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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 | bmrb_id | cing | stage | position | program | type |
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652761 |
6yhz ![]() ![]() |
50219 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ARG 472 HT1 ARG 472 2.448 -12.422 -4.708 2 H2 ARG 472 HT2 ARG 472 3.778 -11.404 -4.474 3 H3 ARG 472 HT3 ARG 472 2.343 -10.789 -5.124 4 HA ARG 472 HA ARG 472 2.669 -11.867 -2.392 5 HB2 ARG 472 HB2 ARG 472 3.379 -9.357 -3.411 6 HB3 ARG 472 HB1 ARG 472 1.832 -9.098 -2.623 7 HG2 ARG 472 HG2 ARG 472 4.240 -10.355 -1.321 8 HG3 ARG 472 HG1 ARG 472 3.757 -8.669 -1.151 9 HD2 ARG 472 HD2 ARG 472 1.654 -9.356 -0.132 10 HD3 ARG 472 HD1 ARG 472 2.092 -11.051 -0.339 11 HE ARG 472 HE ARG 472 3.914 -9.400 1.215 12 HH11 ARG 472 HH11 ARG 472 1.369 -11.823 1.235 13 HH12 ARG 472 HH12 ARG 472 1.702 -12.319 2.862 14 HH21 ARG 472 HH21 ARG 472 4.328 -10.066 3.355 15 HH22 ARG 472 HH22 ARG 472 3.359 -11.316 4.069 16 H ASN 473 HN ASN 473 0.798 -12.297 -1.340 17 HA ASN 473 HA ASN 473 -1.705 -11.880 -2.779 18 HB2 ASN 473 HB2 ASN 473 -2.707 -13.358 -1.125 19 HB3 ASN 473 HB1 ASN 473 -1.243 -14.095 -1.763 20 HD21 ASN 473 HD21 ASN 473 -2.634 -14.603 0.733 21 HD22 ASN 473 HD22 ASN 473 -1.486 -14.314 1.998 22 H LEU 474 HN LEU 474 0.153 -10.287 -0.555 23 HA LEU 474 HA LEU 474 -0.115 -8.492 0.809 24 HB2 LEU 474 HB2 LEU 474 -2.738 -8.272 -0.680 25 HB3 LEU 474 HB1 LEU 474 -2.155 -7.065 0.442 26 HG LEU 474 HG LEU 474 -1.742 -6.301 -1.801 27 HD11 LEU 474 HD11 LEU 474 0.767 -6.169 -1.842 28 HD12 LEU 474 HD12 LEU 474 0.759 -7.181 -0.399 29 HD13 LEU 474 HD13 LEU 474 -0.018 -5.597 -0.373 30 HD21 LEU 474 HD21 LEU 474 -0.235 -7.532 -3.321 31 HD22 LEU 474 HD22 LEU 474 -1.772 -8.339 -3.028 32 HD23 LEU 474 HD23 LEU 474 -0.313 -8.904 -2.216 33 H ALA 475 HN ALA 475 -2.423 -7.518 2.138 34 HA ALA 475 HA ALA 475 -3.707 -7.843 3.979 35 HB1 ALA 475 HB1 ALA 475 -3.738 -10.762 3.229 36 HB2 ALA 475 HB2 ALA 475 -4.878 -9.547 2.652 37 HB3 ALA 475 HB3 ALA 475 -4.819 -9.957 4.366 38 H GLU 476 HN GLU 476 -1.493 -10.622 3.741 39 HA GLU 476 HA GLU 476 -0.854 -10.568 6.550 40 HB2 GLU 476 HB2 GLU 476 0.426 -12.062 4.252 41 HB3 GLU 476 HB1 GLU 476 0.766 -12.338 5.956 42 HG2 GLU 476 HG2 GLU 476 -1.482 -13.096 6.332 43 HG3 GLU 476 HG1 GLU 476 -1.934 -12.685 4.678 44 H LEU 477 HN LEU 477 -0.359 -8.126 5.168 45 HA LEU 477 HA LEU 477 2.448 -7.924 4.567 46 HB2 LEU 477 HB2 LEU 477 0.168 -5.971 4.651 47 HB3 LEU 477 HB1 LEU 477 1.817 -5.473 4.313 48 HG LEU 477 HG LEU 477 0.728 -7.682 2.666 49 HD11 LEU 477 HD11 LEU 477 -0.536 -6.256 1.245 50 HD12 LEU 477 HD12 LEU 477 -0.062 -4.822 2.159 51 HD13 LEU 477 HD13 LEU 477 -1.137 -6.017 2.888 52 HD21 LEU 477 HD21 LEU 477 2.338 -5.205 2.070 53 HD22 LEU 477 HD22 LEU 477 2.004 -6.519 0.943 54 HD23 LEU 477 HD23 LEU 477 2.997 -6.814 2.369 55 H HIS 478 HN HIS 478 3.895 -6.499 5.625 56 HA HIS 478 HA HIS 478 3.513 -6.504 8.514 57 HB2 HIS 478 HB2 HIS 478 5.484 -7.635 7.687 58 HB3 HIS 478 HB1 HIS 478 5.933 -6.246 6.713 59 HD1 HIS 478 HD1 HIS 478 6.231 -7.671 10.117 60 HD2 HIS 478 HD2 HIS 478 7.034 -4.108 8.149 61 HE1 HIS 478 HE1 HIS 478 7.783 -6.400 11.641 62 HE2 HIS 478 HE2 HIS 478 8.320 -4.271 10.399 63 H ILE 479 HN ILE 479 3.629 -4.612 9.725 64 HA ILE 479 HA ILE 479 2.796 -2.234 8.429 65 HB ILE 479 HB ILE 479 3.823 -2.565 11.249 66 HG12 ILE 479 HG12 ILE 479 1.909 -4.033 10.819 67 HG13 ILE 479 HG11 ILE 479 1.447 -2.715 11.889 68 HG21 ILE 479 HG21 ILE 479 2.117 -0.386 10.054 69 HG22 ILE 479 HG22 ILE 479 3.833 -0.248 10.443 70 HG23 ILE 479 HG23 ILE 479 2.650 -0.499 11.732 71 HD11 ILE 479 HD11 ILE 479 -0.290 -3.153 10.266 72 HD12 ILE 479 HD12 ILE 479 0.852 -2.905 8.945 73 HD13 ILE 479 HD13 ILE 479 0.410 -1.559 9.994 74 H GLY 480 HN GLY 480 3.964 -0.691 7.495 75 HA2 GLY 480 HA2 GLY 480 5.720 0.862 7.344 76 HA3 GLY 480 HA1 GLY 480 6.640 -0.107 8.487 77 H GLN 481 HN GLN 481 5.305 -2.101 6.197 78 HA GLN 481 HA GLN 481 7.872 -2.668 5.042 79 HB2 GLN 481 HB2 GLN 481 6.288 -4.450 5.619 80 HB3 GLN 481 HB1 GLN 481 5.125 -3.799 4.477 81 HG2 GLN 481 HG2 GLN 481 6.559 -4.360 2.629 82 HG3 GLN 481 HG1 GLN 481 7.827 -4.892 3.734 83 HE21 GLN 481 HE21 GLN 481 7.580 -6.820 4.847 84 HE22 GLN 481 HE22 GLN 481 6.414 -8.011 4.382 85 HA PRO 482 HA PRO 482 7.270 -0.034 1.508 86 HB2 PRO 482 HB2 PRO 482 9.382 -0.861 0.039 87 HB3 PRO 482 HB1 PRO 482 9.565 0.160 1.469 88 HG2 PRO 482 HG2 PRO 482 9.975 -2.784 1.175 89 HG3 PRO 482 HG1 PRO 482 10.931 -1.604 2.090 90 HD2 PRO 482 HD2 PRO 482 9.078 -3.276 3.220 91 HD3 PRO 482 HD1 PRO 482 9.540 -1.706 3.903 92 H VAL 483 HN VAL 483 5.729 -0.389 0.076 93 HA VAL 483 HA VAL 483 5.871 -2.781 -1.617 94 HB VAL 483 HB VAL 483 3.358 -2.894 -1.577 95 HG11 VAL 483 HG11 VAL 483 3.230 -4.085 0.570 96 HG12 VAL 483 HG12 VAL 483 4.785 -3.395 1.034 97 HG13 VAL 483 HG13 VAL 483 4.684 -4.502 -0.336 98 HG21 VAL 483 HG21 VAL 483 2.905 -0.663 -0.714 99 HG22 VAL 483 HG22 VAL 483 3.679 -1.083 0.814 100 HG23 VAL 483 HG23 VAL 483 2.190 -1.893 0.329 101 H VAL 484 HN VAL 484 5.076 -2.508 -3.713 102 HA VAL 484 HA VAL 484 5.038 0.305 -4.507 103 HB VAL 484 HB VAL 484 5.548 -0.530 -6.795 104 HG11 VAL 484 HG11 VAL 484 7.313 0.254 -5.334 105 HG12 VAL 484 HG12 VAL 484 7.884 -1.102 -6.308 106 HG13 VAL 484 HG13 VAL 484 7.454 -1.350 -4.615 107 HG21 VAL 484 HG21 VAL 484 6.311 -2.817 -7.088 108 HG22 VAL 484 HG22 VAL 484 4.616 -2.755 -6.603 109 HG23 VAL 484 HG23 VAL 484 5.855 -3.183 -5.424 110 H HIS 485 HN HIS 485 3.404 1.227 -5.356 111 HA HIS 485 HA HIS 485 0.978 -0.303 -5.999 112 HB2 HIS 485 HB2 HIS 485 0.897 1.648 -4.377 113 HB3 HIS 485 HB1 HIS 485 1.324 2.695 -5.716 114 HD1 HIS 485 HD1 HIS 485 -0.901 4.000 -5.513 115 HD2 HIS 485 HD2 HIS 485 -1.380 -0.055 -6.294 116 HE1 HIS 485 HE1 HIS 485 -3.318 3.708 -6.130 117 HE2 HIS 485 HE2 HIS 485 -3.622 1.226 -6.421 118 H LEU 486 HN LEU 486 0.641 -0.733 -8.067 119 HA LEU 486 HA LEU 486 2.333 -0.074 -10.118 120 HB2 LEU 486 HB2 LEU 486 0.797 -1.079 -11.608 121 HB3 LEU 486 HB1 LEU 486 0.691 -1.932 -10.088 122 HG LEU 486 HG LEU 486 -1.504 -1.841 -10.820 123 HD11 LEU 486 HD11 LEU 486 -1.351 -1.098 -8.511 124 HD12 LEU 486 HD12 LEU 486 -2.730 -0.384 -9.344 125 HD13 LEU 486 HD13 LEU 486 -1.281 0.578 -9.054 126 HD21 LEU 486 HD21 LEU 486 -2.610 0.162 -11.713 127 HD22 LEU 486 HD22 LEU 486 -1.237 -0.356 -12.691 128 HD23 LEU 486 HD23 LEU 486 -1.077 1.029 -11.612 129 H GLU 487 HN GLU 487 -0.126 1.926 -8.817 130 HA GLU 487 HA GLU 487 -0.372 3.606 -11.137 131 HB2 GLU 487 HB2 GLU 487 -1.377 3.876 -8.309 132 HB3 GLU 487 HB1 GLU 487 -1.681 5.073 -9.561 133 HG2 GLU 487 HG2 GLU 487 -2.811 3.336 -10.901 134 HG3 GLU 487 HG1 GLU 487 -2.565 2.194 -9.579 135 H HIS 488 HN HIS 488 1.215 3.892 -7.934 136 HA HIS 488 HA HIS 488 2.520 6.319 -8.983 137 HB2 HIS 488 HB2 HIS 488 1.206 5.849 -6.388 138 HB3 HIS 488 HB1 HIS 488 2.728 6.734 -6.327 139 HD1 HIS 488 HD1 HIS 488 2.397 9.181 -6.447 140 HD2 HIS 488 HD2 HIS 488 -0.527 7.117 -8.571 141 HE1 HIS 488 HE1 HIS 488 0.860 10.941 -7.378 142 HE2 HIS 488 HE2 HIS 488 -0.971 9.665 -8.543 143 H GLY 489 HN GLY 489 3.012 3.493 -6.889 144 HA2 GLY 489 HA2 GLY 489 5.222 2.437 -7.531 145 HA3 GLY 489 HA1 GLY 489 5.904 4.011 -7.156 146 H VAL 490 HN VAL 490 7.245 3.179 -5.604 147 HA VAL 490 HA VAL 490 6.461 1.422 -3.552 148 HB VAL 490 HB VAL 490 8.762 1.583 -4.261 149 HG11 VAL 490 HG11 VAL 490 8.852 3.930 -4.845 150 HG12 VAL 490 HG12 VAL 490 10.143 3.531 -3.717 151 HG13 VAL 490 HG13 VAL 490 8.712 4.381 -3.147 152 HG21 VAL 490 HG21 VAL 490 8.419 2.466 -1.399 153 HG22 VAL 490 HG22 VAL 490 9.890 1.771 -2.080 154 HG23 VAL 490 HG23 VAL 490 8.413 0.807 -1.998 155 H GLY 491 HN GLY 491 5.565 1.703 -1.658 156 HA2 GLY 491 HA2 GLY 491 5.622 4.334 -0.351 157 HA3 GLY 491 HA1 GLY 491 4.066 3.548 -0.608 158 H ARG 492 HN ARG 492 4.409 3.995 1.916 159 HA ARG 492 HA ARG 492 5.629 1.580 3.077 160 HB2 ARG 492 HB2 ARG 492 5.073 4.284 4.298 161 HB3 ARG 492 HB1 ARG 492 5.587 2.880 5.229 162 HG2 ARG 492 HG2 ARG 492 7.130 4.052 2.936 163 HG3 ARG 492 HG1 ARG 492 7.433 4.423 4.636 164 HD2 ARG 492 HD2 ARG 492 7.935 2.095 5.079 165 HD3 ARG 492 HD1 ARG 492 7.534 1.665 3.421 166 HE ARG 492 HE ARG 492 9.526 3.546 3.219 167 HH11 ARG 492 HH11 ARG 492 9.163 0.471 4.836 168 HH12 ARG 492 HH12 ARG 492 10.818 0.002 4.604 169 HH21 ARG 492 HH21 ARG 492 11.720 2.931 2.893 170 HH22 ARG 492 HH22 ARG 492 12.262 1.392 3.490 171 H TYR 493 HN TYR 493 4.267 0.056 3.551 172 HA TYR 493 HA TYR 493 1.469 0.361 3.534 173 HB2 TYR 493 HB2 TYR 493 2.662 -1.751 3.020 174 HB3 TYR 493 HB1 TYR 493 3.122 -1.881 4.712 175 HD1 TYR 493 HD1 TYR 493 0.179 -1.796 2.445 176 HD2 TYR 493 HD2 TYR 493 1.695 -2.877 6.273 177 HE1 TYR 493 HE1 TYR 493 -1.899 -3.020 2.924 178 HE2 TYR 493 HE2 TYR 493 -0.382 -4.092 6.762 179 HH TYR 493 HH TYR 493 -2.714 -4.123 6.035 180 H ALA 494 HN ALA 494 0.027 0.828 5.102 181 HA ALA 494 HA ALA 494 0.952 0.669 7.893 182 HB1 ALA 494 HB1 ALA 494 1.204 2.999 7.188 183 HB2 ALA 494 HB2 ALA 494 -0.054 2.825 8.414 184 HB3 ALA 494 HB3 ALA 494 -0.497 3.038 6.720 185 H GLY 495 HN GLY 495 -0.299 -1.082 8.333 186 HA2 GLY 495 HA2 GLY 495 -2.159 -2.242 8.967 187 HA3 GLY 495 HA1 GLY 495 -2.812 -0.668 9.374 188 H MET 496 HN MET 496 -4.856 -1.311 8.845 189 HA MET 496 HA MET 496 -5.463 -1.157 5.997 190 HB2 MET 496 HB2 MET 496 -6.024 -3.487 7.737 191 HB3 MET 496 HB1 MET 496 -7.336 -2.968 6.688 192 HG2 MET 496 HG2 MET 496 -5.871 -3.177 4.751 193 HG3 MET 496 HG1 MET 496 -4.555 -3.693 5.801 194 HE1 MET 496 HE1 MET 496 -5.770 -5.234 3.188 195 HE2 MET 496 HE2 MET 496 -5.673 -6.903 3.750 196 HE3 MET 496 HE3 MET 496 -4.344 -5.787 4.070 197 H THR 497 HN THR 497 -7.603 -0.496 5.542 198 HA THR 497 HA THR 497 -9.103 0.577 7.827 199 HB THR 497 HB THR 497 -7.873 2.466 6.952 200 HG1 THR 497 HG1 THR 497 -9.594 3.794 6.666 201 HG21 THR 497 HG21 THR 497 -7.345 1.615 