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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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616700 |
5b88 ![]() ![]() |
cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 480 H MET 480 -3.130 -0.692 -2.703 2 HA MET 480 HA MET 480 -1.539 0.046 -4.248 3 HB2 MET 480 HB2 MET 480 -2.047 1.771 -2.406 4 HB3 MET 480 HB3 MET 480 -0.453 1.377 -1.778 5 HG2 MET 480 HG2 MET 480 0.599 2.534 -3.372 6 HG3 MET 480 HG3 MET 480 -0.491 1.972 -4.637 7 HE1 MET 480 HE1 MET 480 -0.073 4.015 -1.580 8 HE2 MET 480 HE2 MET 480 -0.730 5.604 -1.973 9 HE3 MET 480 HE3 MET 480 -1.791 4.341 -1.348 10 H ALA 481 H ALA 481 -0.723 -2.499 -3.262 11 HA ALA 481 HA ALA 481 2.056 -2.347 -2.523 12 HB1 ALA 481 HB1 ALA 481 1.904 -4.878 -2.979 13 HB2 ALA 481 HB2 ALA 481 0.992 -4.209 -1.626 14 HB3 ALA 481 HB3 ALA 481 0.171 -4.592 -3.139 15 H ASP 482 H ASP 482 3.422 -4.116 -3.925 16 HA ASP 482 HA ASP 482 3.993 -2.777 -6.356 17 HB2 ASP 482 HB2 ASP 482 5.559 -4.182 -4.839 18 HB3 ASP 482 HB3 ASP 482 4.940 -5.562 -5.742 19 H VAL 483 H VAL 483 2.283 -5.762 -5.578 20 HA VAL 483 HA VAL 483 1.444 -5.934 -8.400 21 HB VAL 483 HB VAL 483 1.650 -8.245 -6.467 22 HG11 VAL 483 HG11 VAL 483 1.498 -9.540 -8.650 23 HG12 VAL 483 HG12 VAL 483 0.022 -8.754 -8.089 24 HG13 VAL 483 HG13 VAL 483 0.970 -8.027 -9.386 25 HG21 VAL 483 HG21 VAL 483 3.494 -7.613 -8.764 26 HG22 VAL 483 HG22 VAL 483 3.857 -7.233 -7.081 27 HG23 VAL 483 HG23 VAL 483 3.654 -8.912 -7.582 28 H GLY 484 H GLY 484 0.450 -6.772 -5.078 29 HA2 GLY 484 HA2 GLY 484 -1.708 -5.754 -4.365 30 HA3 GLY 484 HA3 GLY 484 -2.341 -6.278 -5.918 31 H ASP 485 H ASP 485 -0.148 -8.418 -4.388 32 HA ASP 485 HA ASP 485 -1.825 -10.602 -4.362 33 HB2 ASP 485 HB2 ASP 485 0.777 -10.272 -3.816 34 HB3 ASP 485 HB3 ASP 485 0.176 -10.440 -2.169 35 H MET 486 H MET 486 -3.806 -10.543 -3.475 36 HA MET 486 HA MET 486 -3.977 -9.919 -0.603 37 HB2 MET 486 HB2 MET 486 -5.049 -8.285 -2.416 38 HB3 MET 486 HB3 MET 486 -6.359 -9.455 -2.327 39 HG2 MET 486 HG2 MET 486 -7.023 -8.744 -0.319 40 HG3 MET 486 HG3 MET 486 -5.372 -8.587 0.279 41 HE1 MET 486 HE1 MET 486 -5.152 -6.839 1.433 42 HE2 MET 486 HE2 MET 486 -5.037 -5.173 0.866 43 HE3 MET 486 HE3 MET 486 -6.566 -5.787 1.498 44 H GLN 487 H GLN 487 -4.560 -11.641 0.529 45 HA GLN 487 HA GLN 487 -6.673 -13.383 -0.422 46 HB2 GLN 487 HB2 GLN 487 -3.966 -14.533 0.273 47 HB3 GLN 487 HB3 GLN 487 -5.395 -15.432 -0.219 48 HG2 GLN 487 HG2 GLN 487 -5.305 -14.383 -2.419 49 HG3 GLN 487 HG3 GLN 487 -3.876 -13.474 -1.928 50 HE21 GLN 487 HE21 GLN 487 -4.291 -15.462 -4.071 51 HE22 GLN 487 HE22 GLN 487 -3.095 -16.679 -3.806 52 H LEU 488 H LEU 488 -6.992 -15.214 1.295 53 HA LEU 488 HA LEU 488 -6.657 -14.012 3.965 54 HB2 LEU 488 HB2 LEU 488 -8.987 -13.972 3.050 55 HB3 LEU 488 HB3 LEU 488 -8.956 -15.734 3.056 56 HG LEU 488 HG LEU 488 -8.597 -15.627 5.536 57 HD11 LEU 488 HD11 LEU 488 -7.974 -13.653 6.357 58 HD12 LEU 488 HD12 LEU 488 -9.664 -13.175 6.194 59 HD13 LEU 488 HD13 LEU 488 -8.512 -12.789 4.916 60 HD21 LEU 488 HD21 LEU 488 -10.898 -15.336 6.030 61 HD22 LEU 488 HD22 LEU 488 -10.812 -15.982 4.392 62 HD23 LEU 488 HD23 LEU 488 -11.130 -14.266 4.648 63 H TYR 489 H TYR 489 -5.154 -15.152 5.000 64 HA TYR 489 HA TYR 489 -5.140 -18.078 4.691 65 HB2 TYR 489 HB2 TYR 489 -2.863 -16.754 6.039 66 HB3 TYR 489 HB3 TYR 489 -2.872 -18.070 4.870 67 HD1 TYR 489 HD1 TYR 489 -2.946 -14.411 5.275 68 HD2 TYR 489 HD2 TYR 489 -2.672 -17.641 2.518 69 HE1 TYR 489 HE1 TYR 489 -2.257 -12.841 3.512 70 HE2 TYR 489 HE2 TYR 489 -1.981 -16.080 0.748 71 HH TYR 489 HH TYR 489 -0.765 -13.633 0.825 72 H ARG 490 H ARG 490 -5.696 -19.320 6.357 73 HA ARG 490 HA ARG 490 -6.036 -18.041 8.984 74 HB2 ARG 490 HB2 ARG 490 -7.645 -19.831 9.470 75 HB3 ARG 490 HB3 ARG 490 -8.098 -18.929 8.030 76 HG2 ARG 490 HG2 ARG 490 -8.346 -20.911 7.054 77 HG3 ARG 490 HG3 ARG 490 -6.583 -20.984 7.015 78 HD2 ARG 490 HD2 ARG 490 -6.980 -21.873 9.499 79 HD3 ARG 490 HD3 ARG 490 -8.511 -22.377 8.782 80 HE ARG 490 HE ARG 490 -6.206 -23.122 7.234 81 HH11 ARG 490 HH11 ARG 490 -8.316 -24.030 9.850 82 HH12 ARG 490 HH12 ARG 490 -7.973 -25.722 9.712 83 HH21 ARG 490 HH21 ARG 490 -5.747 -25.348 7.041 84 HH22 ARG 490 HH22 ARG 490 -6.512 -26.471 8.114 85 H ILE 491 H ILE 491 -4.903 -18.731 10.694 86 HA ILE 491 HA ILE 491 -3.042 -20.956 10.282 87 HB ILE 491 HB ILE 491 -1.781 -20.096 12.151 88 HG12 ILE 491 HG12 ILE 491 -3.929 -17.981 12.420 89 HG13 ILE 491 HG13 ILE 491 -3.735 -19.358 13.500 90 HG21 ILE 491 HG21 ILE 491 -2.342 -18.601 9.775 91 HG22 ILE 491 HG22 ILE 491 -1.960 -17.497 11.095 92 HG23 ILE 491 HG23 ILE 491 -0.821 -18.769 10.653 93 HD11 ILE 491 HD11 ILE 491 -1.651 -17.236 13.055 94 HD12 ILE 491 HD12 ILE 491 -2.801 -17.257 14.392 95 HD13 ILE 491 HD13 ILE 491 -1.604 -18.543 14.238 96 H GLU 492 H GLU 492 -2.566 -22.317 12.233 97 HA GLU 492 HA GLU 492 -5.097 -23.206 13.386 98 HB2 GLU 492 HB2 GLU 492 -3.466 -24.778 12.226 99 HB3 GLU 492 HB3 GLU 492 -2.418 -24.569 13.622 100 HG2 GLU 492 HG2 GLU 492 -4.600 -25.255 14.930 101 HG3 GLU 492 HG3 GLU 492 -5.005 -26.003 13.387 102 H VAL 493 H VAL 493 -4.417 -20.871 14.514 103 HA VAL 493 HA VAL 493 -3.757 -21.670 17.246 104 HB VAL 493 HB VAL 493 -2.516 -19.177 16.113 105 HG11 VAL 493 HG11 VAL 493 -1.628 -20.857 18.443 106 HG12 VAL 493 HG12 VAL 493 -1.186 -19.192 18.059 107 HG13 VAL 493 HG13 VAL 493 -2.821 -19.569 18.603 108 HG21 VAL 493 HG21 VAL 493 -1.343 -21.952 16.181 109 HG22 VAL 493 HG22 VAL 493 -1.599 -20.930 14.767 110 HG23 VAL 493 HG23 VAL 493 -0.389 -20.484 15.970 111 H GLY 494 H GLY 494 -4.950 -20.643 18.764 112 HA2 GLY 494 HA2 GLY 494 -6.352 -18.174 18.046 113 HA3 GLY 494 HA3 GLY 494 -7.327 -19.563 18.503 114 H ARG 495 H ARG 495 -8.019 -17.876 20.132 115 HA ARG 495 HA ARG 495 -6.398 -16.941 22.178 116 HB2 ARG 495 HB2 ARG 495 -8.522 -16.899 23.544 117 HB3 ARG 495 HB3 ARG 495 -8.604 -16.077 21.992 118 HG2 ARG 495 HG2 ARG 495 -9.757 -17.984 21.021 119 HG3 ARG 495 HG3 ARG 495 -9.641 -18.847 22.556 120 HD2 ARG 495 HD2 ARG 495 -11.019 -16.188 22.240 121 HD3 ARG 495 HD3 ARG 495 -11.852 -17.735 22.100 122 HE ARG 495 HE ARG 495 -10.401 -17.571 24.535 123 HH11 ARG 495 HH11 ARG 495 -13.302 -16.462 22.962 124 HH12 ARG 495 HH12 ARG 495 -14.183 -16.261 24.440 125 HH21 ARG 495 HH21 ARG 495 -11.550 -17.312 26.488 126 HH22 ARG 495 HH22 ARG 495 -13.185 -16.744 26.445 127 H ASP 496 H ASP 496 -8.072 -20.037 21.875 128 HA ASP 496 HA ASP 496 -7.466 -20.986 24.471 129 HB2 ASP 496 HB2 ASP 496 -9.127 -21.859 22.582 130 HB3 ASP 496 HB3 ASP 496 -7.761 -22.908 22.212 131 H ASP 497 H ASP 497 -5.581 -20.636 21.641 132 HA ASP 497 HA ASP 497 -3.608 -22.613 22.476 133 HB2 ASP 497 HB2 ASP 497 -4.353 -22.136 20.033 134 HB3 ASP 497 HB3 ASP 497 -3.277 -20.746 20.146 135 H GLY 498 H GLY 498 -3.956 -19.114 22.123 136 HA2 GLY 498 HA2 GLY 498 -2.759 -17.960 24.061 137 HA3 GLY 498 HA3 GLY 498 -1.335 -18.777 23.433 138 H VAL 499 H VAL 499 -3.860 -17.408 21.418 139 HA VAL 499 HA VAL 499 -2.075 -15.186 20.702 140 HB VAL 499 HB VAL 499 -1.971 -17.146 19.054 141 HG11 VAL 499 HG11 VAL 499 -4.356 -16.146 17.683 142 HG12 VAL 499 HG12 VAL 499 -3.776 -17.800 17.897 143 HG13 VAL 499 HG13 VAL 499 -4.695 -17.013 19.181 144 HG21 VAL 499 HG21 VAL 499 -1.481 -14.578 18.721 145 HG22 VAL 499 HG22 VAL 499 -1.454 -15.697 17.358 146 HG23 VAL 499 HG23 VAL 499 -2.870 -14.685 17.641 147 H GLU 500 H GLU 500 -3.105 -13.325 19.895 148 HA GLU 500 HA GLU 500 -6.035 -13.288 20.187 149 HB2 GLU 500 HB2 GLU 500 -4.305 -10.947 20.941 150 HB3 GLU 500 HB3 GLU 500 -5.983 -11.251 21.366 151 HG2 GLU 500 HG2 GLU 500 -4.911 -13.355 22.562 152 HG3 GLU 500 HG3 GLU 500 -3.496 -12.304 22.579 153 H VAL 501 H VAL 501 -6.647 -10.804 19.406 154 HA VAL 501 HA VAL 501 -6.190 -10.904 16.577 155 HB VAL 501 HB VAL 501 -7.625 -8.829 18.240 156 HG11 VAL 501 HG11 VAL 501 -8.648 -8.822 15.656 157 HG12 VAL 501 HG12 VAL 501 -7.615 -7.593 16.388 158 HG13 VAL 501 HG13 VAL 501 -6.900 -8.899 15.442 159 HG21 VAL 501 HG21 VAL 501 -8.955 -10.856 16.492 160 HG22 VAL 501 HG22 VAL 501 -8.443 -11.298 18.121 161 HG23 VAL 501 HG23 VAL 501 -9.596 -9.984 17.885 162 H ARG 502 H ARG 502 -4.959 -9.036 19.259 163 HA ARG 502 HA ARG 502 -3.609 -7.147 17.510 164 HB2 ARG 502 HB2 ARG 502 -2.780 -6.164 19.644 165 HB3 ARG 502 HB3 ARG 502 -4.534 -6.244 19.539 166 HG2 ARG 502 HG2 ARG 502 -4.671 -7.972 21.094 167 HG3 ARG 502 HG3 ARG 502 -2.967 -8.394 20.912 168 HD2 ARG 502 HD2 ARG 502 -3.120 -7.283 22.981 169 HD3 ARG 502 HD3 ARG 502 -2.448 -6.099 21.860 170 HE ARG 502 HE ARG 502 -5.159 -5.689 21.802 171 HH11 ARG 502 HH11 ARG 502 -2.680 -5.677 24.246 172 HH12 ARG 502 HH12 ARG 502 -3.479 -4.500 25.236 173 HH21 ARG 502 HH21 ARG 502 -6.221 -4.139 23.096 174 HH22 ARG 502 HH22 ARG 502 -5.494 -3.627 24.581 175 H HIS 503 H HIS 503 -3.031 -10.229 18.482 176 HA HIS 503 HA HIS 503 -0.194 -9.985 18.996 177 HB2 HIS 503 HB2 HIS 503 -1.917 -11.777 19.894 178 HB3 HIS 503 HB3 HIS 503 -1.501 -12.607 18.398 179 HD1 HIS 503 HD1 HIS 503 1.575 -11.432 18.707 180 HD2 HIS 503 HD2 HIS 503 -0.582 -13.842 21.315 181 HE1 HIS 503 HE1 HIS 503 3.297 -12.633 20.092 182 H ILE 504 H ILE 504 -2.160 -11.623 16.508 183 HA ILE 504 HA ILE 504 0.056 -12.097 14.792 184 HB ILE 504 HB ILE 504 -1.471 -12.962 13.228 185 HG12 ILE 504 HG12 ILE 504 -2.926 -10.905 13.218 186 HG13 ILE 504 HG13 ILE 504 -3.802 -12.427 13.104 187 HG21 ILE 504 HG21 ILE 504 -1.351 -14.291 15.253 188 HG22 ILE 504 HG22 ILE 504 -2.665 -13.357 15.968 189 HG23 ILE 504 HG23 ILE 504 -2.972 -14.379 14.564 190 HD11 ILE 504 HD11 ILE 504 -4.265 -12.283 15.528 191 HD12 ILE 504 HD12 ILE 504 -3.496 -10.696 15.543 192 HD13 ILE 504 HD13 ILE 504 -4.959 -10.958 14.595 193 H VAL 505 H VAL 505 -2.104 -9.431 15.251 194 HA VAL 505 HA VAL 505 -1.570 -8.197 12.705 195 HB VAL 505 HB VAL 505 -2.921 -7.180 15.203 196 HG11 VAL 505 HG11 VAL 505 -3.630 -5.467 13.174 197 HG12 VAL 505 HG12 VAL 505 -2.468 -5.122 14.456 198 HG13 VAL 505 HG13 VAL 505 -1.907 -5.719 12.894 199 HG21 VAL 505 HG21 VAL 505 -4.271 -7.467 12.573 200 HG22 VAL 505 HG22 VAL 505 -3.905 -8.935 13.479 201 HG23 VAL 505 HG23 VAL 505 -4.911 -7.680 14.202 202 H GLY 506 H GLY 506 -0.785 -7.313 16.077 203 HA2 GLY 506 HA2 GLY 506 0.964 -5.214 15.438 204 HA3 GLY 506 HA3 GLY 506 0.956 -6.102 16.954 205 H ALA 507 H ALA 507 1.425 -8.623 15.288 206 HA ALA 507 HA ALA 507 4.274 -8.602 15.541 207 HB1 ALA 507 HB1 ALA 507 2.900 -10.592 16.024 208 HB2 ALA 507 HB2 ALA 507 2.506 -10.711 14.309 209 HB3 ALA 507 HB3 ALA 507 4.173 -10.914 14.846 210 H ILE 508 H ILE 508 2.121 -9.136 12.743 211 HA ILE 508 HA ILE 508 4.247 -8.944 10.853 212 HB ILE 508 HB ILE 508 2.496 -8.941 9.144 213 HG12 ILE 508 HG12 ILE 508 0.098 -9.337 10.276 214 HG13 ILE 508 HG13 ILE 508 0.799 -8.278 11.495 215 HG21 ILE 508 HG21 ILE 508 3.042 -10.960 10.988 216 HG22 ILE 508 HG22 ILE 508 1.290 -10.978 10.788 217 HG23 ILE 508 HG23 ILE 508 2.340 -11.146 9.381 218 HD11 ILE 508 HD11 ILE 508 1.265 -7.236 8.857 219 HD12 ILE 508 HD12 ILE 508 -0.452 -7.534 9.127 220 HD13 ILE 508 HD13 ILE 508 0.448 -6.497 10.233 221 H ALA 509 H ALA 509 2.083 -6.669 12.337 222 HA ALA 509 HA ALA 509 2.479 -4.577 10.416 223 HB1 ALA 509 HB1 ALA 509 0.456 -4.691 11.791 224 HB2 ALA 509 HB2 ALA 509 1.427 -4.420 13.239 225 HB3 ALA 509 HB3 ALA 509 1.305 -3.161 12.011 226 H ASN 510 H ASN 510 4.163 -5.723 13.209 227 HA ASN 510 HA ASN 510 5.727 -3.272 13.452 228 HB2 ASN 510 HB2 ASN 510 4.921 -4.489 15.486 229 HB3 ASN 510 HB3 ASN 510 5.968 -5.834 15.042 230 HD21 ASN 510 HD21 ASN 510 7.223 -5.692 16.866 231 HD22 ASN 510 HD22 ASN 510 8.323 -4.390 17.150 232 H GLU 511 H GLU 511 5.965 -6.514 12.213 233 HA GLU 511 HA GLU 511 8.789 -6.645 12.009 234 HB2 GLU 511 HB2 GLU 511 6.518 -8.136 10.742 235 HB3 GLU 511 HB3 GLU 511 8.159 -8.380 10.162 236 HG2 GLU 511 HG2 GLU 511 7.233 -8.784 12.997 237 HG3 GLU 511 HG3 GLU 511 7.491 -10.060 11.809 238 H GLY 512 H GLY 512 6.247 -5.716 9.709 239 HA2 GLY 512 HA2 GLY 512 8.363 -4.591 7.980 240 HA3 GLY 512 HA3 GLY 512 6.845 -5.233 7.371 241 H ASP 513 H ASP 513 6.317 -3.311 6.317 242 HA ASP 513 HA ASP 513 6.038 -0.886 7.904 243 HB2 ASP 513 HB2 ASP 513 6.852 -1.148 5.392 244 HB3 ASP 513 HB3 ASP 513 5.123 -1.044 5.068 245 H ILE 514 H ILE 514 4.171 -3.560 7.068 246 HA ILE 514 HA ILE 514 1.635 -2.590 6.600 247 HB ILE 514 HB ILE 514 2.365 -4.976 8.303 248 HG12 ILE 514 HG12 ILE 514 1.519 -5.062 5.423 249 HG13 ILE 514 HG13 ILE 514 3.201 -4.757 5.844 250 HG21 ILE 514 HG21 ILE 514 0.121 -4.637 8.756 251 HG22 ILE 514 HG22 ILE 514 -0.218 -4.019 7.140 252 HG23 ILE 514 HG23 ILE 514 0.067 -5.742 7.384 253 HD11 ILE 514 HD11 ILE 514 2.784 -7.110 5.356 254 HD12 ILE 514 HD12 ILE 514 3.306 -6.872 7.024 255 HD13 ILE 514 HD13 ILE 514 1.605 -7.171 6.667 256 H SER 515 H SER 515 -0.074 -1.903 7.847 257 HA SER 515 HA SER 515 0.579 -1.208 10.636 258 HB2 SER 515 HB2 SER 515 0.109 0.597 8.707 259 HB3 SER 515 HB3 SER 515 -1.555 0.292 9.206 260 HG SER 515 HG SER 515 -1.166 1.522 10.849 261 H SER 516 H SER 516 -1.473 -0.843 11.974 262 HA SER 516 HA SER 516 -2.908 -3.279 12.066 263 HB2 SER 516 HB2 SER 516 -2.469 -1.973 14.086 264 HB3 SER 516 HB3 SER 516 -3.459 -0.651 13.468 265 HG SER 516 HG SER 516 -4.623 -1.977 14.920 266 H ARG 517 H ARG 517 -3.447 -0.309 10.418 267 HA ARG 517 HA ARG 517 -6.267 -0.923 9.946 268 HB2 ARG 517 HB2 ARG 517 -6.261 1.299 8.770 269 HB3 ARG 517 HB3 ARG 517 -5.874 1.368 10.484 270 HG2 ARG 517 HG2 ARG 517 -3.545 1.649 10.014 271 HG3 ARG 517 HG3 ARG 517 -3.813 1.368 8.293 272 HD2 ARG 517 HD2 ARG 517 -4.687 3.445 7.949 273 HD3 ARG 517 HD3 ARG 517 -5.345 3.556 9.581 274 HE ARG 517 HE ARG 517 -2.691 3.665 10.012 275 HH11 ARG 517 HH11 ARG 517 -4.799 5.395 7.847 276 HH12 ARG 517 HH12 ARG 517 -3.836 6.835 7.852 277 HH21 ARG 517 HH21 ARG 517 -1.415 5.555 10.026 278 HH22 ARG 517 HH22 ARG 517 -1.911 6.925 9.091 279 H TYR 518 H TYR 518 -3.184 -0.700 8.277 280 HA TYR 518 HA TYR 518 -4.067 -0.860 5.637 281 HB2 TYR 518 HB2 TYR 518 -1.604 -0.855 6.937 282 HB3 TYR 518 HB3 TYR 518 -1.638 -2.396 6.086 283 HD1 TYR 518 HD1 TYR 518 -2.959 -1.887 3.609 284 HD2 TYR 518 HD2 TYR 518 -0.318 0.658 5.765 285 HE1 TYR 518 HE1 TYR 518 -2.356 -0.748 1.514 286 HE2 TYR 518 HE2 TYR 518 0.292 1.805 3.676 287 HH TYR 518 HH TYR 518 -1.432 1.306 0.736 288 H ILE 519 H ILE 519 -3.614 -3.364 8.057 289 HA ILE 519 HA ILE 519 -3.781 -5.614 6.396 290 HB ILE 519 HB ILE 519 -4.706 -5.328 9.257 291 HG12 ILE 519 HG12 ILE 519 -2.176 -6.702 8.548 292 HG13 ILE 519 HG13 ILE 519 -2.189 -4.951 8.367 293 HG21 ILE 519 HG21 ILE 519 -4.424 -7.772 9.363 294 HG22 ILE 519 HG22 ILE 519 -5.683 -7.288 8.227 295 HG23 ILE 519 HG23 ILE 519 -4.102 -7.793 7.629 296 HD11 ILE 519 HD11 ILE 519 -1.347 -5.520 10.534 297 HD12 ILE 519 HD12 ILE 519 -2.930 -4.764 10.718 298 HD13 ILE 519 HD13 ILE 519 -2.765 -6.513 10.871 299 H GLY 520 H GLY 520 -5.479 -6.895 5.717 300 HA2 GLY 520 HA2 GLY 520 -7.956 -5.543 5.242 301 HA3 GLY 520 HA3 GLY 520 -7.569 -7.197 4.790 302 H ASN 521 H ASN 521 -8.907 -8.616 5.662 303 HA ASN 521 HA ASN 521 -10.284 -7.957 8.149 304 HB2 ASN 521 HB2 ASN 521 -10.714 -10.266 6.239 305 HB3 ASN 521 HB3 ASN 521 -11.736 -9.863 7.616 306 HD21 ASN 521 HD21 ASN 521 -12.400 -10.041 4.788 307 HD22 ASN 521 HD22 ASN 521 -13.039 -8.497 4.347 308 H ILE 522 H ILE 522 -9.784 -8.836 10.051 309 HA ILE 522 HA ILE 522 -8.002 -11.184 10.071 310 HB ILE 522 HB ILE 522 -8.087 -9.040 12.191 311 HG12 ILE 522 HG12 ILE 522 -5.620 -8.927 10.890 312 HG13 ILE 522 HG13 ILE 522 -6.796 -9.058 9.588 313 HG21 ILE 522 HG21 ILE 522 -6.454 -10.179 13.278 314 HG22 ILE 522 HG22 ILE 522 -7.222 -11.546 12.472 315 HG23 ILE 522 HG23 ILE 522 -5.762 -10.827 11.792 316 HD11 ILE 522 HD11 ILE 522 -7.873 -7.171 11.310 317 HD12 ILE 522 HD12 ILE 522 -6.147 -6.810 11.264 318 HD13 ILE 522 HD13 ILE 522 -7.075 -6.872 9.766 319 H LYS 523 H LYS 523 -8.635 -12.909 11.214 320 HA LYS 523 HA LYS 523 -10.998 -12.612 12.951 321 HB2 LYS 523 HB2 LYS 523 -11.228 -13.946 10.772 322 HB3 LYS 523 HB3 LYS 523 -10.215 -15.158 11.545 323 HG2 LYS 523 HG2 LYS 523 -11.945 -15.080 13.448 324 HG3 LYS 523 HG3 LYS 523 -12.983 -14.281 12.265 325 HD2 LYS 523 HD2 LYS 523 -11.636 -16.940 11.807 326 HD3 LYS 523 HD3 LYS 523 -13.287 -16.759 12.404 327 HE2 LYS 523 HE2 LYS 523 -12.349 -15.512 9.834 328 HE3 LYS 523 HE3 LYS 523 -13.002 -17.148 9.908 329 HZ1 LYS 523 HZ1 LYS 523 -14.777 -15.716 9.354 330 HZ2 LYS 523 HZ2 LYS 523 -14.389 -14.617 10.580 331 HZ3 LYS 523 HZ3 LYS 523 -15.011 -16.139 10.976 332 H LEU 524 H LEU 524 -11.097 -13.894 14.845 333 HA LEU 524 HA LEU 524 -8.635 -15.252 15.652 334 HB2 LEU 524 HB2 LEU 524 -8.654 -12.831 16.413 335 HB3 LEU 524 HB3 LEU 524 -10.000 -13.275 17.460 336 HG LEU 524 HG LEU 524 -7.756 -13.176 18.574 337 HD11 LEU 524 HD11 LEU 524 -9.832 -14.647 19.194 338 HD12 LEU 524 HD12 LEU 524 -8.298 -14.852 20.039 339 HD13 LEU 524 HD13 LEU 524 -8.757 -15.975 18.759 340 HD21 LEU 524 HD21 LEU 524 -7.205 -15.773 17.167 341 HD22 LEU 524 HD22 LEU 524 -6.118 -14.813 18.171 342 HD23 LEU 524 HD23 LEU 524 -6.589 -14.230 16.574 343 H PHE 525 H PHE 525 -9.690 -17.221 15.592 344 HA PHE 525 HA PHE 525 -12.121 -17.575 17.155 345 HB2 PHE 525 HB2 PHE 525 -11.132 -18.768 14.839 346 HB3 PHE 525 HB3 PHE 525 -10.962 -20.012 16.073 347 HD1 PHE 525 HD1 PHE 525 -12.690 -21.506 16.116 348 HD2 PHE 525 HD2 PHE 525 -13.519 -17.433 15.197 349 HE1 PHE 525 HE1 PHE 525 -15.081 -22.045 15.901 350 HE2 PHE 525 HE2 PHE 525 -15.912 -17.965 14.982 351 HZ PHE 525 HZ PHE 525 -16.695 -20.274 15.332 352 H ALA 526 H ALA 526 -11.845 -20.157 18.055 353 HA ALA 526 HA ALA 526 -10.450 -19.781 20.487 354 HB1 ALA 526 HB1 ALA 526 -11.282 -21.848 21.137 355 HB2 ALA 526 HB2 ALA 526 -12.482 -21.288 19.971 356 HB3 ALA 526 HB3 ALA 526 -11.274 -22.480 19.490 357 H SER 527 H SER 527 -9.747 -21.721 17.600 358 HA SER 527 HA SER 527 -6.933 -21.795 18.426 359 HB2 SER 527 HB2 SER 527 -8.534 -24.177 17.461 360 HB3 SER 527 HB3 SER 527 -6.782 -24.162 17.664 361 HG SER 527 HG SER 527 -8.059 -25.006 19.475 362 H HIS 528 H HIS 528 -8.336 -20.153 16.505 363 HA HIS 528 HA HIS 528 -6.643 -20.669 14.218 364 HB2 HIS 528 HB2 HIS 528 -9.653 -20.756 14.023 365 HB3 HIS 528 HB3 HIS 528 -8.622 -20.434 12.632 366 HD1 HIS 528 HD1 HIS 528 -7.069 -22.411 11.843 367 HD2 HIS 528 HD2 HIS 528 -9.840 -23.404 14.774 368 HE1 HIS 528 HE1 HIS 528 -7.152 -24.924 11.865 369 H SER 529 H SER 529 -6.786 -18.878 12.606 370 HA SER 529 HA SER 529 -8.078 -16.438 13.294 371 HB2 SER 529 HB2 SER 529 -5.589 -15.369 13.478 372 HB3 SER 529 HB3 SER 529 -6.575 -15.802 14.875 373 HG SER 529 HG SER 529 -5.269 -17.403 15.301 374 H THR 530 H THR 530 -8.269 -15.214 11.519 375 HA THR 530 HA THR 530 -6.626 -15.937 9.188 376 HB THR 530 HB THR 530 -8.391 -15.240 7.768 377 HG1 THR 530 HG1 THR 530 -9.244 -13.424 8.578 378 HG21 THR 530 HG21 THR 530 -10.098 -16.413 9.892 379 HG22 THR 530 HG22 THR 530 -8.691 -17.346 9.382 380 HG23 THR 530 HG23 THR 530 -9.914 -16.878 8.202 381 H ILE 531 H ILE 531 -6.261 -14.124 7.613 382 HA ILE 531 HA ILE 531 -6.365 -11.424 8.429 383 HB ILE 531 HB ILE 531 -4.654 -11.986 10.023 384 HG12 ILE 531 HG12 ILE 531 -3.184 -10.710 7.724 385 HG13 ILE 531 HG13 ILE 531 -4.485 -9.876 8.566 386 HG21 ILE 531 HG21 ILE 531 -3.876 -14.055 8.969 387 HG22 ILE 531 HG22 ILE 531 -3.078 -13.110 7.712 388 HG23 ILE 531 HG23 ILE 531 -2.532 -12.991 9.384 389 HD11 ILE 531 HD11 ILE 531 -2.465 -9.136 9.526 390 HD12 ILE 531 HD12 ILE 531 -3.187 -10.249 10.688 391 HD13 ILE 531 HD13 ILE 531 -1.847 -10.780 9.673 392 H GLU 532 H GLU 532 -5.880 -10.054 6.761 393 HA GLU 532 HA GLU 532 -4.849 -11.312 4.303 394 HB2 GLU 532 HB2 GLU 532 -7.263 -10.702 4.217 395 HB3 GLU 532 HB3 GLU 532 -6.815 -9.025 4.496 396 HG2 GLU 532 HG2 GLU 532 -6.115 -8.715 2.382 397 HG3 GLU 532 HG3 GLU 532 -5.464 -10.347 2.242 398 H LEU 533 H LEU 533 -3.027 -10.494 3.518 399 HA LEU 533 HA LEU 533 -2.126 -7.879 4.514 400 HB2 LEU 533 HB2 LEU 533 -0.819 -10.421 4.069 401 HB3 LEU 533 HB3 LEU 533 0.009 -9.114 3.224 402 HG LEU 533 HG LEU 533 0.163 -7.894 5.388 403 HD11 LEU 533 HD11 LEU 533 -1.473 -10.151 6.245 404 HD12 LEU 533 HD12 LEU 533 -1.250 -8.564 6.981 405 HD13 LEU 533 HD13 LEU 533 -0.083 -9.851 7.288 406 HD21 LEU 533 HD21 LEU 533 1.947 -9.297 6.309 407 HD22 LEU 533 HD22 LEU 533 2.039 -9.200 4.550 408 HD23 LEU 533 HD23 LEU 533 1.392 -10.649 5.321 409 HA PRO 534 HA PRO 534 -2.803 -6.290 0.430 410 HB2 PRO 534 HB2 PRO 534 -1.593 -3.892 0.818 411 HB3 PRO 534 HB3 PRO 534 -3.196 -4.273 1.456 412 HG2 PRO 534 HG2 PRO 534 -0.545 -4.315 2.846 413 HG3 PRO 534 HG3 PRO 534 -2.103 -3.696 3.426 414 HD2 PRO 534 HD2 PRO 534 -1.128 -6.111 4.166 415 HD3 PRO 534 HD3 PRO 534 -2.867 -5.794 3.996 416 H LYS 535 H LYS 535 0.156 -7.128 1.827 417 HA LYS 535 HA LYS 535 2.122 -6.092 0.234 418 HB2 LYS 535 HB2 LYS 535 1.885 -8.942 1.216 419 HB3 LYS 535 HB3 LYS 535 3.364 -8.208 0.611 420 HG2 LYS 535 HG2 LYS 535 1.825 -7.345 3.051 421 HG3 LYS 535 HG3 LYS 535 3.344 -8.244 3.034 422 HD2 LYS 535 HD2 LYS 535 2.929 -5.457 1.950 423 HD3 LYS 535 HD3 LYS 535 3.711 -5.864 3.480 424 HE2 LYS 535 HE2 LYS 535 4.654 -6.682 0.733 425 HE3 LYS 535 HE3 LYS 535 5.352 -5.403 1.726 426 HZ1 LYS 535 HZ1 LYS 535 5.442 -8.321 2.143 427 HZ2 LYS 535 HZ2 LYS 535 5.654 -7.263 3.446 428 HZ3 LYS 535 HZ3 LYS 535 6.717 -7.209 2.130 429 H GLY 536 H GLY 536 3.112 -6.669 -1.722 430 HA2 GLY 536 HA2 GLY 536 1.529 -8.454 -3.460 431 HA3 GLY 536 HA3 GLY 536 2.049 -6.872 -4.020 432 H MET 537 H MET 537 3.803 -9.333 -2.152 433 HA MET 537 HA MET 537 5.340 -10.331 -4.275 434 HB2 MET 537 HB2 MET 537 6.105 -7.815 -3.937 435 HB3 MET 537 HB3 MET 537 7.056 -8.521 -2.637 436 HG2 MET 537 HG2 MET 537 8.371 -9.741 -4.075 437 HG3 MET 537 HG3 MET 537 7.161 -9.734 -5.356 438 HE1 MET 537 HE1 MET 537 9.330 -8.736 -7.327 439 HE2 MET 537 HE2 MET 537 10.592 -7.953 -6.375 440 HE3 MET 537 HE3 MET 537 9.947 -9.516 -5.870 441 HA PRO 538 HA PRO 538 5.536 -12.428 -0.105 442 HB2 PRO 538 HB2 PRO 538 4.489 -14.784 -0.955 443 HB3 PRO 538 HB3 PRO 538 3.493 -13.441 -0.383 444 HG2 PRO 538 HG2 PRO 538 4.135 -14.263 -3.189 445 HG3 PRO 538 HG3 PRO 538 2.584 -13.747 -2.502 446 HD2 PRO 538 HD2 PRO 538 4.160 -12.088 -3.951 447 HD3 PRO 538 HD3 PRO 538 3.131 -11.511 -2.624 448 H GLY 539 H GLY 539 6.276 -14.970 0.043 449 HA2 GLY 539 HA2 GLY 539 7.810 -16.606 -0.693 450 HA3 GLY 539 HA3 GLY 539 8.370 -15.491 -1.931 451 H GLU 540 H GLU 540 8.240 -13.618 0.696 452 HA GLU 540 HA GLU 540 11.087 -13.767 1.115 453 HB2 GLU 540 HB2 GLU 540 9.254 -12.045 2.744 454 HB3 GLU 540 HB3 GLU 540 10.903 -11.726 2.224 455 HG2 GLU 540 HG2 GLU 540 9.958 -11.647 -0.142 456 HG3 GLU 540 HG3 GLU 540 8.374 -11.555 0.626 457 H VAL 541 H VAL 541 8.199 -14.157 3.156 458 HA VAL 541 HA VAL 541 9.732 -15.050 5.416 459 HB VAL 541 HB VAL 541 6.750 -15.231 4.965 460 HG11 VAL 541 HG11 VAL 541 7.535 -16.715 6.725 461 HG12 VAL 541 HG12 VAL 541 8.392 -15.376 7.492 462 HG13 VAL 541 HG13 VAL 541 6.630 -15.366 7.412 463 HG21 VAL 541 HG21 VAL 541 6.798 -13.002 5.071 464 HG22 VAL 541 HG22 VAL 541 7.227 -13.200 6.770 465 HG23 VAL 541 HG23 VAL 541 8.492 -12.980 5.561 466 H LEU 542 H LEU 542 7.932 -16.554 2.811 467 HA LEU 542 HA LEU 542 7.799 -19.160 3.884 468 HB2 LEU 542 HB2 LEU 542 7.503 -17.937 1.198 469 HB3 LEU 542 HB3 LEU 542 7.787 -19.675 1.271 470 HG LEU 542 HG LEU 542 5.777 -19.638 2.946 471 HD11 LEU 542 HD11 LEU 542 5.165 -17.480 3.289 472 HD12 LEU 542 HD12 LEU 542 4.172 -17.814 1.870 473 HD13 LEU 542 HD13 LEU 542 5.702 -16.954 1.693 474 HD21 LEU 542 HD21 LEU 542 5.888 -20.715 0.697 475 HD22 LEU 542 HD22 LEU 542 5.286 -19.209 0.003 476 HD23 LEU 542 HD23 LEU 542 4.287 -20.119 1.139 477 H GLN 543 H GLN 543 10.368 -17.363 2.471 478 HA GLN 543 HA GLN 543 11.953 -19.678 1.779 479 HB2 GLN 543 HB2 GLN 543 12.393 -16.712 1.692 480 HB3 GLN 543 HB3 GLN 543 13.752 -17.814 1.512 481 HG2 GLN 543 HG2 GLN 543 12.858 -18.748 -0.461 482 HG3 GLN 543 HG3 GLN 543 11.291 -17.983 -0.198 483 HE21 GLN 543 HE21 GLN 543 12.838 -17.797 -2.558 484 HE22 GLN 543 HE22 GLN 543 13.279 -16.141 -2.771 485 H HIS 544 H HIS 544 12.399 -16.967 4.058 486 HA HIS 544 HA HIS 544 14.494 -18.259 5.478 487 HB2 HIS 544 HB2 HIS 544 12.804 -15.828 5.980 488 HB3 HIS 544 HB3 HIS 544 13.894 -16.427 7.227 489 HD1 HIS 544 HD1 HIS 544 16.388 -17.081 5.700 490 HD2 HIS 544 HD2 HIS 544 14.088 -13.717 4.889 491 HE1 HIS 544 HE1 HIS 544 17.939 -15.466 4.555 492 H PHE 545 H PHE 545 11.114 -17.560 6.380 493 HA PHE 545 HA PHE 545 11.303 -19.397 8.621 494 HB2 PHE 545 HB2 PHE 545 9.085 -17.600 7.633 495 HB3 PHE 545 HB3 PHE 545 8.914 -18.677 9.015 496 HD1 PHE 545 HD1 PHE 545 9.396 -17.878 11.119 497 HD2 PHE 545 HD2 PHE 545 11.125 -15.967 7.731 498 HE1 PHE 545 HE1 PHE 545 10.349 -16.147 12.585 499 HE2 PHE 545 HE2 PHE 545 12.081 -14.234 9.192 500 HZ PHE 545 HZ PHE 545 11.692 -14.321 11.623 501 H THR 546 H THR 546 11.692 -20.756 6.288 502 HA THR 546 HA THR 546 9.253 -21.882 5.284 503 HB THR 546 HB THR 546 11.359 -21.721 3.937 504 HG1 THR 546 HG1 THR 546 10.656 -24.443 4.084 505 HG21 THR 546 HG21 THR 546 12.934 -22.415 5.689 506 HG22 THR 546 HG22 THR 546 13.079 -23.429 4.253 507 HG23 THR 546 HG23 THR 546 12.232 -24.032 5.677 508 H ARG 547 H ARG 547 11.592 -22.722 7.746 509 HA ARG 547 HA ARG 547 10.002 -25.123 8.374 510 HB2 ARG 547 HB2 ARG 547 12.483 -25.355 7.627 511 HB3 ARG 547 HB3 ARG 547 12.853 -24.770 9.244 512 HG2 ARG 547 HG2 ARG 547 10.923 -26.987 9.107 513 HG3 ARG 547 HG3 ARG 547 12.571 -27.367 8.604 514 HD2 ARG 547 HD2 ARG 547 13.421 -27.072 10.689 515 HD3 ARG 547 HD3 ARG 547 12.265 -25.805 11.097 516 HE ARG 547 HE ARG 547 10.864 -27.403 11.958 517 HH11 ARG 547 HH11 ARG 547 13.336 -28.943 10.050 518 HH12 ARG 547 HH12 ARG 547 12.906 -30.545 10.549 519 HH21 ARG 547 HH21 ARG 547 10.288 -29.508 12.621 520 HH22 ARG 547 HH22 ARG 547 11.171 -30.866 12.010 521 H THR 548 H THR 548 11.275 -22.132 9.493 522 HA THR 548 HA THR 548 10.537 -22.759 12.267 523 HB THR 548 HB THR 548 12.122 -20.425 11.176 524 HG1 THR 548 HG1 THR 548 13.122 -22.410 12.911 525 HG21 THR 548 HG21 THR 548 10.884 -19.781 13.170 526 HG22 THR 548 HG22 THR 548 12.601 -19.933 13.544 527 HG23 THR 548 HG23 THR 548 11.478 -21.206 14.022 528 H ARG 549 H ARG 549 8.631 -22.097 12.986 529 HA ARG 549 HA ARG 549 7.552 -19.534 12.124 530 HB2 ARG 549 HB2 ARG 549 6.114 -22.161 11.742 531 HB3 ARG 549 HB3 ARG 549 5.299 -20.603 11.724 532 HG2 ARG 549 HG2 ARG 549 5.646 -20.712 9.517 533 HG3 ARG 549 HG3 ARG 549 7.273 -20.164 9.926 534 HD2 ARG 549 HD2 ARG 549 7.939 -21.990 8.805 535 HD3 ARG 549 HD3 ARG 549 7.502 -22.850 10.281 536 HE ARG 549 HE ARG 549 5.692 -23.752 9.190 537 HH11 ARG 549 HH11 ARG 549 7.045 -21.174 7.281 538 HH12 ARG 549 HH12 ARG 549 6.090 -21.534 5.881 539 HH21 ARG 549 HH21 ARG 549 4.429 -24.236 7.353 540 HH22 ARG 549 HH22 ARG 549 4.602 -23.275 5.923 541 H ILE 550 H ILE 550 5.305 -19.251 13.320 542 HA ILE 550 HA ILE 550 4.992 -20.564 15.823 543 HB ILE 550 HB ILE 550 7.039 -18.956 16.087 544 HG12 ILE 550 HG12 ILE 550 5.146 -18.406 18.270 545 HG13 ILE 550 HG13 ILE 550 5.255 -20.104 17.821 546 HG21 ILE 550 HG21 ILE 550 6.687 -16.724 16.266 547 HG22 ILE 550 HG22 ILE 550 5.371 -17.093 15.152 548 HG23 ILE 550 HG23 ILE 550 5.044 -16.920 16.876 549 HD11 ILE 550 HD11 ILE 550 6.847 -18.970 19.626 550 HD12 ILE 550 HD12 ILE 550 7.362 -20.312 18.603 551 HD13 ILE 550 HD13 ILE 550 7.804 -18.659 18.178 552 H LEU 551 H LEU 551 3.553 -18.971 17.305 553 HA LEU 551 HA LEU 551 1.063 -18.830 16.338 554 HB2 LEU 551 HB2 LEU 551 0.538 -17.134 17.956 555 HB3 LEU 551 HB3 LEU 551 1.710 -18.257 18.642 556 HG LEU 551 HG LEU 551 3.393 -16.368 17.764 557 HD11 LEU 551 HD11 LEU 551 2.564 -14.234 17.746 558 HD12 LEU 551 HD12 LEU 551 1.167 -14.647 18.739 559 HD13 LEU 551 HD13 LEU 551 1.207 -15.111 17.038 560 HD21 LEU 551 HD21 LEU 551 1.888 -16.633 20.338 561 HD22 LEU 551 HD22 LEU 551 3.081 -15.352 20.122 562 HD23 LEU 551 HD23 LEU 551 3.565 -17.042 19.977 563 H ASN 552 H ASN 552 3.528 -16.339 15.852 564 HA ASN 552 HA ASN 552 1.769 -14.641 14.339 565 HB2 ASN 552 HB2 ASN 552 3.499 -13.531 15.535 566 HB3 ASN 552 HB3 ASN 552 4.738 -14.596 14.876 567 HD21 ASN 552 HD21 ASN 552 5.989 -13.021 13.988 568 HD22 ASN 552 HD22 ASN 552 5.489 -12.043 12.654 569 H LYS 553 H LYS 553 4.772 -16.359 13.459 570 HA LYS 553 HA LYS 553 4.451 -16.066 10.686 571 HB2 LYS 553 HB2 LYS 553 5.876 -18.428 11.856 572 HB3 LYS 553 HB3 LYS 553 6.305 -17.454 10.455 573 HG2 LYS 553 HG2 LYS 553 6.570 -16.694 13.353 574 HG3 LYS 553 HG3 LYS 553 7.869 -17.001 12.198 575 HD2 LYS 553 HD2 LYS 553 5.864 -14.749 12.054 576 HD3 LYS 553 HD3 LYS 553 7.549 -14.604 12.560 577 HE2 LYS 553 HE2 LYS 553 8.134 -14.298 10.441 578 HE3 LYS 553 HE3 LYS 553 7.546 -15.916 10.062 579 HZ1 LYS 553 HZ1 LYS 553 5.567 -13.777 10.252 580 HZ2 LYS 553 HZ2 LYS 553 5.613 -15.118 9.223 581 HZ3 LYS 553 HZ3 LYS 553 6.583 -13.771 8.899 582 HA PRO 554 HA PRO 554 1.587 -19.146 9.439 583 HB2 PRO 554 HB2 PRO 554 2.751 -20.204 7.226 584 HB3 PRO 554 HB3 PRO 554 2.052 -18.581 7.261 585 HG2 PRO 554 HG2 PRO 554 4.915 -19.414 7.518 586 HG3 PRO 554 HG3 PRO 554 4.219 -18.073 6.590 587 HD2 PRO 554 HD2 PRO 554 5.403 -17.718 8.999 588 HD3 PRO 554 HD3 PRO 554 4.049 -16.714 8.443 589 H MET 555 H MET 555 2.193 -20.376 11.463 590 HA MET 555 HA MET 555 4.039 -22.493 11.429 591 HB2 MET 555 HB2 MET 555 3.204 -21.732 13.531 592 HB3 MET 555 HB3 MET 555 1.539 -22.030 13.052 593 HG2 MET 555 HG2 MET 555 2.246 -23.727 14.590 594 HG3 MET 555 HG3 MET 555 2.010 -24.442 12.997 595 HE1 MET 555 HE1 MET 555 4.994 -24.370 15.905 596 HE2 MET 555 HE2 MET 555 5.916 -23.239 14.915 597 HE3 MET 555 HE3 MET 555 4.268 -22.843 15.403 598 H ASN 556 H ASN 556 0.481 -22.687 11.172 599 HA ASN 556 HA ASN 556 0.772 -24.843 9.225 600 HB2 ASN 556 HB2 ASN 556 0.517 -25.671 11.708 601 HB3 ASN 556 HB3 ASN 556 -1.177 -25.256 11.462 602 HD21 ASN 556 HD21 ASN 556 -2.211 -26.211 9.532 603 HD22 ASN 556 HD22 ASN 556 -1.766 -27.820 9.089 604 H MET 557 H MET 557 0.056 -22.561 8.288 605 HA MET 557 HA MET 557 -2.876 -22.386 8.337 606 HB2 MET 557 HB2 MET 557 -2.513 -20.169 7.225 607 HB3 MET 557 HB3 MET 557 -1.846 -20.287 8.847 608 HG2 MET 557 HG2 MET 557 0.224 -19.905 8.137 609 HG3 MET 557 HG3 MET 557 0.067 -21.048 6.805 610 HE1 MET 557 HE1 MET 557 0.806 -19.477 4.259 611 HE2 MET 557 HE2 MET 557 -0.330 -20.741 4.729 612 HE3 MET 557 HE3 MET 557 -0.902 -19.324 3.847 613 H GLN 558 H GLN 558 -3.827 -21.662 6.161 614 HA GLN 558 HA GLN 558 -2.465 -22.876 3.879 615 HB2 GLN 558 HB2 GLN 558 -5.316 -23.583 4.578 616 HB3 GLN 558 HB3 GLN 558 -4.349 -24.236 3.261 617 HG2 GLN 558 HG2 GLN 558 -3.619 -24.592 6.152 618 HG3 GLN 558 HG3 GLN 558 -4.650 -25.720 5.272 619 HE21 GLN 558 HE21 GLN 558 -3.497 -25.941 2.874 620 HE22 GLN 558 HE22 GLN 558 -1.895 -26.571 3.009 621 H LEU 559 H LEU 559 -3.424 -22.294 1.815 622 HA LEU 559 HA LEU 559 -4.484 -19.588 1.895 623 HB2 LEU 559 HB2 LEU 559 -2.602 -20.126 0.420 624 HB3 LEU 559 HB3 LEU 559 -3.610 -21.290 -0.436 625 HG LEU 559 HG LEU 559 -3.200 -18.986 -1.504 626 HD11 LEU 559 HD11 LEU 559 -5.140 -19.207 -2.712 627 HD12 LEU 559 HD12 LEU 559 -6.107 -19.613 -1.295 628 HD13 LEU 559 HD13 LEU 559 -5.009 -20.808 -1.985 629 HD21 LEU 559 HD21 LEU 559 -4.728 -17.230 -0.828 630 HD22 LEU 559 HD22 LEU 559 -3.682 -17.677 0.521 631 HD23 LEU 559 HD23 LEU 559 -5.352 -18.244 0.474 632 H LEU 560 H LEU 560 -6.585 -19.192 1.799 633 HA LEU 560 HA LEU 560 -8.330 -21.159 0.469 634 HB2 LEU 560 HB2 LEU 560 -9.997 -20.790 2.034 635 HB3 LEU 560 HB3 LEU 560 -8.524 -20.796 3.001 636 HG LEU 560 HG LEU 560 -8.778 -18.149 2.504 637 HD11 LEU 560 HD11 LEU 560 -10.840 -17.486 2.008 638 HD12 LEU 560 HD12 LEU 560 -11.548 -18.542 3.230 639 HD13 LEU 560 HD13 LEU 560 -11.202 -19.167 1.618 640 HD21 LEU 560 HD21 LEU 560 -9.212 -17.953 4.751 641 HD22 LEU 560 HD22 LEU 560 -8.602 -19.606 4.672 642 HD23 LEU 560 HD23 LEU 560 -10.339 -19.310 4.764 643 H GLY 561 H GLY 561 -7.391 -17.833 0.749 644 HA2 GLY 561 HA2 GLY 561 -9.618 -16.870 -0.851 645 HA3 GLY 561 HA3 GLY 561 -8.295 -15.905 -0.213 646 H ASP 562 H ASP 562 -8.043 -14.861 -2.221 647 HA ASP 562 HA ASP 562 -6.140 -16.058 -3.936 648 HB2 ASP 562 HB2 ASP 562 -8.213 -17.228 -4.719 649 HB3 ASP 562 HB3 ASP 562 -8.866 -15.659 -5.181 650 H ALA 563 H ALA 563 -5.268 -14.589 -5.446 651 HA ALA 563 HA ALA 563 -5.522 -11.851 -4.690 652 HB1 ALA 563 HB1 ALA 563 -3.586 -11.553 -5.789 653 HB2 ALA 563 HB2 ALA 563 -3.540 -13.316 -5.819 654 HB3 ALA 563 HB3 ALA 563 -4.143 -12.426 -7.217 655 H GLN 564 H GLN 564 -7.023 -10.477 -5.359 656 HA GLN 564 HA GLN 564 -8.980 -11.014 -7.252 657 HB2 GLN 564 HB2 GLN 564 -8.644 -9.079 -5.421 658 HB3 GLN 564 HB3 GLN 564 -8.217 -8.173 -6.866 659 HG2 GLN 564 HG2 GLN 564 -10.546 -7.863 -6.390 660 HG3 GLN 564 HG3 GLN 564 -10.375 -8.807 -7.868 661 HE21 GLN 564 HE21 GLN 564 -12.192 -9.976 -7.875 662 HE22 GLN 564 HE22 GLN 564 -12.678 -11.059 -6.620 Start of MODEL 2 1 H MET 480 H MET 480 1.808 0.000 0.855 2 HA MET 480 HA MET 480 1.426 0.288 -2.041 3 HB2 MET 480 HB2 MET 480 3.911 0.711 -0.371 4 HB3 MET 480 HB3 MET 480 3.774 1.005 -2.100 5 HG2 MET 480 HG2 MET 480 2.271 2.809 -1.760 6 HG3 MET 480 HG3 MET 480 2.089 2.415 -0.052 7 HE1 MET 480 HE1 MET 480 3.506 5.219 -2.045 8 HE2 MET 480 HE2 MET 480 5.248 4.948 -2.052 9 HE3 MET 480 HE3 MET 480 4.174 3.799 -2.851 10 H ALA 481 H ALA 481 1.363 -1.609 -3.059 11 HA ALA 481 HA ALA 481 3.290 -3.689 -2.250 12 HB1 ALA 481 HB1 ALA 481 0.446 -3.814 -2.698 13 HB2 ALA 481 HB2 ALA 481 1.303 -4.926 -3.766 14 HB3 ALA 481 HB3 ALA 481 1.532 -5.028 -2.021 15 H ASP 482 H ASP 482 3.355 -5.355 -4.286 16 HA ASP 482 HA ASP 482 4.511 -3.752 -6.432 17 HB2 ASP 482 HB2 ASP 482 5.439 -5.975 -5.181 18 HB3 ASP 482 HB3 ASP 482 4.661 -6.698 -6.587 19 H VAL 483 H VAL 483 2.010 -6.176 -5.896 20 HA VAL 483 HA VAL 483 0.899 -5.509 -8.535 21 HB VAL 483 HB VAL 483 1.949 -7.659 -8.824 22 HG11 VAL 483 HG11 VAL 483 1.990 -8.242 -6.399 23 HG12 VAL 483 HG12 VAL 483 0.285 -8.680 -6.528 24 HG13 VAL 483 HG13 VAL 483 1.497 -9.568 -7.453 25 HG21 VAL 483 HG21 VAL 483 0.068 -8.957 -9.565 26 HG22 VAL 483 HG22 VAL 483 -1.017 -8.085 -8.483 27 HG23 VAL 483 HG23 VAL 483 -0.279 -7.252 -9.851 28 H GLY 484 H GLY 484 0.332 -6.826 -5.302 29 HA2 GLY 484 HA2 GLY 484 -1.575 -5.716 -4.127 30 HA3 GLY 484 HA3 GLY 484 -2.505 -6.046 -5.581 31 H ASP 485 H ASP 485 -0.204 -8.325 -4.270 32 HA ASP 485 HA ASP 485 -1.928 -10.494 -4.304 33 HB2 ASP 485 HB2 ASP 485 0.708 -10.230 -3.871 34 HB3 ASP 485 HB3 ASP 485 0.179 -10.484 -2.210 35 H MET 486 H MET 486 -3.878 -10.351 -3.333 36 HA MET 486 HA MET 486 -3.882 -9.900 -0.422 37 HB2 MET 486 HB2 MET 486 -5.078 -8.245 -2.258 38 HB3 MET 486 HB3 MET 486 -6.402 -9.308 -1.801 39 HG2 MET 486 HG2 MET 486 -6.677 -8.246 0.118 40 HG3 MET 486 HG3 MET 486 -4.977 -8.450 0.534 41 HE1 MET 486 HE1 MET 486 -7.069 -5.148 -1.673 42 HE2 MET 486 HE2 MET 486 -5.864 -5.848 -2.753 43 HE3 MET 486 HE3 MET 486 -7.105 -6.874 -2.032 44 H GLN 487 H GLN 487 -4.476 -11.653 0.655 45 HA GLN 487 HA GLN 487 -6.669 -13.293 -0.307 46 HB2 GLN 487 HB2 GLN 487 -4.033 -14.597 0.361 47 HB3 GLN 487 HB3 GLN 487 -5.477 -15.364 -0.287 48 HG2 GLN 487 HG2 GLN 487 -5.199 -14.175 -2.381 49 HG3 GLN 487 HG3 GLN 487 -3.788 -13.338 -1.736 50 HE21 GLN 487 HE21 GLN 487 -4.340 -15.365 -3.966 51 HE22 GLN 487 HE22 GLN 487 -3.092 -16.541 -3.755 52 H LEU 488 H LEU 488 -7.021 -15.166 1.351 53 HA LEU 488 HA LEU 488 -6.732 -13.997 4.038 54 HB2 LEU 488 HB2 LEU 488 -9.046 -14.281 2.993 55 HB3 LEU 488 HB3 LEU 488 -8.806 -16.011 3.224 56 HG LEU 488 HG LEU 488 -8.586 -15.618 5.657 57 HD11 LEU 488 HD11 LEU 488 -8.164 -13.573 6.397 58 HD12 LEU 488 HD12 LEU 488 -9.795 -13.101 5.921 59 HD13 LEU 488 HD13 LEU 488 -8.452 -12.888 4.797 60 HD21 LEU 488 HD21 LEU 488 -10.880 -15.493 6.061 61 HD22 LEU 488 HD22 LEU 488 -10.776 -16.098 4.408 62 HD23 LEU 488 HD23 LEU 488 -11.156 -14.401 4.704 63 H TYR 489 H TYR 489 -5.118 -14.971 5.079 64 HA TYR 489 HA TYR 489 -4.738 -17.862 4.729 65 HB2 TYR 489 HB2 TYR 489 -2.799 -16.065 6.152 66 HB3 TYR 489 HB3 TYR 489 -2.493 -17.587 5.321 67 HD1 TYR 489 HD1 TYR 489 -2.939 -13.979 4.925 68 HD2 TYR 489 HD2 TYR 489 -2.253 -17.656 2.897 69 HE1 TYR 489 HE1 TYR 489 -2.268 -12.736 2.912 70 HE2 TYR 489 HE2 TYR 489 -1.578 -16.423 0.879 71 HH TYR 489 HH TYR 489 -1.972 -12.974 0.615 72 H ARG 490 H ARG 490 -5.648 -19.098 6.221 73 HA ARG 490 HA ARG 490 -6.073 -18.021 8.915 74 HB2 ARG 490 HB2 ARG 490 -7.651 -19.880 9.206 75 HB3 ARG 490 HB3 ARG 490 -8.053 -18.906 7.798 76 HG2 ARG 490 HG2 ARG 490 -8.206 -20.848 6.720 77 HG3 ARG 490 HG3 ARG 490 -6.441 -20.837 6.726 78 HD2 ARG 490 HD2 ARG 490 -6.839 -22.901 7.634 79 HD3 ARG 490 HD3 ARG 490 -6.770 -21.921 9.098 80 HE ARG 490 HE ARG 490 -9.393 -21.876 8.471 81 HH11 ARG 490 HH11 ARG 490 -7.080 -24.455 8.819 82 HH12 ARG 490 HH12 ARG 490 -8.256 -25.613 9.348 83 HH21 ARG 490 HH21 ARG 490 -10.949 -23.392 9.166 84 HH22 ARG 490 HH22 ARG 490 -10.456 -25.008 9.544 85 H ILE 491 H ILE 491 -4.999 -18.769 10.637 86 HA ILE 491 HA ILE 491 -3.123 -20.989 10.212 87 HB ILE 491 HB ILE 491 -1.844 -20.142 12.068 88 HG12 ILE 491 HG12 ILE 491 -4.028 -18.068 12.369 89 HG13 ILE 491 HG13 ILE 491 -3.709 -19.395 13.480 90 HG21 ILE 491 HG21 ILE 491 -2.078 -17.528 10.980 91 HG22 ILE 491 HG22 ILE 491 -0.861 -18.758 10.642 92 HG23 ILE 491 HG23 ILE 491 -2.339 -18.694 9.683 93 HD11 ILE 491 HD11 ILE 491 -2.785 -17.443 14.435 94 HD12 ILE 491 HD12 ILE 491 -1.433 -18.405 13.839 95 HD13 ILE 491 HD13 ILE 491 -1.985 -17.000 12.927 96 H GLU 492 H GLU 492 -2.641 -22.269 12.265 97 HA GLU 492 HA GLU 492 -5.204 -23.126 13.394 98 HB2 GLU 492 HB2 GLU 492 -3.642 -24.754 12.234 99 HB3 GLU 492 HB3 GLU 492 -2.553 -24.551 13.599 100 HG2 GLU 492 HG2 GLU 492 -4.254 -25.396 15.110 101 HG3 GLU 492 HG3 GLU 492 -5.385 -25.557 13.767 102 H VAL 493 H VAL 493 -4.506 -20.818 14.520 103 HA VAL 493 HA VAL 493 -3.791 -21.619 17.239 104 HB VAL 493 HB VAL 493 -2.584 -19.137 16.033 105 HG11 VAL 493 HG11 VAL 493 -1.629 -20.667 18.428 106 HG12 VAL 493 HG12 VAL 493 -1.328 -18.983 17.992 107 HG13 VAL 493 HG13 VAL 493 -2.924 -19.478 18.557 108 HG21 VAL 493 HG21 VAL 493 -1.310 -21.856 16.326 109 HG22 VAL 493 HG22 VAL 493 -1.698 -21.044 14.810 110 HG23 VAL 493 HG23 VAL 493 -0.466 -20.373 15.878 111 H GLY 494 H GLY 494 -4.879 -20.524 18.816 112 HA2 GLY 494 HA2 GLY 494 -6.339 -18.092 18.128 113 HA3 GLY 494 HA3 GLY 494 -7.304 -19.488 18.584 114 H ARG 495 H ARG 495 -7.979 -17.827 20.244 115 HA ARG 495 HA ARG 495 -6.311 -16.928 22.280 116 HB2 ARG 495 HB2 ARG 495 -8.401 -16.803 23.655 117 HB3 ARG 495 HB3 ARG 495 -8.522 -16.034 22.078 118 HG2 ARG 495 HG2 ARG 495 -9.838 -17.791 21.213 119 HG3 ARG 495 HG3 ARG 495 -9.479 -18.833 22.591 120 HD2 ARG 495 HD2 ARG 495 -10.667 -17.204 24.049 121 HD3 ARG 495 HD3 ARG 495 -11.126 -16.308 22.601 122 HE ARG 495 HE ARG 495 -11.878 -19.077 22.515 123 HH11 ARG 495 HH11 ARG 495 -12.802 -15.902 23.605 124 HH12 ARG 495 HH12 ARG 495 -14.496 -16.265 23.642 125 HH21 ARG 495 HH21 ARG 495 -14.105 -19.567 22.559 126 HH22 ARG 495 HH22 ARG 495 -15.236 -18.350 23.047 127 H ASP 496 H ASP 496 -7.805 -20.047 21.788 128 HA ASP 496 HA ASP 496 -7.284 -21.026 24.429 129 HB2 ASP 496 HB2 ASP 496 -8.992 -21.845 22.577 130 HB3 ASP 496 HB3 ASP 496 -7.642 -22.878 22.114 131 H ASP 497 H ASP 497 -5.423 -20.629 21.594 132 HA ASP 497 HA ASP 497 -3.457 -22.637 22.388 133 HB2 ASP 497 HB2 ASP 497 -4.165 -22.335 19.981 134 HB3 ASP 497 HB3 ASP 497 -3.340 -20.779 20.010 135 H GLY 498 H GLY 498 -3.791 -19.138 22.020 136 HA2 GLY 498 HA2 GLY 498 -2.544 -17.989 23.935 137 HA3 GLY 498 HA3 GLY 498 -1.139 -18.807 23.267 138 H VAL 499 H VAL 499 -3.742 -17.387 21.373 139 HA VAL 499 HA VAL 499 -1.965 -15.184 20.593 140 HB VAL 499 HB VAL 499 -1.926 -17.144 18.936 141 HG11 VAL 499 HG11 VAL 499 -4.354 -16.087 17.668 142 HG12 VAL 499 HG12 VAL 499 -3.763 -17.745 17.787 143 HG13 VAL 499 HG13 VAL 499 -4.629 -17.017 19.141 144 HG21 VAL 499 HG21 VAL 499 -1.293 -14.677 18.566 145 HG22 VAL 499 HG22 VAL 499 -1.567 -15.690 17.148 146 HG23 VAL 499 HG23 VAL 499 -2.818 -14.569 17.685 147 H GLU 500 H GLU 500 -3.014 -13.315 19.832 148 HA GLU 500 HA GLU 500 -5.935 -13.274 20.198 149 HB2 GLU 500 HB2 GLU 500 -4.179 -10.953 20.955 150 HB3 GLU 500 HB3 GLU 500 -5.851 -11.253 21.404 151 HG2 GLU 500 HG2 GLU 500 -3.410 -12.696 22.402 152 HG3 GLU 500 HG3 GLU 500 -4.470 -11.621 23.313 153 H VAL 501 H VAL 501 -6.567 -10.787 19.465 154 HA VAL 501 HA VAL 501 -6.159 -10.838 16.627 155 HB VAL 501 HB VAL 501 -7.585 -8.816 18.361 156 HG11 VAL 501 HG11 VAL 501 -7.530 -9.142 15.363 157 HG12 VAL 501 HG12 VAL 501 -8.650 -8.098 16.241 158 HG13 VAL 501 HG13 VAL 501 -6.917 -7.775 16.293 159 HG21 VAL 501 HG21 VAL 501 -8.402 -11.267 18.185 160 HG22 VAL 501 HG22 VAL 501 -9.562 -9.959 17.947 161 HG23 VAL 501 HG23 VAL 501 -8.896 -10.811 16.554 162 H ARG 502 H ARG 502 -4.921 -8.976 19.319 163 HA ARG 502 HA ARG 502 -3.592 -7.075 17.570 164 HB2 ARG 502 HB2 ARG 502 -2.756 -6.098 19.708 165 HB3 ARG 502 HB3 ARG 502 -4.509 -6.177 19.601 166 HG2 ARG 502 HG2 ARG 502 -4.632 -7.959 21.123 167 HG3 ARG 502 HG3 ARG 502 -2.905 -8.296 20.990 168 HD2 ARG 502 HD2 ARG 502 -3.164 -7.200 23.053 169 HD3 ARG 502 HD3 ARG 502 -2.533 -5.975 21.952 170 HE ARG 502 HE ARG 502 -4.457 -4.790 22.257 171 HH11 ARG 502 HH11 ARG 502 -5.031 -8.099 23.174 172 HH12 ARG 502 HH12 ARG 502 -6.628 -7.793 23.771 173 HH21 ARG 502 HH21 ARG 502 -6.559 -4.375 23.040 174 HH22 ARG 502 HH22 ARG 502 -7.496 -5.675 23.693 175 H HIS 503 H HIS 503 -2.987 -10.155 18.507 176 HA HIS 503 HA HIS 503 -0.154 -9.900 19.031 177 HB2 HIS 503 HB2 HIS 503 -1.869 -11.719 19.890 178 HB3 HIS 503 HB3 HIS 503 -1.434 -12.521 18.384 179 HD1 HIS 503 HD1 HIS 503 1.621 -11.220 18.836 180 HD2 HIS 503 HD2 HIS 503 -0.517 -13.896 21.187 181 HE1 HIS 503 HE1 HIS 503 3.345 -12.453 20.190 182 H ILE 504 H ILE 504 -2.099 -11.513 16.511 183 HA ILE 504 HA ILE 504 0.131 -11.929 14.793 184 HB ILE 504 HB ILE 504 -1.377 -12.805 13.218 185 HG12 ILE 504 HG12 ILE 504 -2.870 -10.776 13.227 186 HG13 ILE 504 HG13 ILE 504 -3.718 -12.313 13.095 187 HG21 ILE 504 HG21 ILE 504 -2.850 -14.268 14.531 188 HG22 ILE 504 HG22 ILE 504 -1.236 -14.152 15.230 189 HG23 ILE 504 HG23 ILE 504 -2.574 -13.256 15.948 190 HD11 ILE 504 HD11 ILE 504 -4.188 -12.205 15.520 191 HD12 ILE 504 HD12 ILE 504 -3.448 -10.604 15.553 192 HD13 ILE 504 HD13 ILE 504 -4.905 -10.883 14.599 193 H VAL 505 H VAL 505 -2.087 -9.315 15.281 194 HA VAL 505 HA VAL 505 -1.566 -8.036 12.753 195 HB VAL 505 HB VAL 505 -2.951 -7.068 15.253 196 HG11 VAL 505 HG11 VAL 505 -2.584 -4.998 14.506 197 HG12 VAL 505 HG12 VAL 505 -1.966 -5.578 12.958 198 HG13 VAL 505 HG13 VAL 505 -3.703 -5.389 13.201 199 HG21 VAL 505 HG21 VAL 505 -4.294 -7.403 12.624 200 HG22 VAL 505 HG22 VAL 505 -3.889 -8.856 13.538 201 HG23 VAL 505 HG23 VAL 505 -4.928 -7.625 14.255 202 H GLY 506 H GLY 506 -0.849 -7.150 16.141 203 HA2 GLY 506 HA2 GLY 506 0.844 -5.003 15.565 204 HA3 GLY 506 HA3 GLY 506 0.876 -5.941 17.051 205 H ALA 507 H ALA 507 1.419 -8.386 15.294 206 HA ALA 507 HA ALA 507 4.271 -8.267 15.527 207 HB1 ALA 507 HB1 ALA 507 3.320 -10.353 16.025 208 HB2 ALA 507 HB2 ALA 507 2.361 -10.367 14.544 209 HB3 ALA 507 HB3 ALA 507 4.111 -10.577 14.464 210 H ILE 508 H ILE 508 2.152 -8.931 12.729 211 HA ILE 508 HA ILE 508 4.227 -8.586 10.826 212 HB ILE 508 HB ILE 508 2.453 -8.609 9.137 213 HG12 ILE 508 HG12 ILE 508 0.093 -9.133 10.322 214 HG13 ILE 508 HG13 ILE 508 0.775 -8.034 11.517 215 HG21 ILE 508 HG21 ILE 508 2.085 -10.832 9.340 216 HG22 ILE 508 HG22 ILE 508 3.244 -10.664 10.658 217 HG23 ILE 508 HG23 ILE 508 1.515 -10.698 11.004 218 HD11 ILE 508 HD11 ILE 508 0.237 -6.298 10.264 219 HD12 ILE 508 HD12 ILE 508 1.161 -6.946 8.908 220 HD13 ILE 508 HD13 ILE 508 -0.531 -7.396 9.118 221 H ALA 509 H ALA 509 1.893 -6.428 12.279 222 HA ALA 509 HA ALA 509 2.218 -4.292 10.422 223 HB1 ALA 509 HB1 ALA 509 0.246 -4.561 11.903 224 HB2 ALA 509 HB2 ALA 509 1.264 -4.132 13.278 225 HB3 ALA 509 HB3 ALA 509 0.978 -2.959 11.992 226 H ASN 510 H ASN 510 4.000 -5.397 13.174 227 HA ASN 510 HA ASN 510 5.505 -2.896 13.349 228 HB2 ASN 510 HB2 ASN 510 4.722 -4.024 15.435 229 HB3 ASN 510 HB3 ASN 510 5.764 -5.389 15.045 230 HD21 ASN 510 HD21 ASN 510 5.976 -1.852 15.273 231 HD22 ASN 510 HD22 ASN 510 7.487 -1.829 16.110 232 H GLU 511 H GLU 511 5.774 -6.163 12.207 233 HA GLU 511 HA GLU 511 8.590 -6.325 12.043 234 HB2 GLU 511 HB2 GLU 511 6.313 -7.780 10.759 235 HB3 GLU 511 HB3 GLU 511 7.941 -8.022 10.140 236 HG2 GLU 511 HG2 GLU 511 7.102 -8.451 12.998 237 HG3 GLU 511 HG3 GLU 511 7.267 -9.720 11.786 238 H GLY 512 H GLY 512 6.120 -5.324 9.698 239 HA2 GLY 512 HA2 GLY 512 8.297 -4.203 8.042 240 HA3 GLY 512 HA3 GLY 512 6.811 -4.858 7.370 241 H ASP 513 H ASP 513 6.132 -3.021 6.336 242 HA ASP 513 HA ASP 513 5.853 -0.559 7.878 243 HB2 ASP 513 HB2 ASP 513 6.694 -0.811 5.390 244 HB3 ASP 513 HB3 ASP 513 4.969 -0.803 5.032 245 H ILE 514 H ILE 514 4.026 -3.269 7.030 246 HA ILE 514 HA ILE 514 1.477 -2.330 6.569 247 HB ILE 514 HB ILE 514 2.246 -4.719 8.251 248 HG12 ILE 514 HG12 ILE 514 1.350 -4.847 5.396 249 HG13 ILE 514 HG13 ILE 514 3.022 -4.425 5.754 250 HG21 ILE 514 HG21 ILE 514 -0.360 -3.800 7.101 251 HG22 ILE 514 HG22 ILE 514 -0.045 -5.515 7.360 252 HG23 ILE 514 HG23 ILE 514 -0.003 -4.396 8.722 253 HD11 ILE 514 HD11 ILE 514 2.616 -6.838 5.287 254 HD12 ILE 514 HD12 ILE 514 3.391 -6.508 6.837 255 HD13 ILE 514 HD13 ILE 514 1.674 -6.908 6.777 256 H SER 515 H SER 515 -0.243 -1.680 7.822 257 HA SER 515 HA SER 515 0.403 -0.983 10.612 258 HB2 SER 515 HB2 SER 515 -0.078 0.835 8.731 259 HB3 SER 515 HB3 SER 515 -1.753 0.463 9.139 260 HG SER 515 HG SER 515 0.234 1.179 11.035 261 H SER 516 H SER 516 -1.645 -0.675 11.965 262 HA SER 516 HA SER 516 -3.029 -3.142 12.044 263 HB2 SER 516 HB2 SER 516 -2.508 -1.391 13.939 264 HB3 SER 516 HB3 SER 516 -4.070 -0.720 13.468 265 HG SER 516 HG SER 516 -4.878 -2.225 14.680 266 H ARG 517 H ARG 517 -3.655 -0.144 10.465 267 HA ARG 517 HA ARG 517 -6.464 -0.800 10.014 268 HB2 ARG 517 HB2 ARG 517 -6.522 1.423 8.868 269 HB3 ARG 517 HB3 ARG 517 -6.055 1.497 10.562 270 HG2 ARG 517 HG2 ARG 517 -3.780 1.859 10.011 271 HG3 ARG 517 HG3 ARG 517 -4.063 1.471 8.313 272 HD2 ARG 517 HD2 ARG 517 -5.557 3.723 9.580 273 HD3 ARG 517 HD3 ARG 517 -3.878 3.961 9.095 274 HE ARG 517 HE ARG 517 -5.029 2.892 6.887 275 HH11 ARG 517 HH11 ARG 517 -5.802 5.601 8.933 276 HH12 ARG 517 HH12 ARG 517 -6.535 6.520 7.660 277 HH21 ARG 517 HH21 ARG 517 -5.991 4.092 5.203 278 HH22 ARG 517 HH22 ARG 517 -6.643 5.661 5.539 279 H TYR 518 H TYR 518 -3.401 -0.612 8.326 280 HA TYR 518 HA TYR 518 -4.329 -0.756 5.688 281 HB2 TYR 518 HB2 TYR 518 -1.846 -0.702 6.943 282 HB3 TYR 518 HB3 TYR 518 -1.866 -2.250 6.105 283 HD1 TYR 518 HD1 TYR 518 -3.268 -1.758 3.652 284 HD2 TYR 518 HD2 TYR 518 -0.574 0.795 5.732 285 HE1 TYR 518 HE1 TYR 518 -2.721 -0.624 1.539 286 HE2 TYR 518 HE2 TYR 518 -0.020 1.937 3.625 287 HH TYR 518 HH TYR 518 -0.838 2.286 1.450 288 H ILE 519 H ILE 519 -3.719 -3.267 8.081 289 HA ILE 519 HA ILE 519 -3.871 -5.522 6.464 290 HB ILE 519 HB ILE 519 -4.859 -5.217 9.302 291 HG12 ILE 519 HG12 ILE 519 -2.303 -6.575 8.696 292 HG13 ILE 519 HG13 ILE 519 -2.322 -4.836 8.426 293 HG21 ILE 519 HG21 ILE 519 -4.195 -7.688 7.707 294 HG22 ILE 519 HG22 ILE 519 -4.525 -7.659 9.438 295 HG23 ILE 519 HG23 ILE 519 -5.787 -7.206 8.293 296 HD11 ILE 519 HD11 ILE 519 -3.284 -4.685 10.796 297 HD12 ILE 519 HD12 ILE 519 -2.722 -6.347 10.974 298 HD13 ILE 519 HD13 ILE 519 -1.572 -5.062 10.607 299 H GLY 520 H GLY 520 -5.529 -6.840 5.761 300 HA2 GLY 520 HA2 GLY 520 -8.025 -5.540 5.234 301 HA3 GLY 520 HA3 GLY 520 -7.591 -7.182 4.784 302 H ASN 521 H ASN 521 -8.886 -8.650 5.640 303 HA ASN 521 HA ASN 521 -10.347 -8.026 8.088 304 HB2 ASN 521 HB2 ASN 521 -10.643 -10.334 6.152 305 HB3 ASN 521 HB3 ASN 521 -11.692 -10.022 7.532 306 HD21 ASN 521 HD21 ASN 521 -11.723 -9.890 4.379 307 HD22 ASN 521 HD22 ASN 521 -12.679 -8.479 4.096 308 H ILE 522 H ILE 522 -9.794 -8.818 10.006 309 HA ILE 522 HA ILE 522 -7.968 -11.131 10.089 310 HB ILE 522 HB ILE 522 -8.134 -8.958 12.173 311 HG12 ILE 522 HG12 ILE 522 -5.658 -8.810 10.869 312 HG13 ILE 522 HG13 ILE 522 -6.846 -8.951 9.578 313 HG21 ILE 522 HG21 ILE 522 -5.714 -10.597 11.865 314 HG22 ILE 522 HG22 ILE 522 -6.558 -10.078 13.323 315 HG23 ILE 522 HG23 ILE 522 -7.148 -11.466 12.410 316 HD11 ILE 522 HD11 ILE 522 -6.201 -6.698 11.243 317 HD12 ILE 522 HD12 ILE 522 -7.170 -6.772 9.771 318 HD13 ILE 522 HD13 ILE 522 -7.919 -7.084 11.337 319 H LYS 523 H LYS 523 -8.543 -12.843 11.289 320 HA LYS 523 HA LYS 523 -10.934 -12.578 12.992 321 HB2 LYS 523 HB2 LYS 523 -11.048 -13.968 10.797 322 HB3 LYS 523 HB3 LYS 523 -10.122 -15.163 11.696 323 HG2 LYS 523 HG2 LYS 523 -11.979 -14.924 13.474 324 HG3 LYS 523 HG3 LYS 523 -12.911 -14.195 12.164 325 HD2 LYS 523 HD2 LYS 523 -11.569 -16.884 11.948 326 HD3 LYS 523 HD3 LYS 523 -13.239 -16.673 12.480 327 HE2 LYS 523 HE2 LYS 523 -13.966 -16.055 10.401 328 HE3 LYS 523 HE3 LYS 523 -12.406 -15.377 9.938 329 HZ1 LYS 523 HZ1 LYS 523 -12.623 -17.305 8.672 330 HZ2 LYS 523 HZ2 LYS 523 -13.236 -18.213 9.961 331 HZ3 LYS 523 HZ3 LYS 523 -11.603 -17.771 9.939 332 H LEU 524 H LEU 524 -11.034 -13.932 14.867 333 HA LEU 524 HA LEU 524 -8.549 -15.208 15.708 334 HB2 LEU 524 HB2 LEU 524 -8.572 -12.784 16.437 335 HB3 LEU 524 HB3 LEU 524 -9.930 -13.206 17.478 336 HG LEU 524 HG LEU 524 -7.687 -13.090 18.604 337 HD11 LEU 524 HD11 LEU 524 -8.749 -15.867 18.844 338 HD12 LEU 524 HD12 LEU 524 -9.778 -14.500 19.271 339 HD13 LEU 524 HD13 LEU 524 -8.242 -14.742 20.104 340 HD21 LEU 524 HD21 LEU 524 -6.041 -14.694 18.229 341 HD22 LEU 524 HD22 LEU 524 -6.564 -14.253 16.604 342 HD23 LEU 524 HD23 LEU 524 -7.137 -15.751 17.339 343 H PHE 525 H PHE 525 -9.589 -17.186 15.675 344 HA PHE 525 HA PHE 525 -12.008 -17.536 17.260 345 HB2 PHE 525 HB2 PHE 525 -11.085 -18.720 14.931 346 HB3 PHE 525 HB3 PHE 525 -10.822 -19.961 16.152 347 HD1 PHE 525 HD1 PHE 525 -12.503 -21.496 16.332 348 HD2 PHE 525 HD2 PHE 525 -13.491 -17.480 15.328 349 HE1 PHE 525 HE1 PHE 525 -14.882 -22.114 16.218 350 HE2 PHE 525 HE2 PHE 525 -15.871 -18.090 15.214 351 HZ PHE 525 HZ PHE 525 -16.570 -20.409 15.660 352 H ALA 526 H ALA 526 -11.717 -20.111 18.171 353 HA ALA 526 HA ALA 526 -10.222 -19.704 20.559 354 HB1 ALA 526 HB1 ALA 526 -12.277 -21.401 19.735 355 HB2 ALA 526 HB2 ALA 526 -10.927 -22.464 20.134 356 HB3 ALA 526 HB3 ALA 526 -11.534 -21.321 21.332 357 H SER 527 H SER 527 -9.651 -21.448 17.569 358 HA SER 527 HA SER 527 -6.858 -21.791 18.341 359 HB2 SER 527 HB2 SER 527 -8.635 -24.066 17.431 360 HB3 SER 527 HB3 SER 527 -6.876 -24.156 17.521 361 HG SER 527 HG SER 527 -6.980 -23.937 19.718 362 H HIS 528 H HIS 528 -8.278 -20.071 16.474 363 HA HIS 528 HA HIS 528 -6.667 -20.621 14.137 364 HB2 HIS 528 HB2 HIS 528 -9.678 -20.666 14.053 365 HB3 HIS 528 HB3 HIS 528 -8.717 -20.278 12.629 366 HD1 HIS 528 HD1 HIS 528 -7.271 -22.207 11.619 367 HD2 HIS 528 HD2 HIS 528 -9.755 -23.350 14.748 368 HE1 HIS 528 HE1 HIS 528 -7.332 -24.720 11.546 369 H SER 529 H SER 529 -6.779 -18.814 12.552 370 HA SER 529 HA SER 529 -7.988 -16.342 13.280 371 HB2 SER 529 HB2 SER 529 -5.404 -15.410 13.392 372 HB3 SER 529 HB3 SER 529 -6.443 -15.682 14.790 373 HG SER 529 HG SER 529 -4.975 -17.060 15.372 374 H THR 530 H THR 530 -8.153 -15.073 11.530 375 HA THR 530 HA THR 530 -6.563 -15.817 9.165 376 HB THR 530 HB THR 530 -8.344 -15.093 7.768 377 HG1 THR 530 HG1 THR 530 -10.021 -13.868 8.482 378 HG21 THR 530 HG21 THR 530 -8.618 -17.209 9.441 379 HG22 THR 530 HG22 THR 530 -9.758 -16.812 8.156 380 HG23 THR 530 HG23 THR 530 -10.085 -16.304 9.812 381 H ILE 531 H ILE 531 -6.214 -13.998 7.594 382 HA ILE 531 HA ILE 531 -6.314 -11.301 8.408 383 HB ILE 531 HB ILE 531 -4.604 -11.876 10.008 384 HG12 ILE 531 HG12 ILE 531 -3.093 -10.569 7.761 385 HG13 ILE 531 HG13 ILE 531 -4.464 -9.758 8.511 386 HG21 ILE 531 HG21 ILE 531 -2.985 -12.925 7.691 387 HG22 ILE 531 HG22 ILE 531 -2.486 -12.866 9.381 388 HG23 ILE 531 HG23 ILE 531 -3.810 -13.922 8.889 389 HD11 ILE 531 HD11 ILE 531 -3.212 -10.222 10.724 390 HD12 ILE 531 HD12 ILE 531 -1.809 -10.453 9.679 391 HD13 ILE 531 HD13 ILE 531 -2.667 -8.912 9.676 392 H GLU 532 H GLU 532 -5.797 -9.924 6.747 393 HA GLU 532 HA GLU 532 -4.714 -11.171 4.306 394 HB2 GLU 532 HB2 GLU 532 -7.165 -10.685 4.194 395 HB3 GLU 532 HB3 GLU 532 -6.794 -8.982 4.422 396 HG2 GLU 532 HG2 GLU 532 -5.974 -8.730 2.317 397 HG3 GLU 532 HG3 GLU 532 -5.432 -10.403 2.207 398 H LEU 533 H LEU 533 -2.955 -10.242 3.492 399 HA LEU 533 HA LEU 533 -2.242 -7.547 4.440 400 HB2 LEU 533 HB2 LEU 533 -0.735 -10.023 4.132 401 HB3 LEU 533 HB3 LEU 533 0.055 -8.637 3.383 402 HG LEU 533 HG LEU 533 0.141 -7.478 5.484 403 HD11 LEU 533 HD11 LEU 533 -1.627 -7.844 6.819 404 HD12 LEU 533 HD12 LEU 533 -0.621 -9.129 7.487 405 HD13 LEU 533 HD13 LEU 533 -1.836 -9.506 6.265 406 HD21 LEU 533 HD21 LEU 533 1.594 -8.964 6.751 407 HD22 LEU 533 HD22 LEU 533 1.917 -9.101 5.022 408 HD23 LEU 533 HD23 LEU 533 0.986 -10.351 5.848 409 HA PRO 534 HA PRO 534 -2.698 -6.159 0.270 410 HB2 PRO 534 HB2 PRO 534 -1.413 -3.783 0.541 411 HB3 PRO 534 HB3 PRO 534 -3.038 -4.074 1.173 412 HG2 PRO 534 HG2 PRO 534 -0.411 -4.123 2.607 413 HG3 PRO 534 HG3 PRO 534 -1.955 -3.421 3.124 414 HD2 PRO 534 HD2 PRO 534 -1.074 -5.821 4.017 415 HD3 PRO 534 HD3 PRO 534 -2.798 -5.457 3.801 416 H LYS 535 H LYS 535 0.196 -7.046 1.749 417 HA LYS 535 HA LYS 535 2.244 -6.167 0.182 418 HB2 LYS 535 HB2 LYS 535 1.836 -8.994 1.174 419 HB3 LYS 535 HB3 LYS 535 3.368 -8.323 0.630 420 HG2 LYS 535 HG2 LYS 535 1.768 -7.372 2.998 421 HG3 LYS 535 HG3 LYS 535 3.227 -8.364 3.057 422 HD2 LYS 535 HD2 LYS 535 3.052 -5.573 1.922 423 HD3 LYS 535 HD3 LYS 535 3.697 -5.993 3.511 424 HE2 LYS 535 HE2 LYS 535 4.784 -6.859 0.834 425 HE3 LYS 535 HE3 LYS 535 5.510 -5.691 1.937 426 HZ1 LYS 535 HZ1 LYS 535 6.661 -7.657 2.329 427 HZ2 LYS 535 HZ2 LYS 535 5.270 -8.617 2.258 428 HZ3 LYS 535 HZ3 LYS 535 5.534 -7.609 3.591 429 H GLY 536 H GLY 536 3.191 -6.733 -1.770 430 HA2 GLY 536 HA2 GLY 536 1.556 -8.465 -3.520 431 HA3 GLY 536 HA3 GLY 536 2.216 -6.935 -4.079 432 H MET 537 H MET 537 3.746 -9.462 -2.113 433 HA MET 537 HA MET 537 5.245 -10.634 -4.175 434 HB2 MET 537 HB2 MET 537 6.185 -8.179 -3.915 435 HB3 MET 537 HB3 MET 537 7.040 -8.885 -2.550 436 HG2 MET 537 HG2 MET 537 8.522 -9.024 -4.353 437 HG3 MET 537 HG3 MET 537 7.872 -10.650 -4.156 438 HE1 MET 537 HE1 MET 537 8.560 -9.467 -8.041 439 HE2 MET 537 HE2 MET 537 8.834 -8.163 -6.886 440 HE3 MET 537 HE3 MET 537 9.448 -9.782 -6.550 441 HA PRO 538 HA PRO 538 5.206 -12.627 0.047 442 HB2 PRO 538 HB2 PRO 538 4.037 -14.935 -0.775 443 HB3 PRO 538 HB3 PRO 538 3.111 -13.518 -0.267 444 HG2 PRO 538 HG2 PRO 538 3.780 -14.453 -3.031 445 HG3 PRO 538 HG3 PRO 538 2.246 -13.824 -2.404 446 HD2 PRO 538 HD2 PRO 538 3.962 -12.305 -3.845 447 HD3 PRO 538 HD3 PRO 538 2.934 -11.630 -2.565 448 H GLY 539 H GLY 539 5.899 -15.083 0.409 449 HA2 GLY 539 HA2 GLY 539 7.353 -16.847 -0.149 450 HA3 GLY 539 HA3 GLY 539 7.883 -15.936 -1.555 451 H GLU 540 H GLU 540 7.847 -13.903 1.077 452 HA GLU 540 HA GLU 540 10.725 -13.877 1.205 453 HB2 GLU 540 HB2 GLU 540 8.876 -12.277 2.960 454 HB3 GLU 540 HB3 GLU 540 10.512 -11.882 2.453 455 HG2 GLU 540 HG2 GLU 540 9.533 -11.829 0.075 456 HG3 GLU 540 HG3 GLU 540 7.971 -11.732 0.886 457 H VAL 541 H VAL 541 8.140 -14.269 3.632 458 HA VAL 541 HA VAL 541 10.016 -15.274 5.584 459 HB VAL 541 HB VAL 541 7.001 -15.183 5.749 460 HG11 VAL 541 HG11 VAL 541 9.173 -15.619 7.782 461 HG12 VAL 541 HG12 VAL 541 7.539 -15.125 8.230 462 HG13 VAL 541 HG13 VAL 541 7.801 -16.660 7.402 463 HG21 VAL 541 HG21 VAL 541 7.606 -12.951 5.451 464 HG22 VAL 541 HG22 VAL 541 7.545 -13.131 7.204 465 HG23 VAL 541 HG23 VAL 541 9.100 -13.133 6.372 466 H LEU 542 H LEU 542 7.610 -16.568 3.391 467 HA LEU 542 HA LEU 542 7.407 -19.153 4.493 468 HB2 LEU 542 HB2 LEU 542 7.105 -18.364 1.601 469 HB3 LEU 542 HB3 LEU 542 6.452 -19.806 2.375 470 HG LEU 542 HG LEU 542 5.614 -16.994 3.071 471 HD11 LEU 542 HD11 LEU 542 4.481 -18.966 1.110 472 HD12 LEU 542 HD12 LEU 542 4.911 -17.277 0.849 473 HD13 LEU 542 HD13 LEU 542 3.506 -17.686 1.832 474 HD21 LEU 542 HD21 LEU 542 5.289 -18.683 4.829 475 HD22 LEU 542 HD22 LEU 542 4.365 -19.669 3.695 476 HD23 LEU 542 HD23 LEU 542 3.758 -18.087 4.186 477 H GLN 543 H GLN 543 9.859 -17.626 2.624 478 HA GLN 543 HA GLN 543 11.054 -20.094 1.708 479 HB2 GLN 543 HB2 GLN 543 11.579 -17.198 1.359 480 HB3 GLN 543 HB3 GLN 543 12.973 -18.264 1.248 481 HG2 GLN 543 HG2 GLN 543 10.512 -18.901 -0.307 482 HG3 GLN 543 HG3 GLN 543 11.607 -17.643 -0.879 483 HE21 GLN 543 HE21 GLN 543 13.922 -18.292 -1.021 484 HE22 GLN 543 HE22 GLN 543 14.269 -19.886 -1.589 485 H HIS 544 H HIS 544 12.161 -17.438 3.822 486 HA HIS 544 HA HIS 544 14.350 -18.907 4.866 487 HB2 HIS 544 HB2 HIS 544 12.944 -16.404 5.795 488 HB3 HIS 544 HB3 HIS 544 14.342 -17.073 6.631 489 HD1 HIS 544 HD1 HIS 544 13.828 -16.676 2.889 490 HD2 HIS 544 HD2 HIS 544 16.313 -15.338 5.938 491 HE1 HIS 544 HE1 HIS 544 15.617 -15.322 1.753 492 H PHE 545 H PHE 545 11.241 -17.972 6.342 493 HA PHE 545 HA PHE 545 11.680 -19.831 8.527 494 HB2 PHE 545 HB2 PHE 545 9.630 -17.732 7.913 495 HB3 PHE 545 HB3 PHE 545 9.287 -18.956 9.131 496 HD1 PHE 545 HD1 PHE 545 10.767 -19.144 11.127 497 HD2 PHE 545 HD2 PHE 545 11.063 -15.919 8.365 498 HE1 PHE 545 HE1 PHE 545 12.011 -17.833 12.797 499 HE2 PHE 545 HE2 PHE 545 12.308 -14.603 10.030 500 HZ PHE 545 HZ PHE 545 12.784 -15.559 12.249 501 H THR 546 H THR 546 11.577 -21.194 6.160 502 HA THR 546 HA THR 546 8.915 -22.181 5.664 503 HB THR 546 HB THR 546 10.701 -22.029 3.893 504 HG1 THR 546 HG1 THR 546 9.694 -23.618 2.870 505 HG21 THR 546 HG21 THR 546 11.757 -24.633 4.915 506 HG22 THR 546 HG22 THR 546 12.408 -23.121 5.547 507 HG23 THR 546 HG23 THR 546 12.506 -23.471 3.822 508 H ARG 547 H ARG 547 11.586 -23.029 7.687 509 HA ARG 547 HA ARG 547 10.324 -25.606 8.336 510 HB2 ARG 547 HB2 ARG 547 12.487 -26.234 9.323 511 HB3 ARG 547 HB3 ARG 547 12.648 -25.796 7.628 512 HG2 ARG 547 HG2 ARG 547 13.050 -23.560 9.461 513 HG3 ARG 547 HG3 ARG 547 14.213 -24.872 9.660 514 HD2 ARG 547 HD2 ARG 547 13.603 -23.979 6.897 515 HD3 ARG 547 HD3 ARG 547 14.567 -22.902 7.907 516 HE ARG 547 HE ARG 547 15.394 -25.395 6.757 517 HH11 ARG 547 HH11 ARG 547 15.913 -23.156 9.371 518 HH12 ARG 547 HH12 ARG 547 17.549 -23.655 9.648 519 HH21 ARG 547 HH21 ARG 547 17.547 -26.062 7.111 520 HH22 ARG 547 HH22 ARG 547 18.477 -25.308 8.361 521 H THR 548 H THR 548 11.086 -22.476 9.542 522 HA THR 548 HA THR 548 10.231 -23.292 12.243 523 HB THR 548 HB THR 548 11.967 -20.940 11.465 524 HG1 THR 548 HG1 THR 548 13.322 -22.626 11.487 525 HG21 THR 548 HG21 THR 548 11.061 -21.891 14.186 526 HG22 THR 548 HG22 THR 548 10.541 -20.413 13.377 527 HG23 THR 548 HG23 THR 548 12.220 -20.597 13.884 528 H ARG 549 H ARG 549 8.524 -22.283 13.165 529 HA ARG 549 HA ARG 549 7.503 -19.791 12.117 530 HB2 ARG 549 HB2 ARG 549 6.104 -22.409 11.694 531 HB3 ARG 549 HB3 ARG 549 5.167 -20.935 11.903 532 HG2 ARG 549 HG2 ARG 549 5.371 -20.646 9.713 533 HG3 ARG 549 HG3 ARG 549 7.061 -20.239 10.020 534 HD2 ARG 549 HD2 ARG 549 6.832 -21.955 8.282 535 HD3 ARG 549 HD3 ARG 549 7.703 -22.556 9.692 536 HE ARG 549 HE ARG 549 4.870 -23.105 9.700 537 HH11 ARG 549 HH11 ARG 549 8.035 -24.223 8.775 538 HH12 ARG 549 HH12 ARG 549 7.569 -25.891 8.708 539 HH21 ARG 549 HH21 ARG 549 4.245 -25.297 9.616 540 HH22 ARG 549 HH22 ARG 549 5.413 -26.500 9.186 541 H ILE 550 H ILE 550 5.271 -19.353 13.289 542 HA ILE 550 HA ILE 550 4.929 -20.536 15.863 543 HB ILE 550 HB ILE 550 6.991 -18.932 16.026 544 HG12 ILE 550 HG12 ILE 550 5.141 -18.215 18.185 545 HG13 ILE 550 HG13 ILE 550 5.165 -19.939 17.827 546 HG21 ILE 550 HG21 ILE 550 6.658 -16.692 16.065 547 HG22 ILE 550 HG22 ILE 550 5.330 -17.116 14.986 548 HG23 ILE 550 HG23 ILE 550 5.019 -16.834 16.699 549 HD11 ILE 550 HD11 ILE 550 7.668 -18.357 18.308 550 HD12 ILE 550 HD12 ILE 550 6.757 -19.130 19.606 551 HD13 ILE 550 HD13 ILE 550 7.458 -20.108 18.316 552 H LEU 551 H LEU 551 3.495 -18.864 17.247 553 HA LEU 551 HA LEU 551 1.011 -18.752 16.264 554 HB2 LEU 551 HB2 LEU 551 0.501 -16.951 17.782 555 HB3 LEU 551 HB3 LEU 551 1.632 -18.072 18.537 556 HG LEU 551 HG LEU 551 3.375 -16.271 17.588 557 HD11 LEU 551 HD11 LEU 551 2.590 -14.188 17.282 558 HD12 LEU 551 HD12 LEU 551 1.355 -14.354 18.530 559 HD13 LEU 551 HD13 LEU 551 1.076 -15.019 16.921 560 HD21 LEU 551 HD21 LEU 551 3.185 -15.185 19.875 561 HD22 LEU 551 HD22 LEU 551 3.428 -16.931 19.847 562 HD23 LEU 551 HD23 LEU 551 1.824 -16.269 20.163 563 H ASN 552 H ASN 552 3.492 -16.298 15.672 564 HA ASN 552 HA ASN 552 1.759 -14.661 14.073 565 HB2 ASN 552 HB2 ASN 552 3.663 -13.721 15.350 566 HB3 ASN 552 HB3 ASN 552 4.775 -14.605 14.309 567 HD21 ASN 552 HD21 ASN 552 1.836 -12.754 13.613 568 HD22 ASN 552 HD22 ASN 552 2.582 -11.659 12.504 569 H LYS 553 H LYS 553 4.735 -16.458 13.262 570 HA LYS 553 HA LYS 553 4.387 -16.305 10.479 571 HB2 LYS 553 HB2 LYS 553 5.818 -18.606 11.758 572 HB3 LYS 553 HB3 LYS 553 6.234 -17.712 10.302 573 HG2 LYS 553 HG2 LYS 553 6.557 -16.827 13.156 574 HG3 LYS 553 HG3 LYS 553 7.823 -17.148 11.970 575 HD2 LYS 553 HD2 LYS 553 6.676 -15.276 10.597 576 HD3 LYS 553 HD3 LYS 553 5.923 -14.836 12.131 577 HE2 LYS 553 HE2 LYS 553 7.778 -13.554 12.322 578 HE3 LYS 553 HE3 LYS 553 8.464 -15.055 12.943 579 HZ1 LYS 553 HZ1 LYS 553 8.689 -14.025 10.167 580 HZ2 LYS 553 HZ2 LYS 553 9.258 -15.534 10.678 581 HZ3 LYS 553 HZ3 LYS 553 9.930 -14.118 11.314 582 HA PRO 554 HA PRO 554 1.500 -19.436 9.428 583 HB2 PRO 554 HB2 PRO 554 2.635 -20.612 7.260 584 HB3 PRO 554 HB3 PRO 554 1.940 -18.987 7.218 585 HG2 PRO 554 HG2 PRO 554 4.805 -19.815 7.485 586 HG3 PRO 554 HG3 PRO 554 4.101 -18.522 6.497 587 HD2 PRO 554 HD2 PRO 554 5.314 -18.046 8.870 588 HD3 PRO 554 HD3 PRO 554 3.957 -17.067 8.279 589 H MET 555 H MET 555 2.063 -20.588 11.484 590 HA MET 555 HA MET 555 3.923 -22.704 11.546 591 HB2 MET 555 HB2 MET 555 3.121 -21.836 13.617 592 HB3 MET 555 HB3 MET 555 1.446 -22.138 13.172 593 HG2 MET 555 HG2 MET 555 2.168 -23.762 14.790 594 HG3 MET 555 HG3 MET 555 1.878 -24.551 13.241 595 HE1 MET 555 HE1 MET 555 4.804 -26.715 14.579 596 HE2 MET 555 HE2 MET 555 3.337 -26.134 15.366 597 HE3 MET 555 HE3 MET 555 3.269 -26.740 13.710 598 H ASN 556 H ASN 556 0.386 -22.752 11.095 599 HA ASN 556 HA ASN 556 0.655 -25.088 9.383 600 HB2 ASN 556 HB2 ASN 556 0.318 -25.797 11.849 601 HB3 ASN 556 HB3 ASN 556 -1.331 -25.214 11.639 602 HD21 ASN 556 HD21 ASN 556 0.624 -27.855 11.451 603 HD22 ASN 556 HD22 ASN 556 -0.341 -28.852 10.422 604 H MET 557 H MET 557 0.024 -22.583 8.554 605 HA MET 557 HA MET 557 -2.884 -22.413 8.364 606 HB2 MET 557 HB2 MET 557 -2.511 -20.233 7.346 607 HB3 MET 557 HB3 MET 557 -1.613 -20.362 8.852 608 HG2 MET 557 HG2 MET 557 0.068 -19.527 7.637 609 HG3 MET 557 HG3 MET 557 0.257 -21.194 7.099 610 HE1 MET 557 HE1 MET 557 1.087 -20.871 4.239 611 HE2 MET 557 HE2 MET 557 0.110 -22.042 5.123 612 HE3 MET 557 HE3 MET 557 -0.483 -21.365 3.606 613 H GLN 558 H GLN 558 -3.547 -21.529 6.030 614 HA GLN 558 HA GLN 558 -2.179 -22.773 3.837 615 HB2 GLN 558 HB2 GLN 558 -3.772 -24.426 3.251 616 HB3 GLN 558 HB3 GLN 558 -3.432 -24.667 4.959 617 HG2 GLN 558 HG2 GLN 558 -5.493 -23.356 5.473 618 HG3 GLN 558 HG3 GLN 558 -5.854 -23.364 3.748 619 HE21 GLN 558 HE21 GLN 558 -7.817 -24.448 4.383 620 HE22 GLN 558 HE22 GLN 558 -7.802 -26.154 4.653 621 H LEU 559 H LEU 559 -2.644 -21.754 1.973 622 HA LEU 559 HA LEU 559 -4.150 -19.392 1.969 623 HB2 LEU 559 HB2 LEU 559 -2.306 -19.842 0.421 624 HB3 LEU 559 HB3 LEU 559 -3.278 -21.080 -0.373 625 HG LEU 559 HG LEU 559 -3.053 -18.779 -1.496 626 HD11 LEU 559 HD11 LEU 559 -5.056 -19.107 -2.592 627 HD12 LEU 559 HD12 LEU 559 -5.901 -19.599 -1.125 628 HD13 LEU 559 HD13 LEU 559 -4.757 -20.699 -1.894 629 HD21 LEU 559 HD21 LEU 559 -4.634 -17.094 -0.780 630 HD22 LEU 559 HD22 LEU 559 -3.521 -17.467 0.537 631 HD23 LEU 559 HD23 LEU 559 -5.161 -18.117 0.557 632 H LEU 560 H LEU 560 -6.270 -19.103 1.939 633 HA LEU 560 HA LEU 560 -7.958 -21.191 0.723 634 HB2 LEU 560 HB2 LEU 560 -9.567 -20.899 2.356 635 HB3 LEU 560 HB3 LEU 560 -8.060 -20.768 3.260 636 HG LEU 560 HG LEU 560 -8.543 -18.160 2.677 637 HD11 LEU 560 HD11 LEU 560 -10.904 -19.366 1.943 638 HD12 LEU 560 HD12 LEU 560 -10.691 -17.665 2.354 639 HD13 LEU 560 HD13 LEU 560 -11.228 -18.808 3.585 640 HD21 LEU 560 HD21 LEU 560 -8.704 -17.934 4.923 641 HD22 LEU 560 HD22 LEU 560 -8.203 -19.625 4.891 642 HD23 LEU 560 HD23 LEU 560 -9.909 -19.213 5.078 643 H GLY 561 H GLY 561 -7.190 -17.815 0.901 644 HA2 GLY 561 HA2 GLY 561 -9.517 -17.051 -0.685 645 HA3 GLY 561 HA3 GLY 561 -8.308 -15.964 -0.021 646 H ASP 562 H ASP 562 -8.273 -14.928 -2.097 647 HA ASP 562 HA ASP 562 -6.212 -15.978 -3.788 648 HB2 ASP 562 HB2 ASP 562 -8.358 -17.130 -4.563 649 HB3 ASP 562 HB3 ASP 562 -8.885 -15.542 -5.115 650 H ALA 563 H ALA 563 -5.386 -14.430 -5.247 651 HA ALA 563 HA ALA 563 -5.669 -11.738 -4.382 652 HB1 ALA 563 HB1 ALA 563 -3.782 -13.181 -5.809 653 HB2 ALA 563 HB2 ALA 563 -4.400 -12.006 -6.970 654 HB3 ALA 563 HB3 ALA 563 -3.728 -11.458 -5.434 655 H GLN 564 H GLN 564 -7.024 -10.203 -5.045 656 HA GLN 564 HA GLN 564 -9.175 -10.687 -6.745 657 HB2 GLN 564 HB2 GLN 564 -8.655 -8.760 -4.992 658 HB3 GLN 564 HB3 GLN 564 -8.178 -7.894 -6.446 659 HG2 GLN 564 HG2 GLN 564 -10.377 -7.290 -6.256 660 HG3 GLN 564 HG3 GLN 564 -10.490 -8.674 -7.343 661 HE21 GLN 564 HE21 GLN 564 -12.312 -9.684 -6.887 662 HE22 GLN 564 HE22 GLN 564 -12.856 -10.132 -5.310 Start of MODEL 3 1 H MET 480 H MET 480 -0.071 0.248 -4.038 2 HA MET 480 HA MET 480 0.189 0.704 -1.140 3 HB2 MET 480 HB2 MET 480 -1.573 -0.978 -0.846 4 HB3 MET 480 HB3 MET 480 -2.125 0.359 -1.845 5 HG2 MET 480 HG2 MET 480 -2.843 -1.191 -3.260 6 HG3 MET 480 HG3 MET 480 -1.150 -1.415 -3.694 7 HE1 MET 480 HE1 MET 480 -3.594 -4.779 -2.896 8 HE2 MET 480 HE2 MET 480 -4.315 -3.222 -2.488 9 HE3 MET 480 HE3 MET 480 -3.528 -3.447 -4.051 10 H ALA 481 H ALA 481 0.912 -1.431 -3.805 11 HA ALA 481 HA ALA 481 2.981 -2.715 -2.264 12 HB1 ALA 481 HB1 ALA 481 2.076 -5.029 -2.871 13 HB2 ALA 481 HB2 ALA 481 1.312 -4.178 -1.528 14 HB3 ALA 481 HB3 ALA 481 0.527 -4.220 -3.106 15 H ASP 482 H ASP 482 3.770 -4.723 -3.780 16 HA ASP 482 HA ASP 482 4.808 -3.467 -6.101 17 HB2 ASP 482 HB2 ASP 482 5.515 -5.648 -4.580 18 HB3 ASP 482 HB3 ASP 482 4.947 -6.396 -6.071 19 H VAL 483 H VAL 483 2.292 -5.897 -5.578 20 HA VAL 483 HA VAL 483 1.336 -5.382 -8.311 21 HB VAL 483 HB VAL 483 2.459 -7.511 -8.436 22 HG11 VAL 483 HG11 VAL 483 2.362 -7.985 -5.988 23 HG12 VAL 483 HG12 VAL 483 0.681 -8.478 -6.202 24 HG13 VAL 483 HG13 VAL 483 1.973 -9.370 -7.008 25 HG21 VAL 483 HG21 VAL 483 -0.488 -8.095 -8.241 26 HG22 VAL 483 HG22 VAL 483 0.229 -7.173 -9.563 27 HG23 VAL 483 HG23 VAL 483 0.702 -8.851 -9.301 28 H GLY 484 H GLY 484 0.598 -6.572 -5.063 29 HA2 GLY 484 HA2 GLY 484 -1.388 -5.519 -4.020 30 HA3 GLY 484 HA3 GLY 484 -2.221 -5.822 -5.537 31 H ASP 485 H ASP 485 -0.030 -8.174 -4.213 32 HA ASP 485 HA ASP 485 -1.772 -10.309 -4.356 33 HB2 ASP 485 HB2 ASP 485 0.822 -10.146 -3.834 34 HB3 ASP 485 HB3 ASP 485 0.263 -10.299 -2.171 35 H MET 486 H MET 486 -3.763 -10.208 -3.482 36 HA MET 486 HA MET 486 -3.934 -9.717 -0.581 37 HB2 MET 486 HB2 MET 486 -5.026 -7.885 -1.630 38 HB3 MET 486 HB3 MET 486 -5.841 -8.935 -2.780 39 HG2 MET 486 HG2 MET 486 -7.487 -9.467 -1.340 40 HG3 MET 486 HG3 MET 486 -6.416 -9.450 0.059 41 HE1 MET 486 HE1 MET 486 -9.067 -7.887 -1.892 42 HE2 MET 486 HE2 MET 486 -9.150 -6.186 -1.432 43 HE3 MET 486 HE3 MET 486 -7.949 -6.725 -2.607 44 H GLN 487 H GLN 487 -4.482 -11.468 0.522 45 HA GLN 487 HA GLN 487 -6.551 -13.243 -0.462 46 HB2 GLN 487 HB2 GLN 487 -3.795 -14.307 0.179 47 HB3 GLN 487 HB3 GLN 487 -5.205 -15.270 -0.242 48 HG2 GLN 487 HG2 GLN 487 -5.245 -14.229 -2.458 49 HG3 GLN 487 HG3 GLN 487 -3.814 -13.291 -2.033 50 HE21 GLN 487 HE21 GLN 487 -1.831 -14.377 -1.744 51 HE22 GLN 487 HE22 GLN 487 -1.552 -15.930 -2.447 52 H LEU 488 H LEU 488 -6.848 -15.100 1.220 53 HA LEU 488 HA LEU 488 -6.637 -13.889 3.897 54 HB2 LEU 488 HB2 LEU 488 -8.931 -14.209 2.854 55 HB3 LEU 488 HB3 LEU 488 -8.663 -15.940 3.043 56 HG LEU 488 HG LEU 488 -8.443 -15.578 5.495 57 HD11 LEU 488 HD11 LEU 488 -9.711 -13.228 5.996 58 HD12 LEU 488 HD12 LEU 488 -8.688 -12.790 4.628 59 HD13 LEU 488 HD13 LEU 488 -7.967 -13.470 6.087 60 HD21 LEU 488 HD21 LEU 488 -10.629 -15.985 5.706 61 HD22 LEU 488 HD22 LEU 488 -10.700 -15.806 3.953 62 HD23 LEU 488 HD23 LEU 488 -11.078 -14.434 4.995 63 H TYR 489 H TYR 489 -5.023 -14.820 4.975 64 HA TYR 489 HA TYR 489 -4.577 -17.706 4.656 65 HB2 TYR 489 HB2 TYR 489 -2.673 -15.931 6.127 66 HB3 TYR 489 HB3 TYR 489 -2.347 -17.380 5.183 67 HD1 TYR 489 HD1 TYR 489 -3.017 -13.766 5.007 68 HD2 TYR 489 HD2 TYR 489 -1.966 -17.258 2.815 69 HE1 TYR 489 HE1 TYR 489 -2.385 -12.364 3.088 70 HE2 TYR 489 HE2 TYR 489 -1.329 -15.865 0.890 71 HH TYR 489 HH TYR 489 -1.975 -12.436 0.810 72 H ARG 490 H ARG 490 -5.516 -18.929 6.143 73 HA ARG 490 HA ARG 490 -5.935 -17.843 8.837 74 HB2 ARG 490 HB2 ARG 490 -7.563 -19.657 9.121 75 HB3 ARG 490 HB3 ARG 490 -7.936 -18.673 7.712 76 HG2 ARG 490 HG2 ARG 490 -8.152 -20.622 6.652 77 HG3 ARG 490 HG3 ARG 490 -6.387 -20.633 6.625 78 HD2 ARG 490 HD2 ARG 490 -6.253 -22.290 8.140 79 HD3 ARG 490 HD3 ARG 490 -7.581 -21.647 9.105 80 HE ARG 490 HE ARG 490 -8.735 -22.664 6.821 81 HH11 ARG 490 HH11 ARG 490 -6.785 -23.887 9.433 82 HH12 ARG 490 HH12 ARG 490 -7.456 -25.483 9.360 83 HH21 ARG 490 HH21 ARG 490 -9.626 -24.761 6.715 84 HH22 ARG 490 HH22 ARG 490 -9.071 -25.979 7.814 85 H ILE 491 H ILE 491 -4.886 -18.631 10.557 86 HA ILE 491 HA ILE 491 -3.070 -20.899 10.121 87 HB ILE 491 HB ILE 491 -1.748 -20.090 11.951 88 HG12 ILE 491 HG12 ILE 491 -3.898 -17.996 12.335 89 HG13 ILE 491 HG13 ILE 491 -3.568 -19.346 13.416 90 HG21 ILE 491 HG21 ILE 491 -1.961 -17.451 10.921 91 HG22 ILE 491 HG22 ILE 491 -0.768 -18.692 10.537 92 HG23 ILE 491 HG23 ILE 491 -2.262 -18.586 9.606 93 HD11 ILE 491 HD11 ILE 491 -1.247 -18.365 13.685 94 HD12 ILE 491 HD12 ILE 491 -1.884 -16.922 12.895 95 HD13 ILE 491 HD13 ILE 491 -2.582 -17.475 14.417 96 H GLU 492 H GLU 492 -2.623 -22.204 12.161 97 HA GLU 492 HA GLU 492 -5.205 -22.992 13.294 98 HB2 GLU 492 HB2 GLU 492 -3.602 -24.629 12.129 99 HB3 GLU 492 HB3 GLU 492 -2.617 -24.502 13.580 100 HG2 GLU 492 HG2 GLU 492 -4.926 -25.067 14.746 101 HG3 GLU 492 HG3 GLU 492 -5.248 -25.801 13.175 102 H VAL 493 H VAL 493 -4.489 -20.713 14.433 103 HA VAL 493 HA VAL 493 -3.780 -21.528 17.148 104 HB VAL 493 HB VAL 493 -2.530 -19.067 15.941 105 HG11 VAL 493 HG11 VAL 493 -1.273 -18.931 17.903 106 HG12 VAL 493 HG12 VAL 493 -2.882 -19.386 18.465 107 HG13 VAL 493 HG13 VAL 493 -1.612 -20.604 18.347 108 HG21 VAL 493 HG21 VAL 493 -1.684 -21.012 14.736 109 HG22 VAL 493 HG22 VAL 493 -0.436 -20.327 15.778 110 HG23 VAL 493 HG23 VAL 493 -1.283 -21.796 16.264 111 H GLY 494 H GLY 494 -4.979 -20.541 18.675 112 HA2 GLY 494 HA2 GLY 494 -6.349 -18.035 18.021 113 HA3 GLY 494 HA3 GLY 494 -7.340 -19.423 18.447 114 H ARG 495 H ARG 495 -8.029 -17.815 20.131 115 HA ARG 495 HA ARG 495 -6.388 -16.929 22.191 116 HB2 ARG 495 HB2 ARG 495 -8.520 -16.934 23.567 117 HB3 ARG 495 HB3 ARG 495 -8.575 -16.032 22.058 118 HG2 ARG 495 HG2 ARG 495 -9.837 -17.736 20.988 119 HG3 ARG 495 HG3 ARG 495 -9.585 -18.850 22.334 120 HD2 ARG 495 HD2 ARG 495 -10.780 -17.088 23.761 121 HD3 ARG 495 HD3 ARG 495 -11.293 -16.384 22.228 122 HE ARG 495 HE ARG 495 -11.861 -19.183 22.410 123 HH11 ARG 495 HH11 ARG 495 -12.987 -16.003 23.268 124 HH12 ARG 495 HH12 ARG 495 -14.649 -16.478 23.375 125 HH21 ARG 495 HH21 ARG 495 -14.046 -19.821 22.547 126 HH22 ARG 495 HH22 ARG 495 -15.251 -18.650 22.966 127 H ASP 496 H ASP 496 -7.889 -20.052 21.678 128 HA ASP 496 HA ASP 496 -7.343 -21.065 24.293 129 HB2 ASP 496 HB2 ASP 496 -9.023 -21.876 22.394 130 HB3 ASP 496 HB3 ASP 496 -7.661 -22.912 21.975 131 H ASP 497 H ASP 497 -5.476 -20.602 21.474 132 HA ASP 497 HA ASP 497 -3.491 -22.602 22.243 133 HB2 ASP 497 HB2 ASP 497 -4.217 -22.228 19.832 134 HB3 ASP 497 HB3 ASP 497 -3.340 -20.702 19.903 135 H GLY 498 H GLY 498 -3.863 -19.101 21.930 136 HA2 GLY 498 HA2 GLY 498 -2.638 -17.966 23.866 137 HA3 GLY 498 HA3 GLY 498 -1.221 -18.762 23.197 138 H VAL 499 H VAL 499 -3.823 -17.341 21.303 139 HA VAL 499 HA VAL 499 -2.063 -15.109 20.569 140 HB VAL 499 HB VAL 499 -1.987 -17.047 18.886 141 HG11 VAL 499 HG11 VAL 499 -4.413 -15.997 17.608 142 HG12 VAL 499 HG12 VAL 499 -3.806 -17.651 17.711 143 HG13 VAL 499 HG13 VAL 499 -4.694 -16.950 19.065 144 HG21 VAL 499 HG21 VAL 499 -2.890 -14.453 17.680 145 HG22 VAL 499 HG22 VAL 499 -1.361 -14.580 18.549 146 HG23 VAL 499 HG23 VAL 499 -1.643 -15.563 17.113 147 H GLU 500 H GLU 500 -3.127 -13.243 19.823 148 HA GLU 500 HA GLU 500 -6.051 -13.240 20.169 149 HB2 GLU 500 HB2 GLU 500 -4.326 -10.903 20.948 150 HB3 GLU 500 HB3 GLU 500 -5.996 -11.226 21.390 151 HG2 GLU 500 HG2 GLU 500 -4.849 -13.364 22.499 152 HG3 GLU 500 HG3 GLU 500 -3.488 -12.245 22.567 153 H VAL 501 H VAL 501 -6.708 -10.753 19.451 154 HA VAL 501 HA VAL 501 -6.287 -10.780 16.614 155 HB VAL 501 HB VAL 501 -7.743 -8.781 18.349 156 HG11 VAL 501 HG11 VAL 501 -7.792 -7.482 16.545 157 HG12 VAL 501 HG12 VAL 501 -7.021 -8.723 15.557 158 HG13 VAL 501 HG13 VAL 501 -8.773 -8.719 15.761 159 HG21 VAL 501 HG21 VAL 501 -9.701 -9.952 17.944 160 HG22 VAL 501 HG22 VAL 501 -9.033 -10.788 16.542 161 HG23 VAL 501 HG23 VAL 501 -8.526 -11.248 18.167 162 H ARG 502 H ARG 502 -5.075 -8.933 19.325 163 HA ARG 502 HA ARG 502 -3.767 -6.996 17.597 164 HB2 ARG 502 HB2 ARG 502 -2.936 -6.045 19.757 165 HB3 ARG 502 HB3 ARG 502 -4.688 -6.117 19.627 166 HG2 ARG 502 HG2 ARG 502 -4.832 -7.925 21.121 167 HG3 ARG 502 HG3 ARG 502 -3.101 -8.251 21.015 168 HD2 ARG 502 HD2 ARG 502 -3.990 -5.584 21.990 169 HD3 ARG 502 HD3 ARG 502 -4.142 -6.967 23.072 170 HE ARG 502 HE ARG 502 -1.575 -7.076 22.098 171 HH11 ARG 502 HH11 ARG 502 -3.497 -4.776 23.869 172 HH12 ARG 502 HH12 ARG 502 -2.143 -4.097 24.711 173 HH21 ARG 502 HH21 ARG 502 0.215 -6.191 23.200 174 HH22 ARG 502 HH22 ARG 502 -0.033 -4.902 24.329 175 H HIS 503 H HIS 503 -3.127 -10.079 18.511 176 HA HIS 503 HA HIS 503 -0.296 -9.793 19.035 177 HB2 HIS 503 HB2 HIS 503 -2.023 -11.649 19.851 178 HB3 HIS 503 HB3 HIS 503 -1.499 -12.437 18.366 179 HD1 HIS 503 HD1 HIS 503 1.491 -11.043 18.937 180 HD2 HIS 503 HD2 HIS 503 -0.658 -13.774 21.214 181 HE1 HIS 503 HE1 HIS 503 3.196 -12.216 20.366 182 H ILE 504 H ILE 504 -2.227 -11.412 16.507 183 HA ILE 504 HA ILE 504 0.003 -11.802 14.785 184 HB ILE 504 HB ILE 504 -1.502 -12.670 13.202 185 HG12 ILE 504 HG12 ILE 504 -3.001 -10.645 13.227 186 HG13 ILE 504 HG13 ILE 504 -3.844 -12.184 13.082 187 HG21 ILE 504 HG21 ILE 504 -2.970 -14.148 14.503 188 HG22 ILE 504 HG22 ILE 504 -1.357 -14.032 15.204 189 HG23 ILE 504 HG23 ILE 504 -2.699 -13.146 15.928 190 HD11 ILE 504 HD11 ILE 504 -5.034 -10.766 14.599 191 HD12 ILE 504 HD12 ILE 504 -4.315 -12.096 15.508 192 HD13 ILE 504 HD13 ILE 504 -3.578 -10.495 15.556 193 H VAL 505 H VAL 505 -2.217 -9.195 15.298 194 HA VAL 505 HA VAL 505 -1.712 -7.896 12.779 195 HB VAL 505 HB VAL 505 -3.078 -6.954 15.299 196 HG11 VAL 505 HG11 VAL 505 -2.694 -4.875 14.580 197 HG12 VAL 505 HG12 VAL 505 -2.105 -5.434 13.014 198 HG13 VAL 505 HG13 VAL 505 -3.836 -5.236 13.287 199 HG21 VAL 505 HG21 VAL 505 -5.060 -7.487 14.303 200 HG22 VAL 505 HG22 VAL 505 -4.437 -7.240 12.672 201 HG23 VAL 505 HG23 VAL 505 -4.029 -8.709 13.558 202 H GLY 506 H GLY 506 -0.952 -7.054 16.169 203 HA2 GLY 506 HA2 GLY 506 0.751 -4.908 15.574 204 HA3 GLY 506 HA3 GLY 506 0.765 -5.828 17.071 205 H ALA 507 H ALA 507 1.289 -8.300 15.346 206 HA ALA 507 HA ALA 507 4.145 -8.196 15.581 207 HB1 ALA 507 HB1 ALA 507 3.130 -10.256 16.138 208 HB2 ALA 507 HB2 ALA 507 2.245 -10.317 14.613 209 HB3 ALA 507 HB3 ALA 507 3.996 -10.530 14.626 210 H ILE 508 H ILE 508 2.007 -8.906 12.809 211 HA ILE 508 HA ILE 508 4.065 -8.659 10.882 212 HB ILE 508 HB ILE 508 2.275 -8.648 9.211 213 HG12 ILE 508 HG12 ILE 508 -0.080 -9.077 10.524 214 HG13 ILE 508 HG13 ILE 508 0.674 -7.870 11.560 215 HG21 ILE 508 HG21 ILE 508 1.158 -10.676 10.974 216 HG22 ILE 508 HG22 ILE 508 2.014 -10.853 9.443 217 HG23 ILE 508 HG23 ILE 508 2.921 -10.681 10.945 218 HD11 ILE 508 HD11 ILE 508 -0.661 -7.523 9.070 219 HD12 ILE 508 HD12 ILE 508 -0.012 -6.303 10.166 220 HD13 ILE 508 HD13 ILE 508 1.013 -6.993 8.909 221 H ALA 509 H ALA 509 1.825 -6.385 12.310 222 HA ALA 509 HA ALA 509 2.177 -4.301 10.414 223 HB1 ALA 509 HB1 ALA 509 0.256 -4.418 11.945 224 HB2 ALA 509 HB2 ALA 509 1.335 -4.092 13.303 225 HB3 ALA 509 HB3 ALA 509 1.101 -2.873 12.050 226 H ASN 510 H ASN 510 4.023 -5.409 13.128 227 HA ASN 510 HA ASN 510 5.641 -2.975 13.169 228 HB2 ASN 510 HB2 ASN 510 4.822 -4.239 15.274 229 HB3 ASN 510 HB3 ASN 510 6.103 -5.390 14.902 230 HD21 ASN 510 HD21 ASN 510 6.781 -4.643 17.081 231 HD22 ASN 510 HD22 ASN 510 7.816 -3.262 17.167 232 H GLU 511 H GLU 511 5.703 -6.247 12.047 233 HA GLU 511 HA GLU 511 8.483 -6.615 11.813 234 HB2 GLU 511 HB2 GLU 511 6.080 -7.839 10.525 235 HB3 GLU 511 HB3 GLU 511 7.668 -8.180 9.853 236 HG2 GLU 511 HG2 GLU 511 6.814 -8.686 12.695 237 HG3 GLU 511 HG3 GLU 511 6.963 -9.900 11.425 238 H GLY 512 H GLY 512 6.104 -5.128 9.678 239 HA2 GLY 512 HA2 GLY 512 8.344 -4.125 8.039 240 HA3 GLY 512 HA3 GLY 512 6.885 -4.753 7.288 241 H ASP 513 H ASP 513 6.053 -2.981 6.334 242 HA ASP 513 HA ASP 513 5.822 -0.510 7.884 243 HB2 ASP 513 HB2 ASP 513 5.791 -1.188 4.987 244 HB3 ASP 513 HB3 ASP 513 4.839 0.202 5.501 245 H ILE 514 H ILE 514 3.997 -3.218 7.008 246 HA ILE 514 HA ILE 514 1.442 -2.280 6.581 247 HB ILE 514 HB ILE 514 2.238 -4.695 8.211 248 HG12 ILE 514 HG12 ILE 514 1.276 -4.823 5.387 249 HG13 ILE 514 HG13 ILE 514 2.936 -4.317 5.679 250 HG21 ILE 514 HG21 ILE 514 -0.043 -5.514 7.440 251 HG22 ILE 514 HG22 ILE 514 -0.023 -4.289 8.708 252 HG23 ILE 514 HG23 ILE 514 -0.392 -3.831 7.045 253 HD11 ILE 514 HD11 ILE 514 1.833 -6.837 6.862 254 HD12 ILE 514 HD12 ILE 514 2.505 -6.784 5.231 255 HD13 ILE 514 HD13 ILE 514 3.516 -6.372 6.616 256 H SER 515 H SER 515 -0.268 -1.649 7.855 257 HA SER 515 HA SER 515 0.394 -1.002 10.653 258 HB2 SER 515 HB2 SER 515 -0.095 0.851 8.810 259 HB3 SER 515 HB3 SER 515 -1.769 0.470 9.216 260 HG SER 515 HG SER 515 0.205 1.693 10.745 261 H SER 516 H SER 516 -1.574 -0.798 12.073 262 HA SER 516 HA SER 516 -2.996 -3.241 12.056 263 HB2 SER 516 HB2 SER 516 -3.276 -0.713 13.679 264 HB3 SER 516 HB3 SER 516 -4.341 -2.099 13.917 265 HG SER 516 HG SER 516 -2.679 -2.396 15.313 266 H ARG 517 H ARG 517 -3.640 -0.137 10.689 267 HA ARG 517 HA ARG 517 -6.466 -0.742 10.278 268 HB2 ARG 517 HB2 ARG 517 -6.524 1.544 9.256 269 HB3 ARG 517 HB3 ARG 517 -6.020 1.515 10.941 270 HG2 ARG 517 HG2 ARG 517 -3.826 2.039 10.432 271 HG3 ARG 517 HG3 ARG 517 -3.977 1.486 8.763 272 HD2 ARG 517 HD2 ARG 517 -5.100 3.406 8.095 273 HD3 ARG 517 HD3 ARG 517 -5.591 3.807 9.741 274 HE ARG 517 HE ARG 517 -2.913 4.024 9.866 275 HH11 ARG 517 HH11 ARG 517 -5.275 5.298 7.647 276 HH12 ARG 517 HH12 ARG 517 -4.358 6.724 7.287 277 HH21 ARG 517 HH21 ARG 517 -1.698 5.897 9.399 278 HH22 ARG 517 HH22 ARG 517 -2.324 7.063 8.283 279 H TYR 518 H TYR 518 -3.445 -0.606 8.546 280 HA TYR 518 HA TYR 518 -4.481 -0.575 5.919 281 HB2 TYR 518 HB2 TYR 518 -1.953 -0.521 7.073 282 HB3 TYR 518 HB3 TYR 518 -1.977 -2.038 6.180 283 HD1 TYR 518 HD1 TYR 518 -3.183 -1.703 3.740 284 HD2 TYR 518 HD2 TYR 518 -1.059 1.261 5.932 285 HE1 TYR 518 HE1 TYR 518 -2.739 -0.484 1.650 286 HE2 TYR 518 HE2 TYR 518 -0.609 2.489 3.849 287 HH TYR 518 HH TYR 518 -2.185 1.753 0.907 288 H ILE 519 H ILE 519 -3.773 -3.168 8.186 289 HA ILE 519 HA ILE 519 -3.912 -5.365 6.496 290 HB ILE 519 HB ILE 519 -4.891 -5.175 9.347 291 HG12 ILE 519 HG12 ILE 519 -2.317 -6.471 8.690 292 HG13 ILE 519 HG13 ILE 519 -2.362 -4.725 8.469 293 HG21 ILE 519 HG21 ILE 519 -5.782 -7.141 8.233 294 HG22 ILE 519 HG22 ILE 519 -4.166 -7.586 7.688 295 HG23 ILE 519 HG23 ILE 519 -4.552 -7.605 9.408 296 HD11 ILE 519 HD11 ILE 519 -2.554 -6.332 10.952 297 HD12 ILE 519 HD12 ILE 519 -1.676 -4.836 10.631 298 HD13 ILE 519 HD13 ILE 519 -3.422 -4.799 10.878 299 H GLY 520 H GLY 520 -5.554 -6.676 5.749 300 HA2 GLY 520 HA2 GLY 520 -8.062 -5.401 5.256 301 HA3 GLY 520 HA3 GLY 520 -7.619 -7.038 4.793 302 H ASN 521 H ASN 521 -8.906 -8.519 5.636 303 HA ASN 521 HA ASN 521 -10.368 -7.923 8.092 304 HB2 ASN 521 HB2 ASN 521 -10.659 -10.106 6.022 305 HB3 ASN 521 HB3 ASN 521 -11.612 -10.045 7.502 306 HD21 ASN 521 HD21 ASN 521 -13.553 -9.785 6.464 307 HD22 ASN 521 HD22 ASN 521 -13.987 -8.336 5.631 308 H ILE 522 H ILE 522 -9.872 -8.781 10.003 309 HA ILE 522 HA ILE 522 -8.021 -11.076 10.061 310 HB ILE 522 HB ILE 522 -8.172 -8.914 12.159 311 HG12 ILE 522 HG12 ILE 522 -5.697 -8.777 10.848 312 HG13 ILE 522 HG13 ILE 522 -6.892 -8.899 9.562 313 HG21 ILE 522 HG21 ILE 522 -6.581 -10.037 13.294 314 HG22 ILE 522 HG22 ILE 522 -7.213 -11.421 12.403 315 HG23 ILE 522 HG23 ILE 522 -5.771 -10.585 11.826 316 HD11 ILE 522 HD11 ILE 522 -7.998 -7.038 11.243 317 HD12 ILE 522 HD12 ILE 522 -6.272 -6.683 11.332 318 HD13 ILE 522 HD13 ILE 522 -7.090 -6.697 9.770 319 H LYS 523 H LYS 523 -8.638 -12.807 11.198 320 HA LYS 523 HA LYS 523 -11.014 -12.544 12.923 321 HB2 LYS 523 HB2 LYS 523 -11.179 -13.906 10.744 322 HB3 LYS 523 HB3 LYS 523 -10.175 -15.094 11.564 323 HG2 LYS 523 HG2 LYS 523 -11.930 -15.052 13.413 324 HG3 LYS 523 HG3 LYS 523 -12.953 -14.202 12.252 325 HD2 LYS 523 HD2 LYS 523 -13.591 -16.304 11.714 326 HD3 LYS 523 HD3 LYS 523 -12.132 -16.254 10.721 327 HE2 LYS 523 HE2 LYS 523 -11.019 -17.090 12.974 328 HE3 LYS 523 HE3 LYS 523 -12.652 -17.679 13.279 329 HZ1 LYS 523 