.141 5.459 1.039 224 HB2 GLN 493 HB2 GLN 493 65.288 5.262 3.149 225 HB3 GLN 493 HB3 GLN 493 63.705 5.974 3.472 226 HG2 GLN 493 HG2 GLN 493 62.589 3.914 2.881 227 HG3 GLN 493 HG3 GLN 493 64.095 3.198 2.332 228 HE21 GLN 493 HE21 GLN 493 63.087 1.598 4.143 229 HE22 GLN 493 HE22 GLN 493 63.718 1.836 5.700 230 H VAL 494 H VAL 494 66.356 6.874 1.479 231 HA VAL 494 HA VAL 494 65.527 9.533 1.935 232 HB VAL 494 HB VAL 494 68.054 8.417 0.700 233 HG11 VAL 494 HG11 VAL 494 67.470 11.196 1.771 234 HG12 VAL 494 HG12 VAL 494 67.829 10.784 0.094 235 HG13 VAL 494 HG13 VAL 494 69.069 10.599 1.331 236 HG21 VAL 494 HG21 VAL 494 68.900 9.013 3.052 237 HG22 VAL 494 HG22 VAL 494 67.844 7.609 2.918 238 HG23 VAL 494 HG23 VAL 494 67.202 9.142 3.506 239 H TYR 495 H TYR 495 66.429 7.823 -1.031 240 HA TYR 495 HA TYR 495 66.130 9.937 -2.854 241 HB2 TYR 495 HB2 TYR 495 67.244 7.922 -3.498 242 HB3 TYR 495 HB3 TYR 495 65.826 6.950 -3.125 243 HD1 TYR 495 HD1 TYR 495 67.147 9.565 -5.424 244 HD2 TYR 495 HD2 TYR 495 64.106 6.612 -4.728 245 HE1 TYR 495 HE1 TYR 495 66.378 9.804 -7.768 246 HE2 TYR 495 HE2 TYR 495 63.333 6.855 -7.072 247 HH TYR 495 HH TYR 495 64.788 9.262 -9.244 248 H GLU 496 H GLU 496 63.767 7.457 -1.850 249 HA GLU 496 HA GLU 496 61.657 8.366 -3.490 250 HB2 GLU 496 HB2 GLU 496 61.622 6.839 -0.891 251 HB3 GLU 496 HB3 GLU 496 60.205 7.083 -1.915 252 HG2 GLU 496 HG2 GLU 496 62.785 5.827 -2.873 253 HG3 GLU 496 HG3 GLU 496 61.394 4.896 -2.322 254 H LEU 497 H LEU 497 62.516 9.086 -0.151 255 HA LEU 497 HA LEU 497 60.330 10.778 0.397 256 HB2 LEU 497 HB2 LEU 497 63.102 10.564 1.538 257 HB3 LEU 497 HB3 LEU 497 61.899 11.673 2.200 258 HG LEU 497 HG LEU 497 61.442 8.701 1.835 259 HD11 LEU 497 HD11 LEU 497 62.079 10.110 4.426 260 HD12 LEU 497 HD12 LEU 497 63.298 9.277 3.461 261 HD13 LEU 497 HD13 LEU 497 61.946 8.377 4.147 262 HD21 LEU 497 HD21 LEU 497 59.303 9.542 2.041 263 HD22 LEU 497 HD22 LEU 497 59.824 10.975 2.922 264 HD23 LEU 497 HD23 LEU 497 59.699 9.426 3.753 265 H GLU 498 H GLU 498 63.521 11.418 -0.954 266 HA GLU 498 HA GLU 498 63.471 14.207 -0.933 267 HB2 GLU 498 HB2 GLU 498 64.737 12.155 -2.731 268 HB3 GLU 498 HB3 GLU 498 64.922 13.873 -3.086 269 HG2 GLU 498 HG2 GLU 498 65.516 12.751 -0.343 270 HG3 GLU 498 HG3 GLU 498 66.735 12.766 -1.615 271 H LYS 499 H LYS 499 62.334 11.983 -3.476 272 HA LYS 499 HA LYS 499 61.345 14.022 -5.210 273 HB2 LYS 499 HB2 LYS 499 61.114 11.049 -4.976 274 HB3 LYS 499 HB3 LYS 499 59.948 11.867 -6.015 275 HG2 LYS 499 HG2 LYS 499 61.920 11.157 -7.305 276 HG3 LYS 499 HG3 LYS 499 61.819 12.918 -7.254 277 HD2 LYS 499 HD2 LYS 499 63.468 13.006 -5.465 278 HD3 LYS 499 HD3 LYS 499 63.503 11.249 -5.382 279 HE2 LYS 499 HE2 LYS 499 64.356 11.130 -7.667 280 HE3 LYS 499 HE3 LYS 499 64.293 12.885 -7.797 281 HZ1 LYS 499 HZ1 LYS 499 65.750 11.816 -5.519 282 HZ2 LYS 499 HZ2 LYS 499 66.115 13.142 -6.514 283 HZ3 LYS 499 HZ3 LYS 499 66.466 11.563 -7.036 284 H LEU 500 H LEU 500 59.782 11.893 -2.883 285 HA LEU 500 HA LEU 500 57.136 12.750 -3.274 286 HB2 LEU 500 HB2 LEU 500 58.494 11.551 -0.872 287 HB3 LEU 500 HB3 LEU 500 56.748 11.680 -1.075 288 HG LEU 500 HG LEU 500 58.481 10.321 -3.142 289 HD11 LEU 500 HD11 LEU 500 58.735 9.260 -0.850 290 HD12 LEU 500 HD12 LEU 500 58.077 8.208 -2.094 291 HD13 LEU 500 HD13 LEU 500 57.003 8.928 -0.899 292 HD21 LEU 500 HD21 LEU 500 55.526 10.321 -2.494 293 HD22 LEU 500 HD22 LEU 500 56.277 9.129 -3.557 294 HD23 LEU 500 HD23 LEU 500 56.305 10.824 -3.990 295 H GLN 501 H GLN 501 59.659 13.922 -1.136 296 HA GLN 501 HA GLN 501 58.242 15.592 0.559 297 HB2 GLN 501 HB2 GLN 501 60.998 15.401 -0.468 298 HB3 GLN 501 HB3 GLN 501 60.561 17.038 -0.003 299 HG2 GLN 501 HG2 GLN 501 61.579 15.692 1.860 300 HG3 GLN 501 HG3 GLN 501 59.982 16.334 2.228 301 HE21 GLN 501 HE21 GLN 501 60.953 14.115 3.665 302 HE22 GLN 501 HE22 GLN 501 60.062 12.738 3.234 303 H GLU 502 H GLU 502 59.002 16.049 -2.810 304 HA GLU 502 HA GLU 502 58.229 18.849 -2.830 305 HB2 GLU 502 HB2 GLU 502 58.569 17.097 -5.257 306 HB3 GLU 502 HB3 GLU 502 58.890 18.826 -5.084 307 HG2 GLU 502 HG2 GLU 502 60.426 16.558 -3.813 308 HG3 GLU 502 HG3 GLU 502 60.991 17.613 -5.103 309 H LYS 503 H LYS 503 56.803 15.750 -3.387 310 HA LYS 503 HA LYS 503 54.459 16.926 -4.708 311 HB2 LYS 503 HB2 LYS 503 55.344 14.097 -4.194 312 HB3 LYS 503 HB3 LYS 503 53.865 14.535 -5.059 313 HG2 LYS 503 HG2 LYS 503 55.095 15.679 -6.759 314 HG3 LYS 503 HG3 LYS 503 56.594 15.576 -5.844 315 HD2 LYS 503 HD2 LYS 503 56.754 13.877 -7.489 316 HD3 LYS 503 HD3 LYS 503 56.347 13.035 -5.995 317 HE2 LYS 503 HE2 LYS 503 54.058 12.807 -6.641 318 HE3 LYS 503 HE3 LYS 503 54.252 13.928 -7.989 319 HZ1 LYS 503 HZ1 LYS 503 54.992 12.307 -9.286 320 HZ2 LYS 503 HZ2 LYS 503 54.533 11.200 -8.079 321 HZ3 LYS 503 HZ3 LYS 503 56.123 11.794 -8.132 322 H LEU 504 H LEU 504 55.419 15.548 -1.688 323 HA LEU 504 HA LEU 504 52.918 14.752 -0.706 324 HB2 LEU 504 HB2 LEU 504 55.561 15.348 0.483 325 HB3 LEU 504 HB3 LEU 504 54.185 15.209 1.574 326 HG LEU 504 HG LEU 504 54.615 13.077 -0.521 327 HD11 LEU 504 HD11 LEU 504 56.800 13.305 0.556 328 HD12 LEU 504 HD12 LEU 504 56.008 11.830 1.117 329 HD13 LEU 504 HD13 LEU 504 56.029 13.261 2.129 330 HD21 LEU 504 HD21 LEU 504 52.587 13.338 1.130 331 HD22 LEU 504 HD22 LEU 504 53.712 12.721 2.340 332 HD23 LEU 504 HD23 LEU 504 53.319 11.747 0.925 333 HA PRO 505 HA PRO 505 50.955 18.885 -0.447 334 HB2 PRO 505 HB2 PRO 505 49.327 17.779 1.702 335 HB3 PRO 505 HB3 PRO 505 48.836 18.166 0.046 336 HG2 PRO 505 HG2 PRO 505 49.787 15.573 1.157 337 HG3 PRO 505 HG3 PRO 505 48.623 15.879 -0.142 338 HD2 PRO 505 HD2 PRO 505 50.981 14.991 -0.752 339 HD3 PRO 505 HD3 PRO 505 50.358 16.365 -1.687 340 H GLU 506 H GLU 506 51.238 20.558 0.926 341 HA GLU 506 HA GLU 506 53.380 20.946 2.440 342 HB2 GLU 506 HB2 GLU 506 50.628 22.067 2.949 343 HB3 GLU 506 HB3 GLU 506 52.097 22.696 3.699 344 HG2 GLU 506 HG2 GLU 506 53.059 23.180 1.524 345 HG3 GLU 506 HG3 GLU 506 51.690 22.424 0.710 346 H LYS 507 H LYS 507 50.314 20.263 4.131 347 HA LYS 507 HA LYS 507 51.363 19.950 6.675 348 HB2 LYS 507 HB2 LYS 507 49.317 18.799 7.228 349 HB3 LYS 507 HB3 LYS 507 48.927 20.032 6.027 350 HG2 LYS 507 HG2 LYS 507 49.267 18.202 4.258 351 HG3 LYS 507 HG3 LYS 507 49.251 17.058 5.598 352 HD2 LYS 507 HD2 LYS 507 47.025 19.049 5.088 353 HD3 LYS 507 HD3 LYS 507 47.007 17.396 4.480 354 HE2 LYS 507 HE2 LYS 507 47.374 16.655 6.905 355 HE3 LYS 507 HE3 LYS 507 46.989 18.314 7.359 356 HZ1 LYS 507 HZ1 LYS 507 45.177 16.954 5.514 357 HZ2 LYS 507 HZ2 LYS 507 44.835 18.092 6.727 358 HZ3 LYS 507 HZ3 LYS 507 45.137 16.471 7.139 359 H TYR 508 H TYR 508 51.411 17.707 4.025 360 HA TYR 508 HA TYR 508 52.349 15.497 5.721 361 HB2 TYR 508 HB2 TYR 508 51.580 15.779 2.816 362 HB3 TYR 508 HB3 TYR 508 52.421 14.347 3.406 363 HD1 TYR 508 HD1 TYR 508 51.435 13.063 5.323 364 HD2 TYR 508 HD2 TYR 508 49.237 16.035 3.174 365 HE1 TYR 508 HE1 TYR 508 49.322 12.128 6.201 366 HE2 TYR 508 HE2 TYR 508 47.109 15.091 4.014 367 HH TYR 508 HH TYR 508 46.497 13.666 6.239 368 H LYS 509 H LYS 509 53.509 18.016 3.706 369 HA LYS 509 HA LYS 509 55.961 16.883 2.852 370 HB2 LYS 509 HB2 LYS 509 54.923 18.969 1.953 371 HB3 LYS 509 HB3 LYS 509 55.318 19.769 3.467 372 HG2 LYS 509 HG2 LYS 509 57.687 19.417 3.095 373 HG3 LYS 509 HG3 LYS 509 57.340 18.508 1.618 374 HD2 LYS 509 HD2 LYS 509 56.219 20.484 0.663 375 HD3 LYS 509 HD3 LYS 509 56.584 21.396 2.126 376 HE2 LYS 509 HE2 LYS 509 58.993 21.099 1.716 377 HE3 LYS 509 HE3 LYS 509 58.632 20.174 0.258 378 HZ1 LYS 509 HZ1 LYS 509 57.200 22.366 -0.187 379 HZ2 LYS 509 HZ2 LYS 509 58.808 22.188 -0.704 380 HZ3 LYS 509 HZ3 LYS 509 58.462 23.037 0.727 381 H ALA 510 H ALA 510 55.086 18.924 5.619 382 HA ALA 510 HA ALA 510 57.617 19.110 6.818 383 HB1 ALA 510 HB1 ALA 510 54.821 19.293 7.907 384 HB2 ALA 510 HB2 ALA 510 55.982 20.592 7.640 385 HB3 ALA 510 HB3 ALA 510 56.222 19.452 8.966 386 H GLU 511 H GLU 511 54.948 16.875 7.543 387 HA GLU 511 HA GLU 511 56.206 15.383 9.559 388 HB2 GLU 511 HB2 GLU 511 53.826 15.232 9.022 389 HB3 GLU 511 HB3 GLU 511 54.207 14.502 7.467 390 HG2 GLU 511 HG2 GLU 511 55.191 12.554 8.590 391 HG3 GLU 511 HG3 GLU 511 54.888 13.297 10.162 392 H TYR 512 H TYR 512 56.272 14.876 6.059 393 HA TYR 512 HA TYR 512 57.879 12.492 6.269 394 HB2 TYR 512 HB2 TYR 512 56.723 14.154 4.080 395 HB3 TYR 512 HB3 TYR 512 57.999 13.002 3.674 396 HD1 TYR 512 HD1 TYR 512 54.782 13.242 5.585 397 HD2 TYR 512 HD2 TYR 512 57.449 10.756 3.319 398 HE1 TYR 512 HE1 TYR 512 53.174 11.367 5.747 399 HE2 TYR 512 HE2 TYR 512 55.847 8.879 3.494 400 HH TYR 512 HH TYR 512 54.014 8.145 4.589 401 H LYS 513 H LYS 513 58.500 15.879 5.930 402 HA LYS 513 HA LYS 513 61.149 15.668 4.899 403 HB2 LYS 513 HB2 LYS 513 59.723 17.724 4.947 404 HB3 LYS 513 HB3 LYS 513 60.008 17.819 6.680 405 HG2 LYS 513 HG2 LYS 513 62.422 17.954 6.282 406 HG3 LYS 513 HG3 LYS 513 62.152 17.837 4.543 407 HD2 LYS 513 HD2 LYS 513 60.987 20.011 6.298 408 HD3 LYS 513 HD3 LYS 513 62.466 20.186 5.358 409 HE2 LYS 513 HE2 LYS 513 60.994 19.463 3.328 410 HE3 LYS 513 HE3 LYS 513 59.632 19.881 4.367 411 HZ1 LYS 513 HZ1 LYS 513 60.022 22.037 4.147 412 HZ2 LYS 513 HZ2 LYS 513 61.018 21.624 2.833 413 HZ3 LYS 513 HZ3 LYS 513 61.693 21.867 4.373 414 H LYS 514 H LYS 514 59.645 15.508 8.027 415 HA LYS 514 HA LYS 514 61.967 15.597 9.663 416 HB2 LYS 514 HB2 LYS 514 59.621 15.845 10.463 417 HB3 LYS 514 HB3 LYS 514 59.357 14.139 10.128 418 HG2 LYS 514 HG2 LYS 514 61.183 13.566 11.707 419 HG3 LYS 514 HG3 LYS 514 61.363 15.279 12.090 420 HD2 LYS 514 HD2 LYS 514 58.741 13.786 12.383 421 HD3 LYS 514 HD3 LYS 514 59.893 13.966 13.706 422 HE2 LYS 514 HE2 LYS 514 59.751 16.513 13.208 423 HE3 LYS 514 HE3 LYS 514 58.295 16.110 12.299 424 HZ1 LYS 514 HZ1 LYS 514 58.514 14.960 14.957 425 HZ2 LYS 514 HZ2 LYS 514 57.160 15.589 14.147 426 HZ3 LYS 514 HZ3 LYS 514 58.273 16.638 14.888 427 H LYS 515 H LYS 515 60.105 13.021 8.130 428 HA LYS 515 HA LYS 515 61.613 10.806 9.045 429 HB2 LYS 515 HB2 LYS 515 59.987 11.185 6.523 430 HB3 LYS 515 HB3 LYS 515 60.674 9.643 7.028 431 HG2 LYS 515 HG2 LYS 515 59.415 9.798 9.152 432 HG3 LYS 515 HG3 LYS 515 58.694 11.314 8.600 433 HD2 LYS 515 HD2 LYS 515 57.687 10.180 6.694 434 HD3 LYS 515 HD3 LYS 515 58.448 8.658 7.166 435 HE2 LYS 515 HE2 LYS 515 56.414 10.227 8.768 436 HE3 LYS 515 HE3 LYS 515 56.150 8.676 7.965 437 HZ1 LYS 515 HZ1 LYS 515 58.173 7.960 9.409 438 HZ2 LYS 515 HZ2 LYS 515 56.623 8.018 10.101 439 HZ3 LYS 515 HZ3 LYS 515 57.727 9.281 10.375 440 H LEU 516 H LEU 516 61.878 12.859 6.196 441 HA LEU 516 HA LEU 516 63.885 11.525 4.774 442 HB2 LEU 516 HB2 LEU 516 62.675 13.374 3.800 443 HB3 LEU 516 HB3 LEU 516 63.202 14.449 5.077 444 HG LEU 516 HG LEU 516 65.527 14.284 4.277 445 HD11 LEU 516 HD11 LEU 516 65.769 13.227 1.938 446 HD12 LEU 516 HD12 LEU 516 64.255 12.406 2.299 447 HD13 LEU 516 HD13 LEU 516 65.669 12.127 3.314 448 HD21 LEU 516 HD21 LEU 516 63.745 14.931 1.939 449 HD22 LEU 516 HD22 LEU 516 65.252 15.713 2.410 450 HD23 LEU 516 HD23 LEU 516 63.790 15.961 3.375 451 H ASP 517 H ASP 517 64.144 14.121 7.165 452 HA ASP 517 HA ASP 517 66.921 14.357 7.272 453 HB2 ASP 517 HB2 ASP 517 65.410 15.957 8.311 454 HB3 ASP 517 HB3 ASP 517 64.840 14.726 9.432 455 H GLN 518 H GLN 518 64.747 12.380 9.262 456 HA GLN 518 HA GLN 518 66.804 11.152 10.805 457 HB2 GLN 518 HB2 GLN 518 63.897 10.715 10.343 458 HB3 GLN 518 HB3 GLN 518 64.800 9.344 10.983 459 HG2 GLN 518 HG2 GLN 518 63.827 10.803 12.770 460 HG3 GLN 518 HG3 GLN 518 65.582 10.662 12.860 461 HE21 GLN 518 HE21 GLN 518 65.655 12.784 13.990 462 HE22 GLN 518 HE22 GLN 518 65.452 14.220 13.109 463 H THR 519 H THR 519 65.237 10.238 7.794 464 HA THR 519 HA THR 519 66.293 7.625 7.579 465 HB THR 519 HB THR 519 65.585 9.535 5.337 466 HG1 THR 519 HG1 THR 519 63.950 7.731 6.778 467 HG21 THR 519 HG21 THR 519 66.743 7.207 4.933 468 HG22 THR 519 HG22 THR 519 65.347 7.668 3.962 469 HG23 THR 519 HG23 THR 519 65.148 6.566 5.324 470 H ARG 520 H ARG 520 67.435 10.766 6.470 471 HA ARG 520 HA ARG 520 69.710 9.902 5.052 472 HB2 ARG 520 HB2 ARG 520 68.992 12.476 6.433 473 HB3 ARG 520 HB3 ARG 520 70.516 12.276 5.566 474 HG2 ARG 520 HG2 ARG 520 69.307 11.718 3.521 475 HG3 ARG 520 HG3 ARG 520 67.766 11.828 4.373 476 HD2 ARG 520 HD2 ARG 520 69.743 14.103 4.156 477 HD3 ARG 520 HD3 ARG 520 68.355 13.901 3.092 478 HE ARG 520 HE ARG 520 67.270 13.818 5.595 479 HH11 ARG 520 HH11 ARG 520 69.888 15.677 5.760 480 HH12 ARG 520 HH12 ARG 520 69.107 17.223 5.776 481 HH21 ARG 520 HH21 ARG 520 66.019 15.961 4.816 482 HH22 ARG 520 HH22 ARG 520 66.912 17.384 5.240 483 H VAL 521 H VAL 521 69.172 10.611 8.441 484 HA VAL 521 HA VAL 521 71.854 10.644 9.322 485 HB VAL 521 HB VAL 521 69.275 9.887 10.697 486 HG11 VAL 521 HG11 VAL 521 70.942 8.839 12.014 487 HG12 VAL 521 HG12 VAL 521 70.623 10.378 12.813 488 HG13 VAL 521 HG13 VAL 521 72.061 10.187 11.811 489 HG21 VAL 521 HG21 VAL 521 69.842 12.292 9.771 490 HG22 VAL 521 HG22 VAL 521 70.873 12.381 11.197 491 HG23 VAL 521 HG23 VAL 521 69.138 12.110 11.377 492 H GLU 522 H GLU 522 69.481 8.021 9.109 493 HA GLU 522 HA GLU 522 71.114 5.963 10.165 494 HB2 GLU 522 HB2 GLU 522 68.833 5.815 8.181 495 HB3 GLU 522 HB3 GLU 522 69.498 4.445 9.076 496 HG2 GLU 522 HG2 GLU 522 68.929 5.546 11.195 497 HG3 GLU 522 HG3 GLU 522 68.280 6.925 10.310 498 H LEU 523 H LEU 523 70.509 7.104 6.893 499 HA LEU 523 HA LEU 523 72.008 5.183 5.476 500 HB2 LEU 523 HB2 LEU 523 70.363 6.655 4.410 501 HB3 LEU 523 HB3 LEU 523 71.352 8.058 4.796 502 HG LEU 523 HG LEU 523 73.170 7.172 3.365 503 HD11 LEU 523 HD11 LEU 523 73.002 4.842 3.360 504 HD12 LEU 523 HD12 LEU 523 72.317 5.236 1.786 505 HD13 LEU 523 HD13 LEU 523 71.252 4.859 3.137 506 HD21 LEU 523 HD21 LEU 523 71.662 8.689 2.304 507 HD22 LEU 523 HD22 LEU 523 70.406 7.457 2.169 508 HD23 LEU 523 HD23 LEU 523 71.858 7.347 1.177 509 H ALA 524 H ALA 524 72.877 8.368 6.750 510 HA ALA 524 HA ALA 524 75.448 8.538 5.639 511 HB1 ALA 524 HB1 ALA 524 74.670 9.677 8.317 512 HB2 ALA 524 HB2 ALA 524 74.098 10.369 6.798 513 HB3 ALA 524 HB3 ALA 524 75.826 10.325 7.157 514 H ASP 525 H ASP 525 74.306 7.138 8.650 515 HA ASP 525 HA ASP 525 76.861 6.541 9.756 516 HB2 ASP 525 HB2 ASP 525 74.025 5.668 10.223 517 HB3 ASP 525 HB3 ASP 525 75.326 4.775 11.011 518 H GLN 526 H GLN 526 74.570 4.745 7.765 519 HA GLN 526 HA GLN 526 75.971 2.271 7.722 520 HB2 GLN 526 HB2 GLN 526 73.593 2.452 7.162 521 HB3 GLN 526 HB3 GLN 526 73.985 3.467 5.779 522 HG2 GLN 526 HG2 GLN 526 75.112 1.655 4.668 523 HG3 GLN 526 HG3 GLN 526 75.015 0.642 6.111 524 HE21 GLN 526 HE21 GLN 526 73.541 1.058 3.156 525 HE22 GLN 526 HE22 GLN 526 71.985 0.496 3.541 526 H VAL 527 H VAL 527 76.019 5.141 5.730 527 HA VAL 527 HA VAL 527 77.704 4.147 3.652 528 HB VAL 527 HB VAL 527 76.884 6.907 4.555 529 HG11 VAL 527 HG11 VAL 527 79.020 7.294 3.568 530 HG12 VAL 527 HG12 VAL 527 77.854 7.608 2.282 531 HG13 VAL 527 HG13 VAL 527 78.744 6.086 2.314 532 HG21 VAL 527 HG21 VAL 527 75.404 6.836 2.720 533 HG22 VAL 527 HG22 VAL 527 75.309 5.210 3.392 534 HG23 VAL 527 HG23 VAL 527 76.278 5.511 1.951 535 H LYS 528 H LYS 528 78.243 5.982 6.599 536 HA LYS 528 HA LYS 528 80.989 6.548 6.238 537 HB2 LYS 528 HB2 LYS 528 79.545 7.713 7.841 538 HB3 LYS 528 HB3 LYS 528 79.359 6.214 8.749 539 HG2 LYS 528 HG2 LYS 528 81.728 6.169 9.281 540 HG3 LYS 528 HG3 LYS 528 82.018 7.570 8.245 541 HD2 LYS 528 HD2 LYS 528 81.884 8.348 10.539 542 HD3 LYS 528 HD3 LYS 528 80.438 8.883 9.684 543 HE2 LYS 528 HE2 LYS 528 79.061 7.317 10.752 544 HE3 LYS 528 HE3 LYS 528 80.412 6.273 11.192 545 HZ1 LYS 528 HZ1 LYS 528 81.179 8.200 12.614 546 HZ2 LYS 528 HZ2 LYS 528 79.798 7.369 13.151 547 HZ3 LYS 528 HZ3 LYS 528 79.641 8.873 12.375 548 H SER 529 H SER 529 79.313 3.932 7.948 549 HA SER 529 HA SER 529 81.739 2.712 8.859 550 HB2 SER 529 HB2 SER 529 79.550 2.428 10.016 551 HB3 SER 529 HB3 SER 529 78.959 1.534 8.619 552 HG SER 529 HG SER 529 79.805 -0.121 9.594 553 H ALA 530 H ALA 530 79.989 2.705 5.943 554 HA ALA 530 HA ALA 530 80.792 0.110 4.977 555 HB1 ALA 530 HB1 ALA 530 78.763 0.972 4.077 556 HB2 ALA 530 HB2 ALA 530 79.943 1.079 2.769 557 HB3 ALA 530 HB3 ALA 530 79.518 2.519 3.691 558 H VAL 531 H VAL 531 82.643 2.513 5.747 559 HA VAL 531 HA VAL 531 84.151 3.184 3.446 560 HB VAL 531 HB VAL 531 84.585 3.289 6.421 561 HG11 VAL 531 HG11 VAL 531 86.633 3.977 4.290 562 HG12 VAL 531 HG12 VAL 531 86.828 2.856 5.640 563 HG13 VAL 531 HG13 VAL 531 86.705 4.586 5.942 564 HG21 VAL 531 HG21 VAL 531 84.680 5.541 4.416 565 HG22 VAL 531 HG22 VAL 531 84.299 5.611 6.137 566 HG23 VAL 531 HG23 VAL 531 83.140 4.911 5.008 567 H THR 532 H THR 532 83.710 0.231 4.790 568 HA THR 532 HA THR 532 86.456 -0.736 4.451 569 HB THR 532 HB THR 532 85.395 -1.620 6.369 570 HG1 THR 532 HG1 THR 532 86.496 -3.161 5.185 571 HG21 THR 532 HG21 THR 532 82.976 -1.486 4.743 572 HG22 THR 532 HG22 THR 532 83.123 -1.675 6.488 573 HG23 THR 532 HG23 THR 532 83.159 -3.093 5.444 574 H GLU 533 H GLU 533 83.600 -2.602 3.559 575 HA GLU 533 HA GLU 533 84.724 -2.974 0.858 576 HB2 GLU 533 HB2 GLU 533 82.759 -4.621 2.453 577 HB3 GLU 533 HB3 GLU 533 83.211 -4.956 0.778 578 HG2 GLU 533 HG2 GLU 533 85.526 -5.241 1.393 579 HG3 GLU 533 HG3 GLU 533 85.197 -4.730 3.048 580 H PHE 534 H PHE 534 83.835 -1.925 -0.745 581 HA PHE 534 HA PHE 534 81.182 -0.711 -0.459 582 HB2 PHE 534 HB2 PHE 534 83.218 -0.448 -2.679 583 HB3 PHE 534 HB3 PHE 534 81.784 0.553 -2.443 584 HD1 PHE 534 HD1 PHE 534 81.592 1.967 -0.366 585 HD2 PHE 534 HD2 PHE 534 85.231 -0.022 -1.480 586 HE1 PHE 534 HE1 PHE 534 82.864 3.436 1.174 587 HE2 PHE 534 HE2 PHE 534 86.506 1.446 0.060 588 HZ PHE 534 HZ PHE 534 85.321 3.172 1.390 589 H GLU 535 H GLU 535 79.590 -2.148 -0.888 590 HA GLU 535 HA GLU 535 78.383 -3.788 -2.018 591 HB2 GLU 535 HB2 GLU 535 79.315 -1.898 -4.189 592 HB3 GLU 535 HB3 GLU 535 78.042 -3.094 -4.418 593 HG2 GLU 535 HG2 GLU 535 76.698 -2.084 -2.673 594 HG3 GLU 535 HG3 GLU 535 77.996 -0.961 -2.272 595 H ASN 536 H ASN 536 78.790 -4.622 -4.758 596 HA ASN 536 HA ASN 536 80.722 -6.709 -4.345 597 HB2 ASN 536 HB2 ASN 536 78.475 -6.892 -5.579 598 HB3 ASN 536 HB3 ASN 536 79.278 -6.076 -6.917 599 HD21 ASN 536 HD21 ASN 536 81.532 -7.193 -7.496 600 HD22 ASN 536 HD22 ASN 536 81.497 -8.890 -7.539 601 H VAL 537 H VAL 537 82.814 -6.047 -4.429 602 HA VAL 537 HA VAL 537 83.730 -4.079 -6.359 603 HB VAL 537 HB VAL 537 85.484 -5.790 -4.604 604 HG11 VAL 537 HG11 VAL 537 85.759 -2.876 -5.357 605 HG12 VAL 537 HG12 VAL 537 86.384 -4.165 -6.381 606 HG13 VAL 537 HG13 VAL 537 87.001 -3.965 -4.745 607 HG21 VAL 537 HG21 VAL 537 85.178 -3.950 -2.890 608 HG22 VAL 537 HG22 VAL 537 83.758 -4.970 -3.127 609 HG23 VAL 537 HG23 VAL 537 83.824 -3.366 -3.856 610 H THR 538 H THR 538 85.367 -4.476 -7.931 611 HA THR 538 HA THR 538 85.960 -5.601 -9.870 612 HB THR 538 HB THR 538 87.343 -7.682 -9.269 613 HG1 THR 538 HG1 THR 538 86.080 -7.954 -7.277 614 HG21 THR 538 HG21 THR 538 89.024 -6.226 -8.001 615 HG22 THR 538 HG22 THR 538 87.808 -4.950 -8.067 616 HG23 THR 538 HG23 THR 538 88.476 -5.609 -9.560 617 HA PRO 539 HA PRO 539 82.534 -8.702 -9.805 618 HB2 PRO 539 HB2 PRO 539 81.033 -7.079 -11.716 619 HB3 PRO 539 HB3 PRO 539 80.589 -7.524 -10.056 620 HG2 PRO 539 HG2 PRO 539 81.218 -4.975 -10.819 621 HG3 PRO 539 HG3 PRO 539 81.446 -5.595 -9.174 622 HD2 PRO 539 HD2 PRO 539 83.487 -5.304 -11.372 623 HD3 PRO 539 HD3 PRO 539 83.630 -4.901 -9.644 624 H THR 540 H THR 540 82.051 -10.208 -11.417 625 HA THR 540 HA THR 540 83.944 -10.330 -13.604 626 HB THR 540 HB THR 540 82.772 -12.540 -14.008 627 HG1 THR 540 HG1 THR 540 80.888 -11.474 -12.704 628 HG21 THR 540 HG21 THR 540 83.567 -13.482 -11.767 629 HG22 THR 540 HG22 THR 540 83.938 -11.818 -11.312 630 HG23 THR 540 HG23 THR 540 84.757 -12.566 -12.686 631 H ASN 541 H ASN 541 83.195 -10.835 -15.822 632 HA ASN 541 HA ASN 541 81.089 -8.972 -16.580 633 HB2 ASN 541 HB2 ASN 541 82.998 -10.622 -18.243 634 HB3 ASN 541 HB3 ASN 541 81.845 -9.452 -18.890 635 HD21 ASN 541 HD21 ASN 541 82.128 -7.500 -16.736 636 HD22 ASN 541 HD22 ASN 541 83.672 -6.814 -16.883 637 H ASP 542 H ASP 542 79.175 -9.424 -17.287 638 HA ASP 542 HA ASP 542 78.012 -11.984 -16.881 639 HB2 ASP 542 HB2 ASP 542 77.003 -9.449 -18.172 640 HB3 ASP 542 HB3 ASP 542 75.999 -10.878 -17.922 641 H GLN 543 H GLN 543 77.262 -13.494 -18.316 642 HA GLN 543 HA GLN 543 78.662 -13.646 -20.847 643 HB2 GLN 543 HB2 GLN 543 76.860 -15.499 -19.298 644 HB3 GLN 543 HB3 GLN 543 77.250 -15.843 -20.985 645 HG2 GLN 543 HG2 GLN 543 78.835 -16.955 -19.438 646 HG3 GLN 543 HG3 GLN 543 79.645 -15.777 -20.471 647 HE21 GLN 543 HE21 GLN 543 81.311 -15.028 -19.090 648 HE22 GLN 543 HE22 GLN 543 81.024 -14.335 -17.566 Start of MODEL 13 1 H1 SER 466 H1 SER 466 36.666 3.923 7.081 2 H2 SER 466 H2 SER 466 35.590 4.424 5.866 3 H3 SER 466 H3 SER 466 36.862 5.441 6.349 4 HA SER 466 HA SER 466 37.335 4.365 4.221 5 HB2 SER 466 HB2 SER 466 39.098 3.205 6.384 6 HB3 SER 466 HB3 SER 466 39.563 3.711 4.763 7 HG SER 466 HG SER 466 40.105 5.271 6.344 8 H ASP 467 H ASP 467 35.143 2.906 4.776 9 HA ASP 467 HA ASP 467 35.725 0.146 5.326 10 HB2 ASP 467 HB2 ASP 467 33.279 1.540 4.220 11 HB3 ASP 467 HB3 ASP 467 33.355 -0.195 4.525 12 H ASP 468 H ASP 468 33.971 1.224 2.464 13 HA ASP 468 HA ASP 468 35.320 -0.760 0.832 14 HB2 ASP 468 HB2 ASP 468 33.135 1.239 0.237 15 HB3 ASP 468 HB3 ASP 468 33.792 0.121 -0.955 16 H TYR 469 H TYR 469 34.435 2.412 -0.260 17 HA TYR 469 HA TYR 469 36.902 2.738 -1.716 18 HB2 TYR 469 HB2 TYR 469 34.590 3.389 -2.468 19 HB3 TYR 469 HB3 TYR 469 34.667 4.706 -1.305 20 HD1 TYR 469 HD1 TYR 469 36.266 3.277 -4.340 21 HD2 TYR 469 HD2 TYR 469 35.930 6.679 -1.744 22 HE1 TYR 469 HE1 TYR 469 37.510 4.654 -5.985 23 HE2 TYR 469 HE2 TYR 469 37.169 8.058 -3.386 24 HH TYR 469 HH TYR 469 37.491 7.831 -6.104 25 H VAL 470 H VAL 470 38.456 4.328 -1.394 26 HA VAL 470 HA VAL 470 38.523 5.507 1.321 27 HB VAL 470 HB VAL 470 40.957 5.183 -0.421 28 HG11 VAL 470 HG11 VAL 470 40.483 5.189 2.572 29 HG12 VAL 470 HG12 VAL 470 41.120 6.533 1.625 30 HG13 VAL 470 HG13 VAL 470 42.054 5.046 1.784 31 HG21 VAL 470 HG21 VAL 470 41.294 2.981 0.789 32 HG22 VAL 470 HG22 VAL 470 40.008 2.964 -0.416 33 HG23 VAL 470 HG23 VAL 470 39.607 3.081 1.297 34 H ASP 471 H ASP 471 38.796 7.676 1.596 35 HA ASP 471 HA ASP 471 38.020 9.517 -0.283 36 HB2 ASP 471 HB2 ASP 471 39.947 9.839 2.022 37 HB3 ASP 471 HB3 ASP 471 39.365 11.199 1.062 38 H GLU 472 H GLU 472 39.018 10.847 -1.749 39 HA GLU 472 HA GLU 472 41.070 9.778 -3.334 40 HB2 GLU 472 HB2 GLU 472 39.954 12.587 -3.169 41 HB3 GLU 472 HB3 GLU 472 41.058 12.038 -4.429 42 HG2 GLU 472 HG2 GLU 472 39.476 10.343 -5.149 43 HG3 GLU 472 HG3 GLU 472 38.398 10.736 -3.809 44 H GLU 473 H GLU 473 41.199 12.356 -0.874 45 HA GLU 473 HA GLU 473 43.903 13.082 -1.347 46 HB2 GLU 473 HB2 GLU 473 43.765 14.251 0.755 47 HB3 GLU 473 HB3 GLU 473 42.223 14.437 -0.074 48 HG2 GLU 473 HG2 GLU 473 41.437 12.397 1.262 49 HG3 GLU 473 HG3 GLU 473 42.886 12.626 2.248 50 H THR 474 H THR 474 42.368 10.875 0.887 51 HA THR 474 HA THR 474 44.686 9.991 2.270 52 HB THR 474 HB THR 474 42.014 8.689 1.708 53 HG1 THR 474 HG1 THR 474 41.916 10.546 2.977 54 HG21 THR 474 HG21 THR 474 42.650 7.290 3.754 55 HG22 THR 474 HG22 THR 474 44.311 7.802 3.444 56 HG23 THR 474 HG23 THR 474 43.424 6.882 2.221 57 H TYR 475 H TYR 475 42.894 8.708 -0.487 58 HA TYR 475 HA TYR 475 44.464 6.411 -0.848 59 HB2 TYR 475 HB2 TYR 475 42.183 6.855 -1.796 60 HB3 TYR 475 HB3 TYR 475 42.940 7.930 -2.973 61 HD1 TYR 475 HD1 TYR 475 43.245 4.502 -1.561 62 HD2 TYR 475 HD2 TYR 475 43.711 7.030 -4.994 63 HE1 TYR 475 HE1 TYR 475 43.831 2.514 -2.940 64 HE2 TYR 475 HE2 TYR 475 44.306 5.055 -6.379 65 HH TYR 475 HH TYR 475 45.303 2.705 -5.892 66 H ASN 476 H ASN 476 44.691 9.639 -2.345 67 HA ASN 476 HA ASN 476 46.842 8.960 -4.074 68 HB2 ASN 476 HB2 ASN 476 46.162 11.685 -2.942 69 HB3 ASN 476 HB3 ASN 476 47.122 11.339 -4.382 70 HD21 ASN 476 HD21 ASN 476 45.012 8.976 -4.751 71 HD22 ASN 476 HD22 ASN 476 43.735 9.765 -5.544 72 H LEU 477 H LEU 477 46.630 10.135 -0.780 73 HA LEU 477 HA LEU 477 49.336 10.779 -0.354 74 HB2 LEU 477 HB2 LEU 477 47.599 11.405 1.232 75 HB3 LEU 477 HB3 LEU 477 47.206 9.717 1.529 76 HG LEU 477 HG LEU 477 49.449 9.362 2.471 77 HD11 LEU 477 HD11 LEU 477 50.871 10.908 1.393 78 HD12 LEU 477 HD12 LEU 477 50.715 11.584 3.012 79 HD13 LEU 477 HD13 LEU 477 49.773 12.257 1.680 80 HD21 LEU 477 HD21 LEU 477 49.139 10.944 4.462 81 HD22 LEU 477 HD22 LEU 477 47.780 9.892 4.064 82 HD23 LEU 477 HD23 LEU 477 47.752 11.590 3.588 83 H GLN 478 H GLN 478 47.511 7.760 0.038 84 HA GLN 478 HA GLN 478 49.659 6.124 0.926 85 HB2 GLN 478 HB2 GLN 478 47.086 5.465 -0.548 86 HB3 GLN 478 HB3 GLN 478 48.187 4.246 0.089 87 HG2 GLN 478 HG2 GLN 478 46.919 6.421 1.765 88 HG3 GLN 478 HG3 GLN 478 46.271 4.790 1.621 89 HE21 GLN 478 HE21 GLN 478 47.866 6.530 3.787 90 HE22 GLN 478 HE22 GLN 478 48.943 5.378 4.419 91 H LYS 479 H LYS 479 48.389 7.017 -2.197 92 HA LYS 479 HA LYS 479 49.876 5.256 -3.824 93 HB2 LYS 479 HB2 LYS 479 47.824 6.709 -4.366 94 HB3 LYS 479 HB3 LYS 479 48.963 8.022 -4.637 95 HG2 LYS 479 HG2 LYS 479 50.121 6.709 -6.341 96 HG3 LYS 479 HG3 LYS 479 49.073 5.327 -6.033 97 HD2 LYS 479 HD2 LYS 479 48.015 8.032 -6.908 98 HD3 LYS 479 HD3 LYS 479 48.435 6.757 -8.051 99 HE2 LYS 479 HE2 LYS 479 46.844 5.254 -6.664 100 HE3 LYS 479 HE3 LYS 479 46.249 6.759 -5.966 101 HZ1 LYS 479 HZ1 LYS 479 45.493 7.511 -8.000 102 HZ2 LYS 479 HZ2 LYS 479 45.087 5.862 -8.028 103 HZ3 LYS 479 HZ3 LYS 479 46.444 6.420 -8.885 104 H LEU 480 H LEU 480 50.469 8.502 -2.650 105 HA LEU 480 HA LEU 480 52.805 9.059 -4.118 106 HB2 LEU 480 HB2 LEU 480 51.544 10.082 -1.592 107 HB3 LEU 480 HB3 LEU 480 53.151 10.644 -2.028 108 HG LEU 480 HG LEU 480 51.068 10.693 -4.183 109 HD11 LEU 480 HD11 LEU 480 51.069 12.501 -1.766 110 HD12 LEU 480 HD12 LEU 480 49.710 11.668 -2.511 111 HD13 LEU 480 HD13 LEU 480 50.446 13.051 -3.320 112 HD21 LEU 480 HD21 LEU 480 52.287 12.705 -4.845 113 HD22 LEU 480 HD22 LEU 480 53.438 11.402 -4.548 114 HD23 LEU 480 HD23 LEU 480 53.214 12.670 -3.344 115 H LEU 481 H LEU 481 52.515 8.108 -0.685 116 HA LEU 481 HA LEU 481 55.344 7.578 -0.476 117 HB2 LEU 481 HB2 LEU 481 54.804 6.961 1.827 118 HB3 LEU 481 HB3 LEU 481 54.053 8.490 1.384 119 HG LEU 481 HG LEU 481 52.097 6.635 0.630 120 HD11 LEU 481 HD11 LEU 481 53.387 4.835 1.752 121 HD12 LEU 481 HD12 LEU 481 51.816 5.102 2.507 122 HD13 LEU 481 HD13 LEU 481 53.279 5.728 3.269 123 HD21 LEU 481 HD21 LEU 481 51.848 8.808 1.946 124 HD22 LEU 481 HD22 LEU 481 52.238 7.871 3.386 125 HD23 LEU 481 HD23 LEU 481 50.803 7.482 2.455 126 H ALA 482 H ALA 482 52.931 5.798 -1.837 127 HA ALA 482 HA ALA 482 53.014 3.271 -0.817 128 HB1 ALA 482 HB1 ALA 482 51.858 2.698 -2.696 129 HB2 ALA 482 HB2 ALA 482 53.114 3.295 -3.777 130 HB3 ALA 482 HB3 ALA 482 51.950 4.418 -3.075 131 HA PRO 483 HA PRO 483 56.894 2.074 -3.267 132 HB2 PRO 483 HB2 PRO 483 58.397 4.410 -4.119 133 HB3 PRO 483 HB3 PRO 483 57.610 3.184 -5.125 134 HG2 PRO 483 HG2 PRO 483 56.781 5.816 -4.921 135 HG3 PRO 483 HG3 PRO 483 55.761 4.471 -5.462 136 HD2 PRO 483 HD2 PRO 483 55.853 5.812 -2.778 137 HD3 PRO 483 HD3 PRO 483 54.459 5.145 -3.656 138 H TYR 484 H TYR 484 57.223 5.033 -1.357 139 HA TYR 484 HA TYR 484 59.812 4.509 -0.322 140 HB2 TYR 484 HB2 TYR 484 59.138 6.696 0.069 141 HB3 TYR 484 HB3 TYR 484 57.494 6.228 0.500 142 HD1 TYR 484 HD1 TYR 484 61.028 6.258 1.719 143 HD2 TYR 484 HD2 TYR 484 56.888 5.781 2.759 144 HE1 TYR 484 HE1 TYR 484 61.612 6.306 4.131 145 HE2 TYR 484 HE2 TYR 484 57.479 5.829 5.157 146 HH TYR 484 HH TYR 484 60.720 5.590 6.254 147 H HIS 485 H HIS 485 56.566 3.625 0.718 148 HA HIS 485 HA HIS 485 57.265 2.340 3.134 149 HB2 HIS 485 HB2 HIS 485 54.945 3.023 2.432 150 HB3 HIS 485 HB3 HIS 485 54.943 1.657 1.316 151 HD1 HIS 485 HD1 HIS 485 54.373 -0.602 2.266 152 HD2 HIS 485 HD2 HIS 485 55.205 2.190 5.247 153 HE1 HIS 485 HE1 HIS 485 53.809 -1.717 4.468 154 H LYS 486 H LYS 486 57.166 1.250 -0.224 155 HA LYS 486 HA LYS 486 57.699 -1.519 0.509 156 HB2 LYS 486 HB2 LYS 486 57.672 -0.111 -2.166 157 HB3 LYS 486 HB3 LYS 486 57.917 -1.844 -1.957 158 HG2 LYS 486 HG2 LYS 486 55.712 -1.977 -0.790 159 HG3 LYS 486 HG3 LYS 486 55.459 -0.269 -1.136 160 HD2 LYS 486 HD2 LYS 486 55.992 -2.332 -3.290 161 HD3 LYS 486 HD3 LYS 486 54.370 -1.875 -2.779 162 HE2 LYS 486 HE2 LYS 486 55.059 0.546 -3.291 163 HE3 LYS 486 HE3 LYS 486 56.460 -0.142 -4.110 164 HZ1 LYS 486 HZ1 LYS 486 54.080 0.265 -5.268 165 HZ2 LYS 486 HZ2 LYS 486 53.942 -1.365 -4.810 166 HZ3 LYS 486 HZ3 LYS 486 55.226 -0.864 -5.805 167 H ALA 487 H ALA 487 59.554 1.269 0.223 168 HA ALA 487 HA ALA 487 61.934 0.263 -0.932 169 HB1 ALA 487 HB1 ALA 487 61.269 2.703 -0.584 170 HB2 ALA 487 HB2 ALA 487 62.943 2.280 -0.228 171 HB3 ALA 487 HB3 ALA 487 61.788 2.490 1.088 172 H LYS 488 H LYS 488 63.039 -1.362 -0.127 173 HA LYS 488 HA LYS 488 63.125 -1.861 2.771 174 HB2 LYS 488 HB2 LYS 488 64.146 -3.486 0.431 175 HB3 LYS 488 HB3 LYS 488 64.282 -3.967 2.119 176 HG2 LYS 488 HG2 LYS 488 61.828 -3.888 2.349 177 HG3 LYS 488 HG3 LYS 488 61.684 -3.425 0.655 178 HD2 LYS 488 HD2 LYS 488 63.049 -5.976 1.562 179 HD3 LYS 488 HD3 LYS 488 61.339 -5.902 1.139 180 HE2 LYS 488 HE2 LYS 488 62.126 -4.876 -1.101 181 HE3 LYS 488 HE3 LYS 488 63.732 -5.450 -0.651 182 HZ1 LYS 488 HZ1 LYS 488 61.406 -6.947 -1.487 183 HZ2 LYS 488 HZ2 LYS 488 62.246 -7.613 -0.169 184 HZ3 LYS 488 HZ3 LYS 488 63.053 -7.322 -1.635 185 H THR 489 H THR 489 64.931 -0.240 0.431 186 HA THR 489 HA THR 489 67.473 -0.566 1.920 187 HB THR 489 HB THR 489 68.609 0.088 -0.078 188 HG1 THR 489 HG1 THR 489 66.308 0.437 -1.565 189 HG21 THR 489 HG21 THR 489 67.880 -1.603 -1.657 190 HG22 THR 489 HG22 THR 489 66.267 -1.629 -0.942 191 HG23 THR 489 HG23 THR 489 67.647 -2.232 -0.024 192 H LEU 490 H LEU 490 68.353 1.115 2.963 193 HA LEU 490 HA LEU 490 66.855 3.390 3.616 194 HB2 LEU 490 HB2 LEU 490 69.762 2.646 3.904 195 HB3 LEU 490 HB3 LEU 490 69.180 4.226 4.420 196 HG LEU 490 HG LEU 490 67.502 3.126 5.861 197 HD11 LEU 490 HD11 LEU 490 67.075 1.053 4.800 198 HD12 LEU 490 HD12 LEU 490 67.933 0.620 6.277 199 HD13 LEU 490 HD13 LEU 490 68.789 0.641 4.735 200 HD21 LEU 490 HD21 LEU 490 69.028 2.508 7.588 201 HD22 LEU 490 HD22 LEU 490 69.898 3.683 6.601 202 HD23 LEU 490 HD23 LEU 490 70.234 1.960 6.424 203 H GLU 491 H GLU 491 69.506 2.973 1.288 204 HA GLU 491 HA GLU 491 69.870 5.612 0.488 205 HB2 GLU 491 HB2 GLU 491 70.775 4.700 -1.575 206 HB3 GLU 491 HB3 GLU 491 71.277 3.685 -0.219 207 HG2 GLU 491 HG2 GLU 491 69.205 2.268 -0.709 208 HG3 GLU 491 HG3 GLU 491 69.087 3.156 -2.226 209 H ARG 492 H ARG 492 67.506 3.242 -0.538 210 HA ARG 492 HA ARG 492 66.335 4.830 -2.603 211 HB2 ARG 492 HB2 ARG 492 66.118 2.405 -2.626 212 HB3 ARG 492 HB3 ARG 492 65.242 2.447 -1.093 213 HG2 ARG 492 HG2 ARG 492 63.393 3.625 -2.084 214 HG3 ARG 492 HG3 ARG 492 64.299 3.904 -3.573 215 HD2 ARG 492 HD2 ARG 492 64.261 1.594 -4.145 216 HD3 ARG 492 HD3 ARG 492 63.692 1.130 -2.544 217 HE ARG 492 HE ARG 492 61.525 1.759 -3.170 218 HH11 ARG 492 HH11 ARG 492 62.861 4.224 -4.719 219 HH12 ARG 492 HH12 ARG 492 62.136 3.985 -6.273 220 HH21 ARG 492 HH21 ARG 492 60.998 0.792 -5.546 221 HH22 ARG 492 HH22 ARG 492 61.083 2.043 -6.740 222 H GLN 493 H GLN 493 65.594 4.266 0.797 223 HA GLN 493 HA GLN 493 63.096 5.515 0.912 224 HB2 GLN 493 HB2 GLN 493 65.319 5.283 2.951 225 HB3 GLN 493 HB3 GLN 493 63.742 5.973 3.325 226 HG2 GLN 493 HG2 GLN 493 62.622 3.920 2.726 227 HG3 GLN 493 HG3 GLN 493 64.125 3.226 2.123 228 HE21 GLN 493 HE21 GLN 493 63.247 1.558 3.912 229 HE22 GLN 493 HE22 GLN 493 63.889 1.789 5.466 230 H VAL 494 H VAL 494 66.345 6.904 1.360 231 HA VAL 494 HA VAL 494 65.502 9.551 1.828 232 HB VAL 494 HB VAL 494 68.055 8.496 0.580 233 HG11 VAL 494 HG11 VAL 494 68.957 10.730 1.363 234 HG12 VAL 494 HG12 VAL 494 67.289 11.233 1.629 235 HG13 VAL 494 HG13 VAL 494 67.838 10.829 0.003 236 HG21 VAL 494 HG21 VAL 494 67.256 9.252 3.410 237 HG22 VAL 494 HG22 VAL 494 68.921 8.960 2.912 238 HG23 VAL 494 HG23 VAL 494 67.736 7.657 2.832 239 H TYR 495 H TYR 495 66.410 7.871 -1.152 240 HA TYR 495 HA TYR 495 66.130 10.005 -2.950 241 HB2 TYR 495 HB2 TYR 495 67.238 8.022 -3.653 242 HB3 TYR 495 HB3 TYR 495 65.867 7.014 -3.222 243 HD1 TYR 495 HD1 TYR 495 66.791 9.860 -5.494 244 HD2 TYR 495 HD2 TYR 495 64.351 6.371 -4.879 245 HE1 TYR 495 HE1 TYR 495 65.933 10.043 -7.815 246 HE2 TYR 495 HE2 TYR 495 63.490 6.564 -7.190 247 HH TYR 495 HH TYR 495 63.419 9.010 -8.931 248 H GLU 496 H GLU 496 63.762 7.510 -2.005 249 HA GLU 496 HA GLU 496 61.669 8.479 -3.635 250 HB2 GLU 496 HB2 GLU 496 61.926 6.210 -2.351 251 HB3 GLU 496 HB3 GLU 496 61.150 7.073 -1.027 252 HG2 GLU 496 HG2 GLU 496 59.388 6.020 -2.277 253 HG3 GLU 496 HG3 GLU 496 59.329 7.735 -2.680 254 H LEU 497 H LEU 497 62.669 9.204 -0.344 255 HA LEU 497 HA LEU 497 60.462 10.809 0.370 256 HB2 LEU 497 HB2 LEU 497 63.287 10.580 1.353 257 HB3 LEU 497 HB3 LEU 497 62.205 11.803 2.021 258 HG LEU 497 HG LEU 497 61.549 8.845 1.888 259 HD11 LEU 497 HD11 LEU 497 63.524 9.653 3.443 260 HD12 LEU 497 HD12 LEU 497 62.312 8.532 4.053 261 HD13 LEU 497 HD13 LEU 497 62.208 10.242 4.458 262 HD21 LEU 497 HD21 LEU 497 60.087 11.271 2.832 263 HD22 LEU 497 HD22 LEU 497 59.963 9.841 3.857 264 HD23 LEU 497 HD23 LEU 497 59.466 9.760 2.170 265 H GLU 498 H GLU 498 63.521 11.561 -1.255 266 HA GLU 498 HA GLU 498 63.327 14.368 -1.224 267 HB2 GLU 498 HB2 GLU 498 64.631 12.442 -3.152 268 HB3 GLU 498 HB3 GLU 498 64.733 14.188 -3.363 269 HG2 GLU 498 HG2 GLU 498 65.852 14.468 -1.268 270 HG3 GLU 498 HG3 GLU 498 65.515 12.808 -0.789 271 H LYS 499 H LYS 499 62.175 12.010 -3.656 272 HA LYS 499 HA LYS 499 60.996 13.988 -5.375 273 HB2 LYS 499 HB2 LYS 499 60.792 10.999 -5.055 274 HB3 LYS 499 HB3 LYS 499 59.613 11.818 -6.069 275 HG2 LYS 499 HG2 LYS 499 61.572 11.016 -7.368 276 HG3 LYS 499 