4.735 202 HG22 THR 497 HG22 THR 497 -8.110 3.201 4.620 203 HG23 THR 497 HG23 THR 497 -9.041 1.745 4.263 204 H THR 498 HN THR 498 -11.335 0.481 7.592 205 HA THR 498 HA THR 498 -12.265 -1.046 5.277 206 HB THR 498 HB THR 498 -14.255 -0.434 7.332 207 HG1 THR 498 HG1 THR 498 -12.056 -2.094 8.082 208 HG21 THR 498 HG21 THR 498 -14.603 -2.144 5.657 209 HG22 THR 498 HG22 THR 498 -14.516 -2.903 7.248 210 HG23 THR 498 HG23 THR 498 -13.132 -2.979 6.156 211 H LEU 499 HN LEU 499 -13.483 -0.124 3.708 212 HA LEU 499 HA LEU 499 -14.404 2.631 4.203 213 HB2 LEU 499 HB2 LEU 499 -13.429 1.478 1.590 214 HB3 LEU 499 HB1 LEU 499 -14.000 3.116 1.840 215 HG LEU 499 HG LEU 499 -11.504 1.900 3.025 216 HD11 LEU 499 HD11 LEU 499 -11.890 4.029 0.931 217 HD12 LEU 499 HD12 LEU 499 -11.310 2.388 0.655 218 HD13 LEU 499 HD13 LEU 499 -10.345 3.516 1.607 219 HD21 LEU 499 HD21 LEU 499 -12.631 4.685 3.304 220 HD22 LEU 499 HD22 LEU 499 -11.039 4.165 3.854 221 HD23 LEU 499 HD23 LEU 499 -12.490 3.480 4.585 222 H GLU 500 HN GLU 500 -16.429 3.162 3.659 223 HA GLU 500 HA GLU 500 -18.086 1.052 2.451 224 HB2 GLU 500 HB2 GLU 500 -18.883 3.229 4.393 225 HB3 GLU 500 HB1 GLU 500 -19.987 2.068 3.667 226 HG2 GLU 500 HG2 GLU 500 -18.916 0.251 4.791 227 HG3 GLU 500 HG1 GLU 500 -17.646 1.312 5.392 228 H ALA 501 HN ALA 501 -18.061 1.602 0.343 229 HA ALA 501 HA ALA 501 -18.502 4.384 -0.429 230 HB1 ALA 501 HB1 ALA 501 -17.780 1.942 -2.039 231 HB2 ALA 501 HB2 ALA 501 -16.686 3.229 -1.530 232 HB3 ALA 501 HB3 ALA 501 -17.961 3.568 -2.701 233 H GLY 502 HN GLY 502 -20.008 4.721 -2.316 234 HA2 GLY 502 HA2 GLY 502 -22.591 3.655 -1.711 235 HA3 GLY 502 HA1 GLY 502 -22.195 4.727 -3.047 236 H GLY 503 HN GLY 503 -22.253 1.392 -1.968 237 HA2 GLY 503 HA2 GLY 503 -23.258 -0.148 -3.658 238 HA3 GLY 503 HA1 GLY 503 -22.108 0.543 -4.795 239 H ILE 504 HN ILE 504 -19.811 0.618 -3.281 240 HA ILE 504 HA ILE 504 -19.317 -2.254 -2.875 241 HB ILE 504 HB ILE 504 -17.270 -0.196 -3.714 242 HG12 ILE 504 HG12 ILE 504 -17.431 -1.581 -5.927 243 HG13 ILE 504 HG11 ILE 504 -19.044 -1.976 -5.356 244 HG21 ILE 504 HG21 ILE 504 -16.340 -2.122 -2.573 245 HG22 ILE 504 HG22 ILE 504 -15.919 -2.165 -4.286 246 HG23 ILE 504 HG23 ILE 504 -17.198 -3.209 -3.666 247 HD11 ILE 504 HD11 ILE 504 -19.107 -0.107 -6.888 248 HD12 ILE 504 HD12 ILE 504 -17.969 0.785 -5.880 249 HD13 ILE 504 HD13 ILE 504 -19.581 0.412 -5.273 250 H THR 505 HN THR 505 -19.242 -2.613 -0.740 251 HA THR 505 HA THR 505 -17.584 -0.797 0.882 252 HB THR 505 HB THR 505 -18.929 -1.354 2.820 253 HG1 THR 505 HG1 THR 505 -19.572 -3.459 2.333 254 HG21 THR 505 HG21 THR 505 -19.711 0.510 1.428 255 HG22 THR 505 HG22 THR 505 -21.054 -0.320 2.213 256 HG23 THR 505 HG23 THR 505 -20.717 -0.607 0.507 257 H GLY 506 HN GLY 506 -16.056 -1.776 2.268 258 HA2 GLY 506 HA2 GLY 506 -15.927 -4.406 3.043 259 HA3 GLY 506 HA1 GLY 506 -15.217 -4.386 1.437 260 H GLU 507 HN GLU 507 -13.301 -5.130 2.488 261 HA GLU 507 HA GLU 507 -11.961 -3.323 4.320 262 HB2 GLU 507 HB2 GLU 507 -11.200 -6.029 3.231 263 HB3 GLU 507 HB1 GLU 507 -10.258 -5.130 4.412 264 HG2 GLU 507 HG2 GLU 507 -12.057 -5.252 6.008 265 HG3 GLU 507 HG1 GLU 507 -13.098 -6.029 4.818 266 H TYR 508 HN TYR 508 -10.197 -2.129 3.874 267 HA TYR 508 HA TYR 508 -9.048 -2.303 1.169 268 HB2 TYR 508 HB2 TYR 508 -9.988 0.191 2.598 269 HB3 TYR 508 HB1 TYR 508 -8.908 0.227 1.209 270 HD1 TYR 508 HD1 TYR 508 -9.811 0.350 -0.929 271 HD2 TYR 508 HD2 TYR 508 -12.248 -1.057 2.253 272 HE1 TYR 508 HE1 TYR 508 -11.751 0.310 -2.438 273 HE2 TYR 508 HE2 TYR 508 -14.189 -1.110 0.760 274 HH TYR 508 HH TYR 508 -14.942 -0.054 -1.330 275 H LEU 509 HN LEU 509 -6.998 -1.727 0.933 276 HA LEU 509 HA LEU 509 -5.276 -2.046 3.188 277 HB2 LEU 509 HB2 LEU 509 -4.669 -3.126 1.194 278 HB3 LEU 509 HB1 LEU 509 -5.009 -1.714 0.224 279 HG LEU 509 HG LEU 509 -2.733 -1.660 2.156 280 HD11 LEU 509 HD11 LEU 509 -2.761 -2.856 -0.609 281 HD12 LEU 509 HD12 LEU 509 -2.501 -3.730 0.898 282 HD13 LEU 509 HD13 LEU 509 -1.312 -2.546 0.351 283 HD21 LEU 509 HD21 LEU 509 -3.611 0.349 0.827 284 HD22 LEU 509 HD22 LEU 509 -2.939 -0.465 -0.588 285 HD23 LEU 509 HD23 LEU 509 -1.885 0.000 0.746 286 H MET 510 HN MET 510 -4.005 -0.487 4.137 287 HA MET 510 HA MET 510 -4.457 2.269 3.216 288 HB2 MET 510 HB2 MET 510 -5.008 1.219 5.705 289 HB3 MET 510 HB1 MET 510 -3.426 1.949 5.939 290 HG2 MET 510 HG2 MET 510 -4.278 4.076 5.100 291 HG3 MET 510 HG1 MET 510 -5.862 3.351 4.864 292 HE1 MET 510 HE1 MET 510 -3.323 2.825 7.867 293 HE2 MET 510 HE2 MET 510 -3.898 4.066 8.979 294 HE3 MET 510 HE3 MET 510 -3.178 4.529 7.437 295 H LEU 511 HN LEU 511 -2.752 3.246 2.387 296 HA LEU 511 HA LEU 511 -0.065 2.343 3.200 297 HB2 LEU 511 HB2 LEU 511 -1.276 2.553 0.573 298 HB3 LEU 511 HB1 LEU 511 0.184 3.512 0.685 299 HG LEU 511 HG LEU 511 0.271 0.685 1.630 300 HD11 LEU 511 HD11 LEU 511 0.578 -0.192 -0.519 301 HD12 LEU 511 HD12 LEU 511 0.672 1.408 -1.253 302 HD13 LEU 511 HD13 LEU 511 -0.870 0.807 -0.645 303 HD21 LEU 511 HD21 LEU 511 2.185 2.184 1.935 304 HD22 LEU 511 HD22 LEU 511 2.224 2.476 0.195 305 HD23 LEU 511 HD23 LEU 511 2.556 0.864 0.828 306 H THR 512 HN THR 512 1.562 3.917 3.306 307 HA THR 512 HA THR 512 0.603 6.694 3.228 308 HB THR 512 HB THR 512 2.510 7.014 5.017 309 HG1 THR 512 HG1 THR 512 2.262 4.314 4.877 310 HG21 THR 512 HG21 THR 512 0.817 6.780 6.791 311 HG22 THR 512 HG22 THR 512 -0.226 5.914 5.660 312 HG23 THR 512 HG23 THR 512 0.187 7.605 5.365 313 H TYR 513 HN TYR 513 1.698 8.001 1.991 314 HA TYR 513 HA TYR 513 4.318 7.121 0.994 315 HB2 TYR 513 HB2 TYR 513 2.096 8.679 -0.294 316 HB3 TYR 513 HB1 TYR 513 3.740 8.768 -0.915 317 HD1 TYR 513 HD1 TYR 513 4.295 7.336 -2.625 318 HD2 TYR 513 HD2 TYR 513 1.256 6.157 0.108 319 HE1 TYR 513 HE1 TYR 513 3.926 5.286 -3.927 320 HE2 TYR 513 HE2 TYR 513 0.881 4.106 -1.189 321 HH TYR 513 HH TYR 513 3.025 3.024 -3.573 322 H ALA 514 HN ALA 514 5.108 9.550 -0.150 323 HA ALA 514 HA ALA 514 6.283 10.890 1.998 324 HB1 ALA 514 HB1 ALA 514 5.760 11.977 -0.765 325 HB2 ALA 514 HB2 ALA 514 7.128 10.963 -0.310 326 HB3 ALA 514 HB3 ALA 514 6.952 12.572 0.389 327 H ASN 515 HN ASN 515 5.855 12.806 3.041 328 HA ASN 515 HA ASN 515 4.615 14.395 4.068 329 HB2 ASN 515 HB2 ASN 515 4.467 15.260 1.692 330 HB3 ASN 515 HB1 ASN 515 2.902 14.464 1.574 331 HD21 ASN 515 HD21 ASN 515 4.708 17.012 3.141 332 HD22 ASN 515 HD22 ASN 515 3.338 17.929 3.664 333 H ASP 516 HN ASP 516 3.940 11.531 4.165 334 HA ASP 516 HA ASP 516 2.462 10.144 5.165 335 HB2 ASP 516 HB2 ASP 516 1.590 12.784 6.323 336 HB3 ASP 516 HB1 ASP 516 0.841 11.264 6.796 337 H ALA 517 HN ALA 517 1.853 10.981 2.531 338 HA ALA 517 HA ALA 517 -0.888 11.619 2.241 339 HB1 ALA 517 HB1 ALA 517 -0.597 11.032 -0.095 340 HB2 ALA 517 HB2 ALA 517 0.942 10.254 0.273 341 HB3 ALA 517 HB3 ALA 517 0.766 11.998 0.468 342 H LYS 518 HN LYS 518 -2.657 10.358 2.116 343 HA LYS 518 HA LYS 518 -2.340 7.625 3.083 344 HB2 LYS 518 HB2 LYS 518 -4.869 9.252 2.769 345 HB3 LYS 518 HB1 LYS 518 -4.689 7.750 3.661 346 HG2 LYS 518 HG2 LYS 518 -3.284 10.315 4.366 347 HG3 LYS 518 HG1 LYS 518 -4.806 9.785 5.080 348 HD2 LYS 518 HD2 LYS 518 -3.667 7.734 5.879 349 HD3 LYS 518 HD1 LYS 518 -2.147 8.363 5.238 350 HE2 LYS 518 HE2 LYS 518 -2.238 10.248 6.725 351 HE3 LYS 518 HE1 LYS 518 -3.845 9.787 7.280 352 HZ1 LYS 518 HZ1 LYS 518 -2.889 7.779 8.235 353 HZ2 LYS 518 HZ2 LYS 518 -2.152 9.158 8.872 354 HZ3 LYS 518 HZ3 LYS 518 -1.349 8.236 7.707 355 H LEU 519 HN LEU 519 -2.577 5.926 1.806 356 HA LEU 519 HA LEU 519 -4.065 6.253 -0.718 357 HB2 LEU 519 HB2 LEU 519 -1.764 5.836 -1.219 358 HB3 LEU 519 HB1 LEU 519 -1.682 4.530 -0.053 359 HG LEU 519 HG LEU 519 -3.250 3.221 -1.480 360 HD11 LEU 519 HD11 LEU 519 -3.623 3.940 -3.781 361 HD12 LEU 519 HD12 LEU 519 -2.798 5.461 -3.447 362 HD13 LEU 519 HD13 LEU 519 -4.319 5.087 -2.637 363 HD21 LEU 519 HD21 LEU 519 -0.701 4.142 -2.793 364 HD22 LEU 519 HD22 LEU 519 -1.594 2.676 -3.196 365 HD23 LEU 519 HD23 LEU 519 -0.859 2.850 -1.602 366 H TYR 520 HN TYR 520 -5.728 4.886 -1.104 367 HA TYR 520 HA TYR 520 -6.094 2.629 0.759 368 HB2 TYR 520 HB2 TYR 520 -8.282 4.107 -0.702 369 HB3 TYR 520 HB1 TYR 520 -8.477 2.884 0.545 370 HD1 TYR 520 HD1 TYR 520 -7.207 3.534 2.832 371 HD2 TYR 520 HD2 TYR 520 -8.623 6.288 -0.077 372 HE1 TYR 520 HE1 TYR 520 -7.304 5.292 4.551 373 HE2 TYR 520 HE2 TYR 520 -8.718 8.054 1.628 374 HH TYR 520 HH TYR 520 -7.336 7.655 4.763 375 H VAL 521 HN VAL 521 -6.006 0.692 -0.171 376 HA VAL 521 HA VAL 521 -6.678 0.491 -3.035 377 HB VAL 521 HB VAL 521 -4.545 -1.069 -1.560 378 HG11 VAL 521 HG11 VAL 521 -5.458 -1.252 -4.428 379 HG12 VAL 521 HG12 VAL 521 -5.667 -2.481 -3.180 380 HG13 VAL 521 HG13 VAL 521 -4.048 -2.069 -3.753 381 HG21 VAL 521 HG21 VAL 521 -4.311 0.946 -3.795 382 HG22 VAL 521 HG22 VAL 521 -2.983 0.048 -3.063 383 HG23 VAL 521 HG23 VAL 521 -3.881 1.225 -2.108 384 HA PRO 522 HA PRO 522 -9.788 -2.268 -1.446 385 HB2 PRO 522 HB2 PRO 522 -10.557 -3.262 -3.888 386 HB3 PRO 522 HB1 PRO 522 -11.132 -1.737 -3.211 387 HG2 PRO 522 HG2 PRO 522 -9.041 -2.232 -5.271 388 HG3 PRO 522 HG1 PRO 522 -10.218 -0.913 -5.155 389 HD2 PRO 522 HD2 PRO 522 -7.597 -0.640 -4.486 390 HD3 PRO 522 HD1 PRO 522 -8.893 0.308 -3.738 391 H VAL 523 HN VAL 523 -9.920 -4.418 -0.962 392 HA VAL 523 HA VAL 523 -7.557 -5.946 -1.254 393 HB VAL 523 HB VAL 523 -8.882 -7.802 -0.195 394 HG11 VAL 523 HG11 VAL 523 -7.559 -6.253 1.128 395 HG12 VAL 523 HG12 VAL 523 -9.044 -6.672 1.979 396 HG13 VAL 523 HG13 VAL 523 -8.903 -5.112 1.169 397 HG21 VAL 523 HG21 VAL 523 -11.093 -7.202 -1.036 398 HG22 VAL 523 HG22 VAL 523 -11.045 -5.697 -0.114 399 HG23 VAL 523 HG23 VAL 523 -11.083 -7.246 0.728 400 H SER 524 HN SER 524 -10.100 -5.489 -3.381 401 HA SER 524 HA SER 524 -9.795 -8.066 -4.689 402 HB2 SER 524 HB2 SER 524 -12.010 -6.880 -4.524 403 HB3 SER 524 HB1 SER 524 -11.371 -5.665 -5.624 404 HG SER 524 HG SER 524 -12.560 -7.863 -6.290 405 H SER 525 HN