HZ1 LYS 523 -11.604 -18.267 10.645 330 HZ2 LYS 523 HZ2 LYS 523 -12.466 -19.255 11.714 331 HZ3 LYS 523 HZ3 LYS 523 -10.800 -19.040 11.918 332 H LEU 524 H LEU 524 -11.116 -13.889 14.798 333 HA LEU 524 HA LEU 524 -8.631 -15.169 15.641 334 HB2 LEU 524 HB2 LEU 524 -8.678 -12.746 16.383 335 HB3 LEU 524 HB3 LEU 524 -10.031 -13.191 17.421 336 HG LEU 524 HG LEU 524 -7.794 -13.061 18.551 337 HD11 LEU 524 HD11 LEU 524 -9.844 -14.470 19.245 338 HD12 LEU 524 HD12 LEU 524 -8.289 -14.790 20.012 339 HD13 LEU 524 HD13 LEU 524 -8.871 -15.847 18.727 340 HD21 LEU 524 HD21 LEU 524 -7.205 -15.697 17.250 341 HD22 LEU 524 HD22 LEU 524 -6.126 -14.641 18.162 342 HD23 LEU 524 HD23 LEU 524 -6.649 -14.181 16.541 343 H PHE 525 H PHE 525 -9.661 -17.152 15.589 344 HA PHE 525 HA PHE 525 -12.074 -17.519 17.186 345 HB2 PHE 525 HB2 PHE 525 -11.176 -18.664 14.819 346 HB3 PHE 525 HB3 PHE 525 -10.938 -19.933 16.016 347 HD1 PHE 525 HD1 PHE 525 -12.640 -21.456 16.049 348 HD2 PHE 525 HD2 PHE 525 -13.566 -17.359 15.362 349 HE1 PHE 525 HE1 PHE 525 -15.032 -22.021 15.926 350 HE2 PHE 525 HE2 PHE 525 -15.959 -17.917 15.238 351 HZ PHE 525 HZ PHE 525 -16.695 -20.250 15.522 352 H ALA 526 H ALA 526 -11.782 -20.119 18.029 353 HA ALA 526 HA ALA 526 -10.304 -19.788 20.424 354 HB1 ALA 526 HB1 ALA 526 -12.135 -21.722 19.312 355 HB2 ALA 526 HB2 ALA 526 -10.801 -22.514 20.153 356 HB3 ALA 526 HB3 ALA 526 -11.798 -21.330 20.999 357 H SER 527 H SER 527 -9.737 -21.704 17.491 358 HA SER 527 HA SER 527 -6.898 -21.842 18.220 359 HB2 SER 527 HB2 SER 527 -8.189 -24.004 18.746 360 HB3 SER 527 HB3 SER 527 -8.308 -24.209 16.998 361 HG SER 527 HG SER 527 -6.394 -25.100 18.325 362 H HIS 528 H HIS 528 -8.322 -20.131 16.380 363 HA HIS 528 HA HIS 528 -6.713 -20.628 14.032 364 HB2 HIS 528 HB2 HIS 528 -9.720 -20.748 13.962 365 HB3 HIS 528 HB3 HIS 528 -8.788 -20.285 12.541 366 HD1 HIS 528 HD1 HIS 528 -7.010 -22.154 11.712 367 HD2 HIS 528 HD2 HIS 528 -9.984 -23.433 14.316 368 HE1 HIS 528 HE1 HIS 528 -7.061 -24.659 11.496 369 H SER 529 H SER 529 -6.806 -18.803 12.494 370 HA SER 529 HA SER 529 -8.080 -16.363 13.223 371 HB2 SER 529 HB2 SER 529 -5.660 -15.258 13.476 372 HB3 SER 529 HB3 SER 529 -6.552 -15.877 14.865 373 HG SER 529 HG SER 529 -5.377 -17.851 14.595 374 H THR 530 H THR 530 -8.231 -15.076 11.484 375 HA THR 530 HA THR 530 -6.580 -15.766 9.145 376 HB THR 530 HB THR 530 -8.340 -15.058 7.721 377 HG1 THR 530 HG1 THR 530 -10.234 -14.053 8.596 378 HG21 THR 530 HG21 THR 530 -10.037 -16.308 9.813 379 HG22 THR 530 HG22 THR 530 -8.621 -17.208 9.269 380 HG23 THR 530 HG23 THR 530 -9.856 -16.719 8.108 381 H ILE 531 H ILE 531 -6.190 -13.934 7.615 382 HA ILE 531 HA ILE 531 -6.341 -11.245 8.473 383 HB ILE 531 HB ILE 531 -4.639 -11.829 10.074 384 HG12 ILE 531 HG12 ILE 531 -3.118 -10.487 7.855 385 HG13 ILE 531 HG13 ILE 531 -4.494 -9.691 8.610 386 HG21 ILE 531 HG21 ILE 531 -2.525 -12.820 9.469 387 HG22 ILE 531 HG22 ILE 531 -3.837 -13.858 8.913 388 HG23 ILE 531 HG23 ILE 531 -2.979 -12.829 7.765 389 HD11 ILE 531 HD11 ILE 531 -2.698 -8.860 9.792 390 HD12 ILE 531 HD12 ILE 531 -3.253 -10.180 10.821 391 HD13 ILE 531 HD13 ILE 531 -1.845 -10.403 9.783 392 H GLU 532 H GLU 532 -5.913 -9.859 6.817 393 HA GLU 532 HA GLU 532 -4.783 -11.043 4.366 394 HB2 GLU 532 HB2 GLU 532 -7.210 -10.587 4.205 395 HB3 GLU 532 HB3 GLU 532 -6.900 -8.895 4.567 396 HG2 GLU 532 HG2 GLU 532 -5.601 -10.239 2.231 397 HG3 GLU 532 HG3 GLU 532 -7.235 -9.587 2.123 398 H LEU 533 H LEU 533 -3.052 -10.075 3.526 399 HA LEU 533 HA LEU 533 -2.351 -7.390 4.515 400 HB2 LEU 533 HB2 LEU 533 -0.806 -9.858 4.207 401 HB3 LEU 533 HB3 LEU 533 -0.013 -8.425 3.556 402 HG LEU 533 HG LEU 533 -0.057 -7.356 5.709 403 HD11 LEU 533 HD11 LEU 533 -1.905 -7.849 6.905 404 HD12 LEU 533 HD12 LEU 533 -0.849 -9.068 7.617 405 HD13 LEU 533 HD13 LEU 533 -1.968 -9.515 6.329 406 HD21 LEU 533 HD21 LEU 533 0.913 -10.206 5.790 407 HD22 LEU 533 HD22 LEU 533 1.284 -9.010 7.032 408 HD23 LEU 533 HD23 LEU 533 1.836 -8.762 5.374 409 HA PRO 534 HA PRO 534 -2.706 -6.030 0.326 410 HB2 PRO 534 HB2 PRO 534 -1.422 -3.654 0.608 411 HB3 PRO 534 HB3 PRO 534 -3.061 -3.937 1.207 412 HG2 PRO 534 HG2 PRO 534 -0.465 -3.981 2.698 413 HG3 PRO 534 HG3 PRO 534 -2.018 -3.272 3.176 414 HD2 PRO 534 HD2 PRO 534 -1.162 -5.667 4.106 415 HD3 PRO 534 HD3 PRO 534 -2.880 -5.301 3.849 416 H LYS 535 H LYS 535 0.150 -6.920 1.871 417 HA LYS 535 HA LYS 535 2.240 -6.056 0.355 418 HB2 LYS 535 HB2 LYS 535 1.801 -8.894 1.304 419 HB3 LYS 535 HB3 LYS 535 3.348 -8.202 0.836 420 HG2 LYS 535 HG2 LYS 535 1.889 -6.727 2.919 421 HG3 LYS 535 HG3 LYS 535 2.450 -8.338 3.373 422 HD2 LYS 535 HD2 LYS 535 4.121 -6.651 3.922 423 HD3 LYS 535 HD3 LYS 535 4.720 -7.742 2.670 424 HE2 LYS 535 HE2 LYS 535 5.282 -5.427 2.155 425 HE3 LYS 535 HE3 LYS 535 4.165 -6.086 0.960 426 HZ1 LYS 535 HZ1 LYS 535 2.376 -4.899 1.918 427 HZ2 LYS 535 HZ2 LYS 535 3.644 -3.792 1.756 428 HZ3 LYS 535 HZ3 LYS 535 3.286 -4.451 3.272 429 H GLY 536 H GLY 536 3.279 -6.708 -1.548 430 HA2 GLY 536 HA2 GLY 536 1.667 -8.404 -3.348 431 HA3 GLY 536 HA3 GLY 536 2.326 -6.869 -3.893 432 H MET 537 H MET 537 3.783 -9.455 -1.936 433 HA MET 537 HA MET 537 5.364 -10.553 -3.978 434 HB2 MET 537 HB2 MET 537 6.303 -8.116 -3.576 435 HB3 MET 537 HB3 MET 537 7.097 -8.884 -2.207 436 HG2 MET 537 HG2 MET 537 8.450 -10.168 -3.529 437 HG3 MET 537 HG3 MET 537 7.320 -10.160 -4.881 438 HE1 MET 537 HE1 MET 537 11.057 -8.407 -5.148 439 HE2 MET 537 HE2 MET 537 10.330 -9.944 -4.682 440 HE3 MET 537 HE3 MET 537 10.182 -9.366 -6.342 441 HA PRO 538 HA PRO 538 5.134 -12.713 0.155 442 HB2 PRO 538 HB2 PRO 538 3.988 -14.978 -0.808 443 HB3 PRO 538 HB3 PRO 538 3.050 -13.575 -0.282 444 HG2 PRO 538 HG2 PRO 538 3.829 -14.404 -3.051 445 HG3 PRO 538 HG3 PRO 538 2.273 -13.789 -2.464 446 HD2 PRO 538 HD2 PRO 538 4.057 -12.226 -3.770 447 HD3 PRO 538 HD3 PRO 538 2.981 -11.595 -2.507 448 H GLY 539 H GLY 539 5.824 -15.159 0.475 449 HA2 GLY 539 HA2 GLY 539 7.301 -16.906 -0.044 450 HA3 GLY 539 HA3 GLY 539 7.836 -16.005 -1.455 451 H GLU 540 H GLU 540 7.771 -13.984 1.202 452 HA GLU 540 HA GLU 540 10.649 -13.916 1.320 453 HB2 GLU 540 HB2 GLU 540 8.773 -12.370 3.097 454 HB3 GLU 540 HB3 GLU 540 10.408 -11.946 2.609 455 HG2 GLU 540 HG2 GLU 540 9.446 -11.867 0.225 456 HG3 GLU 540 HG3 GLU 540 7.876 -11.802 1.026 457 H VAL 541 H VAL 541 8.098 -14.328 3.782 458 HA VAL 541 HA VAL 541 10.000 -15.371 5.688 459 HB VAL 541 HB VAL 541 6.989 -15.250 5.902 460 HG11 VAL 541 HG11 VAL 541 7.892 -16.795 7.489 461 HG12 VAL 541 HG12 VAL 541 9.162 -15.660 7.950 462 HG13 VAL 541 HG13 VAL 541 7.479 -15.312 8.349 463 HG21 VAL 541 HG21 VAL 541 9.119 -13.225 6.389 464 HG22 VAL 541 HG22 VAL 541 7.503 -13.021 5.713 465 HG23 VAL 541 HG23 VAL 541 7.710 -13.251 7.449 466 H LEU 542 H LEU 542 7.546 -16.625 3.526 467 HA LEU 542 HA LEU 542 7.354 -19.223 4.607 468 HB2 LEU 542 HB2 LEU 542 6.696 -17.954 1.998 469 HB3 LEU 542 HB3 LEU 542 6.731 -19.713 2.088 470 HG LEU 542 HG LEU 542 5.103 -19.418 4.072 471 HD11 LEU 542 HD11 LEU 542 5.212 -17.104 4.479 472 HD12 LEU 542 HD12 LEU 542 3.652 -17.370 3.701 473 HD13 LEU 542 HD13 LEU 542 4.998 -16.711 2.773 474 HD21 LEU 542 HD21 LEU 542 3.619 -20.181 2.607 475 HD22 LEU 542 HD22 LEU 542 4.772 -19.799 1.327 476 HD23 LEU 542 HD23 LEU 542 3.541 -18.621 1.787 477 H GLN 543 H GLN 543 9.762 -17.684 2.689 478 HA GLN 543 HA GLN 543 10.920 -20.147 1.713 479 HB2 GLN 543 HB2 GLN 543 11.485 -17.245 1.406 480 HB3 GLN 543 HB3 GLN 543 12.832 -18.354 1.187 481 HG2 GLN 543 HG2 GLN 543 10.265 -18.850 -0.246 482 HG3 GLN 543 HG3 GLN 543 11.383 -17.626 -0.844 483 HE21 GLN 543 HE21 GLN 543 10.828 -21.006 -0.342 484 HE22 GLN 543 HE22 GLN 543 12.168 -21.578 -1.270 485 H HIS 544 H HIS 544 12.097 -17.518 3.822 486 HA HIS 544 HA HIS 544 14.305 -19.013 4.791 487 HB2 HIS 544 HB2 HIS 544 12.961 -16.472 5.677 488 HB3 HIS 544 HB3 HIS 544 14.275 -17.179 6.612 489 HD1 HIS 544 HD1 HIS 544 14.568 -17.516 2.950 490 HD2 HIS 544 HD2 HIS 544 15.798 -14.863 5.901 491 HE1 HIS 544 HE1 HIS 544 16.339 -16.090 1.875 492 H PHE 545 H PHE 545 11.246 -18.058 6.358 493 HA PHE 545 HA PHE 545 11.730 -19.932 8.521 494 HB2 PHE 545 HB2 PHE 545 9.741 -17.770 7.982 495 HB3 PHE 545 HB3 PHE 545 9.318 -19.030 9.136 496 HD1 PHE 545 HD1 PHE 545 9.752 -18.583 11.336 497 HD2 PHE 545 HD2 PHE 545 12.238 -16.836 8.356 498 HE1 PHE 545 HE1 PHE 545 11.016 -17.405 13.087 499 HE2 PHE 545 HE2 PHE 545 13.507 -15.656 10.102 500 HZ PHE 545 HZ PHE 545 12.897 -15.939 12.471 501 H THR 546 H THR 546 11.549 -21.282 6.151 502 HA THR 546 HA THR 546 8.868 -22.242 5.718 503 HB THR 546 HB THR 546 10.614 -22.106 3.907 504 HG1 THR 546 HG1 THR 546 8.922 -23.364 3.356 505 HG21 THR 546 HG21 THR 546 12.532 -23.258 3.997 506 HG22 THR 546 HG22 THR 546 11.714 -24.732 4.515 507 HG23 THR 546 HG23 THR 546 12.172 -23.513 5.704 508 H ARG 547 H ARG 547 11.488 -23.047 7.777 509 HA ARG 547 HA ARG 547 10.252 -25.644 8.409 510 HB2 ARG 547 HB2 ARG 547 12.464 -26.172 9.483 511 HB3 ARG 547 HB3 ARG 547 12.518 -25.972 7.737 512 HG2 ARG 547 HG2 ARG 547 13.590 -23.902 7.888 513 HG3 ARG 547 HG3 ARG 547 13.167 -23.710 9.591 514 HD2 ARG 547 HD2 ARG 547 15.399 -24.301 9.704 515 HD3 ARG 547 HD3 ARG 547 14.590 -25.852 9.923 516 HE ARG 547 HE ARG 547 15.035 -25.601 7.214 517 HH11 ARG 547 HH11 ARG 547 16.966 -25.690 10.109 518 HH12 ARG 547 HH12 ARG 547 18.341 -26.396 9.326 519 HH21 ARG 547 HH21 ARG 547 16.838 -26.531 6.172 520 HH22 ARG 547 HH22 ARG 547 18.268 -26.873 7.087 521 H THR 548 H THR 548 11.038 -22.513 9.604 522 HA THR 548 HA THR 548 10.189 -23.318 12.310 523 HB THR 548 HB THR 548 11.903 -20.943 11.556 524 HG1 THR 548 HG1 THR 548 13.276 -22.612 11.440 525 HG21 THR 548 HG21 THR 548 11.207 -22.050 14.279 526 HG22 THR 548 HG22 THR 548 10.480 -20.613 13.559 527 HG23 THR 548 HG23 THR 548 12.202 -20.635 13.938 528 H ARG 549 H ARG 549 8.462 -22.335 13.203 529 HA ARG 549 HA ARG 549 7.477 -19.812 12.195 530 HB2 ARG 549 HB2 ARG 549 6.051 -22.408 11.711 531 HB3 ARG 549 HB3 ARG 549 5.138 -20.918 11.911 532 HG2 ARG 549 HG2 ARG 549 5.386 -20.655 9.717 533 HG3 ARG 549 HG3 ARG 549 7.058 -20.218 10.076 534 HD2 ARG 549 HD2 ARG 549 7.018 -21.908 8.354 535 HD3 ARG 549 HD3 ARG 549 7.694 -22.590 9.833 536 HE ARG 549 HE ARG 549 4.861 -23.023 9.486 537 HH11 ARG 549 HH11 ARG 549 8.071 -24.240 8.910 538 HH12 ARG 549 HH12 ARG 549 7.557 -25.885 8.731 539 HH21 ARG 549 HH21 ARG 549 4.171 -25.184 9.252 540 HH22 ARG 549 HH22 ARG 549 5.338 -26.421 8.925 541 H ILE 550 H ILE 550 5.235 -19.378 13.345 542 HA ILE 550 HA ILE 550 4.836 -20.614 15.883 543 HB ILE 550 HB ILE 550 6.921 -19.046 16.115 544 HG12 ILE 550 HG12 ILE 550 5.071 -18.357 18.276 545 HG13 ILE 550 HG13 ILE 550 5.042 -20.068 17.863 546 HG21 ILE 550 HG21 ILE 550 4.957 -16.945 16.813 547 HG22 ILE 550 HG22 ILE 550 6.614 -16.802 16.231 548 HG23 ILE 550 HG23 ILE 550 5.312 -17.176 15.102 549 HD11 ILE 550 HD11 ILE 550 7.424 -18.442 18.710 550 HD12 ILE 550 HD12 ILE 550 6.624 -19.729 19.613 551 HD13 ILE 550 HD13 ILE 550 7.509 -20.107 18.135 552 H LEU 551 H LEU 551 3.432 -18.907 17.288 553 HA LEU 551 HA LEU 551 0.954 -18.744 16.286 554 HB2 LEU 551 HB2 LEU 551 0.449 -17.000 17.840 555 HB3 LEU 551 HB3 LEU 551 1.624 -18.089 18.575 556 HG LEU 551 HG LEU 551 3.310 -16.249 17.627 557 HD11 LEU 551 HD11 LEU 551 1.630 -14.172 18.527 558 HD12 LEU 551 HD12 LEU 551 0.742 -15.055 17.286 559 HD13 LEU 551 HD13 LEU 551 2.334 -14.390 16.924 560 HD21 LEU 551 HD21 LEU 551 3.052 -17.050 19.961 561 HD22 LEU 551 HD22 LEU 551 1.745 -15.885 20.179 562 HD23 LEU 551 HD23 LEU 551 3.383 -15.322 19.843 563 H ASN 552 H ASN 552 3.498 -16.352 15.722 564 HA ASN 552 HA ASN 552 1.804 -14.662 14.127 565 HB2 ASN 552 HB2 ASN 552 3.712 -13.773 15.444 566 HB3 ASN 552 HB3 ASN 552 4.819 -14.650 14.391 567 HD21 ASN 552 HD21 ASN 552 1.904 -12.753 13.715 568 HD22 ASN 552 HD22 ASN 552 2.669 -11.645 12.632 569 H LYS 553 H LYS 553 4.774 -16.477 13.334 570 HA LYS 553 HA LYS 553 4.470 -16.297 10.552 571 HB2 LYS 553 HB2 LYS 553 5.835 -18.638 11.834 572 HB3 LYS 553 HB3 LYS 553 6.289 -17.746 10.388 573 HG2 LYS 553 HG2 LYS 553 6.592 -16.884 13.251 574 HG3 LYS 553 HG3 LYS 553 7.866 -17.218 12.077 575 HD2 LYS 553 HD2 LYS 553 6.685 -15.314 10.716 576 HD3 LYS 553 HD3 LYS 553 6.055 -14.855 12.299 577 HE2 LYS 553 HE2 LYS 553 8.464 -14.939 13.107 578 HE3 LYS 553 HE3 LYS 553 8.922 -15.022 11.407 579 HZ1 LYS 553 HZ1 LYS 553 7.504 -12.823 12.796 580 HZ2 LYS 553 HZ2 LYS 553 7.593 -12.932 11.111 581 HZ3 LYS 553 HZ3 LYS 553 9.007 -12.764 12.023 582 HA PRO 554 HA PRO 554 1.534 -19.354 9.420 583 HB2 PRO 554 HB2 PRO 554 2.673 -20.513 7.245 584 HB3 PRO 554 HB3 PRO 554 2.008 -18.876 7.223 585 HG2 PRO 554 HG2 PRO 554 4.853 -19.760 7.508 586 HG3 PRO 554 HG3 PRO 554 4.185 -18.438 6.533 587 HD2 PRO 554 HD2 PRO 554 5.379 -18.023 8.928 588 HD3 PRO 554 HD3 PRO 554 4.045 -17.011 8.338 589 H MET 555 H MET 555 2.051 -20.551 11.461 590 HA MET 555 HA MET 555 3.876 -22.684 11.540 591 HB2 MET 555 HB2 MET 555 2.878 -21.744 13.560 592 HB3 MET 555 HB3 MET 555 1.290 -22.309 13.060 593 HG2 MET 555 HG2 MET 555 2.046 -23.832 14.679 594 HG3 MET 555 HG3 MET 555 2.225 -24.643 13.125 595 HE1 MET 555 HE1 MET 555 5.489 -25.481 12.518 596 HE2 MET 555 HE2 MET 555 4.811 -26.444 13.831 597 HE3 MET 555 HE3 MET 555 3.762 -25.839 12.548 598 H ASN 556 H ASN 556 0.351 -22.739 10.993 599 HA ASN 556 HA ASN 556 0.684 -25.013 9.207 600 HB2 ASN 556 HB2 ASN 556 0.272 -25.778 11.658 601 HB3 ASN 556 HB3 ASN 556 -1.380 -25.235 11.379 602 HD21 ASN 556 HD21 ASN 556 1.137 -27.220 9.866 603 HD22 ASN 556 HD22 ASN 556 0.064 -28.451 9.300 604 H MET 557 H MET 557 0.056 -22.476 8.456 605 HA MET 557 HA MET 557 -2.842 -22.294 8.205 606 HB2 MET 557 HB2 MET 557 -2.416 -20.112 7.181 607 HB3 MET 557 HB3 MET 557 -1.594 -20.254 8.729 608 HG2 MET 557 HG2 MET 557 0.104 -19.369 7.542 609 HG3 MET 557 HG3 MET 557 0.385 -21.064 7.153 610 HE1 MET 557 HE1 MET 557 0.724 -21.913 5.314 611 HE2 MET 557 HE2 MET 557 -0.071 -21.642 3.764 612 HE3 MET 557 HE3 MET 557 1.405 -20.762 4.164 613 H GLN 558 H GLN 558 -3.518 -21.435 5.895 614 HA GLN 558 HA GLN 558 -2.120 -22.625 3.688 615 HB2 GLN 558 HB2 GLN 558 -3.687 -24.296 3.080 616 HB3 GLN 558 HB3 GLN 558 -3.341 -24.553 4.785 617 HG2 GLN 558 HG2 GLN 558 -5.443 -23.099 5.181 618 HG3 GLN 558 HG3 GLN 558 -5.815 -23.484 3.501 619 HE21 GLN 558 HE21 GLN 558 -7.618 -24.300 5.206 620 HE22 GLN 558 HE22 GLN 558 -7.524 -25.999 5.502 621 H LEU 559 H LEU 559 -2.583 -21.572 1.847 622 HA LEU 559 HA LEU 559 -4.088 -19.230 1.844 623 HB2 LEU 559 HB2 LEU 559 -2.258 -20.016 0.229 624 HB3 LEU 559 HB3 LEU 559 -3.557 -20.836 -0.635 625 HG LEU 559 HG LEU 559 -2.908 -18.640 -1.604 626 HD11 LEU 559 HD11 LEU 559 -4.999 -18.353 -2.356 627 HD12 LEU 559 HD12 LEU 559 -5.661 -18.139 -0.736 628 HD13 LEU 559 HD13 LEU 559 -5.373 -19.762 -1.364 629 HD21 LEU 559 HD21 LEU 559 -4.371 -17.045 0.314 630 HD22 LEU 559 HD22 LEU 559 -2.777 -16.779 -0.391 631 HD23 LEU 559 HD23 LEU 559 -2.950 -17.796 1.040 632 H LEU 560 H LEU 560 -6.205 -18.924 1.893 633 HA LEU 560 HA LEU 560 -7.958 -21.019 0.790 634 HB2 LEU 560 HB2 LEU 560 -9.521 -20.608 2.439 635 HB3 LEU 560 HB3 LEU 560 -7.992 -20.445 3.302 636 HG LEU 560 HG LEU 560 -8.452 -17.870 2.575 637 HD11 LEU 560 HD11 LEU 560 -10.797 -18.978 1.848 638 HD12 LEU 560 HD12 LEU 560 -10.626 -17.314 2.408 639 HD13 LEU 560 HD13 LEU 560 -11.147 -18.572 3.529 640 HD21 LEU 560 HD21 LEU 560 -9.769 -18.820 5.060 641 HD22 LEU 560 HD22 LEU 560 -8.632 -17.494 4.814 642 HD23 LEU 560 HD23 LEU 560 -8.049 -19.159 4.857 643 H GLY 561 H GLY 561 -7.116 -17.658 0.752 644 HA2 GLY 561 HA2 GLY 561 -9.472 -16.905 -0.783 645 HA3 GLY 561 HA3 GLY 561 -8.175 -15.836 -0.270 646 H ASP 562 H ASP 562 -7.744 -14.886 -2.213 647 HA ASP 562 HA ASP 562 -5.983 -16.153 -3.973 648 HB2 ASP 562 HB2 ASP 562 -7.760 -17.460 -4.846 649 HB3 ASP 562 HB3 ASP 562 -8.858 -16.082 -4.879 650 H ALA 563 H ALA 563 -4.841 -14.603 -4.943 651 HA ALA 563 HA ALA 563 -5.345 -11.886 -4.530 652 HB1 ALA 563 HB1 ALA 563 -3.229 -13.369 -5.456 653 HB2 ALA 563 HB2 ALA 563 -3.696 -12.427 -6.872 654 HB3 ALA 563 HB3 ALA 563 -3.291 -11.609 -5.363 655 H GLN 564 H GLN 564 -6.515 -10.402 -5.581 656 HA GLN 564 HA GLN 564 -8.460 -11.058 -7.444 657 HB2 GLN 564 HB2 GLN 564 -7.970 -8.876 -5.963 658 HB3 GLN 564 HB3 GLN 564 -7.393 -8.289 -7.518 659 HG2 GLN 564 HG2 GLN 564 -10.103 -9.531 -7.187 660 HG3 GLN 564 HG3 GLN 564 -9.811 -7.814 -6.912 661 HE21 GLN 564 HE21 GLN 564 -10.534 -10.173 -9.181 662 HE22 GLN 564 HE22 GLN 564 -10.313 -9.232 -10.613 Start of MODEL 4 1 H MET 480 H MET 480 1.491 2.096 -1.275 2 HA MET 480 HA MET 480 -0.210 0.167 -2.438 3 HB2 MET 480 HB2 MET 480 0.631 2.384 -3.429 4 HB3 MET 480 HB3 MET 480 2.079 1.493 -3.875 5 HG2 MET 480 HG2 MET 480 1.001 0.254 -5.462 6 HG3 MET 480 HG3 MET 480 -0.561 0.382 -4.657 7 HE1 MET 480 HE1 MET 480 -2.317 3.149 -5.759 8 HE2 MET 480 HE2 MET 480 -2.291 1.825 -6.923 9 HE3 MET 480 HE3 MET 480 -2.205 1.482 -5.195 10 H ALA 481 H ALA 481 0.149 -1.842 -3.220 11 HA ALA 481 HA ALA 481 2.590 -3.168 -2.423 12 HB1 ALA 481 HB1 ALA 481 -0.100 -3.945 -2.909 13 HB2 ALA 481 HB2 ALA 481 0.954 -4.902 -3.951 14 HB3 ALA 481 HB3 ALA 481 1.212 -4.891 -2.206 15 H ASP 482 H ASP 482 3.088 -5.045 -4.259 16 HA ASP 482 HA ASP 482 4.231 -3.496 -6.438 17 HB2 ASP 482 HB2 ASP 482 5.206 -5.571 -4.943 18 HB3 ASP 482 HB3 ASP 482 4.693 -6.401 -6.410 19 H VAL 483 H VAL 483 1.847 -6.012 -5.909 20 HA VAL 483 HA VAL 483 0.962 -5.678 -8.688 21 HB VAL 483 HB VAL 483 2.205 -7.740 -8.722 22 HG11 VAL 483 HG11 VAL 483 2.094 -8.136 -6.262 23 HG12 VAL 483 HG12 VAL 483 0.450 -8.737 -6.485 24 HG13 VAL 483 HG13 VAL 483 1.806 -9.575 -7.239 25 HG21 VAL 483 HG21 VAL 483 -0.098 -7.537 -9.830 26 HG22 VAL 483 HG22 VAL 483 0.586 -9.153 -9.649 27 HG23 VAL 483 HG23 VAL 483 -0.666 -8.596 -8.539 28 H GLY 484 H GLY 484 0.207 -6.833 -5.428 29 HA2 GLY 484 HA2 GLY 484 -1.883 -5.811 -4.507 30 HA3 GLY 484 HA3 GLY 484 -2.645 -6.318 -6.007 31 H ASP 485 H ASP 485 -0.299 -8.281 -4.309 32 HA ASP 485 HA ASP 485 -1.896 -10.574 -4.315 33 HB2 ASP 485 HB2 ASP 485 0.709 -10.133 -3.838 34 HB3 ASP 485 HB3 ASP 485 0.150 -10.319 -2.178 35 H MET 486 H MET 486 -3.901 -10.366 -3.428 36 HA MET 486 HA MET 486 -3.988 -9.881 -0.526 37 HB2 MET 486 HB2 MET 486 -4.938 -7.931 -1.540 38 HB3 MET 486 HB3 MET 486 -5.911 -8.902 -2.637 39 HG2 MET 486 HG2 MET 486 -6.509 -9.620 0.066 40 HG3 MET 486 HG3 MET 486 -6.634 -7.873 -0.131 41 HE1 MET 486 HE1 MET 486 -8.689 -11.342 -1.783 42 HE2 MET 486 HE2 MET 486 -7.941 -11.043 -0.214 43 HE3 MET 486 HE3 MET 486 -9.651 -10.684 -0.458 44 H GLN 487 H GLN 487 -4.650 -11.623 0.528 45 HA GLN 487 HA GLN 487 -6.880 -13.186 -0.457 46 HB2 GLN 487 HB2 GLN 487 -4.198 -14.491 0.037 47 HB3 GLN 487 HB3 GLN 487 -5.696 -15.324 -0.357 48 HG2 GLN 487 HG2 GLN 487 -5.734 -14.116 -2.523 49 HG3 GLN 487 HG3 GLN 487 -4.154 -13.442 -2.125 50 HE21 GLN 487 HE21 GLN 487 -2.474 -14.499 -2.884 51 HE22 GLN 487 HE22 GLN 487 -2.435 -16.166 -3.333 52 H LEU 488 H LEU 488 -7.267 -15.089 1.159 53 HA LEU 488 HA LEU 488 -6.973 -13.965 3.861 54 HB2 LEU 488 HB2 LEU 488 -9.272 -14.341 2.806 55 HB3 LEU 488 HB3 LEU 488 -8.959 -16.060 3.036 56 HG LEU 488 HG LEU 488 -8.805 -15.705 5.455 57 HD11 LEU 488 HD11 LEU 488 -8.767 -12.917 4.630 58 HD12 LEU 488 HD12 LEU 488 -8.243 -13.660 6.141 59 HD13 LEU 488 HD13 LEU 488 -9.939 -13.240 5.908 60 HD21 LEU 488 HD21 LEU 488 -11.040 -15.835 5.745 61 HD22 LEU 488 HD22 LEU 488 -11.044 -15.890 3.982 62 HD23 LEU 488 HD23 LEU 488 -11.357 -14.369 4.818 63 H TYR 489 H TYR 489 -5.327 -14.879 4.904 64 HA TYR 489 HA TYR 489 -4.852 -17.759 4.551 65 HB2 TYR 489 HB2 TYR 489 -2.909 -15.964 5.947 66 HB3 TYR 489 HB3 TYR 489 -2.606 -17.414 4.997 67 HD1 TYR 489 HD1 TYR 489 -3.297 -13.806 4.837 68 HD2 TYR 489 HD2 TYR 489 -2.327 -17.300 2.611 69 HE1 TYR 489 HE1 TYR 489 -2.746 -12.407 2.890 70 HE2 TYR 489 HE2 TYR 489 -1.773 -15.911 0.659 71 HH TYR 489 HH TYR 489 -1.025 -12.950 0.663 72 H ARG 490 H ARG 490 -5.744 -18.979 6.070 73 HA ARG 490 HA ARG 490 -6.065 -17.894 8.777 74 HB2 ARG 490 HB2 ARG 490 -7.688 -19.681 9.127 75 HB3 ARG 490 HB3 ARG 490 -8.092 -18.752 7.689 76 HG2 ARG 490 HG2 ARG 490 -8.344 -20.769 6.751 77 HG3 ARG 490 HG3 ARG 490 -6.586 -20.720 6.609 78 HD2 ARG 490 HD2 ARG 490 -6.813 -22.739 7.638 79 HD3 ARG 490 HD3 ARG 490 -6.732 -21.704 9.063 80 HE ARG 490 HE ARG 490 -8.922 -22.207 9.516 81 HH11 ARG 490 HH11 ARG 490 -8.161 -23.188 6.263 82 HH12 ARG 490 HH12 ARG 490 -9.655 -24.035 6.030 83 HH21 ARG 490 HH21 ARG 490 -10.892 -23.318 9.221 84 HH22 ARG 490 HH22 ARG 490 -11.208 -24.107 7.713 85 H ILE 491 H ILE 491 -4.955 -18.677 10.463 86 HA ILE 491 HA ILE 491 -3.108 -20.901 9.957 87 HB ILE 491 HB ILE 491 -1.801 -20.110 11.816 88 HG12 ILE 491 HG12 ILE 491 -3.981 -18.049 12.215 89 HG13 ILE 491 HG13 ILE 491 -3.640 -19.408 13.281 90 HG21 ILE 491 HG21 ILE 491 -2.084 -17.463 10.791 91 HG22 ILE 491 HG22 ILE 491 -0.834 -18.657 10.447 92 HG23 ILE 491 HG23 ILE 491 -2.305 -18.617 9.476 93 HD11 ILE 491 HD11 ILE 491 -2.701 -17.488 14.281 94 HD12 ILE 491 HD12 ILE 491 -1.356 -18.419 13.622 95 HD13 ILE 491 HD13 ILE 491 -1.938 -16.988 12.772 96 H GLU 492 H GLU 492 -2.586 -22.208 12.005 97 HA GLU 492 HA GLU 492 -5.139 -23.101 13.136 98 HB2 GLU 492 HB2 GLU 492 -3.521 -24.669 11.893 99 HB3 GLU 492 HB3 GLU 492 -2.521 -24.571 13.335 100 HG2 GLU 492 HG2 GLU 492 -3.723 -26.462 13.769 101 HG3 GLU 492 HG3 GLU 492 -4.725 -25.245 14.558 102 H VAL 493 H VAL 493 -4.430 -20.837 14.322 103 HA VAL 493 HA VAL 493 -3.655 -21.717 16.999 104 HB VAL 493 HB VAL 493 -2.477 -19.199 15.840 105 HG11 VAL 493 HG11 VAL 493 -1.159 -19.118 17.776 106 HG12 VAL 493 HG12 VAL 493 -2.763 -19.574 18.354 107 HG13 VAL 493 HG13 VAL 493 -1.504 -20.798 18.188 108 HG21 VAL 493 HG21 VAL 493 -0.363 -20.418 15.604 109 HG22 VAL 493 HG22 VAL 493 -1.180 -21.917 16.048 110 HG23 VAL 493 HG23 VAL 493 -1.616 -21.082 14.556 111 H GLY 494 H GLY 494 -4.704 -20.666 18.633 112 HA2 GLY 494 HA2 GLY 494 -6.184 -18.219 18.050 113 HA3 GLY 494 HA3 GLY 494 -7.139 -19.631 18.480 114 H ARG 495 H ARG 495 -7.781 -18.021 20.203 115 HA ARG 495 HA ARG 495 -6.071 -17.191 22.235 116 HB2 ARG 495 HB2 ARG 495 -8.124 -17.069 23.646 117 HB3 ARG 495 HB3 ARG 495 -8.297 -16.295 22.076 118 HG2 ARG 495 HG2 ARG 495 -9.604 -18.095 21.241 119 HG3 ARG 495 HG3 ARG 495 -9.244 -19.089 22.653 120 HD2 ARG 495 HD2 ARG 495 -10.599 -17.793 24.053 121 HD3 ARG 495 HD3 ARG 495 -10.633 -16.445 22.917 122 HE ARG 495 HE ARG 495 -12.333 -18.767 22.910 123 HH11 ARG 495 HH11 ARG 495 -11.000 -16.174 21.008 124 HH12 ARG 495 HH12 ARG 495 -12.269 -16.211 19.829 125 HH21 ARG 495 HH21 ARG 495 -14.009 -18.827 21.364 126 HH22 ARG 495 HH22 ARG 495 -13.981 -17.720 20.033 127 H ASP 496 H ASP 496 -7.556 -20.292 21.651 128 HA ASP 496 HA ASP 496 -7.003 -21.355 24.258 129 HB2 ASP 496 HB2 ASP 496 -8.763 -22.108 22.445 130 HB3 ASP 496 HB3 ASP 496 -7.432 -23.111 21.876 131 H ASP 497 H ASP 497 -5.194 -20.865 21.408 132 HA ASP 497 HA ASP 497 -3.222 -22.908 22.098 133 HB2 ASP 497 HB2 ASP 497 -3.982 -22.540 19.716 134 HB3 ASP 497 HB3 ASP 497 -3.151 -20.987 19.768 135 H GLY 498 H GLY 498 -3.553 -19.400 21.835 136 HA2 GLY 498 HA2 GLY 498 -2.260 -18.306 23.750 137 HA3 GLY 498 HA3 GLY 498 -0.873 -19.110 23.029 138 H VAL 499 H VAL 499 -3.513 -17.629 21.236 139 HA VAL 499 HA VAL 499 -1.747 -15.410 20.477 140 HB VAL 499 HB VAL 499 -1.744 -17.323 18.767 141 HG11 VAL 499 HG11 VAL 499 -4.443 -17.201 19.032 142 HG12 VAL 499 HG12 VAL 499 -4.196 -16.237 17.575 143 HG13 VAL 499 HG13 VAL 499 -3.605 -17.898 17.646 144 HG21 VAL 499 HG21 VAL 499 -2.671 -14.749 17.559 145 HG22 VAL 499 HG22 VAL 499 -1.161 -14.809 18.468 146 HG23 VAL 499 HG23 VAL 499 -1.373 -15.824 17.041 147 H GLU 500 H GLU 500 -2.808 -13.520 19.789 148 HA GLU 500 HA GLU 500 -5.719 -13.484 20.227 149 HB2 GLU 500 HB2 GLU 500 -3.934 -11.182 20.978 150 HB3 GLU 500 HB3 GLU 500 -5.597 -11.480 21.463 151 HG2 GLU 500 HG2 GLU 500 -3.176 -13.032 22.348 152 HG3 GLU 500 HG3 GLU 500 -4.087 -11.869 23.309 153 H VAL 501 H VAL 501 -6.357 -10.974 19.562 154 HA VAL 501 HA VAL 501 -6.036 -10.977 16.712 155 HB VAL 501 HB VAL 501 -7.404 -8.988 18.528 156 HG11 VAL 501 HG11 VAL 501 -8.507 -8.189 16.471 157 HG12 VAL 501 HG12 VAL 501 -6.765 -7.912 16.457 158 HG13 VAL 501 HG13 VAL 501 -7.456 -9.239 15.523 159 HG21 VAL 501 HG21 VAL 501 -9.396 -10.110 18.131 160 HG22 VAL 501 HG22 VAL 501 -8.768 -10.930 16.701 161 HG23 VAL 501 HG23 VAL 501 -8.240 -11.430 18.308 162 H ARG 502 H ARG 502 -4.704 -9.176 19.399 163 HA ARG 502 HA ARG 502 -3.419 -7.248 17.643 164 HB2 ARG 502 HB2 ARG 502 -2.519 -6.307 19.770 165 HB3 ARG 502 HB3 ARG 502 -4.275 -6.385 19.718 166 HG2 ARG 502 HG2 ARG 502 -4.352 -8.184 21.218 167 HG3 ARG 502 HG3 ARG 502 -2.634 -8.533 21.015 168 HD2 ARG 502 HD2 ARG 502 -2.648 -7.456 23.051 169 HD3 ARG 502 HD3 ARG 502 -2.319 -6.121 21.948 170 HE ARG 502 HE ARG 502 -5.066 -6.240 22.231 171 HH11 ARG 502 HH11 ARG 502 -2.301 -5.726 24.284 172 HH12 ARG 502 HH12 ARG 502 -3.155 -4.713 25.400 173 HH21 ARG 502 HH21 ARG 502 -6.200 -4.908 23.694 174 HH22 ARG 502 HH22 ARG 502 -5.373 -4.249 25.064 175 H HIS 503 H HIS 503 -2.804 -10.347 18.508 176 HA HIS 503 HA HIS 503 0.046 -10.113 18.953 177 HB2 HIS 503 HB2 HIS 503 -1.670 -11.942 19.819 178 HB3 HIS 503 HB3 HIS 503 -1.243 -12.724 18.300 179 HD1 HIS 503 HD1 HIS 503 -0.505 -13.863 21.132 180 HD2 HIS 503 HD2 HIS 503 2.028 -11.666 18.678 181 HE1 HIS 503 HE1 HIS 503 1.825 -14.478 21.848 182 H ILE 504 H ILE 504 -1.983 -11.678 16.469 183 HA ILE 504 HA ILE 504 0.187 -12.089 14.679 184 HB ILE 504 HB ILE 504 -1.378 -12.915 13.133 185 HG12 ILE 504 HG12 ILE 504 -2.840 -10.865 13.220 186 HG13 ILE 504 HG13 ILE 504 -3.714 -12.387 13.086 187 HG21 ILE 504 HG21 ILE 504 -2.505 -13.396 15.888 188 HG22 ILE 504 HG22 ILE 504 -2.834 -14.379 14.462 189 HG23 ILE 504 HG23 ILE 504 -1.200 -14.299 15.119 190 HD11 ILE 504 HD11 ILE 504 -4.115 -12.315 15.524 191 HD12 ILE 504 HD12 ILE 504 -3.347 -10.727 15.566 192 HD13 ILE 504 HD13 ILE 504 -4.834 -10.963 14.649 193 H VAL 505 H VAL 505 -1.973 -9.450 15.278 194 HA VAL 505 HA VAL 505 -1.514 -8.135 12.758 195 HB VAL 505 HB VAL 505 -2.793 -7.188 15.322 196 HG11 VAL 505 HG11 VAL 505 -3.584 -5.458 13.327 197 HG12 VAL 505 HG12 VAL 505 -2.410 -5.110 14.598 198 HG13 VAL 505 HG13 VAL 505 -1.861 -5.675 13.019 199 HG21 VAL 505 HG21 VAL 505 -4.813 -7.687 14.384 200 HG22 VAL 505 HG22 VAL 505 -4.233 -7.450 12.735 201 HG23 VAL 505 HG23 VAL 505 -3.823 -8.925 13.610 202 H GLY 506 H GLY 506 -0.650 -7.340 16.134 203 HA2 GLY 506 HA2 GLY 506 1.079 -5.220 15.502 204 HA3 GLY 506 HA3 GLY 506 1.102 -6.138 17.000 205 H ALA 507 H ALA 507 1.542 -8.623 15.270 206 HA ALA 507 HA ALA 507 4.401 -8.586 15.457 207 HB1 ALA 507 HB1 ALA 507 3.274 -10.615 16.011 208 HB2 ALA 507 HB2 ALA 507 2.474 -10.665 14.440 209 HB3 ALA 507 HB3 ALA 507 4.217 -10.907 14.549 210 H ILE 508 H ILE 508 2.206 -9.218 12.711 211 HA ILE 508 HA ILE 508 4.244 -9.005 10.758 212 HB ILE 508 HB ILE 508 2.444 -8.962 9.110 213 HG12 ILE 508 HG12 ILE 508 0.068 -9.271 10.321 214 HG13 ILE 508 HG13 ILE 508 0.842 -8.217 11.499 215 HG21 ILE 508 HG21 ILE 508 3.140 -11.045 10.539 216 HG22 ILE 508 HG22 ILE 508 1.492 -10.912 11.151 217 HG23 ILE 508 HG23 ILE 508 1.776 -11.136 9.425 218 HD11 ILE 508 HD11 ILE 508 1.349 -7.112 8.963 219 HD12 ILE 508 HD12 ILE 508 -0.359 -7.550 9.008 220 HD13 ILE 508 HD13 ILE 508 0.311 -6.484 10.242 221 H ALA 509 H ALA 509 2.111 -6.690 12.263 222 HA ALA 509 HA ALA 509 2.474 -4.600 10.367 223 HB1 ALA 509 HB1 ALA 509 1.537 -3.147 12.140 224 HB2 ALA 509 HB2 ALA 509 0.555 -4.577 11.819 225 HB3 ALA 509 HB3 ALA 509 1.589 -4.519 13.247 226 H ASN 510 H ASN 510 4.314 -5.768 13.062 227 HA ASN 510 HA ASN 510 5.990 -3.375 13.106 228 HB2 ASN 510 HB2 ASN 510 5.244 -4.424 15.248 229 HB3 ASN 510 HB3 ASN 510 6.182 -5.854 14.829 230 HD21 ASN 510 HD21 ASN 510 7.595 -5.727 16.511 231 HD22 ASN 510 HD22 ASN 510 8.765 -4.467 16.681 232 H GLU 511 H GLU 511 5.962 -6.629 11.940 233 HA GLU 511 HA GLU 511 8.751 -7.015 11.665 234 HB2 GLU 511 HB2 GLU 511 6.314 -8.278 10.478 235 HB3 GLU 511 HB3 GLU 511 7.887 -8.638 9.781 236 HG2 GLU 511 HG2 GLU 511 7.098 -9.061 12.655 237 HG3 GLU 511 HG3 GLU 511 7.219 -10.312 11.419 238 H GLY 512 H GLY 512 6.279 -5.696 9.504 239 HA2 GLY 512 HA2 GLY 512 8.465 -4.717 7.773 240 HA3 GLY 512 HA3 GLY 512 6.957 -5.333 7.112 241 H ASP 513 H ASP 513 6.375 -3.451 6.073 242 HA ASP 513 HA ASP 513 6.184 -0.982 7.599 243 HB2 ASP 513 HB2 ASP 513 5.989 -1.729 4.721 244 HB3 ASP 513 HB3 ASP 513 5.136 -0.281 5.249 245 H ILE 514 H ILE 514 4.237 -3.649 6.875 246 HA ILE 514 HA ILE 514 1.698 -2.633 6.529 247 HB ILE 514 HB ILE 514 2.466 -5.033 8.195 248 HG12 ILE 514 HG12 ILE 514 1.489 -5.091 5.354 249 HG13 ILE 514 HG13 ILE 514 3.195 -4.834 5.705 250 HG21 ILE 514 HG21 ILE 514 0.253 -4.665 8.754 251 HG22 ILE 514 HG22 ILE 514 -0.150 -4.022 7.163 252 HG23 ILE 514 HG23 ILE 514 0.111 -5.753 7.374 253 HD11 ILE 514 HD11 ILE 514 3.314 -6.955 6.846 254 HD12 ILE 514 HD12 ILE 514 1.583 -7.204 6.616 255 HD13 ILE 514 HD13 ILE 514 2.663 -7.177 5.222 256 H SER 515 H SER 515 0.068 -1.910 7.856 257 HA SER 515 HA SER 515 0.854 -1.262 10.622 258 HB2 SER 515 HB2 SER 515 0.453 0.610 8.784 259 HB3 SER 515 HB3 SER 515 -1.236 0.341 9.214 260 HG SER 515 HG SER 515 -0.452 1.916 10.564 261 H SER 516 H SER 516 -1.045 -0.938 12.098 262 HA SER 516 HA SER 516 -2.613 -3.270 12.172 263 HB2 SER 516 HB2 SER 516 -2.681 -0.680 13.699 264 HB3 SER 516 HB3 SER 516 -3.910 -1.916 13.964 265 HG SER 516 HG SER 516 -1.279 -1.860 14.734 266 H ARG 517 H ARG 517 -3.124 -0.184 10.700 267 HA ARG 517 HA ARG 517 -5.974 -0.669 10.323 268 HB2 ARG 517 HB2 ARG 517 -6.073 1.562 9.412 269 HB3 ARG 517 HB3 ARG 517 -5.157 1.602 10.913 270 HG2 ARG 517 HG2 ARG 517 -3.074 1.670 9.662 271 HG3 ARG 517 HG3 ARG 517 -3.972 1.582 8.145 272 HD2 ARG 517 HD2 ARG 517 -3.972 3.809 10.170 273 HD3 ARG 517 HD3 ARG 517 -3.407 3.866 8.501 274 HE ARG 517 HE ARG 517 -6.113 4.137 9.425 275 HH11 ARG 517 HH11 ARG 517 -4.087 3.239 6.739 276 HH12 ARG 517 HH12 ARG 517 -5.301 3.563 5.547 277 HH21 ARG 517 HH21 ARG 517 -7.719 4.567 7.864 278 HH22 ARG 517 HH22 ARG 517 -7.367 4.319 6.187 279 H TYR 518 H TYR 518 -2.972 -0.581 8.503 280 HA TYR 518 HA TYR 518 -4.015 -0.656 5.910 281 HB2 TYR 518 HB2 TYR 518 -1.485 -0.718 7.048 282 HB3 TYR 518 HB3 TYR 518 -1.606 -2.269 6.224 283 HD1 TYR 518 HD1 TYR 518 -3.161 -1.656 3.848 284 HD2 TYR 518 HD2 TYR 518 -0.125 0.638 5.751 285 HE1 TYR 518 HE1 TYR 518 -2.653 -0.561 1.705 286 HE2 TYR 518 HE2 TYR 518 0.390 1.740 3.614 287 HH TYR 518 HH TYR 518 -0.382 0.643 0.747 288 H ILE 519 H ILE 519 -3.441 -3.224 8.248 289 HA ILE 519 HA ILE 519 -3.788 -5.437 6.582 290 HB ILE 519 HB ILE 519 -4.547 -5.166 9.493 291 HG12 ILE 519 HG12 ILE 519 -2.103 -6.611 8.665 292 HG13 ILE 519 HG13 ILE 519 -2.067 -4.865 8.438 293 HG21 ILE 519 HG21 ILE 519 -5.630 -7.087 8.497 294 HG22 ILE 519 HG22 ILE 519 -4.101 -7.620 7.799 295 HG23 ILE 519 HG23 ILE 519 -4.319 -7.620 9.549 296 HD11 ILE 519 HD11 ILE 519 -2.882 -4.782 10.890 297 HD12 ILE 519 HD12 ILE 519 -2.285 -6.440 10.961 298 HD13 ILE 519 HD13 ILE 519 -1.187 -5.123 10.549 299 H GLY 520 H GLY 520 -5.556 -6.661 5.982 300 HA2 GLY 520 HA2 GLY 520 -8.024 -5.232 5.689 301 HA3 GLY 520 HA3 GLY 520 -7.700 -6.873 5.152 302 H ASN 521 H ASN 521 -9.036 -8.286 6.039 303 HA ASN 521 HA ASN 521 -10.230 -7.706 8.638 304 HB2 ASN 521 HB2 ASN 521 -10.856 -9.820 6.567 305 HB3 ASN 521 HB3 ASN 521 -11.713 -9.645 8.096 306 HD21 ASN 521 HD21 ASN 521 -11.555 -8.709 4.879 307 HD22 ASN 521 HD22 ASN 521 -12.704 -7.419 4.931 308 H ILE 522 H ILE 522 -9.620 -8.675 10.459 309 HA ILE 522 HA ILE 522 -7.926 -11.080 10.255 310 HB ILE 522 HB ILE 522 -7.803 -9.024 12.460 311 HG12 ILE 522 HG12 ILE 522 -5.411 -8.966 11.016 312 HG13 ILE 522 HG13 ILE 522 -6.671 -8.991 9.787 313 HG21 ILE 522 HG21 ILE 522 -5.482 -10.711 11.992 314 HG22 ILE 522 HG22 ILE 522 -6.352 -10.372 13.487 315 HG23 ILE 522 HG23 ILE 522 -6.928 -11.635 12.400 316 HD11 ILE 522 HD11 ILE 522 -6.848 -6.805 10.069 317 HD12 ILE 522 HD12 ILE 522 -7.542 -7.132 11.658 318 HD13 ILE 522 HD13 ILE 522 -5.810 -6.843 11.494 319 H LYS 523 H LYS 523 -8.597 -12.844 11.295 320 HA LYS 523 HA LYS 523 -10.855 -12.567 13.166 321 HB2 LYS 523 HB2 LYS 523 -11.111 -13.889 10.969 322 HB3 LYS 523 HB3 LYS 523 -10.100 -15.107 11.737 323 HG2 LYS 523 HG2 LYS 523 -11.709 -15.458 13.463 324 HG3 LYS 523 HG3 LYS 523 -12.670 -14.082 12.919 325 HD2 LYS 523 HD2 LYS 523 -12.112 -16.303 11.009 326 HD3 LYS 523 HD3 LYS 523 -13.335 -16.538 12.260 327 HE2 LYS 523 HE2 LYS 523 -13.300 -14.187 10.377 328 HE3 LYS 523 HE3 LYS 523 -14.194 -15.673 10.062 329 HZ1 LYS 523 HZ1 LYS 523 -14.862 -14.873 12.629 330 HZ2 LYS 523 HZ2 LYS 523 -15.844 -14.834 11.252 331 HZ3 LYS 523 HZ3 LYS 523 -14.928 -13.476 11.676 332 H LEU 524 H LEU 524 -10.930 -14.015 14.991 333 HA LEU 524 HA LEU 524 -8.423 -15.305 15.739 334 HB2 LEU 524 HB2 LEU 524 -8.447 -12.907 16.555 335 HB3 LEU 524 HB3 LEU 524 -9.779 -13.378 17.608 336 HG LEU 524 HG LEU 524 -7.512 -13.287 18.689 337 HD11 LEU 524 HD11 LEU 524 -9.577 -14.734 19.350 338 HD12 LEU 524 HD12 LEU 524 -8.022 -14.999 20.137 339 HD13 LEU 524 HD13 LEU 524 -8.553 -16.079 18.848 340 HD21 LEU 524 HD21 LEU 524 -6.431 -14.372 16.619 341 HD22 LEU 524 HD22 LEU 524 -6.971 -15.898 17.320 342 HD23 LEU 524 HD23 LEU 524 -5.863 -14.858 18.217 343 H PHE 525 H PHE 525 -9.456 -17.285 15.652 344 HA PHE 525 HA PHE 525 -11.845 -17.706 17.263 345 HB2 PHE 525 HB2 PHE 525 -10.987 -18.792 14.882 346 HB3 PHE 525 HB3 PHE 525 -10.621 -20.069 16.037 347 HD1 PHE 525 HD1 PHE 525 -12.243 -21.650 16.354 348 HD2 PHE 525 HD2 PHE 525 -13.407 -17.692 15.308 349 HE1 PHE 525 HE1 PHE 525 -14.599 -22.356 16.319 350 HE2 PHE 525 HE2 PHE 525 -15.766 -18.391 15.273 351 HZ PHE 525 HZ PHE 525 -16.365 -20.726 15.780 352 H ALA 526 H ALA 526 -11.525 -20.303 18.093 353 HA ALA 526 HA ALA 526 -10.001 -19.960 20.471 354 HB1 ALA 526 HB1 ALA 526 -11.129 -21.744 21.232 355 HB2 ALA 526 HB2 ALA 526 -12.109 -21.526 19.781 356 HB3 ALA 526 HB3 ALA 526 -10.793 -22.700 19.788 357 H SER 527 H SER 527 -9.463 -21.623 17.426 358 HA SER 527 HA SER 527 -6.653 -21.955 18.144 359 HB2 SER 527 HB2 SER 527 -8.407 -24.229 17.185 360 HB3 SER 527 HB3 SER 527 -6.648 -24.298 17.294 361 HG SER 527 HG SER 527 -6.801 -24.576 19.373 362 H HIS 528 H HIS 528 -8.115 -20.203 16.343 363 HA HIS 528 HA HIS 528 -6.540 -20.682 13.967 364 HB2 HIS 528 HB2 HIS 528 -9.548 -20.780 13.940 365 HB3 HIS 528 HB3 HIS 528 -8.633 -20.311 12.510 366 HD1 HIS 528 HD1 HIS 528 -9.460 -23.253 14.652 367 HD2 HIS 528 HD2 HIS 528 -7.240 -22.394 11.246 368 HE1 HIS 528 HE1 HIS 528 -8.879 -25.484 13.647 369 H SER 529 H SER 529 -6.704 -18.839 12.424 370 HA SER 529 HA SER 529 -7.923 -16.399 13.238 371 HB2 SER 529 HB2 SER 529 -5.331 -15.458 13.303 372 HB3 SER 529 HB3 SER 529 -6.351 -15.738 14.715 373 HG SER 529 HG SER 529 -4.656 -16.960 15.184 374 H THR 530 H THR 530 -8.163 -15.112 11.513 375 HA THR 530 HA THR 530 -6.626 -15.784 9.095 376 HB THR 530 HB THR 530 -8.445 -15.018 7.767 377 HG1 THR 530 HG1 THR 530 -9.272 -13.253 8.721 378 HG21 THR 530 HG21 THR 530 -8.651 -17.219 9.235 379 HG22 THR 530 HG22 THR 530 -9.964 -16.677 8.189 380 HG23 THR 530 HG23 THR 530 -10.017 -16.339 9.919 381 H ILE 531 H ILE 531 -6.356 -13.913 7.549 382 HA ILE 531 HA ILE 531 -6.407 -11.244 8.459 383 HB ILE 531 HB ILE 531 -4.615 -11.888 9.944 384 HG12 ILE 531 HG12 ILE 531 -3.259 -10.470 7.662 385 HG13 ILE 531 HG13 ILE 531 -4.557 -9.701 8.568 386 HG21 ILE 531 HG21 ILE 531 -3.852 -13.879 8.772 387 HG22 ILE 531 HG22 ILE 531 -3.188 -12.880 7.480 388 HG23 ILE 531 HG23 ILE 531 -2.500 -12.795 9.101 389 HD11 ILE 531 HD11 ILE 531 -1.959 -10.707 9.704 390 HD12 ILE 531 HD12 ILE 531 -2.391 -9.023 9.407 391 HD13 ILE 531 HD13 ILE 531 -3.262 -9.956 10.624 392 H GLU 532 H GLU 532 -5.924 -9.798 6.834 393 HA GLU 532 HA GLU 532 -5.070 -10.986 4.275 394 HB2 GLU 532 HB2 GLU 532 -7.502 -10.242 4.472 395 HB3 GLU 532 HB3 GLU 532 -6.887 -8.596 4.545 396 HG2 GLU 532 HG2 GLU 532 -6.134 -8.641 2.356 397 HG3 GLU 532 HG3 GLU 532 -6.111 -10.403 2.295 398 H LEU 533 H LEU 533 -3.267 -10.182 3.436 399 HA LEU 533 HA LEU 533 -2.312 -7.573 4.412 400 HB2 LEU 533 HB2 LEU 533 -1.002 -10.145 3.942 401 HB3 LEU 533 HB3 LEU 533 -0.139 -8.771 3.254 402 HG LEU 533 HG LEU 533 0.002 -7.732 5.446 403 HD11 LEU 533 HD11 LEU 533 -1.954 -9.805 6.117 404 HD12 LEU 533 HD12 LEU 533 -1.676 -8.224 6.846 405 HD13 LEU 533 HD13 LEU 533 -0.670 -9.597 7.308 406 HD21 LEU 533 HD21 LEU 533 1.325 -9.613 6.601 407 HD22 LEU 533 HD22 LEU 533 1.867 -9.057 5.017 408 HD23 LEU 533 HD23 LEU 533 0.953 -10.560 5.160 409 HA PRO 534 HA PRO 534 -2.955 -6.140 0.261 410 HB2 PRO 534 HB2 PRO 534 -1.790 -3.710 0.592 411 HB3 PRO 534 HB3 PRO 534 -3.401 -4.095 1.210 412 HG2 PRO 534 HG2 PRO 534 -0.780 -4.047 2.654 413 HG3 PRO 534 HG3 PRO 534 -2.358 -3.434 3.180 414 HD2 PRO 534 HD2 PRO 534 -1.363 -5.807 4.023 415 HD3 PRO 534 HD3 PRO 534 -3.102 -5.523 3.807 416 H LYS 535 H LYS 535 -0.024 -6.909 1.737 417 HA LYS 535 HA LYS 535 1.969 -5.891 0.164 418 HB2 LYS 535 HB2 LYS 535 1.742 -8.725 1.195 419 HB3 LYS 535 HB3 LYS 535 3.226 -7.973 0.625 420 HG2 LYS 535 HG2 LYS 535 1.738 -6.583 2.776 421 HG3 LYS 535 HG3 LYS 535 2.573 -8.081 3.193 422 HD2 LYS 535 HD2 LYS 535 4.129 -6.359 3.602 423 HD3 LYS 535 HD3 LYS 535 4.619 -7.078 2.066 424 HE2 LYS 535 HE2 LYS 535 3.983 -5.245 0.851 425 HE3 LYS 535 HE3 LYS 535 2.742 -4.772 2.009 426 HZ1 LYS 535 HZ1 LYS 535 4.309 -3.187 2.405 427 HZ2 LYS 535 HZ2 LYS 535 5.613 -4.194 2.023 428 HZ3 LYS 535 HZ3 LYS 535 4.827 -4.357 3.513 429 H GLY 536 H GLY 536 3.009 -6.507 -1.754 430 HA2 GLY 536 HA2 GLY 536 1.447 -8.308 -3.497 431 HA3 GLY 536 HA3 GLY 536 2.049 -6.761 -4.075 432 H MET 537 H MET 537 3.671 -9.181 -2.052 433 HA MET 537 HA MET 537 5.230 -10.334 -4.081 434 HB2 MET 537 HB2 MET 537 6.062 -7.834 -3.867 435 HB3 MET 537 HB3 MET 537 6.943 -8.477 -2.488 436 HG2 MET 537 HG2 MET 537 8.502 -8.744 -4.119 437 HG3 MET 537 HG3 MET 537 7.684 -10.302 -4.219 438 HE1 MET 537 HE1 MET 537 6.042 -10.616 -7.317 439 HE2 MET 537 HE2 MET 537 7.777 -10.926 -7.261 440 HE3 MET 537 HE3 MET 537 6.776 -11.256 -5.847 441 HA PRO 538 HA PRO 538 5.254 -12.230 0.186 442 HB2 PRO 538 HB2 PRO 538 4.185 -14.603 -0.586 443 HB3 PRO 538 HB3 PRO 538 3.199 -13.214 -0.113 444 HG2 PRO 538 HG2 PRO 538 3.916 -14.183 -2.853 445 HG3 PRO 538 HG3 PRO 538 2.355 -13.603 -2.244 446 HD2 PRO 538 HD2 PRO 538 4.013 -12.048 -3.716 447 HD3 PRO 538 HD3 PRO 538 2.954 -11.387 -2.454 448 H GLY 539 H GLY 539 6.044 -14.649 0.604 449 HA2 GLY 539 HA2 GLY 539 7.551 -16.381 0.024 450 HA3 GLY 539 HA3 GLY 539 8.113 -15.406 -1.325 451 H GLU 540 H GLU 540 7.879 -13.484 1.388 452 HA GLU 540 HA GLU 540 10.746 -13.349 1.640 453 HB2 GLU 540 HB2 GLU 540 8.754 -11.902 3.373 454 HB3 GLU 540 HB3 GLU 540 10.397 -11.424 2.971 455 HG2 GLU 540 HG2 GLU 540 8.051 -11.490 1.088 456 HG3 GLU 540 HG3 GLU 540 8.789 -10.053 1.794 457 H VAL 541 H VAL 541 8.096 -13.897 3.967 458 HA VAL 541 HA VAL 541 9.930 -14.938 5.936 459 HB VAL 541 HB VAL 541 6.909 -14.933 5.989 460 HG11 VAL 541 HG11 VAL 541 7.276 -15.049 8.459 461 HG12 VAL 541 HG12 VAL 541 7.774 -16.494 7.578 462 HG13 VAL 541 HG13 VAL 541 8.985 -15.338 8.135 463 HG21 VAL 541 HG21 VAL 541 7.227 -12.695 5.992 464 HG22 VAL 541 HG22 VAL 541 7.614 -12.974 7.690 465 HG23 VAL 541 HG23 VAL 541 8.910 -12.825 6.503 466 H LEU 542 H LEU 542 7.638 -16.214 3.613 467 HA LEU 542 HA LEU 542 7.492 -18.849 4.605 468 HB2 LEU 542 HB2 LEU 542 7.234 -17.951 1.741 469 HB3 LEU 542 HB3 LEU 542 6.609 -19.444 2.440 470 HG LEU 542 HG LEU 542 5.663 -16.688 3.217 471 HD11 LEU 542 HD11 LEU 542 3.598 -17.445 1.916 472 HD12 LEU 542 HD12 LEU 542 4.665 -18.623 1.152 473 HD13 LEU 542 HD13 LEU 542 4.994 -16.898 0.986 474 HD21 LEU 542 HD21 LEU 542 5.389 -18.513 4.887 475 HD22 LEU 542 HD22 LEU 542 4.425 -19.394 3.701 476 HD23 LEU 542 HD23 LEU 542 3.866 -17.836 4.311 477 H GLN 543 H GLN 543 9.932 -17.164 2.858 478 HA GLN 543 HA GLN 543 11.234 -19.554 1.879 479 HB2 GLN 543 HB2 GLN 543 11.689 -16.626 1.666 480 HB3 GLN 543 HB3 GLN 543 13.096 -17.667 1.502 481 HG2 GLN 543 HG2 GLN 543 10.580 -17.908 -0.131 482 HG3 GLN 543 HG3 GLN 543 12.051 -17.085 -0.650 483 HE21 GLN 543 HE21 GLN 543 14.066 -18.498 -0.423 484 HE22 GLN 543 HE22 GLN 543 13.916 -20.120 -0.997 485 H HIS 544 H HIS 544 12.202 -16.938 4.107 486 HA HIS 544 HA HIS 544 14.419 -18.365 5.148 487 HB2 HIS 544 HB2 HIS 544 13.933 -15.818 5.186 488 HB3 HIS 544 HB3 HIS 544 13.010 -16.171 6.644 489 HD1 HIS 544 HD1 HIS 544 14.425 -17.283 8.643 490 HD2 HIS 544 HD2 HIS 544 16.626 -15.572 5.562 491 HE1 HIS 544 HE1 HIS 544 16.746 -16.978 9.562 492 H PHE 545 H PHE 545 11.250 -17.592 6.591 493 HA PHE 545 HA PHE 545 11.711 -19.520 8.712 494 HB2 PHE 545 HB2 PHE 545 9.624 -17.447 8.146 495 HB3 PHE 545 HB3 PHE 545 9.269 -18.740 9.287 496 HD1 PHE 545 HD1 PHE 545 9.543 -18.164 11.480 497 HD2 PHE 545 HD2 PHE 545 12.152 -16.473 8.574 498 HE1 PHE 545 HE1 PHE 545 10.705 -16.917 13.254 499 HE2 PHE 545 HE2 PHE 545 13.319 -15.224 10.343 500 HZ PHE 545 HZ PHE 545 12.596 -15.445 12.687 501 H THR 546 H THR 546 11.692 -20.794 6.296 502 HA THR 546 HA THR 546 9.074 -21.835 5.700 503 HB THR 546 HB THR 546 10.899 -21.579 3.984 504 HG1 THR 546 HG1 THR 546 10.463 -23.881 3.195 505 HG21 THR 546 HG21 THR 546 12.746 -22.968 3.915 506 HG22 THR 546 HG22 THR 546 12.002 -24.183 4.954 507 HG23 THR 546 HG23 THR 546 12.594 -22.673 5.646 508 H ARG 547 H ARG 547 11.806 -22.768 7.652 509 HA ARG 547 HA ARG 547 10.545 -25.358 8.231 510 HB2 ARG 547 HB2 ARG 547 12.664 -26.107 9.040 511 HB3 ARG 547 HB3 ARG 547 12.949 -25.303 7.502 512 HG2 ARG 547 HG2 ARG 547 14.547 -24.174 8.552 513 HG3 ARG 547 HG3 ARG 547 13.247 -23.272 9.333 514 HD2 ARG 547 HD2 ARG 547 13.379 -24.521 11.282 515 HD3 ARG 547 HD3 ARG 547 14.175 -25.873 10.478 516 HE ARG 547 HE ARG 547 15.882 -23.678 10.330 517 HH11 ARG 547 HH11 ARG 547 14.493 -25.758 12.752 518 HH12 ARG 547 HH12 ARG 547 15.823 -25.585 13.850 519 HH21 ARG 547 HH21 ARG 547 17.638 -23.442 11.766 520 HH22 ARG 547 HH22 ARG 547 17.610 -24.266 13.288 521 H THR 548 H THR 548 11.242 -22.264 9.553 522 HA THR 548 HA THR 548 10.411 -23.195 12.224 523 HB THR 548 HB THR 548 12.077 -20.772 11.516 524 HG1 THR 548 HG1 THR 548 13.686 -21.970 12.702 525 HG21 THR 548 HG21 THR 548 12.191 -21.327 14.271 526 HG22 THR 548 HG22 THR 548 10.483 -21.361 13.832 527 HG23 THR 548 HG23 THR 548 11.456 -19.932 13.484 528 H ARG 549 H ARG 549 8.595 -22.386 13.081 529 HA ARG 549 HA ARG 549 7.514 -19.856 12.152 530 HB2 ARG 549 HB2 ARG 549 6.147 -22.503 11.719 531 HB3 ARG 549 HB3 ARG 549 5.237 -21.003 11.830 532 HG2 ARG 549 HG2 ARG 549 5.520 -20.873 9.626 533 HG3 ARG 549 HG3 ARG 549 7.172 -20.377 10.000 534 HD2 ARG 549 HD2 ARG 549 7.884 -22.152 8.868 535 HD3 ARG 549 HD3 ARG 549 7.189 -23.165 10.132 536 HE ARG 549 HE ARG 549 5.461 -23.704 8.717 537 HH11 ARG 549 HH11 ARG 549 7.263 -21.033 7.399 538 HH12 ARG 549 HH12 ARG 549 6.464 -21.083 5.863 539 HH21 ARG 549 HH21 ARG 549 4.402 -23.781 6.698 540 HH22 ARG 549 HH22 ARG 549 4.836 -22.646 5.465 541 H ILE 550 H ILE 550 5.266 -19.540 13.331 542 HA ILE 550 HA ILE 550 4.927 -20.820 15.849 543 HB ILE 550 HB ILE 550 6.984 -19.221 16.104 544 HG12 ILE 550 HG12 ILE 550 5.100 -18.627 18.277 545 HG13 ILE 550 HG13 ILE 550 5.168 -20.331 17.841 546 HG21 ILE 550 HG21 ILE 550 5.327 -17.360 15.141 547 HG22 ILE 550 HG22 ILE 550 4.997 -17.167 16.862 548 HG23 ILE 550 HG23 ILE 550 6.643 -16.986 16.255 549 HD11 ILE 550 HD11 ILE 550 6.814 -19.138 19.611 550 HD12 ILE 550 HD12 ILE 550 7.219 -20.594 18.701 551 HD13 ILE 550 HD13 ILE 550 7.774 -19.019 18.136 552 H LEU 551 H LEU 551 3.490 -19.198 17.301 553 HA LEU 551 HA LEU 551 1.007 -19.051 16.313 554 HB2 LEU 551 HB2 LEU 551 0.483 -17.336 17.910 555 HB3 LEU 551 HB3 LEU 551 1.641 -18.460 18.617 556 HG LEU 551 HG LEU 551 3.345 -16.594 17.738 557 HD11 LEU 551 HD11 LEU 551 1.140 -15.338 17.000 558 HD12 LEU 551 HD12 LEU 551 2.535 -14.467 17.638 559 HD13 LEU 551 HD13 LEU 551 1.161 -14.819 18.686 560 HD21 LEU 551 HD21 LEU 551 3.040 -17.515 20.044 561 HD22 LEU 551 HD22 LEU 551 1.803 -16.286 20.308 562 HD23 LEU 551 HD23 LEU 551 3.470 -15.806 19.985 563 H ASN 552 H ASN 552 3.494 -16.582 15.824 564 HA ASN 552 HA ASN 552 1.761 -14.885 14.282 565 HB2 ASN 552 HB2 ASN 552 3.541 -13.851 15.539 566 HB3 ASN 552 HB3 ASN 552 4.750 -14.849 14.737 567 HD21 ASN 552 HD21 ASN 552 1.989 -13.073 13.423 568 HD22 ASN 552 HD22 ASN 552 2.916 -12.071 12.364 569 H LYS 553 H LYS 553 4.761 -16.627 13.438 570 HA LYS 553 HA LYS 553 4.459 -16.359 10.661 571 HB2 LYS 553 HB2 LYS 553 5.860 -18.720 11.861 572 HB3 LYS 553 HB3 LYS 553 6.306 -17.762 10.455 573 HG2 LYS 553 HG2 LYS 553 6.580 -17.013 13.353 574 HG3 LYS 553 HG3 LYS 553 7.866 -17.278 12.173 575 HD2 LYS 553 HD2 LYS 553 6.687 -15.340 10.880 576 HD3 LYS 553 HD3 LYS 553 5.997 -14.962 12.460 577 HE2 LYS 553 HE2 LYS 553 8.928 -15.157 11.776 578 HE3 LYS 553 HE3 LYS 553 8.023 -13.678 12.095 579 HZ1 LYS 553 HZ1 LYS 553 7.512 -14.907 14.330 580 HZ2 LYS 553 HZ2 LYS 553 8.955 -14.049 14.125 581 HZ3 LYS 553 HZ3 LYS 553 8.944 -15.733 13.969 582 HA PRO 554 HA PRO 554 1.582 -19.431 9.422 583 HB2 PRO 554 HB2 PRO 554 2.753 -20.514 7.225 584 HB3 PRO 554 HB3 PRO 554 2.063 -18.886 7.242 585 HG2 PRO 554 HG2 PRO 554 4.920 -19.736 7.523 586 HG3 PRO 554 HG3 PRO 554 4.238 -18.398 6.580 587 HD2 PRO 554 HD2 PRO 554 5.410 -18.031 8.994 588 HD3 PRO 554 HD3 PRO 554 4.066 -17.022 8.421 589 H MET 555 H MET 555 2.192 -20.638 11.469 590 HA MET 555 HA MET 555 4.000 -22.813 11.371 591 HB2 MET 555 HB2 MET 555 3.370 -21.952 13.508 592 HB3 MET 555 HB3 MET 555 1.661 -22.199 13.175 593 HG2 MET 555 HG2 MET 555 2.431 -23.877 14.706 594 HG3 MET 555 HG3 MET 555 2.039 -24.628 13.161 595 HE1 MET 555 HE1 MET 555 5.360 -25.318 15.675 596 HE2 MET 555 HE2 MET 555 3.601 -25.247 15.780 597 HE3 MET 555 HE3 MET 555 4.383 -26.617 14.990 598 H ASN 556 H ASN 556 0.460 -22.651 11.044 599 HA ASN 556 HA ASN 556 0.512 -24.972 9.310 600 HB2 ASN 556 HB2 ASN 556 0.316 -25.768 11.748 601 HB3 ASN 556 HB3 ASN 556 -1.299 -25.067 11.716 602 HD21 ASN 556 HD21 ASN 556 -2.176 -27.135 12.059 603 HD22 ASN 556 HD22 ASN 556 -2.286 -28.286 10.776 604 H MET 557 H MET 557 -0.061 -22.771 8.203 605 HA MET 557 HA MET 557 -2.961 -22.317 8.359 606 HB2 MET 557 HB2 MET 557 -2.532 -20.199 7.204 607 HB3 MET 557 HB3 MET 557 -1.587 -20.320 8.683 608 HG2 MET 557 HG2 MET 557 0.397 -20.463 7.574 609 HG3 MET 557 HG3 MET 557 -0.327 -21.198 6.145 610 HE1 MET 557 HE1 MET 557 -1.596 -19.275 4.037 611 HE2 MET 557 HE2 MET 557 0.027 -18.639 3.767 612 HE3 MET 557 HE3 MET 557 -0.192 -20.320 4.258 613 H GLN 558 H GLN 558 -3.673 -21.385 6.011 614 HA GLN 558 HA GLN 558 -2.583 -22.838 3.794 615 HB2 GLN 558 HB2 GLN 558 -4.353 -24.346 3.369 616 HB3 GLN 558 HB3 GLN 558 -3.959 -24.549 5.071 617 HG2 GLN 558 HG2 GLN 558 -5.852 -23.016 5.612 618 HG3 GLN 558 HG3 GLN 558 -6.291 -23.053 3.905 619 HE21 GLN 558 HE21 GLN 558 -8.059 -24.235 3.737 620 HE22 GLN 558 HE22 GLN 558 -8.306 -25.793 4.441 621 H LEU 559 H LEU 559 -3.078 -21.858 1.912 622 HA LEU 559 HA LEU 559 -4.447 -19.373 1.963 623 HB2 LEU 559 HB2 LEU 559 -2.551 -19.951 0.454 624 HB3 LEU 559 HB3 LEU 559 -3.646 -21.001 -0.443 625 HG LEU 559 HG LEU 559 -3.162 -18.708 -1.429 626 HD11 LEU 559 HD11 LEU 559 -5.092 -18.867 -2.565 627 HD12 LEU 559 HD12 LEU 559 -6.078 -18.837 -1.103 628 HD13 LEU 559 HD13 LEU 559 -5.312 -20.340 -1.619 629 HD21 LEU 559 HD21 LEU 559 -5.280 -17.568 0.270 630 HD22 LEU 559 HD22 LEU 559 -3.852 -16.808 -0.432 631 HD23 LEU 559 HD23 LEU 559 -3.706 -17.771 1.039 632 H LEU 560 H LEU 560 -6.552 -19.001 1.830 633 HA LEU 560 HA LEU 560 -8.264 -21.046 0.577 634 HB2 LEU 560 HB2 LEU 560 -9.931 -20.657 2.139 635 HB3 LEU 560 HB3 LEU 560 -8.452 -20.601 3.096 636 HG LEU 560 HG LEU 560 -8.738 -17.984 2.544 637 HD11 LEU 560 HD11 LEU 560 -10.778 -17.363 1.931 638 HD12 LEU 560 HD12 LEU 560 -11.517 -18.328 3.208 639 HD13 LEU 560 HD13 LEU 560 -11.151 -19.063 1.647 640 HD21 LEU 560 HD21 LEU 560 -8.666 -19.443 4.750 641 HD22 LEU 560 HD22 LEU 560 -10.381 -19.033 4.786 642 HD23 LEU 560 HD23 LEU 560 -9.168 -17.752 4.771 643 H GLY 561 H GLY 561 -7.355 -17.712 0.698 644 HA2 GLY 561 HA2 GLY 561 -9.628 -16.802 -0.855 645 HA3 GLY 561 HA3 GLY 561 -8.255 -15.832 -0.342 646 H ASP 562 H ASP 562 -8.185 -14.917 -2.454 647 HA ASP 562 HA ASP 562 -6.388 -16.275 -4.198 648 HB2 ASP 562 HB2 ASP 562 -8.609 -17.330 -4.782 649 HB3 ASP 562 HB3 ASP 562 -9.134 -15.743 -5.339 650 H ALA 563 H ALA 563 -5.095 -14.726 -4.912 651 HA ALA 563 HA ALA 563 -5.451 -12.017 -4.559 652 HB1 ALA 563 HB1 ALA 563 -3.412 -11.809 -5.477 653 HB2 ALA 563 HB2 ALA 563 -3.416 -13.573 -5.450 654 HB3 ALA 563 HB3 ALA 563 -3.859 -12.713 -6.925 655 H GLN 564 H GLN 564 -6.519 -10.439 -5.584 656 HA GLN 564 HA GLN 564 -8.509 -10.958 -7.458 657 HB2 GLN 564 HB2 GLN 564 -7.831 -8.818 -5.921 658 HB3 GLN 564 HB3 GLN 564 -7.382 -8.234 -7.518 659 HG2 GLN 564 HG2 GLN 564 -9.637 -8.695 -8.326 660 HG3 GLN 564 HG3 GLN 564 -10.089 -9.287 -6.728 661 HE21 GLN 564 HE21 GLN 564 -10.661 -6.847 -8.618 662 HE22 GLN 564 HE22 GLN 564 -10.707 -5.529 -7.503 Start of MODEL 5 1 H MET 480 H MET 480 -1.319 0.236 -2.422 2 HA MET 480 HA MET 480 0.727 0.574 -3.490 3 HB2 MET 480 HB2 MET 480 1.128 0.922 -0.527 4 HB3 MET 480 HB3 MET 480 2.382 1.342 -1.686 5 HG2 MET 480 HG2 MET 480 1.019 3.007 -2.685 6 HG3 MET 480 HG3 MET 480 -0.401 2.467 -1.792 7 HE1 MET 480 HE1 MET 480 -0.447 5.430 0.346 8 HE2 MET 480 HE2 MET 480 -1.111 4.531 -1.019 9 HE3 MET 480 HE3 MET 480 -1.090 3.805 0.589 10 H ALA 481 H ALA 481 0.458 -2.097 -3.598 11 HA ALA 481 HA ALA 481 2.937 -3.239 -2.517 12 HB1 ALA 481 HB1 ALA 481 1.776 -5.098 -2.177 13 HB2 ALA 481 HB2 ALA 481 0.328 -4.249 -2.722 14 HB3 ALA 481 HB3 ALA 481 1.301 -5.164 -3.874 15 H ASP 482 H ASP 482 3.423 -5.270 -4.251 16 HA ASP 482 HA ASP 482 4.545 -3.848 -6.506 17 HB2 ASP 482 HB2 ASP 482 5.522 -5.856 -5.021 18 HB3 ASP 482 HB3 ASP 482 4.784 -6.804 -6.309 19 H VAL 483 H VAL 483 1.865 -5.936 -5.861 20 HA VAL 483 HA VAL 483 0.959 -5.625 -8.607 21 HB VAL 483 HB VAL 483 2.129 -7.716 -8.794 22 HG11 VAL 483 HG11 VAL 483 0.482 -8.752 -6.492 23 HG12 VAL 483 HG12 VAL 483 1.767 -9.598 -7.358 24 HG13 VAL 483 HG13 VAL 483 2.151 -8.204 -6.347 25 HG21 VAL 483 HG21 VAL 483 0.307 -9.203 -9.441 26 HG22 VAL 483 HG22 VAL 483 -0.834 -8.224 -8.520 27 HG23 VAL 483 HG23 VAL 483 -0.032 -7.545 -9.936 28 H GLY 484 H GLY 484 0.318 -6.916 -5.371 29 HA2 GLY 484 HA2 GLY 484 -1.684 -5.885 -4.290 30 HA3 GLY 484 HA3 GLY 484 -2.535 -6.260 -5.781 31 H ASP 485 H ASP 485 -0.207 -8.380 -4.224 32 HA ASP 485 HA ASP 485 -1.894 -10.623 -4.335 33 HB2 ASP 485 HB2 ASP 485 0.751 -10.288 -3.918 34 HB3 ASP 485 HB3 ASP 485 0.228 -10.607 -2.267 35 H MET 486 H MET 486 -3.865 -10.288 -3.368 36 HA MET 486 HA MET 486 -3.812 -9.973 -0.439 37 HB2 MET 486 HB2 MET 486 -5.038 -8.281 -2.297 38 HB3 MET 486 HB3 MET 486 -6.351 -9.240 -1.628 39 HG2 MET 486 HG2 MET 486 -6.251 -8.222 0.357 40 HG3 MET 486 HG3 MET 486 -4.489 -8.211 0.373 41 HE1 MET 486 HE1 MET 486 -7.133 -5.133 -1.785 42 HE2 MET 486 HE2 MET 486 -6.489 -6.488 -2.712 43 HE3 MET 486 HE3 MET 486 -7.573 -6.785 -1.352 44 H GLN 487 H GLN 487 -4.465 -11.736 0.587 45 HA GLN 487 HA GLN 487 -6.733 -13.254 -0.408 46 HB2 GLN 487 HB2 GLN 487 -4.179 -14.715 0.237 47 HB3 GLN 487 HB3 GLN 487 -5.640 -15.358 -0.502 48 HG2 GLN 487 HG2 GLN 487 -5.218 -14.100 -2.519 49 HG3 GLN 487 HG3 GLN 487 -3.808 -13.342 -1.781 50 HE21 GLN 487 HE21 GLN 487 -4.370 -15.276 -4.111 51 HE22 GLN 487 HE22 GLN 487 -3.157 -16.490 -3.913 52 H LEU 488 H LEU 488 -7.162 -15.152 1.196 53 HA LEU 488 HA LEU 488 -6.880 -14.043 3.906 54 HB2 LEU 488 HB2 LEU 488 -9.172 -14.415 2.790 55 HB3 LEU 488 HB3 LEU 488 -8.879 -16.126 3.097 56 HG LEU 488 HG LEU 488 -8.732 -15.641 5.510 57 HD11 LEU 488 HD11 LEU 488 -8.498 -12.976 4.611 58 HD12 LEU 488 HD12 LEU 488 -8.467 -13.577 6.268 59 HD13 LEU 488 HD13 LEU 488 -9.995 -13.087 5.536 60 HD21 LEU 488 HD21 LEU 488 -10.864 -16.290 4.389 61 HD22 LEU 488 HD22 LEU 488 -11.281 -14.578 4.303 62 HD23 LEU 488 HD23 LEU 488 -11.079 -15.360 5.872 63 H TYR 489 H TYR 489 -5.255 -14.985 4.959 64 HA TYR 489 HA TYR 489 -4.818 -17.870 4.600 65 HB2 TYR 489 HB2 TYR 489 -2.865 -16.091 6.009 66 HB3 TYR 489 HB3 TYR 489 -2.570 -17.559 5.084 67 HD1 TYR 489 HD1 TYR 489 -3.167 -13.942 4.877 68 HD2 TYR 489 HD2 TYR 489 -2.304 -17.485 2.686 69 HE1 TYR 489 HE1 TYR 489 -2.574 -12.579 2.918 70 HE2 TYR 489 HE2 TYR 489 -1.708 -16.132 0.720 71 HH TYR 489 HH TYR 489 -2.532 -13.441 0.021 72 H ARG 490 H ARG 490 -5.695 -19.101 6.116 73 HA ARG 490 HA ARG 490 -6.081 -18.009 8.810 74 HB2 ARG 490 HB2 ARG 490 -7.699 -19.761 9.147 75 HB3 ARG 490 HB3 ARG 490 -8.040 -18.970 7.614 76 HG2 ARG 490 HG2 ARG 490 -8.173 -21.050 6.814 77 HG3 ARG 490 HG3 ARG 490 -6.409 -20.993 6.821 78 HD2 ARG 490 HD2 ARG 490 -6.725 -22.923 7.992 79 HD3 ARG 490 HD3 ARG 490 -6.755 -21.769 9.324 80 HE ARG 490 HE ARG 490 -8.986 -22.220 9.632 81 HH11 ARG 490 HH11 ARG 490 -7.932 -23.558 6.596 82 HH12 ARG 490 HH12 ARG 490 -9.394 -24.449 6.331 83 HH21 ARG 490 HH21 ARG 490 -10.916 -23.389 9.296 84 HH22 ARG 490 HH22 ARG 490 -11.091 -24.351 7.867 85 H ILE 491 H ILE 491 -4.985 -18.747 10.524 86 HA ILE 491 HA ILE 491 -3.074 -20.931 10.075 87 HB ILE 491 HB ILE 491 -1.803 -20.076 11.929 88 HG12 ILE 491 HG12 ILE 491 -4.037 -18.065 12.279 89 HG13 ILE 491 HG13 ILE 491 -3.669 -19.398 13.369 90 HG21 ILE 491 HG21 ILE 491 -2.344 -18.613 9.568 91 HG22 ILE 491 HG22 ILE 491 -2.120 -17.453 10.876 92 HG23 ILE 491 HG23 ILE 491 -0.863 -18.639 10.525 93 HD11 ILE 491 HD11 ILE 491 -2.068 -16.917 12.857 94 HD12 ILE 491 HD12 ILE 491 -2.766 -17.486 14.373 95 HD13 ILE 491 HD13 ILE 491 -1.391 -18.331 13.663 96 H GLU 492 H GLU 492 -2.559 -22.222 12.114 97 HA GLU 492 HA GLU 492 -5.098 -23.153 13.233 98 HB2 GLU 492 HB2 GLU 492 -3.466 -24.721 12.069 99 HB3 GLU 492 HB3 GLU 492 -2.413 -24.506 13.461 100 HG2 GLU 492 HG2 GLU 492 -4.618 -25.190 14.760 101 HG3 GLU 492 HG3 GLU 492 -4.972 -25.976 13.223 102 H VAL 493 H VAL 493 -4.481 -20.835 14.378 103 HA VAL 493 HA VAL 493 -3.761 -21.629 17.097 104 HB VAL 493 HB VAL 493 -2.605 -19.110 15.918 105 HG11 VAL 493 HG11 VAL 493 -1.294 -19.013 17.878 106 HG12 VAL 493 HG12 VAL 493 -2.929 -19.403 18.416 107 HG13 VAL 493 HG13 VAL 493 -1.703 -20.668 18.326 108 HG21 VAL 493 HG21 VAL 493 -0.456 -20.298 15.767 109 HG22 VAL 493 HG22 VAL 493 -1.273 -21.806 16.179 110 HG23 VAL 493 HG23 VAL 493 -1.666 -20.972 14.675 111 H GLY 494 H GLY 494 -4.847 -20.527 18.683 112 HA2 GLY 494 HA2 GLY 494 -6.368 -18.139 17.992 113 HA3 GLY 494 HA3 GLY 494 -7.309 -19.557 18.430 114 H ARG 495 H ARG 495 -8.026 -17.909 20.091 115 HA ARG 495 HA ARG 495 -6.394 -16.999 22.150 116 HB2 ARG 495 HB2 ARG 495 -8.491 -16.895 23.502 117 HB3 ARG 495 HB3 ARG 495 -8.628 -16.150 21.914 118 HG2 ARG 495 HG2 ARG 495 -9.884 -17.974 21.069 119 HG3 ARG 495 HG3 ARG 495 -9.536 -18.956 22.494 120 HD2 ARG 495 HD2 ARG 495 -10.917 -17.622 23.869 121 HD3 ARG 495 HD3 ARG 495 -11.022 -16.348 22.655 122 HE ARG 495 HE ARG 495 -12.086 -18.744 21.618 123 HH11 ARG 495 HH11 ARG 495 -12.795 -16.232 23.923 124 HH12 ARG 495 HH12 ARG 495 -14.513 -16.414 23.789 125 HH21 ARG 495 HH21 ARG 495 -14.346 -18.992 21.433 126 HH22 ARG 495 HH22 ARG 495 -15.394 -17.984 22.373 127 H ASP 496 H ASP 496 -7.858 -20.134 21.638 128 HA ASP 496 HA ASP 496 -7.340 -21.122 24.273 129 HB2 ASP 496 HB2 ASP 496 -8.993 -21.953 22.346 130 HB3 ASP 496 HB3 ASP 496 -7.625 -23.003 21.983 131 H ASP 497 H ASP 497 -5.454 -20.677 21.463 132 HA ASP 497 HA ASP 497 -3.468 -22.664 22.262 133 HB2 ASP 497 HB2 ASP 497 -4.173 -22.316 19.844 134 HB3 ASP 497 HB3 ASP 497 -3.312 -20.780 19.909 135 H GLY 498 H GLY 498 -3.845 -19.166 21.915 136 HA2 GLY 498 HA2 GLY 498 -2.638 -18.015 23.856 137 HA3 GLY 498 HA3 GLY 498 -1.214 -18.808 23.198 138 H VAL 499 H VAL 499 -3.806 -17.422 21.271 139 HA VAL 499 HA VAL 499 -2.049 -15.186 20.531 140 HB VAL 499 HB VAL 499 -1.982 -17.137 18.860 141 HG11 VAL 499 HG11 VAL 499 -4.409 -16.075 17.587 142 HG12 VAL 499 HG12 VAL 499 -3.803 -17.730 17.678 143 HG13 VAL 499 HG13 VAL 499 -4.684 -17.036 19.040 144 HG21 VAL 499 HG21 VAL 499 -1.613 -15.667 17.090 145 HG22 VAL 499 HG22 VAL 499 -2.873 -14.555 17.623 146 HG23 VAL 499 HG23 VAL 499 -1.357 -14.663 18.517 147 H GLU 500 H GLU 500 -3.107 -13.318 19.799 148 HA GLU 500 HA GLU 500 -6.031 -13.308 20.156 149 HB2 GLU 500 HB2 GLU 500 -4.319 -10.945 20.867 150 HB3 GLU 500 HB3 GLU 500 -5.966 -11.301 21.367 151 HG2 GLU 500 HG2 GLU 500 -4.805 -11.749 23.286 152 HG3 GLU 500 HG3 GLU 500 -4.874 -13.347 22.546 153 H VAL 501 H VAL 501 -6.705 -10.846 19.400 154 HA VAL 501 HA VAL 501 -6.302 -10.913 16.561 155 HB VAL 501 HB VAL 501 -7.755 -8.892 18.275 156 HG11 VAL 501 HG11 VAL 501 -8.909 -8.566 15.928 157 HG12 VAL 501 HG12 VAL 501 -7.435 -7.692 16.351 158 HG13 VAL 501 HG13 VAL 501 -7.347 -9.133 15.337 159 HG21 VAL 501 HG21 VAL 501 -9.091 -10.892 16.510 160 HG22 VAL 501 HG22 VAL 501 -8.505 -11.394 18.096 161 HG23 VAL 501 HG23 VAL 501 -9.691 -10.096 17.965 162 H ARG 502 H ARG 502 -5.095 -9.003 19.235 163 HA ARG 502 HA ARG 502 -3.800 -7.097 17.464 164 HB2 ARG 502 HB2 ARG 502 -2.983 -6.080 19.589 165 HB3 ARG 502 HB3 ARG 502 -4.735 -6.198 19.489 166 HG2 ARG 502 HG2 ARG 502 -4.828 -7.928 21.051 167 HG3 ARG 502 HG3 ARG 502 -3.111 -8.296 20.879 168 HD2 ARG 502 HD2 ARG 502 -3.826 -5.573 21.799 169 HD3 ARG 502 HD3 ARG 502 -4.097 -6.898 22.930 170 HE ARG 502 HE ARG 502 -1.563 -7.312 22.052 171 HH11 ARG 502 HH11 ARG 502 -3.226 -4.592 23.451 172 HH12 ARG 502 HH12 ARG 502 -1.808 -3.950 24.212 173 HH21 ARG 502 HH21 ARG 502 0.311 -6.477 23.049 174 HH22 ARG 502 HH22 ARG 502 0.203 -5.023 23.982 175 H HIS 503 H HIS 503 -3.141 -10.157 18.430 176 HA HIS 503 HA HIS 503 -0.313 -9.848 18.954 177 HB2 HIS 503 HB2 HIS 503 -1.999 -11.691 19.823 178 HB3 HIS 503 HB3 HIS 503 -1.544 -12.497 18.325 179 HD1 HIS 503 HD1 HIS 503 1.490 -11.184 18.728 180 HD2 HIS 503 HD2 HIS 503 -0.616 -13.785 21.189 181 HE1 HIS 503 HE1 HIS 503 3.231 -12.362 20.108 182 H ILE 504 H ILE 504 -2.225 -11.516 16.445 183 HA ILE 504 HA ILE 504 0.015 -11.903 14.733 184 HB ILE 504 HB ILE 504 -1.473 -12.821 13.163 185 HG12 ILE 504 HG12 ILE 504 -3.008 -10.823 13.155 186 HG13 ILE 504 HG13 ILE 504 -3.824 -12.378 13.036 187 HG21 ILE 504 HG21 ILE 504 -1.307 -14.152 15.184 188 HG22 ILE 504 HG22 ILE 504 -2.658 -13.274 15.898 189 HG23 ILE 504 HG23 ILE 504 -2.921 -14.301 14.490 190 HD11 ILE 504 HD11 ILE 504 -5.041 -10.963 14.529 191 HD12 ILE 504 HD12 ILE 504 -4.290 -12.257 15.464 192 HD13 ILE 504 HD13 ILE 504 -3.590 -10.638 15.477 193 H VAL 505 H VAL 505 -2.248 -9.326 15.202 194 HA VAL 505 HA VAL 505 -1.763 -8.059 12.662 195 HB VAL 505 HB VAL 505 -3.149 -7.102 15.165 196 HG11 VAL 505 HG11 VAL 505 -3.934 -5.425 13.131 197 HG12 VAL 505 HG12 VAL 505 -2.789 -5.028 14.414 198 HG13 VAL 505 HG13 VAL 505 -2.202 -5.603 12.853 199 HG21 VAL 505 HG21 VAL 505 -4.066 -8.899 13.448 200 HG22 VAL 505 HG22 VAL 505 -5.121 -7.686 14.173 201 HG23 VAL 505 HG23 VAL 505 -4.498 -7.450 12.540 202 H GLY 506 H GLY 506 -1.029 -7.142 16.038 203 HA2 GLY 506 HA2 GLY 506 0.646 -4.983 15.402 204 HA3 GLY 506 HA3 GLY 506 0.661 -5.866 16.922 205 H ALA 507 H ALA 507 1.239 -8.377 15.288 206 HA ALA 507 HA ALA 507 4.079 -8.256 15.559 207 HB1 ALA 507 HB1 ALA 507 3.276 -10.353 16.050 208 HB2 ALA 507 HB2 ALA 507 2.121 -10.342 14.717 209 HB3 ALA 507 HB3 ALA 507 3.838 -10.583 14.394 210 H ILE 508 H ILE 508 1.987 -8.866 12.730 211 HA ILE 508 HA ILE 508 4.130 -8.575 10.872 212 HB ILE 508 HB ILE 508 2.408 -8.651 9.137 213 HG12 ILE 508 HG12 ILE 508 0.013 -9.156 10.247 214 HG13 ILE 508 HG13 ILE 508 0.651 -8.046 11.455 215 HG21 ILE 508 HG21 ILE 508 1.380 -10.710 10.966 216 HG22 ILE 508 HG22 ILE 508 2.108 -10.869 9.369 217 HG23 ILE 508 HG23 ILE 508 3.134 -10.663 10.788 218 HD11 ILE 508 HD11 ILE 508 1.143 -6.955 8.878 219 HD12 ILE 508 HD12 ILE 508 -0.549 -7.443 8.979 220 HD13 ILE 508 HD13 ILE 508 0.121 -6.331 10.173 221 H ALA 509 H ALA 509 1.816 -6.408 12.304 222 HA ALA 509 HA ALA 509 2.134 -4.297 10.402 223 HB1 ALA 509 HB1 ALA 509 1.128 -4.101 13.237 224 HB2 ALA 509 HB2 ALA 509 0.849 -2.957 11.924 225 HB3 ALA 509 HB3 ALA 509 0.136 -4.568 11.855 226 H ASN 510 H ASN 510 3.864 -5.355 13.207 227 HA ASN 510 HA ASN 510 5.342 -2.842 13.397 228 HB2 ASN 510 HB2 ASN 510 4.550 -3.975 15.470 229 HB3 ASN 510 HB3 ASN 510 5.599 -5.337 15.089 230 HD21 ASN 510 HD21 ASN 510 5.671 -1.833 15.574 231 HD22 ASN 510 HD22 ASN 510 7.223 -1.795 16.332 232 H GLU 511 H GLU 511 5.683 -6.118 12.282 233 HA GLU 511 HA GLU 511 8.501 -6.227 12.144 234 HB2 GLU 511 HB2 GLU 511 6.270 -7.728 10.827 235 HB3 GLU 511 HB3 GLU 511 7.918 -7.954 10.258 236 HG2 GLU 511 HG2 GLU 511 7.066 -8.323 13.118 237 HG3 GLU 511 HG3 GLU 511 7.150 -9.626 11.934 238 H GLY 512 H GLY 512 6.042 -5.335 9.736 239 HA2 GLY 512 HA2 GLY 512 8.215 -4.183 8.097 240 HA3 GLY 512 HA3 GLY 512 6.733 -4.850 7.426 241 H ASP 513 H ASP 513 6.088 -3.004 6.367 242 HA ASP 513 HA ASP 513 5.774 -0.543 7.901 243 HB2 ASP 513 HB2 ASP 513 5.772 -1.253 5.008 244 HB3 ASP 513 HB3 ASP 513 4.840 0.157 5.503 245 H ILE 514 H ILE 514 3.963 -3.261 7.038 246 HA ILE 514 HA ILE 514 1.416 -2.330 6.552 247 HB ILE 514 HB ILE 514 2.174 -4.717 8.241 248 HG12 ILE 514 HG12 ILE 514 1.324 -4.824 5.368 249 HG13 ILE 514 HG13 ILE 514 2.994 -4.437 5.767 250 HG21 ILE 514 HG21 ILE 514 -0.420 -3.787 7.082 251 HG22 ILE 514 HG22 ILE 514 -0.109 -5.509 7.297 252 HG23 ILE 514 HG23 ILE 514 -0.077 -4.428 8.689 253 HD11 ILE 514 HD11 ILE 514 1.634 -6.881 6.842 254 HD12 ILE 514 HD12 ILE 514 2.441 -6.862 5.273 255 HD13 ILE 514 HD13 ILE 514 3.359 -6.530 6.742 256 H SER 515 H SER 515 -0.318 -1.686 7.788 257 HA SER 515 HA SER 515 0.302 -0.981 10.582 258 HB2 SER 515 HB2 SER 515 -0.175 0.833 8.705 259 HB3 SER 515 HB3 SER 515 -1.853 0.439 9.077 260 HG SER 515 HG SER 515 0.094 1.655 10.671 261 H SER 516 H SER 516 -1.775 -0.670 11.908 262 HA SER 516 HA SER 516 -3.122 -3.154 12.014 263 HB2 SER 516 HB2 SER 516 -2.672 -1.534 13.941 264 HB3 SER 516 HB3 SER 516 -4.064 -0.621 13.359 265 HG SER 516 HG SER 516 -5.045 -2.926 13.470 266 H ARG 517 H ARG 517 -3.750 -0.231 10.319 267 HA ARG 517 HA ARG 517 -6.545 -0.945 9.839 268 HB2 ARG 517 HB2 ARG 517 -6.614 1.254 8.635 269 HB3 ARG 517 HB3 ARG 517 -6.216 1.369 10.344 270 HG2 ARG 517 HG2 ARG 517 -3.875 1.659 9.817 271 HG3 ARG 517 HG3 ARG 517 -4.211 1.438 8.099 272 HD2 ARG 517 HD2 ARG 517 -5.116 3.513 7.868 273 HD3 ARG 517 HD3 ARG 517 -5.734 3.545 9.519 274 HE ARG 517 HE ARG 517 -3.835 4.640 10.128 275 HH11 ARG 517 HH11 ARG 517 -3.191 2.874 7.198 276 HH12 ARG 517 HH12 ARG 517 -1.581 3.490 7.026 277 HH21 ARG 517 HH21 ARG 517 -1.717 5.458 9.913 278 HH22 ARG 517 HH22 ARG 517 -0.743 4.959 8.572 279 H TYR 518 H TYR 518 -3.464 -0.625 8.175 280 HA TYR 518 HA TYR 518 -4.298 -0.849 5.537 281 HB2 TYR 518 HB2 TYR 518 -1.852 -0.847 6.894 282 HB3 TYR 518 HB3 TYR 518 -1.871 -2.363 6.000 283 HD1 TYR 518 HD1 TYR 518 -0.596 -2.164 4.090 284 HD2 TYR 518 HD2 TYR 518 -3.115 1.075 5.214 285 HE1 TYR 518 HE1 TYR 518 0.039 -0.966 2.038 286 HE2 TYR 518 HE2 TYR 518 -2.488 2.282 3.165 287 HH TYR 518 HH TYR 518 -1.621 1.753 0.909 288 H ILE 519 H ILE 519 -3.772 -3.353 7.960 289 HA ILE 519 HA ILE 519 -3.928 -5.606 6.324 290 HB ILE 519 HB ILE 519 -4.898 -5.315 9.170 291 HG12 ILE 519 HG12 ILE 519 -2.348 -6.675 8.566 292 HG13 ILE 519 HG13 ILE 519 -2.359 -4.940 8.267 293 HG21 ILE 519 HG21 ILE 519 -4.237 -7.774 7.556 294 HG22 ILE 519 HG22 ILE 519 -4.560 -7.757 9.289 295 HG23 ILE 519 HG23 ILE 519 -5.827 -7.298 8.152 296 HD11 ILE 519 HD11 ILE 519 -2.795 -6.399 10.845 297 HD12 ILE 519 HD12 ILE 519 -1.594 -5.166 10.455 298 HD13 ILE 519 HD13 ILE 519 -3.291 -4.721 10.629 299 H GLY 520 H GLY 520 -5.605 -6.921 5.647 300 HA2 GLY 520 HA2 GLY 520 -8.094 -5.597 5.135 301 HA3 GLY 520 HA3 GLY 520 -7.677 -7.244 4.684 302 H ASN 521 H ASN 521 -8.980 -8.699 5.552 303 HA ASN 521 HA ASN 521 -10.412 -8.059 8.013 304 HB2 ASN 521 HB2 ASN 521 -10.752 -10.386 6.106 305 HB3 ASN 521 HB3 ASN 521 -11.803 -10.012 7.470 306 HD21 ASN 521 HD21 ASN 521 -13.290 -8.391 7.299 307 HD22 ASN 521 HD22 ASN 521 -13.634 -7.572 5.817 308 H ILE 522 H ILE 522 -9.885 -8.885 9.927 309 HA ILE 522 HA ILE 522 -8.071 -11.208 9.991 310 HB ILE 522 HB ILE 522 -8.193 -9.043 12.087 311 HG12 ILE 522 HG12 ILE 522 -5.739 -8.865 10.782 312 HG13 ILE 522 HG13 ILE 522 -6.905 -9.055 9.478 313 HG21 ILE 522 HG21 ILE 522 -6.509 -10.127 13.162 314 HG22 ILE 522 HG22 ILE 522 -7.274 -11.517 12.395 315 HG23 ILE 522 HG23 ILE 522 -5.837 -10.793 11.673 316 HD11 ILE 522 HD11 ILE 522 -7.227 -6.869 9.624 317 HD12 ILE 522 HD12 ILE 522 -8.066 -7.182 11.144 318 HD13 ILE 522 HD13 ILE 522 -6.351 -6.768 11.151 319 H LYS 523 H LYS 523 -8.643 -12.910 11.213 320 HA LYS 523 HA LYS 523 -11.018 -12.618 12.935 321 HB2 LYS 523 HB2 LYS 523 -11.188 -13.994 10.738 322 HB3 LYS 523 HB3 LYS 523 -10.260 -15.206 11.613 323 HG2 LYS 523 HG2 LYS 523 -12.005 -15.229 13.360 324 HG3 LYS 523 HG3 LYS 523 -12.949 -14.096 12.390 325 HD2 LYS 523 HD2 LYS 523 -12.026 -16.776 11.369 326 HD3 LYS 523 HD3 LYS 523 -13.585 -16.525 12.158 327 HE2 LYS 523 HE2 LYS 523 -14.303 -15.039 10.448 328 HE3 LYS 523 HE3 LYS 523 -12.684 -14.954 9.753 329 HZ1 LYS 523 HZ1 LYS 523 -13.172 -17.578 9.632 330 HZ2 LYS 523 HZ2 LYS 523 -13.493 -16.501 8.368 331 HZ3 LYS 523 HZ3 LYS 523 -14.736 -16.969 9.416 332 H LEU 524 H LEU 524 -11.120 -14.004 14.796 333 HA LEU 524 HA LEU 524 -8.631 -15.295 15.606 334 HB2 LEU 524 HB2 LEU 524 -8.670 -12.875 16.371 335 HB3 LEU 524 HB3 LEU 524 -10.009 -13.334 17.422 336 HG LEU 524 HG LEU 524 -7.761 -13.214 18.527 337 HD11 LEU 524 HD11 LEU 524 -8.854 -16.001 18.656 338 HD12 LEU 524 HD12 LEU 524 -9.781 -14.624 19.252 339 HD13 LEU 524 HD13 LEU 524 -8.207 -14.998 19.955 340 HD21 LEU 524 HD21 LEU 524 -6.082 -14.757 18.084 341 HD22 LEU 524 HD22 LEU 524 -6.647 -14.308 16.475 342 HD23 LEU 524 HD23 LEU 524 -7.164 -15.831 17.198 343 H PHE 525 H PHE 525 -9.648 -17.278 15.565 344 HA PHE 525 HA PHE 525 -12.063 -17.654 17.157 345 HB2 PHE 525 HB2 PHE 525 -11.141 -18.804 14.797 346 HB3 PHE 525 HB3 PHE 525 -10.919 -20.068 16.002 347 HD1 PHE 525 HD1 PHE 525 -12.633 -21.576 16.093 348 HD2 PHE 525 HD2 PHE 525 -13.525 -17.503 15.237 349 HE1 PHE 525 HE1 PHE 525 -15.025 -22.134 15.946 350 HE2 PHE 525 HE2 PHE 525 -15.918 -18.054 15.090 351 HZ PHE 525 HZ PHE 525 -16.671 -20.373 15.444 352 H ALA 526 H ALA 526 -11.758 -20.255 18.003 353 HA ALA 526 HA ALA 526 -10.291 -19.911 20.403 354 HB1 ALA 526 HB1 ALA 526 -10.765 -22.628 20.182 355 HB2 ALA 526 HB2 ALA 526 -11.815 -21.438 20.952 356 HB3 ALA 526 HB3 ALA 526 -12.080 -21.888 19.268 357 H SER 527 H SER 527 -9.687 -21.768 17.448 358 HA SER 527 HA SER 527 -6.856 -21.906 18.193 359 HB2 SER 527 HB2 SER 527 -8.484 -24.261 17.205 360 HB3 SER 527 HB3 SER 527 -6.735 -24.258 17.432 361 HG SER 527 HG SER 527 -7.137 -24.769 19.419 362 H HIS 528 H HIS 528 -8.281 -20.210 16.348 363 HA HIS 528 HA HIS 528 -6.672 -20.708 14.001 364 HB2 HIS 528 HB2 HIS 528 -9.678 -20.844 13.931 365 HB3 HIS 528 HB3 HIS 528 -8.749 -20.381 12.508 366 HD1 HIS 528 HD1 HIS 528 -7.178 -22.228 11.481 367 HD2 HIS 528 HD2 HIS 528 -9.708 -23.546 14.501 368 HE1 HIS 528 HE1 HIS 528 -7.160 -24.738 11.325 369 H SER 529 H SER 529 -6.813 -18.890 12.438 370 HA SER 529 HA SER 529 -8.082 -16.452 13.186 371 HB2 SER 529 HB2 SER 529 -5.542 -15.441 13.320 372 HB3 SER 529 HB3 SER 529 -6.551 -15.801 14.720 373 HG SER 529 HG SER 529 -5.228 -17.344 15.227 374 H THR 530 H THR 530 -8.300 -15.201 11.433 375 HA THR 530 HA THR 530 -6.705 -15.898 9.061 376 HB THR 530 HB THR 530 -8.492 -15.157 7.686 377 HG1 THR 530 HG1 THR 530 -9.808 -13.635 8.335 378 HG21 THR 530 HG21 THR 530 -10.117 -16.396 9.853 379 HG22 THR 530 HG22 THR 530 -8.762 -17.314 9.196 380 HG23 THR 530 HG23 THR 530 -10.058 -16.771 8.131 381 H ILE 531 H ILE 531 -6.323 -14.077 7.517 382 HA ILE 531 HA ILE 531 -6.415 -11.383 8.345 383 HB ILE 531 HB ILE 531 -4.715 -11.990 9.952 384 HG12 ILE 531 HG12 ILE 531 -3.162 -10.656 7.759 385 HG13 ILE 531 HG13 ILE 531 -4.571 -9.857 8.448 386 HG21 ILE 531 HG21 ILE 531 -3.910 -14.016 8.821 387 HG22 ILE 531 HG22 ILE 531 -3.101 -13.012 7.620 388 HG23 ILE 531 HG23 ILE 531 -2.585 -12.958 9.305 389 HD11 ILE 531 HD11 ILE 531 -2.890 -8.987 9.727 390 HD12 ILE 531 HD12 ILE 531 -3.373 -10.368 10.712 391 HD13 ILE 531 HD13 ILE 531 -1.941 -10.473 9.689 392 H GLU 532 H GLU 532 -5.841 -9.989 6.707 393 HA GLU 532 HA GLU 532 -4.765 -11.232 4.261 394 HB2 GLU 532 HB2 GLU 532 -7.216 -10.719 4.148 395 HB3 GLU 532 HB3 GLU 532 -6.820 -9.020 4.364 396 HG2 GLU 532 HG2 GLU 532 -5.984 -8.798 2.261 397 HG3 GLU 532 HG3 GLU 532 -5.477 -10.483 2.164 398 H LEU 533 H LEU 533 -3.000 -10.306 3.455 399 HA LEU 533 HA LEU 533 -2.278 -7.619 4.420 400 HB2 LEU 533 HB2 LEU 533 -0.787 -10.104 4.165 401 HB3 LEU 533 HB3 LEU 533 0.024 -8.743 3.392 402 HG LEU 533 HG LEU 533 0.086 -7.533 5.473 403 HD11 LEU 533 HD11 LEU 533 -0.666 -9.181 7.492 404 HD12 LEU 533 HD12 LEU 533 -1.884 -9.554 6.273 405 HD13 LEU 533 HD13 LEU 533 -1.668 -7.892 6.824 406 HD21 LEU 533 HD21 LEU 533 0.950 -10.389 5.916 407 HD22 LEU 533 HD22 LEU 533 1.571 -8.961 6.744 408 HD23 LEU 533 HD23 LEU 533 1.864 -9.177 5.018 409 HA PRO 534 HA PRO 534 -2.651 -6.233 0.242 410 HB2 PRO 534 HB2 PRO 534 -1.330 -3.877 0.522 411 HB3 PRO 534 HB3 PRO 534 -2.967 -4.140 1.136 412 HG2 PRO 534 HG2 PRO 534 -0.359 -4.228 2.601 413 HG3 PRO 534 HG3 PRO 534 -1.897 -3.499 3.098 414 HD2 PRO 534 HD2 PRO 534 -1.066 -5.910 4.008 415 HD3 PRO 534 HD3 PRO 534 -2.781 -5.519 3.770 416 H LYS 535 H LYS 535 0.205 -7.176 1.753 417 HA LYS 535 HA LYS 535 2.294 -6.333 0.225 418 HB2 LYS 535 HB2 LYS 535 1.810 -9.165 1.170 419 HB3 LYS 535 HB3 LYS 535 3.365 -8.513 0.670 420 HG2 LYS 535 HG2 LYS 535 1.734 -7.544 3.009 421 HG3 LYS 535 HG3 LYS 535 3.145 -8.600 3.101 422 HD2 LYS 535 HD2 LYS 535 3.123 -5.789 2.001 423 HD3 LYS 535 HD3 LYS 535 3.712 -6.262 3.596 424 HE2 LYS 535 HE2 LYS 535 4.819 -7.158 0.937 425 HE3 LYS 535 HE3 LYS 535 5.564 -6.007 2.044 426 HZ1 LYS 535 HZ1 LYS 535 6.643 -8.000 2.480 427 HZ2 LYS 535 HZ2 LYS 535 5.229 -8.922 2.371 428 HZ3 LYS 535 HZ3 LYS 535 5.484 -7.920 3.710 429 H GLY 536 H GLY 536 3.242 -6.876 -1.727 430 HA2 GLY 536 HA2 GLY 536 1.570 -8.515 -3.531 431 HA3 GLY 536 HA3 GLY 536 2.357 -7.033 -4.052 432 H MET 537 H MET 537 3.721 -9.577 -2.011 433 HA MET 537 HA MET 537 5.141 -10.934 -4.013 434 HB2 MET 537 HB2 MET 537 6.209 -8.519 -3.887 435 HB3 MET 537 HB3 MET 537 7.043 -9.201 -2.498 436 HG2 MET 537 HG2 MET 537 8.160 -10.784 -3.792 437 HG3 MET 537 HG3 MET 537 7.049 -10.593 -5.146 438 HE1 MET 537 HE1 MET 537 10.963 -9.558 -5.241 439 HE2 MET 537 HE2 MET 537 10.644 -8.651 -3.763 440 HE3 MET 537 HE3 MET 537 10.127 -10.332 -3.895 441 HA PRO 538 HA PRO 538 5.036 -12.683 0.315 442 HB2 PRO 538 HB2 PRO 538 3.729 -14.963 -0.364 443 HB3 PRO 538 HB3 PRO 538 2.891 -13.469 0.072 444 HG2 PRO 538 HG2 PRO 538 3.472 -14.594 -2.641 445 HG3 PRO 538 HG3 PRO 538 1.983 -13.844 -2.036 446 HD2 PRO 538 HD2 PRO 538 3.764 -12.508 -3.577 447 HD3 PRO 538 HD3 PRO 538 2.792 -11.705 -2.327 448 H GLY 539 H GLY 539 5.725 -15.019 0.910 449 HA2 GLY 539 HA2 GLY 539 7.060 -16.915 0.476 450 HA3 GLY 539 HA3 GLY 539 7.538 -16.199 -1.056 451 H GLU 540 H GLU 540 7.691 -14.007 1.517 452 HA GLU 540 HA GLU 540 10.568 -13.939 1.363 453 HB2 GLU 540 HB2 GLU 540 8.851 -12.333 3.248 454 HB3 GLU 540 HB3 GLU 540 10.444 -11.932 2.621 455 HG2 GLU 540 HG2 GLU 540 9.303 -11.912 0.319 456 HG3 GLU 540 HG3 GLU 540 7.798 -11.827 1.232 457 H VAL 541 H VAL 541 8.258 -14.265 4.065 458 HA VAL 541 HA VAL 541 10.332 -15.258 5.813 459 HB VAL 541 HB VAL 541 7.356 -15.103 6.313 460 HG11 VAL 541 HG11 VAL 541 8.451 -16.615 7.839 461 HG12 VAL 541 HG12 VAL 541 9.703 -15.419 8.181 462 HG13 VAL 541 HG13 VAL 541 8.040 -15.127 8.692 463 HG21 VAL 541 HG21 VAL 541 9.469 -13.060 6.322 464 HG22 VAL 541 HG22 VAL 541 7.721 -12.886 6.163 465 HG23 VAL 541 HG23 VAL 541 8.446 -13.084 7.759 466 H LEU 542 H LEU 542 7.684 -16.559 3.929 467 HA LEU 542 HA LEU 542 7.580 -19.119 5.113 468 HB2 LEU 542 HB2 LEU 542 6.643 -17.897 2.579 469 HB3 LEU 542 HB3 LEU 542 6.737 -19.656 2.644 470 HG LEU 542 HG LEU 542 5.338 -19.328 4.846 471 HD11 LEU 542 HD11 LEU 542 3.782 -17.451 4.666 472 HD12 LEU 542 HD12 LEU 542 4.675 -16.844 3.272 473 HD13 LEU 542 HD13 LEU 542 5.446 -16.898 4.857 474 HD21 LEU 542 HD21 LEU 542 4.790 -20.223 2.373 475 HD22 LEU 542 HD22 LEU 542 3.686 -18.850 2.448 476 HD23 LEU 542 HD23 LEU 542 3.590 -20.127 3.661 477 H GLN 543 H GLN 543 9.795 -17.662 2.920 478 HA GLN 543 HA GLN 543 10.837 -20.162 1.911 479 HB2 GLN 543 HB2 GLN 543 11.383 -17.276 1.462 480 HB3 GLN 543 HB3 GLN 543 12.701 -18.398 1.154 481 HG2 GLN 543 HG2 GLN 543 10.003 -18.899 -0.020 482 HG3 GLN 543 HG3 GLN 543 11.096 -17.734 -0.764 483 HE21 GLN 543 HE21 GLN 543 10.088 -20.287 -1.770 484 HE22 GLN 543 HE22 GLN 543 11.483 -21.240 -2.131 485 H HIS 544 H HIS 544 12.231 -17.486 3.818 486 HA HIS 544 HA HIS 544 14.510 -18.979 4.614 487 HB2 HIS 544 HB2 HIS 544 13.288 -16.392 5.544 488 HB3 HIS 544 HB3 HIS 544 14.684 -17.087 6.363 489 HD1 HIS 544 HD1 HIS 544 16.045 -14.971 5.602 490 HD2 HIS 544 HD2 HIS 544 14.697 -17.400 2.513 491 HE1 HIS 544 HE1 HIS 544 17.343 -14.257 3.570 492 H PHE 545 H PHE 545 11.638 -17.921 6.445 493 HA PHE 545 HA PHE 545 12.305 -19.754 8.598 494 HB2 PHE 545 HB2 PHE 545 10.269 -17.584 8.224 495 HB3 PHE 545 HB3 PHE 545 10.061 -18.769 9.509 496 HD1 PHE 545 HD1 PHE 545 10.725 -18.036 11.567 497 HD2 PHE 545 HD2 PHE 545 12.892 -16.757 8.134 498 HE1 PHE 545 HE1 PHE 545 12.238 -16.738 13.010 499 HE2 PHE 545 HE2 PHE 545 14.409 -15.458 9.572 500 HZ PHE 545 HZ PHE 545 14.084 -15.448 12.013 501 H THR 546 H THR 546 11.826 -21.151 6.300 502 HA THR 546 HA THR 546 9.094 -22.011 6.126 503 HB THR 546 HB THR 546 10.719 -22.068 4.203 504 HG1 THR 546 HG1 THR 546 9.972 -24.290 3.596 505 HG21 THR 546 HG21 THR 546 11.702 -24.707 5.137 506 HG22 THR 546 HG22 THR 546 12.439 -23.273 5.853 507 HG23 THR 546 HG23 THR 546 12.482 -23.509 4.106 508 H ARG 547 H ARG 547 11.954 -23.045 7.832 509 HA ARG 547 HA ARG 547 10.667 -25.525 8.685 510 HB2 ARG 547 HB2 ARG 547 12.854 -26.001 9.767 511 HB3 ARG 547 HB3 ARG 547 12.979 -25.734 8.033 512 HG2 ARG 547 HG2 ARG 547 14.135 -23.788 8.272 513 HG3 ARG 547 HG3 ARG 547 13.387 -23.405 9.824 514 HD2 ARG 547 HD2 ARG 547 15.101 -24.297 10.921 515 HD3 ARG 547 HD3 ARG 547 14.911 -25.820 10.053 516 HE ARG 547 HE ARG 547 16.862 -23.788 9.558 517 HH11 ARG 547 HH11 ARG 547 15.000 -26.339 8.092 518 HH12 ARG 547 HH12 ARG 547 16.138 -26.612 6.814 519 HH21 ARG 547 HH21 ARG 547 18.367 -24.138 7.880 520 HH22 ARG 547 HH22 ARG 547 18.053 -25.360 6.695 521 H THR 548 H THR 548 11.315 -22.333 9.790 522 HA THR 548 HA THR 548 10.463 -23.083 12.511 523 HB THR 548 HB THR 548 12.124 -20.705 11.655 524 HG1 THR 548 HG1 THR 548 13.802 -21.851 12.328 525 HG21 THR 548 HG21 THR 548 10.825 -19.972 13.486 526 HG22 THR 548 HG22 THR 548 12.377 -20.445 14.177 527 HG23 THR 548 HG23 THR 548 10.985 -21.518 14.319 528 H ARG 549 H ARG 549 8.640 -22.217 13.299 529 HA ARG 549 HA ARG 549 7.559 -19.758 12.210 530 HB2 ARG 549 HB2 ARG 549 6.178 -22.420 11.897 531 HB3 ARG 549 HB3 ARG 549 5.307 -20.894 11.841 532 HG2 ARG 549 HG2 ARG 549 5.674 -21.093 9.633 533 HG3 ARG 549 HG3 ARG 549 7.233 -20.377 10.047 534 HD2 ARG 549 HD2 ARG 549 8.011 -22.172 8.907 535 HD3 ARG 549 HD3 ARG 549 7.815 -22.951 10.476 536 HE ARG 549 HE ARG 549 6.067 -24.178 9.623 537 HH11 ARG 549 HH11 ARG 549 6.915 -21.636 7.401 538 HH12 ARG 549 HH12 ARG 549 5.923 -22.247 6.119 539 HH21 ARG 549 HH21 ARG 549 4.758 -24.993 7.943 540 HH22 ARG 549 HH22 ARG 549 4.696 -24.157 6.428 541 H ILE 550 H ILE 550 5.284 -19.396 13.315 542 HA ILE 550 HA ILE 550 4.872 -20.567 15.872 543 HB ILE 550 HB ILE 550 6.928 -18.961 16.115 544 HG12 ILE 550 HG12 ILE 550 4.995 -18.285 18.218 545 HG13 ILE 550 HG13 ILE 550 5.067 -20.004 17.847 546 HG21 ILE 550 HG21 ILE 550 6.583 -16.721 16.185 547 HG22 ILE 550 HG22 ILE 550 5.310 -17.137 15.039 548 HG23 ILE 550 HG23 ILE 550 4.917 -16.882 16.740 549 HD11 ILE 550 HD11 ILE 550 7.381 -18.258 18.648 550 HD12 ILE 550 HD12 ILE 550 6.573 -19.463 19.651 551 HD13 ILE 550 HD13 ILE 550 7.487 -19.968 18.230 552 H LEU 551 H LEU 551 3.420 -18.846 17.218 553 HA LEU 551 HA LEU 551 0.958 -18.743 16.166 554 HB2 LEU 551 HB2 LEU 551 0.397 -16.981 17.677 555 HB3 LEU 551 HB3 LEU 551 1.581 -18.029 18.453 556 HG LEU 551 HG LEU 551 3.247 -16.179 17.496 557 HD11 LEU 551 HD11 LEU 551 1.157 -14.296 18.317 558 HD12 LEU 551 HD12 LEU 551 0.890 -15.056 16.748 559 HD13 LEU 551 HD13 LEU 551 2.379 -14.161 17.053 560 HD21 LEU 551 HD21 LEU 551 3.186 -16.811 19.797 561 HD22 LEU 551 HD22 LEU 551 1.614 -16.044 20.025 562 HD23 LEU 551 HD23 LEU 551 3.043 -15.055 19.719 563 H ASN 552 H ASN 552 3.479 -16.329 15.597 564 HA ASN 552 HA ASN 552 1.789 -14.702 13.931 565 HB2 ASN 552 HB2 ASN 552 3.674 -13.782 15.293 566 HB3 ASN 552 HB3 ASN 552 4.798 -14.610 14.220 567 HD21 ASN 552 HD21 ASN 552 1.824 -12.786 13.604 568 HD22 ASN 552 HD22 ASN 552 2.545 -11.644 12.525 569 H LYS 553 H LYS 553 4.805 -16.487 13.255 570 HA LYS 553 HA LYS 553 4.586 -16.363 10.464 571 HB2 LYS 553 HB2 LYS 553 5.922 -18.674 11.827 572 HB3 LYS 553 HB3 LYS 553 6.418 -17.800 10.384 573 HG2 LYS 553 HG2 LYS 553 6.623 -16.896 13.243 574 HG3 LYS 553 HG3 LYS 553 7.936 -17.238 12.114 575 HD2 LYS 553 HD2 LYS 553 6.805 -15.361 10.687 576 HD3 LYS 553 HD3 LYS 553 6.092 -14.889 12.232 577 HE2 LYS 553 HE2 LYS 553 8.006 -13.638 12.277 578 HE3 LYS 553 HE3 LYS 553 8.584 -15.107 13.061 579 HZ1 LYS 553 HZ1 LYS 553 10.202 -14.855 11.518 580 HZ2 LYS 553 HZ2 LYS 553 9.208 -14.042 10.417 581 HZ3 LYS 553 HZ3 LYS 553 9.111 -15.725 10.561 582 HA PRO 554 HA PRO 554 1.709 -19.460 9.290 583 HB2 PRO 554 HB2 PRO 554 2.931 -20.661 7.185 584 HB3 PRO 554 HB3 PRO 554 2.261 -19.028 7.102 585 HG2 PRO 554 HG2 PRO 554 5.097 -19.893 7.509 586 HG3 PRO 554 HG3 PRO 554 4.460 -18.595 6.483 587 HD2 PRO 554 HD2 PRO 554 5.564 -18.123 8.909 588 HD3 PRO 554 HD3 PRO 554 4.250 -17.130 8.249 589 H MET 555 H MET 555 2.289 -20.555 11.426 590 HA MET 555 HA MET 555 4.062 -22.744 11.502 591 HB2 MET 555 HB2 MET 555 3.337 -21.796 13.567 592 HB3 MET 555 HB3 MET 555 1.643 -22.042 13.161 593 HG2 MET 555 HG2 MET 555 2.330 -23.657 14.802 594 HG3 MET 555 HG3 MET 555 1.986 -24.470 13.276 595 HE1 MET 555 HE1 MET 555 3.971 -26.369 15.295 596 HE2 MET 555 HE2 MET 555 5.279 -25.318 15.837 597 HE3 MET 555 HE3 MET 555 3.601 -24.826 16.066 598 H ASN 556 H ASN 556 0.530 -22.626 11.054 599 HA ASN 556 HA ASN 556 0.655 -24.988 9.382 600 HB2 ASN 556 HB2 ASN 556 0.432 -25.738 11.829 601 HB3 ASN 556 HB3 ASN 556 -1.192 -25.061 11.762 602 HD21 ASN 556 HD21 ASN 556 0.921 -27.566 10.627 603 HD22 ASN 556 HD22 ASN 556 -0.306 -28.577 9.950 604 H MET 557 H MET 557 0.064 -22.689 8.340 605 HA MET 557 HA MET 557 -2.855 -22.374 8.369 606 HB2 MET 557 HB2 MET 557 -2.430 -20.226 7.213 607 HB3 MET 557 HB3 MET 557 -1.643 -20.320 8.783 608 HG2 MET 557 HG2 MET 557 0.436 -20.286 7.900 609 HG3 MET 557 HG3 MET 557 -0.044 -21.168 6.453 610 HE1 MET 557 HE1 MET 557 -1.100 -17.227 7.811 611 HE2 MET 557 HE2 MET 557 0.313 -18.120 8.374 612 HE3 MET 557 HE3 MET 557 0.500 -16.833 7.181 613 H GLN 558 H GLN 558 -3.548 -21.452 6.030 614 HA GLN 558 HA GLN 558 -2.308 -22.802 3.822 615 HB2 GLN 558 HB2 GLN 558 -4.001 -24.370 3.304 616 HB3 GLN 558 HB3 GLN 558 -3.655 -24.595 5.013 617 HG2 GLN 558 HG2 GLN 558 -5.625 -23.178 5.538 618 HG3 GLN 558 HG3 GLN 558 -6.000 -23.143 3.815 619 HE21 GLN 558 HE21 GLN 558 -7.445 -24.565 3.192 620 HE22 GLN 558 HE22 GLN 558 -7.769 -26.090 3.935 621 H LEU 559 H LEU 559 -2.856 -21.890 1.899 622 HA LEU 559 HA LEU 559 -4.264 -19.422 1.943 623 HB2 LEU 559 HB2 LEU 559 -2.371 -19.872 0.446 624 HB3 LEU 559 HB3 LEU 559 -3.342 -21.068 -0.409 625 HG LEU 559 HG LEU 559 -3.041 -18.746 -1.465 626 HD11 LEU 559 HD11 LEU 559 -4.964 -19.059 -2.657 627 HD12 LEU 559 HD12 LEU 559 -5.924 -19.433 -1.227 628 HD13 LEU 559 HD13 LEU 559 -4.819 -20.639 -1.886 629 HD21 LEU 559 HD21 LEU 559 -4.586 -17.038 -0.746 630 HD22 LEU 559 HD22 LEU 559 -3.543 -17.488 0.603 631 HD23 LEU 559 HD23 LEU 559 -5.201 -18.085 0.533 632 H LEU 560 H LEU 560 -6.375 -19.089 1.793 633 HA LEU 560 HA LEU 560 -8.036 -21.158 0.511 634 HB2 LEU 560 HB2 LEU 560 -9.703 -20.869 2.087 635 HB3 LEU 560 HB3 LEU 560 -8.228 -20.772 3.046 636 HG LEU 560 HG LEU 560 -8.620 -18.158 2.538 637 HD11 LEU 560 HD11 LEU 560 -10.996 -19.329 1.642 638 HD12 LEU 560 HD12 LEU 560 -10.682 -17.617 1.927 639 HD13 LEU 560 HD13 LEU 560 -11.377 -18.611 3.208 640 HD21 LEU 560 HD21 LEU 560 -10.239 -19.213 4.769 641 HD22 LEU 560 HD22 LEU 560 -8.953 -18.005 4.768 642 HD23 LEU 560 HD23 LEU 560 -8.551 -19.722 4.720 643 H GLY 561 H GLY 561 -7.312 -17.767 0.826 644 HA2 GLY 561 HA2 GLY 561 -9.550 -16.982 -0.865 645 HA3 GLY 561 HA3 GLY 561 -8.375 -15.906 -0.125 646 H ASP 562 H ASP 562 -8.422 -14.894 -2.278 647 HA ASP 562 HA ASP 562 -6.214 -15.856 -3.858 648 HB2 ASP 562 HB2 ASP 562 -8.278 -17.072 -4.729 649 HB3 ASP 562 HB3 ASP 562 -8.853 -15.499 -5.277 650 H ALA 563 H ALA 563 -5.423 -14.287 -5.346 651 HA ALA 563 HA ALA 563 -5.698 -11.620 -4.453 652 HB1 ALA 563 HB1 ALA 563 -3.902 -13.030 -6.037 653 HB2 ALA 563 HB2 ALA 563 -4.579 -11.804 -7.109 654 HB3 ALA 563 HB3 ALA 563 -3.813 -11.325 -5.595 655 H GLN 564 H GLN 564 -7.151 -10.123 -4.963 656 HA GLN 564 HA GLN 564 -9.376 -10.571 -6.554 657 HB2 GLN 564 HB2 GLN 564 -8.765 -8.675 -4.800 658 HB3 GLN 564 HB3 GLN 564 -8.374 -7.778 -6.261 659 HG2 GLN 564 HG2 GLN 564 -10.562 -7.189 -5.925 660 