HG3 LYS 499 61.400 12.769 -7.443 277 HD2 LYS 499 HD2 LYS 499 63.126 13.043 -5.732 278 HD3 LYS 499 HD3 LYS 499 63.254 11.292 -5.550 279 HE2 LYS 499 HE2 LYS 499 65.044 12.052 -7.006 280 HE3 LYS 499 HE3 LYS 499 63.876 11.143 -7.968 281 HZ1 LYS 499 HZ1 LYS 499 63.406 12.930 -9.172 282 HZ2 LYS 499 HZ2 LYS 499 64.750 13.688 -8.461 283 HZ3 LYS 499 HZ3 LYS 499 63.199 13.907 -7.802 284 H LEU 500 H LEU 500 59.703 11.929 -2.800 285 HA LEU 500 HA LEU 500 57.019 12.746 -3.015 286 HB2 LEU 500 HB2 LEU 500 58.678 11.559 -0.813 287 HB3 LEU 500 HB3 LEU 500 57.005 12.001 -0.527 288 HG LEU 500 HG LEU 500 57.733 10.309 -2.913 289 HD11 LEU 500 HD11 LEU 500 57.331 8.297 -1.545 290 HD12 LEU 500 HD12 LEU 500 57.192 9.303 -0.103 291 HD13 LEU 500 HD13 LEU 500 58.730 9.197 -0.959 292 HD21 LEU 500 HD21 LEU 500 55.241 9.854 -1.359 293 HD22 LEU 500 HD22 LEU 500 55.475 10.003 -3.099 294 HD23 LEU 500 HD23 LEU 500 55.351 11.448 -2.111 295 H GLN 501 H GLN 501 59.701 14.027 -1.082 296 HA GLN 501 HA GLN 501 58.265 15.915 0.405 297 HB2 GLN 501 HB2 GLN 501 61.113 15.700 -0.533 298 HB3 GLN 501 HB3 GLN 501 60.576 17.191 0.240 299 HG2 GLN 501 HG2 GLN 501 60.155 14.455 1.468 300 HG3 GLN 501 HG3 GLN 501 61.561 15.462 1.822 301 HE21 GLN 501 HE21 GLN 501 58.818 14.654 3.306 302 HE22 GLN 501 HE22 GLN 501 58.370 16.135 4.000 303 H GLU 502 H GLU 502 59.421 15.985 -2.891 304 HA GLU 502 HA GLU 502 58.828 18.785 -3.276 305 HB2 GLU 502 HB2 GLU 502 60.626 17.988 -4.559 306 HB3 GLU 502 HB3 GLU 502 59.767 16.525 -5.031 307 HG2 GLU 502 HG2 GLU 502 58.350 17.725 -6.520 308 HG3 GLU 502 HG3 GLU 502 58.872 19.285 -5.879 309 H LYS 503 H LYS 503 57.089 15.786 -3.607 310 HA LYS 503 HA LYS 503 54.937 17.133 -5.142 311 HB2 LYS 503 HB2 LYS 503 55.547 14.211 -4.705 312 HB3 LYS 503 HB3 LYS 503 54.174 14.822 -5.625 313 HG2 LYS 503 HG2 LYS 503 55.720 16.002 -7.152 314 HG3 LYS 503 HG3 LYS 503 57.093 15.375 -6.243 315 HD2 LYS 503 HD2 LYS 503 55.020 13.567 -7.507 316 HD3 LYS 503 HD3 LYS 503 56.466 14.090 -8.366 317 HE2 LYS 503 HE2 LYS 503 57.798 13.177 -6.381 318 HE3 LYS 503 HE3 LYS 503 56.305 12.405 -5.859 319 HZ1 LYS 503 HZ1 LYS 503 57.866 11.913 -8.311 320 HZ2 LYS 503 HZ2 LYS 503 56.220 11.501 -8.227 321 HZ3 LYS 503 HZ3 LYS 503 57.329 10.801 -7.149 322 H LEU 504 H LEU 504 55.650 15.820 -2.027 323 HA LEU 504 HA LEU 504 53.079 15.049 -1.213 324 HB2 LEU 504 HB2 LEU 504 55.631 15.730 0.170 325 HB3 LEU 504 HB3 LEU 504 54.175 15.595 1.149 326 HG LEU 504 HG LEU 504 55.162 13.440 -0.746 327 HD11 LEU 504 HD11 LEU 504 55.780 12.297 1.425 328 HD12 LEU 504 HD12 LEU 504 55.469 13.830 2.233 329 HD13 LEU 504 HD13 LEU 504 56.763 13.711 1.041 330 HD21 LEU 504 HD21 LEU 504 52.916 12.909 -0.445 331 HD22 LEU 504 HD22 LEU 504 52.816 13.711 1.118 332 HD23 LEU 504 HD23 LEU 504 53.579 12.131 0.984 333 HA PRO 505 HA PRO 505 51.316 19.077 -0.330 334 HB2 PRO 505 HB2 PRO 505 49.469 17.976 1.650 335 HB3 PRO 505 HB3 PRO 505 49.105 18.586 0.029 336 HG2 PRO 505 HG2 PRO 505 48.950 15.934 0.759 337 HG3 PRO 505 HG3 PRO 505 49.177 16.510 -0.896 338 HD2 PRO 505 HD2 PRO 505 51.194 15.360 0.974 339 HD3 PRO 505 HD3 PRO 505 51.076 15.243 -0.784 340 H GLU 506 H GLU 506 51.389 20.661 1.242 341 HA GLU 506 HA GLU 506 53.500 20.967 2.809 342 HB2 GLU 506 HB2 GLU 506 51.521 22.560 2.246 343 HB3 GLU 506 HB3 GLU 506 50.882 22.055 3.808 344 HG2 GLU 506 HG2 GLU 506 52.953 22.768 4.904 345 HG3 GLU 506 HG3 GLU 506 53.632 23.222 3.344 346 H LYS 507 H LYS 507 50.398 20.056 4.349 347 HA LYS 507 HA LYS 507 51.347 19.712 6.925 348 HB2 LYS 507 HB2 LYS 507 49.369 18.349 7.321 349 HB3 LYS 507 HB3 LYS 507 48.952 19.669 6.222 350 HG2 LYS 507 HG2 LYS 507 49.468 18.044 4.311 351 HG3 LYS 507 HG3 LYS 507 49.476 16.774 5.533 352 HD2 LYS 507 HD2 LYS 507 47.155 18.675 5.102 353 HD3 LYS 507 HD3 LYS 507 47.261 17.079 4.362 354 HE2 LYS 507 HE2 LYS 507 47.584 16.171 6.743 355 HE3 LYS 507 HE3 LYS 507 47.054 17.760 7.298 356 HZ1 LYS 507 HZ1 LYS 507 45.547 15.679 5.893 357 HZ2 LYS 507 HZ2 LYS 507 45.145 17.301 5.583 358 HZ3 LYS 507 HZ3 LYS 507 45.064 16.689 7.167 359 H TYR 508 H TYR 508 51.627 17.508 4.229 360 HA TYR 508 HA TYR 508 52.711 15.381 5.958 361 HB2 TYR 508 HB2 TYR 508 52.135 15.551 3.003 362 HB3 TYR 508 HB3 TYR 508 52.842 14.144 3.785 363 HD1 TYR 508 HD1 TYR 508 51.558 13.263 5.905 364 HD2 TYR 508 HD2 TYR 508 49.800 15.695 2.839 365 HE1 TYR 508 HE1 TYR 508 49.315 12.474 6.582 366 HE2 TYR 508 HE2 TYR 508 47.534 14.901 3.519 367 HH TYR 508 HH TYR 508 46.397 13.891 5.307 368 H LYS 509 H LYS 509 53.663 17.963 3.903 369 HA LYS 509 HA LYS 509 56.176 17.046 3.035 370 HB2 LYS 509 HB2 LYS 509 55.022 19.115 2.231 371 HB3 LYS 509 HB3 LYS 509 55.372 19.871 3.781 372 HG2 LYS 509 HG2 LYS 509 57.779 19.582 3.393 373 HG3 LYS 509 HG3 LYS 509 57.437 18.817 1.837 374 HD2 LYS 509 HD2 LYS 509 56.272 20.856 1.086 375 HD3 LYS 509 HD3 LYS 509 56.628 21.629 2.629 376 HE2 LYS 509 HE2 LYS 509 59.044 21.414 2.181 377 HE3 LYS 509 HE3 LYS 509 58.684 20.646 0.632 378 HZ1 LYS 509 HZ1 LYS 509 57.230 23.061 0.930 379 HZ2 LYS 509 HZ2 LYS 509 58.323 22.613 -0.292 380 HZ3 LYS 509 HZ3 LYS 509 58.889 23.349 1.132 381 H ALA 510 H ALA 510 55.201 18.900 5.926 382 HA ALA 510 HA ALA 510 57.767 19.032 7.097 383 HB1 ALA 510 HB1 ALA 510 54.971 19.201 8.207 384 HB2 ALA 510 HB2 ALA 510 56.191 20.466 8.075 385 HB3 ALA 510 HB3 ALA 510 56.364 19.202 9.294 386 H GLU 511 H GLU 511 55.086 16.754 7.731 387 HA GLU 511 HA GLU 511 56.413 15.171 9.624 388 HB2 GLU 511 HB2 GLU 511 53.992 15.031 9.021 389 HB3 GLU 511 HB3 GLU 511 54.438 14.222 7.523 390 HG2 GLU 511 HG2 GLU 511 53.855 12.502 9.088 391 HG3 GLU 511 HG3 GLU 511 55.608 12.469 8.944 392 H TYR 512 H TYR 512 56.392 14.800 6.066 393 HA TYR 512 HA TYR 512 58.134 12.498 6.190 394 HB2 TYR 512 HB2 TYR 512 56.890 14.122 3.991 395 HB3 TYR 512 HB3 TYR 512 58.188 12.988 3.612 396 HD1 TYR 512 HD1 TYR 512 54.939 13.197 5.478 397 HD2 TYR 512 HD2 TYR 512 57.690 10.716 3.322 398 HE1 TYR 512 HE1 TYR 512 53.368 11.294 5.654 399 HE2 TYR 512 HE2 TYR 512 56.129 8.811 3.509 400 HH TYR 512 HH TYR 512 52.910 9.179 4.434 401 H LYS 513 H LYS 513 58.575 15.940 5.921 402 HA LYS 513 HA LYS 513 61.236 15.852 4.879 403 HB2 LYS 513 HB2 LYS 513 59.814 17.922 4.935 404 HB3 LYS 513 HB3 LYS 513 59.980 17.952 6.684 405 HG2 LYS 513 HG2 LYS 513 61.682 19.412 6.034 406 HG3 LYS 513 HG3 LYS 513 62.564 17.895 6.153 407 HD2 LYS 513 HD2 LYS 513 63.252 18.656 4.056 408 HD3 LYS 513 HD3 LYS 513 61.898 17.629 3.614 409 HE2 LYS 513 HE2 LYS 513 60.419 19.556 3.440 410 HE3 LYS 513 HE3 LYS 513 61.690 20.622 4.039 411 HZ1 LYS 513 HZ1 LYS 513 62.416 18.995 1.760 412 HZ2 LYS 513 HZ2 LYS 513 62.725 20.637 2.068 413 HZ3 LYS 513 HZ3 LYS 513 61.217 20.154 1.451 414 H LYS 514 H LYS 514 59.742 15.666 8.014 415 HA LYS 514 HA LYS 514 62.046 15.778 9.646 416 HB2 LYS 514 HB2 LYS 514 59.668 16.004 10.391 417 HB3 LYS 514 HB3 LYS 514 59.464 14.275 10.112 418 HG2 LYS 514 HG2 LYS 514 61.022 13.712 11.820 419 HG3 LYS 514 HG3 LYS 514 61.601 15.376 11.940 420 HD2 LYS 514 HD2 LYS 514 60.031 14.820 13.788 421 HD3 LYS 514 HD3 LYS 514 59.408 16.107 12.754 422 HE2 LYS 514 HE2 LYS 514 57.838 14.712 11.722 423 HE3 LYS 514 HE3 LYS 514 58.682 13.236 12.213 424 HZ1 LYS 514 HZ1 LYS 514 57.656 15.064 14.267 425 HZ2 LYS 514 HZ2 LYS 514 57.890 13.384 14.341 426 HZ3 LYS 514 HZ3 LYS 514 56.574 14.023 13.478 427 H LYS 515 H LYS 515 60.263 13.097 8.154 428 HA LYS 515 HA LYS 515 61.887 10.991 9.134 429 HB2 LYS 515 HB2 LYS 515 60.144 11.170 6.665 430 HB3 LYS 515 HB3 LYS 515 60.966 9.699 7.173 431 HG2 LYS 515 HG2 LYS 515 59.784 10.002 9.438 432 HG3 LYS 515 HG3 LYS 515 58.786 11.210 8.627 433 HD2 LYS 515 HD2 LYS 515 59.101 8.406 7.524 434 HD3 LYS 515 HD3 LYS 515 57.853 8.819 8.695 435 HE2 LYS 515 HE2 LYS 515 57.071 10.625 7.145 436 HE3 LYS 515 HE3 LYS 515 58.236 10.047 5.954 437 HZ1 LYS 515 HZ1 LYS 515 56.527 8.018 7.115 438 HZ2 LYS 515 HZ2 LYS 515 57.016 8.237 5.503 439 HZ3 LYS 515 HZ3 LYS 515 55.736 9.153 6.138 440 H LEU 516 H LEU 516 62.017 12.960 6.204 441 HA LEU 516 HA LEU 516 64.032 11.614 4.801 442 HB2 LEU 516 HB2 LEU 516 62.758 13.361 3.753 443 HB3 LEU 516 HB3 LEU 516 63.268 14.536 4.959 444 HG LEU 516 HG LEU 516 65.549 14.471 4.135 445 HD11 LEU 516 HD11 LEU 516 64.493 12.198 2.457 446 HD12 LEU 516 HD12 LEU 516 65.908 12.219 3.506 447 HD13 LEU 516 HD13 LEU 516 65.932 13.094 1.976 448 HD21 LEU 516 HD21 LEU 516 63.741 14.582 1.715 449 HD22 LEU 516 HD22 LEU 516 65.206 15.517 2.015 450 HD23 LEU 516 HD23 LEU 516 63.747 15.840 2.950 451 H ASP 517 H ASP 517 64.264 14.269 7.146 452 HA ASP 517 HA ASP 517 67.056 14.535 7.148 453 HB2 ASP 517 HB2 ASP 517 65.597 16.188 8.179 454 HB3 ASP 517 HB3 ASP 517 65.043 15.006 9.362 455 H GLN 518 H GLN 518 64.920 12.613 9.236 456 HA GLN 518 HA GLN 518 66.995 11.447 10.789 457 HB2 GLN 518 HB2 GLN 518 64.110 10.759 10.293 458 HB3 GLN 518 HB3 GLN 518 65.141 9.652 11.203 459 HG2 GLN 518 HG2 GLN 518 63.915 11.276 12.663 460 HG3 GLN 518 HG3 GLN 518 65.665 11.373 12.826 461 HE21 GLN 518 HE21 GLN 518 62.884 13.242 12.308 462 HE22 GLN 518 HE22 GLN 518 63.636 14.639 11.706 463 H THR 519 H THR 519 65.449 10.431 7.788 464 HA THR 519 HA THR 519 66.538 7.827 7.665 465 HB THR 519 HB THR 519 65.885 9.616 5.310 466 HG1 THR 519 HG1 THR 519 64.269 8.204 7.120 467 HG21 THR 519 HG21 THR 519 65.598 7.631 4.084 468 HG22 THR 519 HG22 THR 519 65.478 6.640 5.538 469 HG23 THR 519 HG23 THR 519 67.037 7.302 5.047 470 H ARG 520 H ARG 520 67.687 10.947 6.506 471 HA ARG 520 HA ARG 520 69.969 10.056 5.118 472 HB2 ARG 520 HB2 ARG 520 69.261 12.660 6.472 473 HB3 ARG 520 HB3 ARG 520 70.766 12.436 5.579 474 HG2 ARG 520 HG2 ARG 520 69.569 11.928 3.551 475 HG3 ARG 520 HG3 ARG 520 68.030 11.886 4.412 476 HD2 ARG 520 HD2 ARG 520 68.216 14.249 4.947 477 HD3 ARG 520 HD3 ARG 520 69.817 14.322 4.221 478 HE ARG 520 HE ARG 520 67.255 14.198 2.802 479 HH11 ARG 520 HH11 ARG 520 69.818 15.998 2.441 480 HH12 ARG 520 HH12 ARG 520 70.334 15.464 0.878 481 HH21 ARG 520 HH21 ARG 520 68.315 12.646 0.888 482 HH22 ARG 520 HH22 ARG 520 69.482 13.562 -0.006 483 H VAL 521 H VAL 521 69.402 10.856 8.500 484 HA VAL 521 HA VAL 521 72.088 10.825 9.381 485 HB VAL 521 HB VAL 521 69.518 10.116 10.825 486 HG11 VAL 521 HG11 VAL 521 70.890 10.664 12.881 487 HG12 VAL 521 HG12 VAL 521 72.324 10.589 11.857 488 HG13 VAL 521 HG13 VAL 521 71.324 9.154 12.081 489 HG21 VAL 521 HG21 VAL 521 71.107 12.660 11.147 490 HG22 VAL 521 HG22 VAL 521 69.394 12.367 11.457 491 HG23 VAL 521 HG23 VAL 521 69.978 12.491 9.801 492 H GLU 522 H GLU 522 69.639 8.256 9.240 493 HA GLU 522 HA GLU 522 71.225 6.184 10.330 494 HB2 GLU 522 HB2 GLU 522 68.914 6.031 8.371 495 HB3 GLU 522 HB3 GLU 522 69.558 4.677 9.297 496 HG2 GLU 522 HG2 GLU 522 68.985 5.816 11.396 497 HG3 GLU 522 HG3 GLU 522 68.373 7.198 10.482 498 H LEU 523 H LEU 523 70.599 7.205 7.007 499 HA LEU 523 HA LEU 523 72.052 5.186 5.692 500 HB2 LEU 523 HB2 LEU 523 70.391 6.787 4.673 501 HB3 LEU 523 HB3 LEU 523 71.634 8.030 4.765 502 HG LEU 523 HG LEU 523 73.103 6.188 3.497 503 HD11 LEU 523 HD11 LEU 523 70.246 5.472 2.776 504 HD12 LEU 523 HD12 LEU 523 71.447 4.413 3.513 505 HD13 LEU 523 HD13 LEU 523 71.657 4.966 1.851 506 HD21 LEU 523 HD21 LEU 523 72.148 7.159 1.301 507 HD22 LEU 523 HD22 LEU 523 72.777 8.307 2.483 508 HD23 LEU 523 HD23 LEU 523 71.036 8.063 2.331 509 H ALA 524 H ALA 524 73.016 8.437 6.768 510 HA ALA 524 HA ALA 524 75.609 8.379 5.659 511 HB1 ALA 524 HB1 ALA 524 74.299 10.381 6.587 512 HB2 ALA 524 HB2 ALA 524 76.029 10.328 6.919 513 HB3 ALA 524 HB3 ALA 524 74.881 9.869 8.175 514 H ASP 525 H ASP 525 74.347 7.336 8.784 515 HA ASP 525 HA ASP 525 76.859 6.780 9.984 516 HB2 ASP 525 HB2 ASP 525 74.625 7.009 11.154 517 HB3 ASP 525 HB3 ASP 525 74.222 5.403 10.549 518 H GLN 526 H GLN 526 74.556 4.829 8.151 519 HA GLN 526 HA GLN 526 75.962 2.362 8.330 520 HB2 GLN 526 HB2 GLN 526 73.578 2.473 7.816 521 HB3 GLN 526 HB3 GLN 526 73.916 3.360 6.331 522 HG2 GLN 526 HG2 GLN 526 75.094 1.453 5.402 523 HG3 GLN 526 HG3 GLN 526 74.941 0.572 6.923 524 HE21 GLN 526 HE21 GLN 526 73.596 0.675 3.914 525 HE22 GLN 526 HE22 GLN 526 72.013 0.187 4.286 526 H VAL 527 H VAL 527 75.899 4.977 5.983 527 HA VAL 527 HA VAL 527 77.590 3.730 4.053 528 HB VAL 527 HB VAL 527 76.696 6.585 4.524 529 HG11 VAL 527 HG11 VAL 527 78.835 6.833 3.474 530 HG12 VAL 527 HG12 VAL 527 77.641 6.963 2.182 531 HG13 VAL 527 HG13 VAL 527 78.545 5.463 2.401 532 HG21 VAL 527 HG21 VAL 527 76.128 4.707 2.220 533 HG22 VAL 527 HG22 VAL 527 75.280 6.195 2.643 534 HG23 VAL 527 HG23 VAL 527 75.117 4.767 3.665 535 H LYS 528 H LYS 528 78.114 6.019 6.686 536 HA LYS 528 HA LYS 528 80.856 6.537 6.204 537 HB2 LYS 528 HB2 LYS 528 79.390 7.946 7.577 538 HB3 LYS 528 HB3 LYS 528 79.297 6.669 8.787 539 HG2 LYS 528 HG2 LYS 528 81.774 6.778 9.047 540 HG3 LYS 528 HG3 LYS 528 81.809 8.125 7.904 541 HD2 LYS 528 HD2 LYS 528 80.166 8.122 10.445 542 HD3 LYS 528 HD3 LYS 528 81.788 8.799 10.344 543 HE2 LYS 528 HE2 LYS 528 80.860 10.199 8.365 544 HE3 LYS 528 HE3 LYS 528 79.268 9.745 8.979 545 HZ1 LYS 528 HZ1 LYS 528 79.726 10.746 11.046 546 HZ2 LYS 528 HZ2 LYS 528 80.178 11.877 9.863 547 HZ3 LYS 528 HZ3 LYS 528 81.365 10.971 10.673 548 H SER 529 H SER 529 79.212 4.258 8.389 549 HA SER 529 HA SER 529 81.691 3.236 9.408 550 HB2 SER 529 HB2 SER 529 78.829 2.291 9.625 551 HB3 SER 529 HB3 SER 529 80.172 1.453 10.395 552 HG SER 529 HG SER 529 79.311 4.125 10.781 553 H ALA 530 H ALA 530 79.778 2.627 6.631 554 HA ALA 530 HA ALA 530 80.667 -0.091 6.207 555 HB1 ALA 530 HB1 ALA 530 78.558 0.421 5.257 556 HB2 ALA 530 HB2 ALA 530 79.665 0.340 3.887 557 HB3 ALA 530 HB3 ALA 530 79.162 1.908 4.520 558 H VAL 531 H VAL 531 82.338 2.649 6.203 559 HA VAL 531 HA VAL 531 83.844 2.237 3.724 560 HB VAL 531 HB VAL 531 83.091 4.491 4.736 561 HG11 VAL 531 HG11 VAL 531 85.671 4.426 6.272 562 HG12 VAL 531 HG12 VAL 531 84.223 3.741 7.013 563 HG13 VAL 531 HG13 VAL 531 84.245 5.434 6.517 564 HG21 VAL 531 HG21 VAL 531 85.949 4.006 3.837 565 HG22 VAL 531 HG22 VAL 531 85.195 5.597 3.923 566 HG23 VAL 531 HG23 VAL 531 84.563 4.384 2.813 567 H THR 532 H THR 532 83.890 0.301 6.022 568 HA THR 532 HA THR 532 86.621 0.581 7.033 569 HB THR 532 HB THR 532 84.968 0.045 8.666 570 HG1 THR 532 HG1 THR 532 85.820 -2.089 9.283 571 HG21 THR 532 HG21 THR 532 83.319 -1.550 8.477 572 HG22 THR 532 HG22 THR 532 84.337 -2.646 7.549 573 HG23 THR 532 HG23 THR 532 83.564 -1.277 6.754 574 H GLU 533 H GLU 533 84.882 -2.328 5.853 575 HA GLU 533 HA GLU 533 87.187 -2.933 4.109 576 HB2 GLU 533 HB2 GLU 533 86.066 -4.750 6.243 577 HB3 GLU 533 HB3 GLU 533 87.127 -5.296 4.948 578 HG2 GLU 533 HG2 GLU 533 88.874 -3.739 5.696 579 HG3 GLU 533 HG3 GLU 533 87.810 -3.140 6.966 580 H PHE 534 H PHE 534 84.420 -2.079 3.692 581 HA PHE 534 HA PHE 534 82.867 -4.296 2.783 582 HB2 PHE 534 HB2 PHE 534 82.685 -1.307 2.553 583 HB3 PHE 534 HB3 PHE 534 81.667 -2.298 1.513 584 HD1 PHE 534 HD1 PHE 534 82.799 -2.727 5.081 585 HD2 PHE 534 HD2 PHE 534 79.491 -2.301 2.372 586 HE1 PHE 534 HE1 PHE 534 81.222 -3.094 6.952 587 HE2 PHE 534 HE2 PHE 534 77.916 -2.667 4.246 588 HZ PHE 534 HZ PHE 534 78.778 -3.064 6.535 589 H GLU 535 H GLU 535 82.433 -4.946 0.669 590 HA GLU 535 HA GLU 535 84.688 -4.842 -1.113 591 HB2 GLU 535 HB2 GLU 535 81.915 -6.030 -1.399 592 HB3 GLU 535 HB3 GLU 535 83.190 -6.201 -2.605 593 HG2 GLU 535 HG2 GLU 535 84.623 -7.336 -1.016 594 HG3 GLU 535 HG3 GLU 535 83.471 -7.042 0.288 595 H ASN 536 H ASN 536 84.949 -3.652 -2.959 596 HA ASN 536 HA ASN 536 84.608 -1.978 -4.494 597 HB2 ASN 536 HB2 ASN 536 82.738 -3.650 -5.056 598 HB3 ASN 536 HB3 ASN 536 81.658 -2.538 -4.220 599 HD21 ASN 536 HD21 ASN 536 84.056 -0.621 -5.523 600 HD22 ASN 536 HD22 ASN 536 83.322 -0.232 -7.001 601 H VAL 537 H VAL 537 85.047 -0.914 -2.087 602 HA VAL 537 HA VAL 537 82.999 0.707 -1.002 603 HB VAL 537 HB VAL 537 85.957 1.332 -0.953 604 HG11 VAL 537 HG11 VAL 537 85.476 2.551 1.013 605 HG12 VAL 537 HG12 VAL 537 83.916 1.762 1.236 606 HG13 VAL 537 HG13 VAL 537 84.124 2.948 -0.050 607 HG21 VAL 537 HG21 VAL 537 85.741 -0.988 -0.306 608 HG22 VAL 537 HG22 VAL 537 84.337 -0.631 0.700 609 HG23 VAL 537 HG23 VAL 537 85.932 -0.049 1.176 610 H THR 538 H THR 538 82.223 2.658 -1.582 611 HA THR 538 HA THR 538 83.407 3.997 -3.955 612 HB THR 538 HB THR 538 81.187 4.726 -4.514 613 HG1 THR 538 HG1 THR 538 79.587 3.524 -2.942 614 HG21 THR 538 HG21 THR 538 80.994 1.824 -3.688 615 HG22 THR 538 HG22 THR 538 81.951 2.366 -5.068 616 HG23 THR 538 HG23 THR 538 80.204 2.609 -5.053 617 HA PRO 539 HA PRO 539 84.016 6.797 -0.131 618 HB2 PRO 539 HB2 PRO 539 85.894 8.217 -1.847 619 HB3 PRO 539 HB3 PRO 539 86.244 7.269 -0.391 620 HG2 PRO 539 HG2 PRO 539 86.407 6.474 -3.230 621 HG3 PRO 539 HG3 PRO 539 87.254 5.812 -1.821 622 HD2 PRO 539 HD2 PRO 539 85.315 4.424 -3.038 623 HD3 PRO 539 HD3 PRO 539 85.504 4.365 -1.279 624 H THR 540 H THR 540 83.439 9.019 0.078 625 HA THR 540 HA THR 540 81.356 9.890 -1.657 626 HB THR 540 HB THR 540 82.760 11.657 0.343 627 HG1 THR 540 HG1 THR 540 80.786 9.715 0.916 628 HG21 THR 540 HG21 THR 540 80.791 12.415 -1.149 629 HG22 THR 540 HG22 THR 540 80.644 12.685 0.585 630 HG23 THR 540 HG23 THR 540 79.807 11.329 -0.170 631 H ASN 541 H ASN 541 83.876 9.560 -3.071 632 HA ASN 541 HA ASN 541 85.211 10.668 -4.587 633 HB2 ASN 541 HB2 ASN 541 83.048 12.783 -4.503 634 HB3 ASN 541 HB3 ASN 541 84.152 12.432 -5.835 635 HD21 ASN 541 HD21 ASN 541 84.014 9.665 -6.046 636 HD22 ASN 541 HD22 ASN 541 82.426 9.177 -6.391 637 H ASP 542 H ASP 542 85.654 10.983 -1.862 638 HA ASP 542 HA ASP 542 86.320 13.766 -1.339 639 HB2 ASP 542 HB2 ASP 542 85.365 12.163 0.371 640 HB3 ASP 542 HB3 ASP 542 86.926 11.345 0.356 641 H GLN 543 H GLN 543 88.124 14.558 -2.220 642 HA GLN 543 HA GLN 543 90.292 14.699 -3.005 643 HB2 GLN 543 HB2 GLN 543 90.647 13.061 -0.484 644 HB3 GLN 543 HB3 GLN 543 91.977 13.793 -1.382 645 HG2 GLN 543 HG2 GLN 543 89.615 15.375 -0.346 646 HG3 GLN 543 HG3 GLN 543 91.112 15.175 0.562 647 HE21 GLN 543 HE21 GLN 543 93.008 16.306 -0.188 648 HE22 GLN 543 HE22 GLN 543 92.936 17.474 -1.417 Start of MODEL 14 1 H1 SER 466 H1 SER 466 28.311 -1.848 0.365 2 H2 SER 466 H2 SER 466 29.908 -1.712 -0.202 3 H3 SER 466 H3 SER 466 28.810 -2.745 -0.985 4 HA SER 466 HA SER 466 27.854 -1.107 -2.150 5 HB2 SER 466 HB2 SER 466 27.581 1.198 -1.159 6 HB3 SER 466 HB3 SER 466 26.800 -0.087 -0.242 7 HG SER 466 HG SER 466 28.552 -0.086 1.167 8 H ASP 467 H ASP 467 29.382 1.637 -1.103 9 HA ASP 467 HA ASP 467 31.414 1.428 -3.209 10 HB2 ASP 467 HB2 ASP 467 29.802 3.395 -2.971 11 HB3 ASP 467 HB3 ASP 467 30.726 3.847 -1.540 12 H ASP 468 H ASP 468 33.267 0.532 -2.546 13 HA ASP 468 HA ASP 468 34.255 0.950 0.180 14 HB2 ASP 468 HB2 ASP 468 35.292 -0.721 -2.122 15 HB3 ASP 468 HB3 ASP 468 36.015 -0.671 -0.515 16 H TYR 469 H TYR 469 34.340 2.601 -2.608 17 HA TYR 469 HA TYR 469 36.935 3.335 -3.224 18 HB2 TYR 469 HB2 TYR 469 34.849 3.994 -4.402 19 HB3 TYR 469 HB3 TYR 469 34.504 5.121 -3.094 20 HD1 TYR 469 HD1 TYR 469 37.048 4.260 -5.686 21 HD2 TYR 469 HD2 TYR 469 35.460 7.276 -3.076 22 HE1 TYR 469 HE1 TYR 469 38.453 5.967 -6.806 23 HE2 TYR 469 HE2 TYR 469 36.864 8.985 -4.192 24 HH TYR 469 HH TYR 469 37.992 8.956 -6.882 25 H VAL 470 H VAL 470 38.148 5.306 -2.655 26 HA VAL 470 HA VAL 470 37.693 6.223 0.135 27 HB VAL 470 HB VAL 470 40.417 5.818 -1.102 28 HG11 VAL 470 HG11 VAL 470 40.993 5.764 1.389 29 HG12 VAL 470 HG12 VAL 470 39.368 6.374 1.681 30 HG13 VAL 470 HG13 VAL 470 40.509 7.325 0.732 31 HG21 VAL 470 HG21 VAL 470 39.448 3.626 -1.027 32 HG22 VAL 470 HG22 VAL 470 38.716 3.933 0.548 33 HG23 VAL 470 HG23 VAL 470 40.466 3.763 0.407 34 H ASP 471 H ASP 471 38.731 8.319 0.634 35 HA ASP 471 HA ASP 471 38.060 10.298 -1.273 36 HB2 ASP 471 HB2 ASP 471 39.718 10.398 1.246 37 HB3 ASP 471 HB3 ASP 471 39.360 11.828 0.281 38 H GLU 472 H GLU 472 39.320 11.600 -2.566 39 HA GLU 472 HA GLU 472 41.448 10.432 -3.967 40 HB2 GLU 472 HB2 GLU 472 40.553 13.314 -3.760 41 HB3 GLU 472 HB3 GLU 472 41.739 12.735 -4.930 42 HG2 GLU 472 HG2 GLU 472 40.106 11.214 -5.899 43 HG3 GLU 472 HG3 GLU 472 38.924 11.648 -4.665 44 H GLU 473 H GLU 473 41.504 12.870 -1.375 45 HA GLU 473 HA GLU 473 44.286 13.372 -1.493 46 HB2 GLU 473 HB2 GLU 473 43.122 15.029 -0.355 47 HB3 GLU 473 HB3 GLU 473 42.060 13.877 0.448 48 HG2 GLU 473 HG2 GLU 473 43.763 13.250 1.997 49 HG3 GLU 473 HG3 GLU 473 45.003 14.107 1.080 50 H THR 474 H THR 474 42.337 11.210 0.513 51 HA THR 474 HA THR 474 44.475 10.118 2.032 52 HB THR 474 HB THR 474 41.700 9.202 1.298 53 HG1 THR 474 HG1 THR 474 42.827 9.941 3.787 54 HG21 THR 474 HG21 THR 474 42.824 7.143 1.630 55 HG22 THR 474 HG22 THR 474 41.998 7.494 3.147 56 HG23 THR 474 HG23 THR 474 43.736 7.777 3.003 57 H TYR 475 H TYR 475 42.786 9.053 -0.878 58 HA TYR 475 HA TYR 475 44.155 6.631 -1.190 59 HB2 TYR 475 HB2 TYR 475 41.999 7.357 -2.295 60 HB3 TYR 475 HB3 TYR 475 42.978 8.321 -3.404 61 HD1 TYR 475 HD1 TYR 475 42.670 4.896 -1.998 62 HD2 TYR 475 HD2 TYR 475 43.862 7.320 -5.327 63 HE1 TYR 475 HE1 TYR 475 43.122 2.839 -3.331 64 HE2 TYR 475 HE2 TYR 475 44.323 5.280 -6.663 65 HH TYR 475 HH TYR 475 43.234 2.613 -6.366 66 H ASN 476 H ASN 476 44.794 9.828 -2.640 67 HA ASN 476 HA ASN 476 47.011 8.934 -4.176 68 HB2 ASN 476 HB2 ASN 476 46.484 11.721 -3.129 69 HB3 ASN 476 HB3 ASN 476 47.530 11.273 -4.477 70 HD21 ASN 476 HD21 ASN 476 45.427 9.116 -5.236 71 HD22 ASN 476 HD22 ASN 476 44.226 10.001 -6.045 72 H LEU 477 H LEU 477 46.632 10.176 -0.918 73 HA LEU 477 HA LEU 477 49.341 10.568 -0.266 74 HB2 LEU 477 HB2 LEU 477 47.536 11.335 1.183 75 HB3 LEU 477 HB3 LEU 477 46.983 9.684 1.427 76 HG LEU 477 HG LEU 477 49.117 9.135 2.539 77 HD11 LEU 477 HD11 LEU 477 50.488 11.257 3.216 78 HD12 LEU 477 HD12 LEU 477 49.718 12.004 1.816 79 HD13 LEU 477 HD13 LEU 477 50.734 10.577 1.608 80 HD21 LEU 477 HD21 LEU 477 47.337 9.797 3.974 81 HD22 LEU 477 HD22 LEU 477 47.531 11.497 3.548 82 HD23 LEU 477 HD23 LEU 477 48.755 10.687 4.528 83 H GLN 478 H GLN 478 47.230 7.697 -0.027 84 HA GLN 478 HA GLN 478 49.181 5.928 1.020 85 HB2 GLN 478 HB2 GLN 478 46.722 5.430 -0.682 86 HB3 GLN 478 HB3 GLN 478 47.680 4.145 0.050 87 HG2 GLN 478 HG2 GLN 478 46.411 6.401 1.613 88 HG3 GLN 478 HG3 GLN 478 45.668 4.818 1.402 89 HE21 GLN 478 HE21 GLN 478 47.177 6.447 3.714 90 HE22 GLN 478 HE22 GLN 478 48.107 5.222 4.435 91 H LYS 479 H LYS 479 48.245 6.852 -2.216 92 HA LYS 479 HA LYS 479 49.788 4.993 -3.677 93 HB2 LYS 479 HB2 LYS 479 47.855 6.533 -4.432 94 HB3 LYS 479 HB3 LYS 479 49.088 7.781 -4.598 95 HG2 LYS 479 HG2 LYS 479 50.297 6.452 -6.224 96 HG3 LYS 479 HG3 LYS 479 49.240 5.066 -5.946 97 HD2 LYS 479 HD2 LYS 479 48.510 6.167 -7.979 98 HD3 LYS 479 HD3 LYS 479 47.302 6.461 -6.727 99 HE2 LYS 479 HE2 LYS 479 48.031 8.698 -6.394 100 HE3 LYS 479 HE3 LYS 479 49.541 8.421 -7.264 101 HZ1 LYS 479 HZ1 LYS 479 46.925 9.066 -8.262 102 HZ2 LYS 479 HZ2 LYS 479 47.657 7.772 -9.083 103 HZ3 LYS 479 HZ3 LYS 479 48.441 9.276 -8.990 104 H LEU 480 H LEU 480 50.422 8.265 -2.545 105 HA LEU 480 HA LEU 480 52.909 8.673 -3.792 106 HB2 LEU 480 HB2 LEU 480 51.544 9.802 -1.353 107 HB3 LEU 480 HB3 LEU 480 53.156 10.340 -1.815 108 HG LEU 480 HG LEU 480 51.031 10.278 -3.931 109 HD11 LEU 480 HD11 LEU 480 49.681 11.479 -2.509 110 HD12 LEU 480 HD12 LEU 480 50.650 12.804 -3.142 111 HD13 LEU 480 HD13 LEU 480 51.021 12.115 -1.562 112 HD21 LEU 480 HD21 LEU 480 53.044 12.469 -3.473 113 HD22 LEU 480 HD22 LEU 480 52.359 11.884 -4.987 114 HD23 LEU 480 HD23 LEU 480 53.577 10.926 -4.147 115 H LEU 481 H LEU 481 52.081 7.379 -0.587 116 HA LEU 481 HA LEU 481 54.852 7.009 0.161 117 HB2 LEU 481 HB2 LEU 481 52.364 5.931 1.487 118 HB3 LEU 481 HB3 LEU 481 53.954 6.138 2.215 119 HG LEU 481 HG LEU 481 52.257 8.389 1.132 120 HD11 LEU 481 HD11 LEU 481 52.216 8.955 3.673 121 HD12 LEU 481 HD12 LEU 481 52.597 7.245 3.888 122 HD13 LEU 481 HD13 LEU 481 51.119 7.722 3.057 123 HD21 LEU 481 HD21 LEU 481 54.480 9.128 0.989 124 HD22 LEU 481 HD22 LEU 481 54.963 8.246 2.435 125 HD23 LEU 481 HD23 LEU 481 53.980 9.702 2.577 126 H ALA 482 H ALA 482 52.624 5.190 -1.643 127 HA ALA 482 HA ALA 482 52.945 2.583 -0.952 128 HB1 ALA 482 HB1 ALA 482 51.867 3.825 -3.108 129 HB2 ALA 482 HB2 ALA 482 52.082 2.078 -3.011 130 HB3 ALA 482 HB3 ALA 482 53.260 3.060 -3.874 131 HA PRO 483 HA PRO 483 57.078 2.121 -3.201 132 HB2 PRO 483 HB2 PRO 483 58.318 4.672 -3.747 133 HB3 PRO 483 HB3 PRO 483 57.724 3.482 -4.907 134 HG2 PRO 483 HG2 PRO 483 56.584 5.958 -4.509 135 HG3 PRO 483 HG3 PRO 483 55.729 4.554 -5.175 136 HD2 PRO 483 HD2 PRO 483 55.695 5.624 -2.371 137 HD3 PRO 483 HD3 PRO 483 54.352 4.988 -3.347 138 H TYR 484 H TYR 484 57.287 5.111 -1.268 139 HA TYR 484 HA TYR 484 59.778 4.516 -0.077 140 HB2 TYR 484 HB2 TYR 484 59.137 6.751 0.107 141 HB3 TYR 484 HB3 TYR 484 57.500 6.350 0.620 142 HD1 TYR 484 HD1 TYR 484 61.070 5.994 1.751 143 HD2 TYR 484 HD2 TYR 484 56.963 6.476 2.902 144 HE1 TYR 484 HE1 TYR 484 61.753 6.205 4.127 145 HE2 TYR 484 HE2 TYR 484 57.650 6.692 5.268 146 HH TYR 484 HH TYR 484 61.081 6.719 6.191 147 H HIS 485 H HIS 485 56.503 3.567 0.649 148 HA HIS 485 HA HIS 485 56.910 2.524 3.256 149 HB2 HIS 485 HB2 HIS 485 54.838 2.212 1.107 150 HB3 HIS 485 HB3 HIS 485 54.812 1.091 2.464 151 HD1 HIS 485 HD1 HIS 485 52.446 2.419 2.882 152 HD2 HIS 485 HD2 HIS 485 55.940 4.547 3.679 153 HE1 HIS 485 HE1 HIS 485 51.782 4.370 4.351 154 H LYS 486 H LYS 486 57.001 0.974 0.034 155 HA LYS 486 HA LYS 486 57.766 -1.570 1.258 156 HB2 LYS 486 HB2 LYS 486 57.659 -2.492 -0.960 157 HB3 LYS 486 HB3 LYS 486 56.271 -1.421 -0.768 158 HG2 LYS 486 HG2 LYS 486 57.565 0.380 -1.893 159 HG3 LYS 486 HG3 LYS 486 58.869 -0.760 -2.185 160 HD2 LYS 486 HD2 LYS 486 57.251 -2.222 -3.425 161 HD3 LYS 486 HD3 LYS 486 56.033 -0.962 -3.239 162 HE2 LYS 486 HE2 LYS 486 57.065 0.456 -4.754 163 HE3 LYS 486 HE3 LYS 486 58.680 -0.167 -4.413 164 HZ1 LYS 486 HZ1 LYS 486 56.570 -1.695 -5.827 165 HZ2 LYS 486 HZ2 LYS 486 58.198 -2.136 -5.628 166 HZ3 LYS 486 HZ3 LYS 486 57.787 -0.810 -6.608 167 H ALA 487 H ALA 487 59.379 1.216 0.495 168 HA ALA 487 HA ALA 487 61.752 0.284 -0.732 169 HB1 ALA 487 HB1 ALA 487 61.356 2.653 1.100 170 HB2 ALA 487 HB2 ALA 487 61.135 2.654 -0.649 171 HB3 ALA 487 HB3 ALA 487 62.740 2.389 0.037 172 H LYS 488 H LYS 488 62.701 -1.434 0.145 173 HA LYS 488 HA LYS 488 63.203 -1.614 3.025 174 HB2 LYS 488 HB2 LYS 488 64.085 -3.847 2.484 175 HB3 LYS 488 HB3 LYS 488 62.466 -3.633 1.814 176 HG2 LYS 488 HG2 LYS 488 63.533 -2.980 -0.367 177 HG3 LYS 488 HG3 LYS 488 65.099 -3.389 0.327 178 HD2 LYS 488 HD2 LYS 488 64.350 -5.700 0.706 179 HD3 LYS 488 HD3 LYS 488 62.765 -5.302 0.038 180 HE2 LYS 488 HE2 LYS 488 64.166 -6.368 -1.680 181 HE3 LYS 488 HE3 LYS 488 63.838 -4.688 -2.110 182 HZ1 LYS 488 HZ1 LYS 488 66.176 -5.253 -2.398 183 HZ2 LYS 488 HZ2 LYS 488 66.290 -5.669 -0.755 184 HZ3 LYS 488 HZ3 LYS 488 65.975 -4.062 -1.206 185 H THR 489 H THR 489 64.565 0.303 1.022 186 HA THR 489 HA THR 489 67.348 -0.296 1.863 187 HB THR 489 HB THR 489 67.900 0.847 -0.462 188 HG1 THR 489 HG1 THR 489 66.279 0.177 -1.984 189 HG21 THR 489 HG21 THR 489 66.972 -2.005 -0.051 190 HG22 THR 489 HG22 THR 489 68.627 -1.387 -0.026 191 HG23 THR 489 HG23 THR 489 67.734 -1.453 -1.545 192 H LEU 490 H LEU 490 68.333 1.327 2.850 193 HA LEU 490 HA LEU 490 67.032 3.701 3.570 194 HB2 LEU 490 HB2 LEU 490 69.904 2.785 3.625 195 HB3 LEU 490 HB3 LEU 490 69.464 4.405 4.153 196 HG LEU 490 HG LEU 490 67.854 3.428 5.761 197 HD11 LEU 490 HD11 LEU 490 68.917 0.857 4.590 198 HD12 LEU 490 HD12 LEU 490 67.236 1.355 4.790 199 HD13 LEU 490 HD13 LEU 490 68.197 0.909 6.200 200 HD21 LEU 490 HD21 LEU 490 70.032 3.937 6.629 201 HD22 LEU 490 HD22 LEU 490 70.732 2.506 5.874 202 HD23 LEU 490 HD23 LEU 490 69.626 2.331 7.235 203 H GLU 491 H GLU 491 69.502 3.098 1.080 204 HA GLU 491 HA GLU 491 69.871 5.718 0.174 205 HB2 GLU 491 HB2 GLU 491 71.328 3.923 -0.539 206 HB3 GLU 491 HB3 GLU 491 69.988 3.086 -1.312 207 HG2 GLU 491 HG2 GLU 491 71.336 4.248 -2.987 208 HG3 GLU 491 HG3 GLU 491 69.741 4.980 -2.902 209 H ARG 492 H ARG 492 67.482 3.323 -0.681 210 HA ARG 492 HA ARG 492 66.221 4.865 -2.728 211 HB2 ARG 492 HB2 ARG 492 66.026 2.442 -2.708 212 HB3 ARG 492 HB3 ARG 492 65.218 2.506 -1.141 213 HG2 ARG 492 HG2 ARG 492 63.312 3.611 -2.051 214 HG3 ARG 492 HG3 ARG 492 64.142 3.924 -3.580 215 HD2 ARG 492 HD2 ARG 492 64.140 1.610 -4.156 216 HD3 ARG 492 HD3 ARG 492 63.639 1.134 -2.535 217 HE ARG 492 HE ARG 492 61.437 1.926 -3.020 218 HH11 ARG 492 HH11 ARG 492 62.756 3.933 -5.125 219 HH12 ARG 492 HH12 ARG 492 61.927 3.409 -6.552 220 HH21 ARG 492 HH21 ARG 492 60.729 0.495 -5.105 221 HH22 ARG 492 HH22 ARG 492 60.779 1.463 -6.541 222 H GLN 493 H GLN 493 65.621 4.346 0.704 223 HA GLN 493 HA GLN 493 63.134 5.591 0.874 224 HB2 GLN 493 HB2 GLN 493 65.397 5.303 2.846 225 HB3 GLN 493 HB3 GLN 493 63.894 6.111 3.275 226 HG2 GLN 493 HG2 GLN 493 62.604 4.144 2.855 227 HG3 GLN 493 HG3 GLN 493 63.966 3.335 2.090 228 HE21 GLN 493 HE21 GLN 493 63.113 1.762 4.011 229 HE22 GLN 493 HE22 GLN 493 63.971 1.929 5.466 230 H VAL 494 H VAL 494 66.388 6.994 1.206 231 HA VAL 494 HA VAL 494 65.539 9.631 1.683 232 HB VAL 494 HB VAL 494 68.052 8.617 0.321 233 HG11 VAL 494 HG11 VAL 494 69.007 10.801 1.036 234 HG12 VAL 494 HG12 VAL 494 67.403 11.302 1.569 235 HG13 VAL 494 HG13 VAL 494 67.708 10.996 -0.140 236 HG21 VAL 494 HG21 VAL 494 67.419 9.309 3.207 237 HG22 VAL 494 HG22 VAL 494 69.034 8.953 2.598 238 HG23 VAL 494 HG23 VAL 494 67.787 7.708 2.568 239 H TYR 495 H TYR 495 66.355 7.936 -1.308 240 HA TYR 495 HA TYR 495 65.995 10.044 -3.120 241 HB2 TYR 495 HB2 TYR 495 67.077 8.061 -3.854 242 HB3 TYR 495 HB3 TYR 495 65.739 7.049 -3.329 243 HD1 TYR 495 HD1 TYR 495 66.586 9.789 -5.744 244 HD2 TYR 495 HD2 TYR 495 64.069 6.421 -4.844 245 HE1 TYR 495 HE1 TYR 495 65.585 9.924 -8.011 246 HE2 TYR 495 HE2 TYR 495 63.071 6.563 -7.104 247 HH TYR 495 HH TYR 495 64.405 8.525 -9.586 248 H GLU 496 H GLU 496 63.681 7.557 -2.054 249 HA GLU 496 HA GLU 496 61.537 8.519 -3.615 250 HB2 GLU 496 HB2 GLU 496 61.829 6.242 -2.408 251 HB3 GLU 496 HB3 GLU 496 61.167 7.073 -1.002 252 HG2 GLU 496 HG2 GLU 496 59.318 6.052 -2.157 253 HG3 GLU 496 HG3 GLU 496 59.225 7.786 -2.458 254 H LEU 497 H LEU 497 62.577 9.189 -0.328 255 HA LEU 497 HA LEU 497 60.377 10.771 0.451 256 HB2 LEU 497 HB2 LEU 497 63.234 10.549 1.332 257 HB3 LEU 497 HB3 LEU 497 62.165 11.743 2.068 258 HG LEU 497 HG LEU 497 61.540 8.780 1.887 259 HD11 LEU 497 HD11 LEU 497 62.332 8.468 4.069 260 HD12 LEU 497 HD12 LEU 497 62.346 10.192 4.418 261 HD13 LEU 497 HD13 LEU 497 63.567 9.498 3.351 262 HD21 LEU 497 HD21 LEU 497 59.458 9.685 2.273 263 HD22 LEU 497 HD22 LEU 497 60.105 11.168 2.973 264 HD23 LEU 497 HD23 LEU 497 60.030 9.696 3.939 265 H GLU 498 H GLU 498 63.400 11.556 -1.213 266 HA GLU 498 HA GLU 498 63.182 14.360 -1.163 267 HB2 GLU 498 HB2 GLU 498 64.503 12.412 -3.049 268 HB3 GLU 498 HB3 GLU 498 64.558 14.147 -3.355 269 HG2 GLU 498 HG2 GLU 498 65.388 12.939 -0.709 270 HG3 GLU 498 HG3 GLU 498 66.524 13.166 -2.034 271 H LYS 499 H LYS 499 61.955 11.957 -3.479 272 HA LYS 499 HA LYS 499 60.773 13.846 -5.274 273 HB2 LYS 499 HB2 LYS 499 60.651 10.891 -4.794 274 HB3 LYS 499 HB3 LYS 499 59.317 11.587 -5.705 275 HG2 LYS 499 HG2 LYS 499 61.008 10.875 -7.274 276 HG3 LYS 499 HG3 LYS 499 61.019 12.639 -7.241 277 HD2 LYS 499 HD2 LYS 499 62.889 12.550 -5.589 278 HD3 LYS 499 HD3 LYS 499 62.923 10.796 -5.768 279 HE2 LYS 499 HE2 LYS 499 63.332 12.802 -7.996 280 HE3 LYS 499 HE3 LYS 499 64.604 11.872 -7.208 281 HZ1 LYS 499 HZ1 LYS 499 63.027 9.902 -7.877 282 HZ2 LYS 499 HZ2 LYS 499 64.171 10.524 -8.968 283 HZ3 LYS 499 HZ3 LYS 499 62.541 10.991 -9.082 284 H LEU 500 H LEU 500 59.507 11.897 -2.612 285 HA LEU 500 HA LEU 500 56.838 12.720 -2.809 286 HB2 LEU 500 HB2 LEU 500 58.460 11.714 -0.476 287 HB3 LEU 500 HB3 LEU 500 56.717 11.946 -0.405 288 HG LEU 500 HG LEU 500 57.956 10.281 -2.599 289 HD11 LEU 500 HD11 LEU 500 57.322 9.467 0.241 290 HD12 LEU 500 HD12 LEU 500 58.820 9.222 -0.657 291 HD13 LEU 500 HD13 LEU 500 57.377 8.299 -1.080 292 HD21 LEU 500 HD21 LEU 500 55.316 9.675 -1.317 293 HD22 LEU 500 HD22 LEU 500 55.798 9.559 -3.008 294 HD23 LEU 500 HD23 LEU 500 55.388 11.119 -2.319 295 H GLN 501 H GLN 501 59.487 14.010 -0.836 296 HA GLN 501 HA GLN 501 58.070 15.918 0.608 297 HB2 GLN 501 HB2 GLN 501 60.892 15.778 -0.433 298 HB3 GLN 501 HB3 GLN 501 60.336 17.212 0.431 299 HG2 GLN 501 HG2 GLN 501 60.003 14.419 1.545 300 HG3 GLN 501 HG3 GLN 501 61.434 15.400 1.871 301 HE21 GLN 501 HE21 GLN 501 59.008 14.519 3.632 302 HE22 GLN 501 HE22 GLN 501 58.507 15.973 4.350 303 H GLU 502 H GLU 502 59.071 15.904 -2.719 304 HA GLU 502 HA GLU 502 58.471 18.703 -3.155 305 HB2 GLU 502 HB2 GLU 502 60.278 17.626 -4.381 306 HB3 GLU 502 HB3 GLU 502 59.162 16.430 -5.029 307 HG2 GLU 502 HG2 GLU 502 59.608 18.150 -6.694 308 HG3 GLU 502 HG3 GLU 502 57.924 18.235 -6.196 309 H LYS 503 H LYS 503 56.799 15.646 -3.423 310 HA LYS 503 HA LYS 503 54.583 16.920 -4.932 311 HB2 LYS 503 HB2 LYS 503 55.235 14.020 -4.416 312 HB3 LYS 503 HB3 LYS 503 53.864 14.591 -5.363 313 HG2 LYS 503 HG2 LYS 503 55.420 15.742 -6.909 314 HG3 LYS 503 HG3 LYS 503 56.788 15.131 -5.981 315 HD2 LYS 503 HD2 LYS 503 54.708 13.319 -7.230 316 HD3 LYS 503 HD3 LYS 503 56.185 13.791 -8.066 317 HE2 LYS 503 HE2 LYS 503 57.442 12.903 -6.010 318 HE3 LYS 503 HE3 LYS 503 55.917 12.161 -5.533 319 HZ1 LYS 503 HZ1 LYS 503 55.996 11.357 -8.019 320 HZ2 LYS 503 HZ2 LYS 503 56.760 10.490 -6.774 321 HZ3 LYS 503 HZ3 LYS 503 57.667 11.519 -7.780 322 H LEU 504 H LEU 504 55.300 15.509 -1.806 323 HA LEU 504 HA LEU 504 52.685 14.848 -1.058 324 HB2 LEU 504 HB2 LEU 504 55.278 15.009 0.249 325 HB3 LEU 504 HB3 LEU 504 54.007 15.537 1.336 326 HG LEU 504 HG LEU 504 52.780 13.453 0.945 327 HD11 LEU 504 HD11 LEU 504 53.183 12.590 -1.141 328 HD12 LEU 504 HD12 LEU 504 54.388 11.651 -0.279 329 HD13 LEU 504 HD13 LEU 504 