SER 525 -8.102 -5.222 -4.589 406 HA SER 525 HA SER 525 -7.047 -5.621 -7.313 407 HB2 SER 525 HB2 SER 525 -7.167 -3.031 -5.749 408 HB3 SER 525 HB1 SER 525 -6.511 -3.230 -7.373 409 HG SER 525 HG SER 525 -8.685 -4.016 -7.937 410 H LEU 526 HN LEU 526 -6.293 -6.822 -4.718 411 HA LEU 526 HA LEU 526 -3.960 -5.639 -3.675 412 HB2 LEU 526 HB2 LEU 526 -4.938 -8.488 -3.619 413 HB3 LEU 526 HB1 LEU 526 -3.543 -7.924 -2.725 414 HG LEU 526 HG LEU 526 -6.365 -6.935 -2.347 415 HD11 LEU 526 HD11 LEU 526 -4.675 -8.757 -0.640 416 HD12 LEU 526 HD12 LEU 526 -6.096 -9.224 -1.572 417 HD13 LEU 526 HD13 LEU 526 -6.260 -8.119 -0.207 418 HD21 LEU 526 HD21 LEU 526 -5.424 -5.844 -0.335 419 HD22 LEU 526 HD22 LEU 526 -4.772 -5.196 -1.840 420 HD23 LEU 526 HD23 LEU 526 -3.809 -6.313 -0.871 421 H HIS 527 HN HIS 527 -4.470 -7.820 -6.371 422 HA HIS 527 HA HIS 527 -1.759 -8.687 -6.524 423 HB2 HIS 527 HB2 HIS 527 -4.058 -8.862 -8.462 424 HB3 HIS 527 HB1 HIS 527 -2.452 -9.469 -8.851 425 HD1 HIS 527 HD1 HIS 527 -1.869 -11.758 -8.017 426 HD2 HIS 527 HD2 HIS 527 -5.284 -10.229 -6.205 427 HE1 HIS 527 HE1 HIS 527 -2.810 -13.641 -6.644 428 HE2 HIS 527 HE2 HIS 527 -4.871 -12.694 -5.546 429 H LEU 528 HN LEU 528 -3.027 -5.709 -7.127 430 HA LEU 528 HA LEU 528 -1.185 -5.067 -9.285 431 HB2 LEU 528 HB2 LEU 528 -3.073 -3.300 -7.730 432 HB3 LEU 528 HB1 LEU 528 -2.133 -2.806 -9.121 433 HG LEU 528 HG LEU 528 -4.352 -4.853 -9.130 434 HD11 LEU 528 HD11 LEU 528 -4.210 -2.048 -10.232 435 HD12 LEU 528 HD12 LEU 528 -5.169 -2.581 -8.853 436 HD13 LEU 528 HD13 LEU 528 -5.545 -3.177 -10.468 437 HD21 LEU 528 HD21 LEU 528 -2.658 -5.423 -10.768 438 HD22 LEU 528 HD22 LEU 528 -2.655 -3.767 -11.378 439 HD23 LEU 528 HD23 LEU 528 -4.086 -4.779 -11.581 440 H ILE 529 HN ILE 529 -1.242 -5.228 -5.910 441 HA ILE 529 HA ILE 529 0.911 -3.283 -5.558 442 HB ILE 529 HB ILE 529 -0.455 -4.997 -3.479 443 HG12 ILE 529 HG12 ILE 529 -2.011 -3.487 -4.743 444 HG13 ILE 529 HG11 ILE 529 -1.911 -3.149 -3.025 445 HG21 ILE 529 HG21 ILE 529 0.413 -3.345 -1.896 446 HG22 ILE 529 HG22 ILE 529 1.199 -2.486 -3.221 447 HG23 ILE 529 HG23 ILE 529 1.718 -4.117 -2.797 448 HD11 ILE 529 HD11 ILE 529 -0.450 -1.260 -3.460 449 HD12 ILE 529 HD12 ILE 529 -1.949 -1.110 -4.376 450 HD13 ILE 529 HD13 ILE 529 -0.471 -1.627 -5.184 451 H SER 530 HN SER 530 2.977 -3.856 -5.106 452 HA SER 530 HA SER 530 3.598 -6.717 -4.802 453 HB2 SER 530 HB2 SER 530 4.786 -4.732 -6.732 454 HB3 SER 530 HB1 SER 530 5.640 -6.195 -6.277 455 HG SER 530 HG SER 530 3.006 -6.545 -7.050 456 H ARG 531 HN ARG 531 5.341 -7.214 -3.560 457 HA ARG 531 HA ARG 531 6.063 -5.151 -1.677 458 HB2 ARG 531 HB2 ARG 531 5.533 -7.518 -1.019 459 HB3 ARG 531 HB1 ARG 531 7.039 -8.004 -1.791 460 HG2 ARG 531 HG2 ARG 531 8.282 -6.579 -0.283 461 HG3 ARG 531 HG1 ARG 531 6.776 -6.064 0.475 462 HD2 ARG 531 HD2 ARG 531 7.945 -7.803 1.779 463 HD3 ARG 531 HD1 ARG 531 6.344 -8.310 1.244 464 HE ARG 531 HE ARG 531 7.666 -9.438 -0.643 465 HH11 ARG 531 HH11 ARG 531 8.875 -9.035 2.620 466 HH12 ARG 531 HH12 ARG 531 9.814 -10.493 2.584 467 HH21 ARG 531 HH21 ARG 531 8.890 -11.337 -0.704 468 HH22 ARG 531 HH22 ARG 531 9.820 -11.810 0.682 469 H TYR 532 HN TYR 532 8.052 -4.201 -1.455 470 HA TYR 532 HA TYR 532 9.412 -3.614 -3.764 471 HB2 TYR 532 HB2 TYR 532 9.437 -2.386 -1.523 472 HB3 TYR 532 HB1 TYR 532 10.724 -3.493 -1.054 473 HD1 TYR 532 HD1 TYR 532 9.790 -0.725 -3.256 474 HD2 TYR 532 HD2 TYR 532 12.933 -3.310 -2.023 475 HE1 TYR 532 HE1 TYR 532 11.424 0.730 -4.389 476 HE2 TYR 532 HE2 TYR 532 14.575 -1.865 -3.146 477 HH TYR 532 HH TYR 532 14.641 -0.232 -4.963 478 H ALA 533 HN ALA 533 10.939 -5.441 -1.105 479 HA ALA 533 HA ALA 533 12.413 -7.159 -1.076 480 HB1 ALA 533 HB1 ALA 533 12.093 -8.967 -2.679 481 HB2 ALA 533 HB2 ALA 533 11.105 -7.910 -3.689 482 HB3 ALA 533 HB3 ALA 533 10.543 -8.372 -2.082 483 H GLY 534 HN GLY 534 13.805 -5.108 -1.579 484 HA2 GLY 534 HA2 GLY 534 15.337 -5.615 -4.056 485 HA3 GLY 534 HA1 GLY 534 15.281 -4.074 -3.211 486 H GLY 535 HN GLY 535 15.534 -5.205 -0.586 487 HA2 GLY 535 HA2 GLY 535 17.426 -6.848 0.188 488 HA3 GLY 535 HA1 GLY 535 18.434 -5.668 -0.643 489 H ALA 536 HN ALA 536 18.062 -3.368 0.033 490 HA ALA 536 HA ALA 536 17.989 -3.225 2.938 491 HB1 ALA 536 HB1 ALA 536 18.607 -1.092 0.892 492 HB2 ALA 536 HB2 ALA 536 19.794 -2.075 1.750 493 HB3 ALA 536 HB3 ALA 536 18.787 -0.931 2.638 494 H GLU 537 HN GLU 537 15.687 -3.764 2.976 495 HA GLU 537 HA GLU 537 13.721 -2.223 1.676 496 HB2 GLU 537 HB2 GLU 537 13.413 -3.819 4.224 497 HB3 GLU 537 HB1 GLU 537 12.124 -3.334 3.130 498 HG2 GLU 537 HG2 GLU 537 14.355 -5.264 2.537 499 HG3 GLU 537 HG1 GLU 537 12.661 -5.660 2.805 500 H GLU 538 HN GLU 538 15.447 -1.747 4.651 501 HA GLU 538 HA GLU 538 13.666 0.179 5.767 502 HB2 GLU 538 HB2 GLU 538 16.605 -0.299 6.273 503 HB3 GLU 538 HB1 GLU 538 15.577 0.749 7.239 504 HG2 GLU 538 HG2 GLU 538 15.327 -2.226 6.911 505 HG3 GLU 538 HG1 GLU 538 15.839 -1.351 8.352 506 H ASN 539 HN ASN 539 16.244 0.282 3.445 507 HA ASN 539 HA ASN 539 16.193 3.214 3.446 508 HB2 ASN 539 HB2 ASN 539 18.132 1.247 2.221 509 HB3 ASN 539 HB1 ASN 539 18.192 2.981 1.918 510 HD21 ASN 539 HD21 ASN 539 18.814 4.368 3.568 511 HD22 ASN 539 HD22 ASN 539 19.611 3.801 4.994 512 H ALA 540 HN ALA 540 14.322 1.048 2.209 513 HA ALA 540 HA ALA 540 14.269 1.516 -0.566 514 HB1 ALA 540 HB1 ALA 540 11.969 0.860 1.279 515 HB2 ALA 540 HB2 ALA 540 13.030 -0.314 0.502 516 HB3 ALA 540 HB3 ALA 540 11.969 0.697 -0.477 517 HA PRO 541 HA PRO 541 13.133 5.731 -0.638 518 HB2 PRO 541 HB2 PRO 541 12.231 5.924 -3.184 519 HB3 PRO 541 HB1 PRO 541 13.941 5.715 -2.788 520 HG2 PRO 541 HG2 PRO 541 11.944 3.676 -3.672 521 HG3 PRO 541 HG1 PRO 541 13.624 3.876 -4.174 522 HD2 PRO 541 HD2 PRO 541 12.832 2.026 -2.358 523 HD3 PRO 541 HD1 PRO 541 14.440 2.783 -2.329 524 H LEU 542 HN LEU 542 11.300 7.207 -1.159 525 HA LEU 542 HA LEU 542 8.701 5.871 -0.848 526 HB2 LEU 542 HB2 LEU 542 9.594 6.722 1.323 527 HB3 LEU 542 HB1 LEU 542 9.592 8.337 0.645 528 HG LEU 542 HG LEU 542 7.142 8.216 0.390 529 HD11 LEU 542 HD11 LEU 542 7.523 5.524 1.677 530 HD12 LEU 542 HD12 LEU 542 6.771 5.885 0.123 531 HD13 LEU 542 HD13 LEU 542 5.977 6.365 1.622 532 HD21 LEU 542 HD21 LEU 542 6.607 8.400 2.755 533 HD22 LEU 542 HD22 LEU 542 8.145 9.186 2.403 534 HD23 LEU 542 HD23 LEU 542 8.122 7.601 3.176 535 H HIS 543 HN HIS 543 7.349 6.457 -2.394 536 HA HIS 543 HA HIS 543 7.881 8.832 -3.989 537 HB2 HIS 543 HB2 HIS 543 6.045 6.474 -4.274 538 HB3 HIS 543 HB1 HIS 543 5.768 7.926 -5.229 539 HD1 HIS 543 HD1 HIS 543 6.290 6.507 -7.382 540 HD2 HIS 543 HD2 HIS 543 9.473 6.918 -4.729 541 HE1 HIS 543 HE1 HIS 543 8.339 5.806 -8.661 542 HE2 HIS 543 HE2 HIS 543 10.238 5.977 -7.014 543 H LYS 544 HN LYS 544 5.947 10.190 -4.630 544 HA LYS 544 HA LYS 544 4.412 10.834 -2.203 545 HB2 LYS 544 HB2 LYS 544 5.990 12.575 -3.032 546 HB3 LYS 544 HB1 LYS 544 5.101 12.622 -4.547 547 HG2 LYS 544 HG2 LYS 544 3.075 13.286 -3.245 548 HG3 LYS 544 HG1 LYS 544 4.111 13.422 -1.823 549 HD2 LYS 544 HD2 LYS 544 5.452 15.114 -2.932 550 HD3 LYS 544 HD1 LYS 544 4.487 14.944 -4.400 551 HE2 LYS 544 HE2 LYS 544 2.486 15.634 -3.083 552 HE3 LYS 544 HE1 LYS 544 3.553 15.948 -1.715 553 HZ1 LYS 544 HZ1 LYS 544 3.069 17.962 -2.965 554 HZ2 LYS 544 HZ2 LYS 544 3.719 17.276 -4.365 555 HZ3 LYS 544 HZ3 LYS 544 4.715 17.594 -3.037 556 H LEU 545 HN LEU 545 2.202 11.487 -2.454 557 HA LEU 545 HA LEU 545 0.924 10.433 -4.884 558 HB2 LEU 545 HB2 LEU 545 -0.279 10.929 -2.157 559 HB3 LEU 545 HB1 LEU 545 -1.119 10.252 -3.537 560 HG LEU 545 HG LEU 545 1.196 8.960 -2.096 561 HD11 LEU 545 HD11 LEU 545 -0.424 7.379 -1.270 562 HD12 LEU 545 HD12 LEU 545 -1.717 8.203 -2.136 563 HD13 LEU 545 HD13 LEU 545 -0.900 9.010 -0.798 564 HD21 LEU 545 HD21 LEU 545 0.629 6.998 -3.474 565 HD22 LEU 545 HD22 LEU 545 1.199 8.360 -4.435 566 HD23 LEU 545 HD23 LEU 545 -0.522 7.986 -4.370 567 H GLY 546 HN GLY 546 -0.940 11.650 -5.703 568 HA2 GLY 546 HA2 GLY 546 -0.321 14.514 -5.546 569 HA3 GLY 546 HA1 GLY 546 -1.162 13.714 -6.862 570 H GLY 547 HN GLY 547 -1.583 14.167 -3.349 571 HA2 GLY 547 HA2 GLY 547 -4.442 14.085 -3.568 572 HA3 GLY 547 HA1 GLY 547 -3.518 14.513 -2.132 Start of MODEL 2 1 H1 ARG 472 HT1 ARG 472 3.048 -12.677 -5.786 2 H2 ARG 472 HT2 ARG 472 4.634 -12.787 -5.220 3 H3 ARG 472 HT3 ARG 472 4.288 -11.846 -6.580 4 HA ARG 472 HA ARG 472 4.658 -10.501 -4.612 5 HB2 ARG 472 HB2 ARG 472 2.566 -9.174 -4.765 6 HB3 ARG 472 HB1 ARG 472 3.232 -9.594 -6.336 7 HG2 ARG 472 HG2 ARG 472 1.605 -11.401 -6.545 8 HG3 ARG 472 HG1 ARG 472 0.937 -10.981 -4.968 9 HD2 ARG 472 HD2 ARG 472 -0.382 -10.071 -6.841 10 HD3 ARG 472 HD1 ARG 472 0.260 -8.817 -5.782 11 HE ARG 472 HE ARG 472 1.700 -8.132 -7.481 12 HH11 ARG 472 HH11 ARG 472 -0.126 -10.956 -8.450 13 HH12 ARG 472 HH12 ARG 472 0.164 -10.724 -10.144 14 HH21 ARG 472 HH21 ARG 472 2.109 -7.837 -9.715 15 HH22 ARG 472 HH22 ARG 472 1.445 -8.957 -10.861 16 H ASN 473 HN ASN 473 4.007 -9.878 -2.520 17 HA ASN 473 HA ASN 473 2.439 -11.940 -1.117 18 HB2 ASN 473 HB2 ASN 473 4.813 -10.368 -0.109 19 HB3 ASN 473 HB1 ASN 473 3.846 -11.471 0.865 20 HD21 ASN 473 HD21 ASN 473 4.122 -13.664 0.642 21 HD22 ASN 473 HD22 ASN 473 5.392 -14.360 -0.307 22 H LEU 474 HN LEU 474 0.506 -10.963 -0.988 23 HA LEU 474 HA LEU 474 0.402 -8.269 0.191 24 HB2 LEU 474 HB2 LEU 474 -1.182 -9.641 -1.897 25 HB3 LEU 474 HB1 LEU 474 -2.059 -8.556 -0.834 26 HG LEU 474 HG LEU 474 -1.381 -7.459 -2.923 27 HD11 LEU 474 HD11 LEU 474 -1.550 -6.269 -0.695 28 HD12 LEU 474 HD12 LEU 474 -0.633 -5.458 -1.957 29 HD13 LEU 474 HD13 LEU 474 0.213 -6.301 -0.662 30 HD21 LEU 474 HD21 LEU 474 0.673 -8.719 -3.347 31 HD22 LEU 474 HD22 LEU 474 1.434 -7.935 -1.961 32 HD23 LEU 474 HD23 LEU 474 0.964 -6.979 -3.366 33 H ALA 475 HN ALA 475 0.187 -11.336 1.114 34 HA ALA 475 HA ALA 475 -2.070 -10.876 2.943 35 HB1 ALA 475 HB1 ALA 475 -0.693 -13.472 2.259 36 HB2 ALA 475 HB2 ALA 475 -2.228 -12.916 1.593 37 HB3 ALA 475 HB3 ALA 475 -2.094 -13.283 3.314 38 H GLU 476 HN GLU 476 1.325 -11.781 2.779 39 HA GLU 476 HA GLU 476 1.584 -11.816 5.668 40 HB2 GLU 476 HB2 GLU 476 3.659 -12.107 3.485 41 HB3 GLU 476 HB1 GLU 476 3.961 -12.328 5.205 42 HG2 GLU 476 HG2 GLU 476 2.499 -14.226 5.275 43 HG3 GLU 476 HG1 GLU 476 2.001 -13.955 3.606 44 H LEU 477 HN LEU 477 0.747 -9.365 4.356 45 HA LEU 477 HA LEU 477 2.886 -7.525 4.196 46 HB2 LEU 477 HB2 LEU 477 -0.077 -7.175 4.551 47 HB3 LEU 477 HB1 LEU 477 1.025 -5.816 4.445 48 HG LEU 477 HG LEU 477 0.694 -7.911 2.305 49 HD11 LEU 477 HD11 LEU 477 -0.395 -5.104 2.447 50 HD12 LEU 477 HD12 LEU 477 -1.342 -6.585 2.589 51 HD13 LEU 477 HD13 LEU 477 -0.526 -6.200 1.075 52 HD21 LEU 477 HD21 LEU 477 2.158 -5.276 2.346 53 HD22 LEU 477 HD22 LEU 477 1.918 -6.285 0.920 54 HD23 LEU 477 HD23 LEU 477 2.883 -6.881 2.269 55 H HIS 478 HN HIS 478 3.948 -6.504 5.688 56 HA HIS 478 HA HIS 478 2.943 -6.563 8.448 57 HB2 HIS 478 HB2 HIS 478 5.790 -6.505 7.420 58 HB3 HIS 478 HB1 HIS 478 5.344 -6.362 9.119 59 HD1 HIS 478 HD1 HIS 478 6.679 -8.800 7.063 60 HD2 HIS 478 HD2 HIS 478 3.381 -8.773 9.586 61 HE1 HIS 478 HE1 HIS 478 6.205 -11.212 7.582 62 HE2 HIS 478 HE2 HIS 478 4.079 -11.171 8.933 63 H ILE 479 HN ILE 479 3.475 -4.693 9.769 64 HA ILE 479 HA ILE 479 2.585 -2.373 8.373 65 HB ILE 479 HB ILE 479 3.511 -2.524 11.239 66 HG12 ILE 479 HG12 ILE 479 1.830 -4.251 10.863 67 HG13 ILE 479 HG11 ILE 479 1.142 -2.940 11.813 68 HG21 ILE 479 HG21 ILE 479 1.603 -0.653 9.843 69 HG22 ILE 479 HG22 ILE 479 3.249 -0.270 10.351 70 HG23 ILE 479 HG23 ILE 479 2.011 -0.623 11.559 71 HD11 ILE 479 HD11 ILE 479 0.729 -3.388 8.865 72 HD12 ILE 479 HD12 ILE 479 0.026 -2.084 9.824 73 HD13 ILE 479 HD13 ILE 479 -0.423 -3.759 10.147 74 H GLY 480 HN GLY 480 3.702 -0.706 7.603 75 HA2 GLY 480 HA2 GLY 480 5.336 0.958 7.622 76 HA3 GLY 480 HA1 GLY 480 6.248 0.021 8.796 77 H GLN 481 HN GLN 481 5.231 -1.884 6.195 78 HA GLN 481 HA GLN 481 7.996 -1.970 5.289 79 HB2 GLN 481 HB2 GLN 481 5.686 -3.862 4.892 80 HB3 GLN 481 HB1 GLN 481 7.258 -4.076 4.136 81 HG2 GLN 481 HG2 GLN 481 6.583 -4.150 7.055 82 HG3 GLN 481 HG1 GLN 481 7.246 -5.436 6.050 83 HE21 GLN 481 HE21 GLN 481 9.428 -5.389 5.492 84 HE22 GLN 481 HE22 GLN 481 10.573 -4.391 6.335 85 HA PRO 482 HA PRO 482 7.125 0.067 1.532 86 HB2 PRO 482 HB2 PRO 482 9.219 -0.741 0.053 87 HB3 PRO 482 HB1 PRO 482 9.413 0.326 1.449 88 HG2 PRO 482 HG2 PRO 482 9.881 -2.622 1.238 89 HG3 PRO 482 HG1 PRO 482 10.848 -1.390 2.069 90 HD2 PRO 482 HD2 PRO 482 9.058 -3.049 3.333 91 HD3 PRO 482 HD1 PRO 482 9.530 -1.448 3.939 92 H VAL 483 HN VAL 483 5.567 -0.398 0.167 93 HA VAL 483 HA VAL 483 5.791 -2.813 -1.490 94 HB VAL 483 HB VAL 483 3.292 -3.013 -1.467 95 HG11 VAL 483 HG11 VAL 483 4.651 -4.528 -0.148 96 HG12 VAL 483 HG12 VAL 483 3.164 -4.137 0.715 97 HG13 VAL 483 HG13 VAL 483 4.683 -3.373 1.184 98 HG21 VAL 483 HG21 VAL 483 2.734 -0.777 -0.695 99 HG22 VAL 483 HG22 VAL 483 3.508 -1.101 0.855 100 HG23 VAL 483 HG23 VAL 483 2.057 -1.990 0.392 101 H VAL 484 HN VAL 484 4.971 -2.575 -3.611 102 HA VAL 484 HA VAL 484 4.875 0.245 -4.401 103 HB VAL 484 HB VAL 484 5.448 -0.526 -6.680 104 HG11 VAL 484 HG11 VAL 484 7.786 -1.079 -6.175 105 HG12 VAL 484 HG12 VAL 484 7.336 -1.370 -4.494 106 HG13 VAL 484 HG13 VAL 484 7.177 0.246 -5.181 107 HG21 VAL 484 HG21 VAL 484 5.780 -3.213 -5.361 108 HG22 VAL 484 HG22 VAL 484 6.260 -2.805 -7.009 109 HG23 VAL 484 HG23 VAL 484 4.555 -2.784 -6.554 110 H HIS 485 HN HIS 485 3.246 1.120 -5.329 111 HA HIS 485 HA HIS 485 0.871 -0.468 -5.996 112 HB2 HIS 485 HB2 HIS 485 0.760 1.641 -4.566 113 HB3 HIS 485 HB1 HIS 485 1.213 2.547 -5.993 114 HD1 HIS 485 HD1 HIS 485 -1.083 3.829 -5.734 115 HD2 HIS 485 HD2 HIS 485 -1.415 -0.234 -6.583 116 HE1 HIS 485 HE1 HIS 485 -3.466 3.472 -6.449 117 HE2 HIS 485 HE2 HIS 485 -3.602 1.047 -7.099 118 H LEU 486 HN LEU 486 0.669 -1.113 -8.047 119 HA LEU 486 HA LEU 486 2.510 -0.643 -10.027 120 HB2 LEU 486 HB2 LEU 486 1.108 -1.820 -11.509 121 HB3 LEU 486 HB1 LEU 486 0.842 -2.492 -9.920 122 HG LEU 486 HG LEU 486 -1.270 -2.469 -10.867 123 HD11 LEU 486 HD11 LEU 486 -1.336 -1.468 -8.652 124 HD12 LEU 486 HD12 LEU 486 -2.611 -0.837 -9.693 125 HD13 LEU 486 HD13 LEU 486 -1.175 0.134 -9.370 126 HD21 LEU 486 HD21 LEU 486 -0.738 0.289 -11.934 127 HD22 LEU 486 HD22 LEU 486 -2.256 -0.594 -12.089 128 HD23 LEU 486 HD23 LEU 486 -0.795 -1.212 -12.859 129 H GLU 487 HN GLU 487 -0.029 1.440 -9.106 130 HA GLU 487 HA GLU 487 -0.088 2.905 -11.585 131 HB2 GLU 487 HB2 GLU 487 -1.402 3.331 -8.909 132 HB3 GLU 487 HB1 GLU 487 -1.589 4.440 -10.260 133 HG2 GLU 487 HG2 GLU 487 -2.628 2.737 -11.588 134 HG3 GLU 487 HG1 GLU 487 -2.303 1.523 -10.352 135 H HIS 488 HN HIS 488 1.022 3.570 -8.226 136 HA HIS 488 HA HIS 488 2.370 5.928 -9.361 137 HB2 HIS 488 HB2 HIS 488 0.737 5.696 -6.884 138 HB3 HIS 488 HB1 HIS 488 2.048 6.872 -6.938 139 HD1 HIS 488 HD1 HIS 488 -1.435 6.427 -7.905 140 HD2 HIS 488 HD2 HIS 488 1.763 8.753 -9.171 141 HE1 HIS 488 HE1 HIS 488 -2.445 8.274 -9.268 142 HE2 HIS 488 HE2 HIS 488 -0.521 9.829 -9.736 143 H GLY 489 HN GLY 489 2.849 3.119 -7.385 144 HA2 GLY 489 HA2 GLY 489 5.174 2.367 -7.600 145 HA3 GLY 489 HA1 GLY 489 5.660 4.013 -7.245 146 H VAL 490 HN VAL 490 7.014 3.195 -5.657 147 HA VAL 490 HA VAL 490 6.219 1.454 -3.590 148 HB VAL 490 HB VAL 490 8.517 1.577 -4.266 149 HG11 VAL 490 HG11 VAL 490 8.591 4.400 -3.221 150 HG12 VAL 490 HG12 VAL 490 8.516 3.957 -4.925 151 HG13 VAL 490 HG13 VAL 490 9.914 3.500 -3.958 152 HG21 VAL 490 HG21 VAL 490 9.654 1.912 -2.098 153 HG22 VAL 490 HG22 VAL 490 8.200 0.916 -1.974 154 HG23 VAL 490 HG23 VAL 490 8.162 2.602 -1.455 155 H GLY 491 HN GLY 491 5.370 1.744 -1.671 156 HA2 GLY 491 HA2 GLY 491 5.503 4.364 -0.358 157 HA3 GLY 491 HA1 GLY 491 3.920 3.626 -0.591 158 H ARG 492 HN ARG 492 4.323 4.034 1.924 159 HA ARG 492 HA ARG 492 5.510 1.594 3.059 160 HB2 ARG 492 HB2 ARG 492 4.851 4.257 4.316 161 HB3 ARG 492 HB1 ARG 492 5.335 2.844 5.246 162 HG2 ARG 492 HG2 ARG 492 6.978 4.088 3.061 163 HG3 ARG 492 HG1 ARG 492 7.186 4.418 4.785 164 HD2 ARG 492 HD2 ARG 492 7.663 2.055 5.180 165 HD3 ARG 492 HD1 ARG 492 7.428 1.713 3.468 166 HE ARG 492 HE ARG 492 9.356 3.528 3.342 167 HH11 ARG 492 HH11 ARG 492 9.018 0.790 5.502 168 HH12 ARG 492 HH12 ARG 492 10.728 0.532 5.638 169 HH21 ARG 492 HH21 ARG 492 11.595 3.197 3.522 170 HH22 ARG 492 HH22 ARG 492 12.199 1.886 4.490 171 H TYR 493 HN TYR 493 4.184 0.025 3.521 172 HA TYR 493 HA TYR 493 1.365 0.272 3.494 173 HB2 TYR 493 HB2 TYR 493 2.607 -1.814 2.943 174 HB3 TYR 493 HB1 TYR 493 3.060 -1.960 4.633 175 HD1 TYR 493 HD1 TYR 493 0.064 -1.769 2.423 176 HD2 TYR 493 HD2 TYR 493 1.705 -3.134 6.106 177 HE1 TYR 493 HE1 TYR 493 -1.995 -3.033 2.873 178 HE2 TYR 493 HE2 TYR 493 -0.353 -4.394 6.565 179 HH TYR 493 HH TYR 493 -2.775 -4.884 4.174 180 H ALA 494 HN ALA 494 -0.060 0.711 5.104 181 HA ALA 494 HA ALA 494 0.910 0.450 7.873 182 HB1 ALA 494 HB1 ALA 494 -0.523 2.880 6.810 183 HB2 ALA 494 HB2 ALA 494 1.181 2.802 7.265 184 HB3 ALA 494 HB3 ALA 494 -0.073 2.595 8.490 185 H GLY 495 HN GLY 495 -0.356 -1.305 8.252 186 HA2 GLY 495 HA2 GLY 495 -2.229 -2.490 8.807 187 HA3 GLY 495 HA1 GLY 495 -2.863 -0.940 9.319 188 H MET 496 HN MET 496 -4.916 -1.558 8.750 189 HA MET 496 HA MET 496 -5.508 -1.210 5.919 190 HB2 MET 496 HB2 MET 496 -6.204 -3.603 7.548 191 HB3 MET 496 HB1 MET 496 -7.412 -3.004 6.419 192 HG2 MET 496 HG2 MET 496 -5.822 -3.208 4.594 193 HG3 MET 496 HG1 MET 496 -4.596 -3.784 5.716 194 HE1 MET 496 HE1 MET 496 -6.291 -5.673 7.643 195 HE2 MET 496 HE2 MET 496 -4.714 -6.095 6.978 196 HE3 MET 496 HE3 MET 496 -6.059 -7.225 6.842 197 H THR 497 HN THR 497 -7.615 -0.479 5.509 198 HA THR 497 HA THR 497 -9.062 0.521 7.860 199 HB THR 497 HB THR 497 -7.800 2.419 7.117 200 HG1 THR 497 HG1 THR 497 -9.983 2.879 7.614 201 HG21 THR 497 HG21 THR 497 -8.860 1.838 4.350 202 HG22 THR 497 HG22 THR 497 -7.188 1.687 4.892 203 HG23 THR 497 HG23 THR 497 -7.945 3.276 4.808 204 H THR 498 HN THR 498 -11.231 0.249 7.737 205 HA THR 498 HA THR 498 -12.292 -0.897 5.281 206 HB THR 498 HB THR 498 -14.390 -0.913 7.008 207 HG1 THR 498 HG1 THR 498 -13.728 -0.825 9.023 208 HG21 THR 498 HG21 THR 498 -12.161 -2.944 6.863 209 HG22 THR 498 HG22 THR 498 -13.524 -2.820 5.750 210 HG23 THR 498 HG23 THR 498 -13.799 -3.253 7.438 211 H LEU 499 HN LEU 499 -13.481 0.230 3.897 212 HA LEU 499 HA LEU 499 -14.330 2.926 4.723 213 HB2 LEU 499 HB2 LEU 499 -13.630 1.912 1.965 214 HB3 LEU 499 HB1 LEU 499 -14.177 3.534 2.335 215 HG LEU 499 HG LEU 499 -11.582 2.292 3.260 216 HD11 LEU 499 HD11 LEU 499 -12.120 4.476 1.256 217 HD12 LEU 499 HD12 LEU 499 -11.621 2.827 0.876 218 HD13 LEU 499 HD13 LEU 499 -10.535 3.895 1.766 219 HD21 LEU 499 HD21 LEU 499 -12.696 5.063 3.679 220 HD22 LEU 499 HD22 LEU 499 -11.056 4.553 4.077 221 HD23 LEU 499 HD23 LEU 499 -12.430 3.841 4.921 222 H GLU 500 HN GLU 500 -16.399 3.534 4.439 223 HA GLU 500 HA GLU 500 -18.197 1.605 3.140 224 HB2 GLU 500 HB2 GLU 500 -18.689 3.460 5.465 225 HB3 GLU 500 HB1 GLU 500 -19.985 2.643 4.600 226 HG2 GLU 500 HG2 GLU 500 -19.067 0.487 5.198 227 HG3 GLU 500 HG1 GLU 500 -17.704 1.268 5.995 228 H ALA 501 HN ALA 501 -18.685 2.291 1.202 229 HA ALA 501 HA ALA 501 -19.178 5.161 0.780 230 HB1 ALA 501 HB1 ALA 501 -18.443 4.788 -1.541 231 HB2 ALA 501 HB2 ALA 501 -18.088 3.106 -1.140 232 HB3 ALA 501 HB3 ALA 501 -17.176 4.407 -0.375 233 H GLY 502 HN GLY 502 -20.770 5.638 -0.907 234 HA2 GLY 502 HA2 GLY 502 -23.099 3.976 -0.594 235 HA3 GLY 502 HA1 GLY 502 -23.004 5.489 -1.486 236 H GLY 503 HN GLY 503 -22.061 2.080 -1.643 237 HA2 GLY 503 HA2 GLY 503 -23.138 1.259 -3.925 238 HA3 GLY 503 HA1 GLY 503 -21.814 2.237 -4.542 239 H ILE 504 HN ILE 504 -19.818 1.692 -2.742 240 HA ILE 504 HA ILE 504 -19.484 -1.227 -2.874 241 HB ILE 504 HB ILE 504 -17.370 0.782 -3.679 242 HG12 ILE 504 HG12 ILE 504 -18.864 -1.233 -5.376 