HG3 GLN 564 HG3 GLN 564 -10.728 -8.541 -7.044 661 HE21 GLN 564 HE21 GLN 564 -11.576 -10.477 -6.319 662 HE22 GLN 564 HE22 GLN 564 -12.396 -10.624 -4.806 Start of MODEL 6 1 H MET 480 H MET 480 1.687 0.718 -2.947 2 HA MET 480 HA MET 480 0.808 0.176 -0.187 3 HB2 MET 480 HB2 MET 480 -1.099 -1.092 -1.203 4 HB3 MET 480 HB3 MET 480 -1.157 0.645 -1.473 5 HG2 MET 480 HG2 MET 480 -0.162 0.251 -3.724 6 HG3 MET 480 HG3 MET 480 -0.338 -1.478 -3.437 7 HE1 MET 480 HE1 MET 480 -3.125 -0.745 -6.056 8 HE2 MET 480 HE2 MET 480 -1.837 0.452 -5.927 9 HE3 MET 480 HE3 MET 480 -1.460 -1.266 -5.796 10 H ALA 481 H ALA 481 1.819 -1.233 -3.274 11 HA ALA 481 HA ALA 481 3.425 -3.200 -1.999 12 HB1 ALA 481 HB1 ALA 481 2.069 -4.947 -1.816 13 HB2 ALA 481 HB2 ALA 481 0.720 -3.895 -2.247 14 HB3 ALA 481 HB3 ALA 481 1.573 -4.795 -3.502 15 H ASP 482 H ASP 482 3.676 -5.098 -3.921 16 HA ASP 482 HA ASP 482 4.874 -3.577 -6.084 17 HB2 ASP 482 HB2 ASP 482 5.720 -5.774 -4.741 18 HB3 ASP 482 HB3 ASP 482 4.985 -6.531 -6.152 19 H VAL 483 H VAL 483 2.334 -5.980 -5.616 20 HA VAL 483 HA VAL 483 1.340 -5.344 -8.309 21 HB VAL 483 HB VAL 483 2.392 -7.504 -8.520 22 HG11 VAL 483 HG11 VAL 483 1.849 -9.394 -7.145 23 HG12 VAL 483 HG12 VAL 483 2.331 -8.061 -6.095 24 HG13 VAL 483 HG13 VAL 483 0.625 -8.469 -6.277 25 HG21 VAL 483 HG21 VAL 483 0.657 -8.620 -9.552 26 HG22 VAL 483 HG22 VAL 483 -0.502 -8.211 -8.286 27 HG23 VAL 483 HG23 VAL 483 0.008 -6.983 -9.445 28 H GLY 484 H GLY 484 0.628 -6.608 -5.084 29 HA2 GLY 484 HA2 GLY 484 -1.308 -5.511 -3.980 30 HA3 GLY 484 HA3 GLY 484 -2.180 -5.773 -5.484 31 H ASP 485 H ASP 485 -0.016 -8.190 -4.226 32 HA ASP 485 HA ASP 485 -1.808 -10.284 -4.367 33 HB2 ASP 485 HB2 ASP 485 0.806 -10.163 -3.872 34 HB3 ASP 485 HB3 ASP 485 0.250 -10.375 -2.214 35 H MET 486 H MET 486 -3.780 -10.145 -3.453 36 HA MET 486 HA MET 486 -3.883 -9.689 -0.543 37 HB2 MET 486 HB2 MET 486 -4.927 -7.829 -1.709 38 HB3 MET 486 HB3 MET 486 -5.933 -8.936 -2.633 39 HG2 MET 486 HG2 MET 486 -6.439 -9.574 0.023 40 HG3 MET 486 HG3 MET 486 -6.349 -7.814 -0.012 41 HE1 MET 486 HE1 MET 486 -9.389 -10.531 -2.066 42 HE2 MET 486 HE2 MET 486 -7.868 -10.322 -2.933 43 HE3 MET 486 HE3 MET 486 -7.868 -10.989 -1.300 44 H GLN 487 H GLN 487 -4.454 -11.437 0.554 45 HA GLN 487 HA GLN 487 -6.570 -13.163 -0.420 46 HB2 GLN 487 HB2 GLN 487 -3.858 -14.323 0.231 47 HB3 GLN 487 HB3 GLN 487 -5.286 -15.210 -0.282 48 HG2 GLN 487 HG2 GLN 487 -5.202 -14.096 -2.453 49 HG3 GLN 487 HG3 GLN 487 -3.771 -13.205 -1.938 50 HE21 GLN 487 HE21 GLN 487 -4.232 -15.162 -4.124 51 HE22 GLN 487 HE22 GLN 487 -3.023 -16.376 -3.902 52 H LEU 488 H LEU 488 -6.886 -15.026 1.253 53 HA LEU 488 HA LEU 488 -6.567 -13.867 3.944 54 HB2 LEU 488 HB2 LEU 488 -8.897 -13.931 3.002 55 HB3 LEU 488 HB3 LEU 488 -8.784 -15.690 3.036 56 HG LEU 488 HG LEU 488 -8.455 -15.548 5.507 57 HD11 LEU 488 HD11 LEU 488 -7.808 -13.527 6.231 58 HD12 LEU 488 HD12 LEU 488 -9.535 -13.171 6.239 59 HD13 LEU 488 HD13 LEU 488 -8.542 -12.687 4.865 60 HD21 LEU 488 HD21 LEU 488 -10.615 -16.129 4.708 61 HD22 LEU 488 HD22 LEU 488 -10.978 -14.457 4.278 62 HD23 LEU 488 HD23 LEU 488 -10.844 -14.923 5.975 63 H TYR 489 H TYR 489 -5.053 -14.958 5.009 64 HA TYR 489 HA TYR 489 -4.888 -17.873 4.638 65 HB2 TYR 489 HB2 TYR 489 -2.702 -16.426 6.027 66 HB3 TYR 489 HB3 TYR 489 -2.621 -17.769 4.893 67 HD1 TYR 489 HD1 TYR 489 -2.846 -14.115 5.214 68 HD2 TYR 489 HD2 TYR 489 -2.445 -17.385 2.522 69 HE1 TYR 489 HE1 TYR 489 -2.204 -12.555 3.424 70 HE2 TYR 489 HE2 TYR 489 -1.801 -15.834 0.725 71 HH TYR 489 HH TYR 489 -1.565 -12.337 1.312 72 H ARG 490 H ARG 490 -5.712 -19.060 6.214 73 HA ARG 490 HA ARG 490 -6.000 -17.886 8.886 74 HB2 ARG 490 HB2 ARG 490 -7.650 -19.628 9.301 75 HB3 ARG 490 HB3 ARG 490 -8.039 -18.762 7.820 76 HG2 ARG 490 HG2 ARG 490 -8.286 -20.793 6.932 77 HG3 ARG 490 HG3 ARG 490 -6.522 -20.821 6.878 78 HD2 ARG 490 HD2 ARG 490 -6.748 -21.713 9.319 79 HD3 ARG 490 HD3 ARG 490 -8.386 -22.127 8.813 80 HE ARG 490 HE ARG 490 -5.945 -23.417 8.013 81 HH11 ARG 490 HH11 ARG 490 -9.258 -22.774 7.161 82 HH12 ARG 490 HH12 ARG 490 -9.402 -24.165 6.138 83 HH21 ARG 490 HH21 ARG 490 -6.121 -25.251 6.669 84 HH22 ARG 490 HH22 ARG 490 -7.617 -25.574 5.859 85 H ILE 491 H ILE 491 -4.901 -18.630 10.596 86 HA ILE 491 HA ILE 491 -3.063 -20.874 10.156 87 HB ILE 491 HB ILE 491 -1.788 -20.051 12.036 88 HG12 ILE 491 HG12 ILE 491 -3.915 -17.914 12.300 89 HG13 ILE 491 HG13 ILE 491 -3.692 -19.269 13.402 90 HG21 ILE 491 HG21 ILE 491 -1.874 -17.452 10.993 91 HG22 ILE 491 HG22 ILE 491 -0.797 -18.766 10.522 92 HG23 ILE 491 HG23 ILE 491 -2.319 -18.524 9.665 93 HD11 ILE 491 HD11 ILE 491 -1.370 -18.380 13.818 94 HD12 ILE 491 HD12 ILE 491 -1.873 -16.928 12.952 95 HD13 ILE 491 HD13 ILE 491 -2.703 -17.404 14.433 96 H GLU 492 H GLU 492 -2.578 -22.180 12.190 97 HA GLU 492 HA GLU 492 -5.137 -23.049 13.315 98 HB2 GLU 492 HB2 GLU 492 -3.616 -24.684 12.156 99 HB3 GLU 492 HB3 GLU 492 -2.465 -24.449 13.465 100 HG2 GLU 492 HG2 GLU 492 -3.841 -25.482 15.029 101 HG3 GLU 492 HG3 GLU 492 -5.278 -25.299 14.024 102 H VAL 493 H VAL 493 -4.412 -20.734 14.446 103 HA VAL 493 HA VAL 493 -3.728 -21.552 17.168 104 HB VAL 493 HB VAL 493 -2.485 -19.085 15.965 105 HG11 VAL 493 HG11 VAL 493 -1.553 -20.593 18.379 106 HG12 VAL 493 HG12 VAL 493 -1.272 -18.907 17.941 107 HG13 VAL 493 HG13 VAL 493 -2.866 -19.423 18.495 108 HG21 VAL 493 HG21 VAL 493 -1.612 -21.027 14.778 109 HG22 VAL 493 HG22 VAL 493 -0.381 -20.335 15.834 110 HG23 VAL 493 HG23 VAL 493 -1.227 -21.806 16.313 111 H GLY 494 H GLY 494 -4.903 -20.537 18.707 112 HA2 GLY 494 HA2 GLY 494 -6.304 -18.056 18.035 113 HA3 GLY 494 HA3 GLY 494 -7.284 -19.448 18.468 114 H ARG 495 H ARG 495 -7.976 -17.816 20.138 115 HA ARG 495 HA ARG 495 -6.333 -16.930 22.199 116 HB2 ARG 495 HB2 ARG 495 -8.429 -16.811 23.552 117 HB3 ARG 495 HB3 ARG 495 -8.556 -16.054 21.970 118 HG2 ARG 495 HG2 ARG 495 -9.847 -17.837 21.114 119 HG3 ARG 495 HG3 ARG 495 -9.488 -18.858 22.508 120 HD2 ARG 495 HD2 ARG 495 -11.624 -18.123 22.987 121 HD3 ARG 495 HD3 ARG 495 -10.630 -16.959 23.862 122 HE ARG 495 HE ARG 495 -10.997 -15.766 21.467 123 HH11 ARG 495 HH11 ARG 495 -13.176 -17.186 23.781 124 HH12 ARG 495 HH12 ARG 495 -14.492 -16.131 23.385 125 HH21 ARG 495 HH21 ARG 495 -12.723 -14.371 20.936 126 HH22 ARG 495 HH22 ARG 495 -14.234 -14.531 21.766 127 H ASP 496 H ASP 496 -7.811 -20.051 21.665 128 HA ASP 496 HA ASP 496 -7.304 -21.051 24.302 129 HB2 ASP 496 HB2 ASP 496 -8.987 -21.856 22.404 130 HB3 ASP 496 HB3 ASP 496 -7.634 -22.905 21.991 131 H ASP 497 H ASP 497 -5.422 -20.607 21.494 132 HA ASP 497 HA ASP 497 -3.458 -22.625 22.274 133 HB2 ASP 497 HB2 ASP 497 -4.162 -22.285 19.863 134 HB3 ASP 497 HB3 ASP 497 -3.313 -20.743 19.918 135 H GLY 498 H GLY 498 -3.798 -19.124 21.936 136 HA2 GLY 498 HA2 GLY 498 -2.564 -17.992 23.872 137 HA3 GLY 498 HA3 GLY 498 -1.153 -18.796 23.198 138 H VAL 499 H VAL 499 -3.759 -17.360 21.319 139 HA VAL 499 HA VAL 499 -1.985 -15.144 20.566 140 HB VAL 499 HB VAL 499 -1.950 -17.086 18.885 141 HG11 VAL 499 HG11 VAL 499 -4.376 -16.006 17.632 142 HG12 VAL 499 HG12 VAL 499 -3.788 -17.667 17.729 143 HG13 VAL 499 HG13 VAL 499 -4.652 -16.955 19.092 144 HG21 VAL 499 HG21 VAL 499 -1.381 -14.556 18.574 145 HG22 VAL 499 HG22 VAL 499 -1.505 -15.613 17.167 146 HG23 VAL 499 HG23 VAL 499 -2.846 -14.548 17.591 147 H GLU 500 H GLU 500 -3.036 -13.268 19.830 148 HA GLU 500 HA GLU 500 -5.957 -13.233 20.203 149 HB2 GLU 500 HB2 GLU 500 -4.194 -10.923 20.983 150 HB3 GLU 500 HB3 GLU 500 -5.869 -11.219 21.426 151 HG2 GLU 500 HG2 GLU 500 -4.700 -13.395 22.499 152 HG3 GLU 500 HG3 GLU 500 -3.384 -12.229 22.627 153 H VAL 501 H VAL 501 -6.583 -10.729 19.504 154 HA VAL 501 HA VAL 501 -6.191 -10.752 16.663 155 HB VAL 501 HB VAL 501 -7.605 -8.752 18.432 156 HG11 VAL 501 HG11 VAL 501 -7.580 -9.019 15.428 157 HG12 VAL 501 HG12 VAL 501 -8.655 -7.961 16.345 158 HG13 VAL 501 HG13 VAL 501 -6.912 -7.688 16.372 159 HG21 VAL 501 HG21 VAL 501 -9.584 -9.879 17.996 160 HG22 VAL 501 HG22 VAL 501 -8.925 -10.699 16.581 161 HG23 VAL 501 HG23 VAL 501 -8.431 -11.198 18.198 162 H ARG 502 H ARG 502 -4.922 -8.934 19.368 163 HA ARG 502 HA ARG 502 -3.601 -7.012 17.635 164 HB2 ARG 502 HB2 ARG 502 -2.738 -6.074 19.782 165 HB3 ARG 502 HB3 ARG 502 -4.493 -6.139 19.687 166 HG2 ARG 502 HG2 ARG 502 -4.608 -7.963 21.171 167 HG3 ARG 502 HG3 ARG 502 -2.876 -8.277 21.039 168 HD2 ARG 502 HD2 ARG 502 -3.142 -7.214 23.114 169 HD3 ARG 502 HD3 ARG 502 -2.546 -5.956 22.032 170 HE ARG 502 HE ARG 502 -4.527 -4.839 22.294 171 HH11 ARG 502 HH11 ARG 502 -4.901 -8.111 23.422 172 HH12 ARG 502 HH12 ARG 502 -6.474 -7.838 24.095 173 HH21 ARG 502 HH21 ARG 502 -6.597 -4.466 23.176 174 HH22 ARG 502 HH22 ARG 502 -7.438 -5.764 23.954 175 H HIS 503 H HIS 503 -3.002 -10.109 18.521 176 HA HIS 503 HA HIS 503 -0.161 -9.873 19.016 177 HB2 HIS 503 HB2 HIS 503 -1.889 -11.698 19.861 178 HB3 HIS 503 HB3 HIS 503 -1.441 -12.486 18.352 179 HD1 HIS 503 HD1 HIS 503 -0.739 -13.740 21.080 180 HD2 HIS 503 HD2 HIS 503 1.819 -11.306 18.891 181 HE1 HIS 503 HE1 HIS 503 1.579 -14.325 21.862 182 H ILE 504 H ILE 504 -2.145 -11.449 16.502 183 HA ILE 504 HA ILE 504 0.058 -11.863 14.753 184 HB ILE 504 HB ILE 504 -1.477 -12.700 13.183 185 HG12 ILE 504 HG12 ILE 504 -2.948 -10.655 13.239 186 HG13 ILE 504 HG13 ILE 504 -3.814 -12.181 13.095 187 HG21 ILE 504 HG21 ILE 504 -1.326 -14.077 15.176 188 HG22 ILE 504 HG22 ILE 504 -2.645 -13.175 15.922 189 HG23 ILE 504 HG23 ILE 504 -2.951 -14.165 14.495 190 HD11 ILE 504 HD11 ILE 504 -4.967 -10.759 14.635 191 HD12 ILE 504 HD12 ILE 504 -4.251 -12.101 15.528 192 HD13 ILE 504 HD13 ILE 504 -3.495 -10.509 15.574 193 H VAL 505 H VAL 505 -2.123 -9.230 15.299 194 HA VAL 505 HA VAL 505 -1.618 -7.924 12.782 195 HB VAL 505 HB VAL 505 -2.955 -6.970 15.314 196 HG11 VAL 505 HG11 VAL 505 -3.714 -5.259 13.287 197 HG12 VAL 505 HG12 VAL 505 -2.575 -4.895 14.585 198 HG13 VAL 505 HG13 VAL 505 -1.982 -5.466 13.025 199 HG21 VAL 505 HG21 VAL 505 -4.075 -7.656 12.598 200 HG22 VAL 505 HG22 VAL 505 -4.160 -8.684 14.029 201 HG23 VAL 505 HG23 VAL 505 -4.999 -7.132 14.006 202 H GLY 506 H GLY 506 -0.838 -7.098 16.171 203 HA2 GLY 506 HA2 GLY 506 0.882 -4.969 15.586 204 HA3 GLY 506 HA3 GLY 506 0.905 -5.908 17.071 205 H ALA 507 H ALA 507 1.393 -8.362 15.311 206 HA ALA 507 HA ALA 507 4.249 -8.291 15.524 207 HB1 ALA 507 HB1 ALA 507 2.509 -10.415 14.277 208 HB2 ALA 507 HB2 ALA 507 4.184 -10.591 14.803 209 HB3 ALA 507 HB3 ALA 507 2.911 -10.317 15.992 210 H ILE 508 H ILE 508 2.080 -8.892 12.751 211 HA ILE 508 HA ILE 508 4.148 -8.604 10.826 212 HB ILE 508 HB ILE 508 2.356 -8.589 9.154 213 HG12 ILE 508 HG12 ILE 508 0.007 -9.087 10.420 214 HG13 ILE 508 HG13 ILE 508 0.732 -7.936 11.537 215 HG21 ILE 508 HG21 ILE 508 3.084 -10.652 10.771 216 HG22 ILE 508 HG22 ILE 508 1.330 -10.672 10.941 217 HG23 ILE 508 HG23 ILE 508 2.062 -10.805 9.342 218 HD11 ILE 508 HD11 ILE 508 1.096 -6.896 8.949 219 HD12 ILE 508 HD12 ILE 508 -0.574 -7.454 9.056 220 HD13 ILE 508 HD13 ILE 508 0.046 -6.295 10.232 221 H ALA 509 H ALA 509 1.900 -6.393 12.322 222 HA ALA 509 HA ALA 509 2.212 -4.268 10.455 223 HB1 ALA 509 HB1 ALA 509 1.030 -2.918 12.022 224 HB2 ALA 509 HB2 ALA 509 0.305 -4.526 12.057 225 HB3 ALA 509 HB3 ALA 509 1.400 -4.024 13.345 226 H ASN 510 H ASN 510 4.055 -5.397 13.165 227 HA ASN 510 HA ASN 510 5.638 -2.940 13.251 228 HB2 ASN 510 HB2 ASN 510 4.819 -4.189 15.345 229 HB3 ASN 510 HB3 ASN 510 6.066 -5.375 14.973 230 HD21 ASN 510 HD21 ASN 510 7.327 -4.991 16.732 231 HD22 ASN 510 HD22 ASN 510 8.181 -3.512 16.991 232 H GLU 511 H GLU 511 5.762 -6.215 12.128 233 HA GLU 511 HA GLU 511 8.560 -6.502 11.905 234 HB2 GLU 511 HB2 GLU 511 6.193 -7.843 10.665 235 HB3 GLU 511 HB3 GLU 511 7.789 -8.147 9.994 236 HG2 GLU 511 HG2 GLU 511 7.059 -8.551 12.883 237 HG3 GLU 511 HG3 GLU 511 7.055 -9.822 11.663 238 H GLY 512 H GLY 512 6.135 -5.049 9.825 239 HA2 GLY 512 HA2 GLY 512 8.322 -4.077 8.100 240 HA3 GLY 512 HA3 GLY 512 6.847 -4.725 7.396 241 H ASP 513 H ASP 513 6.061 -2.933 6.411 242 HA ASP 513 HA ASP 513 5.804 -0.466 7.961 243 HB2 ASP 513 HB2 ASP 513 6.642 -0.696 5.469 244 HB3 ASP 513 HB3 ASP 513 4.916 -0.692 5.115 245 H ILE 514 H ILE 514 3.995 -3.183 7.096 246 HA ILE 514 HA ILE 514 1.439 -2.259 6.646 247 HB ILE 514 HB ILE 514 2.229 -4.655 8.307 248 HG12 ILE 514 HG12 ILE 514 1.304 -4.824 5.475 249 HG13 ILE 514 HG13 ILE 514 2.955 -4.297 5.778 250 HG21 ILE 514 HG21 ILE 514 -0.055 -5.467 7.435 251 HG22 ILE 514 HG22 ILE 514 -0.023 -4.335 8.786 252 HG23 ILE 514 HG23 ILE 514 -0.388 -3.757 7.160 253 HD11 ILE 514 HD11 ILE 514 1.825 -6.832 6.917 254 HD12 ILE 514 HD12 ILE 514 2.632 -6.751 5.350 255 HD13 ILE 514 HD13 ILE 514 3.514 -6.335 6.819 256 H SER 515 H SER 515 -0.281 -1.622 7.903 257 HA SER 515 HA SER 515 0.361 -0.952 10.701 258 HB2 SER 515 HB2 SER 515 -0.116 0.886 8.839 259 HB3 SER 515 HB3 SER 515 -1.792 0.509 9.237 260 HG SER 515 HG SER 515 -1.103 2.151 10.582 261 H SER 516 H SER 516 -1.537 -0.835 12.156 262 HA SER 516 HA SER 516 -2.971 -3.244 12.146 263 HB2 SER 516 HB2 SER 516 -2.549 -2.108 14.230 264 HB3 SER 516 HB3 SER 516 -3.432 -0.682 13.687 265 HG SER 516 HG SER 516 -5.260 -1.628 14.162 266 H ARG 517 H ARG 517 -3.654 -0.163 10.731 267 HA ARG 517 HA ARG 517 -6.457 -0.832 10.278 268 HB2 ARG 517 HB2 ARG 517 -6.663 1.419 9.379 269 HB3 ARG 517 HB3 ARG 517 -5.874 1.464 10.950 270 HG2 ARG 517 HG2 ARG 517 -3.681 1.574 9.738 271 HG3 ARG 517 HG3 ARG 517 -4.601 1.784 8.246 272 HD2 ARG 517 HD2 ARG 517 -5.655 3.607 10.119 273 HD3 ARG 517 HD3 ARG 517 -3.899 3.725 10.229 274 HE ARG 517 HE ARG 517 -3.855 4.644 8.124 275 HH11 ARG 517 HH11 ARG 517 -7.001 3.286 8.738 276 HH12 ARG 517 HH12 ARG 517 -7.720 3.978 7.322 277 HH21 ARG 517 HH21 ARG 517 -4.789 5.560 6.257 278 HH22 ARG 517 HH22 ARG 517 -6.461 5.271 5.911 279 H TYR 518 H TYR 518 -3.422 -0.542 8.553 280 HA TYR 518 HA TYR 518 -4.397 -0.586 5.926 281 HB2 TYR 518 HB2 TYR 518 -1.899 -0.511 7.122 282 HB3 TYR 518 HB3 TYR 518 -1.896 -2.050 6.268 283 HD1 TYR 518 HD1 TYR 518 -3.060 -1.773 3.794 284 HD2 TYR 518 HD2 TYR 518 -0.967 1.235 5.956 285 HE1 TYR 518 HE1 TYR 518 -2.571 -0.606 1.685 286 HE2 TYR 518 HE2 TYR 518 -0.473 2.411 3.853 287 HH TYR 518 HH TYR 518 -1.948 1.509 0.852 288 H ILE 519 H ILE 519 -3.753 -3.170 8.220 289 HA ILE 519 HA ILE 519 -3.860 -5.371 6.525 290 HB ILE 519 HB ILE 519 -4.884 -5.187 9.361 291 HG12 ILE 519 HG12 ILE 519 -2.297 -6.475 8.800 292 HG13 ILE 519 HG13 ILE 519 -2.330 -4.742 8.490 293 HG21 ILE 519 HG21 ILE 519 -5.735 -7.162 8.238 294 HG22 ILE 519 HG22 ILE 519 -4.109 -7.585 7.706 295 HG23 ILE 519 HG23 ILE 519 -4.511 -7.616 9.423 296 HD11 ILE 519 HD11 ILE 519 -3.474 -4.748 10.891 297 HD12 ILE 519 HD12 ILE 519 -2.513 -6.220 11.038 298 HD13 ILE 519 HD13 ILE 519 -1.727 -4.687 10.662 299 H GLY 520 H GLY 520 -5.500 -6.701 5.786 300 HA2 GLY 520 HA2 GLY 520 -8.000 -5.418 5.252 301 HA3 GLY 520 HA3 GLY 520 -7.552 -7.055 4.796 302 H ASN 521 H ASN 521 -8.828 -8.547 5.639 303 HA ASN 521 HA ASN 521 -10.334 -7.943 8.065 304 HB2 ASN 521 HB2 ASN 521 -10.569 -10.171 6.035 305 HB3 ASN 521 HB3 ASN 521 -11.568 -10.057 7.480 306 HD21 ASN 521 HD21 ASN 521 -13.474 -9.822 6.375 307 HD22 ASN 521 HD22 ASN 521 -13.874 -8.399 5.480 308 H ILE 522 H ILE 522 -9.796 -8.724 9.991 309 HA ILE 522 HA ILE 522 -7.966 -11.033 10.102 310 HB ILE 522 HB ILE 522 -8.104 -8.828 12.155 311 HG12 ILE 522 HG12 ILE 522 -5.636 -8.735 10.808 312 HG13 ILE 522 HG13 ILE 522 -6.861 -8.842 9.548 313 HG21 ILE 522 HG21 ILE 522 -5.771 -10.632 11.768 314 HG22 ILE 522 HG22 ILE 522 -6.375 -9.863 13.235 315 HG23 ILE 522 HG23 ILE 522 -7.206 -11.269 12.572 316 HD11 ILE 522 HD11 ILE 522 -7.940 -6.958 11.164 317 HD12 ILE 522 HD12 ILE 522 -6.216 -6.649 11.373 318 HD13 ILE 522 HD13 ILE 522 -6.928 -6.620 9.760 319 H LYS 523 H LYS 523 -8.612 -12.740 11.254 320 HA LYS 523 HA LYS 523 -10.960 -12.416 13.006 321 HB2 LYS 523 HB2 LYS 523 -11.355 -13.746 10.924 322 HB3 LYS 523 HB3 LYS 523 -10.155 -14.902 11.487 323 HG2 LYS 523 HG2 LYS 523 -11.509 -15.474 13.381 324 HG3 LYS 523 HG3 LYS 523 -12.665 -14.198 12.992 325 HD2 LYS 523 HD2 LYS 523 -13.513 -15.346 11.167 326 HD3 LYS 523 HD3 LYS 523 -12.059 -16.330 10.983 327 HE2 LYS 523 HE2 LYS 523 -13.020 -16.943 13.523 328 HE3 LYS 523 HE3 LYS 523 -14.460 -16.844 12.511 329 HZ1 LYS 523 HZ1 LYS 523 -12.432 -18.260 11.153 330 HZ2 LYS 523 HZ2 LYS 523 -13.967 -18.795 11.621 331 HZ3 LYS 523 HZ3 LYS 523 -12.659 -18.944 12.684 332 H LEU 524 H LEU 524 -11.074 -13.806 14.869 333 HA LEU 524 HA LEU 524 -8.591 -15.100 15.688 334 HB2 LEU 524 HB2 LEU 524 -8.611 -12.682 16.445 335 HB3 LEU 524 HB3 LEU 524 -9.963 -13.118 17.487 336 HG LEU 524 HG LEU 524 -7.716 -13.016 18.605 337 HD11 LEU 524 HD11 LEU 524 -9.725 -14.326 19.407 338 HD12 LEU 524 HD12 LEU 524 -8.157 -14.851 20.018 339 HD13 LEU 524 HD13 LEU 524 -8.948 -15.755 18.727 340 HD21 LEU 524 HD21 LEU 524 -6.576 -14.125 16.603 341 HD22 LEU 524 HD22 LEU 524 -7.178 -15.647 17.261 342 HD23 LEU 524 HD23 LEU 524 -6.082 -14.645 18.214 343 H PHE 525 H PHE 525 -9.636 -17.074 15.634 344 HA PHE 525 HA PHE 525 -12.042 -17.433 17.244 345 HB2 PHE 525 HB2 PHE 525 -11.211 -18.554 14.864 346 HB3 PHE 525 HB3 PHE 525 -10.884 -19.831 16.031 347 HD1 PHE 525 HD1 PHE 525 -12.535 -21.411 16.090 348 HD2 PHE 525 HD2 PHE 525 -13.616 -17.331 15.545 349 HE1 PHE 525 HE1 PHE 525 -14.911 -22.049 16.057 350 HE2 PHE 525 HE2 PHE 525 -15.994 -17.961 15.513 351 HZ PHE 525 HZ PHE 525 -16.644 -20.323 15.770 352 H ALA 526 H ALA 526 -11.762 -20.037 18.079 353 HA ALA 526 HA ALA 526 -10.249 -19.716 20.460 354 HB1 ALA 526 HB1 ALA 526 -11.309 -22.332 19.429 355 HB2 ALA 526 HB2 ALA 526 -11.064 -21.828 21.102 356 HB3 ALA 526 HB3 ALA 526 -12.353 -21.102 20.142 357 H SER 527 H SER 527 -9.753 -21.594 17.498 358 HA SER 527 HA SER 527 -6.916 -21.821 18.198 359 HB2 SER 527 HB2 SER 527 -8.002 -23.956 18.820 360 HB3 SER 527 HB3 SER 527 -8.588 -24.126 17.165 361 HG SER 527 HG SER 527 -6.211 -24.810 18.168 362 H HIS 528 H HIS 528 -8.299 -20.064 16.387 363 HA HIS 528 HA HIS 528 -6.737 -20.586 14.020 364 HB2 HIS 528 HB2 HIS 528 -9.730 -20.768 14.012 365 HB3 HIS 528 HB3 HIS 528 -8.887 -20.164 12.589 366 HD1 HIS 528 HD1 HIS 528 -9.637 -23.267 14.468 367 HD2 HIS 528 HD2 HIS 528 -7.271 -22.091 11.262 368 HE1 HIS 528 HE1 HIS 528 -8.929 -25.399 13.337 369 H SER 529 H SER 529 -6.805 -18.759 12.492 370 HA SER 529 HA SER 529 -8.060 -16.308 13.217 371 HB2 SER 529 HB2 SER 529 -5.574 -15.273 13.447 372 HB3 SER 529 HB3 SER 529 -6.550 -15.761 14.832 373 HG SER 529 HG SER 529 -4.880 -16.982 15.236 374 H THR 530 H THR 530 -8.211 -15.039 11.469 375 HA THR 530 HA THR 530 -6.553 -15.738 9.139 376 HB THR 530 HB THR 530 -8.305 -14.984 7.711 377 HG1 THR 530 HG1 THR 530 -10.243 -14.065 8.672 378 HG21 THR 530 HG21 THR 530 -8.617 -17.118 9.409 379 HG22 THR 530 HG22 THR 530 -9.630 -16.772 8.008 380 HG23 THR 530 HG23 THR 530 -10.134 -16.244 9.613 381 H ILE 531 H ILE 531 -6.159 -13.904 7.603 382 HA ILE 531 HA ILE 531 -6.285 -11.216 8.455 383 HB ILE 531 HB ILE 531 -4.600 -11.804 10.071 384 HG12 ILE 531 HG12 ILE 531 -2.989 -10.510 7.901 385 HG13 ILE 531 HG13 ILE 531 -4.420 -9.693 8.520 386 HG21 ILE 531 HG21 ILE 531 -2.950 -12.849 7.773 387 HG22 ILE 531 HG22 ILE 531 -2.478 -12.802 9.471 388 HG23 ILE 531 HG23 ILE 531 -3.800 -13.847 8.953 389 HD11 ILE 531 HD11 ILE 531 -1.828 -10.255 9.848 390 HD12 ILE 531 HD12 ILE 531 -2.821 -8.798 9.867 391 HD13 ILE 531 HD13 ILE 531 -3.285 -10.194 10.838 392 H GLU 532 H GLU 532 -5.867 -9.850 6.787 393 HA GLU 532 HA GLU 532 -4.714 -11.047 4.353 394 HB2 GLU 532 HB2 GLU 532 -7.130 -10.587 4.157 395 HB3 GLU 532 HB3 GLU 532 -6.831 -8.898 4.541 396 HG2 GLU 532 HG2 GLU 532 -5.487 -10.200 2.210 397 HG3 GLU 532 HG3 GLU 532 -7.132 -9.582 2.083 398 H LEU 533 H LEU 533 -2.955 -10.105 3.548 399 HA LEU 533 HA LEU 533 -2.249 -7.418 4.527 400 HB2 LEU 533 HB2 LEU 533 -0.734 -9.897 4.263 401 HB3 LEU 533 HB3 LEU 533 0.076 -8.507 3.544 402 HG LEU 533 HG LEU 533 0.091 -7.354 5.652 403 HD11 LEU 533 HD11 LEU 533 -1.672 -7.729 6.976 404 HD12 LEU 533 HD12 LEU 533 -0.725 -9.079 7.602 405 HD13 LEU 533 HD13 LEU 533 -1.927 -9.355 6.341 406 HD21 LEU 533 HD21 LEU 533 1.902 -8.934 5.252 407 HD22 LEU 533 HD22 LEU 533 0.953 -10.226 5.988 408 HD23 LEU 533 HD23 LEU 533 1.498 -8.863 6.967 409 HA PRO 534 HA PRO 534 -2.564 -6.031 0.347 410 HB2 PRO 534 HB2 PRO 534 -1.209 -3.695 0.628 411 HB3 PRO 534 HB3 PRO 534 -2.852 -3.932 1.236 412 HG2 PRO 534 HG2 PRO 534 -0.250 -4.057 2.711 413 HG3 PRO 534 HG3 PRO 534 -1.779 -3.304 3.201 414 HD2 PRO 534 HD2 PRO 534 -0.988 -5.725 4.118 415 HD3 PRO 534 HD3 PRO 534 -2.696 -5.309 3.873 416 H LYS 535 H LYS 535 0.268 -7.021 1.868 417 HA LYS 535 HA LYS 535 2.381 -6.214 0.355 418 HB2 LYS 535 HB2 LYS 535 1.836 -9.041 1.281 419 HB3 LYS 535 HB3 LYS 535 3.406 -8.418 0.791 420 HG2 LYS 535 HG2 LYS 535 1.800 -7.338 3.096 421 HG3 LYS 535 HG3 LYS 535 3.083 -8.541 3.246 422 HD2 LYS 535 HD2 LYS 535 3.515 -5.853 1.963 423 HD3 LYS 535 HD3 LYS 535 3.736 -6.130 3.692 424 HE2 LYS 535 HE2 LYS 535 5.083 -7.999 1.825 425 HE3 LYS 535 HE3 LYS 535 5.724 -6.360 1.930 426 HZ1 LYS 535 HZ1 LYS 535 6.680 -8.088 3.500 427 HZ2 LYS 535 HZ2 LYS 535 5.221 -7.986 4.348 428 HZ3 LYS 535 HZ3 LYS 535 6.202 -6.617 4.185 429 H GLY 536 H GLY 536 3.359 -6.812 -1.579 430 HA2 GLY 536 HA2 GLY 536 1.698 -8.450 -3.391 431 HA3 GLY 536 HA3 GLY 536 2.399 -6.926 -3.913 432 H MET 537 H MET 537 3.805 -9.568 -1.999 433 HA MET 537 HA MET 537 5.333 -10.693 -4.068 434 HB2 MET 537 HB2 MET 537 6.341 -8.286 -3.663 435 HB3 MET 537 HB3 MET 537 7.127 -9.080 -2.305 436 HG2 MET 537 HG2 MET 537 8.435 -10.391 -3.645 437 HG3 MET 537 HG3 MET 537 7.292 -10.351 -4.985 438 HE1 MET 537 HE1 MET 537 10.696 -9.312 -5.988 439 HE2 MET 537 HE2 MET 537 11.040 -8.502 -4.460 440 HE3 MET 537 HE3 MET 537 10.330 -10.118 -4.462 441 HA PRO 538 HA PRO 538 5.092 -12.880 0.050 442 HB2 PRO 538 HB2 PRO 538 3.881 -15.108 -0.919 443 HB3 PRO 538 HB3 PRO 538 2.983 -13.686 -0.373 444 HG2 PRO 538 HG2 PRO 538 3.713 -14.511 -3.156 445 HG3 PRO 538 HG3 PRO 538 2.179 -13.863 -2.548 446 HD2 PRO 538 HD2 PRO 538 3.989 -12.335 -3.860 447 HD3 PRO 538 HD3 PRO 538 2.941 -11.688 -2.581 448 H GLY 539 H GLY 539 5.769 -15.300 0.388 449 HA2 GLY 539 HA2 GLY 539 7.198 -17.084 -0.134 450 HA3 GLY 539 HA3 GLY 539 7.697 -16.230 -1.587 451 H GLU 540 H GLU 540 7.764 -14.139 1.015 452 HA GLU 540 HA GLU 540 10.645 -14.120 1.026 453 HB2 GLU 540 HB2 GLU 540 8.882 -12.492 2.841 454 HB3 GLU 540 HB3 GLU 540 10.490 -12.106 2.245 455 HG2 GLU 540 HG2 GLU 540 9.395 -12.082 -0.079 456 HG3 GLU 540 HG3 GLU 540 7.873 -11.982 0.804 457 H VAL 541 H VAL 541 8.180 -14.416 3.591 458 HA VAL 541 HA VAL 541 10.132 -15.440 5.455 459 HB VAL 541 HB VAL 541 7.133 -15.264 5.771 460 HG11 VAL 541 HG11 VAL 541 7.666 -15.305 8.187 461 HG12 VAL 541 HG12 VAL 541 8.126 -16.792 7.354 462 HG13 VAL 541 HG13 VAL 541 9.356 -15.602 7.781 463 HG21 VAL 541 HG21 VAL 541 8.231 -13.270 7.301 464 HG22 VAL 541 HG22 VAL 541 9.222 -13.226 5.843 465 HG23 VAL 541 HG23 VAL 541 7.472 -13.051 5.724 466 H LEU 542 H LEU 542 7.590 -16.712 3.410 467 HA LEU 542 HA LEU 542 7.390 -19.275 4.570 468 HB2 LEU 542 HB2 LEU 542 6.692 -18.092 1.924 469 HB3 LEU 542 HB3 LEU 542 6.652 -19.843 2.116 470 HG LEU 542 HG LEU 542 5.142 -19.217 4.199 471 HD11 LEU 542 HD11 LEU 542 5.340 -16.827 4.000 472 HD12 LEU 542 HD12 LEU 542 3.684 -17.304 3.630 473 HD13 LEU 542 HD13 LEU 542 4.792 -16.884 2.324 474 HD21 LEU 542 HD21 LEU 542 3.524 -18.924 1.817 475 HD22 LEU 542 HD22 LEU 542 3.585 -20.245 2.984 476 HD23 LEU 542 HD23 LEU 542 4.727 -20.202 1.640 477 H GLN 543 H GLN 543 9.759 -17.831 2.535 478 HA GLN 543 HA GLN 543 10.844 -20.337 1.588 479 HB2 GLN 543 HB2 GLN 543 11.448 -17.455 1.190 480 HB3 GLN 543 HB3 GLN 543 12.770 -18.591 0.960 481 HG2 GLN 543 HG2 GLN 543 10.162 -19.109 -0.380 482 HG3 GLN 543 HG3 GLN 543 11.246 -17.883 -1.037 483 HE21 GLN 543 HE21 GLN 543 10.750 -19.847 -2.681 484 HE22 GLN 543 HE22 GLN 543 12.060 -20.968 -2.787 485 H HIS 544 H HIS 544 12.133 -17.680 3.593 486 HA HIS 544 HA HIS 544 14.344 -19.189 4.531 487 HB2 HIS 544 HB2 HIS 544 13.959 -16.602 4.470 488 HB3 HIS 544 HB3 HIS 544 13.226 -16.858 6.051 489 HD1 HIS 544 HD1 HIS 544 15.191 -15.422 7.055 490 HD2 HIS 544 HD2 HIS 544 16.342 -19.016 5.316 491 HE1 HIS 544 HE1 HIS 544 17.538 -15.837 7.859 492 H PHE 545 H PHE 545 11.350 -18.148 6.166 493 HA PHE 545 HA PHE 545 11.870 -19.977 8.358 494 HB2 PHE 545 HB2 PHE 545 9.899 -17.796 7.828 495 HB3 PHE 545 HB3 PHE 545 9.495 -19.021 9.026 496 HD1 PHE 545 HD1 PHE 545 9.962 -18.468 11.194 497 HD2 PHE 545 HD2 PHE 545 12.466 -16.954 8.103 498 HE1 PHE 545 HE1 PHE 545 11.301 -17.267 12.872 499 HE2 PHE 545 HE2 PHE 545 13.810 -15.751 9.776 500 HZ PHE 545 HZ PHE 545 13.228 -15.905 12.164 501 H THR 546 H THR 546 11.594 -21.379 6.027 502 HA THR 546 HA THR 546 8.885 -22.302 5.699 503 HB THR 546 HB THR 546 10.573 -22.240 3.832 504 HG1 THR 546 HG1 THR 546 9.056 -23.543 3.130 505 HG21 THR 546 HG21 THR 546 12.487 -23.392 3.914 506 HG22 THR 546 HG22 THR 546 11.663 -24.861 4.436 507 HG23 THR 546 HG23 THR 546 12.151 -23.654 5.625 508 H ARG 547 H ARG 547 11.531 -23.084 7.721 509 HA ARG 547 HA ARG 547 10.286 -25.655 8.439 510 HB2 ARG 547 HB2 ARG 547 12.488 -26.243 9.423 511 HB3 ARG 547 HB3 ARG 547 12.562 -25.953 7.690 512 HG2 ARG 547 HG2 ARG 547 13.121 -23.645 9.448 513 HG3 ARG 547 HG3 ARG 547 14.321 -24.938 9.415 514 HD2 ARG 547 HD2 ARG 547 13.828 -24.652 6.774 515 HD3 ARG 547 HD3 ARG 547 13.557 -23.001 7.331 516 HE ARG 547 HE ARG 547 15.807 -22.792 7.682 517 HH11 ARG 547 HH11 ARG 547 15.015 -26.168 7.373 518 HH12 ARG 547 HH12 ARG 547 16.668 -26.688 7.355 519 HH21 ARG 547 HH21 ARG 547 17.987 -23.464 7.660 520 HH22 ARG 547 HH22 ARG 547 18.357 -25.149 7.520 521 H THR 548 H THR 548 11.125 -22.504 9.536 522 HA THR 548 HA THR 548 10.342 -23.235 12.283 523 HB THR 548 HB THR 548 12.040 -20.886 11.416 524 HG1 THR 548 HG1 THR 548 13.740 -22.096 11.935 525 HG21 THR 548 HG21 THR 548 11.439 -21.903 14.195 526 HG22 THR 548 HG22 THR 548 10.648 -20.514 13.449 527 HG23 THR 548 HG23 THR 548 12.382 -20.476 13.765 528 H ARG 549 H ARG 549 8.571 -22.318 13.119 529 HA ARG 549 HA ARG 549 7.586 -19.781 12.125 530 HB2 ARG 549 HB2 ARG 549 6.156 -22.383 11.671 531 HB3 ARG 549 HB3 ARG 549 5.253 -20.885 11.847 532 HG2 ARG 549 HG2 ARG 549 5.507 -20.642 9.654 533 HG3 ARG 549 HG3 ARG 549 7.189 -20.236 10.002 534 HD2 ARG 549 HD2 ARG 549 7.142 -21.942 8.313 535 HD3 ARG 549 HD3 ARG 549 7.755 -22.644 9.809 536 HE ARG 549 HE ARG 549 4.916 -22.968 9.385 537 HH11 ARG 549 HH11 ARG 549 8.093 -24.314 8.925 538 HH12 ARG 549 HH12 ARG 549 7.521 -25.939 8.746 539 HH21 ARG 549 HH21 ARG 549 4.150 -25.104 9.151 540 HH22 ARG 549 HH22 ARG 549 5.278 -26.388 8.874 541 H ILE 550 H ILE 550 5.343 -19.359 13.284 542 HA ILE 550 HA ILE 550 4.953 -20.586 15.824 543 HB ILE 550 HB ILE 550 7.049 -19.036 16.055 544 HG12 ILE 550 HG12 ILE 550 5.182 -18.339 18.208 545 HG13 ILE 550 HG13 ILE 550 5.188 -20.053 17.807 546 HG21 ILE 550 HG21 ILE 550 5.447 -17.153 15.044 547 HG22 ILE 550 HG22 ILE 550 5.115 -16.914 16.759 548 HG23 ILE 550 HG23 ILE 550 6.767 -16.790 16.155 549 HD11 ILE 550 HD11 ILE 550 7.840 -18.831 18.084 550 HD12 ILE 550 HD12 ILE 550 6.872 -18.892 19.558 551 HD13 ILE 550 HD13 ILE 550 7.227 -20.376 18.674 552 H LEU 551 H LEU 551 3.554 -18.894 17.236 553 HA LEU 551 HA LEU 551 1.080 -18.705 16.234 554 HB2 LEU 551 HB2 LEU 551 0.593 -16.943 17.792 555 HB3 LEU 551 HB3 LEU 551 1.721 -18.081 18.527 556 HG LEU 551 HG LEU 551 3.474 -16.276 17.614 557 HD11 LEU 551 HD11 LEU 551 1.356 -14.414 18.525 558 HD12 LEU 551 HD12 LEU 551 1.279 -14.988 16.860 559 HD13 LEU 551 HD13 LEU 551 2.716 -14.143 17.435 560 HD21 LEU 551 HD21 LEU 551 1.918 -16.371 20.174 561 HD22 LEU 551 HD22 LEU 551 3.195 -15.181 19.925 562 HD23 LEU 551 HD23 LEU 551 3.569 -16.904 19.855 563 H ASN 552 H ASN 552 3.632 -16.313 15.702 564 HA ASN 552 HA ASN 552 1.950 -14.603 14.119 565 HB2 ASN 552 HB2 ASN 552 3.923 -13.814 15.478 566 HB3 ASN 552 HB3 ASN 552 4.968 -14.579 14.285 567 HD21 ASN 552 HD21 ASN 552 5.914 -12.707 13.593 568 HD22 ASN 552 HD22 ASN 552 5.068 -11.491 12.703 569 H LYS 553 H LYS 553 4.903 -16.442 13.316 570 HA LYS 553 HA LYS 553 4.608 -16.229 10.534 571 HB2 LYS 553 HB2 LYS 553 5.952 -18.595 11.788 572 HB3 LYS 553 HB3 LYS 553 6.419 -17.681 10.360 573 HG2 LYS 553 HG2 LYS 553 6.714 -16.870 13.239 574 HG3 LYS 553 HG3 LYS 553 7.992 -17.194 12.065 575 HD2 LYS 553 HD2 LYS 553 6.847 -15.259 10.728 576 HD3 LYS 553 HD3 LYS 553 6.186 -14.826 12.306 577 HE2 LYS 553 HE2 LYS 553 9.122 -15.263 11.807 578 HE3 LYS 553 HE3 LYS 553 8.344 -13.688 11.666 579 HZ1 LYS 553 HZ1 LYS 553 8.749 -13.477 13.827 580 HZ2 LYS 553 HZ2 LYS 553 9.147 -15.111 14.012 581 HZ3 LYS 553 HZ3 LYS 553 7.530 -14.620 14.095 582 HA PRO 554 HA PRO 554 1.655 -19.256 9.365 583 HB2 PRO 554 HB2 PRO 554 2.796 -20.413 7.190 584 HB3 PRO 554 HB3 PRO 554 2.145 -18.770 7.174 585 HG2 PRO 554 HG2 PRO 554 4.982 -19.681 7.469 586 HG3 PRO 554 HG3 PRO 554 4.330 -18.347 6.499 587 HD2 PRO 554 HD2 PRO 554 5.515 -17.957 8.902 588 HD3 PRO 554 HD3 PRO 554 4.194 -16.929 8.310 589 H MET 555 H MET 555 2.185 -20.454 11.416 590 HA MET 555 HA MET 555 3.975 -22.624 11.455 591 HB2 MET 555 HB2 MET 555 3.163 -21.774 13.531 592 HB3 MET 555 HB3 MET 555 1.489 -22.032 13.058 593 HG2 MET 555 HG2 MET 555 2.155 -23.702 14.654 594 HG3 MET 555 HG3 MET 555 1.871 -24.455 13.086 595 HE1 MET 555 HE1 MET 555 2.811 -26.246 12.797 596 HE2 MET 555 HE2 MET 555 4.364 -26.144 11.968 597 HE3 MET 555 HE3 MET 555 4.264 -26.885 13.566 598 H ASN 556 H ASN 556 0.435 -22.601 11.013 599 HA ASN 556 HA ASN 556 0.652 -24.854 9.193 600 HB2 ASN 556 HB2 ASN 556 0.392 -25.692 11.628 601 HB3 ASN 556 HB3 ASN 556 -1.265 -25.107 11.498 602 HD21 ASN 556 HD21 ASN 556 0.663 -27.736 11.153 603 HD22 ASN 556 HD22 ASN 556 -0.316 -28.678 10.087 604 H MET 557 H MET 557 0.023 -22.561 8.210 605 HA MET 557 HA MET 557 -2.902 -22.291 8.228 606 HB2 MET 557 HB2 MET 557 -2.429 -20.109 7.049 607 HB3 MET 557 HB3 MET 557 -1.855 -20.210 8.708 608 HG2 MET 557 HG2 MET 557 0.220 -19.786 8.078 609 HG3 MET 557 HG3 MET 557 0.188 -21.107 6.913 610 HE1 MET 557 HE1 MET 557 0.208 -21.018 4.719 611 HE2 MET 557 HE2 MET 557 -1.346 -20.358 4.210 612 HE3 MET 557 HE3 MET 557 0.154 -19.622 3.642 613 H GLN 558 H GLN 558 -3.804 -21.566 6.028 614 HA GLN 558 HA GLN 558 -2.453 -22.798 3.761 615 HB2 GLN 558 HB2 GLN 558 -5.305 -23.559 4.338 616 HB3 GLN 558 HB3 GLN 558 -4.184 -24.297 3.202 617 HG2 GLN 558 HG2 GLN 558 -2.817 -24.974 5.235 618 HG3 GLN 558 HG3 GLN 558 -4.229 -24.528 6.191 619 HE21 GLN 558 HE21 GLN 558 -2.901 -27.131 5.715 620 HE22 GLN 558 HE22 GLN 558 -4.149 -28.180 5.142 621 H LEU 559 H LEU 559 -2.985 -21.899 1.810 622 HA LEU 559 HA LEU 559 -4.267 -19.351 1.864 623 HB2 LEU 559 HB2 LEU 559 -2.368 -19.848 0.398 624 HB3 LEU 559 HB3 LEU 559 -3.354 -21.019 -0.477 625 HG LEU 559 HG LEU 559 -2.964 -18.695 -1.517 626 HD11 LEU 559 HD11 LEU 559 -4.919 -18.902 -2.730 627 HD12 LEU 559 HD12 LEU 559 -5.857 -19.423 -1.330 628 HD13 LEU 559 HD13 LEU 559 -4.707 -20.529 -2.081 629 HD21 LEU 559 HD21 LEU 559 -5.156 -18.011 0.439 630 HD22 LEU 559 HD22 LEU 559 -4.528 -16.972 -0.841 631 HD23 LEU 559 HD23 LEU 559 -3.496 -17.419 0.518 632 H LEU 560 H LEU 560 -6.375 -18.995 1.787 633 HA LEU 560 HA LEU 560 -8.084 -20.946 0.389 634 HB2 LEU 560 HB2 LEU 560 -9.762 -20.658 1.960 635 HB3 LEU 560 HB3 LEU 560 -8.291 -20.675 2.931 636 HG LEU 560 HG LEU 560 -8.581 -18.018 2.532 637 HD11 LEU 560 HD11 LEU 560 -10.923 -18.928 1.494 638 HD12 LEU 560 HD12 LEU 560 -10.683 -17.325 2.186 639 HD13 LEU 560 HD13 LEU 560 -11.377 -18.614 3.169 640 HD21 LEU 560 HD21 LEU 560 -8.419 -19.568 4.645 641 HD22 LEU 560 HD22 LEU 560 -10.153 -19.263 4.735 642 HD23 LEU 560 HD23 LEU 560 -9.016 -17.914 4.780 643 H GLY 561 H GLY 561 -7.242 -17.601 0.829 644 HA2 GLY 561 HA2 GLY 561 -9.469 -16.617 -0.740 645 HA3 GLY 561 HA3 GLY 561 -8.143 -15.663 -0.093 646 H ASP 562 H ASP 562 -8.033 -14.573 -2.123 647 HA ASP 562 HA ASP 562 -6.098 -15.672 -3.878 648 HB2 ASP 562 HB2 ASP 562 -8.245 -16.859 -4.589 649 HB3 ASP 562 HB3 ASP 562 -8.799 -15.288 -5.162 650 H ALA 563 H ALA 563 -5.276 -14.143 -5.338 651 HA ALA 563 HA ALA 563 -5.635 -11.430 -4.551 652 HB1 ALA 563 HB1 ALA 563 -3.649 -11.164 -5.512 653 HB2 ALA 563 HB2 ALA 563 -3.677 -12.886 -5.895 654 HB3 ALA 563 HB3 ALA 563 -4.263 -11.711 -7.073 655 H GLN 564 H GLN 564 -6.943 -9.911 -5.350 656 HA GLN 564 HA GLN 564 -9.042 -10.500 -7.093 657 HB2 GLN 564 HB2 GLN 564 -8.553 -8.477 -5.406 658 HB3 GLN 564 HB3 GLN 564 -8.128 -7.680 -6.915 659 HG2 GLN 564 HG2 GLN 564 -10.278 -7.814 -7.747 660 HG3 GLN 564 HG3 GLN 564 -10.719 -9.142 -6.674 661 HE21 GLN 564 HE21 GLN 564 -12.553 -7.393 -6.653 662 HE22 GLN 564 HE22 GLN 564 -12.485 -6.309 -5.309 Start of MODEL 7 1 H MET 480 H MET 480 0.468 0.312 -0.187 2 HA MET 480 HA MET 480 2.003 0.494 -1.880 3 HB2 MET 480 HB2 MET 480 4.350 0.767 -1.006 4 HB3 MET 480 HB3 MET 480 3.140 1.774 -0.223 5 HG2 MET 480 HG2 MET 480 3.090 0.338 1.689 6 HG3 MET 480 HG3 MET 480 4.133 -0.836 0.890 7 HE1 MET 480 HE1 MET 480 5.352 3.277 0.807 8 HE2 MET 480 HE2 MET 480 3.760 2.798 1.397 9 HE3 MET 480 HE3 MET 480 5.028 3.241 2.540 10 H ALA 481 H ALA 481 1.162 -1.872 -2.307 11 HA ALA 481 HA ALA 481 3.206 -3.900 -1.985 12 HB1 ALA 481 HB1 ALA 481 0.379 -3.845 -2.646 13 HB2 ALA 481 HB2 ALA 481 1.293 -4.945 -3.678 14 HB3 ALA 481 HB3 ALA 481 1.349 -5.131 -1.926 15 H ASP 482 H ASP 482 3.344 -5.339 -4.165 16 HA ASP 482 HA ASP 482 4.493 -3.511 -6.153 17 HB2 ASP 482 HB2 ASP 482 5.681 -5.598 -4.950 18 HB3 ASP 482 HB3 ASP 482 4.978 -6.436 -6.331 19 H VAL 483 H VAL 483 2.141 -6.060 -5.731 20 HA VAL 483 HA VAL 483 1.185 -5.554 -8.466 21 HB VAL 483 HB VAL 483 2.317 -7.679 -8.578 22 HG11 VAL 483 HG11 VAL 483 1.820 -9.537 -7.144 23 HG12 VAL 483 HG12 VAL 483 2.231 -8.149 -6.135 24 HG13 VAL 483 HG13 VAL 483 0.545 -8.629 -6.332 25 HG21 VAL 483 HG21 VAL 483 -0.068 -7.283 -9.561 26 HG22 VAL 483 HG22 VAL 483 0.646 -8.895 -9.603 27 HG23 VAL 483 HG23 VAL 483 -0.550 -8.491 -8.370 28 H GLY 484 H GLY 484 0.442 -6.731 -5.214 29 HA2 GLY 484 HA2 GLY 484 -1.560 -5.662 -4.199 30 HA3 GLY 484 HA3 GLY 484 -2.385 -6.021 -5.708 31 H ASP 485 H ASP 485 -0.157 -8.301 -4.321 32 HA ASP 485 HA ASP 485 -1.856 -10.469 -4.408 33 HB2 ASP 485 HB2 ASP 485 0.739 -10.207 -3.839 34 HB3 ASP 485 HB3 ASP 485 0.135 -10.396 -2.195 35 H MET 486 H MET 486 -3.849 -10.413 -3.543 36 HA MET 486 HA MET 486 -4.048 -9.876 -0.654 37 HB2 MET 486 HB2 MET 486 -5.110 -8.028 -1.701 38 HB3 MET 486 HB3 MET 486 -5.922 -9.062 -2.869 39 HG2 MET 486 HG2 MET 486 -6.577 -9.686 -0.096 40 HG3 MET 486 HG3 MET 486 -7.031 -8.056 -0.589 41 HE1 MET 486 HE1 MET 486 -8.985 -8.866 -3.881 42 HE2 MET 486 HE2 MET 486 -9.259 -7.708 -2.579 43 HE3 MET 486 HE3 MET 486 -7.635 -7.934 -3.231 44 H GLN 487 H GLN 487 -4.628 -11.623 0.441 45 HA GLN 487 HA GLN 487 -6.713 -13.366 -0.559 46 HB2 GLN 487 HB2 GLN 487 -3.965 -14.458 0.069 47 HB3 GLN 487 HB3 GLN 487 -5.387 -15.414 -0.326 48 HG2 GLN 487 HG2 GLN 487 -5.450 -14.395 -2.549 49 HG3 GLN 487 HG3 GLN 487 -4.011 -13.457 -2.152 50 HE21 GLN 487 HE21 GLN 487 -2.086 -14.735 -1.523 51 HE22 GLN 487 HE22 GLN 487 -1.798 -16.222 -2.354 52 H LEU 488 H LEU 488 -7.028 -15.235 1.114 53 HA LEU 488 HA LEU 488 -6.790 -14.048 3.800 54 HB2 LEU 488 HB2 LEU 488 -9.096 -14.247 2.799 55 HB3 LEU 488 HB3 LEU 488 -8.896 -15.996 2.888 56 HG LEU 488 HG LEU 488 -8.632 -15.770 5.359 57 HD11 LEU 488 HD11 LEU 488 -9.873 -13.378 5.913 58 HD12 LEU 488 HD12 LEU 488 -8.727 -12.953 4.642 59 HD13 LEU 488 HD13 LEU 488 -8.157 -13.730 6.119 60 HD21 LEU 488 HD21 LEU 488 -11.221 -14.641 4.305 61 HD22 LEU 488 HD22 LEU 488 -10.977 -15.549 5.798 62 HD23 LEU 488 HD23 LEU 488 -10.780 -16.347 4.237 63 H TYR 489 H TYR 489 -5.303 -15.061 4.966 64 HA TYR 489 HA TYR 489 -4.987 -17.970 4.628 65 HB2 TYR 489 HB2 TYR 489 -2.866 -16.417 6.000 66 HB3 TYR 489 HB3 TYR 489 -2.728 -17.770 4.883 67 HD1 TYR 489 HD1 TYR 489 -3.113 -14.122 5.151 68 HD2 TYR 489 HD2 TYR 489 -2.534 -17.410 2.514 69 HE1 TYR 489 HE1 TYR 489 -2.522 -12.561 3.345 70 HE2 TYR 489 HE2 TYR 489 -1.941 -15.858 0.700 71 HH TYR 489 HH TYR 489 -2.423 -12.466 0.952 72 H ARG 490 H ARG 490 -5.842 -19.121 6.215 73 HA ARG 490 HA ARG 490 -6.116 -17.911 8.875 74 HB2 ARG 490 HB2 ARG 490 -7.798 -19.606 9.313 75 HB3 ARG 490 HB3 ARG 490 -8.168 -18.775 7.808 76 HG2 ARG 490 HG2 ARG 490 -8.417 -20.805 6.936 77 HG3 ARG 490 HG3 ARG 490 -6.655 -20.903 6.967 78 HD2 ARG 490 HD2 ARG 490 -7.010 -21.723 9.408 79 HD3 ARG 490 HD3 ARG 490 -8.654 -22.061 8.867 80 HE ARG 490 HE ARG 490 -6.258 -23.493 8.152 81 HH11 ARG 490 HH11 ARG 490 -9.540 -22.744 7.266 82 HH12 ARG 490 HH12 ARG 490 -9.741 -24.166 6.296 83 HH21 ARG 490 HH21 ARG 490 -6.509 -25.368 6.879 84 HH22 ARG 490 HH22 ARG 490 -8.016 -25.658 6.078 85 H ILE 491 H ILE 491 -5.004 -18.645 10.579 86 HA ILE 491 HA ILE 491 -3.208 -20.924 10.154 87 HB ILE 491 HB ILE 491 -1.889 -20.099 11.983 88 HG12 ILE 491 HG12 ILE 491 -4.048 -18.011 12.355 89 HG13 ILE 491 HG13 ILE 491 -3.720 -19.357 13.441 90 HG21 ILE 491 HG21 ILE 491 -0.927 -18.724 10.534 91 HG22 ILE 491 HG22 ILE 491 -2.438 -18.595 9.635 92 HG23 ILE 491 HG23 ILE 491 -2.096 -17.471 10.950 93 HD11 ILE 491 HD11 ILE 491 -1.987 -16.968 12.891 94 HD12 ILE 491 HD12 ILE 491 -2.758 -17.431 14.408 95 HD13 ILE 491 HD13 ILE 491 -1.426 -18.393 13.767 96 H GLU 492 H GLU 492 -2.756 -22.273 12.134 97 HA GLU 492 HA GLU 492 -5.314 -23.060 13.312 98 HB2 GLU 492 HB2 GLU 492 -3.857 -24.735 12.129 99 HB3 GLU 492 HB3 GLU 492 -2.679 -24.532 13.418 100 HG2 GLU 492 HG2 GLU 492 -3.958 -25.634 14.956 101 HG3 GLU 492 HG3 GLU 492 -5.472 -25.230 14.150 102 H VAL 493 H VAL 493 -4.569 -20.784 14.454 103 HA VAL 493 HA VAL 493 -3.818 -21.623 17.152 104 HB VAL 493 HB VAL 493 -2.610 -19.139 15.950 105 HG11 VAL 493 HG11 VAL 493 -2.911 -19.493 18.476 106 HG12 VAL 493 HG12 VAL 493 -1.632 -20.699 18.318 107 HG13 VAL 493 HG13 VAL 493 -1.317 -19.017 17.890 108 HG21 VAL 493 HG21 VAL 493 -1.766 -21.048 14.699 109 HG22 VAL 493 HG22 VAL 493 -0.507 -20.387 15.743 110 HG23 VAL 493 HG23 VAL 493 -1.346 -21.867 16.204 111 H GLY 494 H GLY 494 -4.875 -20.544 18.757 112 HA2 GLY 494 HA2 GLY 494 -6.324 -18.089 18.124 113 HA3 GLY 494 HA3 GLY 494 -7.293 -19.483 18.581 114 H ARG 495 H ARG 495 -7.925 -17.835 20.270 115 HA ARG 495 HA ARG 495 -6.216 -16.973 22.287 116 HB2 ARG 495 HB2 ARG 495 -8.317 -16.925 23.710 117 HB3 ARG 495 HB3 ARG 495 -8.384 -16.028 22.200 118 HG2 ARG 495 HG2 ARG 495 -9.691 -17.731 21.161 119 HG3 ARG 495 HG3 ARG 495 -9.464 -18.814 22.535 120 HD2 ARG 495 HD2 ARG 495 -10.752 -17.361 23.957 121 HD3 ARG 495 HD3 ARG 495 -10.863 -16.149 22.682 122 HE ARG 495 HE ARG 495 -11.947 -18.560 21.742 123 HH11 ARG 495 HH11 ARG 495 -12.621 -16.042 24.050 124 HH12 ARG 495 HH12 ARG 495 -14.339 -16.249 23.970 125 HH21 ARG 495 HH21 ARG 495 -14.208 -18.842 21.628 126 HH22 ARG 495 HH22 ARG 495 -15.241 -17.843 22.593 127 H ASP 496 H ASP 496 -7.743 -20.075 21.787 128 HA ASP 496 HA ASP 496 -7.180 -21.088 24.407 129 HB2 ASP 496 HB2 ASP 496 -8.916 -21.871 22.546 130 HB3 ASP 496 HB3 ASP 496 -7.585 -22.936 22.104 131 H ASP 497 H ASP 497 -5.362 -20.653 21.557 132 HA ASP 497 HA ASP 497 -3.399 -22.692 22.286 133 HB2 ASP 497 HB2 ASP 497 -4.156 -22.358 19.895 134 HB3 ASP 497 HB3 ASP 497 -3.310 -20.813 19.923 135 H GLY 498 H GLY 498 -3.713 -19.187 21.950 136 HA2 GLY 498 HA2 GLY 498 -2.419 -18.068 23.854 137 HA3 GLY 498 HA3 GLY 498 -1.035 -18.883 23.142 138 H VAL 499 H VAL 499 -3.684 -17.413 21.348 139 HA VAL 499 HA VAL 499 -1.908 -15.218 20.541 140 HB VAL 499 HB VAL 499 -1.943 -17.156 18.857 141 HG11 VAL 499 HG11 VAL 499 -4.394 -16.055 17.676 142 HG12 VAL 499 HG12 VAL 499 -3.822 -17.722 17.761 143 HG13 VAL 499 HG13 VAL 499 -4.638 -16.997 19.147 144 HG21 VAL 499 HG21 VAL 499 -2.854 -14.596 17.613 145 HG22 VAL 499 HG22 VAL 499 -1.345 -14.643 18.525 146 HG23 VAL 499 HG23 VAL 499 -1.557 -15.684 17.117 147 H GLU 500 H GLU 500 -2.961 -13.328 19.844 148 HA GLU 500 HA GLU 500 -5.869 -13.264 20.301 149 HB2 GLU 500 HB2 GLU 500 -4.071 -10.967 21.029 150 HB3 GLU 500 HB3 GLU 500 -5.728 -11.265 21.536 151 HG2 GLU 500 HG2 GLU 500 -4.631 -13.411 22.617 152 HG3 GLU 500 HG3 GLU 500 -3.190 -12.397 22.571 153 H VAL 501 H VAL 501 -6.506 -10.768 19.619 154 HA VAL 501 HA VAL 501 -6.180 -10.781 16.770 155 HB VAL 501 HB VAL 501 -7.552 -8.784 18.574 156 HG11 VAL 501 HG11 VAL 501 -8.673 -8.035 16.488 157 HG12 VAL 501 HG12 VAL 501 -6.941 -7.695 16.519 158 HG13 VAL 501 HG13 VAL 501 -7.559 -9.048 15.571 159 HG21 VAL 501 HG21 VAL 501 -8.380 -11.231 18.366 160 HG22 VAL 501 HG22 VAL 501 -9.541 -9.914 18.193 161 HG23 VAL 501 HG23 VAL 501 -8.919 -10.734 16.761 162 H ARG 502 H ARG 502 -4.890 -8.928 19.451 163 HA ARG 502 HA ARG 502 -3.586 -7.028 17.683 164 HB2 ARG 502 HB2 ARG 502 -2.711 -6.056 19.806 165 HB3 ARG 502 HB3 ARG 502 -4.466 -6.138 19.735 166 HG2 ARG 502 HG2 ARG 502 -4.552 -7.931 21.250 167 HG3 ARG 502 HG3 ARG 502 -2.825 -8.253 21.088 168 HD2 ARG 502 HD2 ARG 502 -2.235 -6.551 22.482 169 HD3 ARG 502 HD3 ARG 502 -3.628 -5.564 22.041 170 HE ARG 502 HE ARG 502 -4.323 -7.915 23.533 171 HH11 ARG 502 HH11 ARG 502 -3.265 -4.606 23.752 172 HH12 ARG 502 HH12 ARG 502 -3.895 -4.373 25.349 173 HH21 ARG 502 HH21 ARG 502 -5.156 -7.622 25.636 174 HH22 ARG 502 HH22 ARG 502 -4.969 -6.090 26.420 175 H HIS 503 H HIS 503 -2.969 -10.113 18.584 176 HA HIS 503 HA HIS 503 -0.128 -9.867 19.069 177 HB2 HIS 503 HB2 HIS 503 -1.885 -11.709 19.882 178 HB3 HIS 503 HB3 HIS 503 -1.349 -12.497 18.401 179 HD1 HIS 503 HD1 HIS 503 1.664 -11.322 18.808 180 HD2 HIS 503 HD2 HIS 503 -0.563 -13.627 21.451 181 HE1 HIS 503 HE1 HIS 503 3.346 -12.447 20.300 182 H ILE 504 H ILE 504 -2.109 -11.460 16.564 183 HA ILE 504 HA ILE 504 0.096 -11.855 14.809 184 HB ILE 504 HB ILE 504 -1.432 -12.724 13.250 185 HG12 ILE 504 HG12 ILE 504 -2.930 -10.698 13.297 186 HG13 ILE 504 HG13 ILE 504 -3.775 -12.236 13.163 187 HG21 ILE 504 HG21 ILE 504 -2.885 -14.199 14.575 188 HG22 ILE 504 HG22 ILE 504 -1.260 -14.088 15.248 189 HG23 ILE 504 HG23 ILE 504 -2.586 -13.198 15.995 190 HD11 ILE 504 HD11 ILE 504 -3.474 -10.551 15.635 191 HD12 ILE 504 HD12 ILE 504 -4.944 -10.820 14.697 192 HD13 ILE 504 HD13 ILE 504 -4.213 -12.152 15.593 193 H VAL 505 H VAL 505 -2.120 -9.251 15.354 194 HA VAL 505 HA VAL 505 -1.648 -7.950 12.829 195 HB VAL 505 HB VAL 505 -2.983 -7.005 15.365 196 HG11 VAL 505 HG11 VAL 505 -2.060 -5.500 13.047 197 HG12 VAL 505 HG12 VAL 505 -3.785 -5.300 13.364 198 HG13 VAL 505 HG13 VAL 505 -2.606 -4.930 14.624 199 HG21 VAL 505 HG21 VAL 505 -3.949 -8.775 13.643 200 HG22 VAL 505 HG22 VAL 505 -4.977 -7.564 14.408 201 HG23 VAL 505 HG23 VAL 505 -4.387 -7.309 12.766 202 H GLY 506 H GLY 506 -0.864 -7.091 16.209 203 HA2 GLY 506 HA2 GLY 506 0.824 -4.943 15.606 204 HA3 GLY 506 HA3 GLY 506 0.870 -5.876 17.094 205 H ALA 507 H ALA 507 1.383 -8.329 15.342 206 HA ALA 507 HA ALA 507 4.234 -8.231 15.546 207 HB1 ALA 507 HB1 ALA 507 3.312 -10.319 16.030 208 HB2 ALA 507 HB2 ALA 507 2.286 -10.303 14.595 209 HB3 ALA 507 HB3 ALA 507 4.027 -10.530 14.432 210 H ILE 508 H ILE 508 2.091 -8.850 12.756 211 HA ILE 508 HA ILE 508 4.164 -8.495 10.847 212 HB ILE 508 HB ILE 508 2.392 -8.529 9.162 213 HG12 ILE 508 HG12 ILE 508 0.040 -9.071 10.429 214 HG13 ILE 508 HG13 ILE 508 0.734 -7.868 11.511 215 HG21 ILE 508 HG21 ILE 508 1.384 -10.623 10.950 216 HG22 ILE 508 HG22 ILE 508 2.125 -10.749 9.355 217 HG23 ILE 508 HG23 ILE 508 3.139 -10.574 10.787 218 HD11 ILE 508 HD11 ILE 508 1.094 -6.869 8.923 219 HD12 ILE 508 HD12 ILE 508 -0.548 -7.510 8.981 220 HD13 ILE 508 HD13 ILE 508 -0.031 -6.302 10.157 221 H ALA 509 H ALA 509 1.858 -6.354 12.353 222 HA ALA 509 HA ALA 509 2.146 -4.206 10.497 223 HB1 ALA 509 HB1 ALA 509 1.262 -3.962 13.362 224 HB2 ALA 509 HB2 ALA 509 0.845 -2.923 11.998 225 HB3 ALA 509 HB3 ALA 509 0.212 -4.567 12.081 226 H ASN 510 H ASN 510 3.969 -5.333 13.208 227 HA ASN 510 HA ASN 510 5.478 -2.827 13.359 228 HB2 ASN 510 HB2 ASN 510 4.669 -3.902 15.466 229 HB3 ASN 510 HB3 ASN 510 5.711 -5.278 15.116 230 HD21 ASN 510 HD21 ASN 510 6.142 -1.761 14.919 231 HD22 ASN 510 HD22 ASN 510 7.564 -1.710 15.898 232 H GLU 511 H GLU 511 5.696 -6.092 12.241 233 HA GLU 511 HA GLU 511 8.521 -6.296 12.110 234 HB2 GLU 511 HB2 GLU 511 6.227 -7.772 10.890 235 HB3 GLU 511 HB3 GLU 511 7.840 -8.031 10.240 236 HG2 GLU 511 HG2 GLU 511 7.069 -8.393 13.126 237 HG3 GLU 511 HG3 GLU 511 7.197 -9.691 11.940 238 H GLY 512 H GLY 512 6.064 -5.442 9.679 239 HA2 GLY 512 HA2 GLY 512 8.246 -4.353 8.011 240 HA3 GLY 512 HA3 GLY 512 6.751 -5.012 7.363 241 H ASP 513 H ASP 513 6.175 -3.162 6.252 242 HA ASP 513 HA ASP 513 5.915 -0.658 7.710 243 HB2 ASP 513 HB2 ASP 513 5.853 -1.477 4.854 244 HB3 ASP 513 HB3 ASP 513 4.906 -0.059 5.299 245 H ILE 514 H ILE 514 4.027 -3.369 7.002 246 HA ILE 514 HA ILE 514 1.485 -2.404 6.555 247 HB ILE 514 HB ILE 514 2.240 -4.739 8.317 248 HG12 ILE 514 HG12 ILE 514 1.359 -4.879 5.444 249 HG13 ILE 514 HG13 ILE 514 3.051 -4.624 5.859 250 HG21 ILE 514 HG21 ILE 514 -0.093 -5.497 7.390 251 HG22 ILE 514 HG22 ILE 514 0.017 -4.458 8.809 252 HG23 ILE 514 HG23 ILE 514 -0.357 -3.761 7.233 253 HD11 ILE 514 HD11 ILE 514 3.095 -6.717 7.070 254 HD12 ILE 514 HD12 ILE 514 1.379 -6.964 6.742 255 HD13 ILE 514 HD13 ILE 514 2.541 -6.973 5.416 256 H SER 515 H SER 515 -0.204 -1.689 7.819 257 HA SER 515 HA SER 515 0.506 -0.907 10.571 258 HB2 SER 515 HB2 SER 515 0.059 0.869 8.652 259 HB3 SER 515 HB3 SER 515 -1.625 0.545 9.062 260 HG SER 515 HG SER 515 -1.349 1.781 10.723 261 H SER 516 H SER 516 -1.441 -0.584 11.995 262 HA SER 516 HA SER 516 -2.899 -2.979 12.171 263 HB2 SER 516 HB2 SER 516 -2.411 -1.565 14.125 264 HB3 SER 516 HB3 SER 516 -3.477 -0.313 13.488 265 HG SER 516 HG SER 516 -5.104 -1.361 14.286 266 H ARG 517 H ARG 517 -3.526 -0.010 10.512 267 HA ARG 517 HA ARG 517 -6.335 -0.677 10.089 268 HB2 ARG 517 HB2 ARG 517 -6.389 1.511 8.872 269 HB3 ARG 517 HB3 ARG 517 -5.923 1.633 10.564 270 HG2 ARG 517 HG2 ARG 517 -3.633 1.942 9.991 271 HG3 ARG 517 HG3 ARG 517 -3.948 1.558 8.298 272 HD2 ARG 517 HD2 ARG 517 -5.492 3.789 9.481 273 HD3 ARG 517 HD3 ARG 517 -3.771 4.063 9.218 274 HE ARG 517 HE ARG 517 -4.576 3.062 6.851 275 HH11 ARG 517 HH11 ARG 517 -5.794 5.625 8.868 276 HH12 ARG 517 HH12 ARG 517 -6.412 6.552 7.541 277 HH21 ARG 517 HH21 ARG 517 -5.384 4.273 5.096 278 HH22 ARG 517 HH22 ARG 517 -6.179 5.782 5.396 279 H TYR 518 H TYR 518 -3.282 -0.555 8.379 280 HA TYR 518 HA TYR 518 -4.189 -0.743 5.749 281 HB2 TYR 518 HB2 TYR 518 -1.721 -0.762 7.016 282 HB3 TYR 518 HB3 TYR 518 -1.800 -2.341 6.242 283 HD1 TYR 518 HD1 TYR 518 -0.651 -2.372 4.249 284 HD2 TYR 518 HD2 TYR 518 -2.874 1.110 5.266 285 HE1 TYR 518 HE1 TYR 518 -0.026 -1.353 2.100 286 HE2 TYR 518 HE2 TYR 518 -2.256 2.139 3.119 287 HH TYR 518 HH TYR 518 -1.319 0.680 0.583 288 H ILE 519 H ILE 519 -3.590 -3.273 8.148 289 HA ILE 519 HA ILE 519 -3.894 -5.524 6.566 290 HB ILE 519 HB ILE 519 -4.836 -5.175 9.415 291 HG12 ILE 519 HG12 ILE 519 -2.331 -6.609 8.904 292 HG13 ILE 519 HG13 ILE 519 -2.275 -4.913 8.436 293 HG21 ILE 519 HG21 ILE 519 -4.561 -7.613 9.568 294 HG22 ILE 519 HG22 ILE 519 -5.795 -7.154 8.396 295 HG23 ILE 519 HG23 ILE 519 -4.202 -7.668 7.843 296 HD11 ILE 519 HD11 ILE 519 -1.513 -4.968 10.641 297 HD12 ILE 519 HD12 ILE 519 -3.185 -4.417 10.758 298 HD13 ILE 519 HD13 ILE 519 -2.778 -6.089 11.144 299 H GLY 520 H GLY 520 -5.621 -6.793 5.927 300 HA2 GLY 520 HA2 GLY 520 -8.084 -5.387 5.461 301 HA3 GLY 520 HA3 GLY 520 -7.710 -7.031 4.965 302 H ASN 521 H ASN 521 -9.068 -8.453 5.802 303 HA ASN 521 HA ASN 521 -10.413 -7.853 8.321 304 HB2 ASN 521 HB2 ASN 521 -10.887 -10.075 6.321 305 HB3 ASN 521 HB3 ASN 521 -11.877 -9.754 7.743 306 HD21 ASN 521 HD21 ASN 521 -12.242 -9.644 4.703 307 HD22 ASN 521 HD22 ASN 521 -13.036 -8.130 4.452 308 H ILE 522 H ILE 522 -9.864 -8.761 10.190 309 HA ILE 522 HA ILE 522 -8.144 -11.155 10.125 310 HB ILE 522 HB ILE 522 -8.127 -9.056 12.291 311 HG12 ILE 522 HG12 ILE 522 -5.694 -8.985 10.900 312 HG13 ILE 522 HG13 ILE 522 -6.935 -9.011 9.653 313 HG21 ILE 522 HG21 ILE 522 -6.063 -11.153 11.665 314 HG22 ILE 522 HG22 ILE 522 -6.192 -10.149 13.108 315 HG23 ILE 522 HG23 ILE 522 -7.385 -11.411 12.803 316 HD11 ILE 522 HD11 ILE 522 -7.056 -6.815 9.938 317 HD12 ILE 522 HD12 ILE 522 -7.881 -7.161 11.459 318 HD13 ILE 522 HD13 ILE 522 -6.140 -6.880 11.444 319 H LYS 523 H LYS 523 -8.646 -12.841 11.441 320 HA LYS 523 HA LYS 523 -11.017 -12.536 13.165 321 HB2 LYS 523 HB2 LYS 523 -11.619 -13.811 11.187 322 HB3 LYS 523 HB3 LYS 523 -10.252 -14.890 11.429 323 HG2 LYS 523 HG2 LYS 523 -11.256 -15.654 13.541 324 HG3 LYS 523 HG3 LYS 523 -12.647 -14.611 13.235 325 HD2 LYS 523 HD2 LYS 523 -13.574 -16.200 11.989 326 HD3 LYS 523 HD3 LYS 523 -12.177 -16.184 10.910 327 HE2 LYS 523 HE2 LYS 523 -11.114 -17.621 12.860 328 HE3 LYS 523 HE3 LYS 523 -12.807 -17.987 13.191 329 HZ1 LYS 523 HZ1 LYS 523 -11.273 -19.304 11.421 330 HZ2 LYS 523 HZ2 LYS 523 -12.065 -18.203 10.411 331 HZ3 LYS 523 HZ3 LYS 523 -12.964 -19.261 11.377 332 H LEU 524 H LEU 524 -11.053 -13.711 15.096 333 HA LEU 524 HA LEU 524 -8.593 -15.127 15.833 334 HB2 LEU 524 HB2 LEU 524 -8.590 -12.710 16.599 335 HB3 LEU 524 HB3 LEU 524 -9.922 -13.148 17.667 336 HG LEU 524 HG LEU 524 -7.655 -13.058 18.741 337 HD11 LEU 524 HD11 LEU 524 -8.117 -14.824 20.185 338 HD12 LEU 524 HD12 LEU 524 -8.798 -15.823 18.902 339 HD13 LEU 524 HD13 LEU 524 -9.692 -14.425 19.500 340 HD21 LEU 524 HD21 LEU 524 -6.574 -14.170 16.693 341 HD22 LEU 524 HD22 LEU 524 -7.137 -15.688 17.394 342 HD23 LEU 524 HD23 LEU 524 -6.020 -14.660 18.294 343 H PHE 525 H PHE 525 -9.643 -17.096 15.797 344 HA PHE 525 HA PHE 525 -12.031 -17.446 17.434 345 HB2 PHE 525 HB2 PHE 525 -11.172 -18.597 15.052 346 HB3 PHE 525 HB3 PHE 525 -10.943 -19.870 16.246 347 HD1 PHE 525 HD1 PHE 525 -12.675 -21.350 16.396 348 HD2 PHE 525 HD2 PHE 525 -13.528 -17.274 15.515 349 HE1 PHE 525 HE1 PHE 525 -15.076 -21.878 16.296 350 HE2 PHE 525 HE2 PHE 525 -15.931 -17.795 15.415 351 HZ PHE 525 HZ PHE 525 -16.708 -20.099 15.806 352 H ALA 526 H ALA 526 -11.753 -20.048 18.270 353 HA ALA 526 HA ALA 526 -10.196 -19.729 20.627 354 HB1 ALA 526 HB1 ALA 526 -10.807 -22.181 20.965 355 HB2 ALA 526 HB2 ALA 526 -12.136 -21.025 20.861 356 HB3 ALA 526 HB3 ALA 526 -11.734 -22.034 19.472 357 H SER 527 H SER 527 -9.784 -21.622 17.664 358 HA SER 527 HA SER 527 -6.938 -21.889 18.307 359 HB2 SER 527 HB2 SER 527 -8.753 -24.163 17.475 360 HB3 SER 527 HB3 SER 527 -6.992 -24.257 17.486 361 HG SER 527 HG SER 527 -7.313 -23.516 19.803 362 H HIS 528 H HIS 528 -8.340 -20.138 16.505 363 HA HIS 528 HA HIS 528 -6.832 -20.698 14.115 364 HB2 HIS 528 HB2 HIS 528 -9.813 -20.934 14.182 365 HB3 HIS 528 HB3 HIS 528 -9.043 -20.273 12.742 366 HD1 HIS 528 HD1 HIS 528 -9.673 -23.435 14.544 367 HD2 HIS 528 HD2 HIS 528 -7.370 -22.120 11.346 368 HE1 HIS 528 HE1 HIS 528 -8.930 -25.519 13.349 369 H SER 529 H SER 529 -6.906 -18.893 12.574 370 HA SER 529 HA SER 529 -8.165 -16.435 13.269 371 HB2 SER 529 HB2 SER 529 -5.684 -15.386 13.468 372 HB3 SER 529 HB3 SER 529 -6.644 -15.865 14.868 373 HG SER 529 HG SER 529 -4.755 -16.890 15.165 374 H THR 530 H THR 530 -8.327 -15.188 11.505 375 HA THR 530 HA THR 530 -6.655 -15.896 9.185 376 HB THR 530 HB THR 530 -8.422 -15.301 7.735 377 HG1 THR 530 HG1 THR 530 -9.344 -13.886 9.959 378 HG21 THR 530 HG21 THR 530 -9.953 -16.941 8.201 379 HG22 THR 530 HG22 THR 530 -10.094 -16.479 9.898 380 HG23 THR 530 HG23 THR 530 -8.687 -17.388 9.344 381 H ILE 531 H ILE 531 -6.344 -14.073 7.607 382 HA ILE 531 HA ILE 531 -6.559 -11.377 8.431 383 HB ILE 531 HB ILE 531 -4.818 -11.908 10.016 384 HG12 ILE 531 HG12 ILE 531 -3.534 -10.468 7.691 385 HG13 ILE 531 HG13 ILE 531 -4.755 -9.738 8.727 386 HG21 ILE 531 HG21 ILE 531 -3.945 -13.907 8.896 387 HG22 ILE 531 HG22 ILE 531 -3.201 -12.886 7.667 388 HG23 ILE 531 HG23 ILE 531 -2.654 -12.790 9.340 389 HD11 ILE 531 HD11 ILE 531 -2.613 -9.020 9.470 390 HD12 ILE 531 HD12 ILE 531 -3.247 -10.153 10.664 391 HD13 ILE 531 HD13 ILE 531 -2.012 -10.677 9.519 392 H GLU 532 H GLU 532 -6.052 -9.957 6.790 393 HA GLU 532 HA GLU 532 -5.089 -11.194 4.294 394 HB2 GLU 532 HB2 GLU 532 -7.470 -10.498 4.246 395 HB3 GLU 532 HB3 GLU 532 -6.972 -8.848 4.590 396 HG2 GLU 532 HG2 GLU 532 -5.701 -8.810 2.492 397 HG3 GLU 532 HG3 GLU 532 -6.257 -10.446 2.142 398 H LEU 533 H LEU 533 -3.176 -10.499 3.632 399 HA LEU 533 HA LEU 533 -2.194 -7.908 4.602 400 HB2 LEU 533 HB2 LEU 533 -0.990 -10.500 4.156 401 HB3 LEU 533 HB3 LEU 533 -0.105 -9.227 3.317 402 HG LEU 533 HG LEU 533 0.211 -8.041 5.424 403 HD11 LEU 533 HD11 LEU 533 -1.834 -9.877 6.320 404 HD12 LEU 533 HD12 LEU 533 -1.261 -8.380 7.054 405 HD13 LEU 533 HD13 LEU 533 -0.427 -9.899 7.383 406 HD21 LEU 533 HD21 LEU 533 2.038 -9.242 5.866 407 HD22 LEU 533 HD22 LEU 533 1.469 -10.354 4.621 408 HD23 LEU 533 HD23 LEU 533 1.099 -10.664 6.318 409 HA PRO 534 HA PRO 534 -2.803 -6.295 0.513 410 HB2 PRO 534 HB2 PRO 534 -1.550 -3.922 0.927 411 HB3 PRO 534 HB3 PRO 534 -3.170 -4.273 1.541 412 HG2 PRO 534 HG2 PRO 534 -0.540 -4.373 2.968 413 HG3 PRO 534 HG3 PRO 534 -2.093 -3.725 3.528 414 HD2 PRO 534 HD2 PRO 534 -1.178 -6.162 4.273 415 HD3 PRO 534 HD3 PRO 534 -2.907 -5.809 4.080 416 H LYS 535 H LYS 535 0.107 -7.224 1.937 417 HA LYS 535 HA LYS 535 2.134 -6.222 0.409 418 HB2 LYS 535 HB2 LYS 535 1.786 -9.098 1.277 419 HB3 LYS 535 HB3 LYS 535 3.302 -8.377 0.750 420 HG2 LYS 535 HG2 LYS 535 1.721 -7.407 3.119 421 HG3 LYS 535 HG3 LYS 535 3.039 -8.577 3.220 422 HD2 LYS 535 HD2 LYS 535 3.307 -5.807 2.057 423 HD3 LYS 535 HD3 LYS 535 3.725 -6.235 3.718 424 HE2 LYS 535 HE2 LYS 535 5.297 -7.947 2.784 425 HE3 LYS 535 HE3 LYS 535 4.976 -7.281 1.183 426 HZ1 LYS 535 HZ1 LYS 535 5.741 -5.345 3.197 427 HZ2 LYS 535 HZ2 LYS 535 6.236 -5.486 1.586 428 HZ3 LYS 535 HZ3 LYS 535 6.949 -6.452 2.777 429 H GLY 536 H GLY 536 3.176 -6.832 -1.529 430 HA2 GLY 536 HA2 GLY 536 1.510 -8.428 -3.373 431 HA3 GLY 536 HA3 GLY 536 2.210 -6.893 -3.865 432 H MET 537 H MET 537 3.700 -9.469 -1.943 433 HA MET 537 HA MET 537 5.175 -10.651 -4.016 434 HB2 MET 537 HB2 MET 537 6.141 -8.203 -3.749 435 HB3 MET 537 HB3 MET 537 7.004 -8.930 -2.400 436 HG2 MET 537 HG2 MET 537 8.251 -10.303 -3.758 437 HG3 MET 537 HG3 MET 537 7.071 -10.258 -5.066 438 HE1 MET 537 HE1 MET 537 9.692 -10.264 -5.934 439 HE2 MET 537 HE2 MET 537 10.449 -8.755 -6.445 440 HE3 MET 537 HE3 MET 537 10.664 -9.335 -4.793 441 HA PRO 538 HA PRO 538 5.148 -12.626 0.221 442 HB2 PRO 538 HB2 PRO 538 3.890 -14.901 -0.562 443 HB3 PRO 538 HB3 PRO 538 3.021 -13.454 -0.039 444 HG2 PRO 538 HG2 PRO 538 3.594 -14.420 -2.813 445 HG3 PRO 538 HG3 PRO 538 2.095 -13.741 -2.153 446 HD2 PRO 538 HD2 PRO 538 3.823 -12.282 -3.642 447 HD3 PRO 538 HD3 PRO 538 2.847 -11.570 -2.340 448 H GLY 539 H GLY 539 5.898 -14.976 0.682 449 HA2 GLY 539 HA2 GLY 539 7.283 -16.805 0.150 450 HA3 GLY 539 HA3 GLY 539 7.705 -16.016 -1.363 451 H GLU 540 H GLU 540 7.860 -13.929 1.299 452 HA GLU 540 HA GLU 540 10.730 -13.775 1.081 453 HB2 GLU 540 HB2 GLU 540 9.014 -12.293 3.065 454 HB3 GLU 540 HB3 GLU 540 10.583 -11.825 2.425 455 HG2 GLU 540 HG2 GLU 540 8.018 -11.957 0.855 456 HG3 GLU 540 HG3 GLU 540 8.773 -10.491 1.479 457 H VAL 541 H VAL 541 8.495 -14.266 3.821 458 HA VAL 541 HA VAL 541 10.641 -15.295 5.465 459 HB VAL 541 HB VAL 541 7.686 -15.173 6.079 460 HG11 VAL 541 HG11 VAL 541 8.913 -16.739 7.486 461 HG12 VAL 541 HG12 VAL 541 10.083 -15.479 7.886 462 HG13 VAL 541 HG13 VAL 541 8.407 -15.327 8.413 463 HG21 VAL 541 HG21 VAL 541 8.222 -13.120 7.319 464 HG22 VAL 541 HG22 VAL 541 9.878 -13.199 6.717 465 HG23 VAL 541 HG23 VAL 541 8.542 -12.950 5.593 466 H LEU 542 H LEU 542 7.932 -16.540 3.632 467 HA LEU 542 HA LEU 542 7.879 -19.141 4.727 468 HB2 LEU 542 HB2 LEU 542 6.961 -17.966 2.126 469 HB3 LEU 542 HB3 LEU 542 6.833 -19.695 2.441 470 HG LEU 542 HG LEU 542 5.586 -18.802 4.620 471 HD11 LEU 542 HD11 LEU 542 4.080 -16.903 3.712 472 HD12 LEU 542 HD12 LEU 542 5.430 -16.580 2.625 473 HD13 LEU 542 HD13 LEU 542 5.667 -16.504 4.370 474 HD21 LEU 542 HD21 LEU 542 4.874 -20.058 2.281 475 HD22 LEU 542 HD22 LEU 542 3.788 -18.669 2.331 476 HD23 LEU 542 HD23 LEU 542 3.828 -19.806 3.679 477 H GLN 543 H GLN 543 10.017 -17.595 2.522 478 HA GLN 543 HA GLN 543 11.013 -20.025 1.337 479 HB2 GLN 543 HB2 GLN 543 11.561 -17.128 1.081 480 HB3 GLN 543 HB3 GLN 543 12.910 -18.201 0.736 481 HG2 GLN 543 HG2 GLN 543 10.219 -18.566 -0.536 482 HG3 GLN 543 HG3 GLN 543 11.445 -17.496 -1.213 483 HE21 GLN 543 HE21 GLN 543 10.285 -20.645 -1.049 484 HE22 GLN 543 HE22 GLN 543 11.594 -21.441 -1.848 485 H HIS 544 H HIS 544 12.488 -17.537 3.429 486 HA HIS 544 HA HIS 544 14.731 -19.165 4.080 487 HB2 HIS 544 HB2 HIS 544 13.692 -16.718 5.523 488 HB3 HIS 544 HB3 HIS 544 15.305 -17.409 5.670 489 HD1 HIS 544 HD1 HIS 544 14.041 -14.550 4.375 490 HD2 HIS 544 HD2 HIS 544 16.181 -17.625 2.580 491 HE1 HIS 544 HE1 HIS 544 15.078 -13.537 2.319 492 H PHE 545 H PHE 545 11.950 -18.072 6.029 493 HA PHE 545 HA PHE 545 12.554 -20.101 8.030 494 HB2 PHE 545 HB2 PHE 545 10.378 -18.000 8.006 495 HB3 PHE 545 HB3 PHE 545 10.824 -19.016 9.373 496 HD1 PHE 545 HD1 PHE 545 12.598 -18.427 10.800 497 HD2 PHE 545 HD2 PHE 545 12.012 -16.312 7.153 498 HE1 PHE 545 HE1 PHE 545 14.237 -16.739 11.519 499 HE2 PHE 545 HE2 PHE 545 13.651 -14.621 7.866 500 HZ PHE 545 HZ PHE 545 14.765 -14.833 10.053 501 H THR 546 H THR 546 11.831 -21.227 5.629 502 HA THR 546 HA THR 546 9.086 -21.772 5.332 503 HB THR 546 HB THR 546 10.836 -22.204 3.591 504 HG1 THR 546 HG1 THR 546 9.560 -23.710 2.723 505 HG21 THR 546 HG21 THR 546 12.111 -23.622 5.549 506 HG22 THR 546 HG22 THR 546 12.456 -23.747 3.824 507 HG23 THR 546 HG23 THR 546 11.372 -24.906 4.594 508 H ARG 547 H ARG 547 11.467 -23.016 7.503 509 HA ARG 547 HA ARG 547 9.585 -25.101 8.391 510 HB2 ARG 547 HB2 ARG 547 11.509 -26.275 9.337 511 HB3 ARG 547 HB3 ARG 547 11.732 -25.995 7.615 512 HG2 ARG 547 HG2 ARG 547 13.792 -25.407 8.368 513 HG3 ARG 547 HG3 ARG 547 12.985 -23.842 8.485 514 HD2 ARG 547 HD2 ARG 547 12.734 -24.016 10.804 515 HD3 ARG 547 HD3 ARG 547 13.019 -25.756 10.793 516 HE ARG 547 HE ARG 547 15.001 -23.671 10.860 517 HH11 ARG 547 HH11 ARG 547 14.353 -26.995 10.055 518 HH12 ARG 547 HH12 ARG 547 16.006 -27.490 10.207 519 HH21 ARG 547 HH21 ARG 547 17.181 -24.310 11.062 520 HH22 ARG 547 HH22 ARG 547 17.614 -25.962 10.780 521 H THR 548 H THR 548 10.620 -22.078 9.123 522 HA THR 548 HA THR 548 10.296 -22.497 12.024 523 HB THR 548 HB THR 548 11.768 -20.271 10.599 524 HG1 THR 548 HG1 THR 548 13.327 -21.697 10.738 525 HG21 THR 548 HG21 THR 548 12.492 -19.930 13.124 526 HG22 THR 548 HG22 THR 548 10.908 -20.644 13.424 527 HG23 THR 548 HG23 THR 548 11.043 -19.167 12.471 528 H ARG 549 H ARG 549 8.465 -21.761 12.860 529 HA ARG 549 HA ARG 549 7.319 -19.258 11.981 530 HB2 ARG 549 HB2 ARG 549 5.968 -21.899 11.492 531 HB3 ARG 549 HB3 ARG 549 5.032 -20.427 11.712 532 HG2 ARG 549 HG2 ARG 549 5.213 -20.246 9.492 533 HG3 ARG 549 HG3 ARG 549 6.828 -19.628 9.845 534 HD2 ARG 549 HD2 ARG 549 7.613 -21.279 8.572 535 HD3 ARG 549 HD3 ARG 549 7.140 -22.380 9.866 536 HE ARG 549 HE ARG 549 5.354 -23.079 8.589 537 HH11 ARG 549 HH11 ARG 549 6.821 -20.272 7.144 538 HH12 ARG 549 HH12 ARG 549 5.937 -20.412 5.661 539 HH21 ARG 549 HH21 ARG 549 4.184 -23.274 6.641 540 HH22 ARG 549 HH22 ARG 549 4.437 -22.120 5.376 541 H ILE 550 H ILE 550 5.106 -18.975 13.229 542 HA ILE 550 HA ILE 550 4.887 -20.317 15.742 543 HB ILE 550 HB ILE 550 6.868 -18.619 15.941 544 HG12 ILE 550 HG12 ILE 550 5.047 -18.104 18.177 545 HG13 ILE 550 HG13 ILE 550 5.136 -19.804 17.729 546 HG21 ILE 550 HG21 ILE 550 5.089 -16.840 15.035 547 HG22 ILE 550 HG22 ILE 550 4.813 -16.662 16.767 548 HG23 ILE 550 HG23 ILE 550 6.425 -16.404 16.099 549 HD11 ILE 550 HD11 ILE 550 7.264 -20.016 18.443 550 HD12 ILE 550 HD12 ILE 550 7.701 -18.370 17.983 551 HD13 ILE 550 HD13 ILE 550 6.796 -18.660 19.469 552 H LEU 551 H LEU 551 3.405 -18.805 17.246 553 HA LEU 551 HA LEU 551 0.893 -18.769 16.327 554 HB2 LEU 551 HB2 LEU 551 0.333 -17.077 17.954 555 HB3 LEU 551 HB3 LEU 551 1.526 -18.190 18.620 556 HG LEU 551 HG LEU 551 3.168 -16.258 17.743 557 HD11 LEU 551 HD11 LEU 551 0.731 -15.087 17.291 558 HD12 LEU 551 HD12 LEU 551 2.262 -14.236 17.487 559 HD13 LEU 551 HD13 LEU 551 1.186 -14.443 18.869 560 HD21 LEU 551 HD21 LEU 551 2.884 -15.295 20.123 561 HD22 LEU 551 HD22 LEU 551 3.388 -16.975 19.939 562 HD23 LEU 551 HD23 LEU 551 1.712 -16.595 20.337 563 H ASN 552 H ASN 552 3.227 -16.155 15.825 564 HA ASN 552 HA ASN 552 1.376 -14.519 14.369 565 HB2 ASN 552 HB2 ASN 552 3.186 -13.457 15.580 566 HB3 ASN 552 HB3 ASN 552 4.383 -14.372 14.667 567 HD21 ASN 552 HD21 ASN 552 1.469 -12.683 13.589 568 HD22 ASN 552 HD22 ASN 552 2.283 -11.601 12.515 569 H LYS 553 H LYS 553 4.402 -16.126 13.366 570 HA LYS 553 HA LYS 553 3.955 -15.834 10.608 571 HB2 LYS 553 HB2 LYS 553 5.534 -18.127 11.722 572 HB3 LYS 553 HB3 LYS 553 5.852 -17.154 10.292 573 HG2 LYS 553 HG2 LYS 553 6.223 -16.349 13.166 574 HG3 LYS 553 HG3 LYS 553 7.475 -16.605 11.948 575 HD2 LYS 553 HD2 LYS 553 5.361 -14.451 11.893 576 HD3 LYS 553 HD3 LYS 553 7.061 -14.223 12.306 577 HE2 LYS 553 HE2 LYS 553 7.528 -13.924 10.157 578 HE3 LYS 553 HE3 LYS 553 6.970 -15.562 9.817 579 HZ1 LYS 553 HZ1 LYS 553 5.870 -13.355 8.785 580 HZ2 LYS 553 HZ2 LYS 553 4.874 -13.591 10.131 581 HZ3 LYS 553 HZ3 LYS 553 5.043 -14.818 8.980 582 HA PRO 554 HA PRO 554 1.180 -19.036 9.468 583 HB2 PRO 554 HB2 PRO 554 2.295 -20.031 7.202 584 HB3 PRO 554 HB3 PRO 554 1.525 -18.442 7.276 585 HG2 PRO 554 HG2 PRO 554 4.431 -19.146 7.405 586 HG3 PRO 554 HG3 PRO 554 3.637 -17.834 6.515 587 HD2 PRO 554 HD2 PRO 554 4.906 -17.435 8.873 588 HD3 PRO 554 HD3 PRO 554 3.485 -16.491 8.382 589 H MET 555 H MET 555 1.885 -20.264 11.443 590 HA MET 555 HA MET 555 3.839 -22.276 11.352 591 HB2 MET 555 HB2 MET 555 2.997 -21.591 13.476 592 HB3 MET 555 HB3 MET 555 1.343 -21.970 13.017 593 HG2 MET 555 HG2 MET 555 2.181 -23.643 14.529 594 HG3 MET 555 HG3 MET 555 1.923 -24.349 12.935 595 HE1 MET 555 HE1 MET 555 3.034 -26.197 12.863 596 HE2 MET 555 HE2 MET 555 4.236 -25.753 11.651 597 HE3 MET 555 HE3 MET 555 4.740 -26.541 13.147 598 H ASN 556 H ASN 556 0.294 -22.653 11.129 599 HA ASN 556 HA ASN 556 0.687 -24.796 9.181 600 HB2 ASN 556 HB2 ASN 556 0.423 -25.609 11.672 601 HB3 ASN 556 HB3 ASN 556 -1.281 -25.267 11.387 602 HD21 ASN 556 HD21 ASN 556 -0.762 -27.761 11.966 603 HD22 ASN 556 HD22 ASN 556 -0.810 -28.782 10.573 604 H MET 557 H MET 557 -0.112 -22.440 8.342 605 HA MET 557 HA MET 557 -3.030 -22.329 8.363 606 HB2 MET 557 HB2 MET 557 -2.762 -20.180 7.222 607 HB3 MET 557 HB3 MET 557 -1.807 -20.234 8.697 608 HG2 MET 557 HG2 MET 557 -0.246 -19.351 7.332 609 HG3 MET 557 HG3 MET 557 0.056 -21.053 6.990 610 HE1 MET 557 HE1 MET 557 0.787 -20.564 3.728 611 HE2 MET 557 HE2 MET 557 0.718 -21.594 5.158 612 HE3 MET 557 HE3 MET 557 -0.421 -21.844 3.834 613 H GLN 558 H GLN 558 -3.971 -21.642 6.118 614 HA GLN 558 HA GLN 558 -2.716 -23.054 3.903 615 HB2 GLN 558 HB2 GLN 558 -5.572 -23.693 4.606 616 HB3 GLN 558 HB3 GLN 558 -4.518 -24.519 3.466 617 HG2 GLN 558 HG2 GLN 558 -3.095 -25.150 5.468 618 HG3 GLN 558 HG3 GLN 558 -4.442 -24.599 6.463 619 HE21 GLN 558 HE21 GLN 558 -3.373 -27.242 6.337 620 HE22 GLN 558 HE22 GLN 558 -4.633 -28.280 5.772 621 H LEU 559 H LEU 559 -2.990 -21.983 2.051 622 HA LEU 559 HA LEU 559 -4.364 -19.515 1.978 623 HB2 LEU 559 HB2 LEU 559 -2.393 -20.009 0.609 624 HB3 LEU 559 HB3 LEU 559 -3.325 -21.198 -0.299 625 HG LEU 559 HG LEU 559 -2.908 -18.881 -1.344 626 HD11 LEU 559 HD11 LEU 559 -5.796 -19.660 -1.277 627 HD12 LEU 559 HD12 LEU 559 -4.590 -20.729 -1.992 628 HD13 LEU 559 HD13 LEU 559 -4.819 -19.103 -2.635 629 HD21 LEU 559 HD21 LEU 559 -3.552 -17.596 0.658 630 HD22 LEU 559 HD22 LEU 559 -5.202 -18.197 0.493 631 HD23 LEU 559 HD23 LEU 559 -4.510 -17.164 -0.758 632 H LEU 560 H LEU 560 -6.469 -19.182 1.794 633 HA LEU 560 HA LEU 560 -8.096 -21.188 0.375 634 HB2 LEU 560 HB2 LEU 560 -9.859 -20.824 1.838 635 HB3 LEU 560 HB3 LEU 560 -8.441 -20.805 2.884 636 HG LEU 560 HG LEU 560 -8.678 -18.171 2.385 637 HD11 LEU 560 HD11 LEU 560 -10.670 -17.524 1.658 638 HD12 LEU 560 HD12 LEU 560 -11.491 -18.504 2.872 639 HD13 LEU 560 HD13 LEU 560 -11.042 -19.216 1.323 640 HD21 LEU 560 HD21 LEU 560 -10.447 -19.306 4.494 641 HD22 LEU 560 HD22 LEU 560 -9.283 -17.984 4.586 642 HD23 LEU 560 HD23 LEU 560 -8.719 -19.655 4.555 643 H GLY 561 H GLY 561 -7.301 -17.815 0.720 644 HA2 GLY 561 HA2 GLY 561 -9.448 -16.849 -0.926 645 HA3 GLY 561 HA3 GLY 561 -8.046 -15.932 -0.395 646 H ASP 562 H ASP 562 -7.911 -15.005 -2.494 647 HA ASP 562 HA ASP 562 -6.141 -16.396 -4.228 648 HB2 ASP 562 HB2 ASP 562 -8.130 -17.530 -4.994 649 HB3 ASP 562 HB3 ASP 562 -8.987 -16.001 -5.168 650 H ALA 563 H ALA 563 -4.816 -14.863 -4.915 651 HA ALA 563 HA ALA 563 -5.154 -12.146 -4.582 652 HB1 ALA 563 HB1 ALA 563 -3.118 -13.739 -5.430 653 HB2 ALA 563 HB2 ALA 563 -3.510 -12.851 -6.903 654 HB3 ALA 563 HB3 ALA 563 -3.086 -11.975 -5.432 655 H GLN 564 H GLN 564 -6.887 -11.079 -5.340 656 HA GLN 564 HA GLN 564 -8.346 -11.615 -7.631 657 HB2 GLN 564 HB2 GLN 564 -8.614 -9.861 -5.602 658 HB3 GLN 564 HB3 GLN 564 -8.093 -8.762 -6.872 659 HG2 GLN 564 HG2 GLN 564 -10.375 -8.680 -7.081 660 HG3 GLN 564 HG3 GLN 564 -9.949 -9.907 -8.273 661 HE21 GLN 564 HE21 GLN 564 -12.251 -9.234 -6.236 662 HE22 GLN 564 HE22 GLN 564 -12.672 -10.801 -5.641 Start of MODEL 8 1 H MET 480 H MET 480 1.757 -0.834 1.041 2 HA MET 480 HA MET 480 1.442 0.091 -1.700 3 HB2 MET 480 HB2 MET 480 2.912 1.780 -0.846 4 HB3 MET 480 HB3 MET 480 3.924 0.580 -0.053 5 HG2 MET 480 HG2 MET 480 4.590 -0.291 -2.243 6 HG3 MET 480 HG3 MET 480 3.597 0.939 -3.023 7 HE1 MET 480 HE1 MET 480 6.489 -0.074 -3.116 8 HE2 MET 480 HE2 MET 480 7.356 1.387 -3.590 9 HE3 MET 480 HE3 MET 480 7.634 0.672 -2.001 10 H ALA 481 H ALA 481 1.375 -1.746 -2.809 11 HA ALA 481 HA ALA 481 3.248 -3.900 -2.071 12 HB1 ALA 481 HB1 ALA 481 1.223 -5.028 -3.628 13 HB2 ALA 481 HB2 ALA 481 1.460 -5.206 -1.889 14 HB3 ALA 481 HB3 ALA 481 0.403 -3.938 -2.509 15 H ASP 482 H ASP 482 3.263 -5.502 -4.161 16 HA ASP 482 HA ASP 482 4.448 -3.855 -6.261 17 HB2 ASP 482 HB2 ASP 482 5.358 -6.115 -5.072 18 HB3 ASP 482 HB3 ASP 482 4.560 -6.800 -6.486 19 H VAL 483 H VAL 483 1.977 -6.345 -5.822 20 HA VAL 483 HA VAL 483 0.853 -5.574 -8.431 21 HB VAL 483 HB VAL 483 1.883 -7.735 -8.749 22 HG11 VAL 483 HG11 VAL 483 1.385 -9.661 -7.422 23 HG12 VAL 483 HG12 VAL 483 1.875 -8.364 -6.331 24 HG13 VAL 483 HG13 VAL 483 0.169 -8.778 -6.501 25 HG21 VAL 483 HG21 VAL 483 0.040 -8.922 -9.631 26 HG22 VAL 483 HG22 VAL 483 -1.068 -8.235 -8.443 27 HG23 VAL 483 HG23 VAL 483 -0.400 -7.216 -9.718 28 H GLY 484 H GLY 484 0.271 -6.911 -5.214 29 HA2 GLY 484 HA2 GLY 484 -1.627 -5.809 -4.028 30 HA3 GLY 484 HA3 GLY 484 -2.559 -6.102 -5.488 31 H ASP 485 H ASP 485 -0.294 -8.451 -4.258 32 HA ASP 485 HA ASP 485 -2.034 -10.593 -4.322 33 HB2 ASP 485 HB2 ASP 485 0.598 -10.361 -3.854 34 HB3 ASP 485 HB3 ASP 485 0.048 -10.635 -2.203 35 H MET 486 H MET 486 -3.987 -10.490 -3.363 36 HA MET 486 HA MET 486 -4.029 -10.027 -0.454 37 HB2 MET 486 HB2 MET 486 -5.213 -8.380 -2.256 38 HB3 MET 486 HB3 MET 486 -6.524 -9.510 -1.947 39 HG2 MET 486 HG2 MET 486 -6.978 -8.553 -0.008 40 HG3 MET 486 HG3 MET 486 -5.305 -8.708 0.522 41 HE1 MET 486 HE1 MET 486 -5.434 -5.035 1.379 42 HE2 MET 486 HE2 MET 486 -6.225 -6.520 1.909 43 HE3 MET 486 HE3 MET 486 -4.487 -6.506 1.605 44 H GLN 487 H GLN 487 -4.589 -11.782 0.639 45 HA GLN 487 HA GLN 487 -6.721 -13.497 -0.334 46 HB2 GLN 487 HB2 GLN 487 -4.050 -14.702 0.385 47 HB3 GLN 487 HB3 GLN 487 -5.465 -15.535 -0.246 48 HG2 GLN 487 HG2 GLN 487 -5.221 -14.390 -2.369 49 HG3 GLN 487 HG3 GLN 487 -3.844 -13.486 -1.741 50 HE21 GLN 487 HE21 GLN 487 -4.190 -15.462 -3.975 51 HE22 GLN 487 HE22 GLN 487 -2.949 -16.635 -3.711 52 H LEU 488 H LEU 488 -7.044 -15.357 1.346 53 HA LEU 488 HA LEU 488 -6.785 -14.165 4.028 54 HB2 LEU 488 HB2 LEU 488 -9.097 -14.354 3.031 55 HB3 LEU 488 HB3 LEU 488 -8.907 -16.103 3.135 56 HG LEU 488 HG LEU 488 -8.612 -15.834 5.611 57 HD11 LEU 488 HD11 LEU 488 -8.296 -13.803 6.439 58 HD12 LEU 488 HD12 LEU 488 -9.948 -13.391 5.980 59 HD13 LEU 488 HD13 LEU 488 -8.617 -13.069 4.868 60 HD21 LEU 488 HD21 LEU 488 -11.056 -15.319 6.000 61 HD22 LEU 488 HD22 LEU 488 -10.711 -16.605 4.843 62 HD23 LEU 488 HD23 LEU 488 -11.173 -15.003 4.269 63 H TYR 489 H TYR 489 -5.210 -15.172 5.093 64 HA TYR 489 HA TYR 489 -4.930 -18.083 4.780 65 HB2 TYR 489 HB2 TYR 489 -2.831 -16.506 6.171 66 HB3 TYR 489 HB3 TYR 489 -2.670 -17.881 5.085 67 HD1 TYR 489 HD1 TYR 489 -3.072 -14.232 5.274 68 HD2 TYR 489 HD2 TYR 489 -2.458 -17.570 2.709 69 HE1 TYR 489 HE1 TYR 489 -2.469 -12.706 3.442 70 HE2 TYR 489 HE2 TYR 489 -1.852 -16.054 0.870 71 HH TYR 489 HH TYR 489 -2.547 -13.301 0.450 72 H ARG 490 H ARG 490 -5.809 -19.247 6.346 73 HA ARG 490 HA ARG 490 -6.117 -18.067 9.012 74 HB2 ARG 490 HB2 ARG 490 -7.748 -19.843 9.419 75 HB3 ARG 490 HB3 ARG 490 -8.150 -18.945 7.962 76 HG2 ARG 490 HG2 ARG 490 -8.323 -20.900 6.933 77 HG3 ARG 490 HG3 ARG 490 -6.568 -21.032 7.058 78 HD2 ARG 490 HD2 ARG 490 -7.172 -21.915 9.477 79 HD3 ARG 490 HD3 ARG 490 -8.698 -22.313 8.690 80 HE ARG 490 HE ARG 490 -6.423 -23.223 7.213 81 HH11 ARG 490 HH11 ARG 490 -8.554 -23.962 9.865 82 HH12 ARG 490 HH12 ARG 490 -8.286 -25.672 9.773 83 HH21 ARG 490 HH21 ARG 490 -6.063 -25.471 7.082 84 HH22 ARG 490 HH22 ARG 490 -6.869 -26.529 8.191 85 H ILE 491 H ILE 491 -5.000 -18.780 10.719 86 HA ILE 491 HA ILE 491 -3.172 -21.037 10.308 87 HB ILE 491 HB ILE 491 -1.877 -20.186 12.156 88 HG12 ILE 491 HG12 ILE 491 -4.018 -18.065 12.435 89 HG13 ILE 491 HG13 ILE 491 -3.754 -19.402 13.549 90 HG21 ILE 491 HG21 ILE 491 -2.005 -17.592 11.086 91 HG22 ILE 491 HG22 ILE 491 -0.904 -18.894 10.638 92 HG23 ILE 491 HG23 ILE 491 -2.429 -18.694 9.776 93 HD11 ILE 491 HD11 ILE 491 -1.459 -18.489 13.948 94 HD12 ILE 491 HD12 ILE 491 -1.939 -17.070 13.015 95 HD13 ILE 491 HD13 ILE 491 -2.785 -17.471 14.510 96 H GLU 492 H GLU 492 -2.684 -22.316 12.356 97 HA GLU 492 HA GLU 492 -5.240 -23.154 13.509 98 HB2 GLU 492 HB2 GLU 492 -3.729 -24.813 12.369 99 HB3 GLU 492 HB3 GLU 492 -2.575 -24.563 13.671 100 HG2 GLU 492 HG2 GLU 492 -3.805 -25.723 15.179 101 HG3 GLU 492 HG3 GLU 492 -5.341 -25.277 14.438 102 H VAL 493 H VAL 493 -4.522 -20.830 14.605 103 HA VAL 493 HA VAL 493 -3.827 -21.604 17.335 104 HB VAL 493 HB VAL 493 -2.572 -19.160 16.103 105 HG11 VAL 493 HG11 VAL 493 -1.293 -19.031 18.063 106 HG12 VAL 493 HG12 VAL 493 -2.919 -19.428 18.621 107 HG13 VAL 493 HG13 VAL 493 -1.685 -20.685 18.532 108 HG21 VAL 493 HG21 VAL 493 -1.715 -21.095 14.908 109 HG22 VAL 493 HG22 VAL 493 -0.474 -20.433 15.972 110 HG23 VAL 493 HG23 VAL 493 -1.344 -21.896 16.435 111 H GLY 494 H GLY 494 -5.066 -20.623 18.826 112 HA2 GLY 494 HA2 GLY 494 -6.427 -18.121 18.125 113 HA3 GLY 494 HA3 GLY 494 -7.412 -19.502 18.585 114 H ARG 495 H ARG 495 -8.111 -17.871 20.237 115 HA ARG 495 HA ARG 495 -6.479 -16.916 22.270 116 HB2 ARG 495 HB2 ARG 495 -8.608 -16.940 23.657 117 HB3 ARG 495 HB3 ARG 495 -8.677 -16.058 22.137 118 HG2 ARG 495 HG2 ARG 495 -9.919 -17.786 21.090 119 HG3 ARG 495 HG3 ARG 495 -9.640 -18.888 22.440 120 HD2 ARG 495 HD2 ARG 495 -11.734 -18.196 22.988 121 HD3 ARG 495 HD3 ARG 495 -10.814 -16.918 23.781 122 HE ARG 495 HE ARG 495 -11.245 -15.910 21.315 123 HH11 ARG 495 HH11 ARG 495 -13.346 -17.314 23.710 124 HH12 ARG 495 HH12 ARG 495 -14.723 -16.373 23.243 125 HH21 ARG 495 HH21 ARG 495 -13.052 -14.665 20.690 126 HH22 ARG 495 HH22 ARG 495 -14.555 -14.867 21.524 127 H ASP 496 H ASP 496 -8.034 -20.052 21.905 128 HA ASP 496 HA ASP 496 -7.413 -20.998 24.515 129 HB2 ASP 496 HB2 ASP 496 -9.112 -21.875 22.673 130 HB3 ASP 496 HB3 ASP 496 -7.745 -22.898 22.238 131 H ASP 497 H ASP 497 -5.563 -20.557 21.694 132 HA ASP 497 HA ASP 497 -3.559 -22.534 22.479 133 HB2 ASP 497 HB2 ASP 497 -4.334 -22.161 20.058 134 HB3 ASP 497 HB3 ASP 497 -3.381 -20.681 20.111 135 H GLY 498 H GLY 498 -3.960 -19.043 22.091 136 HA2 GLY 498 HA2 GLY 498 -2.736 -17.857 23.997 137 HA3 GLY 498 HA3 GLY 498 -1.316 -18.655 23.337 138 H VAL 499 H VAL 499 -3.942 -17.294 21.432 139 HA VAL 499 HA VAL 499 -2.205 -15.064 20.639 140 HB VAL 499 HB VAL 499 -2.127 -17.041 18.998 141 HG11 VAL 499 HG11 VAL 499 -4.831 -16.951 19.185 142 HG12 VAL 499 HG12 VAL 499 -4.561 -16.023 17.708 143 HG13 VAL 499 HG13 VAL 499 -3.948 -17.672 17.840 144 HG21 VAL 499 HG21 VAL 499 -1.725 -15.597 17.235 145 HG22 VAL 499 HG22 VAL 499 -3.050 -14.520 17.678 146 HG23 VAL 499 HG23 VAL 499 -1.567 -14.531 18.631 147 H GLU 500 H GLU 500 -3.288 -13.222 19.865 148 HA GLU 500 HA GLU 500 -6.211 -13.238 20.218 149 HB2 GLU 500 HB2 GLU 500 -4.504 -10.876 20.963 150 HB3 GLU 500 HB3 GLU 500 -6.172 -11.205 21.409 151 HG2 GLU 500 HG2 GLU 500 -3.713 -12.609 22.421 152 HG3 GLU 500 HG3 GLU 500 -4.773 -11.527 23.322 153 H VAL 501 H VAL 501 -6.888 -10.767 19.466 154 HA VAL 501 HA VAL 501 -6.469 -10.831 16.629 155 HB VAL 501 HB VAL 501 -7.944 -8.827 18.342 156 HG11 VAL 501 HG11 VAL 501 -7.925 -9.181 15.347 157 HG12 VAL 501 HG12 VAL 501 -8.993 -8.100 16.243 158 HG13 VAL 501 HG13 VAL 501 -7.251 -7.820 16.243 159 HG21 VAL 501 HG21 VAL 501 -8.710 -11.294 18.180 160 HG22 VAL 501 HG22 VAL 501 -9.895 -10.013 17.925 161 HG23 VAL 501 HG23 VAL 501 -9.203 -10.861 16.543 162 H ARG 502 H ARG 502 -5.289 -8.915 19.311 163 HA ARG 502 HA ARG 502 -3.988 -7.005 17.551 164 HB2 ARG 502 HB2 ARG 502 -3.194 -5.979 19.676 165 HB3 ARG 502 HB3 ARG 502 -4.944 -6.121 19.577 166 HG2 ARG 502 HG2 ARG 502 -5.009 -7.862 21.134 167 HG3 ARG 502 HG3 ARG 502 -3.283 -8.190 20.968 168 HD2 ARG 502 HD2 ARG 502 -4.071 -5.486 21.890 169 HD3 ARG 502 HD3 ARG 502 -4.302 -6.821 23.018 170 HE ARG 502 HE ARG 502 -1.805 -5.678 22.173 171 HH11 ARG 502 HH11 ARG 502 -3.369 -8.518 23.442 172 HH12 ARG 502 HH12 ARG 502 -1.928 -9.145 24.170 173 HH21 ARG 502 HH21 ARG 502 0.099 -6.494 23.127 174 HH22 ARG 502 HH22 ARG 502 0.044 -7.993 23.992 175 H HIS 503 H HIS 503 -3.324 -10.063 18.518 176 HA HIS 503 HA HIS 503 -0.498 -9.742 19.053 177 HB2 HIS 503 HB2 HIS 503 -2.217 -11.602 19.886 178 HB3 HIS 503 HB3 HIS 503 -1.665 -12.409 18.422 179 HD1 HIS 503 HD1 HIS 503 -1.039 -13.601 21.176 180 HD2 HIS 503 HD2 HIS 503 1.507 -11.041 19.121 181 HE1 HIS 503 HE1 HIS 503 1.258 -14.058 22.092 182 H ILE 504 H ILE 504 -2.397 -11.428 16.545 183 HA ILE 504 HA ILE 504 -0.154 -11.819 14.841 184 HB ILE 504 HB ILE 504 -1.637 -12.739 13.269 185 HG12 ILE 504 HG12 ILE 504 -3.165 -10.735 13.247 186 HG13 ILE 504 HG13 ILE 504 -3.985 -12.288 13.127 187 HG21 ILE 504 HG21 ILE 504 -1.484 -14.055 15.305 188 HG22 ILE 504 HG22 ILE 504 -2.849 -13.178 15.995 189 HG23 ILE 504 HG23 ILE 504 -3.087 -14.216 14.589 190 HD11 ILE 504 HD11 ILE 504 -4.479 -12.163 15.542 191 HD12 ILE 504 HD12 ILE 504 -3.757 -10.554 15.572 192 HD13 ILE 504 HD13 ILE 504 -5.203 -10.854 14.608 193 H VAL 505 H VAL 505 -2.420 -9.239 15.291 194 HA VAL 505 HA VAL 505 -1.916 -7.978 12.752 195 HB VAL 505 HB VAL 505 -3.316 -7.009 15.243 196 HG11 VAL 505 HG11 VAL 505 -2.970 -4.939 14.482 197 HG12 VAL 505 HG12 VAL 505 -2.351 -5.521 12.936 198 HG13 VAL 505 HG13 VAL 505 -4.089 -5.351 13.183 199 HG21 VAL 505 HG21 VAL 505 -5.281 -7.604 14.251 200 HG22 VAL 505 HG22 VAL 505 -4.657 -7.372 12.617 201 HG23 VAL 505 HG23 VAL 505 -4.224 -8.818 13.530 202 H GLY 506 H GLY 506 -1.204 -7.052 16.130 203 HA2 GLY 506 HA2 GLY 506 0.487 -4.902 15.485 204 HA3 GLY 506 HA3 GLY 506 0.471 -5.759 17.019 205 H ALA 507 H ALA 507 1.055 -8.297 15.416 206 HA ALA 507 HA ALA 507 3.899 -8.174 15.725 207 HB1 ALA 507 HB1 ALA 507 2.078 -10.338 14.688 208 HB2 ALA 507 HB2 ALA 507 3.820 -10.528 14.894 209 HB3 ALA 507 HB3 ALA 507 2.795 -10.214 16.295 210 H ILE 508 H ILE 508 1.857 -8.965 12.904 211 HA ILE 508 HA ILE 508 3.982 -8.750 11.043 212 HB ILE 508 HB ILE 508 2.269 -8.837 9.310 213 HG12 ILE 508 HG12 ILE 508 -0.158 -9.169 10.417 214 HG13 ILE 508 HG13 ILE 508 0.525 -8.036 11.578 215 HG21 ILE 508 HG21 ILE 508 2.802 -10.779 11.199 216 HG22 ILE 508 HG22 ILE 508 1.042 -10.775 11.089 217 HG23 ILE 508 HG23 ILE 508 2.015 -11.027 9.640 218 HD11 ILE 508 HD11 ILE 508 0.023 -6.378 10.212 219 HD12 ILE 508 HD12 ILE 508 1.119 -7.051 9.004 220 HD13 ILE 508 HD13 ILE 508 -0.580 -7.522 9.013 221 H ALA 509 H ALA 509 1.703 -6.462 12.362 222 HA ALA 509 HA ALA 509 2.139 -4.425 10.405 223 HB1 ALA 509 HB1 ALA 509 1.070 -4.108 13.205 224 HB2 ALA 509 HB2 ALA 509 0.864 -2.994 11.853 225 HB3 ALA 509 HB3 ALA 509 0.098 -4.582 11.811 226 H ASN 510 H ASN 510 3.762 -5.441 13.290 227 HA ASN 510 HA ASN 510 5.293 -2.967 13.477 228 HB2 ASN 510 HB2 ASN 510 4.489 -4.073 15.545 229 HB3 ASN 510 HB3 ASN 510 5.471 -5.481 15.153 230 HD21 ASN 510 HD21 ASN 510 6.459 -5.110 17.224 231 HD22 ASN 510 HD22 ASN 510 7.722 -3.941 17.373 232 H GLU 511 H GLU 511 5.575 -6.196 12.262 233 HA GLU 511 HA GLU 511 8.406 -6.343 12.161 234 HB2 GLU 511 HB2 GLU 511 6.166 -7.825 10.834 235 HB3 GLU 511 HB3 GLU 511 7.815 -8.063 10.273 236 HG2 GLU 511 HG2 GLU 511 6.780 -8.550 13.056 237 HG3 GLU 511 HG3 GLU 511 7.225 -9.771 11.865 238 H GLY 512 H GLY 512 5.957 -5.469 9.732 239 HA2 GLY 512 HA2 GLY 512 8.134 -4.299 8.112 240 HA3 GLY 512 HA3 GLY 512 6.661 -4.974 7.431 241 H ASP 513 H ASP 513 6.039 -3.119 6.362 242 HA ASP 513 HA ASP 513 5.702 -0.660 7.888 243 HB2 ASP 513 HB2 ASP 513 5.723 -1.386 5.004 244 HB3 ASP 513 HB3 ASP 513 4.749 0.004 5.476 245 H ILE 514 H ILE 514 3.899 -3.389 7.045 246 HA ILE 514 HA ILE 514 1.347 -2.466 6.559 247 HB ILE 514 HB ILE 514 2.114 -4.845 8.255 248 HG12 ILE 514 HG12 ILE 514 1.278 -4.938 5.373 249 HG13 ILE 514 HG13 ILE 514 2.951 -4.593 5.797 250 HG21 ILE 514 HG21 ILE 514 -0.165 -5.651 7.320 251 HG22 ILE 514 HG22 ILE 514 -0.137 -4.557 8.702 252 HG23 ILE 514 HG23 ILE 514 -0.483 -3.932 7.090 253 HD11 ILE 514 HD11 ILE 514 1.494 -7.019 6.793 254 HD12 ILE 514 HD12 ILE 514 2.401 -6.991 5.281 255 HD13 ILE 514 HD13 ILE 514 3.228 -6.700 6.811 256 H SER 515 H SER 515 -0.382 -1.814 7.794 257 HA SER 515 HA SER 515 0.246 -1.088 10.581 258 HB2 SER 515 HB2 SER 515 -0.281 0.696 8.681 259 HB3 SER 515 HB3 SER 515 -1.947 0.287 9.093 260 HG SER 515 HG SER 515 -0.414 1.964 10.348 261 H SER 516 H SER 516 -1.791 -0.827 11.946 262 HA SER 516 HA SER 516 -3.126 -3.321 12.041 263 HB2 SER 516 HB2 SER 516 -2.613 -1.658 13.963 264 HB3 SER 516 HB3 SER 516 -4.110 -0.864 13.473 265 HG SER 516 HG SER 516 -4.893 -3.236 13.617 266 H ARG 517 H ARG 517 -3.822 -0.338 10.466 267 HA ARG 517 HA ARG 517 -6.623 -1.051 10.042 268 HB2 ARG 517 HB2 ARG 517 -6.727 1.179 8.895 269 HB3 ARG 517 HB3 ARG 517 -6.283 1.249 10.595 270 HG2 ARG 517 HG2 ARG 517 -3.981 1.608 10.045 271 HG3 ARG 517 HG3 ARG 517 -4.303 1.335 8.332 272 HD2 ARG 517 HD2 ARG 517 -5.218 3.392 8.035 273 HD3 ARG 517 HD3 ARG 517 -5.881 3.451 9.668 274 HE ARG 517 HE ARG 517 -3.234 3.652 10.107 275 HH11 ARG 517 HH11 ARG 517 -5.397 5.336 7.961 276 HH12 ARG 517 HH12 ARG 517 -4.487 6.810 7.989 277 HH21 ARG 517 HH21 ARG 517 -2.028 5.587 10.153 278 HH22 ARG 517 HH22 ARG 517 -2.570 6.951 9.236 279 H TYR 518 H TYR 518 -3.585 -0.748 8.316 280 HA TYR 518 HA TYR 518 -4.516 -0.895 5.691 281 HB2 TYR 518 HB2 TYR 518 -2.027 -0.860 6.948 282 HB3 TYR 518 HB3 TYR 518 -2.048 -2.383 6.066 283 HD1 TYR 518 HD1 TYR 518 -0.861 -2.187 4.101 284 HD2 TYR 518 HD2 TYR 518 -3.361 1.038 5.308 285 HE1 TYR 518 HE1 TYR 518 -0.317 -0.994 2.020 286 HE2 TYR 518 HE2 TYR 518 -2.825 2.239 3.230 287 HH TYR 518 HH TYR 518 -1.904 2.035 1.170 288 H ILE 519 H ILE 519 -3.817 -3.450 8.024 289 HA ILE 519 HA ILE 519 -3.985 -5.677 6.388 290 HB ILE 519 HB ILE 519 -4.970 -5.423 9.232 291 HG12 ILE 519 HG12 ILE 519 -2.399 -6.741 8.610 292 HG13 ILE 519 HG13 ILE 519 -2.437 -5.000 8.353 293 HG21 ILE 519 HG21 ILE 519 -5.865 -7.408 8.155 294 HG22 ILE 519 HG22 ILE 519 -4.249 -7.870 7.626 295 HG23 ILE 519 HG23 ILE 519 -4.641 -7.852 9.345 296 HD11 ILE 519 HD11 ILE 519 -2.812 -6.536 10.889 297 HD12 ILE 519 HD12 ILE 519 -1.687 -5.225 10.532 298 HD13 ILE 519 HD13 ILE 519 -3.407 -4.884 10.726 299 H GLY 520 H GLY 520 -5.636 -7.001 5.676 300 HA2 GLY 520 HA2 GLY 520 -8.137 -5.717 5.153 301 HA3 GLY 520 HA3 GLY 520 -7.701 -7.363 4.717 302 H ASN 521 H ASN 521 -8.998 -8.823 5.582 303 HA ASN 521 HA ASN 521 -10.456 -8.182 8.028 304 HB2 ASN 521 HB2 ASN 521 -10.759 -10.395 5.993 305 HB3 ASN 521 HB3 ASN 521 -11.712 -10.306 7.471 306 HD21 ASN 521 HD21 ASN 521 -10.796 -8.351 4.663 307 HD22 ASN 521 HD22 ASN 521 -12.328 -7.570 4.491 308 H ILE 522 H ILE 522 -9.987 -9.032 9.952 309 HA ILE 522 HA ILE 522 -8.150 -11.335 10.046 310 HB ILE 522 HB ILE 522 -8.260 -9.127 12.098 311 HG12 ILE 522 HG12 ILE 522 -5.792 -9.022 10.810 312 HG13 ILE 522 HG13 ILE 522 -6.952 -9.224 9.502 313 HG21 ILE 522 HG21 ILE 522 -6.565 -10.191 13.197 314 HG22 ILE 522 HG22 ILE 522 -7.398 -11.587 12.516 315 HG23 ILE 522 HG23 ILE 522 -5.948 -10.957 11.734 316 HD11 ILE 522 HD11 ILE 522 -7.218 -7.025 9.593 317 HD12 ILE 522 HD12 ILE 522 -8.103 -7.293 11.095 318 HD13 ILE 522 HD13 ILE 522 -6.382 -6.909 11.141 319 H LYS 523 H LYS 523 -8.772 -13.032 11.236 320 HA LYS 523 HA LYS 523 -11.144 -12.706 12.955 321 HB2 LYS 523 HB2 LYS 523 -11.278 -14.137 10.796 322 HB3 LYS 523 HB3 LYS 523 -10.341 -15.317 11.704 323 HG2 LYS 523 HG2 LYS 523 -12.170 -15.088 13.493 324 HG3 LYS 523 HG3 LYS 523 -13.120 -14.328 12.214 325 HD2 LYS 523 HD2 LYS 523 -12.258 -16.510 10.904 326 HD3 LYS 523 HD3 LYS 523 -12.290 -17.146 12.551 327 HE2 LYS 523 HE2 LYS 523 -14.567 -15.915 11.009 328 HE3 LYS 523 HE3 LYS 523 -14.413 -17.588 11.541 329 HZ1 LYS 523 HZ1 LYS 523 -15.540 -16.971 13.334 330 HZ2 LYS 523 HZ2 LYS 