54.866 13.101 -1.165 330 HD21 LEU 504 HD21 LEU 504 54.683 13.704 2.660 331 HD22 LEU 504 HD22 LEU 504 55.659 12.757 1.539 332 HD23 LEU 504 HD23 LEU 504 54.204 12.058 2.245 333 HA PRO 505 HA PRO 505 51.043 18.862 -0.074 334 HB2 PRO 505 HB2 PRO 505 49.277 17.819 2.002 335 HB3 PRO 505 HB3 PRO 505 48.848 18.398 0.385 336 HG2 PRO 505 HG2 PRO 505 48.713 15.759 1.187 337 HG3 PRO 505 HG3 PRO 505 48.834 16.299 -0.488 338 HD2 PRO 505 HD2 PRO 505 50.952 15.142 1.257 339 HD3 PRO 505 HD3 PRO 505 50.733 15.044 -0.496 340 H GLU 506 H GLU 506 51.164 20.450 1.547 341 HA GLU 506 HA GLU 506 53.385 20.710 3.037 342 HB2 GLU 506 HB2 GLU 506 50.650 21.834 3.613 343 HB3 GLU 506 HB3 GLU 506 52.117 22.384 4.422 344 HG2 GLU 506 HG2 GLU 506 53.107 23.011 2.278 345 HG3 GLU 506 HG3 GLU 506 51.710 22.370 1.417 346 H LYS 507 H LYS 507 50.304 19.807 4.628 347 HA LYS 507 HA LYS 507 51.249 19.450 7.197 348 HB2 LYS 507 HB2 LYS 507 49.365 17.642 7.299 349 HB3 LYS 507 HB3 LYS 507 48.927 19.314 6.938 350 HG2 LYS 507 HG2 LYS 507 48.411 18.868 4.736 351 HG3 LYS 507 HG3 LYS 507 49.665 17.639 4.572 352 HD2 LYS 507 HD2 LYS 507 47.430 16.629 4.456 353 HD3 LYS 507 HD3 LYS 507 48.305 16.073 5.883 354 HE2 LYS 507 HE2 LYS 507 47.015 17.320 7.338 355 HE3 LYS 507 HE3 LYS 507 46.514 18.463 6.091 356 HZ1 LYS 507 HZ1 LYS 507 45.681 15.620 6.260 357 HZ2 LYS 507 HZ2 LYS 507 45.201 16.724 5.063 358 HZ3 LYS 507 HZ3 LYS 507 44.716 16.952 6.675 359 H TYR 508 H TYR 508 51.451 17.203 4.497 360 HA TYR 508 HA TYR 508 52.591 15.119 6.199 361 HB2 TYR 508 HB2 TYR 508 51.948 15.321 3.265 362 HB3 TYR 508 HB3 TYR 508 52.765 13.925 3.955 363 HD1 TYR 508 HD1 TYR 508 51.639 12.912 6.102 364 HD2 TYR 508 HD2 TYR 508 49.615 15.323 3.189 365 HE1 TYR 508 HE1 TYR 508 49.477 11.955 6.833 366 HE2 TYR 508 HE2 TYR 508 47.433 14.363 3.923 367 HH TYR 508 HH TYR 508 47.240 12.143 6.686 368 H LYS 509 H LYS 509 53.497 17.577 3.909 369 HA LYS 509 HA LYS 509 56.043 16.688 3.185 370 HB2 LYS 509 HB2 LYS 509 54.661 18.727 2.362 371 HB3 LYS 509 HB3 LYS 509 55.390 19.578 3.720 372 HG2 LYS 509 HG2 LYS 509 57.620 19.135 2.871 373 HG3 LYS 509 HG3 LYS 509 56.974 18.100 1.600 374 HD2 LYS 509 HD2 LYS 509 57.424 20.210 0.571 375 HD3 LYS 509 HD3 LYS 509 55.675 20.121 0.769 376 HE2 LYS 509 HE2 LYS 509 55.734 21.567 2.688 377 HE3 LYS 509 HE3 LYS 509 57.492 21.470 2.783 378 HZ1 LYS 509 HZ1 LYS 509 56.921 22.312 0.231 379 HZ2 LYS 509 HZ2 LYS 509 57.538 23.257 1.501 380 HZ3 LYS 509 HZ3 LYS 509 55.862 23.189 1.223 381 H ALA 510 H ALA 510 54.977 18.678 5.938 382 HA ALA 510 HA ALA 510 57.506 19.071 7.106 383 HB1 ALA 510 HB1 ALA 510 56.327 19.731 9.071 384 HB2 ALA 510 HB2 ALA 510 54.919 18.762 8.634 385 HB3 ALA 510 HB3 ALA 510 55.316 20.210 7.707 386 H GLU 511 H GLU 511 55.025 16.633 7.913 387 HA GLU 511 HA GLU 511 56.522 15.253 9.845 388 HB2 GLU 511 HB2 GLU 511 54.082 14.943 9.387 389 HB3 GLU 511 HB3 GLU 511 54.501 14.068 7.918 390 HG2 GLU 511 HG2 GLU 511 54.107 12.414 9.606 391 HG3 GLU 511 HG3 GLU 511 55.853 12.480 9.382 392 H TYR 512 H TYR 512 56.370 14.721 6.336 393 HA TYR 512 HA TYR 512 58.171 12.480 6.485 394 HB2 TYR 512 HB2 TYR 512 56.788 13.987 4.286 395 HB3 TYR 512 HB3 TYR 512 58.140 12.926 3.878 396 HD1 TYR 512 HD1 TYR 512 54.824 13.016 5.611 397 HD2 TYR 512 HD2 TYR 512 57.887 10.573 3.896 398 HE1 TYR 512 HE1 TYR 512 53.374 11.023 5.856 399 HE2 TYR 512 HE2 TYR 512 56.462 8.575 4.156 400 HH TYR 512 HH TYR 512 54.068 8.272 6.073 401 H LYS 513 H LYS 513 58.551 15.888 6.365 402 HA LYS 513 HA LYS 513 61.109 15.958 5.107 403 HB2 LYS 513 HB2 LYS 513 59.662 17.983 5.526 404 HB3 LYS 513 HB3 LYS 513 60.035 17.839 7.234 405 HG2 LYS 513 HG2 LYS 513 61.654 19.379 6.554 406 HG3 LYS 513 HG3 LYS 513 62.540 17.869 6.401 407 HD2 LYS 513 HD2 LYS 513 62.967 19.004 4.366 408 HD3 LYS 513 HD3 LYS 513 61.727 17.831 3.953 409 HE2 LYS 513 HE2 LYS 513 60.030 19.477 3.853 410 HE3 LYS 513 HE3 LYS 513 60.991 20.647 4.762 411 HZ1 LYS 513 HZ1 LYS 513 62.536 20.036 2.605 412 HZ2 LYS 513 HZ2 LYS 513 61.587 21.434 2.787 413 HZ3 LYS 513 HZ3 LYS 513 60.969 20.086 1.958 414 H LYS 514 H LYS 514 59.935 15.538 8.400 415 HA LYS 514 HA LYS 514 62.448 15.471 9.712 416 HB2 LYS 514 HB2 LYS 514 59.662 14.592 10.327 417 HB3 LYS 514 HB3 LYS 514 60.934 13.791 11.246 418 HG2 LYS 514 HG2 LYS 514 60.118 15.794 12.418 419 HG3 LYS 514 HG3 LYS 514 61.813 15.972 11.951 420 HD2 LYS 514 HD2 LYS 514 61.354 17.569 10.332 421 HD3 LYS 514 HD3 LYS 514 59.746 16.932 9.995 422 HE2 LYS 514 HE2 LYS 514 59.636 19.121 11.134 423 HE3 LYS 514 HE3 LYS 514 58.914 17.839 12.108 424 HZ1 LYS 514 HZ1 LYS 514 61.625 19.014 12.420 425 HZ2 LYS 514 HZ2 LYS 514 61.075 17.651 13.272 426 HZ3 LYS 514 HZ3 LYS 514 60.321 19.156 13.497 427 H LYS 515 H LYS 515 60.447 12.968 8.192 428 HA LYS 515 HA LYS 515 62.068 10.757 8.873 429 HB2 LYS 515 HB2 LYS 515 60.284 11.211 6.473 430 HB3 LYS 515 HB3 LYS 515 61.024 9.663 6.872 431 HG2 LYS 515 HG2 LYS 515 59.884 9.704 9.077 432 HG3 LYS 515 HG3 LYS 515 59.099 11.223 8.623 433 HD2 LYS 515 HD2 LYS 515 58.061 10.117 6.683 434 HD3 LYS 515 HD3 LYS 515 58.845 8.600 7.119 435 HE2 LYS 515 HE2 LYS 515 56.793 10.107 8.762 436 HE3 LYS 515 HE3 LYS 515 56.563 8.562 7.937 437 HZ1 LYS 515 HZ1 LYS 515 57.049 7.940 10.095 438 HZ2 LYS 515 HZ2 LYS 515 58.207 9.166 10.308 439 HZ3 LYS 515 HZ3 LYS 515 58.561 7.820 9.335 440 H LEU 516 H LEU 516 62.126 12.914 6.068 441 HA LEU 516 HA LEU 516 64.150 11.644 4.600 442 HB2 LEU 516 HB2 LEU 516 62.781 13.382 3.637 443 HB3 LEU 516 HB3 LEU 516 63.328 14.543 4.843 444 HG LEU 516 HG LEU 516 65.580 14.503 3.929 445 HD11 LEU 516 HD11 LEU 516 65.873 13.191 1.713 446 HD12 LEU 516 HD12 LEU 516 64.457 12.279 2.228 447 HD13 LEU 516 HD13 LEU 516 65.916 12.269 3.216 448 HD21 LEU 516 HD21 LEU 516 63.662 14.677 1.599 449 HD22 LEU 516 HD22 LEU 516 65.141 15.605 1.854 450 HD23 LEU 516 HD23 LEU 516 63.727 15.902 2.866 451 H ASP 517 H ASP 517 64.329 14.283 6.968 452 HA ASP 517 HA ASP 517 67.118 14.615 6.974 453 HB2 ASP 517 HB2 ASP 517 65.556 16.235 7.951 454 HB3 ASP 517 HB3 ASP 517 65.110 15.070 9.196 455 H GLN 518 H GLN 518 65.031 12.675 9.082 456 HA GLN 518 HA GLN 518 67.158 11.601 10.630 457 HB2 GLN 518 HB2 GLN 518 64.321 10.662 10.219 458 HB3 GLN 518 HB3 GLN 518 65.440 9.970 11.395 459 HG2 GLN 518 HG2 GLN 518 65.695 12.130 12.497 460 HG3 GLN 518 HG3 GLN 518 64.679 12.909 11.286 461 HE21 GLN 518 HE21 GLN 518 63.605 13.384 13.606 462 HE22 GLN 518 HE22 GLN 518 62.359 12.311 14.028 463 H THR 519 H THR 519 65.500 10.462 7.728 464 HA THR 519 HA THR 519 66.579 7.850 7.679 465 HB THR 519 HB THR 519 65.617 9.621 5.408 466 HG1 THR 519 HG1 THR 519 63.687 8.512 5.758 467 HG21 THR 519 HG21 THR 519 65.691 6.598 5.432 468 HG22 THR 519 HG22 THR 519 67.020 7.545 4.770 469 HG23 THR 519 HG23 THR 519 65.416 7.674 4.066 470 H ARG 520 H ARG 520 67.661 10.822 5.994 471 HA ARG 520 HA ARG 520 69.866 9.623 4.701 472 HB2 ARG 520 HB2 ARG 520 70.685 11.920 4.386 473 HB3 ARG 520 HB3 ARG 520 68.946 11.841 4.083 474 HG2 ARG 520 HG2 ARG 520 68.540 12.538 6.400 475 HG3 ARG 520 HG3 ARG 520 70.266 12.733 6.657 476 HD2 ARG 520 HD2 ARG 520 70.223 14.358 4.702 477 HD3 ARG 520 HD3 ARG 520 68.463 14.298 4.822 478 HE ARG 520 HE ARG 520 69.491 14.771 7.394 479 HH11 ARG 520 HH11 ARG 520 70.985 16.486 5.117 480 HH12 ARG 520 HH12 ARG 520 70.229 18.013 5.423 481 HH21 ARG 520 HH21 ARG 520 67.779 16.682 7.481 482 HH22 ARG 520 HH22 ARG 520 68.410 18.127 6.765 483 H VAL 521 H VAL 521 69.428 10.960 7.910 484 HA VAL 521 HA VAL 521 72.121 11.172 8.689 485 HB VAL 521 HB VAL 521 69.548 10.708 10.196 486 HG11 VAL 521 HG11 VAL 521 70.934 11.337 12.246 487 HG12 VAL 521 HG12 VAL 521 72.352 10.926 11.279 488 HG13 VAL 521 HG13 VAL 521 71.136 9.697 11.628 489 HG21 VAL 521 HG21 VAL 521 70.356 12.959 9.009 490 HG22 VAL 521 HG22 VAL 521 71.313 13.123 10.480 491 HG23 VAL 521 HG23 VAL 521 69.555 12.998 10.580 492 H GLU 522 H GLU 522 69.826 8.457 9.024 493 HA GLU 522 HA GLU 522 71.620 6.689 10.324 494 HB2 GLU 522 HB2 GLU 522 69.240 6.083 8.542 495 HB3 GLU 522 HB3 GLU 522 70.030 4.926 9.612 496 HG2 GLU 522 HG2 GLU 522 69.468 6.328 11.556 497 HG3 GLU 522 HG3 GLU 522 68.699 7.501 10.488 498 H LEU 523 H LEU 523 70.826 7.247 6.944 499 HA LEU 523 HA LEU 523 72.353 5.173 5.813 500 HB2 LEU 523 HB2 LEU 523 70.614 6.350 4.598 501 HB3 LEU 523 HB3 LEU 523 71.533 7.845 4.677 502 HG LEU 523 HG LEU 523 73.085 5.569 3.559 503 HD11 LEU 523 HD11 LEU 523 70.550 6.527 2.224 504 HD12 LEU 523 HD12 LEU 523 71.074 4.868 2.514 505 HD13 LEU 523 HD13 LEU 523 71.895 5.853 1.303 506 HD21 LEU 523 HD21 LEU 523 73.740 8.018 3.588 507 HD22 LEU 523 HD22 LEU 523 72.457 8.311 2.416 508 HD23 LEU 523 HD23 LEU 523 73.810 7.263 1.998 509 H ALA 524 H ALA 524 73.198 8.552 6.520 510 HA ALA 524 HA ALA 524 75.727 8.516 5.272 511 HB1 ALA 524 HB1 ALA 524 74.868 10.153 7.667 512 HB2 ALA 524 HB2 ALA 524 74.509 10.569 5.992 513 HB3 ALA 524 HB3 ALA 524 76.181 10.532 6.551 514 H ASP 525 H ASP 525 74.704 7.717 8.558 515 HA ASP 525 HA ASP 525 77.318 7.336 9.615 516 HB2 ASP 525 HB2 ASP 525 74.522 6.558 10.413 517 HB3 ASP 525 HB3 ASP 525 75.882 5.829 11.267 518 H GLN 526 H GLN 526 74.986 5.227 8.037 519 HA GLN 526 HA GLN 526 76.356 2.771 8.420 520 HB2 GLN 526 HB2 GLN 526 73.981 2.892 7.861 521 HB3 GLN 526 HB3 GLN 526 74.365 3.633 6.310 522 HG2 GLN 526 HG2 GLN 526 75.498 1.627 5.567 523 HG3 GLN 526 HG3 GLN 526 75.330 0.895 7.164 524 HE21 GLN 526 HE21 GLN 526 73.974 0.755 4.145 525 HE22 GLN 526 HE22 GLN 526 72.387 0.319 4.566 526 H VAL 527 H VAL 527 76.456 5.238 5.943 527 HA VAL 527 HA VAL 527 78.087 3.823 4.082 528 HB VAL 527 HB VAL 527 77.431 6.750 4.478 529 HG11 VAL 527 HG11 VAL 527 79.545 6.787 3.388 530 HG12 VAL 527 HG12 VAL 527 78.355 6.948 2.096 531 HG13 VAL 527 HG13 VAL 527 79.139 5.394 2.385 532 HG21 VAL 527 HG21 VAL 527 75.710 4.958 3.674 533 HG22 VAL 527 HG22 VAL 527 76.634 4.967 2.173 534 HG23 VAL 527 HG23 VAL 527 75.864 6.447 2.744 535 H LYS 528 H LYS 528 78.721 6.141 6.671 536 HA LYS 528 HA LYS 528 81.501 6.483 6.220 537 HB2 LYS 528 HB2 LYS 528 80.087 7.995 7.553 538 HB3 LYS 528 HB3 LYS 528 79.921 6.746 8.783 539 HG2 LYS 528 HG2 LYS 528 82.395 6.730 9.066 540 HG3 LYS 528 HG3 LYS 528 82.512 8.049 7.895 541 HD2 LYS 528 HD2 LYS 528 80.806 8.228 10.382 542 HD3 LYS 528 HD3 LYS 528 82.493 8.733 10.357 543 HE2 LYS 528 HE2 LYS 528 81.866 10.236 8.378 544 HE3 LYS 528 HE3 LYS 528 80.183 9.893 8.782 545 HZ1 LYS 528 HZ1 LYS 528 82.106 10.889 10.792 546 HZ2 LYS 528 HZ2 LYS 528 80.409 10.863 10.875 547 HZ3 LYS 528 HZ3 LYS 528 81.196 11.940 9.820 548 H SER 529 H SER 529 79.703 4.352 8.438 549 HA SER 529 HA SER 529 82.135 3.173 9.428 550 HB2 SER 529 HB2 SER 529 79.207 2.567 9.809 551 HB3 SER 529 HB3 SER 529 80.464 1.535 10.491 552 HG SER 529 HG SER 529 80.492 2.960 12.030 553 H ALA 530 H ALA 530 80.314 2.763 6.634 554 HA ALA 530 HA ALA 530 80.715 -0.077 6.293 555 HB1 ALA 530 HB1 ALA 530 80.062 0.580 3.851 556 HB2 ALA 530 HB2 ALA 530 79.699 2.157 4.555 557 HB3 ALA 530 HB3 ALA 530 78.849 0.721 5.125 558 H VAL 531 H VAL 531 82.899 2.194 6.541 559 HA VAL 531 HA VAL 531 84.478 1.802 4.152 560 HB VAL 531 HB VAL 531 85.046 3.132 6.807 561 HG11 VAL 531 HG11 VAL 531 87.157 2.440 5.779 562 HG12 VAL 531 HG12 VAL 531 86.963 4.183 5.611 563 HG13 VAL 531 HG13 VAL 531 86.653 3.125 4.235 564 HG21 VAL 531 HG21 VAL 531 83.263 4.088 5.269 565 HG22 VAL 531 HG22 VAL 531 84.544 4.372 4.093 566 HG23 VAL 531 HG23 VAL 531 84.587 5.185 5.658 567 H THR 532 H THR 532 85.087 -0.379 3.957 568 HA THR 532 HA THR 532 87.181 -1.247 5.757 569 HB THR 532 HB THR 532 84.853 -1.870 6.772 570 HG1 THR 532 HG1 THR 532 86.892 -2.617 7.494 571 HG21 THR 532 HG21 THR 532 84.174 -2.943 4.508 572 HG22 THR 532 HG22 THR 532 83.815 -3.832 5.988 573 HG23 THR 532 HG23 THR 532 85.205 -4.286 5.004 574 H GLU 533 H GLU 533 85.078 -2.056 3.005 575 HA GLU 533 HA GLU 533 87.386 -3.393 1.721 576 HB2 GLU 533 HB2 GLU 533 85.829 -5.082 2.761 577 HB3 GLU 533 HB3 GLU 533 84.568 -4.495 1.678 578 HG2 GLU 533 HG2 GLU 533 85.847 -5.144 -0.271 579 HG3 GLU 533 HG3 GLU 533 87.248 -5.536 0.720 580 H PHE 534 H PHE 534 85.025 -1.081 1.565 581 HA PHE 534 HA PHE 534 84.152 0.219 -0.098 582 HB2 PHE 534 HB2 PHE 534 86.720 -0.737 -1.339 583 HB3 PHE 534 HB3 PHE 534 85.689 0.477 -2.098 584 HD1 PHE 534 HD1 PHE 534 85.292 2.662 -0.974 585 HD2 PHE 534 HD2 PHE 534 88.018 -0.247 0.621 586 HE1 PHE 534 HE1 PHE 534 86.281 4.397 0.496 587 HE2 PHE 534 HE2 PHE 534 89.008 1.486 2.092 588 HZ PHE 534 HZ PHE 534 88.139 3.809 2.030 589 H GLU 535 H GLU 535 83.303 0.226 -2.369 590 HA GLU 535 HA GLU 535 82.274 -2.465 -3.044 591 HB2 GLU 535 HB2 GLU 535 81.282 0.299 -3.775 592 HB3 GLU 535 HB3 GLU 535 80.519 -1.213 -4.271 593 HG2 GLU 535 HG2 GLU 535 81.005 -0.416 -1.390 594 HG3 GLU 535 HG3 GLU 535 79.475 -0.183 -2.231 595 H ASN 536 H ASN 536 82.492 -3.351 -5.062 596 HA ASN 536 HA ASN 536 83.390 -3.726 -7.142 597 HB2 ASN 536 HB2 ASN 536 81.874 -1.692 -7.534 598 HB3 ASN 536 HB3 ASN 536 83.352 -0.734 -7.517 599 HD21 ASN 536 HD21 ASN 536 84.214 -3.732 -8.723 600 HD22 ASN 536 HD22 ASN 536 84.041 -3.412 -10.379 601 H VAL 537 H VAL 537 85.308 -3.830 -5.254 602 HA VAL 537 HA VAL 537 87.481 -2.024 -5.624 603 HB VAL 537 HB VAL 537 87.407 -4.858 -4.541 604 HG11 VAL 537 HG11 VAL 537 89.603 -4.191 -3.499 605 HG12 VAL 537 HG12 VAL 537 89.595 -2.760 -4.527 606 HG13 VAL 537 HG13 VAL 537 89.671 -4.365 -5.252 607 HG21 VAL 537 HG21 VAL 537 87.330 -2.099 -3.288 608 HG22 VAL 537 HG22 VAL 537 87.672 -3.561 -2.363 609 HG23 VAL 537 HG23 VAL 537 86.112 -3.369 -3.164 610 H THR 538 H THR 538 89.037 -1.973 -7.139 611 HA THR 538 HA THR 538 88.827 -3.792 -9.393 612 HB THR 538 HB THR 538 90.079 -2.210 -10.595 613 HG1 THR 538 HG1 THR 538 91.231 -1.811 -8.098 614 HG21 THR 538 HG21 THR 538 87.901 -1.331 -9.572 615 HG22 THR 538 HG22 THR 538 89.052 -0.114 -10.126 616 HG23 THR 538 HG23 THR 538 88.918 -0.483 -8.407 617 HA PRO 539 HA PRO 539 92.453 -6.156 -8.439 618 HB2 PRO 539 HB2 PRO 539 93.615 -6.122 -11.111 619 HB3 PRO 539 HB3 PRO 539 92.667 -7.408 -10.345 620 HG2 PRO 539 HG2 PRO 539 91.786 -5.911 -12.468 621 HG3 PRO 539 HG3 PRO 539 90.716 -6.713 -11.305 622 HD2 PRO 539 HD2 PRO 539 91.548 -3.827 -11.423 623 HD3 PRO 539 HD3 PRO 539 89.960 -4.532 -11.059 624 H THR 540 H THR 540 94.694 -6.082 -7.987 625 HA THR 540 HA THR 540 95.931 -3.411 -8.287 626 HB THR 540 HB THR 540 95.698 -4.369 -5.996 627 HG1 THR 540 HG1 THR 540 98.241 -4.422 -5.843 628 HG21 THR 540 HG21 THR 540 96.802 -6.357 -5.352 629 HG22 THR 540 HG22 THR 540 97.786 -6.388 -6.816 630 HG23 THR 540 HG23 THR 540 96.065 -6.769 -6.901 631 H ASN 541 H ASN 541 97.712 -3.152 -9.553 632 HA ASN 541 HA ASN 541 99.452 -5.376 -10.188 633 HB2 ASN 541 HB2 ASN 541 99.133 -5.079 -12.671 634 HB3 ASN 541 HB3 ASN 541 97.775 -5.831 -11.832 635 HD21 ASN 541 HD21 ASN 541 97.877 -2.601 -10.941 636 HD22 ASN 541 HD22 ASN 541 96.753 -1.987 -12.058 637 H ASP 542 H ASP 542 100.853 -3.890 -9.078 638 HA ASP 542 HA ASP 542 101.432 -1.290 -10.118 639 HB2 ASP 542 HB2 ASP 542 102.977 -3.115 -8.264 640 HB3 ASP 542 HB3 ASP 542 103.439 -1.454 -8.628 641 H GLN 543 H GLN 543 103.053 -0.607 -11.468 642 HA GLN 543 HA GLN 543 104.484 -0.763 -13.277 643 HB2 GLN 543 HB2 GLN 543 105.967 -1.180 -11.337 644 HB3 GLN 543 HB3 GLN 543 105.677 -2.911 -11.503 645 HG2 GLN 543 HG2 GLN 543 106.616 -2.827 -13.799 646 HG3 GLN 543 HG3 GLN 543 106.950 -1.109 -13.580 647 HE21 GLN 543 HE21 GLN 543 109.210 -1.023 -13.368 648 HE22 GLN 543 HE22 GLN 543 110.099 -1.952 -12.260 Start of MODEL 15 1 H1 SER 466 H1 SER 466 36.348 1.256 -5.699 2 H2 SER 466 H2 SER 466 36.802 -0.226 -6.396 3 H3 SER 466 H3 SER 466 36.695 -0.075 -4.708 4 HA SER 466 HA SER 466 34.325 0.428 -6.374 5 HB2 SER 466 HB2 SER 466 33.746 -1.990 -6.068 6 HB3 SER 466 HB3 SER 466 35.128 -1.742 -7.131 7 HG SER 466 HG SER 466 36.385 -2.663 -5.700 8 H ASP 467 H ASP 467 34.274 -1.999 -3.995 9 HA ASP 467 HA ASP 467 32.685 -0.357 -2.197 10 HB2 ASP 467 HB2 ASP 467 33.521 -3.262 -2.183 11 HB3 ASP 467 HB3 ASP 467 32.524 -2.538 -0.925 12 H ASP 468 H ASP 468 33.166 -0.391 0.195 13 HA ASP 468 HA ASP 468 34.603 0.229 1.909 14 HB2 ASP 468 HB2 ASP 468 36.089 -2.043 0.581 15 HB3 ASP 468 HB3 ASP 468 36.609 -1.315 2.103 16 H TYR 469 H TYR 469 34.763 1.643 -0.554 17 HA TYR 469 HA TYR 469 37.412 2.212 -1.380 18 HB2 TYR 469 HB2 TYR 469 35.249 2.609 -2.601 19 HB3 TYR 469 HB3 TYR 469 34.984 3.984 -1.534 20 HD1 TYR 469 HD1 TYR 469 37.299 2.549 -4.065 21 HD2 TYR 469 HD2 TYR 469 36.079 6.046 -1.896 22 HE1 TYR 469 HE1 TYR 469 38.692 3.958 -5.553 23 HE2 TYR 469 HE2 TYR 469 37.472 7.455 -3.379 24 HH TYR 469 HH TYR 469 39.171 6.062 -6.166 25 H VAL 470 H VAL 470 38.641 4.136 -1.039 26 HA VAL 470 HA VAL 470 38.231 5.406 1.618 27 HB VAL 470 HB VAL 470 40.846 5.195 0.123 28 HG11 VAL 470 HG11 VAL 470 40.946 6.843 1.837 29 HG12 VAL 470 HG12 VAL 470 41.684 5.401 2.527 30 HG13 VAL 470 HG13 VAL 470 40.039 5.841 2.969 31 HG21 VAL 470 HG21 VAL 470 40.072 2.921 0.483 32 HG22 VAL 470 HG22 VAL 470 39.632 3.296 2.150 33 HG23 VAL 470 HG23 VAL 470 41.329 3.278 1.668 34 H ASP 471 H ASP 471 39.018 7.607 1.845 35 HA ASP 471 HA ASP 471 37.972 9.361 -0.106 36 HB2 ASP 471 HB2 ASP 471 39.760 9.767 2.290 37 HB3 ASP 471 HB3 ASP 471 39.333 11.110 1.231 38 H GLU 472 H GLU 472 38.921 10.636 -1.597 39 HA GLU 472 HA GLU 472 41.017 9.611 -3.133 40 HB2 GLU 472 HB2 GLU 472 39.821 12.394 -3.048 41 HB3 GLU 472 HB3 GLU 472 40.921 11.830 -4.303 42 HG2 GLU 472 HG2 GLU 472 38.834 11.414 -5.270 43 HG3 GLU 472 HG3 GLU 472 39.217 9.851 -4.558 44 H GLU 473 H GLU 473 41.051 12.250 -0.755 45 HA GLU 473 HA GLU 473 43.727 13.060 -1.226 46 HB2 GLU 473 HB2 GLU 473 42.569 14.672 -0.039 47 HB3 GLU 473 HB3 GLU 473 41.635 13.481 0.854 48 HG2 GLU 473 HG2 GLU 473 43.249 14.775 2.269 49 HG3 GLU 473 HG3 GLU 473 43.495 13.031 2.337 50 H THR 474 H THR 474 42.275 10.878 1.141 51 HA THR 474 HA THR 474 44.644 10.154 2.503 52 HB THR 474 HB THR 474 41.953 8.874 2.113 53 HG1 THR 474 HG1 THR 474 41.552 10.095 3.743 54 HG21 THR 474 HG21 THR 474 43.355 6.972 2.435 55 HG22 THR 474 HG22 THR 474 42.640 7.321 4.007 56 HG23 THR 474 HG23 THR 474 44.307 7.795 3.671 57 H TYR 475 H TYR 475 42.887 8.704 -0.166 58 HA TYR 475 HA TYR 475 44.431 6.392 -0.472 59 HB2 TYR 475 HB2 TYR 475 42.158 6.943 -1.452 60 HB3 TYR 475 HB3 TYR 475 43.012 7.893 -2.669 61 HD1 TYR 475 HD1 TYR 475 42.981 4.543 -1.077 62 HD2 TYR 475 HD2 TYR 475 43.800 6.831 -4.609 63 HE1 TYR 475 HE1 TYR 475 43.417 2.440 -2.332 64 HE2 TYR 475 HE2 TYR 475 44.254 4.735 -5.873 65 HH TYR 475 HH TYR 475 44.767 2.476 -5.554 66 H ASN 476 H ASN 476 44.706 9.554 -2.084 67 HA ASN 476 HA ASN 476 46.880 8.795 -3.750 68 HB2 ASN 476 HB2 ASN 476 46.234 11.567 -2.728 69 HB3 ASN 476 HB3 ASN 476 47.154 11.147 -4.177 70 HD21 ASN 476 HD21 ASN 476 44.963 8.800 -4.265 71 HD22 ASN 476 HD22 ASN 476 43.695 9.553 -5.107 72 H LEU 477 H LEU 477 46.578 10.017 -0.502 73 HA LEU 477 HA LEU 477 49.246 10.728 0.022 74 HB2 LEU 477 HB2 LEU 477 47.011 10.896 1.456 75 HB3 LEU 477 HB3 LEU 477 47.543 9.344 2.084 76 HG LEU 477 HG LEU 477 48.398 11.068 3.537 77 HD11 LEU 477 HD11 LEU 477 50.727 10.251 1.828 78 HD12 LEU 477 HD12 LEU 477 49.842 9.100 2.829 79 HD13 LEU 477 HD13 LEU 477 50.671 10.461 3.576 80 HD21 LEU 477 HD21 LEU 477 49.244 13.066 2.829 81 HD22 LEU 477 HD22 LEU 477 48.434 12.705 1.319 82 HD23 LEU 477 HD23 LEU 477 50.151 12.354 1.506 83 H GLN 478 H GLN 478 47.516 7.652 0.403 84 HA GLN 478 HA GLN 478 49.709 6.119 1.317 85 HB2 GLN 478 HB2 GLN 478 47.216 5.309 -0.197 86 HB3 GLN 478 HB3 GLN 478 48.312 4.175 0.595 87 HG2 GLN 478 HG2 GLN 478 46.863 6.437 1.990 88 HG3 GLN 478 HG3 GLN 478 46.328 4.760 1.998 89 HE21 GLN 478 HE21 GLN 478 47.727 6.842 4.014 90 HE22 GLN 478 HE22 GLN 478 48.835 5.835 4.815 91 H LYS 479 H LYS 479 48.452 6.846 -1.846 92 HA LYS 479 HA LYS 479 50.051 5.118 -3.412 93 HB2 LYS 479 HB2 LYS 479 47.908 6.440 -3.951 94 HB3 LYS 479 HB3 LYS 479 48.975 7.796 -4.290 95 HG2 LYS 479 HG2 LYS 479 50.159 6.484 -5.972 96 HG3 LYS 479 HG3 LYS 479 49.179 5.066 -5.599 97 HD2 LYS 479 HD2 LYS 479 48.017 7.706 -6.531 98 HD3 LYS 479 HD3 LYS 479 48.397 6.378 -7.624 99 HE2 LYS 479 HE2 LYS 479 46.904 4.954 -6.002 100 HE3 LYS 479 HE3 LYS 479 46.278 6.521 -5.491 101 HZ1 LYS 479 HZ1 LYS 479 45.024 5.497 -7.336 102 HZ2 LYS 479 HZ2 LYS 479 46.407 5.640 -8.314 103 HZ3 LYS 479 HZ3 LYS 479 45.648 7.031 -7.703 104 H LEU 480 H LEU 480 50.483 8.361 -2.215 105 HA LEU 480 HA LEU 480 52.721 9.088 -3.780 106 HB2 LEU 480 HB2 LEU 480 51.438 10.032 -1.232 107 HB3 LEU 480 HB3 LEU 480 52.982 10.712 -1.719 108 HG LEU 480 HG LEU 480 50.797 10.567 -3.774 109 HD11 LEU 480 HD11 LEU 480 49.511 11.604 -2.102 110 HD12 LEU 480 HD12 LEU 480 50.200 12.968 -2.974 111 HD13 LEU 480 HD13 LEU 480 50.894 12.467 -1.431 112 HD21 LEU 480 HD21 LEU 480 52.791 12.773 -3.232 113 HD22 LEU 480 HD22 LEU 480 51.954 12.404 -4.740 114 HD23 LEU 480 HD23 LEU 480 53.230 11.335 -4.157 115 H LEU 481 H LEU 481 52.570 8.122 -0.361 116 HA LEU 481 HA LEU 481 55.423 7.887 -0.104 117 HB2 LEU 481 HB2 LEU 481 54.861 7.182 2.181 118 HB3 LEU 481 HB3 LEU 481 53.969 8.622 1.706 119 HG LEU 481 HG LEU 481 52.106 6.959 0.926 120 HD11 LEU 481 HD11 LEU 481 52.331 4.965 2.800 121 HD12 LEU 481 HD12 LEU 481 53.994 5.126 2.258 122 HD13 LEU 481 HD13 LEU 481 52.718 4.800 1.096 123 HD21 LEU 481 HD21 LEU 481 51.016 7.133 3.020 124 HD22 LEU 481 HD22 LEU 481 52.088 8.528 2.945 125 HD23 LEU 481 HD23 LEU 481 52.536 7.119 3.908 126 H ALA 482 H ALA 482 53.116 5.870 -1.402 127 HA ALA 482 HA ALA 482 53.562 3.327 -0.496 128 HB1 ALA 482 HB1 ALA 482 52.601 4.542 -2.940 129 HB2 ALA 482 HB2 ALA 482 52.089 3.040 -2.193 130 HB3 ALA 482 HB3 ALA 482 53.454 3.051 -3.307 131 HA PRO 483 HA PRO 483 57.261 2.662 -3.730 132 HB2 PRO 483 HB2 PRO 483 58.627 5.204 -3.799 133 HB3 PRO 483 HB3 PRO 483 57.837 4.363 -5.140 134 HG2 PRO 483 HG2 PRO 483 56.801 6.520 -3.398 135 HG3 PRO 483 HG3 PRO 483 56.414 6.153 -5.088 136 HD2 PRO 483 HD2 PRO 483 54.657 5.630 -3.152 137 HD3 PRO 483 HD3 PRO 483 54.862 4.484 -4.493 138 H TYR 484 H TYR 484 57.690 5.302 -1.362 139 HA TYR 484 HA TYR 484 60.185 4.470 -0.338 140 HB2 TYR 484 HB2 TYR 484 59.747 6.645 0.295 141 HB3 TYR 484 HB3 TYR 484 58.025 6.347 0.520 142 HD1 TYR 484 HD1 TYR 484 61.380 5.776 2.070 143 HD2 TYR 484 HD2 TYR 484 57.134 5.871 2.680 144 HE1 TYR 484 HE1 TYR 484 61.729 5.529 4.511 145 HE2 TYR 484 HE2 TYR 484 57.480 5.624 5.119 146 HH TYR 484 HH TYR 484 59.749 4.486 6.548 147 H HIS 485 H HIS 485 56.883 3.785 0.685 148 HA HIS 485 HA HIS 485 57.463 2.296 3.008 149 HB2 HIS 485 HB2 HIS 485 55.234 3.209 2.297 150 HB3 HIS 485 HB3 HIS 485 55.134 1.902 1.125 151 HD1 HIS 485 HD1 HIS 485 54.130 2.705 4.442 152 HD2 HIS 485 HD2 HIS 485 55.548 -0.760 2.615 153 HE1 HIS 485 HE1 HIS 485 53.434 0.779 5.928 154 H LYS 486 H LYS 486 57.368 1.422 -0.384 155 HA LYS 486 HA LYS 486 57.647 -1.437 0.125 156 HB2 LYS 486 HB2 LYS 486 57.663 0.234 -2.402 157 HB3 LYS 486 HB3 LYS 486 57.731 -1.530 -2.379 158 HG2 LYS 486 HG2 LYS 486 55.576 -1.623 -1.218 159 HG3 LYS 486 HG3 LYS 486 55.518 0.137 -1.146 160 HD2 LYS 486 HD2 LYS 486 55.495 0.242 -3.611 161 HD3 LYS 486 HD3 LYS 486 55.538 -1.521 -3.685 162 HE2 LYS 486 HE2 LYS 486 53.365 0.140 -2.373 163 HE3 LYS 486 HE3 LYS 486 53.223 -0.703 -3.917 164 HZ1 LYS 486 HZ1 LYS 486 52.878 -1.727 -1.314 165 HZ2 LYS 486 HZ2 LYS 486 54.166 -2.542 -2.062 166 HZ3 LYS 486 HZ3 LYS 486 52.637 -2.509 -2.800 167 H ALA 487 H ALA 487 59.640 1.271 -0.202 168 HA ALA 487 HA ALA 487 61.971 0.173 -1.392 169 HB1 ALA 487 HB1 ALA 487 61.835 2.501 0.510 170 HB2 ALA 487 HB2 ALA 487 61.333 2.615 -1.173 171 HB3 ALA 487 HB3 ALA 487 63.006 2.226 -0.773 172 H LYS 488 H LYS 488 63.127 -1.396 -0.538 173 HA LYS 488 HA LYS 488 63.291 -1.804 2.362 174 HB2 LYS 488 HB2 LYS 488 64.322 -3.403 0.020 175 HB3 LYS 488 HB3 LYS 488 64.493 -3.885 1.710 176 HG2 LYS 488 HG2 LYS 488 62.038 -3.784 1.972 177 HG3 LYS 488 HG3 LYS 488 61.879 -3.368 0.269 178 HD2 LYS 488 HD2 LYS 488 63.257 -5.889 1.224 179 HD3 LYS 488 HD3 LYS 488 61.540 -5.826 0.837 180 HE2 LYS 488 HE2 LYS 488 62.255 -4.875 -1.446 181 HE3 LYS 488 HE3 LYS 488 63.882 -5.406 -1.024 182 HZ1 LYS 488 HZ1 LYS 488 62.014 -7.447 -0.469 183 HZ2 LYS 488 HZ2 LYS 488 63.353 -7.480 -1.514 184 HZ3 LYS 488 HZ3 LYS 488 61.842 -6.942 -2.079 185 H THR 489 H THR 489 65.047 -0.164 -0.002 186 HA THR 489 HA THR 489 67.639 -0.467 1.407 187 HB THR 489 HB THR 489 68.362 0.891 -0.743 188 HG1 THR 489 HG1 THR 489 65.750 0.551 -1.077 189 HG21 THR 489 HG21 THR 489 67.485 -2.010 -0.780 190 HG22 THR 489 HG22 THR 489 69.081 -1.391 -0.352 191 HG23 THR 489 HG23 THR 489 68.502 -1.263 -2.013 192 H LEU 490 H LEU 490 68.519 1.180 2.502 193 HA LEU 490 HA LEU 490 67.006 3.386 3.342 194 HB2 LEU 490 HB2 LEU 490 69.929 2.672 3.442 195 HB3 LEU 490 HB3 LEU 490 69.368 4.226 4.055 196 HG LEU 490 HG LEU 490 67.761 3.038 5.524 197 HD11 LEU 490 HD11 LEU 490 67.336 1.002 4.398 198 HD12 LEU 490 HD12 LEU 490 68.264 0.528 5.819 199 HD13 LEU 490 HD13 LEU 490 69.052 0.630 4.245 200 HD21 LEU 490 HD21 LEU 490 69.466 2.098 7.084 201 HD22 LEU 490 HD22 LEU 490 69.959 3.656 6.421 202 HD23 LEU 490 HD23 LEU 490 70.657 2.167 5.785 203 H GLU 491 H GLU 491 69.586 3.160 0.929 204 HA GLU 491 HA GLU 491 69.784 5.858 0.186 205 HB2 GLU 491 HB2 GLU 491 71.428 4.265 -0.535 206 HB3 GLU 491 HB3 GLU 491 70.201 3.300 -1.353 207 HG2 GLU 491 HG2 GLU 491 69.848 4.999 -3.006 208 HG3 GLU 491 HG3 GLU 491 70.838 6.156 -2.112 209 H ARG 492 H ARG 492 67.583 3.364 -0.811 210 HA ARG 492 HA ARG 492 66.346 4.832 -2.929 211 HB2 ARG 492 HB2 ARG 492 66.312 2.365 -2.767 212 HB3 ARG 492 HB3 ARG 492 65.331 2.486 -1.310 213 HG2 ARG 492 HG2 ARG 492 63.707 2.125 -2.953 214 HG3 ARG 492 HG3 ARG 492 63.694 3.879 -2.834 215 HD2 ARG 492 HD2 ARG 492 65.163 4.045 -4.781 216 HD3 ARG 492 HD3 ARG 492 65.285 2.287 -4.862 217 HE ARG 492 HE ARG 492 62.566 2.943 -4.923 218 HH11 ARG 492 HH11 ARG 492 64.165 5.033 -6.699 219 HH12 ARG 492 HH12 ARG 492 63.868 4.346 -8.261 220 HH21 ARG 492 HH21 ARG 492 62.729 1.321 -6.991 221 HH22 ARG 492 HH22 ARG 492 63.051 2.233 -8.427 222 H GLN 493 H GLN 493 65.589 4.258 0.477 223 HA GLN 493 HA GLN 493 63.065 5.449 0.548 224 HB2 GLN 493 HB2 GLN 493 65.226 5.212 2.641 225 HB3 GLN 493 HB3 GLN 493 63.622 5.854 2.996 226 HG2 GLN 493 HG2 GLN 493 62.580 3.784 2.295 227 HG3 GLN 493 HG3 GLN 493 64.120 3.142 1.747 228 HE21 GLN 493 HE21 GLN 493 64.622 1.493 3.217 229 HE22 GLN 493 HE22 GLN 493 64.584 1.670 4.904 230 H VAL 494 H VAL 494 66.266 6.877 1.022 231 HA VAL 494 HA VAL 494 65.425 9.509 1.599 232 HB VAL 494 HB VAL 494 67.945 8.440 0.311 233 HG11 VAL 494 HG11 VAL 494 68.937 10.637 1.042 234 HG12 VAL 494 HG12 VAL 494 67.300 11.207 1.365 235 HG13 VAL 494 HG13 VAL 494 67.777 10.783 -0.279 236 HG21 VAL 494 HG21 VAL 494 67.160 9.197 3.133 237 HG22 VAL 494 HG22 VAL 494 68.832 8.931 2.639 238 HG23 VAL 494 HG23 VAL 494 67.664 7.612 2.546 239 H TYR 495 H TYR 495 66.276 7.916 -1.445 240 HA TYR 495 HA TYR 495 65.966 10.092 -3.188 241 HB2 TYR 495 HB2 TYR 495 67.031 8.051 -3.886 242 HB3 TYR 495 HB3 TYR 495 65.565 7.128 -3.579 243 HD1 TYR 495 HD1 TYR 495 66.970 9.868 -5.683 244 HD2 TYR 495 HD2 TYR 495 63.913 6.881 -5.252 245 HE1 TYR 495 HE1 TYR 495 66.241 10.276 -8.019 246 HE2 TYR 495 HE2 TYR 495 63.187 7.287 -7.588 247 HH TYR 495 HH TYR 495 63.494 8.480 -9.423 248 H GLU 496 H GLU 496 63.574 7.632 -2.199 249 HA GLU 496 HA GLU 496 61.443 8.632 -3.770 250 HB2 GLU 496 HB2 GLU 496 61.462 7.017 -1.225 251 HB3 GLU 496 HB3 GLU 496 60.016 7.305 -2.197 252 HG2 GLU 496 HG2 GLU 496 62.561 6.035 -3.236 253 HG3 GLU 496 HG3 GLU 496 61.144 5.125 -2.721 254 H LEU 497 H LEU 497 62.465 9.266 -0.470 255 HA LEU 497 HA LEU 497 60.329 10.949 0.264 256 HB2 LEU 497 HB2 LEU 497 63.156 10.650 1.217 257 HB3 LEU 497 HB3 LEU 497 62.055 11.809 1.965 258 HG LEU 497 HG LEU 497 61.467 8.850 1.642 259 HD11 LEU 497 HD11 LEU 497 62.147 8.471 3.857 260 HD12 LEU 497 HD12 LEU 497 62.156 10.188 4.246 261 HD13 LEU 497 HD13 LEU 497 63.418 9.511 3.216 262 HD21 LEU 497 HD21 LEU 497 59.366 9.720 1.965 263 HD22 LEU 497 HD22 LEU 497 59.962 11.192 2.729 264 HD23 LEU 497 HD23 LEU 497 59.856 9.697 3.656 265 H GLU 498 H GLU 498 63.437 11.596 -1.258 266 HA GLU 498 HA GLU 498 63.375 14.399 -1.210 267 HB2 GLU 498 HB2 GLU 498 64.604 12.367 -3.060 268 HB3 GLU 498 HB3 GLU 498 64.788 14.094 -3.370 269 HG2 GLU 498 HG2 GLU 498 65.860 14.432 -1.246 270 HG3 GLU 498 HG3 GLU 498 65.486 12.796 -0.727 271 H LYS 499 H LYS 499 62.121 12.116 -3.614 272 HA LYS 499 HA LYS 499 61.103 14.084 -5.417 273 HB2 LYS 499 HB2 LYS 499 60.917 11.137 -5.020 274 HB3 LYS 499 HB3 LYS 499 59.612 11.865 -5.955 275 HG2 LYS 499 HG2 LYS 499 61.426 11.151 -7.438 276 HG3 LYS 499 HG3 LYS 499 61.290 12.909 -7.450 277 HD2 LYS 499 HD2 LYS 499 63.146 13.094 -5.866 278 HD3 LYS 499 HD3 LYS 499 63.251 11.336 -5.762 279 HE2 LYS 499 HE2 LYS 499 64.932 12.118 -7.326 280 HE3 LYS 499 HE3 LYS 499 63.672 11.266 -8.220 281 HZ1 LYS 499 HZ1 LYS 499 63.295 14.126 -7.822 282 HZ2 LYS 499 HZ2 LYS 499 62.924 13.158 -9.168 283 HZ3 LYS 499 HZ3 LYS 499 64.521 13.672 -8.902 284 H LEU 500 H LEU 500 59.640 12.150 -2.861 285 HA LEU 500 HA LEU 500 56.988 13.005 -3.176 286 HB2 LEU 500 HB2 LEU 500 58.596 11.866 -0.924 287 HB3 LEU 500 HB3 LEU 500 56.921 12.330 -0.656 288 HG LEU 500 HG LEU 500 57.638 10.599 -3.022 289 HD11 LEU 500 HD11 LEU 500 58.664 9.481 -1.095 290 HD12 LEU 500 HD12 LEU 500 57.241 8.593 -1.631 291 HD13 LEU 500 HD13 LEU 500 57.155 9.611 -0.193 292 HD21 LEU 500 HD21 LEU 500 55.375 10.228 -3.139 293 HD22 LEU 500 HD22 LEU 500 55.279 11.745 -2.256 294 HD23 LEU 500 HD23 LEU 500 55.177 10.215 -1.391 295 H GLN 501 H GLN 501 59.593 14.271 -1.161 296 HA GLN 501 HA GLN 501 58.294 16.130 0.373 297 HB2 GLN 501 HB2 GLN 501 60.986 16.062 -0.956 298 HB3 GLN 501 HB3 GLN 501 60.508 17.520 -0.088 299 HG2 GLN 501 HG2 GLN 501 60.378 14.754 1.139 300 HG3 GLN 501 HG3 GLN 501 61.781 15.809 1.299 301 HE21 GLN 501 HE21 GLN 501 59.177 14.882 3.024 302 HE22 GLN 501 HE22 GLN 501 58.840 16.315 3.866 303 H GLU 502 H GLU 502 58.944 16.298 -3.056 304 HA GLU 502 HA GLU 502 58.183 19.098 -3.285 305 HB2 GLU 502 HB2 GLU 502 58.472 17.220 -5.618 306 HB3 GLU 502 HB3 GLU 502 58.915 18.928 -5.496 307 HG2 GLU 502 HG2 GLU 502 60.645 18.234 -3.786 308 HG3 GLU 502 HG3 GLU 502 60.284 16.566 -4.217 309 H LYS 503 H LYS 503 56.748 15.970 -3.620 310 HA LYS 503 HA LYS 503 54.377 17.067 -4.974 311 HB2 LYS 503 HB2 LYS 503 55.354 14.281 -4.397 312 HB3 LYS 503 HB3 LYS 503 53.825 14.634 -5.214 313 HG2 LYS 503 HG2 LYS 503 54.946 15.755 -7.006 314 HG3 LYS 503 HG3 LYS 503 56.482 15.745 -6.142 315 HD2 LYS 503 HD2 LYS 503 56.610 13.993 -7.761 316 HD3 LYS 503 HD3 LYS 503 56.376 13.210 -6.199 317 HE2 LYS 503 HE2 LYS 503 54.083 12.772 -6.644 318 HE3 LYS 503 HE3 LYS 503 54.052 13.885 -8.014 319 HZ1 LYS 503 HZ1 LYS 503 55.149 11.181 -7.841 320 HZ2 LYS 503 HZ2 LYS 503 55.946 12.294 -8.845 321 HZ3 LYS 503 HZ3 LYS 503 54.309 11.928 -9.112 322 H LEU 504 H LEU 504 55.322 15.480 -1.995 323 HA LEU 504 HA LEU 504 52.801 14.877 -1.000 324 HB2 LEU 504 HB2 LEU 504 55.403 14.533 -0.158 325 HB3 LEU 504 HB3 LEU 504 54.749 15.616 1.059 326 HG LEU 504 HG LEU 504 52.769 13.964 1.188 327 HD11 LEU 504 HD11 LEU 504 53.030 11.786 0.344 328 HD12 LEU 504 HD12 LEU 504 54.755 11.995 0.067 329 HD13 LEU 504 HD13 LEU 504 53.597 12.795 -0.982 330 HD21 LEU 504 HD21 LEU 504 53.919 12.603 2.805 331 HD22 LEU 504 HD22 LEU 504 54.681 14.192 2.856 332 HD23 LEU 504 HD23 LEU 504 55.466 12.867 2.004 333 HA PRO 505 HA PRO 505 51.115 19.099 -0.540 334 HB2 PRO 505 HB2 PRO 505 49.510 18.071 1.660 335 HB3 PRO 505 HB3 PRO 505 48.979 18.495 0.026 336 HG2 PRO 505 HG2 PRO 505 49.833 15.846 1.085 337 HG3 PRO 505 HG3 PRO 505 48.625 16.222 -0.154 338 HD2 PRO 505 HD2 PRO 505 50.892 15.217 -0.892 339 HD3 PRO 505 HD3 PRO 505 50.310 16.640 -1.777 340 H GLU 506 H GLU 506 51.516 20.735 0.869 341 HA GLU 506 HA GLU 506 53.759 20.927 2.324 342 HB2 GLU 506 HB2 GLU 506 51.124 22.299 2.846 343 HB3 GLU 506 HB3 GLU 506 52.649 22.797 3.582 344 HG2 GLU 506 HG2 GLU 506 53.634 23.178 1.394 345 HG3 GLU 506 HG3 GLU 506 52.194 22.548 0.597 346 H LYS 507 H LYS 507 50.656 20.533 4.055 347 HA LYS 507 HA LYS 507 51.660 20.167 6.598 348 HB2 LYS 507 HB2 LYS 507 49.550 19.125 7.133 349 HB3 LYS 507 HB3 LYS 507 49.247 20.376 5.925 350 HG2 LYS 507 HG2 LYS 507 49.467 18.548 4.159 351 HG3 LYS 507 HG3 LYS 507 49.421 17.393 5.491 352 HD2 LYS 507 HD2 LYS 507 47.282 19.459 4.910 353 HD3 LYS 507 HD3 LYS 507 47.169 17.745 4.521 354 HE2 LYS 507 HE2 LYS 507 46.072 17.801 6.576 355 HE3 LYS 507 HE3 LYS 507 47.716 17.445 7.102 356 HZ1 LYS 507 HZ1 LYS 507 47.265 19.225 8.415 357 HZ2 LYS 507 HZ2 LYS 507 46.189 19.931 7.306 358 HZ3 LYS 507 HZ3 LYS 507 47.865 20.054 7.064 359 H TYR 508 H TYR 508 51.608 17.884 3.980 360 HA TYR 508 HA TYR 508 52.421 15.652 5.712 361 HB2 TYR 508 HB2 TYR 508 51.712 15.950 2.795 362 HB3 TYR 508 HB3 TYR 508 52.468 14.484 3.412 363 HD1 TYR 508 HD1 TYR 508 51.393 13.228 5.274 364 HD2 TYR 508 HD2 TYR 508 49.386 16.348 3.145 365 HE1 TYR 508 HE1 TYR 508 49.217 12.384 6.096 366 HE2 TYR 508 HE2 TYR 508 47.198 15.499 3.939 367 HH TYR 508 HH TYR 508 46.856 12.457 5.461 368 H LYS 509 H LYS 509 53.702 18.001 3.514 369 HA LYS 509 HA LYS 509 56.130 16.750 2.823 370 HB2 LYS 509 HB2 LYS 509 55.215 18.811 1.779 371 HB3 LYS 509 HB3 LYS 509 55.559 19.683 3.267 372 HG2 LYS 509 HG2 LYS 509 57.941 19.222 3.025 373 HG3 LYS 509 HG3 LYS 509 57.623 18.291 1.557 374 HD2 LYS 509 HD2 LYS 509 56.619 20.281 0.510 375 HD3 LYS 509 HD3 LYS 509 56.953 21.216 1.965 376 HE2 LYS 509 HE2 LYS 509 59.364 20.831 1.669 377 HE3 LYS 509 HE3 LYS 509 59.040 19.880 0.220 378 HZ1 LYS 509 HZ1 LYS 509 58.077 22.660 0.509 379 HZ2 LYS 509 HZ2 LYS 509 58.238 21.742 -0.911 380 HZ3 LYS 509 HZ3 LYS 509 59.620 22.314 -0.104 381 H ALA 510 H ALA 510 55.293 18.960 5.481 382 HA ALA 