243 HG13 ILE 504 HG11 ILE 504 -19.173 0.501 -5.368 244 HG21 ILE 504 HG21 ILE 504 -17.324 -2.234 -3.657 245 HG22 ILE 504 HG22 ILE 504 -16.430 -1.169 -2.572 246 HG23 ILE 504 HG23 ILE 504 -16.050 -1.195 -4.294 247 HD11 ILE 504 HD11 ILE 504 -16.920 0.905 -6.199 248 HD12 ILE 504 HD12 ILE 504 -17.830 -0.150 -7.279 249 HD13 ILE 504 HD13 ILE 504 -16.608 -0.830 -6.204 250 H THR 505 HN THR 505 -19.113 -1.951 -0.892 251 HA THR 505 HA THR 505 -17.500 -0.296 0.939 252 HB THR 505 HB THR 505 -18.729 -1.286 2.818 253 HG1 THR 505 HG1 THR 505 -19.527 -3.204 2.133 254 HG21 THR 505 HG21 THR 505 -19.526 0.830 1.874 255 HG22 THR 505 HG22 THR 505 -20.854 -0.132 2.518 256 HG23 THR 505 HG23 THR 505 -20.582 -0.059 0.777 257 H GLY 506 HN GLY 506 -16.135 -1.522 2.445 258 HA2 GLY 506 HA2 GLY 506 -15.927 -4.169 2.841 259 HA3 GLY 506 HA1 GLY 506 -15.173 -3.993 1.266 260 H GLU 507 HN GLU 507 -13.339 -4.907 2.397 261 HA GLU 507 HA GLU 507 -11.925 -3.204 4.263 262 HB2 GLU 507 HB2 GLU 507 -11.222 -5.836 2.974 263 HB3 GLU 507 HB1 GLU 507 -10.204 -5.007 4.142 264 HG2 GLU 507 HG2 GLU 507 -11.791 -5.303 5.871 265 HG3 GLU 507 HG1 GLU 507 -13.028 -5.837 4.733 266 H TYR 508 HN TYR 508 -10.166 -1.972 3.812 267 HA TYR 508 HA TYR 508 -9.072 -2.076 1.090 268 HB2 TYR 508 HB2 TYR 508 -9.921 0.421 2.572 269 HB3 TYR 508 HB1 TYR 508 -8.954 0.423 1.101 270 HD1 TYR 508 HD1 TYR 508 -9.971 0.184 -1.030 271 HD2 TYR 508 HD2 TYR 508 -12.259 -0.474 2.493 272 HE1 TYR 508 HE1 TYR 508 -12.024 0.112 -2.380 273 HE2 TYR 508 HE2 TYR 508 -14.311 -0.557 1.160 274 HH TYR 508 HH TYR 508 -14.306 -0.840 -2.209 275 H LEU 509 HN LEU 509 -7.033 -1.710 0.867 276 HA LEU 509 HA LEU 509 -5.316 -2.045 3.101 277 HB2 LEU 509 HB2 LEU 509 -4.719 -3.125 1.118 278 HB3 LEU 509 HB1 LEU 509 -5.059 -1.717 0.140 279 HG LEU 509 HG LEU 509 -2.762 -1.670 2.047 280 HD11 LEU 509 HD11 LEU 509 -2.545 -3.744 0.800 281 HD12 LEU 509 HD12 LEU 509 -1.368 -2.565 0.217 282 HD13 LEU 509 HD13 LEU 509 -2.839 -2.884 -0.708 283 HD21 LEU 509 HD21 LEU 509 -2.955 -0.493 -0.700 284 HD22 LEU 509 HD22 LEU 509 -1.933 -0.002 0.652 285 HD23 LEU 509 HD23 LEU 509 -3.665 0.325 0.690 286 H MET 510 HN MET 510 -4.106 -0.535 4.146 287 HA MET 510 HA MET 510 -4.495 2.248 3.298 288 HB2 MET 510 HB2 MET 510 -5.069 1.181 5.717 289 HB3 MET 510 HB1 MET 510 -3.400 1.668 5.985 290 HG2 MET 510 HG2 MET 510 -3.984 3.945 5.227 291 HG3 MET 510 HG1 MET 510 -5.662 3.434 5.105 292 HE1 MET 510 HE1 MET 510 -4.620 5.946 6.833 293 HE2 MET 510 HE2 MET 510 -5.612 5.758 8.279 294 HE3 MET 510 HE3 MET 510 -6.318 5.495 6.686 295 H LEU 511 HN LEU 511 -2.818 3.194 2.393 296 HA LEU 511 HA LEU 511 -0.113 2.297 3.142 297 HB2 LEU 511 HB2 LEU 511 -1.375 2.450 0.552 298 HB3 LEU 511 HB1 LEU 511 0.019 3.507 0.611 299 HG LEU 511 HG LEU 511 0.365 0.719 1.595 300 HD11 LEU 511 HD11 LEU 511 0.635 1.300 -1.320 301 HD12 LEU 511 HD12 LEU 511 -0.919 0.793 -0.667 302 HD13 LEU 511 HD13 LEU 511 0.490 -0.252 -0.492 303 HD21 LEU 511 HD21 LEU 511 2.170 2.371 1.721 304 HD22 LEU 511 HD22 LEU 511 2.067 2.606 -0.025 305 HD23 LEU 511 HD23 LEU 511 2.570 1.047 0.627 306 H THR 512 HN THR 512 1.499 3.889 3.233 307 HA THR 512 HA THR 512 0.502 6.655 3.240 308 HB THR 512 HB THR 512 2.530 6.890 4.965 309 HG1 THR 512 HG1 THR 512 1.940 4.195 4.890 310 HG21 THR 512 HG21 THR 512 -0.268 6.000 5.664 311 HG22 THR 512 HG22 THR 512 0.275 7.657 5.392 312 HG23 THR 512 HG23 THR 512 0.866 6.753 6.785 313 H TYR 513 HN TYR 513 1.603 8.069 2.088 314 HA TYR 513 HA TYR 513 4.213 7.254 1.005 315 HB2 TYR 513 HB2 TYR 513 1.967 8.846 -0.209 316 HB3 TYR 513 HB1 TYR 513 3.607 8.959 -0.832 317 HD1 TYR 513 HD1 TYR 513 1.109 6.315 0.070 318 HD2 TYR 513 HD2 TYR 513 4.155 7.602 -2.604 319 HE1 TYR 513 HE1 TYR 513 0.702 4.343 -1.337 320 HE2 TYR 513 HE2 TYR 513 3.756 5.631 -4.019 321 HH TYR 513 HH TYR 513 2.821 3.375 -3.813 322 H ALA 514 HN ALA 514 5.107 9.632 0.034 323 HA ALA 514 HA ALA 514 6.120 10.894 2.324 324 HB1 ALA 514 HB1 ALA 514 7.197 10.891 0.091 325 HB2 ALA 514 HB2 ALA 514 7.112 12.488 0.832 326 HB3 ALA 514 HB3 ALA 514 5.987 12.053 -0.453 327 H ASN 515 HN ASN 515 5.728 12.910 3.232 328 HA ASN 515 HA ASN 515 4.491 14.620 4.061 329 HB2 ASN 515 HB2 ASN 515 4.376 15.341 1.661 330 HB3 ASN 515 HB1 ASN 515 2.868 14.450 1.509 331 HD21 ASN 515 HD21 ASN 515 3.806 16.291 4.353 332 HD22 ASN 515 HD22 ASN 515 2.589 17.509 4.182 333 H ASP 516 HN ASP 516 3.821 11.736 4.283 334 HA ASP 516 HA ASP 516 2.350 10.402 5.365 335 HB2 ASP 516 HB2 ASP 516 1.372 13.072 6.371 336 HB3 ASP 516 HB1 ASP 516 0.753 11.536 6.958 337 H ALA 517 HN ALA 517 1.713 11.176 2.668 338 HA ALA 517 HA ALA 517 -1.079 11.688 2.438 339 HB1 ALA 517 HB1 ALA 517 -0.789 11.151 0.085 340 HB2 ALA 517 HB2 ALA 517 0.807 10.480 0.418 341 HB3 ALA 517 HB3 ALA 517 0.511 12.205 0.641 342 H LYS 518 HN LYS 518 -2.768 10.263 2.055 343 HA LYS 518 HA LYS 518 -2.212 7.541 3.000 344 HB2 LYS 518 HB2 LYS 518 -4.848 9.018 2.926 345 HB3 LYS 518 HB1 LYS 518 -4.558 7.446 3.655 346 HG2 LYS 518 HG2 LYS 518 -3.443 10.089 4.569 347 HG3 LYS 518 HG1 LYS 518 -4.690 9.129 5.366 348 HD2 LYS 518 HD2 LYS 518 -3.013 7.302 5.629 349 HD3 LYS 518 HD1 LYS 518 -1.789 8.400 4.990 350 HE2 LYS 518 HE2 LYS 518 -3.407 8.743 7.510 351 HE3 LYS 518 HE1 LYS 518 -1.681 8.410 7.396 352 HZ1 LYS 518 HZ1 LYS 518 -2.013 10.720 7.854 353 HZ2 LYS 518 HZ2 LYS 518 -3.072 10.894 6.552 354 HZ3 LYS 518 HZ3 LYS 518 -1.431 10.583 6.269 355 H LEU 519 HN LEU 519 -2.378 5.906 1.655 356 HA LEU 519 HA LEU 519 -3.944 6.236 -0.816 357 HB2 LEU 519 HB2 LEU 519 -1.634 5.772 -1.296 358 HB3 LEU 519 HB1 LEU 519 -1.616 4.440 -0.157 359 HG LEU 519 HG LEU 519 -3.216 3.218 -1.617 360 HD11 LEU 519 HD11 LEU 519 -4.261 5.061 -2.747 361 HD12 LEU 519 HD12 LEU 519 -3.482 4.021 -3.939 362 HD13 LEU 519 HD13 LEU 519 -2.726 5.542 -3.466 363 HD21 LEU 519 HD21 LEU 519 -0.643 4.064 -2.937 364 HD22 LEU 519 HD22 LEU 519 -1.590 2.630 -3.336 365 HD23 LEU 519 HD23 LEU 519 -0.831 2.771 -1.751 366 H TYR 520 HN TYR 520 -5.574 4.823 -1.262 367 HA TYR 520 HA TYR 520 -6.001 2.619 0.645 368 HB2 TYR 520 HB2 TYR 520 -8.197 4.202 -0.700 369 HB3 TYR 520 HB1 TYR 520 -8.380 2.986 0.555 370 HD1 TYR 520 HD1 TYR 520 -7.412 3.495 2.854 371 HD2 TYR 520 HD2 TYR 520 -7.927 6.466 -0.143 372 HE1 TYR 520 HE1 TYR 520 -7.295 5.246 4.577 373 HE2 TYR 520 HE2 TYR 520 -7.812 8.224 1.571 374 HH TYR 520 HH TYR 520 -6.839 7.582 4.807 375 H VAL 521 HN VAL 521 -5.976 0.698 -0.297 376 HA VAL 521 HA VAL 521 -6.701 0.514 -3.151 377 HB VAL 521 HB VAL 521 -4.605 -1.086 -1.659 378 HG11 VAL 521 HG11 VAL 521 -4.150 -2.168 -3.817 379 HG12 VAL 521 HG12 VAL 521 -5.540 -1.335 -4.515 380 HG13 VAL 521 HG13 VAL 521 -5.776 -2.517 -3.227 381 HG21 VAL 521 HG21 VAL 521 -3.032 -0.065 -3.231 382 HG22 VAL 521 HG22 VAL 521 -3.867 1.157 -2.272 383 HG23 VAL 521 HG23 VAL 521 -4.347 0.870 -3.944 384 HA PRO 522 HA PRO 522 -9.848 -2.242 -1.592 385 HB2 PRO 522 HB2 PRO 522 -10.575 -3.279 -4.025 386 HB3 PRO 522 HB1 PRO 522 -11.154 -1.733 -3.400 387 HG2 PRO 522 HG2 PRO 522 -8.999 -2.289 -5.386 388 HG3 PRO 522 HG1 PRO 522 -10.196 -0.982 -5.362 389 HD2 PRO 522 HD2 PRO 522 -7.611 -0.635 -4.614 390 HD3 PRO 522 HD1 PRO 522 -8.946 0.301 -3.920 391 H VAL 523 HN VAL 523 -9.897 -4.381 -1.036 392 HA VAL 523 HA VAL 523 -7.473 -5.828 -1.314 393 HB VAL 523 HB VAL 523 -8.688 -7.686 -0.142 394 HG11 VAL 523 HG11 VAL 523 -8.868 -6.475 1.983 395 HG12 VAL 523 HG12 VAL 523 -8.835 -4.944 1.109 396 HG13 VAL 523 HG13 VAL 523 -7.425 -6.005 1.083 397 HG21 VAL 523 HG21 VAL 523 -10.954 -5.694 -0.076 398 HG22 VAL 523 HG22 VAL 523 -10.897 -7.234 0.781 399 HG23 VAL 523 HG23 VAL 523 -10.942 -7.206 -0.982 400 H SER 524 HN SER 524 -10.024 -5.510 -3.425 401 HA SER 524 HA SER 524 -9.813 -8.109 -4.642 402 HB2 SER 524 HB2 SER 524 -10.981 -5.587 -5.826 403 HB3 SER 524 HB1 SER 524 -11.336 -7.249 -6.291 404 HG SER 524 HG SER 524 -12.987 -6.552 -4.974 405 H SER 525 HN SER 525 -8.113 -5.131 -4.745 406 HA SER 525 HA SER 525 -6.907 -5.765 -7.346 407 HB2 SER 525 HB2 SER 525 -6.895 -3.175 -5.781 408 HB3 SER 525 HB1 SER 525 -6.185 -3.414 -7.376 409 HG SER 525 HG SER 525 -8.558 -4.235 -7.743 410 H LEU 526 HN LEU 526 -6.215 -6.974 -4.681 411 HA LEU 526 HA LEU 526 -3.704 -5.965 -3.846 412 HB2 LEU 526 HB2 LEU 526 -4.904 -8.716 -3.558 413 HB3 LEU 526 HB1 LEU 526 -3.435 -8.192 -2.757 414 HG LEU 526 HG LEU 526 -6.202 -7.067 -2.323 415 HD11 LEU 526 HD11 LEU 526 -4.410 -8.714 -0.546 416 HD12 LEU 526 HD12 LEU 526 -5.892 -9.261 -1.328 417 HD13 LEU 526 HD13 LEU 526 -5.961 -8.016 -0.081 418 HD21 LEU 526 HD21 LEU 526 -3.569 -6.319 -1.057 419 HD22 LEU 526 HD22 LEU 526 -5.153 -5.761 -0.518 420 HD23 LEU 526 HD23 LEU 526 -4.553 -5.305 -2.113 421 H HIS 527 HN HIS 527 -4.627 -7.786 -6.580 422 HA HIS 527 HA HIS 527 -2.051 -9.027 -6.986 423 HB2 HIS 527 HB2 HIS 527 -4.514 -8.844 -8.723 424 HB3 HIS 527 HB1 HIS 527 -3.026 -9.624 -9.251 425 HD1 HIS 527 HD1 HIS 527 -2.569 -11.972 -8.399 426 HD2 HIS 527 HD2 HIS 527 -5.888 -10.204 -6.626 427 HE1 HIS 527 HE1 HIS 527 -3.717 -13.810 -7.130 428 HE2 HIS 527 HE2 HIS 527 -5.802 -12.754 -6.198 429 H LEU 528 HN LEU 528 -2.756 -5.969 -6.980 430 HA LEU 528 HA LEU 528 -1.195 -5.330 -9.394 431 HB2 LEU 528 HB2 LEU 528 -3.168 -3.606 -7.895 432 HB3 LEU 528 HB1 LEU 528 -2.233 -3.098 -9.285 433 HG LEU 528 HG LEU 528 -4.371 -5.227 -9.270 434 HD11 LEU 528 HD11 LEU 528 -4.299 -2.478 -10.506 435 HD12 LEU 528 HD12 LEU 528 -5.235 -2.950 -9.089 436 HD13 LEU 528 HD13 LEU 528 -5.605 -3.651 -10.664 437 HD21 LEU 528 HD21 LEU 528 -4.054 -5.266 -11.701 438 HD22 LEU 528 HD22 LEU 528 -2.604 -5.786 -10.846 439 HD23 LEU 528 HD23 LEU 528 -2.687 -4.167 -11.538 440 H ILE 529 HN ILE 529 -0.925 -5.696 -6.176 441 HA ILE 529 HA ILE 529 1.016 -3.515 -5.838 442 HB ILE 529 HB ILE 529 -0.142 -5.322 -3.722 443 HG12 ILE 529 HG12 ILE 529 -1.867 -3.991 -4.991 444 HG13 ILE 529 HG11 ILE 529 -1.812 -3.700 -3.263 445 HG21 ILE 529 HG21 ILE 529 1.919 -4.209 -3.066 446 HG22 ILE 529 HG22 ILE 529 0.551 -3.539 -2.177 447 HG23 ILE 529 HG23 ILE 529 1.243 -2.648 -3.533 448 HD11 ILE 529 HD11 ILE 529 -2.102 -1.627 -4.519 449 HD12 ILE 529 HD12 ILE 529 -0.604 -1.938 -5.395 450 HD13 ILE 529 HD13 ILE 529 -0.562 -1.627 -3.659 451 H SER 530 HN SER 530 3.064 -4.094 -4.763 452 HA SER 530 HA SER 530 3.791 -6.905 -4.688 453 HB2 SER 530 HB2 SER 530 4.181 -5.899 -7.068 454 HB3 SER 530 HB1 SER 530 5.526 -5.057 -6.308 455 HG SER 530 HG SER 530 6.618 -6.851 -6.244 456 H ARG 531 HN ARG 531 5.762 -7.278 -3.615 457 HA ARG 531 HA ARG 531 6.168 -5.291 -1.545 458 HB2 ARG 531 HB2 ARG 531 5.804 -7.728 -1.057 459 HB3 ARG 531 HB1 ARG 531 7.371 -8.048 -1.788 460 HG2 ARG 531 HG2 ARG 531 8.484 -6.772 -0.123 461 HG3 ARG 531 HG1 ARG 531 6.946 -6.217 0.538 462 HD2 ARG 531 HD2 ARG 531 7.943 -8.014 1.897 463 HD3 ARG 531 HD1 ARG 531 6.381 -8.471 1.220 464 HE ARG 531 HE ARG 531 8.532 -9.314 -0.449 465 HH11 ARG 531 HH11 ARG 531 6.827 -10.107 2.506 466 HH12 ARG 531 HH12 ARG 531 7.178 -11.803 2.404 467 HH21 ARG 531 HH21 ARG 531 9.025 -11.546 -0.562 468 HH22 ARG 531 HH22 ARG 531 8.430 -12.619 0.664 469 H TYR 532 HN TYR 532 7.980 -4.113 -1.277 470 HA TYR 532 HA TYR 532 9.757 -3.927 -3.518 471 HB2 TYR 532 HB2 TYR 532 8.808 -2.009 -2.086 472 HB3 TYR 532 HB1 TYR 532 10.042 -2.453 -0.911 473 HD1 TYR 532 HD1 TYR 532 12.468 -2.428 -1.670 474 HD2 TYR 532 HD2 TYR 532 9.318 -0.647 -3.884 475 HE1 TYR 532 HE1 TYR 532 14.117 -1.066 -2.895 476 HE2 TYR 532 HE2 TYR 532 10.947 0.723 -5.125 477 HH TYR 532 HH TYR 532 13.227 1.574 -4.859 478 H ALA 533 HN ALA 533 11.010 -5.735 -3.590 479 HA ALA 533 HA ALA 533 12.859 -6.990 -3.267 480 HB1 ALA 533 HB1 ALA 533 14.667 -6.175 -1.868 481 HB2 ALA 533 HB2 ALA 533 13.586 -4.996 -1.125 482 HB3 ALA 533 HB3 ALA 533 13.993 -4.863 -2.836 483 H GLY 534 HN GLY 534 12.018 -5.914 0.027 484 HA2 GLY 534 HA2 GLY 534 10.709 -7.691 1.296 485 HA3 GLY 534 HA1 GLY 534 12.034 -8.752 0.838 486 H GLY 535 HN GLY 535 14.262 -7.735 1.385 487 HA2 GLY 535 HA2 GLY 535 14.112 -6.964 4.222 488 HA3 GLY 535 HA1 GLY 535 15.467 -7.783 3.459 489 H ALA 536 HN ALA 536 15.007 -5.766 1.148 490 HA ALA 536 HA ALA 536 16.900 -3.821 2.155 491 HB1 ALA 536 HB1 ALA 536 17.182 -4.796 -0.081 492 HB2 ALA 536 HB2 ALA 536 17.028 -3.040 -0.145 493 HB3 ALA 536 HB3 ALA 536 15.659 -4.060 -0.586 494 H GLU 537 HN GLU 537 14.819 -3.385 3.645 495 HA GLU 537 HA GLU 537 12.838 -1.668 2.469 496 HB2 GLU 537 HB2 GLU 537 12.047 -1.432 4.833 497 HB3 GLU 537 HB1 GLU 537 12.127 -3.089 4.251 498 HG2 GLU 537 HG2 GLU 537 14.167 -3.473 5.455 499 HG3 GLU 537 HG1 GLU 537 14.251 -1.776 5.928 500 H GLU 538 HN GLU 538 15.866 -1.236 4.098 501 HA GLU 538 HA GLU 538 15.412 1.486 4.863 502 HB2 GLU 538 HB2 GLU 538 17.061 0.012 5.988 503 HB3 GLU 538 HB1 GLU 538 18.022 -0.003 4.516 504 HG2 GLU 538 HG2 GLU 538 18.410 2.375 4.707 505 HG3 GLU 538 HG1 GLU 538 17.375 2.449 6.134 506 H ASN 539 HN ASN 539 16.517 -0.172 2.039 507 HA ASN 539 HA ASN 539 17.607 2.197 0.783 508 HB2 ASN 539 HB2 ASN 539 17.074 -0.545 -0.381 509 HB3 ASN 539 HB1 ASN 539 18.029 0.730 -1.131 510 HD21 ASN 539 HD21 ASN 539 20.085 1.157 -0.370 511 HD22 ASN 539 HD22 ASN 539 20.911 0.091 0.710 512 H ALA 540 HN ALA 540 14.568 0.981 1.295 513 HA ALA 540 HA ALA 540 13.369 1.528 -1.241 514 HB1 ALA 540 HB1 ALA 540 12.078 1.165 1.460 515 HB2 ALA 540 HB2 ALA 540 12.419 -0.117 0.298 516 HB3 ALA 540 HB3 ALA 540 11.252 1.144 -0.099 517 HA PRO 541 HA PRO 541 12.867 5.905 -0.467 518 HB2 PRO 541 HB2 PRO 541 12.088 6.587 -2.914 519 HB3 PRO 541 HB1 PRO 541 13.738 6.016 -2.629 520 HG2 PRO 541 HG2 PRO 541 11.391 4.541 -3.743 521 HG3 PRO 541 HG1 PRO 541 13.072 4.511 -4.277 522 HD2 PRO 541 HD2 PRO 541 11.902 2.611 -2.641 523 HD3 PRO 541 HD1 PRO 541 13.647 2.914 -2.759 524 H LEU 542 HN LEU 542 11.041 7.510 -0.827 525 HA LEU 542 HA LEU 542 8.433 6.161 -0.659 526 HB2 LEU 542 HB2 LEU 542 9.372 6.891 1.569 527 HB3 LEU 542 HB1 LEU 542 9.248 8.542 0.999 528 HG LEU 542 HG LEU 542 6.824 8.337 0.832 529 HD11 LEU 542 HD11 LEU 542 5.757 6.275 1.799 530 HD12 LEU 542 HD12 LEU 542 7.339 5.501 1.691 531 HD13 LEU 542 HD13 LEU 542 6.531 6.065 0.230 532 HD21 LEU 542 HD21 LEU 542 6.315 8.092 3.222 533 HD22 LEU 542 HD22 LEU 542 7.761 9.065 2.955 534 HD23 LEU 542 HD23 LEU 542 7.912 7.389 3.482 535 H HIS 543 HN HIS 543 7.208 6.796 -2.290 536 HA HIS 543 HA HIS 543 7.788 9.173 -3.802 537 HB2 HIS 543 HB2 HIS 543 5.693 7.021 -4.002 538 HB3 HIS 543 HB1 HIS 543 5.597 8.470 -4.995 539 HD1 HIS 543 HD1 HIS 543 5.826 6.752 -7.022 540 HD2 HIS 543 HD2 HIS 543 9.186 7.167 -4.602 541 HE1 HIS 543 HE1 HIS 543 7.734 5.772 -8.334 542 HE2 HIS 543 HE2 HIS 543 9.731 5.930 -6.807 543 H LYS 544 HN LYS 544 6.322 10.910 -4.191 544 HA LYS 544 HA LYS 544 4.642 11.560 -1.885 545 HB2 LYS 544 HB2 LYS 544 6.214 13.286 -2.510 546 HB3 LYS 544 HB1 LYS 544 5.684 13.226 -4.185 547 HG2 LYS 544 HG2 LYS 544 3.409 13.969 -3.348 548 HG3 LYS 544 HG1 LYS 544 4.201 14.304 -1.806 549 HD2 LYS 544 HD2 LYS 544 5.126 15.459 -4.431 550 HD3 LYS 544 HD1 LYS 544 3.975 16.270 -3.369 551 HE2 LYS 544 HE2 LYS 544 6.739 15.406 -2.535 552 HE3 LYS 544 HE1 LYS 544 6.338 17.027 -3.100 553 HZ1 LYS 544 HZ1 LYS 544 6.337 16.945 -0.706 554 HZ2 LYS 544 HZ2 LYS 544 5.220 15.683 -0.702 555 HZ3 LYS 544 HZ3 LYS 544 4.761 17.211 -1.255 556 H LEU 545 HN LEU 545 2.455 11.665 -2.006 557 HA LEU 545 HA LEU 545 1.215 11.016 -4.561 558 HB2 LEU 545 HB2 LEU 545 0.078 11.213 -1.778 559 HB3 LEU 545 HB1 LEU 545 -0.900 10.916 -3.199 560 HG LEU 545 HG LEU 545 1.241 9.111 -2.076 561 HD11 LEU 545 HD11 LEU 545 -0.857 9.083 -0.839 562 HD12 LEU 545 HD12 LEU 545 -0.616 7.572 -1.714 563 HD13 LEU 545 HD13 LEU 545 -1.743 8.778 -2.334 564 HD21 LEU 545 HD21 LEU 545 0.558 7.538 -3.847 565 HD22 LEU 545 HD22 LEU 545 1.315 8.995 -4.488 566 HD23 LEU 545 HD23 LEU 545 -0.436 8.807 -4.561 567 H GLY 546 HN GLY 546 2.170 13.298 -5.081 568 HA2 GLY 546 HA2 GLY 546 0.213 15.389 -4.438 569 HA3 GLY 546 HA1 GLY 546 1.741 15.620 -5.283 570 H GLY 547 HN GLY 547 0.222 12.902 -6.370 571 HA2 GLY 547 HA2 GLY 547 -1.785 13.586 -8.075 572 HA3 GLY 547 HA1 GLY 547 -0.312 14.010 -8.946 Start of MODEL 3 1 H1 ARG 472 HT1 ARG 472 4.466 -11.387 -6.096 2 H2 ARG 472 HT2 ARG 472 3.116 -12.373 -6.365 3 H3 ARG 472 HT3 ARG 472 4.190 -12.732 -5.111 4 HA ARG 472 HA ARG 472 3.589 -10.783 -3.919 5 HB2 ARG 472 HB2 ARG 472 1.831 -9.293 -4.714 6 HB3 ARG 472 HB1 ARG 472 3.145 -9.345 -5.880 7 HG2 ARG 472 HG2 ARG 472 1.884 -10.779 -7.328 8 HG3 ARG 472 HG1 ARG 472 0.612 -10.949 -6.120 9 HD2 ARG 472 HD2 ARG 472 -0.075 -9.372 -7.820 10 HD3 ARG 472 HD1 ARG 472 0.158 -8.535 -6.287 11 HE ARG 472 HE ARG 472 2.186 -7.614 -7.147 12 HH11 ARG 472 HH11 ARG 472 0.247 -9.306 -9.533 13 HH12 ARG 472 HH12 ARG 472 0.973 -8.488 -10.880 14 HH21 ARG 472 HH21 ARG 472 3.140 -6.550 -8.908 15 HH22 ARG 472 HH22 ARG 472 2.615 -6.909 -10.526 16 H ASN 473 HN ASN 473 1.816 -10.785 -2.475 17 HA ASN 473 HA ASN 473 -0.451 -12.508 -3.000 18 HB2 ASN 473 HB2 ASN 473 1.188 -14.120 -2.133 19 HB3 ASN 473 HB1 ASN 473 1.452 -13.104 -0.719 20 HD21 ASN 473 HD21 ASN 473 0.808 -14.647 0.738 21 HD22 ASN 473 HD22 ASN 473 -0.837 -15.155 0.903 22 H LEU 474 HN LEU 474 1.358 -10.549 -0.718 23 HA LEU 474 HA LEU 474 0.787 -8.998 0.814 24 HB2 LEU 474 HB2 LEU 474 -1.742 -8.791 -0.828 25 HB3 LEU 474 HB1 LEU 474 -1.262 -7.658 0.417 26 HG LEU 474 HG LEU 474 -0.554 -6.502 -1.406 27 HD11 LEU 474 HD11 LEU 474 1.446 -6.988 -0.050 28 HD12 LEU 474 HD12 LEU 474 1.812 -6.692 -1.746 29 HD13 LEU 474 HD13 LEU 474 1.811 -8.338 -1.118 30 HD21 LEU 474 HD21 LEU 474 -0.024 -9.130 -2.758 31 HD22 LEU 474 HD22 LEU 474 0.317 -7.554 -3.470 32 HD23 LEU 474 HD23 LEU 474 -1.341 -7.999 -3.076 33 H ALA 475 HN ALA 475 -1.861 -8.395 1.826 34 HA ALA 475 HA ALA 475 -3.337 -9.023 3.426 35 HB1 ALA 475 HB1 ALA 475 -4.074 -11.323 3.632 36 HB2 ALA 475 HB2 ALA 475 -2.718 -11.869 2.646 37 HB3 ALA 475 HB3 ALA 475 -3.977 -10.862 1.932 38 H GLU 476 HN GLU 476 -0.470 -11.117 3.425 39 HA GLU 476 HA GLU 476 -0.276 -10.972 6.327 40 HB2 GLU 476 HB2 GLU 476 1.497 -12.293 4.259 41 HB3 GLU 476 HB1 GLU 476 1.703 -12.432 6.000 42 HG2 GLU 476 HG2 GLU 476 -0.381 -13.583 6.221 43 HG3 GLU 476 HG1 GLU 476 -0.768 -13.296 4.526 44 H LEU 477 HN LEU 477 -0.102 -8.573 4.761 45 HA LEU 477 HA LEU 477 2.597 -7.716 4.490 46 HB2 LEU 477 HB2 LEU 477 -0.087 -6.402 4.367 47 HB3 LEU 477 HB1 LEU 477 1.362 -5.417 4.416 48 HG LEU 477 HG LEU 477 1.044 -7.573 2.350 49 HD11 LEU 477 HD11 LEU 477 -0.931 -6.091 2.226 50 HD12 LEU 477 HD12 LEU 477 0.120 -5.941 0.817 51 HD13 LEU 477 HD13 LEU 477 0.149 -4.705 2.078 52 HD21 LEU 477 HD21 LEU 477 2.614 -6.141 1.135 53 HD22 LEU 477 HD22 LEU 477 3.260 -6.611 2.705 54 HD23 LEU 477 HD23 LEU 477 2.599 -4.993 2.470 55 H HIS 478 HN HIS 478 3.852 -6.557 5.844 56 HA HIS 478 HA HIS 478 2.948 -6.386 8.621 57 HB2 HIS 478 HB2 HIS 478 5.683 -6.336 7.346 58 HB3 HIS 478 HB1 HIS 478 5.429 -5.946 9.043 59 HD1 HIS 478 HD1 HIS 478 5.618 -7.871 10.588 60 HD2 HIS 478 HD2 HIS 478 4.630 -9.073 6.734 61 HE1 HIS 478 HE1 HIS 478 5.592 -10.383 10.647 62 HE2 HIS 478 HE2 HIS 478 4.806 -11.078 8.359 63 H ILE 479 HN ILE 479 3.397 -4.499 9.879 64 HA ILE 479 HA ILE 479 2.557 -2.134 8.529 65 HB ILE 479 HB ILE 479 3.549 -2.439 11.366 66 HG12 ILE 479 HG12 ILE 479 1.631 -3.897 10.953 67 HG13 ILE 479 HG11 ILE 479 1.161 -2.549 11.980 68 HG21 ILE 479 HG21 ILE 479 1.876 -0.261 10.124 69 HG22 ILE 479 HG22 ILE 479 3.588 -0.133 10.536 70 HG23 ILE 479 HG23 ILE 479 2.385 -0.359 11.809 71 HD11 ILE 479 HD11 ILE 479 0.175 -1.434 10.028 72 HD12 ILE 479 HD12 ILE 479 -0.556 -3.005 10.355 73 HD13 ILE 479 HD13 ILE 479 0.603 -2.829 9.037 74 H GLY 480 HN GLY 480 3.745 -0.599 7.629 75 HA2 GLY 480 HA2 GLY 480 5.500 0.945 7.492 76 HA3 GLY 480 HA1 GLY 480 6.404 -0.014 8.657 77 H GLN 481 HN GLN 481 5.122 -2.036 6.347 78 HA GLN 481 HA GLN 481 7.733 -2.571 5.283 79 HB2 GLN 481 HB2 