523 -15.405 -15.327 12.964 331 HZ3 LYS 523 HZ3 LYS 523 -14.175 -16.103 13.828 332 H LEU 524 H LEU 524 -11.255 -14.005 14.863 333 HA LEU 524 HA LEU 524 -8.766 -15.261 15.740 334 HB2 LEU 524 HB2 LEU 524 -8.849 -12.824 16.441 335 HB3 LEU 524 HB3 LEU 524 -10.201 -13.271 17.480 336 HG LEU 524 HG LEU 524 -7.971 -13.095 18.619 337 HD11 LEU 524 HD11 LEU 524 -9.056 -15.882 18.810 338 HD12 LEU 524 HD12 LEU 524 -9.990 -14.491 19.359 339 HD13 LEU 524 HD13 LEU 524 -8.424 -14.846 20.089 340 HD21 LEU 524 HD21 LEU 524 -7.343 -15.739 17.351 341 HD22 LEU 524 HD22 LEU 524 -6.283 -14.666 18.265 342 HD23 LEU 524 HD23 LEU 524 -6.796 -14.223 16.636 343 H PHE 525 H PHE 525 -9.772 -17.255 15.717 344 HA PHE 525 HA PHE 525 -12.194 -17.621 17.302 345 HB2 PHE 525 HB2 PHE 525 -11.235 -18.809 14.965 346 HB3 PHE 525 HB3 PHE 525 -11.056 -20.053 16.198 347 HD1 PHE 525 HD1 PHE 525 -12.781 -21.553 16.194 348 HD2 PHE 525 HD2 PHE 525 -13.622 -17.453 15.418 349 HE1 PHE 525 HE1 PHE 525 -15.176 -22.083 16.007 350 HE2 PHE 525 HE2 PHE 525 -16.019 -17.977 15.231 351 HZ PHE 525 HZ PHE 525 -16.798 -20.294 15.524 352 H ALA 526 H ALA 526 -11.877 -20.208 18.184 353 HA ALA 526 HA ALA 526 -10.429 -19.826 20.587 354 HB1 ALA 526 HB1 ALA 526 -12.443 -21.263 20.356 355 HB2 ALA 526 HB2 ALA 526 -11.458 -22.430 19.473 356 HB3 ALA 526 HB3 ALA 526 -11.089 -22.061 21.157 357 H SER 527 H SER 527 -9.806 -21.799 17.700 358 HA SER 527 HA SER 527 -6.968 -21.861 18.450 359 HB2 SER 527 HB2 SER 527 -7.983 -24.027 19.094 360 HB3 SER 527 HB3 SER 527 -8.518 -24.255 17.429 361 HG SER 527 HG SER 527 -5.824 -23.990 18.290 362 H HIS 528 H HIS 528 -8.395 -20.208 16.568 363 HA HIS 528 HA HIS 528 -6.762 -20.724 14.243 364 HB2 HIS 528 HB2 HIS 528 -9.757 -20.952 14.173 365 HB3 HIS 528 HB3 HIS 528 -8.869 -20.415 12.750 366 HD1 HIS 528 HD1 HIS 528 -9.592 -23.425 14.811 367 HD2 HIS 528 HD2 HIS 528 -7.284 -22.397 11.514 368 HE1 HIS 528 HE1 HIS 528 -8.862 -25.607 13.795 369 H SER 529 H SER 529 -6.884 -18.932 12.664 370 HA SER 529 HA SER 529 -8.205 -16.501 13.341 371 HB2 SER 529 HB2 SER 529 -5.804 -15.350 13.576 372 HB3 SER 529 HB3 SER 529 -6.693 -15.952 14.975 373 HG SER 529 HG SER 529 -5.484 -17.909 14.764 374 H THR 530 H THR 530 -8.373 -15.251 11.577 375 HA THR 530 HA THR 530 -6.736 -15.982 9.244 376 HB THR 530 HB THR 530 -8.494 -15.243 7.826 377 HG1 THR 530 HG1 THR 530 -10.269 -14.101 8.597 378 HG21 THR 530 HG21 THR 530 -8.803 -17.361 9.472 379 HG22 THR 530 HG22 THR 530 -9.952 -16.932 8.204 380 HG23 THR 530 HG23 THR 530 -10.252 -16.440 9.871 381 H ILE 531 H ILE 531 -6.341 -14.171 7.679 382 HA ILE 531 HA ILE 531 -6.429 -11.471 8.489 383 HB ILE 531 HB ILE 531 -4.745 -12.065 10.112 384 HG12 ILE 531 HG12 ILE 531 -3.178 -10.770 7.900 385 HG13 ILE 531 HG13 ILE 531 -4.570 -9.950 8.599 386 HG21 ILE 531 HG21 ILE 531 -2.631 -13.075 9.515 387 HG22 ILE 531 HG22 ILE 531 -3.955 -14.114 8.992 388 HG23 ILE 531 HG23 ILE 531 -3.099 -13.118 7.815 389 HD11 ILE 531 HD11 ILE 531 -3.163 -10.707 10.816 390 HD12 ILE 531 HD12 ILE 531 -1.887 -10.324 9.659 391 HD13 ILE 531 HD13 ILE 531 -3.110 -9.117 10.055 392 H GLU 532 H GLU 532 -5.954 -10.122 6.813 393 HA GLU 532 HA GLU 532 -4.825 -11.373 4.394 394 HB2 GLU 532 HB2 GLU 532 -7.255 -10.895 4.220 395 HB3 GLU 532 HB3 GLU 532 -6.918 -9.195 4.513 396 HG2 GLU 532 HG2 GLU 532 -6.046 -8.861 2.437 397 HG3 GLU 532 HG3 GLU 532 -5.495 -10.528 2.278 398 H LEU 533 H LEU 533 -3.058 -10.453 3.586 399 HA LEU 533 HA LEU 533 -2.327 -7.768 4.550 400 HB2 LEU 533 HB2 LEU 533 -0.848 -10.251 4.249 401 HB3 LEU 533 HB3 LEU 533 -0.048 -8.893 3.460 402 HG LEU 533 HG LEU 533 0.075 -7.689 5.539 403 HD11 LEU 533 HD11 LEU 533 -1.907 -9.680 6.381 404 HD12 LEU 533 HD12 LEU 533 -1.654 -8.023 6.927 405 HD13 LEU 533 HD13 LEU 533 -0.658 -9.326 7.575 406 HD21 LEU 533 HD21 LEU 533 1.608 -9.078 6.736 407 HD22 LEU 533 HD22 LEU 533 1.790 -9.424 5.016 408 HD23 LEU 533 HD23 LEU 533 0.900 -10.541 6.052 409 HA PRO 534 HA PRO 534 -2.779 -6.336 0.394 410 HB2 PRO 534 HB2 PRO 534 -1.469 -3.976 0.683 411 HB3 PRO 534 HB3 PRO 534 -3.095 -4.256 1.317 412 HG2 PRO 534 HG2 PRO 534 -0.464 -4.345 2.742 413 HG3 PRO 534 HG3 PRO 534 -2.000 -3.632 3.271 414 HD2 PRO 534 HD2 PRO 534 -1.140 -6.049 4.139 415 HD3 PRO 534 HD3 PRO 534 -2.861 -5.666 3.931 416 H LYS 535 H LYS 535 0.104 -7.278 1.851 417 HA LYS 535 HA LYS 535 2.166 -6.405 0.303 418 HB2 LYS 535 HB2 LYS 535 1.708 -9.249 1.225 419 HB3 LYS 535 HB3 LYS 535 3.252 -8.591 0.699 420 HG2 LYS 535 HG2 LYS 535 1.670 -7.626 3.073 421 HG3 LYS 535 HG3 LYS 535 3.064 -8.706 3.139 422 HD2 LYS 535 HD2 LYS 535 3.092 -5.903 2.021 423 HD3 LYS 535 HD3 LYS 535 3.646 -6.356 3.635 424 HE2 LYS 535 HE2 LYS 535 5.277 -7.906 2.558 425 HE3 LYS 535 HE3 LYS 535 4.790 -7.254 0.994 426 HZ1 LYS 535 HZ1 LYS 535 6.071 -5.482 1.290 427 HZ2 LYS 535 HZ2 LYS 535 6.750 -6.267 2.626 428 HZ3 LYS 535 HZ3 LYS 535 5.464 -5.189 2.842 429 H GLY 536 H GLY 536 3.099 -6.934 -1.665 430 HA2 GLY 536 HA2 GLY 536 1.446 -8.608 -3.452 431 HA3 GLY 536 HA3 GLY 536 2.108 -7.067 -3.975 432 H MET 537 H MET 537 3.643 -9.640 -2.077 433 HA MET 537 HA MET 537 5.127 -10.772 -4.173 434 HB2 MET 537 HB2 MET 537 6.072 -8.322 -3.863 435 HB3 MET 537 HB3 MET 537 6.940 -9.064 -2.526 436 HG2 MET 537 HG2 MET 537 8.217 -10.380 -3.898 437 HG3 MET 537 HG3 MET 537 7.025 -10.369 -5.196 438 HE1 MET 537 HE1 MET 537 10.724 -8.024 -4.839 439 HE2 MET 537 HE2 MET 537 10.142 -9.438 -3.959 440 HE3 MET 537 HE3 MET 537 10.479 -9.551 -5.687 441 HA PRO 538 HA PRO 538 5.117 -12.837 0.018 442 HB2 PRO 538 HB2 PRO 538 3.904 -15.116 -0.822 443 HB3 PRO 538 HB3 PRO 538 3.006 -13.695 -0.274 444 HG2 PRO 538 HG2 PRO 538 3.615 -14.591 -3.065 445 HG3 PRO 538 HG3 PRO 538 2.100 -13.953 -2.401 446 HD2 PRO 538 HD2 PRO 538 3.811 -12.432 -3.846 447 HD3 PRO 538 HD3 PRO 538 2.815 -11.766 -2.536 448 H GLY 539 H GLY 539 5.874 -15.216 0.408 449 HA2 GLY 539 HA2 GLY 539 7.308 -16.993 -0.133 450 HA3 GLY 539 HA3 GLY 539 7.713 -16.179 -1.637 451 H GLU 540 H GLU 540 7.857 -14.037 0.940 452 HA GLU 540 HA GLU 540 10.733 -13.925 0.776 453 HB2 GLU 540 HB2 GLU 540 9.016 -12.330 2.665 454 HB3 GLU 540 HB3 GLU 540 10.585 -11.905 1.995 455 HG2 GLU 540 HG2 GLU 540 9.389 -11.934 -0.278 456 HG3 GLU 540 HG3 GLU 540 7.904 -11.870 0.669 457 H VAL 541 H VAL 541 8.435 -14.260 3.487 458 HA VAL 541 HA VAL 541 10.530 -15.219 5.232 459 HB VAL 541 HB VAL 541 7.558 -15.074 5.755 460 HG11 VAL 541 HG11 VAL 541 8.767 -16.574 7.262 461 HG12 VAL 541 HG12 VAL 541 9.896 -15.275 7.652 462 HG13 VAL 541 HG13 VAL 541 8.198 -15.136 8.108 463 HG21 VAL 541 HG21 VAL 541 8.259 -12.867 5.263 464 HG22 VAL 541 HG22 VAL 541 8.201 -12.984 7.022 465 HG23 VAL 541 HG23 VAL 541 9.751 -13.058 6.184 466 H LEU 542 H LEU 542 7.886 -16.552 3.369 467 HA LEU 542 HA LEU 542 7.800 -19.101 4.584 468 HB2 LEU 542 HB2 LEU 542 7.117 -18.392 1.736 469 HB3 LEU 542 HB3 LEU 542 6.567 -19.807 2.632 470 HG LEU 542 HG LEU 542 5.777 -16.935 3.101 471 HD11 LEU 542 HD11 LEU 542 4.476 -17.641 1.344 472 HD12 LEU 542 HD12 LEU 542 3.483 -18.121 2.719 473 HD13 LEU 542 HD13 LEU 542 4.467 -19.320 1.881 474 HD21 LEU 542 HD21 LEU 542 4.165 -18.638 4.618 475 HD22 LEU 542 HD22 LEU 542 5.368 -17.492 5.212 476 HD23 LEU 542 HD23 LEU 542 5.820 -19.171 4.914 477 H GLN 543 H GLN 543 9.994 -17.651 2.368 478 HA GLN 543 HA GLN 543 11.033 -20.144 1.348 479 HB2 GLN 543 HB2 GLN 543 11.572 -17.258 0.918 480 HB3 GLN 543 HB3 GLN 543 12.909 -18.363 0.627 481 HG2 GLN 543 HG2 GLN 543 10.243 -18.919 -0.586 482 HG3 GLN 543 HG3 GLN 543 11.304 -17.709 -1.307 483 HE21 GLN 543 HE21 GLN 543 11.986 -18.679 -3.108 484 HE22 GLN 543 HE22 GLN 543 12.799 -20.202 -3.170 485 H HIS 544 H HIS 544 12.444 -17.492 3.278 486 HA HIS 544 HA HIS 544 14.697 -19.038 4.076 487 HB2 HIS 544 HB2 HIS 544 13.559 -16.396 4.955 488 HB3 HIS 544 HB3 HIS 544 14.927 -17.120 5.795 489 HD1 HIS 544 HD1 HIS 544 17.190 -17.140 4.577 490 HD2 HIS 544 HD2 HIS 544 14.111 -15.428 2.374 491 HE1 HIS 544 HE1 HIS 544 18.309 -15.983 2.644 492 H PHE 545 H PHE 545 11.875 -17.845 5.905 493 HA PHE 545 HA PHE 545 12.475 -19.712 8.057 494 HB2 PHE 545 HB2 PHE 545 10.656 -17.360 7.739 495 HB3 PHE 545 HB3 PHE 545 10.294 -18.552 8.983 496 HD1 PHE 545 HD1 PHE 545 10.816 -17.605 11.016 497 HD2 PHE 545 HD2 PHE 545 13.536 -17.176 7.771 498 HE1 PHE 545 HE1 PHE 545 12.435 -16.524 12.521 499 HE2 PHE 545 HE2 PHE 545 15.160 -16.095 9.271 500 HZ PHE 545 HZ PHE 545 14.611 -15.769 11.649 501 H THR 546 H THR 546 11.820 -21.035 5.742 502 HA THR 546 HA THR 546 9.078 -21.656 5.472 503 HB THR 546 HB THR 546 10.850 -22.124 3.751 504 HG1 THR 546 HG1 THR 546 8.988 -23.137 3.286 505 HG21 THR 546 HG21 THR 546 12.431 -23.738 3.997 506 HG22 THR 546 HG22 THR 546 11.395 -24.750 5.004 507 HG23 THR 546 HG23 THR 546 12.216 -23.356 5.705 508 H ARG 547 H ARG 547 11.598 -22.869 7.560 509 HA ARG 547 HA ARG 547 9.756 -24.908 8.611 510 HB2 ARG 547 HB2 ARG 547 11.742 -25.961 9.601 511 HB3 ARG 547 HB3 ARG 547 11.903 -25.790 7.858 512 HG2 ARG 547 HG2 ARG 547 12.999 -23.595 9.498 513 HG3 ARG 547 HG3 ARG 547 13.836 -25.146 9.586 514 HD2 ARG 547 HD2 ARG 547 13.543 -24.979 6.938 515 HD3 ARG 547 HD3 ARG 547 13.553 -23.258 7.321 516 HE ARG 547 HE ARG 547 15.702 -24.702 8.553 517 HH11 ARG 547 HH11 ARG 547 14.645 -23.104 5.646 518 HH12 ARG 547 HH12 ARG 547 16.251 -22.766 5.092 519 HH21 ARG 547 HH21 ARG 547 17.822 -24.263 7.834 520 HH22 ARG 547 HH22 ARG 547 18.058 -23.427 6.337 521 H THR 548 H THR 548 10.649 -21.824 9.197 522 HA THR 548 HA THR 548 10.417 -22.129 12.120 523 HB THR 548 HB THR 548 11.703 -19.861 10.586 524 HG1 THR 548 HG1 THR 548 13.068 -21.541 12.383 525 HG21 THR 548 HG21 THR 548 12.493 -19.221 12.909 526 HG22 THR 548 HG22 THR 548 11.281 -20.342 13.530 527 HG23 THR 548 HG23 THR 548 10.784 -18.948 12.571 528 H ARG 549 H ARG 549 8.546 -21.489 12.945 529 HA ARG 549 HA ARG 549 7.258 -19.074 12.024 530 HB2 ARG 549 HB2 ARG 549 6.040 -21.792 11.606 531 HB3 ARG 549 HB3 ARG 549 5.037 -20.359 11.786 532 HG2 ARG 549 HG2 ARG 549 5.204 -20.285 9.550 533 HG3 ARG 549 HG3 ARG 549 6.749 -19.504 9.893 534 HD2 ARG 549 HD2 ARG 549 7.592 -21.108 8.564 535 HD3 ARG 549 HD3 ARG 549 7.457 -22.117 10.004 536 HE ARG 549 HE ARG 549 5.712 -23.251 9.021 537 HH11 ARG 549 HH11 ARG 549 6.471 -20.406 7.163 538 HH12 ARG 549 HH12 ARG 549 5.472 -20.857 5.821 539 HH21 ARG 549 HH21 ARG 549 4.395 -23.856 7.260 540 HH22 ARG 549 HH22 ARG 549 4.292 -22.820 5.877 541 H ILE 550 H ILE 550 5.042 -18.885 13.283 542 HA ILE 550 HA ILE 550 4.863 -20.195 15.803 543 HB ILE 550 HB ILE 550 6.833 -18.478 15.992 544 HG12 ILE 550 HG12 ILE 550 5.139 -17.937 18.277 545 HG13 ILE 550 HG13 ILE 550 5.015 -19.625 17.792 546 HG21 ILE 550 HG21 ILE 550 5.043 -16.712 15.105 547 HG22 ILE 550 HG22 ILE 550 4.748 -16.555 16.835 548 HG23 ILE 550 HG23 ILE 550 6.362 -16.267 16.188 549 HD11 ILE 550 HD11 ILE 550 7.721 -19.144 17.717 550 HD12 ILE 550 HD12 ILE 550 7.174 -18.222 19.118 551 HD13 ILE 550 HD13 ILE 550 6.838 -19.950 19.013 552 H LEU 551 H LEU 551 3.390 -18.658 17.315 553 HA LEU 551 HA LEU 551 0.869 -18.651 16.417 554 HB2 LEU 551 HB2 LEU 551 0.302 -16.988 18.045 555 HB3 LEU 551 HB3 LEU 551 1.569 -18.023 18.699 556 HG LEU 551 HG LEU 551 3.098 -16.045 17.758 557 HD11 LEU 551 HD11 LEU 551 1.164 -14.205 18.828 558 HD12 LEU 551 HD12 LEU 551 0.528 -15.013 17.396 559 HD13 LEU 551 HD13 LEU 551 2.057 -14.139 17.309 560 HD21 LEU 551 HD21 LEU 551 2.785 -17.009 20.114 561 HD22 LEU 551 HD22 LEU 551 1.665 -15.669 20.367 562 HD23 LEU 551 HD23 LEU 551 3.354 -15.346 19.970 563 H ASN 552 H ASN 552 3.194 -16.047 15.843 564 HA ASN 552 HA ASN 552 1.315 -14.442 14.379 565 HB2 ASN 552 HB2 ASN 552 3.098 -13.324 15.563 566 HB3 ASN 552 HB3 ASN 552 4.317 -14.257 14.698 567 HD21 ASN 552 HD21 ASN 552 5.383 -12.787 13.556 568 HD22 ASN 552 HD22 ASN 552 4.667 -11.668 12.450 569 H LYS 553 H LYS 553 4.356 -16.035 13.401 570 HA LYS 553 HA LYS 553 3.915 -15.781 10.639 571 HB2 LYS 553 HB2 LYS 553 5.501 -18.055 11.782 572 HB3 LYS 553 HB3 LYS 553 5.821 -17.092 10.345 573 HG2 LYS 553 HG2 LYS 553 6.174 -16.260 13.214 574 HG3 LYS 553 HG3 LYS 553 7.434 -16.524 12.006 575 HD2 LYS 553 HD2 LYS 553 5.315 -14.376 11.920 576 HD3 LYS 553 HD3 LYS 553 7.014 -14.141 12.336 577 HE2 LYS 553 HE2 LYS 553 7.469 -15.206 10.018 578 HE3 LYS 553 HE3 LYS 553 5.785 -14.804 9.686 579 HZ1 LYS 553 HZ1 LYS 553 8.087 -13.051 9.991 580 HZ2 LYS 553 HZ2 LYS 553 6.635 -12.492 10.654 581 HZ3 LYS 553 HZ3 LYS 553 6.719 -12.882 9.010 582 HA PRO 554 HA PRO 554 1.160 -19.010 9.529 583 HB2 PRO 554 HB2 PRO 554 2.289 -20.031 7.281 584 HB3 PRO 554 HB3 PRO 554 1.512 -18.444 7.330 585 HG2 PRO 554 HG2 PRO 554 4.421 -19.135 7.482 586 HG3 PRO 554 HG3 PRO 554 3.625 -17.838 6.571 587 HD2 PRO 554 HD2 PRO 554 4.882 -17.402 8.929 588 HD3 PRO 554 HD3 PRO 554 3.460 -16.470 8.418 589 H MET 555 H MET 555 1.922 -20.181 11.544 590 HA MET 555 HA MET 555 3.865 -22.185 11.496 591 HB2 MET 555 HB2 MET 555 2.976 -21.491 13.598 592 HB3 MET 555 HB3 MET 555 1.334 -21.895 13.112 593 HG2 MET 555 HG2 MET 555 2.166 -23.542 14.656 594 HG3 MET 555 HG3 MET 555 1.943 -24.267 13.065 595 HE1 MET 555 HE1 MET 555 3.689 -26.429 13.440 596 HE2 MET 555 HE2 MET 555 5.000 -26.178 14.592 597 HE3 MET 555 HE3 MET 555 3.337 -25.820 15.058 598 H ASN 556 H ASN 556 0.331 -22.659 11.281 599 HA ASN 556 HA ASN 556 0.787 -24.798 9.335 600 HB2 ASN 556 HB2 ASN 556 0.505 -25.587 11.834 601 HB3 ASN 556 HB3 ASN 556 -1.202 -25.285 11.519 602 HD21 ASN 556 HD21 ASN 556 -2.235 -27.062 11.015 603 HD22 ASN 556 HD22 ASN 556 -1.622 -28.370 10.067 604 H MET 557 H MET 557 -0.041 -22.485 8.438 605 HA MET 557 HA MET 557 -2.964 -22.434 8.422 606 HB2 MET 557 HB2 MET 557 -2.725 -20.279 7.277 607 HB3 MET 557 HB3 MET 557 -1.817 -20.307 8.783 608 HG2 MET 557 HG2 MET 557 -0.245 -19.374 7.461 609 HG3 MET 557 HG3 MET 557 0.127 -21.069 7.150 610 HE1 MET 557 HE1 MET 557 1.138 -21.233 5.091 611 HE2 MET 557 HE2 MET 557 0.642 -20.546 3.544 612 HE3 MET 557 HE3 MET 557 1.359 -19.511 4.781 613 H GLN 558 H GLN 558 -3.904 -21.808 6.178 614 HA GLN 558 HA GLN 558 -2.559 -23.150 3.972 615 HB2 GLN 558 HB2 GLN 558 -5.397 -23.919 4.587 616 HB3 GLN 558 HB3 GLN 558 -4.244 -24.722 3.529 617 HG2 GLN 558 HG2 GLN 558 -2.906 -25.239 5.616 618 HG3 GLN 558 HG3 GLN 558 -4.323 -24.718 6.527 619 HE21 GLN 558 HE21 GLN 558 -3.595 -27.173 7.021 620 HE22 GLN 558 HE22 GLN 558 -4.607 -28.334 6.238 621 H LEU 559 H LEU 559 -2.777 -21.978 2.189 622 HA LEU 559 HA LEU 559 -4.236 -19.600 2.073 623 HB2 LEU 559 HB2 LEU 559 -2.294 -20.087 0.664 624 HB3 LEU 559 HB3 LEU 559 -3.230 -21.301 -0.205 625 HG LEU 559 HG LEU 559 -2.868 -18.993 -1.291 626 HD11 LEU 559 HD11 LEU 559 -4.734 -19.326 -2.577 627 HD12 LEU 559 HD12 LEU 559 -5.754 -19.721 -1.194 628 HD13 LEU 559 HD13 LEU 559 -4.592 -20.902 -1.797 629 HD21 LEU 559 HD21 LEU 559 -4.485 -17.293 -0.697 630 HD22 LEU 559 HD22 LEU 559 -3.488 -17.687 0.703 631 HD23 LEU 559 HD23 LEU 559 -5.132 -18.317 0.585 632 H LEU 560 H LEU 560 -6.351 -19.299 1.954 633 HA LEU 560 HA LEU 560 -7.987 -21.319 0.565 634 HB2 LEU 560 HB2 LEU 560 -9.704 -21.019 2.087 635 HB3 LEU 560 HB3 LEU 560 -8.259 -20.960 3.094 636 HG LEU 560 HG LEU 560 -8.618 -18.325 2.569 637 HD11 LEU 560 HD11 LEU 560 -10.940 -19.400 1.591 638 HD12 LEU 560 HD12 LEU 560 -10.724 -17.734 2.126 639 HD13 LEU 560 HD13 LEU 560 -11.391 -18.935 3.231 640 HD21 LEU 560 HD21 LEU 560 -8.999 -18.152 4.804 641 HD22 LEU 560 HD22 LEU 560 -8.470 -19.834 4.751 642 HD23 LEU 560 HD23 LEU 560 -10.191 -19.452 4.817 643 H GLY 561 H GLY 561 -7.193 -17.955 0.890 644 HA2 GLY 561 HA2 GLY 561 -9.399 -17.083 -0.789 645 HA3 GLY 561 HA3 GLY 561 -8.149 -16.063 -0.093 646 H ASP 562 H ASP 562 -8.135 -15.063 -2.231 647 HA ASP 562 HA ASP 562 -6.017 -16.127 -3.835 648 HB2 ASP 562 HB2 ASP 562 -7.997 -17.409 -4.674 649 HB3 ASP 562 HB3 ASP 562 -8.730 -15.879 -5.148 650 H ALA 563 H ALA 563 -5.204 -14.617 -5.349 651 HA ALA 563 HA ALA 563 -5.483 -11.915 -4.578 652 HB1 ALA 563 HB1 ALA 563 -3.588 -11.681 -5.715 653 HB2 ALA 563 HB2 ALA 563 -3.689 -13.398 -6.108 654 HB3 ALA 563 HB3 ALA 563 -4.355 -12.198 -7.217 655 H GLN 564 H GLN 564 -6.914 -10.425 -5.168 656 HA GLN 564 HA GLN 564 -9.157 -10.915 -6.701 657 HB2 GLN 564 HB2 GLN 564 -9.636 -8.603 -6.563 658 HB3 GLN 564 HB3 GLN 564 -8.745 -8.991 -5.097 659 HG2 GLN 564 HG2 GLN 564 -7.685 -7.076 -5.692 660 HG3 GLN 564 HG3 GLN 564 -6.687 -8.242 -6.559 661 HE21 GLN 564 HE21 GLN 564 -6.202 -7.610 -8.522 662 HE22 GLN 564 HE22 GLN 564 -7.205 -6.682 -9.579 Start of MODEL 9 1 H MET 480 H MET 480 -0.452 -0.246 -1.049 2 HA MET 480 HA MET 480 1.172 0.897 -3.201 3 HB2 MET 480 HB2 MET 480 2.674 1.657 -1.526 4 HB3 MET 480 HB3 MET 480 1.055 1.989 -0.925 5 HG2 MET 480 HG2 MET 480 1.297 -0.292 0.271 6 HG3 MET 480 HG3 MET 480 3.020 -0.067 -0.021 7 HE1 MET 480 HE1 MET 480 4.460 1.914 2.093 8 HE2 MET 480 HE2 MET 480 4.183 1.952 0.352 9 HE3 MET 480 HE3 MET 480 3.702 3.324 1.352 10 H ALA 481 H ALA 481 0.425 -1.934 -3.119 11 HA ALA 481 HA ALA 481 2.844 -3.349 -2.383 12 HB1 ALA 481 HB1 ALA 481 1.065 -4.967 -3.921 13 HB2 ALA 481 HB2 ALA 481 1.465 -5.077 -2.206 14 HB3 ALA 481 HB3 ALA 481 0.135 -4.048 -2.737 15 H ASP 482 H ASP 482 3.168 -5.225 -4.300 16 HA ASP 482 HA ASP 482 4.300 -3.657 -6.482 17 HB2 ASP 482 HB2 ASP 482 5.372 -5.674 -5.053 18 HB3 ASP 482 HB3 ASP 482 4.691 -6.595 -6.392 19 H VAL 483 H VAL 483 1.746 -5.908 -5.852 20 HA VAL 483 HA VAL 483 0.818 -5.602 -8.602 21 HB VAL 483 HB VAL 483 2.020 -7.679 -8.749 22 HG11 VAL 483 HG11 VAL 483 2.031 -8.129 -6.294 23 HG12 VAL 483 HG12 VAL 483 0.371 -8.709 -6.446 24 HG13 VAL 483 HG13 VAL 483 1.678 -9.542 -7.288 25 HG21 VAL 483 HG21 VAL 483 -0.939 -8.210 -8.490 26 HG22 VAL 483 HG22 VAL 483 -0.127 -7.561 -9.914 27 HG23 VAL 483 HG23 VAL 483 0.217 -9.205 -9.377 28 H GLY 484 H GLY 484 0.183 -6.857 -5.350 29 HA2 GLY 484 HA2 GLY 484 -1.834 -5.845 -4.284 30 HA3 GLY 484 HA3 GLY 484 -2.676 -6.238 -5.776 31 H ASP 485 H ASP 485 -0.332 -8.333 -4.213 32 HA ASP 485 HA ASP 485 -2.006 -10.586 -4.308 33 HB2 ASP 485 HB2 ASP 485 0.632 -10.260 -3.934 34 HB3 ASP 485 HB3 ASP 485 0.145 -10.517 -2.261 35 H MET 486 H MET 486 -3.974 -10.256 -3.331 36 HA MET 486 HA MET 486 -3.907 -9.936 -0.403 37 HB2 MET 486 HB2 MET 486 -5.117 -8.222 -2.227 38 HB3 MET 486 HB3 MET 486 -6.445 -9.204 -1.623 39 HG2 MET 486 HG2 MET 486 -6.427 -8.210 0.370 40 HG3 MET 486 HG3 MET 486 -4.668 -8.252 0.478 41 HE1 MET 486 HE1 MET 486 -6.145 -6.341 -2.778 42 HE2 MET 486 HE2 MET 486 -7.437 -6.808 -1.672 43 HE3 MET 486 HE3 MET 486 -7.029 -5.105 -1.883 44 H GLN 487 H GLN 487 -4.550 -11.702 0.625 45 HA GLN 487 HA GLN 487 -6.825 -13.219 -0.353 46 HB2 GLN 487 HB2 GLN 487 -4.268 -14.685 0.268 47 HB3 GLN 487 HB3 GLN 487 -5.734 -15.321 -0.467 48 HG2 GLN 487 HG2 GLN 487 -5.319 -14.046 -2.479 49 HG3 GLN 487 HG3 GLN 487 -3.898 -13.306 -1.743 50 HE21 GLN 487 HE21 GLN 487 -4.527 -15.251 -4.069 51 HE22 GLN 487 HE22 GLN 487 -3.309 -16.464 -3.894 52 H LEU 488 H LEU 488 -7.240 -15.120 1.251 53 HA LEU 488 HA LEU 488 -6.936 -14.017 3.960 54 HB2 LEU 488 HB2 LEU 488 -9.237 -14.334 2.937 55 HB3 LEU 488 HB3 LEU 488 -8.950 -16.068 3.077 56 HG LEU 488 HG LEU 488 -8.666 -15.721 5.549 57 HD11 LEU 488 HD11 LEU 488 -8.530 -13.664 6.357 58 HD12 LEU 488 HD12 LEU 488 -10.177 -13.349 5.812 59 HD13 LEU 488 HD13 LEU 488 -8.814 -12.991 4.752 60 HD21 LEU 488 HD21 LEU 488 -10.728 -16.602 4.596 61 HD22 LEU 488 HD22 LEU 488 -11.323 -14.962 4.336 62 HD23 LEU 488 HD23 LEU 488 -11.070 -15.560 5.977 63 H TYR 489 H TYR 489 -5.293 -14.953 4.991 64 HA TYR 489 HA TYR 489 -4.856 -17.839 4.630 65 HB2 TYR 489 HB2 TYR 489 -2.884 -16.069 6.018 66 HB3 TYR 489 HB3 TYR 489 -2.604 -17.524 5.068 67 HD1 TYR 489 HD1 TYR 489 -3.053 -13.905 4.964 68 HD2 TYR 489 HD2 TYR 489 -2.530 -17.418 2.623 69 HE1 TYR 489 HE1 TYR 489 -2.493 -12.514 3.014 70 HE2 TYR 489 HE2 TYR 489 -1.966 -16.038 0.666 71 HH TYR 489 HH TYR 489 -2.063 -13.909 -0.175 72 H ARG 490 H ARG 490 -5.695 -19.075 6.162 73 HA ARG 490 HA ARG 490 -6.051 -17.978 8.858 74 HB2 ARG 490 HB2 ARG 490 -7.678 -19.703 9.219 75 HB3 ARG 490 HB3 ARG 490 -8.019 -18.954 7.665 76 HG2 ARG 490 HG2 ARG 490 -8.131 -21.039 6.889 77 HG3 ARG 490 HG3 ARG 490 -6.368 -21.015 6.962 78 HD2 ARG 490 HD2 ARG 490 -6.292 -22.368 8.774 79 HD3 ARG 490 HD3 ARG 490 -7.762 -21.690 9.473 80 HE ARG 490 HE ARG 490 -7.558 -24.010 7.824 81 HH11 ARG 490 HH11 ARG 490 -9.637 -21.358 8.697 82 HH12 ARG 490 HH12 ARG 490 -11.097 -22.201 8.299 83 HH21 ARG 490 HH21 ARG 490 -9.473 -25.131 7.297 84 HH22 ARG 490 HH22 ARG 490 -11.003 -24.347 7.503 85 H ILE 491 H ILE 491 -4.933 -18.717 10.559 86 HA ILE 491 HA ILE 491 -3.023 -20.895 10.083 87 HB ILE 491 HB ILE 491 -1.747 -20.044 11.946 88 HG12 ILE 491 HG12 ILE 491 -3.921 -17.963 12.261 89 HG13 ILE 491 HG13 ILE 491 -3.670 -19.333 13.338 90 HG21 ILE 491 HG21 ILE 491 -0.792 -18.624 10.536 91 HG22 ILE 491 HG22 ILE 491 -2.264 -18.612 9.566 92 HG23 ILE 491 HG23 ILE 491 -2.049 -17.431 10.857 93 HD11 ILE 491 HD11 ILE 491 -1.664 -18.456 14.160 94 HD12 ILE 491 HD12 ILE 491 -1.530 -17.296 12.837 95 HD13 ILE 491 HD13 ILE 491 -2.766 -17.082 14.077 96 H GLU 492 H GLU 492 -2.524 -22.286 11.998 97 HA GLU 492 HA GLU 492 -5.034 -23.195 13.178 98 HB2 GLU 492 HB2 GLU 492 -3.342 -24.717 11.976 99 HB3 GLU 492 HB3 GLU 492 -2.368 -24.568 13.432 100 HG2 GLU 492 HG2 GLU 492 -4.632 -25.284 14.588 101 HG3 GLU 492 HG3 GLU 492 -4.936 -25.986 13.000 102 H VAL 493 H VAL 493 -4.366 -20.873 14.327 103 HA VAL 493 HA VAL 493 -3.652 -21.699 17.039 104 HB VAL 493 HB VAL 493 -2.466 -19.182 15.892 105 HG11 VAL 493 HG11 VAL 493 -1.018 -19.290 17.825 106 HG12 VAL 493 HG12 VAL 493 -2.703 -19.378 18.343 107 HG13 VAL 493 HG13 VAL 493 -1.716 -20.839 18.298 108 HG21 VAL 493 HG21 VAL 493 -1.175 -21.903 16.062 109 HG22 VAL 493 HG22 VAL 493 -1.574 -21.024 14.586 110 HG23 VAL 493 HG23 VAL 493 -0.338 -20.399 15.678 111 H GLY 494 H GLY 494 -4.737 -20.615 18.629 112 HA2 GLY 494 HA2 GLY 494 -6.224 -18.195 17.956 113 HA3 GLY 494 HA3 GLY 494 -7.175 -19.603 18.407 114 H ARG 495 H ARG 495 -7.850 -17.928 20.068 115 HA ARG 495 HA ARG 495 -6.198 -17.025 22.105 116 HB2 ARG 495 HB2 ARG 495 -8.304 -16.997 23.499 117 HB3 ARG 495 HB3 ARG 495 -8.403 -16.152 21.960 118 HG2 ARG 495 HG2 ARG 495 -9.575 -18.041 20.976 119 HG3 ARG 495 HG3 ARG 495 -9.442 -18.926 22.497 120 HD2 ARG 495 HD2 ARG 495 -10.788 -17.238 23.618 121 HD3 ARG 495 HD3 ARG 495 -10.878 -16.300 22.128 122 HE ARG 495 HE ARG 495 -11.864 -18.957 21.791 123 HH11 ARG 495 HH11 ARG 495 -12.680 -15.784 22.969 124 HH12 ARG 495 HH12 ARG 495 -14.384 -15.993 22.735 125 HH21 ARG 495 HH21 ARG 495 -14.105 -19.244 21.478 126 HH22 ARG 495 HH22 ARG 495 -15.194 -17.962 21.888 127 H ASP 496 H ASP 496 -7.859 -20.119 21.761 128 HA ASP 496 HA ASP 496 -7.226 -21.104 24.342 129 HB2 ASP 496 HB2 ASP 496 -8.916 -21.943 22.455 130 HB3 ASP 496 HB3 ASP 496 -7.562 -23.002 22.072 131 H ASP 497 H ASP 497 -5.360 -20.653 21.535 132 HA ASP 497 HA ASP 497 -3.383 -22.664 22.306 133 HB2 ASP 497 HB2 ASP 497 -4.204 -22.113 19.867 134 HB3 ASP 497 HB3 ASP 497 -3.020 -20.814 19.981 135 H GLY 498 H GLY 498 -3.744 -19.166 21.948 136 HA2 GLY 498 HA2 GLY 498 -2.510 -18.010 23.866 137 HA3 GLY 498 HA3 GLY 498 -1.098 -18.820 23.204 138 H VAL 499 H VAL 499 -3.693 -17.427 21.285 139 HA VAL 499 HA VAL 499 -1.930 -15.206 20.521 140 HB VAL 499 HB VAL 499 -1.872 -17.180 18.869 141 HG11 VAL 499 HG11 VAL 499 -4.283 -16.090 17.584 142 HG12 VAL 499 HG12 VAL 499 -3.692 -17.750 17.670 143 HG13 VAL 499 HG13 VAL 499 -4.569 -17.054 19.032 144 HG21 VAL 499 HG21 VAL 499 -1.287 -15.725 17.224 145 HG22 VAL 499 HG22 VAL 499 -2.732 -14.736 17.428 146 HG23 VAL 499 HG23 VAL 499 -1.389 -14.578 18.559 147 H GLU 500 H GLU 500 -2.985 -13.343 19.772 148 HA GLU 500 HA GLU 500 -5.911 -13.330 20.112 149 HB2 GLU 500 HB2 GLU 500 -4.174 -10.989 20.856 150 HB3 GLU 500 HB3 GLU 500 -5.847 -11.295 21.300 151 HG2 GLU 500 HG2 GLU 500 -4.703 -13.426 22.437 152 HG3 GLU 500 HG3 GLU 500 -3.349 -12.300 22.503 153 H VAL 501 H VAL 501 -6.554 -10.845 19.363 154 HA VAL 501 HA VAL 501 -6.151 -10.919 16.525 155 HB VAL 501 HB VAL 501 -7.571 -8.874 18.237 156 HG11 VAL 501 HG11 VAL 501 -7.202 -7.694 16.300 157 HG12 VAL 501 HG12 VAL 501 -7.199 -9.141 15.290 158 HG13 VAL 501 HG13 VAL 501 -8.721 -8.500 15.912 159 HG21 VAL 501 HG21 VAL 501 -9.539 -10.035 17.892 160 HG22 VAL 501 HG22 VAL 501 -8.915 -10.884 16.478 161 HG23 VAL 501 HG23 VAL 501 -8.375 -11.345 18.092 162 H ARG 502 H ARG 502 -4.895 -9.049 19.198 163 HA ARG 502 HA ARG 502 -3.585 -7.146 17.436 164 HB2 ARG 502 HB2 ARG 502 -2.714 -6.185 19.576 165 HB3 ARG 502 HB3 ARG 502 -4.468 -6.238 19.470 166 HG2 ARG 502 HG2 ARG 502 -4.623 -8.004 20.997 167 HG3 ARG 502 HG3 ARG 502 -2.910 -8.399 20.842 168 HD2 ARG 502 HD2 ARG 502 -3.102 -7.303 22.911 169 HD3 ARG 502 HD3 ARG 502 -2.451 -6.092 21.807 170 HE ARG 502 HE ARG 502 -5.118 -5.669 21.680 171 HH11 ARG 502 HH11 ARG 502 -2.861 -5.924 24.319 172 HH12 ARG 502 HH12 ARG 502 -3.746 -4.852 25.352 173 HH21 ARG 502 HH21 ARG 502 -6.293 -4.255 23.031 174 HH22 ARG 502 HH22 ARG 502 -5.699 -3.904 24.619 175 H HIS 503 H HIS 503 -2.968 -10.228 18.376 176 HA HIS 503 HA HIS 503 -0.126 -9.968 18.853 177 HB2 HIS 503 HB2 HIS 503 -1.819 -11.781 19.758 178 HB3 HIS 503 HB3 HIS 503 -1.427 -12.591 18.245 179 HD1 HIS 503 HD1 HIS 503 -0.650 -13.701 21.073 180 HD2 HIS 503 HD2 HIS 503 1.861 -11.550 18.556 181 HE1 HIS 503 HE1 HIS 503 1.687 -14.326 21.760 182 H ILE 504 H ILE 504 -2.110 -11.601 16.375 183 HA ILE 504 HA ILE 504 0.089 -12.031 14.625 184 HB ILE 504 HB ILE 504 -1.446 -12.906 13.076 185 HG12 ILE 504 HG12 ILE 504 -2.931 -10.871 13.099 186 HG13 ILE 504 HG13 ILE 504 -3.788 -12.405 12.990 187 HG21 ILE 504 HG21 ILE 504 -2.901 -14.360 14.416 188 HG22 ILE 504 HG22 ILE 504 -1.278 -14.243 15.095 189 HG23 ILE 504 HG23 ILE 504 -2.607 -13.341 15.825 190 HD11 ILE 504 HD11 ILE 504 -4.941 -10.957 14.508 191 HD12 ILE 504 HD12 ILE 504 -4.215 -12.279 15.423 192 HD13 ILE 504 HD13 ILE 504 -3.466 -10.683 15.434 193 H VAL 505 H VAL 505 -2.100 -9.400 15.139 194 HA VAL 505 HA VAL 505 -1.622 -8.137 12.595 195 HB VAL 505 HB VAL 505 -2.950 -7.157 15.121 196 HG11 VAL 505 HG11 VAL 505 -1.995 -5.669 12.805 197 HG12 VAL 505 HG12 VAL 505 -3.719 -5.448 13.109 198 HG13 VAL 505 HG13 VAL 505 -2.545 -5.089 14.377 199 HG21 VAL 505 HG21 VAL 505 -4.066 -7.867 12.409 200 HG22 VAL 505 HG22 VAL 505 -4.161 -8.874 13.854 201 HG23 VAL 505 HG23 VAL 505 -4.994 -7.321 13.806 202 H GLY 506 H GLY 506 -0.809 -7.261 15.964 203 HA2 GLY 506 HA2 GLY 506 0.904 -5.136 15.313 204 HA3 GLY 506 HA3 GLY 506 0.924 -6.029 16.826 205 H ALA 507 H ALA 507 1.408 -8.536 15.138 206 HA ALA 507 HA ALA 507 4.262 -8.471 15.358 207 HB1 ALA 507 HB1 ALA 507 3.324 -10.530 15.912 208 HB2 ALA 507 HB2 ALA 507 2.283 -10.547 14.488 209 HB3 ALA 507 HB3 ALA 507 4.019 -10.806 14.315 210 H ILE 508 H ILE 508 2.118 -9.159 12.586 211 HA ILE 508 HA ILE 508 4.188 -8.924 10.665 212 HB ILE 508 HB ILE 508 2.399 -8.921 8.987 213 HG12 ILE 508 HG12 ILE 508 0.045 -9.367 10.274 214 HG13 ILE 508 HG13 ILE 508 0.784 -8.181 11.345 215 HG21 ILE 508 HG21 ILE 508 2.127 -11.128 9.217 216 HG22 ILE 508 HG22 ILE 508 3.078 -10.953 10.691 217 HG23 ILE 508 HG23 ILE 508 1.317 -10.958 10.774 218 HD11 ILE 508 HD11 ILE 508 1.083 -7.341 8.630 219 HD12 ILE 508 HD12 ILE 508 -0.608 -7.718 8.963 220 HD13 ILE 508 HD13 ILE 508 0.248 -6.545 9.964 221 H ALA 509 H ALA 509 1.958 -6.649 12.094 222 HA ALA 509 HA ALA 509 2.346 -4.572 10.178 223 HB1 ALA 509 HB1 ALA 509 1.365 -4.375 13.023 224 HB2 ALA 509 HB2 ALA 509 1.193 -3.145 11.769 225 HB3 ALA 509 HB3 ALA 509 0.356 -4.690 11.610 226 H ASN 510 H ASN 510 4.066 -5.656 12.985 227 HA ASN 510 HA ASN 510 5.653 -3.209 13.116 228 HB2 ASN 510 HB2 ASN 510 4.840 -4.336 15.204 229 HB3 ASN 510 HB3 ASN 510 5.890 -5.697 14.819 230 HD21 ASN 510 HD21 ASN 510 6.176 -2.156 14.882 231 HD22 ASN 510 HD22 ASN 510 7.649 -2.124 15.783 232 H GLU 511 H GLU 511 5.808 -6.444 11.912 233 HA GLU 511 HA GLU 511 8.622 -6.712 11.763 234 HB2 GLU 511 HB2 GLU 511 6.298 -8.068 10.455 235 HB3 GLU 511 HB3 GLU 511 7.919 -8.360 9.840 236 HG2 GLU 511 HG2 GLU 511 7.069 -8.785 12.694 237 HG3 GLU 511 HG3 GLU 511 7.159 -10.049 11.469 238 H GLY 512 H GLY 512 6.191 -5.636 9.404 239 HA2 GLY 512 HA2 GLY 512 8.406 -4.544 7.780 240 HA3 GLY 512 HA3 GLY 512 6.910 -5.155 7.092 241 H ASP 513 H ASP 513 6.175 -3.341 6.101 242 HA ASP 513 HA ASP 513 5.995 -0.863 7.643 243 HB2 ASP 513 HB2 ASP 513 5.946 -1.559 4.754 244 HB3 ASP 513 HB3 ASP 513 5.005 -0.156 5.253 245 H ILE 514 H ILE 514 4.098 -3.530 6.782 246 HA ILE 514 HA ILE 514 1.564 -2.527 6.375 247 HB ILE 514 HB ILE 514 2.305 -4.963 8.000 248 HG12 ILE 514 HG12 ILE 514 1.349 -5.042 5.168 249 HG13 ILE 514 HG13 ILE 514 3.029 -4.620 5.482 250 HG21 ILE 514 HG21 ILE 514 -0.298 -3.963 6.914 251 HG22 ILE 514 HG22 ILE 514 -0.018 -5.690 7.131 252 HG23 ILE 514 HG23 ILE 514 0.072 -4.602 8.516 253 HD11 ILE 514 HD11 ILE 514 2.539 -7.047 5.004 254 HD12 ILE 514 HD12 ILE 514 3.471 -6.711 6.463 255 HD13 ILE 514 HD13 ILE 514 1.756 -7.103 6.582 256 H SER 515 H SER 515 -0.129 -1.875 7.668 257 HA SER 515 HA SER 515 0.579 -1.227 10.455 258 HB2 SER 515 HB2 SER 515 0.078 0.620 8.607 259 HB3 SER 515 HB3 SER 515 -1.592 0.260 9.047 260 HG SER 515 HG SER 515 0.253 1.695 10.392 261 H SER 516 H SER 516 -1.407 -0.950 11.875 262 HA SER 516 HA SER 516 -2.831 -3.393 11.924 263 HB2 SER 516 HB2 SER 516 -2.397 -2.325 14.012 264 HB3 SER 516 HB3 SER 516 -3.149 -0.822 13.478 265 HG SER 516 HG SER 516 -4.907 -1.597 14.307 266 H ARG 517 H ARG 517 -3.448 -0.351 10.439 267 HA ARG 517 HA ARG 517 -6.284 -0.942 10.065 268 HB2 ARG 517 HB2 ARG 517 -6.335 1.313 8.980 269 HB3 ARG 517 HB3 ARG 517 -5.820 1.332 10.662 270 HG2 ARG 517 HG2 ARG 517 -3.535 1.623 10.032 271 HG3 ARG 517 HG3 ARG 517 -3.923 1.373 8.328 272 HD2 ARG 517 HD2 ARG 517 -5.126 3.418 8.216 273 HD3 ARG 517 HD3 ARG 517 -5.087 3.611 9.968 274 HE ARG 517 HE ARG 517 -2.474 3.597 9.324 275 HH11 ARG 517 HH11 ARG 517 -5.200 5.368 8.076 276 HH12 ARG 517 HH12 ARG 517 -4.262 6.757 7.637 277 HH21 ARG 517 HH21 ARG 517 -1.229 5.420 8.750 278 HH22 ARG 517 HH22 ARG 517 -2.003 6.785 8.020 279 H TYR 518 H TYR 518 -3.277 -0.711 8.270 280 HA TYR 518 HA TYR 518 -4.297 -0.787 5.668 281 HB2 TYR 518 HB2 TYR 518 -1.769 -0.798 6.843 282 HB3 TYR 518 HB3 TYR 518 -1.836 -2.308 5.941 283 HD1 TYR 518 HD1 TYR 518 -0.735 -2.108 3.928 284 HD2 TYR 518 HD2 TYR 518 -3.112 1.149 5.287 285 HE1 TYR 518 HE1 TYR 518 -0.244 -0.890 1.848 286 HE2 TYR 518 HE2 TYR 518 -2.629 2.376 3.211 287 HH TYR 518 HH TYR 518 -1.940 1.912 0.917 288 H ILE 519 H ILE 519 -3.666 -3.356 7.983 289 HA ILE 519 HA ILE 519 -3.874 -5.571 6.309 290 HB ILE 519 HB ILE 519 -4.777 -5.332 9.182 291 HG12 ILE 519 HG12 ILE 519 -2.244 -6.680 8.444 292 HG13 ILE 519 HG13 ILE 519 -2.268 -4.930 8.264 293 HG21 ILE 519 HG21 ILE 519 -4.160 -7.771 7.519 294 HG22 ILE 519 HG22 ILE 519 -4.478 -7.773 9.253 295 HG23 ILE 519 HG23 ILE 519 -5.744 -7.288 8.125 296 HD11 ILE 519 HD11 ILE 519 -1.461 -5.250 10.408 297 HD12 ILE 519 HD12 ILE 519 -3.173 -4.915 10.670 298 HD13 ILE 519 HD13 ILE 519 -2.578 -6.574 10.739 299 H GLY 520 H GLY 520 -5.566 -6.860 5.629 300 HA2 GLY 520 HA2 GLY 520 -8.056 -5.526 5.184 301 HA3 GLY 520 HA3 GLY 520 -7.661 -7.175 4.720 302 H ASN 521 H ASN 521 -8.963 -8.620 5.603 303 HA ASN 521 HA ASN 521 -10.344 -7.980 8.094 304 HB2 ASN 521 HB2 ASN 521 -10.766 -10.020 5.928 305 HB3 ASN 521 HB3 ASN 521 -11.540 -10.211 7.498 306 HD21 ASN 521 HD21 ASN 521 -10.890 -7.318 5.568 307 HD22 ASN 521 HD22 ASN 521 -12.540 -6.822 5.440 308 H ILE 522 H ILE 522 -9.859 -8.875 9.995 309 HA ILE 522 HA ILE 522 -8.030 -11.187 10.014 310 HB ILE 522 HB ILE 522 -8.134 -9.045 12.134 311 HG12 ILE 522 HG12 ILE 522 -5.678 -8.899 10.804 312 HG13 ILE 522 HG13 ILE 522 -6.875 -9.025 9.521 313 HG21 ILE 522 HG21 ILE 522 -7.248 -11.512 12.457 314 HG22 ILE 522 HG22 ILE 522 -5.812 -10.843 11.684 315 HG23 ILE 522 HG23 ILE 522 -6.421 -10.133 13.179 316 HD11 ILE 522 HD11 ILE 522 -7.961 -7.166 11.242 317 HD12 ILE 522 HD12 ILE 522 -6.236 -6.799 11.253 318 HD13 ILE 522 HD13 ILE 522 -7.121 -6.832 9.728 319 H LYS 523 H LYS 523 -8.622 -12.913 11.182 320 HA LYS 523 HA LYS 523 -10.981 -12.641 12.929 321 HB2 LYS 523 HB2 LYS 523 -11.276 -13.958 10.774 322 HB3 LYS 523 HB3 LYS 523 -10.176 -15.149 11.457 323 HG2 LYS 523 HG2 LYS 523 -11.756 -15.324 13.409 324 HG3 LYS 523 HG3 LYS 523 -12.890 -14.349 12.471 325 HD2 LYS 523 HD2 LYS 523 -13.616 -16.326 11.691 326 HD3 LYS 523 HD3 LYS 523 -12.182 -16.263 10.663 327 HE2 LYS 523 HE2 LYS 523 -10.986 -17.394 12.647 328 HE3 LYS 523 HE3 LYS 523 -12.610 -17.772 13.219 329 HZ1 LYS 523 HZ1 LYS 523 -11.543 -19.535 11.844 330 HZ2 LYS 523 HZ2 LYS 523 -11.625 -18.491 10.516 331 HZ3 LYS 523 HZ3 LYS 523 -13.047 -19.017 11.266 332 H LEU 524 H LEU 524 -11.050 -13.920 14.824 333 HA LEU 524 HA LEU 524 -8.576 -15.273 15.602 334 HB2 LEU 524 HB2 LEU 524 -8.584 -12.849 16.356 335 HB3 LEU 524 HB3 LEU 524 -9.914 -13.291 17.425 336 HG LEU 524 HG LEU 524 -7.652 -13.188 18.502 337 HD11 LEU 524 HD11 LEU 524 -8.620 -15.990 18.730 338 HD12 LEU 524 HD12 LEU 524 -9.729 -14.680 19.133 339 HD13 LEU 524 HD13 LEU 524 -8.196 -14.831 19.991 340 HD21 LEU 524 HD21 LEU 524 -6.572 -14.299 16.442 341 HD22 LEU 524 HD22 LEU 524 -7.099 -15.816 17.172 342 HD23 LEU 524 HD23 LEU 524 -5.994 -14.753 18.046 343 H PHE 525 H PHE 525 -9.606 -17.247 15.590 344 HA PHE 525 HA PHE 525 -12.012 -17.588 17.206 345 HB2 PHE 525 HB2 PHE 525 -11.081 -18.781 14.847 346 HB3 PHE 525 HB3 PHE 525 -10.956 -20.036 16.076 347 HD1 PHE 525 HD1 PHE 525 -12.725 -21.482 15.973 348 HD2 PHE 525 HD2 PHE 525 -13.428 -17.327 15.372 349 HE1 PHE 525 HE1 PHE 525 -15.138 -21.923 15.769 350 HE2 PHE 525 HE2 PHE 525 -15.841 -17.761 15.168 351 HZ PHE 525 HZ PHE 525 -16.699 -20.061 15.368 352 H ALA 526 H ALA 526 -11.733 -20.185 18.061 353 HA ALA 526 HA ALA 526 -10.261 -19.860 20.451 354 HB1 ALA 526 HB1 ALA 526 -12.207 -21.615 19.507 355 HB2 ALA 526 HB2 ALA 526 -10.806 -22.629 19.853 356 HB3 ALA 526 HB3 ALA 526 -11.480 -21.596 21.114 357 H SER 527 H SER 527 -9.657 -21.806 17.539 358 HA SER 527 HA SER 527 -6.813 -21.865 18.265 359 HB2 SER 527 HB2 SER 527 -8.132 -24.280 17.047 360 HB3 SER 527 HB3 SER 527 -6.587 -24.173 17.889 361 HG SER 527 HG SER 527 -7.869 -24.987 19.411 362 H HIS 528 H HIS 528 -8.228 -20.186 16.416 363 HA HIS 528 HA HIS 528 -6.629 -20.697 14.068 364 HB2 HIS 528 HB2 HIS 528 -9.628 -20.878 14.025 365 HB3 HIS 528 HB3 HIS 528 -8.741 -20.351 12.597 366 HD1 HIS 528 HD1 HIS 528 -7.102 -22.126 11.520 367 HD2 HIS 528 HD2 HIS 528 -9.613 -23.592 14.488 368 HE1 HIS 528 HE1 HIS 528 -7.029 -24.629 11.287 369 H SER 529 H SER 529 -6.759 -18.887 12.503 370 HA SER 529 HA SER 529 -8.035 -16.447 13.228 371 HB2 SER 529 HB2 SER 529 -5.527 -15.404 13.390 372 HB3 SER 529 HB3 SER 529 -6.512 -15.823 14.791 373 HG SER 529 HG SER 529 -4.717 -16.930 15.184 374 H THR 530 H THR 530 -8.236 -15.200 11.469 375 HA THR 530 HA THR 530 -6.619 -15.905 9.114 376 HB THR 530 HB THR 530 -8.399 -15.167 7.719 377 HG1 THR 530 HG1 THR 530 -9.541 -13.537 8.424 378 HG21 THR 530 HG21 THR 530 -9.880 -16.852 8.105 379 HG22 THR 530 HG22 THR 530 -10.073 -16.438 9.809 380 HG23 THR 530 HG23 THR 530 -8.648 -17.329 9.274 381 H ILE 531 H ILE 531 -6.270 -14.076 7.553 382 HA ILE 531 HA ILE 531 -6.374 -11.384 8.387 383 HB ILE 531 HB ILE 531 -4.660 -11.958 9.977 384 HG12 ILE 531 HG12 ILE 531 -3.100 -10.676 7.760 385 HG13 ILE 531 HG13 ILE 531 -4.511 -9.856 8.419 386 HG21 ILE 531 HG21 ILE 531 -2.550 -12.963 9.351 387 HG22 ILE 531 HG22 ILE 531 -3.880 -14.009 8.857 388 HG23 ILE 531 HG23 ILE 531 -3.048 -13.017 7.660 389 HD11 ILE 531 HD11 ILE 531 -3.350 -10.289 10.705 390 HD12 ILE 531 HD12 ILE 531 -1.902 -10.472 9.713 391 HD13 ILE 531 HD13 ILE 531 -2.814 -8.963 9.673 392 H GLU 532 H GLU 532 -5.883 -9.998 6.731 393 HA GLU 532 HA GLU 532 -4.820 -11.230 4.273 394 HB2 GLU 532 HB2 GLU 532 -7.265 -10.695 4.195 395 HB3 GLU 532 HB3 GLU 532 -6.854 -9.001 4.425 396 HG2 GLU 532 HG2 GLU 532 -6.036 -8.764 2.313 397 HG3 GLU 532 HG3 GLU 532 -5.559 -10.456 2.188 398 H LEU 533 H LEU 533 -3.035 -10.336 3.482 399 HA LEU 533 HA LEU 533 -2.266 -7.665 4.452 400 HB2 LEU 533 HB2 LEU 533 -0.814 -10.164 4.080 401 HB3 LEU 533 HB3 LEU 533 -0.007 -8.782 3.341 402 HG LEU 533 HG LEU 533 0.130 -7.657 5.459 403 HD11 LEU 533 HD11 LEU 533 -1.836 -9.703 6.258 404 HD12 LEU 533 HD12 LEU 533 -1.658 -8.029 6.781 405 HD13 LEU 533 HD13 LEU 533 -0.619 -9.280 7.462 406 HD21 LEU 533 HD21 LEU 533 1.021 -10.520 5.425 407 HD22 LEU 533 HD22 LEU 533 1.391 -9.457 6.783 408 HD23 LEU 533 HD23 LEU 533 1.972 -9.058 5.166 409 HA PRO 534 HA PRO 534 -2.766 -6.201 0.310 410 HB2 PRO 534 HB2 PRO 534 -1.468 -3.836 0.614 411 HB3 PRO 534 HB3 PRO 534 -3.089 -4.132 1.254 412 HG2 PRO 534 HG2 PRO 534 -0.451 -4.219 2.666 413 HG3 PRO 534 HG3 PRO 534 -1.988 -3.519 3.208 414 HD2 PRO 534 HD2 PRO 534 -1.110 -5.939 4.050 415 HD3 PRO 534 HD3 PRO 534 -2.835 -5.564 3.854 416 H LYS 535 H LYS 535 0.134 -7.131 1.748 417 HA LYS 535 HA LYS 535 2.172 -6.230 0.176 418 HB2 LYS 535 HB2 LYS 535 1.788 -9.085 1.097 419 HB3 LYS 535 HB3 LYS 535 3.314 -8.361 0.607 420 HG2 LYS 535 HG2 LYS 535 1.828 -7.010 2.778 421 HG3 LYS 535 HG3 LYS 535 2.562 -8.572 3.151 422 HD2 LYS 535 HD2 LYS 535 4.166 -6.902 3.695 423 HD3 LYS 535 HD3 LYS 535 4.710 -7.669 2.201 424 HE2 LYS 535 HE2 LYS 535 4.235 -5.820 0.921 425 HE3 LYS 535 HE3 LYS 535 2.996 -5.238 2.031 426 HZ1 LYS 535 HZ1 LYS 535 4.492 -4.120 3.249 427 HZ2 LYS 535 HZ2 LYS 535 5.443 -4.195 1.852 428 HZ3 LYS 535 HZ3 LYS 535 5.687 -5.308 3.102 429 H GLY 536 H GLY 536 3.111 -6.792 -1.787 430 HA2 GLY 536 HA2 GLY 536 1.448 -8.484 -3.548 431 HA3 GLY 536 HA3 GLY 536 2.118 -6.954 -4.093 432 H MET 537 H MET 537 3.664 -9.481 -2.148 433 HA MET 537 HA MET 537 5.123 -10.677 -4.225 434 HB2 MET 537 HB2 MET 537 6.071 -8.219 -4.004 435 HB3 MET 537 HB3 MET 537 6.956 -8.918 -2.655 436 HG2 MET 537 HG2 MET 537 8.158 -10.353 -4.020 437 HG3 MET 537 HG3 MET 537 6.998 -10.226 -5.340 438 HE1 MET 537 HE1 MET 537 8.817 -9.893 -7.122 439 HE2 MET 537 HE2 MET 537 7.449 -8.814 -7.397 440 HE3 MET 537 HE3 MET 537 9.097 -8.221 -7.608 441 HA PRO 538 HA PRO 538 5.166 -12.609 0.029 442 HB2 PRO 538 HB2 PRO 538 3.945 -14.914 -0.725 443 HB3 PRO 538 HB3 PRO 538 3.052 -13.478 -0.211 444 HG2 PRO 538 HG2 PRO 538 3.629 -14.461 -2.980 445 HG3 PRO 538 HG3 PRO 538 2.121 -13.803 -2.317 446 HD2 PRO 538 HD2 PRO 538 3.814 -12.327 -3.830 447 HD3 PRO 538 HD3 PRO 538 2.833 -11.621 -2.531 448 H GLY 539 H GLY 539 5.759 -15.148 0.330 449 HA2 GLY 539 HA2 GLY 539 7.192 -16.915 -0.234 450 HA3 GLY 539 HA3 GLY 539 7.711 -16.013 -1.650 451 H GLU 540 H GLU 540 7.795 -13.923 0.901 452 HA GLU 540 HA GLU 540 10.672 -14.022 1.016 453 HB2 GLU 540 HB2 GLU 540 8.915 -12.267 2.716 454 HB3 GLU 540 HB3 GLU 540 10.559 -11.966 2.169 455 HG2 GLU 540 HG2 GLU 540 8.104 -12.016 0.429 456 HG3 GLU 540 HG3 GLU 540 8.952 -10.575 0.987 457 H VAL 541 H VAL 541 8.039 -14.333 3.394 458 HA VAL 541 HA VAL 541 9.826 -15.157 5.485 459 HB VAL 541 HB VAL 541 6.811 -15.337 5.393 460 HG11 VAL 541 HG11 VAL 541 7.912 -16.765 7.090 461 HG12 VAL 541 HG12 VAL 541 8.675 -15.323 7.765 462 HG13 VAL 541 HG13 VAL 541 6.919 -15.491 7.796 463 HG21 VAL 541 HG21 VAL 541 7.338 -13.059 5.105 464 HG22 VAL 541 HG22 VAL 541 6.996 -13.245 6.825 465 HG23 VAL 541 HG23 VAL 541 8.664 -13.135 6.265 466 H LEU 542 H LEU 542 7.739 -16.743 3.160 467 HA LEU 542 HA LEU 542 7.735 -19.311 4.337 468 HB2 LEU 542 HB2 LEU 542 7.253 -18.289 1.562 469 HB3 LEU 542 HB3 LEU 542 7.282 -20.019 1.894 470 HG LEU 542 HG LEU 542 5.480 -19.459 3.673 471 HD11 LEU 542 HD11 LEU 542 5.680 -17.052 3.605 472 HD12 LEU 542 HD12 LEU 542 4.079 -17.533 3.044 473 HD13 LEU 542 HD13 LEU 542 5.309 -17.041 1.881 474 HD21 LEU 542 HD21 LEU 542 5.029 -19.448 0.698 475 HD22 LEU 542 HD22 LEU 542 3.715 -19.543 1.871 476 HD23 LEU 542 HD23 LEU 542 4.937 -20.814 1.809 477 H GLN 543 H GLN 543 10.113 -17.570 2.569 478 HA GLN 543 HA GLN 543 11.600 -19.897 1.734 479 HB2 GLN 543 HB2 GLN 543 12.000 -16.938 1.555 480 HB3 GLN 543 HB3 GLN 543 13.376 -18.005 1.310 481 HG2 GLN 543 HG2 GLN 543 12.381 -19.019 -0.570 482 HG3 GLN 543 HG3 GLN 543 10.809 -18.304 -0.216 483 HE21 GLN 543 HE21 GLN 543 11.382 -17.867 -2.637 484 HE22 GLN 543 HE22 GLN 543 12.053 -16.304 -2.942 485 H HIS 544 H HIS 544 12.310 -17.189 3.949 486 HA HIS 544 HA HIS 544 14.538 -18.508 5.131 487 HB2 HIS 544 HB2 HIS 544 12.959 -16.043 5.804 488 HB3 HIS 544 HB3 HIS 544 14.182 -16.652 6.914 489 HD1 HIS 544 HD1 HIS 544 13.766 -14.539 4.001 490 HD2 HIS 544 HD2 HIS 544 16.842 -16.789 5.656 491 HE1 HIS 544 HE1 HIS 544 15.877 -13.673 2.943 492 H PHE 545 H PHE 545 11.290 -17.740 6.390 493 HA PHE 545 HA PHE 545 11.692 -19.548 8.624 494 HB2 PHE 545 HB2 PHE 545 9.587 -17.562 7.853 495 HB3 PHE 545 HB3 PHE 545 9.205 -18.806 9.039 496 HD1 PHE 545 HD1 PHE 545 9.367 -18.132 11.215 497 HD2 PHE 545 HD2 PHE 545 12.054 -16.489 8.353 498 HE1 PHE 545 HE1 PHE 545 10.409 -16.770 12.980 499 HE2 PHE 545 HE2 PHE 545 13.101 -15.126 10.113 500 HZ PHE 545 HZ PHE 545 12.279 -15.265 12.430 501 H THR 546 H THR 546 11.825 -20.946 6.283 502 HA THR 546 HA THR 546 9.281 -22.069 5.571 503 HB THR 546 HB THR 546 11.258 -21.921 4.011 504 HG1 THR 546 HG1 THR 546 9.947 -24.405 4.470 505 HG21 THR 546 HG21 THR 546 13.069 -23.382 4.176 506 HG22 THR 546 HG22 THR 546 12.236 -24.439 5.316 507 HG23 THR 546 HG23 THR 546 12.823 -22.862 5.843 508 H ARG 547 H ARG 547 11.843 -22.846 7.805 509 HA ARG 547 HA ARG 547 10.449 -25.338 8.525 510 HB2 ARG 547 HB2 ARG 547 12.511 -26.179 9.383 511 HB3 ARG 547 HB3 ARG 547 12.848 -25.512 7.791 512 HG2 ARG 547 HG2 ARG 547 14.553 -24.487 8.798 513 HG3 ARG 547 HG3 ARG 547 13.329 -23.369 9.405 514 HD2 ARG 547 HD2 ARG 547 13.231 -24.424 11.487 515 HD3 ARG 547 HD3 ARG 547 13.996 -25.892 10.880 516 HE ARG 547 HE ARG 547 15.924 -24.030 10.562 517 HH11 ARG 547 HH11 ARG 547 13.924 -24.945 13.261 518 HH12 ARG 547 HH12 ARG 547 15.110 -24.523 14.451 519 HH21 ARG 547 HH21 ARG 547 17.494 -23.470 12.119 520 HH22 ARG 547 HH22 ARG 547 17.140 -23.683 13.801 521 H THR 548 H THR 548 11.391 -22.212 9.604 522 HA THR 548 HA THR 548 10.630 -22.874 12.369 523 HB THR 548 HB THR 548 12.155 -20.475 11.335 524 HG1 THR 548 HG1 THR 548 13.782 -21.806 11.533 525 HG21 THR 548 HG21 THR 548 12.544 -20.597 14.045 526 HG22 THR 548 HG22 THR 548 10.846 -21.050 13.890 527 HG23 THR 548 HG23 THR 548 11.415 -19.517 13.228 528 H ARG 549 H ARG 549 8.745 -22.171 13.127 529 HA ARG 549 HA ARG 549 7.570 -19.709 12.131 530 HB2 ARG 549 HB2 ARG 549 6.337 -22.422 11.734 531 HB3 ARG 549 HB3 ARG 549 5.336 -20.982 11.859 532 HG2 ARG 549 HG2 ARG 549 5.593 -20.773 9.664 533 HG3 ARG 549 HG3 ARG 549 7.251 -20.274 10.005 534 HD2 ARG 549 HD2 ARG 549 7.423 -22.000 8.412 535 HD3 ARG 549 HD3 ARG 549 7.851 -22.736 9.956 536 HE ARG 549 HE ARG 549 5.073 -23.006 9.234 537 HH11 ARG 549 HH11 ARG 549 8.262 -24.386 9.018 538 HH12 ARG 549 HH12 ARG 549 7.688 -25.995 8.726 539 HH21 ARG 549 HH21 ARG 549 4.306 -25.119 8.849 540 HH22 ARG 549 HH22 ARG 549 5.438 -26.410 8.629 541 H ILE 550 H ILE 550 5.319 -19.435 13.299 542 HA ILE 550 HA ILE 550 5.002 -20.670 15.840 543 HB ILE 550 HB ILE 550 7.019 -19.016 16.071 544 HG12 ILE 550 HG12 ILE 550 5.117 -18.427 18.228 545 HG13 ILE 550 HG13 ILE 550 5.221 -20.137 17.822 546 HG21 ILE 550 HG21 ILE 550 5.324 -17.214 15.068 547 HG22 ILE 550 HG22 ILE 550 4.976 -16.999 16.783 548 HG23 ILE 550 HG23 ILE 550 6.621 -16.787 16.184 549 HD11 ILE 550 HD11 ILE 550 7.149 -20.332 18.888 550 HD12 ILE 550 HD12 ILE 550 7.843 -18.972 18.005 551 HD13 ILE 550 HD13 ILE 550 6.917 -18.686 19.478 552 H LEU 551 H LEU 551 3.527 -19.039 17.256 553 HA LEU 551 HA LEU 551 1.043 -18.975 16.258 554 HB2 LEU 551 HB2 LEU 551 0.471 -17.249 17.820 555 HB3 LEU 551 HB3 LEU 551 1.670 -18.314 18.550 556 HG LEU 551 HG LEU 551 3.307 -16.414 17.623 557 HD11 LEU 551 HD11 LEU 551 2.425 -14.326 17.448 558 HD12 LEU 551 HD12 LEU 551 1.075 -14.681 18.526 559 HD13 LEU 551 HD13 LEU 551 1.049 -15.259 16.860 560 HD21 LEU 551 HD21 LEU 551 3.174 -15.400 19.889 561 HD22 LEU 551 HD22 LEU 551 3.279 -17.161 19.903 562 HD23 LEU 551 HD23 LEU 551 1.730 -16.367 20.192 563 H ASN 552 H ASN 552 3.478 -16.467 15.713 564 HA ASN 552 HA ASN 552 1.707 -14.850 14.124 565 HB2 ASN 552 HB2 ASN 552 3.495 -13.800 15.419 566 HB3 ASN 552 HB3 ASN 552 4.705 -14.703 14.513 567 HD21 ASN 552 HD21 ASN 552 1.792 -13.024 13.417 568 HD22 ASN 552 HD22 ASN 552 2.610 -11.933 12.356 569 H LYS 553 H LYS 553 4.764 -16.522 13.348 570 HA LYS 553 HA LYS 553 4.501 -16.324 10.566 571 HB2 LYS 553 HB2 LYS 553 5.912 -18.640 11.842 572 HB3 LYS 553 HB3 LYS 553 6.366 -17.713 10.418 573 HG2 LYS 553 HG2 LYS 553 6.568 -16.856 13.294 574 HG3 LYS 553 HG3 LYS 553 7.890 -17.186 12.171 575 HD2 LYS 553 HD2 LYS 553 5.870 -14.955 11.934 576 HD3 LYS 553 HD3 LYS 553 7.551 -14.784 12.445 577 HE2 LYS 553 HE2 LYS 553 8.293 -15.595 10.258 578 HE3 LYS 553 HE3 LYS 553 6.614 -15.766 9.750 579 HZ1 LYS 553 HZ1 LYS 553 6.317 -13.493 9.669 580 HZ2 LYS 553 HZ2 LYS 553 7.901 -13.656 9.100 581 HZ3 LYS 553 HZ3 LYS 553 7.622 -13.163 10.694 582 HA PRO 554 HA PRO 554 1.688 -19.457 9.335 583 HB2 PRO 554 HB2 PRO 554 2.915 -20.569 7.183 584 HB3 PRO 554 HB3 PRO 554 2.205 -18.951 7.154 585 HG2 PRO 554 HG2 PRO 554 5.066 -19.759 7.507 586 HG3 PRO 554 HG3 PRO 554 4.386 -18.449 6.524 587 HD2 PRO 554 HD2 PRO 554 5.507 -18.018 8.951 588 HD3 PRO 554 HD3 PRO 554 4.161 -17.038 8.333 589 H MET 555 H MET 555 2.261 -20.620 11.412 590 HA MET 555 HA MET 555 4.103 -22.767 11.405 591 HB2 MET 555 HB2 MET 555 3.411 -21.896 13.510 592 HB3 MET 555 HB3 MET 555 1.712 -22.140 13.131 593 HG2 MET 555 HG2 MET 555 2.427 -23.800 14.706 594 HG3 MET 555 HG3 MET 555 2.079 -24.571 13.160 595 HE1 MET 555 HE1 MET 555 4.349 -26.572 15.047 596 HE2 MET 555 HE2 MET 555 5.299 -25.279 15.779 597 HE3 MET 555 HE3 MET 555 3.536 -25.206 15.812 598 H ASN 556 H ASN 556 0.562 -22.693 11.025 599 HA ASN 556 HA ASN 556 0.697 -25.024 9.306 600 HB2 ASN 556 HB2 ASN 556 0.483 -25.795 11.754 601 HB3 ASN 556 HB3 ASN 556 -1.153 -25.147 11.680 602 HD21 ASN 556 HD21 ASN 556 0.943 -27.089 9.568 603 HD22 ASN 556 HD22 ASN 556 -0.232 -28.315 9.249 604 H MET 557 H MET 557 0.085 -22.636 8.381 605 HA MET 557 HA MET 557 -2.829 -22.344 8.414 606 HB2 MET 557 HB2 MET 557 -2.433 -20.194 7.292 607 HB3 MET 557 HB3 MET 557 -1.540 -20.310 8.803 608 HG2 MET 557 HG2 MET 557 0.480 -20.330 7.775 609 HG3 MET 557 HG3 MET 557 -0.136 -21.134 6.333 610 HE1 MET 557 HE1 MET 557 0.256 -16.797 7.362 611 HE2 MET 557 HE2 MET 557 -1.377 -17.295 7.802 612 HE3 MET 557 HE3 MET 557 0.015 -18.150 8.468 613 H GLN 558 H GLN 558 -3.533 -21.395 6.075 614 HA GLN 558 HA GLN 558 -2.355 -22.766 3.850 615 HB2 GLN 558 HB2 GLN 558 -4.071 -24.319 3.363 616 HB3 GLN 558 HB3 GLN 558 -3.697 -24.547 5.066 617 HG2 GLN 558 HG2 GLN 558 -5.645 -23.105 5.620 618 HG3 GLN 558 HG3 GLN 558 -6.051 -23.079 3.905 619 HE21 GLN 558 HE21 GLN 558 -7.894 -23.989 5.636 620 HE22 GLN 558 HE22 GLN 558 -8.070 -25.702 5.498 621 H LEU 559 H LEU 559 -2.980 -21.901 1.915 622 HA LEU 559 HA LEU 559 -4.356 -19.404 1.992 623 HB2 LEU 559 HB2 LEU 559 -2.485 -19.853 0.469 624 HB3 LEU 559 HB3 LEU 559 -3.466 -21.051 -0.372 625 HG LEU 559 HG LEU 559 -3.180 -18.731 -1.436 626 HD11 LEU 559 HD11 LEU 559 -5.174 -18.990 -2.565 627 HD12 LEU 559 HD12 LEU 559 -6.052 -19.486 -1.119 628 HD13 LEU 559 HD13 LEU 559 -4.927 -20.602 -1.893 629 HD21 LEU 559 HD21 LEU 559 -3.678 -17.518 0.694 630 HD22 LEU 559 HD22 LEU 559 -5.355 -18.041 0.532 631 HD23 LEU 559 HD23 LEU 559 -4.634 -16.994 -0.692 632 H LEU 560 H LEU 560 -6.465 -19.054 1.844 633 HA LEU 560 HA LEU 560 -8.149 -21.124 0.594 634 HB2 LEU 560 HB2 LEU 560 -9.791 -20.836 2.192 635 HB3 LEU 560 HB3 LEU 560 -8.306 -20.719 3.134 636 HG LEU 560 HG LEU 560 -8.699 -18.119 2.639 637 HD11 LEU 560 HD11 LEU 560 -10.814 -17.486 2.219 638 HD12 LEU 560 HD12 LEU 560 -11.509 -18.801 3.165 639 HD13 LEU 560 HD13 LEU 560 -10.955 -19.099 1.518 640 HD21 LEU 560 HD21 LEU 560 -10.380 -18.721 4.838 641 HD22 LEU 560 HD22 LEU 560 -8.697 -18.192 4.855 642 HD23 LEU 560 HD23 LEU 560 -9.081 -19.914 4.811 643 H GLY 561 H GLY 561 -7.430 -17.727 0.914 644 HA2 GLY 561 HA2 GLY 561 -9.676 -16.945 -0.766 645 HA3 GLY 561 HA3 GLY 561 -8.496 -15.868 -0.034 646 H ASP 562 H ASP 562 -8.556 -14.855 -2.185 647 HA ASP 562 HA ASP 562 -6.365 -15.824 -3.786 648 HB2 ASP 562 HB2 ASP 562 -8.543 -16.971 -4.604 649 HB3 ASP 562 HB3 ASP 562 -8.948 -15.387 -5.258 650 H ALA 563 H ALA 563 -5.586 -14.256 -5.288 651 HA ALA 563 HA ALA 563 -5.848 -11.586 -4.377 652 HB1 ALA 563 HB1 ALA 563 -3.957 -11.290 -5.509 653 HB2 ALA 563 HB2 ALA 563 -4.041 -12.997 -5.946 654 HB3 ALA 563 HB3 ALA 563 -4.712 -11.777 -7.028 655 H GLN 564 H GLN 564 -7.304 -10.094 -4.889 656 HA GLN 564 HA GLN 564 -9.499 -10.549 -6.534 657 HB2 GLN 564 HB2 GLN 564 -8.970 -8.700 -4.707 658 HB3 GLN 564 HB3 GLN 564 -8.561 -7.749 -6.128 659 HG2 GLN 564 HG2 GLN 564 -10.812 -7.273 -5.618 660 HG3 GLN 564 HG3 GLN 564 -10.827 -8.318 -7.038 661 HE21 GLN 564 HE21 GLN 564 -12.651 -9.435 -6.885 662 HE22 GLN 564 HE22 GLN 564 -13.154 -10.353 -5.511 Start of MODEL 10 1 H MET 480 H MET 480 1.478 0.761 0.829 2 HA MET 480 HA MET 480 1.479 0.266 -1.790 3 HB2 MET 480 HB2 MET 480 3.730 0.984 0.040 4 HB3 MET 480 HB3 MET 480 4.081 0.674 -1.655 5 HG2 MET 480 HG2 MET 480 1.863 2.536 -1.021 6 HG3 MET 480 HG3 MET 480 3.514 3.089 -0.747 7 HE1 MET 480 HE1 MET 480 1.306 4.335 -3.383 8 HE2 MET 480 HE2 MET 480 2.469 4.891 -2.179 9 HE3 MET 480 HE3 MET 480 2.864 4.983 -3.896 10 H ALA 481 H ALA 481 1.455 -1.585 -2.878 11 HA ALA 481 HA ALA 481 3.350 -3.701 -2.088 12 HB1 ALA 481 HB1 ALA 481 1.594 -5.046 -1.910 13 HB2 ALA 481 HB2 ALA 481 0.512 -3.798 -2.528 14 HB3 ALA 481 HB3 ALA 481 1.346 -4.874 -3.648 15 H ASP 482 H ASP 482 3.395 -5.332 -4.161 16 HA ASP 482 HA ASP 482 4.593 -3.702 -6.264 17 HB2 ASP 482 HB2 ASP 482 5.466 -5.976 -5.057 18 HB3 ASP 482 HB3 ASP 482 4.695 -6.644 -6.493 19 H VAL 483 H VAL 483 2.054 -6.104 -5.801 20 HA VAL 483 HA VAL 483 0.970 -5.355 -8.431 21 HB VAL 483 HB VAL 483 1.982 -7.519 -8.758 22 HG11 VAL 483 HG11 VAL 483 1.502 -9.442 -7.427 23 HG12 VAL 483 HG12 VAL 483 1.982 -8.142 -6.334 24 HG13 VAL 483 HG13 VAL 483 0.279 -8.568 -6.505 25 HG21 VAL 483 HG21 VAL 483 0.048 -8.800 -9.479 26 HG22 VAL 483 HG22 VAL 483 -1.006 -7.824 -8.455 27 HG23 VAL 483 HG23 VAL 483 -0.188 -7.089 -9.834 28 H GLY 484 H GLY 484 0.357 -6.722 -5.228 29 HA2 GLY 484 HA2 GLY 484 -1.534 -5.611 -4.038 30 HA3 GLY 484 HA3 GLY 484 -2.461 -5.873 -5.508 31 H ASP 485 H ASP 485 -0.231 -8.264 -4.294 32 HA ASP 485 HA ASP 485 -1.993 -10.386 -4.398 33 HB2 ASP 485 HB2 ASP 485 0.626 -10.222 -3.938 34 HB3 ASP 485 HB3 ASP 485 0.094 -10.435 -2.272 35 H MET 486 H MET 486 -3.952 -10.286 -3.456 36 HA MET 486 HA MET 486 -4.027 -9.794 -0.551 37 HB2 MET 486 HB2 MET 486 -5.230 -8.206 -2.361 38 HB3 MET 486 HB3 MET 486 -6.504 -9.396 -2.131 39 HG2 MET 486 HG2 MET 486 -7.069 -8.546 -0.163 40 HG3 MET 486 HG3 MET 486 -5.396 -8.517 0.389 41 HE1 MET 486 HE1 MET 486 -7.659 -7.079 -2.200 42 HE2 MET 486 HE2 MET 486 -7.618 -5.331 -1.974 43 HE3 MET 486 HE3 MET 486 -6.355 -6.129 -2.913 44 H GLN 487 H GLN 487 -4.544 -11.534 0.586 45 HA GLN 487 HA GLN 487 -6.613 -13.341 -0.341 46 HB2 GLN 487 HB2 GLN 487 -3.852 -14.386 0.303 47 HB3 GLN 487 HB3 GLN 487 -5.257 -15.347 -0.140 48 HG2 GLN 487 HG2 GLN 487 -5.269 -14.312 -2.351 49 HG3 GLN 487 HG3 GLN 487 -3.860 -13.351 -1.907 50 HE21 GLN 487 HE21 GLN 487 -4.223 -15.327 -4.039 51 HE22 GLN 487 HE22 GLN 487 -2.996 -16.518 -3.793 52 H LEU 488 H LEU 488 -6.861 -15.180 1.372 53 HA LEU 488 HA LEU 488 -6.578 -13.950 4.036 54 HB2 LEU 488 HB2 LEU 488 -8.908 -14.161 3.057 55 HB3 LEU 488 HB3 LEU 488 -8.715 -15.905 3.225 56 HG LEU 488 HG LEU 488 -8.404 -15.562 5.678 57 HD11 LEU 488 HD11 LEU 488 -9.651 -13.110 6.071 58 HD12 LEU 488 HD12 LEU 488 -8.429 -12.799 4.839 59 HD13 LEU 488 HD13 LEU 488 -7.961 -13.505 6.386 60 HD21 LEU 488 HD21 LEU 488 -10.678 -15.557 6.117 61 HD22 LEU 488 HD22 LEU 488 -10.618 -16.040 4.421 62 HD23 LEU 488 HD23 LEU 488 -11.025 -14.378 4.851 63 H TYR 489 H TYR 489 -4.973 -14.950 5.066 64 HA TYR 489 HA TYR 489 -4.667 -17.854 4.745 65 HB2 TYR 489 HB2 TYR 489 -2.695 -15.975 6.042 66 HB3 TYR 489 HB3 TYR 489 -2.405 -17.607 5.451 67 HD1 TYR 489 HD1 TYR 489 -3.002 -14.111 4.434 68 HD2 TYR 489 HD2 TYR 489 -1.904 -18.017 3.153 69 HE1 TYR 489 HE1 TYR 489 -2.275 -13.191 2.272 70 HE2 TYR 489 HE2 TYR 489 -1.173 -17.108 0.988 71 HH TYR 489 HH TYR 489 -1.702 -13.737 0.138 72 H ARG 490 H ARG 490 -5.546 -19.070 6.269 73 HA ARG 490 HA ARG 490 -5.954 -17.947 8.946 74 HB2 ARG 490 HB2 ARG 490 -7.581 -19.699 9.283 75 HB3 ARG 490 HB3 ARG 490 -7.911 -18.897 7.754 76 HG2 ARG 490 HG2 ARG 490 -8.058 -20.974 6.945 77 HG3 ARG 490 HG3 ARG 490 -6.294 -20.925 6.951 78 HD2 ARG 490 HD2 ARG 490 -6.593 -22.851 8.122 79 HD3 ARG 490 HD3 ARG 490 -6.664 -21.705 9.461 80 HE ARG 490 HE ARG 490 -8.888 -22.202 9.730 81 HH11 ARG 490 HH11 ARG 490 -7.782 -23.455 6.676 82 HH12 ARG 490 HH12 ARG 490 -9.232 -24.352 6.371 83 HH21 ARG 490 HH21 ARG 490 -10.802 -23.379 9.339 84 HH22 ARG 490 HH22 ARG 490 -10.950 -24.308 7.886 85 H ILE 491 H ILE 491 -4.870 -18.664 10.674 86 HA ILE 491 HA ILE 491 -2.937 -20.829 10.269 87 HB ILE 491 HB ILE 491 -1.798 -20.005 12.246 88 HG12 ILE 491 HG12 ILE 491 -3.969 -17.903 12.395 89 HG13 ILE 491 HG13 ILE 491 -3.836 -19.286 13.476 90 HG21 ILE 491 HG21 ILE 491 -1.916 -17.399 11.204 91 HG22 ILE 491 HG22 ILE 491 -0.753 -18.666 10.818 92 HG23 ILE 491 HG23 ILE 491 -2.218 -18.491 9.852 93 HD11 ILE 491 HD11 ILE 491 -1.815 -17.076 13.185 94 HD12 ILE 491 HD12 ILE 491 -2.968 -17.267 14.506 95 HD13 ILE 491 HD13 ILE 491 -1.688 -18.458 14.273 96 H GLU 492 H GLU 492 -2.521 -22.270 12.158 97 HA GLU 492 HA GLU 492 -5.073 -23.228 13.202 98 HB2 GLU 492 HB2 GLU 492 -3.334 -24.710 12.024 99 HB3 GLU 492 HB3 GLU 492 -2.410 -24.594 13.515 100 HG2 GLU 492 HG2 GLU 492 -4.349 -25.522 14.738 101 HG3 GLU 492 HG3 GLU 492 -5.174 -25.736 13.196 102 H VAL 493 H VAL 493 -4.339 -20.901 14.413 103 HA VAL 493 HA VAL 493 -3.825 -21.812 17.144 104 HB VAL 493 HB VAL 493 -2.472 -19.322 16.140 105 HG11 VAL 493 HG11 VAL 493 -1.180 -19.482 18.131 106 HG12 VAL 493 HG12 VAL 493 -2.868 -19.713 18.592 107 HG13 VAL 493 HG13 VAL 493 -1.788 -21.102 18.470 108 HG21 VAL 493 HG21 VAL 493 -1.471 -20.954 14.780 109 HG22 VAL 493 HG22 VAL 493 -0.370 -20.768 16.145 110 HG23 VAL 493 HG23 VAL 493 -1.463 -22.151 16.074 111 H GLY 494 H GLY 494 -4.873 -20.638 18.722 112 HA2 GLY 494 HA2 GLY 494 -6.247 -18.172 17.992 113 HA3 GLY 494 HA3 GLY 494 -7.272 -19.539 18.405 114 H ARG 495 H ARG 495 -7.934 -17.830 20.040 115 HA ARG 495 HA ARG 495 -6.342 -16.978 22.134 116 HB2 ARG 495 HB2 ARG 495 -8.498 -16.939 23.466 117 HB3 ARG 495 HB3 ARG 495 -8.519 -16.062 21.941 118 HG2 ARG 495 HG2 ARG 495 -9.681 -17.922 20.876 119 HG3 ARG 495 HG3 ARG 495 -9.645 -18.817 22.397 120 HD2 ARG 495 HD2 ARG 495 -11.036 -17.167 23.459 121 HD3 ARG 495 HD3 ARG 495 -10.958 -16.128 22.037 122 HE ARG 495 HE ARG 495 -12.049 -18.731 21.503 123 HH11 ARG 495 HH11 ARG 495 -12.758 -15.498 22.582 124 HH12 ARG 495 HH12 ARG 495 -14.431 -15.577 22.139 125 HH21 ARG 495 HH21 ARG 495 -14.250 -18.847 20.914 126 HH22 ARG 495 HH22 ARG 495 -15.279 -17.483 21.191 127 H ASP 496 H ASP 496 -8.140 -20.012 21.811 128 HA ASP 496 HA ASP 496 -7.624 -21.030 24.372 129 HB2 ASP 496 HB2 ASP 496 -9.168 -21.876 22.386 130 HB3 ASP 496 HB3 ASP 496 -7.772 -22.896 22.047 131 H ASP 497 H ASP 497 -5.576 -20.634 21.657 132 HA ASP 497 HA ASP 497 -3.631 -22.584 22.629 133 HB2 ASP 497 HB2 ASP 497 -4.239 -22.259 20.151 134 HB3 ASP 497 HB3 ASP 497 -3.279 -20.785 20.240 135 H GLY 498 H GLY 498 -3.991 -19.102 22.122 136 HA2 GLY 498 HA2 GLY 498 -2.892 -17.887 24.098 137 HA3 GLY 498 HA3 GLY 498 -1.433 -18.682 23.524 138 H VAL 499 H VAL 499 -3.976 -17.338 21.490 139 HA VAL 499 HA VAL 499 -2.187 -15.133 20.736 140 HB VAL 499 HB VAL 499 -2.163 -17.174 19.121 141 HG11 VAL 499 HG11 VAL 499 -3.947 -17.588 17.792 142 HG12 VAL 499 HG12 VAL 499 -4.832 -16.922 19.166 143 HG13 VAL 499 HG13 VAL 499 -4.465 -15.903 17.773 144 HG21 VAL 499 HG21 VAL 499 -1.343 -15.766 17.560 145 HG22 VAL 499 HG22 VAL 499 -2.780 -14.743 17.572 146 HG23 VAL 499 HG23 VAL 499 -1.558 -14.561 18.830 147 H GLU 500 H GLU 500 -3.217 -13.279 19.923 148 HA GLU 500 HA GLU 500 -6.149 -13.244 20.194 149 HB2 GLU 500 HB2 GLU 500 -4.416 -10.914 20.984 150 HB3 GLU 500 HB3 GLU 500 -6.108 -11.200 21.370 151 HG2 GLU 500 HG2 GLU 500 -3.742 -12.705 22.462 152 HG3 GLU 500 HG3 GLU 500 -4.738 -11.534 23.324 153 H VAL 501 H VAL 501 -6.735 -10.740 19.426 154 HA VAL 501 HA VAL 501 -6.265 -10.833 16.598 155 HB VAL 501 HB VAL 501 -7.688 -8.748 18.259 156 HG11 VAL 501 HG11 VAL 501 -7.468 -7.541 16.372 157 HG12 VAL 501 HG12 VAL 501 -7.090 -8.955 15.387 158 HG13 VAL 501 HG13 VAL 501 -8.767 -8.578 15.783 159 HG21 VAL 501 HG21 VAL 501 -9.039 -10.756 16.508 160 HG22 VAL 501 HG22 VAL 501 -8.524 -11.216 18.130 161 HG23 VAL 501 HG23 VAL 501 -9.665 -9.889 17.910 162 H ARG 502 H ARG 502 -5.039 -8.980 19.296 163 HA ARG 502 HA ARG 502 -3.664 -7.095 17.565 164 HB2 ARG 502 HB2 ARG 502 -2.841 -6.123 19.698 165 HB3 ARG 502 HB3 ARG 502 -4.595 -6.214 19.608 166 HG2 ARG 502 HG2 ARG 502 -4.691 -7.999 21.128 167 HG3 ARG 502 HG3 ARG 502 -2.964 -8.329 20.972 168 HD2 ARG 502 HD2 ARG 502 -2.369 -6.481 22.254 169 HD3 ARG 502 HD3 ARG 502 -3.924 -5.688 22.004 170 HE ARG 502 HE ARG 502 -4.106 -8.157 23.464 171 HH11 ARG 502 HH11 ARG 502 -3.553 -4.728 23.693 172 HH12 ARG 502 HH12 ARG 502 -4.043 -4.627 25.352 173 HH21 ARG 502 HH21 ARG 502 -4.753 -8.038 25.648 174 HH22 ARG 502 HH22 ARG 502 -4.725 -6.511 26.463 175 H HIS 503 H HIS 503 -3.114 -10.189 18.518 176 HA HIS 503 HA HIS 503 -0.276 -9.973 19.038 177 HB2 HIS 503 HB2 HIS 503 -2.010 -11.755 19.924 178 HB3 HIS 503 HB3 HIS 503 -1.610 -12.577 18.418 179 HD1 HIS 503 HD1 HIS 503 -0.891 -13.689 21.260 180 HD2 HIS 503 HD2 HIS 503 1.690 -11.592 18.770 181 HE1 HIS 503 HE1 HIS 503 1.426 -14.352 21.981 182 H ILE 504 H ILE 504 -2.248 -11.581 16.535 183 HA ILE 504 HA ILE 504 -0.029 -12.051 14.819 184 HB ILE 504 HB ILE 504 -1.555 -12.908 13.251 185 HG12 ILE 504 HG12 ILE 504 -3.005 -10.848 13.242 186 HG13 ILE 504 HG13 ILE 504 -3.885 -12.368 13.124 187 HG21 ILE 504 HG21 ILE 504 -1.441 -14.238 15.279 188 HG22 ILE 504 HG22 ILE 504 -2.765 -13.311 15.982 189 HG23 ILE 504 HG23 ILE 504 -3.055 -14.332 14.574 190 HD11 ILE 504 HD11 ILE 504 -3.575 -10.649 15.571 191 HD12 ILE 504 HD12 ILE 504 -5.038 -10.895 14.618 192 HD13 ILE 504 HD13 ILE 504 -4.355 -12.230 15.545 193 H VAL 505 H VAL 505 -2.189 -9.386 15.289 194 HA VAL 505 HA VAL 505 -1.648 -8.138 12.751 195 HB VAL 505 HB VAL 505 -3.012 -7.140 15.249 196 HG11 VAL 505 HG11 VAL 505 -2.547 -5.077 14.524 197 HG12 VAL 505 HG12 VAL 505 -1.989 -5.658 12.954 198 HG13 VAL 505 HG13 VAL 505 -3.711 -5.405 13.241 199 HG21 VAL 505 HG21 VAL 505 -4.350 -7.398 12.611 200 HG22 VAL 505 HG22 VAL 505 -3.983 -8.878 13.497 201 HG23 VAL 505 HG23 VAL 505 -4.994 -7.636 14.235 202 H GLY 506 H GLY 506 -0.888 -7.253 16.130 203 HA2 GLY 506 HA2 GLY 506 0.851 -5.149 15.528 204 HA3 GLY 506 HA3 GLY 506 0.864 -6.072 17.023 205 H ALA 507 H ALA 507 1.340 -8.546 15.284 206 HA ALA 507 HA ALA 507 4.187 -8.519 15.528 207 HB1 ALA 507 HB1 ALA 507 2.826 -10.533 15.937 208 HB2 ALA 507 HB2 ALA 507 2.426 -10.588 14.220 209 HB3 ALA 507 HB3 ALA 507 4.096 -10.804 14.744 210 H ILE 508 H ILE 508 2.073 -9.052 12.698 211 HA ILE 508 HA ILE 508 4.196 -8.727 10.832 212 HB ILE 508 HB ILE 508 2.441 -8.706 9.113 213 HG12 ILE 508 HG12 ILE 508 0.076 -9.281 10.298 214 HG13 ILE 508 HG13 ILE 508 0.747 -8.163 11.480 215 HG21 ILE 508 HG21 ILE 508 3.286 -10.816 10.219 216 HG22 ILE 508 HG22 ILE 508 1.795 -10.812 11.159 217 HG23 ILE 508 HG23 ILE 508 1.729 -10.941 9.401 218 HD11 ILE 508 HD11 ILE 508 0.214 -6.437 10.209 219 HD12 ILE 508 HD12 ILE 508 1.099 -7.113 8.841 220 HD13 ILE 508 HD13 ILE 508 -0.589 -7.552 9.103 221 H ALA 509 H ALA 509 1.885 -6.567 12.302 222 HA ALA 509 HA ALA 509 2.225 -4.413 10.465 223 HB1 ALA 509 HB1 ALA 509 0.261 -4.727 11.991 224 HB2 ALA 509 HB2 ALA 509 1.298 -4.216 13.323 225 HB3 ALA 509 HB3 ALA 509 0.955 -3.106 11.997 226 H ASN 510 H ASN 510 3.979 -5.553 13.227 227 HA ASN 510 HA ASN 510 5.506 -3.071 13.433 228 HB2 ASN 510 HB2 ASN 510 4.711 -4.249 15.494 229 HB3 ASN 510 HB3 ASN 510 5.773 -5.592 15.082 230 HD21 ASN 510 HD21 ASN 510 6.438 -4.879 17.354 231 HD22 ASN 510 HD22 ASN 510 7.749 -3.757 17.434 232 H GLU 511 H GLU 511 5.751 -6.305 12.210 233 HA GLU 511 HA GLU 511 8.572 -6.475 12.045 234 HB2 GLU 511 HB2 GLU 511 6.289 -7.913 10.753 235 HB3 GLU 511 HB3 GLU 511 7.916 -8.150 10.129 236 HG2 GLU 511 HG2 GLU 511 7.102 -8.595 12.991 237 HG3 GLU 511 HG3 GLU 511 7.219 -9.860 11.768 238 H GLY 512 H GLY 512 6.087 -5.391 9.761 239 HA2 GLY 512 HA2 GLY 512 8.256 -4.268 8.096 240 HA3 GLY 512 HA3 GLY 512 6.769 -4.916 7.421 241 H ASP 513 H ASP 513 6.149 -3.034 6.399 242 HA ASP 513 HA ASP 513 5.850 -0.606 7.982 243 HB2 ASP 513 HB2 ASP 513 5.819 -1.268 5.081 244 HB3 ASP 513 HB3 ASP 513 4.882 0.129 5.603 245 H ILE 514 H ILE 514 4.016 -3.302 7.102 246 HA ILE 514 HA ILE 514 1.467 -2.355 6.662 247 HB ILE 514 HB ILE 514 2.234 -4.766 8.312 248 HG12 ILE 514 HG12 ILE 514 1.361 -4.822 5.443 249 HG13 ILE 514 HG13 ILE 514 3.039 -4.468 5.842 250 HG21 ILE 514 HG21 ILE 514 -0.369 -3.839 7.156 251 HG22 ILE 514 HG22 ILE 514 -0.053 -5.553 7.421 252 HG23 ILE 514 HG23 ILE 514 -0.019 -4.430 8.780 253 HD11 ILE 514 HD11 ILE 514 2.513 -6.862 5.308 254 HD12 ILE 514 HD12 ILE 514 3.337 -6.586 6.843 255 HD13 ILE 514 HD13 ILE 514 1.606 -6.918 6.819 256 H SER 515 H SER 515 -0.225 -1.664 7.912 257 HA SER 515 HA SER 515 0.422 -1.029 10.716 258 HB2 SER 515 HB2 SER 515 -0.029 0.828 8.882 259 HB3 SER 515 HB3 SER 515 -1.715 0.450 9.237 260 HG SER 515 HG SER 515 0.114 1.821 10.724 261 H SER 516 H SER 516 -1.633 -0.712 12.067 262 HA SER 516 HA SER 516 -3.028 -3.173 12.127 263 HB2 SER 516 HB2 SER 516 -2.508 -1.566 14.076 264 HB3 SER 516 HB3 SER 516 -3.945 -0.684 13.558 265 HG SER 516 HG SER 516 -4.978 -2.876 13.696 266 H ARG 517 H ARG 517 -3.624 -0.178 10.542 267 HA ARG 517 HA ARG 517 -6.437 -0.826 10.075 268 HB2 ARG 517 HB2 ARG 517 -6.468 1.416 8.937 269 HB3 ARG 517 HB3 ARG 517 -6.076 1.460 10.650 270 HG2 ARG 517 HG2 ARG 517 -3.797 1.876 10.223 271 HG3 ARG 517 HG3 ARG 517 -3.965 1.459 8.516 272 HD2 ARG 517 HD2 ARG 517 -5.617 3.685 9.589 273 HD3 ARG 517 HD3 ARG 517 -3.895 3.973 9.343 274 HE ARG 517 HE ARG 517 -4.707 2.868 7.000 275 HH11 ARG 517 HH11 ARG 517 -5.785 5.574 8.905 276 HH12 ARG 517 HH12 ARG 517 -6.346 6.480 7.539 277 HH21 ARG 517 HH21 ARG 517 -5.442 4.050 5.193 278 HH22 ARG 517 HH22 ARG 517 -6.152 5.611 5.428 279 H TYR 518 H TYR 518 -3.361 -0.595 8.414 280 HA TYR 518 HA TYR 518 -4.254 -0.696 5.767 281 HB2 TYR 518 HB2 TYR 518 -1.790 -0.675 7.047 282 HB3 TYR 518 HB3 TYR 518 -1.809 -2.219 6.203 283 HD1 TYR 518 HD1 TYR 518 -3.217 -1.667 3.742 284 HD2 TYR 518 HD2 TYR 518 -0.445 0.777 5.850 285 HE1 TYR 518 HE1 TYR 518 -2.633 -0.529 1.642 286 HE2 TYR 518 HE2 TYR 518 0.146 1.923 3.756 287 HH TYR 518 HH TYR 518 -0.030 1.843 1.500 288 H ILE 519 H ILE 519 -3.718 -3.251 8.127 289 HA ILE 519 HA ILE 519 -3.877 -5.471 6.448 290 HB ILE 519 HB ILE 519 -4.845 -5.231 9.300 291 HG12 ILE 519 HG12 ILE 519 -2.295 -6.578 8.637 292 HG13 ILE 519 HG13 ILE 519 -2.313 -4.830 8.428 293 HG21 ILE 519 HG21 ILE 519 -5.779 -7.190 8.211 294 HG22 ILE 519 HG22 ILE 519 -4.174 -7.671 7.661 295 HG23 ILE 519 HG23 ILE 519 -4.552 -7.668 9.384 296 HD11 ILE 519 HD11 ILE 519 -1.512 -5.288 10.609 297 HD12 ILE 519 HD12 ILE 519 -3.150 -4.653 10.777 298 HD13 ILE 519 HD13 ILE 519 -2.853 -6.384 10.940 299 H GLY 520 H GLY 520 -5.554 -6.761 5.733 300 HA2 GLY 520 HA2 GLY 520 -8.038 -5.428 5.241 301 HA3 GLY 520 HA3 GLY 520 -7.629 -7.072 4.775 302 H ASN 521 H ASN 521 -8.950 -8.523 5.620 303 HA ASN 521 HA ASN 521 -10.377 -7.903 8.089 304 HB2 ASN 521 HB2 ASN 521 -10.738 -10.197 6.147 305 HB3 ASN 521 HB3 ASN 521 -11.783 -9.840 7.519 306 HD21 ASN 521 HD21 ASN 521 -11.238 -9.339 4.258 307 HD22 ASN 521 HD22 ASN 521 -12.362 -8.052 4.001 308 H ILE 522 H ILE 522 -9.850 -8.753 9.992 309 HA ILE 522 HA ILE 522 -8.066 -11.100 10.026 310 HB ILE 522 HB ILE 522 -8.150 -8.938 12.127 311 HG12 ILE 522 HG12 ILE 522 -5.679 -8.865 10.808 312 HG13 ILE 522 HG13 ILE 522 -6.879 -8.965 9.524 313 HG21 ILE 522 HG21 ILE 522 -6.339 -9.996 13.125 314 HG22 ILE 522 HG22 ILE 522 -7.359 -11.342 12.621 315 HG23 ILE 522 HG23 ILE 522 -5.941 -10.906 11.667 316 HD11 ILE 522 HD11 ILE 522 -7.014 -6.755 9.724 317 HD12 ILE 522 HD12 ILE 522 -7.939 -7.070 11.193 318 HD13 ILE 522 HD13 ILE 522 -6.206 -6.759 11.291 319 H LYS 523 H LYS 523 -8.711 -12.822 11.163 320 HA LYS 523 HA LYS 523 -11.056 -12.510 12.921 321 HB2 LYS 523 HB2 LYS 523 -11.470 -13.797 10.819 322 HB3 LYS 523 HB3 LYS 523 -10.273 -14.971 11.351 323 HG2 LYS 523 HG2 LYS 523 -11.654 -15.409 13.355 324 HG3 LYS 523 HG3 LYS 523 -12.878 -14.312 12.710 325 HD2 LYS 523 HD2 LYS 523 -11.865 -16.723 11.215 326 HD3 LYS 523 HD3 LYS 523 -13.273 -16.765 12.278 327 HE2 LYS 523 HE2 LYS 523 -13.184 -14.644 10.207 328 HE3 LYS 523 HE3 LYS 523 -13.460 -16.297 9.661 329 HZ1 LYS 523 HZ1 LYS 523 -15.046 -15.098 11.850 330 HZ2 LYS 523 HZ2 LYS 523 -15.411 -16.455 10.909 331 HZ3 LYS 523 HZ3 LYS 523 -15.486 -14.909 10.227 332 H LEU 524 H LEU 524 -11.145 -13.785 14.816 333 HA LEU 524 HA LEU 524 -8.666 -15.138 15.598 334 HB2 LEU 524 HB2 LEU 524 -8.758 -12.732 16.411 335 HB3 LEU 524 HB3 LEU 524 -10.094 -13.240 17.442 336 HG LEU 524 HG LEU 524 -7.853 -13.101 18.563 337 HD11 LEU 524 HD11 LEU 524 -9.896 -14.648 19.137 338 HD12 LEU 524 HD12 LEU 524 -8.365 -14.811 19.996 339 HD13 LEU 524 HD13 LEU 524 -8.768 -15.931 18.695 340 HD21 LEU 524 HD21 LEU 524 -7.262 -15.604 16.992 341 HD22 LEU 524 HD22 LEU 524 -6.218 -14.801 18.165 342 HD23 LEU 524 HD23 LEU 524 -6.580 -14.020 16.625 343 H PHE 525 H PHE 525 -9.691 -17.125 15.464 344 HA PHE 525 HA PHE 525 -12.126 -17.580 16.982 345 HB2 PHE 525 HB2 PHE 525 -11.018 -18.726 14.689 346 HB3 PHE 525 HB3 PHE 525 -10.872 -19.973 15.923 347 HD1 PHE 525 HD1 PHE 525 -12.580 -21.489 15.953 348 HD2 PHE 525 HD2 PHE 525 -13.434 -17.458 14.889 349 HE1 PHE 525 HE1 PHE 525 -14.948 -22.078 15.638 350 HE2 PHE 525 HE2 PHE 525 -15.803 -18.039 14.574 351 HZ PHE 525 HZ PHE 525 -16.563 -20.351 14.949 352 H ALA 526 H ALA 526 -11.797 -20.151 17.878 353 HA ALA 526 HA ALA 526 -10.444 -19.742 20.337 354 HB1 ALA 526 HB1 ALA 526 -11.200 -22.471 19.393 355 HB2 ALA 526 HB2 ALA 526 -11.322 -21.763 21.005 356 HB3 ALA 526 HB3 ALA 526 -12.460 -21.287 19.745 357 H SER 527 H SER 527 -9.712 -21.725 17.483 358 HA SER 527 HA SER 527 -6.906 -21.790 18.347 359 HB2 SER 527 HB2 SER 527 -8.408 -24.168 17.225 360 HB3 SER 527 HB3 SER 527 -6.705 -24.133 17.682 361 HG SER 527 HG SER 527 -7.327 -24.587 19.624 362 H HIS 528 H HIS 528 -8.317 -20.145 16.402 363 HA HIS 528 HA HIS 528 -6.555 -20.604 14.157 364 HB2 HIS 528 HB2 HIS 528 -9.553 -20.784 13.892 365 HB3 HIS 528 HB3 HIS 528 -8.509 -20.401 12.526 366 HD1 HIS 528 HD1 HIS 528 -9.498 -23.204 14.790 367 HD2 HIS 528 HD2 HIS 528 -7.016 -22.547 11.523 368 HE1 HIS 528 HE1 HIS 528 -8.820 -25.490 13.990 369 H SER 529 H SER 529 -6.713 -18.808 12.547 370 HA SER 529 HA SER 529 -8.079 -16.405 13.233 371 HB2 SER 529 HB2 SER 529 -5.478 -15.413 13.390 372 HB3 SER 529 HB3 SER 529 -6.622 -15.568 14.724 373 HG SER 529 HG SER 529 -4.755 -16.647 15.284 374 H THR 530 H THR 530 -8.289 -15.179 11.462 375 HA THR 530 HA THR 530 -6.616 -15.852 9.139 376 HB THR 530 HB THR 530 -8.386 -15.153 7.714 377 HG1 THR 530 HG1 THR 530 -10.016 -13.884 8.366 378 HG21 THR 530 HG21 THR 530 -10.017 -16.449 9.844 379 HG22 THR 530 HG22 THR 530 -8.626 -17.323 9.203 380 HG23 THR 530 HG23 THR 530 -9.920 -16.810 8.121 381 H ILE 531 H ILE 531 -6.289 -14.017 7.573 382 HA ILE 531 HA ILE 531 -6.439 -11.327 8.407 383 HB ILE 531 HB ILE 531 -4.727 -11.879 10.008 384 HG12 ILE 531 HG12 ILE 531 -3.208 -10.555 7.780 385 HG13 ILE 531 HG13 ILE 531 -4.604 -9.761 8.500 386 HG21 ILE 531 HG21 ILE 531 -2.597 -12.847 9.394 387 HG22 ILE 531 HG22 ILE 531 -3.905 -13.913 8.887 388 HG23 ILE 531 HG23 ILE 531 -3.081 -12.903 7.699 389 HD11 ILE 531 HD11 ILE 531 -3.337 -10.279 10.737 390 HD12 ILE 531 HD12 ILE 531 -1.936 -10.334 9.666 391 HD13 ILE 531 HD13 ILE 531 -2.923 -8.875 9.753 392 H GLU 532 H GLU 532 -5.909 -9.920 6.768 393 HA GLU 532 HA GLU 532 -4.833 -11.141 4.310 394 HB2 GLU 532 HB2 GLU 532 -7.281 -10.623 4.215 395 HB3 GLU 532 HB3 GLU 532 -6.884 -8.927 4.454 396 HG2 GLU 532 HG2 GLU 532 -6.152 -8.655 2.339 397 HG3 GLU 532 HG3 GLU 532 -5.496 -10.288 2.238 398 H LEU 533 H LEU 533 -3.085 -10.204 3.474 399 HA LEU 533 HA LEU 533 -2.343 -7.529 4.459 400 HB2 LEU 533 HB2 LEU 533 -0.851 -10.016 4.143 401 HB3 LEU 533 HB3 LEU 533 -0.045 -8.625 3.421 402 HG LEU 533 HG LEU 533 0.020 -7.492 5.538 403 HD11 LEU 533 HD11 LEU 533 -1.953 -9.546 6.281 404 HD12 LEU 533 HD12 LEU 533 -1.780 -7.880 6.832 405 HD13 LEU 533 HD13 LEU 533 -0.761 -9.145 7.518 406 HD21 LEU 533 HD21 LEU 533 1.405 -9.069 6.838 407 HD22 LEU 533 HD22 LEU 533 1.829 -9.036 5.126 408 HD23 LEU 533 HD23 LEU 533 0.878 -10.373 5.774 409 HA PRO 534 HA PRO 534 -2.751 -6.118 0.292 410 HB2 PRO 534 HB2 PRO 534 -1.427 -3.764 0.577 411 HB3 PRO 534 HB3 PRO 534 -3.059 -4.030 1.201 412 HG2 PRO 534 HG2 PRO 534 -0.438 -4.128 2.645 413 HG3 PRO 534 HG3 PRO 534 -1.973 -3.402 3.159 414 HD2 PRO 534 HD2 PRO 534 -1.135 -5.819 4.047 415 HD3 PRO 534 HD3 PRO 534 -2.852 -5.426 3.825 416 H LYS 535 H LYS 535 0.116 -7.071 1.774 417 HA LYS 535 HA LYS 535 2.192 -6.219 0.230 418 HB2 LYS 535 HB2 LYS 535 1.725 -9.056 1.167 419 HB3 LYS 535 HB3 LYS 535 3.274 -8.392 0.665 420 HG2 LYS 535 HG2 LYS 535 1.651 -7.395 2.997 421 HG3 LYS 535 HG3 LYS 535 3.013 -8.513 3.111 422 HD2 LYS 535 HD2 LYS 535 3.201 -5.761 1.894 423 HD3 LYS 535 HD3 LYS 535 3.569 -6.112 3.584 424 HE2 LYS 535 HE2 LYS 535 5.220 -7.826 2.736 425 HE3 LYS 535 HE3 LYS 535 4.968 -7.150 1.128 426 HZ1 LYS 535 HZ1 LYS 535 6.834 -6.054 1.959 427 HZ2 LYS 535 HZ2 LYS 535 6.162 -5.846 3.497 428 HZ3 LYS 535 HZ3 LYS 535 5.580 -4.943 2.190 429 H GLY 536 H GLY 536 3.162 -6.820 -1.712 430 HA2 GLY 536 HA2 GLY 536 1.496 -8.483 -3.497 431 HA3 GLY 536 HA3 GLY 536 2.184 -6.958 -4.034 432 H MET 537 H MET 537 3.640 -9.560 -2.105 433 HA MET 537 HA MET 537 5.142 -10.710 -4.178 434 HB2 MET 537 HB2 MET 537 6.131 -8.282 -3.835 435 HB3 MET 537 HB3 MET 537 6.956 -9.048 -2.484 436 HG2 MET 537 HG2 MET 537 8.447 -9.156 -4.289 437 HG3 MET 537 HG3 MET 537 7.775 -10.777 -4.127 438 HE1 MET 537 HE1 MET 537 9.140 -10.344 -7.013 439 HE2 MET 537 HE2 MET 537 8.341 -11.691 -6.202 440 HE3 MET 537 HE3 MET 537 7.811 -11.189 -7.809 441 HA PRO 538 HA PRO 538 5.002 -12.808 -0.009 442 HB2 PRO 538 HB2 PRO 538 3.790 -15.066 -0.903 443 HB3 PRO 538 HB3 PRO 538 2.891 -13.641 -0.369 444 HG2 PRO 538 HG2 PRO 538 3.571 -14.521 -3.149 445 HG3 PRO 538 HG3 PRO 538 2.044 -13.871 -2.522 446 HD2 PRO 538 HD2 PRO 538 3.813 -12.358 -3.905 447 HD3 PRO 538 HD3 PRO 538 2.787 -11.691 -2.619 448 H GLY 539 H GLY 539 5.648 -15.274 0.313 449 HA2 GLY 539 HA2 GLY 539 7.101 -17.035 -0.176 450 HA3 GLY 539 HA3 GLY 539 7.556 -16.216 -1.663 451 H GLU 540 H GLU 540 7.687 -14.038 0.853 452 HA GLU 540 HA GLU 540 10.568 -14.029 0.804 453 HB2 GLU 540 HB2 GLU 540 8.836 -12.320 2.576 454 HB3 GLU 540 HB3 GLU 540 10.442 -11.968 1.954 455 HG2 GLU 540 HG2 GLU 540 9.347 -12.015 -0.360 456 HG3 GLU 540 HG3 GLU 540 7.820 -11.903 0.514 457 H VAL 541 H VAL 541 8.152 -14.216 3.424 458 HA VAL 541 HA VAL 541 10.137 -15.162 5.294 459 HB VAL 541 HB VAL 541 7.143 -14.954 5.642 460 HG11 VAL 541 HG11 VAL 541 8.299 -16.476 7.219 461 HG12 VAL 541 HG12 VAL 541 9.319 -15.127 7.723 462 HG13 VAL 541 HG13 VAL 541 7.579 -15.073 8.008 463 HG21 VAL 541 HG21 VAL 541 7.533 -12.750 5.509 464 HG22 VAL 541 HG22 VAL 541 8.250 -12.934 7.110 465 HG23 VAL 541 HG23 VAL 541 9.277 -12.951 5.676 466 H LEU 542 H LEU 542 7.555 -16.519 3.355 467 HA LEU 542 HA LEU 542 7.390 -19.034 4.622 468 HB2 LEU 542 HB2 LEU 542 6.596 -17.928 1.978 469 HB3 LEU 542 HB3 LEU 542 6.623 -19.679 2.174 470 HG LEU 542 HG LEU 542 5.095 -19.304 4.187 471 HD11 LEU 542 HD11 LEU 542 3.688 -17.180 3.811 472 HD12 LEU 542 HD12 LEU 542 5.104 -16.577 2.950 473 HD13 LEU 542 HD13 LEU 542 5.233 -17.032 4.648 474 HD21 LEU 542 HD21 LEU 542 4.487 -20.117 1.837 475 HD22 LEU 542 HD22 LEU 542 3.867 -18.487 1.572 476 HD23 LEU 542 HD23 LEU 542 3.185 -19.494 2.851 477 H GLN 543 H GLN 543 9.704 -17.667 2.471 478 HA GLN 543 HA GLN 543 10.773 -20.208 1.602 479 HB2 GLN 543 HB2 GLN 543 11.353 -17.343 1.068 480 HB3 GLN 543 HB3 GLN 543 12.676 -18.482 0.855 481 HG2 GLN 543 HG2 GLN 543 9.989 -18.807 -0.449 482 HG3 GLN 543 HG3 GLN 543 11.345 -17.969 -1.202 483 HE21 GLN 543 HE21 GLN 543 13.277 -19.185 -1.615 484 HE22 GLN 543 HE22 GLN 543 13.182 -20.887 -1.893 485 H HIS 544 H HIS 544 12.095 -17.467 3.467 486 HA HIS 544 HA HIS 544 14.341 -18.922 4.406 487 HB2 HIS 544 HB2 HIS 544 13.067 -16.313 5.174 488 HB3 HIS 544 HB3 HIS 544 14.389 -16.977 6.129 489 HD1 HIS 544 HD1 HIS 544 13.712 -16.115 2.482 490 HD2 HIS 544 HD2 HIS 544 16.822 -16.210 5.237 491 HE1 HIS 544 HE1 HIS 544 15.707 -15.170 1.277 492 H PHE 545 H PHE 545 11.380 -17.847 6.079 493 HA PHE 545 HA PHE 545 11.969 -19.607 8.313 494 HB2 PHE 545 HB2 PHE 545 9.945 -17.465 7.779 495 HB3 PHE 545 HB3 PHE 545 9.652 -18.629 9.067 496 HD1 PHE 545 HD1 PHE 545 10.124 -17.784 11.137 497 HD2 PHE 545 HD2 PHE 545 12.624 -16.713 7.863 498 HE1 PHE 545 HE1 PHE 545 11.539 -16.461 12.655 499 HE2 PHE 545 HE2 PHE 545 14.043 -15.390 9.376 500 HZ PHE 545 HZ PHE 545 13.502 -15.263 11.775 501 H THR 546 H THR 546 11.614 -21.069 6.026 502 HA THR 546 HA THR 546 8.900 -21.989 5.791 503 HB THR 546 HB THR 546 10.566 -22.018 3.901 504 HG1 THR 546 HG1 THR 546 9.543 -23.737 3.041 505 HG21 THR 546 HG21 THR 546 12.226 -23.255 5.656 506 HG22 THR 546 HG22 THR 546 12.405 -23.328 3.902 507 HG23 THR 546 HG23 THR 546 11.596 -24.638 4.762 508 H ARG 547 H ARG 547 11.574 -22.723 7.797 509 HA ARG 547 HA ARG 547 10.296 -25.236 8.653 510 HB2 ARG 547 HB2 ARG 547 12.486 -25.898 9.538 511 HB3 ARG 547 HB3 ARG 547 12.566 -25.560 7.814 512 HG2 ARG 547 HG2 ARG 547 13.252 -23.156 8.717 513 HG3 ARG 547 HG3 ARG 547 13.790 -24.124 10.092 514 HD2 ARG 547 HD2 ARG 547 14.525 -24.873 7.283 515 HD3 ARG 547 HD3 ARG 547 15.451 -23.665 8.174 516 HE ARG 547 HE ARG 547 15.170 -25.978 9.751 517 HH11 ARG 547 HH11 ARG 547 16.809 -24.841 6.897 518 HH12 ARG 547 HH12 ARG 547 18.146 -25.929 7.073 519 HH21 ARG 547 HH21 ARG 547 16.925 -27.415 9.993 520 HH22 ARG 547 HH22 ARG 547 18.210 -27.393 8.834 521 H THR 548 H THR 548 11.236 -22.064 9.584 522 HA THR 548 HA THR 548 10.638 -22.665 12.404 523 HB THR 548 HB THR 548 12.107 -20.276 11.272 524 HG1 THR 548 HG1 THR 548 13.424 -22.083 11.148 525 HG21 THR 548 HG21 THR 548 12.646 -19.778 13.608 526 HG22 THR 548 HG22 THR 548 11.668 -21.149 14.131 527 HG23 THR 548 HG23 THR 548 10.903 -19.768 13.344 528 H ARG 549 H ARG 549 8.721 -22.039 13.130 529 HA ARG 549 HA ARG 549 7.564 -19.526 12.234 530 HB2 ARG 549 HB2 ARG 549 6.269 -22.212 11.813 531 HB3 ARG 549 HB3 ARG 549 5.322 -20.734 11.922 532 HG2 ARG 549 HG2 ARG 549 5.599 -20.572 9.723 533 HG3 ARG 549 HG3 ARG 549 7.260 -20.094 10.080 534 HD2 ARG 549 HD2 ARG 549 7.457 -21.834 8.520 535 HD3 ARG 549 HD3 ARG 549 7.801 -22.584 10.078 536 HE ARG 549 HE ARG 549 5.049 -22.762 9.209 537 HH11 ARG 549 HH11 ARG 549 8.191 -24.261 9.253 538 HH12 ARG 549 HH12 ARG 549 7.577 -25.856 8.966 539 HH21 ARG 549 HH21 ARG 549 4.229 -24.856 8.831 540 HH22 ARG 549 HH22 ARG 549 5.324 -26.193 8.725 541 H ILE 550 H ILE 550 5.315 -19.289 13.434 542 HA ILE 550 HA ILE 550 5.043 -20.584 15.951 543 HB ILE 550 HB ILE 550 7.047 -18.918 16.192 544 HG12 ILE 550 HG12 ILE 550 5.201 -18.366 18.394 545 HG13 ILE 550 HG13 ILE 550 5.244 -20.067 17.942 546 HG21 ILE 550 HG21 ILE 550 5.320 -17.112 15.247 547 HG22 ILE 550 HG22 ILE 550 5.001 -16.931 16.971 548 HG23 ILE 550 HG23 ILE 550 6.633 -16.696 16.347 549 HD11 ILE 550 HD11 ILE 550 7.716 -19.996 18.176 550 HD12 ILE 550 HD12 ILE 550 7.558 -18.353 18.798 551 HD13 ILE 550 HD13 ILE 550 6.835 -19.701 19.675 552 H LEU 551 H LEU 551 3.563 -19.019 17.421 553 HA LEU 551 HA LEU 551 1.069 -18.953 16.454 554 HB2 LEU 551 HB2 LEU 551 0.501 -17.257 18.060 555 HB3 LEU 551 HB3 LEU 551 1.698 -18.349 18.754 556 HG LEU 551 HG LEU 551 3.336 -16.425 17.865 557 HD11 LEU 551 HD11 LEU 551 1.067 -14.757 18.833 558 HD12 LEU 551 HD12 LEU 551 1.126 -15.221 17.133 559 HD13 LEU 551 HD13 LEU 551 2.457 -14.309 17.845 560 HD21 LEU 551 HD21 LEU 551 1.822 -16.645 20.447 561 HD22 LEU 551 HD22 LEU 551 3.073 -15.425 20.204 562 HD23 LEU 551 HD23 LEU 551 3.477 -17.139 20.089 563 H ASN 552 H ASN 552 3.465 -16.397 15.954 564 HA ASN 552 HA ASN 552 1.661 -14.758 14.430 565 HB2 ASN 552 HB2 ASN 552 3.407 -13.657 15.671 566 HB3 ASN 552 HB3 ASN 552 4.648 -14.619 14.875 567 HD21 ASN 552 HD21 ASN 552 5.794 -13.152 13.798 568 HD22 ASN 552 HD22 ASN 552 5.152 -12.043 12.639 569 H LYS 553 H LYS 553 4.714 -16.390 13.558 570 HA LYS 553 HA LYS 553 4.386 -16.124 10.785 571 HB2 LYS 553 HB2 LYS 553 5.869 -18.444 11.968 572 HB3 LYS 553 HB3 LYS 553 6.275 -17.467 10.563 573 HG2 LYS 553 HG2 LYS 553 6.518 -16.687 13.458 574 HG3 LYS 553 HG3 LYS 553 7.824 -16.965 12.304 575 HD2 LYS 553 HD2 LYS 553 5.763 -14.764 12.156 576 HD3 LYS 553 HD3 LYS 553 7.447 -14.576 12.652 577 HE2 LYS 553 HE2 LYS 553 8.082 -15.494 10.385 578 HE3 LYS 553 HE3 LYS 553 6.386 -15.324 9.936 579 HZ1 LYS 553 HZ1 LYS 553 7.922 -13.424 9.344 580 HZ2 LYS 553 HZ2 LYS 553 7.962 -13.055 10.994 581 HZ3 LYS 553 HZ3 LYS 553 6.495 -13.010 10.153 582 HA PRO 554 HA PRO 554 1.602 -19.282 9.550 583 HB2 PRO 554 HB2 PRO 554 2.796 -20.321 7.344 584 HB3 PRO 554 HB3 PRO 554 2.055 -18.716 7.369 585 HG2 PRO 554 HG2 PRO 554 4.939 -19.476 7.634 586 HG3 PRO 554 HG3 PRO 554 4.211 -18.158 6.699 587 HD2 PRO 554 HD2 PRO 554 5.382 -17.761 9.107 588 HD3 PRO 554 HD3 PRO 554 4.004 -16.793 8.545 589 H MET 555 H MET 555 2.223 -20.491 11.576 590 HA MET 555 HA MET 555 4.122 -22.573 11.530 591 HB2 MET 555 HB2 MET 555 3.329 -21.799 13.644 592 HB3 MET 555 HB3 MET 555 1.657 -22.122 13.209 593 HG2 MET 555 HG2 MET 555 2.432 -23.791 14.752 594 HG3 MET 555 HG3 MET 555 2.150 -24.527 13.176 595 HE1 MET 555 HE1 MET 555 4.706 -26.384 15.144 596 HE2 MET 555 HE2 MET 555 5.285 -24.911 15.922 597 HE3 MET 555 HE3 MET 555 3.553 -25.222 15.800 598 H ASN 556 H ASN 556 0.588 -22.645 11.079 599 HA ASN 556 HA ASN 556 0.878 -24.921 9.295 600 HB2 ASN 556 HB2 ASN 556 0.553 -25.708 11.746 601 HB3 ASN 556 HB3 ASN 556 -1.107 -25.159 11.540 602 HD21 ASN 556 HD21 ASN 556 0.569 -27.829 11.625 603 HD22 ASN 556 HD22 ASN 556 -0.231 -28.785 10.429 604 H MET 557 H MET 557 0.202 -22.366 8.602 605 HA MET 557 HA MET 557 -2.708 -22.255 8.401 606 HB2 MET 557 HB2 MET 557 -2.364 -20.018 7.470 607 HB3 MET 557 HB3 MET 557 -1.523 -20.199 9.004 608 HG2 MET 557 HG2 MET 557 0.136 -19.210 7.844 609 HG3 MET 557 HG3 MET 557 0.466 -20.876 7.375 610 HE1 MET 557 HE1 MET 557 0.254 -17.562 6.531 611 HE2 MET 557 HE2 MET 557 1.334 -18.102 5.246 612 HE3 MET 557 HE3 MET 557 -0.220 -17.371 4.843 613 H GLN 558 H GLN 558 -3.551 -21.489 6.194 614 HA GLN 558 HA GLN 558 -2.093 -22.615 3.939 615 HB2 GLN 558 HB2 GLN 558 -4.936 -23.480 4.412 616 HB3 GLN 558 HB3 GLN 558 -3.769 -24.140 3.275 617 HG2 GLN 558 HG2 GLN 558 -2.425 -24.857 5.306 618 HG3 GLN 558 HG3 GLN 558 -3.864 -24.480 6.252 619 HE21 GLN 558 HE21 GLN 558 -2.722 -27.021 6.119 620 HE22 GLN 558 HE22 GLN 558 -3.832 -28.083 5.330 621 H LEU 559 H LEU 559 -3.066 -22.061 1.861 622 HA LEU 559 HA LEU 559 -4.208 -19.398 1.953 623 HB2 LEU 559 HB2 LEU 559 -2.365 -19.870 0.432 624 HB3 LEU 559 HB3 LEU 559 -3.330 -21.106 -0.372 625 HG LEU 559 HG LEU 559 -3.052 -18.798 -1.494 626 HD11 LEU 559 HD11 LEU 559 -5.920 -19.542 -1.287 627 HD12 LEU 559 HD12 LEU 559 -4.782 -20.757 -1.870 628 HD13 LEU 559 HD13 LEU 559 -4.932 -19.215 -2.712 629 HD21 LEU 559 HD21 LEU 559 -3.616 -17.498 0.527 630 HD22 LEU 559 HD22 LEU 559 -5.254 -18.151 0.464 631 HD23 LEU 559 HD23 LEU 559 -4.664 -17.121 -0.841 632 H LEU 560 H LEU 560 -6.331 -19.129 2.053 633 HA LEU 560 HA LEU 560 -8.067 -21.093 0.711 634 HB2 LEU 560 HB2 LEU 560 -9.688 -20.786 2.339 635 HB3 LEU 560 HB3 LEU 560 -8.181 -20.770 3.253 636 HG LEU 560 HG LEU 560 -8.513 -18.123 2.807 637 HD11 LEU 560 HD11 LEU 560 -11.265 -18.676 3.592 638 HD12 LEU 560 HD12 LEU 560 -10.908 -19.124 1.924 639 HD13 LEU 560 HD13 LEU 560 -10.621 -17.473 2.474 640 HD21 LEU 560 HD21 LEU 560 -9.972 -19.356 5.098 641 HD22 LEU 560 HD22 LEU 560 -8.881 -17.970 5.070 642 HD23 LEU 560 HD23 LEU 560 -8.232 -19.606 4.945 643 H GLY 561 H GLY 561 -7.186 -17.756 0.982 644 HA2 GLY 561 HA2 GLY 561 -9.499 -16.822 -0.509 645 HA3 GLY 561 HA3 GLY 561 -8.169 -15.837 0.081 646 H ASP 562 H ASP 562 -8.043 -14.774 -1.936 647 HA ASP 562 HA ASP 562 -6.178 -15.898 -3.733 648 HB2 ASP 562 HB2 ASP 562 -8.248 -17.146 -4.419 649 HB3 ASP 562 HB3 ASP 562 -8.960 -15.601 -4.876 650 H ALA 563 H ALA 563 -5.381 -14.386 -5.214 651 HA ALA 563 HA ALA 563 -5.752 -11.662 -4.471 652 HB1 ALA 563 HB1 ALA 563 -3.790 -13.120 -5.788 653 HB2 ALA 563 HB2 ALA 563 -4.404 -12.001 -7.006 654 HB3 ALA 563 HB3 ALA 563 -3.786 -11.384 -5.473 655 H GLN 564 H GLN 564 -7.199 -10.253 -5.198 656 HA GLN 564 HA GLN 564 -9.251 -10.881 -6.961 657 HB2 GLN 564 HB2 GLN 564 -8.843 -8.860 -5.259 658 HB3 GLN 564 HB3 GLN 564 -8.426 -8.032 -6.753 659 HG2 GLN 564 HG2 GLN 564 -10.695 -7.589 -6.419 660 HG3 GLN 564 HG3 GLN 564 -10.650 -8.845 -7.655 661 HE21 GLN 564 HE21 GLN 