510 HA ALA 510 57.783 19.144 6.724 383 HB1 ALA 510 HB1 ALA 510 56.175 20.598 7.590 384 HB2 ALA 510 HB2 ALA 510 56.287 19.388 8.871 385 HB3 ALA 510 HB3 ALA 510 54.958 19.327 7.712 386 H GLU 511 H GLU 511 55.120 16.921 7.540 387 HA GLU 511 HA GLU 511 56.475 15.442 9.511 388 HB2 GLU 511 HB2 GLU 511 54.047 15.333 9.045 389 HB3 GLU 511 HB3 GLU 511 54.380 14.484 7.542 390 HG2 GLU 511 HG2 GLU 511 53.803 12.817 9.169 391 HG3 GLU 511 HG3 GLU 511 55.545 12.693 8.929 392 H TYR 512 H TYR 512 56.362 14.912 6.006 393 HA TYR 512 HA TYR 512 57.943 12.497 6.134 394 HB2 TYR 512 HB2 TYR 512 56.731 14.205 3.991 395 HB3 TYR 512 HB3 TYR 512 57.980 13.042 3.536 396 HD1 TYR 512 HD1 TYR 512 54.870 13.291 5.615 397 HD2 TYR 512 HD2 TYR 512 57.365 10.830 3.144 398 HE1 TYR 512 HE1 TYR 512 53.242 11.442 5.821 399 HE2 TYR 512 HE2 TYR 512 55.744 8.976 3.360 400 HH TYR 512 HH TYR 512 53.969 8.235 4.630 401 H LYS 513 H LYS 513 58.602 15.896 5.696 402 HA LYS 513 HA LYS 513 61.246 15.612 4.660 403 HB2 LYS 513 HB2 LYS 513 59.778 17.693 4.724 404 HB3 LYS 513 HB3 LYS 513 60.250 17.849 6.411 405 HG2 LYS 513 HG2 LYS 513 62.655 17.752 5.618 406 HG3 LYS 513 HG3 LYS 513 62.034 17.898 3.972 407 HD2 LYS 513 HD2 LYS 513 61.413 19.864 6.191 408 HD3 LYS 513 HD3 LYS 513 62.693 20.089 5.000 409 HE2 LYS 513 HE2 LYS 513 60.897 19.821 3.206 410 HE3 LYS 513 HE3 LYS 513 59.708 19.951 4.501 411 HZ1 LYS 513 HZ1 LYS 513 60.335 22.079 3.333 412 HZ2 LYS 513 HZ2 LYS 513 61.837 21.962 4.118 413 HZ3 LYS 513 HZ3 LYS 513 60.409 22.097 5.027 414 H LYS 514 H LYS 514 59.753 15.560 7.802 415 HA LYS 514 HA LYS 514 62.078 15.700 9.421 416 HB2 LYS 514 HB2 LYS 514 59.588 15.896 10.069 417 HB3 LYS 514 HB3 LYS 514 59.578 14.135 10.050 418 HG2 LYS 514 HG2 LYS 514 61.121 13.985 11.836 419 HG3 LYS 514 HG3 LYS 514 61.609 15.673 11.670 420 HD2 LYS 514 HD2 LYS 514 60.045 15.220 13.614 421 HD3 LYS 514 HD3 LYS 514 59.491 16.458 12.488 422 HE2 LYS 514 HE2 LYS 514 57.877 15.049 11.524 423 HE3 LYS 514 HE3 LYS 514 58.640 13.586 12.158 424 HZ1 LYS 514 HZ1 LYS 514 57.774 15.575 14.103 425 HZ2 LYS 514 HZ2 LYS 514 57.732 13.879 14.194 426 HZ3 LYS 514 HZ3 LYS 514 56.546 14.717 13.308 427 H LYS 515 H LYS 515 60.248 13.079 7.951 428 HA LYS 515 HA LYS 515 61.760 10.884 8.928 429 HB2 LYS 515 HB2 LYS 515 60.171 11.183 6.369 430 HB3 LYS 515 HB3 LYS 515 60.765 9.657 7.014 431 HG2 LYS 515 HG2 LYS 515 59.437 9.969 9.047 432 HG3 LYS 515 HG3 LYS 515 58.888 11.539 8.474 433 HD2 LYS 515 HD2 LYS 515 57.093 10.209 7.826 434 HD3 LYS 515 HD3 LYS 515 58.073 10.146 6.359 435 HE2 LYS 515 HE2 LYS 515 57.369 7.897 6.959 436 HE3 LYS 515 HE3 LYS 515 59.109 8.042 7.198 437 HZ1 LYS 515 HZ1 LYS 515 57.443 7.112 9.061 438 HZ2 LYS 515 HZ2 LYS 515 57.471 8.759 9.478 439 HZ3 LYS 515 HZ3 LYS 515 58.919 7.871 9.418 440 H LEU 516 H LEU 516 61.991 12.888 6.038 441 HA LEU 516 HA LEU 516 63.983 11.538 4.610 442 HB2 LEU 516 HB2 LEU 516 62.769 13.378 3.626 443 HB3 LEU 516 HB3 LEU 516 63.313 14.467 4.881 444 HG LEU 516 HG LEU 516 65.610 14.330 4.069 445 HD11 LEU 516 HD11 LEU 516 65.867 13.150 1.772 446 HD12 LEU 516 HD12 LEU 516 64.397 12.291 2.220 447 HD13 LEU 516 HD13 LEU 516 65.841 12.142 3.221 448 HD21 LEU 516 HD21 LEU 516 63.808 14.801 1.704 449 HD22 LEU 516 HD22 LEU 516 65.310 15.630 2.103 450 HD23 LEU 516 HD23 LEU 516 63.859 15.917 3.072 451 H ASP 517 H ASP 517 64.277 14.146 6.979 452 HA ASP 517 HA ASP 517 67.071 14.329 7.048 453 HB2 ASP 517 HB2 ASP 517 64.928 14.889 9.096 454 HB3 ASP 517 HB3 ASP 517 66.628 15.270 9.370 455 H GLN 518 H GLN 518 64.843 12.455 9.070 456 HA GLN 518 HA GLN 518 66.836 11.239 10.687 457 HB2 GLN 518 HB2 GLN 518 64.018 10.405 10.011 458 HB3 GLN 518 HB3 GLN 518 65.019 9.619 11.238 459 HG2 GLN 518 HG2 GLN 518 65.221 11.689 12.475 460 HG3 GLN 518 HG3 GLN 518 64.380 12.578 11.205 461 HE21 GLN 518 HE21 GLN 518 62.848 9.657 11.291 462 HE22 GLN 518 HE22 GLN 518 61.613 10.013 12.401 463 H THR 519 H THR 519 65.329 10.272 7.663 464 HA THR 519 HA THR 519 66.350 7.635 7.534 465 HB THR 519 HB THR 519 65.687 9.520 5.258 466 HG1 THR 519 HG1 THR 519 63.661 8.075 5.597 467 HG21 THR 519 HG21 THR 519 65.424 6.512 5.350 468 HG22 THR 519 HG22 THR 519 66.864 7.320 4.732 469 HG23 THR 519 HG23 THR 519 65.309 7.567 3.943 470 H ARG 520 H ARG 520 67.553 10.732 6.358 471 HA ARG 520 HA ARG 520 69.846 9.813 5.000 472 HB2 ARG 520 HB2 ARG 520 69.108 12.422 6.320 473 HB3 ARG 520 HB3 ARG 520 70.640 12.207 5.465 474 HG2 ARG 520 HG2 ARG 520 69.462 11.591 3.436 475 HG3 ARG 520 HG3 ARG 520 67.916 11.654 4.270 476 HD2 ARG 520 HD2 ARG 520 68.213 14.057 4.667 477 HD3 ARG 520 HD3 ARG 520 69.784 14.003 3.864 478 HE ARG 520 HE ARG 520 67.635 12.983 2.231 479 HH11 ARG 520 HH11 ARG 520 67.332 15.961 3.345 480 HH12 ARG 520 HH12 ARG 520 67.815 16.823 1.924 481 HH21 ARG 520 HH21 ARG 520 69.137 14.020 0.361 482 HH22 ARG 520 HH22 ARG 520 68.841 15.721 0.227 483 H VAL 521 H VAL 521 69.255 10.626 8.356 484 HA VAL 521 HA VAL 521 71.919 10.614 9.287 485 HB VAL 521 HB VAL 521 69.280 10.022 10.625 486 HG11 VAL 521 HG11 VAL 521 72.042 10.265 11.824 487 HG12 VAL 521 HG12 VAL 521 70.902 8.930 11.996 488 HG13 VAL 521 HG13 VAL 521 70.566 10.482 12.764 489 HG21 VAL 521 HG21 VAL 521 69.268 12.273 11.258 490 HG22 VAL 521 HG22 VAL 521 69.962 12.355 9.640 491 HG23 VAL 521 HG23 VAL 521 71.012 12.442 11.053 492 H GLU 522 H GLU 522 69.473 8.051 9.123 493 HA GLU 522 HA GLU 522 71.002 5.994 10.316 494 HB2 GLU 522 HB2 GLU 522 68.786 5.866 8.256 495 HB3 GLU 522 HB3 GLU 522 69.383 4.484 9.180 496 HG2 GLU 522 HG2 GLU 522 68.777 5.604 11.273 497 HG3 GLU 522 HG3 GLU 522 68.223 7.013 10.372 498 H LEU 523 H LEU 523 70.504 6.920 6.956 499 HA LEU 523 HA LEU 523 72.079 4.914 5.743 500 HB2 LEU 523 HB2 LEU 523 70.411 6.234 4.556 501 HB3 LEU 523 HB3 LEU 523 71.346 7.698 4.828 502 HG LEU 523 HG LEU 523 72.945 5.538 3.574 503 HD11 LEU 523 HD11 LEU 523 70.459 6.611 2.236 504 HD12 LEU 523 HD12 LEU 523 70.959 4.927 2.409 505 HD13 LEU 523 HD13 LEU 523 71.829 6.000 1.310 506 HD21 LEU 523 HD21 LEU 523 72.331 8.342 2.591 507 HD22 LEU 523 HD22 LEU 523 73.739 7.353 2.214 508 HD23 LEU 523 HD23 LEU 523 73.536 8.012 3.837 509 H ALA 524 H ALA 524 72.843 8.208 6.807 510 HA ALA 524 HA ALA 524 75.434 8.374 5.727 511 HB1 ALA 524 HB1 ALA 524 74.479 10.396 6.476 512 HB2 ALA 524 HB2 ALA 524 75.745 10.066 7.658 513 HB3 ALA 524 HB3 ALA 524 74.063 9.710 8.047 514 H ASP 525 H ASP 525 74.253 7.156 8.808 515 HA ASP 525 HA ASP 525 76.788 6.694 10.013 516 HB2 ASP 525 HB2 ASP 525 73.964 5.774 10.459 517 HB3 ASP 525 HB3 ASP 525 75.266 4.973 11.335 518 H GLN 526 H GLN 526 74.654 4.789 7.982 519 HA GLN 526 HA GLN 526 76.032 2.306 8.154 520 HB2 GLN 526 HB2 GLN 526 73.692 2.605 7.351 521 HB3 GLN 526 HB3 GLN 526 74.319 3.405 5.915 522 HG2 GLN 526 HG2 GLN 526 75.593 1.341 5.357 523 HG3 GLN 526 HG3 GLN 526 74.863 0.547 6.755 524 HE21 GLN 526 HE21 GLN 526 72.940 -0.543 6.318 525 HE22 GLN 526 HE22 GLN 526 71.917 -0.216 5.006 526 H VAL 527 H VAL 527 76.231 5.066 5.992 527 HA VAL 527 HA VAL 527 78.123 3.969 4.156 528 HB VAL 527 HB VAL 527 77.253 6.792 4.794 529 HG11 VAL 527 HG11 VAL 527 78.312 7.313 2.540 530 HG12 VAL 527 HG12 VAL 527 79.123 5.750 2.650 531 HG13 VAL 527 HG13 VAL 527 79.453 7.003 3.848 532 HG21 VAL 527 HG21 VAL 527 76.704 5.112 2.345 533 HG22 VAL 527 HG22 VAL 527 75.873 6.580 2.866 534 HG23 VAL 527 HG23 VAL 527 75.654 5.077 3.762 535 H LYS 528 H LYS 528 78.356 6.055 6.980 536 HA LYS 528 HA LYS 528 81.142 6.585 6.835 537 HB2 LYS 528 HB2 LYS 528 79.516 7.916 8.114 538 HB3 LYS 528 HB3 LYS 528 79.296 6.558 9.215 539 HG2 LYS 528 HG2 LYS 528 81.712 6.637 9.780 540 HG3 LYS 528 HG3 LYS 528 81.891 8.043 8.726 541 HD2 LYS 528 HD2 LYS 528 79.940 7.927 11.031 542 HD3 LYS 528 HD3 LYS 528 81.572 8.570 11.185 543 HE2 LYS 528 HE2 LYS 528 80.928 10.096 9.176 544 HE3 LYS 528 HE3 LYS 528 79.266 9.659 9.576 545 HZ1 LYS 528 HZ1 LYS 528 81.243 11.031 11.294 546 HZ2 LYS 528 HZ2 LYS 528 79.823 10.334 11.913 547 HZ3 LYS 528 HZ3 LYS 528 79.729 11.600 10.782 548 H SER 529 H SER 529 79.240 4.191 8.635 549 HA SER 529 HA SER 529 81.559 3.063 9.908 550 HB2 SER 529 HB2 SER 529 78.692 2.128 9.672 551 HB3 SER 529 HB3 SER 529 79.914 1.280 10.617 552 HG SER 529 HG SER 529 80.210 3.269 11.765 553 H ALA 530 H ALA 530 80.170 2.777 6.857 554 HA ALA 530 HA ALA 530 80.800 0.015 6.324 555 HB1 ALA 530 HB1 ALA 530 80.413 0.887 3.889 556 HB2 ALA 530 HB2 ALA 530 79.873 2.360 4.695 557 HB3 ALA 530 HB3 ALA 530 79.047 0.833 5.003 558 H VAL 531 H VAL 531 82.794 2.342 7.053 559 HA VAL 531 HA VAL 531 84.714 2.231 4.872 560 HB VAL 531 HB VAL 531 84.776 3.459 7.634 561 HG11 VAL 531 HG11 VAL 531 86.621 4.020 5.305 562 HG12 VAL 531 HG12 VAL 531 87.067 3.015 6.682 563 HG13 VAL 531 HG13 VAL 531 86.709 4.722 6.912 564 HG21 VAL 531 HG21 VAL 531 84.446 4.799 4.950 565 HG22 VAL 531 HG22 VAL 531 84.204 5.512 6.543 566 HG23 VAL 531 HG23 VAL 531 83.078 4.294 5.943 567 H THR 532 H THR 532 86.085 0.533 4.645 568 HA THR 532 HA THR 532 87.459 -0.534 6.969 569 HB THR 532 HB THR 532 85.557 -1.899 7.173 570 HG1 THR 532 HG1 THR 532 86.788 -3.564 7.259 571 HG21 THR 532 HG21 THR 532 84.745 -3.230 5.114 572 HG22 THR 532 HG22 THR 532 85.617 -2.028 4.163 573 HG23 THR 532 HG23 THR 532 84.304 -1.527 5.221 574 H GLU 533 H GLU 533 87.213 -2.769 4.389 575 HA GLU 533 HA GLU 533 89.968 -2.148 3.585 576 HB2 GLU 533 HB2 GLU 533 88.163 -4.505 3.042 577 HB3 GLU 533 HB3 GLU 533 89.817 -4.360 2.442 578 HG2 GLU 533 HG2 GLU 533 90.678 -4.226 4.709 579 HG3 GLU 533 HG3 GLU 533 89.043 -4.213 5.367 580 H PHE 534 H PHE 534 90.303 -0.885 1.918 581 HA PHE 534 HA PHE 534 88.256 -0.583 -0.181 582 HB2 PHE 534 HB2 PHE 534 90.692 1.020 0.604 583 HB3 PHE 534 HB3 PHE 534 89.761 1.345 -0.859 584 HD1 PHE 534 HD1 PHE 534 89.641 1.261 2.847 585 HD2 PHE 534 HD2 PHE 534 87.557 2.328 -0.753 586 HE1 PHE 534 HE1 PHE 534 87.990 2.529 4.180 587 HE2 PHE 534 HE2 PHE 534 85.900 3.599 0.583 588 HZ PHE 534 HZ PHE 534 86.115 3.703 3.048 589 H GLU 535 H GLU 535 88.650 -0.956 -2.314 590 HA GLU 535 HA GLU 535 90.417 -3.029 -3.047 591 HB2 GLU 535 HB2 GLU 535 88.964 -0.969 -4.719 592 HB3 GLU 535 HB3 GLU 535 89.787 -2.379 -5.384 593 HG2 GLU 535 HG2 GLU 535 88.330 -3.875 -4.140 594 HG3 GLU 535 HG3 GLU 535 87.573 -2.512 -3.318 595 H ASN 536 H ASN 536 92.497 -3.039 -3.746 596 HA ASN 536 HA ASN 536 94.625 -2.259 -4.206 597 HB2 ASN 536 HB2 ASN 536 93.458 -1.730 -6.319 598 HB3 ASN 536 HB3 ASN 536 93.043 -0.144 -5.681 599 HD21 ASN 536 HD21 ASN 536 96.103 -2.087 -5.786 600 HD22 ASN 536 HD22 ASN 536 97.041 -0.818 -6.412 601 H VAL 537 H VAL 537 94.483 -1.636 -1.748 602 HA VAL 537 HA VAL 537 94.239 1.100 -1.035 603 HB VAL 537 HB VAL 537 95.209 0.402 1.077 604 HG11 VAL 537 HG11 VAL 537 92.858 -0.212 0.531 605 HG12 VAL 537 HG12 VAL 537 93.614 -1.342 1.655 606 HG13 VAL 537 HG13 VAL 537 93.442 -1.771 -0.047 607 HG21 VAL 537 HG21 VAL 537 95.976 -1.996 1.308 608 HG22 VAL 537 HG22 VAL 537 97.042 -0.984 0.332 609 HG23 VAL 537 HG23 VAL 537 95.932 -2.109 -0.452 610 H THR 538 H THR 538 95.693 2.708 -0.996 611 HA THR 538 HA THR 538 98.250 2.274 -2.349 612 HB THR 538 HB THR 538 98.237 4.893 -2.115 613 HG1 THR 538 HG1 THR 538 96.628 5.559 -0.986 614 HG21 THR 538 HG21 THR 538 96.118 3.467 -3.747 615 HG22 THR 538 HG22 THR 538 97.807 3.654 -4.219 616 HG23 THR 538 HG23 THR 538 96.769 5.072 -4.073 617 HA PRO 539 HA PRO 539 101.159 2.489 0.991 618 HB2 PRO 539 HB2 PRO 539 102.257 5.115 0.383 619 HB3 PRO 539 HB3 PRO 539 102.951 3.525 0.010 620 HG2 PRO 539 HG2 PRO 539 101.317 5.313 -1.696 621 HG3 PRO 539 HG3 PRO 539 102.567 4.142 -2.159 622 HD2 PRO 539 HD2 PRO 539 100.019 3.612 -2.641 623 HD3 PRO 539 HD3 PRO 539 101.077 2.324 -2.031 624 H THR 540 H THR 540 101.190 3.272 3.057 625 HA THR 540 HA THR 540 99.049 5.096 3.802 626 HB THR 540 HB THR 540 101.013 3.569 5.514 627 HG1 THR 540 HG1 THR 540 99.246 2.109 5.669 628 HG21 THR 540 HG21 THR 540 100.016 5.279 6.837 629 HG22 THR 540 HG22 THR 540 99.074 3.828 7.170 630 HG23 THR 540 HG23 THR 540 98.444 5.054 6.072 631 H ASN 541 H ASN 541 102.252 5.442 2.966 632 HA ASN 541 HA ASN 541 103.793 7.140 3.292 633 HB2 ASN 541 HB2 ASN 541 101.679 8.363 2.483 634 HB3 ASN 541 HB3 ASN 541 101.430 8.803 4.170 635 HD21 ASN 541 HD21 ASN 541 103.821 9.077 1.507 636 HD22 ASN 541 HD22 ASN 541 104.537 10.498 2.097 637 H ASP 542 H ASP 542 103.243 5.343 5.393 638 HA ASP 542 HA ASP 542 103.578 4.999 7.646 639 HB2 ASP 542 HB2 ASP 542 105.415 7.316 7.055 640 HB3 ASP 542 HB3 ASP 542 105.429 6.436 8.583 641 H GLN 543 H GLN 543 101.386 6.963 6.908 642 HA GLN 543 HA GLN 543 100.011 8.505 7.984 643 HB2 GLN 543 HB2 GLN 543 99.706 6.430 9.301 644 HB3 GLN 543 HB3 GLN 543 101.024 6.923 10.360 645 HG2 GLN 543 HG2 GLN 543 99.779 8.878 11.085 646 HG3 GLN 543 HG3 GLN 543 98.501 8.544 9.915 647 HE21 GLN 543 HE21 GLN 543 97.899 8.675 12.712 648 HE22 GLN 543 HE22 GLN 543 97.487 7.117 13.244 Start of MODEL 16 1 H1 SER 466 H1 SER 466 26.853 4.047 1.328 2 H2 SER 466 H2 SER 466 25.734 4.811 0.303 3 H3 SER 466 H3 SER 466 27.385 5.203 0.208 4 HA SER 466 HA SER 466 26.984 2.409 -0.133 5 HB2 SER 466 HB2 SER 466 24.808 3.112 -1.069 6 HB3 SER 466 HB3 SER 466 25.622 4.282 -2.104 7 HG SER 466 HG SER 466 26.885 2.187 -2.665 8 H ASP 467 H ASP 467 28.724 5.028 -0.054 9 HA ASP 467 HA ASP 467 30.202 4.707 -2.575 10 HB2 ASP 467 HB2 ASP 467 30.429 6.712 -0.316 11 HB3 ASP 467 HB3 ASP 467 31.487 6.683 -1.726 12 H ASP 468 H ASP 468 31.601 3.050 -2.564 13 HA ASP 468 HA ASP 468 33.057 2.322 -0.124 14 HB2 ASP 468 HB2 ASP 468 32.902 1.028 -2.855 15 HB3 ASP 468 HB3 ASP 468 33.820 0.385 -1.494 16 H TYR 469 H TYR 469 33.396 4.471 -2.515 17 HA TYR 469 HA TYR 469 36.135 4.136 -3.288 18 HB2 TYR 469 HB2 TYR 469 34.266 5.278 -4.548 19 HB3 TYR 469 HB3 TYR 469 34.435 6.619 -3.420 20 HD1 TYR 469 HD1 TYR 469 36.155 4.653 -6.055 21 HD2 TYR 469 HD2 TYR 469 36.289 8.136 -3.545 22 HE1 TYR 469 HE1 TYR 469 38.021 5.561 -7.412 23 HE2 TYR 469 HE2 TYR 469 38.150 9.046 -4.905 24 HH TYR 469 HH TYR 469 39.462 8.741 -6.653 25 H VAL 470 H VAL 470 37.861 5.669 -2.816 26 HA VAL 470 HA VAL 470 37.736 6.718 -0.048 27 HB VAL 470 HB VAL 470 40.304 6.146 -1.507 28 HG11 VAL 470 HG11 VAL 470 40.415 7.362 0.614 29 HG12 VAL 470 HG12 VAL 470 41.086 5.744 0.809 30 HG13 VAL 470 HG13 VAL 470 39.466 6.104 1.404 31 HG21 VAL 470 HG21 VAL 470 40.209 3.883 -0.349 32 HG22 VAL 470 HG22 VAL 470 39.149 4.065 -1.745 33 HG23 VAL 470 HG23 VAL 470 38.485 4.172 -0.114 34 H ASP 471 H ASP 471 38.237 8.806 0.375 35 HA ASP 471 HA ASP 471 37.946 10.813 -1.449 36 HB2 ASP 471 HB2 ASP 471 39.637 10.778 1.059 37 HB3 ASP 471 HB3 ASP 471 39.321 12.239 0.128 38 H GLU 472 H GLU 472 39.271 12.055 -2.720 39 HA GLU 472 HA GLU 472 41.313 10.776 -4.149 40 HB2 GLU 472 HB2 GLU 472 40.574 13.698 -3.913 41 HB3 GLU 472 HB3 GLU 472 41.753 13.075 -5.067 42 HG2 GLU 472 HG2 GLU 472 40.082 11.655 -6.102 43 HG3 GLU 472 HG3 GLU 472 38.897 12.087 -4.871 44 H GLU 473 H GLU 473 41.523 13.196 -1.549 45 HA GLU 473 HA GLU 473 44.329 13.570 -1.709 46 HB2 GLU 473 HB2 GLU 473 44.112 14.692 0.398 47 HB3 GLU 473 HB3 GLU 473 42.683 15.077 -0.555 48 HG2 GLU 473 HG2 GLU 473 41.542 13.123 0.646 49 HG3 GLU 473 HG3 GLU 473 42.919 13.134 1.748 50 H THR 474 H THR 474 42.290 11.504 0.241 51 HA THR 474 HA THR 474 44.303 10.278 1.832 52 HB THR 474 HB THR 474 41.565 9.363 0.918 53 HG1 THR 474 HG1 THR 474 42.000 9.936 3.554 54 HG21 THR 474 HG21 THR 474 41.775 7.806 2.935 55 HG22 THR 474 HG22 THR 474 43.513 8.099 2.841 56 HG23 THR 474 HG23 THR 474 42.662 7.359 1.478 57 H TYR 475 H TYR 475 42.691 9.347 -1.164 58 HA TYR 475 HA TYR 475 43.925 6.848 -1.469 59 HB2 TYR 475 HB2 TYR 475 41.877 7.645 -2.637 60 HB3 TYR 475 HB3 TYR 475 42.891 8.692 -3.630 61 HD1 TYR 475 HD1 TYR 475 42.438 5.170 -2.568 62 HD2 TYR 475 HD2 TYR 475 43.927 7.843 -5.566 63 HE1 TYR 475 HE1 TYR 475 42.881 3.231 -4.068 64 HE2 TYR 475 HE2 TYR 475 44.383 5.917 -7.073 65 HH TYR 475 HH TYR 475 43.677 3.631 -7.397 66 H ASN 476 H ASN 476 44.770 10.035 -2.827 67 HA ASN 476 HA ASN 476 47.030 9.092 -4.295 68 HB2 ASN 476 HB2 ASN 476 46.561 11.889 -3.229 69 HB3 ASN 476 HB3 ASN 476 47.603 11.408 -4.570 70 HD21 ASN 476 HD21 ASN 476 45.324 9.337 -5.201 71 HD22 ASN 476 HD22 ASN 476 44.208 10.266 -6.081 72 H LEU 477 H LEU 477 46.501 10.257 -1.025 73 HA LEU 477 HA LEU 477 49.184 10.615 -0.238 74 HB2 LEU 477 HB2 LEU 477 47.243 11.345 1.105 75 HB3 LEU 477 HB3 LEU 477 46.790 9.668 1.367 76 HG LEU 477 HG LEU 477 48.998 9.297 2.494 77 HD11 LEU 477 HD11 LEU 477 49.247 12.243 1.897 78 HD12 LEU 477 HD12 LEU 477 50.443 10.963 1.684 79 HD13 LEU 477 HD13 LEU 477 50.054 11.540 3.298 80 HD21 LEU 477 HD21 LEU 477 47.198 11.468 3.597 81 HD22 LEU 477 HD22 LEU 477 48.355 10.541 4.553 82 HD23 LEU 477 HD23 LEU 477 46.985 9.731 3.798 83 H GLN 478 H GLN 478 46.999 7.797 -0.185 84 HA GLN 478 HA GLN 478 48.791 5.934 0.959 85 HB2 GLN 478 HB2 GLN 478 46.471 5.593 -0.957 86 HB3 GLN 478 HB3 GLN 478 47.342 4.240 -0.238 87 HG2 GLN 478 HG2 GLN 478 46.062 6.438 1.385 88 HG3 GLN 478 HG3 GLN 478 45.253 4.922 1.000 89 HE21 GLN 478 HE21 GLN 478 46.567 6.244 3.550 90 HE22 GLN 478 HE22 GLN 478 47.428 4.945 4.226 91 H LYS 479 H LYS 479 48.202 6.956 -2.336 92 HA LYS 479 HA LYS 479 49.824 5.063 -3.677 93 HB2 LYS 479 HB2 LYS 479 48.034 6.473 -4.689 94 HB3 LYS 479 HB3 LYS 479 49.070 7.883 -4.480 95 HG2 LYS 479 HG2 LYS 479 50.724 6.984 -5.988 96 HG3 LYS 479 HG3 LYS 479 49.886 5.434 -6.073 97 HD2 LYS 479 HD2 LYS 479 49.293 6.649 -8.069 98 HD3 LYS 479 HD3 LYS 479 47.882 6.681 -7.012 99 HE2 LYS 479 HE2 LYS 479 48.287 8.935 -6.362 100 HE3 LYS 479 HE3 LYS 479 49.924 8.912 -7.017 101 HZ1 LYS 479 HZ1 LYS 479 48.333 10.091 -8.441 102 HZ2 LYS 479 HZ2 LYS 479 47.442 8.657 -8.634 103 HZ3 LYS 479 HZ3 LYS 479 49.031 8.763 -9.229 104 H LEU 480 H LEU 480 50.427 8.302 -2.422 105 HA LEU 480 HA LEU 480 53.017 8.695 -3.461 106 HB2 LEU 480 HB2 LEU 480 51.441 9.842 -1.170 107 HB3 LEU 480 HB3 LEU 480 53.113 10.334 -1.428 108 HG LEU 480 HG LEU 480 51.262 10.376 -3.800 109 HD11 LEU 480 HD11 LEU 480 51.182 12.329 -1.487 110 HD12 LEU 480 HD12 LEU 480 49.833 11.529 -2.291 111 HD13 LEU 480 HD13 LEU 480 50.717 12.807 -3.121 112 HD21 LEU 480 HD21 LEU 480 53.779 10.922 -3.772 113 HD22 LEU 480 HD22 LEU 480 53.327 12.402 -2.927 114 HD23 LEU 480 HD23 LEU 480 52.716 12.092 -4.554 115 H LEU 481 H LEU 481 51.930 7.384 -0.349 116 HA LEU 481 HA LEU 481 54.538 7.100 0.753 117 HB2 LEU 481 HB2 LEU 481 51.963 5.716 1.507 118 HB3 LEU 481 HB3 LEU 481 53.401 5.870 2.517 119 HG LEU 481 HG LEU 481 51.812 8.196 1.428 120 HD11 LEU 481 HD11 LEU 481 51.857 7.023 4.215 121 HD12 LEU 481 HD12 LEU 481 50.514 6.914 3.077 122 HD13 LEU 481 HD13 LEU 481 50.992 8.481 3.728 123 HD21 LEU 481 HD21 LEU 481 53.140 9.348 3.326 124 HD22 LEU 481 HD22 LEU 481 53.949 9.038 1.801 125 HD23 LEU 481 HD23 LEU 481 54.237 7.971 3.178 126 H ALA 482 H ALA 482 52.347 4.907 -0.920 127 HA ALA 482 HA ALA 482 53.260 2.456 -0.520 128 HB1 ALA 482 HB1 ALA 482 52.208 3.843 -2.874 129 HB2 ALA 482 HB2 ALA 482 51.788 2.256 -2.228 130 HB3 ALA 482 HB3 ALA 482 53.177 2.431 -3.302 131 HA PRO 483 HA PRO 483 57.021 2.626 -3.699 132 HB2 PRO 483 HB2 PRO 483 58.032 5.322 -3.558 133 HB3 PRO 483 HB3 PRO 483 57.397 4.484 -4.973 134 HG2 PRO 483 HG2 PRO 483 56.081 6.407 -3.165 135 HG3 PRO 483 HG3 PRO 483 55.714 6.012 -4.850 136 HD2 PRO 483 HD2 PRO 483 54.113 5.232 -2.811 137 HD3 PRO 483 HD3 PRO 483 54.329 4.236 -4.266 138 H TYR 484 H TYR 484 57.131 5.078 -1.105 139 HA TYR 484 HA TYR 484 59.724 4.282 -0.185 140 HB2 TYR 484 HB2 TYR 484 59.253 6.510 0.299 141 HB3 TYR 484 HB3 TYR 484 57.581 6.167 0.752 142 HD1 TYR 484 HD1 TYR 484 57.077 5.073 2.953 143 HD2 TYR 484 HD2 TYR 484 61.042 6.407 1.957 144 HE1 TYR 484 HE1 TYR 484 57.731 4.907 5.336 145 HE2 TYR 484 HE2 TYR 484 61.681 6.235 4.350 146 HH TYR 484 HH TYR 484 60.930 5.960 6.443 147 H HIS 485 H HIS 485 56.421 3.436 0.572 148 HA HIS 485 HA HIS 485 56.792 2.156 3.056 149 HB2 HIS 485 HB2 HIS 485 54.601 2.811 1.981 150 HB3 HIS 485 HB3 HIS 485 54.770 1.401 0.941 151 HD1 HIS 485 HD1 HIS 485 54.135 -0.843 1.897 152 HD2 HIS 485 HD2 HIS 485 54.379 2.113 4.828 153 HE1 HIS 485 HE1 HIS 485 53.185 -1.854 4.017 154 H LYS 486 H LYS 486 57.122 1.002 -0.265 155 HA LYS 486 HA LYS 486 57.626 -1.753 0.539 156 HB2 LYS 486 HB2 LYS 486 57.999 -2.085 -1.912 157 HB3 LYS 486 HB3 LYS 486 56.446 -1.323 -1.564 158 HG2 LYS 486 HG2 LYS 486 57.290 0.848 -2.118 159 HG3 LYS 486 HG3 LYS 486 58.938 0.256 -2.246 160 HD2 LYS 486 HD2 LYS 486 58.127 0.485 -4.479 161 HD3 LYS 486 HD3 LYS 486 58.143 -1.242 -4.127 162 HE2 LYS 486 HE2 LYS 486 55.794 -1.319 -3.839 163 HE3 LYS 486 HE3 LYS 486 55.665 0.431 -3.692 164 HZ1 LYS 486 HZ1 LYS 486 56.589 0.462 -6.057 165 HZ2 LYS 486 HZ2 LYS 486 54.970 -0.005 -5.842 166 HZ3 LYS 486 HZ3 LYS 486 56.165 -1.180 -6.115 167 H ALA 487 H ALA 487 59.383 1.142 -0.015 168 HA ALA 487 HA ALA 487 61.882 0.116 -0.798 169 HB1 ALA 487 HB1 ALA 487 62.747 2.297 -0.259 170 HB2 ALA 487 HB2 ALA 487 61.368 2.646 0.779 171 HB3 ALA 487 HB3 ALA 487 61.147 2.514 -0.965 172 H LYS 488 H LYS 488 62.821 -1.452 0.370 173 HA LYS 488 HA LYS 488 62.855 -1.337 3.307 174 HB2 LYS 488 HB2 LYS 488 63.862 -3.419 1.361 175 HB3 LYS 488 HB3 LYS 488 63.928 -3.568 3.117 176 HG2 LYS 488 HG2 LYS 488 61.464 -3.309 3.219 177 HG3 LYS 488 HG3 LYS 488 61.414 -3.223 1.461 178 HD2 LYS 488 HD2 LYS 488 62.601 -5.581 2.950 179 HD3 LYS 488 HD3 LYS 488 60.906 -5.513 2.472 180 HE2 LYS 488 HE2 LYS 488 61.761 -5.058 0.088 181 HE3 LYS 488 HE3 LYS 488 63.345 -5.551 0.682 182 HZ1 LYS 488 HZ1 LYS 488 61.126 -7.159 -0.032 183 HZ2 LYS 488 HZ2 LYS 488 61.580 -7.468 1.575 184 HZ3 LYS 488 HZ3 LYS 488 62.717 -7.626 0.321 185 H THR 489 H THR 489 64.730 -0.166 0.805 186 HA THR 489 HA THR 489 67.288 -0.480 2.262 187 HB THR 489 HB THR 489 68.143 0.640 0.073 188 HG1 THR 489 HG1 THR 489 65.476 0.486 -0.333 189 HG21 THR 489 HG21 THR 489 68.008 -1.562 -1.134 190 HG22 THR 489 HG22 THR 489 66.914 -2.125 0.131 191 HG23 THR 489 HG23 THR 489 68.575 -1.689 0.529 192 H LEU 490 H LEU 490 68.217 1.187 3.296 193 HA LEU 490 HA LEU 490 66.810 3.539 3.909 194 HB2 LEU 490 HB2 LEU 490 69.687 2.679 4.181 195 HB3 LEU 490 HB3 LEU 490 69.187 4.301 4.656 196 HG LEU 490 HG LEU 490 67.469 3.311 6.150 197 HD11 LEU 490 HD11 LEU 490 67.812 0.802 6.633 198 HD12 LEU 490 HD12 LEU 490 68.655 0.749 5.084 199 HD13 LEU 490 HD13 LEU 490 66.958 1.228 5.152 200 HD21 LEU 490 HD21 LEU 490 69.617 3.863 7.138 201 HD22 LEU 490 HD22 LEU 490 70.325 2.363 6.538 202 HD23 LEU 490 HD23 LEU 490 69.097 2.313 7.802 203 H GLU 491 H GLU 491 69.424 2.932 1.587 204 HA GLU 491 HA GLU 491 69.880 5.537 0.681 205 HB2 GLU 491 HB2 GLU 491 71.366 3.773 0.062 206 HB3 GLU 491 HB3 GLU 491 70.063 2.857 -0.688 207 HG2 GLU 491 HG2 GLU 491 69.846 4.466 -2.459 208 HG3 GLU 491 HG3 GLU 491 70.952 5.586 -1.661 209 H ARG 492 H ARG 492 67.495 3.174 -0.230 210 HA ARG 492 HA ARG 492 66.374 4.655 -2.406 211 HB2 ARG 492 HB2 ARG 492 66.166 2.197 -2.177 212 HB3 ARG 492 HB3 ARG 492 65.172 2.427 -0.741 213 HG2 ARG 492 HG2 ARG 492 63.555 2.139 -2.414 214 HG3 ARG 492 HG3 ARG 492 63.666 3.894 -2.339 215 HD2 ARG 492 HD2 ARG 492 65.248 3.865 -4.239 216 HD3 ARG 492 HD3 ARG 492 65.142 2.110 -4.302 217 HE ARG 492 HE ARG 492 63.159 4.013 -5.244 218 HH11 ARG 492 HH11 ARG 492 64.178 1.305 -6.426 219 HH12 ARG 492 HH12 ARG 492 62.725 0.363 -6.335 220 HH21 ARG 492 HH21 ARG 492 61.133 2.552 -4.165 221 HH22 ARG 492 HH22 ARG 492 61.000 1.072 -5.053 222 H GLN 493 H GLN 493 65.607 4.276 1.025 223 HA GLN 493 HA GLN 493 63.133 5.575 1.050 224 HB2 GLN 493 HB2 GLN 493 65.325 5.373 3.121 225 HB3 GLN 493 HB3 GLN 493 63.782 6.154 3.446 226 HG2 GLN 493 HG2 GLN 493 62.568 4.116 2.953 227 HG3 GLN 493 HG3 GLN 493 64.038 3.325 2.408 228 HE21 GLN 493 HE21 GLN 493 63.096 1.788 4.245 229 HE22 GLN 493 HE22 GLN 493 63.715 2.063 5.801 230 H VAL 494 H VAL 494 66.409 6.909 1.423 231 HA VAL 494 HA VAL 494 65.641 9.595 1.798 232 HB VAL 494 HB VAL 494 68.136 8.405 0.559 233 HG11 VAL 494 HG11 VAL 494 67.479 11.220 1.463 234 HG12 VAL 494 HG12 VAL 494 68.057 10.699 -0.120 235 HG13 VAL 494 HG13 VAL 494 69.132 10.636 1.276 236 HG21 VAL 494 HG21 VAL 494 67.348 9.224 3.364 237 HG22 VAL 494 HG22 VAL 494 69.030 9.012 2.877 238 HG23 VAL 494 HG23 VAL 494 67.915 7.650 2.805 239 H TYR 495 H TYR 495 66.505 7.777 -1.128 240 HA TYR 495 HA TYR 495 66.201 9.863 -3.006 241 HB2 TYR 495 HB2 TYR 495 67.331 7.797 -3.535 242 HB3 TYR 495 HB3 TYR 495 65.862 6.873 -3.245 243 HD1 TYR 495 HD1 TYR 495 67.298 9.559 -5.420 244 HD2 TYR 495 HD2 TYR 495 64.314 6.496 -4.987 245 HE1 TYR 495 HE1 TYR 495 66.672 9.829 -7.805 246 HE2 TYR 495 HE2 TYR 495 63.697 6.762 -7.374 247 HH TYR 495 HH TYR 495 64.868 7.595 -9.490 248 H GLU 496 H GLU 496 63.902 7.388 -1.895 249 HA GLU 496 HA GLU 496 61.755 8.190 -3.546 250 HB2 GLU 496 HB2 GLU 496 62.195 6.050 -1.999 251 HB3 GLU 496 HB3 GLU 496 61.215 6.973 -0.869 252 HG2 GLU 496 HG2 GLU 496 59.737 5.590 -2.130 253 HG3 GLU 496 HG3 GLU 496 59.505 7.238 -2.714 254 H LEU 497 H LEU 497 62.716 9.044 -0.266 255 HA LEU 497 HA LEU 497 60.484 10.640 0.380 256 HB2 LEU 497 HB2 LEU 497 63.328 10.509 1.370 257 HB3 LEU 497 HB3 LEU 497 62.199 11.699 2.010 258 HG LEU 497 HG LEU 497 61.579 8.733 1.913 259 HD11 LEU 497 HD11 LEU 497 62.401 10.184 4.416 260 HD12 LEU 497 HD12 LEU 497 63.614 9.434 3.378 261 HD13 LEU 497 HD13 LEU 497 62.351 8.452 4.112 262 HD21 LEU 497 HD21 LEU 497 60.084 9.702 3.932 263 HD22 LEU 497 HD22 LEU 497 59.522 9.694 2.263 264 HD23 LEU 497 HD23 LEU 497 60.194 11.168 2.960 265 H GLU 498 H GLU 498 63.550 11.370 -1.232 266 HA GLU 498 HA GLU 498 63.380 14.161 -1.263 267 HB2 GLU 498 HB2 GLU 498 64.598 12.139 -3.138 268 HB3 GLU 498 HB3 GLU 498 64.677 13.859 -3.503 269 HG2 GLU 498 HG2 GLU 498 65.546 12.766 -0.827 270 HG3 GLU 498 HG3 GLU 498 66.646 12.834 -2.202 271 H LYS 499 H LYS 499 62.176 11.795 -3.637 272 HA LYS 499 HA LYS 499 60.955 13.731 -5.366 273 HB2 LYS 499 HB2 LYS 499 60.523 10.761 -4.951 274 HB3 LYS 499 HB3 LYS 499 59.805 11.688 -6.269 275 HG2 LYS 499 HG2 LYS 499 61.814 11.926 -7.391 276 HG3 LYS 499 HG3 LYS 499 62.763 11.992 -5.907 277 HD2 LYS 499 HD2 LYS 499 63.225 9.932 -7.174 278 HD3 LYS 499 HD3 LYS 499 62.499 9.566 -5.610 279 HE2 LYS 499 HE2 LYS 499 60.375 9.099 -6.590 280 HE3 LYS 499 HE3 LYS 499 60.826 9.856 -8.115 281 HZ1 LYS 499 HZ1 LYS 499 62.455 8.084 -8.456 282 HZ2 LYS 499 HZ2 LYS 499 60.881 7.465 -8.304 283 HZ3 LYS 499 HZ3 LYS 499 61.971 7.346 -7.006 284 H LEU 500 H LEU 500 59.691 11.605 -2.832 285 HA LEU 500 HA LEU 500 56.988 12.367 -3.107 286 HB2 LEU 500 HB2 LEU 500 58.515 11.215 -0.766 287 HB3 LEU 500 HB3 LEU 500 56.764 11.356 -0.833 288 HG LEU 500 HG LEU 500 58.359 9.903 -2.950 289 HD11 LEU 500 HD11 LEU 500 57.453 7.834 -1.707 290 HD12 LEU 500 HD12 LEU 500 57.180 8.922 -0.346 291 HD13 LEU 500 HD13 LEU 500 58.812 8.681 -0.969 292 HD21 LEU 500 HD21 LEU 500 55.421 10.095 -2.250 293 HD22 LEU 500 HD22 LEU 500 56.067 8.754 -3.198 294 HD23 LEU 500 HD23 LEU 500 56.202 10.391 -3.806 295 H GLN 501 H GLN 501 59.587 13.590 -1.056 296 HA GLN 501 HA GLN 501 58.126 15.352 0.541 297 HB2 GLN 501 HB2 GLN 501 60.954 15.341 -0.498 298 HB3 GLN 501 HB3 GLN 501 60.369 16.682 0.487 299 HG2 GLN 501 HG2 GLN 501 60.001 13.821 1.387 300 HG3 GLN 501 HG3 GLN 501 61.502 14.692 1.714 301 HE21 GLN 501 HE21 GLN 501 58.387 14.091 2.900 302 HE22 GLN 501 HE22 GLN 501 58.290 15.379 4.000 303 H GLU 502 H GLU 502 59.045 15.576 -2.794 304 HA GLU 502 HA GLU 502 58.578 18.412 -3.065 305 HB2 GLU 502 HB2 GLU 502 60.152 17.139 -4.500 306 HB3 GLU 502 HB3 GLU 502 58.795 16.224 -5.145 307 HG2 GLU 502 HG2 GLU 502 59.303 17.962 -6.710 308 HG3 GLU 502 HG3 GLU 502 57.790 18.395 -5.926 309 H LYS 503 H LYS 503 56.777 15.427 -3.570 310 HA LYS 503 HA LYS 503 54.455 16.930 -4.623 311 HB2 LYS 503 HB2 LYS 503 55.086 13.992 -4.494 312 HB3 LYS 503 HB3 LYS 503 53.622 14.678 -5.204 313 HG2 LYS 503 HG2 LYS 503 55.025 16.028 -6.745 314 HG3 LYS 503 HG3 LYS 503 56.464 15.272 -6.066 315 HD2 LYS 503 HD2 LYS 503 54.216 13.695 -7.344 316 HD3 LYS 503 HD3 LYS 503 55.637 14.244 -8.230 317 HE2 LYS 503 HE2 LYS 503 57.030 13.052 -6.429 318 HE3 LYS 503 HE3 LYS 503 55.524 12.283 -5.928 319 HZ1 LYS 503 HZ1 LYS 503 56.560 10.850 -7.463 320 HZ2 LYS 503 HZ2 LYS 503 56.849 12.106 -8.571 321 HZ3 LYS 503 HZ3 LYS 503 55.261 11.566 -8.288 322 H LEU 504 H LEU 504 55.550 15.447 -1.756 323 HA LEU 504 HA LEU 504 53.118 14.506 -0.722 324 HB2 LEU 504 HB2 LEU 504 55.796 15.185 0.404 325 HB3 LEU 504 HB3 LEU 504 54.461 14.973 1.531 326 HG LEU 504 HG LEU 504 55.181 12.952 -0.604 327 HD11 LEU 504 HD11 LEU 504 56.013 13.186 2.285 328 HD12 LEU 504 HD12 LEU 504 57.060 13.021 0.880 329 HD13 LEU 504 HD13 LEU 504 56.081 11.655 1.422 330 HD21 LEU 504 HD21 LEU 504 53.078 12.257 -0.046 331 HD22 LEU 504 HD22 LEU 504 53.059 13.146 1.473 332 HD23 LEU 504 HD23 LEU 504 53.867 11.583 1.377 333 HA PRO 505 HA PRO 505 51.053 18.583 -0.242 334 HB2 PRO 505 HB2 PRO 505 49.531 17.362 1.922 335 HB3 PRO 505 HB3 PRO 505 48.963 17.814 0.307 336 HG2 PRO 505 HG2 PRO 505 49.963 15.184 1.274 337 HG3 PRO 505 HG3 PRO 505 48.793 15.539 -0.001 338 HD2 PRO 505 HD2 PRO 505 51.177 14.695 -0.646 339 HD3 PRO 505 HD3 PRO 505 50.494 16.060 -1.550 340 H GLU 506 H GLU 506 51.351 20.225 1.160 341 HA GLU 506 HA GLU 506 53.529 20.576 2.656 342 HB2 GLU 506 HB2 GLU 506 52.337 22.382 3.873 343 HB3 GLU 506 HB3 GLU 506 52.045 22.403 2.135 344 HG2 GLU 506 HG2 GLU 506 49.945 20.937 2.736 345 HG3 GLU 506 HG3 GLU 506 50.185 21.582 4.359 346 H LYS 507 H LYS 507 50.438 19.785 4.291 347 HA LYS 507 HA LYS 507 51.442 19.511 6.865 348 HB2 LYS 507 HB2 LYS 507 49.425 18.296 7.365 349 HB3 LYS 507 HB3 LYS 507 49.021 19.522 6.162 350 HG2 LYS 507 HG2 LYS 507 49.484 17.682 4.404 351 HG3 LYS 507 HG3 LYS 507 49.406 16.557 5.758 352 HD2 LYS 507 HD2 LYS 507 47.200 18.526 5.090 353 HD3 LYS 507 HD3 LYS 507 47.220 16.855 4.528 354 HE2 LYS 507 HE2 LYS 507 47.459 16.173 6.980 355 HE3 LYS 507 HE3 LYS 507 47.078 17.847 7.382 356 HZ1 LYS 507 HZ1 LYS 507 45.259 15.898 7.003 357 HZ2 LYS 507 HZ2 LYS 507 45.272 16.645 5.477 358 HZ3 LYS 507 HZ3 LYS 507 44.935 17.557 6.871 359 H TYR 508 H TYR 508 51.587 17.260 4.199 360 HA TYR 508 HA TYR 508 52.592 15.098 5.925 361 HB2 TYR 508 HB2 TYR 508 51.857 15.300 2.998 362 HB3 TYR 508 HB3 TYR 508 52.712 13.904 3.654 363 HD1 TYR 508 HD1 TYR 508 51.701 12.636 5.564 364 HD2 TYR 508 HD2 TYR 508 49.511 15.535 3.311 365 HE1 TYR 508 HE1 TYR 508 49.583 11.673 6.394 366 HE2 TYR 508 HE2 TYR 508 47.377 14.564 4.107 367 HH TYR 508 HH TYR 508 47.288 12.249 6.684 368 H LYS 509 H LYS 509 53.651 17.628 3.873 369 HA LYS 509 HA LYS 509 56.149 16.579 3.058 370 HB2 LYS 509 HB2 LYS 509 55.065 18.612 2.116 371 HB3 LYS 509 HB3 LYS 509 55.381 19.446 3.631 372 HG2 LYS 509 HG2 LYS 509 57.769 19.189 3.347 373 HG3 LYS 509 HG3 LYS 509 57.524 18.222 1.888 374 HD2 LYS 509 HD2 LYS 509 56.400 20.127 0.809 375 HD3 LYS 509 HD3 LYS 509 56.639 21.098 2.262 376 HE2 LYS 509 HE2 LYS 509 58.891 19.847 0.666 377 HE3 LYS 509 HE3 LYS 509 58.356 21.518 0.481 378 HZ1 LYS 509 HZ1 LYS 509 58.711 21.009 3.207 379 HZ2 LYS 509 HZ2 LYS 509 59.591 22.070 2.212 380 HZ3 LYS 509 HZ3 LYS 509 60.095 20.460 2.399 381 H ALA 510 H ALA 510 55.163 18.597 5.819 382 HA ALA 510 HA ALA 510 57.672 18.891 7.041 383 HB1 ALA 510 HB1 ALA 510 55.045 18.668 8.515 384 HB2 ALA 510 HB2 ALA 510 55.534 20.113 7.629 385 HB3 ALA 510 HB3 ALA 510 56.487 19.557 9.004 386 H GLU 511 H GLU 511 55.112 16.492 7.710 387 HA GLU 511 HA GLU 511 56.460 15.087 9.750 388 HB2 GLU 511 HB2 GLU 511 54.093 14.802 9.235 389 HB3 GLU 511 HB3 GLU 511 54.492 14.104 7.670 390 HG2 GLU 511 HG2 GLU 511 55.582 12.202 8.757 391 HG3 GLU 511 HG3 GLU 511 55.290 12.916 10.346 392 H TYR 512 H TYR 512 56.479 14.492 6.255 393 HA TYR 512 HA TYR 512 58.288 12.248 6.515 394 HB2 TYR 512 HB2 TYR 512 56.963 13.720 4.262 395 HB3 TYR 512 HB3 TYR 512 58.264 12.576 3.916 396 HD1 TYR 512 HD1 TYR 512 54.993 12.907 5.710 397 HD2 TYR 512 HD2 TYR 512 57.846 10.247 3.925 398 HE1 TYR 512 HE1 TYR 512 53.435 11.010 6.054 399 HE2 TYR 512 HE2 TYR 512 56.300 8.346 4.291 400 HH TYR 512 HH TYR 512 53.021 8.846 5.436 401 H LYS 513 H LYS 513 58.634 15.643 6.339 402 HA LYS 513 HA LYS 513 61.194 15.759 5.063 403 HB2 LYS 513 HB2 LYS 513 59.756 17.772 5.383 404 HB3 LYS 513 HB3 LYS 513 59.966 17.630 7.121 405 HG2 LYS 513 HG2 LYS 513 61.593 19.214 6.582 406 HG3 LYS 513 HG3 LYS 513 62.533 17.733 6.549 407 HD2 LYS 513 HD2 LYS 513 63.116 18.951 4.571 408 HD3 LYS 513 HD3 LYS 513 62.091 17.624 4.046 409 HE2 LYS 513 HE2 LYS 513 60.309 19.027 3.519 410 HE3 LYS 513 HE3 LYS 513 60.779 20.248 4.701 411 HZ1 LYS 513 HZ1 LYS 513 61.628 21.328 2.976 412 HZ2 LYS 513 HZ2 LYS 513 61.540 19.974 1.954 413 HZ3 LYS 513 HZ3 LYS 513 62.879 20.183 2.979 414 H LYS 514 H LYS 514 59.982 15.397 8.349 415 HA LYS 514 HA LYS 514 62.481 15.400 9.678 416 HB2 LYS 514 HB2 LYS 514 59.781 14.199 10.324 417 HB3 LYS 514 HB3 LYS 514 61.171 14.007 11.398 418 HG2 LYS 514 HG2 LYS 514 61.410 16.375 11.634 419 HG3 LYS 514 HG3 LYS 514 60.174 16.677 10.407 420 HD2 LYS 514 HD2 LYS 514 58.535 15.449 11.868 421 HD3 LYS 514 HD3 LYS 514 59.777 15.398 13.123 422 HE2 LYS 514 HE2 LYS 514 58.769 17.932 11.813 423 HE3 LYS 514 HE3 LYS 514 58.197 17.329 13.367 424 HZ1 LYS 514 HZ1 LYS 514 60.996 18.091 12.703 425 HZ2 LYS 514 HZ2 LYS 514 60.484 17.454 14.194 426 HZ3 LYS 514 HZ3 LYS 514 59.925 18.973 13.679 427 H LYS 515 H LYS 515 60.509 12.870 8.194 428 HA LYS 515 HA LYS 515 62.091 10.667 8.982 429 HB2 LYS 515 HB2 LYS 515 60.484 11.055 6.447 430 HB3 LYS 515 HB3 LYS 515 61.080 9.512 7.062 431 HG2 LYS 515 HG2 LYS 515 59.775 9.842 9.142 432 HG3 LYS 515 HG3 LYS 515 59.167 11.368 8.508 433 HD2 LYS 515 HD2 LYS 515 57.429 9.878 7.958 434 HD3 LYS 515 HD3 LYS 515 58.365 9.938 6.466 435 HE2 LYS 515 HE2 LYS 515 59.447 7.868 6.954 436 HE3 LYS 515 HE3 LYS 515 58.809 7.842 8.595 437 HZ1 LYS 