GLN 481 5.479 -4.088 5.703 80 HB3 GLN 481 HB1 GLN 481 5.466 -3.874 3.957 81 HG2 GLN 481 HG2 GLN 481 6.630 -5.895 4.484 82 HG3 GLN 481 HG1 GLN 481 7.790 -4.712 3.878 83 HE21 GLN 481 HE21 GLN 481 9.554 -5.651 4.888 84 HE22 GLN 481 HE22 GLN 481 9.757 -5.626 6.611 85 HA PRO 482 HA PRO 482 7.213 0.067 1.731 86 HB2 PRO 482 HB2 PRO 482 9.436 -0.701 0.394 87 HB3 PRO 482 HB1 PRO 482 9.491 0.373 1.796 88 HG2 PRO 482 HG2 PRO 482 10.030 -2.564 1.635 89 HG3 PRO 482 HG1 PRO 482 10.907 -1.311 2.536 90 HD2 PRO 482 HD2 PRO 482 9.100 -2.990 3.687 91 HD3 PRO 482 HD1 PRO 482 9.409 -1.345 4.278 92 H VAL 483 HN VAL 483 5.795 -0.361 0.216 93 HA VAL 483 HA VAL 483 6.117 -2.754 -1.450 94 HB VAL 483 HB VAL 483 3.618 -2.994 -1.518 95 HG11 VAL 483 HG11 VAL 483 4.926 -3.387 1.172 96 HG12 VAL 483 HG12 VAL 483 4.980 -4.509 -0.187 97 HG13 VAL 483 HG13 VAL 483 3.450 -4.180 0.622 98 HG21 VAL 483 HG21 VAL 483 3.722 -1.167 0.884 99 HG22 VAL 483 HG22 VAL 483 2.297 -2.021 0.290 100 HG23 VAL 483 HG23 VAL 483 3.043 -0.760 -0.693 101 H VAL 484 HN VAL 484 5.224 -2.520 -3.579 102 HA VAL 484 HA VAL 484 5.055 0.314 -4.322 103 HB VAL 484 HB VAL 484 5.866 -0.291 -6.535 104 HG11 VAL 484 HG11 VAL 484 8.152 -0.922 -5.928 105 HG12 VAL 484 HG12 VAL 484 7.584 -1.390 -4.326 106 HG13 VAL 484 HG13 VAL 484 7.492 0.296 -4.837 107 HG21 VAL 484 HG21 VAL 484 6.670 -2.519 -7.038 108 HG22 VAL 484 HG22 VAL 484 4.937 -2.510 -6.700 109 HG23 VAL 484 HG23 VAL 484 6.073 -3.088 -5.477 110 H HIS 485 HN HIS 485 3.353 1.069 -5.208 111 HA HIS 485 HA HIS 485 1.146 -0.697 -5.985 112 HB2 HIS 485 HB2 HIS 485 0.783 1.286 -4.449 113 HB3 HIS 485 HB1 HIS 485 1.198 2.328 -5.795 114 HD1 HIS 485 HD1 HIS 485 -1.167 3.401 -5.658 115 HD2 HIS 485 HD2 HIS 485 -1.188 -0.654 -6.565 116 HE1 HIS 485 HE1 HIS 485 -3.500 2.897 -6.450 117 HE2 HIS 485 HE2 HIS 485 -3.516 0.428 -6.926 118 H LEU 486 HN LEU 486 0.737 -1.085 -8.076 119 HA LEU 486 HA LEU 486 2.578 -0.489 -10.043 120 HB2 LEU 486 HB2 LEU 486 1.170 -1.580 -11.575 121 HB3 LEU 486 HB1 LEU 486 0.926 -2.363 -10.033 122 HG LEU 486 HG LEU 486 -1.199 -2.303 -10.926 123 HD11 LEU 486 HD11 LEU 486 -1.150 0.269 -9.377 124 HD12 LEU 486 HD12 LEU 486 -1.197 -1.342 -8.667 125 HD13 LEU 486 HD13 LEU 486 -2.540 -0.779 -9.662 126 HD21 LEU 486 HD21 LEU 486 -0.675 0.492 -11.897 127 HD22 LEU 486 HD22 LEU 486 -2.198 -0.379 -12.069 128 HD23 LEU 486 HD23 LEU 486 -0.746 -0.974 -12.874 129 H GLU 487 HN GLU 487 0.085 1.525 -8.885 130 HA GLU 487 HA GLU 487 0.023 3.211 -11.225 131 HB2 GLU 487 HB2 GLU 487 -1.286 3.322 -8.530 132 HB3 GLU 487 HB1 GLU 487 -1.351 4.694 -9.634 133 HG2 GLU 487 HG2 GLU 487 -2.363 1.913 -10.186 134 HG3 GLU 487 HG1 GLU 487 -3.345 3.336 -9.834 135 H HIS 488 HN HIS 488 1.128 3.629 -7.826 136 HA HIS 488 HA HIS 488 2.486 6.069 -8.744 137 HB2 HIS 488 HB2 HIS 488 1.212 5.347 -6.171 138 HB3 HIS 488 HB1 HIS 488 2.630 6.388 -6.104 139 HD1 HIS 488 HD1 HIS 488 2.154 8.809 -6.326 140 HD2 HIS 488 HD2 HIS 488 -0.810 6.473 -8.074 141 HE1 HIS 488 HE1 HIS 488 0.379 10.419 -7.094 142 HE2 HIS 488 HE2 HIS 488 -1.470 8.967 -7.990 143 H GLY 489 HN GLY 489 3.066 3.145 -6.820 144 HA2 GLY 489 HA2 GLY 489 5.296 2.164 -7.335 145 HA3 GLY 489 HA1 GLY 489 5.938 3.778 -7.082 146 H VAL 490 HN VAL 490 7.295 3.275 -5.453 147 HA VAL 490 HA VAL 490 6.677 1.511 -3.339 148 HB VAL 490 HB VAL 490 8.958 1.832 -4.068 149 HG11 VAL 490 HG11 VAL 490 8.836 4.174 -4.716 150 HG12 VAL 490 HG12 VAL 490 10.191 3.887 -3.627 151 HG13 VAL 490 HG13 VAL 490 8.722 4.647 -3.022 152 HG21 VAL 490 HG21 VAL 490 10.062 2.193 -1.890 153 HG22 VAL 490 HG22 VAL 490 8.682 1.098 -1.790 154 HG23 VAL 490 HG23 VAL 490 8.527 2.765 -1.235 155 H GLY 491 HN GLY 491 5.705 1.783 -1.493 156 HA2 GLY 491 HA2 GLY 491 5.745 4.385 -0.150 157 HA3 GLY 491 HA1 GLY 491 4.177 3.645 -0.465 158 H ARG 492 HN ARG 492 4.561 4.048 2.095 159 HA ARG 492 HA ARG 492 5.672 1.560 3.208 160 HB2 ARG 492 HB2 ARG 492 5.063 4.220 4.492 161 HB3 ARG 492 HB1 ARG 492 5.536 2.787 5.395 162 HG2 ARG 492 HG2 ARG 492 7.193 3.984 3.198 163 HG3 ARG 492 HG1 ARG 492 7.384 4.403 4.905 164 HD2 ARG 492 HD2 ARG 492 7.742 1.967 5.371 165 HD3 ARG 492 HD1 ARG 492 7.757 1.694 3.631 166 HE ARG 492 HE ARG 492 9.638 3.597 3.940 167 HH11 ARG 492 HH11 ARG 492 9.104 0.530 5.554 168 HH12 ARG 492 HH12 ARG 492 10.792 0.258 5.863 169 HH21 ARG 492 HH21 ARG 492 11.847 3.251 4.353 170 HH22 ARG 492 HH22 ARG 492 12.361 1.813 5.177 171 H TYR 493 HN TYR 493 4.283 0.022 3.620 172 HA TYR 493 HA TYR 493 1.488 0.320 3.505 173 HB2 TYR 493 HB2 TYR 493 2.665 -1.789 3.028 174 HB3 TYR 493 HB1 TYR 493 3.134 -1.909 4.716 175 HD1 TYR 493 HD1 TYR 493 0.183 -1.851 2.464 176 HD2 TYR 493 HD2 TYR 493 1.728 -2.924 6.281 177 HE1 TYR 493 HE1 TYR 493 -1.878 -3.098 2.949 178 HE2 TYR 493 HE2 TYR 493 -0.332 -4.165 6.779 179 HH TYR 493 HH TYR 493 -2.678 -4.201 6.061 180 H ALA 494 HN ALA 494 -0.037 0.722 5.035 181 HA ALA 494 HA ALA 494 0.771 0.504 7.855 182 HB1 ALA 494 HB1 ALA 494 -0.239 2.637 8.396 183 HB2 ALA 494 HB2 ALA 494 -0.647 2.895 6.701 184 HB3 ALA 494 HB3 ALA 494 1.043 2.851 7.203 185 H GLY 495 HN GLY 495 -0.515 -1.272 8.151 186 HA2 GLY 495 HA2 GLY 495 -2.416 -2.399 8.708 187 HA3 GLY 495 HA1 GLY 495 -3.036 -0.829 9.157 188 H MET 496 HN MET 496 -5.069 -1.571 8.585 189 HA MET 496 HA MET 496 -5.640 -1.229 5.742 190 HB2 MET 496 HB2 MET 496 -6.500 -3.551 7.443 191 HB3 MET 496 HB1 MET 496 -7.503 -3.009 6.105 192 HG2 MET 496 HG2 MET 496 -5.558 -3.323 4.601 193 HG3 MET 496 HG1 MET 496 -4.672 -4.009 5.955 194 HE1 MET 496 HE1 MET 496 -4.205 -6.178 4.454 195 HE2 MET 496 HE2 MET 496 -5.130 -5.448 3.141 196 HE3 MET 496 HE3 MET 496 -5.485 -7.095 3.659 197 H THR 497 HN THR 497 -7.665 -0.389 5.296 198 HA THR 497 HA THR 497 -9.251 0.521 7.589 199 HB THR 497 HB THR 497 -7.901 2.424 6.964 200 HG1 THR 497 HG1 THR 497 -10.422 2.526 7.139 201 HG21 THR 497 HG21 THR 497 -7.964 3.387 4.705 202 HG22 THR 497 HG22 THR 497 -8.933 2.018 4.158 203 HG23 THR 497 HG23 THR 497 -7.277 1.763 4.708 204 H THR 498 HN THR 498 -11.429 0.281 7.273 205 HA THR 498 HA THR 498 -12.222 -0.847 4.697 206 HB THR 498 HB THR 498 -14.043 -0.549 7.069 207 HG1 THR 498 HG1 THR 498 -11.787 -1.758 7.273 208 HG21 THR 498 HG21 THR 498 -15.009 -2.629 6.124 209 HG22 THR 498 HG22 THR 498 -13.853 -2.513 4.792 210 HG23 THR 498 HG23 THR 498 -15.079 -1.262 5.012 211 H LEU 499 HN LEU 499 -13.585 0.158 3.311 212 HA LEU 499 HA LEU 499 -14.269 2.927 4.012 213 HB2 LEU 499 HB2 LEU 499 -13.705 1.720 1.306 214 HB3 LEU 499 HB1 LEU 499 -14.245 3.367 1.565 215 HG LEU 499 HG LEU 499 -11.622 2.175 2.468 216 HD11 LEU 499 HD11 LEU 499 -10.645 3.801 0.935 217 HD12 LEU 499 HD12 LEU 499 -12.260 4.321 0.454 218 HD13 LEU 499 HD13 LEU 499 -11.716 2.683 0.091 219 HD21 LEU 499 HD21 LEU 499 -12.400 3.725 4.151 220 HD22 LEU 499 HD22 LEU 499 -12.749 4.935 2.917 221 HD23 LEU 499 HD23 LEU 499 -11.082 4.456 3.235 222 H GLU 500 HN GLU 500 -16.292 3.340 4.291 223 HA GLU 500 HA GLU 500 -18.251 1.338 3.492 224 HB2 GLU 500 HB2 GLU 500 -18.440 3.615 5.469 225 HB3 GLU 500 HB1 GLU 500 -19.697 2.420 5.173 226 HG2 GLU 500 HG2 GLU 500 -18.297 0.657 6.004 227 HG3 GLU 500 HG1 GLU 500 -16.927 1.757 6.144 228 H ALA 501 HN ALA 501 -18.952 1.747 1.491 229 HA ALA 501 HA ALA 501 -19.696 4.486 0.768 230 HB1 ALA 501 HB1 ALA 501 -19.394 2.010 -0.926 231 HB2 ALA 501 HB2 ALA 501 -18.234 3.333 -0.795 232 HB3 ALA 501 HB3 ALA 501 -19.813 3.614 -1.528 233 H GLY 502 HN GLY 502 -21.721 4.569 -0.666 234 HA2 GLY 502 HA2 GLY 502 -23.920 3.771 0.924 235 HA3 GLY 502 HA1 GLY 502 -24.011 4.490 -0.676 236 H GLY 503 HN GLY 503 -24.032 1.560 1.158 237 HA2 GLY 503 HA2 GLY 503 -25.454 -0.231 0.473 238 HA3 GLY 503 HA1 GLY 503 -25.137 0.200 -1.201 239 H ILE 504 HN ILE 504 -22.233 0.465 -0.688 240 HA ILE 504 HA ILE 504 -21.583 -2.385 -0.385 241 HB ILE 504 HB ILE 504 -20.453 -0.599 -2.549 242 HG12 ILE 504 HG12 ILE 504 -22.436 -2.880 -2.773 243 HG13 ILE 504 HG11 ILE 504 -22.826 -1.174 -2.956 244 HG21 ILE 504 HG21 ILE 504 -18.892 -2.298 -1.776 245 HG22 ILE 504 HG22 ILE 504 -19.467 -2.683 -3.399 246 HG23 ILE 504 HG23 ILE 504 -20.114 -3.548 -2.006 247 HD11 ILE 504 HD11 ILE 504 -20.991 -2.769 -4.728 248 HD12 ILE 504 HD12 ILE 504 -21.375 -1.057 -4.914 249 HD13 ILE 504 HD13 ILE 504 -22.640 -2.271 -5.108 250 H THR 505 HN THR 505 -20.364 -2.438 1.378 251 HA THR 505 HA THR 505 -18.278 -0.392 1.707 252 HB THR 505 HB THR 505 -18.240 -0.963 4.069 253 HG1 THR 505 HG1 THR 505 -19.499 -3.215 3.201 254 HG21 THR 505 HG21 THR 505 -21.126 -0.722 3.225 255 HG22 THR 505 HG22 THR 505 -19.986 0.619 3.182 256 HG23 THR 505 HG23 THR 505 -20.392 -0.143 4.721 257 H GLY 506 HN GLY 506 -16.109 -1.044 1.918 258 HA2 GLY 506 HA2 GLY 506 -15.610 -3.915 1.558 259 HA3 GLY 506 HA1 GLY 506 -15.067 -2.816 0.302 260 H GLU 507 HN GLU 507 -13.400 -4.540 1.712 261 HA GLU 507 HA GLU 507 -12.021 -3.029 3.766 262 HB2 GLU 507 HB2 GLU 507 -11.427 -5.686 2.464 263 HB3 GLU 507 HB1 GLU 507 -10.480 -4.991 3.770 264 HG2 GLU 507 HG2 GLU 507 -12.363 -5.117 5.262 265 HG3 GLU 507 HG1 GLU 507 -13.403 -5.674 3.952 266 H TYR 508 HN TYR 508 -10.334 -1.744 3.445 267 HA TYR 508 HA TYR 508 -8.894 -1.953 0.881 268 HB2 TYR 508 HB2 TYR 508 -9.836 0.544 2.292 269 HB3 TYR 508 HB1 TYR 508 -8.612 0.561 1.028 270 HD1 TYR 508 HD1 TYR 508 -12.053 -0.766 1.603 271 HD2 TYR 508 HD2 TYR 508 -9.322 0.999 -1.128 272 HE1 TYR 508 HE1 TYR 508 -13.835 -0.633 -0.071 273 HE2 TYR 508 HE2 TYR 508 -11.099 1.140 -2.823 274 HH TYR 508 HH TYR 508 -14.405 0.587 -2.062 275 H LEU 509 HN LEU 509 -6.829 -1.576 0.845 276 HA LEU 509 HA LEU 509 -5.281 -1.874 3.231 277 HB2 LEU 509 HB2 LEU 509 -4.539 -3.055 1.362 278 HB3 LEU 509 HB1 LEU 509 -4.860 -1.730 0.275 279 HG LEU 509 HG LEU 509 -2.608 -1.587 2.251 280 HD11 LEU 509 HD11 LEU 509 -2.614 -2.777 -0.518 281 HD12 LEU 509 HD12 LEU 509 -2.374 -3.662 0.987 282 HD13 LEU 509 HD13 LEU 509 -1.177 -2.476 0.461 283 HD21 LEU 509 HD21 LEU 509 -3.463 