564 -11.777 -10.645 -7.329 662 HE22 GLN 564 HE22 GLN 564 -12.541 -11.092 -5.845 Start of MODEL 11 1 H MET 480 H MET 480 -0.843 0.139 -2.099 2 HA MET 480 HA MET 480 1.372 0.550 -2.420 3 HB2 MET 480 HB2 MET 480 0.929 1.203 0.059 4 HB3 MET 480 HB3 MET 480 1.856 -0.244 0.435 5 HG2 MET 480 HG2 MET 480 3.724 0.663 -0.914 6 HG3 MET 480 HG3 MET 480 2.796 2.144 -1.134 7 HE1 MET 480 HE1 MET 480 5.927 2.186 0.550 8 HE2 MET 480 HE2 MET 480 4.904 3.184 -0.484 9 HE3 MET 480 HE3 MET 480 5.239 3.685 1.174 10 H ALA 481 H ALA 481 0.576 -2.015 -3.165 11 HA ALA 481 HA ALA 481 2.784 -3.747 -2.298 12 HB1 ALA 481 HB1 ALA 481 0.028 -4.224 -2.973 13 HB2 ALA 481 HB2 ALA 481 1.095 -5.215 -3.969 14 HB3 ALA 481 HB3 ALA 481 1.200 -5.300 -2.211 15 H ASP 482 H ASP 482 3.366 -5.351 -4.227 16 HA ASP 482 HA ASP 482 4.398 -3.624 -6.337 17 HB2 ASP 482 HB2 ASP 482 5.586 -5.613 -4.921 18 HB3 ASP 482 HB3 ASP 482 5.083 -6.498 -6.359 19 H VAL 483 H VAL 483 2.238 -6.351 -5.888 20 HA VAL 483 HA VAL 483 1.385 -6.053 -8.689 21 HB VAL 483 HB VAL 483 2.673 -8.091 -8.607 22 HG11 VAL 483 HG11 VAL 483 2.424 -8.404 -6.130 23 HG12 VAL 483 HG12 VAL 483 0.828 -9.089 -6.445 24 HG13 VAL 483 HG13 VAL 483 2.270 -9.878 -7.087 25 HG21 VAL 483 HG21 VAL 483 0.226 -7.902 -9.651 26 HG22 VAL 483 HG22 VAL 483 1.189 -9.376 -9.752 27 HG23 VAL 483 HG23 VAL 483 -0.063 -9.223 -8.519 28 H GLY 484 H GLY 484 0.548 -7.089 -5.414 29 HA2 GLY 484 HA2 GLY 484 -1.584 -6.106 -4.582 30 HA3 GLY 484 HA3 GLY 484 -2.292 -6.639 -6.099 31 H ASP 485 H ASP 485 0.012 -8.550 -4.284 32 HA ASP 485 HA ASP 485 -1.616 -10.844 -4.298 33 HB2 ASP 485 HB2 ASP 485 1.016 -10.390 -3.824 34 HB3 ASP 485 HB3 ASP 485 0.441 -10.671 -2.183 35 H MET 486 H MET 486 -3.619 -10.469 -3.400 36 HA MET 486 HA MET 486 -3.633 -10.056 -0.485 37 HB2 MET 486 HB2 MET 486 -4.468 -8.046 -1.626 38 HB3 MET 486 HB3 MET 486 -5.669 -9.018 -2.465 39 HG2 MET 486 HG2 MET 486 -6.370 -9.680 -0.026 40 HG3 MET 486 HG3 MET 486 -5.567 -8.165 0.379 41 HE1 MET 486 HE1 MET 486 -7.896 -5.462 -0.642 42 HE2 MET 486 HE2 MET 486 -7.058 -6.151 0.748 43 HE3 MET 486 HE3 MET 486 -6.181 -5.857 -0.754 44 H GLN 487 H GLN 487 -4.387 -11.774 0.550 45 HA GLN 487 HA GLN 487 -6.694 -13.208 -0.468 46 HB2 GLN 487 HB2 GLN 487 -4.035 -14.567 -0.012 47 HB3 GLN 487 HB3 GLN 487 -5.559 -15.417 -0.225 48 HG2 GLN 487 HG2 GLN 487 -4.760 -15.512 -2.347 49 HG3 GLN 487 HG3 GLN 487 -5.660 -13.999 -2.435 50 HE21 GLN 487 HE21 GLN 487 -2.475 -14.870 -1.136 51 HE22 GLN 487 HE22 GLN 487 -1.593 -13.697 -2.048 52 H LEU 488 H LEU 488 -7.183 -15.106 1.144 53 HA LEU 488 HA LEU 488 -6.898 -13.986 3.849 54 HB2 LEU 488 HB2 LEU 488 -9.191 -14.204 2.814 55 HB3 LEU 488 HB3 LEU 488 -8.977 -15.950 2.914 56 HG LEU 488 HG LEU 488 -8.758 -15.723 5.382 57 HD11 LEU 488 HD11 LEU 488 -9.397 -12.853 4.751 58 HD12 LEU 488 HD12 LEU 488 -8.024 -13.493 5.655 59 HD13 LEU 488 HD13 LEU 488 -9.646 -13.569 6.344 60 HD21 LEU 488 HD21 LEU 488 -11.033 -15.720 3.799 61 HD22 LEU 488 HD22 LEU 488 -11.348 -14.480 5.013 62 HD23 LEU 488 HD23 LEU 488 -10.944 -16.122 5.514 63 H TYR 489 H TYR 489 -5.346 -14.983 4.954 64 HA TYR 489 HA TYR 489 -5.032 -17.892 4.630 65 HB2 TYR 489 HB2 TYR 489 -2.935 -16.283 5.994 66 HB3 TYR 489 HB3 TYR 489 -2.770 -17.682 4.940 67 HD1 TYR 489 HD1 TYR 489 -3.179 -14.031 5.049 68 HD2 TYR 489 HD2 TYR 489 -2.579 -17.424 2.552 69 HE1 TYR 489 HE1 TYR 489 -2.586 -12.544 3.182 70 HE2 TYR 489 HE2 TYR 489 -1.983 -15.946 0.678 71 HH TYR 489 HH TYR 489 -2.506 -12.569 0.763 72 H ARG 490 H ARG 490 -5.827 -19.080 6.221 73 HA ARG 490 HA ARG 490 -6.135 -17.876 8.882 74 HB2 ARG 490 HB2 ARG 490 -7.803 -19.580 9.313 75 HB3 ARG 490 HB3 ARG 490 -8.174 -18.765 7.799 76 HG2 ARG 490 HG2 ARG 490 -8.414 -20.819 6.970 77 HG3 ARG 490 HG3 ARG 490 -6.650 -20.866 6.954 78 HD2 ARG 490 HD2 ARG 490 -6.975 -21.650 9.442 79 HD3 ARG 490 HD3 ARG 490 -8.573 -22.115 8.859 80 HE ARG 490 HE ARG 490 -6.057 -23.367 8.224 81 HH11 ARG 490 HH11 ARG 490 -9.362 -22.878 7.245 82 HH12 ARG 490 HH12 ARG 490 -9.428 -24.320 6.286 83 HH21 ARG 490 HH21 ARG 490 -6.132 -25.268 6.965 84 HH22 ARG 490 HH22 ARG 490 -7.591 -25.679 6.128 85 H ILE 491 H ILE 491 -5.026 -18.612 10.589 86 HA ILE 491 HA ILE 491 -3.198 -20.863 10.152 87 HB ILE 491 HB ILE 491 -1.897 -20.034 11.996 88 HG12 ILE 491 HG12 ILE 491 -4.078 -17.967 12.356 89 HG13 ILE 491 HG13 ILE 491 -3.744 -19.311 13.442 90 HG21 ILE 491 HG21 ILE 491 -2.125 -17.407 10.964 91 HG22 ILE 491 HG22 ILE 491 -0.938 -18.646 10.558 92 HG23 ILE 491 HG23 ILE 491 -2.443 -18.534 9.645 93 HD11 ILE 491 HD11 ILE 491 -1.419 -18.293 13.693 94 HD12 ILE 491 HD12 ILE 491 -2.115 -16.851 12.953 95 HD13 ILE 491 HD13 ILE 491 -2.769 -17.467 14.470 96 H GLU 492 H GLU 492 -2.723 -22.198 12.149 97 HA GLU 492 HA GLU 492 -5.278 -23.031 13.311 98 HB2 GLU 492 HB2 GLU 492 -3.791 -24.677 12.113 99 HB3 GLU 492 HB3 GLU 492 -2.631 -24.480 13.420 100 HG2 GLU 492 HG2 GLU 492 -3.692 -26.278 14.245 101 HG3 GLU 492 HG3 GLU 492 -4.811 -25.061 14.857 102 H VAL 493 H VAL 493 -4.554 -20.754 14.467 103 HA VAL 493 HA VAL 493 -3.790 -21.603 17.159 104 HB VAL 493 HB VAL 493 -2.620 -19.087 15.990 105 HG11 VAL 493 HG11 VAL 493 -1.280 -19.022 17.913 106 HG12 VAL 493 HG12 VAL 493 -2.881 -19.474 18.502 107 HG13 VAL 493 HG13 VAL 493 -1.628 -20.703 18.319 108 HG21 VAL 493 HG21 VAL 493 -1.729 -20.888 14.667 109 HG22 VAL 493 HG22 VAL 493 -0.486 -20.342 15.793 110 HG23 VAL 493 HG23 VAL 493 -1.374 -21.831 16.114 111 H GLY 494 H GLY 494 -4.817 -20.510 18.786 112 HA2 GLY 494 HA2 GLY 494 -6.317 -18.086 18.163 113 HA3 GLY 494 HA3 GLY 494 -7.262 -19.493 18.627 114 H ARG 495 H ARG 495 -7.896 -17.840 20.318 115 HA ARG 495 HA ARG 495 -6.183 -16.963 22.323 116 HB2 ARG 495 HB2 ARG 495 -8.243 -16.871 23.753 117 HB3 ARG 495 HB3 ARG 495 -8.396 -16.070 22.195 118 HG2 ARG 495 HG2 ARG 495 -9.672 -17.892 21.312 119 HG3 ARG 495 HG3 ARG 495 -9.379 -18.857 22.760 120 HD2 ARG 495 HD2 ARG 495 -10.846 -16.224 22.738 121 HD3 ARG 495 HD3 ARG 495 -11.636 -17.799 22.668 122 HE ARG 495 HE ARG 495 -9.854 -17.502 24.902 123 HH11 ARG 495 HH11 ARG 495 -13.084 -16.953 23.727 124 HH12 ARG 495 HH12 ARG 495 -13.796 -16.933 25.306 125 HH21 ARG 495 HH21 ARG 495 -10.779 -17.477 26.987 126 HH22 ARG 495 HH22 ARG 495 -12.483 -17.230 27.160 127 H ASP 496 H ASP 496 -7.728 -20.072 21.866 128 HA ASP 496 HA ASP 496 -7.126 -21.080 24.470 129 HB2 ASP 496 HB2 ASP 496 -8.903 -21.897 22.747 130 HB3 ASP 496 HB3 ASP 496 -7.573 -22.840 22.080 131 H ASP 497 H ASP 497 -5.329 -20.656 21.595 132 HA ASP 497 HA ASP 497 -3.339 -22.663 22.330 133 HB2 ASP 497 HB2 ASP 497 -4.116 -22.307 19.936 134 HB3 ASP 497 HB3 ASP 497 -3.242 -20.779 19.973 135 H GLY 498 H GLY 498 -3.694 -19.162 22.011 136 HA2 GLY 498 HA2 GLY 498 -2.412 -18.024 23.905 137 HA3 GLY 498 HA3 GLY 498 -1.018 -18.836 23.208 138 H VAL 499 H VAL 499 -3.651 -17.412 21.362 139 HA VAL 499 HA VAL 499 -1.889 -15.199 20.568 140 HB VAL 499 HB VAL 499 -1.883 -17.149 18.897 141 HG11 VAL 499 HG11 VAL 499 -4.582 -17.019 19.154 142 HG12 VAL 499 HG12 VAL 499 -4.332 -16.082 17.679 143 HG13 VAL 499 HG13 VAL 499 -3.742 -17.742 17.782 144 HG21 VAL 499 HG21 VAL 499 -1.344 -14.605 18.567 145 HG22 VAL 499 HG22 VAL 499 -1.452 -15.685 17.177 146 HG23 VAL 499 HG23 VAL 499 -2.809 -14.636 17.585 147 H GLU 500 H GLU 500 -2.952 -13.326 19.839 148 HA GLU 500 HA GLU 500 -5.864 -13.284 20.274 149 HB2 GLU 500 HB2 GLU 500 -4.085 -10.962 20.975 150 HB3 GLU 500 HB3 GLU 500 -5.746 -11.257 21.470 151 HG2 GLU 500 HG2 GLU 500 -4.569 -13.407 22.554 152 HG3 GLU 500 HG3 GLU 500 -3.221 -12.272 22.598 153 H VAL 501 H VAL 501 -6.509 -10.794 19.553 154 HA VAL 501 HA VAL 501 -6.183 -10.857 16.704 155 HB VAL 501 HB VAL 501 -7.554 -8.822 18.467 156 HG11 VAL 501 HG11 VAL 501 -7.652 -7.535 16.657 157 HG12 VAL 501 HG12 VAL 501 -6.914 -8.787 15.657 158 HG13 VAL 501 HG13 VAL 501 -8.660 -8.771 15.906 159 HG21 VAL 501 HG21 VAL 501 -8.371 -11.284 18.318 160 HG22 VAL 501 HG22 VAL 501 -9.537 -9.971 18.146 161 HG23 VAL 501 HG23 VAL 501 -8.938 -10.812 16.716 162 H ARG 502 H ARG 502 -4.874 -8.980 19.354 163 HA ARG 502 HA ARG 502 -3.588 -7.091 17.559 164 HB2 ARG 502 HB2 ARG 502 -2.697 -6.099 19.665 165 HB3 ARG 502 HB3 ARG 502 -4.453 -6.190 19.616 166 HG2 ARG 502 HG2 ARG 502 -4.518 -7.953 21.157 167 HG3 ARG 502 HG3 ARG 502 -2.799 -8.302 20.956 168 HD2 ARG 502 HD2 ARG 502 -2.936 -7.193 23.013 169 HD3 ARG 502 HD3 ARG 502 -2.395 -5.956 21.879 170 HE ARG 502 HE ARG 502 -5.140 -5.769 21.935 171 HH11 ARG 502 HH11 ARG 502 -2.542 -5.511 24.238 172 HH12 ARG 502 HH12 ARG 502 -3.381 -4.385 25.253 173 HH21 ARG 502 HH21 ARG 502 -6.254 -4.288 23.264 174 HH22 ARG 502 HH22 ARG 502 -5.492 -3.691 24.699 175 H HIS 503 H HIS 503 -2.962 -10.168 18.494 176 HA HIS 503 HA HIS 503 -0.114 -9.915 18.939 177 HB2 HIS 503 HB2 HIS 503 -1.831 -11.735 19.831 178 HB3 HIS 503 HB3 HIS 503 -1.385 -12.545 18.332 179 HD1 HIS 503 HD1 HIS 503 -0.662 -13.688 21.133 180 HD2 HIS 503 HD2 HIS 503 1.873 -11.389 18.777 181 HE1 HIS 503 HE1 HIS 503 1.666 -14.255 21.898 182 H ILE 504 H ILE 504 -2.132 -11.533 16.479 183 HA ILE 504 HA ILE 504 0.052 -11.957 14.703 184 HB ILE 504 HB ILE 504 -1.496 -12.848 13.177 185 HG12 ILE 504 HG12 ILE 504 -2.992 -10.820 13.212 186 HG13 ILE 504 HG13 ILE 504 -3.840 -12.360 13.113 187 HG21 ILE 504 HG21 ILE 504 -1.299 -14.181 15.194 188 HG22 ILE 504 HG22 ILE 504 -2.617 -13.280 15.942 189 HG23 ILE 504 HG23 ILE 504 -2.932 -14.303 14.540 190 HD11 ILE 504 HD11 ILE 504 -4.247 -12.236 15.547 191 HD12 ILE 504 HD12 ILE 504 -3.507 -10.634 15.552 192 HD13 ILE 504 HD13 ILE 504 -4.988 -10.919 14.639 193 H VAL 505 H VAL 505 -2.155 -9.345 15.241 194 HA VAL 505 HA VAL 505 -1.715 -8.078 12.693 195 HB VAL 505 HB VAL 505 -3.022 -7.103 15.231 196 HG11 VAL 505 HG11 VAL 505 -2.118 -5.621 12.892 197 HG12 VAL 505 HG12 VAL 505 -3.839 -5.416 13.222 198 HG13 VAL 505 HG13 VAL 505 -2.650 -5.036 14.468 199 HG21 VAL 505 HG21 VAL 505 -4.187 -7.811 12.541 200 HG22 VAL 505 HG22 VAL 505 -4.212 -8.854 13.963 201 HG23 VAL 505 HG23 VAL 505 -5.083 -7.321 13.979 202 H GLY 506 H GLY 506 -0.891 -7.170 16.050 203 HA2 GLY 506 HA2 GLY 506 0.793 -5.034 15.392 204 HA3 GLY 506 HA3 GLY 506 0.851 -5.940 16.896 205 H ALA 507 H ALA 507 1.343 -8.425 15.182 206 HA ALA 507 HA ALA 507 4.195 -8.333 15.362 207 HB1 ALA 507 HB1 ALA 507 2.965 -10.375 15.864 208 HB2 ALA 507 HB2 ALA 507 2.395 -10.454 14.196 209 HB3 ALA 507 HB3 ALA 507 4.113 -10.640 14.551 210 H ILE 508 H ILE 508 2.027 -8.973 12.596 211 HA ILE 508 HA ILE 508 4.092 -8.649 10.669 212 HB ILE 508 HB ILE 508 2.310 -8.705 8.996 213 HG12 ILE 508 HG12 ILE 508 -0.044 -9.211 10.211 214 HG13 ILE 508 HG13 ILE 508 0.646 -8.080 11.369 215 HG21 ILE 508 HG21 ILE 508 1.138 -10.826 10.403 216 HG22 ILE 508 HG22 ILE 508 2.490 -10.900 9.275 217 HG23 ILE 508 HG23 ILE 508 2.792 -10.700 11.001 218 HD11 ILE 508 HD11 ILE 508 0.060 -6.389 10.078 219 HD12 ILE 508 HD12 ILE 508 1.024 -7.039 8.752 220 HD13 ILE 508 HD13 ILE 508 -0.662 -7.523 8.937 221 H ALA 509 H ALA 509 1.790 -6.489 12.155 222 HA ALA 509 HA ALA 509 2.068 -4.366 10.271 223 HB1 ALA 509 HB1 ALA 509 0.110 -4.587 11.736 224 HB2 ALA 509 HB2 ALA 509 1.130 -4.251 13.135 225 HB3 ALA 509 HB3 ALA 509 0.888 -3.013 11.904 226 H ASN 510 H ASN 510 3.904 -5.452 12.992 227 HA ASN 510 HA ASN 510 5.411 -2.944 13.108 228 HB2 ASN 510 HB2 ASN 510 4.605 -4.082 15.216 229 HB3 ASN 510 HB3 ASN 510 5.746 -5.378 14.868 230 HD21 ASN 510 HD21 ASN 510 5.862 -1.830 14.758 231 HD22 ASN 510 HD22 ASN 510 7.296 -1.680 15.710 232 H GLU 511 H GLU 511 5.632 -6.213 11.997 233 HA GLU 511 HA GLU 511 8.456 -6.402 11.835 234 HB2 GLU 511 HB2 GLU 511 6.158 -7.895 10.642 235 HB3 GLU 511 HB3 GLU 511 7.768 -8.151 9.985 236 HG2 GLU 511 HG2 GLU 511 7.034 -8.488 12.883 237 HG3 GLU 511 HG3 GLU 511 7.121 -9.798 11.707 238 H GLY 512 H GLY 512 5.958 -5.365 9.552 239 HA2 GLY 512 HA2 GLY 512 8.117 -4.324 7.822 240 HA3 GLY 512 HA3 GLY 512 6.636 -5.014 7.176 241 H ASP 513 H ASP 513 6.008 -3.178 6.073 242 HA ASP 513 HA ASP 513 5.699 -0.683 7.538 243 HB2 ASP 513 HB2 ASP 513 5.639 -1.496 4.679 244 HB3 ASP 513 HB3 ASP 513 4.674 -0.094 5.134 245 H ILE 514 H ILE 514 3.870 -3.433 6.825 246 HA ILE 514 HA ILE 514 1.306 -2.524 6.390 247 HB ILE 514 HB ILE 514 2.114 -4.848 8.142 248 HG12 ILE 514 HG12 ILE 514 1.225 -5.026 5.279 249 HG13 ILE 514 HG13 ILE 514 2.908 -4.685 5.667 250 HG21 ILE 514 HG21 ILE 514 -0.243 -5.565 7.048 251 HG22 ILE 514 HG22 ILE 514 -0.084 -4.807 8.632 252 HG23 ILE 514 HG23 ILE 514 -0.489 -3.827 7.222 253 HD11 ILE 514 HD11 ILE 514 2.420 -7.075 5.234 254 HD12 ILE 514 HD12 ILE 514 3.126 -6.765 6.820 255 HD13 ILE 514 HD13 ILE 514 1.398 -7.083 6.671 256 H SER 515 H SER 515 -0.384 -1.827 7.652 257 HA SER 515 HA SER 515 0.305 -1.070 10.417 258 HB2 SER 515 HB2 SER 515 -0.159 0.715 8.488 259 HB3 SER 515 HB3 SER 515 -1.832 0.401 8.948 260 HG SER 515 HG SER 515 0.091 0.925 10.929 261 H SER 516 H SER 516 -1.648 -0.776 11.834 262 HA SER 516 HA SER 516 -3.125 -3.180 11.918 263 HB2 SER 516 HB2 SER 516 -2.501 -1.493 13.822 264 HB3 SER 516 HB3 SER 516 -4.024 -0.720 13.383 265 HG SER 516 HG SER 516 -4.984 -2.854 13.672 266 H ARG 517 H ARG 517 -3.718 -0.116 10.429 267 HA ARG 517 HA ARG 517 -6.549 -0.684 10.032 268 HB2 ARG 517 HB2 ARG 517 -6.556 1.543 8.891 269 HB3 ARG 517 HB3 ARG 517 -6.040 1.595 10.571 270 HG2 ARG 517 HG2 ARG 517 -3.806 1.962 9.996 271 HG3 ARG 517 HG3 ARG 517 -4.057 1.437 8.331 272 HD2 ARG 517 HD2 ARG 517 -3.816 3.915 8.642 273 HD3 ARG 517 HD3 ARG 517 -5.283 3.404 7.808 274 HE ARG 517 HE ARG 517 -5.602 3.749 10.649 275 HH11 ARG 517 HH11 ARG 517 -5.692 5.300 7.533 276 HH12 ARG 517 HH12 ARG 517 -6.743 6.575 8.052 277 HH21 ARG 517 HH21 ARG 517 -6.987 5.423 11.345 278 HH22 ARG 517 HH22 ARG 517 -7.479 6.644 10.221 279 H TYR 518 H TYR 518 -3.529 -0.680 8.282 280 HA TYR 518 HA TYR 518 -4.564 -0.779 5.663 281 HB2 TYR 518 HB2 TYR 518 -2.043 -0.698 6.793 282 HB3 TYR 518 HB3 TYR 518 -2.092 -2.291 6.045 283 HD1 TYR 518 HD1 TYR 518 -3.274 -2.169 3.578 284 HD2 TYR 518 HD2 TYR 518 -1.119 0.958 5.495 285 HE1 TYR 518 HE1 TYR 518 -2.802 -1.159 1.386 286 HE2 TYR 518 HE2 TYR 518 -0.642 1.978 3.309 287 HH TYR 518 HH TYR 518 -2.187 0.929 0.414 288 H ILE 519 H ILE 519 -3.805 -3.300 8.016 289 HA ILE 519 HA ILE 519 -4.067 -5.555 6.435 290 HB ILE 519 HB ILE 519 -4.945 -5.228 9.306 291 HG12 ILE 519 HG12 ILE 519 -2.422 -6.607 8.627 292 HG13 ILE 519 HG13 ILE 519 -2.437 -4.874 8.319 293 HG21 ILE 519 HG21 ILE 519 -4.642 -7.662 9.455 294 HG22 ILE 519 HG22 ILE 519 -5.914 -7.219 8.317 295 HG23 ILE 519 HG23 ILE 519 -4.331 -7.718 7.720 296 HD11 ILE 519 HD11 ILE 519 -2.602 -6.348 10.890 297 HD12 ILE 519 HD12 ILE 519 -1.670 -4.913 10.463 298 HD13 ILE 519 HD13 ILE 519 -3.404 -4.783 10.757 299 H GLY 520 H GLY 520 -5.758 -6.864 5.800 300 HA2 GLY 520 HA2 GLY 520 -8.262 -5.555 5.353 301 HA3 GLY 520 HA3 GLY 520 -7.859 -7.209 4.916 302 H ASN 521 H ASN 521 -9.143 -8.646 5.839 303 HA ASN 521 HA ASN 521 -10.498 -7.969 8.334 304 HB2 ASN 521 HB2 ASN 521 -10.904 -10.255 6.394 305 HB3 ASN 521 HB3 ASN 521 -11.858 -10.002 7.853 306 HD21 ASN 521 HD21 ASN 521 -13.551 -10.045 6.120 307 HD22 ASN 521 HD22 ASN 521 -13.981 -8.531 5.406 308 H ILE 522 H ILE 522 -9.885 -8.748 10.239 309 HA ILE 522 HA ILE 522 -8.069 -11.070 10.278 310 HB ILE 522 HB ILE 522 -8.186 -8.886 12.356 311 HG12 ILE 522 HG12 ILE 522 -5.743 -8.686 11.072 312 HG13 ILE 522 HG13 ILE 522 -6.867 -8.975 9.748 313 HG21 ILE 522 HG21 ILE 522 -5.753 -10.472 12.066 314 HG22 ILE 522 HG22 ILE 522 -6.668 -10.051 13.513 315 HG23 ILE 522 HG23 ILE 522 -7.167 -11.422 12.523 316 HD11 ILE 522 HD11 ILE 522 -6.468 -6.605 11.380 317 HD12 ILE 522 HD12 ILE 522 -7.203 -6.779 9.786 318 HD13 ILE 522 HD13 ILE 522 -8.162 -7.074 11.236 319 H LYS 523 H LYS 523 -8.704 -12.808 11.378 320 HA LYS 523 HA LYS 523 -11.019 -12.537 13.182 321 HB2 LYS 523 HB2 LYS 523 -11.262 -13.888 11.012 322 HB3 LYS 523 HB3 LYS 523 -10.220 -15.079 11.779 323 HG2 LYS 523 HG2 LYS 523 -11.834 -15.297 13.611 324 HG3 LYS 523 HG3 LYS 523 -12.886 -14.128 12.809 325 HD2 LYS 523 HD2 LYS 523 -13.623 -15.638 11.311 326 HD3 LYS 523 HD3 LYS 523 -12.029 -16.371 11.118 327 HE2 LYS 523 HE2 LYS 523 -12.987 -18.106 12.190 328 HE3 LYS 523 HE3 LYS 523 -12.620 -17.156 13.629 329 HZ1 LYS 523 HZ1 LYS 523 -14.908 -17.934 13.634 330 HZ2 LYS 523 HZ2 LYS 523 -15.206 -17.145 12.168 331 HZ3 LYS 523 HZ3 LYS 523 -14.854 -16.245 13.556 332 H LEU 524 H LEU 524 -11.085 -13.922 15.042 333 HA LEU 524 HA LEU 524 -8.581 -15.201 15.821 334 HB2 LEU 524 HB2 LEU 524 -8.604 -12.780 16.576 335 HB3 LEU 524 HB3 LEU 524 -9.930 -13.229 17.647 336 HG LEU 524 HG LEU 524 -7.660 -13.109 18.716 337 HD11 LEU 524 HD11 LEU 524 -9.712 -14.539 19.428 338 HD12 LEU 524 HD12 LEU 524 -8.148 -14.805 20.198 339 HD13 LEU 524 HD13 LEU 524 -8.705 -15.899 18.931 340 HD21 LEU 524 HD21 LEU 524 -6.001 -14.667 18.261 341 HD22 LEU 524 HD22 LEU 524 -6.596 -14.247 16.655 342 HD23 LEU 524 HD23 LEU 524 -7.108 -15.752 17.420 343 H PHE 525 H PHE 525 -9.615 -17.181 15.788 344 HA PHE 525 HA PHE 525 -12.003 -17.554 17.414 345 HB2 PHE 525 HB2 PHE 525 -11.201 -18.680 15.049 346 HB3 PHE 525 HB3 PHE 525 -10.770 -19.933 16.207 347 HD1 PHE 525 HD1 PHE 525 -12.336 -21.586 16.388 348 HD2 PHE 525 HD2 PHE 525 -13.639 -17.585 15.750 349 HE1 PHE 525 HE1 PHE 525 -14.676 -22.344 16.440 350 HE2 PHE 525 HE2 PHE 525 -15.982 -18.336 15.802 351 HZ PHE 525 HZ PHE 525 -16.503 -20.718 16.148 352 H ALA 526 H ALA 526 -11.690 -20.136 18.295 353 HA ALA 526 HA ALA 526 -10.162 -19.752 20.662 354 HB1 ALA 526 HB1 ALA 526 -11.621 -22.130 19.539 355 HB2 ALA 526 HB2 ALA 526 -10.760 -22.174 21.078 356 HB3 ALA 526 HB3 ALA 526 -12.114 -21.066 20.856 357 H SER 527 H SER 527 -9.622 -21.472 17.647 358 HA SER 527 HA SER 527 -6.809 -21.773 18.362 359 HB2 SER 527 HB2 SER 527 -8.323 -24.122 17.222 360 HB3 SER 527 HB3 SER 527 -6.692 -24.098 17.893 361 HG SER 527 HG SER 527 -7.661 -23.616 19.936 362 H HIS 528 H HIS 528 -8.286 -20.074 16.525 363 HA HIS 528 HA HIS 528 -6.725 -20.614 14.151 364 HB2 HIS 528 HB2 HIS 528 -9.741 -20.634 14.119 365 HB3 HIS 528 HB3 HIS 528 -8.784 -20.312 12.676 366 HD1 HIS 528 HD1 HIS 528 -9.748 -23.051 15.027 367 HD2 HIS 528 HD2 HIS 528 -7.495 -22.540 11.574 368 HE1 HIS 528 HE1 HIS 528 -9.260 -25.373 14.193 369 H SER 529 H SER 529 -6.857 -18.807 12.581 370 HA SER 529 HA SER 529 -8.072 -16.342 13.324 371 HB2 SER 529 HB2 SER 529 -5.494 -15.394 13.403 372 HB3 SER 529 HB3 SER 529 -6.511 -15.676 14.815 373 HG SER 529 HG SER 529 -5.141 -17.148 15.381 374 H THR 530 H THR 530 -8.287 -15.094 11.568 375 HA THR 530 HA THR 530 -6.720 -15.825 9.185 376 HB THR 530 HB THR 530 -8.523 -15.116 7.813 377 HG1 THR 530 HG1 THR 530 -10.446 -14.193 8.897 378 HG21 THR 530 HG21 THR 530 -8.763 -17.242 9.421 379 HG22 THR 530 HG22 THR 530 -10.008 -16.782 8.259 380 HG23 THR 530 HG23 THR 530 -10.173 -16.329 9.955 381 H ILE 531 H ILE 531 -6.379 -14.013 7.613 382 HA ILE 531 HA ILE 531 -6.485 -11.313 8.416 383 HB ILE 531 HB ILE 531 -4.765 -11.863 10.008 384 HG12 ILE 531 HG12 ILE 531 -3.226 -10.602 7.762 385 HG13 ILE 531 HG13 ILE 531 -4.626 -9.777 8.439 386 HG21 ILE 531 HG21 ILE 531 -3.954 -13.920 9.000 387 HG22 ILE 531 HG22 ILE 531 -3.229 -13.005 7.679 388 HG23 ILE 531 HG23 ILE 531 -2.614 -12.820 9.321 389 HD11 ILE 531 HD11 ILE 531 -3.519 -10.016 10.690 390 HD12 ILE 531 HD12 ILE 531 -2.072 -10.527 9.821 391 HD13 ILE 531 HD13 ILE 531 -2.741 -8.918 9.550 392 H GLU 532 H GLU 532 -5.960 -9.935 6.753 393 HA GLU 532 HA GLU 532 -5.021 -11.224 4.275 394 HB2 GLU 532 HB2 GLU 532 -7.435 -10.309 4.436 395 HB3 GLU 532 HB3 GLU 532 -6.685 -8.722 4.341 396 HG2 GLU 532 HG2 GLU 532 -6.527 -8.879 2.145 397 HG3 GLU 532 HG3 GLU 532 -5.624 -10.387 2.279 398 H LEU 533 H LEU 533 -3.108 -10.572 3.569 399 HA LEU 533 HA LEU 533 -2.022 -8.033 4.556 400 HB2 LEU 533 HB2 LEU 533 -0.925 -10.643 4.051 401 HB3 LEU 533 HB3 LEU 533 -0.044 -9.422 3.136 402 HG LEU 533 HG LEU 533 0.417 -8.206 5.214 403 HD11 LEU 533 HD11 LEU 533 -1.158 -8.559 6.795 404 HD12 LEU 533 HD12 LEU 533 -0.034 -9.820 7.301 405 HD13 LEU 533 HD13 LEU 533 -1.432 -10.232 6.308 406 HD21 LEU 533 HD21 LEU 533 2.261 -9.423 5.513 407 HD22 LEU 533 HD22 LEU 533 1.584 -10.544 4.331 408 HD23 LEU 533 HD23 LEU 533 1.344 -10.829 6.055 409 HA PRO 534 HA PRO 534 -2.774 -6.326 0.518 410 HB2 PRO 534 HB2 PRO 534 -1.591 -3.930 0.995 411 HB3 PRO 534 HB3 PRO 534 -3.195 -4.347 1.607 412 HG2 PRO 534 HG2 PRO 534 -0.555 -4.409 3.016 413 HG3 PRO 534 HG3 PRO 534 -2.123 -3.825 3.603 414 HD2 PRO 534 HD2 PRO 534 -1.131 -6.254 4.272 415 HD3 PRO 534 HD3 PRO 534 -2.871 -5.948 4.098 416 H LYS 535 H LYS 535 0.169 -7.214 1.896 417 HA LYS 535 HA LYS 535 2.151 -6.102 0.376 418 HB2 LYS 535 HB2 LYS 535 1.909 -9.000 1.202 419 HB3 LYS 535 HB3 LYS 535 3.393 -8.226 0.665 420 HG2 LYS 535 HG2 LYS 535 1.806 -7.487 3.116 421 HG3 LYS 535 HG3 LYS 535 3.312 -8.409 3.089 422 HD2 LYS 535 HD2 LYS 535 2.969 -5.566 2.134 423 HD3 LYS 535 HD3 LYS 535 3.696 -6.056 3.666 424 HE2 LYS 535 HE2 LYS 535 4.714 -6.730 0.907 425 HE3 LYS 535 HE3 LYS 535 5.412 -5.549 2.015 426 HZ1 LYS 535 HZ1 LYS 535 6.673 -7.532 2.185 427 HZ2 LYS 535 HZ2 LYS 535 5.292 -8.491 2.366 428 HZ3 LYS 535 HZ3 LYS 535 5.749 -7.425 3.598 429 H GLY 536 H GLY 536 3.331 -6.913 -1.505 430 HA2 GLY 536 HA2 GLY 536 1.707 -8.495 -3.373 431 HA3 GLY 536 HA3 GLY 536 2.234 -6.893 -3.866 432 H MET 537 H MET 537 3.970 -9.405 -2.053 433 HA MET 537 HA MET 537 5.543 -10.322 -4.191 434 HB2 MET 537 HB2 MET 537 6.304 -7.833 -3.764 435 HB3 MET 537 HB3 MET 537 7.202 -8.559 -2.438 436 HG2 MET 537 HG2 MET 537 8.589 -9.736 -3.838 437 HG3 MET 537 HG3 MET 537 7.430 -9.730 -5.165 438 HE1 MET 537 HE1 MET 537 11.046 -7.390 -4.879 439 HE2 MET 537 HE2 MET 537 10.533 -8.925 -4.178 440 HE3 MET 537 HE3 MET 537 10.668 -8.756 -5.929 441 HA PRO 538 HA PRO 538 5.659 -12.592 -0.108 442 HB2 PRO 538 HB2 PRO 538 4.621 -14.908 -1.073 443 HB3 PRO 538 HB3 PRO 538 3.618 -13.586 -0.464 444 HG2 PRO 538 HG2 PRO 538 4.308 -14.293 -3.290 445 HG3 PRO 538 HG3 PRO 538 2.746 -13.802 -2.608 446 HD2 PRO 538 HD2 PRO 538 4.350 -12.089 -3.959 447 HD3 PRO 538 HD3 PRO 538 3.300 -11.564 -2.628 448 H GLY 539 H GLY 539 6.381 -15.150 -0.066 449 HA2 GLY 539 HA2 GLY 539 7.949 -16.746 -0.760 450 HA3 GLY 539 HA3 GLY 539 8.461 -15.654 -2.039 451 H GLU 540 H GLU 540 8.382 -13.734 0.564 452 HA GLU 540 HA GLU 540 11.243 -13.830 0.891 453 HB2 GLU 540 HB2 GLU 540 9.421 -12.117 2.548 454 HB3 GLU 540 HB3 GLU 540 11.056 -11.781 1.996 455 HG2 GLU 540 HG2 GLU 540 10.068 -11.742 -0.355 456 HG3 GLU 540 HG3 GLU 540 8.497 -11.663 0.441 457 H VAL 541 H VAL 541 8.445 -14.181 3.068 458 HA VAL 541 HA VAL 541 10.086 -15.072 5.254 459 HB VAL 541 HB VAL 541 7.081 -15.208 4.984 460 HG11 VAL 541 HG11 VAL 541 7.192 -15.170 7.488 461 HG12 VAL 541 HG12 VAL 541 7.816 -16.642 6.741 462 HG13 VAL 541 HG13 VAL 541 8.932 -15.420 7.350 463 HG21 VAL 541 HG21 VAL 541 7.648 -13.137 6.687 464 HG22 VAL 541 HG22 VAL 541 8.898 -12.969 5.453 465 HG23 VAL 541 HG23 VAL 541 7.196 -12.971 4.990 466 H LEU 542 H LEU 542 8.137 -16.566 2.759 467 HA LEU 542 HA LEU 542 8.003 -19.157 3.882 468 HB2 LEU 542 HB2 LEU 542 7.717 -18.070 1.105 469 HB3 LEU 542 HB3 LEU 542 7.688 -19.807 1.402 470 HG LEU 542 HG LEU 542 5.810 -19.103 3.138 471 HD11 LEU 542 HD11 LEU 542 5.945 -16.735 2.820 472 HD12 LEU 542 HD12 LEU 542 4.422 -17.301 2.135 473 HD13 LEU 542 HD13 LEU 542 5.775 -16.910 1.073 474 HD21 LEU 542 HD21 LEU 542 4.955 -19.101 0.287 475 HD22 LEU 542 HD22 LEU 542 4.300 -19.989 1.663 476 HD23 LEU 542 HD23 LEU 542 5.810 -20.510 0.915 477 H GLN 543 H GLN 543 10.518 -17.429 2.299 478 HA GLN 543 HA GLN 543 12.009 -19.746 1.472 479 HB2 GLN 543 HB2 GLN 543 12.461 -16.797 1.465 480 HB3 GLN 543 HB3 GLN 543 13.859 -17.855 1.333 481 HG2 GLN 543 HG2 GLN 543 13.084 -18.797 -0.681 482 HG3 GLN 543 HG3 GLN 543 11.476 -18.104 -0.472 483 HE21 GLN 543 HE21 GLN 543 12.600 -17.692 -2.824 484 HE22 GLN 543 HE22 GLN 543 13.170 -16.069 -2.987 485 H HIS 544 H HIS 544 12.633 -17.191 3.886 486 HA HIS 544 HA HIS 544 14.707 -18.687 5.156 487 HB2 HIS 544 HB2 HIS 544 13.295 -16.110 5.700 488 HB3 HIS 544 HB3 HIS 544 14.230 -16.849 6.997 489 HD1 HIS 544 HD1 HIS 544 16.754 -17.715 5.779 490 HD2 HIS 544 HD2 HIS 544 14.844 -14.241 4.537 491 HE1 HIS 544 HE1 HIS 544 18.542 -16.313 4.702 492 H PHE 545 H PHE 545 11.431 -17.744 6.204 493 HA PHE 545 HA PHE 545 11.551 -19.653 8.391 494 HB2 PHE 545 HB2 PHE 545 9.667 -17.475 7.575 495 HB3 PHE 545 HB3 PHE 545 9.098 -18.736 8.664 496 HD1 PHE 545 HD1 PHE 545 8.998 -17.945 10.812 497 HD2 PHE 545 HD2 PHE 545 12.315 -16.867 8.373 498 HE1 PHE 545 HE1 PHE 545 10.006 -16.756 12.715 499 HE2 PHE 545 HE2 PHE 545 13.329 -15.677 10.272 500 HZ PHE 545 HZ PHE 545 12.176 -15.621 12.447 501 H THR 546 H THR 546 11.735 -20.959 5.997 502 HA THR 546 HA THR 546 9.224 -21.828 4.980 503 HB THR 546 HB THR 546 11.371 -21.961 3.706 504 HG1 THR 546 HG1 THR 546 9.985 -23.242 2.709 505 HG21 THR 546 HG21 THR 546 12.562 -22.969 5.796 506 HG22 THR 546 HG22 THR 546 13.033 -23.504 4.183 507 HG23 THR 546 HG23 THR 546 11.965 -24.504 5.167 508 H ARG 547 H ARG 547 11.347 -22.936 7.533 509 HA ARG 547 HA ARG 547 9.433 -25.098 8.124 510 HB2 ARG 547 HB2 ARG 547 11.926 -25.614 7.478 511 HB3 ARG 547 HB3 ARG 547 12.247 -25.144 9.142 512 HG2 ARG 547 HG2 ARG 547 10.046 -27.039 8.875 513 HG3 ARG 547 HG3 ARG 547 11.593 -27.656 8.292 514 HD2 ARG 547 HD2 ARG 547 11.546 -26.237 10.902 515 HD3 ARG 547 HD3 ARG 547 10.863 -27.861 10.832 516 HE ARG 547 HE ARG 547 13.269 -28.145 9.626 517 HH11 ARG 547 HH11 ARG 547 12.258 -26.802 12.675 518 HH12 ARG 547 HH12 ARG 547 13.732 -27.206 13.490 519 HH21 ARG 547 HH21 ARG 547 15.214 -28.683 10.689 520 HH22 ARG 547 HH22 ARG 547 15.413 -28.275 12.359 521 H THR 548 H THR 548 11.052 -22.287 9.263 522 HA THR 548 HA THR 548 10.278 -22.791 12.038 523 HB THR 548 HB THR 548 11.854 -20.493 10.861 524 HG1 THR 548 HG1 THR 548 13.630 -21.584 11.773 525 HG21 THR 548 HG21 THR 548 10.697 -19.848 12.910 526 HG22 THR 548 HG22 THR 548 12.431 -19.989 13.198 527 HG23 THR 548 HG23 THR 548 11.341 -21.267 13.735 528 H ARG 549 H ARG 549 8.436 -22.033 12.834 529 HA ARG 549 HA ARG 549 7.375 -19.484 11.941 530 HB2 ARG 549 HB2 ARG 549 5.951 -22.103 11.519 531 HB3 ARG 549 HB3 ARG 549 5.072 -20.586 11.656 532 HG2 ARG 549 HG2 ARG 549 5.306 -20.477 9.441 533 HG3 ARG 549 HG3 ARG 549 6.959 -19.966 9.791 534 HD2 ARG 549 HD2 ARG 549 7.652 -21.726 8.620 535 HD3 ARG 549 HD3 ARG 549 7.036 -22.742 9.922 536 HE ARG 549 HE ARG 549 5.269 -23.342 8.583 537 HH11 ARG 549 HH11 ARG 549 6.932 -20.627 7.175 538 HH12 ARG 549 HH12 ARG 549 6.068 -20.709 5.675 539 HH21 ARG 549 HH21 ARG 549 4.125 -23.461 6.613 540 HH22 ARG 549 HH22 ARG 549 4.471 -22.321 5.357 541 H ILE 550 H ILE 550 5.151 -19.148 13.169 542 HA ILE 550 HA ILE 550 4.877 -20.438 15.696 543 HB ILE 550 HB ILE 550 6.919 -18.815 15.894 544 HG12 ILE 550 HG12 ILE 550 5.123 -18.202 18.119 545 HG13 ILE 550 HG13 ILE 550 5.113 -19.906 17.680 546 HG21 ILE 550 HG21 ILE 550 4.931 -16.775 16.687 547 HG22 ILE 550 HG22 ILE 550 6.558 -16.583 16.038 548 HG23 ILE 550 HG23 ILE 550 5.220 -16.977 14.960 549 HD11 ILE 550 HD11 ILE 550 7.666 -18.409 18.142 550 HD12 ILE 550 HD12 ILE 550 6.763 -19.160 19.458 551 HD13 ILE 550 HD13 ILE 550 7.390 -20.151 18.141 552 H LEU 551 H LEU 551 3.447 -18.846 17.175 553 HA LEU 551 HA LEU 551 0.943 -18.728 16.242 554 HB2 LEU 551 HB2 LEU 551 0.435 -17.009 17.847 555 HB3 LEU 551 HB3 LEU 551 1.607 -18.133 18.531 556 HG LEU 551 HG LEU 551 3.291 -16.259 17.625 557 HD11 LEU 551 HD11 LEU 551 2.473 -14.126 17.585 558 HD12 LEU 551 HD12 LEU 551 1.096 -14.513 18.615 559 HD13 LEU 551 HD13 LEU 551 1.093 -14.999 16.920 560 HD21 LEU 551 HD21 LEU 551 3.115 -17.167 19.914 561 HD22 LEU 551 HD22 LEU 551 1.784 -16.054 20.230 562 HD23 LEU 551 HD23 LEU 551 3.397 -15.427 19.888 563 H ASN 552 H ASN 552 3.383 -16.222 15.704 564 HA ASN 552 HA ASN 552 1.600 -14.540 14.211 565 HB2 ASN 552 HB2 ASN 552 3.455 -13.551 15.444 566 HB3 ASN 552 HB3 ASN 552 4.611 -14.482 14.497 567 HD21 ASN 552 HD21 ASN 552 5.690 -12.862 13.530 568 HD22 ASN 552 HD22 ASN 552 4.974 -11.725 12.443 569 H LYS 553 H LYS 553 4.573 -16.277 13.270 570 HA LYS 553 HA LYS 553 4.166 -16.010 10.501 571 HB2 LYS 553 HB2 LYS 553 5.656 -18.337 11.666 572 HB3 LYS 553 HB3 LYS 553 6.022 -17.395 10.227 573 HG2 LYS 553 HG2 LYS 553 6.388 -16.563 13.094 574 HG3 LYS 553 HG3 LYS 553 7.644 -16.879 11.895 575 HD2 LYS 553 HD2 LYS 553 5.604 -14.656 11.782 576 HD3 LYS 553 HD3 LYS 553 7.306 -14.478 12.218 577 HE2 LYS 553 HE2 LYS 553 7.480 -15.763 9.822 578 HE3 LYS 553 HE3 LYS 553 6.046 -14.765 9.583 579 HZ1 LYS 553 HZ1 LYS 553 8.524 -13.898 9.178 580 HZ2 LYS 553 HZ2 LYS 553 8.327 -13.437 10.793 581 HZ3 LYS 553 HZ3 LYS 553 7.247 -12.879 9.617 582 HA PRO 554 HA PRO 554 1.293 -19.133 9.387 583 HB2 PRO 554 HB2 PRO 554 2.391 -20.196 7.143 584 HB3 PRO 554 HB3 PRO 554 1.673 -18.582 7.189 585 HG2 PRO 554 HG2 PRO 554 4.554 -19.378 7.350 586 HG3 PRO 554 HG3 PRO 554 3.809 -18.054 6.436 587 HD2 PRO 554 HD2 PRO 554 5.074 -17.663 8.798 588 HD3 PRO 554 HD3 PRO 554 3.688 -16.680 8.283 589 H MET 555 H MET 555 1.947 -20.355 11.385 590 HA MET 555 HA MET 555 3.833 -22.430 11.337 591 HB2 MET 555 HB2 MET 555 2.993 -21.688 13.444 592 HB3 MET 555 HB3 MET 555 1.333 -22.026 12.975 593 HG2 MET 555 HG2 MET 555 2.104 -23.701 14.516 594 HG3 MET 555 HG3 MET 555 1.848 -24.423 12.929 595 HE1 MET 555 HE1 MET 555 2.890 -26.369 13.265 596 HE2 MET 555 HE2 MET 555 4.026 -26.145 11.934 597 HE3 MET 555 HE3 MET 555 4.605 -26.705 13.503 598 H ASN 556 H ASN 556 0.287 -22.629 10.980 599 HA ASN 556 HA ASN 556 0.627 -24.827 9.096 600 HB2 ASN 556 HB2 ASN 556 0.336 -25.645 11.565 601 HB3 ASN 556 HB3 ASN 556 -1.351 -25.204 11.319 602 HD21 ASN 556 HD21 ASN 556 0.679 -27.710 11.275 603 HD22 ASN 556 HD22 ASN 556 -0.095 -28.725 10.111 604 H MET 557 H MET 557 -0.106 -22.380 8.328 605 HA MET 557 HA MET 557 -3.022 -22.254 8.261 606 HB2 MET 557 HB2 MET 557 -2.711 -20.059 7.225 607 HB3 MET 557 HB3 MET 557 -1.803 -20.183 8.726 608 HG2 MET 557 HG2 MET 557 -0.193 -19.253 7.455 609 HG3 MET 557 HG3 MET 557 0.107 -20.938 7.038 610 HE1 MET 557 HE1 MET 557 -0.301 -21.805 4.201 611 HE2 MET 557 HE2 MET 557 0.615 -20.451 3.541 612 HE3 MET 557 HE3 MET 557 1.042 -21.121 5.117 613 H GLN 558 H GLN 558 -3.950 -21.555 6.057 614 HA GLN 558 HA GLN 558 -2.608 -22.837 3.806 615 HB2 GLN 558 HB2 GLN 558 -5.470 -23.523 4.452 616 HB3 GLN 558 HB3 GLN 558 -4.425 -24.265 3.248 617 HG2 GLN 558 HG2 GLN 558 -3.926 -24.420 6.208 618 HG3 GLN 558 HG3 GLN 558 -4.830 -25.630 5.299 619 HE21 GLN 558 HE21 GLN 558 -2.616 -26.361 6.692 620 HE22 GLN 558 HE22 GLN 558 -1.335 -26.764 5.604 621 H LEU 559 H LEU 559 -3.084 -21.937 1.849 622 HA LEU 559 HA LEU 559 -4.338 -19.372 1.861 623 HB2 LEU 559 HB2 LEU 559 -2.402 -19.910 0.448 624 HB3 LEU 559 HB3 LEU 559 -3.393 -21.051 -0.458 625 HG LEU 559 HG LEU 559 -2.929 -18.743 -1.484 626 HD11 LEU 559 HD11 LEU 559 -5.851 -19.284 -1.374 627 HD12 LEU 559 HD12 LEU 559 -4.780 -20.538 -1.998 628 HD13 LEU 559 HD13 LEU 559 -4.814 -18.947 -2.759 629 HD21 LEU 559 HD21 LEU 559 -5.304 -17.780 -0.001 630 HD22 LEU 559 HD22 LEU 559 -3.944 -16.882 -0.676 631 HD23 LEU 559 HD23 LEU 559 -3.759 -17.750 0.849 632 H LEU 560 H LEU 560 -6.448 -19.026 1.771 633 HA LEU 560 HA LEU 560 -8.143 -20.992 0.379 634 HB2 LEU 560 HB2 LEU 560 -9.849 -20.599 1.882 635 HB3 LEU 560 HB3 LEU 560 -8.412 -20.519 2.900 636 HG LEU 560 HG LEU 560 -8.713 -17.907 2.257 637 HD11 LEU 560 HD11 LEU 560 -10.838 -17.259 1.878 638 HD12 LEU 560 HD12 LEU 560 -11.525 -18.559 2.850 639 HD13 LEU 560 HD13 LEU 560 -10.986 -18.881 1.202 640 HD21 LEU 560 HD21 LEU 560 -10.349 -18.331 4.510 641 HD22 LEU 560 HD22 LEU 560 -8.636 -17.910 4.474 642 HD23 LEU 560 HD23 LEU 560 -9.128 -19.604 4.520 643 H GLY 561 H GLY 561 -7.196 -17.664 0.587 644 HA2 GLY 561 HA2 GLY 561 -9.367 -16.708 -1.074 645 HA3 GLY 561 HA3 GLY 561 -8.004 -15.765 -0.489 646 H ASP 562 H ASP 562 -7.755 -14.828 -2.558 647 HA ASP 562 HA ASP 562 -5.887 -16.144 -4.215 648 HB2 ASP 562 HB2 ASP 562 -8.718 -16.453 -4.910 649 HB3 ASP 562 HB3 ASP 562 -7.740 -15.800 -6.221 650 H ALA 563 H ALA 563 -4.742 -14.665 -5.321 651 HA ALA 563 HA ALA 563 -4.985 -11.957 -4.871 652 HB1 ALA 563 HB1 ALA 563 -3.211 -13.594 -6.224 653 HB2 ALA 563 HB2 ALA 563 -3.797 -12.481 -7.462 654 HB3 ALA 563 HB3 ALA 563 -3.062 -11.852 -5.987 655 H GLN 564 H GLN 564 -6.539 -10.588 -5.422 656 HA GLN 564 HA GLN 564 -8.573 -11.096 -7.259 657 HB2 GLN 564 HB2 GLN 564 -7.673 -8.814 -5.656 658 HB3 GLN 564 HB3 GLN 564 -8.489 -8.351 -7.143 659 HG2 GLN 564 HG2 GLN 564 -9.579 -10.111 -4.959 660 HG3 GLN 564 HG3 GLN 564 -10.078 -8.465 -5.346 661 HE21 GLN 564 HE21 GLN 564 -11.528 -11.073 -5.295 662 HE22 GLN 564 HE22 GLN 564 -12.283 -11.189 -6.844 Start of MODEL 12 1 H MET 480 H MET 480 -2.197 -0.135 -1.151 2 HA MET 480 HA MET 480 -1.419 -0.621 -3.883 3 HB2 MET 480 HB2 MET 480 -0.126 1.152 -1.804 4 HB3 MET 480 HB3 MET 480 0.187 1.183 -3.534 5 HG2 MET 480 HG2 MET 480 -2.457 1.811 -2.243 6 HG3 MET 480 HG3 MET 480 -1.281 3.003 -2.790 7 HE1 MET 480 HE1 MET 480 -1.379 4.112 -4.529 8 HE2 MET 480 HE2 MET 480 -1.781 3.646 -6.182 9 HE3 MET 480 HE3 MET 480 -3.049 4.203 -5.089 10 H ALA 481 H ALA 481 -0.123 -2.229 -4.449 11 HA ALA 481 HA ALA 481 2.182 -2.861 -2.748 12 HB1 ALA 481 HB1 ALA 481 -0.046 -4.489 -2.854 13 HB2 ALA 481 HB2 ALA 481 1.076 -5.241 -3.989 14 HB3 ALA 481 HB3 ALA 481 1.568 -4.960 -2.319 15 H ASP 482 H ASP 482 3.293 -4.885 -4.183 16 HA ASP 482 HA ASP 482 4.317 -3.480 -6.470 17 HB2 ASP 482 HB2 ASP 482 5.334 -5.380 -4.741 18 HB3 ASP 482 HB3 ASP 482 5.093 -6.290 -6.230 19 H VAL 483 H VAL 483 2.262 -6.288 -5.912 20 HA VAL 483 HA VAL 483 1.548 -6.239 -8.766 21 HB VAL 483 HB VAL 483 2.983 -8.162 -8.475 22 HG11 VAL 483 HG11 VAL 483 2.561 -8.332 -5.992 23 HG12 VAL 483 HG12 VAL 483 1.079 -9.203 -6.390 24 HG13 VAL 483 HG13 VAL 483 2.645 -9.863 -6.864 25 HG21 VAL 483 HG21 VAL 483 0.345 -9.502 -8.481 26 HG22 VAL 483 HG22 VAL 483 0.588 -8.219 -9.665 27 HG23 VAL 483 HG23 VAL 483 1.674 -9.608 -9.635 28 H GLY 484 H GLY 484 0.616 -7.125 -5.473 29 HA2 GLY 484 HA2 GLY 484 -1.619 -6.275 -4.799 30 HA3 GLY 484 HA3 GLY 484 -2.209 -6.924 -6.322 31 H ASP 485 H ASP 485 0.112 -8.567 -4.272 32 HA ASP 485 HA ASP 485 -1.394 -10.962 -4.251 33 HB2 ASP 485 HB2 ASP 485 1.180 -10.515 -3.887 34 HB3 ASP 485 HB3 ASP 485 0.710 -10.437 -2.191 35 H MET 486 H MET 486 -3.444 -10.496 -3.426 36 HA MET 486 HA MET 486 -3.511 -10.069 -0.513 37 HB2 MET 486 HB2 MET 486 -4.326 -8.064 -1.637 38 HB3 MET 486 HB3 MET 486 -5.468 -9.025 -2.567 39 HG2 MET 486 HG2 MET 486 -6.509 -9.704 -0.383 40 HG3 MET 486 HG3 MET 486 -5.492 -8.488 0.387 41 HE1 MET 486 HE1 MET 486 -6.331 -6.382 0.982 42 HE2 MET 486 HE2 MET 486 -5.633 -5.764 -0.516 43 HE3 MET 486 HE3 MET 486 -7.265 -5.289 -0.041 44 H GLN 487 H GLN 487 -4.281 -11.778 0.523 45 HA GLN 487 HA GLN 487 -6.585 -13.207 -0.496 46 HB2 GLN 487 HB2 GLN 487 -3.995 -14.671 0.040 47 HB3 GLN 487 HB3 GLN 487 -5.529 -15.405 -0.407 48 HG2 GLN 487 HG2 GLN 487 -5.433 -14.177 -2.557 49 HG3 GLN 487 HG3 GLN 487 -3.831 -13.596 -2.107 50 HE21 GLN 487 HE21 GLN 487 -2.223 -14.709 -2.926 51 HE22 GLN 487 HE22 GLN 487 -2.250 -16.381 -3.359 52 H LEU 488 H LEU 488 -7.096 -15.094 1.105 53 HA LEU 488 HA LEU 488 -6.787 -13.994 3.815 54 HB2 LEU 488 HB2 LEU 488 -9.084 -14.198 2.808 55 HB3 LEU 488 HB3 LEU 488 -8.870 -15.947 2.860 56 HG LEU 488 HG LEU 488 -8.613 -15.764 5.340 57 HD11 LEU 488 HD11 LEU 488 -9.072 -12.900 4.679 58 HD12 LEU 488 HD12 LEU 488 -8.013 -13.628 5.887 59 HD13 LEU 488 HD13 LEU 488 -9.751 -13.544 6.175 60 HD21 LEU 488 HD21 LEU 488 -10.907 -15.772 3.764 61 HD22 LEU 488 HD22 LEU 488 -11.238 -14.597 5.038 62 HD23 LEU 488 HD23 LEU 488 -10.780 -16.248 5.458 63 H TYR 489 H TYR 489 -5.252 -14.996 4.934 64 HA TYR 489 HA TYR 489 -4.924 -17.901 4.590 65 HB2 TYR 489 HB2 TYR 489 -2.832 -16.290 5.961 66 HB3 TYR 489 HB3 TYR 489 -2.663 -17.688 4.905 67 HD1 TYR 489 HD1 TYR 489 -3.118 -14.037 5.006 68 HD2 TYR 489 HD2 TYR 489 -2.429 -17.428 2.530 69 HE1 TYR 489 HE1 TYR 489 -2.528 -12.548 3.140 70 HE2 TYR 489 HE2 TYR 489 -1.835 -15.948 0.658 71 HH TYR 489 HH TYR 489 -1.660 -12.440 1.074 72 H ARG 490 H ARG 490 -5.837 -19.045 6.153 73 HA ARG 490 HA ARG 490 -6.098 -17.873 8.827 74 HB2 ARG 490 HB2 ARG 490 -7.724 -19.701 9.230 75 HB3 ARG 490 HB3 ARG 490 -8.172 -18.672 7.877 76 HG2 ARG 490 HG2 ARG 490 -8.415 -20.512 6.669 77 HG3 ARG 490 HG3 ARG 490 -6.664 -20.718 6.746 78 HD2 ARG 490 HD2 ARG 490 -7.079 -22.656 7.771 79 HD3 ARG 490 HD3 ARG 490 -7.525 -21.689 9.176 80 HE ARG 490 HE ARG 490 -9.778 -21.870 7.569 81 HH11 ARG 490 HH11 ARG 490 -7.702 -24.012 9.364 82 HH12 ARG 490 HH12 ARG 490 -8.952 -25.169 9.682 83 HH21 ARG 490 HH21 ARG 490 -11.432 -23.385 7.981 84 HH22 ARG 490 HH22 ARG 490 -11.073 -24.812 8.894 85 H ILE 491 H ILE 491 -5.007 -18.636 10.535 86 HA ILE 491 HA ILE 491 -3.198 -20.900 10.088 87 HB ILE 491 HB ILE 491 -1.910 -20.104 11.960 88 HG12 ILE 491 HG12 ILE 491 -4.051 -17.992 12.298 89 HG13 ILE 491 HG13 ILE 491 -3.786 -19.360 13.373 90 HG21 ILE 491 HG21 ILE 491 -2.432 -18.557 9.618 91 HG22 ILE 491 HG22 ILE 491 -2.054 -17.473 10.957 92 HG23 ILE 491 HG23 ILE 491 -0.922 -18.748 10.508 93 HD11 ILE 491 HD11 ILE 491 -2.828 -17.429 14.374 94 HD12 ILE 491 HD12 ILE 491 -1.507 -18.460 13.824 95 HD13 ILE 491 HD13 ILE 491 -1.952 -17.028 12.897 96 H GLU 492 H GLU 492 -2.768 -22.297 12.029 97 HA GLU 492 HA GLU 492 -5.331 -23.109 13.174 98 HB2 GLU 492 HB2 GLU 492 -3.849 -24.752 11.971 99 HB3 GLU 492 HB3 GLU 492 -2.695 -24.578 13.286 100 HG2 GLU 492 HG2 GLU 492 -4.148 -25.569 14.838 101 HG3 GLU 492 HG3 GLU 492 -5.537 -25.406 13.765 102 H VAL 493 H VAL 493 -4.569 -20.843 14.356 103 HA VAL 493 HA VAL 493 -3.873 -21.733 17.052 104 HB VAL 493 HB VAL 493 -2.609 -19.245 15.926 105 HG11 VAL 493 HG11 VAL 493 -1.290 -19.247 17.870 106 HG12 VAL 493 HG12 VAL 493 -2.919 -19.633 18.426 107 HG13 VAL 493 HG13 VAL 493 -1.717 -20.913 18.259 108 HG21 VAL 493 HG21 VAL 493 -1.774 -21.099 14.609 109 HG22 VAL 493 HG22 VAL 493 -0.519 -20.536 15.713 110 HG23 VAL 493 HG23 VAL 493 -1.415 -22.012 16.075 111 H GLY 494 H GLY 494 -4.891 -20.616 18.672 112 HA2 GLY 494 HA2 GLY 494 -6.304 -18.144 18.044 113 HA3 GLY 494 HA3 GLY 494 -7.304 -19.524 18.472 114 H ARG 495 H ARG 495 -7.930 -17.893 20.176 115 HA ARG 495 HA ARG 495 -6.248 -17.062 22.219 116 HB2 ARG 495 HB2 ARG 495 -8.353 -17.044 23.630 117 HB3 ARG 495 HB3 ARG 495 -8.427 -16.137 22.125 118 HG2 ARG 495 HG2 ARG 495 -9.670 -17.915 21.067 119 HG3 ARG 495 HG3 ARG 495 -9.513 -18.918 22.511 120 HD2 ARG 495 HD2 ARG 495 -11.668 -17.999 22.643 121 HD3 ARG 495 HD3 ARG 495 -10.692 -17.035 23.751 122 HE ARG 495 HE ARG 495 -11.013 -15.208 22.400 123 HH11 ARG 495 HH11 ARG 495 -11.983 -18.090 20.704 124 HH12 ARG 495 HH12 ARG 495 -12.701 -17.229 19.384 125 HH21 ARG 495 HH21 ARG 495 -11.956 -14.063 20.668 126 HH22 ARG 495 HH22 ARG 495 -12.685 -14.938 19.364 127 H ASP 496 H ASP 496 -7.947 -20.124 21.804 128 HA ASP 496 HA ASP 496 -7.331 -21.176 24.364 129 HB2 ASP 496 HB2 ASP 496 -9.053 -21.951 22.509 130 HB3 ASP 496 HB3 ASP 496 -7.712 -22.980 22.014 131 H ASP 497 H ASP 497 -5.476 -20.724 21.538 132 HA ASP 497 HA ASP 497 -3.520 -22.763 22.279 133 HB2 ASP 497 HB2 ASP 497 -4.276 -22.328 19.871 134 HB3 ASP 497 HB3 ASP 497 -3.315 -20.854 19.954 135 H GLY 498 H GLY 498 -3.839 -19.255 21.993 136 HA2 GLY 498 HA2 GLY 498 -2.585 -18.144 23.918 137 HA3 GLY 498 HA3 GLY 498 -1.185 -18.968 23.249 138 H VAL 499 H VAL 499 -3.753 -17.506 21.344 139 HA VAL 499 HA VAL 499 -1.948 -15.308 20.609 140 HB VAL 499 HB VAL 499 -1.929 -17.258 18.930 141 HG11 VAL 499 HG11 VAL 499 -4.626 -17.082 19.105 142 HG12 VAL 499 HG12 VAL 499 -4.322 -16.119 17.658 143 HG13 VAL 499 HG13 VAL 499 -3.763 -17.790 17.740 144 HG21 VAL 499 HG21 VAL 499 -1.262 -14.775 18.616 145 HG22 VAL 499 HG22 VAL 499 -1.475 -15.792 17.191 146 HG23 VAL 499 HG23 VAL 499 -2.748 -14.669 17.671 147 H GLU 500 H GLU 500 -2.968 -13.418 19.875 148 HA GLU 500 HA GLU 500 -5.892 -13.348 20.224 149 HB2 GLU 500 HB2 GLU 500 -4.111 -11.051 20.998 150 HB3 GLU 500 HB3 GLU 500 -5.787 -11.335 21.443 151 HG2 GLU 500 HG2 GLU 500 -4.669 -13.504 22.543 152 HG3 GLU 500 HG3 GLU 500 -3.303 -12.393 22.626 153 H VAL 501 H VAL 501 -6.482 -10.838 19.512 154 HA VAL 501 HA VAL 501 -6.080 -10.880 16.672 155 HB VAL 501 HB VAL 501 -7.473 -8.849 18.422 156 HG11 VAL 501 HG11 VAL 501 -8.512 -8.070 16.325 157 HG12 VAL 501 HG12 VAL 501 -6.766 -7.816 16.351 158 HG13 VAL 501 HG13 VAL 501 -7.451 -9.150 15.421 159 HG21 VAL 501 HG21 VAL 501 -8.814 -10.801 16.592 160 HG22 VAL 501 HG22 VAL 501 -8.330 -11.287 18.217 161 HG23 VAL 501 HG23 VAL 501 -9.466 -9.957 17.997 162 H ARG 502 H ARG 502 -4.795 -9.071 19.374 163 HA ARG 502 HA ARG 502 -3.446 -7.170 17.638 164 HB2 ARG 502 HB2 ARG 502 -2.582 -6.228 19.777 165 HB3 ARG 502 HB3 ARG 502 -4.337 -6.291 19.694 166 HG2 ARG 502 HG2 ARG 502 -4.462 -8.063 21.211 167 HG3 ARG 502 HG3 ARG 502 -2.754 -8.462 21.020 168 HD2 ARG 502 HD2 ARG 502 -3.519 -5.772 22.058 169 HD3 ARG 502 HD3 ARG 502 -3.604 -7.165 23.136 170 HE ARG 502 HE ARG 502 -1.104 -7.070 21.802 171 HH11 ARG 502 HH11 ARG 502 -2.918 -5.577 24.371 172 HH12 ARG 502 HH12 ARG 502 -1.512 -5.111 25.269 173 HH21 ARG 502 HH21 ARG 502 0.755 -6.461 22.976 174 HH22 ARG 502 HH22 ARG 502 0.577 -5.613 24.474 175 H HIS 503 H HIS 503 -2.888 -10.272 18.543 176 HA HIS 503 HA HIS 503 -0.044 -10.069 19.036 177 HB2 HIS 503 HB2 HIS 503 -1.800 -11.870 19.885 178 HB3 HIS 503 HB3 HIS 503 -1.352 -12.671 18.383 179 HD1 HIS 503 HD1 HIS 503 1.707 -11.781 18.539 180 HD2 HIS 503 HD2 HIS 503 -0.479 -13.664 21.529 181 HE1 HIS 503 HE1 HIS 503 3.408 -12.927 19.995 182 H ILE 504 H ILE 504 -2.047 -11.632 16.529 183 HA ILE 504 HA ILE 504 0.151 -12.084 14.783 184 HB ILE 504 HB ILE 504 -1.395 -12.908 13.216 185 HG12 ILE 504 HG12 ILE 504 -2.837 -10.842 13.260 186 HG13 ILE 504 HG13 ILE 504 -3.724 -12.356 13.124 187 HG21 ILE 504 HG21 ILE 504 -2.572 -13.352 15.956 188 HG22 ILE 504 HG22 ILE 504 -2.892 -14.343 14.534 189 HG23 ILE 504 HG23 ILE 504 -1.266 -14.277 15.214 190 HD11 ILE 504 HD11 ILE 504 -4.857 -10.909 14.655 191 HD12 ILE 504 HD12 ILE 504 -4.163 -12.258 15.555 192 HD13 ILE 504 HD13 ILE 504 -3.383 -10.677 15.594 193 H VAL 505 H VAL 505 -1.990 -9.417 15.318 194 HA VAL 505 HA VAL 505 -1.471 -8.131 12.795 195 HB VAL 505 HB VAL 505 -2.793 -7.153 15.324 196 HG11 VAL 505 HG11 VAL 505 -3.522 -5.417 13.316 197 HG12 VAL 505 HG12 VAL 505 -2.357 -5.085 14.600 198 HG13 VAL 505 HG13 VAL 505 -1.799 -5.662 13.029 199 HG21 VAL 505 HG21 VAL 505 -4.835 -7.272 14.007 200 HG22 VAL 505 HG22 VAL 505 -3.917 -7.814 12.602 201 HG23 VAL 505 HG23 VAL 505 -4.027 -8.839 14.034 202 H GLY 506 H GLY 506 -0.673 -7.298 16.178 203 HA2 GLY 506 HA2 GLY 506 1.079 -5.199 15.578 204 HA3 GLY 506 HA3 GLY 506 1.089 -6.130 17.069 205 H ALA 507 H ALA 507 1.537 -8.601 15.321 206 HA ALA 507 HA ALA 507 4.392 -8.580 15.536 207 HB1 ALA 507 HB1 ALA 507 3.106 -10.593 16.023 208 HB2 ALA 507 HB2 ALA 507 2.554 -10.656 14.348 209 HB3 ALA 507 HB3 ALA 507 4.262 -10.882 14.722 210 H ILE 508 H ILE 508 2.233 -9.170 12.751 211 HA ILE 508 HA ILE 508 4.311 -8.902 10.837 212 HB ILE 508 HB ILE 508 2.544 -8.895 9.155 213 HG12 ILE 508 HG12 ILE 508 0.151 -9.269 10.320 214 HG13 ILE 508 HG13 ILE 508 0.877 -8.197 11.513 215 HG21 ILE 508 HG21 ILE 508 2.035 -11.091 9.411 216 HG22 ILE 508 HG22 ILE 508 3.230 -10.956 10.700 217 HG23 ILE 508 HG23 ILE 508 1.510 -10.889 11.082 218 HD11 ILE 508 HD11 ILE 508 0.470 -6.442 10.236 219 HD12 ILE 508 HD12 ILE 508 1.341 -7.170 8.885 220 HD13 ILE 508 HD13 ILE 508 -0.376 -7.503 9.110 221 H ALA 509 H ALA 509 2.074 -6.663 12.312 222 HA ALA 509 HA ALA 509 2.422 -4.544 10.447 223 HB1 ALA 509 HB1 ALA 509 1.291 -3.161 12.055 224 HB2 ALA 509 HB2 ALA 509 0.495 -4.734 11.995 225 HB3 ALA 509 HB3 ALA 509 1.575 -4.344 13.333 226 H ASN 510 H ASN 510 4.254 -5.702 13.145 227 HA ASN 510 HA ASN 510 5.852 -3.258 13.264 228 HB2 ASN 510 HB2 ASN 510 5.143 -4.306 15.385 229 HB3 ASN 510 HB3 ASN 510 6.021 -5.768 14.946 230 HD21 ASN 510 HD21 ASN 510 6.287 -2.452 15.949 231 HD22 ASN 510 HD22 ASN 510 7.956 -2.510 16.394 232 H GLU 511 H GLU 511 5.952 -6.500 12.057 233 HA GLU 511 HA GLU 511 8.754 -6.784 11.808 234 HB2 GLU 511 HB2 GLU 511 6.376 -8.112 10.572 235 HB3 GLU 511 HB3 GLU 511 7.969 -8.407 9.889 236 HG2 GLU 511 HG2 GLU 511 7.175 -8.892 12.751 237 HG3 GLU 511 HG3 GLU 511 7.328 -10.125 11.500 238 H GLY 512 H GLY 512 6.269 -5.477 9.661 239 HA2 GLY 512 HA2 GLY 512 8.441 -4.423 7.957 240 HA3 GLY 512 HA3 GLY 512 6.953 -5.062 7.275 241 H ASP 513 H ASP 513 6.264 -3.208 6.283 242 HA ASP 513 HA ASP 513 6.013 -0.768 7.859 243 HB2 ASP 513 HB2 ASP 513 6.803 -0.973 5.363 244 HB3 ASP 513 HB3 ASP 513 5.074 -1.009 5.025 245 H ILE 514 H ILE 514 4.161 -3.468 7.035 246 HA ILE 514 HA ILE 514 1.602 -2.519 6.651 247 HB ILE 514 HB ILE 514 2.407 -4.930 8.282 248 HG12 ILE 514 HG12 ILE 514 1.459 -4.996 5.438 249 HG13 ILE 514 HG13 ILE 514 3.144 -4.625 5.787 250 HG21 ILE 514 HG21 ILE 514 0.175 -4.633 8.812 251 HG22 ILE 514 HG22 ILE 514 -0.221 -3.976 7.224 252 HG23 ILE 514 HG23 ILE 514 0.089 -5.702 7.411 253 HD11 ILE 514 HD11 ILE 514 1.748 -7.092 6.782 254 HD12 ILE 514 HD12 ILE 514 2.665 -7.018 5.277 255 HD13 ILE 514 HD13 ILE 514 3.475 -6.737 6.818 256 H SER 515 H SER 515 -0.078 -1.870 7.953 257 HA SER 515 HA SER 515 0.639 -1.223 10.738 258 HB2 SER 515 HB2 SER 515 0.160 0.644 8.929 259 HB3 SER 515 HB3 SER 515 -1.522 0.262 9.297 260 HG SER 515 HG SER 515 0.182 1.755 10.698 261 H SER 516 H SER 516 -1.283 -1.022 12.204 262 HA SER 516 HA SER 516 -2.728 -3.443 12.221 263 HB2 SER 516 HB2 SER 516 -2.278 -2.413 14.321 264 HB3 SER 516 HB3 SER 516 -3.017 -0.894 13.815 265 HG SER 516 HG SER 516 -4.556 -1.865 15.009 266 H ARG 517 H ARG 517 -3.396 -0.330 10.866 267 HA ARG 517 HA ARG 517 -6.221 -0.944 10.480 268 HB2 ARG 517 HB2 ARG 517 -6.425 1.318 9.639 269 HB3 ARG 517 HB3 ARG 517 -5.548 1.336 11.163 270 HG2 ARG 517 HG2 ARG 517 -3.449 1.597 9.994 271 HG3 ARG 517 HG3 ARG 517 -4.273 1.471 8.439 272 HD2 ARG 517 HD2 ARG 517 -5.099 3.563 10.408 273 HD3 ARG 517 HD3 ARG 517 -3.670 3.813 9.405 274 HE ARG 517 HE ARG 517 -5.538 3.127 7.595 275 HH11 ARG 517 HH11 ARG 517 -5.510 5.459 10.180 276 HH12 ARG 517 HH12 ARG 517 -6.591 6.552 9.381 277 HH21 ARG 517 HH21 ARG 517 -6.961 4.558 6.532 278 HH22 ARG 517 HH22 ARG 517 -7.416 6.038 7.306 279 H TYR 518 H TYR 518 -3.226 -0.715 8.685 280 HA TYR 518 HA TYR 518 -4.263 -0.694 6.081 281 HB2 TYR 518 HB2 TYR 518 -1.736 -0.713 7.219 282 HB3 TYR 518 HB3 TYR 518 -1.802 -2.241 6.347 283 HD1 TYR 518 HD1 TYR 518 -3.101 -1.834 3.918 284 HD2 TYR 518 HD2 TYR 518 -0.690 0.958 6.038 285 HE1 TYR 518 HE1 TYR 518 -2.623 -0.656 1.812 286 HE2 TYR 518 HE2 TYR 518 -0.207 2.144 3.939 287 HH TYR 518 HH TYR 518 -1.628 2.290 1.539 288 H ILE 519 H ILE 519 -3.503 -3.365 8.265 289 HA ILE 519 HA ILE 519 -3.774 -5.516 6.557 290 HB ILE 519 HB ILE 519 -4.686 -5.358 9.432 291 HG12 ILE 519 HG12 ILE 519 -2.155 -6.696 8.700 292 HG13 ILE 519 HG13 ILE 519 -2.166 -4.947 8.506 293 HG21 ILE 519 HG21 ILE 519 -5.650 -7.285 8.341 294 HG22 ILE 519 HG22 ILE 519 -4.077 -7.739 7.687 295 HG23 ILE 519 HG23 ILE 519 -4.361 -7.806 9.426 296 HD11 ILE 519 HD11 ILE 519 -3.092 -4.917 10.909 297 HD12 ILE 519 HD12 ILE 519 -2.484 -6.571 10.990 298 HD13 ILE 519 HD13 ILE 519 -1.377 -5.240 10.655 299 H GLY 520 H GLY 520 -5.465 -6.779 5.832 300 HA2 GLY 520 HA2 GLY 520 -7.947 -5.436 5.403 301 HA3 GLY 520 HA3 GLY 520 -7.561 -7.082 4.925 302 H ASN 521 H ASN 521 -8.875 -8.528 5.788 303 HA ASN 521 HA ASN 521 -10.267 -7.901 8.276 304 HB2 ASN 521 HB2 ASN 521 -10.700 -9.861 6.052 305 HB3 ASN 521 HB3 ASN 521 -11.423 -10.173 7.628 306 HD21 ASN 521 HD21 ASN 521 -11.347 -8.035 4.879 307 HD22 ASN 521 HD22 ASN 521 -12.841 -7.234 5.211 308 H ILE 522 H ILE 522 -9.665 -8.711 10.169 309 HA ILE 522 HA ILE 522 -7.920 -11.087 10.184 310 HB ILE 522 HB ILE 522 -7.935 -8.917 12.278 311 HG12 ILE 522 HG12 ILE 522 -5.503 -8.864 10.876 312 HG13 ILE 522 HG13 ILE 522 -6.752 -8.934 9.639 313 HG21 ILE 522 HG21 ILE 522 -7.044 -11.450 12.497 314 HG22 ILE 522 HG22 ILE 522 -5.600 -10.663 11.865 315 HG23 ILE 522 HG23 ILE 522 -6.337 -10.084 13.359 316 HD11 ILE 522 HD11 ILE 522 -6.825 -6.721 9.867 317 HD12 ILE 522 HD12 ILE 522 -7.734 -7.043 11.345 318 HD13 ILE 522 HD13 ILE 522 -5.995 -6.760 11.422 319 H LYS 523 H LYS 523 -8.670 -12.812 11.219 320 HA LYS 523 HA LYS 523 -10.938 -12.455 13.064 321 HB2 LYS 523 HB2 LYS 523 -11.222 -13.796 10.882 322 HB3 LYS 523 HB3 LYS 523 -10.249 -15.031 11.669 323 HG2 LYS 523 HG2 LYS 523 -11.914 -15.053 13.527 324 HG3 LYS 523 HG3 LYS 523 -12.919 -13.970 12.561 325 HD2 LYS 523 HD2 LYS 523 -12.422 -15.906 10.750 326 HD3 LYS 523 HD3 LYS 523 -12.377 -16.853 12.239 327 HE2 LYS 523 HE2 LYS 523 -14.620 -16.856 11.352 328 HE3 LYS 523 HE3 LYS 523 -14.584 -15.928 12.850 329 HZ1 LYS 523 HZ1 LYS 523 -15.075 -14.026 11.786 330 HZ2 LYS 523 HZ2 LYS 523 -15.708 -15.056 10.603 331 HZ3 LYS 523 HZ3 LYS 523 -14.157 -14.406 10.416 332 H LEU 524 H LEU 524 -11.044 -13.828 14.927 333 HA LEU 524 HA LEU 524 -8.575 -15.190 15.691 334 HB2 LEU 524 HB2 LEU 524 -8.547 -12.782 16.477 335 HB3 LEU 524 HB3 LEU 524 -9.894 -13.209 17.530 336 HG LEU 524 HG LEU 524 -7.632 -13.156 18.621 337 HD11 LEU 524 HD11 LEU 524 -8.839 -15.897 18.756 338 HD12 LEU 524 HD12 LEU 524 -9.688 -14.481 19.375 339 HD13 LEU 524 HD13 LEU 524 -8.123 -14.935 20.049 340 HD21 LEU 524 HD21 LEU 524 -6.022 -14.786 18.183 341 HD22 LEU 524 HD22 LEU 524 -6.550 -14.274 16.580 342 HD23 LEU 524 HD23 LEU 524 -7.147 -15.786 17.265 343 H PHE 525 H PHE 525 -9.655 -17.146 15.623 344 HA PHE 525 HA PHE 525 -12.053 -17.490 17.240 345 HB2 PHE 525 HB2 PHE 525 -11.020 -18.725 14.903 346 HB3 PHE 525 HB3 PHE 525 -11.099 -19.961 16.154 347 HD1 PHE 525 HD1 PHE 525 -13.465 -19.182 17.668 348 HD2 PHE 525 HD2 PHE 525 -12.776 -19.153 13.468 349 HE1 PHE 525 HE1 PHE 525 -15.882 -19.425 17.273 350 HE2 PHE 525 HE2 PHE 525 -15.191 -19.395 13.066 351 HZ PHE 525 HZ PHE 525 -16.747 -19.533 14.970 352 H ALA 526 H ALA 526 -11.815 -20.078 18.098 353 HA ALA 526 HA ALA 526 -10.329 -19.780 20.485 354 HB1 ALA 526 HB1 ALA 526 -10.821 -22.413 20.473 355 HB2 ALA 526 HB2 ALA 526 -12.041 -21.205 20.878 356 HB3 ALA 526 HB3 ALA 526 -11.987 -21.894 19.256 357 H SER 527 H SER 527 -9.768 -21.688 17.545 358 HA SER 527 HA SER 527 -6.930 -21.841 18.275 359 HB2 SER 527 HB2 SER 527 -8.303 -23.999 18.772 360 HB3 SER 527 HB3 SER 527 -8.279 -24.217 17.022 361 HG SER 527 HG SER 527 -6.299 -24.869 17.188 362 H HIS 528 H HIS 528 -8.353 -20.135 16.427 363 HA HIS 528 HA HIS 528 -6.753 -20.658 14.077 364 HB2 HIS 528 HB2 HIS 528 -9.764 -20.715 14.009 365 HB3 HIS 528 HB3 HIS 528 -8.813 -20.310 12.583 366 HD1 HIS 528 HD1 HIS 528 -7.082 -22.246 11.808 367 HD2 HIS 528 HD2 HIS 528 -10.107 -23.383 14.418 368 HE1 HIS 528 HE1 HIS 528 -7.203 -24.752 11.645 369 H SER 529 H SER 529 -6.872 -18.837 12.512 370 HA SER 529 HA SER 529 -8.090 -16.377 13.268 371 HB2 SER 529 HB2 SER 529 -5.529 -15.415 13.381 372 HB3 SER 529 HB3 SER 529 -6.536 -15.751 14.789 373 HG SER 529 HG SER 529 -5.198 -17.273 15.302 374 H THR 530 H THR 530 -8.293 -15.117 11.519 375 HA THR 530 HA THR 530 -6.740 -15.851 9.131 376 HB THR 530 HB THR 530 -8.519 -15.047 7.777 377 HG1 THR 530 HG1 THR 530 -10.245 -13.874 8.619 378 HG21 THR 530 HG21 THR 530 -8.829 -17.193 9.351 379 HG22 THR 530 HG22 THR 530 -10.053 -16.674 8.193 380 HG23 THR 530 HG23 THR 530 -10.211 -16.241 9.895 381 H ILE 531 H ILE 531 -6.340 -14.031 7.581 382 HA ILE 531 HA ILE 531 -6.336 -11.340 8.425 383 HB ILE 531 HB ILE 531 -4.625 -12.000 9.995 384 HG12 ILE 531 HG12 ILE 531 -3.111 -10.701 7.745 385 HG13 ILE 531 HG13 ILE 531 -4.439 -9.861 8.538 386 HG21 ILE 531 HG21 ILE 531 -2.518 -13.008 9.274 387 HG22 ILE 531 HG22 ILE 531 -3.891 -14.048 8.898 388 HG23 ILE 531 HG23 ILE 531 -3.127 -13.101 7.621 389 HD11 ILE 531 HD11 ILE 531 -1.771 -10.626 9.609 390 HD12 ILE 531 HD12 ILE 531 -2.636 -9.092 9.718 391 HD13 ILE 531 HD13 ILE 531 -3.135 -10.460 10.713 392 H GLU 532 H GLU 532 -5.767 -9.957 6.779 393 HA GLU 532 HA GLU 532 -4.789 -11.221 4.303 394 HB2 GLU 532 HB2 GLU 532 -7.230 -10.564 4.299 395 HB3 GLU 532 HB3 GLU 532 -6.704 -8.892 4.436 396 HG2 GLU 532 HG2 GLU 532 -6.015 -8.783 2.289 397 HG3 GLU 532 HG3 GLU 532 -5.505 -10.470 2.250 398 H LEU 533 H LEU 533 -2.983 -10.387 3.494 399 HA LEU 533 HA LEU 533 -2.098 -7.760 4.482 400 HB2 LEU 533 HB2 LEU 533 -0.762 -10.305 4.093 401 HB3 LEU 533 HB3 LEU 533 0.080 -8.986 3.281 402 HG LEU 533 HG LEU 533 0.199 -7.777 5.428 403 HD11 LEU 533 HD11 LEU 533 -1.506 -10.014 6.273 404 HD12 LEU 533 HD12 LEU 533 -1.380 -8.374 6.908 405 HD13 LEU 533 HD13 LEU 533 -0.205 -9.598 7.388 406 HD21 LEU 533 HD21 LEU 533 1.739 -9.502 6.559 407 HD22 LEU 533 HD22 LEU 533 2.148 -8.949 4.934 408 HD23 LEU 533 HD23 LEU 533 1.378 -10.520 5.165 409 HA PRO 534 HA PRO 534 -2.724 -6.293 0.340 410 HB2 PRO 534 HB2 PRO 534 -1.610 -3.846 0.710 411 HB3 PRO 534 HB3 PRO 534 -3.220 -4.268 1.305 412 HG2 PRO 534 HG2 PRO 534 -0.616 -4.186 2.780 413 HG3 PRO 534 HG3 PRO 534 -2.212 -3.609 3.294 414 HD2 PRO 534 HD2 PRO 534 -1.181 -5.972 4.123 415 HD3 PRO 534 HD3 PRO 534 -2.923 -5.719 3.889 416 H LYS 535 H LYS 535 0.208 -7.013 1.844 417 HA LYS 535 HA LYS 535 2.195 -5.942 0.300 418 HB2 LYS 535 HB2 LYS 535 2.038 -8.801 1.275 419 HB3 LYS 535 HB3 LYS 535 3.506 -7.968 0.781 420 HG2 LYS 535 HG2 LYS 535 1.754 -7.203 3.108 421 HG3 LYS 535 HG3 LYS 535 3.292 -8.063 3.208 422 HD2 LYS 535 HD2 LYS 535 2.925 -5.295 2.063 423 HD3 LYS 535 HD3 LYS 535 3.507 -5.649 3.692 424 HE2 LYS 535 HE2 LYS 535 4.825 -6.432 1.094 425 HE3 LYS 535 HE3 LYS 535 5.377 -5.195 2.223 426 HZ1 LYS 535 HZ1 LYS 535 5.593 -8.092 2.393 427 HZ2 LYS 535 HZ2 LYS 535 5.276 -7.281 3.843 428 HZ3 LYS 535 HZ3 LYS 535 6.654 -6.894 2.940 429 H GLY 536 H GLY 536 3.305 -6.576 -1.591 430 HA2 GLY 536 HA2 GLY 536 1.804 -8.396 -3.364 431 HA3 GLY 536 HA3 GLY 536 2.341 -6.822 -3.931 432 H MET 537 H MET 537 3.966 -9.328 -1.994 433 HA MET 537 HA MET 537 5.637 -10.264 -4.048 434 HB2 MET 537 HB2 MET 537 6.416 -7.791 -3.571 435 HB3 MET 537 HB3 MET 537 7.227 -8.535 -2.199 436 HG2 MET 537 HG2 MET 537 7.601 -9.778 -4.863 437 HG3 MET 537 HG3 MET 537 8.399 -8.238 -4.550 438 HE1 MET 537 HE1 MET 537 11.595 -9.388 -3.264 439 HE2 MET 537 HE2 MET 537 10.941 -9.639 -4.883 440 HE3 MET 537 HE3 MET 537 10.579 -8.152 -4.005 441 HA PRO 538 HA PRO 538 5.487 -12.608 -0.029 442 HB2 PRO 538 HB2 PRO 538 4.622 -14.931 -1.136 443 HB3 PRO 538 HB3 PRO 538 3.523 -13.653 -0.604 444 HG2 PRO 538 HG2 PRO 538 4.510 -14.276 -3.361 445 HG3 PRO 538 HG3 PRO 538 2.874 -13.845 -2.828 446 HD2 PRO 538 HD2 PRO 538 4.549 -12.057 -3.980 447 HD3 PRO 538 HD3 PRO 538 3.357 -11.593 -2.750 448 H GLY 539 H GLY 539 6.281 -15.144 0.036 449 HA2 GLY 539 HA2 GLY 539 7.959 -16.677 -0.528 450 HA3 GLY 539 HA3 GLY 539 8.559 -15.545 -1.731 451 H GLU 540 H GLU 540 8.158 -13.695 0.900 452 HA GLU 540 HA GLU 540 10.977 -13.700 1.496 453 HB2 GLU 540 HB2 GLU 540 8.940 -12.100 3.010 454 HB3 GLU 540 HB3 GLU 540 10.608 -11.693 2.635 455 HG2 GLU 540 HG2 GLU 540 8.305 -11.763 0.700 456 HG3 GLU 540 HG3 GLU 540 9.102 -10.327 1.340 457 H VAL 541 H VAL 541 8.016 -14.133 3.435 458 HA VAL 541 HA VAL 541 9.484 -15.070 5.717 459 HB VAL 541 HB VAL 541 6.521 -15.088 5.131 460 HG11 VAL 541 HG11 VAL 541 6.865 -16.810 6.706 461 HG12 VAL 541 HG12 VAL 541 8.060 -15.865 7.595 462 HG13 VAL 541 HG13 VAL 541 6.358 -15.404 7.642 463 HG21 VAL 541 HG21 VAL 541 8.247 -13.265 6.801 464 HG22 VAL 541 HG22 VAL 541 7.399 -12.850 5.312 465 HG23 VAL 541 HG23 VAL 541 6.484 -13.229 6.771 466 H LEU 542 H LEU 542 7.691 -16.537 3.077 467 HA LEU 542 HA LEU 542 7.559 -19.155 4.122 468 HB2 LEU 542 HB2 LEU 542 7.305 -17.933 1.419 469 HB3 LEU 542 HB3 LEU 542 7.490 -19.681 1.539 470 HG LEU 542 HG LEU 542 5.131 -18.868 1.340 471 HD11 LEU 542 HD11 LEU 542 4.841 -20.150 3.853 472 HD12 LEU 542 HD12 LEU 542 6.242 -20.846 3.040 473 HD13 LEU 542 HD13 LEU 542 4.671 -20.838 2.238 474 HD21 LEU 542 HD21 LEU 542 5.523 -16.868 2.826 475 HD22 LEU 542 HD22 LEU 542 5.474 -17.978 4.195 476 HD23 LEU 542 HD23 LEU 542 4.059 -17.793 3.157 477 H GLN 543 H GLN 543 10.123 -17.345 2.717 478 HA GLN 543 HA GLN 543 11.703 -19.656 1.996 479 HB2 GLN 543 HB2 GLN 543 11.988 -16.711 1.780 480 HB3 GLN 543 HB3 GLN 543 13.477 -17.641 1.884 481 HG2 GLN 543 HG2 GLN 543 11.298 -18.153 -0.126 482 HG3 GLN 543 HG3 GLN 543 12.725 -17.163 -0.431 483 HE21 GLN 543 HE21 GLN 543 12.386 -19.165 -2.099 484 HE22 GLN 543 HE22 GLN 543 13.469 -20.471 -1.774 485 H HIS 544 H HIS 544 12.150 -16.964 4.298 486 HA HIS 544 HA HIS 544 14.262 -18.255 5.692 487 HB2 HIS 544 HB2 HIS 544 12.542 -15.855 6.259 488 HB3 HIS 544 HB3 HIS 544 13.682 -16.453 7.462 489 HD1 HIS 544 HD1 HIS 544 14.368 -13.762 6.674 490 HD2 HIS 544 HD2 HIS 544 15.531 -16.991 4.334 491 HE1 HIS 544 HE1 HIS 544 16.303 -12.933 5.298 492 H PHE 545 H PHE 545 10.880 -17.601 6.618 493 HA PHE 545 HA PHE 545 11.096 -19.458 8.839 494 HB2 PHE 545 HB2 PHE 545 8.841 -17.694 7.873 495 HB3 PHE 545 HB3 PHE 545 8.710 -18.770 9.260 496 HD1 PHE 545 HD1 PHE 545 9.292 -18.011 11.364 497 HD2 PHE 545 HD2 PHE 545 10.759 -15.965 7.932 498 HE1 PHE 545 HE1 PHE 545 10.229 -16.257 12.814 499 HE2 PHE 545 HE2 PHE 545 11.699 -14.209 9.376 500 HZ PHE 545 HZ PHE 545 11.435 -14.354 11.820 501 H THR 546 H THR 546 11.496 -20.787 6.489 502 HA THR 546 HA THR 546 9.060 -21.943 5.498 503 HB THR 546 HB THR 546 11.137 -21.712 4.116 504 HG1 THR 546 HG1 THR 546 10.946 -24.036 3.370 505 HG21 THR 546 HG21 THR 546 12.113 -24.112 5.660 506 HG22 THR 546 HG22 THR 546 12.683 -22.468 5.951 507 HG23 THR 546 HG23 THR 546 12.957 -23.232 4.386 508 H ARG 547 H ARG 547 11.458 -22.766 7.908 509 HA ARG 547 HA ARG 547 9.946 -25.223 8.512 510 HB2 ARG 547 HB2 ARG 547 12.011 -26.139 9.465 511 HB3 ARG 547 HB3 ARG 547 12.223 -25.714 7.772 512 HG2 ARG 547 HG2 ARG 547 12.959 -23.686 9.807 513 HG3 ARG 547 HG3 ARG 547 14.011 -25.090 9.611 514 HD2 ARG 547 HD2 ARG 547 13.669 -24.437 7.037 515 HD3 ARG 547 HD3 ARG 547 13.467 -22.843 7.765 516 HE ARG 547 HE ARG 547 15.711 -22.800 8.164 517 HH11 ARG 547 HH11 ARG 547 14.732 -26.103 7.664 518 HH12 ARG 547 HH12 ARG 547 16.349 -26.725 7.702 519 HH21 ARG 547 HH21 ARG 547 17.844 -23.607 8.215 520 HH22 ARG 547 HH22 ARG 547 18.118 -25.304 8.017 521 H THR 548 H THR 548 11.133 -22.211 9.674 522 HA THR 548 HA THR 548 10.392 -22.905 12.434 523 HB THR 548 HB THR 548 12.002 -20.558 11.409 524 HG1 THR 548 HG1 THR 548 12.643 -23.074 12.461 525 HG21 THR 548 HG21 THR 548 10.700 -19.984 13.410 526 HG22 THR 548 HG22 THR 548 12.427 -20.059 13.763 527 HG23 THR 548 HG23 THR 548 11.370 -21.386 14.244 528 H ARG 549 H ARG 549 8.496 -22.229 13.171 529 HA ARG 549 HA ARG 549 7.437 -19.646 12.363 530 HB2 ARG 549 HB2 ARG 549 6.026 -22.256 11.818 531 HB3 ARG 549 HB3 ARG 549 5.175 -20.720 11.908 532 HG2 ARG 549 HG2 ARG 549 5.517 -20.814 9.669 533 HG3 ARG 549 HG3 ARG 549 7.017 -20.015 10.143 534 HD2 ARG 549 HD2 ARG 549 8.265 -21.749 9.490 535 HD3 ARG 549 HD3 ARG 549 7.199 -22.913 10.277 536 HE ARG 549 HE ARG 549 7.143 -22.089 7.508 537 HH11 ARG 549 HH11 ARG 549 5.413 -23.597 10.126 538 HH12 ARG 549 HH12 ARG 549 4.333 -24.465 9.086 539 HH21 ARG 549 HH21 ARG 549 5.728 -23.227 6.128 540 HH22 ARG 549 HH22 ARG 549 4.514 -24.255 6.812 541 H ILE 550 H ILE 550 5.170 -19.390 13.523 542 HA ILE 550 HA ILE 550 4.817 -20.796 15.977 543 HB ILE 550 HB ILE 550 6.834 -19.166 16.325 544 HG12 ILE 550 HG12 ILE 550 4.912 -18.696 18.494 545 HG13 ILE 550 HG13 ILE 550 5.017 -20.380 17.991 546 HG21 ILE 550 HG21 ILE 550 4.796 -17.184 17.138 547 HG22 ILE 550 HG22 ILE 550 6.444 -16.946 16.559 548 HG23 ILE 550 HG23 ILE 550 5.150 -17.302 15.414 549 HD11 ILE 550 HD11 ILE 550 6.941 -18.717 19.438 550 HD12 ILE 550 HD12 ILE 550 6.696 -20.464 19.461 551 HD13 ILE 550 HD13 ILE 550 7.638 -19.722 18.168 552 H LEU 551 H LEU 551 3.328 -19.265 17.476 553 HA LEU 551 HA LEU 551 0.854 -19.134 16.464 554 HB2 LEU 551 HB2 LEU 551 0.270 -17.503 18.124 555 HB3 LEU 551 HB3 LEU 551 1.456 -18.619 18.797 556 HG LEU 551 HG LEU 551 3.113 -16.675 18.012 557 HD11 LEU 551 HD11 LEU 551 0.891 -14.979 18.996 558 HD12 LEU 551 HD12 LEU 551 0.862 -15.463 17.301 559 HD13 LEU 551 HD13 LEU 551 2.246 -14.578 17.941 560 HD21 LEU 551 HD21 LEU 551 3.148 -15.928 20.294 561 HD22 LEU 551 HD22 LEU 551 2.847 -17.666 20.274 562 HD23 LEU 551 HD23 LEU 551 1.518 -16.544 20.567 563 H ASN 552 H ASN 552 3.291 -16.594 16.101 564 HA ASN 552 HA ASN 552 1.544 -14.863 14.622 565 HB2 ASN 552 HB2 ASN 552 3.226 -13.722 15.796 566 HB3 ASN 552 HB3 ASN 552 4.481 -14.838 15.266 567 HD21 ASN 552 HD21 ASN 552 5.805 -13.248 14.466 568 HD22 ASN 552 HD22 ASN 552 5.432 -12.343 13.042 569 H LYS 553 H LYS 553 4.557 -16.538 13.697 570 HA LYS 553 HA LYS 553 4.227 -16.169 10.932 571 HB2 LYS 553 HB2 LYS 553 5.691 -18.535 12.051 572 HB3 LYS 553 HB3 LYS 553 6.094 -17.541 10.657 573 HG2 LYS 553 HG2 LYS 553 6.376 -16.811 13.561 574 HG3 LYS 553 HG3 LYS 553 7.667 -17.081 12.388 575 HD2 LYS 553 HD2 LYS 553 5.625 -14.860 12.298 576 HD3 LYS 553 HD3 LYS 553 7.314 -14.695 12.784 577 HE2 LYS 553 HE2 LYS 553 7.881 -14.369 10.663 578 HE3 LYS 553 HE3 LYS 553 7.279 -15.977 10.263 579 HZ1 LYS 553 HZ1 LYS 553 6.308 -13.775 9.181 580 HZ2 LYS 553 HZ2 LYS 553 5.291 -13.864 10.530 581 HZ3 LYS 553 HZ3 LYS 553 5.361 -15.154 9.437 582 HA PRO 554 HA PRO 554 1.407 -19.256 9.605 583 HB2 PRO 554 HB2 PRO 554 2.584 -20.240 7.366 584 HB3 PRO 554 HB3 PRO 554 1.862 -18.628 7.442 585 HG2 PRO 554 HG2 PRO 554 4.737 -19.429 7.677 586 HG3 PRO 554 HG3 PRO 554 4.022 -18.073 6.784 587 HD2 PRO 554 HD2 PRO 554 5.203 -17.765 9.201 588 HD3 PRO 554 HD3 PRO 554 3.835 -16.765 8.672 589 H MET 555 H MET 555 2.008 -20.539 11.588 590 HA MET 555 HA MET 555 3.881 -22.651 11.446 591 HB2 MET 555 HB2 MET 555 3.165 -21.904 13.599 592 HB3 MET 555 HB3 MET 555 1.475 -22.193 13.207 593 HG2 MET 555 HG2 MET 555 2.281 -23.905 14.692 594 HG3 MET 555 HG3 MET 555 1.920 -24.601 13.114 595 HE1 MET 555 HE1 MET 555 3.085 -26.193 14.917 596 HE2 MET 555 HE2 MET 555 4.583 -26.867 14.275 597 HE3 MET 555 HE3 MET 555 4.632 -25.744 15.635 598 H ASN 556 H ASN 556 0.333 -22.639 11.114 599 HA ASN 556 HA ASN 556 0.508 -24.854 9.246 600 HB2 ASN 556 HB2 ASN 556 0.297 -25.745 11.666 601 HB3 ASN 556 HB3 ASN 556 -1.359 -25.152 11.586 602 HD21 ASN 556 HD21 ASN 556 0.175 -27.869 11.521 603 HD22 ASN 556 HD22 ASN 556 -0.687 -28.750 10.310 604 H MET 557 H MET 557 -0.143 -22.695 8.170 605 HA MET 557 HA MET 557 -3.053 -22.312 8.342 606 HB2 MET 557 HB2 MET 557 -2.568 -20.194 7.044 607 HB3 MET 557 HB3 MET 557 -1.940 -20.244 8.686 608 HG2 MET 557 HG2 MET 557 0.130 -19.928 7.976 609 HG3 MET 557 HG3 MET 557 0.005 -21.272 6.843 610 HE1 MET 557 HE1 MET 557 -0.208 -19.762 3.503 611 HE2 MET 557 HE2 MET 557 0.296 -21.074 4.569 612 HE3 MET 557 HE3 MET 557 -1.420 -20.771 4.294 613 H GLN 558 H GLN 558 -3.994 -21.576 6.129 614 HA GLN 558 HA GLN 558 -2.814 -22.986 3.872 615 HB2 GLN 558 HB2 GLN 558 -5.677 -23.549 4.613 616 HB3 GLN 558 HB3 GLN 558 -4.674 -24.380 3.432 617 HG2 GLN 558 HG2 GLN 558 -3.254 -25.187 5.314 618 HG3 GLN 558 HG3 GLN 558 -4.432 -24.493 6.426 619 HE21 GLN 558 HE21 GLN 558 -4.317 -26.874 7.039 620 HE22 GLN 558 HE22 GLN 558 -5.483 -27.907 6.292 621 H LEU 559 H LEU 559 -3.312 -22.093 1.924 622 HA LEU 559 HA LEU 559 -4.502 -19.495 1.931 623 HB2 LEU 559 HB2 LEU 559 -2.600 -20.197 0.479 624 HB3 LEU 559 HB3 LEU 559 -3.730 -21.192 -0.437 625 HG LEU 559 HG LEU 559 -3.091 -18.939 -1.428 626 HD11 LEU 559 HD11 LEU 559 -5.007 -18.980 -2.606 627 HD12 LEU 559 HD12 LEU 559 -6.022 -18.923 -1.166 628 HD13 LEU 559 HD13 LEU 559 -5.310 -20.451 -1.682 629 HD21 LEU 559 HD21 LEU 559 -3.650 -17.952 1.019 630 HD22 LEU 559 HD22 LEU 559 -5.186 -17.664 0.203 631 HD23 LEU 559 HD23 LEU 559 -3.695 -16.996 -0.462 632 H LEU 560 H LEU 560 -6.589 -19.043 1.786 633 HA LEU 560 HA LEU 560 -8.368 -21.004 0.492 634 HB2 LEU 560 HB2 LEU 560 -10.050 -20.518 2.011 635 HB3 LEU 560 HB3 LEU 560 -8.593 -20.540 3.002 636 HG LEU 560 HG LEU 560 -8.716 -17.915 2.451 637 HD11 LEU 560 HD11 LEU 560 -10.746 -17.102 1.960 638 HD12 LEU 560 HD12 LEU 560 -11.579 -18.294 2.959 639 HD13 LEU 560 HD13 LEU 560 -11.053 -18.721 1.330 640 HD21 LEU 560 HD21 LEU 560 -10.441 -18.231 4.636 641 HD22 LEU 560 HD22 LEU 560 -8.690 -18.023 4.668 642 HD23 LEU 560 HD23 LEU 560 -9.386 -19.644 4.644 643 H GLY 561 H GLY 561 -7.425 -17.654 0.745 644 HA2 GLY 561 HA2 GLY 561 -9.572 -16.683 -0.921 645 HA3 GLY 561 HA3 GLY 561 -8.187 -15.760 -0.357 646 H ASP 562 H ASP 562 -8.037 -14.842 -2.469 647 HA ASP 562 HA ASP 562 -6.206 -16.227 -4.150 648 HB2 ASP 562 HB2 ASP 562 -8.657 -17.074 -4.705 649 HB3 ASP 562 HB3 ASP 562 -8.718 -15.572 -5.624 650 H ALA 563 H ALA 563 -4.911 -14.740 -5.000 651 HA ALA 563 HA ALA 563 -5.145 -12.025 -4.594 652 HB1 ALA 563 HB1 ALA 563 -3.125 -11.935 -5.538 653 HB2 ALA 563 HB2 ALA 563 -3.255 -13.687 -5.702 654 HB3 ALA 563 HB3 ALA 563 -3.705 -12.640 -7.047 655 H GLN 564 H GLN 564 -6.286 -10.431 -5.486 656 HA GLN 564 HA GLN 564 -8.378 -10.816 -7.243 657 HB2 GLN 564 HB2 GLN 564 -7.552 -8.734 -5.759 658 HB3 GLN 564 HB3 GLN 564 -7.042 -8.169 -7.344 659 HG2 GLN 564 HG2 GLN 564 -9.190 -7.289 -7.002 660 HG3 GLN 564 HG3 GLN 564 -9.392 -8.628 -8.130 661 HE21 GLN 564 HE21 GLN 564 -11.446 -9.193 -7.690 662 HE22 GLN 564 HE22 GLN 564 -11.997 -9.758 -6.154 Start of MODEL 13 1 H MET 480 H MET 480 1.628 0.739 0.901 2 HA MET 480 HA MET 480 0.964 0.418 -1.788 3 HB2 MET 480 HB2 MET 480 2.423 2.210 -0.966 4 HB3 MET 480 HB3 MET 480 3.668 1.030 -0.580 5 HG2 MET 480 HG2 MET 480 4.347 1.964 -2.601 6 HG3 MET 480 HG3 MET 480 3.629 0.418 -3.046 7 HE1 MET 480 HE1 MET 480 1.694 1.498 -5.954 8 HE2 MET 480 HE2 MET 480 3.140 0.683 -5.360 9 HE3 MET 480 HE3 MET 480 1.551 0.214 -4.754 10 H ALA 481 H ALA 481 0.831 -1.486 -2.789 11 HA ALA 481 HA ALA 481 2.847 -3.544 -2.229 12 HB1 ALA 481 HB1 ALA 481 0.020 -3.595 -2.872 13 HB2 ALA 481 HB2 ALA 481 0.959 -4.673 -3.907 14 HB3 ALA 481 HB3 ALA 481 1.039 -4.842 -2.153 15 H ASP 482 H ASP 482 3.021 -5.026 -4.383 16 HA ASP 482 HA ASP 482 4.116 -3.206 -6.408 17 HB2 ASP 482 HB2 ASP 482 5.357 -5.243 -5.158 18 HB3 ASP 482 HB3 ASP 482 4.697 -6.112 -6.542 19 H VAL 483 H VAL 483 1.850 -5.824 -5.931 20 HA VAL 483 HA VAL 483 0.863 -5.394 -8.667 21 HB VAL 483 HB VAL 483 2.088 -7.468 -8.767 22 HG11 VAL 483 HG11 VAL 483 1.686 -9.332 -7.314 23 HG12 VAL 483 HG12 VAL 483 2.027 -7.917 -6.317 24 HG13 VAL 483 HG13 VAL 483 0.367 -8.482 -6.509 25 HG21 VAL 483 HG21 VAL 483 0.473 -8.744 -9.792 26 HG22 VAL 483 HG22 VAL 483 -0.727 -8.428 -8.539 27 HG23 VAL 483 HG23 VAL 483 -0.338 -7.179 -9.721 28 H GLY 484 H GLY 484 0.193 -6.575 -5.401 29 HA2 GLY 484 HA2 GLY 484 -1.850 -5.580 -4.386 30 HA3 GLY 484 HA3 GLY 484 -2.666 -6.001 -5.884 31 H ASP 485 H ASP 485 -0.324 -8.144 -4.461 32 HA ASP 485 HA ASP 485 -1.915 -10.395 -4.510 33 HB2 ASP 485 HB2 ASP 485 0.662 -10.011 -3.968 34 HB3 ASP 485 HB3 ASP 485 0.086 -10.170 -2.311 35 H MET 486 H MET 486 -3.910 -10.407 -3.644 36 HA MET 486 HA MET 486 -4.128 -9.830 -0.763 37 HB2 MET 486 HB2 MET 486 -5.253 -8.188 -2.428 38 HB3 MET 486 HB3 MET 486 -6.433 -9.472 -2.655 39 HG2 MET 486 HG2 MET 486 -7.463 -8.307 -1.008 40 HG3 MET 486 HG3 MET 486 -6.498 -9.402 -0.022 41 HE1 MET 486 HE1 MET 486 -7.136 -5.536 -0.847 42 HE2 MET 486 HE2 MET 486 -5.451 -5.020 -0.925 43 HE3 MET 486 HE3 MET 486 -6.063 -6.211 -2.073 44 H GLN 487 H GLN 487 -4.599 -11.588 0.366 45 HA GLN 487 HA GLN 487 -6.595 -13.459 -0.588 46 HB2 GLN 487 HB2 GLN 487 -3.804 -14.411 0.079 47 HB3 GLN 487 HB3 GLN 487 -5.175 -15.426 -0.349 48 HG2 GLN 487 HG2 GLN 487 -5.227 -14.425 -2.574 49 HG3 GLN 487 HG3 GLN 487 -3.856 -13.403 -2.146 50 HE21 GLN 487 HE21 GLN 487 -4.898 -16.714 -2.655 51 HE22 GLN 487 HE22 GLN 487 -3.332 -17.351 -3.012 52 H LEU 488 H LEU 488 -6.819 -15.299 1.124 53 HA LEU 488 HA LEU 488 -6.627 -14.050 3.785 54 HB2 LEU 488 HB2 LEU 488 -8.925 -14.359 2.817 55 HB3 LEU 488 HB3 LEU 488 -8.648 -16.098 2.899 56 HG LEU 488 HG LEU 488 -8.353 -15.837 5.379 57 HD11 LEU 488 HD11 LEU 488 -9.778 -13.544 5.914 58 HD12 LEU 488 HD12 LEU 488 -8.673 -13.046 4.633 59 HD13 LEU 488 HD13 LEU 488 -8.039 -13.759 6.116 60 HD21 LEU 488 HD21 LEU 488 -11.061 -14.814 4.850 61 HD22 LEU 488 HD22 LEU 488 -10.540 -16.282 5.679 62 HD23 LEU 488 HD23 LEU 488 -10.587 -16.232 3.916 63 H TYR 489 H TYR 489 -5.050 -14.963 4.922 64 HA TYR 489 HA TYR 489 -4.546 -17.841 4.596 65 HB2 TYR 489 HB2 TYR 489 -2.717 -15.910 6.004 66 HB3 TYR 489 HB3 TYR 489 -2.326 -17.474 5.298 67 HD1 TYR 489 HD1 TYR 489 -3.115 -13.952 4.531 68 HD2 TYR 489 HD2 TYR 489 -1.761 -17.679 2.989 69 HE1 TYR 489 HE1 TYR 489 -2.412 -12.832 2.457 70 HE2 TYR 489 HE2 TYR 489 -1.053 -16.570 0.912 71 HH TYR 489 HH TYR 489 -1.712 -13.147 0.340 72 H ARG 490 H ARG 490 -5.523 -19.058 6.065 73 HA ARG 490 HA ARG 490 -5.980 -17.981 8.754 74 HB2 ARG 490 HB2 ARG 490 -7.626 -19.724 9.026 75 HB3 ARG 490 HB3 ARG 490 -7.916 -18.902 7.499 76 HG2 ARG 490 HG2 ARG 490 -8.060 -20.972 6.669 77 HG3 ARG 490 HG3 ARG 490 -6.296 -20.927 6.704 78 HD2 ARG 490 HD2 ARG 490 -6.635 -22.872 7.841 79 HD3 ARG 490 HD3 ARG 490 -6.695 -21.740 9.192 80 HE ARG 490 HE ARG 490 -8.928 -22.204 9.447 81 HH11 ARG 490 HH11 ARG 490 -7.822 -23.454 6.391 82 HH12 ARG 490 HH12 ARG 490 -9.282 -24.330 6.073 83 HH21 ARG 490 HH21 ARG 490 -10.855 -23.354 9.039 84 HH22 ARG 490 HH22 ARG 490 -11.007 -24.272 7.579 85 H ILE 491 H ILE 491 -4.930 -18.734 10.488 86 HA ILE 491 HA ILE 491 -3.061 -20.964 10.088 87 HB ILE 491 HB ILE 491 -1.791 -20.122 11.944 88 HG12 ILE 491 HG12 ILE 491 -3.987 -18.064 12.265 89 HG13 ILE 491 HG13 ILE 491 -3.654 -19.398 13.364 90 HG21 ILE 491 HG21 ILE 491 -2.041 -17.496 10.879 91 HG22 ILE 491 HG22 ILE 491 -0.807 -18.710 10.546 92 HG23 ILE 491 HG23 ILE 491 -2.276 -18.657 9.572 93 HD11 ILE 491 HD11 ILE 491 -2.760 -17.409 14.311 94 HD12 ILE 491 HD12 ILE 491 -1.407 -18.402 13.766 95 HD13 ILE 491 HD13 ILE 491 -1.918 -17.008 12.814 96 H GLU 492 H GLU 492 -2.648 -22.330 12.048 97 HA GLU 492 HA GLU 492 -5.219 -23.130 13.188 98 HB2 GLU 492 HB2 GLU 492 -3.715 -24.785 12.020 99 HB3 GLU 492 HB3 GLU 492 -2.583 -24.592 13.350 100 HG2 GLU 492 HG2 GLU 492 -4.638 -25.209 14.825 101 HG3 GLU 492 HG3 GLU 492 -5.268 -25.884 13.323 102 H VAL 493 H VAL 493 -4.487 -20.848 14.344 103 HA VAL 493 HA VAL 493 -3.789 -21.694 17.055 104 HB VAL 493 HB VAL 493 -2.562 -19.201 15.897 105 HG11 VAL 493 HG11 VAL 493 -1.650 -20.816 18.260 106 HG12 VAL 493 HG12 VAL 493 -1.257 -19.145 17.848 107 HG13 VAL 493 HG13 VAL 493 -2.880 -19.560 18.403 108 HG21 VAL 493 HG21 VAL 493 -1.335 -21.950 16.087 109 HG22 VAL 493 HG22 VAL 493 -1.684 -21.051 14.610 110 HG23 VAL 493 HG23 VAL 493 -0.448 -20.468 15.725 111 H GLY 494 H GLY 494 -4.830 -20.575 18.658 112 HA2 GLY 494 HA2 GLY 494 -6.282 -18.134 17.995 113 HA3 GLY 494 HA3 GLY 494 -7.260 -19.526 18.438 114 H ARG 495 H ARG 495 -7.918 -17.883 20.119 115 HA ARG 495 HA ARG 495 -6.248 -17.006 22.157 116 HB2 ARG 495 HB2 ARG 495 -8.367 -16.996 23.558 117 HB3 ARG 495 HB3 ARG 495 -8.427 -16.092 22.051 118 HG2 ARG 495 HG2 ARG 495 -9.730 -17.760 20.994 119 HG3 ARG 495 HG3 ARG 495 -9.449 -18.905 22.308 120 HD2 ARG 495 HD2 ARG 495 -11.036 -16.344 22.446 121 HD3 ARG 495 HD3 ARG 495 -11.677 -17.986 22.488 122 HE ARG 495 HE ARG 495 -10.542 -16.523 24.671 123 HH11 ARG 495 HH11 ARG 495 -11.085 -19.707 23.372 124 HH12 ARG 495 HH12 ARG 495 -11.029 -20.489 24.917 125 HH21 ARG 495 HH21 ARG 495 -10.466 -17.540 26.711 126 HH22 ARG 495 HH22 ARG 495 -10.678 -19.255 26.816 127 H ASP 496 H ASP 496 -7.862 -20.101 21.730 128 HA ASP 496 HA ASP 496 -7.271 -21.111 24.323 129 HB2 ASP 496 HB2 ASP 496 -9.006 -21.927 22.535 130 HB3 ASP 496 HB3 ASP 496 -7.659 -22.901 21.951 131 H ASP 497 H ASP 497 -5.407 -20.661 21.507 132 HA ASP 497 HA ASP 497 -3.436 -22.678 22.274 133 HB2 ASP 497 HB2 ASP 497 -4.181 -22.303 19.862 134 HB3 ASP 497 HB3 ASP 497 -3.265 -20.799 19.921 135 H GLY 498 H GLY 498 -3.783 -19.177 21.929 136 HA2 GLY 498 HA2 GLY 498 -2.543 -18.032 23.849 137 HA3 GLY 498 HA3 GLY 498 -1.134 -18.846 23.183 138 H VAL 499 H VAL 499 -3.731 -17.425 21.283 139 HA VAL 499 HA VAL 499 -1.960 -15.210 20.523 140 HB VAL 499 HB VAL 499 -1.893 -17.169 18.861 141 HG11 VAL 499 HG11 VAL 499 -4.599 -17.052 19.035 142 HG12 VAL 499 HG12 VAL 499 -4.309 -16.119 17.566 143 HG13 VAL 499 HG13 VAL 499 -3.714 -17.775 17.693 144 HG21 VAL 499 HG21 VAL 499 -2.791 -14.655 17.527 145 HG22 VAL 499 HG22 VAL 499 -1.343 -14.632 18.533 146 HG23 VAL 499 HG23 VAL 499 -1.431 -15.710 17.140 147 H GLU 500 H GLU 500 -3.014 -13.347 19.759 148 HA GLU 500 HA GLU 500 -5.939 -13.328 20.097 149 HB2 GLU 500 HB2 GLU 500 -4.207 -10.994 20.868 150 HB3 GLU 500 HB3 GLU 500 -5.880 -11.307 21.305 151 HG2 GLU 500 HG2 GLU 500 -3.457 -12.786 22.302 152 HG3 GLU 500 HG3 GLU 500 -4.452 -11.650 23.211 153 H VAL 501 H VAL 501 -6.579 -10.841 19.362 154 HA VAL 501 HA VAL 501 -6.150 -10.890 16.526 155 HB VAL 501 HB VAL 501 -7.594 -8.862 18.240 156 HG11 VAL 501 HG11 VAL 501 -7.323 -7.635 16.349 157 HG12 VAL 501 HG12 VAL 501 -7.100 -9.056 15.326 158 HG13 VAL 501 HG13 VAL 501 -8.720 -8.581 15.839 159 HG21 VAL 501 HG21 VAL 501 -9.555 -10.030 17.872 160 HG22 VAL 501 HG22 VAL 501 -8.913 -10.874 16.463 161 HG23 VAL 501 HG23 VAL 501 -8.387 -11.334 18.082 162 H ARG 502 H ARG 502 -4.956 -9.009 19.228 163 HA ARG 502 HA ARG 502 -3.621 -7.103 17.489 164 HB2 ARG 502 HB2 ARG 502 -2.812 -6.115 19.628 165 HB3 ARG 502 HB3 ARG 502 -4.564 -6.220 19.518 166 HG2 ARG 502 HG2 ARG 502 -4.671 -7.983 21.052 167 HG3 ARG 502 HG3 ARG 502 -2.947 -8.331 20.901 168 HD2 ARG 502 HD2 ARG 502 -3.726 -5.630 21.848 169 HD3 ARG 502 HD3 ARG 502 -3.959 -6.980 22.958 170 HE ARG 502 HE ARG 502 -1.419 -7.323 22.098 171 HH11 ARG 502 HH11 ARG 502 -3.139 -4.613 23.448 172 HH12 ARG 502 HH12 ARG 502 -1.735 -3.928 24.197 173 HH21 ARG 502 HH21 ARG 502 0.436 -6.430 23.079 174 HH22 ARG 502 HH22 ARG 502 0.298 -4.962 23.986 175 H HIS 503 H HIS 503 -3.003 -10.180 18.424 176 HA HIS 503 HA HIS 503 -0.175 -9.908 18.973 177 HB2 HIS 503 HB2 HIS 503 -1.900 -11.746 19.797 178 HB3 HIS 503 HB3 HIS 503 -1.413 -12.540 18.302 179 HD1 HIS 503 HD1 HIS 503 -0.757 -13.726 21.093 180 HD2 HIS 503 HD2 HIS 503 1.827 -11.361 18.859 181 HE1 HIS 503 HE1 HIS 503 1.551 -14.290 21.916 182 H ILE 504 H ILE 504 -2.086 -11.530 16.432 183 HA ILE 504 HA ILE 504 0.166 -11.913 14.731 184 HB ILE 504 HB ILE 504 -1.314 -12.816 13.146 185 HG12 ILE 504 HG12 ILE 504 -2.844 -10.814 13.145 186 HG13 ILE 504 HG13 ILE 504 -3.663 -12.367 13.006 187 HG21 ILE 504 HG21 ILE 504 -2.517 -13.287 15.870 188 HG22 ILE 504 HG22 ILE 504 -2.775 -14.302 14.452 189 HG23 ILE 504 HG23 ILE 504 -1.164 -14.164 15.156 190 HD11 ILE 504 HD11 ILE 504 -4.148 -12.266 15.430 191 HD12 ILE 504 HD12 ILE 504 -3.444 -10.649 15.464 192 HD13 ILE 504 HD13 ILE 504 -4.888 -10.963 14.502 193 H VAL 505 H VAL 505 -2.097 -9.337 15.208 194 HA VAL 505 HA VAL 505 -1.590 -8.049 12.682 195 HB VAL 505 HB VAL 505 -3.001 -7.117 15.180 196 HG11 VAL 505 HG11 VAL 505 -3.759 -5.414 13.157 197 HG12 VAL 505 HG12 VAL 505 -2.633 -5.034 14.462 198 HG13 VAL 505 HG13 VAL 505 -2.023 -5.589 12.903 199 HG21 VAL 505 HG21 VAL 505 -4.324 -7.422 12.540 200 HG22 VAL 505 HG22 VAL 505 -3.898 -8.890 13.421 201 HG23 VAL 505 HG23 VAL 505 -4.960 -7.692 14.163 202 H GLY 506 H GLY 506 -0.900 -7.138 16.069 203 HA2 GLY 506 HA2 GLY 506 0.777 -4.979 15.477 204 HA3 GLY 506 HA3 GLY 506 0.795 -5.889 16.980 205 H ALA 507 H ALA 507 1.382 -8.361 15.274 206 HA ALA 507 HA ALA 507 4.236 -8.191 15.525 207 HB1 ALA 507 HB1 ALA 507 2.334 -10.352 14.693 208 HB2 ALA 507 HB2 ALA 507 4.078 -10.551 14.515 209 HB3 ALA 507 HB3 ALA 507 3.380 -10.275 16.111 210 H ILE 508 H ILE 508 2.127 -9.010 12.762 211 HA ILE 508 HA ILE 508 4.180 -8.750 10.835 212 HB ILE 508 HB ILE 508 2.412 -8.832 9.159 213 HG12 ILE 508 HG12 ILE 508 0.025 -9.188 10.341 214 HG13 ILE 508 HG13 ILE 508 0.739 -8.062 11.490 215 HG21 ILE 508 HG21 ILE 508 1.998 -11.024 9.488 216 HG22 ILE 508 HG22 ILE 508 3.099 -10.813 10.848 217 HG23 ILE 508 HG23 ILE 508 1.356 -10.770 11.110 218 HD11 ILE 508 HD11 ILE 508 -0.509 -7.488 9.042 219 HD12 ILE 508 HD12 ILE 508 0.287 -6.368 10.148 220 HD13 ILE 508 HD13 ILE 508 1.203 -7.116 8.840 221 H ALA 509 H ALA 509 1.889 -6.496 12.213 222 HA ALA 509 HA ALA 509 2.253 -4.438 10.275 223 HB1 ALA 509 HB1 ALA 509 1.072 -3.009 11.844 224 HB2 ALA 509 HB2 ALA 509 0.262 -4.569 11.703 225 HB3 ALA 509 HB3 ALA 509 1.259 -4.219 13.114 226 H ASN 510 H ASN 510 3.839 -5.307 13.281 227 HA ASN 510 HA ASN 510 5.496 -2.904 13.186 228 HB2 ASN 510 HB2 ASN 510 4.444 -3.877 15.333 229 HB3 ASN 510 HB3 ASN 510 5.716 -5.092 15.241 230 HD21 ASN 510 HD21 ASN 510 5.761 -3.702 17.436 231 HD22 ASN 510 HD22 ASN 510 6.997 -2.495 17.434 232 H GLU 511 H GLU 511 5.545 -5.697 11.613 233 HA GLU 511 HA GLU 511 8.371 -6.318 11.988 234 HB2 GLU 511 HB2 GLU 511 6.050 -7.683 10.729 235 HB3 GLU 511 HB3 GLU 511 7.638 -8.015 10.051 236 HG2 GLU 511 HG2 GLU 511 7.132 -8.241 12.992 237 HG3 GLU 511 HG3 GLU 511 6.741 -9.559 11.888 238 H GLY 512 H GLY 512 6.158 -5.067 9.540 239 HA2 GLY 512 HA2 GLY 512 8.515 -4.159 8.014 240 HA3 GLY 512 HA3 GLY 512 7.143 -4.896 7.199 241 H ASP 513 H ASP 513 6.006 -3.411 6.162 242 HA ASP 513 HA ASP 513 5.829 -0.706 7.271 243 HB2 ASP 513 HB2 ASP 513 4.829 -0.192 4.982 244 HB3 ASP 513 HB3 ASP 513 6.528 -0.656 5.010 245 H ILE 514 H ILE 514 3.901 -3.503 6.502 246 HA ILE 514 HA ILE 514 1.348 -2.561 6.369 247 HB ILE 514 HB ILE 514 2.210 -4.965 7.982 248 HG12 ILE 514 HG12 ILE 514 1.151 -5.260 5.234 249 HG13 ILE 514 HG13 ILE 514 2.760 -4.560 5.363 250 HG21 ILE 514 HG21 ILE 514 -0.086 -5.785 7.301 251 HG22 ILE 514 HG22 ILE 514 -0.041 -4.506 8.513 252 HG23 ILE 514 HG23 ILE 514 -0.438 -4.120 6.839 253 HD11 ILE 514 HD11 ILE 514 2.859 -6.965 5.050 254 HD12 ILE 514 HD12 ILE 514 3.506 -6.506 6.625 255 HD13 ILE 514 HD13 ILE 514 1.892 -7.205 6.505 256 H SER 515 H SER 515 -0.282 -2.014 7.817 257 HA SER 515 HA SER 515 0.609 -1.390 10.556 258 HB2 SER 515 HB2 SER 515 0.089 0.521 8.742 259 HB3 SER 515 HB3 SER 515 -1.548 0.258 9.343 260 HG SER 515 HG SER 515 -1.018 1.186 11.155 261 H SER 516 H SER 516 -1.313 -1.042 12.056 262 HA SER 516 HA SER 516 -2.827 -3.410 12.159 263 HB2 SER 516 HB2 SER 516 -2.163 -1.683 14.035 264 HB3 SER 516 HB3 SER 516 -3.718 -0.957 13.629 265 HG SER 516 HG SER 516 -4.597 -3.132 13.949 266 H ARG 517 H ARG 517 -3.406 -0.359 10.649 267 HA ARG 517 HA ARG 517 -6.243 -0.948 10.263 268 HB2 ARG 517 HB2 ARG 517 -6.286 1.326 9.200 269 HB3 ARG 517 HB3 ARG 517 -5.812 1.316 10.894 270 HG2 ARG 517 HG2 ARG 517 -3.517 1.634 10.331 271 HG3 ARG 517 HG3 ARG 517 -3.853 1.400 8.614 272 HD2 ARG 517 HD2 ARG 517 -3.554 3.791 9.358 273 HD3 ARG 517 HD3 ARG 517 -5.039 3.443 8.474 274 HE ARG 517 HE ARG 517 -5.307 3.291 11.337 275 HH11 ARG 517 HH11 ARG 517 -5.443 5.354 8.536 276 HH12 ARG 517 HH12 ARG 517 -6.477 6.524 9.287 277 HH21 ARG 517 HH21 ARG 517 -6.669 4.824 12.336 278 HH22 ARG 517 HH22 ARG 517 -7.173 6.222 11.448 279 H TYR 518 H TYR 518 -3.230 -0.655 8.482 280 HA TYR 518 HA TYR 518 -4.229 -0.695 5.876 281 HB2 TYR 518 HB2 TYR 518 -1.726 -0.652 7.023 282 HB3 TYR 518 HB3 TYR 518 -1.756 -2.225 6.233 283 HD1 TYR 518 HD1 TYR 518 -0.812 -2.248 4.138 284 HD2 TYR 518 HD2 TYR 518 -2.887 1.246 5.398 285 HE1 TYR 518 HE1 TYR 518 -0.309 -1.179 1.981 286 HE2 TYR 518 HE2 TYR 518 -2.391 2.324 3.244 287 HH TYR 518 HH TYR 518 -0.623 0.602 0.691 288 H ILE 519 H ILE 519 -3.730 -3.279 8.183 289 HA ILE 519 HA ILE 519 -3.919 -5.468 6.436 290 HB ILE 519 HB ILE 519 -4.757 -5.293 9.332 291 HG12 ILE 519 HG12 ILE 519 -2.253 -6.640 8.482 292 HG13 ILE 519 HG13 ILE 519 -2.270 -4.882 8.385 293 HG21 ILE 519 HG21 ILE 519 -4.210 -7.696 7.596 294 HG22 ILE 519 HG22 ILE 519 -4.482 -7.739 9.337 295 HG23 ILE 519 HG23 ILE 519 -5.771 -7.212 8.255 296 HD11 ILE 519 HD11 ILE 519 -3.095 -4.951 10.804 297 HD12 ILE 519 HD12 ILE 519 -2.561 -6.632 10.793 298 HD13 ILE 519 HD13 ILE 519 -1.403 -5.337 10.490 299 H GLY 520 H GLY 520 -5.633 -6.724 5.751 300 HA2 GLY 520 HA2 GLY 520 -8.124 -5.366 5.397 301 HA3 GLY 520 HA3 GLY 520 -7.748 -7.002 4.878 302 H ASN 521 H ASN 521 -9.039 -8.466 5.748 303 HA ASN 521 HA ASN 521 -10.365 -7.889 8.282 304 HB2 ASN 521 HB2 ASN 521 -10.814 -10.024 6.190 305 HB3 ASN 521 HB3 ASN 521 -11.703 -9.951 7.709 306 HD21 ASN 521 HD21 ASN 521 -10.849 -7.947 4.917 307 HD22 ASN 521 HD22 ASN 521 -12.362 -7.117 4.832 308 H ILE 522 H ILE 522 -9.765 -8.774 10.147 309 HA ILE 522 HA ILE 522 -7.982 -11.121 10.067 310 HB ILE 522 HB ILE 522 -8.007 -9.018 12.229 311 HG12 ILE 522 HG12 ILE 522 -5.588 -8.871 10.833 312 HG13 ILE 522 HG13 ILE 522 -6.823 -8.960 9.582 313 HG21 ILE 522 HG21 ILE 522 -5.678 -10.766 11.717 314 HG22 ILE 522 HG22 ILE 522 -6.340 -10.172 13.239 315 HG23 ILE 522 HG23 ILE 522 -7.107 -11.528 12.414 316 HD11 ILE 522 HD11 ILE 522 -6.128 -6.782 11.368 317 HD12 ILE 522 HD12 ILE 522 -7.008 -6.763 9.840 318 HD13 ILE 522 HD13 ILE 522 -7.857 -7.126 11.342 319 H LYS 523 H LYS 523 -8.709 -12.891 11.039 320 HA LYS 523 HA LYS 523 -10.992 -12.637 12.879 321 HB2 LYS 523 HB2 LYS 523 -11.161 -13.984 10.682 322 HB3 LYS 523 HB3 LYS 523 -10.168 -15.181 11.502 323 HG2 LYS 523 HG2 LYS 523 -11.997 -14.954 13.370 324 HG3 LYS 523 HG3 LYS 523 -12.979 -14.364 12.027 325 HD2 LYS 523 HD2 LYS 523 -11.436 -16.942 11.886 326 HD3 LYS 523 HD3 LYS 523 -13.081 -16.859 12.519 327 HE2 LYS 523 HE2 LYS 523 -12.469 -15.655 9.858 328 HE3 LYS 523 HE3 LYS 523 -12.647 -17.404 9.994 329 HZ1 LYS 523 HZ1 LYS 523 -14.800 -16.577 11.320 330 HZ2 LYS 523 HZ2 LYS 523 -14.800 -16.915 9.663 331 HZ3 LYS 523 HZ3 LYS 523 -14.652 -15.318 