515 HZ1 LYS 515 56.723 8.085 6.682 438 HZ2 LYS 515 HZ2 LYS 515 56.946 6.911 7.891 439 HZ3 LYS 515 HZ3 LYS 515 57.671 6.713 6.367 440 H LEU 516 H LEU 516 62.232 12.772 6.143 441 HA LEU 516 HA LEU 516 64.254 11.489 4.689 442 HB2 LEU 516 HB2 LEU 516 62.901 13.258 3.752 443 HB3 LEU 516 HB3 LEU 516 63.490 14.409 4.942 444 HG LEU 516 HG LEU 516 65.636 13.091 3.374 445 HD11 LEU 516 HD11 LEU 516 63.786 15.074 2.024 446 HD12 LEU 516 HD12 LEU 516 63.881 13.358 1.626 447 HD13 LEU 516 HD13 LEU 516 65.269 14.407 1.344 448 HD21 LEU 516 HD21 LEU 516 66.136 14.953 4.876 449 HD22 LEU 516 HD22 LEU 516 64.969 15.975 4.036 450 HD23 LEU 516 HD23 LEU 516 66.440 15.452 3.214 451 H ASP 517 H ASP 517 64.533 14.273 6.849 452 HA ASP 517 HA ASP 517 67.314 14.483 6.957 453 HB2 ASP 517 HB2 ASP 517 65.779 16.205 7.790 454 HB3 ASP 517 HB3 ASP 517 65.253 15.128 9.080 455 H GLN 518 H GLN 518 65.096 12.767 9.154 456 HA GLN 518 HA GLN 518 67.068 11.754 10.908 457 HB2 GLN 518 HB2 GLN 518 64.281 10.804 10.235 458 HB3 GLN 518 HB3 GLN 518 65.268 10.117 11.523 459 HG2 GLN 518 HG2 GLN 518 64.661 13.080 11.353 460 HG3 GLN 518 HG3 GLN 518 63.648 11.950 12.248 461 HE21 GLN 518 HE21 GLN 518 65.567 14.196 13.146 462 HE22 GLN 518 HE22 GLN 518 66.559 13.440 14.297 463 H THR 519 H THR 519 65.653 10.444 7.945 464 HA THR 519 HA THR 519 66.784 7.850 8.106 465 HB THR 519 HB THR 519 65.975 9.492 5.683 466 HG1 THR 519 HG1 THR 519 64.583 7.424 7.019 467 HG21 THR 519 HG21 THR 519 66.392 6.498 5.962 468 HG22 THR 519 HG22 THR 519 67.467 7.593 5.094 469 HG23 THR 519 HG23 THR 519 65.823 7.337 4.521 470 H ARG 520 H ARG 520 67.855 10.887 6.649 471 HA ARG 520 HA ARG 520 70.170 9.968 5.362 472 HB2 ARG 520 HB2 ARG 520 69.428 12.626 6.587 473 HB3 ARG 520 HB3 ARG 520 70.965 12.375 5.761 474 HG2 ARG 520 HG2 ARG 520 69.818 11.753 3.709 475 HG3 ARG 520 HG3 ARG 520 68.252 11.854 4.516 476 HD2 ARG 520 HD2 ARG 520 68.697 13.920 3.261 477 HD3 ARG 520 HD3 ARG 520 68.654 14.243 4.993 478 HE ARG 520 HE ARG 520 71.312 13.671 4.134 479 HH11 ARG 520 HH11 ARG 520 69.780 15.841 2.351 480 HH12 ARG 520 HH12 ARG 520 70.466 17.278 3.033 481 HH21 ARG 520 HH21 ARG 520 71.792 15.652 5.794 482 HH22 ARG 520 HH22 ARG 520 71.605 17.172 4.984 483 H VAL 521 H VAL 521 69.584 10.943 8.705 484 HA VAL 521 HA VAL 521 72.272 11.014 9.580 485 HB VAL 521 HB VAL 521 69.715 10.325 11.041 486 HG11 VAL 521 HG11 VAL 521 71.043 11.003 13.080 487 HG12 VAL 521 HG12 VAL 521 72.495 10.915 12.082 488 HG13 VAL 521 HG13 VAL 521 71.525 9.468 12.362 489 HG21 VAL 521 HG21 VAL 521 69.531 12.602 11.550 490 HG22 VAL 521 HG22 VAL 521 70.126 12.648 9.893 491 HG23 VAL 521 HG23 VAL 521 71.238 12.918 11.233 492 H GLU 522 H GLU 522 69.850 8.402 9.617 493 HA GLU 522 HA GLU 522 71.522 6.420 10.775 494 HB2 GLU 522 HB2 GLU 522 69.169 6.098 8.894 495 HB3 GLU 522 HB3 GLU 522 69.855 4.835 9.919 496 HG2 GLU 522 HG2 GLU 522 69.333 6.156 11.927 497 HG3 GLU 522 HG3 GLU 522 68.682 7.443 10.913 498 H LEU 523 H LEU 523 70.677 7.134 7.411 499 HA LEU 523 HA LEU 523 72.206 5.103 6.165 500 HB2 LEU 523 HB2 LEU 523 70.391 6.280 5.032 501 HB3 LEU 523 HB3 LEU 523 71.268 7.801 5.156 502 HG LEU 523 HG LEU 523 73.046 6.929 3.708 503 HD11 LEU 523 HD11 LEU 523 72.421 4.671 2.515 504 HD12 LEU 523 HD12 LEU 523 71.457 4.379 3.963 505 HD13 LEU 523 HD13 LEU 523 73.201 4.623 4.098 506 HD21 LEU 523 HD21 LEU 523 70.221 6.578 2.687 507 HD22 LEU 523 HD22 LEU 523 71.646 6.621 1.643 508 HD23 LEU 523 HD23 LEU 523 71.217 8.031 2.607 509 H ALA 524 H ALA 524 72.918 8.492 6.949 510 HA ALA 524 HA ALA 524 75.351 8.717 5.576 511 HB1 ALA 524 HB1 ALA 524 75.830 10.563 7.189 512 HB2 ALA 524 HB2 ALA 524 74.394 10.091 8.097 513 HB3 ALA 524 HB3 ALA 524 74.236 10.681 6.441 514 H ASP 525 H ASP 525 74.631 7.604 8.853 515 HA ASP 525 HA ASP 525 77.334 7.279 9.707 516 HB2 ASP 525 HB2 ASP 525 75.440 7.409 11.268 517 HB3 ASP 525 HB3 ASP 525 74.776 5.916 10.606 518 H GLN 526 H GLN 526 74.966 5.204 8.122 519 HA GLN 526 HA GLN 526 76.400 2.751 8.223 520 HB2 GLN 526 HB2 GLN 526 73.972 2.975 7.761 521 HB3 GLN 526 HB3 GLN 526 74.354 3.714 6.210 522 HG2 GLN 526 HG2 GLN 526 75.583 1.627 5.571 523 HG3 GLN 526 HG3 GLN 526 75.051 0.891 7.084 524 HE21 GLN 526 HE21 GLN 526 73.104 -0.261 6.904 525 HE22 GLN 526 HE22 GLN 526 71.912 0.026 5.727 526 H VAL 527 H VAL 527 76.287 5.423 5.947 527 HA VAL 527 HA VAL 527 77.817 4.204 3.867 528 HB VAL 527 HB VAL 527 77.100 7.059 4.559 529 HG11 VAL 527 HG11 VAL 527 77.902 7.530 2.177 530 HG12 VAL 527 HG12 VAL 527 78.746 5.982 2.254 531 HG13 VAL 527 HG13 VAL 527 79.168 7.276 3.378 532 HG21 VAL 527 HG21 VAL 527 76.271 5.394 2.178 533 HG22 VAL 527 HG22 VAL 527 75.519 6.861 2.808 534 HG23 VAL 527 HG23 VAL 527 75.389 5.350 3.705 535 H LYS 528 H LYS 528 78.553 6.360 6.550 536 HA LYS 528 HA LYS 528 81.317 6.733 5.983 537 HB2 LYS 528 HB2 LYS 528 80.013 8.254 7.391 538 HB3 LYS 528 HB3 LYS 528 79.761 6.959 8.560 539 HG2 LYS 528 HG2 LYS 528 82.166 6.826 8.996 540 HG3 LYS 528 HG3 LYS 528 82.478 8.043 7.756 541 HD2 LYS 528 HD2 LYS 528 82.492 9.202 9.862 542 HD3 LYS 528 HD3 LYS 528 80.974 9.612 9.065 543 HE2 LYS 528 HE2 LYS 528 79.704 8.228 10.474 544 HE3 LYS 528 HE3 LYS 528 81.102 7.280 10.975 545 HZ1 LYS 528 HZ1 LYS 528 81.457 10.021 11.623 546 HZ2 LYS 528 HZ2 LYS 528 81.465 8.664 12.645 547 HZ3 LYS 528 HZ3 LYS 528 80.003 9.444 12.278 548 H SER 529 H SER 529 79.491 4.455 7.966 549 HA SER 529 HA SER 529 81.766 3.309 9.246 550 HB2 SER 529 HB2 SER 529 80.164 1.539 9.915 551 HB3 SER 529 HB3 SER 529 79.514 3.150 10.208 552 HG SER 529 HG SER 529 78.547 2.907 8.053 553 H ALA 530 H ALA 530 79.729 2.371 6.502 554 HA ALA 530 HA ALA 530 81.277 0.010 5.904 555 HB1 ALA 530 HB1 ALA 530 78.844 0.133 5.437 556 HB2 ALA 530 HB2 ALA 530 79.786 -0.224 3.988 557 HB3 ALA 530 HB3 ALA 530 79.156 1.403 4.253 558 H VAL 531 H VAL 531 82.415 2.831 5.851 559 HA VAL 531 HA VAL 531 83.092 3.437 3.148 560 HB VAL 531 HB VAL 531 83.079 5.058 5.061 561 HG11 VAL 531 HG11 VAL 531 85.735 3.827 5.812 562 HG12 VAL 531 HG12 VAL 531 84.228 3.374 6.610 563 HG13 VAL 531 HG13 VAL 531 84.807 5.038 6.701 564 HG21 VAL 531 HG21 VAL 531 85.767 4.825 3.664 565 HG22 VAL 531 HG22 VAL 531 85.086 6.280 4.373 566 HG23 VAL 531 HG23 VAL 531 84.326 5.552 2.959 567 H THR 532 H THR 532 84.025 0.890 5.095 568 HA THR 532 HA THR 532 86.650 0.632 3.724 569 HB THR 532 HB THR 532 86.687 0.785 6.246 570 HG1 THR 532 HG1 THR 532 88.395 -0.190 5.250 571 HG21 THR 532 HG21 THR 532 85.926 -1.116 7.527 572 HG22 THR 532 HG22 THR 532 85.454 -1.976 6.065 573 HG23 THR 532 HG23 THR 532 84.575 -0.528 6.560 574 H GLU 533 H GLU 533 83.701 -1.093 4.701 575 HA GLU 533 HA GLU 533 84.464 -3.357 2.950 576 HB2 GLU 533 HB2 GLU 533 82.387 -4.400 4.111 577 HB3 GLU 533 HB3 GLU 533 83.879 -4.236 5.038 578 HG2 GLU 533 HG2 GLU 533 83.088 -2.308 6.182 579 HG3 GLU 533 HG3 GLU 533 81.748 -2.097 5.060 580 H PHE 534 H PHE 534 83.919 -2.593 0.939 581 HA PHE 534 HA PHE 534 81.371 -1.344 0.434 582 HB2 PHE 534 HB2 PHE 534 83.557 -2.317 -1.421 583 HB3 PHE 534 HB3 PHE 534 82.103 -1.475 -1.960 584 HD1 PHE 534 HD1 PHE 534 85.261 -1.161 -0.083 585 HD2 PHE 534 HD2 PHE 534 81.741 0.891 -1.447 586 HE1 PHE 534 HE1 PHE 534 86.309 1.014 0.486 587 HE2 PHE 534 HE2 PHE 534 82.790 3.064 -0.879 588 HZ PHE 534 HZ PHE 534 85.072 3.127 0.089 589 H GLU 535 H GLU 535 79.618 -2.199 -0.707 590 HA GLU 535 HA GLU 535 79.069 -4.963 -0.284 591 HB2 GLU 535 HB2 GLU 535 77.476 -2.914 -0.301 592 HB3 GLU 535 HB3 GLU 535 77.497 -3.089 -2.052 593 HG2 GLU 535 HG2 GLU 535 76.695 -5.400 -1.846 594 HG3 GLU 535 HG3 GLU 535 76.732 -5.263 -0.093 595 H ASN 536 H ASN 536 81.301 -4.148 -2.150 596 HA ASN 536 HA ASN 536 80.697 -6.060 -4.236 597 HB2 ASN 536 HB2 ASN 536 79.737 -4.045 -5.189 598 HB3 ASN 536 HB3 ASN 536 81.225 -3.152 -4.885 599 HD21 ASN 536 HD21 ASN 536 81.188 -6.515 -6.066 600 HD22 ASN 536 HD22 ASN 536 81.814 -6.154 -7.601 601 H VAL 537 H VAL 537 82.555 -6.378 -2.286 602 HA VAL 537 HA VAL 537 85.166 -5.578 -3.367 603 HB VAL 537 HB VAL 537 84.442 -7.077 -0.838 604 HG11 VAL 537 HG11 VAL 537 86.676 -7.679 -1.537 605 HG12 VAL 537 HG12 VAL 537 86.827 -6.489 -0.245 606 HG13 VAL 537 HG13 VAL 537 87.058 -6.002 -1.923 607 HG21 VAL 537 HG21 VAL 537 83.763 -4.611 -1.110 608 HG22 VAL 537 HG22 VAL 537 85.487 -4.253 -1.132 609 HG23 VAL 537 HG23 VAL 537 84.760 -5.000 0.291 610 H THR 538 H THR 538 84.170 -8.628 -1.874 611 HA THR 538 HA THR 538 84.547 -10.172 -4.253 612 HB THR 538 HB THR 538 86.655 -10.554 -2.118 613 HG1 THR 538 HG1 THR 538 87.620 -9.614 -4.416 614 HG21 THR 538 HG21 THR 538 86.697 -11.416 -5.010 615 HG22 THR 538 HG22 THR 538 85.941 -12.411 -3.764 616 HG23 THR 538 HG23 THR 538 87.661 -12.031 -3.668 617 HA PRO 539 HA PRO 539 82.348 -12.156 -0.665 618 HB2 PRO 539 HB2 PRO 539 79.811 -11.946 -2.061 619 HB3 PRO 539 HB3 PRO 539 80.303 -11.131 -0.569 620 HG2 PRO 539 HG2 PRO 539 79.858 -9.832 -2.951 621 HG3 PRO 539 HG3 PRO 539 80.924 -9.221 -1.671 622 HD2 PRO 539 HD2 PRO 539 81.664 -10.706 -4.185 623 HD3 PRO 539 HD3 PRO 539 82.441 -9.286 -3.443 624 H THR 540 H THR 540 80.734 -12.633 -3.804 625 HA THR 540 HA THR 540 81.692 -15.412 -3.938 626 HB THR 540 HB THR 540 79.318 -16.100 -4.473 627 HG1 THR 540 HG1 THR 540 77.933 -14.545 -4.595 628 HG21 THR 540 HG21 THR 540 80.434 -16.475 -2.263 629 HG22 THR 540 HG22 THR 540 78.686 -16.272 -2.126 630 HG23 THR 540 HG23 THR 540 79.765 -14.939 -1.711 631 H ASN 541 H ASN 541 82.966 -14.687 -5.723 632 HA ASN 541 HA ASN 541 81.626 -13.496 -8.005 633 HB2 ASN 541 HB2 ASN 541 84.482 -14.430 -7.634 634 HB3 ASN 541 HB3 ASN 541 83.870 -13.561 -9.041 635 HD21 ASN 541 HD21 ASN 541 82.045 -11.861 -7.415 636 HD22 ASN 541 HD22 ASN 541 83.036 -10.750 -6.603 637 H ASP 542 H ASP 542 81.101 -14.418 -9.863 638 HA ASP 542 HA ASP 542 80.535 -17.176 -9.926 639 HB2 ASP 542 HB2 ASP 542 80.560 -15.065 -12.096 640 HB3 ASP 542 HB3 ASP 542 79.968 -16.712 -12.336 641 H GLN 543 H GLN 543 81.492 -18.879 -10.940 642 HA GLN 543 HA GLN 543 84.331 -18.704 -11.436 643 HB2 GLN 543 HB2 GLN 543 83.263 -20.655 -10.311 644 HB3 GLN 543 HB3 GLN 543 82.440 -21.039 -11.823 645 HG2 GLN 543 HG2 GLN 543 84.637 -21.278 -12.948 646 HG3 GLN 543 HG3 GLN 543 85.446 -20.935 -11.419 647 HE21 GLN 543 HE21 GLN 543 86.302 -22.962 -10.791 648 HE22 GLN 543 HE22 GLN 543 85.386 -24.388 -10.685 Start of MODEL 17 1 H1 SER 466 H1 SER 466 31.946 0.010 -3.655 2 H2 SER 466 H2 SER 466 30.635 0.200 -2.590 3 H3 SER 466 H3 SER 466 32.179 -0.160 -1.983 4 HA SER 466 HA SER 466 32.842 2.045 -3.174 5 HB2 SER 466 HB2 SER 466 29.858 2.276 -2.717 6 HB3 SER 466 HB3 SER 466 30.916 3.669 -2.919 7 HG SER 466 HG SER 466 31.564 2.679 -4.935 8 H ASP 467 H ASP 467 30.942 0.712 -0.566 9 HA ASP 467 HA ASP 467 31.428 2.733 1.376 10 HB2 ASP 467 HB2 ASP 467 30.682 -0.181 1.603 11 HB3 ASP 467 HB3 ASP 467 30.797 0.896 2.993 12 H ASP 468 H ASP 468 33.360 0.153 0.147 13 HA ASP 468 HA ASP 468 35.197 0.129 2.426 14 HB2 ASP 468 HB2 ASP 468 34.519 -1.955 1.162 15 HB3 ASP 468 HB3 ASP 468 35.413 -1.325 -0.217 16 H TYR 469 H TYR 469 34.646 2.075 -0.072 17 HA TYR 469 HA TYR 469 37.178 2.530 -1.264 18 HB2 TYR 469 HB2 TYR 469 34.874 3.129 -2.093 19 HB3 TYR 469 HB3 TYR 469 34.913 4.474 -0.959 20 HD1 TYR 469 HD1 TYR 469 36.486 3.005 -3.963 21 HD2 TYR 469 HD2 TYR 469 36.267 6.413 -1.364 22 HE1 TYR 469 HE1 TYR 469 37.736 4.350 -5.624 23 HE2 TYR 469 HE2 TYR 469 37.520 7.761 -3.022 24 HH TYR 469 HH TYR 469 39.331 6.869 -5.124 25 H VAL 470 H VAL 470 38.685 4.167 -0.925 26 HA VAL 470 HA VAL 470 38.700 5.371 1.783 27 HB VAL 470 HB VAL 470 41.145 5.076 0.038 28 HG11 VAL 470 HG11 VAL 470 40.660 5.198 3.029 29 HG12 VAL 470 HG12 VAL 470 41.389 6.454 2.027 30 HG13 VAL 470 HG13 VAL 470 42.231 4.925 2.280 31 HG21 VAL 470 HG21 VAL 470 40.287 2.842 0.082 32 HG22 VAL 470 HG22 VAL 470 39.818 2.985 1.776 33 HG23 VAL 470 HG23 VAL 470 41.524 2.919 1.336 34 H ASP 471 H ASP 471 38.901 7.519 2.057 35 HA ASP 471 HA ASP 471 38.158 9.372 0.176 36 HB2 ASP 471 HB2 ASP 471 40.021 9.710 2.539 37 HB3 ASP 471 HB3 ASP 471 39.402 11.060 1.589 38 H GLU 472 H GLU 472 39.172 10.702 -1.245 39 HA GLU 472 HA GLU 472 41.300 9.694 -2.754 40 HB2 GLU 472 HB2 GLU 472 39.920 12.359 -2.637 41 HB3 GLU 472 HB3 GLU 472 41.302 12.123 -3.704 42 HG2 GLU 472 HG2 GLU 472 38.946 10.234 -3.703 43 HG3 GLU 472 HG3 GLU 472 38.979 11.684 -4.705 44 H GLU 473 H GLU 473 41.284 12.212 -0.269 45 HA GLU 473 HA GLU 473 43.939 13.088 -0.665 46 HB2 GLU 473 HB2 GLU 473 43.708 14.155 1.471 47 HB3 GLU 473 HB3 GLU 473 42.153 14.256 0.655 48 HG2 GLU 473 HG2 GLU 473 41.523 12.116 1.924 49 HG3 GLU 473 HG3 GLU 473 42.955 12.414 2.911 50 H THR 474 H THR 474 42.536 10.704 1.489 51 HA THR 474 HA THR 474 44.958 9.878 2.763 52 HB THR 474 HB THR 474 42.244 8.606 2.382 53 HG1 THR 474 HG1 THR 474 42.757 10.483 3.836 54 HG21 THR 474 HG21 THR 474 43.035 7.033 4.235 55 HG22 THR 474 HG22 THR 474 44.674 7.530 3.808 56 HG23 THR 474 HG23 THR 474 43.652 6.726 2.612 57 H TYR 475 H TYR 475 43.023 8.606 0.107 58 HA TYR 475 HA TYR 475 44.565 6.320 -0.405 59 HB2 TYR 475 HB2 TYR 475 42.232 6.806 -1.207 60 HB3 TYR 475 HB3 TYR 475 42.940 7.900 -2.399 61 HD1 TYR 475 HD1 TYR 475 43.322 4.452 -1.072 62 HD2 TYR 475 HD2 TYR 475 43.541 7.028 -4.494 63 HE1 TYR 475 HE1 TYR 475 43.803 2.484 -2.520 64 HE2 TYR 475 HE2 TYR 475 44.029 5.070 -5.948 65 HH TYR 475 HH TYR 475 45.148 2.350 -5.046 66 H ASN 476 H ASN 476 44.673 9.554 -1.897 67 HA ASN 476 HA ASN 476 46.735 8.896 -3.735 68 HB2 ASN 476 HB2 ASN 476 46.072 11.606 -2.566 69 HB3 ASN 476 HB3 ASN 476 46.969 11.290 -4.052 70 HD21 ASN 476 HD21 ASN 476 44.789 8.885 -4.118 71 HD22 ASN 476 HD22 ASN 476 43.497 9.642 -4.920 72 H LEU 477 H LEU 477 46.699 10.212 -0.463 73 HA LEU 477 HA LEU 477 49.391 10.853 -0.149 74 HB2 LEU 477 HB2 LEU 477 47.654 11.299 1.547 75 HB3 LEU 477 HB3 LEU 477 47.479 9.572 1.829 76 HG LEU 477 HG LEU 477 49.774 9.439 2.626 77 HD11 LEU 477 HD11 LEU 477 49.819 12.326 1.769 78 HD12 LEU 477 HD12 LEU 477 51.026 11.070 1.501 79 HD13 LEU 477 HD13 LEU 477 50.855 11.798 3.096 80 HD21 LEU 477 HD21 LEU 477 47.987 9.926 4.222 81 HD22 LEU 477 HD22 LEU 477 48.154 11.651 3.906 82 HD23 LEU 477 HD23 LEU 477 49.462 10.769 4.696 83 H GLN 478 H GLN 478 47.729 7.724 0.319 84 HA GLN 478 HA GLN 478 49.989 6.176 0.991 85 HB2 GLN 478 HB2 GLN 478 47.382 5.450 -0.346 86 HB3 GLN 478 HB3 GLN 478 48.540 4.273 0.280 87 HG2 GLN 478 HG2 GLN 478 47.323 6.475 1.950 88 HG3 GLN 478 HG3 GLN 478 46.664 4.845 1.869 89 HE21 GLN 478 HE21 GLN 478 47.731 3.216 3.010 90 HE22 GLN 478 HE22 GLN 478 49.082 3.487 3.998 91 H LYS 479 H LYS 479 48.523 7.056 -2.025 92 HA LYS 479 HA LYS 479 49.997 5.400 -3.779 93 HB2 LYS 479 HB2 LYS 479 47.819 6.760 -4.102 94 HB3 LYS 479 HB3 LYS 479 48.885 8.111 -4.459 95 HG2 LYS 479 HG2 LYS 479 49.895 6.912 -6.308 96 HG3 LYS 479 HG3 LYS 479 49.006 5.445 -5.897 97 HD2 LYS 479 HD2 LYS 479 47.685 6.342 -7.616 98 HD3 LYS 479 HD3 LYS 479 46.870 6.963 -6.185 99 HE2 LYS 479 HE2 LYS 479 47.155 8.764 -7.808 100 HE3 LYS 479 HE3 LYS 479 48.176 9.085 -6.410 101 HZ1 LYS 479 HZ1 LYS 479 49.683 7.528 -8.117 102 HZ2 LYS 479 HZ2 LYS 479 49.884 9.184 -7.797 103 HZ3 LYS 479 HZ3 LYS 479 48.930 8.678 -9.110 104 H LEU 480 H LEU 480 50.503 8.629 -2.507 105 HA LEU 480 HA LEU 480 52.679 9.335 -4.175 106 HB2 LEU 480 HB2 LEU 480 51.419 10.371 -1.676 107 HB3 LEU 480 HB3 LEU 480 53.054 10.914 -2.017 108 HG LEU 480 HG LEU 480 52.256 11.585 -4.320 109 HD11 LEU 480 HD11 LEU 480 49.485 11.381 -3.151 110 HD12 LEU 480 HD12 LEU 480 50.166 10.120 -4.183 111 HD13 LEU 480 HD13 LEU 480 49.941 11.747 -4.812 112 HD21 LEU 480 HD21 LEU 480 50.921 13.589 -3.382 113 HD22 LEU 480 HD22 LEU 480 52.567 13.340 -2.807 114 HD23 LEU 480 HD23 LEU 480 51.200 12.854 -1.799 115 H LEU 481 H LEU 481 52.650 8.341 -0.760 116 HA LEU 481 HA LEU 481 55.512 8.062 -0.614 117 HB2 LEU 481 HB2 LEU 481 55.044 7.361 1.693 118 HB3 LEU 481 HB3 LEU 481 54.178 8.837 1.271 119 HG LEU 481 HG LEU 481 52.331 6.919 0.501 120 HD11 LEU 481 HD11 LEU 481 52.177 5.286 2.333 121 HD12 LEU 481 HD12 LEU 481 53.687 5.889 3.011 122 HD13 LEU 481 HD13 LEU 481 53.681 5.087 1.444 123 HD21 LEU 481 HD21 LEU 481 51.094 7.525 2.490 124 HD22 LEU 481 HD22 LEU 481 51.963 8.956 1.931 125 HD23 LEU 481 HD23 LEU 481 52.567 8.026 3.300 126 H ALA 482 H ALA 482 53.139 6.114 -1.872 127 HA ALA 482 HA ALA 482 53.470 3.584 -0.965 128 HB1 ALA 482 HB1 ALA 482 52.055 3.344 -2.716 129 HB2 ALA 482 HB2 ALA 482 53.475 3.230 -3.758 130 HB3 ALA 482 HB3 ALA 482 52.697 4.783 -3.494 131 HA PRO 483 HA PRO 483 57.276 2.676 -4.010 132 HB2 PRO 483 HB2 PRO 483 58.781 5.147 -4.029 133 HB3 PRO 483 HB3 PRO 483 58.041 4.313 -5.404 134 HG2 PRO 483 HG2 PRO 483 57.010 6.568 -3.792 135 HG3 PRO 483 HG3 PRO 483 56.683 6.150 -5.481 136 HD2 PRO 483 HD2 PRO 483 54.822 5.792 -3.588 137 HD3 PRO 483 HD3 PRO 483 55.005 4.611 -4.903 138 H TYR 484 H TYR 484 57.693 5.289 -1.619 139 HA TYR 484 HA TYR 484 60.108 4.357 -0.493 140 HB2 TYR 484 HB2 TYR 484 59.692 6.571 0.044 141 HB3 TYR 484 HB3 TYR 484 57.974 6.290 0.335 142 HD1 TYR 484 HD1 TYR 484 61.374 5.651 1.763 143 HD2 TYR 484 HD2 TYR 484 57.160 5.896 2.552 144 HE1 TYR 484 HE1 TYR 484 61.808 5.423 4.198 145 HE2 TYR 484 HE2 TYR 484 57.602 5.672 4.979 146 HH TYR 484 HH TYR 484 59.955 6.278 6.485 147 H HIS 485 H HIS 485 56.740 3.780 0.352 148 HA HIS 485 HA HIS 485 57.139 2.323 2.724 149 HB2 HIS 485 HB2 HIS 485 54.963 3.221 1.884 150 HB3 HIS 485 HB3 HIS 485 54.943 1.938 0.681 151 HD1 HIS 485 HD1 HIS 485 54.610 -0.504 1.541 152 HD2 HIS 485 HD2 HIS 485 54.341 2.404 4.514 153 HE1 HIS 485 HE1 HIS 485 53.550 -1.628 3.547 154 H LYS 486 H LYS 486 57.450 1.448 -0.630 155 HA LYS 486 HA LYS 486 57.616 -1.427 -0.103 156 HB2 LYS 486 HB2 LYS 486 57.954 0.227 -2.621 157 HB3 LYS 486 HB3 LYS 486 57.939 -1.537 -2.568 158 HG2 LYS 486 HG2 LYS 486 55.670 -1.525 -1.667 159 HG3 LYS 486 HG3 LYS 486 55.679 0.235 -1.598 160 HD2 LYS 486 HD2 LYS 486 55.939 0.324 -4.060 161 HD3 LYS 486 HD3 LYS 486 55.905 -1.440 -4.116 162 HE2 LYS 486 HE2 LYS 486 53.671 -0.777 -4.594 163 HE3 LYS 486 HE3 LYS 486 53.644 -1.280 -2.905 164 HZ1 LYS 486 HZ1 LYS 486 52.986 1.225 -3.986 165 HZ2 LYS 486 HZ2 LYS 486 54.346 1.423 -2.989 166 HZ3 LYS 486 HZ3 LYS 486 52.928 0.731 -2.364 167 H ALA 487 H ALA 487 59.651 1.309 -0.395 168 HA ALA 487 HA ALA 487 62.078 0.115 -1.243 169 HB1 ALA 487 HB1 ALA 487 61.670 2.630 0.375 170 HB2 ALA 487 HB2 ALA 487 61.564 2.540 -1.380 171 HB3 ALA 487 HB3 ALA 487 63.097 2.209 -0.571 172 H LYS 488 H LYS 488 63.099 -1.404 -0.145 173 HA LYS 488 HA LYS 488 62.992 -1.526 2.788 174 HB2 LYS 488 HB2 LYS 488 64.174 -3.409 0.748 175 HB3 LYS 488 HB3 LYS 488 64.100 -3.713 2.485 176 HG2 LYS 488 HG2 LYS 488 61.633 -3.460 2.397 177 HG3 LYS 488 HG3 LYS 488 61.734 -3.251 0.651 178 HD2 LYS 488 HD2 LYS 488 62.802 -5.698 2.082 179 HD3 LYS 488 HD3 LYS 488 61.164 -5.602 1.438 180 HE2 LYS 488 HE2 LYS 488 62.256 -4.976 -0.806 181 HE3 LYS 488 HE3 LYS 488 63.772 -5.519 -0.088 182 HZ1 LYS 488 HZ1 LYS 488 63.182 -7.636 -0.302 183 HZ2 LYS 488 HZ2 LYS 488 61.927 -7.099 -1.315 184 HZ3 LYS 488 HZ3 LYS 488 61.634 -7.367 0.337 185 H THR 489 H THR 489 64.990 -0.202 0.429 186 HA THR 489 HA THR 489 67.444 -0.458 2.067 187 HB THR 489 HB THR 489 68.439 0.597 -0.110 188 HG1 THR 489 HG1 THR 489 67.160 0.222 -1.908 189 HG21 THR 489 HG21 THR 489 67.274 -2.203 -0.119 190 HG22 THR 489 HG22 THR 489 68.811 -1.732 0.607 191 HG23 THR 489 HG23 THR 489 68.595 -1.633 -1.141 192 H LEU 490 H LEU 490 68.293 1.253 3.076 193 HA LEU 490 HA LEU 490 66.824 3.593 3.541 194 HB2 LEU 490 HB2 LEU 490 69.673 2.774 3.995 195 HB3 LEU 490 HB3 LEU 490 69.175 4.422 4.360 196 HG LEU 490 HG LEU 490 67.496 2.145 5.398 197 HD11 LEU 490 HD11 LEU 490 68.934 2.237 7.507 198 HD12 LEU 490 HD12 LEU 490 70.164 3.028 6.521 199 HD13 LEU 490 HD13 LEU 490 69.640 1.389 6.132 200 HD21 LEU 490 HD21 LEU 490 66.646 4.357 5.760 201 HD22 LEU 490 HD22 LEU 490 68.201 4.928 6.356 202 HD23 LEU 490 HD23 LEU 490 67.259 3.783 7.307 203 H GLU 491 H GLU 491 69.568 3.026 1.383 204 HA GLU 491 HA GLU 491 70.032 5.616 0.461 205 HB2 GLU 491 HB2 GLU 491 71.493 3.729 -0.039 206 HB3 GLU 491 HB3 GLU 491 70.219 2.964 -0.981 207 HG2 GLU 491 HG2 GLU 491 71.815 4.063 -2.464 208 HG3 GLU 491 HG3 GLU 491 70.261 4.881 -2.565 209 H ARG 492 H ARG 492 67.797 3.174 -0.722 210 HA ARG 492 HA ARG 492 66.747 4.757 -2.854 211 HB2 ARG 492 HB2 ARG 492 66.639 2.349 -2.949 212 HB3 ARG 492 HB3 ARG 492 65.699 2.300 -1.461 213 HG2 ARG 492 HG2 ARG 492 63.802 3.348 -2.511 214 HG3 ARG 492 HG3 ARG 492 64.745 3.712 -3.967 215 HD2 ARG 492 HD2 ARG 492 63.346 1.700 -4.302 216 HD3 ARG 492 HD3 ARG 492 65.062 1.306 -4.378 217 HE ARG 492 HE ARG 492 64.040 1.010 -1.723 218 HH11 ARG 492 HH11 ARG 492 62.322 -0.503 -3.923 219 HH12 ARG 492 HH12 ARG 492 62.977 -2.095 -3.740 220 HH21 ARG 492 HH21 ARG 492 65.718 -1.040 -1.895 221 HH22 ARG 492 HH22 ARG 492 64.903 -2.402 -2.591 222 H GLN 493 H GLN 493 65.734 4.093 0.454 223 HA GLN 493 HA GLN 493 63.202 5.273 0.376 224 HB2 GLN 493 HB2 GLN 493 65.244 4.973 2.569 225 HB3 GLN 493 HB3 GLN 493 63.666 5.692 2.861 226 HG2 GLN 493 HG2 GLN 493 62.529 3.695 2.235 227 HG3 GLN 493 HG3 GLN 493 63.983 2.987 1.559 228 HE21 GLN 493 HE21 GLN 493 63.053 1.258 3.251 229 HE22 GLN 493 HE22 GLN 493 63.724 1.355 4.808 230 H VAL 494 H VAL 494 66.376 6.701 1.063 231 HA VAL 494 HA VAL 494 65.510 9.330 1.622 232 HB VAL 494 HB VAL 494 68.094 8.240 0.482 233 HG11 VAL 494 HG11 VAL 494 67.950 10.571 -0.207 234 HG12 VAL 494 HG12 VAL 494 69.064 10.454 1.153 235 HG13 VAL 494 HG13 VAL 494 67.425 11.052 1.408 236 HG21 VAL 494 HG21 VAL 494 67.643 7.524 2.751 237 HG22 VAL 494 HG22 VAL 494 67.206 9.164 3.228 238 HG23 VAL 494 HG23 VAL 494 68.876 8.782 2.812 239 H TYR 495 H TYR 495 66.509 7.762 -1.392 240 HA TYR 495 HA TYR 495 66.203 9.978 -3.118 241 HB2 TYR 495 HB2 TYR 495 67.399 8.045 -3.833 242 HB3 TYR 495 HB3 TYR 495 66.021 7.001 -3.515 243 HD1 TYR 495 HD1 TYR 495 66.655 10.169 -5.448 244 HD2 TYR 495 HD2 TYR 495 64.941 6.226 -5.426 245 HE1 TYR 495 HE1 TYR 495 65.925 10.467 -7.797 246 HE2 TYR 495 HE2 TYR 495 64.211 6.529 -7.772 247 HH TYR 495 HH TYR 495 64.916 9.546 -9.538 248 H GLU 496 H GLU 496 63.921 7.366 -2.295 249 HA GLU 496 HA GLU 496 61.809 8.338 -3.923 250 HB2 GLU 496 HB2 GLU 496 61.772 6.591 -1.453 251 HB3 GLU 496 HB3 GLU 496 60.378 6.866 -2.499 252 HG2 GLU 496 HG2 GLU 496 63.026 5.768 -3.469 253 HG3 GLU 496 HG3 GLU 496 61.647 4.760 -3.036 254 H LEU 497 H LEU 497 62.785 8.957 -0.621 255 HA LEU 497 HA LEU 497 60.518 10.402 0.211 256 HB2 LEU 497 HB2 LEU 497 63.395 10.302 1.072 257 HB3 LEU 497 HB3 LEU 497 62.314 11.489 1.796 258 HG LEU 497 HG LEU 497 61.432 8.608 1.653 259 HD11 LEU 497 HD11 LEU 497 63.254 7.966 2.835 260 HD12 LEU 497 HD12 LEU 497 62.485 8.765 4.194 261 HD13 LEU 497 HD13 LEU 497 63.714 9.606 3.254 262 HD21 LEU 497 HD21 LEU 497 60.015 10.656 2.420 263 HD22 LEU 497 HD22 LEU 497 61.018 10.618 3.871 264 HD23 LEU 497 HD23 LEU 497 60.023 9.225 3.453 265 H GLU 498 H GLU 498 63.453 11.357 -1.493 266 HA GLU 498 HA GLU 498 63.136 14.140 -1.396 267 HB2 GLU 498 HB2 GLU 498 64.376 12.311 -3.446 268 HB3 GLU 498 HB3 GLU 498 64.403 14.059 -3.620 269 HG2 GLU 498 HG2 GLU 498 65.362 12.671 -1.116 270 HG3 GLU 498 HG3 GLU 498 66.436 13.005 -2.473 271 H LYS 499 H LYS 499 61.730 11.674 -3.470 272 HA LYS 499 HA LYS 499 60.464 13.438 -5.351 273 HB2 LYS 499 HB2 LYS 499 59.468 10.727 -4.416 274 HB3 LYS 499 HB3 LYS 499 59.138 11.510 -5.960 275 HG2 LYS 499 HG2 LYS 499 61.851 10.575 -4.985 276 HG3 LYS 499 HG3 LYS 499 60.883 9.808 -6.246 277 HD2 LYS 499 HD2 LYS 499 60.939 12.183 -7.361 278 HD3 LYS 499 HD3 LYS 499 62.315 12.447 -6.293 279 HE2 LYS 499 HE2 LYS 499 63.258 10.275 -7.224 280 HE3 LYS 499 HE3 LYS 499 62.035 10.405 -8.484 281 HZ1 LYS 499 HZ1 LYS 499 64.466 11.885 -8.159 282 HZ2 LYS 499 HZ2 LYS 499 63.120 12.903 -8.339 283 HZ3 LYS 499 HZ3 LYS 499 63.470 11.738 -9.524 284 H LEU 500 H LEU 500 59.357 11.981 -2.324 285 HA LEU 500 HA LEU 500 56.705 12.959 -2.411 286 HB2 LEU 500 HB2 LEU 500 58.379 12.500 0.055 287 HB3 LEU 500 HB3 LEU 500 56.626 12.378 -0.088 288 HG LEU 500 HG LEU 500 58.688 10.607 -1.391 289 HD11 LEU 500 HD11 LEU 500 58.198 10.132 0.989 290 HD12 LEU 500 HD12 LEU 500 57.715 8.819 -0.084 291 HD13 LEU 500 HD13 LEU 500 56.499 9.919 0.564 292 HD21 LEU 500 HD21 LEU 500 57.007 10.798 -3.044 293 HD22 LEU 500 HD22 LEU 500 55.714 10.803 -1.842 294 HD23 LEU 500 HD23 LEU 500 56.614 9.325 -2.177 295 H GLN 501 H GLN 501 59.489 14.253 -0.613 296 HA GLN 501 HA GLN 501 58.327 16.497 0.453 297 HB2 GLN 501 HB2 GLN 501 61.094 15.907 -0.564 298 HB3 GLN 501 HB3 GLN 501 60.718 17.499 0.095 299 HG2 GLN 501 HG2 GLN 501 61.635 15.626 1.702 300 HG3 GLN 501 HG3 GLN 501 60.311 16.657 2.243 301 HE21 GLN 501 HE21 GLN 501 58.103 15.701 2.226 302 HE22 GLN 501 HE22 GLN 501 57.904 14.015 2.221 303 H GLU 502 H GLU 502 59.101 15.898 -2.856 304 HA GLU 502 HA GLU 502 58.819 18.677 -3.688 305 HB2 GLU 502 HB2 GLU 502 60.473 17.389 -4.827 306 HB3 GLU 502 HB3 GLU 502 59.340 16.074 -5.117 307 HG2 GLU 502 HG2 GLU 502 58.100 17.364 -6.692 308 HG3 GLU 502 HG3 GLU 502 58.952 18.848 -6.258 309 H LYS 503 H LYS 503 56.877 15.802 -3.460 310 HA LYS 503 HA LYS 503 54.688 17.090 -5.011 311 HB2 LYS 503 HB2 LYS 503 55.373 14.208 -4.499 312 HB3 LYS 503 HB3 LYS 503 53.920 14.746 -5.348 313 HG2 LYS 503 HG2 LYS 503 55.344 15.965 -6.968 314 HG3 LYS 503 HG3 LYS 503 56.777 15.364 -6.142 315 HD2 LYS 503 HD2 LYS 503 54.667 13.529 -7.293 316 HD3 LYS 503 HD3 LYS 503 56.066 14.070 -8.216 317 HE2 LYS 503 HE2 LYS 503 57.505 13.172 -6.297 318 HE3 LYS 503 HE3 LYS 503 56.044 12.384 -5.706 319 HZ1 LYS 503 HZ1 LYS 503 55.833 11.206 -7.758 320 HZ2 LYS 503 HZ2 LYS 503 57.402 10.958 -7.156 321 HZ3 LYS 503 HZ3 LYS 503 57.141 12.042 -8.438 322 H LEU 504 H LEU 504 55.428 15.265 -2.096 323 HA LEU 504 HA LEU 504 52.914 14.814 -1.111 324 HB2 LEU 504 HB2 LEU 504 55.474 14.456 -0.182 325 HB3 LEU 504 HB3 LEU 504 54.826 15.605 0.976 326 HG LEU 504 HG LEU 504 52.817 14.021 1.163 327 HD11 LEU 504 HD11 LEU 504 53.969 12.753 -1.012 328 HD12 LEU 504 HD12 LEU 504 52.750 12.053 0.050 329 HD13 LEU 504 HD13 LEU 504 54.453 11.710 0.325 330 HD21 LEU 504 HD21 LEU 504 55.459 12.795 1.998 331 HD22 LEU 504 HD22 LEU 504 53.915 12.712 2.846 332 HD23 LEU 504 HD23 LEU 504 54.804 14.229 2.781 333 HA PRO 505 HA PRO 505 51.270 19.076 -0.818 334 HB2 PRO 505 HB2 PRO 505 49.600 18.121 1.373 335 HB3 PRO 505 HB3 PRO 505 49.110 18.534 -0.279 336 HG2 PRO 505 HG2 PRO 505 49.870 15.882 0.840 337 HG3 PRO 505 HG3 PRO 505 48.725 16.269 -0.451 338 HD2 PRO 505 HD2 PRO 505 51.006 15.194 -1.070 339 HD3 PRO 505 HD3 PRO 505 50.475 16.598 -2.017 340 H GLU 506 H GLU 506 51.661 20.753 0.541 341 HA GLU 506 HA GLU 506 53.857 20.949 2.061 342 HB2 GLU 506 HB2 GLU 506 51.247 22.405 2.482 343 HB3 GLU 506 HB3 GLU 506 52.782 22.903 3.195 344 HG2 GLU 506 HG2 GLU 506 52.334 22.522 0.222 345 HG3 GLU 506 HG3 GLU 506 52.244 24.081 1.038 346 H LYS 507 H LYS 507 50.695 20.662 3.699 347 HA LYS 507 HA LYS 507 51.610 20.377 6.279 348 HB2 LYS 507 HB2 LYS 507 49.499 19.329 6.779 349 HB3 LYS 507 HB3 LYS 507 49.218 20.530 5.517 350 HG2 LYS 507 HG2 LYS 507 49.560 18.618 3.836 351 HG3 LYS 507 HG3 LYS 507 49.420 17.534 5.221 352 HD2 LYS 507 HD2 LYS 507 47.342 19.576 4.384 353 HD3 LYS 507 HD3 LYS 507 47.239 17.841 4.098 354 HE2 LYS 507 HE2 LYS 507 46.030 17.972 6.072 355 HE3 LYS 507 HE3 LYS 507 47.643 17.749 6.748 356 HZ1 LYS 507 HZ1 LYS 507 47.357 20.459 6.255 357 HZ2 LYS 507 HZ2 LYS 507 47.388 19.683 7.766 358 HZ3 LYS 507 HZ3 LYS 507 45.907 19.969 6.984 359 H TYR 508 H TYR 508 51.693 18.019 3.730 360 HA TYR 508 HA TYR 508 52.473 15.866 5.575 361 HB2 TYR 508 HB2 TYR 508 51.840 15.993 2.627 362 HB3 TYR 508 HB3 TYR 508 52.585 14.579 3.366 363 HD1 TYR 508 HD1 TYR 508 51.460 13.434 5.260 364 HD2 TYR 508 HD2 TYR 508 49.493 16.386 2.876 365 HE1 TYR 508 HE1 TYR 508 49.273 12.631 6.082 366 HE2 TYR 508 HE2 TYR 508 47.287 15.568 3.666 367 HH TYR 508 HH TYR 508 47.036 12.706 5.729 368 H LYS 509 H LYS 509 53.801 18.220 3.451 369 HA LYS 509 HA LYS 509 56.252 16.970 2.784 370 HB2 LYS 509 HB2 LYS 509 55.367 19.026 1.723 371 HB3 LYS 509 HB3 LYS 509 55.649 19.894 3.225 372 HG2 LYS 509 HG2 LYS 509 58.043 19.453 3.070 373 HG3 LYS 509 HG3 LYS 509 57.787 18.533 1.580 374 HD2 LYS 509 HD2 LYS 509 56.790 20.524 0.523 375 HD3 LYS 509 HD3 LYS 509 57.066 21.446 1.998 376 HE2 LYS 509 HE2 LYS 509 59.493 21.072 1.776 377 HE3 LYS 509 HE3 LYS 509 59.213 20.157 0.294 378 HZ1 LYS 509 HZ1 LYS 509 58.189 22.132 -0.675 379 HZ2 LYS 509 HZ2 LYS 509 59.794 22.438 -0.209 380 HZ3 LYS 509 HZ3 LYS 509 58.506 23.007 0.741 381 H ALA 510 H ALA 510 55.352 19.187 5.422 382 HA ALA 510 HA ALA 510 57.834 19.314 6.709 383 HB1 ALA 510 HB1 ALA 510 56.161 20.846 7.407 384 HB2 ALA 510 HB2 ALA 510 56.412 19.781 8.790 385 HB3 ALA 510 HB3 ALA 510 55.012 19.553 7.742 386 H GLU 511 H GLU 511 55.071 17.176 7.432 387 HA GLU 511 HA GLU 511 56.296 15.697 9.500 388 HB2 GLU 511 HB2 GLU 511 53.917 15.602 9.061 389 HB3 GLU 511 HB3 GLU 511 54.197 14.909 7.472 390 HG2 GLU 511 HG2 GLU 511 55.133 12.876 8.495 391 HG3 GLU 511 HG3 GLU 511 54.927 13.581 10.101 392 H TYR 512 H TYR 512 56.301 15.085 6.002 393 HA TYR 512 HA TYR 512 57.825 12.651 6.279 394 HB2 TYR 512 HB2 TYR 512 56.793 14.282 3.983 395 HB3 TYR 512 HB3 TYR 512 57.966 12.994 3.693 396 HD1 TYR 512 HD1 TYR 512 54.862 13.575 5.712 397 HD2 TYR 512 HD2 TYR 512 57.113 10.855 3.280 398 HE1 TYR 512 HE1 TYR 512 53.083 11.889 5.979 399 HE2 TYR 512 HE2 TYR 512 55.330 9.148 3.555 400 HH TYR 512 HH TYR 512 52.317 9.916 5.277 401 H LYS 513 H LYS 513 58.555 15.989 5.980 402 HA LYS 513 HA LYS 513 61.181 15.748 4.894 403 HB2 LYS 513 HB2 LYS 513 59.869 17.882 5.024 404 HB3 LYS 513 HB3 LYS 513 60.080 17.858 6.767 405 HG2 LYS 513 HG2 LYS 513 61.834 19.246 6.113 406 HG3 LYS 513 HG3 LYS 513 62.640 17.686 6.185 407 HD2 LYS 513 HD2 LYS 513 63.337 18.492 4.102 408 HD3 LYS 513 HD3 LYS 513 61.956 17.501 3.656 409 HE2 LYS 513 HE2 LYS 513 60.521 19.451 3.498 410 HE3 LYS 513 HE3 LYS 513 61.787 20.487 4.157 411 HZ1 LYS 513 HZ1 LYS 513 62.414 20.819 2.070 412 HZ2 LYS 513 HZ2 LYS 513 61.389 19.598 1.481 413 HZ3 LYS 513 HZ3 LYS 513 62.949 19.209 2.032 414 H LYS 514 H LYS 514 59.739 15.586 8.061 415 HA LYS 514 HA LYS 514 62.098 15.550 9.625 416 HB2 LYS 514 HB2 LYS 514 59.562 15.748 10.274 417 HB3 LYS 514 HB3 LYS 514 59.619 13.991 10.320 418 HG2 LYS 514 HG2 LYS 514 61.355 14.014 11.996 419 HG3 LYS 514 HG3 LYS 514 61.537 15.764 11.864 420 HD2 LYS 514 HD2 LYS 514 58.818 14.645 12.534 421 HD3 LYS 514 HD3 LYS 514 60.046 14.707 13.797 422 HE2 LYS 514 HE2 LYS 514 59.206 17.090 12.113 423 HE3 LYS 514 HE3 LYS 514 58.615 16.754 13.740 424 HZ1 LYS 514 HZ1 LYS 514 61.074 17.932 12.934 425 HZ2 LYS 514 HZ2 LYS 514 61.354 16.566 13.903 426 HZ3 LYS 514 HZ3 LYS 514 60.388 17.836 14.483 427 H LYS 515 H LYS 515 60.095 13.063 8.136 428 HA LYS 515 HA LYS 515 61.515 10.783 9.019 429 HB2 LYS 515 HB2 LYS 515 59.836 11.280 6.562 430 HB3 LYS 515 HB3 LYS 515 60.493 9.693 6.963 431 HG2 LYS 515 HG2 LYS 515 59.341 10.065 9.282 432 HG3 LYS 515 HG3 LYS 515 58.420 11.316 8.446 433 HD2 LYS 515 HD2 LYS 515 58.610 8.461 7.429 434 HD3 LYS 515 HD3 LYS 515 57.337 9.016 8.510 435 HE2 LYS 515 HE2 LYS 515 56.626 10.686 6.879 436 HE3 LYS 515 HE3 LYS 515 57.945 10.230 5.802 437 HZ1 LYS 515 HZ1 LYS 515 55.416 9.067 6.014 438 HZ2 LYS 515 HZ2 LYS 515 56.559 7.915 6.520 439 HZ3 LYS 515 HZ3 LYS 515 56.691 8.629 4.985 440 H LEU 516 H LEU 516 61.847 12.822 6.178 441 HA LEU 516 HA LEU 516 63.731 11.354 4.735 442 HB2 LEU 516 HB2 LEU 516 62.643 13.230 3.741 443 HB3 LEU 516 HB3 LEU 516 63.192 14.306 5.011 444 HG LEU 516 HG LEU 516 65.394 12.952 3.583 445 HD11 LEU 516 HD11 LEU 516 63.806 15.052 2.121 446 HD12 LEU 516 HD12 LEU 516 63.773 13.334 1.718 447 HD13 LEU 516 HD13 LEU 516 65.268 14.254 1.558 448 HD21 LEU 516 HD21 LEU 516 66.319 15.256 3.571 449 HD22 LEU 516 HD22 LEU 516 65.813 14.762 5.186 450 HD23 LEU 516 HD23 LEU 516 64.797 15.849 4.237 451 H ASP 517 H ASP 517 64.196 13.918 7.094 452 HA ASP 517 HA ASP 517 66.988 13.989 7.202 453 HB2 ASP 517 HB2 ASP 517 65.570 15.703 8.225 454 HB3 ASP 517 HB3 ASP 517 64.950 14.523 9.374 455 H GLN 518 H GLN 518 64.661 12.112 9.110 456 HA GLN 518 HA GLN 518 66.516 10.834 10.819 457 HB2 GLN 518 HB2 GLN 518 63.772 10.027 9.865 458 HB3 GLN 518 HB3 GLN 518 64.674 9.144 11.100 459 HG2 GLN 518 HG2 GLN 518 64.766 11.106 12.513 460 HG3 GLN 518 HG3 GLN 518 64.030 12.096 11.258 461 HE21 GLN 518 HE21 GLN 518 63.284 10.555 14.094 462 HE22 GLN 518 HE22 GLN 518 61.633 10.260 13.831 463 H THR 519 H THR 519 65.271 9.937 7.649 464 HA THR 519 HA THR 519 66.361 7.327 7.528 465 HB THR 519 HB THR 519 65.924 9.191 5.187 466 HG1 THR 519 HG1 THR 519 64.064 7.596 6.612 467 HG21 THR 519 HG21 THR 519 65.629 7.233 3.911 468 HG22 THR 519 HG22 THR 519 65.374 6.233 5.339 469 HG23 THR 519 HG23 THR 519 66.989 6.830 4.960 470 H ARG 520 H ARG 520 67.558 10.489 6.572 471 HA ARG 520 HA ARG 520 69.964 9.692 5.342 472 HB2 ARG 520 HB2 ARG 520 69.135 12.224 6.749 473 HB3 ARG 520 HB3 ARG 520 70.678 12.052 5.911 474 HG2 ARG 520 HG2 ARG 520 69.507 11.506 3.831 475 HG3 ARG 520 HG3 ARG 520 67.955 11.625 4.659 476 HD2 ARG 520 HD2 ARG 520 68.397 13.717 3.505 477 HD3 ARG 520 HD3 ARG 520 68.498 13.983 5.244 478 HE ARG 520 HE ARG 520 71.059 13.324 4.252 479 HH11 ARG 520 HH11 ARG 520 69.535 15.477 2.439 480 HH12 ARG 520 HH12 ARG 520 70.315 16.910 3.021 481 HH21 ARG 520 HH21 ARG 520 71.706 15.339 5.786 482 HH22 ARG 520 HH22 ARG 520 71.548 16.833 4.922 483 H VAL 521 H VAL 521 69.123 10.344 8.683 484 HA VAL 521 HA VAL 521 71.712 10.419 9.797 485 HB VAL 521 HB VAL 521 69.031 9.611 10.921 486 HG11 VAL 521 HG11 VAL 521 70.167 10.057 13.163 487 HG12 VAL 521 HG12 VAL 521 71.699 9.910 12.302 488 HG13 VAL 521 HG13 VAL 521 70.587 8.542 12.364 489 HG21 VAL 521 HG21 VAL 521 69.621 12.027 