10.200 332 H LEU 524 H LEU 524 -11.055 -13.935 14.768 333 HA LEU 524 HA LEU 524 -8.570 -15.252 15.560 334 HB2 LEU 524 HB2 LEU 524 -8.569 -12.834 16.303 335 HB3 LEU 524 HB3 LEU 524 -9.922 -13.250 17.354 336 HG LEU 524 HG LEU 524 -7.663 -13.155 18.457 337 HD11 LEU 524 HD11 LEU 524 -8.200 -14.836 19.951 338 HD12 LEU 524 HD12 LEU 524 -8.798 -15.912 18.689 339 HD13 LEU 524 HD13 LEU 524 -9.751 -14.510 19.177 340 HD21 LEU 524 HD21 LEU 524 -7.171 -15.815 17.156 341 HD22 LEU 524 HD22 LEU 524 -6.054 -14.811 18.081 342 HD23 LEU 524 HD23 LEU 524 -6.554 -14.314 16.464 343 H PHE 525 H PHE 525 -9.625 -17.224 15.524 344 HA PHE 525 HA PHE 525 -12.023 -17.572 17.139 345 HB2 PHE 525 HB2 PHE 525 -11.144 -18.744 14.793 346 HB3 PHE 525 HB3 PHE 525 -10.852 -19.993 15.998 347 HD1 PHE 525 HD1 PHE 525 -12.526 -21.534 16.208 348 HD2 PHE 525 HD2 PHE 525 -13.543 -17.517 15.238 349 HE1 PHE 525 HE1 PHE 525 -14.904 -22.158 16.137 350 HE2 PHE 525 HE2 PHE 525 -15.924 -18.134 15.167 351 HZ PHE 525 HZ PHE 525 -16.607 -20.457 15.615 352 H ALA 526 H ALA 526 -11.730 -20.155 18.032 353 HA ALA 526 HA ALA 526 -10.240 -19.772 20.417 354 HB1 ALA 526 HB1 ALA 526 -10.782 -22.498 20.217 355 HB2 ALA 526 HB2 ALA 526 -11.747 -21.278 21.049 356 HB3 ALA 526 HB3 ALA 526 -12.112 -21.702 19.376 357 H SER 527 H SER 527 -9.702 -21.703 17.497 358 HA SER 527 HA SER 527 -6.871 -21.904 18.235 359 HB2 SER 527 HB2 SER 527 -8.694 -24.182 17.483 360 HB3 SER 527 HB3 SER 527 -6.948 -24.284 17.259 361 HG SER 527 HG SER 527 -6.729 -23.862 19.506 362 H HIS 528 H HIS 528 -8.266 -20.183 16.380 363 HA HIS 528 HA HIS 528 -6.657 -20.712 14.044 364 HB2 HIS 528 HB2 HIS 528 -9.653 -20.897 13.986 365 HB3 HIS 528 HB3 HIS 528 -8.771 -20.343 12.565 366 HD1 HIS 528 HD1 HIS 528 -9.542 -23.382 14.555 367 HD2 HIS 528 HD2 HIS 528 -7.184 -22.319 11.303 368 HE1 HIS 528 HE1 HIS 528 -8.835 -25.552 13.499 369 H SER 529 H SER 529 -6.793 -18.905 12.460 370 HA SER 529 HA SER 529 -8.048 -16.456 13.189 371 HB2 SER 529 HB2 SER 529 -5.512 -15.448 13.319 372 HB3 SER 529 HB3 SER 529 -6.512 -15.812 14.725 373 HG SER 529 HG SER 529 -4.857 -17.039 15.204 374 H THR 530 H THR 530 -8.213 -15.165 11.449 375 HA THR 530 HA THR 530 -6.611 -15.884 9.084 376 HB THR 530 HB THR 530 -8.402 -15.193 7.682 377 HG1 THR 530 HG1 THR 530 -9.488 -13.522 8.410 378 HG21 THR 530 HG21 THR 530 -10.081 -16.462 9.762 379 HG22 THR 530 HG22 THR 530 -8.625 -17.336 9.286 380 HG23 THR 530 HG23 THR 530 -9.834 -16.910 8.075 381 H ILE 531 H ILE 531 -6.290 -14.057 7.518 382 HA ILE 531 HA ILE 531 -6.431 -11.364 8.381 383 HB ILE 531 HB ILE 531 -4.651 -11.951 9.900 384 HG12 ILE 531 HG12 ILE 531 -3.240 -10.571 7.636 385 HG13 ILE 531 HG13 ILE 531 -4.604 -9.799 8.436 386 HG21 ILE 531 HG21 ILE 531 -2.546 -12.894 9.168 387 HG22 ILE 531 HG22 ILE 531 -3.873 -13.957 8.700 388 HG23 ILE 531 HG23 ILE 531 -3.109 -12.919 7.497 389 HD11 ILE 531 HD11 ILE 531 -3.404 -10.016 10.585 390 HD12 ILE 531 HD12 ILE 531 -2.018 -10.659 9.705 391 HD13 ILE 531 HD13 ILE 531 -2.564 -9.009 9.406 392 H GLU 532 H GLU 532 -5.963 -9.936 6.739 393 HA GLU 532 HA GLU 532 -5.006 -11.132 4.221 394 HB2 GLU 532 HB2 GLU 532 -7.476 -10.544 4.322 395 HB3 GLU 532 HB3 GLU 532 -6.980 -8.860 4.416 396 HG2 GLU 532 HG2 GLU 532 -6.474 -8.751 2.238 397 HG3 GLU 532 HG3 GLU 532 -5.769 -10.366 2.215 398 H LEU 533 H LEU 533 -3.189 -10.273 3.482 399 HA LEU 533 HA LEU 533 -2.409 -7.599 4.424 400 HB2 LEU 533 HB2 LEU 533 -0.962 -10.096 3.942 401 HB3 LEU 533 HB3 LEU 533 -0.168 -8.670 3.278 402 HG LEU 533 HG LEU 533 -0.049 -7.659 5.461 403 HD11 LEU 533 HD11 LEU 533 -1.895 -8.185 6.689 404 HD12 LEU 533 HD12 LEU 533 -0.741 -9.313 7.401 405 HD13 LEU 533 HD13 LEU 533 -1.889 -9.876 6.186 406 HD21 LEU 533 HD21 LEU 533 0.823 -10.545 5.573 407 HD22 LEU 533 HD22 LEU 533 1.442 -9.231 6.574 408 HD23 LEU 533 HD23 LEU 533 1.727 -9.224 4.832 409 HA PRO 534 HA PRO 534 -3.070 -6.150 0.287 410 HB2 PRO 534 HB2 PRO 534 -1.942 -3.703 0.620 411 HB3 PRO 534 HB3 PRO 534 -3.541 -4.117 1.249 412 HG2 PRO 534 HG2 PRO 534 -0.909 -4.033 2.673 413 HG3 PRO 534 HG3 PRO 534 -2.494 -3.449 3.214 414 HD2 PRO 534 HD2 PRO 534 -1.453 -5.809 4.038 415 HD3 PRO 534 HD3 PRO 534 -3.198 -5.553 3.836 416 H LYS 535 H LYS 535 -0.116 -6.882 1.734 417 HA LYS 535 HA LYS 535 1.857 -5.827 0.172 418 HB2 LYS 535 HB2 LYS 535 1.667 -8.695 1.112 419 HB3 LYS 535 HB3 LYS 535 3.141 -7.891 0.589 420 HG2 LYS 535 HG2 LYS 535 1.562 -6.684 2.803 421 HG3 LYS 535 HG3 LYS 535 2.546 -8.113 3.130 422 HD2 LYS 535 HD2 LYS 535 4.115 -6.518 3.538 423 HD3 LYS 535 HD3 LYS 535 4.352 -6.677 1.796 424 HE2 LYS 535 HE2 LYS 535 2.398 -4.835 1.824 425 HE3 LYS 535 HE3 LYS 535 3.172 -4.467 3.365 426 HZ1 LYS 535 HZ1 LYS 535 4.020 -3.275 1.301 427 HZ2 LYS 535 HZ2 LYS 535 4.748 -4.744 0.882 428 HZ3 LYS 535 HZ3 LYS 535 5.177 -3.969 2.323 429 H GLY 536 H GLY 536 2.928 -6.442 -1.748 430 HA2 GLY 536 HA2 GLY 536 1.354 -8.189 -3.535 431 HA3 GLY 536 HA3 GLY 536 1.952 -6.628 -4.079 432 H MET 537 H MET 537 3.589 -9.079 -2.107 433 HA MET 537 HA MET 537 5.143 -10.192 -4.161 434 HB2 MET 537 HB2 MET 537 5.967 -7.694 -3.911 435 HB3 MET 537 HB3 MET 537 6.855 -8.354 -2.545 436 HG2 MET 537 HG2 MET 537 8.319 -8.402 -4.388 437 HG3 MET 537 HG3 MET 537 7.802 -10.064 -4.116 438 HE1 MET 537 HE1 MET 537 7.795 -11.366 -5.748 439 HE2 MET 537 HE2 MET 537 6.897 -11.288 -7.264 440 HE3 MET 537 HE3 MET 537 8.526 -10.619 -7.169 441 HA PRO 538 HA PRO 538 5.194 -12.154 0.077 442 HB2 PRO 538 HB2 PRO 538 4.121 -14.516 -0.724 443 HB3 PRO 538 HB3 PRO 538 3.138 -13.135 -0.223 444 HG2 PRO 538 HG2 PRO 538 3.837 -14.061 -2.982 445 HG3 PRO 538 HG3 PRO 538 2.279 -13.492 -2.354 446 HD2 PRO 538 HD2 PRO 538 3.926 -11.914 -3.813 447 HD3 PRO 538 HD3 PRO 538 2.875 -11.273 -2.534 448 H GLY 539 H GLY 539 5.970 -14.600 0.433 449 HA2 GLY 539 HA2 GLY 539 7.473 -16.319 -0.197 450 HA3 GLY 539 HA3 GLY 539 8.046 -15.301 -1.511 451 H GLU 540 H GLU 540 7.817 -13.432 1.221 452 HA GLU 540 HA GLU 540 10.682 -13.353 1.515 453 HB2 GLU 540 HB2 GLU 540 8.701 -11.888 3.243 454 HB3 GLU 540 HB3 GLU 540 10.353 -11.433 2.852 455 HG2 GLU 540 HG2 GLU 540 8.023 -11.453 0.948 456 HG3 GLU 540 HG3 GLU 540 8.757 -10.030 1.683 457 H VAL 541 H VAL 541 7.969 -13.944 3.754 458 HA VAL 541 HA VAL 541 9.738 -14.975 5.783 459 HB VAL 541 HB VAL 541 6.719 -15.056 5.698 460 HG11 VAL 541 HG11 VAL 541 7.508 -16.607 7.310 461 HG12 VAL 541 HG12 VAL 541 8.722 -15.474 7.906 462 HG13 VAL 541 HG13 VAL 541 7.010 -15.167 8.197 463 HG21 VAL 541 HG21 VAL 541 6.836 -13.052 7.136 464 HG22 VAL 541 HG22 VAL 541 8.579 -12.994 6.877 465 HG23 VAL 541 HG23 VAL 541 7.478 -12.766 5.518 466 H LEU 542 H LEU 542 7.593 -16.277 3.337 467 HA LEU 542 HA LEU 542 7.486 -18.932 4.286 468 HB2 LEU 542 HB2 LEU 542 7.286 -17.963 1.440 469 HB3 LEU 542 HB3 LEU 542 6.726 -19.515 2.058 470 HG LEU 542 HG LEU 542 5.594 -16.823 2.820 471 HD11 LEU 542 HD11 LEU 542 4.808 -17.070 0.686 472 HD12 LEU 542 HD12 LEU 542 3.577 -17.960 1.581 473 HD13 LEU 542 HD13 LEU 542 4.864 -18.832 0.748 474 HD21 LEU 542 HD21 LEU 542 4.637 -19.613 3.454 475 HD22 LEU 542 HD22 LEU 542 3.846 -18.105 3.914 476 HD23 LEU 542 HD23 LEU 542 5.423 -18.516 4.591 477 H GLN 543 H GLN 543 9.937 -17.142 2.668 478 HA GLN 543 HA GLN 543 11.344 -19.468 1.683 479 HB2 GLN 543 HB2 GLN 543 11.745 -16.521 1.582 480 HB3 GLN 543 HB3 GLN 543 13.167 -17.541 1.408 481 HG2 GLN 543 HG2 GLN 543 10.698 -17.881 -0.268 482 HG3 GLN 543 HG3 GLN 543 12.037 -16.829 -0.724 483 HE21 GLN 543 HE21 GLN 543 13.557 -17.696 -1.934 484 HE22 GLN 543 HE22 GLN 543 13.892 -19.383 -2.095 485 H HIS 544 H HIS 544 12.147 -16.888 4.016 486 HA HIS 544 HA HIS 544 14.355 -18.300 5.111 487 HB2 HIS 544 HB2 HIS 544 12.790 -15.884 5.990 488 HB3 HIS 544 HB3 HIS 544 14.075 -16.557 6.990 489 HD1 HIS 544 HD1 HIS 544 16.454 -16.828 5.543 490 HD2 HIS 544 HD2 HIS 544 13.689 -13.990 4.294 491 HE1 HIS 544 HE1 HIS 544 17.747 -15.214 4.112 492 H PHE 545 H PHE 545 11.122 -17.584 6.437 493 HA PHE 545 HA PHE 545 11.524 -19.527 8.555 494 HB2 PHE 545 HB2 PHE 545 9.450 -17.466 7.927 495 HB3 PHE 545 HB3 PHE 545 9.033 -18.788 9.012 496 HD1 PHE 545 HD1 PHE 545 9.218 -18.319 11.240 497 HD2 PHE 545 HD2 PHE 545 11.904 -16.449 8.519 498 HE1 PHE 545 HE1 PHE 545 10.271 -17.117 13.111 499 HE2 PHE 545 HE2 PHE 545 12.962 -15.245 10.385 500 HZ PHE 545 HZ PHE 545 12.147 -15.579 12.685 501 H THR 546 H THR 546 11.628 -20.780 6.132 502 HA THR 546 HA THR 546 9.056 -21.853 5.410 503 HB THR 546 HB THR 546 10.971 -21.559 3.792 504 HG1 THR 546 HG1 THR 546 10.055 -23.094 2.628 505 HG21 THR 546 HG21 THR 546 11.999 -24.112 5.026 506 HG22 THR 546 HG22 THR 546 12.691 -22.523 5.352 507 HG23 THR 546 HG23 THR 546 12.724 -23.181 3.716 508 H ARG 547 H ARG 547 11.593 -22.674 7.604 509 HA ARG 547 HA ARG 547 10.325 -25.285 8.109 510 HB2 ARG 547 HB2 ARG 547 12.811 -25.125 7.383 511 HB3 ARG 547 HB3 ARG 547 13.092 -24.566 9.027 512 HG2 ARG 547 HG2 ARG 547 11.492 -27.012 8.836 513 HG3 ARG 547 HG3 ARG 547 13.145 -27.159 8.234 514 HD2 ARG 547 HD2 ARG 547 14.072 -26.795 10.288 515 HD3 ARG 547 HD3 ARG 547 12.736 -25.779 10.830 516 HE ARG 547 HE ARG 547 11.903 -28.473 10.501 517 HH11 ARG 547 HH11 ARG 547 13.682 -26.366 12.627 518 HH12 ARG 547 HH12 ARG 547 13.371 -27.317 14.042 519 HH21 ARG 547 HH21 ARG 547 11.487 -29.733 12.356 520 HH22 ARG 547 HH22 ARG 547 12.123 -29.232 13.886 521 H THR 548 H THR 548 11.143 -22.212 9.414 522 HA THR 548 HA THR 548 10.296 -23.099 12.095 523 HB THR 548 HB THR 548 12.025 -20.729 11.361 524 HG1 THR 548 HG1 THR 548 13.185 -22.664 11.277 525 HG21 THR 548 HG21 THR 548 11.230 -19.885 13.288 526 HG22 THR 548 HG22 THR 548 12.255 -21.094 14.063 527 HG23 THR 548 HG23 THR 548 10.545 -21.430 13.790 528 H ARG 549 H ARG 549 8.601 -22.112 13.066 529 HA ARG 549 HA ARG 549 7.570 -19.592 12.115 530 HB2 ARG 549 HB2 ARG 549 6.187 -22.189 11.550 531 HB3 ARG 549 HB3 ARG 549 5.234 -20.741 11.846 532 HG2 ARG 549 HG2 ARG 549 5.428 -20.341 9.670 533 HG3 ARG 549 HG3 ARG 549 7.103 -19.900 10.008 534 HD2 ARG 549 HD2 ARG 549 6.923 -21.525 8.174 535 HD3 ARG 549 HD3 ARG 549 7.823 -22.168 9.547 536 HE ARG 549 HE ARG 549 5.015 -22.822 9.547 537 HH11 ARG 549 HH11 ARG 549 8.203 -23.766 8.514 538 HH12 ARG 549 HH12 ARG 549 7.796 -25.443 8.352 539 HH21 ARG 549 HH21 ARG 549 4.467 -25.026 9.337 540 HH22 ARG 549 HH22 ARG 549 5.671 -26.158 8.820 541 H ILE 550 H ILE 550 5.339 -19.202 13.298 542 HA ILE 550 HA ILE 550 5.016 -20.505 15.826 543 HB ILE 550 HB ILE 550 7.023 -18.844 16.046 544 HG12 ILE 550 HG12 ILE 550 5.184 -18.218 18.226 545 HG13 ILE 550 HG13 ILE 550 5.180 -19.928 17.810 546 HG21 ILE 550 HG21 ILE 550 6.627 -16.618 16.132 547 HG22 ILE 550 HG22 ILE 550 5.303 -17.051 15.051 548 HG23 ILE 550 HG23 ILE 550 4.997 -16.821 16.772 549 HD11 ILE 550 HD11 ILE 550 7.812 -18.615 18.111 550 HD12 ILE 550 HD12 ILE 550 6.862 -18.890 19.571 551 HD13 ILE 550 HD13 ILE 550 7.299 -20.248 18.535 552 H LEU 551 H LEU 551 3.517 -18.952 17.259 553 HA LEU 551 HA LEU 551 1.034 -18.884 16.270 554 HB2 LEU 551 HB2 LEU 551 0.468 -17.132 17.845 555 HB3 LEU 551 HB3 LEU 551 1.588 -18.285 18.568 556 HG LEU 551 HG LEU 551 3.337 -16.427 17.726 557 HD11 LEU 551 HD11 LEU 551 1.061 -15.148 17.088 558 HD12 LEU 551 HD12 LEU 551 2.544 -14.323 17.569 559 HD13 LEU 551 HD13 LEU 551 1.265 -14.598 18.752 560 HD21 LEU 551 HD21 LEU 551 3.270 -17.293 19.962 561 HD22 LEU 551 HD22 LEU 551 1.757 -16.448 20.294 562 HD23 LEU 551 HD23 LEU 551 3.243 -15.531 20.044 563 H ASN 552 H ASN 552 3.421 -16.308 15.807 564 HA ASN 552 HA ASN 552 1.643 -14.668 14.268 565 HB2 ASN 552 HB2 ASN 552 3.500 -13.700 15.566 566 HB3 ASN 552 HB3 ASN 552 4.655 -14.542 14.538 567 HD21 ASN 552 HD21 ASN 552 1.684 -12.787 13.752 568 HD22 ASN 552 HD22 ASN 552 2.434 -11.642 12.697 569 H LYS 553 H LYS 553 4.672 -16.333 13.376 570 HA LYS 553 HA LYS 553 4.311 -16.077 10.603 571 HB2 LYS 553 HB2 LYS 553 5.814 -18.388 11.775 572 HB3 LYS 553 HB3 LYS 553 6.202 -17.410 10.365 573 HG2 LYS 553 HG2 LYS 553 6.496 -16.657 13.260 574 HG3 LYS 553 HG3 LYS 553 7.773 -16.883 12.063 575 HD2 LYS 553 HD2 LYS 553 6.404 -14.984 10.808 576 HD3 LYS 553 HD3 LYS 553 5.912 -14.600 12.459 577 HE2 LYS 553 HE2 LYS 553 8.437 -14.728 12.991 578 HE3 LYS 553 HE3 LYS 553 8.653 -14.575 11.248 579 HZ1 LYS 553 HZ1 LYS 553 7.797 -12.599 13.186 580 HZ2 LYS 553 HZ2 LYS 553 6.932 -12.594 11.733 581 HZ3 LYS 553 HZ3 LYS 553 8.612 -12.395 11.718 582 HA PRO 554 HA PRO 554 1.520 -19.250 9.424 583 HB2 PRO 554 HB2 PRO 554 2.689 -20.304 7.212 584 HB3 PRO 554 HB3 PRO 554 1.946 -18.700 7.234 585 HG2 PRO 554 HG2 PRO 554 4.834 -19.453 7.471 586 HG3 PRO 554 HG3 PRO 554 4.092 -18.143 6.534 587 HD2 PRO 554 HD2 PRO 554 5.291 -17.726 8.925 588 HD3 PRO 554 HD3 PRO 554 3.905 -16.765 8.372 589 H MET 555 H MET 555 2.105 -20.471 11.428 590 HA MET 555 HA MET 555 4.030 -22.534 11.400 591 HB2 MET 555 HB2 MET 555 3.227 -21.768 13.510 592 HB3 MET 555 HB3 MET 555 1.556 -22.089 13.067 593 HG2 MET 555 HG2 MET 555 2.313 -23.761 14.610 594 HG3 MET 555 HG3 MET 555 2.053 -24.496 13.030 595 HE1 MET 555 HE1 MET 555 5.019 -24.151 15.880 596 HE2 MET 555 HE2 MET 555 3.540 -25.103 15.748 597 HE3 MET 555 HE3 MET 555 5.101 -25.844 15.393 598 H ASN 556 H ASN 556 0.474 -22.767 11.165 599 HA ASN 556 HA ASN 556 0.793 -25.007 9.312 600 HB2 ASN 556 HB2 ASN 556 0.425 -25.685 11.832 601 HB3 ASN 556 HB3 ASN 556 -1.251 -25.272 11.482 602 HD21 ASN 556 HD21 ASN 556 1.322 -27.497 10.944 603 HD22 ASN 556 HD22 ASN 556 0.406 -28.680 10.080 604 H MET 557 H MET 557 0.127 -22.558 8.459 605 HA MET 557 HA MET 557 -2.784 -22.378 8.331 606 HB2 MET 557 HB2 MET 557 -2.407 -20.226 7.227 607 HB3 MET 557 HB3 MET 557 -1.533 -20.317 8.750 608 HG2 MET 557 HG2 MET 557 0.124 -19.465 7.486 609 HG3 MET 557 HG3 MET 557 0.395 -21.169 7.126 610 HE1 MET 557 HE1 MET 557 1.251 -20.842 3.950 611 HE2 MET 557 HE2 MET 557 0.899 -21.902 5.315 612 HE3 MET 557 HE3 MET 557 -0.148 -21.915 3.895 613 H GLN 558 H GLN 558 -3.482 -21.521 5.989 614 HA GLN 558 HA GLN 558 -2.175 -22.841 3.800 615 HB2 GLN 558 HB2 GLN 558 -3.823 -24.462 3.274 616 HB3 GLN 558 HB3 GLN 558 -3.453 -24.680 4.979 617 HG2 GLN 558 HG2 GLN 558 -5.485 -23.122 5.363 618 HG3 GLN 558 HG3 GLN 558 -5.909 -23.557 3.708 619 HE21 GLN 558 HE21 GLN 558 -5.632 -24.641 6.975 620 HE22 GLN 558 HE22 GLN 558 -6.401 -26.172 6.757 621 H LEU 559 H LEU 559 -2.627 -21.828 1.933 622 HA LEU 559 HA LEU 559 -4.085 -19.439 1.901 623 HB2 LEU 559 HB2 LEU 559 -2.235 -20.174 0.337 624 HB3 LEU 559 HB3 LEU 559 -3.457 -21.111 -0.520 625 HG LEU 559 HG LEU 559 -2.872 -18.890 -1.540 626 HD11 LEU 559 HD11 LEU 559 -4.901 -18.857 -2.477 627 HD12 LEU 559 HD12 LEU 559 -5.716 -18.602 -0.934 628 HD13 LEU 559 HD13 LEU 559 -5.248 -20.230 -1.425 629 HD21 LEU 559 HD21 LEU 559 -4.637 -17.442 0.281 630 HD22 LEU 559 HD22 LEU 559 -3.104 -16.955 -0.443 631 HD23 LEU 559 HD23 LEU 559 -3.115 -17.944 1.018 632 H LEU 560 H LEU 560 -6.196 -19.086 1.851 633 HA LEU 560 HA LEU 560 -7.946 -21.174 0.728 634 HB2 LEU 560 HB2 LEU 560 -9.539 -20.767 2.352 635 HB3 LEU 560 HB3 LEU 560 -8.024 -20.643 3.244 636 HG LEU 560 HG LEU 560 -8.422 -18.050 2.571 637 HD11 LEU 560 HD11 LEU 560 -10.829 -19.221 1.875 638 HD12 LEU 560 HD12 LEU 560 -10.539 -17.505 2.163 639 HD13 LEU 560 HD13 LEU 560 -11.135 -18.530 3.469 640 HD21 LEU 560 HD21 LEU 560 -8.599 -17.739 4.804 641 HD22 LEU 560 HD22 LEU 560 -8.171 -19.450 4.841 642 HD23 LEU 560 HD23 LEU 560 -9.859 -18.960 4.988 643 H GLY 561 H GLY 561 -7.042 -17.840 0.706 644 HA2 GLY 561 HA2 GLY 561 -9.385 -17.002 -0.794 645 HA3 GLY 561 HA3 GLY 561 -8.027 -15.990 -0.327 646 H ASP 562 H ASP 562 -7.830 -15.085 -2.381 647 HA ASP 562 HA ASP 562 -6.099 -16.443 -4.152 648 HB2 ASP 562 HB2 ASP 562 -8.484 -17.429 -4.608 649 HB3 ASP 562 HB3 ASP 562 -8.740 -15.910 -5.462 650 H ALA 563 H ALA 563 -4.859 -14.890 -4.949 651 HA ALA 563 HA ALA 563 -5.351 -12.164 -4.650 652 HB1 ALA 563 HB1 ALA 563 -3.576 -12.891 -6.877 653 HB2 ALA 563 HB2 ALA 563 -3.272 -11.883 -5.462 654 HB3 ALA 563 HB3 ALA 563 -3.187 -13.640 -5.328 655 H GLN 564 H GLN 564 -6.677 -10.833 -5.681 656 HA GLN 564 HA GLN 564 -8.352 -11.551 -7.773 657 HB2 GLN 564 HB2 GLN 564 -8.226 -9.431 -6.118 658 HB3 GLN 564 HB3 GLN 564 -7.606 -8.689 -7.587 659 HG2 GLN 564 HG2 GLN 564 -9.642 -9.519 -8.769 660 HG3 GLN 564 HG3 GLN 564 -10.269 -10.030 -7.203 661 HE21 GLN 564 HE21 GLN 564 -9.010 -7.204 -8.917 662 HE22 GLN 564 HE22 GLN 564 -10.012 -6.050 -8.112 Start of MODEL 14 1 H MET 480 H MET 480 0.346 0.070 -1.522 2 HA MET 480 HA MET 480 2.913 0.993 -2.497 3 HB2 MET 480 HB2 MET 480 3.761 0.383 -0.314 4 HB3 MET 480 HB3 MET 480 2.260 1.280 -0.124 5 HG2 MET 480 HG2 MET 480 1.050 -0.671 0.421 6 HG3 MET 480 HG3 MET 480 2.369 -1.719 -0.095 7 HE1 MET 480 HE1 MET 480 2.918 1.088 3.518 8 HE2 MET 480 HE2 MET 480 3.126 1.557 1.830 9 HE3 MET 480 HE3 MET 480 1.515 1.195 2.454 10 H ALA 481 H ALA 481 1.153 -1.984 -2.217 11 HA ALA 481 HA ALA 481 3.228 -3.845 -2.289 12 HB1 ALA 481 HB1 ALA 481 1.405 -5.101 -2.059 13 HB2 ALA 481 HB2 ALA 481 0.368 -3.850 -2.747 14 HB3 ALA 481 HB3 ALA 481 1.209 -4.981 -3.808 15 H ASP 482 H ASP 482 3.282 -5.408 -4.369 16 HA ASP 482 HA ASP 482 4.355 -3.718 -6.500 17 HB2 ASP 482 HB2 ASP 482 5.424 -5.898 -5.296 18 HB3 ASP 482 HB3 ASP 482 4.646 -6.655 -6.683 19 H VAL 483 H VAL 483 1.981 -6.260 -5.943 20 HA VAL 483 HA VAL 483 0.831 -5.663 -8.586 21 HB VAL 483 HB VAL 483 1.908 -7.813 -8.794 22 HG11 VAL 483 HG11 VAL 483 1.941 -8.306 -6.348 23 HG12 VAL 483 HG12 VAL 483 0.242 -8.768 -6.471 24 HG13 VAL 483 HG13 VAL 483 1.470 -9.674 -7.357 25 HG21 VAL 483 HG21 VAL 483 -0.405 -7.399 -9.756 26 HG22 VAL 483 HG22 VAL 483 0.093 -9.084 -9.603 27 HG23 VAL 483 HG23 VAL 483 -1.022 -8.384 -8.430 28 H GLY 484 H GLY 484 0.291 -6.841 -5.299 29 HA2 GLY 484 HA2 GLY 484 -1.616 -5.744 -4.144 30 HA3 GLY 484 HA3 GLY 484 -2.550 -6.078 -5.595 31 H ASP 485 H ASP 485 -0.271 -8.384 -4.313 32 HA ASP 485 HA ASP 485 -1.996 -10.537 -4.319 33 HB2 ASP 485 HB2 ASP 485 0.639 -10.256 -3.832 34 HB3 ASP 485 HB3 ASP 485 0.067 -10.532 -2.188 35 H MET 486 H MET 486 -3.947 -10.443 -3.364 36 HA MET 486 HA MET 486 -3.998 -9.926 -0.466 37 HB2 MET 486 HB2 MET 486 -5.179 -8.306 -2.325 38 HB3 MET 486 HB3 MET 486 -6.499 -9.394 -1.918 39 HG2 MET 486 HG2 MET 486 -6.864 -8.335 -0.013 40 HG3 MET 486 HG3 MET 486 -5.180 -8.519 0.469 41 HE1 MET 486 HE1 MET 486 -5.978 -5.809 -2.817 42 HE2 MET 486 HE2 MET 486 -7.143 -7.001 -2.241 43 HE3 MET 486 HE3 MET 486 -7.305 -5.309 -1.768 44 H GLN 487 H GLN 487 -4.595 -11.659 0.643 45 HA GLN 487 HA GLN 487 -6.756 -13.344 -0.304 46 HB2 GLN 487 HB2 GLN 487 -4.035 -14.522 0.281 47 HB3 GLN 487 HB3 GLN 487 -5.489 -15.421 -0.130 48 HG2 GLN 487 HG2 GLN 487 -5.516 -14.380 -2.335 49 HG3 GLN 487 HG3 GLN 487 -4.062 -13.471 -1.924 50 HE21 GLN 487 HE21 GLN 487 -2.382 -15.146 -0.849 51 HE22 GLN 487 HE22 GLN 487 -2.031 -16.488 -1.878 52 H LEU 488 H LEU 488 -7.085 -15.201 1.375 53 HA LEU 488 HA LEU 488 -6.786 -14.007 4.051 54 HB2 LEU 488 HB2 LEU 488 -9.106 -14.254 3.062 55 HB3 LEU 488 HB3 LEU 488 -8.883 -15.995 3.217 56 HG LEU 488 HG LEU 488 -8.535 -15.599 5.692 57 HD11 LEU 488 HD11 LEU 488 -8.643 -12.903 4.847 58 HD12 LEU 488 HD12 LEU 488 -8.449 -13.533 6.482 59 HD13 LEU 488 HD13 LEU 488 -10.062 -13.205 5.850 60 HD21 LEU 488 HD21 LEU 488 -10.906 -15.510 6.152 61 HD22 LEU 488 HD22 LEU 488 -10.616 -16.487 4.713 62 HD23 LEU 488 HD23 LEU 488 -11.221 -14.837 4.553 63 H TYR 489 H TYR 489 -5.178 -14.982 5.098 64 HA TYR 489 HA TYR 489 -4.807 -17.876 4.759 65 HB2 TYR 489 HB2 TYR 489 -2.885 -15.998 6.123 66 HB3 TYR 489 HB3 TYR 489 -2.561 -17.594 5.455 67 HD1 TYR 489 HD1 TYR 489 -3.192 -14.062 4.617 68 HD2 TYR 489 HD2 TYR 489 -2.071 -17.887 3.130 69 HE1 TYR 489 HE1 TYR 489 -2.475 -13.024 2.506 70 HE2 TYR 489 HE2 TYR 489 -1.349 -16.860 1.015 71 HH TYR 489 HH TYR 489 -1.885 -13.443 0.355 72 H ARG 490 H ARG 490 -5.718 -19.107 6.254 73 HA ARG 490 HA ARG 490 -6.153 -18.021 8.941 74 HB2 ARG 490 HB2 ARG 490 -7.734 -19.868 9.237 75 HB3 ARG 490 HB3 ARG 490 -8.121 -18.925 7.804 76 HG2 ARG 490 HG2 ARG 490 -8.276 -20.909 6.795 77 HG3 ARG 490 HG3 ARG 490 -6.512 -20.855 6.764 78 HD2 ARG 490 HD2 ARG 490 -6.798 -22.893 7.742 79 HD3 ARG 490 HD3 ARG 490 -6.808 -21.882 9.186 80 HE ARG 490 HE ARG 490 -9.416 -21.984 8.514 81 HH11 ARG 490 HH11 ARG 490 -6.983 -24.437 8.943 82 HH12 ARG 490 HH12 ARG 490 -8.108 -25.645 9.469 83 HH21 ARG 490 HH21 ARG 490 -10.907 -23.566 9.206 84 HH22 ARG 490 HH22 ARG 490 -10.340 -25.149 9.617 85 H ILE 491 H ILE 491 -5.085 -18.760 10.671 86 HA ILE 491 HA ILE 491 -3.153 -20.926 10.256 87 HB ILE 491 HB ILE 491 -2.036 -20.115 12.271 88 HG12 ILE 491 HG12 ILE 491 -4.073 -17.884 12.315 89 HG13 ILE 491 HG13 ILE 491 -4.159 -19.295 13.364 90 HG21 ILE 491 HG21 ILE 491 -0.925 -18.863 10.812 91 HG22 ILE 491 HG22 ILE 491 -2.374 -18.629 9.837 92 HG23 ILE 491 HG23 ILE 491 -2.029 -17.538 11.179 93 HD11 ILE 491 HD11 ILE 491 -3.186 -17.409 14.525 94 HD12 ILE 491 HD12 ILE 491 -1.994 -18.695 14.330 95 HD13 ILE 491 HD13 ILE 491 -1.934 -17.271 13.291 96 H GLU 492 H GLU 492 -2.700 -22.252 12.296 97 HA GLU 492 HA GLU 492 -5.275 -23.232 13.297 98 HB2 GLU 492 HB2 GLU 492 -3.654 -24.775 12.109 99 HB3 GLU 492 HB3 GLU 492 -2.596 -24.603 13.502 100 HG2 GLU 492 HG2 GLU 492 -4.879 -25.299 14.737 101 HG3 GLU 492 HG3 GLU 492 -5.094 -26.126 13.195 102 H VAL 493 H VAL 493 -4.355 -20.883 14.459 103 HA VAL 493 HA VAL 493 -3.942 -21.790 17.209 104 HB VAL 493 HB VAL 493 -2.370 -19.449 16.156 105 HG11 VAL 493 HG11 VAL 493 -1.568 -21.118 18.481 106 HG12 VAL 493 HG12 VAL 493 -1.359 -19.388 18.203 107 HG13 VAL 493 HG13 VAL 493 -2.936 -20.022 18.676 108 HG21 VAL 493 HG21 VAL 493 -1.564 -22.346 16.277 109 HG22 VAL 493 HG22 VAL 493 -1.538 -21.268 14.881 110 HG23 VAL 493 HG23 VAL 493 -0.399 -21.023 16.206 111 H GLY 494 H GLY 494 -5.166 -20.715 18.648 112 HA2 GLY 494 HA2 GLY 494 -6.247 -18.086 17.900 113 HA3 GLY 494 HA3 GLY 494 -7.364 -19.371 18.335 114 H ARG 495 H ARG 495 -7.990 -17.706 19.962 115 HA ARG 495 HA ARG 495 -6.375 -16.826 22.030 116 HB2 ARG 495 HB2 ARG 495 -8.504 -16.705 23.368 117 HB3 ARG 495 HB3 ARG 495 -8.564 -15.912 21.800 118 HG2 ARG 495 HG2 ARG 495 -9.831 -17.698 20.859 119 HG3 ARG 495 HG3 ARG 495 -9.601 -18.690 22.301 120 HD2 ARG 495 HD2 ARG 495 -11.017 -16.032 22.320 121 HD3 ARG 495 HD3 ARG 495 -11.847 -17.572 22.096 122 HE ARG 495 HE ARG 495 -10.913 -16.481 24.551 123 HH11 ARG 495 HH11 ARG 495 -11.397 -19.474 22.841 124 HH12 ARG 495 HH12 ARG 495 -11.577 -20.419 24.282 125 HH21 ARG 495 HH21 ARG 495 -11.148 -17.714 26.455 126 HH22 ARG 495 HH22 ARG 495 -11.435 -19.417 26.337 127 H ASP 496 H ASP 496 -8.011 -19.912 21.626 128 HA ASP 496 HA ASP 496 -7.637 -20.906 24.230 129 HB2 ASP 496 HB2 ASP 496 -9.017 -21.817 22.162 130 HB3 ASP 496 HB3 ASP 496 -7.554 -22.761 21.891 131 H ASP 497 H ASP 497 -5.462 -20.500 21.589 132 HA ASP 497 HA ASP 497 -3.485 -22.312 22.741 133 HB2 ASP 497 HB2 ASP 497 -4.022 -21.262 20.109 134 HB3 ASP 497 HB3 ASP 497 -2.353 -20.930 20.565 135 H GLY 498 H GLY 498 -3.964 -18.871 22.079 136 HA2 GLY 498 HA2 GLY 498 -3.017 -17.549 24.074 137 HA3 GLY 498 HA3 GLY 498 -1.498 -18.281 23.577 138 H VAL 499 H VAL 499 -3.993 -17.177 21.363 139 HA VAL 499 HA VAL 499 -2.265 -14.919 20.599 140 HB VAL 499 HB VAL 499 -2.229 -17.002 19.037 141 HG11 VAL 499 HG11 VAL 499 -4.887 -16.807 19.086 142 HG12 VAL 499 HG12 VAL 499 -4.564 -15.770 17.694 143 HG13 VAL 499 HG13 VAL 499 -4.007 -17.444 17.697 144 HG21 VAL 499 HG21 VAL 499 -1.570 -15.639 17.308 145 HG22 VAL 499 HG22 VAL 499 -2.878 -14.486 17.573 146 HG23 VAL 499 HG23 VAL 499 -1.492 -14.512 18.663 147 H GLU 500 H GLU 500 -3.304 -13.071 19.856 148 HA GLU 500 HA GLU 500 -6.241 -13.072 20.070 149 HB2 GLU 500 HB2 GLU 500 -4.528 -10.737 20.893 150 HB3 GLU 500 HB3 GLU 500 -6.230 -11.015 21.238 151 HG2 GLU 500 HG2 GLU 500 -5.159 -13.167 22.436 152 HG3 GLU 500 HG3 GLU 500 -3.827 -12.025 22.606 153 H VAL 501 H VAL 501 -6.811 -10.540 19.318 154 HA VAL 501 HA VAL 501 -6.339 -10.635 16.489 155 HB VAL 501 HB VAL 501 -7.748 -8.539 18.148 156 HG11 VAL 501 HG11 VAL 501 -6.988 -8.595 15.373 157 HG12 VAL 501 HG12 VAL 501 -8.745 -8.561 15.535 158 HG13 VAL 501 HG13 VAL 501 -7.763 -7.309 16.297 159 HG21 VAL 501 HG21 VAL 501 -9.730 -9.667 17.810 160 HG22 VAL 501 HG22 VAL 501 -9.122 -10.536 16.401 161 HG23 VAL 501 HG23 VAL 501 -8.600 -11.005 18.019 162 H ARG 502 H ARG 502 -5.102 -8.799 19.192 163 HA ARG 502 HA ARG 502 -3.716 -6.915 17.471 164 HB2 ARG 502 HB2 ARG 502 -2.860 -5.990 19.628 165 HB3 ARG 502 HB3 ARG 502 -4.614 -6.018 19.508 166 HG2 ARG 502 HG2 ARG 502 -4.802 -7.806 21.011 167 HG3 ARG 502 HG3 ARG 502 -3.089 -8.209 20.873 168 HD2 ARG 502 HD2 ARG 502 -3.300 -7.133 22.950 169 HD3 ARG 502 HD3 ARG 502 -2.630 -5.914 21.866 170 HE ARG 502 HE ARG 502 -5.457 -5.754 21.921 171 HH11 ARG 502 HH11 ARG 502 -2.626 -5.016 23.809 172 HH12 ARG 502 HH12 ARG 502 -3.374 -3.704 24.658 173 HH21 ARG 502 HH21 ARG 502 -6.453 -4.029 23.033 174 HH22 ARG 502 HH22 ARG 502 -5.552 -3.145 24.217 175 H HIS 503 H HIS 503 -3.185 -10.020 18.410 176 HA HIS 503 HA HIS 503 -0.341 -9.824 18.909 177 HB2 HIS 503 HB2 HIS 503 -2.059 -11.587 19.830 178 HB3 HIS 503 HB3 HIS 503 -1.726 -12.411 18.309 179 HD1 HIS 503 HD1 HIS 503 -0.936 -13.585 21.089 180 HD2 HIS 503 HD2 HIS 503 1.605 -11.453 18.587 181 HE1 HIS 503 HE1 HIS 503 1.391 -14.286 21.738 182 H ILE 504 H ILE 504 -2.349 -11.414 16.423 183 HA ILE 504 HA ILE 504 -0.149 -11.906 14.688 184 HB ILE 504 HB ILE 504 -1.695 -12.751 13.134 185 HG12 ILE 504 HG12 ILE 504 -3.126 -10.674 13.141 186 HG13 ILE 504 HG13 ILE 504 -4.019 -12.186 13.020 187 HG21 ILE 504 HG21 ILE 504 -1.579 -14.080 15.163 188 HG22 ILE 504 HG22 ILE 504 -2.888 -13.139 15.876 189 HG23 ILE 504 HG23 ILE 504 -3.198 -14.159 14.471 190 HD11 ILE 504 HD11 ILE 504 -5.150 -10.704 14.525 191 HD12 ILE 504 HD12 ILE 504 -4.480 -12.054 15.442 192 HD13 ILE 504 HD13 ILE 504 -3.681 -10.482 15.475 193 H VAL 505 H VAL 505 -2.289 -9.225 15.170 194 HA VAL 505 HA VAL 505 -1.747 -7.982 12.629 195 HB VAL 505 HB VAL 505 -3.102 -6.971 15.127 196 HG11 VAL 505 HG11 VAL 505 -2.646 -4.911 14.392 197 HG12 VAL 505 HG12 VAL 505 -2.073 -5.502 12.831 198 HG13 VAL 505 HG13 VAL 505 -3.798 -5.249 13.100 199 HG21 VAL 505 HG21 VAL 505 -4.316 -8.667 13.832 200 HG22 VAL 505 HG22 VAL 505 -5.124 -7.100 13.781 201 HG23 VAL 505 HG23 VAL 505 -4.185 -7.653 12.394 202 H GLY 506 H GLY 506 -0.987 -7.089 16.006 203 HA2 GLY 506 HA2 GLY 506 0.792 -5.013 15.359 204 HA3 GLY 506 HA3 GLY 506 0.745 -5.872 16.892 205 H ALA 507 H ALA 507 1.219 -8.433 15.303 206 HA ALA 507 HA ALA 507 4.060 -8.442 15.607 207 HB1 ALA 507 HB1 ALA 507 2.778 -10.424 16.127 208 HB2 ALA 507 HB2 ALA 507 2.200 -10.521 14.463 209 HB3 ALA 507 HB3 ALA 507 3.909 -10.773 14.818 210 H ILE 508 H ILE 508 1.959 -8.985 12.772 211 HA ILE 508 HA ILE 508 4.133 -8.845 10.928 212 HB ILE 508 HB ILE 508 2.437 -8.892 9.178 213 HG12 ILE 508 HG12 ILE 508 -0.004 -9.213 10.282 214 HG13 ILE 508 HG13 ILE 508 0.689 -8.072 11.430 215 HG21 ILE 508 HG21 ILE 508 1.340 -10.802 11.169 216 HG22 ILE 508 HG22 ILE 508 1.848 -11.070 9.502 217 HG23 ILE 508 HG23 ILE 508 3.056 -10.908 10.777 218 HD11 ILE 508 HD11 ILE 508 0.236 -6.417 10.044 219 HD12 ILE 508 HD12 ILE 508 1.276 -7.147 8.820 220 HD13 ILE 508 HD13 ILE 508 -0.436 -7.565 8.885 221 H ALA 509 H ALA 509 2.004 -6.530 12.369 222 HA ALA 509 HA ALA 509 2.424 -4.475 10.405 223 HB1 ALA 509 HB1 ALA 509 1.365 -4.197 13.214 224 HB2 ALA 509 HB2 ALA 509 1.190 -3.041 11.892 225 HB3 ALA 509 HB3 ALA 509 0.384 -4.608 11.806 226 H ASN 510 H ASN 510 4.044 -5.579 13.255 227 HA ASN 510 HA ASN 510 5.620 -3.138 13.488 228 HB2 ASN 510 HB2 ASN 510 4.816 -4.256 15.540 229 HB3 ASN 510 HB3 ASN 510 5.743 -5.690 15.110 230 HD21 ASN 510 HD21 ASN 510 6.500 -2.228 15.021 231 HD22 ASN 510 HD22 ASN 510 7.909 -2.337 16.015 232 H GLU 511 H GLU 511 5.836 -6.345 12.204 233 HA GLU 511 HA GLU 511 8.665 -6.538 12.082 234 HB2 GLU 511 HB2 GLU 511 6.394 -7.960 10.743 235 HB3 GLU 511 HB3 GLU 511 8.037 -8.217 10.174 236 HG2 GLU 511 HG2 GLU 511 7.058 -8.684 12.981 237 HG3 GLU 511 HG3 GLU 511 7.345 -9.928 11.766 238 H GLY 512 H GLY 512 6.202 -5.427 9.789 239 HA2 GLY 512 HA2 GLY 512 8.387 -4.295 8.152 240 HA3 GLY 512 HA3 GLY 512 6.922 -4.964 7.449 241 H ASP 513 H ASP 513 6.329 -3.075 6.408 242 HA ASP 513 HA ASP 513 5.958 -0.656 7.984 243 HB2 ASP 513 HB2 ASP 513 6.815 -0.905 5.483 244 HB3 ASP 513 HB3 ASP 513 5.090 -0.840 5.136 245 H ILE 514 H ILE 514 4.173 -3.377 7.091 246 HA ILE 514 HA ILE 514 1.620 -2.464 6.600 247 HB ILE 514 HB ILE 514 2.388 -4.854 8.280 248 HG12 ILE 514 HG12 ILE 514 1.580 -4.919 5.388 249 HG13 ILE 514 HG13 ILE 514 3.248 -4.580 5.836 250 HG21 ILE 514 HG21 ILE 514 -0.204 -3.940 7.105 251 HG22 ILE 514 HG22 ILE 514 0.120 -5.661 7.311 252 HG23 ILE 514 HG23 ILE 514 0.131 -4.589 8.711 253 HD11 ILE 514 HD11 ILE 514 3.445 -6.705 6.922 254 HD12 ILE 514 HD12 ILE 514 1.729 -7.033 6.680 255 HD13 ILE 514 HD13 ILE 514 2.815 -6.950 5.293 256 H SER 515 H SER 515 -0.115 -1.821 7.826 257 HA SER 515 HA SER 515 0.478 -1.153 10.636 258 HB2 SER 515 HB2 SER 515 0.012 0.676 8.747 259 HB3 SER 515 HB3 SER 515 -1.662 0.308 9.162 260 HG SER 515 HG SER 515 0.350 1.475 10.716 261 H SER 516 H SER 516 -1.497 -0.976 12.025 262 HA SER 516 HA SER 516 -2.911 -3.409 12.008 263 HB2 SER 516 HB2 SER 516 -3.285 -0.843 13.550 264 HB3 SER 516 HB3 SER 516 -4.332 -2.241 13.791 265 HG SER 516 HG SER 516 -2.828 -2.902 15.093 266 H ARG 517 H ARG 517 -3.546 -0.353 10.535 267 HA ARG 517 HA ARG 517 -6.348 -1.001 10.047 268 HB2 ARG 517 HB2 ARG 517 -6.391 1.251 8.947 269 HB3 ARG 517 HB3 ARG 517 -5.948 1.280 10.649 270 HG2 ARG 517 HG2 ARG 517 -3.641 1.601 10.114 271 HG3 ARG 517 HG3 ARG 517 -3.956 1.348 8.396 272 HD2 ARG 517 HD2 ARG 517 -3.685 3.738 9.037 273 HD3 ARG 517 HD3 ARG 517 -5.227 3.372 8.266 274 HE ARG 517 HE ARG 517 -5.301 3.286 11.142 275 HH11 ARG 517 HH11 ARG 517 -5.613 5.293 8.315 276 HH12 ARG 517 HH12 ARG 517 -6.588 6.485 9.108 277 HH21 ARG 517 HH21 ARG 517 -6.585 4.848 12.198 278 HH22 ARG 517 HH22 ARG 517 -7.140 6.232 11.317 279 H TYR 518 H TYR 518 -3.285 -0.738 8.358 280 HA TYR 518 HA TYR 518 -4.182 -0.809 5.721 281 HB2 TYR 518 HB2 TYR 518 -1.716 -0.853 6.995 282 HB3 TYR 518 HB3 TYR 518 -1.766 -2.387 6.132 283 HD1 TYR 518 HD1 TYR 518 -0.615 -2.286 4.143 284 HD2 TYR 518 HD2 TYR 518 -2.896 1.096 5.351 285 HE1 TYR 518 HE1 TYR 518 -0.005 -1.136 2.056 286 HE2 TYR 518 HE2 TYR 518 -2.293 2.255 3.268 287 HH TYR 518 HH TYR 518 -1.431 1.088 0.697 288 H ILE 519 H ILE 519 -3.565 -3.444 7.995 289 HA ILE 519 HA ILE 519 -3.804 -5.621 6.305 290 HB ILE 519 HB ILE 519 -4.800 -5.416 9.150 291 HG12 ILE 519 HG12 ILE 519 -2.270 -6.798 8.600 292 HG13 ILE 519 HG13 ILE 519 -2.230 -5.076 8.237 293 HG21 ILE 519 HG21 ILE 519 -4.542 -7.845 9.208 294 HG22 ILE 519 HG22 ILE 519 -5.714 -7.355 7.987 295 HG23 ILE 519 HG23 ILE 519 -4.089 -7.841 7.504 296 HD11 ILE 519 HD11 ILE 519 -3.230 -4.783 10.587 297 HD12 ILE 519 HD12 ILE 519 -2.686 -6.440 10.854 298 HD13 ILE 519 HD13 ILE 519 -1.520 -5.185 10.434 299 H GLY 520 H GLY 520 -5.493 -6.875 5.557 300 HA2 GLY 520 HA2 GLY 520 -7.950 -5.503 5.058 301 HA3 GLY 520 HA3 GLY 520 -7.565 -7.152 4.587 302 H ASN 521 H ASN 521 -8.877 -8.609 5.435 303 HA ASN 521 HA ASN 521 -10.353 -7.965 7.869 304 HB2 ASN 521 HB2 ASN 521 -10.685 -10.009 5.693 305 HB3 ASN 521 HB3 ASN 521 -11.509 -10.212 7.236 306 HD21 ASN 521 HD21 ASN 521 -10.823 -7.326 5.302 307 HD22 ASN 521 HD22 ASN 521 -12.471 -6.837 5.133 308 H ILE 522 H ILE 522 -9.845 -8.775 9.792 309 HA ILE 522 HA ILE 522 -8.082 -11.136 9.894 310 HB ILE 522 HB ILE 522 -8.137 -8.925 11.945 311 HG12 ILE 522 HG12 ILE 522 -5.673 -8.919 10.587 312 HG13 ILE 522 HG13 ILE 522 -6.907 -8.984 9.333 313 HG21 ILE 522 HG21 ILE 522 -6.291 -9.967 12.926 314 HG22 ILE 522 HG22 ILE 522 -7.367 -11.301 12.514 315 HG23 ILE 522 HG23 ILE 522 -5.970 -10.949 11.497 316 HD11 ILE 522 HD11 ILE 522 -7.929 -7.061 10.913 317 HD12 ILE 522 HD12 ILE 522 -6.203 -6.821 11.186 318 HD13 ILE 522 HD13 ILE 522 -6.854 -6.755 9.549 319 H LYS 523 H LYS 523 -8.865 -12.838 10.941 320 HA LYS 523 HA LYS 523 -11.153 -12.430 12.754 321 HB2 LYS 523 HB2 LYS 523 -11.636 -13.711 10.667 322 HB3 LYS 523 HB3 LYS 523 -10.467 -14.920 11.182 323 HG2 LYS 523 HG2 LYS 523 -11.909 -15.079 13.314 324 HG3 LYS 523 HG3 LYS 523 -13.143 -14.268 12.346 325 HD2 LYS 523 HD2 LYS 523 -12.428 -16.175 10.613 326 HD3 LYS 523 HD3 LYS 523 -12.037 -17.008 12.119 327 HE2 LYS 523 HE2 LYS 523 -14.206 -17.609 12.052 328 HE3 LYS 523 HE3 LYS 523 -14.469 -16.002 12.729 329 HZ1 LYS 523 HZ1 LYS 523 -15.528 -16.979 10.403 330 HZ2 LYS 523 HZ2 LYS 523 -14.300 -15.939 9.883 331 HZ3 LYS 523 HZ3 LYS 523 -15.523 -15.362 10.899 332 H LEU 524 H LEU 524 -11.178 -13.451 14.733 333 HA LEU 524 HA LEU 524 -8.734 -14.908 15.491 334 HB2 LEU 524 HB2 LEU 524 -8.896 -12.518 16.333 335 HB3 LEU 524 HB3 LEU 524 -10.240 -13.068 17.331 336 HG LEU 524 HG LEU 524 -8.006 -12.890 18.481 337 HD11 LEU 524 HD11 LEU 524 -10.070 -14.527 18.943 338 HD12 LEU 524 HD12 LEU 524 -8.616 -14.505 19.940 339 HD13 LEU 524 HD13 LEU 524 -8.804 -15.727 18.683 340 HD21 LEU 524 HD21 LEU 524 -7.332 -15.473 17.120 341 HD22 LEU 524 HD22 LEU 524 -6.287 -14.397 18.048 342 HD23 LEU 524 HD23 LEU 524 -6.829 -13.927 16.436 343 H PHE 525 H PHE 525 -9.614 -16.937 15.419 344 HA PHE 525 HA PHE 525 -12.105 -17.473 16.828 345 HB2 PHE 525 HB2 PHE 525 -10.860 -18.594 14.587 346 HB3 PHE 525 HB3 PHE 525 -10.737 -19.827 15.837 347 HD1 PHE 525 HD1 PHE 525 -12.361 -21.423 15.619 348 HD2 PHE 525 HD2 PHE 525 -13.358 -17.357 14.851 349 HE1 PHE 525 HE1 PHE 525 -14.696 -22.078 15.202 350 HE2 PHE 525 HE2 PHE 525 -15.695 -18.005 14.433 351 HZ PHE 525 HZ PHE 525 -16.366 -20.369 14.607 352 H ALA 526 H ALA 526 -11.705 -20.027 17.750 353 HA ALA 526 HA ALA 526 -10.335 -19.522 20.215 354 HB1 ALA 526 HB1 ALA 526 -12.388 -21.194 19.415 355 HB2 ALA 526 HB2 ALA 526 -11.058 -22.295 19.776 356 HB3 ALA 526 HB3 ALA 526 -11.621 -21.161 21.003 357 H SER 527 H SER 527 -9.789 -21.651 17.431 358 HA SER 527 HA SER 527 -6.994 -21.934 18.305 359 HB2 SER 527 HB2 SER 527 -8.949 -24.066 17.566 360 HB3 SER 527 HB3 SER 527 -7.265 -24.282 17.092 361 HG SER 527 HG SER 527 -6.767 -24.661 19.098 362 H HIS 528 H HIS 528 -8.509 -20.268 16.279 363 HA HIS 528 HA HIS 528 -6.609 -20.640 14.125 364 HB2 HIS 528 HB2 HIS 528 -9.590 -20.811 13.640 365 HB3 HIS 528 HB3 HIS 528 -8.378 -20.644 12.373 366 HD1 HIS 528 HD1 HIS 528 -7.062 -22.731 11.715 367 HD2 HIS 528 HD2 HIS 528 -9.680 -23.353 14.881 368 HE1 HIS 528 HE1 HIS 528 -7.152 -25.224 12.033 369 H SER 529 H SER 529 -6.730 -18.852 12.528 370 HA SER 529 HA SER 529 -8.239 -16.506 13.161 371 HB2 SER 529 HB2 SER 529 -5.302 -16.040 13.443 372 HB3 SER 529 HB3 SER 529 -6.653 -15.142 14.134 373 HG SER 529 HG SER 529 -5.661 -16.304 15.765 374 H THR 530 H THR 530 -8.464 -15.290 11.384 375 HA THR 530 HA THR 530 -6.789 -15.953 9.066 376 HB THR 530 HB THR 530 -8.541 -15.184 7.657 377 HG1 THR 530 HG1 THR 530 -10.197 -13.929 8.359 378 HG21 THR 530 HG21 THR 530 -10.319 -16.389 9.677 379 HG22 THR 530 HG22 THR 530 -8.868 -17.315 9.291 380 HG23 THR 530 HG23 THR 530 -9.999 -16.874 8.012 381 H ILE 531 H ILE 531 -6.377 -14.128 7.523 382 HA ILE 531 HA ILE 531 -6.448 -11.437 8.358 383 HB ILE 531 HB ILE 531 -4.774 -12.062 9.983 384 HG12 ILE 531 HG12 ILE 531 -3.198 -10.743 7.793 385 HG13 ILE 531 HG13 ILE 531 -4.585 -9.926 8.505 386 HG21 ILE 531 HG21 ILE 531 -2.662 -13.072 9.380 387 HG22 ILE 531 HG22 ILE 531 -3.988 -14.099 8.838 388 HG23 ILE 531 HG23 ILE 531 -3.124 -13.090 7.678 389 HD11 ILE 531 HD11 ILE 531 -1.931 -10.521 9.661 390 HD12 ILE 531 HD12 ILE 531 -2.957 -9.097 9.837 391 HD13 ILE 531 HD13 ILE 531 -3.320 -10.564 10.745 392 H GLU 532 H GLU 532 -5.953 -10.075 6.697 393 HA GLU 532 HA GLU 532 -4.837 -11.316 4.268 394 HB2 GLU 532 HB2 GLU 532 -7.257 -10.782 4.098 395 HB3 GLU 532 HB3 GLU 532 -6.881 -9.093 4.411 396 HG2 GLU 532 HG2 GLU 532 -6.018 -8.751 2.338 397 HG3 GLU 532 HG3 GLU 532 -5.475 -10.419 2.166 398 H LEU 533 H LEU 533 -3.040 -10.432 3.491 399 HA LEU 533 HA LEU 533 -2.242 -7.786 4.500 400 HB2 LEU 533 HB2 LEU 533 -0.841 -10.293 4.152 401 HB3 LEU 533 HB3 LEU 533 -0.021 -8.973 3.320 402 HG LEU 533 HG LEU 533 0.171 -7.739 5.395 403 HD11 LEU 533 HD11 LEU 533 -1.588 -8.129 6.771 404 HD12 LEU 533 HD12 LEU 533 -0.443 -9.262 7.489 405 HD13 LEU 533 HD13 LEU 533 -1.672 -9.844 6.366 406 HD21 LEU 533 HD21 LEU 533 1.231 -10.471 5.100 407 HD22 LEU 533 HD22 LEU 533 1.363 -9.768 6.712 408 HD23 LEU 533 HD23 LEU 533 2.077 -8.940 5.328 409 HA PRO 534 HA PRO 534 -2.742 -6.238 0.387 410 HB2 PRO 534 HB2 PRO 534 -1.439 -3.883 0.742 411 HB3 PRO 534 HB3 PRO 534 -3.062 -4.187 1.373 412 HG2 PRO 534 HG2 PRO 534 -0.426 -4.310 2.787 413 HG3 PRO 534 HG3 PRO 534 -1.962 -3.618 3.341 414 HD2 PRO 534 HD2 PRO 534 -1.092 -6.056 4.135 415 HD3 PRO 534 HD3 PRO 534 -2.815 -5.673 3.943 416 H LYS 535 H LYS 535 0.156 -7.198 1.814 417 HA LYS 535 HA LYS 535 2.194 -6.270 0.253 418 HB2 LYS 535 HB2 LYS 535 1.787 -9.113 1.199 419 HB3 LYS 535 HB3 LYS 535 3.313 -8.451 0.628 420 HG2 LYS 535 HG2 LYS 535 1.781 -7.494 3.038 421 HG3 LYS 535 HG3 LYS 535 3.210 -8.531 3.064 422 HD2 LYS 535 HD2 LYS 535 3.109 -5.730 1.946 423 HD3 LYS 535 HD3 LYS 535 3.750 -6.172 3.530 424 HE2 LYS 535 HE2 LYS 535 5.368 -7.678 2.360 425 HE3 LYS 535 HE3 LYS 535 4.798 -7.011 0.831 426 HZ1 LYS 535 HZ1 LYS 535 5.368 -4.768 2.033 427 HZ2 LYS 535 HZ2 LYS 535 6.564 -5.657 1.234 428 HZ3 LYS 535 HZ3 LYS 535 6.422 -5.754 2.917 429 H GLY 536 H GLY 536 3.128 -6.801 -1.718 430 HA2 GLY 536 HA2 GLY 536 1.469 -8.481 -3.495 431 HA3 GLY 536 HA3 GLY 536 2.137 -6.944 -4.024 432 H MET 537 H MET 537 3.697 -9.476 -2.099 433 HA MET 537 HA MET 537 5.153 -10.658 -4.188 434 HB2 MET 537 HB2 MET 537 6.093 -8.200 -3.961 435 HB3 MET 537 HB3 MET 537 6.980 -8.897 -2.612 436 HG2 MET 537 HG2 MET 537 8.224 -10.281 -3.967 437 HG3 MET 537 HG3 MET 537 7.035 -10.248 -5.268 438 HE1 MET 537 HE1 MET 537 10.696 -7.811 -4.692 439 HE2 MET 537 HE2 MET 537 9.527 -7.321 -3.466 440 HE3 MET 537 HE3 MET 537 9.982 -9.019 -3.623 441 HA PRO 538 HA PRO 538 5.213 -12.616 0.053 442 HB2 PRO 538 HB2 PRO 538 4.005 -14.923 -0.715 443 HB3 PRO 538 HB3 PRO 538 3.104 -13.495 -0.191 444 HG2 PRO 538 HG2 PRO 538 3.684 -14.457 -2.966 445 HG3 PRO 538 HG3 PRO 538 2.173 -13.812 -2.299 446 HD2 PRO 538 HD2 PRO 538 3.857 -12.317 -3.803 447 HD3 PRO 538 HD3 PRO 538 2.872 -11.624 -2.498 448 H GLY 539 H GLY 539 6.024 -14.944 0.518 449 HA2 GLY 539 HA2 GLY 539 7.427 -16.757 -0.061 450 HA3 GLY 539 HA3 GLY 539 7.874 -15.909 -1.534 451 H GLU 540 H GLU 540 7.931 -13.880 1.161 452 HA GLU 540 HA GLU 540 10.805 -13.704 1.045 453 HB2 GLU 540 HB2 GLU 540 9.024 -12.261 2.997 454 HB3 GLU 540 HB3 GLU 540 10.600 -11.769 2.394 455 HG2 GLU 540 HG2 GLU 540 8.062 -11.903 0.783 456 HG3 GLU 540 HG3 GLU 540 8.810 -10.440 1.421 457 H VAL 541 H VAL 541 8.480 -14.252 3.697 458 HA VAL 541 HA VAL 541 10.571 -15.273 5.411 459 HB VAL 541 HB VAL 541 7.587 -15.179 5.874 460 HG11 VAL 541 HG11 VAL 541 8.116 -15.508 8.212 461 HG12 VAL 541 HG12 VAL 541 8.783 -16.834 7.258 462 HG13 VAL 541 HG13 VAL 541 9.840 -15.549 7.844 463 HG21 VAL 541 HG21 VAL 541 8.317 -13.247 7.407 464 HG22 VAL 541 HG22 VAL 541 9.793 -13.227 6.442 465 HG23 VAL 541 HG23 VAL 541 8.232 -12.945 5.671 466 H LEU 542 H LEU 542 7.974 -16.546 3.439 467 HA LEU 542 HA LEU 542 7.934 -19.166 4.489 468 HB2 LEU 542 HB2 LEU 542 7.277 -18.305 1.677 469 HB3 LEU 542 HB3 LEU 542 6.739 -19.776 2.485 470 HG LEU 542 HG LEU 542 5.961 -17.008 3.388 471 HD11 LEU 542 HD11 LEU 542 3.742 -17.639 2.326 472 HD12 LEU 542 HD12 LEU 542 4.639 -18.871 1.438 473 HD13 LEU 542 HD13 LEU 542 5.043 -17.167 1.232 474 HD21 LEU 542 HD21 LEU 542 5.625 -18.464 5.169 475 HD22 LEU 542 HD22 LEU 542 5.150 -19.799 4.118 476 HD23 LEU 542 HD23 LEU 542 4.054 -18.439 4.368 477 H GLN 543 H GLN 543 10.125 -17.534 2.401 478 HA GLN 543 HA GLN 543 11.237 -19.942 1.254 479 HB2 GLN 543 HB2 GLN 543 11.709 -17.024 0.989 480 HB3 GLN 543 HB3 GLN 543 13.072 -18.081 0.648 481 HG2 GLN 543 HG2 GLN 543 10.440 -18.659 -0.615 482 HG3 GLN 543 HG3 GLN 543 11.433 -17.347 -1.247 483 HE21 GLN 543 HE21 GLN 543 13.307 -17.810 -2.328 484 HE22 GLN 543 HE22 GLN 543 13.759 -19.410 -2.796 485 H HIS 544 H HIS 544 12.556 -17.363 3.341 486 HA HIS 544 HA HIS 544 14.845 -18.883 4.079 487 HB2 HIS 544 HB2 HIS 544 14.404 -16.288 4.140 488 HB3 HIS 544 HB3 HIS 544 13.830 -16.631 5.769 489 HD1 HIS 544 HD1 HIS 544 15.689 -18.046 7.262 490 HD2 HIS 544 HD2 HIS 544 17.065 -15.834 4.025 491 HE1 HIS 544 HE1 HIS 544 18.151 -17.726 7.664 492 H PHE 545 H PHE 545 11.972 -17.889 5.948 493 HA PHE 545 HA PHE 545 12.603 -19.893 7.969 494 HB2 PHE 545 HB2 PHE 545 10.341 -17.886 7.926 495 HB3 PHE 545 HB3 PHE 545 10.869 -18.847 9.304 496 HD1 PHE 545 HD1 PHE 545 12.649 -18.141 10.676 497 HD2 PHE 545 HD2 PHE 545 11.839 -16.111 7.023 498 HE1 PHE 545 HE1 PHE 545 14.199 -16.347 11.333 499 HE2 PHE 545 HE2 PHE 545 13.389 -14.315 7.674 500 HZ PHE 545 HZ PHE 545 14.572 -14.431 9.830 501 H THR 546 H THR 546 11.950 -21.040 5.558 502 HA THR 546 HA THR 546 9.234 -21.653 5.192 503 HB THR 546 HB THR 546 11.053 -22.083 3.520 504 HG1 THR 546 HG1 THR 546 9.685 -23.441 2.642 505 HG21 THR 546 HG21 THR 546 12.706 -23.558 3.867 506 HG22 THR 546 HG22 THR 546 11.604 -24.765 4.530 507 HG23 THR 546 HG23 THR 546 12.243 -23.489 5.566 508 H ARG 547 H ARG 547 11.517 -22.755 7.513 509 HA ARG 547 HA ARG 547 9.675 -24.900 8.341 510 HB2 ARG 547 HB2 ARG 547 11.693 -25.820 9.563 511 HB3 ARG 547 HB3 ARG 547 11.760 -25.894 7.807 512 HG2 ARG 547 HG2 ARG 547 13.442 -24.371 7.665 513 HG3 ARG 547 HG3 ARG 547 12.943 -23.519 9.128 514 HD2 ARG 547 HD2 ARG 547 14.869 -24.543 9.850 515 HD3 ARG 547 HD3 ARG 547 13.658 -25.740 10.307 516 HE ARG 547 HE ARG 547 14.577 -26.317 7.720 517 HH11 ARG 547 HH11 ARG 547 15.685 -26.334 11.020 518 HH12 ARG 547 HH12 ARG 547 16.822 -27.617 10.768 519 HH21 ARG 547 HH21 ARG 547 16.070 -28.007 7.376 520 HH22 ARG 547 HH22 ARG 547 17.041 -28.567 8.695 521 H THR 548 H THR 548 11.148 -21.932 9.208 522 HA THR 548 HA THR 548 10.531 -22.264 12.045 523 HB THR 548 HB THR 548 11.884 -19.986 10.587 524 HG1 THR 548 HG1 THR 548 12.993 -21.857 12.423 525 HG21 THR 548 HG21 THR 548 11.481 -20.432 13.548 526 HG22 THR 548 HG22 THR 548 10.704 -19.186 12.571 527 HG23 THR 548 HG23 THR 548 12.448 -19.148 12.824 528 H ARG 549 H ARG 549 8.658 -21.614 12.859 529 HA ARG 549 HA ARG 549 7.368 -19.209 11.910 530 HB2 ARG 549 HB2 ARG 549 6.174 -21.939 11.498 531 HB3 ARG 549 HB3 ARG 549 5.157 -20.513 11.661 532 HG2 ARG 549 HG2 ARG 549 5.346 -20.415 9.434 533 HG3 ARG 549 HG3 ARG 549 6.910 -19.673 9.779 534 HD2 ARG 549 HD2 ARG 549 7.758 -21.303 8.500 535 HD3 ARG 549 HD3 ARG 549 7.496 -22.340 9.901 536 HE ARG 549 HE ARG 549 5.735 -23.342 8.806 537 HH11 ARG 549 HH11 ARG 549 6.770 -20.516 7.056 538 HH12 ARG 549 HH12 ARG 549 5.824 -20.879 5.651 539 HH21 ARG 549 HH21 ARG 549 4.485 -23.831 6.962 540 HH22 ARG 549 HH22 ARG 549 4.524 -22.765 5.599 541 H ILE 550 H ILE 550 5.134 -19.029 13.143 542 HA ILE 550 HA ILE 550 4.937 -20.319 15.671 543 HB ILE 550 HB ILE 550 6.896 -18.591 15.869 544 HG12 ILE 550 HG12 ILE 550 5.042 -18.114 18.094 545 HG13 ILE 550 HG13 ILE 550 5.197 -19.811 17.654 546 HG21 ILE 550 HG21 ILE 550 4.800 -16.669 16.681 547 HG22 ILE 550 HG22 ILE 550 6.415 -16.383 16.035 548 HG23 ILE 550 HG23 ILE 550 5.101 -16.841 14.952 549 HD11 ILE 550 HD11 ILE 550 7.793 -18.658 17.739 550 HD12 ILE 550 HD12 ILE 550 6.932 -18.242 19.222 551 HD13 ILE 550 HD13 ILE 550 7.108 -19.932 18.748 552 H LEU 551 H LEU 551 3.437 -18.786 17.155 553 HA LEU 551 HA LEU 551 0.927 -18.796 16.226 554 HB2 LEU 551 HB2 LEU 551 0.333 -17.119 17.837 555 HB3 LEU 551 HB3 LEU 551 1.584 -18.160 18.514 556 HG LEU 551 HG LEU 551 3.133 -16.184 17.587 557 HD11 LEU 551 HD11 LEU 551 2.176 -14.113 17.525 558 HD12 LEU 551 HD12 LEU 551 0.843 -14.572 18.584 559 HD13 LEU 551 HD13 LEU 551 0.843 -15.080 16.895 560 HD21 LEU 551 HD21 LEU 551 1.627 -16.182 20.200 561 HD22 LEU 551 HD22 LEU 551 3.096 -15.264 19.867 562 HD23 LEU 551 HD23 LEU 551 3.137 -17.028 19.860 563 H ASN 552 H ASN 552 3.243 -16.177 15.677 564 HA ASN 552 HA ASN 552 1.374 -14.590 14.180 565 HB2 ASN 552 HB2 ASN 552 3.174 -13.508 15.424 566 HB3 ASN 552 HB3 ASN 552 4.378 -14.368 14.469 567 HD21 ASN 552 HD21 ASN 552 5.366 -12.739 13.447 568 HD22 ASN 552 HD22 ASN 552 4.582 -11.618 12.392 569 H LYS 553 H LYS 553 4.441 -16.164 13.253 570 HA LYS 553 HA LYS 553 4.044 -15.920 10.485 571 HB2 LYS 553 HB2 LYS 553 5.616 -18.192 11.643 572 HB3 LYS 553 HB3 LYS 553 5.965 -17.209 10.227 573 HG2 LYS 553 HG2 LYS 553 6.274 -16.441 13.117 574 HG3 LYS 553 HG3 LYS 553 7.541 -16.635 11.903 575 HD2 LYS 553 HD2 LYS 553 6.223 -14.771 10.640 576 HD3 LYS 553 HD3 LYS 553 5.549 -14.430 12.235 577 HE2 LYS 553 HE2 LYS 553 7.369 -13.052 12.280 578 HE3 LYS 553 HE3 LYS 553 8.090 -14.518 12.942 579 HZ1 LYS 553 HZ1 LYS 553 8.210 -13.714 10.086 580 HZ2 LYS 553 HZ2 LYS 553 8.973 -15.052 10.783 581 HZ3 LYS 553 HZ3 LYS 553 9.457 -13.487 11.206 582 HA PRO 554 HA PRO 554 1.322 -19.161 9.332 583 HB2 PRO 554 HB2 PRO 554 2.496 -20.187 7.110 584 HB3 PRO 554 HB3 PRO 554 1.714 -18.602 7.139 585 HG2 PRO 554 HG2 PRO 554 4.621 -19.283 7.348 586 HG3 PRO 554 HG3 PRO 554 3.839 -17.992 6.417 587 HD2 PRO 554 HD2 PRO 554 5.050 -17.545 8.798 588 HD3 PRO 554 HD3 PRO 554 3.635 -16.618 8.257 589 H MET 555 H MET 555 2.066 -20.314 11.371 590 HA MET 555 HA MET 555 4.001 -22.351 11.294 591 HB2 MET 555 HB2 MET 555 3.233 -21.577 13.417 592 HB3 MET 555 HB3 MET 555 1.562 -21.957 13.024 593 HG2 MET 555 HG2 MET 555 2.422 -23.585 14.565 594 HG3 MET 555 HG3 MET 555 2.129 -24.345 13.002 595 HE1 MET 555 HE1 MET 555 3.831 -26.421 14.183 596 HE2 MET 555 HE2 MET 555 3.485 -26.142 12.476 597 HE3 MET 555 HE3 MET 555 5.141 -26.448 13.002 598 H ASN 556 H ASN 556 0.448 -22.718 11.246 599 HA ASN 556 HA ASN 556 0.769 -24.959 9.383 600 HB2 ASN 556 HB2 ASN 556 0.464 -25.597 11.920 601 HB3 ASN 556 HB3 ASN 556 -1.225 -25.213 11.601 602 HD21 ASN 556 HD21 ASN 556 1.436 -27.319 10.814 603 HD22 ASN 556 HD22 ASN 556 0.491 -28.566 10.082 604 H MET 557 H MET 557 0.014 -22.429 8.641 605 HA MET 557 HA MET 557 -2.891 -22.350 8.515 606 HB2 MET 557 HB2 MET 557 -2.581 -20.194 7.398 607 HB3 MET 557 HB3 MET 557 -1.676 -20.262 8.904 608 HG2 MET 557 HG2 MET 557 -0.069 -19.372 7.598 609 HG3 MET 557 HG3 MET 557 0.242 -21.073 7.256 610 HE1 MET 557 HE1 MET 557 1.060 -20.274 3.900 611 HE2 MET 557 HE2 MET 557 1.332 -21.098 5.436 612 HE3 MET 557 HE3 MET 557 0.233 -21.794 4.244 613 H GLN 558 H GLN 558 -3.646 -21.510 6.181 614 HA GLN 558 HA GLN 558 -2.354 -22.831 3.980 615 HB2 GLN 558 HB2 GLN 558 -3.998 -24.462 3.485 616 HB3 GLN 558 HB3 GLN 558 -3.622 -24.661 5.192 617 HG2 GLN 558 HG2 GLN 558 -5.637 -23.339 5.746 618 HG3 GLN 558 HG3 GLN 558 -6.029 -23.280 4.029 619 HE21 GLN 558 HE21 GLN 558 -6.965 -25.010 3.073 620 HE22 GLN 558 HE22 GLN 558 -7.418 -26.451 3.910 621 H LEU 559 H LEU 559 -2.843 -21.850 2.102 622 HA LEU 559 HA LEU 559 -4.304 -19.456 2.078 623 HB2 LEU 559 HB2 LEU 559 -2.496 -19.984 0.506 624 HB3 LEU 559 HB3 LEU 559 -3.516 -21.207 -0.248 625 HG LEU 559 HG LEU 559 -3.255 -18.936 -1.418 626 HD11 LEU 559 HD11 LEU 559 -5.302 -19.213 -2.452 627 HD12 LEU 559 HD12 LEU 559 -6.115 -19.674 -0.956 628 HD13 LEU 559 HD13 LEU 559 -5.019 -20.806 -1.749 629 HD21 LEU 559 HD21 LEU 559 -4.785 -17.198 -0.694 630 HD22 LEU 559 HD22 LEU 559 -3.626 -17.563 0.585 631 HD23 LEU 559 HD23 LEU 559 -5.277 -18.177 0.688 632 H LEU 560 H LEU 560 -6.416 -19.103 2.020 633 HA LEU 560 HA LEU 560 -8.165 -21.213 0.937 634 HB2 LEU 560 HB2 LEU 560 -9.747 -20.796 2.566 635 HB3 LEU 560 HB3 LEU 560 -8.229 -20.639 3.448 636 HG LEU 560 HG LEU 560 -8.667 -18.063 2.718 637 HD11 LEU 560 HD11 LEU 560 -10.956 -19.032 1.861 638 HD12 LEU 560 HD12 LEU 560 -10.874 -17.471 2.676 639 HD13 LEU 560 HD13 LEU 560 -11.392 -18.903 3.565 640 HD21 LEU 560 HD21 LEU 560 -8.829 -17.699 4.949 641 HD22 LEU 560 HD22 LEU 560 -8.339 -19.393 5.011 642 HD23 LEU 560 HD23 LEU 560 -10.041 -18.960 5.180 643 H GLY 561 H GLY 561 -7.313 -17.853 0.915 644 HA2 GLY 561 HA2 GLY 561 -9.645 -17.091 -0.650 645 HA3 GLY 561 HA3 GLY 561 -8.349 -16.028 -0.123 646 H ASP 562 H ASP 562 -8.139 -15.100 -2.173 647 HA ASP 562 HA ASP 562 -6.289 -16.388 -3.890 648 HB2 ASP 562 HB2 ASP 562 -8.146 -17.640 -4.731 649 HB3 ASP 562 HB3 ASP 562 -9.152 -16.197 -4.832 650 H ALA 563 H ALA 563 -5.088 -14.839 -4.774 651 HA ALA 563 HA ALA 563 -5.484 -12.133 -4.351 652 HB1 ALA 563 HB1 ALA 563 -3.451 -13.634 -5.335 653 HB2 ALA 563 HB2 ALA 563 -3.972 -12.775 -6.785 654 HB3 ALA 563 HB3 ALA 563 -3.489 -11.871 -5.350 655 H GLN 564 H GLN 564 -6.926 -10.762 -5.143 656 HA GLN 564 HA GLN 564 -8.780 -11.348 -7.131 657 HB2 GLN 564 HB2 GLN 564 -8.617 -9.409 -5.319 658 HB3 GLN 564 HB3 GLN 564 -8.007 -8.504 -6.697 659 HG2 GLN 564 HG2 GLN 564 -10.366 -8.140 -6.488 660 HG3 GLN 564 HG3 GLN 564 -10.049 -9.081 -7.945 661 HE21 GLN 564 HE21 GLN 564 -11.662 -10.436 -8.242 662 HE22 GLN 564 HE22 GLN 564 -12.399 -11.423 -7.031 Start of MODEL 15 1 H MET 480 H MET 480 1.161 -0.020 0.813 2 HA MET 480 HA MET 480 1.821 0.337 -1.948 3 HB2 MET 480 HB2 MET 480 2.978 1.664 -0.310 4 HB3 MET 480 HB3 MET 480 3.520 0.227 0.546 5 HG2 MET 480 HG2 MET 480 5.054 -0.331 -1.133 6 HG3 MET 480 HG3 MET 480 4.309 0.766 -2.293 7 HE1 MET 480 HE1 MET 480 7.092 1.610 1.155 8 HE2 MET 480 HE2 MET 480 5.453 2.098 1.588 9 HE3 MET 480 HE3 MET 480 5.777 0.437 1.089 10 H ALA 481 H ALA 481 1.376 -1.628 -2.967 11 HA ALA 481 HA ALA 481 3.160 -3.858 -2.235 12 HB1 ALA 481 HB1 ALA 481 1.227 -4.941 -3.874 13 HB2 ALA 481 HB2 ALA 481 1.274 -5.042 -2.113 14 HB3 ALA 481 HB3 ALA 481 0.332 -3.776 -2.899 15 H ASP 482 H ASP 482 3.270 -5.388 -4.349 16 HA ASP 482 HA ASP 482 4.485 -3.680 -6.396 17 HB2 ASP 482 HB2 ASP 482 5.496 -5.862 -5.139 18 HB3 ASP 482 HB3 ASP 482 4.810 -6.611 -6.578 19 H VAL 483 H VAL 483 2.044 -6.162 -5.945 20 HA VAL 483 HA VAL 483 1.052 -5.587 -8.653 21 HB VAL 483 HB VAL 483 2.151 -7.725 -8.831 22 HG11 VAL 483 HG11 VAL 483 0.396 -8.712 -6.588 23 HG12 VAL 483 HG12 VAL 483 1.667 -9.603 -7.428 24 HG13 VAL 483 HG13 VAL 483 2.083 -8.239 -6.390 25 HG21 VAL 483 HG21 VAL 483 -0.728 -8.487 -8.593 26 HG22 VAL 483 HG22 VAL 483 -0.238 -7.272 -9.774 27 HG23 VAL 483 HG23 VAL 483 0.441 -8.898 -9.848 28 H GLY 484 H GLY 484 0.349 -6.826 -5.416 29 HA2 GLY 484 HA2 GLY 484 -1.627 -5.728 -4.359 30 HA3 GLY 484 HA3 GLY 484 -2.481 -6.093 -5.851 31 H ASP 485 H ASP 485 -0.226 -8.351 -4.456 32 HA ASP 485 HA ASP 485 -1.911 -10.532 -4.520 33 HB2 ASP 485 HB2 ASP 485 0.680 -10.261 -3.975 34 HB3 ASP 485 HB3 ASP 485 0.096 -10.409 -2.320 35 H MET 486 H MET 486 -3.906 -10.464 -3.655 36 HA MET 486 HA MET 486 -4.098 -9.910 -0.768 37 HB2 MET 486 HB2 MET 486 -5.132 -8.178 -2.381 38 HB3 MET 486 HB3 MET 486 -6.363 -9.398 -2.677 39 HG2 MET 486 HG2 MET 486 -7.390 -8.281 -1.006 40 HG3 MET 486 HG3 MET 486 -6.450 -9.407 -0.029 41 HE1 MET 486 HE1 MET 486 -6.171 -6.347 -2.043 42 HE2 MET 486 HE2 MET 486 -6.321 -5.111 -0.793 43 HE3 MET 486 HE3 MET 486 -4.727 -5.563 -1.400 44 H GLN 487 H GLN 487 -4.661 -11.656 0.337 45 HA GLN 487 HA GLN 487 -6.754 -13.406 -0.633 46 HB2 GLN 487 HB2 GLN 487 -3.998 -14.497 -0.038 47 HB3 GLN 487 HB3 GLN 487 -5.424 -15.452 -0.420 48 HG2 GLN 487 HG2 GLN 487 -5.509 -14.407 -2.639 49 HG3 GLN 487 HG3 GLN 487 -4.046 -13.503 -2.253 50 HE21 GLN 487 HE21 GLN 487 -2.094 -14.486 -2.390 51 HE22 GLN 487 HE22 GLN 487 -1.865 -16.105 -2.948 52 H LEU 488 H LEU 488 -7.047 -15.270 1.046 53 HA LEU 488 HA LEU 488 -6.790 -14.071 3.725 54 HB2 LEU 488 HB2 LEU 488 -9.102 -14.371 2.679 55 HB3 LEU 488 HB3 LEU 488 -8.854 -16.099 2.923 56 HG LEU 488 HG LEU 488 -8.624 -15.672 5.357 57 HD11 LEU 488 HD11 LEU 488 -8.487 -13.629 6.218 58 HD12 LEU 488 HD12 LEU 488 -9.901 -13.079 5.320 59 HD13 LEU 488 HD13 LEU 488 -8.306 -13.032 4.569 60 HD21 LEU 488 HD21 LEU 488 -10.740 -16.422 4.580 61 HD22 LEU 488 HD22 LEU 488 -11.159 -14.820 3.974 62 HD23 LEU 488 HD23 LEU 488 -11.045 -15.104 5.711 63 H TYR 489 H TYR 489 -5.298 -15.053 4.908 64 HA TYR 489 HA TYR 489 -4.907 -17.952 4.564 65 HB2 TYR 489 HB2 TYR 489 -2.844 -16.310 5.938 66 HB3 TYR 489 HB3 TYR 489 -2.651 -17.701 4.877 67 HD1 TYR 489 HD1 TYR 489 -3.158 -14.057 4.993 68 HD2 TYR 489 HD2 TYR 489 -2.421 -17.427 2.502 69 HE1 TYR 489 HE1 TYR 489 -2.585 -12.551 3.135 70 HE2 TYR 489 HE2 TYR 489 -1.845 -15.930 0.638 71 HH TYR 489 HH TYR 489 -2.596 -12.718 0.561 72 H ARG 490 H ARG 490 -5.796 -19.106 6.132 73 HA ARG 490 HA ARG 490 -6.061 -17.926 8.806 74 HB2 ARG 490 HB2 ARG 490 -7.742 -19.655 9.220 75 HB3 ARG 490 HB3 ARG 490 -8.134 -18.728 7.778 76 HG2 ARG 490 HG2 ARG 490 -8.405 -20.679 6.756 77 HG3 ARG 490 HG3 ARG 490 -6.648 -20.837 6.804 78 HD2 ARG 490 HD2 ARG 490 -6.973 -22.696 7.989 79 HD3 ARG 490 HD3 ARG 490 -7.449 -21.644 9.322 80 HE ARG 490 HE ARG 490 -9.721 -21.986 7.820 81 HH11 ARG 490 HH11 ARG 490 -7.485 -24.066 9.492 82 HH12 ARG 490 HH12 ARG 490 -8.672 -25.279 9.841 83 HH21 ARG 490 HH21 ARG 490 -11.292 -23.575 8.274 84 HH22 ARG 490 HH22 ARG 490 -10.837 -24.999 9.147 85 H ILE 491 H ILE 491 -4.966 -18.702 10.504 86 HA ILE 491 HA ILE 491 -3.196 -20.995 10.046 87 HB ILE 491 HB ILE 491 -1.915 -20.217 11.963 88 HG12 ILE 491 HG12 ILE 491 -3.907 -17.945 12.122 89 HG13 ILE 491 HG13 ILE 491 -3.840 -19.301 13.242 90 HG21 ILE 491 HG21 ILE 491 -1.202 -19.296 9.914 91 HG22 ILE 491 HG22 ILE 491 -2.550 -18.161 9.865 92 HG23 ILE 491 HG23 ILE 491 -1.259 -17.945 11.046 93 HD11 ILE 491 HD11 ILE 491 -2.737 -17.559 14.331 94 HD12 ILE 491 HD12 ILE 491 -1.442 -18.578 13.701 95 HD13 ILE 491 HD13 ILE 491 -1.868 -17.079 12.874 96 H GLU 492 H GLU 492 -2.711 -22.263 12.140 97 HA GLU 492 HA GLU 492 -5.296 -23.087 13.255 98 HB2 GLU 492 HB2 GLU 492 -3.814 -24.756 12.078 99 HB3 GLU 492 HB3 GLU 492 -2.669 -24.567 13.398 100 HG2 GLU 492 HG2 GLU 492 -5.272 -25.102 14.455 101 HG3 GLU 492 HG3 GLU 492 -4.856 -26.314 13.245 102 H VAL 493 H VAL 493 -4.425 -20.778 14.359 103 HA VAL 493 HA VAL 493 -3.729 -21.628 17.077 104 HB VAL 493 HB VAL 493 -2.517 -19.158 15.846 105 HG11 VAL 493 HG11 VAL 493 -1.561 -20.653 18.263 106 HG12 VAL 493 HG12 VAL 493 -1.255 -18.978 17.799 107 HG13 VAL 493 HG13 VAL 493 -2.851 -19.456 18.379 108 HG21 VAL 493 HG21 VAL 493 -1.259 -21.879 16.186 109 HG22 VAL 493 HG22 VAL 493 -1.655 -21.098 14.655 110 HG23 VAL 493 HG23 VAL 493 -0.411 -20.412 15.700 111 H GLY 494 H GLY 494 -4.819 -20.581 18.671 112 HA2 GLY 494 HA2 GLY 494 -6.261 -18.117 18.040 113 HA3 GLY 494 HA3 GLY 494 -7.226 -19.512 18.499 114 H ARG 495 H ARG 495 -7.872 -17.891 20.195 115 HA ARG 495 HA ARG 495 -6.171 -17.001 22.206 116 HB2 ARG 495 HB2 ARG 495 -8.254 -16.963 23.634 117 HB3 ARG 495 HB3 ARG 495 -8.370 -16.105 22.103 118 HG2 ARG 495 HG2 ARG 495 -9.658 -17.854 21.130 119 HG3 ARG 495 HG3 ARG 495 -9.364 -18.913 22.511 120 HD2 ARG 495 HD2 ARG 495 -10.895 -16.315 22.580 121 HD3 ARG 495 HD3 ARG 495 -11.611 -17.926 22.566 122 HE ARG 495 HE ARG 495 -10.529 -16.556 24.817 123 HH11 ARG 495 HH11 ARG 495 -10.974 -19.712 23.416 124 HH12 ARG 495 HH12 ARG 495 -10.948 -20.535 24.940 125 HH21 ARG 495 HH21 ARG 495 -10.495 -17.628 26.829 126 HH22 ARG 495 HH22 ARG 495 -10.677 -19.349 26.881 127 H ASP 496 H ASP 496 -7.687 -20.121 21.734 128 HA ASP 496 HA ASP 496 -7.084 -21.127 24.342 129 HB2 ASP 496 HB2 ASP 496 -8.805 -21.936 22.466 130 HB3 ASP 496 HB3 ASP 496 -7.460 -22.996 22.056 131 H ASP 497 H ASP 497 -5.290 -20.685 21.472 132 HA ASP 497 HA ASP 497 -3.293 -22.689 22.199 133 HB2 ASP 497 HB2 ASP 497 -4.069 -22.351 19.809 134 HB3 ASP 497 HB3 ASP 497 -3.224 -20.806 19.839 135 H GLY 498 H GLY 498 -3.656 -19.188 21.867 136 HA2 GLY 498 HA2 GLY 498 -2.375 -18.048 23.765 137 HA3 GLY 498 HA3 GLY 498 -0.980 -18.851 23.059 138 H VAL 499 H VAL 499 -3.631 -17.435 21.231 139 HA VAL 499 HA VAL 499 -1.894 -15.205 20.441 140 HB VAL 499 HB VAL 499 -1.848 -17.154 18.769 141 HG11 VAL 499 HG11 VAL 499 -4.549 -17.063 19.004 142 HG12 VAL 499 HG12 VAL 499 -4.303 -16.115 17.536 143 HG13 VAL 499 HG13 VAL 499 -3.690 -17.766 17.634 144 HG21 VAL 499 HG21 VAL 499 -2.737 -14.478 17.707 145 HG22 VAL 499 HG22 VAL 499 -1.122 -14.800 18.338 146 HG23 VAL 499 HG23 VAL 499 -1.697 -15.658 16.909 147 H GLU 500 H GLU 500 -2.978 -13.345 19.716 148 HA GLU 500 HA GLU 500 -5.896 -13.351 20.116 149 HB2 GLU 500 HB2 GLU 500 -4.165 -11.008 20.863 150 HB3 GLU 500 HB3 GLU 500 -5.826 -11.338 21.336 151 HG2 GLU 500 HG2 GLU 500 -3.346 -12.745 22.288 152 HG3 GLU 500 HG3 GLU 500 -4.412 -11.696 23.222 153 H VAL 501 H VAL 501 -6.581 -10.876 19.405 154 HA VAL 501 HA VAL 501 -6.203 -10.900 16.562 155 HB VAL 501 HB VAL 501 -7.652 -8.920 18.325 156 HG11 VAL 501 HG11 VAL 501 -7.071 -7.812 16.293 157 HG12 VAL 501 HG12 VAL 501 -7.557 -9.206 15.327 158 HG13 VAL 501 HG13 VAL 501 -8.773 -8.260 16.187 159 HG21 VAL 501 HG21 VAL 501 -8.411 -11.398 18.115 160 HG22 VAL 501 HG22 VAL 501 -9.601 -10.108 17.947 161 HG23 VAL 501 HG23 VAL 501 -8.959 -10.907 16.512 162 H ARG 502 H ARG 502 -4.997 -9.009 19.254 163 HA ARG 502 HA ARG 502 -3.714 -7.082 17.499 164 HB2 ARG 502 HB2 ARG 502 -2.894 -6.081 19.627 165 HB3 ARG 502 HB3 ARG 502 -4.645 -6.218 19.545 166 HG2 ARG 502 HG2 ARG 502 -4.683 -8.014 21.061 167 HG3 ARG 502 HG3 ARG 502 -2.944 -8.276 20.913 168 HD2 ARG 502 HD2 ARG 502 -3.848 -5.615 21.855 169 HD3 ARG 502 HD3 ARG 502 -4.035 -6.972 22.966 170 HE ARG 502 HE ARG 502 -1.463 -7.165 22.064 171 HH11 ARG 502 HH11 ARG 502 -3.352 -4.699 23.635 172 HH12 ARG 502 HH12 ARG 502 -1.996 -3.998 24.453 173 HH21 ARG 502 HH21 ARG 502 0.331 -6.250 23.135 174 HH22 ARG 502 HH22 ARG 502 0.099 -4.880 24.167 175 H HIS 503 H HIS 503 -3.037 -10.150 18.423 176 HA HIS 503 HA HIS 503 -0.207 -9.835 18.932 177 HB2 HIS 503 HB2 HIS 503 -1.932 -11.713 19.739 178 HB3 HIS 503 HB3 HIS 503 -1.356 -12.498 18.272 179 HD1 HIS 503 HD1 HIS 503 -0.766 -13.603 21.126 180 HD2 HIS 503 HD2 HIS 503 1.815 -11.217 18.912 181 HE1 HIS 503 HE1 HIS 503 1.531 -14.075 22.034 182 H ILE 504 H ILE 504 -2.129 -11.488 16.420 183 HA ILE 504 HA ILE 504 0.101 -11.844 14.688 184 HB ILE 504 HB ILE 504 -1.390 -12.762 13.123 185 HG12 ILE 504 HG12 ILE 504 -2.935 -10.770 13.138 186 HG13 ILE 504 HG13 ILE 504 -3.743 -12.328 13.008 187 HG21 ILE 504 HG21 ILE 504 -2.818 -14.262 14.442 188 HG22 ILE 504 HG22 ILE 504 -1.206 -14.100 15.139 189 HG23 ILE 504 HG23 ILE 504 -2.568 -13.240 15.857 190 HD11 ILE 504 HD11 ILE 504 -3.506 -10.620 15.471 191 HD12 ILE 504 HD12 ILE 504 -4.959 -10.926 14.519 192 HD13 ILE 504 HD13 ILE 504 -4.210 -12.236 15.432 193 H VAL 505 H VAL 505 -2.180 -9.290 15.195 194 HA VAL 505 HA VAL 505 -1.718 -7.995 12.665 195 HB VAL 505 HB VAL 505 -3.100 -7.071 15.183 196 HG11 VAL 505 HG11 VAL 505 -3.910 -5.388 13.163 197 HG12 VAL 505 HG12 VAL 505 -2.768 -4.988 14.447 198 HG13 VAL 505 HG13 VAL 505 -2.177 -5.545 12.881 199 HG21 VAL 505 HG21 VAL 505 -5.127 -7.304 13.857 200 HG22 VAL 505 HG22 VAL 505 -4.175 -7.808 12.461 201 HG23 VAL 505 HG23 VAL 505 -4.239 -8.827 13.899 202 H GLY 506 H GLY 506 -0.984 -7.091 16.045 203 HA2 GLY 506 HA2 GLY 506 0.681 -4.922 15.407 204 HA3 GLY 506 HA3 GLY 506 0.690 -5.796 16.931 205 H ALA 507 H ALA 507 1.282 -8.311 15.296 206 HA ALA 507 HA ALA 507 4.122 -8.178 15.588 207 HB1 ALA 507 HB1 ALA 507 4.054 -10.508 14.689 208 HB2 ALA 507 HB2 ALA 507 3.034 -10.239 16.103 209 HB3 ALA 507 HB3 ALA 507 2.311 -10.323 14.497 210 H ILE 508 H ILE 508 2.033 -8.794 12.759 211 HA ILE 508 HA ILE 508 4.187 -8.515 10.905 212 HB ILE 508 HB ILE 508 2.464 -8.609 9.165 213 HG12 ILE 508 HG12 ILE 508 0.081 -9.157 10.291 214 HG13 ILE 508 HG13 ILE 508 0.706 -8.021 11.482 215 HG21 ILE 508 HG21 ILE 508 3.139 -10.596 10.969 216 HG22 ILE 508 HG22 ILE 508 1.384 -10.707 10.845 217 HG23 ILE 508 HG23 ILE 508 2.380 -10.823 9.394 218 HD11 ILE 508 HD11 ILE 508 0.334 -6.284 10.153 219 HD12 ILE 508 HD12 ILE 508 1.065 -7.085 8.762 220 HD13 ILE 508 HD13 ILE 508 -0.625 -7.387 9.166 221 H ALA 509 H ALA 509 1.876 -6.351 12.334 222 HA ALA 509 HA ALA 509 2.182 -4.253 10.408 223 HB1 ALA 509 HB1 ALA 509 0.811 -2.947 11.823 224 HB2 ALA 509 HB2 ALA 509 0.190 -4.595 11.923 225 HB3 ALA 509 HB3 ALA 509 1.183 -3.946 13.228 226 H ASN 510 H ASN 510 3.910 -5.295 13.211 227 HA ASN 510 HA ASN 510 5.355 -2.763 13.419 228 HB2 ASN 510 HB2 ASN 510 4.563 -3.914 15.485 229 HB3 ASN 510 HB3 ASN 510 5.636 -5.258 15.108 230 HD21 ASN 510 HD21 ASN 510 6.724 -4.933 17.070 231 HD22 ASN 510 HD22 ASN 510 7.853 -3.641 17.270 232 H GLU 511 H GLU 511 5.715 -5.999 12.234 233 HA GLU 511 HA GLU 511 8.556 -6.046 12.114 234 HB2 GLU 511 HB2 GLU 511 6.358 -7.662 10.880 235 HB3 GLU 511 HB3 GLU 511 8.003 -7.849 10.290 236 HG2 GLU 511 HG2 GLU 511 7.136 -8.213 13.149 237 HG3 GLU 511 HG3 GLU 511 7.406 -9.513 11.990 238 H GLY 512 H GLY 512 6.038 -5.360 9.693 239 HA2 GLY 512 HA2 GLY 512 8.143 -4.192 7.982 240 HA3 GLY 512 HA3 GLY 512 6.653 -4.897 7.373 241 H ASP 513 H ASP 513 6.072 -3.033 6.252 242 HA ASP 513 HA ASP 513 5.723 -0.557 7.739 243 HB2 ASP 513 HB2 ASP 513 5.694 -1.339 4.868 244 HB3 ASP 513 HB3 ASP 513 4.737 0.064 5.333 245 H ILE 514 H ILE 514 3.922 -3.311 6.988 246 HA ILE 514 HA ILE 514 1.359 -2.414 6.515 247 HB ILE 514 HB ILE 514 2.162 -4.744 8.262 248 HG12 ILE 514 HG12 ILE 514 1.295 -4.900 5.390 249 HG13 ILE 514 HG13 ILE 514 2.974 -4.564 5.798 250 HG21 ILE 514 HG21 ILE 514 -0.126 -5.585 7.379 251 HG22 ILE 514 HG22 ILE 514 -0.084 -4.457 8.733 252 HG23 ILE 514 HG23 ILE 514 -0.456 -3.873 7.111 253 HD11 ILE 514 HD11 ILE 514 1.446 -6.973 6.748 254 HD12 ILE 514 HD12 ILE 514 2.508 -6.946 5.340 255 HD13 ILE 514 HD13 ILE 514 3.168 -6.654 6.949 256 H SER 515 H SER 515 -0.364 -1.755 7.763 257 HA SER 515 HA SER 515 0.287 -0.988 10.535 258 HB2 SER 515 HB2 SER 515 -0.172 0.799 8.624 259 HB3 SER 515 HB3 SER 515 -1.853 0.440 9.019 260 HG SER 515 HG SER 515 -0.628 2.182 10.233 261 H SER 516 H SER 516 -1.700 -0.711 11.923 262 HA SER 516 HA SER 516 -3.118 -3.145 12.023 263 HB2 SER 516 HB2 SER 516 -3.421 -0.521 13.470 264 HB3 SER 516 HB3 SER 516 -4.535 -1.858 13.751 265 HG SER 516 HG SER 516 -2.933 -2.107 15.228 266 H ARG 517 H ARG 517 -3.763 -0.131 10.457 267 HA ARG 517 HA ARG 517 -6.562 -0.821 9.988 268 HB2 ARG 517 HB2 ARG 517 -6.655 1.416 8.881 269 HB3 ARG 517 HB3 ARG 517 -6.180 1.475 10.573 270 HG2 ARG 517 HG2 ARG 517 -3.958 1.970 10.055 271 HG3 ARG 517 HG3 ARG 517 -4.139 1.444 8.380 272 HD2 ARG 517 HD2 ARG 517 -4.040 3.933 8.727 273 HD3 ARG 517 HD3 ARG 517 -5.442 3.348 7.832 274 HE ARG 517 HE ARG 517 -5.942 3.604 10.640 275 HH11 ARG 517 HH11 ARG 517 -5.807 5.326 7.617 276 HH12 ARG 517 HH12 ARG 517 -6.903 6.568 8.125 277 HH21 ARG 517 HH21 ARG 517 -7.386 5.233 11.320 278 HH22 ARG 517 HH22 ARG 517 -7.800 6.514 10.232 279 H TYR 518 H TYR 518 -3.489 -0.654 8.345 280 HA TYR 518 HA TYR 518 -4.405 -0.742 5.688 281 HB2 TYR 518 HB2 TYR 518 -1.931 -0.671 6.951 282 HB3 TYR 518 HB3 TYR 518 -1.930 -2.218 6.113 283 HD1 TYR 518 HD1 TYR 518 -3.321 -1.741 3.652 284 HD2 TYR 518 HD2 TYR 518 -0.668 0.842 5.748 285 HE1 TYR 518 HE1 TYR 518 -2.772 -0.602 1.542 286 HE2 TYR 518 HE2 TYR 518 -0.113 1.989 3.645 287 HH TYR 518 HH TYR 518 -1.876 1.865 0.962 288 H ILE 519 H ILE 519 -3.892 -3.247 8.089 289 HA ILE 519 HA ILE 519 -4.020 -5.487 6.397 290 HB ILE 519 HB ILE 519 -4.882 -5.260 9.283 291 HG12 ILE 519 HG12 ILE 519 -2.344 -6.579 8.546 292 HG13 ILE 519 HG13 ILE 519 -2.386 -4.837 8.295 293 HG21 ILE 519 HG21 ILE 519 -5.826 -7.233 8.225 294 HG22 ILE 519 HG22 ILE 519 -4.234 -7.692 7.623 295 HG23 ILE 519 HG23 ILE 519 -4.554 -7.690 9.357 296 HD11 ILE 519 HD11 ILE 519 -1.515 -5.167 10.448 297 HD12 ILE 519 HD12 ILE 519 -3.186 -4.654 10.684 298 HD13 ILE 519 HD13 ILE 519 -2.753 -6.355 10.854 299 H GLY 520 H GLY 520 -5.703 -6.800 5.744 300 HA2 GLY 520 HA2 GLY 520 -8.224 -5.505 5.349 301 HA3 GLY 520 HA3 GLY 520 -7.808 -7.143 4.866 302 H ASN 521 H ASN 521 -9.085 -8.608 5.754 303 HA ASN 521 HA ASN 521 -10.416 -8.013 8.283 304 HB2 ASN 521 HB2 ASN 521 -10.835 -10.292 6.334 305 HB3 ASN 521 HB3 ASN 521 -11.818 -9.972 7.760 306 HD21 ASN 521 HD21 ASN 521 -10.819 -8.687 4.648 307 HD22 ASN 521 HD22 ASN 521 -12.213 -7.695 4.402 308 H ILE 522 H ILE 522 -9.829 -8.888 10.159 309 HA ILE 522 HA ILE 522 -8.019 -11.215 10.107 310 HB ILE 522 HB ILE 522 -8.024 -9.071 12.228 311 HG12 ILE 522 HG12 ILE 522 -5.625 -8.920 10.815 312 HG13 ILE 522 HG13 ILE 522 -6.856 -9.072 9.566 313 HG21 ILE 522 HG21 ILE 522 -7.096 -11.587 12.410 314 HG22 ILE 522 HG22 ILE 522 -5.678 -10.787 11.735 315 HG23 ILE 522 HG23 ILE 522 -6.372 -10.219 13.253 316 HD11 ILE 522 HD11 ILE 522 -7.159 -6.889 9.756 317 HD12 ILE 522 HD12 ILE 522 -7.885 -7.199 11.333 318 HD13 ILE 522 HD13 ILE 522 -6.169 -6.812 11.212 319 H LYS 523 H LYS 523 -8.740 -12.966 11.114 320 HA LYS 523 HA LYS 523 -10.995 -12.676 12.984 321 HB2 LYS 523 HB2 LYS 523 -11.197 -14.058 10.807 322 HB3 LYS 523 HB3 LYS 523 -10.204 -15.247 11.640 323 HG2 LYS 523 HG2 LYS 523 -11.941 -15.155 13.499 324 HG3 LYS 523 HG3 LYS 523 -12.960 -14.296 12.342 325 HD2 LYS 523 HD2 LYS 523 -12.626 -16.216 10.764 326 HD3 LYS 523 HD3 LYS 523 -11.828 -17.078 12.082 327 HE2 LYS 523 HE2 LYS 523 -13.983 -16.556 13.411 328 HE3 LYS 523 HE3 LYS 523 -14.695 -16.245 11.828 329 HZ1 LYS 523 HZ1 LYS 523 -14.988 -18.553 12.665 330 HZ2 LYS 523 HZ2 LYS 523 -13.316 -18.773 12.535 331 HZ3 LYS 523 HZ3 LYS 523 -14.237 -18.459 11.151 332 H LEU 524 H LEU 524 -11.057 -14.056 14.851 333 HA LEU 524 HA LEU 524 -8.544 -15.312 15.639 334 HB2 LEU 524 HB2 LEU 524 -8.581 -12.892 16.385 335 HB3 LEU 524 HB3 LEU 524 -9.914 -13.337 17.448 336 HG LEU 524 HG LEU 524 -7.649 -13.204 18.531 337 HD11 LEU 524 HD11 LEU 524 -9.670 -14.561 19.320 338 HD12 LEU 524 HD12 LEU 524 -8.092 -14.967 19.995 339 HD13 LEU 524 HD13 LEU 524 -8.791 -15.970 18.724 340 HD21 LEU 524 HD21 LEU 524 -7.102 -15.852 17.237 341 HD22 LEU 524 HD22 LEU 524 -5.998 -14.796 18.118 342 HD23 LEU 524 HD23 LEU 524 -6.553 -14.344 16.505 343 H PHE 525 H PHE 525 -9.572 -17.298 15.603 344 HA PHE 525 HA PHE 525 -11.959 -17.686 17.225 345 HB2 PHE 525 HB2 PHE 525 -11.016 -18.865 14.886 346 HB3 PHE 525 HB3 PHE 525 -10.782 -20.104 16.115 347 HD1 PHE 525 HD1 PHE 525 -12.491 -21.606 16.336 348 HD2 PHE 525 HD2 PHE 525 -13.405 -17.610 15.191 349 HE1 PHE 525 HE1 PHE 525 -14.875 -22.196 16.194 350 HE2 PHE 525 HE2 PHE 525 -15.791 -18.193 15.048 351 HZ PHE 525 HZ PHE 525 -16.529 -20.489 15.549 352 H ALA 526 H ALA 526 -11.615 -20.266 18.116 353 HA ALA 526 HA ALA 526 -10.120 -19.849 20.498 354 HB1 ALA 526 HB1 ALA 526 -10.746 -22.625 20.027 355 HB2 ALA 526 HB2 ALA 526 -11.368 -21.524 21.257 356 HB3 ALA 526 HB3 ALA 526 -12.128 -21.591 19.667 357 H SER 527 H SER 527 -9.530 -21.619 17.513 358 HA SER 527 HA SER 527 -6.715 -21.855 18.262 359 HB2 SER 527 HB2 SER 527 -8.503 -24.158 17.488 360 HB3 SER 527 HB3 SER 527 -6.751 -24.230 17.299 361 HG SER 527 HG SER 527 -6.649 -23.701 19.586 362 H HIS 528 H HIS 528 -8.189 -20.167 16.409 363 HA HIS 528 HA HIS 528 -6.578 -20.668 14.061 364 HB2 HIS 528 HB2 HIS 528 -9.589 -20.771 13.992 365 HB3 HIS 528 HB3 HIS 528 -8.640 -20.367 12.564 366 HD1 HIS 528 HD1 HIS 528 -9.471 -23.215 14.846 367 HD2 HIS 528 HD2 HIS 528 -7.299 -22.508 11.375 368 HE1 HIS 528 HE1 HIS 528 -8.902 -25.488 13.934 369 H SER 529 H SER 529 -6.753 -18.855 12.480 370 HA SER 529 HA SER 529 -8.004 -16.414 13.237 371 HB2 SER 529 HB2 SER 529 -5.475 -15.392 13.338 372 HB3 SER 529 HB3 SER 529 -6.450 -15.774 14.757 373 HG SER 529 HG SER 529 -4.603 -16.857 15.103 374 H THR 530 H THR 530 -8.240 -15.163 11.486 375 HA THR 530 HA THR 530 -6.689 -15.877 9.091 376 HB THR 530 HB THR 530 -8.492 -15.112 7.744 377 HG1 THR 530 HG1 THR 530 -9.797 -13.596 8.425 378 HG21 THR 530 HG21 THR 530 -8.787 -17.196 9.533 379 HG22 THR 530 HG22 THR 530 -9.804 -16.887 8.126 380 HG23 THR 530 HG23 THR 530 -10.288 -16.288 9.712 381 H ILE 531 H ILE 531 -6.383 -14.035 7.519 382 HA ILE 531 HA ILE 531 -6.403 -11.351 8.383 383 HB ILE 531 HB ILE 531 -4.633 -11.990 9.894 384 HG12 ILE 531 HG12 ILE 531 -3.155 -10.665 7.648 385 HG13 ILE 531 HG13 ILE 531 -4.534 -9.852 8.379 386 HG21 ILE 531 HG21 ILE 531 -3.926 -14.018 8.670 387 HG22 ILE 531 HG22 ILE 531 -3.118 -12.990 7.488 388 HG23 ILE 531 HG23 ILE 531 -2.570 -13.005 9.164 389 HD11 ILE 531 HD11 ILE 531 -2.698 -9.014 9.525 390 HD12 ILE 531 HD12 ILE 531 -3.339 -10.252 10.605 391 HD13 ILE 531 HD13 ILE 531 -1.916 -10.592 9.620 392 H GLU 532 H GLU 532 -5.889 -9.940 6.737 393 HA GLU 532 HA GLU 532 -4.931 -11.157 4.230 394 HB2 GLU 532 HB2 GLU 532 -7.412 -10.635 4.292 395 HB3 GLU 532 HB3 GLU 532 -6.967 -8.937 4.386 396 HG2 GLU 532 HG2 GLU 532 -6.438 -8.820 2.215 397 HG3 GLU 532 HG3 GLU 532 -5.685 -10.413 2.205 398 H LEU 533 H LEU 533 -3.138 -10.258 3.480 399 HA LEU 533 HA LEU 533 -2.451 -7.537 4.370 400 HB2 LEU 533 HB2 LEU 533 -0.899 -10.004 3.989 401 HB3 LEU 533 HB3 LEU 533 -0.129 -8.538 3.387 402 HG LEU 533 HG LEU 533 -0.165 -7.551 5.577 403 HD11 LEU 533 HD11 LEU 533 -2.086 -9.709 6.114 404 HD12 LEU 533 HD12 LEU 533 -1.969 -8.090 6.803 405 HD13 LEU 533 HD13 LEU 533 -0.934 -9.383 7.410 406 HD21 LEU 533 HD21 LEU 533 1.343 -9.019 6.735 407 HD22 LEU 533 HD22 LEU 533 1.660 -9.135 5.004 408 HD23 LEU 533 HD23 LEU 533 0.758 -10.411 5.823 409 HA PRO 534 HA PRO 534 -2.946 -6.231 0.173 410 HB2 PRO 534 HB2 PRO 534 -1.742 -3.811 0.419 411 HB3 PRO 534 HB3 PRO 534 -3.362 -4.146 1.043 412 HG2 PRO 534 HG2 PRO 534 -0.746 -4.088 2.498 413 HG3 PRO 534 HG3 PRO 534 -2.317 -3.429 2.993 414 HD2 PRO 534 HD2 PRO 534 -1.365 -5.785 3.928 415 HD3 PRO 534 HD3 PRO 534 -3.098 -5.482 3.693 416 H LYS 535 H LYS 535 -0.041 -7.009 1.685 417 HA LYS 535 HA LYS 535 1.998 -6.086 0.136 418 HB2 LYS 535 HB2 LYS 535 1.655 -8.924 1.124 419 HB3 LYS 535 HB3 LYS 535 3.174 -8.210 0.600 420 HG2 LYS 535 HG2 LYS 535 1.530 -7.182 2.901 421 HG3 LYS 535 HG3 LYS 535 2.884 -8.302 3.063 422 HD2 LYS 535 HD2 LYS 535 3.056 -5.554 1.828 423 HD3 LYS 535 HD3 LYS 535 3.512 -5.944 3.489 424 HE2 LYS 535 HE2 LYS 535 5.016 -7.745 2.341 425 HE3 LYS 535 HE3 LYS 535 4.831 -6.716 0.922 426 HZ1 LYS 535 HZ1 LYS 535 5.979 -5.955 3.549 427 HZ2 LYS 535 HZ2 LYS 535 5.631 -4.844 2.322 428 HZ3 LYS 535 HZ3 LYS 535 6.788 -6.051 2.066 429 H GLY 536 H GLY 536 3.036 -6.715 -1.776 430 HA2 GLY 536 HA2 GLY 536 1.460 -8.476 -3.546 431 HA3 GLY 536 HA3 GLY 536 2.054 -6.920 -4.107 432 H MET 537 H MET 537 3.647 -9.422 -2.150 433 HA MET 537 HA MET 537 5.233 -10.483 -4.209 434 HB2 MET 537 HB2 MET 537 6.081 -8.007 -3.858 435 HB3 MET 537 HB3 MET 537 6.925 -8.720 -2.490 436 HG2 MET 537 HG2 MET 537 8.313 -9.963 -3.811 437 HG3 MET 537 HG3 MET 537 7.161 -10.035 -5.142 438 HE1 MET 537 HE1 MET 537 9.682 -8.672 -7.135 439 HE2 MET 537 HE2 MET 537 10.699 -8.643 -5.695 440 HE3 MET 537 HE3 MET 537 9.585 -9.985 -5.961 441 HA PRO 538 HA PRO 538 5.163 -12.600 -0.049 442 HB2 PRO 538 HB2 PRO 538 4.096 -14.922 -0.965 443 HB3 PRO 538 HB3 PRO 538 3.109 -13.553 -0.440 444 HG2 PRO 538 HG2 PRO 538 3.876 -14.382 -3.213 445 HG3 PRO 538 HG3 PRO 538 2.306 -13.825 -2.605 446 HD2 PRO 538 HD2 PRO 538 4.002 -12.206 -3.960 447 HD3 PRO 538 HD3 PRO 538 2.921 -11.605 -2.686 448 H GLY 539 H GLY 539 5.840 -15.144 0.147 449 HA2 GLY 539 HA2 GLY 539 7.405 -16.797 -0.362 450 HA3 GLY 539 HA3 GLY 539 7.910 -15.854 -1.757 451 H GLU 540 H GLU 540 7.821 -13.798 0.826 452 HA GLU 540 HA GLU 540 10.697 -13.741 1.005 453 HB2 GLU 540 HB2 GLU 540 8.797 -12.111 2.676 454 HB3 GLU 540 HB3 GLU 540 10.442 -11.717 2.200 455 HG2 GLU 540 HG2 GLU 540 8.049 -11.843 0.380 456 HG3 GLU 540 HG3 GLU 540 8.838 -10.382 0.971 457 H VAL 541 H VAL 541 8.088 -14.034 3.423 458 HA VAL 541 HA VAL 541 9.942 -15.013 5.411 459 HB VAL 541 HB VAL 541 6.929 -14.852 5.560 460 HG11 VAL 541 HG11 VAL 541 7.275 -14.912 7.977 461 HG12 VAL 541 HG12 VAL 541 7.929 -16.358 7.206 462 HG13 VAL 541 HG13 VAL 541 9.014 -15.070 7.730 463 HG21 VAL 541 HG21 VAL 541 7.728 -12.806 7.068 464 HG22 VAL 541 HG22 VAL 541 9.058 -12.819 5.910 465 HG23 VAL 541 HG23 VAL 541 7.398 -12.637 5.343 466 H LEU 542 H LEU 542 7.528 -16.331 3.244 467 HA LEU 542 HA LEU 542 7.283 -18.879 4.433 468 HB2 LEU 542 HB2 LEU 542 6.947 -18.118 1.536 469 HB3 LEU 542 HB3 LEU 542 6.337 -19.582 2.304 470 HG LEU 542 HG LEU 542 5.423 -16.761 2.864 471 HD11 LEU 542 HD11 LEU 542 4.325 -17.184 0.932 472 HD12 LEU 542 HD12 LEU 542 3.243 -18.055 2.018 473 HD13 LEU 542 HD13 LEU 542 4.467 -18.933 1.102 474 HD21 LEU 542 HD21 LEU 542 4.568 -19.405 4.033 475 HD22 LEU 542 HD22 LEU 542 3.668 -17.898 4.214 476 HD23 LEU 542 HD23 LEU 542 5.293 -18.042 4.886 477 H GLN 543 H GLN 543 9.740 -17.444 2.497 478 HA GLN 543 HA GLN 543 10.887 -19.954 1.638 479 HB2 GLN 543 HB2 GLN 543 11.486 -17.073 1.232 480 HB3 GLN 543 HB3 GLN 543 12.831 -18.196 1.091 481 HG2 GLN 543 HG2 GLN 543 10.255 -18.453 -0.438 482 HG3 GLN 543 HG3 GLN 543 11.703 -17.659 -1.055 483 HE21 GLN 543 HE21 GLN 543 10.012 -20.444 -1.116 484 HE22 GLN 543 HE22 GLN 543 11.276 -21.557 -1.501 485 H HIS 544 H HIS 544 12.054 -17.265 3.675 486 HA HIS 544 HA HIS 544 14.221 -18.757 4.743 487 HB2 HIS 544 HB2 HIS 544 13.929 -16.195 4.610 488 HB3 HIS 544 HB3 HIS 544 12.992 -16.364 6.092 489 HD1 HIS 544 HD1 HIS 544 15.849 -18.665 5.812 490 HD2 HIS 544 HD2 HIS 544 15.113 -14.869 7.331 491 HE1 HIS 544 HE1 HIS 544 17.807 -18.146 7.303 492 H PHE 545 H PHE 545 11.154 -17.680 6.212 493 HA PHE 545 HA PHE 545 11.561 -19.489 8.449 494 HB2 PHE 545 HB2 PHE 545 9.595 -17.318 7.811 495 HB3 PHE 545 HB3 PHE 545 9.213 -18.497 9.062 496 HD1 PHE 545 HD1 PHE 545 9.566 -17.695 11.173 497 HD2 PHE 545 HD2 PHE 545 12.258 -16.573 8.073 498 HE1 PHE 545 HE1 PHE 545 10.888 -16.402 12.795 499 HE2 PHE 545 HE2 PHE 545 13.586 -15.278 9.691 500 HZ PHE 545 HZ PHE 545 12.901 -15.191 12.055 501 H THR 546 H THR 546 11.357 -20.905 6.116 502 HA THR 546 HA THR 546 8.667 -21.775 5.632 503 HB THR 546 HB THR 546 10.500 -21.848 3.912 504 HG1 THR 546 HG1 THR 546 8.737 -23.057 3.407 505 HG21 THR 546 HG21 THR 546 12.048 -23.720 3.934 506 HG22 THR 546 HG22 THR 546 11.384 -24.281 5.469 507 HG23 THR 546 HG23 THR 546 12.259 -22.752 5.392 508 H ARG 547 H ARG 547 11.308 -22.790 7.671 509 HA ARG 547 HA ARG 547 9.743 -25.130 8.530 510 HB2 ARG 547 HB2 ARG 547 11.793 -26.111 9.315 511 HB3 ARG 547 HB3 ARG 547 12.041 -25.565 7.661 512 HG2 ARG 547 HG2 ARG 547 13.903 -24.626 8.444 513 HG3 ARG 547 HG3 ARG 547 12.834 -23.388 9.109 514 HD2 ARG 547 HD2 ARG 547 14.023 -23.978 10.981 515 HD3 ARG 547 HD3 ARG 547 12.642 -25.067 11.110 516 HE ARG 547 HE ARG 547 14.050 -26.842 10.762 517 HH11 ARG 547 HH11 ARG 547 15.684 -23.890 9.904 518 HH12 ARG 547 HH12 ARG 547 17.228 -24.650 9.700 519 HH21 ARG 547 HH21 ARG 547 16.077 -27.855 10.497 520 HH22 ARG 547 HH22 ARG 547 17.450 -26.906 10.037 521 H THR 548 H THR 548 11.010 -22.084 9.496 522 HA THR 548 HA THR 548 10.395 -22.650 12.316 523 HB THR 548 HB THR 548 11.983 -20.359 11.142 524 HG1 THR 548 HG1 THR 548 13.548 -21.774 11.216 525 HG21 THR 548 HG21 THR 548 12.650 -20.261 13.685 526 HG22 THR 548 HG22 THR 548 11.075 -21.024 13.906 527 HG23 THR 548 HG23 THR 548 11.192 -19.457 13.106 528 H ARG 549 H ARG 549 8.421 -22.062 12.919 529 HA ARG 549 HA ARG 549 7.430 -19.423 12.165 530 HB2 ARG 549 HB2 ARG 549 5.887 -21.983 11.716 531 HB3 ARG 549 HB3 ARG 549 5.180 -20.375 11.643 532 HG2 ARG 549 HG2 ARG 549 5.613 -20.522 9.457 533 HG3 ARG 549 HG3 ARG 549 7.265 -20.112 9.925 534 HD2 ARG 549 HD2 ARG 549 7.840 -22.007 8.885 535 HD3 ARG 549 HD3 ARG 549 7.201 -22.820 10.312 536 HE ARG 549 HE ARG 549 5.402 -23.529 9.072 537 HH11 ARG 549 HH11 ARG 549 7.152 -21.093 7.306 538 HH12 ARG 549 HH12 ARG 549 6.277 -21.347 5.832 539 HH21 ARG 549 HH21 ARG 549 4.242 -23.872 7.138 540 HH22 ARG 549 HH22 ARG 549 4.621 -22.927 5.738 541 H ILE 550 H ILE 550 5.169 -19.137 13.337 542 HA ILE 550 HA ILE 550 4.807 -20.532 15.793 543 HB ILE 550 HB ILE 550 6.860 -18.945 16.132 544 HG12 ILE 550 HG12 ILE 550 4.987 -18.423 18.321 545 HG13 ILE 550 HG13 ILE 550 5.001 -20.107 17.807 546 HG21 ILE 550 HG21 ILE 550 4.861 -16.923 16.951 547 HG22 ILE 550 HG22 ILE 550 6.516 -16.717 16.382 548 HG23 ILE 550 HG23 ILE 550 5.223 -17.043 15.229 549 HD11 ILE 550 HD11 ILE 550 7.660 -19.546 17.951 550 HD12 ILE 550 HD12 ILE 550 7.003 -18.570 19.265 551 HD13 ILE 550 HD13 ILE 550 6.707 -20.308 19.224 552 H LEU 551 H LEU 551 3.371 -18.947 17.306 553 HA LEU 551 HA LEU 551 0.889 -18.771 16.318 554 HB2 LEU 551 HB2 LEU 551 0.352 -17.138 17.979 555 HB3 LEU 551 HB3 LEU 551 1.553 -18.243 18.643 556 HG LEU 551 HG LEU 551 3.197 -16.315 17.810 557 HD11 LEU 551 HD11 LEU 551 1.301 -14.413 18.843 558 HD12 LEU 551 HD12 LEU 551 0.697 -15.159 17.364 559 HD13 LEU 551 HD13 LEU 551 2.265 -14.352 17.367 560 HD21 LEU 551 HD21 LEU 551 3.395 -15.669 20.045 561 HD22 LEU 551 HD22 LEU 551 2.752 -17.309 20.131 562 HD23 LEU 551 HD23 LEU 551 1.681 -15.928 20.369 563 H ASN 552 H ASN 552 3.385 -16.303 15.893 564 HA ASN 552 HA ASN 552 1.650 -14.557 14.403 565 HB2 ASN 552 HB2 ASN 552 3.413 -13.547 15.696 566 HB3 ASN 552 HB3 ASN 552 4.633 -14.526 14.888 567 HD21 ASN 552 HD21 ASN 552 1.888 -12.729 13.571 568 HD22 ASN 552 HD22 ASN 552 2.828 -11.701 12.549 569 H LYS 553 H LYS 553 4.665 -16.254 13.523 570 HA LYS 553 HA LYS 553 4.376 -15.908 10.754 571 HB2 LYS 553 HB2 LYS 553 5.785 -18.291 11.903 572 HB3 LYS 553 HB3 LYS 553 6.227 -17.304 10.516 573 HG2 LYS 553 HG2 LYS 553 6.473 -16.579 13.424 574 HG3 LYS 553 HG3 LYS 553 7.778 -16.867 12.271 575 HD2 LYS 553 HD2 LYS 553 5.770 -14.616 12.151 576 HD3 LYS 553 HD3 LYS 553 7.453 -14.477 12.663 577 HE2 LYS 553 HE2 LYS 553 8.152 -15.259 10.420 578 HE3 LYS 553 HE3 LYS 553 6.459 -15.267 9.927 579 HZ1 LYS 553 HZ1 LYS 553 6.976 -13.201 9.242 580 HZ2 LYS 553 HZ2 LYS 553 8.264 -13.025 10.324 581 HZ3 LYS 553 HZ3 LYS 553 6.675 -12.793 10.856 582 HA PRO 554 HA PRO 554 1.516 -18.954 9.414 583 HB2 PRO 554 HB2 PRO 554 2.695 -19.950 7.180 584 HB3 PRO 554 HB3 PRO 554 1.992 -18.330 7.254 585 HG2 PRO 554 HG2 PRO 554 4.856 -19.166 7.505 586 HG3 PRO 554 HG3 PRO 554 4.163 -17.801 6.609 587 HD2 PRO 554 HD2 PRO 554 5.333 -17.509 9.034 588 HD3 PRO 554 HD3 PRO 554 3.980 -16.492 8.498 589 H MET 555 H MET 555 2.078 -20.250 11.394 590 HA MET 555 HA MET 555 3.935 -22.371 11.293 591 HB2 MET 555 HB2 MET 555 3.152 -21.652 13.427 592 HB3 MET 555 HB3 MET 555 1.473 -21.912 12.973 593 HG2 MET 555 HG2 MET 555 2.186 -23.655 14.460 594 HG3 MET 555 HG3 MET 555 1.898 -24.328 12.857 595 HE1 MET 555 HE1 MET 555 4.340 -26.267 11.999 596 HE2 MET 555 HE2 MET 555 4.277 -26.734 13.699 597 HE3 MET 555 HE3 MET 555 2.808 -26.212 12.872 598 H ASN 556 H ASN 556 0.374 -22.621 11.235 599 HA ASN 556 HA ASN 556 0.604 -24.710 9.195 600 HB2 ASN 556 HB2 ASN 556 0.404 -25.594 11.646 601 HB3 ASN 556 HB3 ASN 556 -1.284 -25.116 11.491 602 HD21 ASN 556 HD21 ASN 556 0.999 -27.506 10.886 603 HD22 ASN 556 HD22 ASN 556 0.034 -28.530 9.885 604 H MET 557 H MET 557 -0.132 -22.763 7.976 605 HA MET 557 HA MET 557 -3.041 -22.374 8.235 606 HB2 MET 557 HB2 MET 557 -2.448 -20.300 6.735 607 HB3 MET 557 HB3 MET 557 -2.213 -20.239 8.476 608 HG2 MET 557 HG2 MET 557 -0.298 -19.290 7.438 609 HG3 MET 557 HG3 MET 557 0.166 -20.848 8.117 610 HE1 MET 557 HE1 MET 557 -1.430 -20.012 4.228 611 HE2 MET 557 HE2 MET 557 -0.770 -18.753 5.271 612 HE3 MET 557 HE3 MET 557 0.175 -19.355 3.908 613 H GLN 558 H GLN 558 -4.007 -21.668 6.014 614 HA GLN 558 HA GLN 558 -2.819 -23.093 3.770 615 HB2 GLN 558 HB2 GLN 558 -5.675 -23.675 4.523 616 HB3 GLN 558 HB3 GLN 558 -4.662 -24.514 3.356 617 HG2 GLN 558 HG2 GLN 558 -3.210 -25.180 5.334 618 HG3 GLN 558 HG3 GLN 558 -4.540 -24.625 6.349 619 HE21 GLN 558 HE21 GLN 558 -6.013 -26.070 6.871 620 HE22 GLN 558 HE22 GLN 558 -6.320 -27.555 6.043 621 H LEU 559 H LEU 559 -3.127 -22.034 1.912 622 HA LEU 559 HA LEU 559 -4.434 -19.526 1.875 623 HB2 LEU 559 HB2 LEU 559 -2.491 -20.169 0.460 624 HB3 LEU 559 HB3 LEU 559 -3.570 -21.198 -0.480 625 HG LEU 559 HG LEU 559 -2.972 -18.923 -1.455 626 HD11 LEU 559 HD11 LEU 559 -5.928 -19.188 -1.183 627 HD12 LEU 559 HD12 LEU 559 -5.011 -20.490 -1.939 628 HD13 LEU 559 HD13 LEU 559 -4.950 -18.862 -2.614 629 HD21 LEU 559 HD21 LEU 559 -3.676 -17.000 -0.512 630 HD22 LEU 559 HD22 LEU 559 -3.623 -17.952 0.972 631 HD23 LEU 559 HD23 LEU 559 -5.153 -17.725 0.124 632 H LEU 560 H LEU 560 -6.550 -19.201 1.837 633 HA LEU 560 HA LEU 560 -8.259 -21.162 0.459 634 HB2 LEU 560 HB2 LEU 560 -9.984 -20.673 1.939 635 HB3 LEU 560 HB3 LEU 560 -8.543 -20.696 2.954 636 HG LEU 560 HG LEU 560 -8.650 -18.074 2.423 637 HD11 LEU 560 HD11 LEU 560 -10.935 -18.833 1.201 638 HD12 LEU 560 HD12 LEU 560 -10.670 -17.238 1.902 639 HD13 LEU 560 HD13 LEU 560 -11.535 -18.470 2.819 640 HD21 LEU 560 HD21 LEU 560 -8.929 -19.632 4.607 641 HD22 LEU 560 HD22 LEU 560 -10.529 -18.895 4.536 642 HD23 LEU 560 HD23 LEU 560 -9.091 -17.876 4.623 643 H GLY 561 H GLY 561 -7.363 -17.801 0.675 644 HA2 GLY 561 HA2 GLY 561 -9.508 -16.870 -1.013 645 HA3 GLY 561 HA3 GLY 561 -8.128 -15.931 -0.461 646 H ASP 562 H ASP 562 -7.967 -15.044 -2.583 647 HA ASP 562 HA ASP 562 -6.110 -16.410 -4.231 648 HB2 ASP 562 HB2 ASP 562 -8.109 -17.640 -4.944 649 HB3 ASP 562 HB3 ASP 562 -8.911 -16.122 -5.337 650 H ALA 563 H ALA 563 -4.860 -14.867 -5.036 651 HA ALA 563 HA ALA 563 -5.282 -12.156 -4.766 652 HB1 ALA 563 HB1 ALA 563 -3.669 -12.827 -7.107 653 HB2 ALA 563 HB2 ALA 563 -3.231 -11.957 -5.636 654 HB3 ALA 563 HB3 ALA 563 -3.222 -13.721 -5.653 655 H GLN 564 H GLN 564 -6.697 -10.826 -5.670 656 HA GLN 564 HA GLN 564 -8.498 -11.465 -7.661 657 HB2 GLN 564 HB2 GLN 564 -8.261 -9.383 -6.012 658 HB3 GLN 564 HB3 GLN 564 -7.620 -8.628 -7.466 659 HG2 GLN 564 HG2 GLN 564 -10.254 -10.060 -7.447 660 HG3 GLN 564 HG3 GLN 564 -10.103 -8.362 -6.998 661 HE21 GLN 564 HE21 GLN 564 -11.225 -10.032 -9.359 662 HE22 GLN 564 HE22 GLN 564 -10.690 -9.144 -10.741 Start of MODEL 16 1 H MET 480 H MET 480 1.556 -0.191 0.941 2 HA MET 480 HA MET 480 1.553 0.334 -1.929 3 HB2 MET 480 HB2 MET 480 2.879 1.861 -0.654 4 HB3 MET 480 HB3 MET 480 3.689 0.549 0.191 5 HG2 MET 480 HG2 MET 480 5.135 1.563 -1.479 6 HG3 MET 480 HG3 MET 480 4.793 -0.123 -1.860 7 HE1 MET 480 HE1 MET 480 5.482 2.858 -4.151 8 HE2 MET 480 HE2 MET 480 6.140 1.274 -3.740 9 HE3 MET 480 HE3 MET 480 5.285 1.506 -5.266 10 H ALA 481 H ALA 481 1.185 -1.664 -2.852 11 HA ALA 481 HA ALA 481 3.155 -3.773 -2.271 12 HB1 ALA 481 HB1 ALA 481 0.299 -3.811 -2.830 13 HB2 ALA 481 HB2 ALA 481 1.212 -4.944 -3.827 14 HB3 ALA 481 HB3 ALA 481 1.323 -5.030 -2.069 15 H ASP 482 H ASP 482 3.237 -5.289 -4.400 16 HA ASP 482 HA ASP 482 4.280 -3.518 -6.490 17 HB2 ASP 482 HB2 ASP 482 5.485 -5.612 -5.285 18 HB3 ASP 482 HB3 ASP 482 4.749 -6.438 -6.656 19 H VAL 483 H VAL 483 1.965 -6.082 -5.921 20 HA VAL 483 HA VAL 483 0.867 -5.604 -8.607 21 HB VAL 483 HB VAL 483 2.019 -7.715 -8.763 22 HG11 VAL 483 HG11 VAL 483 1.657 -9.559 -7.294 23 HG12 VAL 483 HG12 VAL 483 2.026 -8.151 -6.296 24 HG13 VAL 483 HG13 VAL 483 0.360 -8.709 -6.454 25 HG21 VAL 483 HG21 VAL 483 -0.141 -7.524 -9.898 26 HG22 VAL 483 HG22 VAL 483 0.168 -9.181 -9.378 27 HG23 VAL 483 HG23 VAL 483 -0.950 -8.165 -8.468 28 H GLY 484 H GLY 484 0.303 -6.776 -5.317 29 HA2 GLY 484 HA2 GLY 484 -1.660 -5.722 -4.209 30 HA3 GLY 484 HA3 GLY 484 -2.555 -6.107 -5.672 31 H ASP 485 H ASP 485 -0.223 -8.322 -4.335 32 HA ASP 485 HA ASP 485 -1.879 -10.528 -4.336 33 HB2 ASP 485 HB2 ASP 485 0.729 -10.205 -3.868 34 HB3 ASP 485 HB3 ASP 485 0.191 -10.383 -2.201 35 H MET 486 H MET 486 -3.845 -10.476 -3.406 36 HA MET 486 HA MET 486 -3.942 -9.945 -0.511 37 HB2 MET 486 HB2 MET 486 -5.071 -8.271 -2.259 38 HB3 MET 486 HB3 MET 486 -6.375 -9.447 -2.150 39 HG2 MET 486 HG2 MET 486 -6.982 -8.760 -0.120 40 HG3 MET 486 HG3 MET 486 -5.317 -8.651 0.444 41 HE1 MET 486 HE1 MET 486 -8.295 -6.309 -1.285 42 HE2 MET 486 HE2 MET 486 -7.115 -5.488 -2.307 43 HE3 MET 486 HE3 MET 486 -7.299 -7.240 -2.404 44 H GLN 487 H GLN 487 -4.510 -11.689 0.596 45 HA GLN 487 HA GLN 487 -6.622 -13.424 -0.369 46 HB2 GLN 487 HB2 GLN 487 -3.904 -14.569 0.285 47 HB3 GLN 487 HB3 GLN 487 -5.330 -15.467 -0.218 48 HG2 GLN 487 HG2 GLN 487 -5.257 -14.378 -2.397 49 HG3 GLN 487 HG3 GLN 487 -3.836 -13.463 -1.894 50 HE21 GLN 487 HE21 GLN 487 -4.280 -15.451 -4.058 51 HE22 GLN 487 HE22 GLN 487 -3.054 -16.646 -3.828 52 H LEU 488 H LEU 488 -6.934 -15.279 1.312 53 HA LEU 488 HA LEU 488 -6.626 -14.103 3.997 54 HB2 LEU 488 HB2 LEU 488 -8.954 -14.203 3.048 55 HB3 LEU 488 HB3 LEU 488 -8.820 -15.959 3.101 56 HG LEU 488 HG LEU 488 -8.437 -15.722 5.593 57 HD11 LEU 488 HD11 LEU 488 -9.834 -13.313 5.987 58 HD12 LEU 488 HD12 LEU 488 -8.517 -12.956 4.870 59 HD13 LEU 488 HD13 LEU 488 -8.170 -13.690 6.435 60 HD21 LEU 488 HD21 LEU 488 -10.822 -15.479 6.070 61 HD22 LEU 488 HD22 LEU 488 -10.552 -16.484 4.646 62 HD23 LEU 488 HD23 LEU 488 -11.080 -14.811 4.458 63 H TYR 489 H TYR 489 -5.080 -15.167 5.048 64 HA TYR 489 HA TYR 489 -4.891 -18.083 4.707 65 HB2 TYR 489 HB2 TYR 489 -2.719 -16.601 6.083 66 HB3 TYR 489 HB3 TYR 489 -2.624 -17.951 4.957 67 HD1 TYR 489 HD1 TYR 489 -2.895 -14.297 5.254 68 HD2 TYR 489 HD2 TYR 489 -2.449 -17.581 2.585 69 HE1 TYR 489 HE1 TYR 489 -2.273 -12.742 3.452 70 HE2 TYR 489 HE2 TYR 489 -1.825 -16.035 0.777 71 HH TYR 489 HH TYR 489 -2.024 -13.742 0.165 72 H ARG 490 H ARG 490 -5.752 -19.243 6.284 73 HA ARG 490 HA ARG 490 -6.007 -18.063 8.956 74 HB2 ARG 490 HB2 ARG 490 -7.690 -19.756 9.383 75 HB3 ARG 490 HB3 ARG 490 -8.057 -18.924 7.878 76 HG2 ARG 490 HG2 ARG 490 -8.352 -20.993 7.079 77 HG3 ARG 490 HG3 ARG 490 -6.591 -21.007 6.962 78 HD2 ARG 490 HD2 ARG 490 -6.847 -22.921 8.149 79 HD3 ARG 490 HD3 ARG 490 -6.845 -21.788 9.501 80 HE ARG 490 HE ARG 490 -9.066 -22.248 9.856 81 HH11 ARG 490 HH11 ARG 490 -8.092 -23.520 6.765 82 HH12 ARG 490 HH12 ARG 490 -9.563 -24.402 6.518 83 HH21 ARG 490 HH21 ARG 490 -11.006 -23.406 9.543 84 HH22 ARG 490 HH22 ARG 490 -11.220 -24.336 8.099 85 H ILE 491 H ILE 491 -4.882 -18.802 10.648 86 HA ILE 491 HA ILE 491 -3.095 -21.084 10.207 87 HB ILE 491 HB ILE 491 -1.793 -20.270 12.081 88 HG12 ILE 491 HG12 ILE 491 -3.850 -18.061 12.302 89 HG13 ILE 491 HG13 ILE 491 -3.689 -19.408 13.423 90 HG21 ILE 491 HG21 ILE 491 -1.190 -19.326 9.986 91 HG22 ILE 491 HG22 ILE 491 -2.520 -18.172 10.050 92 HG23 ILE 491 HG23 ILE 491 -1.163 -18.016 11.165 93 HD11 ILE 491 HD11 ILE 491 -1.772 -17.149 12.956 94 HD12 ILE 491 HD12 ILE 491 -2.635 -17.568 14.436 95 HD13 ILE 491 HD13 ILE 491 -1.337 -18.607 13.847 96 H GLU 492 H GLU 492 -2.602 -22.369 12.260 97 HA GLU 492 HA GLU 492 -5.163 -23.197 13.411 98 HB2 GLU 492 HB2 GLU 492 -3.647 -24.855 12.260 99 HB3 GLU 492 HB3 GLU 492 -2.510 -24.628 13.582 100 HG2 GLU 492 HG2 GLU 492 -3.897 -25.658 15.124 101 HG3 GLU 492 HG3 GLU 492 -5.337 -25.419 14.137 102 H VAL 493 H VAL 493 -4.376 -20.867 14.497 103 HA VAL 493 HA VAL 493 -3.697 -21.661 17.230 104 HB VAL 493 HB VAL 493 -2.424 -19.235 15.972 105 HG11 VAL 493 HG11 VAL 493 -1.498 -20.684 18.422 106 HG12 VAL 493 HG12 VAL 493 -1.225 -19.007 17.945 107 HG13 VAL 493 HG13 VAL 493 -2.815 -19.515 18.515 108 HG21 VAL 493 HG21 VAL 493 -0.340 -20.514 15.875 109 HG22 VAL 493 HG22 VAL 493 -1.200 -21.961 16.401 110 HG23 VAL 493 HG23 VAL 493 -1.580 -21.227 14.843 111 H GLY 494 H GLY 494 -4.842 -20.603 18.765 112 HA2 GLY 494 HA2 GLY 494 -6.220 -18.117 18.062 113 HA3 GLY 494 HA3 GLY 494 -7.212 -19.490 18.531 114 H ARG 495 H ARG 495 -7.863 -17.811 20.176 115 HA ARG 495 HA ARG 495 -6.197 -16.899 22.199 116 HB2 ARG 495 HB2 ARG 495 -8.302 -16.819 23.591 117 HB3 ARG 495 HB3 ARG 495 -8.390 -15.997 22.039 118 HG2 ARG 495 HG2 ARG 495 -9.616 -17.842 21.084 119 HG3 ARG 495 HG3 ARG 495 -9.444 -18.765 22.578 120 HD2 ARG 495 HD2 ARG 495 -10.683 -16.941 23.753 121 HD3 ARG 495 HD3 ARG 495 -10.977 -16.201 22.180 122 HE ARG 495 HE ARG 495 -11.821 -18.943 22.341 123 HH11 ARG 495 HH11 ARG 495 -12.719 -15.632 22.936 124 HH12 ARG 495 HH12 ARG 495 -14.421 -15.940 22.842 125 HH21 ARG 495 HH21 ARG 495 -14.060 -19.361 22.215 126 HH22 ARG 495 HH22 ARG 495 -15.183 -18.062 22.433 127 H ASP 496 H ASP 496 -7.803 -20.002 21.823 128 HA ASP 496 HA ASP 496 -7.222 -20.958 24.442 129 HB2 ASP 496 HB2 ASP 496 -8.970 -21.807 22.699 130 HB3 ASP 496 HB3 ASP 496 -7.631 -22.777 22.092 131 H ASP 497 H ASP 497 -5.370 -20.600 21.596 132 HA ASP 497 HA ASP 497 -3.404 -22.601 22.406 133 HB2 ASP 497 HB2 ASP 497 -4.164 -22.229 19.983 134 HB3 ASP 497 HB3 ASP 497 -3.189 -20.763 20.028 135 H GLY 498 H GLY 498 -3.736 -19.105 22.014 136 HA2 GLY 498 HA2 GLY 498 -2.485 -17.938 23.912 137 HA3 GLY 498 HA3 GLY 498 -1.082 -18.768 23.255 138 H VAL 499 H VAL 499 -3.677 -17.361 21.342 139 HA VAL 499 HA VAL 499 -1.889 -15.174 20.538 140 HB VAL 499 HB VAL 499 -1.892 -17.174 18.906 141 HG11 VAL 499 HG11 VAL 499 -3.729 -17.686 17.700 142 HG12 VAL 499 HG12 VAL 499 -4.575 -16.994 19.086 143 HG13 VAL 499 HG13 VAL 499 -4.291 -16.015 17.646 144 HG21 VAL 499 HG21 VAL 499 -2.156 -15.478 16.936 145 HG22 VAL 499 HG22 VAL 499 -2.300 -14.293 18.234 146 HG23 VAL 499 HG23 VAL 499 -0.847 -15.284 18.102 147 H GLU 500 H GLU 500 -2.917 -13.295 19.822 148 HA GLU 500 HA GLU 500 -5.840 -13.234 20.185 149 HB2 GLU 500 HB2 GLU 500 -4.067 -10.905 20.872 150 HB3 GLU 500 HB3 GLU 500 -5.730 -11.200 21.361 151 HG2 GLU 500 HG2 GLU 500 -4.597 -13.317 22.505 152 HG3 GLU 500 HG3 GLU 500 -3.204 -12.236 22.494 153 H VAL 501 H VAL 501 -6.473 -10.765 19.410 154 HA VAL 501 HA VAL 501 -6.087 -10.868 16.569 155 HB VAL 501 HB VAL 501 -7.503 -8.814 18.275 156 HG11 VAL 501 HG11 VAL 501 -6.793 -8.803 15.485 157 HG12 VAL 501 HG12 VAL 501 -8.547 -8.807 15.683 158 HG13 VAL 501 HG13 VAL 501 -7.574 -7.550 16.449 159 HG21 VAL 501 HG21 VAL 501 -8.312 -11.277 18.145 160 HG22 VAL 501 HG22 VAL 501 -9.477 -9.973 17.916 161 HG23 VAL 501 HG23 VAL 501 -8.835 -10.837 16.519 162 H ARG 502 H ARG 502 -4.882 -8.903 19.216 163 HA ARG 502 HA ARG 502 -3.540 -7.065 17.412 164 HB2 ARG 502 HB2 ARG 502 -2.726 -6.010 19.523 165 HB3 ARG 502 HB3 ARG 502 -4.478 -6.102 19.403 166 HG2 ARG 502 HG2 ARG 502 -4.631 -7.757 21.023 167 HG3 ARG 502 HG3 ARG 502 -2.936 -8.218 20.847 168 HD2 ARG 502 HD2 ARG 502 -3.052 -7.043 22.881 169 HD3 ARG 502 HD3 ARG 502 -2.372 -5.902 21.722 170 HE ARG 502 HE ARG 502 -4.184 -4.568 22.071 171 HH11 ARG 502 HH11 ARG 502 -5.007 -7.816 23.014 172 HH12 ARG 502 HH12 ARG 502 -6.569 -7.383 23.624 173 HH21 ARG 502 HH21 ARG 502 -6.240 -3.985 22.870 174 HH22 ARG 502 HH22 ARG 502 -7.270 -5.204 23.541 175 H HIS 503 H HIS 503 -2.928 -10.109 18.446 176 HA HIS 503 HA HIS 503 -0.103 -9.826 18.999 177 HB2 HIS 503 HB2 HIS 503 -1.868 -11.651 19.829 178 HB3 HIS 503 HB3 HIS 503 -1.294 -12.485 18.388 179 HD1 HIS 503 HD1 HIS 503 1.681 -11.107 18.974 180 HD2 HIS 503 HD2 HIS 503 -0.554 -13.686 21.343 181 HE1 HIS 503 HE1 HIS 503 3.338 -12.218 20.505 182 H ILE 504 H ILE 504 -2.001 -11.520 16.495 183 HA ILE 504 HA ILE 504 0.258 -11.953 14.818 184 HB ILE 504 HB ILE 504 -1.214 -12.899 13.253 185 HG12 ILE 504 HG12 ILE 504 -2.730 -10.888 13.173 186 HG13 ILE 504 HG13 ILE 504 -3.557 -12.439 13.075 187 HG21 ILE 504 HG21 ILE 504 -2.457 -13.277 15.974 188 HG22 ILE 504 HG22 ILE 504 -2.689 -14.339 14.586 189 HG23 ILE 504 HG23 ILE 504 -1.091 -14.177 15.315 190 HD11 ILE 504 HD11 ILE 504 -4.779 -10.961 14.515 191 HD12 ILE 504 HD12 ILE 504 -4.082 -12.263 15.479 192 HD13 ILE 504 HD13 ILE 504 -3.342 -10.662 15.492 193 H VAL 505 H VAL 505 -1.996 -9.356 15.213 194 HA VAL 505 HA VAL 505 -1.478 -8.140 12.656 195 HB VAL 505 HB VAL 505 -2.878 -7.122 15.127 196 HG11 VAL 505 HG11 VAL 505 -1.893 -5.677 12.804 197 HG12 VAL 505 HG12 VAL 505 -3.633 -5.493 13.035 198 HG13 VAL 505 HG13 VAL 505 -2.520 -5.066 14.335 199 HG21 VAL 505 HG21 VAL 505 -3.790 -8.952 13.439 200 HG22 VAL 505 HG22 VAL 505 -4.844 -7.723 14.139 201 HG23 VAL 505 HG23 VAL 505 -4.215 -7.518 12.505 202 H GLY 506 H GLY 506 -0.763 -7.169 16.021 203 HA2 GLY 506 HA2 GLY 506 0.919 -5.025 15.374 204 HA3 GLY 506 HA3 GLY 506 0.936 -5.902 16.897 205 H ALA 507 H ALA 507 1.504 -8.415 15.249 206 HA ALA 507 HA ALA 507 4.356 -8.269 15.499 207 HB1 ALA 507 HB1 ALA 507 3.493 -10.342 16.095 208 HB2 ALA 507 HB2 ALA 507 2.431 -10.416 14.689 209 HB3 ALA 507 HB3 ALA 507 4.170 -10.636 14.493 210 H ILE 508 H ILE 508 2.244 -9.070 12.732 211 HA ILE 508 HA ILE 508 4.316 -8.846 10.814 212 HB ILE 508 HB ILE 508 2.557 -8.934 9.129 213 HG12 ILE 508 HG12 ILE 508 0.161 -9.270 10.296 214 HG13 ILE 508 HG13 ILE 508 0.873 -8.142 11.445 215 HG21 ILE 508 HG21 ILE 508 3.113 -10.870 11.045 216 HG22 ILE 508 HG22 ILE 508 1.357 -10.883 10.889 217 HG23 ILE 508 HG23 ILE 508 2.370 -11.125 9.466 218 HD11 ILE 508 HD11 ILE 508 -0.411 -7.521 9.073 219 HD12 ILE 508 HD12 ILE 508 0.551 -6.433 10.075 220 HD13 ILE 508 HD13 ILE 508 1.301 -7.284 8.725 221 H ALA 509 H ALA 509 2.095 -6.560 12.220 222 HA ALA 509 HA ALA 509 2.453 -4.520 10.249 223 HB1 ALA 509 HB1 ALA 509 1.204 -3.108 11.704 224 HB2 ALA 509 HB2 ALA 509 0.478 -4.714 11.778 225 HB3 ALA 509 HB3 ALA 509 1.518 -4.155 13.088 226 H ASN 510 H ASN 510 4.206 -5.561 13.040 227 HA ASN 510 HA ASN 510 5.757 -3.087 13.145 228 HB2 ASN 510 HB2 ASN 510 5.601 -5.513 14.924 229 HB3 ASN 510 HB3 ASN 510 6.889 -4.324 15.095 230 HD21 ASN 510 HD21 ASN 510 5.988 -4.066 17.244 231 HD22 ASN 510 HD22 ASN 510 4.649 -2.999 17.472 232 H GLU 511 H GLU 511 5.948 -6.350 12.015 233 HA GLU 511 HA GLU 511 8.760 -6.599 11.868 234 HB2 GLU 511 HB2 GLU 511 6.445 -7.984 10.578 235 HB3 GLU 511 HB3 GLU 511 8.063 -8.268 9.953 236 HG2 GLU 511 HG2 GLU 511 8.769 -8.932 12.237 237 HG3 GLU 511 HG3 GLU 511 7.091 -8.781 12.753 238 H GLY 512 H GLY 512 6.339 -5.629 9.444 239 HA2 GLY 512 HA2 GLY 512 8.555 -4.517 7.836 240 HA3 GLY 512 HA3 GLY 512 7.071 -5.156 7.144 241 H ASP 513 H ASP 513 6.328 -3.366 6.117 242 HA ASP 513 HA ASP 513 6.112 -0.863 7.611 243 HB2 ASP 513 HB2 ASP 513 6.933 -1.148 5.130 244 HB3 ASP 513 HB3 ASP 513 5.208 -1.170 4.773 245 H ILE 514 H ILE 514 4.247 -3.568 6.812 246 HA ILE 514 HA ILE 514 1.703 -2.609 6.373 247 HB ILE 514 HB ILE 514 2.469 -4.987 8.071 248 HG12 ILE 514 HG12 ILE 514 1.528 -5.148 5.235 249 HG13 ILE 514 HG13 ILE 514 3.206 -4.720 5.554 250 HG21 ILE 514 HG21 ILE 514 0.162 -5.776 7.241 251 HG22 ILE 514 HG22 ILE 514 0.227 -4.616 8.567 252 HG23 ILE 514 HG23 ILE 514 -0.144 -4.067 6.933 253 HD11 ILE 514 HD11 ILE 514 1.875 -7.191 6.629 254 HD12 ILE 514 HD12 ILE 514 2.808 -7.136 5.132 255 HD13 ILE 514 HD13 ILE 514 3.591 -6.786 6.673 256 H SER 515 H SER 515 -0.002 -1.941 7.642 257 HA SER 515 HA SER 515 0.689 -1.206 10.412 258 HB2 SER 515 HB2 SER 515 0.182 0.585 8.510 259 HB3 SER 515 HB3 SER 515 -1.486 0.225 8.953 260 HG SER 515 HG SER 515 0.565 1.046 10.738 261 H SER 516 H SER 516 -1.300 -0.914 11.819 262 HA SER 516 HA SER 516 -2.720 -3.365 11.901 263 HB2 SER 516 HB2 SER 516 -2.092 -1.783 13.849 264 HB3 SER 516 HB3 SER 516 -3.554 -0.899 13.415 265 HG SER 516 HG SER 516 -4.674 -2.387 14.368 266 H ARG 517 H ARG 517 -3.355 -0.305 10.437 267 HA ARG 517 HA ARG 517 -6.189 -0.905 10.072 268 HB2 ARG 517 HB2 ARG 517 -6.246 1.351 8.986 269 HB3 ARG 517 HB3 ARG 517 -5.727 1.368 10.667 270 HG2 ARG 517 HG2 ARG 517 -3.507 1.807 10.103 271 HG3 ARG 517 HG3 ARG 517 -3.740 1.305 8.427 272 HD2 ARG 517 HD2 ARG 517 -3.561 3.792 8.823 273 HD3 ARG 517 HD3 ARG 517 -4.973 3.254 7.914 274 HE ARG 517 HE ARG 517 -5.441 3.502 10.739 275 HH11 ARG 517 HH11 ARG 517 -5.388 5.176 7.687 276 HH12 ARG 517 HH12 ARG 517 -6.489 6.412 8.198 277 HH21 ARG 517 HH21 ARG 517 -6.892 5.124 11.423 278 HH22 ARG 517 HH22 ARG 517 -7.343 6.382 10.323 279 H TYR 518 H TYR 518 -3.183 -0.809 8.304 280 HA TYR 518 HA TYR 518 -4.215 -0.835 5.688 281 HB2 TYR 518 HB2 TYR 518 -1.688 -0.844 6.844 282 HB3 TYR 518 HB3 TYR 518 -1.763 -2.378 5.984 283 HD1 TYR 518 HD1 TYR 518 -3.296 -1.781 3.606 284 HD2 TYR 518 HD2 TYR 518 -0.389 0.607 5.594 285 HE1 TYR 518 HE1 TYR 518 -2.810 -0.623 1.492 286 HE2 TYR 518 HE2 TYR 518 0.104 1.773 3.485 287 HH TYR 518 HH TYR 518 -0.215 0.977 0.826 288 H ILE 519 H ILE 519 -3.522 -3.422 7.980 289 HA ILE 519 HA ILE 519 -3.788 -5.629 6.319 290 HB ILE 519 HB ILE 519 -4.652 -5.385 9.203 291 HG12 ILE 519 HG12 ILE 519 -2.136 -6.745 8.417 292 HG13 ILE 519 HG13 ILE 519 -2.156 -4.991 8.263 293 HG21 ILE 519 HG21 ILE 519 -4.377 -7.825 9.274 294 HG22 ILE 519 HG22 ILE 519 -5.647 -7.332 8.156 295 HG23 ILE 519 HG23 ILE 519 -4.072 -7.830 7.537 296 HD11 ILE 519 HD11 ILE 519 -2.559 -6.637 10.739 297 HD12 ILE 519 HD12 ILE 519 -1.285 -5.466 10.395 298 HD13 ILE 519 HD13 ILE 519 -2.941 -4.918 10.657 299 H GLY 520 H GLY 520 -5.491 -6.891 5.636 300 HA2 GLY 520 HA2 GLY 520 -7.980 -5.552 5.229 301 HA3 GLY 520 HA3 GLY 520 -7.600 -7.203 4.763 302 H ASN 521 H ASN 521 -8.890 -8.646 5.668 303 HA ASN 521 HA ASN 521 -10.250 -7.990 8.165 304 HB2 ASN 521 HB2 ASN 521 -10.658 -10.320 6.276 305 HB3 ASN 521 HB3 ASN 521 -11.671 -9.931 7.664 306 HD21 ASN 521 HD21 ASN 521 -10.525 -8.699 4.569 307 HD22 ASN 521 HD22 ASN 521 -11.914 -7.726 4.237 308 H ILE 522 H ILE 522 -9.720 -8.847 10.069 309 HA ILE 522 HA ILE 522 -7.910 -11.175 10.091 310 HB ILE 522 HB ILE 522 -7.961 -8.989 12.170 311 HG12 ILE 522 HG12 ILE 522 -5.519 -8.894 10.827 312 HG13 ILE 522 HG13 ILE 522 -6.713 -9.067 9.545 313 HG21 ILE 522 HG21 ILE 522 -5.624 -10.751 11.782 314 HG22 ILE 522 HG22 ILE 522 -6.335 -10.115 13.265 315 HG23 ILE 522 HG23 ILE 522 -7.070 -11.501 12.458 316 HD11 ILE 522 HD11 ILE 522 -6.106 -6.788 11.244 317 HD12 ILE 522 HD12 ILE 522 -6.904 -6.856 9.673 318 HD13 ILE 522 HD13 ILE 522 -7.829 -7.148 11.145 319 H LYS 523 H LYS 523 -8.614 -12.905 11.155 320 HA LYS 523 HA LYS 523 -10.901 -12.578 12.984 321 HB2 LYS 523 HB2 LYS 523 -11.152 -13.938 10.808 322 HB3 LYS 523 HB3 LYS 523 -10.162 -15.151 11.608 323 HG2 LYS 523 HG2 LYS 523 -11.926 -14.911 13.518 324 HG3 LYS 523 HG3 LYS 523 -12.936 -14.259 12.226 325 HD2 LYS 523 HD2 LYS 523 -11.498 -16.898 12.026 326 HD3 LYS 523 HD3 LYS 523 -13.147 -16.740 12.635 327 HE2 LYS 523 HE2 LYS 523 -13.999 -16.201 10.580 328 HE3 LYS 523 HE3 LYS 523 -12.486 -15.493 10.017 329 HZ1 LYS 523 HZ1 LYS 523 -12.466 -17.410 8.835 330 HZ2 LYS 523 HZ2 LYS 523 -13.363 -18.278 9.976 331 HZ3 LYS 523 HZ3 LYS 523 -11.716 -17.991 10.236 332 H LEU 524 H LEU 524 -10.970 -13.867 14.882 333 HA LEU 524 HA LEU 524 -8.498 -15.224 15.651 334 HB2 LEU 524 HB2 LEU 524 -8.470 -12.799 16.388 335 HB3 LEU 524 HB3 LEU 524 -9.806 -13.210 17.463 336 HG LEU 524 HG LEU 524 -7.539 -13.129 18.535 337 HD11 LEU 524 HD11 LEU 524 -8.774 -15.862 18.697 338 HD12 LEU 524 HD12 LEU 524 -9.552 -14.429 19.367 339 HD13 LEU 524 HD13 LEU 524 -7.976 -14.940 19.971 340 HD21 LEU 524 HD21 LEU 524 -7.054 -15.763 17.176 341 HD22 LEU 524 HD22 LEU 524 -5.932 -14.788 18.125 342 HD23 LEU 524 HD23 LEU 524 -6.437 -14.245 16.524 343 H PHE 525 H PHE 525 -9.575 -17.182 15.630 344 HA PHE 525 HA PHE 525 -11.965 -17.498 17.264 345 HB2 PHE 525 HB2 PHE 525 -11.088 -18.700 14.919 346 HB3 PHE 525 HB3 PHE 525 -10.853 -19.946 16.140 347 HD1 PHE 525 HD1 PHE 525 -12.575 -21.435 16.321 348 HD2 PHE 525 HD2 PHE 525 -13.456 -17.388 15.339 349 HE1 PHE 525 HE1 PHE 525 -14.971 -21.985 16.222 350 HE2 PHE 525 HE2 PHE 525 -15.854 -17.931 15.240 351 HZ PHE 525 HZ PHE 525 -16.614 -20.231 15.683 352 H ALA 526 H ALA 526 -11.702 -20.075 18.170 353 HA ALA 526 HA ALA 526 -10.196 -19.705 20.544 354 HB1 ALA 526 HB1 ALA 526 -11.334 -22.292 19.499 355 HB2 ALA 526 HB2 ALA 526 -10.936 -21.894 21.171 356 HB3 ALA 526 HB3 ALA 526 -12.271 -21.073 20.362 357 H SER 527 H SER 527 -9.684 -21.665 17.636 358 HA SER 527 HA SER 527 -6.848 -21.870 18.362 359 HB2 SER 527 HB2 SER 527 -8.686 -24.139 17.619 360 HB3 SER 527 HB3 SER 527 -6.942 -24.251 17.389 361 HG SER 527 HG SER 527 -6.862 -24.767 19.414 362 H HIS 528 H HIS 528 -8.249 -20.149 16.505 363 HA HIS 528 HA HIS 528 -6.649 -20.695 14.163 364 HB2 HIS 528 HB2 HIS 528 -9.652 -20.816 14.109 365 HB3 HIS 528 HB3 HIS 528 -8.746 -20.320 12.682 366 HD1 HIS 528 HD1 HIS 528 -9.579 -23.291 14.761 367 HD2 HIS 528 HD2 HIS 528 -7.251 -22.368 11.446 368 HE1 HIS 528 HE1 HIS 528 -8.940 -25.504 13.751 369 H SER 529 H SER 529 -6.769 -18.888 12.580 370 HA SER 529 HA SER 529 -7.992 -16.423 13.307 371 HB2 SER 529 HB2 SER 529 -5.497 -15.395 13.466 372 HB3 SER 529 HB3 SER 529 -6.442 -15.864 14.879 373 HG SER 529 HG SER 529 -5.075 -17.414 15.247 374 H THR 530 H THR 530 -8.187 -15.183 11.544 375 HA THR 530 HA THR 530 -6.594 -15.921 9.182 376 HB THR 530 HB THR 530 -8.371 -15.172 7.793 377 HG1 THR 530 HG1 THR 530 -9.174 -13.360 8.691 378 HG21 THR 530 HG21 THR 530 -9.866 -16.834 8.203 379 HG22 THR 530 HG22 THR 530 -10.070 -16.381 9.895 380 HG23 THR 530 HG23 THR 530 -8.654 -17.306 9.394 381 H ILE 531 H ILE 531 -6.229 -14.103 7.612 382 HA ILE 531 HA ILE 531 -6.286 -11.407 8.443 383 HB ILE 531 HB ILE 531 -4.560 -12.002 10.010 384 HG12 ILE 531 HG12 ILE 531 -3.004 -10.759 7.769 385 HG13 ILE 531 HG13 ILE 531 -4.393 -9.911 8.439 386 HG21 ILE 531 HG21 ILE 531 -3.013 -13.112 7.672 387 HG22 ILE 531 HG22 ILE 531 -2.467 -13.035 9.346 388 HG23 ILE 531 HG23 ILE 531 -3.825 -14.072 8.909 389 HD11 ILE 531 HD11 ILE 531 -1.868 -10.717 9.846 390 HD12 ILE 531 HD12 ILE 531 -2.486 -9.091 9.554 391 HD13 ILE 531 HD13 ILE 531 -3.309 -10.156 10.693 392 H GLU 532 H GLU 532 -5.782 -10.027 6.783 393 HA GLU 532 HA GLU 532 -4.762 -11.273 4.314 394 HB2 GLU 532 HB2 GLU 532 -7.208 -10.730 4.264 395 HB3 GLU 532 HB3 GLU 532 -6.786 -9.037 4.473 396 HG2 GLU 532 HG2 GLU 532 -6.085 -8.802 2.342 397 HG3 GLU 532 HG3 GLU 532 -5.461 -10.448 2.249 398 H LEU 533 H LEU 533 -2.975 -10.392 3.518 399 HA LEU 533 HA LEU 533 -2.182 -7.728 4.483 400 HB2 LEU 533 HB2 LEU 533 -0.755 -10.228 4.061 401 HB3 LEU 533 HB3 LEU 533 0.040 -8.854 3.296 402 HG LEU 533 HG LEU 533 0.220 -7.721 5.420 403 HD11 LEU 533 HD11 LEU 533 -1.713 -9.768 6.244 404 HD12 LEU 533 HD12 LEU 533 -1.459 -8.131 6.849 405 HD13 LEU 533 HD13 LEU 533 -0.427 -9.447 7.408 406 HD21 LEU 533 HD21 LEU 533 1.094 -10.598 5.653 407 HD22 LEU 533 HD22 LEU 533 1.746 -9.235 6.562 408 HD23 LEU 533 HD23 LEU 533 1.974 -9.320 4.815 409 HA PRO 534 HA PRO 534 -2.818 -6.246 0.358 410 HB2 PRO 534 HB2 PRO 534 -1.626 -3.829 0.688 411 HB3 PRO 534 HB3 PRO 534 -3.229 -4.205 1.330 412 HG2 PRO 534 HG2 PRO 534 -0.584 -4.192 2.731 413 HG3 PRO 534 HG3 PRO 534 -2.148 -3.569 3.288 414 HD2 PRO 534 HD2 PRO 534 -1.160 -5.957 4.095 415 HD3 PRO 534 HD3 PRO 534 -2.900 -5.657 3.910 416 H LYS 535 H LYS 535 0.131 -7.050 1.778 417 HA LYS 535 HA LYS 535 2.109 -6.039 0.187 418 HB2 LYS 535 HB2 LYS 535 1.866 -8.886 1.177 419 HB3 LYS 535 HB3 LYS 535 3.350 -8.140 0.599 420 HG2 LYS 535 HG2 LYS 535 1.939 -6.724 2.769 421 HG3 LYS 535 HG3 LYS 535 2.671 -8.276 3.183 422 HD2 LYS 535 HD2 LYS 535 4.281 -6.555 3.608 423 HD3 LYS 535 HD3 LYS 535 4.805 -7.455 2.183 424 HE2 LYS 535 HE2 LYS 535 4.362 -5.716 0.754 425 HE3 LYS 535 HE3 LYS 535 3.115 -5.035 1.798 426 HZ1 LYS 535 HZ1 LYS 535 4.623 -3.609 2.525 427 HZ2 LYS 535 HZ2 LYS 535 5.853 -4.362 1.642 428 HZ3 LYS 535 HZ3 LYS 535 5.493 -4.889 3.209 429 H GLY 536 H GLY 536 3.141 -6.684 -1.741 430 HA2 GLY 536 HA2 GLY 536 1.507 -8.407 -3.496 431 HA3 GLY 536 HA3 GLY 536 2.156 -6.874 -4.059 432 H MET 537 H MET 537 3.720 -9.356 -2.069 433 HA MET 537 HA MET 537 5.221 -10.547 -4.120 434 HB2 MET 537 HB2 MET 537 6.131 -8.075 -3.904 435 HB3 MET 537 HB3 MET 537 7.008 -8.752 -2.538 436 HG2 MET 537 HG2 MET 537 8.315 -10.086 -3.857 437 HG3 MET 537 HG3 MET 537 7.117 -10.172 -5.146 438 HE1 MET 537 HE1 MET 537 10.026 -10.005 -5.342 439 HE2 MET 537 HE2 MET 537 10.485 -8.719 -6.459 440 HE3 MET 537 HE3 MET 537 10.745 -8.516 -4.726 441 HA PRO 538 HA PRO 538 5.234 -12.459 0.141 442 HB2 PRO 538 HB2 PRO 538 4.075 -14.792 -0.624 443 HB3 PRO 538 HB3 PRO 538 3.144 -13.372 -0.134 444 HG2 PRO 538 HG2 PRO 538 3.791 -14.355 -2.886 445 HG3 PRO 538 HG3 PRO 538 2.258 -13.725 -2.255 446 HD2 PRO 538 HD2 PRO 538 3.948 -12.222 -3.744 447 HD3 PRO 538 HD3 PRO 538 2.928 -11.530 -2.465 448 H GLY 539 H GLY 539 5.842 -15.017 0.429 449 HA2 GLY 539 HA2 GLY 539 7.316 -16.755 -0.129 450 HA3 GLY 539 HA3 GLY 539 7.884 -15.805 -1.494 451 H GLU 540 H GLU 540 7.938 -13.625 0.860 452 HA GLU 540 HA GLU 540 10.766 -13.759 1.182 453 HB2 GLU 540 HB2 GLU 540 8.950 -12.042 2.853 454 HB3 GLU 540 HB3 GLU 540 10.595 -11.712 2.328 455 HG2 GLU 540 HG2 GLU 540 9.641 -11.684 -0.041 456 HG3 GLU 540 HG3 GLU 540 8.062 -11.584 0.735 457 H VAL 541 H VAL 541 8.063 -14.080 3.482 458 HA VAL 541 HA VAL 541 9.790 -14.944 5.607 459 HB VAL 541 HB VAL 541 6.778 -15.103 5.452 460 HG11 VAL 541 HG11 VAL 541 8.775 -15.525 7.627 461 HG12 VAL 541 HG12 VAL 541 7.184 -14.874 8.024 462 HG13 VAL 541 HG13 VAL 541 7.323 -16.447 7.239 463 HG21 VAL 541 HG21 VAL 541 6.757 -12.886 5.592 464 HG22 VAL 541 HG22 VAL 541 7.593 -13.008 7.140 465 HG23 VAL 541 HG23 VAL 541 8.519 -12.835 5.649 466 H LEU 542 H LEU 542 7.737 -16.485 3.222 467 HA LEU 542 HA LEU 542 7.689 -19.064 4.379 468 HB2 LEU 542 HB2 LEU 542 7.107 -17.907 1.710 469 HB3 LEU 542 HB3 LEU 542 7.374 -19.646 1.802 470 HG LEU 542 HG LEU 542 5.566 -19.383 3.762 471 HD11 LEU 542 HD11 LEU 542 5.340 -16.973 3.475 472 HD12 LEU 542 HD12 LEU 542 3.837 -17.804 3.074 473 HD13 LEU 542 HD13 LEU 542 4.885 -17.209 1.787 474 HD21 LEU 542 HD21 LEU 542 5.659 -20.577 1.349 475 HD22 LEU 542 HD22 LEU 542 4.365 -19.411 1.071 476 HD23 LEU 542 HD23 LEU 542 4.235 -20.576 2.389 477 H GLN 543 H GLN 543 10.100 -17.328 2.651 478 HA GLN 543 HA GLN 543 11.571 -19.645 1.781 479 HB2 GLN 543 HB2 GLN 543 11.956 -16.695 1.667 480 HB3 GLN 543 HB3 GLN 543 13.384 -17.712 1.526 481 HG2 GLN 543 HG2 GLN 543 12.662 -18.673 -0.456 482 HG3 GLN 543 HG3 GLN 543 10.982 -18.217 -0.179 483 HE21 GLN 543 HE21 GLN 543 12.259 -17.736 -2.578 484 HE22 GLN 543 HE22 GLN 543 12.449 -16.031 -2.788 485 H HIS 544 H HIS 544 12.286 -17.036 4.109 486 HA HIS 544 HA HIS 544 14.454 -18.467 5.288 487 HB2 HIS 544 HB2 HIS 544 12.933 -16.016 6.192 488 HB3 HIS 544 HB3 HIS 544 14.355 -16.649 7.018 489 HD1 HIS 544 HD1 HIS 544 16.636 -16.500 5.700 490 HD2 HIS 544 HD2 HIS 544 13.445 -14.495 3.951 491 HE1 HIS 544 HE1 HIS 544 17.662 -14.965 3.992 492 H PHE 545 H PHE 545 11.219 -17.585 6.502 493 HA PHE 545 HA PHE 545 11.501 -19.455 8.705 494 HB2 PHE 545 HB2 PHE 545 9.494 -17.363 7.947 495 HB3 PHE 545 HB3 PHE 545 9.056 -18.605 9.115 496 HD1 PHE 545 HD1 PHE 545 9.082 -17.758 11.242 497 HD2 PHE 545 HD2 PHE 545 12.152 -16.605 8.529 498 HE1 PHE 545 HE1 PHE 545 10.170 -16.463 13.029 499 HE2 PHE 545 HE2 PHE 545 13.245 -15.309 10.312 500 HZ PHE 545 HZ PHE 545 12.255 -15.237 12.565 501 H THR 546 H THR 546 11.601 -20.800 6.329 502 HA THR 546 HA THR 546 9.052 -21.762 5.484 503 HB THR 546 HB THR 546 11.107 -21.807 4.056 504 HG1 THR 546 HG1 THR 546 9.466 -23.104 3.351 505 HG21 THR 546 HG21 THR 546 12.382 -22.892 6.149 506 HG22 THR 546 HG22 THR 546 12.909 -23.127 4.482 507 HG23 THR 546 HG23 THR 546 11.947 -24.367 5.286 508 H ARG 547 H ARG 547 11.402 -22.762 7.876 509 HA ARG 547 HA ARG 547 9.654 -25.024 8.590 510 HB2 ARG 547 HB2 ARG 547 11.758 -25.928 9.723 511 HB3 ARG 547 HB3 ARG 547 11.717 -25.967 7.965 512 HG2 ARG 547 HG2 ARG 547 13.265 -24.255 7.763 513 HG3 ARG 547 HG3 ARG 547 12.976 -23.667 9.401 514 HD2 ARG 547 HD2 ARG 547 15.023 -24.728 9.605 515 HD3 ARG 547 HD3 ARG 547 13.893 -25.976 10.128 516 HE ARG 547 HE ARG 547 14.553 -27.242 8.351 517 HH11 ARG 547 HH11 ARG 547 15.398 -23.923 7.729 518 HH12 ARG 547 HH12 ARG 547 16.255 -24.279 6.265 519 HH21 ARG 547 HH21 ARG 547 15.679 -27.723 6.426 520 HH22 ARG 547 HH22 ARG 547 16.413 -26.441 5.525 521 H THR 548 H THR 548 11.141 -22.104 9.630 522 HA THR 548 HA THR 548 10.494 -22.632 12.438 523 HB THR 548 HB THR 548 12.006 -20.330 11.189 524 HG1 THR 548 HG1 THR 548 13.509 -21.838 11.241 525 HG21 THR 548 HG21 THR 548 11.496 -20.999 14.090 526 HG22 THR 548 HG22 THR 548 10.865 -19.607 13.210 527 HG23 THR 548 HG23 THR 548 12.596 -19.748 13.513 528 H ARG 549 H ARG 549 8.559 -22.048 13.147 529 HA ARG 549 HA ARG 549 7.454 -19.468 12.381 530 HB2 ARG 549 HB2 ARG 549 6.089 -22.101 11.849 531 HB3 ARG 549 HB3 ARG 549 5.190 -20.598 12.007 532 HG2 ARG 549 HG2 ARG 549 5.450 -20.629 9.756 533 HG3 ARG 549 HG3 ARG 549 6.941 -19.792 10.192 534 HD2 ARG 549 HD2 ARG 549 8.237 -21.507 9.537 535 HD3 ARG 549 HD3 ARG 549 7.141 -22.716 10.204 536 HE ARG 549 HE ARG 549 7.161 -21.676 7.504 537 HH11 ARG 549 HH11 ARG 549 5.397 -23.421 9.946 538 HH12 ARG 549 HH12 ARG 549 4.359 -24.218 8.812 539 HH21 ARG 549 HH21 ARG 549 5.799 -22.720 6.000 540 HH22 ARG 549 HH22 ARG 549 4.589 -23.819 6.567 541 H ILE 550 H ILE 550 5.217 -19.238 13.600 542 HA ILE 550 HA ILE 550 4.941 -20.648 16.060 543 HB ILE 550 HB ILE 550 6.953 -19.009 16.365 544 HG12 ILE 550 HG12 ILE 550 5.075 -18.536 18.572 545 HG13 ILE 550 HG13 ILE 550 5.174 -20.221 18.073 546 HG21 ILE 550 HG21 ILE 550 5.226 -17.156 15.490 547 HG22 ILE 550 HG22 ILE 550 4.941 -17.025 17.224 548 HG23 ILE 550 HG23 ILE 550 6.565 -16.790 16.578 549 HD11 ILE 550 HD11 ILE 550 6.932 -18.784 19.733 550 HD12 ILE 550 HD12 ILE 550 7.062 -20.457 19.189 551 HD13 ILE 550 HD13 ILE 550 7.809 -19.163 18.251 552 H LEU 551 H LEU 551 3.464 -19.161 17.596 553 HA LEU 551 HA LEU 551 0.970 -19.037 16.639 554 HB2 LEU 551 HB2 LEU 551 0.425 -17.372 18.309 555 HB3 LEU 551 HB3 LEU 551 1.557 -18.555 18.959 556 HG LEU 551 HG LEU 551 3.295 -16.661 18.197 557 HD11 LEU 551 HD11 LEU 551 1.143 -15.319 17.524 558 HD12 LEU 551 HD12 LEU 551 2.511 -14.512 18.290 559 HD13 LEU 551 HD13 LEU 551 1.097 -14.950 19.248 560 HD21 LEU 551 HD21 LEU 551 3.537 -16.152 20.460 561 HD22 LEU 551 HD22 LEU 551 2.822 -17.765 20.465 562 HD23 LEU 551 HD23 LEU 551 1.815 -16.353 20.787 563 H ASN 552 H ASN 552 3.362 -16.451 16.276 564 HA ASN 552 HA ASN 552 1.575 -14.724 14.849 565 HB2 ASN 552 HB2 ASN 552 3.313 -13.635 16.035 566 HB3 ASN 552 HB3 ASN 552 4.548 -14.686 15.347 567 HD21 ASN 552 HD21 ASN 552 1.900 -12.943 13.783 568 HD22 ASN 552 HD22 ASN 552 2.905 -11.993 12.747 569 H LYS 553 H LYS 553 4.563 -16.390 13.830 570 HA LYS 553 HA LYS 553 4.153 -15.986 11.076 571 HB2 LYS 553 HB2 LYS 553 5.678 -18.346 12.121 572 HB3 LYS 553 HB3 LYS 553 6.032 -17.322 10.734 573 HG2 LYS 553 HG2 LYS 553 6.380 -16.637 13.642 574 HG3 LYS 553 HG3 LYS 553 7.644 -16.875 12.433 575 HD2 LYS 553 HD2 LYS 553 5.577 -14.674 12.431 576 HD3 LYS 553 HD3 LYS 553 7.278 -14.499 12.872 577 HE2 LYS 553 HE2 LYS 553 7.758 -14.109 10.740 578 HE3 LYS 553 HE3 LYS 553 7.216 -15.738 10.342 579 HZ1 LYS 553 HZ1 LYS 553 5.100 -13.794 10.683 580 HZ2 LYS 553 HZ2 LYS 553 5.300 -14.981 9.494 581 HZ3 LYS 553 HZ3 LYS 553 6.117 -13.506 9.362 582 HA PRO 554 HA PRO 554 1.338 -19.100 9.802 583 HB2 PRO 554 HB2 PRO 554 2.467 -20.056 7.526 584 HB3 PRO 554 HB3 PRO 554 1.729 -18.454 7.632 585 HG2 PRO 554 HG2 PRO 554 4.618 -19.222 7.786 586 HG3 PRO 554 HG3 PRO 554 3.864 -17.870 6.920 587 HD2 PRO 554 HD2 PRO 554 5.104 -17.562 9.308 588 HD3 PRO 554 HD3 PRO 554 3.711 -16.575 8.821 589 H MET 555 H MET 555 2.033 -20.376 11.770 590 HA MET 555 HA MET 555 3.928 -22.439 11.625 591 HB2 MET 555 HB2 MET 555 3.111 -21.769 13.767 592 HB3 MET 555 HB3 MET 555 1.447 -22.108 13.310 593 HG2 MET 555 HG2 MET 555 2.258 -23.825 14.785 594 HG3 MET 555 HG3 MET 555 1.984 -24.497 13.179 595 HE1 MET 555 HE1 MET 555 4.865 -26.715 13.324 596 HE2 MET 555 HE2 MET 555 3.926 -26.527 14.805 597 HE3 MET 555 HE3 MET 555 3.123 -26.447 13.237 598 H ASN 556 H ASN 556 0.384 -22.599 11.244 599 HA ASN 556 HA ASN 556 0.705 -24.742 9.304 600 HB2 ASN 556 HB2 ASN 556 0.495 -25.730 11.669 601 HB3 ASN 556 HB3 ASN 556 -1.174 -25.169 11.619 602 HD21 ASN 556 HD21 ASN 556 -2.511 -25.954 9.849 603 HD22 ASN 556 HD22 ASN 556 -2.229 -27.542 9.231 604 H MET 557 H MET 557 -0.035 -22.806 8.078 605 HA MET 557 HA MET 557 -2.958 -22.484 8.254 606 HB2 MET 557 HB2 MET 557 -2.379 -20.358 6.831 607 HB3 MET 557 HB3 MET 557 -2.186 -20.335 8.579 608 HG2 MET 557 HG2 MET 557 -0.271 -19.313 7.624 609 HG3 MET 557 HG3 MET 557 0.218 -20.885 8.252 610 HE1 MET 557 HE1 MET 557 -1.630 -20.111 4.667 611 HE2 MET 557 HE2 MET 557 -0.705 -18.743 5.286 612 HE3 MET 557 HE3 MET 557 -0.138 -19.621 3.864 613 H GLN 558 H GLN 558 -3.916 -21.825 6.051 614 HA GLN 558 HA GLN 558 -2.592 -23.108 3.794 615 HB2 GLN 558 HB2 GLN 558 -5.433 -23.869 4.405 616 HB3 GLN 558 HB3 GLN 558 -4.292 -24.654 3.322 617 HG2 GLN 558 HG2 GLN 558 -2.952 -25.257 5.373 618 HG3 GLN 558 HG3 GLN 558 -4.333 -24.713 6.323 619 HE21 GLN 558 HE21 GLN 558 -3.382 -27.296 6.472 620 HE22 GLN 558 HE22 GLN 558 -4.553 -28.374 5.800 621 H LEU 559 H LEU 559 -2.912 -22.009 1.964 622 HA LEU 559 HA LEU 559 -4.299 -19.566 1.938 623 HB2 LEU 559 HB2 LEU 559 -2.404 -20.065 0.474 624 HB3 LEU 559 HB3 LEU 559 -3.378 -21.258 -0.382 625 HG LEU 559 HG LEU 559 -3.010 -18.942 -1.453 626 HD11 LEU 559 HD11 LEU 559 -4.753 -20.820 -1.959 627 HD12 LEU 559 HD12 LEU 559 -4.923 -19.226 -2.692 628 HD13 LEU 559 HD13 LEU 559 -5.899 -19.660 -1.290 629 HD21 LEU 559 HD21 LEU 559 -3.571 -17.651 0.568 630 HD22 LEU 559 HD22 LEU 559 -5.224 -18.261 0.480 631 HD23 LEU 559 HD23 LEU 559 -4.594 -17.230 -0.806 632 H LEU 560 H LEU 560 -6.415 -19.243 1.903 633 HA LEU 560 HA LEU 560 -8.117 -21.204 0.510 634 HB2 LEU 560 HB2 LEU 560 -9.789 -20.917 2.088 635 HB3 LEU 560 HB3 LEU 560 -8.314 -20.914 3.052 636 HG LEU 560 HG LEU 560 -8.640 -18.258 2.614 637 HD11 LEU 560 HD11 LEU 560 -10.749 -17.618 2.260 638 HD12 LEU 560 HD12 LEU 560 -11.402 -18.846 3.344 639 HD13 LEU 560 HD13 LEU 560 -11.009 -19.262 1.676 640 HD21 LEU 560 HD21 LEU 560 -10.168 -19.403 4.879 641 HD22 LEU 560 HD22 LEU 560 -8.928 -18.148 4.863 642 HD23 LEU 560 HD23 LEU 560 -8.466 -19.847 4.746 643 H GLY 561 H GLY 561 -7.275 -17.858 0.906 644 HA2 GLY 561 HA2 GLY 561 -9.519 -16.895 -0.656 645 HA3 GLY 561 HA3 GLY 561 -8.198 -15.928 -0.017 646 H ASP 562 H ASP 562 -8.083 -14.848 -2.048 647 HA ASP 562 HA ASP 562 -6.149 -15.947 -3.800 648 HB2 ASP 562 HB2 ASP 562 -8.141 -17.215 -4.580 649 HB3 ASP 562 HB3 ASP 562 -8.932 -15.687 -4.957 650 H ALA 563 H ALA 563 -5.328 -14.420 -5.256 651 HA ALA 563 HA ALA 563 -5.644 -11.716 -4.484 652 HB1 ALA 563 HB1 ALA 563 -3.726 -11.451 -5.578 653 HB2 ALA 563 HB2 ALA 563 -3.780 -13.178 -5.932 654 HB3 ALA 563 HB3 ALA 563 -4.432 -12.019 -7.091 655 H GLN 564 H GLN 564 -7.458 -10.616 -4.875 656 HA GLN 564 HA GLN 564 -9.322 -11.152 -6.881 657 HB2 GLN 564 HB2 GLN 564 -9.989 -9.862 -4.984 658 HB3 GLN 564 HB3 GLN 564 -8.765 -8.641 -5.305 659 HG2 GLN 564 HG2 GLN 564 -10.942 -7.817 -5.922 660 HG3 GLN 564 HG3 GLN 564 -9.941 -8.015 -7.360 661 HE21 GLN 564 HE21 GLN 564 -12.646 -9.263 -5.552 662 HE22 GLN 564 HE22 GLN 564 -13.315 -10.216 -6.828 Start of MODEL 17 1 H MET 480 H MET 480 1.772 -1.175 1.455 2 HA MET 480 HA MET 480 1.894 0.018 -1.153 3 HB2 MET 480 HB2 MET 480 4.152 0.371 0.801 4 HB3 MET 480 HB3 MET 480 4.443 0.349 -0.933 5 HG2 MET 480 HG2 MET 480 3.287 2.324 -1.284 6 HG3 MET 480 HG3 MET 480 2.403 2.192 0.234 7 HE1 MET 480 HE1 MET 480 5.776 4.347 -1.075 8 HE2 MET 480 HE2 MET 480 6.748 3.025 -0.430 9 HE3 MET 480 HE3 MET 480 5.480 2.693 -1.611 10 H ALA 481 H ALA 481 1.931 -1.704 -2.427 11 HA ALA 481 HA ALA 481 3.666 -3.967 -1.682 12 HB1 ALA 481 HB1 ALA 481 0.816 -3.933 -2.201 13 HB2 ALA 481 HB2 ALA 481 1.669 -5.056 -3.261 14 HB3 ALA 481 HB3 ALA 481 1.824 -5.205 -1.511 15 H ASP 482 H ASP 482 3.698 -5.494 -3.812 16 HA ASP 482 HA ASP 482 4.899 -3.793 -5.859 17 HB2 ASP 482 HB2 ASP 482 5.823 -6.062 -4.734 18 HB3 ASP 482 HB3 ASP 482 4.992 -6.743 -6.130 19 H VAL 483 H VAL 483 2.294 -6.100 -5.418 20 HA VAL 483 HA VAL 483 1.243 -5.324 -8.049 21 HB VAL 483 HB VAL 483 2.210 -7.502 -8.408 22 HG11 VAL 483 HG11 VAL 483 1.663 -9.441 -7.105 23 HG12 VAL 483 HG12 VAL 483 2.226 -8.175 -6.011 24 HG13 VAL 483 HG13 VAL 483 0.502 -8.525 -6.144 25 HG21 VAL 483 HG21 VAL 483 0.027 -6.995 -9.450 26 HG22 VAL 483 HG22 VAL 483 0.268 -8.720 -9.172 27 HG23 VAL 483 HG23 VAL 483 -0.776 -7.791 -8.097 28 H GLY 484 H GLY 484 0.597 -6.743 -4.873 29 HA2 GLY 484 HA2 GLY 484 -1.267 -5.613 -3.657 30 HA3 GLY 484 HA3 GLY 484 -2.198 -5.817 -5.133 31 H ASP 485 H ASP 485 -0.033 -8.295 -3.984 32 HA ASP 485 HA ASP 485 -1.848 -10.366 -4.138 33 HB2 ASP 485 HB2 ASP 485 0.773 -10.284 -3.676 34 HB3 ASP 485 HB3 ASP 485 0.238 -10.517 -2.014 35 H MET 486 H MET 486 -3.804 -10.238 -3.194 36 HA MET 486 HA MET 486 -3.862 -9.880 -0.271 37 HB2 MET 486 HB2 MET 486 -5.053 -8.213 -2.151 38 HB3 MET 486 HB3 MET 486 -6.373 -9.231 -1.591 39 HG2 MET 486 HG2 MET 486 -6.532 -8.083 0.289 40 HG3 MET 486 HG3 MET 486 -4.826 -8.344 0.645 41 HE1 MET 486 HE1 MET 486 -6.672 -4.914 -1.723 42 HE2 MET 486 HE2 MET 486 -5.780 -6.071 -2.711 43 HE3 MET 486 HE3 MET 486 -7.142 -6.614 -1.729 44 H GLN 487 H GLN 487 -4.485 -11.663 0.739 45 HA GLN 487 HA GLN 487 -6.685 -13.245 -0.300 46 HB2 GLN 487 HB2 GLN 487 -4.097 -14.635 0.368 47 HB3 GLN 487 HB3 GLN 487 -5.531 -15.319 -0.385 48 HG2 GLN 487 HG2 GLN 487 -5.130 -14.024 -2.392 49 HG3 GLN 487 HG3 GLN 487 -3.733 -13.256 -1.638 50 HE21 GLN 487 HE21 GLN 487 -4.273 -15.188 -3.984 51 HE22 GLN 487 HE22 GLN 487 -3.040 -16.383 -3.794 52 H LEU 488 H LEU 488 -7.075 -15.168 1.289 53 HA LEU 488 HA LEU 488 -6.820 -14.086 4.014 54 HB2 LEU 488 HB2 LEU 488 -9.114 -14.391 2.901 55 HB3 LEU 488 HB3 LEU 488 -8.850 -16.117 3.147 56 HG LEU 488 HG LEU 488 -8.674 -15.698 5.583 57 HD11 LEU 488 HD11 LEU 488 -8.380 -13.644 6.355 58 HD12 LEU 488 HD12 LEU 488 -9.963 -13.183 5.730 59 HD13 LEU 488 HD13 LEU 488 -8.528 -12.993 4.723 60 HD21 LEU 488 HD21 LEU 488 -10.777 -16.439 4.704 61 HD22 LEU 488 HD22 LEU 488 -11.198 -14.803 4.198 62 HD23 LEU 488 HD23 LEU 488 -11.089 -15.196 5.915 63 H TYR 489 H TYR 489 -5.212 -15.068 5.056 64 HA TYR 489 HA TYR 489 -4.822 -17.955 4.654 65 HB2 TYR 489 HB2 TYR 489 -2.825 -16.275 6.105 66 HB3 TYR 489 HB3 TYR 489 -2.571 -17.687 5.085 67 HD1 TYR 489 HD1 TYR 489 -2.990 -14.056 5.148 68 HD2 TYR 489 HD2 TYR 489 -2.444 -17.463 2.660 69 HE1 TYR 489 HE1 TYR 489 -2.393 -12.582 3.272 70 HE2 TYR 489 HE2 TYR 489 -1.845 -15.999 0.777 71 HH TYR 489 HH TYR 489 -2.496 -13.308 0.260 72 H ARG 490 H ARG 490 -5.675 -19.209 6.162 73 HA ARG 490 HA ARG 490 -6.073 -18.139 8.863 74 HB2 ARG 490 HB2 ARG 490 -7.673 -19.924 9.183 75 HB3 ARG 490 HB3 ARG 490 -8.033 -19.086 7.679 76 HG2 ARG 490 HG2 ARG 490 -8.153 -21.130 6.797 77 HG3 ARG 490 HG3 ARG 490 -6.389 -21.084 6.823 78 HD2 ARG 490 HD2 ARG 490 -6.764 -23.063 7.911 79 HD3 ARG 490 HD3 ARG 490 -6.729 -21.953 9.280 80 HE ARG 490 HE ARG 490 -8.964 -22.351 9.625 81 HH11 ARG 490 HH11 ARG 490 -8.029 -23.591 6.509 82 HH12 ARG 490 HH12 ARG 490 -9.527 -24.419 6.244 83 HH21 ARG 490 HH21 ARG 490 -10.941 -23.437 9.287 84 HH22 ARG 490 HH22 ARG 490 -11.183 -24.330 7.824 85 H ILE 491 H ILE 491 -4.960 -18.872 10.565 86 HA ILE 491 HA ILE 491 -3.066 -21.071 10.110 87 HB ILE 491 HB ILE 491 -1.761 -20.207 11.936 88 HG12 ILE 491 HG12 ILE 491 -3.969 -18.170 12.298 89 HG13 ILE 491 HG13 ILE 491 -3.605 -19.499 13.393 90 HG21 ILE 491 HG21 ILE 491 -2.344 -18.744 9.574 91 HG22 ILE 491 HG22 ILE 491 -2.048 -17.593 10.876 92 HG23 ILE 491 HG23 ILE 491 -0.834 -18.810 10.483 93 HD11 ILE 491 HD11 ILE 491 -1.303 -18.451 13.636 94 HD12 ILE 491 HD12 ILE 491 -1.997 -17.031 12.853 95 HD13 ILE 491 HD13 ILE 491 -2.660 -17.608 14.382 96 H GLU 492 H GLU 492 -2.554 -22.389 12.104 97 HA GLU 492 HA GLU 492 -5.080 -23.270 13.283 98 HB2 GLU 492 HB2 GLU 492 -3.544 -24.892 12.127 99 HB3 GLU 492 HB3 GLU 492 -2.383 -24.623 13.419 100 HG2 GLU 492 HG2 GLU 492 -3.386 -26.470 14.244 101 HG3 GLU 492 HG3 GLU 492 -4.477 -25.260 14.916 102 H VAL 493 H VAL 493 -4.414 -20.942 14.395 103 HA VAL 493 HA VAL 493 -3.678 -21.719 17.114 104 HB VAL 493 HB VAL 493 -2.508 -19.223 15.905 105 HG11 VAL 493 HG11 VAL 493 -1.546 -20.771 18.292 106 HG12 VAL 493 HG12 VAL 493 -1.205 -19.096 17.850 107 HG13 VAL 493 HG13 VAL 493 -2.812 -19.550 18.421 108 HG21 VAL 493 HG21 VAL 493 -1.583 -21.057 14.646 109 HG22 VAL 493 HG22 VAL 493 -0.363 -20.461 15.771 110 HG23 VAL 493 HG23 VAL 493 -1.238 -21.950 16.128 111 H GLY 494 H GLY 494 -4.743 -20.599 18.698 112 HA2 GLY 494 HA2 GLY 494 -6.238 -18.194 18.006 113 HA3 GLY 494 HA3 GLY 494 -7.194 -19.598 18.458 114 H ARG 495 H ARG 495 -7.880 -17.936 20.116 115 HA ARG 495 HA ARG 495 -6.231 -17.023 22.155 116 HB2 ARG 495 HB2 ARG 495 -8.338 -16.975 23.539 117 HB3 ARG 495 HB3 ARG 495 -8.438 -16.149 21.990 118 HG2 ARG 495 HG2 ARG 495 -9.733 -17.874 21.039 119 HG3 ARG 495 HG3 ARG 495 -9.382 -18.973 22.375 120 HD2 ARG 495 HD2 ARG 495 -11.464 -18.296 23.001 121 HD3 ARG 495 HD3 ARG 495 -10.513 -17.031 23.778 122 HE ARG 495 HE ARG 495 -11.046 -15.996 21.336 123 HH11 ARG 495 HH11 ARG 495 -13.031 -17.392 23.832 124 HH12 ARG 495 HH12 ARG 495 -14.421 -16.433 23.444 125 HH21 ARG 495 HH21 ARG 495 -12.869 -14.727 20.816 126 HH22 ARG 495 HH22 ARG 495 -14.328 -14.918 21.728 127 H ASP 496 H ASP 496 -7.742 -20.153 21.704 128 HA ASP 496 HA ASP 496 -7.187 -21.131 24.327 129 HB2 ASP 496 HB2 ASP 496 -8.877 -21.984 22.496 130 HB3 ASP 496 HB3 ASP 496 -7.506 -22.964 21.983 131 H ASP 497 H ASP 497 -5.312 -20.697 21.506 132 HA ASP 497 HA ASP 497 -3.311 -22.664 22.321 133 HB2 ASP 497 HB2 ASP 497 -4.022 -22.373 19.904 134 HB3 ASP 497 HB3 ASP 497 -3.197 -20.817 19.935 135 H GLY 498 H GLY 498 -3.712 -19.174 21.923 136 HA2 GLY 498 HA2 GLY 498 -2.500 -17.989 23.841 137 HA3 GLY 498 HA3 GLY 498 -1.076 -18.780 23.183 138 H VAL 499 H VAL 499 -3.707 -17.412 21.286 139 HA VAL 499 HA VAL 499 -1.969 -15.182 20.495 140 HB VAL 499 HB VAL 499 -1.885 -17.144 18.846 141 HG11 VAL 499 HG11 VAL 499 -4.328 -16.160 17.558 142 HG12 VAL 499 HG12 VAL 499 -3.710 -17.806 17.717 143 HG13 VAL 499 HG13 VAL 499 -4.598 -17.063 19.049 144 HG21 VAL 499 HG21 VAL 499 -1.304 -14.672 18.461 145 HG22 VAL 499 HG22 VAL 499 -1.571 -15.690 17.046 146 HG23 VAL 499 HG23 VAL 499 -2.837 -14.591 17.592 147 H GLU 500 H GLU 500 -3.054 -13.338 19.723 148 HA GLU 500 HA GLU 500 -5.977 -13.354 20.069 149 HB2 GLU 500 HB2 GLU 500 -4.281 -11.000 20.858 150 HB3 GLU 500 HB3 GLU 500 -5.948 -11.346 21.296 151 HG2 GLU 500 HG2 GLU 500 -4.827 -13.454 22.433 152 HG3 GLU 500 HG3 GLU 500 -3.425 -12.386 22.450 153 H VAL 501 H VAL 501 -6.662 -10.887 19.340 154 HA VAL 501 HA VAL 501 -6.205 -10.904 16.508 155 HB VAL 501 HB VAL 501 -7.717 -8.931 18.225 156 HG11 VAL 501 HG11 VAL 501 -7.667 -9.273 15.228 157 HG12 VAL 501 HG12 VAL 501 -8.760 -8.211 16.118 158 HG13 VAL 501 HG13 VAL 501 -7.023 -7.906 16.137 159 HG21 VAL 501 HG21 VAL 501 -9.644 -10.141 17.816 160 HG22 VAL 501 HG22 VAL 501 -8.964 -10.949 16.404 161 HG23 VAL 501 HG23 VAL 501 -8.447 -11.420 18.023 162 H ARG 502 H ARG 502 -5.169 -8.929 19.228 163 HA ARG 502 HA ARG 502 -3.813 -7.034 17.499 164 HB2 ARG 502 HB2 ARG 502 -3.126 -5.964 19.635 165 HB3 ARG 502 HB3 ARG 502 -4.868 -6.148 19.478 166 HG2 ARG 502 HG2 ARG 502 -4.951 -7.858 21.062 167 HG3 ARG 502 HG3 ARG 502 -3.217 -8.167 20.949 168 HD2 ARG 502 HD2 ARG 502 -4.082 -5.465 21.819 169 HD3 ARG 502 HD3 ARG 502 -4.296 -6.795 22.957 170 HE ARG 502 HE ARG 502 -1.739 -7.099 22.162 171 HH11 ARG 502 HH11 ARG 502 -3.539 -4.369 23.357 172 HH12 ARG 502 HH12 ARG 502 -2.163 -3.620 24.097 173 HH21 ARG 502 HH21 ARG 502 0.081 -6.122 23.132 174 HH22 ARG 502 HH22 ARG 502 -0.104 -4.618 23.967 175 H HIS 503 H HIS 503 -3.140 -10.071 18.498 176 HA HIS 503 HA HIS 503 -0.354 -9.713 19.180 177 HB2 HIS 503 HB2 HIS 503 -2.049 -11.600 19.929 178 HB3 HIS 503 HB3 HIS 503 -1.493 -12.378 18.451 179 HD1 HIS 503 HD1 HIS 503 1.475 -10.956 19.100 180 HD2 HIS 503 HD2 HIS 503 -0.696 -13.739 21.292 181 HE1 HIS 503 HE1 HIS 503 3.160 -12.131 20.551 182 H ILE 504 H ILE 504 -2.070 -11.420 16.555 183 HA ILE 504 HA ILE 504 0.281 -11.698 14.968 184 HB ILE 504 HB ILE 504 -1.070 -12.695 13.327 185 HG12 ILE 504 HG12 ILE 504 -2.700 -10.772 13.230 186 HG13 ILE 504 HG13 ILE 504 -3.426 -12.366 13.059 187 HG21 ILE 504 HG21 ILE 504 -0.952 -14.010 15.363 188 HG22 ILE 504 HG22 ILE 504 -2.387 -13.202 15.991 189 HG23 ILE 504 HG23 ILE 504 -2.512 -14.245 14.574 190 HD11 ILE 504 HD11 ILE 504 -4.049 -12.285 15.449 191 HD12 ILE 504 HD12 ILE 504 -3.427 -10.636 15.517 192 HD13 ILE 504 HD13 ILE 504 -4.800 -11.018 14.479 193 H VAL 505 H VAL 505 -2.148 -9.251 15.304 194 HA VAL 505 HA VAL 505 -1.576 -7.953 12.797 195 HB VAL 505 HB VAL 505 -3.170 -7.066 15.201 196 HG11 VAL 505 HG11 VAL 505 -3.939 -5.481 13.085 197 HG12 VAL 505 HG12 VAL 505 -2.911 -4.985 14.431 198 HG13 VAL 505 HG13 VAL 505 -2.184 -5.545 12.924 199 HG21 VAL 505 HG21 VAL 505 -5.033 -7.811 14.127 200 HG22 VAL 505 HG22 VAL 505 -4.358 -7.528 12.522 201 HG23 VAL 505 HG23 VAL 505 -3.863 -8.944 13.450 202 H GLY 506 H GLY 506 -1.018 -7.135 16.226 203 HA2 GLY 506 HA2 GLY 506 0.450 -4.799 15.806 204 HA3 GLY 506 HA3 GLY 506 0.582 -5.828 17.224 205 H ALA 507 H ALA 507 1.368 -8.079 15.310 206 HA ALA 507 HA ALA 507 4.213 -7.541 15.447 207 HB1 ALA 507 HB1 ALA 507 4.185 -9.973 14.418 208 HB2 ALA 507 HB2 ALA 507 3.870 -9.691 16.131 209 HB3 ALA 507 HB3 ALA 507 2.526 -9.950 15.018 210 H ILE 508 H ILE 508 2.032 -8.757 12.892 211 HA ILE 508 HA ILE 508 3.843 -8.422 10.782 212 HB ILE 508 HB ILE 508 1.897 -8.557 9.287 213 HG12 ILE 508 HG12 ILE 508 -0.298 -9.072 10.780 214 HG13 ILE 508 HG13 ILE 508 0.482 -7.863 11.795 215 HG21 ILE 508 HG21 ILE 508 1.653 -10.496 11.581 216 HG22 ILE 508 HG22 ILE 508 1.192 -10.768 9.901 217 HG23 ILE 508 HG23 ILE 508 2.893 -10.581 10.329 218 HD11 ILE 508 HD11 ILE 508 -1.199 -7.349 9.709 219 HD12 ILE 508 HD12 ILE 508 -0.055 -6.204 10.410 220 HD13 ILE 508 HD13 ILE 508 0.390 -7.130 8.976 221 H ALA 509 H ALA 509 2.029 -6.123 12.539 222 HA ALA 509 HA ALA 509 2.197 -4.113 10.424 223 HB1 ALA 509 HB1 ALA 509 1.057 -3.700 13.173 224 HB2 ALA 509 HB2 ALA 509 0.727 -2.792 11.697 225 HB3 ALA 509 HB3 ALA 509 0.132 -4.443 11.868 226 H ASN 510 H ASN 510 3.927 -5.188 13.147 227 HA ASN 510 HA ASN 510 5.288 -2.611 13.475 228 HB2 ASN 510 HB2 ASN 510 4.508 -3.669 15.537 229 HB3 ASN 510 HB3 ASN 510 5.418 -5.127 15.152 230 HD21 ASN 510 HD21 ASN 510 6.251 -1.688 14.974 231 HD22 ASN 510 HD22 ASN 510 7.636 -1.795 16.002 232 H GLU 511 H GLU 511 5.597 -5.494 11.812 233 HA GLU 511 HA GLU 511 8.484 -5.664 11.927 234 HB2 GLU 511 HB2 GLU 511 8.224 -7.502 10.321 235 HB3 GLU 511 HB3 GLU 511 7.179 -7.714 11.718 236 HG2 GLU 511 HG2 GLU 511 5.679 -8.210 10.109 237 HG3 GLU 511 HG3 GLU 511 5.459 -6.461 10.127 238 H GLY 512 H GLY 512 6.011 -4.703 9.572 239 HA2 GLY 512 HA2 GLY 512 8.162 -3.429 7.993 240 HA3 GLY 512 HA3 GLY 512 6.747 -4.169 7.259 241 H ASP 513 H ASP 513 5.487 -2.645 6.438 242 HA ASP 513 HA ASP 513 5.169 -0.127 7.929 243 HB2 ASP 513 HB2 ASP 513 5.169 -0.801 5.025 244 HB3 ASP 513 HB3 ASP 513 4.139 0.524 5.562 245 H ILE 514 H ILE 514 3.616 -2.999 7.182 246 HA ILE 514 HA ILE 514 0.987 -2.350 6.680 247 HB ILE 514 HB ILE 514 1.993 -4.561 8.474 248 HG12 ILE 514 HG12 ILE 514 1.098 -4.965 5.653 249 HG13 ILE 514 HG13 ILE 514 2.699 -4.288 5.934 250 HG21 ILE 514 HG21 ILE 514 -0.694 -3.978 7.289 251 HG22 ILE 514 HG22 ILE 514 -0.203 -5.632 7.650 252 HG23 ILE 514 HG23 ILE 514 -0.280 -4.434 8.941 253 HD11 ILE 514 HD11 ILE 514 1.796 -6.829 7.240 254 HD12 ILE 514 HD12 ILE 514 2.534 -6.797 5.639 255 HD13 ILE 514 HD13 ILE 514 3.436 -6.215 7.038 256 H SER 515 H SER 515 -0.793 -1.810 7.898 257 HA SER 515 HA SER 515 -0.258 -0.998 10.681 258 HB2 SER 515 HB2 SER 515 -0.741 0.771 8.733 259 HB3 SER 515 HB3 SER 515 -2.409 0.371 9.143 260 HG SER 515 HG SER 515 -0.432 1.204 11.004 261 H SER 516 H SER 516 -2.260 -0.855 12.028 262 HA SER 516 HA SER 516 -3.615 -3.326 12.012 263 HB2 SER 516 HB2 SER 516 -3.171 -1.547 13.934 264 HB3 SER 516 HB3 SER 516 -4.782 -0.998 13.474 265 HG SER 516 HG SER 516 -5.180 -3.464 13.638 266 H ARG 517 H ARG 517 -4.316 -0.269 10.550 267 HA ARG 517 HA ARG 517 -7.087 -1.002 10.011 268 HB2 ARG 517 HB2 ARG 517 -7.301 1.240 9.073 269 HB3 ARG 517 HB3 ARG 517 -6.595 1.309 10.682 270 HG2 ARG 517 HG2 ARG 517 -4.344 1.451 9.574 271 HG3 ARG 517 HG3 ARG 517 -5.199 1.652 8.043 272 HD2 ARG 517 HD2 ARG 517 -6.339 3.443 9.925 273 HD3 ARG 517 HD3 ARG 517 -4.586 3.609 10.015 274 HE ARG 517 HE ARG 517 -4.590 4.524 7.908 275 HH11 ARG 517 HH11 ARG 517 -7.693 3.086 8.562 276 HH12 ARG 517 HH12 ARG 517 -8.447 3.758 7.154 277 HH21 ARG 517 HH21 ARG 517 -5.571 5.414 6.051 278 HH22 ARG 517 HH22 ARG 517 -7.239 5.080 5.726 279 H TYR 518 H TYR 518 -4.003 -0.665 8.387 280 HA TYR 518 HA TYR 518 -4.913 -0.765 5.729 281 HB2 TYR 518 HB2 TYR 518 -2.461 -0.518 6.961 282 HB3 TYR 518 HB3 TYR 518 -2.347 -2.099 6.197 283 HD1 TYR 518 HD1 TYR 518 -3.435 -2.031 3.678 284 HD2 TYR 518 HD2 TYR 518 -1.600 1.217 5.724 285 HE1 TYR 518 HE1 TYR 518 -2.943 -0.958 1.521 286 HE2 TYR 518 HE2 TYR 518 -1.104 2.299 3.572 287 HH TYR 518 HH TYR 518 -1.090 0.802 0.721 288 H ILE 519 H ILE 519 -4.257 -3.274 8.091 289 HA ILE 519 HA ILE 519 -4.213 -5.502 6.408 290 HB ILE 519 HB ILE 519 -5.252 -5.325 9.238 291 HG12 ILE 519 HG12 ILE 519 -2.601 -6.489 8.586 292 HG13 ILE 519 HG13 ILE 519 -2.748 -4.741 8.449 293 HG21 ILE 519 HG21 ILE 519 -4.461 -7.701 7.562 294 HG22 ILE 519 HG22 ILE 519 -4.727 -7.756 9.304 295 HG23 ILE 519 HG23 ILE 519 -6.056 -7.343 8.223 296 HD11 ILE 519 HD11 ILE 519 -2.957 -6.477 10.859 297 HD12 ILE 519 HD12 ILE 519 -2.037 -4.992 10.613 298 HD13 ILE 519 HD13 ILE 519 -3.787 -4.921 10.825 299 H GLY 520 H GLY 520 -5.779 -6.900 5.651 300 HA2 GLY 520 HA2 GLY 520 -8.326 -5.749 5.074 301 HA3 GLY 520 HA3 GLY 520 -7.808 -7.379 4.672 302 H ASN 521 H ASN 521 -9.030 -8.899 5.545 303 HA ASN 521 HA ASN 521 -10.593 -8.284 7.932 304 HB2 ASN 521 HB2 ASN 521 -10.704 -10.647 6.043 305 HB3 ASN 521 HB3 ASN 521 -11.793 -10.390 7.404 306 HD21 ASN 521 HD21 ASN 521 -10.735 -9.093 4.318 307 HD22 ASN 521 HD22 ASN 521 -12.187 -8.221 3.977 308 H ILE 522 H ILE 522 -9.988 -8.930 9.883 309 HA ILE 522 HA ILE 522 -8.052 -11.144 10.090 310 HB ILE 522 HB ILE 522 -8.424 -8.902 12.076 311 HG12 ILE 522 HG12 ILE 522 -5.889 -8.721 10.881 312 HG13 ILE 522 HG13 ILE 522 -7.016 -8.958 9.550 313 HG21 ILE 522 HG21 ILE 522 -6.925 -9.931 13.381 314 HG22 ILE 522 HG22 ILE 522 -7.306 -11.369 12.436 315 HG23 ILE 522 HG23 ILE 522 -5.906 -10.384 12.015 316 HD11 ILE 522 HD11 ILE 522 -7.420 -6.786 9.635 317 HD12 ILE 522 HD12 ILE 522 -8.222 -7.057 11.183 318 HD13 ILE 522 HD13 ILE 522 -6.515 -6.616 11.139 319 H LYS 523 H LYS 523 -8.583 -12.870 11.279 320 HA LYS 523 HA LYS 523 -10.970 -12.687 12.998 321 HB2 LYS 523 HB2 LYS 523 -11.183 -13.993 10.787 322 HB3 LYS 523 HB3 LYS 523 -10.155 -15.198 11.553 323 HG2 LYS 523 HG2 LYS 523 -11.913 -15.089 13.466 324 HG3 LYS 523 HG3 LYS 523 -12.950 -14.393 12.218 325 HD2 LYS 523 HD2 LYS 523 -12.096 -16.461 10.828 326 HD3 LYS 523 HD3 LYS 523 -11.803 -17.136 12.433 327 HE2 LYS 523 HE2 LYS 523 -14.237 -16.352 12.910 328 HE3 LYS 523 HE3 LYS 523 -14.385 -16.329 11.153 329 HZ1 LYS 523 HZ1 LYS 523 -13.407 -18.702 12.631 330 HZ2 LYS 523 HZ2 LYS 523 -13.947 -18.619 11.030 331 HZ3 LYS 523 HZ3 LYS 523 -15.048 -18.452 12.304 332 H LEU 524 H LEU 524 -11.000 -14.023 14.863 333 HA LEU 524 HA LEU 524 -8.513 -15.365 15.591 334 HB2 LEU 524 HB2 LEU 524 -8.459 -12.948 16.346 335 HB3 LEU 524 HB3 LEU 524 -9.781 -13.358 17.437 336 HG LEU 524 HG LEU 524 -7.493 -13.299 18.472 337 HD11 LEU 524 HD11 LEU 524 -8.025 -14.951 19.975 338 HD12 LEU 524 HD12 LEU 524 -8.580 -16.063 18.724 339 HD13 LEU 524 HD13 LEU 524 -9.585 -14.691 19.193 340 HD21 LEU 524 HD21 LEU 524 -5.910 -14.969 18.029 341 HD22 LEU 524 HD22 LEU 524 -6.440 -14.423 16.438 342 HD23 LEU 524 HD23 LEU 524 -7.058 -15.936 17.103 343 H PHE 525 H PHE 525 -9.607 -17.317 15.567 344 HA PHE 525 HA PHE 525 -11.969 -17.636 17.239 345 HB2 PHE 525 HB2 PHE 525 -11.121 -18.831 14.875 346 HB3 PHE 525 HB3 PHE 525 -10.891 -20.084 16.091 347 HD1 PHE 525 HD1 PHE 525 -12.639 -21.523 16.405 348 HD2 PHE 525 HD2 PHE 525 -13.460 -17.527 15.189 349 HE1 PHE 525 HE1 PHE 525 -15.042 -22.045 16.321 350 HE2 PHE 525 HE2 PHE 525 -15.864 -18.043 15.104 351 HZ PHE 525 HZ PHE 525 -16.658 -20.304 15.671 352 H ALA 526 H ALA 526 -11.687 -20.232 18.110 353 HA ALA 526 HA ALA 526 -10.174 -19.884 20.478 354 HB1 ALA 526 HB1 ALA 526 -11.519 -22.304 19.295 355 HB2 ALA 526 HB2 ALA 526 -10.737 -22.296 20.876 356 HB3 ALA 526 HB3 ALA 526 -12.121 -21.247 20.572 357 H SER 527 H SER 527 -9.656 -21.842 17.563 358 HA SER 527 HA SER 527 -6.808 -21.988 18.261 359 HB2 SER 527 HB2 SER 527 -8.613 -24.282 17.513 360 HB3 SER 527 HB3 SER 527 -6.868 -24.363 17.271 361 HG SER 527 HG SER 527 -6.774 -23.742 19.591 362 H HIS 528 H HIS 528 -8.220 -20.264 16.434 363 HA HIS 528 HA HIS 528 -6.640 -20.781 14.073 364 HB2 HIS 528 HB2 HIS 528 -9.639 -20.938 14.051 365 HB3 HIS 528 HB3 HIS 528 -8.767 -20.389 12.623 366 HD1 HIS 528 HD1 HIS 528 -9.532 -23.427 14.622 367 HD2 HIS 528 HD2 HIS 528 -7.234 -22.377 11.325 368 HE1 HIS 528 HE1 HIS 528 -8.865 -25.601 13.548 369 H SER 529 H SER 529 -6.776 -18.959 12.511 370 HA SER 529 HA SER 529 -8.008 -16.508 13.270 371 HB2 SER 529 HB2 SER 529 -5.484 -15.499 13.401 372 HB3 SER 529 HB3 SER 529 -6.454 -15.913 14.814 373 HG SER 529 HG SER 529 -4.683 -17.058 15.183 374 H THR 530 H THR 530 -8.180 -15.205 11.541 375 HA THR 530 HA THR 530 -6.581 -15.899 9.165 376 HB THR 530 HB THR 530 -8.382 -15.243 7.769 377 HG1 THR 530 HG1 THR 530 -10.343 -14.368 8.799 378 HG21 THR 530 HG21 THR 530 -9.774 -16.984 8.167 379 HG22 THR 530 HG22 THR 530 -10.075 -16.498 9.835 380 HG23 THR 530 HG23 THR 530 -8.596 -17.365 9.422 381 H ILE 531 H ILE 531 -6.180 -14.098 7.645 382 HA ILE 531 HA ILE 531 -6.428 -11.395 8.423 383 HB ILE 531 HB ILE 531 -4.769 -11.899 10.102 384 HG12 ILE 531 HG12 ILE 531 -3.091 -10.572 8.024 385 HG13 ILE 531 HG13 ILE 531 -4.629 -9.824 8.441 386 HG21 ILE 531 HG21 ILE 531 -3.017 -12.897 7.860 387 HG22 ILE 531 HG22 ILE 531 -2.584 -12.801 9.566 388 HG23 ILE 531 HG23 ILE 531 -3.845 -13.915 9.038 389 HD11 ILE 531 HD11 ILE 531 -2.242 -10.298 10.183 390 HD12 ILE 531 HD12 ILE 531 -3.070 -8.783 9.819 391 HD13 ILE 531 HD13 ILE 531 -3.839 -9.980 10.862 392 H GLU 532 H GLU 532 -6.007 -10.056 6.734 393 HA GLU 532 HA GLU 532 -4.763 -11.278 4.358 394 HB2 GLU 532 HB2 GLU 532 -7.190 -10.844 4.117 395 HB3 GLU 532 HB3 GLU 532 -6.899 -9.140 4.438 396 HG2 GLU 532 HG2 GLU 532 -5.901 -8.782 2.400 397 HG3 GLU 532 HG3 GLU 532 -5.446 -10.474 2.206 398 H LEU 533 H LEU 533 -2.878 -10.419 3.821 399 HA LEU 533 HA LEU 533 -2.246 -7.698 4.722 400 HB2 LEU 533 HB2 LEU 533 -0.720 -10.167 4.385 401 HB3 LEU 533 HB3 LEU 533 0.085 -8.743 3.729 402 HG LEU 533 HG LEU 533 0.092 -7.679 5.875 403 HD11 LEU 533 HD11 LEU 533 -1.777 -8.104 7.069 404 HD12 LEU 533 HD12 LEU 533 -0.753 -9.339 7.801 405 HD13 LEU 533 HD13 LEU 533 -1.883 -9.777 6.519 406 HD21 LEU 533 HD21 LEU 533 1.922 -8.816 6.398 407 HD22 LEU 533 HD22 LEU 533 1.410 -10.110 5.314 408 HD23 LEU 533 HD23 LEU 533 0.949 -10.151 7.017 409 HA PRO 534 HA PRO 534 -2.560 -6.220 0.573 410 HB2 PRO 534 HB2 PRO 534 -1.203 -3.892 0.903 411 HB3 PRO 534 HB3 PRO 534 -2.846 -4.140 1.506 412 HG2 PRO 534 HG2 PRO 534 -0.243 -4.299 2.977 413 HG3 PRO 534 HG3 PRO 534 -1.771 -3.555 3.484 414 HD2 PRO 534 HD2 PRO 534 -0.981 -5.997 4.349 415 HD3 PRO 534 HD3 PRO 534 -2.689 -5.573 4.114 416 H LYS 535 H LYS 535 0.281 -7.225 2.079 417 HA LYS 535 HA LYS 535 2.386 -6.391 0.570 418 HB2 LYS 535 HB2 LYS 535 1.873 -9.243 1.433 419 HB3 LYS 535 HB3 LYS 535 3.437 -8.570 0.996 420 HG2 LYS 535 HG2 LYS 535 1.752 -7.620 3.302 421 HG3 LYS 535 HG3 LYS 535 3.091 -8.762 3.432 422 HD2 LYS 535 HD2 LYS 535 3.407 -6.017 2.240 423 HD3 LYS 535 HD3 LYS 535 3.614 -6.336 3.964 424 HE2 LYS 535 HE2 LYS 535 5.107 -7.889 1.872 425 HE3 LYS 535 HE3 LYS 535 5.706 -6.350 2.489 426 HZ1 LYS 535 HZ1 LYS 535 6.713 -7.769 3.926 427 HZ2 LYS 535 HZ2 LYS 535 5.493 -8.937 3.835 428 HZ3 LYS 535 HZ3 LYS 535 5.265 -7.547 4.773 429 H GLY 536 H GLY 536 3.390 -7.015 -1.358 430 HA2 GLY 536 HA2 GLY 536 1.696 -8.585 -3.201 431 HA3 GLY 536 HA3 GLY 536 2.459 -7.083 -3.702 432 H MET 537 H MET 537 3.775 -9.754 -1.770 433 HA MET 537 HA MET 537 5.265 -10.952 -3.825 434 HB2 MET 537 HB2 MET 537 6.343 -8.568 -3.451 435 HB3 MET 537 HB3 MET 537 7.113 -9.373 -2.091 436 HG2 MET 537 HG2 MET 537 8.618 -9.505 -3.899 437 HG3 MET 537 HG3 MET 537 7.922 -11.112 -3.703 438 HE1 MET 537 HE1 MET 537 8.093 -11.511 -7.395 439 HE2 MET 537 HE2 MET 537 8.950 -11.679 -5.863 440 HE3 MET 537 HE3 MET 537 7.365 -12.424 -6.073 441 HA PRO 538 HA PRO 538 4.972 -13.066 0.328 442 HB2 PRO 538 HB2 PRO 538 3.682 -15.268 -0.599 443 HB3 PRO 538 HB3 PRO 538 2.835 -13.810 -0.070 444 HG2 PRO 538 HG2 PRO 538 3.522 -14.701 -2.844 445 HG3 PRO 538 HG3 PRO 538 2.013 -13.993 -2.238 446 HD2 PRO 538 HD2 PRO 538 3.864 -12.546 -3.583 447 HD3 PRO 538 HD3 PRO 538 2.845 -11.845 -2.309 448 H GLY 539 H GLY 539 5.619 -15.455 0.744 449 HA2 GLY 539 HA2 GLY 539 7.035 -17.261 0.358 450 HA3 GLY 539 HA3 GLY 539 7.388 -16.609 -1.235 451 H GLU 540 H GLU 540 7.703 -14.348 1.285 452 HA GLU 540 HA GLU 540 10.552 -14.214 0.877 453 HB2 GLU 540 HB2 GLU 540 8.956 -12.631 2.884 454 HB3 GLU 540 HB3 GLU 540 10.491 -12.203 2.142 455 HG2 GLU 540 HG2 GLU 540 9.210 -12.197 -0.070 456 HG3 GLU 540 HG3 GLU 540 7.755 -12.185 0.926 457 H VAL 541 H VAL 541 8.498 -14.570 3.774 458 HA VAL 541 HA VAL 541 10.749 -15.516 5.327 459 HB VAL 541 HB VAL 541 7.839 -15.368 6.124 460 HG11 VAL 541 HG11 VAL 541 10.182 -16.397 7.423 461 HG12 VAL 541 HG12 VAL 541 9.541 -15.024 8.327 462 HG13 VAL 541 HG13 VAL 541 8.506 -16.407 7.970 463 HG21 VAL 541 HG21 VAL 541 10.033 -13.362 6.630 464 HG22 VAL 541 HG22 VAL 541 8.756 -13.178 5.428 465 HG23 VAL 541 HG23 VAL 541 8.351 -13.238 7.143 466 H LEU 542 H LEU 542 7.912 -16.849 3.759 467 HA LEU 542 HA LEU 542 7.945 -19.392 4.973 468 HB2 LEU 542 HB2 LEU 542 6.860 -18.351 2.379 469 HB3 LEU 542 HB3 LEU 542 6.752 -20.061 2.795 470 HG LEU 542 HG LEU 542 5.650 -19.045 4.998 471 HD11 LEU 542 HD11 LEU 542 5.502 -16.899 2.956 472 HD12 LEU 542 HD12 LEU 542 5.593 -16.790 4.714 473 HD13 LEU 542 HD13 LEU 542 4.067 -17.207 3.935 474 HD21 LEU 542 HD21 LEU 542 4.612 -20.691 3.563 475 HD22 LEU 542 HD22 LEU 542 4.259 -19.457 2.354 476 HD23 LEU 542 HD23 LEU 542 3.459 -19.407 3.925 477 H GLN 543 H GLN 543 9.930 -17.959 2.558 478 HA GLN 543 HA GLN 543 10.846 -20.432 1.409 479 HB2 GLN 543 HB2 GLN 543 11.386 -17.553 1.028 480 HB3 GLN 543 HB3 GLN 543 12.732 -18.629 0.676 481 HG2 GLN 543 HG2 GLN 543 10.035 -19.191 -0.471 482 HG3 GLN 543 HG3 GLN 543 11.073 -17.967 -1.201 483 HE21 GLN 543 HE21 GLN 543 10.128 -20.584 -2.192 484 HE22 GLN 543 HE22 GLN 543 11.556 -21.453 -2.625 485 H HIS 544 H HIS 544 12.450 -17.911 3.361 486 HA HIS 544 HA HIS 544 14.713 -19.544 3.929 487 HB2 HIS 544 HB2 HIS 544 13.711 -16.956 5.116 488 HB3 HIS 544 HB3 HIS 544 15.199 -17.736 5.646 489 HD1 HIS 544 HD1 HIS 544 16.671 -15.806 4.805 490 HD2 HIS 544 HD2 HIS 544 14.380 -17.588 1.833 491 HE1 HIS 544 HE1 HIS 544 17.592 -14.935 2.633 492 H PHE 545 H PHE 545 12.052 -18.375 5.998 493 HA PHE 545 HA PHE 545 12.744 -20.358 8.015 494 HB2 PHE 545 HB2 PHE 545 10.574 -18.251 8.047 495 HB3 PHE 545 HB3 PHE 545 11.091 -19.230 9.416 496 HD1 PHE 545 HD1 PHE 545 12.933 -18.605 10.734 497 HD2 PHE 545 HD2 PHE 545 12.167 -16.594 7.061 498 HE1 PHE 545 HE1 PHE 545 14.610 -16.902 11.320 499 HE2 PHE 545 HE2 PHE 545 13.843 -14.889 7.641 500 HZ PHE 545 HZ PHE 545 15.068 -15.042 9.773 501 H THR 546 H THR 546 11.902 -21.552 5.692 502 HA THR 546 HA THR 546 9.139 -22.091 5.554 503 HB THR 546 HB THR 546 10.780 -22.561 3.723 504 HG1 THR 546 HG1 THR 546 9.185 -23.768 3.058 505 HG21 THR 546 HG21 THR 546 11.385 -25.230 4.809 506 HG22 THR 546 HG22 THR 546 12.212 -23.890 5.604 507 HG23 THR 546 HG23 THR 546 12.394 -24.133 3.867 508 H ARG 547 H ARG 547 11.664 -23.338 7.573 509 HA ARG 547 HA ARG 547 9.865 -25.436 8.581 510 HB2 ARG 547 HB2 ARG 547 11.831 -26.518 9.498 511 HB3 ARG 547 HB3 ARG 547 12.081 -26.191 7.788 512 HG2 ARG 547 HG2 ARG 547 14.073 -25.446 8.522 513 HG3 ARG 547 HG3 ARG 547 13.158 -23.968 8.826 514 HD2 ARG 547 HD2 ARG 547 12.931 -24.467 11.124 515 HD3 ARG 547 HD3 ARG 547 13.464 -26.131 10.890 516 HE ARG 547 HE ARG 547 15.127 -23.796 11.180 517 HH11 ARG 547 HH11 ARG 547 14.936 -27.074 10.026 518 HH12 ARG 547 HH12 ARG 547 16.646 -27.340 10.106 519 HH21 ARG 547 HH21 ARG 547 17.380 -24.133 11.291 520 HH22 ARG 547 HH22 ARG 547 18.035 -25.667 10.827 521 H THR 548 H THR 548 10.876 -22.353 9.248 522 HA THR 548 HA THR 548 10.494 -22.716 12.149 523 HB THR 548 HB THR 548 11.981 -20.501 10.723 524 HG1 THR 548 HG1 THR 548 13.110 -22.321 12.561 525 HG21 THR 548 HG21 THR 548 11.556 -21.005 13.671 526 HG22 THR 548 HG22 THR 548 10.880 -19.675 12.731 527 HG23 THR 548 HG23 THR 548 12.621 -19.777 12.988 528 H ARG 549 H ARG 549 8.613 -22.012 12.894 529 HA ARG 549 HA ARG 549 7.496 -19.510 11.949 530 HB2 ARG 549 HB2 ARG 549 6.139 -22.166 11.542 531 HB3 ARG 549 HB3 ARG 549 5.217 -20.674 11.672 532 HG2 ARG 549 HG2 ARG 549 5.452 -20.576 9.455 533 HG3 ARG 549 HG3 ARG 549 7.083 -20.002 9.808 534 HD2 ARG 549 HD2 ARG 549 7.830 -21.736 8.628 535 HD3 ARG 549 HD3 ARG 549 7.286 -22.762 9.955 536 HE ARG 549 HE ARG 549 5.510 -23.451 8.664 537 HH11 ARG 549 HH11 ARG 549 7.085 -20.738 7.154 538 HH12 ARG 549 HH12 ARG 549 6.219 -20.899 5.662 539 HH21 ARG 549 HH21 ARG 549 4.363 -23.673 6.705 540 HH22 ARG 549 HH22 ARG 549 4.670 -22.568 5.408 541 H ILE 550 H ILE 550 5.261 -19.201 13.158 542 HA ILE 550 HA ILE 550 5.005 -20.464 15.704 543 HB ILE 550 HB ILE 550 6.995 -18.777 15.887 544 HG12 ILE 550 HG12 ILE 550 5.239 -18.137 18.107 545 HG13 ILE 550 HG13 ILE 550 5.136 -19.842 17.681 546 HG21 ILE 550 HG21 ILE 550 6.569 -16.556 15.971 547 HG22 ILE 550 HG22 ILE 550 5.237 -17.011 14.911 548 HG23 ILE 550 HG23 ILE 550 4.951 -16.779 16.635 549 HD11 ILE 550 HD11 ILE 550 7.875 -18.953 17.748 550 HD12 ILE 550 HD12 ILE 550 7.050 -18.626 19.273 551 HD13 ILE 550 HD13 ILE 550 7.090 -20.266 18.626 552 H LEU 551 H LEU 551 3.519 -18.888 17.148 553 HA LEU 551 HA LEU 551 1.018 -18.865 16.197 554 HB2 LEU 551 HB2 LEU 551 0.449 -17.125 17.767 555 HB3 LEU 551 HB3 LEU 551 1.635 -18.218 18.480 556 HG LEU 551 HG LEU 551 3.290 -16.320 17.562 557 HD11 LEU 551 HD11 LEU 551 1.317 -14.451 18.595 558 HD12 LEU 551 HD12 LEU 551 0.849 -15.162 17.051 559 HD13 LEU 551 HD13 LEU 551 2.388 -14.315 17.200 560 HD21 LEU 551 HD21 LEU 551 3.082 -15.304 19.879 561 HD22 LEU 551 HD22 LEU 551 3.396 -17.038 19.802 562 HD23 LEU 551 HD23 LEU 551 1.769 -16.450 20.152 563 H ASN 552 H ASN 552 3.380 -16.288 15.642 564 HA ASN 552 HA ASN 552 1.556 -14.688 14.107 565 HB2 ASN 552 HB2 ASN 552 4.083 -14.313 15.309 566 HB3 ASN 552 HB3 ASN 552 4.313 -14.046 13.583 567 HD21 ASN 552 HD21 ASN 552 3.101 -12.414 12.549 568 HD22 ASN 552 HD22 ASN 552 2.431 -11.099 13.448 569 H LYS 553 H LYS 553 4.600 -16.325 13.211 570 HA LYS 553 HA LYS 553 4.218 -16.114 10.440 571 HB2 LYS 553 HB2 LYS 553 5.741 -18.396 11.648 572 HB3 LYS 553 HB3 LYS 553 6.109 -17.457 10.207 573 HG2 LYS 553 HG2 LYS 553 6.413 -16.597 13.073 574 HG3 LYS 553 HG3 LYS 553 7.693 -16.892 11.894 575 HD2 LYS 553 HD2 LYS 553 5.608 -14.715 11.744 576 HD3 LYS 553 HD3 LYS 553 7.302 -14.499 12.191 577 HE2 LYS 553 HE2 LYS 553 7.483 -15.814 9.794 578 HE3 LYS 553 HE3 LYS 553 6.070 -14.788 9.554 579 HZ1 LYS 553 HZ1 LYS 553 7.705 -13.029 10.632 580 HZ2 LYS 553 HZ2 LYS 553 7.674 -13.327 8.968 581 HZ3 LYS 553 HZ3 LYS 553 8.864 -14.044 9.932 582 HA PRO 554 HA PRO 554 1.433 -19.314 9.321 583 HB2 PRO 554 HB2 PRO 554 2.591 -20.386 7.111 584 HB3 PRO 554 HB3 PRO 554 1.839 -18.787 7.121 585 HG2 PRO 554 HG2 PRO 554 4.733 -19.520 7.343 586 HG3 PRO 554 HG3 PRO 554 3.976 -18.225 6.397 587 HD2 PRO 554 HD2 PRO 554 5.192 -17.774 8.774 588 HD3 PRO 554 HD3 PRO 554 3.796 -16.828 8.221 589 H MET 555 H MET 555 2.091 -20.487 11.351 590 HA MET 555 HA MET 555 4.013 -22.537 11.341 591 HB2 MET 555 HB2 MET 555 3.185 -21.769 13.439 592 HB3 MET 555 HB3 MET 555 1.521 -22.114 12.986 593 HG2 MET 555 HG2 MET 555 2.294 -23.764 14.549 594 HG3 MET 555 HG3 MET 555 2.040 -24.513 12.974 595 HE1 MET 555 HE1 MET 555 4.275 -24.901 15.891 596 HE2 MET 555 HE2 MET 555 5.850 -24.282 15.395 597 HE3 MET 555 HE3 MET 555 4.484 -23.179 15.569 598 H ASN 556 H ASN 556 0.472 -22.751 10.955 599 HA ASN 556 HA ASN 556 0.833 -25.008 9.148 600 HB2 ASN 556 HB2 ASN 556 0.533 -25.782 11.613 601 HB3 ASN 556 HB3 ASN 556 -1.147 -25.301 11.390 602 HD21 ASN 556 HD21 ASN 556 -0.830 -27.820 11.983 603 HD22 ASN 556 HD22 ASN 556 -1.014 -28.850 10.608 604 H MET 557 H MET 557 0.103 -22.565 8.325 605 HA MET 557 HA MET 557 -2.816 -22.483 8.192 606 HB2 MET 557 HB2 MET 557 -2.523 -20.280 7.178 607 HB3 MET 557 HB3 MET 557 -1.639 -20.391 8.694 608 HG2 MET 557 HG2 MET 557 -0.004 -19.449 7.477 609 HG3 MET 557 HG3 MET 557 0.300 -21.118 7.002 610 HE1 MET 557 HE1 MET 557 1.340 -20.098 4.028 611 HE2 MET 557 HE2 MET 557 1.094 -21.433 5.154 612 HE3 MET 557 HE3 MET 557 0.197 -21.382 3.636 613 H GLN 558 H GLN 558 -3.549 -21.604 5.883 614 HA GLN 558 HA GLN 558 -2.161 -22.797 3.665 615 HB2 GLN 558 HB2 GLN 558 -3.776 -24.436 3.060 616 HB3 GLN 558 HB3 GLN 558 -3.384 -24.716 4.752 617 HG2 GLN 558 HG2 GLN 558 -5.479 -23.126 5.101 618 HG3 GLN 558 HG3 GLN 558 -5.900 -23.768 3.514 619 HE21 GLN 558 HE21 GLN 558 -4.831 -24.812 6.724 620 HE22 GLN 558 HE22 GLN 558 -5.759 -26.269 6.751 621 H LEU 559 H LEU 559 -2.603 -21.721 1.836 622 HA LEU 559 HA LEU 559 -4.143 -19.385 1.858 623 HB2 LEU 559 HB2 LEU 559 -2.275 -19.797 0.320 624 HB3 LEU 559 HB3 LEU 559 -3.241 -21.013 -0.514 625 HG LEU 559 HG LEU 559 -3.007 -18.683 -1.575 626 HD11 LEU 559 HD11 LEU 559 -4.943 -19.041 -2.731 627 HD12 LEU 559 HD12 LEU 559 -5.872 -19.425 -1.282 628 HD13 LEU 559 HD13 LEU 559 -4.758 -20.614 -1.956 629 HD21 LEU 559 HD21 LEU 559 -3.485 -17.420 0.482 630 HD22 LEU 559 HD22 LEU 559 -5.122 -18.077 0.490 631 HD23 LEU 559 HD23 LEU 559 -4.601 -17.020 -0.823 632 H LEU 560 H LEU 560 -6.263 -19.100 1.772 633 HA LEU 560 HA LEU 560 -7.915 -21.196 0.520 634 HB2 LEU 560 HB2 LEU 560 -9.547 -20.941 2.135 635 HB3 LEU 560 HB3 LEU 560 -8.054 -20.801 3.061 636 HG LEU 560 HG LEU 560 -8.562 -18.194 2.497 637 HD11 LEU 560 HD11 LEU 560 -10.755 -17.682 2.334 638 HD12 LEU 560 HD12 LEU 560 -11.265 -19.066 3.300 639 HD13 LEU 560 HD13 LEU 560 -10.841 -19.285 1.602 640 HD21 LEU 560 HD21 LEU 560 -8.816 -17.980 4.749 641 HD22 LEU 560 HD22 LEU 560 -8.192 -19.629 4.697 642 HD23 LEU 560 HD23 LEU 560 -9.925 -19.346 4.869 643 H GLY 561 H GLY 561 -7.185 -17.814 0.750 644 HA2 GLY 561 HA2 GLY 561 -9.490 -17.073 -0.887 645 HA3 GLY 561 HA3 GLY 561 -8.340 -15.967 -0.151 646 H ASP 562 H ASP 562 -8.253 -14.879 -2.198 647 HA ASP 562 HA ASP 562 -6.106 -15.841 -3.838 648 HB2 ASP 562 HB2 ASP 562 -8.317 -16.940 -4.681 649 HB3 ASP 562 HB3 ASP 562 -8.657 -15.341 -5.338 650 H ALA 563 H ALA 563 -5.294 -14.242 -5.275 651 HA ALA 563 HA ALA 563 -5.618 -11.582 -4.319 652 HB1 ALA 563 HB1 ALA 563 -3.694 -12.958 -5.772 653 HB2 ALA 563 HB2 ALA 563 -4.304 -11.738 -6.890 654 HB3 ALA 563 HB3 ALA 563 -3.660 -11.253 -5.322 655 H GLN 564 H GLN 564 -7.028 -10.079 -4.924 656 HA GLN 564 HA GLN 564 -9.131 -10.522 -6.677 657 HB2 GLN 564 HB2 GLN 564 -8.660 -8.642 -4.865 658 HB3 GLN 564 HB3 GLN 564 -8.166 -7.728 -6.284 659 HG2 GLN 564 HG2 GLN 564 -10.833 -9.091 -6.037 660 HG3 GLN 564 HG3 GLN 564 -10.544 -7.416 -5.570 661 HE21 GLN 564 HE21 GLN 564 -10.259 -5.869 -7.136 662 HE22 GLN 564 HE22 GLN 564 -10.561 -6.159 -8.812 Start of MODEL 18 1 H MET 480 H MET 480 -1.018 2.037 -3.603 2 HA MET 480 HA MET 480 -1.749 -0.547 -2.997 3 HB2 MET 480 HB2 MET 480 -0.835 0.717 -5.568 4 HB3 MET 480 HB3 MET 480 -1.300 -0.977 -5.502 5 HG2 MET 480 HG2 MET 480 -3.512 -0.344 -4.692 6 HG3 MET 480 HG3 MET 480 -3.046 1.354 -4.747 7 HE1 MET 480 HE1 MET 480 -4.422 2.483 -7.701 8 HE2 MET 480 HE2 MET 480 -3.530 2.734 -6.200 9 HE3 MET 480 HE3 MET 480 -2.660 2.580 -7.727 10 H ALA 481 H ALA 481 -0.784 -2.594 -3.345 11 HA ALA 481 HA ALA 481 1.866 -2.822 -2.424 12 HB1 ALA 481 HB1 ALA 481 1.276 -4.939 -2.105 13 HB2 ALA 481 HB2 ALA 481 -0.291 -4.544 -2.812 14 HB3 ALA 481 HB3 ALA 481 1.000 -5.185 -3.829 15 H ASP 482 H ASP 482 3.140 -4.705 -3.912 16 HA ASP 482 HA ASP 482 4.207 -3.123 -6.060 17 HB2 ASP 482 HB2 ASP 482 5.213 -5.098 -4.391 18 HB3 ASP 482 HB3 ASP 482 5.123 -5.889 -5.962 19 H VAL 483 H VAL 483 2.139 -5.932 -5.750 20 HA VAL 483 HA VAL 483 1.584 -5.774 -8.626 21 HB VAL 483 HB VAL 483 3.117 -7.622 -8.454 22 HG11 VAL 483 HG11 VAL 483 2.760 -8.009 -6.014 23 HG12 VAL 483 HG12 VAL 483 1.269 -8.861 -6.421 24 HG13 VAL 483 HG13 VAL 483 2.822 -9.483 -6.980 25 HG21 VAL 483 HG21 VAL 483 1.890 -9.189 -9.617 26 HG22 VAL 483 HG22 VAL 483 0.475 -9.010 -8.579 27 HG23 VAL 483 HG23 VAL 483 0.861 -7.764 -9.767 28 H GLY 484 H GLY 484 0.612 -7.013 -5.455 29 HA2 GLY 484 HA2 GLY 484 -1.716 -6.298 -4.839 30 HA3 GLY 484 HA3 GLY 484 -2.190 -6.965 -6.394 31 H ASP 485 H ASP 485 0.154 -8.397 -4.195 32 HA ASP 485 HA ASP 485 -1.208 -10.911 -4.268 33 HB2 ASP 485 HB2 ASP 485 1.353 -10.357 -3.988 34 HB3 ASP 485 HB3 ASP 485 0.945 -10.322 -2.275 35 H MET 486 H MET 486 -3.269 -10.058 -3.410 36 HA MET 486 HA MET 486 -3.242 -9.930 -0.466 37 HB2 MET 486 HB2 MET 486 -4.055 -7.894 -1.818 38 HB3 MET 486 HB3 MET 486 -5.470 -8.870 -2.188 39 HG2 MET 486 HG2 MET 486 -6.187 -8.896 0.018 40 HG3 MET 486 HG3 MET 486 -4.598 -8.459 0.640 41 HE1 MET 486 HE1 MET 486 -7.937 -5.788 -0.842 42 HE2 MET 486 HE2 MET 486 -7.037 -6.532 -2.163 43 HE3 MET 486 HE3 MET 486 -7.806 -7.544 -0.940 44 H GLN 487 H GLN 487 -4.037 -11.669 0.500 45 HA GLN 487 HA GLN 487 -6.391 -12.992 -0.571 46 HB2 GLN 487 HB2 GLN 487 -3.955 -14.646 0.069 47 HB3 GLN 487 HB3 GLN 487 -5.448 -15.168 -0.700 48 HG2 GLN 487 HG2 GLN 487 -4.915 -13.901 -2.683 49 HG3 GLN 487 HG3 GLN 487 -3.469 -13.252 -1.912 50 HE21 GLN 487 HE21 GLN 487 -4.154 -15.120 -4.279 51 HE22 GLN 487 HE22 GLN 487 -3.013 -16.404 -4.099 52 H LEU 488 H LEU 488 -6.974 -14.903 0.974 53 HA LEU 488 HA LEU 488 -6.678 -13.881 3.715 54 HB2 LEU 488 HB2 LEU 488 -8.964 -14.035 2.626 55 HB3 LEU 488 HB3 LEU 488 -8.785 -15.785 2.727 56 HG LEU 488 HG LEU 488 -8.524 -15.485 5.226 57 HD11 LEU 488 HD11 LEU 488 -8.799 -12.711 4.401 58 HD12 LEU 488 HD12 LEU 488 -8.215 -13.391 5.920 59 HD13 LEU 488 HD13 LEU 488 -9.945 -13.170 5.661 60 HD21 LEU 488 HD21 LEU 488 -10.751 -15.820 5.511 61 HD22 LEU 488 HD22 LEU 488 -10.686 -15.981 3.756 62 HD23 LEU 488 HD23 LEU 488 -11.203 -14.459 4.484 63 H TYR 489 H TYR 489 -5.363 -14.981 4.994 64 HA TYR 489 HA TYR 489 -5.000 -17.863 4.499 65 HB2 TYR 489 HB2 TYR 489 -3.002 -16.182 5.983 66 HB3 TYR 489 HB3 TYR 489 -2.755 -17.705 5.135 67 HD1 TYR 489 HD1 TYR 489 -2.976 -14.077 4.800 68 HD2 TYR 489 HD2 TYR 489 -2.512 -17.750 2.701 69 HE1 TYR 489 HE1 TYR 489 -2.207 -12.841 2.818 70 HE2 TYR 489 HE2 TYR 489 -1.741 -16.523 0.714 71 HH TYR 489 HH TYR 489 -0.704 -13.422 0.756 72 H ARG 490 H ARG 490 -5.873 -19.128 5.986 73 HA ARG 490 HA ARG 490 -6.414 -18.039 8.653 74 HB2 ARG 490 HB2 ARG 490 -8.008 -19.838 8.910 75 HB3 ARG 490 HB3 ARG 490 -8.298 -19.025 7.378 76 HG2 ARG 490 HG2 ARG 490 -8.398 -21.128 6.598 77 HG3 ARG 490 HG3 ARG 490 -6.640 -20.973 6.557 78 HD2 ARG 490 HD2 ARG 490 -6.752 -21.844 8.992 79 HD3 ARG 490 HD3 ARG 490 -8.371 -22.386 8.551 80 HE ARG 490 HE ARG 490 -6.787 -23.359 6.566 81 HH11 ARG 490 HH11 ARG 490 -6.752 -23.580 10.040 82 HH12 ARG 490 HH12 ARG 490 -6.016 -25.148 10.064 83 HH21 ARG 490 HH21 ARG 490 -5.818 -25.424 6.584 84 HH22 ARG 490 HH22 ARG 490 -5.484 -26.196 8.097 85 H ILE 491 H ILE 491 -5.388 -18.746 10.421 86 HA ILE 491 HA ILE 491 -3.456 -20.936 10.089 87 HB ILE 491 HB ILE 491 -2.230 -20.027 11.946 88 HG12 ILE 491 HG12 ILE 491 -4.453 -17.986 12.174 89 HG13 ILE 491 HG13 ILE 491 -4.143 -19.297 13.306 90 HG21 ILE 491 HG21 ILE 491 -2.532 -17.436 10.788 91 HG22 ILE 491 HG22 ILE 491 -1.244 -18.615 10.549 92 HG23 ILE 491 HG23 ILE 491 -2.678 -18.656 9.523 93 HD11 ILE 491 HD11 ILE 491 -2.279 -17.009 12.721 94 HD12 ILE 491 HD12 ILE 491 -3.315 -17.167 14.140 95 HD13 ILE 491 HD13 ILE 491 -1.997 -18.310 13.878 96 H GLU 492 H GLU 492 -3.051 -22.272 12.057 97 HA GLU 492 HA GLU 492 -5.621 -23.014 13.258 98 HB2 GLU 492 HB2 GLU 492 -4.269 -24.721 11.996 99 HB3 GLU 492 HB3 GLU 492 -3.047 -24.594 13.254 100 HG2 GLU 492 HG2 GLU 492 -4.425 -25.560 14.863 101 HG3 GLU 492 HG3 GLU 492 -5.885 -25.271 13.919 102 H VAL 493 H VAL 493 -4.711 -20.784 14.406 103 HA VAL 493 HA VAL 493 -3.934 -21.710 17.070 104 HB VAL 493 HB VAL 493 -2.648 -19.242 15.933 105 HG11 VAL 493 HG11 VAL 493 -1.748 -21.051 18.165 106 HG12 VAL 493 HG12 VAL 493 -1.157 -19.435 17.774 107 HG13 VAL 493 HG13 VAL 493 -2.788 -19.649 18.412 108 HG21 VAL 493 HG21 VAL 493 -0.587 -20.731 15.708 109 HG22 VAL 493 HG22 VAL 493 -1.710 -22.091 15.742 110 HG23 VAL 493 HG23 VAL 493 -1.828 -20.882 14.464 111 H GLY 494 H GLY 494 -4.992 -20.695 18.687 112 HA2 GLY 494 HA2 GLY 494 -6.321 -18.140 18.130 113 HA3 GLY 494 HA3 GLY 494 -7.314 -19.497 18.638 114 H ARG 495 H ARG 495 -7.810 -17.822 20.347 115 HA ARG 495 HA ARG 495 -5.999 -16.991 22.275 116 HB2 ARG 495 HB2 ARG 495 -8.020 -16.925 23.808 117 HB3 ARG 495 HB3 ARG 495 -8.163 -16.030 22.301 118 HG2 ARG 495 HG2 ARG 495 -9.492 -17.797 21.330 119 HG3 ARG 495 HG3 ARG 495 -9.275 -18.787 22.775 120 HD2 ARG 495 HD2 ARG 495 -11.359 -17.866 23.139 121 HD3 ARG 495 HD3 ARG 495 -10.310 -16.745 24.006 122 HE ARG 495 HE ARG 495 -10.502 -15.657 21.527 123 HH11 ARG 495 HH11 ARG 495 -12.828 -16.716 23.892 124 HH12 ARG 495 HH12 ARG 495 -14.029 -15.561 23.418 125 HH21 ARG 495 HH21 ARG 495 -12.076 -14.131 20.895 126 HH22 ARG 495 HH22 ARG 495 -13.601 -14.092 21.713 127 H ASP 496 H ASP 496 -7.820 -20.012 22.058 128 HA ASP 496 HA ASP 496 -7.039 -21.036 24.578 129 HB2 ASP 496 HB2 ASP 496 -8.930 -21.810 22.953 130 HB3 ASP 496 HB3 ASP 496 -7.667 -22.810 22.241 131 H ASP 497 H ASP 497 -5.366 -20.671 21.632 132 HA ASP 497 HA ASP 497 -3.418 -22.753 22.265 133 HB2 ASP 497 HB2 ASP 497 -4.343 -22.255 19.901 134 HB3 ASP 497 HB3 ASP 497 -3.249 -20.874 19.922 135 H GLY 498 H GLY 498 -3.659 -19.240 21.960 136 HA2 GLY 498 HA2 GLY 498 -2.258 -18.145 23.792 137 HA3 GLY 498 HA3 GLY 498 -0.926 -19.015 23.046 138 H VAL 499 H VAL 499 -3.566 -17.503 21.286 139 HA VAL 499 HA VAL 499 -1.761 -15.353 20.426 140 HB VAL 499 HB VAL 499 -1.859 -17.319 18.771 141 HG11 VAL 499 HG11 VAL 499 -4.540 -17.100 19.084 142 HG12 VAL 499 HG12 VAL 499 -4.298 -16.159 17.610 143 HG13 VAL 499 HG13 VAL 499 -3.760 -17.838 17.685 144 HG21 VAL 499 HG21 VAL 499 -2.717 -14.780 17.465 145 HG22 VAL 499 HG22 VAL 499 -1.231 -14.798 18.414 146 HG23 VAL 499 HG23 VAL 499 -1.409 -15.881 17.034 147 H GLU 500 H GLU 500 -2.786 -13.452 19.722 148 HA GLU 500 HA GLU 500 -5.686 -13.329 20.211 149 HB2 GLU 500 HB2 GLU 500 -3.831 -11.060 20.889 150 HB3 GLU 500 HB3 GLU 500 -5.491 -11.310 21.411 151 HG2 GLU 500 HG2 GLU 500 -4.452 -13.462 22.523 152 HG3 GLU 500 HG3 GLU 500 -2.976 -12.503 22.439 153 H VAL 501 H VAL 501 -6.268 -10.814 19.511 154 HA VAL 501 HA VAL 501 -5.996 -10.877 16.656 155 HB VAL 501 HB VAL 501 -7.266 -8.799 18.444 156 HG11 VAL 501 HG11 VAL 501 -6.666 -8.771 15.637 157 HG12 VAL 501 HG12 VAL 501 -8.413 -8.755 15.885 158 HG13 VAL 501 HG13 VAL 501 -7.404 -7.518 16.635 159 HG21 VAL 501 HG21 VAL 501 -9.300 -9.879 18.146 160 HG22 VAL 501 HG22 VAL 501 -8.731 -10.778 16.739 161 HG23 VAL 501 HG23 VAL 501 -8.173 -11.221 18.353 162 H ARG 502 H ARG 502 -4.615 -9.012 19.287 163 HA ARG 502 HA ARG 502 -3.288 -7.178 17.469 164 HB2 ARG 502 HB2 ARG 502 -2.371 -6.171 19.536 165 HB3 ARG 502 HB3 ARG 502 -4.126 -6.275 19.554 166 HG2 ARG 502 HG2 ARG 502 -4.142 -7.947 21.153 167 HG3 ARG 502 HG3 ARG 502 -2.477 -8.424 20.815 168 HD2 ARG 502 HD2 ARG 502 -1.899 -6.032 21.643 169 HD3 ARG 502 HD3 ARG 502 -3.500 -6.088 22.379 170 HE ARG 502 HE ARG 502 -1.979 -8.403 23.021 171 HH11 ARG 502 HH11 ARG 502 -2.385 -5.035 23.806 172 HH12 ARG 502 HH12 ARG 502 -1.788 -5.206 25.424 173 HH21 ARG 502 HH21 ARG 502 -1.192 -8.640 25.149 174 HH22 ARG 502 HH22 ARG 502 -1.109 -7.257 26.186 175 H HIS 503 H HIS 503 -2.740 -10.268 18.397 176 HA HIS 503 HA HIS 503 0.116 -10.098 18.823 177 HB2 HIS 503 HB2 HIS 503 -1.647 -11.872 19.719 178 HB3 HIS 503 HB3 HIS 503 -1.232 -12.688 18.215 179 HD1 HIS 503 HD1 HIS 503 1.815 -11.996 18.209 180 HD2 HIS 503 HD2 HIS 503 -0.293 -13.499 21.458 181 HE1 HIS 503 HE1 HIS 503 3.534 -13.107 19.670 182 H ILE 504 H ILE 504 -1.953 -11.668 16.376 183 HA ILE 504 HA ILE 504 0.213 -12.122 14.582 184 HB ILE 504 HB ILE 504 -1.355 -13.004 13.073 185 HG12 ILE 504 HG12 ILE 504 -2.833 -10.963 13.115 186 HG13 ILE 504 HG13 ILE 504 -3.695 -12.495 13.027 187 HG21 ILE 504 HG21 ILE 504 -2.792 -14.443 14.451 188 HG22 ILE 504 HG22 ILE 504 -1.154 -14.332 15.093 189 HG23 ILE 504 HG23 ILE 504 -2.460 -13.419 15.848 190 HD11 ILE 504 HD11 ILE 504 -4.080 -12.361 15.465 191 HD12 ILE 504 HD12 ILE 504 -3.329 -10.764 15.458 192 HD13 ILE 504 HD13 ILE 504 -4.820 -11.042 14.558 193 H VAL 505 H VAL 505 -1.965 -9.489 15.137 194 HA VAL 505 HA VAL 505 -1.538 -8.232 12.582 195 HB VAL 505 HB VAL 505 -2.820 -7.248 15.129 196 HG11 VAL 505 HG11 VAL 505 -1.909 -5.763 12.796 197 HG12 VAL 505 HG12 VAL 505 -3.629 -5.546 13.126 198 HG13 VAL 505 HG13 VAL 505 -2.437 -5.181 14.375 199 HG21 VAL 505 HG21 VAL 505 -4.061 -8.963 13.906 200 HG22 VAL 505 HG22 VAL 505 -4.888 -7.406 13.838 201 HG23 VAL 505 HG23 VAL 505 -3.979 -7.983 12.441 202 H GLY 506 H GLY 506 -0.689 -7.308 15.929 203 HA2 GLY 506 HA2 GLY 506 1.023 -5.201 15.231 204 HA3 GLY 506 HA3 GLY 506 1.058 -6.072 16.757 205 H ALA 507 H ALA 507 1.523 -8.605 15.107 206 HA ALA 507 HA ALA 507 4.378 -8.542 15.296 207 HB1 ALA 507 HB1 ALA 507 2.545 -10.678 14.212 208 HB2 ALA 507 HB2 ALA 507 4.265 -10.875 14.553 209 HB3 ALA 507 HB3 ALA 507 3.136 -10.553 15.869 210 H ILE 508 H ILE 508 2.202 -9.249 12.552 211 HA ILE 508 HA ILE 508 4.264 -9.032 10.613 212 HB ILE 508 HB ILE 508 2.456 -9.062 8.947 213 HG12 ILE 508 HG12 ILE 508 0.112 -9.521 10.147 214 HG13 ILE 508 HG13 ILE 508 0.821 -8.464 11.363 215 HG21 ILE 508 HG21 ILE 508 1.587 -11.090 10.931 216 HG22 ILE 508 HG22 ILE 508 2.007 -11.276 9.229 217 HG23 ILE 508 HG23 ILE 508 3.280 -11.096 10.436 218 HD11 ILE 508 HD11 ILE 508 1.237 -7.299 8.806 219 HD12 ILE 508 HD12 ILE 508 -0.461 -7.756 8.956 220 HD13 ILE 508 HD13 ILE 508 0.278 -6.699 10.159 221 H ALA 509 H ALA 509 2.098 -6.752 12.091 222 HA ALA 509 HA ALA 509 2.394 -4.699 10.123 223 HB1 ALA 509 HB1 ALA 509 0.441 -4.716 11.531 224 HB2 ALA 509 HB2 ALA 509 1.439 -4.583 12.980 225 HB3 ALA 509 HB3 ALA 509 1.360 -3.242 11.837 226 H ASN 510 H ASN 510 4.226 -5.754 12.864 227 HA ASN 510 HA ASN 510 5.816 -3.298 12.881 228 HB2 ASN 510 HB2 ASN 510 5.628 -5.657 14.743 229 HB3 ASN 510 HB3 ASN 510 6.959 -4.509 14.848 230 HD21 ASN 510 HD21 ASN 510 6.017 -4.259 17.029 231 HD22 ASN 510 HD22 ASN 510 4.757 -3.095 17.237 232 H GLU 511 H GLU 511 5.924 -6.607 11.868 233 HA GLU 511 HA GLU 511 8.738 -6.880 11.661 234 HB2 GLU 511 HB2 GLU 511 6.381 -8.341 10.540 235 HB3 GLU 511 HB3 GLU 511 7.980 -8.670 9.888 236 HG2 GLU 511 HG2 GLU 511 7.166 -8.935 12.773 237 HG3 GLU 511 HG3 GLU 511 7.376 -10.258 11.628 238 H GLY 512 H GLY 512 6.239 -5.727 9.457 239 HA2 GLY 512 HA2 GLY 512 8.391 -4.836 7.638 240 HA3 GLY 512 HA3 GLY 512 6.884 -5.506 7.033 241 H ASP 513 H ASP 513 6.261 -3.695 5.896 242 HA ASP 513 HA ASP 513 6.036 -1.154 7.302 243 HB2 ASP 513 HB2 ASP 513 6.798 -1.562 4.815 244 HB3 ASP 513 HB3 ASP 513 5.065 -1.567 4.502 245 H ILE 514 H ILE 514 4.148 -3.882 6.717 246 HA ILE 514 HA ILE 514 1.597 -2.943 6.260 247 HB ILE 514 HB ILE 514 2.373 -5.202 8.109 248 HG12 ILE 514 HG12 ILE 514 1.476 -5.481 5.254 249 HG13 ILE 514 HG13 ILE 514 3.167 -5.172 5.634 250 HG21 ILE 514 HG21 ILE 514 0.175 -5.083 8.604 251 HG22 ILE 514 HG22 ILE 514 -0.215 -4.181 7.140 252 HG23 ILE 514 HG23 ILE 514 0.002 -5.930 7.067 253 HD11 ILE 514 HD11 ILE 514 2.529 -7.577 5.295 254 HD12 ILE 514 HD12 ILE 514 3.369 -7.213 6.803 255 HD13 ILE 514 HD13 ILE 514 1.623 -7.466 6.803 256 H SER 515 H SER 515 -0.070 -2.162 7.505 257 HA SER 515 HA SER 515 0.669 -1.270 10.215 258 HB2 SER 515 HB2 SER 515 0.219 0.443 8.278 259 HB3 SER 515 HB3 SER 515 -1.475 0.083 8.614 260 HG SER 515 HG SER 515 0.369 0.853 10.622 261 H SER 516 H SER 516 -1.083 -1.110 11.769 262 HA SER 516 HA SER 516 -2.602 -3.448 11.948 263 HB2 SER 516 HB2 SER 516 -1.905 -1.884 13.838 264 HB3 SER 516 HB3 SER 516 -3.277 -0.875 13.378 265 HG SER 516 HG SER 516 -4.133 -2.198 14.853 266 H ARG 517 H ARG 517 -3.261 -0.438 10.391 267 HA ARG 517 HA ARG 517 -6.107 -1.039 10.130 268 HB2 ARG 517 HB2 ARG 517 -6.207 1.185 8.999 269 HB3 ARG 517 HB3 ARG 517 -5.606 1.252 10.651 270 HG2 ARG 517 HG2 ARG 517 -3.335 1.460 9.858 271 HG3 ARG 517 HG3 ARG 517 -3.874 1.273 8.188 272 HD2 ARG 517 HD2 ARG 517 -4.783 3.376 8.102 273 HD3 ARG 517 HD3 ARG 517 -5.082 3.433 9.839 274 HE ARG 517 HE ARG 517 -2.336 3.406 9.514 275 HH11 ARG 517 HH11 ARG 517 -5.004 5.459 8.628 276 HH12 ARG 517 HH12 ARG 517 -4.063 6.914 8.656 277 HH21 ARG 517 HH21 ARG 517 -1.087 5.314 9.555 278 HH22 ARG 517 HH22 ARG 517 -1.835 6.830 9.182 279 H TYR 518 H TYR 518 -3.176 -0.797 8.200 280 HA TYR 518 HA TYR 518 -4.264 -0.946 5.647 281 HB2 TYR 518 HB2 TYR 518 -1.706 -0.993 6.748 282 HB3 TYR 518 HB3 TYR 518 -1.834 -2.524 5.889 283 HD1 TYR 518 HD1 TYR 518 -3.059 -2.191 3.469 284 HD2 TYR 518 HD2 TYR 518 -0.769 0.730 5.550 285 HE1 TYR 518 HE1 TYR 518 -2.605 -1.041 1.343 286 HE2 TYR 518 HE2 TYR 518 -0.310 1.889 3.429 287 HH TYR 518 HH TYR 518 -1.814 1.844 0.944 288 H ILE 519 H ILE 519 -3.484 -3.529 7.929 289 HA ILE 519 HA ILE 519 -3.832 -5.752 6.336 290 HB ILE 519 HB ILE 519 -4.686 -5.441 9.216 291 HG12 ILE 519 HG12 ILE 519 -2.199 -6.868 8.532 292 HG13 ILE 519 HG13 ILE 519 -2.172 -5.139 8.203 293 HG21 ILE 519 HG21 ILE 519 -4.165 -7.908 7.566 294 HG22 ILE 519 HG22 ILE 519 -4.384 -7.897 9.315 295 HG23 ILE 519 HG23 ILE 519 -5.705 -7.401 8.258 296 HD11 ILE 519 HD11 ILE 519 -3.027 -4.873 10.602 297 HD12 ILE 519 HD12 ILE 519 -2.519 -6.548 10.816 298 HD13 ILE 519 HD13 ILE 519 -1.338 -5.320 10.359 299 H GLY 520 H GLY 520 -5.558 -7.022 5.709 300 HA2 GLY 520 HA2 GLY 520 -8.029 -5.654 5.270 301 HA3 GLY 520 HA3 GLY 520 -7.674 -7.321 4.845 302 H ASN 521 H ASN 521 -8.998 -8.712 5.783 303 HA ASN 521 HA ASN 521 -10.319 -7.979 8.280 304 HB2 ASN 521 HB2 ASN 521 -10.824 -10.081 6.188 305 HB3 ASN 521 HB3 ASN 521 -11.598 -10.171 7.768 306 HD21 ASN 521 HD21 ASN 521 -12.521 -9.619 4.926 307 HD22 ASN 521 HD22 ASN 521 -13.505 -8.207 5.081 308 H ILE 522 H ILE 522 -9.796 -8.821 10.193 309 HA ILE 522 HA ILE 522 -8.014 -11.169 10.235 310 HB ILE 522 HB ILE 522 -8.092 -9.003 12.331 311 HG12 ILE 522 HG12 ILE 522 -5.648 -8.841 11.020 312 HG13 ILE 522 HG13 ILE 522 -6.809 -9.049 9.714 313 HG21 ILE 522 HG21 ILE 522 -6.653 -10.252 13.484 314 HG22 ILE 522 HG22 ILE 522 -7.063 -11.571 12.388 315 HG23 ILE 522 HG23 ILE 522 -5.660 -10.554 12.058 316 HD11 ILE 522 HD11 ILE 522 -7.086 -6.850 9.829 317 HD12 ILE 522 HD12 ILE 522 -7.999 -7.156 11.307 318 HD13 ILE 522 HD13 ILE 522 -6.286 -6.747 11.398 319 H LYS 523 H LYS 523 -8.554 -12.854 11.507 320 HA LYS 523 HA LYS 523 -10.926 -12.547 13.230 321 HB2 LYS 523 HB2 LYS 523 -11.243 -13.900 11.104 322 HB3 LYS 523 HB3 LYS 523 -10.139 -15.082 11.796 323 HG2 LYS 523 HG2 LYS 523 -11.692 -15.253 13.753 324 HG3 LYS 523 HG3 LYS 523 -12.830 -14.250 12.850 325 HD2 LYS 523 HD2 LYS 523 -11.686 -16.812 11.758 326 HD3 LYS 523 HD3 LYS 523 -13.179 -16.755 12.699 327 HE2 LYS 523 HE2 LYS 523 -14.015 -15.053 11.031 328 HE3 LYS 523 HE3 LYS 523 -12.609 -15.452 10.045 329 HZ1 LYS 523 HZ1 LYS 523 -13.665 -17.218 9.268 330 HZ2 LYS 523 HZ2 LYS 523 -15.047 -16.777 10.136 331 HZ3 LYS 523 HZ3 LYS 523 -13.913 -17.823 10.828 332 H LEU 524 H LEU 524 -10.998 -13.822 15.138 333 HA LEU 