10.107 490 HG22 VAL 521 HG22 VAL 521 70.588 12.100 11.579 491 HG23 VAL 521 HG23 VAL 521 68.849 11.815 11.677 492 H GLU 522 H GLU 522 69.403 7.755 9.391 493 HA GLU 522 HA GLU 522 71.032 5.731 10.535 494 HB2 GLU 522 HB2 GLU 522 68.840 5.577 8.465 495 HB3 GLU 522 HB3 GLU 522 69.503 4.189 9.325 496 HG2 GLU 522 HG2 GLU 522 68.245 6.596 10.662 497 HG3 GLU 522 HG3 GLU 522 67.397 5.083 10.344 498 H LEU 523 H LEU 523 70.506 6.771 7.206 499 HA LEU 523 HA LEU 523 72.187 4.894 5.924 500 HB2 LEU 523 HB2 LEU 523 70.424 6.355 4.852 501 HB3 LEU 523 HB3 LEU 523 71.526 7.713 5.055 502 HG LEU 523 HG LEU 523 73.234 6.070 3.788 503 HD11 LEU 523 HD11 LEU 523 70.552 5.241 2.651 504 HD12 LEU 523 HD12 LEU 523 71.490 4.235 3.748 505 HD13 LEU 523 HD13 LEU 523 72.143 4.659 2.166 506 HD21 LEU 523 HD21 LEU 523 72.591 8.289 2.984 507 HD22 LEU 523 HD22 LEU 523 71.028 7.668 2.446 508 HD23 LEU 523 HD23 LEU 523 72.510 7.134 1.657 509 H ALA 524 H ALA 524 72.762 8.195 7.110 510 HA ALA 524 HA ALA 524 75.350 8.533 6.083 511 HB1 ALA 524 HB1 ALA 524 74.080 9.692 8.569 512 HB2 ALA 524 HB2 ALA 524 74.069 10.409 6.956 513 HB3 ALA 524 HB3 ALA 524 75.585 10.265 7.853 514 H ASP 525 H ASP 525 74.226 7.231 9.162 515 HA ASP 525 HA ASP 525 76.812 6.789 10.290 516 HB2 ASP 525 HB2 ASP 525 74.007 5.856 10.835 517 HB3 ASP 525 HB3 ASP 525 75.343 5.051 11.655 518 H GLN 526 H GLN 526 74.589 4.856 8.355 519 HA GLN 526 HA GLN 526 76.018 2.394 8.452 520 HB2 GLN 526 HB2 GLN 526 73.638 2.601 7.801 521 HB3 GLN 526 HB3 GLN 526 74.125 3.472 6.352 522 HG2 GLN 526 HG2 GLN 526 75.434 1.472 5.630 523 HG3 GLN 526 HG3 GLN 526 74.830 0.606 7.045 524 HE21 GLN 526 HE21 GLN 526 72.928 -0.545 6.687 525 HE22 GLN 526 HE22 GLN 526 71.804 -0.205 5.462 526 H VAL 527 H VAL 527 76.014 5.145 6.271 527 HA VAL 527 HA VAL 527 77.789 4.073 4.317 528 HB VAL 527 HB VAL 527 76.841 6.863 4.985 529 HG11 VAL 527 HG11 VAL 527 78.782 5.938 2.854 530 HG12 VAL 527 HG12 VAL 527 78.982 7.256 4.011 531 HG13 VAL 527 HG13 VAL 527 77.834 7.417 2.681 532 HG21 VAL 527 HG21 VAL 527 75.350 5.031 3.927 533 HG22 VAL 527 HG22 VAL 527 76.349 5.242 2.488 534 HG23 VAL 527 HG23 VAL 527 75.419 6.599 3.126 535 H LYS 528 H LYS 528 78.185 6.170 7.110 536 HA LYS 528 HA LYS 528 80.935 6.760 6.767 537 HB2 LYS 528 HB2 LYS 528 79.439 8.073 8.183 538 HB3 LYS 528 HB3 LYS 528 79.216 6.678 9.235 539 HG2 LYS 528 HG2 LYS 528 81.558 6.704 9.871 540 HG3 LYS 528 HG3 LYS 528 81.894 7.986 8.704 541 HD2 LYS 528 HD2 LYS 528 81.659 9.011 10.888 542 HD3 LYS 528 HD3 LYS 528 80.242 9.435 9.927 543 HE2 LYS 528 HE2 LYS 528 78.841 7.964 11.101 544 HE3 LYS 528 HE3 LYS 528 80.188 7.009 11.717 545 HZ1 LYS 528 HZ1 LYS 528 79.784 9.847 12.454 546 HZ2 LYS 528 HZ2 LYS 528 80.776 8.697 13.214 547 HZ3 LYS 528 HZ3 LYS 528 79.085 8.575 13.334 548 H SER 529 H SER 529 79.225 4.307 8.674 549 HA SER 529 HA SER 529 81.609 3.226 9.819 550 HB2 SER 529 HB2 SER 529 78.913 1.894 9.518 551 HB3 SER 529 HB3 SER 529 80.177 1.467 10.667 552 HG SER 529 HG SER 529 78.721 3.907 10.527 553 H ALA 530 H ALA 530 79.557 2.434 7.074 554 HA ALA 530 HA ALA 530 80.986 0.039 6.362 555 HB1 ALA 530 HB1 ALA 530 78.562 0.420 5.855 556 HB2 ALA 530 HB2 ALA 530 79.517 -0.027 4.438 557 HB3 ALA 530 HB3 ALA 530 79.053 1.655 4.696 558 H VAL 531 H VAL 531 82.069 2.988 6.393 559 HA VAL 531 HA VAL 531 82.964 3.629 3.807 560 HB VAL 531 HB VAL 531 82.963 5.148 5.758 561 HG11 VAL 531 HG11 VAL 531 85.474 3.750 6.673 562 HG12 VAL 531 HG12 VAL 531 83.885 3.324 7.314 563 HG13 VAL 531 HG13 VAL 531 84.516 4.956 7.532 564 HG21 VAL 531 HG21 VAL 531 85.725 4.774 4.569 565 HG22 VAL 531 HG22 VAL 531 85.074 6.262 5.255 566 HG23 VAL 531 HG23 VAL 531 84.395 5.608 3.765 567 H THR 532 H THR 532 84.059 1.319 6.148 568 HA THR 532 HA THR 532 86.680 0.926 5.060 569 HB THR 532 HB THR 532 86.394 0.293 7.310 570 HG1 THR 532 HG1 THR 532 87.564 -1.217 6.049 571 HG21 THR 532 HG21 THR 532 84.599 -1.759 7.566 572 HG22 THR 532 HG22 THR 532 83.789 -0.776 6.346 573 HG23 THR 532 HG23 THR 532 84.212 -0.075 7.905 574 H GLU 533 H GLU 533 84.679 -1.915 5.376 575 HA GLU 533 HA GLU 533 85.371 -2.798 2.726 576 HB2 GLU 533 HB2 GLU 533 83.563 -3.991 4.838 577 HB3 GLU 533 HB3 GLU 533 83.985 -4.784 3.317 578 HG2 GLU 533 HG2 GLU 533 86.061 -3.787 5.277 579 HG3 GLU 533 HG3 GLU 533 85.424 -5.430 5.311 580 H PHE 534 H PHE 534 84.426 -1.927 1.043 581 HA PHE 534 HA PHE 534 81.743 -0.876 1.094 582 HB2 PHE 534 HB2 PHE 534 83.817 -1.178 -1.086 583 HB3 PHE 534 HB3 PHE 534 82.212 -0.505 -1.377 584 HD1 PHE 534 HD1 PHE 534 85.429 -0.012 0.387 585 HD2 PHE 534 HD2 PHE 534 81.574 1.670 -0.500 586 HE1 PHE 534 HE1 PHE 534 86.189 2.187 1.246 587 HE2 PHE 534 HE2 PHE 534 82.337 3.868 0.362 588 HZ PHE 534 HZ PHE 534 84.643 4.125 1.234 589 H GLU 535 H GLU 535 79.979 -1.619 -0.072 590 HA GLU 535 HA GLU 535 79.666 -4.456 -0.235 591 HB2 GLU 535 HB2 GLU 535 77.429 -3.811 -1.257 592 HB3 GLU 535 HB3 GLU 535 77.736 -3.185 0.363 593 HG2 GLU 535 HG2 GLU 535 78.557 -1.512 -2.000 594 HG3 GLU 535 HG3 GLU 535 76.852 -1.582 -1.572 595 H ASN 536 H ASN 536 79.344 -5.744 -2.097 596 HA ASN 536 HA ASN 536 79.737 -6.444 -4.253 597 HB2 ASN 536 HB2 ASN 536 77.933 -4.624 -4.528 598 HB3 ASN 536 HB3 ASN 536 79.239 -3.597 -5.112 599 HD21 ASN 536 HD21 ASN 536 80.331 -4.261 -7.136 600 HD22 ASN 536 HD22 ASN 536 79.570 -5.337 -8.206 601 H VAL 537 H VAL 537 82.082 -6.053 -2.990 602 HA VAL 537 HA VAL 537 83.857 -4.201 -4.211 603 HB VAL 537 HB VAL 537 84.628 -6.833 -2.936 604 HG11 VAL 537 HG11 VAL 537 86.683 -5.720 -2.415 605 HG12 VAL 537 HG12 VAL 537 86.027 -4.146 -2.861 606 HG13 VAL 537 HG13 VAL 537 86.368 -5.343 -4.104 607 HG21 VAL 537 HG21 VAL 537 83.929 -4.169 -1.683 608 HG22 VAL 537 HG22 VAL 537 84.673 -5.510 -0.814 609 HG23 VAL 537 HG23 VAL 537 83.043 -5.680 -1.472 610 H THR 538 H THR 538 85.528 -4.592 -5.728 611 HA THR 538 HA THR 538 84.985 -6.809 -7.635 612 HB THR 538 HB THR 538 85.707 -5.290 -9.403 613 HG1 THR 538 HG1 THR 538 86.820 -3.622 -8.839 614 HG21 THR 538 HG21 THR 538 83.802 -3.664 -9.212 615 HG22 THR 538 HG22 THR 538 83.570 -4.210 -7.551 616 HG23 THR 538 HG23 THR 538 83.342 -5.335 -8.888 617 HA PRO 539 HA PRO 539 89.332 -7.103 -5.623 618 HB2 PRO 539 HB2 PRO 539 89.120 -9.918 -6.329 619 HB3 PRO 539 HB3 PRO 539 89.140 -9.193 -4.710 620 HG2 PRO 539 HG2 PRO 539 86.830 -9.999 -6.383 621 HG3 PRO 539 HG3 PRO 539 86.976 -9.931 -4.616 622 HD2 PRO 539 HD2 PRO 539 85.521 -8.117 -5.903 623 HD3 PRO 539 HD3 PRO 539 86.561 -7.617 -4.553 624 H THR 540 H THR 540 91.191 -7.214 -6.766 625 HA THR 540 HA THR 540 91.133 -6.924 -9.591 626 HB THR 540 HB THR 540 93.637 -7.002 -9.319 627 HG1 THR 540 HG1 THR 540 94.408 -7.738 -7.512 628 HG21 THR 540 HG21 THR 540 93.682 -4.982 -7.798 629 HG22 THR 540 HG22 THR 540 91.973 -5.267 -7.475 630 HG23 THR 540 HG23 THR 540 92.508 -4.879 -9.110 631 H ASN 541 H ASN 541 91.487 -8.393 -11.195 632 HA ASN 541 HA ASN 541 91.240 -11.163 -10.552 633 HB2 ASN 541 HB2 ASN 541 91.753 -9.738 -13.161 634 HB3 ASN 541 HB3 ASN 541 91.544 -11.483 -13.029 635 HD21 ASN 541 HD21 ASN 541 89.514 -11.510 -10.994 636 HD22 ASN 541 HD22 ASN 541 88.099 -10.842 -11.652 637 H ASP 542 H ASP 542 92.664 -12.817 -10.847 638 HA ASP 542 HA ASP 542 95.437 -12.178 -10.306 639 HB2 ASP 542 HB2 ASP 542 94.104 -13.962 -9.129 640 HB3 ASP 542 HB3 ASP 542 94.128 -14.883 -10.629 641 H GLN 543 H GLN 543 96.734 -11.704 -11.956 642 HA GLN 543 HA GLN 543 96.310 -12.469 -14.654 643 HB2 GLN 543 HB2 GLN 543 97.624 -10.485 -13.982 644 HB3 GLN 543 HB3 GLN 543 98.860 -11.544 -13.309 645 HG2 GLN 543 HG2 GLN 543 99.319 -12.488 -15.505 646 HG3 GLN 543 HG3 GLN 543 97.980 -11.580 -16.211 647 HE21 GLN 543 HE21 GLN 543 100.679 -11.223 -17.166 648 HE22 GLN 543 HE22 GLN 543 101.175 -9.654 -16.748 Start of MODEL 18 1 H1 SER 466 H1 SER 466 29.115 -4.005 -2.135 2 H2 SER 466 H2 SER 466 30.266 -3.659 -3.337 3 H3 SER 466 H3 SER 466 28.815 -2.777 -3.268 4 HA SER 466 HA SER 466 29.492 -1.468 -1.582 5 HB2 SER 466 HB2 SER 466 31.253 -3.783 -0.714 6 HB3 SER 466 HB3 SER 466 31.155 -2.236 0.122 7 HG SER 466 HG SER 466 28.845 -2.658 0.257 8 H ASP 467 H ASP 467 30.456 0.083 -2.739 9 HA ASP 467 HA ASP 467 32.665 -0.302 -4.458 10 HB2 ASP 467 HB2 ASP 467 31.248 2.084 -3.307 11 HB3 ASP 467 HB3 ASP 467 32.782 2.330 -4.136 12 H ASP 468 H ASP 468 32.459 0.855 -1.095 13 HA ASP 468 HA ASP 468 34.102 1.153 0.499 14 HB2 ASP 468 HB2 ASP 468 34.290 -1.313 -0.115 15 HB3 ASP 468 HB3 ASP 468 35.673 -0.857 -1.108 16 H TYR 469 H TYR 469 34.103 2.873 -1.768 17 HA TYR 469 HA TYR 469 36.688 3.344 -2.830 18 HB2 TYR 469 HB2 TYR 469 34.427 4.064 -3.716 19 HB3 TYR 469 HB3 TYR 469 34.464 5.340 -2.505 20 HD1 TYR 469 HD1 TYR 469 36.137 3.987 -5.521 21 HD2 TYR 469 HD2 TYR 469 35.883 7.251 -2.742 22 HE1 TYR 469 HE1 TYR 469 37.511 5.385 -7.038 23 HE2 TYR 469 HE2 TYR 469 37.251 8.651 -4.260 24 HH TYR 469 HH TYR 469 37.767 8.736 -6.697 25 H VAL 470 H VAL 470 38.247 4.865 -2.306 26 HA VAL 470 HA VAL 470 38.136 5.958 0.444 27 HB VAL 470 HB VAL 470 40.687 5.622 -1.121 28 HG11 VAL 470 HG11 VAL 470 39.991 5.508 1.826 29 HG12 VAL 470 HG12 VAL 470 40.753 6.861 0.992 30 HG13 VAL 470 HG13 VAL 470 41.607 5.328 1.147 31 HG21 VAL 470 HG21 VAL 470 40.861 3.370 0.046 32 HG22 VAL 470 HG22 VAL 470 39.728 3.437 -1.303 33 HG23 VAL 470 HG23 VAL 470 39.130 3.490 0.357 34 H ASP 471 H ASP 471 38.440 8.097 0.815 35 HA ASP 471 HA ASP 471 37.903 10.050 -1.013 36 HB2 ASP 471 HB2 ASP 471 39.695 10.178 1.420 37 HB3 ASP 471 HB3 ASP 471 39.222 11.602 0.495 38 H GLU 472 H GLU 472 39.072 11.412 -2.326 39 HA GLU 472 HA GLU 472 41.149 10.316 -3.852 40 HB2 GLU 472 HB2 GLU 472 40.169 13.159 -3.551 41 HB3 GLU 472 HB3 GLU 472 41.338 12.650 -4.771 42 HG2 GLU 472 HG2 GLU 472 39.747 11.087 -5.727 43 HG3 GLU 472 HG3 GLU 472 38.595 11.411 -4.434 44 H GLU 473 H GLU 473 41.278 12.766 -1.273 45 HA GLU 473 HA GLU 473 44.043 13.336 -1.532 46 HB2 GLU 473 HB2 GLU 473 43.811 14.483 0.551 47 HB3 GLU 473 HB3 GLU 473 42.316 14.725 -0.346 48 HG2 GLU 473 HG2 GLU 473 41.382 12.723 0.933 49 HG3 GLU 473 HG3 GLU 473 42.802 12.850 1.972 50 H THR 474 H THR 474 42.231 11.144 0.507 51 HA THR 474 HA THR 474 44.389 10.093 2.030 52 HB THR 474 HB THR 474 41.710 8.953 1.222 53 HG1 THR 474 HG1 THR 474 42.256 9.664 3.828 54 HG21 THR 474 HG21 THR 474 42.083 7.443 3.228 55 HG22 THR 474 HG22 THR 474 43.785 7.902 3.145 56 HG23 THR 474 HG23 THR 474 43.024 7.067 1.786 57 H TYR 475 H TYR 475 42.750 8.997 -0.897 58 HA TYR 475 HA TYR 475 44.193 6.616 -1.239 59 HB2 TYR 475 HB2 TYR 475 42.033 7.212 -2.313 60 HB3 TYR 475 HB3 TYR 475 42.899 8.346 -3.351 61 HD1 TYR 475 HD1 TYR 475 42.774 4.800 -2.295 62 HD2 TYR 475 HD2 TYR 475 43.967 7.596 -5.314 63 HE1 TYR 475 HE1 TYR 475 43.341 2.908 -3.817 64 HE2 TYR 475 HE2 TYR 475 44.550 5.722 -6.841 65 HH TYR 475 HH TYR 475 44.536 3.512 -7.126 66 H ASN 476 H ASN 476 44.702 9.864 -2.624 67 HA ASN 476 HA ASN 476 46.948 9.127 -4.208 68 HB2 ASN 476 HB2 ASN 476 46.307 11.848 -3.052 69 HB3 ASN 476 HB3 ASN 476 47.337 11.491 -4.440 70 HD21 ASN 476 HD21 ASN 476 45.192 9.244 -5.025 71 HD22 ASN 476 HD22 ASN 476 43.981 10.100 -5.852 72 H LEU 477 H LEU 477 46.521 10.219 -0.900 73 HA LEU 477 HA LEU 477 49.220 10.710 -0.251 74 HB2 LEU 477 HB2 LEU 477 47.381 11.366 1.212 75 HB3 LEU 477 HB3 LEU 477 46.913 9.687 1.427 76 HG LEU 477 HG LEU 477 49.074 9.219 2.516 77 HD11 LEU 477 HD11 LEU 477 50.634 10.726 1.619 78 HD12 LEU 477 HD12 LEU 477 50.347 11.407 3.219 79 HD13 LEU 477 HD13 LEU 477 49.557 12.110 1.807 80 HD21 LEU 477 HD21 LEU 477 47.235 9.803 3.945 81 HD22 LEU 477 HD22 LEU 477 47.438 11.519 3.600 82 HD23 LEU 477 HD23 LEU 477 48.651 10.660 4.549 83 H GLN 478 H GLN 478 47.192 7.786 -0.103 84 HA GLN 478 HA GLN 478 49.152 6.008 0.903 85 HB2 GLN 478 HB2 GLN 478 46.694 5.568 -0.807 86 HB3 GLN 478 HB3 GLN 478 47.666 4.252 -0.150 87 HG2 GLN 478 HG2 GLN 478 46.430 6.427 1.542 88 HG3 GLN 478 HG3 GLN 478 45.669 4.865 1.257 89 HE21 GLN 478 HE21 GLN 478 47.134 6.321 3.658 90 HE22 GLN 478 HE22 GLN 478 48.105 5.078 4.288 91 H LYS 479 H LYS 479 48.279 7.038 -2.315 92 HA LYS 479 HA LYS 479 49.800 5.207 -3.838 93 HB2 LYS 479 HB2 LYS 479 47.923 6.667 -4.597 94 HB3 LYS 479 HB3 LYS 479 49.004 8.050 -4.505 95 HG2 LYS 479 HG2 LYS 479 50.503 7.017 -6.150 96 HG3 LYS 479 HG3 LYS 479 49.455 5.600 -6.237 97 HD2 LYS 479 HD2 LYS 479 48.433 8.393 -6.804 98 HD3 LYS 479 HD3 LYS 479 49.126 7.380 -8.068 99 HE2 LYS 479 HE2 LYS 479 47.430 5.593 -7.357 100 HE3 LYS 479 HE3 LYS 479 46.642 6.860 -6.421 101 HZ1 LYS 479 HZ1 LYS 479 46.799 8.153 -8.641 102 HZ2 LYS 479 HZ2 LYS 479 45.557 7.018 -8.400 103 HZ3 LYS 479 HZ3 LYS 479 46.921 6.607 -9.326 104 H LEU 480 H LEU 480 50.472 8.408 -2.559 105 HA LEU 480 HA LEU 480 52.974 8.839 -3.779 106 HB2 LEU 480 HB2 LEU 480 51.554 9.916 -1.359 107 HB3 LEU 480 HB3 LEU 480 53.194 10.433 -1.723 108 HG LEU 480 HG LEU 480 51.167 10.506 -3.942 109 HD11 LEU 480 HD11 LEU 480 49.871 11.628 -2.304 110 HD12 LEU 480 HD12 LEU 480 50.689 12.925 -3.173 111 HD13 LEU 480 HD13 LEU 480 51.283 12.409 -1.593 112 HD21 LEU 480 HD21 LEU 480 52.561 12.218 -4.800 113 HD22 LEU 480 HD22 LEU 480 53.690 11.055 -4.103 114 HD23 LEU 480 HD23 LEU 480 53.291 12.530 -3.223 115 H LEU 481 H LEU 481 52.086 7.442 -0.644 116 HA LEU 481 HA LEU 481 54.827 7.028 0.177 117 HB2 LEU 481 HB2 LEU 481 52.270 5.946 1.369 118 HB3 LEU 481 HB3 LEU 481 53.834 6.098 2.171 119 HG LEU 481 HG LEU 481 52.191 8.397 1.097 120 HD11 LEU 481 HD11 LEU 481 51.057 7.657 3.017 121 HD12 LEU 481 HD12 LEU 481 52.102 8.948 3.613 122 HD13 LEU 481 HD13 LEU 481 52.556 7.260 3.856 123 HD21 LEU 481 HD21 LEU 481 53.914 9.672 2.570 124 HD22 LEU 481 HD22 LEU 481 54.403 9.138 0.969 125 HD23 LEU 481 HD23 LEU 481 54.892 8.216 2.389 126 H ALA 482 H ALA 482 52.712 5.373 -1.836 127 HA ALA 482 HA ALA 482 52.952 2.713 -1.282 128 HB1 ALA 482 HB1 ALA 482 51.875 4.051 -3.312 129 HB2 ALA 482 HB2 ALA 482 52.233 2.329 -3.434 130 HB3 ALA 482 HB3 ALA 482 53.333 3.509 -4.142 131 HA PRO 483 HA PRO 483 57.161 2.320 -3.429 132 HB2 PRO 483 HB2 PRO 483 58.408 4.923 -3.789 133 HB3 PRO 483 HB3 PRO 483 57.875 3.788 -5.036 134 HG2 PRO 483 HG2 PRO 483 56.686 6.209 -4.601 135 HG3 PRO 483 HG3 PRO 483 55.824 4.802 -5.253 136 HD2 PRO 483 HD2 PRO 483 55.896 5.797 -2.408 137 HD3 PRO 483 HD3 PRO 483 54.498 5.295 -3.386 138 H TYR 484 H TYR 484 57.335 5.195 -1.298 139 HA TYR 484 HA TYR 484 59.804 4.566 -0.086 140 HB2 TYR 484 HB2 TYR 484 59.035 6.756 0.220 141 HB3 TYR 484 HB3 TYR 484 57.434 6.227 0.737 142 HD1 TYR 484 HD1 TYR 484 61.037 6.295 1.751 143 HD2 TYR 484 HD2 TYR 484 56.958 5.852 3.060 144 HE1 TYR 484 HE1 TYR 484 61.761 6.355 4.117 145 HE2 TYR 484 HE2 TYR 484 57.707 5.911 5.413 146 HH TYR 484 HH TYR 484 59.501 5.809 6.773 147 H HIS 485 H HIS 485 56.490 3.631 0.655 148 HA HIS 485 HA HIS 485 56.973 2.311 3.109 149 HB2 HIS 485 HB2 HIS 485 54.745 3.013 2.219 150 HB3 HIS 485 HB3 HIS 485 54.842 1.690 1.058 151 HD1 HIS 485 HD1 HIS 485 53.469 2.409 4.251 152 HD2 HIS 485 HD2 HIS 485 55.404 -0.913 2.641 153 HE1 HIS 485 HE1 HIS 485 52.836 0.436 5.707 154 H LYS 486 H LYS 486 57.136 1.250 -0.264 155 HA LYS 486 HA LYS 486 57.617 -1.533 0.424 156 HB2 LYS 486 HB2 LYS 486 57.722 0.051 -2.154 157 HB3 LYS 486 HB3 LYS 486 58.013 -1.688 -2.068 158 HG2 LYS 486 HG2 LYS 486 55.796 -2.096 -1.225 159 HG3 LYS 486 HG3 LYS 486 55.498 -0.373 -1.009 160 HD2 LYS 486 HD2 LYS 486 55.711 -0.054 -3.470 161 HD3 LYS 486 HD3 LYS 486 55.919 -1.798 -3.654 162 HE2 LYS 486 HE2 LYS 486 53.571 -1.138 -4.053 163 HE3 LYS 486 HE3 LYS 486 53.708 -2.181 -2.637 164 HZ1 LYS 486 HZ1 LYS 486 52.303 -0.104 -2.400 165 HZ2 LYS 486 HZ2 LYS 486 53.761 0.770 -2.421 166 HZ3 LYS 486 HZ3 LYS 486 53.468 -0.372 -1.197 167 H ALA 487 H ALA 487 59.461 1.281 0.288 168 HA ALA 487 HA ALA 487 61.949 0.307 -0.658 169 HB1 ALA 487 HB1 ALA 487 62.814 2.410 -0.018 170 HB2 ALA 487 HB2 ALA 487 61.577 2.630 1.222 171 HB3 ALA 487 HB3 ALA 487 61.146 2.728 -0.485 172 H LYS 488 H LYS 488 62.905 -1.335 0.298 173 HA LYS 488 HA LYS 488 62.931 -1.632 3.218 174 HB2 LYS 488 HB2 LYS 488 64.212 -3.474 1.208 175 HB3 LYS 488 HB3 LYS 488 63.580 -3.867 2.805 176 HG2 LYS 488 HG2 LYS 488 61.966 -3.082 0.357 177 HG3 LYS 488 HG3 LYS 488 62.022 -4.673 1.104 178 HD2 LYS 488 HD2 LYS 488 60.899 -2.146 2.366 179 HD3 LYS 488 HD3 LYS 488 59.976 -3.522 1.774 180 HE2 LYS 488 HE2 LYS 488 61.814 -3.410 4.164 181 HE3 LYS 488 HE3 LYS 488 60.125 -3.905 4.094 182 HZ1 LYS 488 HZ1 LYS 488 61.187 -5.917 4.145 183 HZ2 LYS 488 HZ2 LYS 488 62.521 -5.373 3.242 184 HZ3 LYS 488 HZ3 LYS 488 61.039 -5.682 2.471 185 H THR 489 H THR 489 64.828 -0.187 0.864 186 HA THR 489 HA THR 489 67.333 -0.605 2.386 187 HB THR 489 HB THR 489 68.450 0.197 0.345 188 HG1 THR 489 HG1 THR 489 66.367 0.008 -1.311 189 HG21 THR 489 HG21 THR 489 68.082 -2.176 0.526 190 HG22 THR 489 HG22 THR 489 67.715 -1.708 -1.135 191 HG23 THR 489 HG23 THR 489 66.404 -2.006 0.011 192 H LEU 490 H LEU 490 68.314 1.058 3.393 193 HA LEU 490 HA LEU 490 66.918 3.403 4.044 194 HB2 LEU 490 HB2 LEU 490 69.798 2.542 4.272 195 HB3 LEU 490 HB3 LEU 490 69.298 4.156 4.779 196 HG LEU 490 HG LEU 490 67.592 3.127 6.266 197 HD11 LEU 490 HD11 LEU 490 68.805 0.594 5.165 198 HD12 LEU 490 HD12 LEU 490 67.102 1.045 5.260 199 HD13 LEU 490 HD13 LEU 490 67.985 0.618 6.727 200 HD21 LEU 490 HD21 LEU 490 69.924 3.683 7.050 201 HD22 LEU 490 HD22 LEU 490 70.363 2.000 6.758 202 HD23 LEU 490 HD23 LEU 490 69.149 2.397 7.974 203 H GLU 491 H GLU 491 69.472 2.807 1.669 204 HA GLU 491 HA GLU 491 69.969 5.405 0.794 205 HB2 GLU 491 HB2 GLU 491 71.374 3.622 0.079 206 HB3 GLU 491 HB3 GLU 491 70.016 2.736 -0.605 207 HG2 GLU 491 HG2 GLU 491 69.764 4.305 -2.380 208 HG3 GLU 491 HG3 GLU 491 70.872 5.452 -1.623 209 H ARG 492 H ARG 492 67.494 3.115 -0.174 210 HA ARG 492 HA ARG 492 66.362 4.724 -2.244 211 HB2 ARG 492 HB2 ARG 492 66.120 2.273 -2.156 212 HB3 ARG 492 HB3 ARG 492 65.181 2.420 -0.675 213 HG2 ARG 492 HG2 ARG 492 63.523 2.217 -2.327 214 HG3 ARG 492 HG3 ARG 492 63.602 3.961 -2.101 215 HD2 ARG 492 HD2 ARG 492 65.042 4.183 -4.059 216 HD3 ARG 492 HD3 ARG 492 65.115 2.430 -4.245 217 HE ARG 492 HE ARG 492 62.894 4.169 -4.956 218 HH11 ARG 492 HH11 ARG 492 64.188 1.691 -6.375 219 HH12 ARG 492 HH12 ARG 492 62.858 0.581 -6.322 220 HH21 ARG 492 HH21 ARG 492 61.101 2.405 -3.950 221 HH22 ARG 492 HH22 ARG 492 61.105 0.989 -4.944 222 H GLN 493 H GLN 493 65.664 4.211 1.176 223 HA GLN 493 HA GLN 493 63.203 5.514 1.329 224 HB2 GLN 493 HB2 GLN 493 65.467 5.209 3.302 225 HB3 GLN 493 HB3 GLN 493 63.964 6.009 3.728 226 HG2 GLN 493 HG2 GLN 493 62.686 4.005 3.175 227 HG3 GLN 493 HG3 GLN 493 64.141 3.206 2.598 228 HE21 GLN 493 HE21 GLN 493 64.709 1.649 4.115 229 HE22 GLN 493 HE22 GLN 493 64.720 1.891 5.796 230 H VAL 494 H VAL 494 66.480 6.856 1.704 231 HA VAL 494 HA VAL 494 65.683 9.521 2.151 232 HB VAL 494 HB VAL 494 68.201 8.389 0.908 233 HG11 VAL 494 HG11 VAL 494 67.512 11.174 1.870 234 HG12 VAL 494 HG12 VAL 494 68.146 10.695 0.295 235 HG13 VAL 494 HG13 VAL 494 69.173 10.604 1.723 236 HG21 VAL 494 HG21 VAL 494 67.362 9.098 3.725 237 HG22 VAL 494 HG22 VAL 494 69.057 8.951 3.263 238 HG23 VAL 494 HG23 VAL 494 67.983 7.562 3.119 239 H TYR 495 H TYR 495 66.579 7.799 -0.814 240 HA TYR 495 HA TYR 495 66.324 9.921 -2.634 241 HB2 TYR 495 HB2 TYR 495 67.416 7.869 -3.231 242 HB3 TYR 495 HB3 TYR 495 65.950 6.941 -2.938 243 HD1 TYR 495 HD1 TYR 495 67.359 9.664 -5.085 244 HD2 TYR 495 HD2 TYR 495 64.390 6.584 -4.670 245 HE1 TYR 495 HE1 TYR 495 66.705 9.970 -7.459 246 HE2 TYR 495 HE2 TYR 495 63.733 6.898 -7.042 247 HH TYR 495 HH TYR 495 65.189 7.893 -9.226 248 H GLU 496 H GLU 496 63.909 7.477 -1.652 249 HA GLU 496 HA GLU 496 61.851 8.399 -3.346 250 HB2 GLU 496 HB2 GLU 496 62.148 6.223 -1.790 251 HB3 GLU 496 HB3 GLU 496 61.128 7.173 -0.715 252 HG2 GLU 496 HG2 GLU 496 59.685 5.827 -2.090 253 HG3 GLU 496 HG3 GLU 496 59.535 7.492 -2.653 254 H LEU 497 H LEU 497 62.736 9.199 -0.039 255 HA LEU 497 HA LEU 497 60.554 10.884 0.547 256 HB2 LEU 497 HB2 LEU 497 63.363 10.669 1.596 257 HB3 LEU 497 HB3 LEU 497 62.220 11.845 2.246 258 HG LEU 497 HG LEU 497 61.650 8.875 2.049 259 HD11 LEU 497 HD11 LEU 497 63.591 9.544 3.605 260 HD12 LEU 497 HD12 LEU 497 62.274 8.616 4.320 261 HD13 LEU 497 HD13 LEU 497 62.359 10.354 4.576 262 HD21 LEU 497 HD21 LEU 497 59.555 9.771 2.313 263 HD22 LEU 497 HD22 LEU 497 60.150 11.261 3.042 264 HD23 LEU 497 HD23 LEU 497 60.031 9.791 4.009 265 H GLU 498 H GLU 498 63.724 11.515 -0.894 266 HA GLU 498 HA GLU 498 63.596 14.307 -0.963 267 HB2 GLU 498 HB2 GLU 498 64.929 12.255 -2.722 268 HB3 GLU 498 HB3 GLU 498 65.081 13.979 -3.056 269 HG2 GLU 498 HG2 GLU 498 66.085 14.383 -0.904 270 HG3 GLU 498 HG3 GLU 498 65.733 12.746 -0.367 271 H LYS 499 H LYS 499 62.424 11.903 -3.299 272 HA LYS 499 HA LYS 499 61.416 13.811 -5.181 273 HB2 LYS 499 HB2 LYS 499 61.269 10.864 -4.735 274 HB3 LYS 499 HB3 LYS 499 60.008 11.563 -5.748 275 HG2 LYS 499 HG2 LYS 499 61.907 10.845 -7.121 276 HG3 LYS 499 HG3 LYS 499 61.754 12.603 -7.172 277 HD2 LYS 499 HD2 LYS 499 63.514 12.836 -5.489 278 HD3 LYS 499 HD3 LYS 499 63.622 11.086 -5.332 279 HE2 LYS 499 HE2 LYS 499 64.334 10.897 -7.664 280 HE3 LYS 499 HE3 LYS 499 64.188 12.643 -7.863 281 HZ1 LYS 499 HZ1 LYS 499 65.827 12.888 -6.046 282 HZ2 LYS 499 HZ2 LYS 499 66.461 12.112 -7.418 283 HZ3 LYS 499 HZ3 LYS 499 66.043 11.205 -6.042 284 H LEU 500 H LEU 500 59.896 11.817 -2.689 285 HA LEU 500 HA LEU 500 57.255 12.652 -3.094 286 HB2 LEU 500 HB2 LEU 500 58.762 11.439 -0.806 287 HB3 LEU 500 HB3 LEU 500 57.073 11.887 -0.614 288 HG LEU 500 HG LEU 500 57.896 10.244 -3.004 289 HD11 LEU 500 HD11 LEU 500 58.872 9.080 -1.065 290 HD12 LEU 500 HD12 LEU 500 57.492 8.186 -1.702 291 HD13 LEU 500 HD13 LEU 500 57.318 9.148 -0.234 292 HD21 LEU 500 HD21 LEU 500 55.515 11.318 -2.389 293 HD22 LEU 500 HD22 LEU 500 55.389 9.865 -1.399 294 HD23 LEU 500 HD23 LEU 500 55.638 9.729 -3.140 295 H GLN 501 H GLN 501 59.751 13.882 -0.915 296 HA GLN 501 HA GLN 501 58.338 15.660 0.610 297 HB2 GLN 501 HB2 GLN 501 61.111 15.653 -0.534 298 HB3 GLN 501 HB3 GLN 501 60.562 17.074 0.350 299 HG2 GLN 501 HG2 GLN 501 60.382 14.264 1.475 300 HG3 GLN 501 HG3 GLN 501 61.753 15.334 1.766 301 HE21 GLN 501 HE21 GLN 501 60.205 17.791 1.937 302 HE22 GLN 501 HE22 GLN 501 59.303 17.710 3.371 303 H GLU 502 H GLU 502 59.085 15.912 -2.777 304 HA GLU 502 HA GLU 502 58.376 18.732 -2.938 305 HB2 GLU 502 HB2 GLU 502 58.683 16.966 -5.348 306 HB3 GLU 502 HB3 GLU 502 59.194 18.642 -5.112 307 HG2 GLU 502 HG2 GLU 502 60.849 17.762 -3.398 308 HG3 GLU 502 HG3 GLU 502 60.424 16.148 -3.955 309 H LYS 503 H LYS 503 56.928 15.616 -3.435 310 HA LYS 503 HA LYS 503 54.589 16.806 -4.764 311 HB2 LYS 503 HB2 LYS 503 55.523 13.976 -4.321 312 HB3 LYS 503 HB3 LYS 503 54.013 14.401 -5.135 313 HG2 LYS 503 HG2 LYS 503 55.171 15.578 -6.869 314 HG3 LYS 503 HG3 LYS 503 56.693 15.512 -5.985 315 HD2 LYS 503 HD2 LYS 503 56.779 13.829 -7.705 316 HD3 LYS 503 HD3 LYS 503 56.605 13.005 -6.157 317 HE2 LYS 503 HE2 LYS 503 54.316 12.530 -6.538 318 HE3 LYS 503 HE3 LYS 503 54.205 13.706 -7.849 319 HZ1 LYS 503 HZ1 LYS 503 54.523 11.135 -8.290 320 HZ2 LYS 503 HZ2 LYS 503 56.160 11.568 -8.149 321 HZ3 LYS 503 HZ3 LYS 503 55.178 12.317 -9.316 322 H LEU 504 H LEU 504 55.515 15.289 -1.771 323 HA LEU 504 HA LEU 504 52.982 14.531 -0.877 324 HB2 LEU 504 HB2 LEU 504 55.580 14.305 0.056 325 HB3 LEU 504 HB3 LEU 504 54.830 15.345 1.260 326 HG LEU 504 HG LEU 504 52.922 13.604 1.314 327 HD11 LEU 504 HD11 LEU 504 54.970 11.647 0.300 328 HD12 LEU 504 HD12 LEU 504 53.960 12.497 -0.862 329 HD13 LEU 504 HD13 LEU 504 53.218 11.494 0.380 330 HD21 LEU 504 HD21 LEU 504 55.612 12.549 2.215 331 HD22 LEU 504 HD22 LEU 504 54.041 12.317 2.979 332 HD23 LEU 504 HD23 LEU 504 54.817 13.897 3.024 333 HA PRO 505 HA PRO 505 51.115 18.692 -0.454 334 HB2 PRO 505 HB2 PRO 505 49.498 17.581 1.701 335 HB3 PRO 505 HB3 PRO 505 48.982 18.030 0.066 336 HG2 PRO 505 HG2 PRO 505 49.870 15.379 1.089 337 HG3 PRO 505 HG3 PRO 505 48.714 15.756 -0.194 338 HD2 PRO 505 HD2 PRO 505 51.049 14.816 -0.839 339 HD3 PRO 505 HD3 PRO 505 50.446 16.224 -1.737 340 H GLU 506 H GLU 506 51.435 20.339 0.937 341 HA GLU 506 HA GLU 506 53.615 20.615 2.455 342 HB2 GLU 506 HB2 GLU 506 50.933 21.923 2.914 343 HB3 GLU 506 HB3 GLU 506 52.438 22.473 3.651 344 HG2 GLU 506 HG2 GLU 506 52.241 23.808 1.710 345 HG3 GLU 506 HG3 GLU 506 53.371 22.551 1.232 346 H LYS 507 H LYS 507 50.477 20.127 4.111 347 HA LYS 507 HA LYS 507 51.436 19.814 6.681 348 HB2 LYS 507 HB2 LYS 507 49.384 18.224 6.932 349 HB3 LYS 507 HB3 LYS 507 49.099 19.901 6.455 350 HG2 LYS 507 HG2 LYS 507 48.897 19.300 4.139 351 HG3 LYS 507 HG3 LYS 507 49.476 17.666 4.454 352 HD2 LYS 507 HD2 LYS 507 47.478 17.169 5.759 353 HD3 LYS 507 HD3 LYS 507 46.907 18.827 5.562 354 HE2 LYS 507 HE2 LYS 507 47.515 17.050 3.195 355 HE3 LYS 507 HE3 LYS 507 45.924 17.078 3.956 356 HZ1 LYS 507 HZ1 LYS 507 45.495 19.147 3.194 357 HZ2 LYS 507 HZ2 LYS 507 46.615 18.712 1.991 358 HZ3 LYS 507 HZ3 LYS 507 47.108 19.659 3.313 359 H TYR 508 H TYR 508 51.561 17.522 4.049 360 HA TYR 508 HA TYR 508 52.447 15.361 5.830 361 HB2 TYR 508 HB2 TYR 508 51.772 15.552 2.895 362 HB3 TYR 508 HB3 TYR 508 52.594 14.144 3.562 363 HD1 TYR 508 HD1 TYR 508 51.550 12.963 5.552 364 HD2 TYR 508 HD2 TYR 508 49.435 15.761 3.115 365 HE1 TYR 508 HE1 TYR 508 49.406 12.061 6.389 366 HE2 TYR 508 HE2 TYR 508 47.275 14.854 3.919 367 HH TYR 508 HH TYR 508 46.674 13.478 6.361 368 H LYS 509 H LYS 509 53.641 17.772 3.682 369 HA LYS 509 HA LYS 509 56.146 16.652 3.015 370 HB2 LYS 509 HB2 LYS 509 55.087 18.672 2.003 371 HB3 LYS 509 HB3 LYS 509 55.454 19.557 3.479 372 HG2 LYS 509 HG2 LYS 509 57.876 18.950 3.149 373 HG3 LYS 509 HG3 LYS 509 57.433 18.301 1.572 374 HD2 LYS 509 HD2 LYS 509 56.873 21.143 2.463 375 HD3 LYS 509 HD3 LYS 509 58.249 20.670 1.469 376 HE2 LYS 509 HE2 LYS 509 56.492 19.622 -0.119 377 HE3 LYS 509 HE3 LYS 509 55.313 20.586 0.771 378 HZ1 LYS 509 HZ1 LYS 509 56.436 21.572 -1.307 379 HZ2 LYS 509 HZ2 LYS 509 57.755 21.849 -0.272 380 HZ3 LYS 509 HZ3 LYS 509 56.244 22.545 0.068 381 H ALA 510 H ALA 510 55.135 18.803 5.672 382 HA ALA 510 HA ALA 510 57.609 19.106 6.936 383 HB1 ALA 510 HB1 ALA 510 54.776 19.144 7.962 384 HB2 ALA 510 HB2 ALA 510 55.869 20.503 7.694 385 HB3 ALA 510 HB3 ALA 510 56.145 19.403 9.046 386 H GLU 511 H GLU 511 55.024 16.760 7.680 387 HA GLU 511 HA GLU 511 56.354 15.371 9.733 388 HB2 GLU 511 HB2 GLU 511 53.957 15.137 9.106 389 HB3 GLU 511 HB3 GLU 511 54.445 14.247 7.667 390 HG2 GLU 511 HG2 GLU 511 53.864 12.623 9.336 391 HG3 GLU 511 HG3 GLU 511 55.620 12.605 9.202 392 H TYR 512 H TYR 512 56.388 14.767 6.233 393 HA TYR 512 HA TYR 512 58.157 12.501 6.497 394 HB2 TYR 512 HB2 TYR 512 56.875 13.997 4.227 395 HB3 TYR 512 HB3 TYR 512 58.204 12.884 3.890 396 HD1 TYR 512 HD1 TYR 512 54.876 13.094 5.616 397 HD2 TYR 512 HD2 TYR 512 57.848 10.566 3.852 398 HE1 TYR 512 HE1 TYR 512 53.360 11.150 5.853 399 HE2 TYR 512 HE2 TYR 512 56.356 8.620 4.103 400 HH TYR 512 HH TYR 512 53.219 8.916 5.735 401 H LYS 513 H LYS 513 58.546 15.910 6.164 402 HA LYS 513 HA LYS 513 61.154 15.916 5.014 403 HB2 LYS 513 HB2 LYS 513 59.681 17.919 5.143 404 HB3 LYS 513 HB3 LYS 513 59.857 17.917 6.891 405 HG2 LYS 513 HG2 LYS 513 61.469 19.476 6.250 406 HG3 LYS 513 HG3 LYS 513 62.428 18.009 6.368 407 HD2 LYS 513 HD2 LYS 513 63.094 18.869 4.291 408 HD3 LYS 513 HD3 LYS 513 61.850 17.719 3.827 409 HE2 LYS 513 HE2 LYS 513 60.217 19.473 3.553 410 HE3 LYS 513 HE3 LYS 513 61.297 20.664 4.281 411 HZ1 LYS 513 HZ1 LYS 513 62.864 20.179 2.425 412 HZ2 LYS 513 HZ2 LYS 513 61.413 20.921 1.946 413 HZ3 LYS 513 HZ3 LYS 513 61.642 19.257 1.696 414 H LYS 514 H LYS 514 59.809 15.679 8.223 415 HA LYS 514 HA LYS 514 62.211 15.819 9.719 416 HB2 LYS 514 HB2 LYS 514 59.881 16.018 10.600 417 HB3 LYS 514 HB3 LYS 514 59.673 14.291 10.333 418 HG2 LYS 514 HG2 LYS 514 61.534 13.812 11.858 419 HG3 LYS 514 HG3 LYS 514 61.782 15.540 12.121 420 HD2 LYS 514 HD2 LYS 514 59.145 14.149 12.669 421 HD3 LYS 514 HD3 LYS 514 60.392 14.344 13.902 422 HE2 LYS 514 HE2 LYS 514 60.292 16.878 13.258 423 HE3 LYS 514 HE3 LYS 514 58.741 16.464 12.528 424 HZ1 LYS 514 HZ1 LYS 514 57.799 16.353 14.508 425 HZ2 LYS 514 HZ2 LYS 514 59.220 17.009 15.171 426 HZ3 LYS 514 HZ3 LYS 514 59.003 15.325 15.116 427 H LYS 515 H LYS 515 60.369 13.192 8.226 428 HA LYS 515 HA LYS 515 61.945 11.021 9.123 429 HB2 LYS 515 HB2 LYS 515 60.288 11.362 6.620 430 HB3 LYS 515 HB3 LYS 515 61.038 9.842 7.096 431 HG2 LYS 515 HG2 LYS 515 59.794 9.934 9.246 432 HG3 LYS 515 HG3 LYS 515 58.986 11.404 8.688 433 HD2 LYS 515 HD2 LYS 515 58.047 10.203 6.777 434 HD3 LYS 515 HD3 LYS 515 58.910 8.739 7.248 435 HE2 LYS 515 HE2 LYS 515 56.540 8.724 7.982 436 HE3 LYS 515 HE3 LYS 515 57.672 8.625 9.332 437 HZ1 LYS 515 HZ1 LYS 515 55.701 10.338 9.341 438 HZ2 LYS 515 HZ2 LYS 515 56.802 11.276 8.451 439 HZ3 LYS 515 HZ3 LYS 515 57.209 10.734 10.009 440 H LEU 516 H LEU 516 62.151 13.073 6.237 441 HA LEU 516 HA LEU 516 64.172 11.734 4.844 442 HB2 LEU 516 HB2 LEU 516 62.920 13.563 3.877 443 HB3 LEU 516 HB3 LEU 516 63.504 14.669 5.108 444 HG LEU 516 HG LEU 516 65.777 14.499 4.244 445 HD11 LEU 516 HD11 LEU 516 64.533 12.431 2.444 446 HD12 LEU 516 HD12 LEU 516 65.973 12.280 3.445 447 HD13 LEU 516 HD13 LEU 516 66.016 13.263 1.981 448 HD21 LEU 516 HD21 LEU 516 63.938 16.014 3.186 449 HD22 LEU 516 HD22 LEU 516 64.029 14.896 1.823 450 HD23 LEU 516 HD23 LEU 516 65.456 15.802 2.317 451 H ASP 517 H ASP 517 64.417 14.340 7.235 452 HA ASP 517 HA ASP 517 67.200 14.576 7.292 453 HB2 ASP 517 HB2 ASP 517 65.084 15.027 9.395 454 HB3 ASP 517 HB3 ASP 517 66.776 15.467 9.619 455 H GLN 518 H GLN 518 65.036 12.627 9.344 456 HA GLN 518 HA GLN 518 67.109 11.420 10.877 457 HB2 GLN 518 HB2 GLN 518 64.208 10.867 10.404 458 HB3 GLN 518 HB3 GLN 518 65.180 9.652 11.229 459 HG2 GLN 518 HG2 GLN 518 64.101 11.215 12.823 460 HG3 GLN 518 HG3 GLN 518 65.859 11.291 12.914 461 HE21 GLN 518 HE21 GLN 518 66.923 13.212 12.003 462 HE22 GLN 518 HE22 GLN 518 66.042 14.630 11.698 463 H THR 519 H THR 519 65.497 10.443 7.900 464 HA THR 519 HA THR 519 66.555 7.827 7.749 465 HB THR 519 HB THR 519 65.840 9.646 5.435 466 HG1 THR 519 HG1 THR 519 64.191 8.013 7.068 467 HG21 THR 519 HG21 THR 519 65.320 6.693 5.611 468 HG22 THR 519 HG22 THR 519 66.928 7.265 5.166 469 HG23 THR 519 HG23 THR 519 65.533 7.705 4.182 470 H ARG 520 H ARG 520 67.695 10.949 6.576 471 HA ARG 520 HA ARG 520 69.941 10.071 5.120 472 HB2 ARG 520 HB2 ARG 520 69.233 12.641 6.530 473 HB3 ARG 520 HB3 ARG 520 70.750 12.453 5.645 474 HG2 ARG 520 HG2 ARG 520 69.569 11.942 3.602 475 HG3 ARG 520 HG3 ARG 520 68.030 11.893 4.450 476 HD2 ARG 520 HD2 ARG 520 68.205 14.274 4.964 477 HD3 ARG 520 HD3 ARG 520 69.796 14.339 4.209 478 HE ARG 520 HE ARG 520 67.729 13.335 2.462 479 HH11 ARG 520 HH11 ARG 520 67.289 16.236 3.735 480 HH12 ARG 520 HH12 ARG 520 67.778 17.196 2.378 481 HH21 ARG 520 HH21 ARG 520 69.238 14.541 0.693 482 HH22 ARG 520 HH22 ARG 520 68.884 16.237 0.654 483 H VAL 521 H VAL 521 69.479 10.818 8.526 484 HA VAL 521 HA VAL 521 72.183 10.777 9.336 485 HB VAL 521 HB VAL 521 69.627 10.066 10.781 486 HG11 VAL 521 HG11 VAL 521 71.037 10.571 12.843 487 HG12 VAL 521 HG12 VAL 521 72.451 10.392 11.803 488 HG13 VAL 521 HG13 VAL 521 71.352 9.033 12.044 489 HG21 VAL 521 HG21 VAL 521 70.150 12.453 9.807 490 HG22 VAL 521 HG22 VAL 521 71.264 12.565 11.170 491 HG23 VAL 521 HG23 VAL 521 69.541 12.301 11.454 492 H GLU 522 H GLU 522 69.728 8.202 9.227 493 HA GLU 522 HA GLU 522 71.367 6.127 10.241 494 HB2 GLU 522 HB2 GLU 522 69.002 5.984 8.355 495 HB3 GLU 522 HB3 GLU 522 69.671 4.632 9.273 496 HG2 GLU 522 HG2 GLU 522 69.200 5.821 11.381 497 HG3 GLU 522 HG3 GLU 522 68.544 7.178 10.463 498 H LEU 523 H LEU 523 70.592 7.155 6.952 499 HA LEU 523 HA LEU 523 72.027 5.174 5.550 500 HB2 LEU 523 HB2 LEU 523 70.307 6.605 4.535 501 HB3 LEU 523 HB3 LEU 523 71.336 8.015 4.766 502 HG LEU 523 HG LEU 523 73.048 6.985 3.285 503 HD11 LEU 523 HD11 LEU 523 72.790 4.669 3.382 504 HD12 LEU 523 HD12 LEU 523 72.021 5.024 1.838 505 HD13 LEU 523 HD13 LEU 523 71.031 4.749 3.274 506 HD21 LEU 523 HD21 LEU 523 71.703 7.202 1.180 507 HD22 LEU 523 HD22 LEU 523 71.456 8.529 2.316 508 HD23 LEU 523 HD23 LEU 523 70.244 7.255 2.172 509 H ALA 524 H ALA 524 72.945 8.444 6.600 510 HA ALA 524 HA ALA 524 75.464 8.527 5.353 511 HB1 ALA 524 HB1 ALA 524 75.949 10.366 6.847 512 HB2 ALA 524 HB2 ALA 524 74.637 9.883 7.921 513 HB3 ALA 524 HB3 ALA 524 74.274 10.489 6.304 514 H ASP 525 H ASP 525 74.458 7.386 8.537 515 HA ASP 525 HA ASP 525 77.070 6.885 9.547 516 HB2 ASP 525 HB2 ASP 525 74.267 6.055 10.238 517 HB3 ASP 525 HB3 ASP 525 75.611 5.235 11.029 518 H GLN 526 H GLN 526 74.676 4.904 7.862 519 HA GLN 526 HA GLN 526 76.096 2.445 7.963 520 HB2 GLN 526 HB2 GLN 526 73.690 2.583 7.522 521 HB3 GLN 526 HB3 GLN 526 74.002 3.458 6.027 522 HG2 GLN 526 HG2 GLN 526 75.087 1.541 5.046 523 HG3 GLN 526 HG3 GLN 526 75.047 0.668 6.580 524 HE21 GLN 526 HE21 GLN 526 73.482 0.733 3.666 525 HE22 GLN 526 HE22 GLN 526 71.929 0.252 4.160 526 H VAL 527 H VAL 527 75.959 5.099 5.665 527 HA VAL 527 HA VAL 527 77.587 3.906 3.641 528 HB VAL 527 HB VAL 527 76.713 6.731 4.253 529 HG11 VAL 527 HG11 VAL 527 78.441 5.692 1.992 530 HG12 VAL 527 HG12 VAL 527 78.792 7.021 3.101 531 HG13 VAL 527 HG13 VAL 527 77.528 7.199 1.884 532 HG21 VAL 527 HG21 VAL 527 76.012 4.985 1.891 533 HG22 VAL 527 HG22 VAL 527 75.161 6.401 2.504 534 HG23 VAL 527 HG23 VAL 527 75.118 4.889 3.407 535 H LYS 528 H LYS 528 78.176 6.162 6.284 536 HA LYS 528 HA LYS 528 80.895 6.705 5.721 537 HB2 LYS 528 HB2 LYS 528 79.487 8.117 7.140 538 HB3 LYS 528 HB3 LYS 528 79.356 6.808 8.311 539 HG2 LYS 528 HG2 LYS 528 81.746 6.882 8.747 540 HG3 LYS 528 HG3 LYS 528 81.973 8.084 7.473 541 HD2 LYS 528 HD2 LYS 528 81.910 9.281 9.564 542 HD3 LYS 528 HD3 LYS 528 80.385 9.591 8.735 543 HE2 LYS 528 HE2 LYS 528 79.172 8.168 10.159 544 HE3 LYS 528 HE3 LYS 528 80.620 7.326 10.713 545 HZ1 LYS 528 HZ1 LYS 528 81.206 9.781 11.482 546 HZ2 LYS 528 HZ2 LYS 528 80.334 8.701 12.462 547 HZ3 LYS 528 HZ3 LYS 528 79.514 9.886 11.561 548 H SER 529 H SER 529 79.317 4.383 7.903 549 HA SER 529 HA SER 529 81.789 3.384 8.945 550 HB2 SER 529 HB2 SER 529 78.942 2.390 9.038 551 HB3 SER 529 HB3 SER 529 80.272 1.525 9.800 552 HG SER 529 HG SER 529 80.671 3.831 10.684 553 H ALA 530 H ALA 530 80.018 2.875 6.085 554 HA ALA 530 HA ALA 530 80.853 0.164 5.581 555 HB1 ALA 530 HB1 ALA 530 79.979 0.735 3.245 556 HB2 ALA 530 HB2 ALA 530 79.526 2.304 3.916 557 HB3 ALA 530 HB3 ALA 530 78.812 0.826 4.565 558 H VAL 531 H VAL 531 82.519 2.958 5.703 559 HA VAL 531 HA VAL 531 84.139 2.704 3.315 560 HB VAL 531 HB VAL 531 83.489 4.849 4.528 561 HG11 VAL 531 HG11 VAL 531 85.840 4.288 6.330 562 HG12 VAL 531 HG12 VAL 531 84.222 3.766 6.800 563 HG13 VAL 531 HG13 VAL 531 84.544 5.474 6.521 564 HG21 VAL 531 HG21 VAL 531 85.637 5.922 4.039 565 HG22 VAL 531 HG22 VAL 531 85.260 4.731 2.796 566 HG23 VAL 531 HG23 VAL 531 86.445 4.356 4.048 567 H THR 532 H THR 532 85.766 1.216 3.153 568 HA THR 532 HA THR 532 87.663 0.904 5.277 569 HB THR 532 HB THR 532 85.674 -0.461 6.043 570 HG1 THR 532 HG1 THR 532 87.127 -2.312 6.454 571 HG21 THR 532 HG21 THR 532 84.952 -2.331 4.903 572 HG22 THR 532 HG22 THR 532 86.530 -2.653 4.202 573 HG23 THR 532 HG23 THR 532 85.500 -1.397 3.510 574 H GLU 533 H GLU 533 88.282 1.668 2.803 575 HA GLU 533 HA GLU 533 89.499 1.178 0.906 576 HB2 GLU 533 HB2 GLU 533 90.585 -0.782 2.923 577 HB3 GLU 533 HB3 GLU 533 91.339 -0.456 1.362 578 HG2 GLU 533 HG2 GLU 533 91.632 1.889 1.937 579 HG3 GLU 533 HG3 GLU 533 90.742 1.660 3.443 580 H PHE 534 H PHE 534 88.109 0.428 -0.588 581 HA PHE 534 HA PHE 534 87.036 -2.229 -0.558 582 HB2 PHE 534 HB2 PHE 534 87.066 -0.159 -2.767 583 HB3 PHE 534 HB3 PHE 534 86.060 -1.609 -2.714 584 HD1 PHE 534 HD1 PHE 534 86.644 1.720 -1.249 585 HD2 PHE 534 HD2 PHE 534 84.193 -1.805 -1.151 586 HE1 PHE 534 HE1 PHE 534 84.966 2.928 0.119 587 HE2 PHE 534 HE2 PHE 534 82.514 -0.598 0.218 588 HZ PHE 534 HZ PHE 534 82.900 1.768 0.853 589 H GLU 535 H GLU 535 87.583 -3.970 -1.804 590 HA GLU 535 HA GLU 535 90.331 -4.149 -2.635 591 HB2 GLU 535 HB2 GLU 535 88.023 -6.102 -2.763 592 HB3 GLU 535 HB3 GLU 535 89.676 -6.497 -3.229 593 HG2 GLU 535 HG2 GLU 535 90.479 -6.010 -0.979 594 HG3 GLU 535 HG3 GLU 535 88.875 -5.466 -0.494 595 H ASN 536 H ASN 536 88.174 -2.506 -4.117 596 HA ASN 536 HA ASN 536 89.189 -3.060 -6.759 597 HB2 ASN 536 HB2 ASN 536 87.336 -4.735 -6.425 598 HB3 ASN 536 HB3 ASN 536 86.220 -3.379 -6.294 599 HD21 ASN 536 HD21 ASN 536 85.392 -2.569 -8.227 600 HD22 ASN 536 HD22 ASN 536 85.995 -2.947 -9.768 601 H VAL 537 H VAL 537 89.754 -0.751 -5.820 602 HA VAL 537 HA VAL 537 87.650 1.194 -6.022 603 HB VAL 537 HB VAL 537 89.413 2.798 -5.588 604 HG11 VAL 537 HG11 VAL 537 88.523 1.580 -3.676 605 HG12 VAL 537 HG12 VAL 537 90.251 1.838 -3.443 606 HG13 VAL 537 HG13 VAL 537 89.658 0.261 -3.960 607 HG21 VAL 537 HG21 VAL 537 91.232 2.023 -6.917 608 HG22 VAL 537 HG22 VAL 537 91.208 0.437 -6.146 609 HG23 VAL 537 HG23 VAL 537 91.772 1.847 -5.248 610 H THR 538 H THR 538 87.026 2.274 -7.775 611 HA THR 538 HA THR 538 88.416 1.783 -10.315 612 HB THR 538 HB THR 538 86.170 1.313 -10.660 613 HG1 THR 538 HG1 THR 538 86.165 4.131 -10.970 614 HG21 THR 538 HG21 THR 538 84.366 2.817 -9.599 615 HG22 THR 538 HG22 THR 538 85.669 3.465 -8.604 616 HG23 THR 538 HG23 THR 538 85.263 1.751 -8.519 617 HA PRO 539 HA PRO 539 90.153 5.774 -11.078 618 HB2 PRO 539 HB2 PRO 539 88.345 6.601 -13.196 619 HB3 PRO 539 HB3 PRO 539 89.996 5.974 -13.358 620 HG2 PRO 539 HG2 PRO 539 87.412 4.545 -13.572 621 HG3 PRO 539 HG3 PRO 539 88.968 4.180 -14.338 622 HD2 PRO 539 HD2 PRO 539 88.063 2.656 -12.351 623 HD3 PRO 539 HD3 PRO 539 89.787 3.079 -12.432 624 H THR 540 H THR 540 89.854 7.802 -10.322 625 HA THR 540 HA THR 540 87.442 8.392 -8.878 626 HB THR 540 HB THR 540 88.680 10.470 -8.282 627 HG1 THR 540 HG1 THR 540 90.149 9.568 -10.421 628 HG21 THR 540 HG21 THR 540 90.642 9.227 -7.224 629 HG22 THR 540 HG22 THR 540 90.091 7.797 -8.093 630 HG23 THR 540 HG23 THR 540 89.047 8.551 -6.888 631 H ASN 541 H ASN 541 85.791 9.757 -9.496 632 HA ASN 541 HA ASN 541 86.170 11.624 -11.673 633 HB2 ASN 541 HB2 ASN 541 85.842 9.423 -12.806 634 HB3 ASN 541 HB3 ASN 541 84.247 9.328 -12.064 635 HD21 ASN 541 HD21 ASN 541 86.108 10.817 -14.633 636 HD22 ASN 541 HD22 ASN 541 84.824 11.697 -15.309 637 H ASP 542 H ASP 542 85.574 12.716 -9.536 638 HA ASP 542 HA ASP 542 84.072 13.905 -8.274 639 HB2 ASP 542 HB2 ASP 542 83.700 14.761 -10.622 640 HB3 ASP 542 HB3 ASP 542 82.316 13.674 -10.717 641 H GLN 543 H GLN 543 83.815 10.892 -8.311 642 HA GLN 543 HA GLN 543 80.989 10.389 -7.942 643 HB2 GLN 543 HB2 GLN 543 81.711 8.121 -7.387 644 HB3 GLN 543 HB3 GLN 543 82.500 8.677 -8.867 645 HG2 GLN 543 HG2 GLN 543 84.462 9.391 -7.456 646 HG3 GLN 543 HG3 GLN 543 83.691 8.599 -6.083 647 HE21 GLN 543 HE21 GLN 543 85.725 7.202 -6.156 648 HE22 GLN 543 HE22 GLN 543 85.736 5.875 -7.213 Start of MODEL 19 1 H1 SER 466 H1 SER 466 32.004 7.703 2.946 2 H2 SER 466 H2 SER 466 31.499 6.571 4.106 3 H3 SER 466 H3 SER 466 30.374 7.638 3.411 4 HA SER 466 HA SER 466 29.956 5.702 2.256 5 HB2 SER 466 HB2 SER 466 30.569 7.691 0.791 6 HB3 SER 466 HB3 SER 466 32.161 6.963 0.604 7 HG SER 466 HG SER 466 31.300 5.714 -0.834 8 H ASP 467 H ASP 467 30.449 3.640 2.556 9 HA ASP 467 HA ASP 467 32.949 2.691 3.452 10 HB2 ASP 467 HB2 ASP 467 30.561 1.296 2.242 11 HB3 ASP 467 HB3 ASP 467 31.973 0.427 2.840 12 H ASP 468 H ASP 468 31.443 2.699 0.243 13 HA ASP 468 HA ASP 468 33.696 1.367 -0.996 14 HB2 ASP 468 HB2 ASP 468 31.204 2.676 -2.106 15 HB3 ASP 468 HB3 ASP 468 32.439 1.924 -3.114 16 H TYR 469 H TYR 469 35.100 2.327 -2.537 17 HA TYR 469 HA TYR 469 36.480 3.974 -3.355 18 HB2 TYR 469 HB2 TYR 469 34.178 4.627 -4.234 19 HB3 TYR 469 HB3 TYR 469 34.137 5.825 -2.944 20 HD1 TYR 469 HD1 TYR 469 35.941 4.746 -5.999 21 HD2 TYR 469 HD2 TYR 469 35.470 7.815 -3.032 22 HE1 TYR 469 HE1 TYR 469 37.299 6.290 -7.383 23 HE2 TYR 469 HE2 TYR 469 36.829 9.359 -4.414 24 HH TYR 469 HH TYR 469 37.317 9.438 -7.141 25 H VAL 470 H VAL 470 37.757 5.824 -2.721 26 HA VAL 470 HA VAL 470 37.425 6.638 0.117 27 HB VAL 470 HB VAL 470 40.128 6.265 -1.166 28 HG11 VAL 470 HG11 VAL 470 40.019 7.516 0.929 29 HG12 VAL 470 HG12 VAL 470 40.771 5.946 1.212 30 HG13 VAL 470 HG13 VAL 470 39.095 6.218 1.685 31 HG21 VAL 470 HG21 VAL 470 40.107 4.006 0.021 32 HG22 VAL 470 HG22 VAL 470 39.131 4.104 -1.443 33 HG23 VAL 470 HG23 VAL 470 38.357 4.183 0.139 34 H ASP 471 H ASP 471 38.530 8.671 0.665 35 HA ASP 471 HA ASP 471 37.886 10.744 -1.140 36 HB2 ASP 471 HB2 ASP 471 39.604 10.683 1.341 37 HB3 ASP 471 HB3 ASP 471 39.300 12.163 0.433 38 H GLU 472 H GLU 472 39.150 12.050 -2.418 39 HA GLU 472 HA GLU 472 41.193 10.863 -3.921 40 HB2 GLU 472 HB2 GLU 472 40.406 13.762 -3.575 41 HB3 GLU 472 HB3 GLU 472 41.562 13.199 -4.782 42 HG2 GLU 472 HG2 GLU 472 39.886 11.795 -5.818 43 HG3 GLU 472 HG3 GLU 472 38.730 12.160 -4.537 44 H GLU 473 H GLU 473 41.421 13.215 -1.249 45 HA GLU 473 HA GLU 473 44.234 13.571 -1.440 46 HB2 GLU 473 HB2 GLU 473 44.064 14.653 0.695 47 HB3 GLU 473 HB3 GLU 473 42.623 15.072 -0.226 48 HG2 GLU 473 HG2 GLU 473 41.485 13.104 0.934 49 HG3 GLU 473 HG3 GLU 473 42.875 13.072 2.018 50 H THR 474 H THR 474 42.204 11.484 0.496 51 HA THR 474 HA THR 474 44.233 10.199 2.008 52 HB THR 474 HB THR 474 41.481 9.320 1.122 53 HG1 THR 474 HG1 THR 474 40.974 10.704 2.599 54 HG21 THR 474 HG21 THR 474 42.607 7.311 1.654 55 HG22 THR 474 HG22 THR 474 41.684 7.732 3.096 56 HG23 THR 474 HG23 THR 474 43.422 8.040 3.042 57 H TYR 475 H TYR 475 42.557 9.333 -0.972 58 HA TYR 475 HA TYR 475 43.787 6.846 -1.348 59 HB2 TYR 475 HB2 TYR 475 41.706 7.685 -2.449 60 HB3 TYR 475 HB3 TYR 475 42.716 8.714 -3.466 61 HD1 TYR 475 HD1 TYR 475 42.258 5.194 -2.380 62 HD2 TYR 475 HD2 TYR 475 43.659 7.856 -5.433 63 HE1 TYR 475 HE1 TYR 475 42.653 3.252 -3.888 64 HE2 TYR 475 HE2 TYR 475 44.067 5.927 -6.944 65 HH TYR 475 HH TYR 475 42.755 3.095 -6.688 66 H ASN 476 H ASN 476 44.615 10.044 -2.691 67 HA ASN 476 HA ASN 476 46.844 9.088 -4.192 68 HB2 ASN 476 HB2 ASN 476 46.415 11.879 -3.108 69 HB3 ASN 476 HB3 ASN 476 47.442 11.400 -4.461 70 HD21 ASN 476 HD21 ASN 476 45.045 9.351 -5.009 71 HD22 ASN 476 HD22 ASN 476 43.971 10.308 -5.911 72 H LEU 477 H LEU 477 46.382 10.257 -0.919 73 HA LEU 477 HA LEU 477 49.073 10.571 -0.170 74 HB2 LEU 477 HB2 LEU 477 47.225 11.324 1.247 75 HB3 LEU 477 HB3 LEU 477 46.674 9.667 1.447 76 HG LEU 477 HG LEU 477 48.815 9.104 2.569 77 HD11 LEU 477 HD11 LEU 477 49.371 12.003 1.946 78 HD12 LEU 477 HD12 LEU 477 50.424 10.603 1.741 79 HD13 LEU 477 HD13 LEU 477 50.114 11.241 3.354 80 HD21 LEU 477 HD21 LEU 477 48.325 10.337 4.639 81 HD22 LEU 477 HD22 LEU 477 46.839 9.800 3.861 82 HD23 LEU 477 HD23 LEU 477 47.343 11.482 3.724 83 H GLN 478 H GLN 478 46.890 7.744 -0.060 84 HA GLN 478 HA GLN 478 48.709 5.887 1.020 85 HB2 GLN 478 HB2 GLN 478 46.380 5.541 -0.878 86 HB3 GLN 478 HB3 GLN 478 47.267 4.187 -0.184 87 HG2 GLN 478 HG2 GLN 478 45.960 6.357 1.465 88 HG3 GLN 478 HG3 GLN 478 45.184 4.822 1.083 89 HE21 GLN 478 HE21 GLN 478 46.517 6.172 3.632 90 HE22 GLN 478 HE22 GLN 478 47.393 4.878 4.297 91 H LYS 479 H LYS 479 48.085 6.945 -2.249 92 HA LYS 479 HA LYS 479 49.745 5.109 -3.615 93 HB2 LYS 479 HB2 LYS 479 47.880 6.656 -4.501 94 HB3 LYS 479 HB3 LYS 479 49.113 7.916 -4.525 95 HG2 LYS 479 HG2 LYS 479 50.467 6.652 -6.079 96 HG3 LYS 479 HG3 LYS 479 49.425 5.238 -5.919 97 HD2 LYS 479 HD2 LYS 479 48.844 6.384 -7.981 98 HD3 LYS 479 HD3 LYS 479 47.526 6.595 -6.829 99 HE2 LYS 479 HE2 LYS 479 48.130 8.838 -6.371 100 HE3 LYS 479 HE3 LYS 479 49.729 8.643 -7.089 101 HZ1 LYS 479 HZ1 LYS 479 48.092 9.857 -8.488 102 HZ2 LYS 479 HZ2 LYS 479 47.191 8.421 -8.607 103 HZ3 LYS 479 HZ3 LYS 479 48.766 8.494 -9.240 104 H LEU 480 H LEU 480 50.299 8.324 -2.279 105 HA LEU 480 HA LEU 480 52.856 8.781 -3.350 106 HB2 LEU 480 HB2 LEU 480 51.316 9.839 -0.997 107 HB3 LEU 480 HB3 LEU 480 52.985 10.345 -1.247 108 HG LEU 480 HG LEU 480 51.159 10.459 -3.626 109 HD11 LEU 480 HD11 LEU 480 50.593 12.890 -2.771 110 HD12 LEU 480 HD12 LEU 480 50.856 12.183 -1.178 111 HD13 LEU 480 HD13 LEU 480 49.616 11.523 -2.241 112 HD21 LEU 480 HD21 LEU 480 53.175 12.468 -2.587 113 HD22 LEU 480 HD22 LEU 480 52.535 12.330 -4.225 114 HD23 LEU 480 HD23 LEU 480 53.624 11.094 -3.600 115 H LEU 481 H LEU 481 51.908 7.314 -0.240 116 HA LEU 481 HA LEU 481 54.584 7.049 0.704 117 HB2 LEU 481 HB2 LEU 481 52.187 5.471 1.637 118 HB3 LEU 481 HB3 LEU 481 53.630 5.894 2.558 119 HG LEU 481 HG LEU 481 51.523 7.788 1.533 120 HD11 LEU 481 HD11 LEU 481 51.283 8.307 3.977 121 HD12 LEU 481 HD12 LEU 481 52.333 6.927 4.298 122 HD13 LEU 481 HD13 LEU 481 50.772 6.684 3.513 123 HD21 LEU 481 HD21 LEU 481 53.511 9.017 1.301 124 HD22 LEU 481 HD22 LEU 481 54.216 8.287 2.738 125 HD23 LEU 481 HD23 LEU 481 52.922 9.474 2.895 126 H ALA 482 H ALA 482 52.407 4.928 -1.061 127 HA ALA 482 HA ALA 482 53.334 2.441 -0.782 128 HB1 ALA 482 HB1 ALA 482 51.867 2.301 -2.500 129 HB2 ALA 482 HB2 ALA 482 53.230 2.618 -3.574 130 HB3 ALA 482 HB3 ALA 482 52.214 3.947 -3.015 131 HA PRO 483 HA PRO 483 57.071 2.895 -3.979 132 HB2 PRO 483 HB2 PRO 483 58.033 5.601 -3.614 133 HB3 PRO 483 HB3 PRO 483 57.414 4.855 -5.095 134 HG2 PRO 483 HG2 PRO 483 56.043 6.565 -3.134 135 HG3 PRO 483 HG3 PRO 483 55.697 6.338 -4.852 136 HD2 PRO 483 HD2 PRO 483 54.090 5.336 -2.937 137 HD3 PRO 483 HD3 PRO 483 54.376 4.452 -4.451 138 H TYR 484 H TYR 484 57.380 5.315 -1.367 139 HA TYR 484 HA TYR 484 59.871 4.365 -0.410 140 HB2 TYR 484 HB2 TYR 484 59.498 6.541 0.267 141 HB3 TYR 484 HB3 TYR 484 57.770 6.272 0.539 142 HD1 TYR 484 HD1 TYR 484 56.961 5.257 2.631 143 HD2 TYR 484 HD2 TYR 484 61.140 6.051 2.047 144 HE1 TYR 484 HE1 TYR 484 57.360 4.923 5.046 145 HE2 TYR 484 HE2 TYR 484 61.533 5.722 4.475 146 HH TYR 484 HH TYR 484 58.964 4.603 6.616 147 H HIS 485 H HIS 485 56.546 3.646 0.468 148 HA HIS 485 HA HIS 485 56.996 2.168 2.804 149 HB2 HIS 485 HB2 HIS 485 54.778 2.967 1.855 150 HB3 HIS 485 HB3 HIS 485 54.858 1.598 0.751 151 HD1 HIS 485 HD1 HIS 485 54.385 -0.728 1.689 152 HD2 HIS 485 HD2 HIS 485 54.441 2.230 4.625 153 HE1 HIS 485 HE1 HIS 485 53.458 -1.791 3.791 154 H LYS 486 H LYS 486 57.367 1.359 -0.571 155 HA LYS 486 HA LYS 486 57.686 -1.496 -0.060 156 HB2 LYS 486 HB2 LYS 486 57.995 0.213 -2.543 157 HB3 LYS 486 HB3 LYS 486 58.234 -1.534 -2.520 158 HG2 LYS 486 HG2 LYS 486 55.940 -1.887 -1.788 159 HG3 LYS 486 HG3 LYS 486 55.682 -0.146 -1.649 160 HD2 LYS 486 HD2 LYS 486 56.081 0.103 -4.079 161 HD3 LYS 486 HD3 LYS 486 56.318 -1.640 -4.214 162 HE2 LYS 486 HE2 LYS 486 53.781 -0.343 -3.173 163 HE3 LYS 486 HE3 LYS 486 54.001 -0.901 -4.832 164 HZ1 LYS 486 HZ1 LYS 486 54.762 -2.888 -2.942 165 HZ2 LYS 486 HZ2 LYS 486 53.649 -2.988 -4.222 166 HZ3 LYS 486 HZ3 LYS 486 53.154 -2.405 -2.703 167 H ALA 487 H ALA 487 59.604 1.353 -0.314 168 HA ALA 487 HA ALA 487 62.103 0.175 -0.945 169 HB1 ALA 487 HB1 ALA 487 63.041 2.297 -0.378 170 HB2 ALA 487 HB2 ALA 487 61.642 2.730 0.594 171 HB3 ALA 487 HB3 ALA 487 61.498 2.615 -1.159 172 H LYS 488 H LYS 488 62.900 -1.383 0.283 173 HA LYS 488 HA LYS 488 62.643 -1.314 3.203 174 HB2 LYS 488 HB2 LYS 488 63.545 -3.573 3.137 175 HB3 LYS 488 HB3 LYS 488 62.231 -3.432 1.968 176 HG2 LYS 488 HG2 LYS 488 63.960 -2.971 0.193 177 HG3 LYS 488 HG3 LYS 488 65.207 -3.333 1.385 178 HD2 LYS 488 HD2 LYS 488 64.285 -5.591 1.689 179 HD3 LYS 488 HD3 LYS 488 63.018 -5.238 0.512 180 HE2 LYS 488 HE2 LYS 488 64.756 -4.828 -1.211 181 HE3 LYS 488 HE3 LYS 488 66.002 -5.243 -0.035 182 HZ1 LYS 488 HZ1 LYS 488 65.255 -7.078 -1.568 183 HZ2 LYS 488 HZ2 LYS 488 63.784 -7.080 -0.718 184 HZ3 LYS 488 HZ3 LYS 488 65.235 -7.442 0.089 185 H THR 489 H THR 489 64.811 -0.232 0.867 186 HA THR 489 HA THR 489 67.156 -0.508 2.652 187 HB THR 489 HB THR 489 68.504 -0.074 0.721 188 HG1 THR 489 HG1 THR 489 66.694 0.087 -1.203 189 HG21 THR 489 HG21 THR 489 67.894 -1.934 -0.688 190 HG22 THR 489 HG22 THR 489 66.207 -1.828 -0.186 191 HG23 THR 489 HG23 THR 489 67.440 -2.351 0.963 192 H LEU 490 H LEU 490 68.169 1.221 3.509 193 HA LEU 490 HA LEU 490 66.785 3.621 3.929 194 HB2 LEU 490 HB2 LEU 490 69.636 2.745 4.308 195 HB3 LEU 490 HB3 LEU 490 69.168 4.406 4.659 196 HG LEU 490 HG LEU 490 67.513 2.168 5.808 197 HD11 LEU 490 HD11 LEU 490 69.002 2.175 7.816 198 HD12 LEU 490 HD12 LEU 490 70.166 3.141 6.909 199 HD13 LEU 490 HD13 LEU 490 69.783 1.500 6.387 200 HD21 LEU 490 HD21 LEU 490 68.315 4.935 6.754 201 HD22 LEU 490 HD22 LEU 490 67.284 3.824 7.654 202 HD23 LEU 490 HD23 LEU 490 66.749 4.460 6.104 203 H GLU 491 H GLU 491 69.455 2.889 1.698 204 HA GLU 491 HA GLU 491 69.915 5.435 0.665 205 HB2 GLU 491 HB2 GLU 491 70.900 4.314 -1.235 206 HB3 GLU 491 HB3 GLU 491 71.265 3.373 0.215 207 HG2 GLU 491 HG2 GLU 491 69.146 2.038 -0.305 208 HG3 GLU 491 HG3 GLU 491 69.174 2.815 -1.885 209 H ARG 492 H ARG 492 67.550 3.015 -0.247 210 HA ARG 492 HA ARG 492 66.459 4.466 -2.458 211 HB2 ARG 492 HB2 ARG 492 66.280 2.018 -2.249 212 HB3 ARG 492 HB3 ARG 492 65.300 2.215 -0.806 213 HG2 ARG 492 HG2 ARG 492 63.757 1.822 -2.592 214 HG3 ARG 492 HG3 ARG 492 63.643 3.544 -2.252 215 HD2 ARG 492 HD2 ARG 492 64.902 4.118 -4.174 216 HD3 ARG 492 HD3 ARG 492 65.518 2.481 -4.372 217 HE ARG 492 HE ARG 492 62.769 2.272 -4.601 218 HH11 ARG 492 HH11 ARG 492 63.549 5.071 -5.864 219 HH12 ARG 492 HH12 ARG 492 63.557 4.633 -7.539 220 HH21 ARG 492 HH21 ARG 492 63.534 1.225 -6.926 221 HH22 ARG 492 HH22 ARG 492 63.548 2.460 -8.140 222 H GLN 493 H GLN 493 65.525 4.016 0.927 223 HA GLN 493 HA GLN 493 63.084 5.395 0.835 224 HB2 GLN 493 HB2 GLN 493 65.072 4.945 3.062 225 HB3 GLN 493 HB3 GLN 493 63.528 5.753 3.313 226 HG2 GLN 493 HG2 GLN 493 62.308 3.806 2.572 227 HG3 GLN 493 HG3 GLN 493 63.789 3.009 2.061 228 HE21 GLN 493 HE21 GLN 493 62.654 1.364 3.713 229 HE22 GLN 493 HE22 GLN 493 63.180 1.499 5.322 230 H VAL 494 H VAL 494 66.370 6.555 1.545 231 HA VAL 494 HA VAL 494 65.682 9.218 2.113 232 HB VAL 494 HB VAL 494 68.181 7.961 0.960 233 HG11 VAL 494 HG11 VAL 494 69.273 10.142 1.623 234 HG12 VAL 494 HG12 VAL 494 67.657 10.831 1.775 235 HG13 VAL 494 HG13 VAL 494 68.229 10.249 0.211 236 HG21 VAL 494 HG21 VAL 494 67.399 9.013 3.697 237 HG22 VAL 494 HG22 VAL 494 69.030 8.498 3.268 238 HG23 VAL 494 HG23 VAL 494 67.706 7.334 3.257 239 H TYR 495 H TYR 495 66.647 7.684 -0.939 240 HA TYR 495 HA TYR 495 66.412 9.978 -2.570 241 HB2 TYR 495 HB2 TYR 495 67.666 8.064 -3.309 242 HB3 TYR 495 HB3 TYR 495 66.254 7.021 -3.167 243 HD1 TYR 495 HD1 TYR 495 67.832 9.728 -5.136 244 HD2 TYR 495 HD2 TYR 495 64.512 7.022 -4.832 245 HE1 TYR 495 HE1 TYR 495 67.222 10.210 -7.492 246 HE2 TYR 495 HE2 TYR 495 63.903 7.507 -7.185 247 HH TYR 495 HH TYR 495 64.506 8.527 -9.064 248 H GLU 496 H GLU 496 64.157 7.306 -1.977 249 HA GLU 496 HA GLU 496 62.099 8.216 -3.667 250 HB2 GLU 496 HB2 GLU 496 62.462 5.920 -2.485 251 HB3 GLU 496 HB3 GLU 496 61.611 6.658 -1.132 252 HG2 GLU 496 HG2 GLU 496 59.975 5.527 -2.445 253 HG3 GLU 496 HG3 GLU 496 59.759 7.250 -2.755 254 H LEU 497 H LEU 497 62.820 8.852 -0.285 255 HA LEU 497 HA LEU 497 60.446 10.241 0.334 256 HB2 LEU 497 HB2 LEU 497 63.221 10.185 1.455 257 HB3 LEU 497 HB3 LEU 497 62.044 11.329 2.099 258 HG LEU 497 HG LEU 497 61.544 8.349 1.859 259 HD11 LEU 497 HD11 LEU 497 63.456 9.063 3.441 260 HD12 LEU 497 HD12 LEU 497 62.181 8.042 4.102 261 HD13 LEU 497 HD13 LEU 497 62.179 9.774 4.432 262 HD21 LEU 497 HD21 LEU 497 59.968 10.674 2.874 263 HD22 LEU 497 HD22 LEU 497 59.881 9.190 3.817 264 HD23 LEU 497 HD23 LEU 497 59.415 9.178 2.121 265 H GLU 498 H GLU 498 63.516 11.294 -1.099 266 HA GLU 498 HA GLU 498 63.057 14.067 -0.997 267 HB2 GLU 498 HB2 GLU 498 64.615 12.373 -2.958 268 HB3 GLU 498 HB3 GLU 498 64.575 14.131 -3.039 269 HG2 GLU 498 HG2 GLU 498 65.577 14.347 -0.878 270 HG3 GLU 498 HG3 GLU 498 65.366 12.633 -0.536 271 H LYS 499 H LYS 499 62.095 11.608 -3.379 272 HA LYS 499 HA LYS 499 60.920 13.441 -5.248 273 HB2 LYS 499 HB2 LYS 499 60.034 10.581 -4.745 274 HB3 LYS 499 HB3 LYS 499 59.918 11.493 -6.248 275 HG2 LYS 499 HG2 LYS 499 62.424 10.452 -4.910 276 HG3 LYS 499 HG3 LYS 499 61.783 10.001 -6.487 277 HD2 LYS 499 HD2 LYS 499 62.066 12.479 -7.107 278 HD3 LYS 499 HD3 LYS 499 63.043 12.591 -5.647 279 HE2 LYS 499 HE2 LYS 499 64.623 11.045 -6.455 280 HE3 LYS 499 HE3 LYS 499 63.594 10.571 -7.808 281 HZ1 LYS 499 HZ1 LYS 499 63.852 13.287 -8.015 282 HZ2 LYS 499 HZ2 LYS 499 64.642 12.126 -8.971 283 HZ3 LYS 499 HZ3 LYS 499 65.407 12.759 -7.591 284 H LEU 500 H LEU 500 59.559 11.496 -2.622 285 HA LEU 500 HA LEU 500 56.891 12.362 -2.938 286 HB2 LEU 500 HB2 LEU 500 58.320 11.284 -0.502 287 HB3 LEU 500 HB3 LEU 500 56.575 11.396 -0.691 288 HG LEU 500 HG LEU 500 58.383 9.840 -2.544 289 HD11 LEU 500 HD11 LEU 500 57.349 7.851 -1.416 290 HD12 LEU 500 HD12 LEU 500 56.645 8.951 -0.231 291 HD13 LEU 500 HD13 LEU 500 58.398 8.798 -0.361 292 HD21 LEU 500 HD21 LEU 500 56.422 10.377 -3.767 293 HD22 LEU 500 HD22 LEU 500 55.388 10.211 -2.346 294 HD23 LEU 500 HD23 LEU 500 56.089 8.796 -3.111 295 H GLN 501 H GLN 501 59.540 13.573 -0.946 296 HA GLN 501 HA GLN 501 58.147 15.451 0.576 297 HB2 GLN 501 HB2 GLN 501 60.945 15.012 -0.282 298 HB3 GLN 501 HB3 GLN 501 60.580 16.693 0.096 299 HG2 GLN 501 HG2 GLN 501 61.398 15.476 2.088 300 HG3 GLN 501 HG3 GLN 501 59.738 16.027 2.309 301 HE21 GLN 501 HE21 GLN 501 60.953 13.785 3.733 302 HE22 GLN 501 HE22 GLN 501 60.084 12.395 3.299 303 H GLU 502 H GLU 502 59.045 15.483 -2.776 304 HA GLU 502 HA GLU 502 58.615 18.310 -3.162 305 HB2 GLU 502 HB2 GLU 502 60.201 17.003 -4.535 306 HB3 GLU 502 HB3 GLU 502 58.865 16.042 -5.152 307 HG2 GLU 502 HG2 GLU 502 59.386 17.708 -6.789 308 HG3 GLU 502 HG3 GLU 502 57.849 18.154 -6.059 309 H LYS 503 H LYS 503 56.751 15.356 -3.512 310 HA LYS 503 HA LYS 503 54.478 16.854 -4.683 311 HB2 LYS 503 HB2 LYS 503 55.028 13.908 -4.396 312 HB3 LYS 503 HB3 LYS 503 53.600 14.596 -5.171 313 HG2 LYS 503 HG2 LYS 503 55.012 15.762 -6.797 314 HG3 LYS 503 HG3 LYS 503 56.462 15.133 -6.018 315 HD2 LYS 503 HD2 LYS 503 54.301 13.338 -7.146 316 HD3 LYS 503 HD3 LYS 503 55.681 13.876 -8.100 317 HE2 LYS 503 HE2 LYS 503 57.147 12.934 -6.196 318 HE3 LYS 503 HE3 LYS 503 55.685 12.123 -5.637 319 HZ1 LYS 503 HZ1 LYS 503 55.569 10.829 -7.502 320 HZ2 LYS 503 HZ2 LYS 503 57.252 10.935 -7.284 321 HZ3 LYS 503 HZ3 LYS 503 56.479 11.900 -8.452 322 H LEU 504 H LEU 504 55.477 15.425 -1.727 323 HA LEU 504 HA LEU 504 52.970 14.693 -0.690 324 HB2 LEU 504 HB2 LEU 504 55.644 15.271 0.498 325 HB3 LEU 504 HB3 LEU 504 54.258 15.066 1.570 326 HG LEU 504 HG LEU 504 55.053 13.074 -0.571 327 HD11 LEU 504 HD11 LEU 504 55.789 11.713 1.465 328 HD12 LEU 504 HD12 LEU 504 55.697 13.218 2.365 329 HD13 LEU 504 HD13 LEU 504 56.827 13.070 1.023 330 HD21 LEU 504 HD21 LEU 504 53.599 11.676 1.276 331 HD22 LEU 504 HD22 LEU 504 52.906 12.423 -0.156 332 HD23 LEU 504 HD23 LEU 504 52.820 13.254 1.389 333 HA PRO 505 HA PRO 505 51.199 18.912 -0.390 334 HB2 PRO 505 HB2 PRO 505 49.534 17.893 1.778 335 HB3 PRO 505 HB3 PRO 505 49.045 18.347 0.136 336 HG2 PRO 505 HG2 PRO 505 49.732 15.673 1.213 337 HG3 PRO 505 HG3 PRO 505 48.690 16.104 -0.148 338 HD2 PRO 505 HD2 PRO 505 51.034 14.985 -0.570 339 HD3 PRO 505 HD3 PRO 505 50.502 16.314 -1.621 340 H GLU 506 H GLU 506 51.590 20.589 0.956 341 HA GLU 506 HA GLU 506 53.744 20.888 2.453 342 HB2 GLU 506 HB2 GLU 506 51.643 22.479 1.905 343 HB3 GLU 506 HB3 GLU 506 51.335 22.226 3.619 344 HG2 GLU 506 HG2 GLU 506 53.974 23.185 2.471 345 HG3 GLU 506 HG3 GLU 506 52.740 24.238 3.156 346 H LYS 507 H LYS 507 50.661 20.332 4.150 347 HA LYS 507 HA LYS 507 51.644 19.942 6.702 348 HB2 LYS 507 HB2 LYS 507 49.549 18.316 6.847 349 HB3 LYS 507 HB3 LYS 507 49.322 20.049 6.609 350 HG2 LYS 507 HG2 LYS 507 48.756 19.825 4.366 351 HG3 LYS 507 HG3 LYS 507 49.683 18.341 4.162 352 HD2 LYS 507 HD2 LYS 507 47.178 18.027 4.123 353 HD3 LYS 507 HD3 LYS 507 48.031 17.055 5.317 354 HE2 LYS 507 HE2 LYS 507 47.217 18.254 7.103 355 HE3 LYS 507 HE3 LYS 507 47.019 19.736 6.165 356 HZ1 LYS 507 HZ1 LYS 507 45.370 17.844 5.002 357 HZ2 LYS 507 HZ2 LYS 507 44.900 19.198 5.913 358 HZ3 LYS 507 HZ3 LYS 507 45.128 17.695 6.674 359 H TYR 508 H TYR 508 51.581 17.670 4.030 360 HA TYR 508 HA TYR 508 52.438 15.467 5.749 361 HB2 TYR 508 HB2 TYR 508 51.753 15.751 2.821 362 HB3 TYR 508 HB3 TYR 508 52.576 14.313 3.422 363 HD1 TYR 508 HD1 TYR 508 51.523 12.871 5.094 364 HD2 TYR 508 HD2 TYR 508 49.438 16.170 3.336 365 HE1 TYR 508 HE1 TYR 508 49.385 11.942 5.907 366 HE2 TYR 508 HE2 TYR 508 47.278 15.227 4.120 367 HH TYR 508 HH TYR 508 47.178 12.164 5.949 368 H LYS 509 H LYS 509 53.691 17.893 3.646 369 HA LYS 509 HA LYS 509 56.142 16.721 2.910 370 HB2 LYS 509 HB2 LYS 509 55.001 18.898 2.108 371 HB3 LYS 509 HB3 LYS 509 55.775 19.660 3.493 372 HG2 LYS 509 HG2 LYS 509 57.969 18.935 2.704 373 HG3 LYS 509 HG3 LYS 509 57.230 18.081 1.355 374 HD2 LYS 509 HD2 LYS 509 56.913 21.061 1.810 375 HD3 LYS 509 HD3 LYS 509 58.167 20.369 0.782 376 HE2 LYS 509 HE2 LYS 509 56.206 19.151 -0.423 377 HE3 LYS 509 HE3 LYS 509 55.176 20.335 0.378 378 HZ1 LYS 509 HZ1 LYS 509 55.652 21.540 -1.428 379 HZ2 LYS 509 HZ2 LYS 509 57.092 20.702 -1.764 380 HZ3 LYS 509 HZ3 LYS 509 57.069 21.916 -0.576 381 H ALA 510 H ALA 510 55.255 18.817 5.620 382 HA ALA 510 HA ALA 510 57.761 18.985 6.851 383 HB1 ALA 510 HB1 ALA 510 56.489 19.556 8.902 384 HB2 ALA 510 HB2 ALA 510 55.007 19.046 8.098 385 HB3 ALA 510 HB3 ALA 510 55.910 20.431 7.483 386 H GLU 511 H GLU 511 55.081 16.753 7.570 387 HA GLU 511 HA GLU 511 56.336 15.293 9.615 388 HB2 GLU 511 HB2 GLU 511 53.962 15.112 9.082 389 HB3 GLU 511 HB3 GLU 511 54.340 14.400 7.516 390 HG2 GLU 511 HG2 GLU 511 55.335 12.451 8.603 391 HG3 GLU 511 HG3 GLU 511 55.073 13.179 10.189 392 H TYR 512 H TYR 512 56.379 14.704 6.116 393 HA TYR 512 HA TYR 512 58.065 12.381 6.385 394 HB2 TYR 512 HB2 TYR 512 56.861 13.937 4.132 395 HB3 TYR 512 HB3 TYR 512 58.138 12.772 3.782 396 HD1 TYR 512 HD1 TYR 512 54.810 13.112 5.482 397 HD2 TYR 512 HD2 TYR 512 57.697 10.465 3.727 398 HE1 TYR 512 HE1 TYR 512 53.217 11.224 5.710 399 HE2 TYR 512 HE2 TYR 512 56.123 8.580 3.978 400 HH TYR 512 HH TYR 512 52.792 9.075 4.888 401 H LYS 513 H LYS 513 58.580 15.786 6.028 402 HA LYS 513 HA LYS 513 61.197 15.656 4.909 403 HB2 LYS 513 HB2 LYS 513 59.788 17.738 5.040 404 HB3 LYS 513 HB3 LYS 513 60.056 17.759 6.774 405 HG2 LYS 513 HG2 LYS 513 61.741 19.198 6.045 406 HG3 LYS 513 HG3 LYS 513 62.604 17.665 6.097 407 HD2 LYS 513 HD2 LYS 513 63.182 18.501 3.981 408 HD3 LYS 513 HD3 LYS 513 61.846 17.421 3.606 409 HE2 LYS 513 HE2 LYS 513 60.302 19.255 3.419 410 HE3 LYS 513 HE3 LYS 513 61.472 20.389 4.094 411 HZ1 LYS 513 HZ1 LYS 513 62.904 19.879 2.152 412 HZ2 LYS 513 HZ2 LYS 513 61.444 20.648 1.746 413 HZ3 LYS 513 HZ3 LYS 513 61.629 18.977 1.491 414 H LYS 514 H LYS 514 59.825 15.528 8.117 415 HA LYS 514 HA LYS 514 62.203 15.588 9.640 416 HB2 LYS 514 HB2 LYS 514 59.727 15.755 10.373 417 HB3 LYS 514 HB3 LYS 514 59.742 13.997 10.365 418 HG2 LYS 514 HG2 LYS 514 61.584 13.965 11.964 419 HG3 LYS 514 HG3 LYS 514 61.684 15.724 11.925 420 HD2 LYS 514 HD2 LYS 514 59.102 14.339 12.670 421 HD3 LYS 514 HD3 LYS 514 60.361 14.615 13.876 422 HE2 LYS 514 HE2 LYS 514 60.312 17.069 13.218 423 HE3 LYS 514 HE3 LYS 514 58.885 16.708 12.249 424 HZ1 LYS 514 HZ1 LYS 514 57.791 15.876 14.226 425 HZ2 LYS 514 HZ2 LYS 514 58.275 17.490 14.440 426 HZ3 LYS 514 HZ3 LYS 514 59.158 16.230 15.163 427 H LYS 515 H LYS 515 60.272 12.937 8.280 428 HA LYS 515 HA LYS 515 61.890 10.800 9.198 429 HB2 LYS 515 HB2 LYS 515 60.047 11.050 6.822 430 HB3 LYS 515 HB3 LYS 515 60.874 9.552 7.215 431 HG2 LYS 515 HG2 LYS 515 59.803 9.861 9.585 432 HG3 LYS 515 HG3 LYS 515 58.722 10.993 8.774 433 HD2 LYS 515 HD2 LYS 515 59.159 8.140 7.806 434 HD3 LYS 515 HD3 LYS 515 57.857 8.605 8.901 435 HE2 LYS 515 HE2 LYS 515 56.928 8.653 6.706 436 HE3 LYS 515 HE3 LYS 515 57.186 10.340 7.157 437 HZ1 LYS 515 HZ1 LYS 515 58.722 10.593 5.587 438 HZ2 LYS 515 HZ2 LYS 515 58.114 9.157 4.912 439 HZ3 LYS 515 HZ3 LYS 515 59.474 9.112 5.931 440 H LEU 516 H LEU 516 61.958 12.721 6.226 441 HA LEU 516 HA LEU 516 63.913 11.304 4.805 442 HB2 LEU 516 HB2 LEU 516 62.647 13.021 3.727 443 HB3 LEU 516 HB3 LEU 516 63.151 14.226 4.901 444 HG LEU 516 HG LEU 516 65.422 14.182 4.053 445 HD11 LEU 516 HD11 LEU 516 65.805 12.750 1.926 446 HD12 LEU 516 HD12 LEU 516 64.392 11.847 2.453 447 HD13 LEU 516 HD13 LEU 516 65.818 11.921 3.482 448 HD21 LEU 516 HD21 LEU 516 65.036 15.105 1.859 449 HD22 LEU 516 HD22 LEU 516 63.642 15.519 2.857 450 HD23 LEU 516 HD23 LEU 516 63.530 14.203 1.689 451 H ASP 517 H ASP 517 64.242 14.066 7.014 452 HA ASP 517 HA ASP 517 67.029 14.308 6.940 453 HB2 ASP 517 HB2 ASP 517 65.543 16.000 7.904 454 HB3 ASP 517 HB3 ASP 517 65.104 14.892 9.201 455 H GLN 518 H GLN 518 64.943 12.514 9.178 456 HA GLN 518 HA GLN 518 67.019 11.457 10.785 457 HB2 GLN 518 HB2 GLN 518 64.216 10.466 10.269 458 HB3 GLN 518 HB3 GLN 518 65.292 9.808 11.503 459 HG2 GLN 518 HG2 GLN 518 65.419 11.929 12.634 460 HG3 GLN 518 HG3 GLN 518 64.559 12.738 11.324 461 HE21 GLN 518 HE21 GLN 518 64.086 11.467 14.389 462 HE22 GLN 518 HE22 GLN 518 62.418 11.161 14.290 463 H THR 519 H THR 519 65.460 10.208 7.873 464 HA THR 519 HA THR 519 66.599 7.621 7.934 465 HB THR 519 HB THR 519 65.873 9.212 5.463 466 HG1 THR 519 HG1 THR 519 64.123 7.540 6.896 467 HG21 THR 519 HG21 THR 519 65.665 7.161 4.381 468 HG22 THR 519 HG22 THR 519 65.391 6.284 5.882 469 HG23 THR 519 HG23 THR 519 67.018 6.821 5.459 470 H ARG 520 H ARG 520 67.657 10.671 6.529 471 HA ARG 520 HA ARG 520 69.941 9.741 5.166 472 HB2 ARG 520 HB2 ARG 520 69.186 12.418 6.342 473 HB3 ARG 520 HB3 ARG 520 70.673 12.167 5.424 474 HG2 ARG 520 HG2 ARG 520 69.435 11.457 3.491 475 HG3 ARG 520 HG3 ARG 520 67.922 11.463 4.389 476 HD2 ARG 520 HD2 ARG 520 68.101 13.881 4.699 477 HD3 ARG 520 HD3 ARG 520 69.648 13.891 3.856 478 HE ARG 520 HE ARG 520 67.534 12.731 2.285 479 HH11 ARG 520 HH11 ARG 520 66.967 15.663 3.408 480 HH12 ARG 520 HH12 ARG 520 67.345 16.573 1.984 481 HH21 ARG 520 HH21 ARG 520 68.897 13.917 0.383 482 HH22 ARG 520 HH22 ARG 520 68.440 15.585 0.270 483 H VAL 521 H VAL 521 69.418 10.756 8.495 484 HA VAL 521 HA VAL 521 72.112 10.881 9.315 485 HB VAL 521 HB VAL 521 69.578 10.222 10.834 486 HG11 VAL 521 HG11 VAL 521 71.370 9.346 12.148 487 HG12 VAL 521 HG12 VAL 521 70.975 10.918 12.841 488 HG13 VAL 521 HG13 VAL 521 72.393 10.741 11.808 489 HG21 VAL 521 HG21 VAL 521 69.451 12.506 11.343 490 HG22 VAL 521 HG22 VAL 521 70.012 12.534 9.673 491 HG23 VAL 521 HG23 VAL 521 71.159 12.788 10.989 492 H GLU 522 H GLU 522 69.753 8.231 9.400 493 HA GLU 522 HA GLU 522 71.422 6.293 10.605 494 HB2 GLU 522 HB2 GLU 522 69.091 5.952 8.698 495 HB3 GLU 522 HB3 GLU 522 69.787 4.668 9.685 496 HG2 GLU 522 HG2 GLU 522 69.224 5.922 11.727 497 HG3 GLU 522 HG3 GLU 522 68.550 7.224 10.744 498 H LEU 523 H LEU 523 70.738 7.070 7.229 499 HA LEU 523 HA LEU 523 72.267 5.026 6.025 500 HB2 LEU 523 HB2 LEU 523 70.523 6.470 4.917 501 HB3 LEU 523 HB3 LEU 523 71.697 7.785 4.930 502 HG LEU 523 HG LEU 523 73.258 5.935 3.762 503 HD11 LEU 523 HD11 LEU 523 71.986 4.472 2.291 504 HD12 LEU 523 HD12 LEU 523 70.468 5.129 2.896 505 HD13 LEU 523 HD13 LEU 523 71.499 4.170 3.957 506 HD21 LEU 523 HD21 LEU 523 72.782 8.028 2.689 507 HD22 LEU 523 HD22 LEU 523 71.090 7.589 2.444 508 HD23 LEU 523 HD23 LEU 523 72.356 6.762 1.536 509 H ALA 524 H ALA 524 73.086 8.363 6.932 510 HA ALA 524 HA ALA 524 75.650 8.420 5.777 511 HB1 ALA 524 HB1 ALA 524 74.288 10.377 6.672 512 HB2 ALA 524 HB2 ALA 524 76.014 10.397 7.043 513 HB3 ALA 524 HB3 ALA 524 74.849 9.905 8.274 514 H ASP 525 H ASP 525 74.528 7.357 8.948 515 HA ASP 525 HA ASP 525 77.094 6.973 10.099 516 HB2 ASP 525 HB2 ASP 525 74.850 7.082 11.288 517 HB3 ASP 525 HB3 ASP 525 74.581 5.427 10.744 518 H GLN 526 H GLN 526 74.876 4.861 8.353 519 HA GLN 526 HA GLN 526 76.441 2.490 8.522 520 HB2 GLN 526 HB2 GLN 526 74.033 2.465 8.091 521 HB3 GLN 526 HB3 GLN 526 74.282 3.315 6.569 522 HG2 GLN 526 HG2 GLN 526 75.532 1.442 5.667 523 HG3 GLN 526 HG3 GLN 526 75.478 0.611 7.223 524 HE21 GLN 526 HE21 GLN 526 74.033 0.510 4.258 525 HE22 GLN 526 HE22 GLN 526 72.493 -0.047 4.704 526 H VAL 527 H VAL 527 76.200 5.107 6.195 527 HA VAL 527 HA VAL 527 77.865 3.911 4.193 528 HB VAL 527 HB VAL 527 76.796 6.695 4.688 529 HG11 VAL 527 HG11 VAL 527 77.659 7.163 2.329 530 HG12 VAL 527 HG12 VAL 527 78.693 5.747 2.530 531 HG13 VAL 527 HG13 VAL 527 78.876 7.134 3.606 532 HG21 VAL 527 HG21 VAL 527 76.315 4.792 2.385 533 HG22 VAL 527 HG22 VAL 527 75.380 6.222 2.821 534 HG23 VAL 527 HG23 VAL 527 75.330 4.789 3.849 535 H LYS 528 H LYS 528 78.383 5.854 7.024 536 HA LYS 528 HA LYS 528 80.987 6.828 6.433 537 HB2 LYS 528 HB2 LYS 528 79.513 7.796 8.130 538 HB3 LYS 528 HB3 LYS 528 79.662 6.331 9.096 539 HG2 LYS 528 HG2 LYS 528 82.112 6.682 9.240 540 HG3 LYS 528 HG3 LYS 528 81.941 8.171 8.306 541 HD2 LYS 528 HD2 LYS 528 80.401 7.715 10.861 542 HD3 LYS 528 HD3 LYS 528 82.027 8.387 10.875 543 HE2 LYS 528 HE2 LYS 528 81.195 10.159 9.252 544 HE3 LYS 528 HE3 LYS 528 79.566 9.561 9.554 545 HZ1 LYS 528 HZ1 LYS 528 79.721 11.172 11.132 546 HZ2 LYS 528 HZ2 LYS 528 81.392 10.963 11.362 547 HZ3 LYS 528 HZ3 LYS 528 80.294 9.847 12.021 548 H SER 529 H SER 529 79.813 4.007 8.228 549 HA SER 529 HA SER 529 82.427 3.150 8.975 550 HB2 SER 529 HB2 SER 529 80.390 2.525 10.237 551 HB3 SER 529 HB3 SER 529 79.838 1.578 8.859 552 HG SER 529 HG SER 529 81.483 0.861 10.805 553 H ALA 530 H ALA 530 80.580 2.911 6.116 554 HA ALA 530 HA ALA 530 81.815 0.503 5.107 555 HB1 ALA 530 HB1 ALA 530 80.378 2.594 3.484 556 HB2 ALA 530 HB2 ALA 530 79.511 1.409 4.461 557 HB3 ALA 530 HB3 ALA 530 80.548 0.872 3.136 558 H VAL 531 H VAL 531 83.003 3.447 5.717 559 HA VAL 531 HA VAL 531 84.439 4.025 3.308 560 HB VAL 531 HB VAL 531 83.764 5.641 5.141 561 HG11 VAL 531 HG11 VAL 531 84.724 4.057 6.946 562 HG12 VAL 531 HG12 VAL 531 84.997 5.789 7.137 563 HG13 VAL 531 HG13 VAL 531 86.290 4.753 6.526 564 HG21 VAL 531 HG21 VAL 531 85.700 7.055 4.807 565 HG22 VAL 531 HG22 VAL 531 85.421 6.152 3.319 566 HG23 VAL 531 HG23 VAL 531 86.709 5.666 4.420 567 H THR 532 H THR 532 84.707 1.466 5.280 568 HA THR 532 HA THR 532 87.648 1.372 5.353 569 HB THR 532 HB THR 532 86.184 0.780 7.357 570 HG1 THR 532 HG1 THR 532 87.937 -0.185 7.886 571 HG21 THR 532 HG21 THR 532 85.857 -1.899 6.028 572 HG22 THR 532 HG22 THR 532 84.635 -0.646 5.795 573 HG23 THR 532 HG23 THR 532 84.998 -1.238 7.419 574 H GLU 533 H GLU 533 88.665 0.519 3.660 575 HA GLU 533 HA GLU 533 89.059 -0.676 1.727 576 HB2 GLU 533 HB2 GLU 533 87.737 -2.688 3.529 577 HB3 GLU 533 HB3 GLU 533 88.510 -3.124 2.005 578 HG2 GLU 533 HG2 GLU 533 90.643 -2.242 2.788 579 HG3 GLU 533 HG3 GLU 533 89.890 -1.647 4.266 580 H PHE 534 H PHE 534 86.217 0.528 2.271 581 HA PHE 534 HA PHE 534 84.125 0.514 1.273 582 HB2 PHE 534 HB2 PHE 534 86.108 0.297 -0.979 583 HB3 PHE 534 HB3 PHE 534 84.397 0.642 -1.244 584 HD1 PHE 534 HD1 PHE 534 87.487 1.840 0.442 585 HD2 PHE 534 HD2 PHE 534 83.492 2.809 -0.799 586 HE1 PHE 534 HE1 PHE 534 87.900 4.227 0.977 587 HE2 PHE 534 HE2 PHE 534 83.903 5.196 -0.262 588 HZ PHE 534 HZ PHE 534 86.107 5.905 0.628 589 H GLU 535 H GLU 535 83.160 -1.399 1.992 590 HA GLU 535 HA GLU 535 83.511 -4.000 1.224 591 HB2 GLU 535 HB2 GLU 535 81.104 -4.312 1.673 592 HB3 GLU 535 HB3 GLU 535 81.846 -3.262 2.883 593 HG2 GLU 535 HG2 GLU 535 81.091 -1.280 1.541 594 HG3 GLU 535 HG3 GLU 535 80.224 -2.382 0.474 595 H ASN 536 H ASN 536 82.882 -5.311 -0.471 596 HA ASN 536 HA ASN 536 82.380 -5.869 -2.639 597 HB2 ASN 536 HB2 ASN 536 80.134 -4.991 -1.729 598 HB3 ASN 