524 HA LEU 524 -8.547 -15.197 15.925 334 HB2 LEU 524 HB2 LEU 524 -8.450 -12.748 16.593 335 HB3 LEU 524 HB3 LEU 524 -9.768 -13.106 17.708 336 HG LEU 524 HG LEU 524 -7.476 -13.049 18.726 337 HD11 LEU 524 HD11 LEU 524 -8.005 -14.669 20.269 338 HD12 LEU 524 HD12 LEU 524 -8.596 -15.795 19.047 339 HD13 LEU 524 HD13 LEU 524 -9.570 -14.398 19.503 340 HD21 LEU 524 HD21 LEU 524 -6.430 -14.218 16.726 341 HD22 LEU 524 HD22 LEU 524 -7.082 -15.715 17.393 342 HD23 LEU 524 HD23 LEU 524 -5.920 -14.767 18.323 343 H PHE 525 H PHE 525 -9.684 -17.121 15.971 344 HA PHE 525 HA PHE 525 -12.027 -17.307 17.708 345 HB2 PHE 525 HB2 PHE 525 -11.222 -18.614 15.322 346 HB3 PHE 525 HB3 PHE 525 -11.280 -19.836 16.588 347 HD1 PHE 525 HD1 PHE 525 -13.493 -18.913 18.251 348 HD2 PHE 525 HD2 PHE 525 -13.091 -18.968 14.014 349 HE1 PHE 525 HE1 PHE 525 -15.940 -19.031 18.024 350 HE2 PHE 525 HE2 PHE 525 -15.538 -19.086 13.780 351 HZ PHE 525 HZ PHE 525 -16.965 -19.119 15.786 352 H ALA 526 H ALA 526 -11.872 -19.902 18.572 353 HA ALA 526 HA ALA 526 -10.256 -19.675 20.871 354 HB1 ALA 526 HB1 ALA 526 -12.386 -21.203 20.193 355 HB2 ALA 526 HB2 ALA 526 -11.084 -22.391 20.119 356 HB3 ALA 526 HB3 ALA 526 -11.367 -21.485 21.605 357 H SER 527 H SER 527 -9.927 -21.726 17.979 358 HA SER 527 HA SER 527 -7.043 -21.869 18.505 359 HB2 SER 527 HB2 SER 527 -8.708 -24.248 17.651 360 HB3 SER 527 HB3 SER 527 -6.979 -24.237 17.998 361 HG SER 527 HG SER 527 -8.333 -25.009 19.743 362 H HIS 528 H HIS 528 -8.526 -20.218 16.684 363 HA HIS 528 HA HIS 528 -7.113 -20.885 14.259 364 HB2 HIS 528 HB2 HIS 528 -10.085 -21.100 14.474 365 HB3 HIS 528 HB3 HIS 528 -9.393 -20.473 12.981 366 HD1 HIS 528 HD1 HIS 528 -9.954 -23.592 14.865 367 HD2 HIS 528 HD2 HIS 528 -7.765 -22.352 11.559 368 HE1 HIS 528 HE1 HIS 528 -9.266 -25.703 13.684 369 H SER 529 H SER 529 -7.304 -19.146 12.622 370 HA SER 529 HA SER 529 -8.472 -16.643 13.304 371 HB2 SER 529 HB2 SER 529 -6.797 -16.180 14.835 372 HB3 SER 529 HB3 SER 529 -5.590 -17.117 13.956 373 HG SER 529 HG SER 529 -5.915 -14.533 13.884 374 H THR 530 H THR 530 -7.971 -14.962 11.717 375 HA THR 530 HA THR 530 -6.757 -15.976 9.243 376 HB THR 530 HB THR 530 -8.548 -15.212 7.870 377 HG1 THR 530 HG1 THR 530 -10.197 -13.964 8.621 378 HG21 THR 530 HG21 THR 530 -10.032 -16.487 10.145 379 HG22 THR 530 HG22 THR 530 -8.817 -17.390 9.240 380 HG23 THR 530 HG23 THR 530 -10.229 -16.735 8.410 381 H ILE 531 H ILE 531 -6.385 -14.194 7.639 382 HA ILE 531 HA ILE 531 -6.405 -11.482 8.411 383 HB ILE 531 HB ILE 531 -4.685 -12.032 9.987 384 HG12 ILE 531 HG12 ILE 531 -3.171 -10.906 7.642 385 HG13 ILE 531 HG13 ILE 531 -4.463 -9.993 8.414 386 HG21 ILE 531 HG21 ILE 531 -2.584 -13.110 9.319 387 HG22 ILE 531 HG22 ILE 531 -3.976 -14.159 9.053 388 HG23 ILE 531 HG23 ILE 531 -3.224 -13.329 7.690 389 HD11 ILE 531 HD11 ILE 531 -1.948 -10.990 9.728 390 HD12 ILE 531 HD12 ILE 531 -2.327 -9.322 9.296 391 HD13 ILE 531 HD13 ILE 531 -3.258 -10.142 10.549 392 H GLU 532 H GLU 532 -5.868 -10.140 6.723 393 HA GLU 532 HA GLU 532 -4.971 -11.480 4.256 394 HB2 GLU 532 HB2 GLU 532 -7.333 -10.703 4.214 395 HB3 GLU 532 HB3 GLU 532 -6.768 -9.061 4.487 396 HG2 GLU 532 HG2 GLU 532 -6.219 -8.770 2.348 397 HG3 GLU 532 HG3 GLU 532 -5.475 -10.363 2.225 398 H LEU 533 H LEU 533 -3.081 -10.831 3.483 399 HA LEU 533 HA LEU 533 -1.962 -8.292 4.439 400 HB2 LEU 533 HB2 LEU 533 -0.883 -10.916 3.910 401 HB3 LEU 533 HB3 LEU 533 0.002 -9.678 3.020 402 HG LEU 533 HG LEU 533 0.421 -8.492 5.144 403 HD11 LEU 533 HD11 LEU 533 -0.027 -10.462 7.056 404 HD12 LEU 533 HD12 LEU 533 -1.515 -10.399 6.112 405 HD13 LEU 533 HD13 LEU 533 -0.895 -8.936 6.876 406 HD21 LEU 533 HD21 LEU 533 1.878 -10.383 4.128 407 HD22 LEU 533 HD22 LEU 533 1.323 -11.320 5.515 408 HD23 LEU 533 HD23 LEU 533 2.213 -9.817 5.764 409 HA PRO 534 HA PRO 534 -2.876 -6.730 0.348 410 HB2 PRO 534 HB2 PRO 534 -2.015 -4.205 0.849 411 HB3 PRO 534 HB3 PRO 534 -3.583 -4.811 1.395 412 HG2 PRO 534 HG2 PRO 534 -1.021 -4.542 2.920 413 HG3 PRO 534 HG3 PRO 534 -2.673 -4.150 3.430 414 HD2 PRO 534 HD2 PRO 534 -1.424 -6.436 4.169 415 HD3 PRO 534 HD3 PRO 534 -3.179 -6.346 3.916 416 H LYS 535 H LYS 535 0.092 -7.229 1.871 417 HA LYS 535 HA LYS 535 1.976 -5.893 0.394 418 HB2 LYS 535 HB2 LYS 535 2.117 -8.779 1.286 419 HB3 LYS 535 HB3 LYS 535 3.492 -7.775 0.845 420 HG2 LYS 535 HG2 LYS 535 1.703 -6.776 2.985 421 HG3 LYS 535 HG3 LYS 535 2.750 -8.146 3.361 422 HD2 LYS 535 HD2 LYS 535 4.114 -6.382 3.925 423 HD3 LYS 535 HD3 LYS 535 4.592 -6.651 2.248 424 HE2 LYS 535 HE2 LYS 535 3.576 -4.741 1.510 425 HE3 LYS 535 HE3 LYS 535 2.352 -4.772 2.778 426 HZ1 LYS 535 HZ1 LYS 535 3.556 -3.312 3.898 427 HZ2 LYS 535 HZ2 LYS 535 4.759 -3.329 2.710 428 HZ3 LYS 535 HZ3 LYS 535 4.832 -4.418 4.002 429 H GLY 536 H GLY 536 3.208 -6.399 -1.478 430 HA2 GLY 536 HA2 GLY 536 1.868 -8.253 -3.347 431 HA3 GLY 536 HA3 GLY 536 2.365 -6.644 -3.850 432 H MET 537 H MET 537 4.010 -9.138 -1.914 433 HA MET 537 HA MET 537 5.791 -9.963 -3.921 434 HB2 MET 537 HB2 MET 537 6.448 -7.465 -3.354 435 HB3 MET 537 HB3 MET 537 7.259 -8.222 -1.989 436 HG2 MET 537 HG2 MET 537 8.386 -9.733 -3.678 437 HG3 MET 537 HG3 MET 537 7.768 -8.641 -4.914 438 HE1 MET 537 HE1 MET 537 10.749 -6.880 -5.488 439 HE2 MET 537 HE2 MET 537 9.202 -7.572 -5.977 440 HE3 MET 537 HE3 MET 537 9.265 -5.948 -5.291 441 HA PRO 538 HA PRO 538 5.596 -12.340 0.094 442 HB2 PRO 538 HB2 PRO 538 4.727 -14.656 -1.024 443 HB3 PRO 538 HB3 PRO 538 3.630 -13.381 -0.481 444 HG2 PRO 538 HG2 PRO 538 4.607 -13.989 -3.245 445 HG3 PRO 538 HG3 PRO 538 2.973 -13.560 -2.705 446 HD2 PRO 538 HD2 PRO 538 4.646 -11.766 -3.851 447 HD3 PRO 538 HD3 PRO 538 3.458 -11.309 -2.614 448 H GLY 539 H GLY 539 6.398 -14.866 0.156 449 HA2 GLY 539 HA2 GLY 539 8.071 -16.401 -0.425 450 HA3 GLY 539 HA3 GLY 539 8.666 -15.264 -1.625 451 H GLU 540 H GLU 540 8.237 -13.487 1.086 452 HA GLU 540 HA GLU 540 11.066 -13.423 1.631 453 HB2 GLU 540 HB2 GLU 540 8.972 -11.952 3.208 454 HB3 GLU 540 HB3 GLU 540 10.641 -11.492 2.904 455 HG2 GLU 540 HG2 GLU 540 9.960 -11.311 0.452 456 HG3 GLU 540 HG3 GLU 540 8.300 -11.369 1.040 457 H VAL 541 H VAL 541 8.167 -13.990 3.631 458 HA VAL 541 HA VAL 541 9.740 -15.032 5.805 459 HB VAL 541 HB VAL 541 6.742 -15.112 5.441 460 HG11 VAL 541 HG11 VAL 541 6.630 -15.465 7.812 461 HG12 VAL 541 HG12 VAL 541 7.699 -16.685 7.116 462 HG13 VAL 541 HG13 VAL 541 8.378 -15.296 7.966 463 HG21 VAL 541 HG21 VAL 541 8.587 -12.955 6.218 464 HG22 VAL 541 HG22 VAL 541 6.959 -12.870 5.545 465 HG23 VAL 541 HG23 VAL 541 7.186 -13.169 7.268 466 H LEU 542 H LEU 542 7.850 -16.332 3.161 467 HA LEU 542 HA LEU 542 7.679 -18.996 4.108 468 HB2 LEU 542 HB2 LEU 542 7.622 -17.949 1.281 469 HB3 LEU 542 HB3 LEU 542 7.139 -19.568 1.783 470 HG LEU 542 HG LEU 542 5.763 -16.972 2.459 471 HD11 LEU 542 HD11 LEU 542 3.890 -18.018 1.225 472 HD12 LEU 542 HD12 LEU 542 4.964 -19.343 0.780 473 HD13 LEU 542 HD13 LEU 542 5.303 -17.707 0.216 474 HD21 LEU 542 HD21 LEU 542 4.052 -18.568 3.469 475 HD22 LEU 542 HD22 LEU 542 5.523 -18.272 4.396 476 HD23 LEU 542 HD23 LEU 542 5.345 -19.767 3.475 477 H GLN 543 H GLN 543 10.215 -17.175 2.664 478 HA GLN 543 HA GLN 543 11.707 -19.479 1.761 479 HB2 GLN 543 HB2 GLN 543 12.056 -16.534 1.686 480 HB3 GLN 543 HB3 GLN 543 13.523 -17.503 1.669 481 HG2 GLN 543 HG2 GLN 543 11.257 -17.976 -0.241 482 HG3 GLN 543 HG3 GLN 543 12.561 -16.838 -0.573 483 HE21 GLN 543 HE21 GLN 543 14.758 -17.703 -0.543 484 HE22 GLN 543 HE22 GLN 543 15.020 -19.325 -1.077 485 H HIS 544 H HIS 544 12.328 -16.919 4.170 486 HA HIS 544 HA HIS 544 14.450 -18.362 5.407 487 HB2 HIS 544 HB2 HIS 544 12.921 -15.868 6.060 488 HB3 HIS 544 HB3 HIS 544 13.977 -16.583 7.275 489 HD1 HIS 544 HD1 HIS 544 16.471 -16.249 6.998 490 HD2 HIS 544 HD2 HIS 544 14.276 -14.895 3.740 491 HE1 HIS 544 HE1 HIS 544 18.102 -14.970 5.573 492 H PHE 545 H PHE 545 11.154 -17.558 6.511 493 HA PHE 545 HA PHE 545 11.371 -19.516 8.649 494 HB2 PHE 545 HB2 PHE 545 9.388 -17.388 7.923 495 HB3 PHE 545 HB3 PHE 545 8.918 -18.678 9.025 496 HD1 PHE 545 HD1 PHE 545 8.888 -17.925 11.187 497 HD2 PHE 545 HD2 PHE 545 12.026 -16.654 8.608 498 HE1 PHE 545 HE1 PHE 545 9.925 -16.706 13.056 499 HE2 PHE 545 HE2 PHE 545 13.069 -15.433 10.473 500 HZ PHE 545 HZ PHE 545 12.019 -15.459 12.700 501 H THR 546 H THR 546 11.538 -20.743 6.207 502 HA THR 546 HA THR 546 9.049 -21.643 5.189 503 HB THR 546 HB THR 546 11.058 -21.772 3.823 504 HG1 THR 546 HG1 THR 546 10.648 -23.802 3.003 505 HG21 THR 546 HG21 THR 546 12.848 -23.329 4.287 506 HG22 THR 546 HG22 THR 546 12.018 -23.906 5.733 507 HG23 THR 546 HG23 THR 546 12.642 -22.258 5.672 508 H ARG 547 H ARG 547 11.274 -22.897 7.620 509 HA ARG 547 HA ARG 547 9.324 -25.021 8.227 510 HB2 ARG 547 HB2 ARG 547 11.134 -26.338 9.123 511 HB3 ARG 547 HB3 ARG 547 11.568 -25.813 7.502 512 HG2 ARG 547 HG2 ARG 547 13.522 -25.363 8.553 513 HG3 ARG 547 HG3 ARG 547 12.697 -23.832 8.856 514 HD2 ARG 547 HD2 ARG 547 12.403 -24.271 11.069 515 HD3 ARG 547 HD3 ARG 547 12.273 -26.011 10.818 516 HE ARG 547 HE ARG 547 14.889 -25.357 10.249 517 HH11 ARG 547 HH11 ARG 547 12.753 -25.121 12.988 518 HH12 ARG 547 HH12 ARG 547 14.023 -25.271 14.157 519 HH21 ARG 547 HH21 ARG 547 16.570 -25.555 11.778 520 HH22 ARG 547 HH22 ARG 547 16.194 -25.517 13.467 521 H THR 548 H THR 548 10.991 -22.255 9.408 522 HA THR 548 HA THR 548 10.313 -22.831 12.189 523 HB THR 548 HB THR 548 11.799 -20.491 10.979 524 HG1 THR 548 HG1 THR 548 13.497 -21.664 12.347 525 HG21 THR 548 HG21 THR 548 12.457 -20.085 13.384 526 HG22 THR 548 HG22 THR 548 11.174 -21.207 13.840 527 HG23 THR 548 HG23 THR 548 10.780 -19.716 12.984 528 H ARG 549 H ARG 549 8.356 -22.310 12.894 529 HA ARG 549 HA ARG 549 7.245 -19.699 12.256 530 HB2 ARG 549 HB2 ARG 549 5.885 -22.303 11.583 531 HB3 ARG 549 HB3 ARG 549 4.991 -20.803 11.792 532 HG2 ARG 549 HG2 ARG 549 5.283 -20.748 9.544 533 HG3 ARG 549 HG3 ARG 549 6.763 -19.925 10.038 534 HD2 ARG 549 HD2 ARG 549 8.071 -21.592 9.305 535 HD3 ARG 549 HD3 ARG 549 7.002 -22.837 9.950 536 HE ARG 549 HE ARG 549 6.997 -21.748 7.273 537 HH11 ARG 549 HH11 ARG 549 5.232 -23.524 9.691 538 HH12 ARG 549 HH12 ARG 549 4.187 -24.300 8.547 539 HH21 ARG 549 HH21 ARG 549 5.628 -22.762 5.756 540 HH22 ARG 549 HH22 ARG 549 4.414 -23.866 6.309 541 H ILE 550 H ILE 550 4.999 -19.541 13.468 542 HA ILE 550 HA ILE 550 4.687 -21.086 15.836 543 HB ILE 550 HB ILE 550 6.721 -19.491 16.253 544 HG12 ILE 550 HG12 ILE 550 4.851 -19.156 18.488 545 HG13 ILE 550 HG13 ILE 550 4.920 -20.802 17.868 546 HG21 ILE 550 HG21 ILE 550 4.694 -17.564 17.223 547 HG22 ILE 550 HG22 ILE 550 6.343 -17.291 16.662 548 HG23 ILE 550 HG23 ILE 550 5.048 -17.561 15.495 549 HD11 ILE 550 HD11 ILE 550 7.354 -20.792 18.175 550 HD12 ILE 550 HD12 ILE 550 7.244 -19.167 18.852 551 HD13 ILE 550 HD13 ILE 550 6.479 -20.521 19.682 552 H LEU 551 H LEU 551 3.246 -19.618 17.460 553 HA LEU 551 HA LEU 551 0.752 -19.416 16.509 554 HB2 LEU 551 HB2 LEU 551 0.210 -17.897 18.274 555 HB3 LEU 551 HB3 LEU 551 1.431 -19.027 18.856 556 HG LEU 551 HG LEU 551 3.041 -17.027 18.129 557 HD11 LEU 551 HD11 LEU 551 0.890 -15.363 19.264 558 HD12 LEU 551 HD12 LEU 551 0.699 -15.833 17.576 559 HD13 LEU 551 HD13 LEU 551 2.143 -14.960 18.090 560 HD21 LEU 551 HD21 LEU 551 2.506 -18.193 20.411 561 HD22 LEU 551 HD22 LEU 551 1.610 -16.706 20.726 562 HD23 LEU 551 HD23 LEU 551 3.338 -16.638 20.374 563 H ASN 552 H ASN 552 3.206 -16.885 16.225 564 HA ASN 552 HA ASN 552 1.440 -15.063 14.879 565 HB2 ASN 552 HB2 ASN 552 3.145 -13.988 16.077 566 HB3 ASN 552 HB3 ASN 552 4.385 -15.087 15.481 567 HD21 ASN 552 HD21 ASN 552 5.712 -13.467 14.745 568 HD22 ASN 552 HD22 ASN 552 5.330 -12.494 13.370 569 H LYS 553 H LYS 553 4.427 -16.702 13.813 570 HA LYS 553 HA LYS 553 4.052 -16.181 11.078 571 HB2 LYS 553 HB2 LYS 553 5.525 -18.609 12.038 572 HB3 LYS 553 HB3 LYS 553 5.910 -17.538 10.697 573 HG2 LYS 553 HG2 LYS 553 6.240 -16.975 13.633 574 HG3 LYS 553 HG3 LYS 553 7.512 -17.185 12.427 575 HD2 LYS 553 HD2 LYS 553 5.479 -14.954 12.487 576 HD3 LYS 553 HD3 LYS 553 7.173 -14.822 12.964 577 HE2 LYS 553 HE2 LYS 553 7.666 -14.316 10.858 578 HE3 LYS 553 HE3 LYS 553 7.186 -15.949 10.399 579 HZ1 LYS 553 HZ1 LYS 553 5.240 -15.236 9.560 580 HZ2 LYS 553 HZ2 LYS 553 6.050 -13.757 9.420 581 HZ3 LYS 553 HZ3 LYS 553 5.024 -14.038 10.735 582 HA PRO 554 HA PRO 554 1.194 -19.184 9.639 583 HB2 PRO 554 HB2 PRO 554 2.326 -20.046 7.327 584 HB3 PRO 554 HB3 PRO 554 1.611 -18.439 7.506 585 HG2 PRO 554 HG2 PRO 554 4.487 -19.258 7.641 586 HG3 PRO 554 HG3 PRO 554 3.760 -17.855 6.837 587 HD2 PRO 554 HD2 PRO 554 4.987 -17.682 9.245 588 HD3 PRO 554 HD3 PRO 554 3.613 -16.651 8.797 589 H MET 555 H MET 555 1.854 -20.565 11.546 590 HA MET 555 HA MET 555 3.712 -22.665 11.269 591 HB2 MET 555 HB2 MET 555 3.001 -22.060 13.463 592 HB3 MET 555 HB3 MET 555 1.309 -22.313 13.057 593 HG2 MET 555 HG2 MET 555 2.075 -24.124 14.424 594 HG3 MET 555 HG3 MET 555 1.760 -24.719 12.796 595 HE1 MET 555 HE1 MET 555 3.846 -24.256 15.629 596 HE2 MET 555 HE2 MET 555 4.270 -25.947 15.367 597 HE3 MET 555 HE3 MET 555 5.505 -24.695 15.222 598 H ASN 556 H ASN 556 0.146 -22.869 11.239 599 HA ASN 556 HA ASN 556 0.355 -24.960 9.189 600 HB2 ASN 556 HB2 ASN 556 -0.021 -25.759 11.676 601 HB3 ASN 556 HB3 ASN 556 -1.683 -25.269 11.357 602 HD21 ASN 556 HD21 ASN 556 0.877 -26.954 9.560 603 HD22 ASN 556 HD22 ASN 556 -0.110 -28.286 9.074 604 H MET 557 H MET 557 -0.197 -22.684 8.193 605 HA MET 557 HA MET 557 -3.121 -22.351 8.161 606 HB2 MET 557 HB2 MET 557 -2.713 -20.106 7.276 607 HB3 MET 557 HB3 MET 557 -1.881 -20.340 8.807 608 HG2 MET 557 HG2 MET 557 -0.192 -19.376 7.673 609 HG3 MET 557 HG3 MET 557 0.092 -21.040 7.168 610 HE1 MET 557 HE1 MET 557 0.883 -20.520 3.918 611 HE2 MET 557 HE2 MET 557 0.676 -21.585 5.308 612 HE3 MET 557 HE3 MET 557 -0.497 -21.616 3.991 613 H GLN 558 H GLN 558 -3.942 -21.526 5.971 614 HA GLN 558 HA GLN 558 -2.511 -22.671 3.702 615 HB2 GLN 558 HB2 GLN 558 -5.391 -23.403 4.218 616 HB3 GLN 558 HB3 GLN 558 -4.324 -24.044 2.975 617 HG2 GLN 558 HG2 GLN 558 -3.877 -24.436 5.922 618 HG3 GLN 558 HG3 GLN 558 -4.753 -25.573 4.899 619 HE21 GLN 558 HE21 GLN 558 -2.737 -26.657 6.113 620 HE22 GLN 558 HE22 GLN 558 -1.364 -26.862 5.085 621 H LEU 559 H LEU 559 -3.434 -22.032 1.625 622 HA LEU 559 HA LEU 559 -4.456 -19.318 1.760 623 HB2 LEU 559 HB2 LEU 559 -2.600 -19.783 0.277 624 HB3 LEU 559 HB3 LEU 559 -3.546 -21.010 -0.563 625 HG LEU 559 HG LEU 559 -3.214 -18.682 -1.650 626 HD11 LEU 559 HD11 LEU 559 -4.901 -20.649 -2.137 627 HD12 LEU 559 HD12 LEU 559 -5.036 -19.095 -2.958 628 HD13 LEU 559 HD13 LEU 559 -6.081 -19.460 -1.586 629 HD21 LEU 559 HD21 LEU 559 -5.688 -17.916 -0.202 630 HD22 LEU 559 HD22 LEU 559 -4.436 -16.905 -0.923 631 HD23 LEU 559 HD23 LEU 559 -4.148 -17.693 0.628 632 H LEU 560 H LEU 560 -6.536 -18.836 1.600 633 HA LEU 560 HA LEU 560 -8.327 -20.762 0.270 634 HB2 LEU 560 HB2 LEU 560 -10.000 -20.333 1.816 635 HB3 LEU 560 HB3 LEU 560 -8.536 -20.387 2.797 636 HG LEU 560 HG LEU 560 -8.643 -17.755 2.376 637 HD11 LEU 560 HD11 LEU 560 -11.016 -18.556 1.213 638 HD12 LEU 560 HD12 LEU 560 -10.605 -16.923 1.735 639 HD13 LEU 560 HD13 LEU 560 -11.501 -17.993 2.813 640 HD21 LEU 560 HD21 LEU 560 -10.532 -18.655 4.453 641 HD22 LEU 560 HD22 LEU 560 -9.100 -17.632 4.582 642 HD23 LEU 560 HD23 LEU 560 -8.928 -19.386 4.500 643 H GLY 561 H GLY 561 -7.427 -17.406 0.680 644 HA2 GLY 561 HA2 GLY 561 -9.543 -16.475 -1.084 645 HA3 GLY 561 HA3 GLY 561 -8.329 -15.480 -0.294 646 H ASP 562 H ASP 562 -8.241 -14.440 -2.429 647 HA ASP 562 HA ASP 562 -6.037 -15.486 -3.944 648 HB2 ASP 562 HB2 ASP 562 -8.310 -16.517 -4.819 649 HB3 ASP 562 HB3 ASP 562 -8.453 -14.954 -5.619 650 H ALA 563 H ALA 563 -5.140 -13.947 -5.399 651 HA ALA 563 HA ALA 563 -5.203 -11.307 -4.526 652 HB1 ALA 563 HB1 ALA 563 -4.404 -11.368 -7.266 653 HB2 ALA 563 HB2 ALA 563 -3.406 -11.197 -5.821 654 HB3 ALA 563 HB3 ALA 563 -3.780 -12.802 -6.449 655 H GLN 564 H GLN 564 -6.661 -9.754 -4.761 656 HA GLN 564 HA GLN 564 -9.056 -9.987 -6.119 657 HB2 GLN 564 HB2 GLN 564 -8.252 -8.252 -4.346 658 HB3 GLN 564 HB3 GLN 564 -7.777 -7.300 -5.746 659 HG2 GLN 564 HG2 GLN 564 -9.918 -6.549 -5.141 660 HG3 GLN 564 HG3 GLN 564 -10.141 -7.551 -6.574 661 HE21 GLN 564 HE21 GLN 564 -10.389 -7.511 -3.067 662 HE22 GLN 564 HE22 GLN 564 -11.605 -8.733 -2.954 Start of MODEL 19 1 H MET 480 H MET 480 -0.710 -0.226 -1.404 2 HA MET 480 HA MET 480 0.946 0.708 -3.592 3 HB2 MET 480 HB2 MET 480 1.090 0.841 -0.607 4 HB3 MET 480 HB3 MET 480 2.556 1.094 -1.545 5 HG2 MET 480 HG2 MET 480 1.693 3.231 -1.168 6 HG3 MET 480 HG3 MET 480 1.259 2.847 -2.832 7 HE1 MET 480 HE1 MET 480 -1.826 4.952 -1.786 8 HE2 MET 480 HE2 MET 480 -0.109 5.230 -1.495 9 HE3 MET 480 HE3 MET 480 -0.653 4.631 -3.063 10 H ALA 481 H ALA 481 0.323 -2.177 -3.264 11 HA ALA 481 HA ALA 481 2.780 -3.430 -2.434 12 HB1 ALA 481 HB1 ALA 481 1.436 -5.177 -2.215 13 HB2 ALA 481 HB2 ALA 481 0.117 -4.269 -2.956 14 HB3 ALA 481 HB3 ALA 481 1.206 -5.221 -3.964 15 H ASP 482 H ASP 482 3.343 -5.335 -4.227 16 HA ASP 482 HA ASP 482 4.509 -3.806 -6.409 17 HB2 ASP 482 HB2 ASP 482 5.456 -5.872 -4.856 18 HB3 ASP 482 HB3 ASP 482 5.033 -6.690 -6.357 19 H VAL 483 H VAL 483 2.156 -6.353 -5.885 20 HA VAL 483 HA VAL 483 1.336 -6.090 -8.693 21 HB VAL 483 HB VAL 483 2.595 -8.145 -8.629 22 HG11 VAL 483 HG11 VAL 483 0.760 -9.122 -6.449 23 HG12 VAL 483 HG12 VAL 483 2.185 -9.930 -7.106 24 HG13 VAL 483 HG13 VAL 483 2.367 -8.459 -6.149 25 HG21 VAL 483 HG21 VAL 483 -0.345 -8.815 -8.569 26 HG22 VAL 483 HG22 VAL 483 0.484 -8.068 -9.935 27 HG23 VAL 483 HG23 VAL 483 0.928 -9.694 -9.416 28 H GLY 484 H GLY 484 0.501 -7.151 -5.422 29 HA2 GLY 484 HA2 GLY 484 -1.610 -6.140 -4.565 30 HA3 GLY 484 HA3 GLY 484 -2.335 -6.642 -6.085 31 H ASP 485 H ASP 485 -0.064 -8.576 -4.232 32 HA ASP 485 HA ASP 485 -1.692 -10.870 -4.302 33 HB2 ASP 485 HB2 ASP 485 0.917 -10.464 -3.793 34 HB3 ASP 485 HB3 ASP 485 0.332 -10.653 -2.142 35 H MET 486 H MET 486 -3.723 -10.468 -3.468 36 HA MET 486 HA MET 486 -3.825 -9.994 -0.561 37 HB2 MET 486 HB2 MET 486 -4.744 -8.093 -1.821 38 HB3 MET 486 HB3 MET 486 -5.866 -9.174 -2.636 39 HG2 MET 486 HG2 MET 486 -6.946 -9.679 -0.520 40 HG3 MET 486 HG3 MET 486 -5.799 -8.640 0.324 41 HE1 MET 486 HE1 MET 486 -5.955 -6.512 0.787 42 HE2 MET 486 HE2 MET 486 -7.115 -5.301 0.241 43 HE3 MET 486 HE3 MET 486 -7.628 -6.579 1.344 44 H GLN 487 H GLN 487 -4.495 -11.707 0.535 45 HA GLN 487 HA GLN 487 -6.709 -13.305 -0.435 46 HB2 GLN 487 HB2 GLN 487 -4.036 -14.587 0.156 47 HB3 GLN 487 HB3 GLN 487 -5.523 -15.434 -0.248 48 HG2 GLN 487 HG2 GLN 487 -5.517 -14.368 -2.455 49 HG3 GLN 487 HG3 GLN 487 -4.005 -13.559 -2.047 50 HE21 GLN 487 HE21 GLN 487 -2.112 -14.669 -2.148 51 HE22 GLN 487 HE22 GLN 487 -1.979 -16.288 -2.734 52 H LEU 488 H LEU 488 -7.125 -15.151 1.236 53 HA LEU 488 HA LEU 488 -6.837 -13.958 3.912 54 HB2 LEU 488 HB2 LEU 488 -9.141 -14.209 2.905 55 HB3 LEU 488 HB3 LEU 488 -8.917 -15.951 3.044 56 HG LEU 488 HG LEU 488 -8.678 -15.671 5.500 57 HD11 LEU 488 HD11 LEU 488 -8.188 -13.627 6.234 58 HD12 LEU 488 HD12 LEU 488 -9.893 -13.247 5.996 59 HD13 LEU 488 HD13 LEU 488 -8.721 -12.871 4.733 60 HD21 LEU 488 HD21 LEU 488 -11.034 -15.352 5.932 61 HD22 LEU 488 HD22 LEU 488 -10.825 -16.272 4.441 62 HD23 LEU 488 HD23 LEU 488 -11.244 -14.560 4.370 63 H TYR 489 H TYR 489 -5.252 -14.922 5.001 64 HA TYR 489 HA TYR 489 -4.895 -17.826 4.710 65 HB2 TYR 489 HB2 TYR 489 -2.888 -16.109 6.105 66 HB3 TYR 489 HB3 TYR 489 -2.643 -17.568 5.151 67 HD1 TYR 489 HD1 TYR 489 -3.184 -13.932 4.995 68 HD2 TYR 489 HD2 TYR 489 -2.331 -17.458 2.772 69 HE1 TYR 489 HE1 TYR 489 -2.559 -12.552 3.058 70 HE2 TYR 489 HE2 TYR 489 -1.703 -16.088 0.829 71 HH TYR 489 HH TYR 489 -2.277 -12.670 0.728 72 H ARG 490 H ARG 490 -5.815 -18.994 6.250 73 HA ARG 490 HA ARG 490 -6.167 -17.830 8.919 74 HB2 ARG 490 HB2 ARG 490 -7.808 -19.605 9.289 75 HB3 ARG 490 HB3 ARG 490 -8.186 -18.693 7.833 76 HG2 ARG 490 HG2 ARG 490 -8.463 -20.738 6.950 77 HG3 ARG 490 HG3 ARG 490 -6.708 -20.674 6.773 78 HD2 ARG 490 HD2 ARG 490 -6.648 -22.558 7.963 79 HD3 ARG 490 HD3 ARG 490 -7.069 -21.569 9.360 80 HE ARG 490 HE ARG 490 -9.161 -22.497 9.343 81 HH11 ARG 490 HH11 ARG 490 -7.601 -23.142 6.298 82 HH12 ARG 490 HH12 ARG 490 -8.840 -24.219 5.743 83 HH21 ARG 490 HH21 ARG 490 -10.798 -23.913 8.623 84 HH22 ARG 490 HH22 ARG 490 -10.659 -24.656 7.066 85 H ILE 491 H ILE 491 -5.094 -18.571 10.646 86 HA ILE 491 HA ILE 491 -3.257 -20.823 10.242 87 HB ILE 491 HB ILE 491 -1.969 -19.989 12.079 88 HG12 ILE 491 HG12 ILE 491 -4.166 -17.945 12.469 89 HG13 ILE 491 HG13 ILE 491 -3.827 -19.305 13.533 90 HG21 ILE 491 HG21 ILE 491 -2.282 -17.346 11.047 91 HG22 ILE 491 HG22 ILE 491 -1.012 -18.523 10.718 92 HG23 ILE 491 HG23 ILE 491 -2.475 -18.509 9.735 93 HD11 ILE 491 HD11 ILE 491 -2.961 -17.202 14.416 94 HD12 ILE 491 HD12 ILE 491 -1.667 -18.354 14.087 95 HD13 ILE 491 HD13 ILE 491 -1.957 -17.014 12.979 96 H GLU 492 H GLU 492 -2.911 -22.314 12.043 97 HA GLU 492 HA GLU 492 -5.455 -23.069 13.238 98 HB2 GLU 492 HB2 GLU 492 -3.812 -24.658 12.029 99 HB3 GLU 492 HB3 GLU 492 -2.882 -24.597 13.520 100 HG2 GLU 492 HG2 GLU 492 -4.191 -26.113 14.448 101 HG3 GLU 492 HG3 GLU 492 -5.616 -25.120 14.146 102 H VAL 493 H VAL 493 -4.690 -20.804 14.421 103 HA VAL 493 HA VAL 493 -4.012 -21.695 17.122 104 HB VAL 493 HB VAL 493 -2.734 -19.207 16.013 105 HG11 VAL 493 HG11 VAL 493 -2.044 -20.932 18.389 106 HG12 VAL 493 HG12 VAL 493 -1.288 -19.402 17.941 107 HG13 VAL 493 HG13 VAL 493 -2.973 -19.436 18.460 108 HG21 VAL 493 HG21 VAL 493 -1.878 -21.000 14.663 109 HG22 VAL 493 HG22 VAL 493 -0.639 -20.537 15.830 110 HG23 VAL 493 HG23 VAL 493 -1.593 -21.998 16.089 111 H GLY 494 H GLY 494 -4.990 -20.530 18.748 112 HA2 GLY 494 HA2 GLY 494 -6.417 -18.075 18.089 113 HA3 GLY 494 HA3 GLY 494 -7.410 -19.449 18.553 114 H ARG 495 H ARG 495 -7.995 -17.734 20.217 115 HA ARG 495 HA ARG 495 -6.285 -16.900 22.233 116 HB2 ARG 495 HB2 ARG 495 -8.369 -16.779 23.652 117 HB3 ARG 495 HB3 ARG 495 -8.458 -15.940 22.109 118 HG2 ARG 495 HG2 ARG 495 -9.725 -17.775 21.154 119 HG3 ARG 495 HG3 ARG 495 -9.590 -18.673 22.667 120 HD2 ARG 495 HD2 ARG 495 -10.848 -15.946 22.497 121 HD3 ARG 495 HD3 ARG 495 -11.767 -17.434 22.272 122 HE ARG 495 HE ARG 495 -10.882 -16.331 24.743 123 HH11 ARG 495 HH11 ARG 495 -11.509 -19.332 23.092 124 HH12 ARG 495 HH12 ARG 495 -11.833 -20.215 24.547 125 HH21 ARG 495 HH21 ARG 495 -11.307 -17.484 26.665 126 HH22 ARG 495 HH22 ARG 495 -11.719 -19.163 26.579 127 H ASP 496 H ASP 496 -8.040 -19.936 21.885 128 HA ASP 496 HA ASP 496 -7.487 -20.955 24.462 129 HB2 ASP 496 HB2 ASP 496 -9.114 -21.763 22.507 130 HB3 ASP 496 HB3 ASP 496 -7.756 -22.832 22.166 131 H ASP 497 H ASP 497 -5.550 -20.583 21.664 132 HA ASP 497 HA ASP 497 -3.605 -22.579 22.534 133 HB2 ASP 497 HB2 ASP 497 -4.392 -21.854 20.043 134 HB3 ASP 497 HB3 ASP 497 -2.968 -20.834 20.235 135 H GLY 498 H GLY 498 -3.921 -19.084 22.110 136 HA2 GLY 498 HA2 GLY 498 -2.724 -17.917 24.050 137 HA3 GLY 498 HA3 GLY 498 -1.304 -18.739 23.423 138 H VAL 499 H VAL 499 -3.857 -17.347 21.446 139 HA VAL 499 HA VAL 499 -2.049 -15.162 20.676 140 HB VAL 499 HB VAL 499 -2.033 -17.133 19.034 141 HG11 VAL 499 HG11 VAL 499 -3.879 -17.735 17.912 142 HG12 VAL 499 HG12 VAL 499 -4.746 -16.938 19.226 143 HG13 VAL 499 HG13 VAL 499 -4.426 -16.070 17.724 144 HG21 VAL 499 HG21 VAL 499 -1.491 -15.700 17.344 145 HG22 VAL 499 HG22 VAL 499 -2.901 -14.675 17.609 146 HG23 VAL 499 HG23 VAL 499 -1.511 -14.559 18.688 147 H GLU 500 H GLU 500 -3.063 -13.283 19.894 148 HA GLU 500 HA GLU 500 -5.985 -13.189 20.250 149 HB2 GLU 500 HB2 GLU 500 -4.187 -10.894 20.989 150 HB3 GLU 500 HB3 GLU 500 -5.868 -11.153 21.432 151 HG2 GLU 500 HG2 GLU 500 -3.496 -12.707 22.436 152 HG3 GLU 500 HG3 GLU 500 -4.429 -11.512 23.335 153 H VAL 501 H VAL 501 -6.552 -10.680 19.500 154 HA VAL 501 HA VAL 501 -6.156 -10.774 16.660 155 HB VAL 501 HB VAL 501 -7.516 -8.683 18.367 156 HG11 VAL 501 HG11 VAL 501 -8.579 -8.636 15.796 157 HG12 VAL 501 HG12 VAL 501 -7.522 -7.428 16.529 158 HG13 VAL 501 HG13 VAL 501 -6.834 -8.732 15.560 159 HG21 VAL 501 HG21 VAL 501 -9.512 -9.795 18.047 160 HG22 VAL 501 HG22 VAL 501 -8.929 -10.653 16.620 161 HG23 VAL 501 HG23 VAL 501 -8.384 -11.139 18.226 162 H ARG 502 H ARG 502 -4.873 -8.905 19.329 163 HA ARG 502 HA ARG 502 -3.496 -7.061 17.556 164 HB2 ARG 502 HB2 ARG 502 -2.617 -6.098 19.691 165 HB3 ARG 502 HB3 ARG 502 -4.372 -6.110 19.575 166 HG2 ARG 502 HG2 ARG 502 -4.568 -7.885 21.104 167 HG3 ARG 502 HG3 ARG 502 -2.849 -8.272 20.994 168 HD2 ARG 502 HD2 ARG 502 -2.234 -6.562 22.375 169 HD3 ARG 502 HD3 ARG 502 -3.597 -5.547 21.903 170 HE ARG 502 HE ARG 502 -4.374 -7.869 23.398 171 HH11 ARG 502 HH11 ARG 502 -3.230 -4.588 23.618 172 HH12 ARG 502 HH12 ARG 502 -3.877 -4.331 25.204 173 HH21 ARG 502 HH21 ARG 502 -5.231 -7.543 25.486 174 HH22 ARG 502 HH22 ARG 502 -5.014 -6.012 26.266 175 H HIS 503 H HIS 503 -2.967 -10.147 18.522 176 HA HIS 503 HA HIS 503 -0.125 -9.961 19.030 177 HB2 HIS 503 HB2 HIS 503 -1.883 -11.727 19.914 178 HB3 HIS 503 HB3 HIS 503 -1.477 -12.554 18.413 179 HD1 HIS 503 HD1 HIS 503 1.617 -11.482 18.693 180 HD2 HIS 503 HD2 HIS 503 -0.586 -13.774 21.369 181 HE1 HIS 503 HE1 HIS 503 3.315 -12.709 20.086 182 H ILE 504 H ILE 504 -2.119 -11.560 16.538 183 HA ILE 504 HA ILE 504 0.092 -12.041 14.813 184 HB ILE 504 HB ILE 504 -1.443 -12.902 13.255 185 HG12 ILE 504 HG12 ILE 504 -2.894 -10.840 13.254 186 HG13 ILE 504 HG13 ILE 504 -3.772 -12.361 13.138 187 HG21 ILE 504 HG21 ILE 504 -2.940 -14.319 14.593 188 HG22 ILE 504 HG22 ILE 504 -1.318 -14.232 15.278 189 HG23 ILE 504 HG23 ILE 504 -2.629 -13.299 15.998 190 HD11 ILE 504 HD11 ILE 504 -4.229 -12.225 15.563 191 HD12 ILE 504 HD12 ILE 504 -3.458 -10.639 15.582 192 HD13 ILE 504 HD13 ILE 504 -4.924 -10.896 14.636 193 H VAL 505 H VAL 505 -2.073 -9.377 15.278 194 HA VAL 505 HA VAL 505 -1.534 -8.137 12.735 195 HB VAL 505 HB VAL 505 -2.896 -7.119 15.227 196 HG11 VAL 505 HG11 VAL 505 -2.477 -5.063 14.465 197 HG12 VAL 505 HG12 VAL 505 -1.885 -5.667 12.916 198 HG13 VAL 505 HG13 VAL 505 -3.615 -5.436 13.171 199 HG21 VAL 505 HG21 VAL 505 -4.258 -7.427 12.610 200 HG22 VAL 505 HG22 VAL 505 -3.862 -8.895 13.503 201 HG23 VAL 505 HG23 VAL 505 -4.879 -7.660 14.244 202 H GLY 506 H GLY 506 -0.793 -7.221 16.109 203 HA2 GLY 506 HA2 GLY 506 0.941 -5.117 15.505 204 HA3 GLY 506 HA3 GLY 506 0.959 -6.038 17.001 205 H ALA 507 H ALA 507 1.450 -8.514 15.275 206 HA ALA 507 HA ALA 507 4.316 -8.407 15.463 207 HB1 ALA 507 HB1 ALA 507 2.944 -10.416 16.037 208 HB2 ALA 507 HB2 ALA 507 2.633 -10.625 14.314 209 HB3 ALA 507 HB3 ALA 507 4.281 -10.733 14.932 210 H ILE 508 H ILE 508 2.086 -9.141 12.771 211 HA ILE 508 HA ILE 508 4.104 -8.963 10.784 212 HB ILE 508 HB ILE 508 2.281 -9.013 9.159 213 HG12 ILE 508 HG12 ILE 508 -0.066 -9.358 10.431 214 HG13 ILE 508 HG13 ILE 508 0.699 -8.229 11.545 215 HG21 ILE 508 HG21 ILE 508 1.820 -10.902 11.463 216 HG22 ILE 508 HG22 ILE 508 1.304 -11.154 9.797 217 HG23 ILE 508 HG23 ILE 508 3.022 -11.103 10.189 218 HD11 ILE 508 HD11 ILE 508 -0.663 -7.640 9.182 219 HD12 ILE 508 HD12 ILE 508 0.253 -6.532 10.204 220 HD13 ILE 508 HD13 ILE 508 1.040 -7.333 8.844 221 H ALA 509 H ALA 509 2.249 -6.617 12.447 222 HA ALA 509 HA ALA 509 2.560 -4.580 10.397 223 HB1 ALA 509 HB1 ALA 509 1.502 -4.210 13.190 224 HB2 ALA 509 HB2 ALA 509 1.250 -3.171 11.788 225 HB3 ALA 509 HB3 ALA 509 0.513 -4.772 11.843 226 H ASN 510 H ASN 510 4.293 -5.784 13.071 227 HA ASN 510 HA ASN 510 5.817 -3.299 13.379 228 HB2 ASN 510 HB2 ASN 510 5.056 -4.303 15.459 229 HB3 ASN 510 HB3 ASN 510 5.807 -5.837 15.027 230 HD21 ASN 510 HD21 ASN 510 6.847 -2.441 15.027 231 HD22 ASN 510 HD22 ASN 510 8.296 -2.710 15.930 232 H GLU 511 H GLU 511 6.006 -6.491 12.079 233 HA GLU 511 HA GLU 511 8.846 -6.693 11.977 234 HB2 GLU 511 HB2 GLU 511 8.506 -8.618 10.602 235 HB3 GLU 511 HB3 GLU 511 7.251 -8.626 11.834 236 HG2 GLU 511 HG2 GLU 511 5.676 -7.676 10.201 237 HG3 GLU 511 HG3 GLU 511 6.935 -7.756 8.970 238 H GLY 512 H GLY 512 6.367 -5.566 9.722 239 HA2 GLY 512 HA2 GLY 512 8.539 -4.551 7.991 240 HA3 GLY 512 HA3 GLY 512 7.003 -5.130 7.364 241 H ASP 513 H ASP 513 6.036 -3.404 6.503 242 HA ASP 513 HA ASP 513 5.993 -0.907 8.059 243 HB2 ASP 513 HB2 ASP 513 5.999 -1.511 5.149 244 HB3 ASP 513 HB3 ASP 513 5.061 -0.115 5.674 245 H ILE 514 H ILE 514 4.107 -3.544 7.164 246 HA ILE 514 HA ILE 514 1.585 -2.539 6.685 247 HB ILE 514 HB ILE 514 2.283 -4.963 8.347 248 HG12 ILE 514 HG12 ILE 514 1.373 -5.108 5.511 249 HG13 ILE 514 HG13 ILE 514 3.034 -4.611 5.817 250 HG21 ILE 514 HG21 ILE 514 0.041 -4.595 8.811 251 HG22 ILE 514 HG22 ILE 514 -0.292 -3.963 7.199 252 HG23 ILE 514 HG23 ILE 514 -0.023 -5.691 7.430 253 HD11 ILE 514 HD11 ILE 514 3.555 -6.659 6.853 254 HD12 ILE 514 HD12 ILE 514 1.857 -7.122 6.962 255 HD13 ILE 514 HD13 ILE 514 2.656 -7.062 5.391 256 H SER 515 H SER 515 -0.130 -1.859 7.929 257 HA SER 515 HA SER 515 0.509 -1.202 10.731 258 HB2 SER 515 HB2 SER 515 0.083 0.642 8.863 259 HB3 SER 515 HB3 SER 515 -1.603 0.302 9.253 260 HG SER 515 HG SER 515 -1.363 1.333 11.064 261 H SER 516 H SER 516 -1.523 -0.883 12.085 262 HA SER 516 HA SER 516 -2.962 -3.312 12.137 263 HB2 SER 516 HB2 SER 516 -2.432 -1.660 14.069 264 HB3 SER 516 HB3 SER 516 -3.897 -0.827 13.550 265 HG SER 516 HG SER 516 -4.430 -2.328 15.127 266 H ARG 517 H ARG 517 -3.526 -0.294 10.567 267 HA ARG 517 HA ARG 517 -6.338 -0.911 10.077 268 HB2 ARG 517 HB2 ARG 517 -6.429 1.312 9.032 269 HB3 ARG 517 HB3 ARG 517 -5.793 1.389 10.670 270 HG2 ARG 517 HG2 ARG 517 -4.214 2.675 9.744 271 HG3 ARG 517 HG3 ARG 517 -3.505 1.138 9.246 272 HD2 ARG 517 HD2 ARG 517 -4.077 1.423 7.073 273 HD3 ARG 517 HD3 ARG 517 -5.576 2.263 7.468 274 HE ARG 517 HE ARG 517 -3.500 3.963 8.158 275 HH11 ARG 517 HH11 ARG 517 -4.746 2.452 5.280 276 HH12 ARG 517 HH12 ARG 517 -4.223 3.725 4.228 277 HH21 ARG 517 HH21 ARG 517 -2.806 5.645 6.783 278 HH22 ARG 517 HH22 ARG 517 -3.119 5.541 5.084 279 H TYR 518 H TYR 518 -3.277 -0.574 8.359 280 HA TYR 518 HA TYR 518 -4.166 -0.741 5.739 281 HB2 TYR 518 HB2 TYR 518 -1.704 -0.708 6.998 282 HB3 TYR 518 HB3 TYR 518 -1.727 -2.281 6.208 283 HD1 TYR 518 HD1 TYR 518 -0.575 -2.256 4.217 284 HD2 TYR 518 HD2 TYR 518 -2.910 1.143 5.264 285 HE1 TYR 518 HE1 TYR 518 0.022 -1.195 2.080 286 HE2 TYR 518 HE2 TYR 518 -2.321 2.213 3.129 287 HH TYR 518 HH TYR 518 -1.579 1.333 0.772 288 H ILE 519 H ILE 519 -3.686 -3.283 8.116 289 HA ILE 519 HA ILE 519 -3.864 -5.508 6.428 290 HB ILE 519 HB ILE 519 -4.786 -5.263 9.294 291 HG12 ILE 519 HG12 ILE 519 -2.245 -6.604 8.535 292 HG13 ILE 519 HG13 ILE 519 -2.278 -4.847 8.434 293 HG21 ILE 519 HG21 ILE 519 -5.755 -7.211 8.223 294 HG22 ILE 519 HG22 ILE 519 -4.167 -7.705 7.639 295 HG23 ILE 519 HG23 ILE 519 -4.508 -7.704 9.369 296 HD11 ILE 519 HD11 ILE 519 -2.788 -6.545 10.860 297 HD12 ILE 519 HD12 ILE 519 -1.433 -5.454 10.570 298 HD13 ILE 519 HD13 ILE 519 -3.055 -4.803 10.799 299 H GLY 520 H GLY 520 -5.565 -6.785 5.742 300 HA2 GLY 520 HA2 GLY 520 -8.041 -5.428 5.283 301 HA3 GLY 520 HA3 GLY 520 -7.656 -7.078 4.818 302 H ASN 521 H ASN 521 -8.973 -8.516 5.692 303 HA ASN 521 HA ASN 521 -10.364 -7.868 8.175 304 HB2 ASN 521 HB2 ASN 521 -10.767 -10.180 6.262 305 HB3 ASN 521 HB3 ASN 521 -11.796 -9.790 7.637 306 HD21 ASN 521 HD21 ASN 521 -10.697 -8.713 4.493 307 HD22 ASN 521 HD22 ASN 521 -12.031 -7.661 4.177 308 H ILE 522 H ILE 522 -9.861 -8.742 10.078 309 HA ILE 522 HA ILE 522 -8.110 -11.113 10.107 310 HB ILE 522 HB ILE 522 -8.054 -8.930 12.185 311 HG12 ILE 522 HG12 ILE 522 -5.654 -8.884 10.740 312 HG13 ILE 522 HG13 ILE 522 -6.919 -8.967 9.519 313 HG21 ILE 522 HG21 ILE 522 -7.205 -11.452 12.430 314 HG22 ILE 522 HG22 ILE 522 -5.772 -10.742 11.689 315 HG23 ILE 522 HG23 ILE 522 -6.395 -10.089 13.204 316 HD11 ILE 522 HD11 ILE 522 -6.993 -6.753 9.729 317 HD12 ILE 522 HD12 ILE 522 -7.882 -7.062 11.220 318 HD13 ILE 522 HD13 ILE 522 -6.143 -6.777 11.273 319 H LYS 523 H LYS 523 -8.810 -12.794 11.260 320 HA LYS 523 HA LYS 523 -11.077 -12.365 13.093 321 HB2 LYS 523 HB2 LYS 523 -11.618 -13.688 11.062 322 HB3 LYS 523 HB3 LYS 523 -10.400 -14.866 11.533 323 HG2 LYS 523 HG2 LYS 523 -11.644 -15.412 13.530 324 HG3 LYS 523 HG3 LYS 523 -12.832 -14.159 13.162 325 HD2 LYS 523 HD2 LYS 523 -13.858 -15.413 11.582 326 HD3 LYS 523 HD3 LYS 523 -12.349 -16.145 11.033 327 HE2 LYS 523 HE2 LYS 523 -12.563 -17.218 13.508 328 HE3 LYS 523 HE3 LYS 523 -14.264 -17.046 13.080 329 HZ1 LYS 523 HZ1 LYS 523 -13.454 -19.191 12.398 330 HZ2 LYS 523 HZ2 LYS 523 -12.197 -18.489 11.511 331 HZ3 LYS 523 HZ3 LYS 523 -13.801 -18.269 11.023 332 H LEU 524 H LEU 524 -11.174 -13.665 14.997 333 HA LEU 524 HA LEU 524 -8.719 -15.060 15.755 334 HB2 LEU 524 HB2 LEU 524 -8.655 -12.636 16.492 335 HB3 LEU 524 HB3 LEU 524 -9.992 -13.028 17.571 336 HG LEU 524 HG LEU 524 -7.717 -12.978 18.633 337 HD11 LEU 524 HD11 LEU 524 -8.808 -15.737 18.896 338 HD12 LEU 524 HD12 LEU 524 -9.830 -14.365 19.325 339 HD13 LEU 524 HD13 LEU 524 -8.286 -14.604 20.143 340 HD21 LEU 524 HD21 LEU 524 -7.302 -15.601 17.217 341 HD22 LEU 524 HD22 LEU 524 -6.167 -14.725 18.243 342 HD23 LEU 524 HD23 LEU 524 -6.600 -14.083 16.658 343 H PHE 525 H PHE 525 -9.830 -17.002 15.732 344 HA PHE 525 HA PHE 525 -12.209 -17.282 17.390 345 HB2 PHE 525 HB2 PHE 525 -11.359 -18.495 15.027 346 HB3 PHE 525 HB3 PHE 525 -11.187 -19.751 16.249 347 HD1 PHE 525 HD1 PHE 525 -12.955 -21.204 16.202 348 HD2 PHE 525 HD2 PHE 525 -13.690 -17.049 15.641 349 HE1 PHE 525 HE1 PHE 525 -15.371 -21.651 16.082 350 HE2 PHE 525 HE2 PHE 525 -16.108 -17.490 15.520 351 HZ PHE 525 HZ PHE 525 -16.951 -19.793 15.740 352 H ALA 526 H ALA 526 -11.973 -19.883 18.258 353 HA ALA 526 HA ALA 526 -10.441 -19.563 20.622 354 HB1 ALA 526 HB1 ALA 526 -12.572 -21.019 20.106 355 HB2 ALA 526 HB2 ALA 526 -11.365 -22.259 19.765 356 HB3 ALA 526 HB3 ALA 526 -11.421 -21.497 21.354 357 H SER 527 H SER 527 -9.989 -21.519 17.698 358 HA SER 527 HA SER 527 -7.143 -21.740 18.373 359 HB2 SER 527 HB2 SER 527 -8.544 -23.855 18.935 360 HB3 SER 527 HB3 SER 527 -8.595 -24.093 17.188 361 HG SER 527 HG SER 527 -6.583 -24.701 17.229 362 H HIS 528 H HIS 528 -8.508 -19.999 16.546 363 HA HIS 528 HA HIS 528 -6.980 -20.586 14.173 364 HB2 HIS 528 HB2 HIS 528 -9.947 -20.840 14.236 365 HB3 HIS 528 HB3 HIS 528 -9.221 -20.088 12.819 366 HD1 HIS 528 HD1 HIS 528 -7.542 -21.603 11.432 367 HD2 HIS 528 HD2 HIS 528 -9.739 -23.579 14.352 368 HE1 HIS 528 HE1 HIS 528 -7.330 -24.050 10.892 369 H SER 529 H SER 529 -7.019 -18.785 12.622 370 HA SER 529 HA SER 529 -8.237 -16.303 13.311 371 HB2 SER 529 HB2 SER 529 -5.691 -15.343 13.485 372 HB3 SER 529 HB3 SER 529 -6.715 -15.695 14.877 373 HG SER 529 HG SER 529 -5.547 -17.955 14.106 374 H THR 530 H THR 530 -8.374 -15.055 11.545 375 HA THR 530 HA THR 530 -6.749 -15.823 9.214 376 HB THR 530 HB THR 530 -8.496 -15.058 7.788 377 HG1 THR 530 HG1 THR 530 -10.409 -14.086 8.748 378 HG21 THR 530 HG21 THR 530 -10.009 -16.718 8.161 379 HG22 THR 530 HG22 THR 530 -10.215 -16.297 9.861 380 HG23 THR 530 HG23 THR 530 -8.799 -17.211 9.343 381 H ILE 531 H ILE 531 -6.387 -13.998 7.629 382 HA ILE 531 HA ILE 531 -6.429 -11.305 8.463 383 HB ILE 531 HB ILE 531 -4.714 -11.910 10.039 384 HG12 ILE 531 HG12 ILE 531 -3.179 -10.659 7.780 385 HG13 ILE 531 HG13 ILE 531 -4.531 -9.806 8.518 386 HG21 ILE 531 HG21 ILE 531 -2.634 -12.965 9.402 387 HG22 ILE 531 HG22 ILE 531 -3.990 -13.981 8.918 388 HG23 ILE 531 HG23 ILE 531 -3.143 -13.011 7.714 389 HD11 ILE 531 HD11 ILE 531 -3.181 -10.463 10.725 390 HD12 ILE 531 HD12 ILE 531 -1.843 -10.381 9.578 391 HD13 ILE 531 HD13 ILE 531 -2.888 -8.981 9.816 392 H GLU 532 H GLU 532 -5.885 -9.919 6.813 393 HA GLU 532 HA GLU 532 -4.856 -11.168 4.350 394 HB2 GLU 532 HB2 GLU 532 -7.312 -10.624 4.298 395 HB3 GLU 532 HB3 GLU 532 -6.879 -8.929 4.472 396 HG2 GLU 532 HG2 GLU 532 -6.163 -8.745 2.339 397 HG3 GLU 532 HG3 GLU 532 -5.564 -10.402 2.280 398 H LEU 533 H LEU 533 -3.102 -10.252 3.508 399 HA LEU 533 HA LEU 533 -2.352 -7.564 4.451 400 HB2 LEU 533 HB2 LEU 533 -0.850 -10.060 4.129 401 HB3 LEU 533 HB3 LEU 533 -0.042 -8.637 3.475 402 HG LEU 533 HG LEU 533 -0.052 -7.573 5.632 403 HD11 LEU 533 HD11 LEU 533 -0.862 -9.392 7.498 404 HD12 LEU 533 HD12 LEU 533 -2.056 -9.617 6.220 405 HD13 LEU 533 HD13 LEU 533 -1.816 -8.021 6.930 406 HD21 LEU 533 HD21 LEU 533 0.836 -10.448 5.846 407 HD22 LEU 533 HD22 LEU 533 1.361 -9.126 6.889 408 HD23 LEU 533 HD23 LEU 533 1.776 -9.116 5.174 409 HA PRO 534 HA PRO 534 -2.769 -6.252 0.248 410 HB2 PRO 534 HB2 PRO 534 -1.519 -3.856 0.506 411 HB3 PRO 534 HB3 PRO 534 -3.152 -4.157 1.111 412 HG2 PRO 534 HG2 PRO 534 -0.553 -4.151 2.597 413 HG3 PRO 534 HG3 PRO 534 -2.115 -3.460 3.073 414 HD2 PRO 534 HD2 PRO 534 -1.222 -5.834 4.021 415 HD3 PRO 534 HD3 PRO 534 -2.946 -5.496 3.765 416 H LYS 535 H LYS 535 0.104 -7.084 1.795 417 HA LYS 535 HA LYS 535 2.172 -6.202 0.254 418 HB2 LYS 535 HB2 LYS 535 1.788 -9.024 1.272 419 HB3 LYS 535 HB3 LYS 535 3.320 -8.324 0.766 420 HG2 LYS 535 HG2 LYS 535 1.636 -7.336 3.058 421 HG3 LYS 535 HG3 LYS 535 3.060 -8.368 3.205 422 HD2 LYS 535 HD2 LYS 535 3.021 -5.594 2.017 423 HD3 LYS 535 HD3 LYS 535 3.583 -6.006 3.639 424 HE2 LYS 535 HE2 LYS 535 5.274 -7.506 2.605 425 HE3 LYS 535 HE3 LYS 535 4.760 -6.930 1.020 426 HZ1 LYS 535 HZ1 LYS 535 5.752 -4.934 1.319 427 HZ2 LYS 535 HZ2 LYS 535 6.755 -5.837 2.340 428 HZ3 LYS 535 HZ3 LYS 535 5.498 -4.911 2.992 429 H GLY 536 H GLY 536 3.180 -6.815 -1.661 430 HA2 GLY 536 HA2 GLY 536 1.643 -8.641 -3.397 431 HA3 GLY 536 HA3 GLY 536 2.173 -7.072 -3.982 432 H MET 537 H MET 537 3.870 -9.502 -2.021 433 HA MET 537 HA MET 537 5.478 -10.512 -4.092 434 HB2 MET 537 HB2 MET 537 6.252 -8.021 -3.765 435 HB3 MET 537 HB3 MET 537 7.098 -8.677 -2.370 436 HG2 MET 537 HG2 MET 537 8.538 -9.917 -3.650 437 HG3 MET 537 HG3 MET 537 7.421 -10.011 -5.009 438 HE1 MET 537 HE1 MET 537 10.784 -9.004 -5.450 439 HE2 MET 537 HE2 MET 537 9.483 -9.817 -6.320 440 HE3 MET 537 HE3 MET 537 10.109 -8.277 -6.909 441 HA PRO 538 HA PRO 538 5.493 -12.644 0.060 442 HB2 PRO 538 HB2 PRO 538 4.504 -14.998 -0.863 443 HB3 PRO 538 HB3 PRO 538 3.472 -13.666 -0.331 444 HG2 PRO 538 HG2 PRO 538 4.261 -14.458 -3.108 445 HG3 PRO 538 HG3 PRO 538 2.674 -13.957 -2.495 446 HD2 PRO 538 HD2 PRO 538 4.310 -12.276 -3.847 447 HD3 PRO 538 HD3 PRO 538 3.212 -11.717 -2.569 448 H GLY 539 H GLY 539 6.245 -15.178 0.228 449 HA2 GLY 539 HA2 GLY 539 7.856 -16.778 -0.320 450 HA3 GLY 539 HA3 GLY 539 8.360 -15.775 -1.672 451 H GLU 540 H GLU 540 8.214 -13.706 0.835 452 HA GLU 540 HA GLU 540 11.071 -13.652 1.133 453 HB2 GLU 540 HB2 GLU 540 9.140 -12.024 2.765 454 HB3 GLU 540 HB3 GLU 540 10.777 -11.614 2.270 455 HG2 GLU 540 HG2 GLU 540 9.861 -11.648 -0.119 456 HG3 GLU 540 HG3 GLU 540 8.269 -11.607 0.635 457 H VAL 541 H VAL 541 8.329 -14.201 3.334 458 HA VAL 541 HA VAL 541 10.073 -14.951 5.507 459 HB VAL 541 HB VAL 541 7.071 -15.226 5.317 460 HG11 VAL 541 HG11 VAL 541 9.008 -15.369 7.615 461 HG12 VAL 541 HG12 VAL 541 7.273 -15.125 7.832 462 HG13 VAL 541 HG13 VAL 541 7.869 -16.601 7.072 463 HG21 VAL 541 HG21 VAL 541 7.252 -12.962 5.157 464 HG22 VAL 541 HG22 VAL 541 7.377 -13.120 6.909 465 HG23 VAL 541 HG23 VAL 541 8.834 -12.921 5.935 466 H LEU 542 H LEU 542 8.139 -16.561 3.075 467 HA LEU 542 HA LEU 542 8.137 -19.141 4.223 468 HB2 LEU 542 HB2 LEU 542 7.647 -18.009 1.521 469 HB3 LEU 542 HB3 LEU 542 7.936 -19.743 1.649 470 HG LEU 542 HG LEU 542 6.039 -19.524 3.504 471 HD11 LEU 542 HD11 LEU 542 4.309 -17.942 2.667 472 HD12 LEU 542 HD12 LEU 542 5.532 -17.236 1.611 473 HD13 LEU 542 HD13 LEU 542 5.728 -17.157 3.362 474 HD21 LEU 542 HD21 LEU 542 6.164 -20.256 0.730 475 HD22 LEU 542 HD22 LEU 542 4.576 -19.591 1.116 476 HD23 LEU 542 HD23 LEU 542 5.205 -20.961 2.032 477 H GLN 543 H GLN 543 10.555 -17.326 2.580 478 HA GLN 543 HA GLN 543 12.133 -19.551 1.713 479 HB2 GLN 543 HB2 GLN 543 12.482 -16.595 1.834 480 HB3 GLN 543 HB3 GLN 543 13.926 -17.588 1.698 481 HG2 GLN 543 HG2 GLN 543 13.261 -18.467 -0.372 482 HG3 GLN 543 HG3 GLN 543 11.604 -17.897 -0.173 483 HE21 GLN 543 HE21 GLN 543 14.677 -16.217 0.313 484 HE22 GLN 543 HE22 GLN 543 14.386 -14.977 -0.853 485 H HIS 544 H HIS 544 12.666 -17.099 4.253 486 HA HIS 544 HA HIS 544 14.760 -18.625 5.470 487 HB2 HIS 544 HB2 HIS 544 13.239 -16.250 6.565 488 HB3 HIS 544 HB3 HIS 544 14.763 -16.881 7.182 489 HD1 HIS 544 HD1 HIS 544 16.008 -17.252 4.245 490 HD2 HIS 544 HD2 HIS 544 14.328 -13.799 5.831 491 HE1 HIS 544 HE1 HIS 544 17.008 -15.354 2.933 492 H PHE 545 H PHE 545 11.470 -17.730 6.514 493 HA PHE 545 HA PHE 545 11.582 -19.677 8.664 494 HB2 PHE 545 HB2 PHE 545 9.671 -17.524 7.847 495 HB3 PHE 545 HB3 PHE 545 9.109 -18.811 8.909 496 HD1 PHE 545 HD1 PHE 545 8.968 -18.068 11.071 497 HD2 PHE 545 HD2 PHE 545 12.284 -16.860 8.691 498 HE1 PHE 545 HE1 PHE 545 9.923 -16.888 13.007 499 HE2 PHE 545 HE2 PHE 545 13.245 -15.678 10.623 500 HZ PHE 545 HZ PHE 545 12.064 -15.690 12.784 501 H THR 546 H THR 546 11.836 -20.949 6.261 502 HA THR 546 HA THR 546 9.386 -21.835 5.144 503 HB THR 546 HB THR 546 11.459 -22.019 3.882 504 HG1 THR 546 HG1 THR 546 9.958 -23.523 3.251 505 HG21 THR 546 HG21 THR 546 12.440 -24.361 5.387 506 HG22 THR 546 HG22 THR 546 12.643 -22.799 6.180 507 HG23 THR 546 HG23 THR 546 13.336 -23.073 4.582 508 H ARG 547 H ARG 547 11.463 -23.062 7.713 509 HA ARG 547 HA ARG 547 9.453 -25.145 8.264 510 HB2 ARG 547 HB2 ARG 547 11.381 -26.245 9.541 511 HB3 ARG 547 HB3 ARG 547 11.455 -26.277 7.784 512 HG2 ARG 547 HG2 ARG 547 13.152 -24.689 7.702 513 HG3 ARG 547 HG3 ARG 547 12.829 -24.123 9.342 514 HD2 ARG 547 HD2 ARG 547 13.898 -25.925 10.316 515 HD3 ARG 547 HD3 ARG 547 13.689 -26.947 8.895 516 HE ARG 547 HE ARG 547 15.867 -25.174 9.436 517 HH11 ARG 547 HH11 ARG 547 13.991 -26.653 6.903 518 HH12 ARG 547 HH12 ARG 547 15.259 -26.554 5.727 519 HH21 ARG 547 HH21 ARG 547 17.544 -25.038 7.896 520 HH22 ARG 547 HH22 ARG 547 17.280 -25.637 6.293 521 H THR 548 H THR 548 11.122 -22.390 9.469 522 HA THR 548 HA THR 548 10.311 -22.898 12.227 523 HB THR 548 HB THR 548 11.848 -20.563 11.071 524 HG1 THR 548 HG1 THR 548 12.947 -22.567 12.724 525 HG21 THR 548 HG21 THR 548 12.411 -20.047 13.390 526 HG22 THR 548 HG22 THR 548 11.420 -21.398 13.943 527 HG23 THR 548 HG23 THR 548 10.664 -20.014 13.154 528 H ARG 549 H ARG 549 8.434 -22.199 12.989 529 HA ARG 549 HA ARG 549 7.351 -19.646 12.132 530 HB2 ARG 549 HB2 ARG 549 5.980 -22.278 11.628 531 HB3 ARG 549 HB3 ARG 549 5.067 -20.784 11.798 532 HG2 ARG 549 HG2 ARG 549 5.329 -20.582 9.596 533 HG3 ARG 549 HG3 ARG 549 6.981 -20.090 9.972 534 HD2 ARG 549 HD2 ARG 549 7.678 -21.817 8.755 535 HD3 ARG 549 HD3 ARG 549 7.037 -22.873 10.013 536 HE ARG 549 HE ARG 549 5.272 -23.401 8.638 537 HH11 ARG 549 HH11 ARG 549 7.014 -20.688 7.325 538 HH12 ARG 549 HH12 ARG 549 6.178 -20.718 5.808 539 HH21 ARG 549 HH21 ARG 549 4.164 -23.451 6.645 540 HH22 ARG 549 HH22 ARG 549 4.556 -22.290 5.422 541 H ILE 550 H ILE 550 5.108 -19.363 13.332 542 HA ILE 550 HA ILE 550 4.785 -20.709 15.817 543 HB ILE 550 HB ILE 550 6.843 -19.120 16.104 544 HG12 ILE 550 HG12 ILE 550 4.957 -18.582 18.294 545 HG13 ILE 550 HG13 ILE 550 5.046 -20.275 17.821 546 HG21 ILE 550 HG21 ILE 550 5.183 -17.233 15.195 547 HG22 ILE 550 HG22 ILE 550 4.865 -17.080 16.922 548 HG23 ILE 550 HG23 ILE 550 6.507 -16.888 16.308 549 HD11 ILE 550 HD11 ILE 550 7.690 -19.264 17.998 550 HD12 ILE 550 HD12 ILE 550 6.814 -18.809 19.460 551 HD13 ILE 550 HD13 ILE 550 6.909 -20.503 18.979 552 H LEU 551 H LEU 551 3.346 -19.149 17.319 553 HA LEU 551 HA LEU 551 0.862 -18.970 16.347 554 HB2 LEU 551 HB2 LEU 551 0.352 -17.275 17.988 555 HB3 LEU 551 HB3 LEU 551 1.473 -18.455 18.663 556 HG LEU 551 HG LEU 551 3.229 -16.597 17.851 557 HD11 LEU 551 HD11 LEU 551 1.091 -14.817 18.888 558 HD12 LEU 551 HD12 LEU 551 1.049 -15.260 17.182 559 HD13 LEU 551 HD13 LEU 551 2.468 -14.451 17.848 560 HD21 LEU 551 HD21 LEU 551 3.255 -17.445 20.056 561 HD22 LEU 551 HD22 LEU 551 1.673 -16.756 20.421 562 HD23 LEU 551 HD23 LEU 551 3.069 -15.698 20.208 563 H ASN 552 H ASN 552 3.336 -16.471 15.936 564 HA ASN 552 HA ASN 552 1.599 -14.730 14.456 565 HB2 ASN 552 HB2 ASN 552 3.422 -13.777 15.747 566 HB3 ASN 552 HB3 ASN 552 4.601 -14.712 14.831 567 HD21 ASN 552 HD21 ASN 552 5.727 -13.017 14.011 568 HD22 ASN 552 HD22 ASN 552 5.071 -11.886 12.881 569 H LYS 553 H LYS 553 4.578 -16.463 13.525 570 HA LYS 553 HA LYS 553 4.237 -16.108 10.759 571 HB2 LYS 553 HB2 LYS 553 5.667 -18.498 11.861 572 HB3 LYS 553 HB3 LYS 553 6.090 -17.486 10.487 573 HG2 LYS 553 HG2 LYS 553 6.392 -16.837 13.406 574 HG3 LYS 553 HG3 LYS 553 7.668 -17.061 12.207 575 HD2 LYS 553 HD2 LYS 553 6.331 -15.082 11.018 576 HD3 LYS 553 HD3 LYS 553 5.895 -14.733 12.692 577 HE2 LYS 553 HE2 LYS 553 8.486 -15.065 13.067 578 HE3 LYS 553 HE3 LYS 553 8.554 -14.647 11.356 579 HZ1 LYS 553 HZ1 LYS 553 7.793 -12.998 13.644 580 HZ2 LYS 553 HZ2 LYS 553 6.985 -12.719 12.185 581 HZ3 LYS 553 HZ3 LYS 553 8.670 -12.584 12.257 582 HA PRO 554 HA PRO 554 1.360 -19.161 9.475 583 HB2 PRO 554 HB2 PRO 554 2.509 -20.185 7.238 584 HB3 PRO 554 HB3 PRO 554 1.813 -18.561 7.304 585 HG2 PRO 554 HG2 PRO 554 4.676 -19.406 7.530 586 HG3 PRO 554 HG3 PRO 554 3.979 -18.048 6.629 587 HD2 PRO 554 HD2 PRO 554 5.178 -17.736 9.037 588 HD3 PRO 554 HD3 PRO 554 3.823 -16.719 8.506 589 H MET 555 H MET 555 1.961 -20.432 11.470 590 HA MET 555 HA MET 555 3.807 -22.543 11.408 591 HB2 MET 555 HB2 MET 555 2.953 -21.836 13.518 592 HB3 MET 555 HB3 MET 555 1.291 -22.115 13.015 593 HG2 MET 555 HG2 MET 555 1.979 -23.850 14.523 594 HG3 MET 555 HG3 MET 555 1.748 -24.526 12.913 595 HE1 MET 555 HE1 MET 555 4.450 -26.792 12.898 596 HE2 MET 555 HE2 MET 555 3.740 -26.701 14.509 597 HE3 MET 555 HE3 MET 555 2.726 -26.470 13.084 598 H ASN 556 H ASN 556 0.251 -22.807 11.197 599 HA ASN 556 HA ASN 556 0.579 -24.925 9.201 600 HB2 ASN 556 HB2 ASN 556 0.216 -25.710 11.708 601 HB3 ASN 556 HB3 ASN 556 -1.467 -25.345 11.335 602 HD21 ASN 556 HD21 ASN 556 -1.466 -27.741 11.842 603 HD22 ASN 556 HD22 ASN 556 -1.285 -28.808 10.495 604 H MET 557 H MET 557 -0.136 -22.376 8.579 605 HA MET 557 HA MET 557 -3.037 -22.217 8.469 606 HB2 MET 557 HB2 MET 557 -2.679 -20.027 7.445 607 HB3 MET 557 HB3 MET 557 -1.749 -20.182 8.930 608 HG2 MET 557 HG2 MET 557 -0.129 -19.299 7.644 609 HG3 MET 557 HG3 MET 557 0.106 -20.986 7.194 610 HE1 MET 557 HE1 MET 557 0.760 -20.365 3.845 611 HE2 MET 557 HE2 MET 557 0.869 -21.326 5.319 612 HE3 MET 557 HE3 MET 557 -0.396 -21.665 4.136 613 H GLN 558 H GLN 558 -3.945 -21.465 6.263 614 HA GLN 558 HA GLN 558 -2.660 -22.790 4.006 615 HB2 GLN 558 HB2 GLN 558 -5.537 -23.386 4.682 616 HB3 GLN 558 HB3 GLN 558 -4.541 -24.143 3.446 617 HG2 GLN 558 HG2 GLN 558 -3.992 -24.360 6.394 618 HG3 GLN 558 HG3 GLN 558 -4.947 -25.528 5.482 619 HE21 GLN 558 HE21 GLN 558 -2.760 -26.384 6.808 620 HE22 GLN 558 HE22 GLN 558 -1.500 -26.792 5.699 621 H LEU 559 H LEU 559 -3.570 -22.191 1.942 622 HA LEU 559 HA LEU 559 -4.564 -19.464 1.978 623 HB2 LEU 559 HB2 LEU 559 -2.691 -20.293 0.495 624 HB3 LEU 559 HB3 LEU 559 -3.921 -21.152 -0.428 625 HG LEU 559 HG LEU 559 -3.151 -18.956 -1.390 626 HD11 LEU 559 HD11 LEU 559 -5.651 -20.151 -1.340 627 HD12 LEU 559 HD12 LEU 559 -5.091 -18.923 -2.475 628 HD13 LEU 559 HD13 LEU 559 -5.975 -18.446 -1.026 629 HD21 LEU 559 HD21 LEU 559 -3.383 -17.010 -0.303 630 HD22 LEU 559 HD22 LEU 559 -3.472 -18.012 1.146 631 HD23 LEU 559 HD23 LEU 559 -4.953 -17.457 0.365 632 H LEU 560 H LEU 560 -6.676 -19.111 2.067 633 HA LEU 560 HA LEU 560 -8.490 -21.026 0.764 634 HB2 LEU 560 HB2 LEU 560 -10.125 -20.511 2.322 635 HB3 LEU 560 HB3 LEU 560 -8.641 -20.515 3.273 636 HG LEU 560 HG LEU 560 -8.777 -17.901 2.676 637 HD11 LEU 560 HD11 LEU 560 -10.747 -17.242 1.909 638 HD12 LEU 560 HD12 LEU 560 -11.537 -17.932 3.326 639 HD13 LEU 560 HD13 LEU 560 -11.305 -18.914 1.880 640 HD21 LEU 560 HD21 LEU 560 -8.880 -19.375 4.911 641 HD22 LEU 560 HD22 LEU 560 -10.520 -18.724 4.917 642 HD23 LEU 560 HD23 LEU 560 -9.136 -17.630 4.893 643 H GLY 561 H GLY 561 -7.473 -17.702 0.891 644 HA2 GLY 561 HA2 GLY 561 -9.674 -16.731 -0.715 645 HA3 GLY 561 HA3 GLY 561 -8.265 -15.812 -0.205 646 H ASP 562 H ASP 562 -8.024 -14.917 -2.278 647 HA ASP 562 HA ASP 562 -6.287 -16.333 -3.991 648 HB2 ASP 562 HB2 ASP 562 -8.617 -17.334 -4.513 649 HB3 ASP 562 HB3 ASP 562 -8.936 -15.795 -5.308 650 H ALA 563 H ALA 563 -5.014 -14.830 -4.837 651 HA ALA 563 HA ALA 563 -5.343 -12.107 -4.536 652 HB1 ALA 563 HB1 ALA 563 -3.808 -12.761 -6.918 653 HB2 ALA 563 HB2 ALA 563 -3.295 -11.996 -5.414 654 HB3 ALA 563 HB3 ALA 563 -3.371 -13.754 -5.527 655 H GLN 564 H GLN 564 -6.665 -10.680 -5.437 656 HA GLN 564 HA GLN 564 -8.583 -11.241 -7.341 657 HB2 GLN 564 HB2 GLN 564 -8.106 -9.131 -5.757 658 HB3 GLN 564 HB3 GLN 564 -7.534 -8.463 -7.280 659 HG2 GLN 564 HG2 GLN 564 -9.774 -7.818 -7.129 660 HG3 GLN 564 HG3 GLN 564 -9.760 -9.169 -8.261 661 HE21 GLN 564 HE21 GLN 564 -11.048 -7.924 -5.399 662 HE22 GLN 564 HE22 GLN 564 -11.935 -9.320 -4.899 Start of MODEL 20 1 H MET 480 H MET 480 1.189 0.373 0.693 2 HA MET 480 HA MET 480 2.213 0.341 -1.781 3 HB2 MET 480 HB2 MET 480 3.564 0.317 0.886 4 HB3 MET 480 HB3 MET 480 4.550 0.239 -0.568 5 HG2 MET 480 HG2 MET 480 2.467 2.342 -0.422 6 HG3 MET 480 HG3 MET 480 3.904 2.528 0.581 7 HE1 MET 480 HE1 MET 480 3.184 4.714 -1.570 8 HE2 MET 480 HE2 MET 480 3.710 4.404 -3.225 9 HE3 MET 480 HE3 MET 480 2.342 3.515 -2.553 10 H ALA 481 H ALA 481 1.621 -1.674 -2.755 11 HA ALA 481 HA ALA 481 3.420 -3.908 -2.077 12 HB1 ALA 481 HB1 ALA 481 1.454 -4.935 -3.734 13 HB2 ALA 481 HB2 ALA 481 1.542 -5.100 -1.979 14 HB3 ALA 481 HB3 ALA 481 0.591 -3.799 -2.696 15 H ASP 482 H ASP 482 3.495 -5.419 -4.214 16 HA ASP 482 HA ASP 482 4.726 -3.702 -6.244 17 HB2 ASP 482 HB2 ASP 482 5.721 -5.903 -5.020 18 HB3 ASP 482 HB3 ASP 482 5.007 -6.638 -6.452 19 H VAL 483 H VAL 483 2.228 -6.117 -5.800 20 HA VAL 483 HA VAL 483 1.244 -5.510 -8.502 21 HB VAL 483 HB VAL 483 2.301 -7.666 -8.708 22 HG11 VAL 483 HG11 VAL 483 1.807 -9.543 -7.318 23 HG12 VAL 483 HG12 VAL 483 2.225 -8.193 -6.262 24 HG13 VAL 483 HG13 VAL 483 0.537 -8.657 -6.476 25 HG21 VAL 483 HG21 VAL 483 -0.074 -7.164 -9.640 26 HG22 VAL 483 HG22 VAL 483 0.561 -8.808 -9.717 27 HG23 VAL 483 HG23 VAL 483 -0.595 -8.367 -8.460 28 H GLY 484 H GLY 484 0.530 -6.775 -5.277 29 HA2 GLY 484 HA2 GLY 484 -1.417 -5.659 -4.192 30 HA3 GLY 484 HA3 GLY 484 -2.285 -5.969 -5.688 31 H ASP 485 H ASP 485 -0.083 -8.314 -4.351 32 HA ASP 485 HA ASP 485 -1.828 -10.447 -4.456 33 HB2 ASP 485 HB2 ASP 485 0.775 -10.254 -3.921 34 HB3 ASP 485 HB3 ASP 485 0.194 -10.437 -2.268 35 H MET 486 H MET 486 -3.815 -10.338 -3.574 36 HA MET 486 HA MET 486 -3.973 -9.815 -0.679 37 HB2 MET 486 HB2 MET 486 -5.042 -8.129 -2.391 38 HB3 MET 486 HB3 MET 486 -6.319 -9.335 -2.472 39 HG2 MET 486 HG2 MET 486 -7.127 -8.794 -0.462 40 HG3 MET 486 HG3 MET 486 -5.522 -8.631 0.248 41 HE1 MET 486 HE1 MET 486 -4.577 -5.576 0.655 42 HE2 MET 486 HE2 MET 486 -6.141 -5.478 1.463 43 HE3 MET 486 HE3 MET 486 -5.252 -7.002 1.444 44 H GLN 487 H GLN 487 -4.541 -11.553 0.436 45 HA GLN 487 HA GLN 487 -6.630 -13.310 -0.538 46 HB2 GLN 487 HB2 GLN 487 -3.908 -14.427 0.149 47 HB3 GLN 487 HB3 GLN 487 -5.325 -15.347 -0.340 48 HG2 GLN 487 HG2 GLN 487 -5.260 -14.288 -2.537 49 HG3 GLN 487 HG3 GLN 487 -3.842 -13.361 -2.048 50 HE21 GLN 487 HE21 GLN 487 -4.254 -15.360 -4.191 51 HE22 GLN 487 HE22 GLN 487 -3.034 -16.556 -3.938 52 H LEU 488 H LEU 488 -6.945 -15.155 1.158 53 HA LEU 488 HA LEU 488 -6.646 -13.967 3.839 54 HB2 LEU 488 HB2 LEU 488 -8.969 -13.988 2.909 55 HB3 LEU 488 HB3 LEU 488 -8.888 -15.748 2.904 56 HG LEU 488 HG LEU 488 -8.490 -15.587 5.410 57 HD11 LEU 488 HD11 LEU 488 -8.440 -12.834 4.791 58 HD12 LEU 488 HD12 LEU 488 -8.306 -13.601 6.373 59 HD13 LEU 488 HD13 LEU 488 -9.888 -13.128 5.755 60 HD21 LEU 488 HD21 LEU 488 -10.910 -15.224 5.869 61 HD22 LEU 488 HD22 LEU 488 -10.591 -16.355 4.554 62 HD23 LEU 488 HD23 LEU 488 -11.103 -14.705 4.194 63 H TYR 489 H TYR 489 -5.165 -15.072 4.933 64 HA TYR 489 HA TYR 489 -5.048 -17.994 4.592 65 HB2 TYR 489 HB2 TYR 489 -2.824 -16.601 5.964 66 HB3 TYR 489 HB3 TYR 489 -2.781 -17.926 4.807 67 HD1 TYR 489 HD1 TYR 489 -2.949 -14.270 5.183 68 HD2 TYR 489 HD2 TYR 489 -2.586 -17.510 2.449 69 HE1 TYR 489 HE1 TYR 489 -2.284 -12.695 3.415 70 HE2 TYR 489 HE2 TYR 489 -1.918 -15.944 0.673 71 HH TYR 489 HH TYR 489 -2.070 -12.483 1.123 72 H ARG 490 H ARG 490 -5.682 -19.227 6.228 73 HA ARG 490 HA ARG 490 -6.024 -17.980 8.868 74 HB2 ARG 490 HB2 ARG 490 -7.642 -19.769 9.323 75 HB3 ARG 490 HB3 ARG 490 -8.080 -18.855 7.886 76 HG2 ARG 490 HG2 ARG 490 -8.305 -20.815 6.868 77 HG3 ARG 490 HG3 ARG 490 -6.544 -20.920 6.893 78 HD2 ARG 490 HD2 ARG 490 -6.520 -22.396 8.634 79 HD3 ARG 490 HD3 ARG 490 -8.013 -21.766 9.329 80 HE ARG 490 HE ARG 490 -7.759 -23.918 7.469 81 HH11 ARG 490 HH11 ARG 490 -9.849 -21.340 8.520 82 HH12 ARG 490 HH12 ARG 490 -11.299 -22.121 7.983 83 HH21 ARG 490 HH21 ARG 490 -9.661 -24.956 6.758 84 HH22 ARG 490 HH22 ARG 490 -11.191 -24.179 6.982 85 H ILE 491 H ILE 491 -4.894 -18.682 10.574 86 HA ILE 491 HA ILE 491 -3.039 -20.910 10.155 87 HB ILE 491 HB ILE 491 -1.791 -20.070 12.043 88 HG12 ILE 491 HG12 ILE 491 -3.974 -17.992 12.316 89 HG13 ILE 491 HG13 ILE 491 -3.705 -19.341 13.415 90 HG21 ILE 491 HG21 ILE 491 -1.973 -17.460 10.994 91 HG22 ILE 491 HG22 ILE 491 -0.809 -18.718 10.584 92 HG23 ILE 491 HG23 ILE 491 -2.309 -18.574 9.668 93 HD11 ILE 491 HD11 ILE 491 -1.420 -18.384 13.842 94 HD12 ILE 491 HD12 ILE 491 -1.947 -16.953 12.956 95 HD13 ILE 491 HD13 ILE 491 -2.779 -17.430 14.436 96 H GLU 492 H GLU 492 -2.556 -22.235 12.163 97 HA GLU 492 HA GLU 492 -5.106 -23.137 13.280 98 HB2 GLU 492 HB2 GLU 492 -3.566 -24.745 12.106 99 HB3 GLU 492 HB3 GLU 492 -2.423 -24.515 13.422 100 HG2 GLU 492 HG2 GLU 492 -3.749 -25.624 14.947 101 HG3 GLU 492 HG3 GLU 492 -5.222 -25.359 14.017 102 H VAL 493 H VAL 493 -4.408 -20.828 14.436 103 HA VAL 493 HA VAL 493 -3.720 -21.666 17.151 104 HB VAL 493 HB VAL 493 -2.499 -19.166 16.001 105 HG11 VAL 493 HG11 VAL 493 -1.218 -19.094 17.961 106 HG12 VAL 493 HG12 VAL 493 -2.834 -19.544 18.509 107 HG13 VAL 493 HG13 VAL 493 -1.577 -20.773 18.363 108 HG21 VAL 493 HG21 VAL 493 -1.602 -21.010 14.719 109 HG22 VAL 493 HG22 VAL 493 -0.377 -20.420 15.842 110 HG23 VAL 493 HG23 VAL 493 -1.255 -21.907 16.197 111 H GLY 494 H GLY 494 -4.812 -20.584 18.733 112 HA2 GLY 494 HA2 GLY 494 -6.265 -18.142 18.059 113 HA3 GLY 494 HA3 GLY 494 -7.234 -19.541 18.501 114 H ARG 495 H ARG 495 -7.910 -17.886 20.169 115 HA ARG 495 HA ARG 495 -6.261 -16.993 22.215 116 HB2 ARG 495 HB2 ARG 495 -8.369 -16.949 23.599 117 HB3 ARG 495 HB3 ARG 495 -8.466 -16.112 22.055 118 HG2 ARG 495 HG2 ARG 495 -9.701 -17.916 21.082 119 HG3 ARG 495 HG3 ARG 495 -9.463 -18.913 22.518 120 HD2 ARG 495 HD2 ARG 495 -10.610 -16.820 23.683 121 HD3 ARG 495 HD3 ARG 495 -11.292 -16.618 22.070 122 HE ARG 495 HE ARG 495 -12.623 -18.437 22.451 123 HH11 ARG 495 HH11 ARG 495 -10.030 -18.427 24.774 124 HH12 ARG 495 HH12 ARG 495 -10.675 -19.744 25.695 125 HH21 ARG 495 HH21 ARG 495 -13.483 -20.172 23.655 126 HH22 ARG 495 HH22 ARG 495 -12.639 -20.737 25.058 127 H ASP 496 H ASP 496 -7.873 -20.095 21.805 128 HA ASP 496 HA ASP 496 -7.282 -21.091 24.401 129 HB2 ASP 496 HB2 ASP 496 -8.960 -21.918 22.502 130 HB3 ASP 496 HB3 ASP 496 -7.602 -22.969 22.111 131 H ASP 497 H ASP 497 -5.408 -20.651 21.589 132 HA ASP 497 HA ASP 497 -3.431 -22.653 22.376 133 HB2 ASP 497 HB2 ASP 497 -4.192 -22.233 19.949 134 HB3 ASP 497 HB3 ASP 497 -3.193 -20.784 20.028 135 H GLY 498 H GLY 498 -3.792 -19.155 22.020 136 HA2 GLY 498 HA2 GLY 498 -2.568 -17.998 23.941 137 HA3 GLY 498 HA3 GLY 498 -1.152 -18.808 23.287 138 H VAL 499 H VAL 499 -3.742 -17.407 21.364 139 HA VAL 499 HA VAL 499 -1.974 -15.189 20.606 140 HB VAL 499 HB VAL 499 -1.898 -17.155 18.952 141 HG11 VAL 499 HG11 VAL 499 -4.604 -17.039 19.112 142 HG12 VAL 499 HG12 VAL 499 -4.309 -16.105 17.644 143 HG13 VAL 499 HG13 VAL 499 -3.713 -17.760 17.772 144 HG21 VAL 499 HG21 VAL 499 -2.787 -14.704 17.531 145 HG22 VAL 499 HG22 VAL 499 -1.420 -14.564 18.636 146 HG23 VAL 499 HG23 VAL 499 -1.350 -15.697 17.286 147 H GLU 500 H GLU 500 -3.029 -13.330 19.833 148 HA GLU 500 HA GLU 500 -5.955 -13.316 20.161 149 HB2 GLU 500 HB2 GLU 500 -4.222 -10.980 20.927 150 HB3 GLU 500 HB3 GLU 500 -5.901 -11.281 21.352 151 HG2 GLU 500 HG2 GLU 500 -4.785 -13.417 22.501 152 HG3 GLU 500 HG3 GLU 500 -3.419 -12.306 22.576 153 H VAL 501 H VAL 501 -6.588 -10.825 19.416 154 HA VAL 501 HA VAL 501 -6.162 -10.891 16.580 155 HB VAL 501 HB VAL 501 -7.609 -8.867 18.294 156 HG11 VAL 501 HG11 VAL 501 -6.916 -7.840 16.222 157 HG12 VAL 501 HG12 VAL 501 -7.546 -9.204 15.297 158 HG13 VAL 501 HG13 VAL 501 -8.651 -8.145 16.174 159 HG21 VAL 501 HG21 VAL 501 -8.411 -11.327 18.109 160 HG22 VAL 501 HG22 VAL 501 -9.575 -10.021 17.878 161 HG23 VAL 501 HG23 VAL 501 -8.904 -10.863 16.480 162 H ARG 502 H ARG 502 -4.959 -9.001 19.271 163 HA ARG 502 HA ARG 502 -3.621 -7.108 17.520 164 HB2 ARG 502 HB2 ARG 502 -2.801 -6.120 19.662 165 HB3 ARG 502 HB3 ARG 502 -4.553 -6.200 19.538 166 HG2 ARG 502 HG2 ARG 502 -4.688 -7.978 21.066 167 HG3 ARG 502 HG3 ARG 502 -2.959 -8.310 20.954 168 HD2 ARG 502 HD2 ARG 502 -3.231 -7.204 23.005 169 HD3 ARG 502 HD3 ARG 502 -2.616 -5.972 21.903 170 HE ARG 502 HE ARG 502 -5.432 -5.919 21.905 171 HH11 ARG 502 HH11 ARG 502 -2.710 -5.132 23.927 172 HH12 ARG 502 HH12 ARG 502 -3.542 -3.875 24.781 173 HH21 ARG 502 HH21 ARG 502 -6.538 -4.266 23.022 174 HH22 ARG 502 HH22 ARG 502 -5.719 -3.384 24.266 175 H HIS 503 H HIS 503 -3.011 -10.181 18.475 176 HA HIS 503 HA HIS 503 -0.182 -9.912 19.018 177 HB2 HIS 503 HB2 HIS 503 -1.914 -11.740 19.855 178 HB3 HIS 503 HB3 HIS 503 -1.422 -12.548 18.370 179 HD1 HIS 503 HD1 HIS 503 1.615 -11.582 18.579 180 HD2 HIS 503 HD2 HIS 503 -0.586 -13.498 21.537 181 HE1 HIS 503 HE1 HIS 503 3.312 -12.678 20.077 182 H ILE 504 H ILE 504 -2.101 -11.553 16.495 183 HA ILE 504 HA ILE 504 0.143 -11.962 14.793 184 HB ILE 504 HB ILE 504 -1.347 -12.861 13.215 185 HG12 ILE 504 HG12 ILE 504 -2.857 -10.843 13.202 186 HG13 ILE 504 HG13 ILE 504 -3.691 -12.388 13.072 187 HG21 ILE 504 HG21 ILE 504 -2.821 -14.325 14.530 188 HG22 ILE 504 HG22 ILE 504 -1.210 -14.196 15.234 189 HG23 ILE 504 HG23 ILE 504 -2.555 -13.302 15.942 190 HD11 ILE 504 HD11 ILE 504 -3.451 -10.664 15.524 191 HD12 ILE 504 HD12 ILE 504 -4.899 -10.959 14.562 192 HD13 ILE 504 HD13 ILE 504 -4.177 -12.270 15.494 193 H VAL 505 H VAL 505 -2.100 -9.363 15.250 194 HA VAL 505 HA VAL 505 -1.575 -8.096 12.718 195 HB VAL 505 HB VAL 505 -2.980 -7.126 15.205 196 HG11 VAL 505 HG11 VAL 505 -1.988 -5.637 12.914 197 HG12 VAL 505 HG12 VAL 505 -3.729 -5.458 13.141 198 HG13 VAL 505 HG13 VAL 505 -2.621 -5.056 14.454 199 HG21 VAL 505 HG21 VAL 505 -4.975 -7.576 14.110 200 HG22 VAL 505 HG22 VAL 505 -4.217 -7.588 12.518 201 HG23 VAL 505 HG23 VAL 505 -3.957 -8.933 13.629 202 H GLY 506 H GLY 506 -0.842 -7.237 16.107 203 HA2 GLY 506 HA2 GLY 506 0.808 -5.053 15.553 204 HA3 GLY 506 HA3 GLY 506 0.879 -6.022 17.017 205 H ALA 507 H ALA 507 1.434 -8.420 15.202 206 HA ALA 507 HA ALA 507 4.301 -8.198 15.342 207 HB1 ALA 507 HB1 ALA 507 2.395 -10.395 14.633 208 HB2 ALA 507 HB2 ALA 507 4.122 -10.562 14.315 209 HB3 ALA 507 HB3 ALA 507 3.551 -10.304 15.963 210 H ILE 508 H ILE 508 2.069 -9.058 12.689 211 HA ILE 508 HA ILE 508 4.016 -8.754 10.660 212 HB ILE 508 HB ILE 508 2.153 -8.854 9.078 213 HG12 ILE 508 HG12 ILE 508 -0.140 -9.318 10.422 214 HG13 ILE 508 HG13 ILE 508 0.609 -8.155 11.512 215 HG21 ILE 508 HG21 ILE 508 2.790 -10.795 11.058 216 HG22 ILE 508 HG22 ILE 508 1.071 -10.917 10.685 217 HG23 ILE 508 HG23 ILE 508 2.265 -11.046 9.393 218 HD11 ILE 508 HD11 ILE 508 0.822 -7.243 8.805 219 HD12 ILE 508 HD12 ILE 508 -0.854 -7.630 9.195 220 HD13 ILE 508 HD13 ILE 508 0.040 -6.481 10.190 221 H ALA 509 H ALA 509 2.106 -6.497 12.387 222 HA ALA 509 HA ALA 509 2.296 -4.431 10.352 223 HB1 ALA 509 HB1 ALA 509 0.295 -4.744 11.870 224 HB2 ALA 509 HB2 ALA 509 1.295 -4.087 13.166 225 HB3 ALA 509 HB3 ALA 509 0.933 -3.104 11.747 226 H ASN 510 H ASN 510 4.124 -5.590 12.984 227 HA ASN 510 HA ASN 510 5.559 -3.050 13.282 228 HB2 ASN 510 HB2 ASN 510 4.805 -4.203 15.344 229 HB3 ASN 510 HB3 ASN 510 5.801 -5.590 14.911 230 HD21 ASN 510 HD21 ASN 510 6.684 -5.102 17.076 231 HD22 ASN 510 HD22 ASN 510 7.985 -3.970 17.183 232 H GLU 511 H GLU 511 5.853 -6.245 11.991 233 HA GLU 511 HA GLU 511 8.686 -6.355 11.841 234 HB2 GLU 511 HB2 GLU 511 8.386 -8.262 10.432 235 HB3 GLU 511 HB3 GLU 511 7.141 -8.325 11.672 236 HG2 GLU 511 HG2 GLU 511 5.528 -7.391 10.070 237 HG3 GLU 511 HG3 GLU 511 6.780 -7.404 8.830 238 H GLY 512 H GLY 512 6.164 -5.243 9.628 239 HA2 GLY 512 HA2 GLY 512 8.297 -4.135 7.907 240 HA3 GLY 512 HA3 GLY 512 6.780 -4.753 7.271 241 H ASP 513 H ASP 513 5.750 -3.047 6.447 242 HA ASP 513 HA ASP 513 5.626 -0.583 8.052 243 HB2 ASP 513 HB2 ASP 513 5.699 -1.124 5.137 244 HB3 ASP 513 HB3 ASP 513 4.662 0.201 5.661 245 H ILE 514 H ILE 514 3.835 -3.265 7.121 246 HA ILE 514 HA ILE 514 1.283 -2.347 6.634 247 HB ILE 514 HB ILE 514 2.056 -4.751 8.292 248 HG12 ILE 514 HG12 ILE 514 1.146 -4.996 5.479 249 HG13 ILE 514 HG13 ILE 514 2.751 -4.317 5.725 250 HG21 ILE 514 HG21 ILE 514 -0.214 -4.398 8.731 251 HG22 ILE 514 HG22 ILE 514 -0.546 -3.884 7.078 252 HG23 ILE 514 HG23 ILE 514 -0.204 -5.579 7.422 253 HD11 ILE 514 HD11 ILE 514 3.520 -6.273 6.782 254 HD12 ILE 514 HD12 ILE 514 1.885 -6.912 6.955 255 HD13 ILE 514 HD13 ILE 514 2.626 -6.804 5.358 256 H SER 515 H SER 515 -0.405 -1.606 7.834 257 HA SER 515 HA SER 515 0.173 -0.989 10.656 258 HB2 SER 515 HB2 SER 515 -0.280 0.850 8.789 259 HB3 SER 515 HB3 SER 515 -1.961 0.471 9.165 260 HG SER 515 HG SER 515 0.022 1.609 10.789 261 H SER 516 H SER 516 -1.856 -0.744 12.010 262 HA SER 516 HA SER 516 -3.258 -3.200 12.004 263 HB2 SER 516 HB2 SER 516 -3.639 -0.637 13.554 264 HB3 SER 516 HB3 SER 516 -4.656 -2.055 13.805 265 HG SER 516 HG SER 516 -2.534 -1.664 15.070 266 H ARG 517 H ARG 517 -3.874 -0.137 10.540 267 HA ARG 517 HA ARG 517 -6.683 -0.760 10.061 268 HB2 ARG 517 HB2 ARG 517 -6.704 1.494 8.959 269 HB3 ARG 517 HB3 ARG 517 -6.270 1.516 10.663 270 HG2 ARG 517 HG2 ARG 517 -4.041 1.995 10.219 271 HG3 ARG 517 HG3 ARG 517 -4.157 1.443 8.547 272 HD2 ARG 517 HD2 ARG 517 -5.890 3.708 9.343 273 HD3 ARG 517 HD3 ARG 517 -4.159 4.027 9.233 274 HE ARG 517 HE ARG 517 -4.672 2.781 6.903 275 HH11 ARG 517 HH11 ARG 517 -6.194 5.459 8.527 276 HH12 ARG 517 HH12 ARG 517 -6.699 6.230 7.061 277 HH21 ARG 517 HH21 ARG 517 -5.332 3.787 4.965 278 HH22 ARG 517 HH22 ARG 517 -6.209 5.278 5.035 279 H TYR 518 H TYR 518 -3.614 -0.625 8.399 280 HA TYR 518 HA TYR 518 -4.571 -0.691 5.749 281 HB2 TYR 518 HB2 TYR 518 -2.080 -0.598 6.973 282 HB3 TYR 518 HB3 TYR 518 -2.075 -2.145 6.133 283 HD1 TYR 518 HD1 TYR 518 -3.146 -1.934 3.642 284 HD2 TYR 518 HD2 TYR 518 -1.214 1.181 5.803 285 HE1 TYR 518 HE1 TYR 518 -2.639 -0.788 1.526 286 HE2 TYR 518 HE2 TYR 518 -0.703 2.336 3.692 287 HH TYR 518 HH TYR 518 -1.240 0.838 0.601 288 H ILE 519 H ILE 519 -3.872 -3.233 8.088 289 HA ILE 519 HA ILE 519 -3.994 -5.465 6.451 290 HB ILE 519 HB ILE 519 -5.007 -5.215 9.285 291 HG12 ILE 519 HG12 ILE 519 -2.417 -6.510 8.675 292 HG13 ILE 519 HG13 ILE 519 -2.473 -4.766 8.438 293 HG21 ILE 519 HG21 ILE 519 -4.655 -7.643 9.405 294 HG22 ILE 519 HG22 ILE 519 -5.879 -7.209 8.213 295 HG23 ILE 519 HG23 ILE 519 -4.257 -7.660 7.687 296 HD11 ILE 519 HD11 ILE 519 -1.825 -4.827 10.606 297 HD12 ILE 519 HD12 ILE 519 -3.573 -4.856 10.843 298 HD13 ILE 519 HD13 ILE 519 -2.646 -6.354 10.928 299 H GLY 520 H GLY 520 -5.623 -6.808 5.725 300 HA2 GLY 520 HA2 GLY 520 -8.136 -5.549 5.185 301 HA3 GLY 520 HA3 GLY 520 -7.674 -7.185 4.739 302 H ASN 521 H ASN 521 -8.954 -8.672 5.584 303 HA ASN 521 HA ASN 521 -10.443 -8.070 8.021 304 HB2 ASN 521 HB2 ASN 521 -10.692 -10.388 6.090 305 HB3 ASN 521 HB3 ASN 521 -11.762 -10.075 7.453 306 HD21 ASN 521 HD21 ASN 521 -10.589 -8.746 4.412 307 HD22 ASN 521 HD22 ASN 521 -12.005 -7.819 4.062 308 H ILE 522 H ILE 522 -9.864 -8.833 9.940 309 HA ILE 522 HA ILE 522 -8.011 -11.124 10.035 310 HB ILE 522 HB ILE 522 -8.239 -8.949 12.114 311 HG12 ILE 522 HG12 ILE 522 -5.741 -8.793 10.844 312 HG13 ILE 522 HG13 ILE 522 -6.916 -8.937 9.541 313 HG21 ILE 522 HG21 ILE 522 -7.352 -11.323 12.636 314 HG22 ILE 522 HG22 ILE 522 -5.928 -10.810 11.731 315 HG23 ILE 522 HG23 ILE 522 -6.422 -9.924 13.174 316 HD11 ILE 522 HD11 ILE 522 -7.230 -6.755 9.730 317 HD12 ILE 522 HD12 ILE 522 -8.019 -7.074 11.276 318 HD13 ILE 522 HD13 ILE 522 -6.299 -6.686 11.226 319 H LYS 523 H LYS 523 -8.558 -12.847 11.236 320 HA LYS 523 HA LYS 523 -10.963 -12.629 12.927 321 HB2 LYS 523 HB2 LYS 523 -11.092 -13.986 10.726 322 HB3 LYS 523 HB3 LYS 523 -10.115 -15.177 11.574 323 HG2 LYS 523 HG2 LYS 523 -11.922 -15.069 13.393 324 HG3 LYS 523 HG3 LYS 523 -12.909 -14.275 12.163 325 HD2 LYS 523 HD2 LYS 523 -11.971 -16.401 10.769 326 HD3 LYS 523 HD3 LYS 523 -12.062 -17.086 12.393 327 HE2 LYS 523 HE2 LYS 523 -14.291 -15.771 10.846 328 HE3 LYS 523 HE3 LYS 523 -14.142 -17.483 11.242 329 HZ1 LYS 523 HZ1 LYS 523 -15.222 -15.371 12.802 330 HZ2 LYS 523 HZ2 LYS 523 -13.981 -16.152 13.644 331 HZ3 LYS 523 HZ3 LYS 523 -15.299 -17.040 13.064 332 H LEU 524 H LEU 524 -11.044 -13.973 14.799 333 HA LEU 524 HA LEU 524 -8.552 -15.253 15.621 334 HB2 LEU 524 HB2 LEU 524 -8.583 -12.834 16.367 335 HB3 LEU 524 HB3 LEU 524 -9.937 -13.268 17.408 336 HG LEU 524 HG LEU 524 -7.689 -13.152 18.527 337 HD11 LEU 524 HD11 LEU 524 -9.759 -14.537 19.230 338 HD12 LEU 524 HD12 LEU 524 -8.208 -14.852 20.007 339 HD13 LEU 524 HD13 LEU 524 -8.790 -15.924 18.733 340 HD21 LEU 524 HD21 LEU 524 -7.146 -15.799 17.227 341 HD22 LEU 524 HD22 LEU 524 -6.049 -14.770 18.148 342 HD23 LEU 524 HD23 LEU 524 -6.558 -14.290 16.529 343 H PHE 525 H PHE 525 -9.588 -17.234 15.573 344 HA PHE 525 HA PHE 525 -12.004 -17.606 17.155 345 HB2 PHE 525 HB2 PHE 525 -11.067 -18.777 14.828 346 HB3 PHE 525 HB3 PHE 525 -10.789 -20.019 16.045 347 HD1 PHE 525 HD1 PHE 525 -12.472 -21.531 16.389 348 HD2 PHE 525 HD2 PHE 525 -13.467 -17.611 15.062 349 HE1 PHE 525 HE1 PHE 525 -14.843 -22.175 16.274 350 HE2 PHE 525 HE2 PHE 525 -15.841 -18.249 14.946 351 HZ PHE 525 HZ PHE 525 -16.531 -20.534 15.551 352 H ALA 526 H ALA 526 -11.692 -20.184 18.060 353 HA ALA 526 HA ALA 526 -10.235 -19.772 20.465 354 HB1 ALA 526 HB1 ALA 526 -12.105 -21.697 19.430 355 HB2 ALA 526 HB2 ALA 526 -10.774 -22.507 20.257 356 HB3 ALA 526 HB3 ALA 526 -11.727 -21.288 21.104 357 H SER 527 H SER 527 -9.609 -21.571 17.501 358 HA SER 527 HA SER 527 -6.805 -21.808 18.295 359 HB2 SER 527 HB2 SER 527 -8.024 -23.951 18.870 360 HB3 SER 527 HB3 SER 527 -8.312 -24.162 17.144 361 HG SER 527 HG SER 527 -5.897 -24.257 18.574 362 H HIS 528 H HIS 528 -8.220 -20.113 16.416 363 HA HIS 528 HA HIS 528 -6.579 -20.634 14.095 364 HB2 HIS 528 HB2 HIS 528 -9.584 -20.762 13.991 365 HB3 HIS 528 HB3 HIS 528 -8.638 -20.310 12.576 366 HD1 HIS 528 HD1 HIS 528 -9.506 -23.221 14.738 367 HD2 HIS 528 HD2 HIS 528 -7.173 -22.400 11.400 368 HE1 HIS 528 HE1 HIS 528 -8.871 -25.463 13.794 369 H SER 529 H SER 529 -6.720 -18.829 12.504 370 HA SER 529 HA SER 529 -7.977 -16.380 13.228 371 HB2 SER 529 HB2 SER 529 -5.405 -15.408 13.350 372 HB3 SER 529 HB3 SER 529 -6.454 -15.683 14.741 373 HG SER 529 HG SER 529 -4.732 -16.858 15.258 374 H THR 530 H THR 530 -8.167 -15.124 11.472 375 HA THR 530 HA THR 530 -6.544 -15.832 9.119 376 HB THR 530 HB THR 530 -8.332 -15.155 7.710 377 HG1 THR 530 HG1 THR 530 -9.709 -13.675 8.329 378 HG21 THR 530 HG21 THR 530 -10.027 -16.403 9.787 379 HG22 THR 530 HG22 THR 530 -8.564 -17.282 9.342 380 HG23 THR 530 HG23 THR 530 -9.757 -16.874 8.109 381 H ILE 531 H ILE 531 -6.206 -14.014 7.555 382 HA ILE 531 HA ILE 531 -6.381 -11.316 8.360 383 HB ILE 531 HB ILE 531 -4.673 -11.850 9.977 384 HG12 ILE 531 HG12 ILE 531 -3.130 -10.524 7.774 385 HG13 ILE 531 HG13 ILE 531 -4.566 -9.743 8.427 386 HG21 ILE 531 HG21 ILE 531 -2.527 -12.792 9.372 387 HG22 ILE 531 HG22 ILE 531 -3.822 -13.878 8.873 388 HG23 ILE 531 HG23 ILE 531 -3.010 -12.867 7.678 389 HD11 ILE 531 HD11 ILE 531 -3.588 -9.697 10.626 390 HD12 ILE 531 HD12 ILE 531 -2.182 -10.594 10.051 391 HD13 ILE 531 HD13 ILE 531 -2.485 -8.959 9.466 392 H GLU 532 H GLU 532 -5.938 -9.949 6.685 393 HA GLU 532 HA GLU 532 -4.819 -11.181 4.252 394 HB2 GLU 532 HB2 GLU 532 -7.247 -10.693 4.104 395 HB3 GLU 532 HB3 GLU 532 -6.903 -8.997 4.413 396 HG2 GLU 532 HG2 GLU 532 -6.072 -8.637 2.330 397 HG3 GLU 532 HG3 GLU 532 -5.491 -10.292 2.153 398 H LEU 533 H LEU 533 -2.979 -10.322 3.571 399 HA LEU 533 HA LEU 533 -2.259 -7.624 4.491 400 HB2 LEU 533 HB2 LEU 533 -0.779 -10.118 4.121 401 HB3 LEU 533 HB3 LEU 533 0.031 -8.705 3.447 402 HG LEU 533 HG LEU 533 0.086 -7.639 5.599 403 HD11 LEU 533 HD11 LEU 533 -1.646 -8.050 6.948 404 HD12 LEU 533 HD12 LEU 533 -0.722 -9.453 7.481 405 HD13 LEU 533 HD13 LEU 533 -1.951 -9.631 6.230 406 HD21 LEU 533 HD21 LEU 533 1.561 -9.809 4.919 407 HD22 LEU 533 HD22 LEU 533 0.904 -10.322 6.474 408 HD23 LEU 533 HD23 LEU 533 1.836 -8.828 6.359 409 HA PRO 534 HA PRO 534 -2.699 -6.192 0.331 410 HB2 PRO 534 HB2 PRO 534 -1.406 -3.824 0.634 411 HB3 PRO 534 HB3 PRO 534 -3.035 -4.115 1.254 412 HG2 PRO 534 HG2 PRO 534 -0.416 -4.190 2.702 413 HG3 PRO 534 HG3 PRO 534 -1.960 -3.487 3.218 414 HD2 PRO 534 HD2 PRO 534 -1.094 -5.900 4.091 415 HD3 PRO 534 HD3 PRO 534 -2.815 -5.527 3.869 416 H LYS 535 H LYS 535 0.178 -7.119 1.812 417 HA LYS 535 HA LYS 535 2.246 -6.230 0.278 418 HB2 LYS 535 HB2 LYS 535 1.813 -9.082 1.189 419 HB3 LYS 535 HB3 LYS 535 3.354 -8.390 0.700 420 HG2 LYS 535 HG2 LYS 535 1.713 -7.411 3.025 421 HG3 LYS 535 HG3 LYS 535 3.058 -8.547 3.151 422 HD2 LYS 535 HD2 LYS 535 3.334 -5.821 1.904 423 HD3 LYS 535 HD3 LYS 535 3.594 -6.116 3.625 424 HE2 LYS 535 HE2 LYS 535 5.011 -7.873 1.698 425 HE3 LYS 535 HE3 LYS 535 5.569 -6.207 1.843 426 HZ1 LYS 535 HZ1 LYS 535 5.995 -8.383 3.600 427 HZ2 LYS 535 HZ2 LYS 535 5.212 -7.130 4.423 428 HZ3 LYS 535 HZ3 LYS 535 6.680 -6.837 3.635 429 H GLY 536 H GLY 536 3.242 -6.830 -1.659 430 HA2 GLY 536 HA2 GLY 536 1.603 -8.500 -3.460 431 HA3 GLY 536 HA3 GLY 536 2.251 -6.954 -3.987 432 H MET 537 H MET 537 3.774 -9.536 -2.081 433 HA MET 537 HA MET 537 5.303 -10.628 -4.166 434 HB2 MET 537 HB2 MET 537 6.233 -8.183 -3.801 435 HB3 MET 537 HB3 MET 537 7.072 -8.937 -2.452 436 HG2 MET 537 HG2 MET 537 7.247 -10.304 -5.065 437 HG3 MET 537 HG3 MET 537 8.101 -8.772 -4.902 438 HE1 MET 537 HE1 MET 537 10.268 -9.210 -5.120 439 HE2 MET 537 HE2 MET 537 10.612 -8.672 -3.476 440 HE3 MET 537 HE3 MET 537 11.330 -10.165 -4.083 441 HA PRO 538 HA PRO 538 5.211 -12.778 -0.023 442 HB2 PRO 538 HB2 PRO 538 4.062 -15.057 -0.947 443 HB3 PRO 538 HB3 PRO 538 3.125 -13.662 -0.399 444 HG2 PRO 538 HG2 PRO 538 3.835 -14.491 -3.187 445 HG3 PRO 538 HG3 PRO 538 2.290 -13.890 -2.558 446 HD2 PRO 538 HD2 PRO 538 4.022 -12.314 -3.917 447 HD3 PRO 538 HD3 PRO 538 2.974 -11.690 -2.627 448 H GLY 539 H GLY 539 5.807 -15.346 0.141 449 HA2 GLY 539 HA2 GLY 539 7.317 -17.040 -0.389 450 HA3 GLY 539 HA3 GLY 539 7.828 -16.111 -1.791 451 H GLU 540 H GLU 540 7.859 -14.028 0.753 452 HA GLU 540 HA GLU 540 10.736 -14.094 0.908 453 HB2 GLU 540 HB2 GLU 540 8.939 -12.348 2.574 454 HB3 GLU 540 HB3 GLU 540 10.585 -12.033 2.045 455 HG2 GLU 540 HG2 GLU 540 8.148 -12.115 0.281 456 HG3 GLU 540 HG3 GLU 540 8.986 -10.665 0.831 457 H VAL 541 H VAL 541 8.128 -14.248 3.340 458 HA VAL 541 HA VAL 541 9.929 -15.188 5.375 459 HB VAL 541 HB VAL 541 6.910 -15.100 5.422 460 HG11 VAL 541 HG11 VAL 541 7.189 -15.112 7.859 461 HG12 VAL 541 HG12 VAL 541 7.849 -16.571 7.117 462 HG13 VAL 541 HG13 VAL 541 8.931 -15.285 7.653 463 HG21 VAL 541 HG21 VAL 541 7.343 -12.879 5.202 464 HG22 VAL 541 HG22 VAL 541 7.610 -13.025 6.940 465 HG23 VAL 541 HG23 VAL 541 8.983 -13.022 5.834 466 H LEU 542 H LEU 542 7.610 -16.611 3.168 467 HA LEU 542 HA LEU 542 7.436 -19.152 4.399 468 HB2 LEU 542 HB2 LEU 542 6.882 -18.124 1.641 469 HB3 LEU 542 HB3 LEU 542 6.781 -19.847 1.997 470 HG LEU 542 HG LEU 542 5.163 -19.040 3.901 471 HD11 LEU 542 HD11 LEU 542 5.330 -16.706 2.047 472 HD12 LEU 542 HD12 LEU 542 5.225 -16.739 3.807 473 HD13 LEU 542 HD13 LEU 542 3.800 -17.100 2.833 474 HD21 LEU 542 HD21 LEU 542 4.614 -20.496 1.974 475 HD22 LEU 542 HD22 LEU 542 4.296 -19.051 1.013 476 HD23 LEU 542 HD23 LEU 542 3.299 -19.410 2.424 477 H GLN 543 H GLN 543 9.845 -17.655 2.453 478 HA GLN 543 HA GLN 543 11.074 -20.132 1.613 479 HB2 GLN 543 HB2 GLN 543 11.561 -17.239 1.176 480 HB3 GLN 543 HB3 GLN 543 12.963 -18.296 1.078 481 HG2 GLN 543 HG2 GLN 543 10.489 -18.992 -0.431 482 HG3 GLN 543 HG3 GLN 543 11.571 -17.745 -1.050 483 HE21 GLN 543 HE21 GLN 543 10.835 -20.614 -1.818 484 HE22 GLN 543 HE22 GLN 543 12.367 -21.359 -2.104 485 H HIS 544 H HIS 544 12.154 -17.394 3.633 486 HA HIS 544 HA HIS 544 14.349 -18.841 4.727 487 HB2 HIS 544 HB2 HIS 544 13.042 -16.210 5.320 488 HB3 HIS 544 HB3 HIS 544 14.223 -16.869 6.448 489 HD1 HIS 544 HD1 HIS 544 13.969 -15.879 2.795 490 HD2 HIS 544 HD2 HIS 544 16.815 -16.373 5.782 491 HE1 HIS 544 HE1 HIS 544 16.129 -15.049 1.810 492 H PHE 545 H PHE 545 11.276 -17.739 6.165 493 HA PHE 545 HA PHE 545 11.689 -19.489 8.447 494 HB2 PHE 545 HB2 PHE 545 9.727 -17.332 7.760 495 HB3 PHE 545 HB3 PHE 545 9.338 -18.484 9.033 496 HD1 PHE 545 HD1 PHE 545 9.687 -17.644 11.130 497 HD2 PHE 545 HD2 PHE 545 12.389 -16.585 8.016 498 HE1 PHE 545 HE1 PHE 545 11.007 -16.320 12.729 499 HE2 PHE 545 HE2 PHE 545 13.714 -15.260 9.611 500 HZ PHE 545 HZ PHE 545 13.023 -15.126 11.971 501 H THR 546 H THR 546 11.488 -20.970 6.161 502 HA THR 546 HA THR 546 8.814 -21.841 5.649 503 HB THR 546 HB THR 546 10.702 -22.039 4.005 504 HG1 THR 546 HG1 THR 546 9.294 -23.396 3.209 505 HG21 THR 546 HG21 THR 546 11.496 -24.515 5.512 506 HG22 THR 546 HG22 THR 546 12.285 -22.964 5.802 507 HG23 THR 546 HG23 THR 546 12.347 -23.700 4.201 508 H ARG 547 H ARG 547 11.359 -22.796 7.837 509 HA ARG 547 HA ARG 547 9.690 -25.032 8.781 510 HB2 ARG 547 HB2 ARG 547 11.868 -25.790 9.884 511 HB3 ARG 547 HB3 ARG 547 11.764 -25.934 8.134 512 HG2 ARG 547 HG2 ARG 547 13.173 -24.080 7.793 513 HG3 ARG 547 HG3 ARG 547 13.034 -23.569 9.476 514 HD2 ARG 547 HD2 ARG 547 15.101 -24.574 9.488 515 HD3 ARG 547 HD3 ARG 547 14.067 -25.920 9.965 516 HE ARG 547 HE ARG 547 14.212 -26.091 7.242 517 HH11 ARG 547 HH11 ARG 547 16.526 -26.022 9.842 518 HH12 ARG 547 HH12 ARG 547 17.691 -26.994 9.004 519 HH21 ARG 547 HH21 ARG 547 15.737 -27.371 6.129 520 HH22 ARG 547 HH22 ARG 547 17.242 -27.760 6.892 521 H THR 548 H THR 548 11.100 -22.005 9.601 522 HA THR 548 HA THR 548 10.564 -22.396 12.455 523 HB THR 548 HB THR 548 11.954 -20.111 11.043 524 HG1 THR 548 HG1 THR 548 12.867 -22.403 12.441 525 HG21 THR 548 HG21 THR 548 11.586 -20.680 13.987 526 HG22 THR 548 HG22 THR 548 10.878 -19.342 13.081 527 HG23 THR 548 HG23 THR 548 12.624 -19.422 13.318 528 H ARG 549 H ARG 549 8.605 -21.870 13.152 529 HA ARG 549 HA ARG 549 7.422 -19.340 12.353 530 HB2 ARG 549 HB2 ARG 549 6.095 -22.005 11.870 531 HB3 ARG 549 HB3 ARG 549 5.199 -20.494 11.946 532 HG2 ARG 549 HG2 ARG 549 5.506 -20.607 9.707 533 HG3 ARG 549 HG3 ARG 549 7.001 -19.775 10.139 534 HD2 ARG 549 HD2 ARG 549 8.278 -21.520 9.545 535 HD3 ARG 549 HD3 ARG 549 7.185 -22.688 10.286 536 HE ARG 549 HE ARG 549 7.191 -21.806 7.530 537 HH11 ARG 549 HH11 ARG 549 5.433 -23.398 10.079 538 HH12 ARG 549 HH12 ARG 549 4.386 -24.256 8.998 539 HH21 ARG 549 HH21 ARG 549 5.818 -22.930 6.097 540 HH22 ARG 549 HH22 ARG 549 4.606 -23.989 6.733 541 H ILE 550 H ILE 550 5.177 -19.164 13.566 542 HA ILE 550 HA ILE 550 4.934 -20.568 16.033 543 HB ILE 550 HB ILE 550 6.899 -18.869 16.330 544 HG12 ILE 550 HG12 ILE 550 5.064 -18.417 18.556 545 HG13 ILE 550 HG13 ILE 550 5.101 -20.100 18.043 546 HG21 ILE 550 HG21 ILE 550 6.443 -16.662 16.556 547 HG22 ILE 550 HG22 ILE 550 5.134 -17.069 15.447 548 HG23 ILE 550 HG23 ILE 550 4.817 -16.949 17.177 549 HD11 ILE 550 HD11 ILE 550 6.851 -18.894 19.776 550 HD12 ILE 550 HD12 ILE 550 7.106 -20.427 18.942 551 HD13 ILE 550 HD13 ILE 550 7.751 -18.934 18.261 552 H LEU 551 H LEU 551 3.420 -19.097 17.560 553 HA LEU 551 HA LEU 551 0.923 -19.051 16.601 554 HB2 LEU 551 HB2 LEU 551 0.324 -17.418 18.266 555 HB3 LEU 551 HB3 LEU 551 1.531 -18.523 18.920 556 HG LEU 551 HG LEU 551 3.150 -16.548 18.114 557 HD11 LEU 551 HD11 LEU 551 2.248 -14.454 18.128 558 HD12 LEU 551 HD12 LEU 551 0.894 -14.920 19.156 559 HD13 LEU 551 HD13 LEU 551 0.893 -15.354 17.447 560 HD21 LEU 551 HD21 LEU 551 3.367 -15.973 20.367 561 HD22 LEU 551 HD22 LEU 551 2.756 -17.627 20.406 562 HD23 LEU 551 HD23 LEU 551 1.663 -16.275 20.705 563 H ASN 552 H ASN 552 3.255 -16.418 16.200 564 HA ASN 552 HA ASN 552 1.417 -14.754 14.754 565 HB2 ASN 552 HB2 ASN 552 3.142 -13.642 15.977 566 HB3 ASN 552 HB3 ASN 552 4.398 -14.610 15.211 567 HD21 ASN 552 HD21 ASN 552 1.617 -12.925 13.820 568 HD22 ASN 552 HD22 ASN 552 2.539 -11.903 12.775 569 H LYS 553 H LYS 553 4.469 -16.324 13.772 570 HA LYS 553 HA LYS 553 4.078 -15.961 11.014 571 HB2 LYS 553 HB2 LYS 553 5.641 -18.279 12.097 572 HB3 LYS 553 HB3 LYS 553 5.987 -17.264 10.703 573 HG2 LYS 553 HG2 LYS 553 6.292 -16.540 13.606 574 HG3 LYS 553 HG3 LYS 553 7.571 -16.760 12.410 575 HD2 LYS 553 HD2 LYS 553 5.456 -14.607 12.374 576 HD3 LYS 553 HD3 LYS 553 7.150 -14.390 12.820 577 HE2 LYS 553 HE2 LYS 553 6.132 -15.278 10.122 578 HE3 LYS 553 HE3 LYS 553 6.716 -13.664 10.522 579 HZ1 LYS 553 HZ1 LYS 553 8.761 -15.230 11.307 580 HZ2 LYS 553 HZ2 LYS 553 8.670 -14.444 9.812 581 HZ3 LYS 553 HZ3 LYS 553 8.202 -16.065 9.945 582 HA PRO 554 HA PRO 554 1.342 -19.142 9.730 583 HB2 PRO 554 HB2 PRO 554 2.515 -20.085 7.471 584 HB3 PRO 554 HB3 PRO 554 1.741 -18.499 7.560 585 HG2 PRO 554 HG2 PRO 554 4.645 -19.203 7.747 586 HG3 PRO 554 HG3 PRO 554 3.871 -17.872 6.867 587 HD2 PRO 554 HD2 PRO 554 5.080 -17.524 9.265 588 HD3 PRO 554 HD3 PRO 554 3.670 -16.571 8.758 589 H MET 555 H MET 555 2.052 -20.389 11.714 590 HA MET 555 HA MET 555 3.985 -22.430 11.559 591 HB2 MET 555 HB2 MET 555 3.233 -21.737 13.713 592 HB3 MET 555 HB3 MET 555 1.555 -22.077 13.310 593 HG2 MET 555 HG2 MET 555 2.398 -23.777 14.783 594 HG3 MET 555 HG3 MET 555 2.085 -24.470 13.193 595 HE1 MET 555 HE1 MET 555 4.525 -23.255 15.766 596 HE2 MET 555 HE2 MET 555 4.536 -25.005 15.986 597 HE3 MET 555 HE3 MET 555 5.996 -24.174 15.448 598 H ASN 556 H ASN 556 0.461 -22.504 11.086 599 HA ASN 556 HA ASN 556 0.746 -24.734 9.261 600 HB2 ASN 556 HB2 ASN 556 0.524 -25.658 11.650 601 HB3 ASN 556 HB3 ASN 556 -1.138 -25.078 11.586 602 HD21 ASN 556 HD21 ASN 556 -0.459 -27.752 11.929 603 HD22 ASN 556 HD22 ASN 556 -0.980 -28.639 10.540 604 H MET 557 H MET 557 0.049 -22.566 8.197 605 HA MET 557 HA MET 557 -2.884 -22.345 8.257 606 HB2 MET 557 HB2 MET 557 -2.591 -20.124 7.262 607 HB3 MET 557 HB3 MET 557 -1.718 -20.263 8.782 608 HG2 MET 557 HG2 MET 557 -0.098 -19.275 7.565 609 HG3 MET 557 HG3 MET 557 0.249 -20.948 7.135 610 HE1 MET 557 HE1 MET 557 -0.074 -21.273 3.611 611 HE2 MET 557 HE2 MET 557 1.315 -20.476 4.349 612 HE3 MET 557 HE3 MET 557 0.498 -21.789 5.197 613 H GLN 558 H GLN 558 -3.789 -21.606 6.052 614 HA GLN 558 HA GLN 558 -2.397 -22.813 3.792 615 HB2 GLN 558 HB2 GLN 558 -5.246 -23.582 4.417 616 HB3 GLN 558 HB3 GLN 558 -4.199 -24.250 3.172 617 HG2 GLN 558 HG2 GLN 558 -3.664 -24.513 6.118 618 HG3 GLN 558 HG3 GLN 558 -4.544 -25.708 5.167 619 HE21 GLN 558 HE21 GLN 558 -2.047 -25.989 6.623 620 HE22 GLN 558 HE22 GLN 558 -0.864 -26.485 5.466 621 H LEU 559 H LEU 559 -3.127 -22.095 1.759 622 HA LEU 559 HA LEU 559 -4.322 -19.472 1.823 623 HB2 LEU 559 HB2 LEU 559 -2.418 -19.972 0.367 624 HB3 LEU 559 HB3 LEU 559 -3.395 -21.153 -0.503 625 HG LEU 559 HG LEU 559 -3.011 -18.837 -1.560 626 HD11 LEU 559 HD11 LEU 559 -4.831 -20.712 -1.997 627 HD12 LEU 559 HD12 LEU 559 -4.868 -19.160 -2.832 628 HD13 LEU 559 HD13 LEU 559 -5.914 -19.436 -1.439 629 HD21 LEU 559 HD21 LEU 559 -5.211 -18.144 0.385 630 HD22 LEU 559 HD22 LEU 559 -4.583 -17.113 -0.902 631 HD23 LEU 559 HD23 LEU 559 -3.553 -17.546 0.463 632 H LEU 560 H LEU 560 -6.431 -19.121 1.736 633 HA LEU 560 HA LEU 560 -8.131 -21.086 0.346 634 HB2 LEU 560 HB2 LEU 560 -9.809 -20.801 1.912 635 HB3 LEU 560 HB3 LEU 560 -8.342 -20.782 2.890 636 HG LEU 560 HG LEU 560 -8.679 -18.132 2.431 637 HD11 LEU 560 HD11 LEU 560 -10.787 -17.506 2.046 638 HD12 LEU 560 HD12 LEU 560 -11.447 -18.726 3.134 639 HD13 LEU 560 HD13 LEU 560 -11.033 -19.156 1.475 640 HD21 LEU 560 HD21 LEU 560 -8.484 -19.665 4.575 641 HD22 LEU 560 HD22 LEU 560 -10.211 -19.325 4.682 642 HD23 LEU 560 HD23 LEU 560 -9.049 -17.998 4.679 643 H GLY 561 H GLY 561 -7.249 -17.755 0.710 644 HA2 GLY 561 HA2 GLY 561 -9.490 -16.773 -0.848 645 HA3 GLY 561 HA3 GLY 561 -8.156 -15.818 -0.219 646 H ASP 562 H ASP 562 -8.030 -14.753 -2.256 647 HA ASP 562 HA ASP 562 -6.119 -15.898 -4.008 648 HB2 ASP 562 HB2 ASP 562 -8.157 -17.115 -4.771 649 HB3 ASP 562 HB3 ASP 562 -8.892 -15.564 -5.169 650 H ALA 563 H ALA 563 -5.268 -14.394 -5.470 651 HA ALA 563 HA ALA 563 -5.611 -11.665 -4.713 652 HB1 ALA 563 HB1 ALA 563 -4.182 -11.993 -7.198 653 HB2 ALA 563 HB2 ALA 563 -3.600 -11.428 -5.631 654 HB3 ALA 563 HB3 ALA 563 -3.634 -13.155 -5.989 655 H GLN 564 H GLN 564 -7.171 -10.361 -5.387 656 HA GLN 564 HA GLN 564 -9.061 -10.952 -7.331 657 HB2 GLN 564 HB2 GLN 564 -8.799 -9.004 -5.469 658 HB3 GLN 564 HB3 GLN 564 -8.468 -8.083 -6.930 659 HG2 GLN 564 HG2 GLN 564 -10.776 -7.875 -6.511 660 HG3 GLN 564 HG3 GLN 564 -10.613 -8.991 -7.865 661 HE21 GLN 564 HE21 GLN 564 -11.279 -8.727 -4.440 662 HE22 GLN 564 HE22 GLN 564 -12.096 -10.242 -4.286
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