536 HB3 ASN 536 80.475 -3.532 -2.655 599 HD21 ASN 536 HD21 ASN 536 81.307 -4.192 -5.051 600 HD22 ASN 536 HD22 ASN 536 80.329 -5.343 -5.824 601 H VAL 537 H VAL 537 84.694 -4.559 -2.613 602 HA VAL 537 HA VAL 537 84.825 -2.134 -4.042 603 HB VAL 537 HB VAL 537 87.200 -2.877 -4.468 604 HG11 VAL 537 HG11 VAL 537 86.349 -1.666 -2.361 605 HG12 VAL 537 HG12 VAL 537 87.894 -2.501 -2.233 606 HG13 VAL 537 HG13 VAL 537 86.439 -3.243 -1.576 607 HG21 VAL 537 HG21 VAL 537 86.463 -5.211 -2.703 608 HG22 VAL 537 HG22 VAL 537 87.992 -4.928 -3.532 609 HG23 VAL 537 HG23 VAL 537 86.554 -5.341 -4.460 610 H THR 538 H THR 538 85.068 -1.684 -6.185 611 HA THR 538 HA THR 538 84.677 -1.939 -8.442 612 HB THR 538 HB THR 538 85.950 -3.880 -9.460 613 HG1 THR 538 HG1 THR 538 86.613 -5.373 -8.163 614 HG21 THR 538 HG21 THR 538 86.985 -1.685 -9.149 615 HG22 THR 538 HG22 THR 538 88.155 -2.955 -8.795 616 HG23 THR 538 HG23 THR 538 87.375 -2.085 -7.475 617 HA PRO 539 HA PRO 539 81.310 -5.079 -7.917 618 HB2 PRO 539 HB2 PRO 539 79.359 -2.964 -8.384 619 HB3 PRO 539 HB3 PRO 539 79.602 -3.927 -6.921 620 HG2 PRO 539 HG2 PRO 539 80.153 -1.245 -7.097 621 HG3 PRO 539 HG3 PRO 539 80.932 -2.346 -5.946 622 HD2 PRO 539 HD2 PRO 539 81.986 -1.299 -8.559 623 HD3 PRO 539 HD3 PRO 539 82.837 -1.548 -7.015 624 H THR 540 H THR 540 79.813 -5.871 -9.520 625 HA THR 540 HA THR 540 80.703 -5.684 -12.190 626 HB THR 540 HB THR 540 79.426 -7.605 -11.263 627 HG1 THR 540 HG1 THR 540 77.784 -6.613 -13.269 628 HG21 THR 540 HG21 THR 540 77.106 -7.443 -10.758 629 HG22 THR 540 HG22 THR 540 76.976 -5.854 -11.508 630 HG23 THR 540 HG23 THR 540 77.840 -6.040 -9.980 631 H ASN 541 H ASN 541 80.030 -4.429 -13.907 632 HA ASN 541 HA ASN 541 78.654 -1.985 -13.274 633 HB2 ASN 541 HB2 ASN 541 79.591 -3.116 -15.914 634 HB3 ASN 541 HB3 ASN 541 78.932 -1.496 -15.696 635 HD21 ASN 541 HD21 ASN 541 80.211 -1.157 -13.001 636 HD22 ASN 541 HD22 ASN 541 81.862 -0.925 -13.309 637 H ASP 542 H ASP 542 76.620 -1.390 -13.657 638 HA ASP 542 HA ASP 542 74.608 -3.365 -14.052 639 HB2 ASP 542 HB2 ASP 542 73.058 -1.445 -13.986 640 HB3 ASP 542 HB3 ASP 542 74.236 -1.378 -12.674 641 H GLN 543 H GLN 543 73.155 -3.619 -15.782 642 HA GLN 543 HA GLN 543 73.386 -2.116 -18.212 643 HB2 GLN 543 HB2 GLN 543 75.467 -3.446 -18.328 644 HB3 GLN 543 HB3 GLN 543 74.516 -4.924 -18.195 645 HG2 GLN 543 HG2 GLN 543 73.344 -4.383 -20.281 646 HG3 GLN 543 HG3 GLN 543 74.241 -2.869 -20.407 647 HE21 GLN 543 HE21 GLN 543 75.690 -3.210 -22.121 648 HE22 GLN 543 HE22 GLN 543 76.731 -4.545 -22.240 Start of MODEL 20 1 H1 SER 466 H1 SER 466 27.891 0.068 3.590 2 H2 SER 466 H2 SER 466 28.492 1.364 2.669 3 H3 SER 466 H3 SER 466 29.558 0.205 3.307 4 HA SER 466 HA SER 466 28.459 -1.507 1.920 5 HB2 SER 466 HB2 SER 466 27.072 -0.656 0.042 6 HB3 SER 466 HB3 SER 466 26.328 -0.325 1.604 7 HG SER 466 HG SER 466 26.710 1.420 -0.184 8 H ASP 467 H ASP 467 29.688 1.737 1.329 9 HA ASP 467 HA ASP 467 31.255 0.858 -0.981 10 HB2 ASP 467 HB2 ASP 467 30.884 3.533 0.381 11 HB3 ASP 467 HB3 ASP 467 31.980 3.276 -0.976 12 H ASP 468 H ASP 468 33.120 -0.179 -0.594 13 HA ASP 468 HA ASP 468 34.590 0.222 1.889 14 HB2 ASP 468 HB2 ASP 468 35.053 -1.569 -0.505 15 HB3 ASP 468 HB3 ASP 468 36.066 -1.563 0.938 16 H TYR 469 H TYR 469 34.367 1.861 -0.872 17 HA TYR 469 HA TYR 469 36.956 2.324 -1.825 18 HB2 TYR 469 HB2 TYR 469 34.709 2.964 -2.798 19 HB3 TYR 469 HB3 TYR 469 34.717 4.325 -1.681 20 HD1 TYR 469 HD1 TYR 469 36.442 2.781 -4.571 21 HD2 TYR 469 HD2 TYR 469 36.142 6.225 -2.022 22 HE1 TYR 469 HE1 TYR 469 37.828 4.080 -6.162 23 HE2 TYR 469 HE2 TYR 469 37.533 7.523 -3.611 24 HH TYR 469 HH TYR 469 39.326 6.909 -5.418 25 H VAL 470 H VAL 470 38.469 3.967 -1.408 26 HA VAL 470 HA VAL 470 38.306 5.185 1.295 27 HB VAL 470 HB VAL 470 40.787 4.721 -0.375 28 HG11 VAL 470 HG11 VAL 470 41.247 6.390 1.209 29 HG12 VAL 470 HG12 VAL 470 41.792 4.903 1.988 30 HG13 VAL 470 HG13 VAL 470 40.254 5.624 2.449 31 HG21 VAL 470 HG21 VAL 470 39.740 2.569 0.169 32 HG22 VAL 470 HG22 VAL 470 39.597 3.050 1.860 33 HG23 VAL 470 HG23 VAL 470 41.190 2.802 1.144 34 H ASP 471 H ASP 471 38.571 7.359 1.580 35 HA ASP 471 HA ASP 471 37.885 9.183 -0.349 36 HB2 ASP 471 HB2 ASP 471 39.667 9.527 2.069 37 HB3 ASP 471 HB3 ASP 471 39.114 10.878 1.081 38 H GLU 472 H GLU 472 38.962 10.510 -1.767 39 HA GLU 472 HA GLU 472 41.121 9.468 -3.214 40 HB2 GLU 472 HB2 GLU 472 39.921 12.240 -3.119 41 HB3 GLU 472 HB3 GLU 472 41.133 11.740 -4.299 42 HG2 GLU 472 HG2 GLU 472 39.657 9.974 -5.122 43 HG3 GLU 472 HG3 GLU 472 38.463 10.358 -3.882 44 H GLU 473 H GLU 473 41.058 11.994 -0.703 45 HA GLU 473 HA GLU 473 43.727 12.850 -1.036 46 HB2 GLU 473 HB2 GLU 473 42.362 14.327 0.151 47 HB3 GLU 473 HB3 GLU 473 41.627 13.042 1.102 48 HG2 GLU 473 HG2 GLU 473 43.579 12.799 2.448 49 HG3 GLU 473 HG3 GLU 473 44.526 13.835 1.380 50 H THR 474 H THR 474 42.236 10.489 1.140 51 HA THR 474 HA THR 474 44.604 9.714 2.502 52 HB THR 474 HB THR 474 41.905 8.456 2.016 53 HG1 THR 474 HG1 THR 474 42.784 10.251 3.659 54 HG21 THR 474 HG21 THR 474 43.339 6.558 2.238 55 HG22 THR 474 HG22 THR 474 42.574 6.797 3.806 56 HG23 THR 474 HG23 THR 474 44.242 7.311 3.554 57 H TYR 475 H TYR 475 42.862 8.440 -0.289 58 HA TYR 475 HA TYR 475 44.442 6.165 -0.694 59 HB2 TYR 475 HB2 TYR 475 42.166 6.744 -1.673 60 HB3 TYR 475 HB3 TYR 475 43.028 7.736 -2.850 61 HD1 TYR 475 HD1 TYR 475 42.934 4.324 -1.384 62 HD2 TYR 475 HD2 TYR 475 43.928 6.748 -4.777 63 HE1 TYR 475 HE1 TYR 475 43.407 2.268 -2.710 64 HE2 TYR 475 HE2 TYR 475 44.410 4.706 -6.110 65 HH TYR 475 HH TYR 475 44.980 2.373 -5.762 66 H ASN 476 H ASN 476 44.685 9.428 -2.122 67 HA ASN 476 HA ASN 476 46.886 8.798 -3.805 68 HB2 ASN 476 HB2 ASN 476 46.152 11.497 -2.645 69 HB3 ASN 476 HB3 ASN 476 47.148 11.181 -4.070 70 HD21 ASN 476 HD21 ASN 476 45.295 8.860 -4.819 71 HD22 ASN 476 HD22 ASN 476 43.934 9.614 -5.500 72 H LEU 477 H LEU 477 46.567 9.927 -0.490 73 HA LEU 477 HA LEU 477 49.244 10.593 0.033 74 HB2 LEU 477 HB2 LEU 477 47.392 11.111 1.553 75 HB3 LEU 477 HB3 LEU 477 47.116 9.401 1.831 76 HG LEU 477 HG LEU 477 49.371 9.198 2.799 77 HD11 LEU 477 HD11 LEU 477 49.474 12.119 2.070 78 HD12 LEU 477 HD12 LEU 477 50.699 10.875 1.829 79 HD13 LEU 477 HD13 LEU 477 50.408 11.522 3.441 80 HD21 LEU 477 HD21 LEU 477 48.863 10.325 4.887 81 HD22 LEU 477 HD22 LEU 477 47.370 9.695 4.195 82 HD23 LEU 477 HD23 LEU 477 47.746 11.411 4.063 83 H GLN 478 H GLN 478 47.470 7.515 0.278 84 HA GLN 478 HA GLN 478 49.632 5.922 1.192 85 HB2 GLN 478 HB2 GLN 478 47.133 5.237 -0.378 86 HB3 GLN 478 HB3 GLN 478 48.242 4.031 0.276 87 HG2 GLN 478 HG2 GLN 478 46.850 6.139 1.945 88 HG3 GLN 478 HG3 GLN 478 46.267 4.488 1.753 89 HE21 GLN 478 HE21 GLN 478 47.806 6.299 3.944 90 HE22 GLN 478 HE22 GLN 478 48.869 5.156 4.615 91 H LYS 479 H LYS 479 48.408 6.777 -1.968 92 HA LYS 479 HA LYS 479 50.062 5.109 -3.536 93 HB2 LYS 479 HB2 LYS 479 47.900 6.391 -4.139 94 HB3 LYS 479 HB3 LYS 479 48.952 7.785 -4.385 95 HG2 LYS 479 HG2 LYS 479 50.200 6.608 -6.100 96 HG3 LYS 479 HG3 LYS 479 49.349 5.104 -5.751 97 HD2 LYS 479 HD2 LYS 479 48.332 6.082 -7.718 98 HD3 LYS 479 HD3 LYS 479 47.199 6.250 -6.379 99 HE2 LYS 479 HE2 LYS 479 47.674 8.561 -6.120 100 HE3 LYS 479 HE3 LYS 479 49.148 8.448 -7.082 101 HZ1 LYS 479 HZ1 LYS 479 47.705 9.310 -8.598 102 HZ2 LYS 479 HZ2 LYS 479 46.351 8.516 -7.948 103 HZ3 LYS 479 HZ3 LYS 479 47.468 7.657 -8.897 104 H LEU 480 H LEU 480 50.415 8.344 -2.255 105 HA LEU 480 HA LEU 480 52.705 9.102 -3.736 106 HB2 LEU 480 HB2 LEU 480 51.269 10.037 -1.280 107 HB3 LEU 480 HB3 LEU 480 52.879 10.686 -1.583 108 HG LEU 480 HG LEU 480 50.982 10.660 -3.908 109 HD11 LEU 480 HD11 LEU 480 50.588 12.327 -1.434 110 HD12 LEU 480 HD12 LEU 480 49.384 11.560 -2.460 111 HD13 LEU 480 HD13 LEU 480 50.210 13.016 -3.012 112 HD21 LEU 480 HD21 LEU 480 52.787 12.867 -2.905 113 HD22 LEU 480 HD22 LEU 480 52.193 12.607 -4.545 114 HD23 LEU 480 HD23 LEU 480 53.401 11.519 -3.862 115 H LEU 481 H LEU 481 52.449 8.135 -0.311 116 HA LEU 481 HA LEU 481 55.295 7.899 -0.011 117 HB2 LEU 481 HB2 LEU 481 54.700 7.096 2.247 118 HB3 LEU 481 HB3 LEU 481 53.874 8.592 1.827 119 HG LEU 481 HG LEU 481 52.072 6.691 0.890 120 HD11 LEU 481 HD11 LEU 481 52.945 5.630 3.574 121 HD12 LEU 481 HD12 LEU 481 53.626 4.991 2.082 122 HD13 LEU 481 HD13 LEU 481 51.893 4.880 2.376 123 HD21 LEU 481 HD21 LEU 481 52.068 7.719 3.730 124 HD22 LEU 481 HD22 LEU 481 50.681 7.306 2.740 125 HD23 LEU 481 HD23 LEU 481 51.647 8.729 2.349 126 H ALA 482 H ALA 482 53.036 5.874 -1.401 127 HA ALA 482 HA ALA 482 53.543 3.342 -0.485 128 HB1 ALA 482 HB1 ALA 482 52.520 4.537 -2.907 129 HB2 ALA 482 HB2 ALA 482 52.079 3.006 -2.170 130 HB3 ALA 482 HB3 ALA 482 53.428 3.084 -3.300 131 HA PRO 483 HA PRO 483 57.264 2.809 -3.725 132 HB2 PRO 483 HB2 PRO 483 58.569 5.396 -3.705 133 HB3 PRO 483 HB3 PRO 483 57.864 4.542 -5.087 134 HG2 PRO 483 HG2 PRO 483 56.697 6.673 -3.402 135 HG3 PRO 483 HG3 PRO 483 56.345 6.243 -5.084 136 HD2 PRO 483 HD2 PRO 483 54.594 5.704 -3.128 137 HD3 PRO 483 HD3 PRO 483 54.826 4.573 -4.477 138 H TYR 484 H TYR 484 57.659 5.394 -1.291 139 HA TYR 484 HA TYR 484 60.131 4.523 -0.277 140 HB2 TYR 484 HB2 TYR 484 59.642 6.701 0.326 141 HB3 TYR 484 HB3 TYR 484 57.942 6.345 0.644 142 HD1 TYR 484 HD1 TYR 484 61.396 5.923 2.015 143 HD2 TYR 484 HD2 TYR 484 57.185 5.750 2.831 144 HE1 TYR 484 HE1 TYR 484 61.872 5.668 4.437 145 HE2 TYR 484 HE2 TYR 484 57.665 5.490 5.248 146 HH TYR 484 HH TYR 484 60.640 4.651 6.449 147 H HIS 485 H HIS 485 56.813 3.823 0.708 148 HA HIS 485 HA HIS 485 57.375 2.312 3.011 149 HB2 HIS 485 HB2 HIS 485 55.145 3.214 2.336 150 HB3 HIS 485 HB3 HIS 485 55.058 1.966 1.096 151 HD1 HIS 485 HD1 HIS 485 54.211 -0.283 1.816 152 HD2 HIS 485 HD2 HIS 485 55.308 2.077 5.072 153 HE1 HIS 485 HE1 HIS 485 53.479 -1.539 3.890 154 H LYS 486 H LYS 486 57.409 1.515 -0.388 155 HA LYS 486 HA LYS 486 57.659 -1.357 0.079 156 HB2 LYS 486 HB2 LYS 486 57.768 0.347 -2.426 157 HB3 LYS 486 HB3 LYS 486 57.849 -1.415 -2.412 158 HG2 LYS 486 HG2 LYS 486 55.636 -1.546 -1.376 159 HG3 LYS 486 HG3 LYS 486 55.554 0.213 -1.270 160 HD2 LYS 486 HD2 LYS 486 55.668 0.374 -3.727 161 HD3 LYS 486 HD3 LYS 486 55.751 -1.384 -3.843 162 HE2 LYS 486 HE2 LYS 486 53.543 -1.563 -2.758 163 HE3 LYS 486 HE3 LYS 486 53.461 0.194 -2.630 164 HZ1 LYS 486 HZ1 LYS 486 52.342 -0.147 -4.570 165 HZ2 LYS 486 HZ2 LYS 486 53.254 -1.512 -5.004 166 HZ3 LYS 486 HZ3 LYS 486 53.913 0.044 -5.182 167 H ALA 487 H ALA 487 59.682 1.359 -0.068 168 HA ALA 487 HA ALA 487 62.009 0.262 -1.239 169 HB1 ALA 487 HB1 ALA 487 63.097 2.234 -0.479 170 HB2 ALA 487 HB2 ALA 487 61.877 2.507 0.762 171 HB3 ALA 487 HB3 ALA 487 61.461 2.707 -0.938 172 H LYS 488 H LYS 488 63.182 -1.309 -0.443 173 HA LYS 488 HA LYS 488 63.201 -1.931 2.428 174 HB2 LYS 488 HB2 LYS 488 64.513 -3.935 1.662 175 HB3 LYS 488 HB3 LYS 488 62.900 -3.815 0.956 176 HG2 LYS 488 HG2 LYS 488 63.776 -2.945 -1.106 177 HG3 LYS 488 HG3 LYS 488 65.380 -2.740 -0.411 178 HD2 LYS 488 HD2 LYS 488 65.438 -4.734 -1.749 179 HD3 LYS 488 HD3 LYS 488 65.459 -5.236 -0.060 180 HE2 LYS 488 HE2 LYS 488 63.172 -5.879 -0.110 181 HE3 LYS 488 HE3 LYS 488 62.881 -5.025 -1.626 182 HZ1 LYS 488 HZ1 LYS 488 63.104 -7.178 -2.333 183 HZ2 LYS 488 HZ2 LYS 488 64.271 -7.573 -1.163 184 HZ3 LYS 488 HZ3 LYS 488 64.699 -6.626 -2.509 185 H THR 489 H THR 489 65.076 -0.200 0.169 186 HA THR 489 HA THR 489 67.538 -0.496 1.798 187 HB THR 489 HB THR 489 68.473 0.794 -0.315 188 HG1 THR 489 HG1 THR 489 66.622 -0.589 -1.769 189 HG21 THR 489 HG21 THR 489 68.678 -1.442 -1.504 190 HG22 THR 489 HG22 THR 489 67.665 -2.118 -0.226 191 HG23 THR 489 HG23 THR 489 69.235 -1.414 0.170 192 H LEU 490 H LEU 490 68.353 1.190 2.916 193 HA LEU 490 HA LEU 490 66.810 3.455 3.519 194 HB2 LEU 490 HB2 LEU 490 69.699 2.701 3.929 195 HB3 LEU 490 HB3 LEU 490 69.111 4.292 4.420 196 HG LEU 490 HG LEU 490 67.353 3.195 5.786 197 HD11 LEU 490 HD11 LEU 490 66.979 1.123 4.697 198 HD12 LEU 490 HD12 LEU 490 67.754 0.687 6.217 199 HD13 LEU 490 HD13 LEU 490 68.692 0.707 4.724 200 HD21 LEU 490 HD21 LEU 490 68.946 2.173 7.481 201 HD22 LEU 490 HD22 LEU 490 69.389 3.789 6.931 202 HD23 LEU 490 HD23 LEU 490 70.226 2.377 6.286 203 H GLU 491 H GLU 491 69.539 3.030 1.290 204 HA GLU 491 HA GLU 491 69.979 5.670 0.515 205 HB2 GLU 491 HB2 GLU 491 71.512 4.015 -0.197 206 HB3 GLU 491 HB3 GLU 491 70.245 3.019 -0.905 207 HG2 GLU 491 HG2 GLU 491 70.779 5.793 -1.956 208 HG3 GLU 491 HG3 GLU 491 71.759 4.428 -2.485 209 H ARG 492 H ARG 492 67.679 3.303 -0.685 210 HA ARG 492 HA ARG 492 66.575 4.951 -2.737 211 HB2 ARG 492 HB2 ARG 492 66.423 2.544 -2.877 212 HB3 ARG 492 HB3 ARG 492 65.533 2.472 -1.358 213 HG2 ARG 492 HG2 ARG 492 63.635 3.593 -2.313 214 HG3 ARG 492 HG3 ARG 492 64.541 3.999 -3.776 215 HD2 ARG 492 HD2 ARG 492 63.895 1.185 -2.857 216 HD3 ARG 492 HD3 ARG 492 63.038 2.060 -4.128 217 HE ARG 492 HE ARG 492 65.711 2.151 -4.836 218 HH11 ARG 492 HH11 ARG 492 65.283 -0.648 -3.415 219 HH12 ARG 492 HH12 ARG 492 65.142 -1.652 -4.819 220 HH21 ARG 492 HH21 ARG 492 64.710 1.005 -7.001 221 HH22 ARG 492 HH22 ARG 492 64.817 -0.716 -6.847 222 H GLN 493 H GLN 493 65.728 4.282 0.625 223 HA GLN 493 HA GLN 493 63.202 5.476 0.652 224 HB2 GLN 493 HB2 GLN 493 65.331 5.192 2.773 225 HB3 GLN 493 HB3 GLN 493 63.749 5.891 3.107 226 HG2 GLN 493 HG2 GLN 493 62.626 3.868 2.478 227 HG3 GLN 493 HG3 GLN 493 64.104 3.172 1.827 228 HE21 GLN 493 HE21 GLN 493 63.196 1.453 3.542 229 HE22 GLN 493 HE22 GLN 493 63.861 1.592 5.099 230 H VAL 494 H VAL 494 66.423 6.885 1.189 231 HA VAL 494 HA VAL 494 65.579 9.521 1.739 232 HB VAL 494 HB VAL 494 68.113 8.465 0.455 233 HG11 VAL 494 HG11 VAL 494 67.932 10.802 -0.096 234 HG12 VAL 494 HG12 VAL 494 69.058 10.669 1.256 235 HG13 VAL 494 HG13 VAL 494 67.401 11.201 1.539 236 HG21 VAL 494 HG21 VAL 494 67.311 9.165 3.291 237 HG22 VAL 494 HG22 VAL 494 68.986 8.922 2.794 238 HG23 VAL 494 HG23 VAL 494 67.831 7.594 2.678 239 H TYR 495 H TYR 495 66.427 7.880 -1.299 240 HA TYR 495 HA TYR 495 66.124 10.060 -3.047 241 HB2 TYR 495 HB2 TYR 495 67.185 8.069 -3.794 242 HB3 TYR 495 HB3 TYR 495 65.787 7.084 -3.385 243 HD1 TYR 495 HD1 TYR 495 66.828 9.935 -5.601 244 HD2 TYR 495 HD2 TYR 495 64.180 6.597 -5.017 245 HE1 TYR 495 HE1 TYR 495 65.952 10.222 -7.905 246 HE2 TYR 495 HE2 TYR 495 63.301 6.892 -7.314 247 HH TYR 495 HH TYR 495 63.694 7.902 -9.317 248 H GLU 496 H GLU 496 63.719 7.587 -2.080 249 HA GLU 496 HA GLU 496 61.597 8.655 -3.630 250 HB2 GLU 496 HB2 GLU 496 61.546 6.949 -1.132 251 HB3 GLU 496 HB3 GLU 496 60.156 7.262 -2.174 252 HG2 GLU 496 HG2 GLU 496 62.749 6.024 -3.143 253 HG3 GLU 496 HG3 GLU 496 61.324 5.093 -2.684 254 H LEU 497 H LEU 497 62.644 9.166 -0.310 255 HA LEU 497 HA LEU 497 60.504 10.785 0.530 256 HB2 LEU 497 HB2 LEU 497 63.354 10.495 1.431 257 HB3 LEU 497 HB3 LEU 497 62.218 11.552 2.255 258 HG LEU 497 HG LEU 497 61.585 8.639 1.714 259 HD11 LEU 497 HD11 LEU 497 62.598 9.658 4.364 260 HD12 LEU 497 HD12 LEU 497 63.711 9.038 3.148 261 HD13 LEU 497 HD13 LEU 497 62.458 7.993 3.810 262 HD21 LEU 497 HD21 LEU 497 59.582 9.721 2.297 263 HD22 LEU 497 HD22 LEU 497 60.387 10.827 3.407 264 HD23 LEU 497 HD23 LEU 497 60.155 9.144 3.859 265 H GLU 498 H GLU 498 63.561 11.528 -1.068 266 HA GLU 498 HA GLU 498 63.474 14.332 -0.889 267 HB2 GLU 498 HB2 GLU 498 64.706 12.383 -2.821 268 HB3 GLU 498 HB3 GLU 498 64.845 14.120 -3.095 269 HG2 GLU 498 HG2 GLU 498 65.584 12.876 -0.441 270 HG3 GLU 498 HG3 GLU 498 66.741 12.963 -1.767 271 H LYS 499 H LYS 499 62.260 12.151 -3.445 272 HA LYS 499 HA LYS 499 61.131 14.221 -5.073 273 HB2 LYS 499 HB2 LYS 499 60.988 11.234 -4.900 274 HB3 LYS 499 HB3 LYS 499 59.733 12.040 -5.827 275 HG2 LYS 499 HG2 LYS 499 61.611 11.416 -7.273 276 HG3 LYS 499 HG3 LYS 499 61.460 13.169 -7.178 277 HD2 LYS 499 HD2 LYS 499 63.257 13.287 -5.547 278 HD3 LYS 499 HD3 LYS 499 63.354 11.528 -5.481 279 HE2 LYS 499 HE2 LYS 499 63.977 11.452 -7.846 280 HE3 LYS 499 HE3 LYS 499 63.857 13.209 -7.946 281 HZ1 LYS 499 HZ1 LYS 499 66.129 11.995 -7.447 282 HZ2 LYS 499 HZ2 LYS 499 65.554 12.092 -5.850 283 HZ3 LYS 499 HZ3 LYS 499 65.755 13.506 -6.772 284 H LEU 500 H LEU 500 59.804 12.068 -2.599 285 HA LEU 500 HA LEU 500 57.128 12.831 -2.850 286 HB2 LEU 500 HB2 LEU 500 58.768 11.644 -0.648 287 HB3 LEU 500 HB3 LEU 500 57.076 12.039 -0.377 288 HG LEU 500 HG LEU 500 57.891 10.421 -2.792 289 HD11 LEU 500 HD11 LEU 500 57.286 9.330 -0.026 290 HD12 LEU 500 HD12 LEU 500 58.862 9.292 -0.817 291 HD13 LEU 500 HD13 LEU 500 57.516 8.366 -1.485 292 HD21 LEU 500 HD21 LEU 500 55.632 10.053 -3.017 293 HD22 LEU 500 HD22 LEU 500 55.473 11.498 -2.036 294 HD23 LEU 500 HD23 LEU 500 55.373 9.917 -1.282 295 H GLN 501 H GLN 501 59.710 14.135 -0.808 296 HA GLN 501 HA GLN 501 58.157 15.962 0.656 297 HB2 GLN 501 HB2 GLN 501 61.047 15.725 -0.107 298 HB3 GLN 501 HB3 GLN 501 60.496 17.224 0.639 299 HG2 GLN 501 HG2 GLN 501 61.380 15.418 2.236 300 HG3 GLN 501 HG3 GLN 501 59.802 16.102 2.625 301 HE21 GLN 501 HE21 GLN 501 61.317 13.229 2.673 302 HE22 GLN 501 HE22 GLN 501 60.040 12.185 2.302 303 H GLU 502 H GLU 502 59.355 16.062 -2.604 304 HA GLU 502 HA GLU 502 58.825 18.891 -2.956 305 HB2 GLU 502 HB2 GLU 502 60.647 18.051 -4.199 306 HB3 GLU 502 HB3 GLU 502 59.745 16.636 -4.733 307 HG2 GLU 502 HG2 GLU 502 58.407 17.925 -6.210 308 HG3 GLU 502 HG3 GLU 502 58.961 19.449 -5.513 309 H LYS 503 H LYS 503 57.083 15.920 -3.258 310 HA LYS 503 HA LYS 503 54.960 17.224 -4.877 311 HB2 LYS 503 HB2 LYS 503 55.654 14.341 -4.375 312 HB3 LYS 503 HB3 LYS 503 54.239 14.872 -5.286 313 HG2 LYS 503 HG2 LYS 503 55.721 16.118 -6.835 314 HG3 LYS 503 HG3 LYS 503 57.126 15.534 -5.948 315 HD2 LYS 503 HD2 LYS 503 55.091 13.661 -7.177 316 HD3 LYS 503 HD3 LYS 503 56.509 14.221 -8.060 317 HE2 LYS 503 HE2 LYS 503 57.892 13.364 -6.082 318 HE3 LYS 503 HE3 LYS 503 56.431 12.542 -5.545 319 HZ1 LYS 503 HZ1 LYS 503 57.038 12.176 -8.335 320 HZ2 LYS 503 HZ2 LYS 503 56.578 11.038 -7.160 321 HZ3 LYS 503 HZ3 LYS 503 58.200 11.526 -7.285 322 H LEU 504 H LEU 504 55.577 15.688 -1.809 323 HA LEU 504 HA LEU 504 52.956 15.065 -1.110 324 HB2 LEU 504 HB2 LEU 504 55.502 15.465 0.379 325 HB3 LEU 504 HB3 LEU 504 54.012 15.400 1.311 326 HG LEU 504 HG LEU 504 54.888 13.285 -0.676 327 HD11 LEU 504 HD11 LEU 504 56.338 13.455 1.341 328 HD12 LEU 504 HD12 LEU 504 55.442 11.939 1.281 329 HD13 LEU 504 HD13 LEU 504 54.911 13.237 2.349 330 HD21 LEU 504 HD21 LEU 504 52.645 12.829 -0.559 331 HD22 LEU 504 HD22 LEU 504 52.413 13.739 0.927 332 HD23 LEU 504 HD23 LEU 504 53.050 12.099 0.988 333 HA PRO 505 HA PRO 505 51.159 19.257 -0.747 334 HB2 PRO 505 HB2 PRO 505 49.515 18.224 1.433 335 HB3 PRO 505 HB3 PRO 505 49.012 18.650 -0.210 336 HG2 PRO 505 HG2 PRO 505 49.781 15.995 0.881 337 HG3 PRO 505 HG3 PRO 505 48.691 16.386 -0.456 338 HD2 PRO 505 HD2 PRO 505 51.035 15.339 -0.951 339 HD3 PRO 505 HD3 PRO 505 50.471 16.686 -1.954 340 H GLU 506 H GLU 506 51.505 20.937 0.630 341 HA GLU 506 HA GLU 506 53.693 21.240 2.118 342 HB2 GLU 506 HB2 GLU 506 50.990 22.495 2.622 343 HB3 GLU 506 HB3 GLU 506 52.488 23.061 3.364 344 HG2 GLU 506 HG2 GLU 506 53.466 23.475 1.163 345 HG3 GLU 506 HG3 GLU 506 52.037 22.809 0.374 346 H LYS 507 H LYS 507 50.591 20.701 3.815 347 HA LYS 507 HA LYS 507 51.639 20.357 6.356 348 HB2 LYS 507 HB2 LYS 507 49.521 18.852 6.667 349 HB3 LYS 507 HB3 LYS 507 49.307 20.555 6.255 350 HG2 LYS 507 HG2 LYS 507 48.973 20.039 3.931 351 HG3 LYS 507 HG3 LYS 507 49.450 18.364 4.180 352 HD2 LYS 507 HD2 LYS 507 47.484 18.020 5.623 353 HD3 LYS 507 HD3 LYS 507 47.009 19.702 5.372 354 HE2 LYS 507 HE2 LYS 507 46.780 19.316 2.972 355 HE3 LYS 507 HE3 LYS 507 47.350 17.659 3.161 356 HZ1 LYS 507 HZ1 LYS 507 44.836 18.095 3.072 357 HZ2 LYS 507 HZ2 LYS 507 45.009 18.628 4.675 358 HZ3 LYS 507 HZ3 LYS 507 45.424 17.035 4.257 359 H TYR 508 H TYR 508 51.607 18.107 3.686 360 HA TYR 508 HA TYR 508 52.402 15.864 5.405 361 HB2 TYR 508 HB2 TYR 508 51.663 16.197 2.506 362 HB3 TYR 508 HB3 TYR 508 52.524 14.751 3.033 363 HD1 TYR 508 HD1 TYR 508 51.562 13.369 4.901 364 HD2 TYR 508 HD2 TYR 508 49.339 16.446 2.925 365 HE1 TYR 508 HE1 TYR 508 49.458 12.391 5.752 366 HE2 TYR 508 HE2 TYR 508 47.220 15.451 3.747 367 HH TYR 508 HH TYR 508 47.249 12.531 5.796 368 H LYS 509 H LYS 509 53.716 18.282 3.343 369 HA LYS 509 HA LYS 509 56.159 17.056 2.634 370 HB2 LYS 509 HB2 LYS 509 55.234 19.120 1.603 371 HB3 LYS 509 HB3 LYS 509 55.557 19.978 3.107 372 HG2 LYS 509 HG2 LYS 509 57.914 19.640 2.902 373 HG3 LYS 509 HG3 LYS 509 57.698 18.523 1.562 374 HD2 LYS 509 HD2 LYS 509 58.349 20.640 0.608 375 HD3 LYS 509 HD3 LYS 509 56.633 20.427 0.269 376 HE2 LYS 509 HE2 LYS 509 55.998 21.947 1.991 377 HE3 LYS 509 HE3 LYS 509 57.611 21.932 2.705 378 HZ1 LYS 509 HZ1 LYS 509 56.588 23.506 0.552 379 HZ2 LYS 509 HZ2 LYS 509 58.025 22.705 0.126 380 HZ3 LYS 509 HZ3 LYS 509 57.986 23.729 1.484 381 H ALA 510 H ALA 510 55.252 19.197 5.320 382 HA ALA 510 HA ALA 510 57.752 19.357 6.566 383 HB1 ALA 510 HB1 ALA 510 55.976 20.838 7.209 384 HB2 ALA 510 HB2 ALA 510 56.433 19.889 8.623 385 HB3 ALA 510 HB3 ALA 510 54.969 19.484 7.727 386 H GLU 511 H GLU 511 55.035 17.158 7.289 387 HA GLU 511 HA GLU 511 56.277 15.701 9.347 388 HB2 GLU 511 HB2 GLU 511 53.877 15.603 8.765 389 HB3 GLU 511 HB3 GLU 511 54.278 14.721 7.295 390 HG2 GLU 511 HG2 GLU 511 53.612 13.121 8.982 391 HG3 GLU 511 HG3 GLU 511 55.346 12.943 8.729 392 H TYR 512 H TYR 512 56.307 15.071 5.841 393 HA TYR 512 HA TYR 512 57.886 12.681 6.159 394 HB2 TYR 512 HB2 TYR 512 56.775 14.232 3.841 395 HB3 TYR 512 HB3 TYR 512 58.021 13.016 3.547 396 HD1 TYR 512 HD1 TYR 512 54.782 13.507 5.361 397 HD2 TYR 512 HD2 TYR 512 57.417 10.762 3.375 398 HE1 TYR 512 HE1 TYR 512 53.095 11.717 5.606 399 HE2 TYR 512 HE2 TYR 512 55.731 8.966 3.631 400 HH TYR 512 HH TYR 512 53.383 8.953 5.703 401 H LYS 513 H LYS 513 58.567 16.041 5.729 402 HA LYS 513 HA LYS 513 61.213 15.772 4.700 403 HB2 LYS 513 HB2 LYS 513 59.882 17.863 4.661 404 HB3 LYS 513 HB3 LYS 513 60.044 17.983 6.411 405 HG2 LYS 513 HG2 LYS 513 62.522 17.992 6.135 406 HG3 LYS 513 HG3 LYS 513 62.299 17.985 4.387 407 HD2 LYS 513 HD2 LYS 513 61.149 20.097 6.222 408 HD3 LYS 513 HD3 LYS 513 62.680 20.269 5.363 409 HE2 LYS 513 HE2 LYS 513 61.337 19.766 3.220 410 HE3 LYS 513 HE3 LYS 513 59.897 20.055 4.195 411 HZ1 LYS 513 HZ1 LYS 513 61.830 21.927 3.186 412 HZ2 LYS 513 HZ2 LYS 513 61.434 22.162 4.822 413 HZ3 LYS 513 HZ3 LYS 513 60.214 22.165 3.639 414 H LYS 514 H LYS 514 59.719 15.687 7.855 415 HA LYS 514 HA LYS 514 62.053 15.811 9.461 416 HB2 LYS 514 HB2 LYS 514 59.523 15.941 10.089 417 HB3 LYS 514 HB3 LYS 514 59.609 14.185 10.158 418 HG2 LYS 514 HG2 LYS 514 61.386 14.290 11.820 419 HG3 LYS 514 HG3 LYS 514 61.433 16.048 11.705 420 HD2 LYS 514 HD2 LYS 514 58.885 14.596 12.434 421 HD3 LYS 514 HD3 LYS 514 60.084 15.004 13.663 422 HE2 LYS 514 HE2 LYS 514 59.938 17.413 12.818 423 HE3 LYS 514 HE3 LYS 514 58.533 16.904 11.885 424 HZ1 LYS 514 HZ1 LYS 514 58.311 17.826 14.310 425 HZ2 LYS 514 HZ2 LYS 514 58.612 16.204 14.716 426 HZ3 LYS 514 HZ3 LYS 514 57.287 16.606 13.730 427 H LYS 515 H LYS 515 60.166 13.185 8.043 428 HA LYS 515 HA LYS 515 61.696 11.007 9.003 429 HB2 LYS 515 HB2 LYS 515 60.002 11.299 6.514 430 HB3 LYS 515 HB3 LYS 515 60.691 9.773 7.062 431 HG2 LYS 515 HG2 LYS 515 59.493 10.298 9.320 432 HG3 LYS 515 HG3 LYS 515 58.557 11.465 8.382 433 HD2 LYS 515 HD2 LYS 515 58.818 8.565 7.534 434 HD3 LYS 515 HD3 LYS 515 57.542 9.121 8.612 435 HE2 LYS 515 HE2 LYS 515 56.761 10.707 6.916 436 HE3 LYS 515 HE3 LYS 515 58.074 10.230 5.839 437 HZ1 LYS 515 HZ1 LYS 515 56.850 8.557 5.125 438 HZ2 LYS 515 HZ2 LYS 515 55.577 9.023 6.150 439 HZ3 LYS 515 HZ3 LYS 515 56.750 7.920 6.694 440 H LEU 516 H LEU 516 61.947 13.001 6.105 441 HA LEU 516 HA LEU 516 63.871 11.570 4.668 442 HB2 LEU 516 HB2 LEU 516 62.715 13.381 3.669 443 HB3 LEU 516 HB3 LEU 516 63.209 14.495 4.916 444 HG LEU 516 HG LEU 516 65.463 13.221 3.496 445 HD11 LEU 516 HD11 LEU 516 65.247 14.556 1.467 446 HD12 LEU 516 HD12 LEU 516 63.710 15.204 2.032 447 HD13 LEU 516 HD13 LEU 516 63.852 13.490 1.630 448 HD21 LEU 516 HD21 LEU 516 65.829 15.047 5.071 449 HD22 LEU 516 HD22 LEU 516 64.729 16.089 4.164 450 HD23 LEU 516 HD23 LEU 516 66.263 15.589 3.448 451 H ASP 517 H ASP 517 64.263 14.178 7.015 452 HA ASP 517 HA ASP 517 67.056 14.313 7.086 453 HB2 ASP 517 HB2 ASP 517 65.601 15.991 8.119 454 HB3 ASP 517 HB3 ASP 517 65.026 14.799 9.283 455 H GLN 518 H GLN 518 64.778 12.426 9.071 456 HA GLN 518 HA GLN 518 66.728 11.166 10.699 457 HB2 GLN 518 HB2 GLN 518 63.936 10.300 9.931 458 HB3 GLN 518 HB3 GLN 518 64.912 9.549 11.196 459 HG2 GLN 518 HG2 GLN 518 64.219 12.495 11.143 460 HG3 GLN 518 HG3 GLN 518 63.294 11.292 12.037 461 HE21 GLN 518 HE21 GLN 518 65.322 13.623 12.770 462 HE22 GLN 518 HE22 GLN 518 66.294 12.883 13.949 463 H THR 519 H THR 519 65.329 10.290 7.587 464 HA THR 519 HA THR 519 66.310 7.644 7.431 465 HB THR 519 HB THR 519 65.859 9.560 5.133 466 HG1 THR 519 HG1 THR 519 63.786 7.966 5.685 467 HG21 THR 519 HG21 THR 519 66.899 7.203 4.821 468 HG22 THR 519 HG22 THR 519 65.521 7.642 3.815 469 HG23 THR 519 HG23 THR 519 65.289 6.604 5.221 470 H ARG 520 H ARG 520 67.622 10.757 6.390 471 HA ARG 520 HA ARG 520 69.945 9.801 5.110 472 HB2 ARG 520 HB2 ARG 520 69.277 12.431 6.436 473 HB3 ARG 520 HB3 ARG 520 70.783 12.149 5.559 474 HG2 ARG 520 HG2 ARG 520 69.513 11.588 3.533 475 HG3 ARG 520 HG3 ARG 520 67.997 11.822 4.406 476 HD2 ARG 520 HD2 ARG 520 70.112 13.955 4.071 477 HD3 ARG 520 HD3 ARG 520 68.690 13.806 3.041 478 HE ARG 520 HE ARG 520 67.463 13.978 5.359 479 HH11 ARG 520 HH11 ARG 520 70.445 14.925 6.127 480 HH12 ARG 520 HH12 ARG 520 70.128 16.613 6.348 481 HH21 ARG 520 HH21 ARG 520 66.994 16.493 4.879 482 HH22 ARG 520 HH22 ARG 520 68.179 17.498 5.644 483 H VAL 521 H VAL 521 69.226 10.596 8.459 484 HA VAL 521 HA VAL 521 71.851 10.591 9.487 485 HB VAL 521 HB VAL 521 69.169 9.945 10.724 486 HG11 VAL 521 HG11 VAL 521 70.773 8.867 12.129 487 HG12 VAL 521 HG12 VAL 521 70.382 10.401 12.902 488 HG13 VAL 521 HG13 VAL 521 71.891 10.227 12.004 489 HG21 VAL 521 HG21 VAL 521 70.851 12.390 11.244 490 HG22 VAL 521 HG22 VAL 521 69.105 12.186 11.400 491 HG23 VAL 521 HG23 VAL 521 69.838 12.310 9.802 492 H GLU 522 H GLU 522 69.426 8.005 9.213 493 HA GLU 522 HA GLU 522 70.957 5.956 10.417 494 HB2 GLU 522 HB2 GLU 522 68.759 5.826 8.338 495 HB3 GLU 522 HB3 GLU 522 69.367 4.446 9.252 496 HG2 GLU 522 HG2 GLU 522 68.195 6.936 10.523 497 HG3 GLU 522 HG3 GLU 522 67.287 5.454 10.229 498 H LEU 523 H LEU 523 70.547 6.994 7.079 499 HA LEU 523 HA LEU 523 72.074 4.982 5.816 500 HB2 LEU 523 HB2 LEU 523 70.460 6.609 4.752 501 HB3 LEU 523 HB3 LEU 523 71.709 7.841 4.918 502 HG LEU 523 HG LEU 523 73.220 5.991 3.703 503 HD11 LEU 523 HD11 LEU 523 70.405 5.351 2.774 504 HD12 LEU 523 HD12 LEU 523 71.476 4.270 3.662 505 HD13 LEU 523 HD13 LEU 523 71.884 4.759 2.018 506 HD21 LEU 523 HD21 LEU 523 72.946 8.136 2.722 507 HD22 LEU 523 HD22 LEU 523 71.226 7.872 2.433 508 HD23 LEU 523 HD23 LEU 523 72.427 6.992 1.484 509 H ALA 524 H ALA 524 72.939 8.189 7.079 510 HA ALA 524 HA ALA 524 75.565 8.300 6.088 511 HB1 ALA 524 HB1 ALA 524 74.698 9.511 8.709 512 HB2 ALA 524 HB2 ALA 524 74.173 10.166 7.155 513 HB3 ALA 524 HB3 ALA 524 75.890 10.117 7.559 514 H ASP 525 H ASP 525 74.250 6.972 9.086 515 HA ASP 525 HA ASP 525 76.735 6.361 10.306 516 HB2 ASP 525 HB2 ASP 525 73.932 5.288 10.599 517 HB3 ASP 525 HB3 ASP 525 75.269 4.708 11.595 518 H GLN 526 H GLN 526 74.534 4.535 8.224 519 HA GLN 526 HA GLN 526 75.964 2.074 8.248 520 HB2 GLN 526 HB2 GLN 526 73.570 2.359 7.606 521 HB3 GLN 526 HB3 GLN 526 74.097 3.186 6.142 522 HG2 GLN 526 HG2 GLN 526 75.382 1.147 5.495 523 HG3 GLN 526 HG3 GLN 526 74.737 0.326 6.916 524 HE21 GLN 526 HE21 GLN 526 72.436 -0.214 6.923 525 HE22 GLN 526 HE22 GLN 526 71.512 -0.148 5.501 526 H VAL 527 H VAL 527 75.981 4.907 6.168 527 HA VAL 527 HA VAL 527 77.756 3.885 4.184 528 HB VAL 527 HB VAL 527 76.807 6.655 4.938 529 HG11 VAL 527 HG11 VAL 527 77.812 7.302 2.685 530 HG12 VAL 527 HG12 VAL 527 78.735 5.800 2.771 531 HG13 VAL 527 HG13 VAL 527 78.963 7.050 3.997 532 HG21 VAL 527 HG21 VAL 527 75.421 6.463 3.026 533 HG22 VAL 527 HG22 VAL 527 75.298 4.898 3.827 534 HG23 VAL 527 HG23 VAL 527 76.324 5.081 2.406 535 H LYS 528 H LYS 528 78.144 5.861 7.074 536 HA LYS 528 HA LYS 528 80.875 6.513 6.760 537 HB2 LYS 528 HB2 LYS 528 79.348 7.700 8.263 538 HB3 LYS 528 HB3 LYS 528 79.184 6.245 9.244 539 HG2 LYS 528 HG2 LYS 528 81.551 6.309 9.823 540 HG3 LYS 528 HG3 LYS 528 81.805 7.679 8.738 541 HD2 LYS 528 HD2 LYS 528 81.591 8.538 10.999 542 HD3 LYS 528 HD3 LYS 528 80.145 8.985 10.094 543 HE2 LYS 528 HE2 LYS 528 78.805 7.402 11.189 544 HE3 LYS 528 HE3 LYS 528 80.189 6.433 11.697 545 HZ1 LYS 528 HZ1 LYS 528 80.340 7.597 13.555 546 HZ2 LYS 528 HZ2 LYS 528 78.892 8.386 13.147 547 HZ3 LYS 528 HZ3 LYS 528 80.387 9.068 12.713 548 H SER 529 H SER 529 79.232 3.885 8.509 549 HA SER 529 HA SER 529 81.670 2.807 9.544 550 HB2 SER 529 HB2 SER 529 78.861 1.708 9.326 551 HB3 SER 529 HB3 SER 529 80.186 0.812 10.065 552 HG SER 529 HG SER 529 79.048 3.286 10.850 553 H ALA 530 H ALA 530 79.646 2.220 6.736 554 HA ALA 530 HA ALA 530 81.054 -0.137 5.876 555 HB1 ALA 530 HB1 ALA 530 79.661 0.024 3.901 556 HB2 ALA 530 HB2 ALA 530 79.199 1.672 4.325 557 HB3 ALA 530 HB3 ALA 530 78.674 0.323 5.330 558 H VAL 531 H VAL 531 82.603 2.333 6.358 559 HA VAL 531 HA VAL 531 83.454 3.343 3.799 560 HB VAL 531 HB VAL 531 84.327 3.639 6.661 561 HG11 VAL 531 HG11 VAL 531 86.026 5.332 5.767 562 HG12 VAL 531 HG12 VAL 531 85.853 4.518 4.211 563 HG13 VAL 531 HG13 VAL 531 86.452 3.630 5.612 564 HG21 VAL 531 HG21 VAL 531 83.667 5.789 4.652 565 HG22 VAL 531 HG22 VAL 531 83.587 5.866 6.411 566 HG23 VAL 531 HG23 VAL 531 82.397 4.920 5.517 567 H THR 532 H THR 532 84.455 1.920 2.424 568 HA THR 532 HA THR 532 87.017 0.862 3.153 569 HB THR 532 HB THR 532 85.697 -0.842 4.237 570 HG1 THR 532 HG1 THR 532 86.188 -2.374 2.096 571 HG21 THR 532 HG21 THR 532 83.618 -0.374 2.857 572 HG22 THR 532 HG22 THR 532 83.958 -2.080 3.140 573 HG23 THR 532 HG23 THR 532 84.337 -1.353 1.580 574 H GLU 533 H GLU 533 86.626 2.545 1.136 575 HA GLU 533 HA GLU 533 86.800 2.880 -1.135 576 HB2 GLU 533 HB2 GLU 533 88.200 0.235 -0.769 577 HB3 GLU 533 HB3 GLU 533 88.296 1.205 -2.239 578 HG2 GLU 533 HG2 GLU 533 89.049 2.223 0.514 579 HG3 GLU 533 HG3 GLU 533 90.211 1.580 -0.644 580 H PHE 534 H PHE 534 84.606 0.901 -0.003 581 HA PHE 534 HA PHE 534 83.009 -0.539 -0.873 582 HB2 PHE 534 HB2 PHE 534 83.122 1.826 -2.733 583 HB3 PHE 534 HB3 PHE 534 81.818 0.641 -2.760 584 HD1 PHE 534 HD1 PHE 534 83.424 3.339 -0.844 585 HD2 PHE 534 HD2 PHE 534 80.246 0.451 -0.900 586 HE1 PHE 534 HE1 PHE 534 82.333 4.505 1.052 587 HE2 PHE 534 HE2 PHE 534 79.153 1.616 0.997 588 HZ PHE 534 HZ PHE 534 80.197 3.644 1.973 589 H GLU 535 H GLU 535 84.118 -2.427 -1.519 590 HA GLU 535 HA GLU 535 85.684 -2.916 -3.692 591 HB2 GLU 535 HB2 GLU 535 85.029 -4.525 -1.902 592 HB3 GLU 535 HB3 GLU 535 83.457 -4.692 -2.681 593 HG2 GLU 535 HG2 GLU 535 84.548 -5.470 -4.732 594 HG3 GLU 535 HG3 GLU 535 86.122 -5.293 -3.959 595 H ASN 536 H ASN 536 85.381 -3.276 -5.864 596 HA ASN 536 HA ASN 536 84.393 -3.121 -7.932 597 HB2 ASN 536 HB2 ASN 536 83.187 -5.109 -6.883 598 HB3 ASN 536 HB3 ASN 536 81.855 -4.004 -6.560 599 HD21 ASN 536 HD21 ASN 536 80.520 -3.375 -8.341 600 HD22 ASN 536 HD22 ASN 536 80.744 -3.972 -9.914 601 H VAL 537 H VAL 537 84.600 -0.645 -6.882 602 HA VAL 537 HA VAL 537 82.260 0.807 -6.430 603 HB VAL 537 HB VAL 537 83.570 2.761 -6.980 604 HG11 VAL 537 HG11 VAL 537 85.230 0.609 -5.650 605 HG12 VAL 537 HG12 VAL 537 84.095 1.698 -4.852 606 HG13 VAL 537 HG13 VAL 537 85.574 2.338 -5.562 607 HG21 VAL 537 HG21 VAL 537 85.911 2.410 -7.896 608 HG22 VAL 537 HG22 VAL 537 84.602 2.135 -9.045 609 HG23 VAL 537 HG23 VAL 537 85.416 0.764 -8.289 610 H THR 538 H THR 538 80.719 1.665 -7.731 611 HA THR 538 HA THR 538 81.078 1.553 -10.666 612 HB THR 538 HB THR 538 78.652 0.727 -10.743 613 HG1 THR 538 HG1 THR 538 79.280 -0.201 -8.151 614 HG21 THR 538 HG21 THR 538 80.889 -1.024 -9.696 615 HG22 THR 538 HG22 THR 538 80.465 -0.732 -11.383 616 HG23 THR 538 HG23 THR 538 79.374 -1.651 -10.345 617 HA PRO 539 HA PRO 539 79.074 5.470 -9.234 618 HB2 PRO 539 HB2 PRO 539 81.134 6.967 -10.657 619 HB3 PRO 539 HB3 PRO 539 80.805 6.928 -8.915 620 HG2 PRO 539 HG2 PRO 539 83.053 5.858 -10.071 621 HG3 PRO 539 HG3 PRO 539 82.373 5.308 -8.530 622 HD2 PRO 539 HD2 PRO 539 82.082 4.075 -11.260 623 HD3 PRO 539 HD3 PRO 539 82.329 3.281 -9.685 624 H THR 540 H THR 540 77.803 6.911 -10.446 625 HA THR 540 HA THR 540 77.223 6.043 -13.159 626 HB THR 540 HB THR 540 75.966 8.235 -11.486 627 HG1 THR 540 HG1 THR 540 74.850 6.696 -10.607 628 HG21 THR 540 HG21 THR 540 75.530 8.519 -13.871 629 HG22 THR 540 HG22 THR 540 74.072 7.925 -13.075 630 HG23 THR 540 HG23 THR 540 75.075 6.820 -14.015 631 H ASN 541 H ASN 541 77.879 7.045 -14.988 632 HA ASN 541 HA ASN 541 79.844 9.077 -14.882 633 HB2 ASN 541 HB2 ASN 541 78.195 8.066 -17.204 634 HB3 ASN 541 HB3 ASN 541 79.594 9.133 -17.349 635 HD21 ASN 541 HD21 ASN 541 81.138 7.848 -15.184 636 HD22 ASN 541 HD22 ASN 541 81.626 6.335 -15.779 637 H ASP 542 H ASP 542 79.672 11.121 -16.166 638 HA ASP 542 HA ASP 542 77.470 12.689 -15.127 639 HB2 ASP 542 HB2 ASP 542 79.892 13.404 -15.137 640 HB3 ASP 542 HB3 ASP 542 79.766 13.578 -16.887 641 H GLN 543 H GLN 543 75.591 12.680 -16.210 642 HA GLN 543 HA GLN 543 75.092 11.906 -18.813 643 HB2 GLN 543 HB2 GLN 543 73.657 13.958 -17.113 644 HB3 GLN 543 HB3 GLN 543 73.018 13.307 -18.623 645 HG2 GLN 543 HG2 GLN 543 73.041 11.048 -17.715 646 HG3 GLN 543 HG3 GLN 543 73.818 11.611 -16.239 647 HE21 GLN 543 HE21 GLN 543 70.817 10.808 -17.509 648 HE22 GLN 543 HE22 GLN 543 69.838 11.682 -16.433
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