0.428 0.914 284 HD22 LEU 509 HD22 LEU 509 -2.813 -0.402 -0.503 285 HD23 LEU 509 HD23 LEU 509 -1.741 0.056 0.819 286 H MET 510 HN MET 510 -4.060 -0.272 4.235 287 HA MET 510 HA MET 510 -4.323 2.418 3.080 288 HB2 MET 510 HB2 MET 510 -4.895 1.625 5.663 289 HB3 MET 510 HB1 MET 510 -3.269 2.282 5.805 290 HG2 MET 510 HG2 MET 510 -4.214 4.273 4.444 291 HG3 MET 510 HG1 MET 510 -5.777 3.659 4.964 292 HE1 MET 510 HE1 MET 510 -5.419 3.875 8.881 293 HE2 MET 510 HE2 MET 510 -5.195 2.507 7.790 294 HE3 MET 510 HE3 MET 510 -6.559 3.601 7.569 295 H LEU 511 HN LEU 511 -2.589 3.330 2.268 296 HA LEU 511 HA LEU 511 0.053 2.352 3.124 297 HB2 LEU 511 HB2 LEU 511 -1.129 2.489 0.491 298 HB3 LEU 511 HB1 LEU 511 0.327 3.459 0.567 299 HG LEU 511 HG LEU 511 0.437 0.667 1.614 300 HD11 LEU 511 HD11 LEU 511 0.810 1.278 -1.300 301 HD12 LEU 511 HD12 LEU 511 -0.725 0.696 -0.657 302 HD13 LEU 511 HD13 LEU 511 0.726 -0.295 -0.502 303 HD21 LEU 511 HD21 LEU 511 2.718 0.834 0.787 304 HD22 LEU 511 HD22 LEU 511 2.343 2.194 1.845 305 HD23 LEU 511 HD23 LEU 511 2.365 2.416 0.095 306 H THR 512 HN THR 512 1.686 3.831 3.320 307 HA THR 512 HA THR 512 0.758 6.617 3.463 308 HB THR 512 HB THR 512 3.243 6.012 4.890 309 HG1 THR 512 HG1 THR 512 1.785 4.050 5.134 310 HG21 THR 512 HG21 THR 512 0.606 7.211 5.721 311 HG22 THR 512 HG22 THR 512 1.988 8.103 5.085 312 HG23 THR 512 HG23 THR 512 2.108 7.280 6.641 313 H TYR 513 HN TYR 513 1.539 7.888 1.972 314 HA TYR 513 HA TYR 513 4.157 7.275 0.787 315 HB2 TYR 513 HB2 TYR 513 1.697 8.613 -0.274 316 HB3 TYR 513 HB1 TYR 513 3.260 8.964 -0.996 317 HD1 TYR 513 HD1 TYR 513 1.124 6.051 -0.038 318 HD2 TYR 513 HD2 TYR 513 3.984 7.646 -2.754 319 HE1 TYR 513 HE1 TYR 513 0.918 4.039 -1.432 320 HE2 TYR 513 HE2 TYR 513 3.782 5.637 -4.155 321 HH TYR 513 HH TYR 513 3.102 3.227 -3.832 322 H ALA 514 HN ALA 514 4.755 9.736 -0.290 323 HA ALA 514 HA ALA 514 6.007 11.045 1.797 324 HB1 ALA 514 HB1 ALA 514 6.466 12.827 0.244 325 HB2 ALA 514 HB2 ALA 514 5.162 12.287 -0.811 326 HB3 ALA 514 HB3 ALA 514 6.592 11.278 -0.589 327 H ASN 515 HN ASN 515 5.583 12.786 3.062 328 HA ASN 515 HA ASN 515 4.427 14.356 4.221 329 HB2 ASN 515 HB2 ASN 515 4.087 15.366 1.965 330 HB3 ASN 515 HB1 ASN 515 2.590 14.457 1.813 331 HD21 ASN 515 HD21 ASN 515 1.324 16.261 1.622 332 HD22 ASN 515 HD22 ASN 515 1.020 17.345 2.934 333 H ASP 516 HN ASP 516 3.820 11.518 4.452 334 HA ASP 516 HA ASP 516 2.383 10.104 5.484 335 HB2 ASP 516 HB2 ASP 516 1.557 12.748 6.633 336 HB3 ASP 516 HB1 ASP 516 0.661 11.291 7.040 337 H ALA 517 HN ALA 517 1.706 10.997 2.828 338 HA ALA 517 HA ALA 517 -1.095 11.502 2.674 339 HB1 ALA 517 HB1 ALA 517 -0.831 11.152 0.283 340 HB2 ALA 517 HB2 ALA 517 0.789 10.507 0.546 341 HB3 ALA 517 HB3 ALA 517 0.443 12.196 0.911 342 H LYS 518 HN LYS 518 -2.765 10.128 2.242 343 HA LYS 518 HA LYS 518 -2.233 7.354 3.004 344 HB2 LYS 518 HB2 LYS 518 -4.860 8.848 2.909 345 HB3 LYS 518 HB1 LYS 518 -4.596 7.248 3.587 346 HG2 LYS 518 HG2 LYS 518 -3.267 9.737 4.613 347 HG3 LYS 518 HG1 LYS 518 -4.778 9.091 5.255 348 HD2 LYS 518 HD2 LYS 518 -3.609 6.978 5.787 349 HD3 LYS 518 HD1 LYS 518 -2.101 7.695 5.213 350 HE2 LYS 518 HE2 LYS 518 -2.273 9.432 6.926 351 HE3 LYS 518 HE1 LYS 518 -3.785 8.729 7.494 352 HZ1 LYS 518 HZ1 LYS 518 -1.945 8.050 8.882 353 HZ2 LYS 518 HZ2 LYS 518 -1.123 7.412 7.554 354 HZ3 LYS 518 HZ3 LYS 518 -2.570 6.707 8.069 355 H LEU 519 HN LEU 519 -2.193 5.871 1.497 356 HA LEU 519 HA LEU 519 -3.804 6.214 -0.936 357 HB2 LEU 519 HB2 LEU 519 -1.543 5.711 -1.475 358 HB3 LEU 519 HB1 LEU 519 -1.459 4.446 -0.265 359 HG LEU 519 HG LEU 519 -3.068 3.108 -1.610 360 HD11 LEU 519 HD11 LEU 519 -2.685 5.329 -3.608 361 HD12 LEU 519 HD12 LEU 519 -4.190 4.847 -2.827 362 HD13 LEU 519 HD13 LEU 519 -3.404 3.761 -3.973 363 HD21 LEU 519 HD21 LEU 519 -1.465 2.485 -3.358 364 HD22 LEU 519 HD22 LEU 519 -0.700 2.676 -1.781 365 HD23 LEU 519 HD23 LEU 519 -0.531 3.938 -3.003 366 H TYR 520 HN TYR 520 -5.520 4.932 -1.316 367 HA TYR 520 HA TYR 520 -6.019 2.731 0.577 368 HB2 TYR 520 HB2 TYR 520 -8.065 4.247 -1.037 369 HB3 TYR 520 HB1 TYR 520 -8.385 3.053 0.208 370 HD1 TYR 520 HD1 TYR 520 -7.983 3.614 2.587 371 HD2 TYR 520 HD2 TYR 520 -7.603 6.522 -0.487 372 HE1 TYR 520 HE1 TYR 520 -8.115 5.406 4.270 373 HE2 TYR 520 HE2 TYR 520 -7.728 8.318 1.183 374 HH TYR 520 HH TYR 520 -7.443 7.761 4.511 375 H VAL 521 HN VAL 521 -5.732 0.812 -0.304 376 HA VAL 521 HA VAL 521 -6.434 0.455 -3.146 377 HB VAL 521 HB VAL 521 -4.329 -1.032 -1.566 378 HG11 VAL 521 HG11 VAL 521 -5.399 -2.547 -3.083 379 HG12 VAL 521 HG12 VAL 521 -3.818 -2.119 -3.740 380 HG13 VAL 521 HG13 VAL 521 -5.280 -1.382 -4.400 381 HG21 VAL 521 HG21 VAL 521 -4.046 0.842 -3.911 382 HG22 VAL 521 HG22 VAL 521 -2.736 -0.008 -3.093 383 HG23 VAL 521 HG23 VAL 521 -3.654 1.229 -2.237 384 HA PRO 522 HA PRO 522 -9.547 -2.154 -1.317 385 HB2 PRO 522 HB2 PRO 522 -10.453 -3.230 -3.666 386 HB3 PRO 522 HB1 PRO 522 -10.941 -1.647 -3.063 387 HG2 PRO 522 HG2 PRO 522 -8.928 -2.344 -5.148 388 HG3 PRO 522 HG1 PRO 522 -10.076 -0.994 -5.101 389 HD2 PRO 522 HD2 PRO 522 -7.438 -0.723 -4.515 390 HD3 PRO 522 HD1 PRO 522 -8.692 0.290 -3.785 391 H VAL 523 HN VAL 523 -9.582 -4.246 -0.658 392 HA VAL 523 HA VAL 523 -7.292 -5.851 -1.123 393 HB VAL 523 HB VAL 523 -8.485 -7.626 0.135 394 HG11 VAL 523 HG11 VAL 523 -7.195 -5.937 1.322 395 HG12 VAL 523 HG12 VAL 523 -8.621 -6.394 2.255 396 HG13 VAL 523 HG13 VAL 523 -8.601 -4.872 1.364 397 HG21 VAL 523 HG21 VAL 523 -10.750 -7.177 -0.665 398 HG22 VAL 523 HG22 VAL 523 -10.753 -5.637 0.196 399 HG23 VAL 523 HG23 VAL 523 -10.681 -7.152 1.097 400 H SER 524 HN SER 524 -10.003 -5.353 -3.000 401 HA SER 524 HA SER 524 -9.977 -7.933 -4.310 402 HB2 SER 524 HB2 SER 524 -11.386 -5.376 -5.098 403 HB3 SER 524 HB1 SER 524 -11.702 -6.984 -5.744 404 HG SER 524 HG SER 524 -12.261 -7.594 -3.554 405 H SER 525 HN SER 525 -7.967 -5.316 -4.355 406 HA SER 525 HA SER 525 -7.164 -5.834 -7.142 407 HB2 SER 525 HB2 SER 525 -7.051 -3.163 -5.723 408 HB3 SER 525 HB1 SER 525 -6.551 -3.483 -7.384 409 HG SER 525 HG SER 525 -8.697 -2.604 -7.198 410 H LEU 526 HN LEU 526 -6.249 -6.942 -4.547 411 HA LEU 526 HA LEU 526 -3.771 -5.845 -3.788 412 HB2 LEU 526 HB2 LEU 526 -4.883 -8.630 -3.537 413 HB3 LEU 526 HB1 LEU 526 -3.337 -8.159 -2.864 414 HG LEU 526 HG LEU 526 -6.024 -7.019 -2.107 415 HD11 LEU 526 HD11 LEU 526 -5.647 -9.268 -1.250 416 HD12 LEU 526 HD12 LEU 526 -5.600 -8.078 0.050 417 HD13 LEU 526 HD13 LEU 526 -4.099 -8.760 -0.576 418 HD21 LEU 526 HD21 LEU 526 -3.242 -6.350 -1.166 419 HD22 LEU 526 HD22 LEU 526 -4.716 -5.858 -0.330 420 HD23 LEU 526 HD23 LEU 526 -4.393 -5.275 -1.963 421 H HIS 527 HN HIS 527 -4.659 -7.825 -6.478 422 HA HIS 527 HA HIS 527 -2.024 -8.866 -6.938 423 HB2 HIS 527 HB2 HIS 527 -4.535 -8.862 -8.604 424 HB3 HIS 527 HB1 HIS 527 -3.018 -9.537 -9.185 425 HD1 HIS 527 HD1 HIS 527 -2.717 -11.949 -8.728 426 HD2 HIS 527 HD2 HIS 527 -5.354 -10.194 -6.041 427 HE1 HIS 527 HE1 HIS 527 -3.592 -13.832 -7.311 428 HE2 HIS 527 HE2 HIS 527 -5.338 -12.768 -5.838 429 H LEU 528 HN LEU 528 -2.757 -5.840 -6.934 430 HA LEU 528 HA LEU 528 -1.173 -5.204 -9.333 431 HB2 LEU 528 HB2 LEU 528 -3.034 -3.399 -7.789 432 HB3 LEU 528 HB1 LEU 528 -2.125 -2.958 -9.215 433 HG LEU 528 HG LEU 528 -4.351 -4.994 -9.129 434 HD11 LEU 528 HD11 LEU 528 -4.263 -2.198 -10.257 435 HD12 LEU 528 HD12 LEU 528 -5.150 -2.711 -8.823 436 HD13 LEU 528 HD13 LEU 528 -5.606 -3.332 -10.407 437 HD21 LEU 528 HD21 LEU 528 -4.168 -4.952 -11.573 438 HD22 LEU 528 HD22 LEU 528 -2.686 -5.541 -10.819 439 HD23 LEU 528 HD23 LEU 528 -2.763 -3.894 -11.447 440 H ILE 529 HN ILE 529 -0.997 -5.571 -6.054 441 HA ILE 529 HA ILE 529 0.981 -3.442 -5.660 442 HB ILE 529 HB ILE 529 -0.236 -5.338 -3.653 443 HG12 ILE 529 HG12 ILE 529 -1.810 -3.721 -4.818 444 HG13 ILE 529 HG11 ILE 529 -1.759 -3.624 -3.066 445 HG21 ILE 529 HG21 ILE 529 1.924 -4.494 -2.934 446 HG22 ILE 529 HG22 ILE 529 0.633 -3.768 -1.976 447 HG23 ILE 529 HG23 ILE 529 1.406 -2.840 -3.261 448 HD11 ILE 529 HD11 ILE 529 -0.351 -1.655 -3.194 449 HD12 ILE 529 HD12 ILE 529 -1.818 -1.419 -4.142 450 HD13 ILE 529 HD13 ILE 529 -0.296 -1.788 -4.950 451 H SER 530 HN SER 530 3.106 -3.872 -5.363 452 HA SER 530 HA SER 530 3.919 -6.708 -5.302 453 HB2 SER 530 HB2 SER 530 5.229 -4.385 -6.734 454 HB3 SER 530 HB1 SER 530 5.911 -5.995 -6.633 455 HG SER 530 HG SER 530 4.296 -5.095 -8.451 456 H ARG 531 HN ARG 531 5.562 -7.238 -3.897 457 HA ARG 531 HA ARG 531 6.045 -5.334 -1.794 458 HB2 ARG 531 HB2 ARG 531 5.845 -8.003 -1.748 459 HB3 ARG 531 HB1 ARG 531 7.590 -7.869 -1.929 460 HG2 ARG 531 HG2 ARG 531 7.551 -6.294 0.033 461 HG3 ARG 531 HG1 ARG 531 5.872 -6.785 0.271 462 HD2 ARG 531 HD2 ARG 531 7.192 -8.141 1.709 463 HD3 ARG 531 HD1 ARG 531 6.694 -9.164 0.361 464 HE ARG 531 HE ARG 531 8.889 -9.252 -0.379 465 HH11 ARG 531 HH11 ARG 531 8.570 -7.067 2.337 466 HH12 ARG 531 HH12 ARG 531 10.284 -6.870 2.559 467 HH21 ARG 531 HH21 ARG 531 11.156 -9.031 -0.059 468 HH22 ARG 531 HH22 ARG 531 11.745 -7.988 1.204 469 H TYR 532 HN TYR 532 8.031 -4.395 -1.261 470 HA TYR 532 HA TYR 532 9.493 -3.383 -3.360 471 HB2 TYR 532 HB2 TYR 532 9.353 -2.545 -0.970 472 HB3 TYR 532 HB1 TYR 532 10.596 -3.727 -0.575 473 HD1 TYR 532 HD1 TYR 532 12.853 -3.218 -0.901 474 HD2 TYR 532 HD2 TYR 532 9.872 -0.831 -2.756 475 HE1 TYR 532 HE1 TYR 532 14.587 -1.620 -1.602 476 HE2 TYR 532 HE2 TYR 532 11.591 0.780 -3.471 477 HH TYR 532 HH TYR 532 14.901 0.088 -3.358 478 H ALA 533 HN ALA 533 11.107 -5.424 -0.942 479 HA ALA 533 HA ALA 533 12.708 -7.020 -1.086 480 HB1 ALA 533 HB1 ALA 533 11.406 -7.655 -3.727 481 HB2 ALA 533 HB2 ALA 533 10.870 -8.245 -2.154 482 HB3 ALA 533 HB3 ALA 533 12.445 -8.724 -2.784 483 H GLY 534 HN GLY 534 14.202 -8.090 -3.123 484 HA2 GLY 534 HA2 GLY 534 15.760 -7.626 -4.799 485 HA3 GLY 534 HA1 GLY 534 15.282 -5.937 -4.746 486 H GLY 535 HN GLY 535 15.872 -4.817 -2.631 487 HA2 GLY 535 HA2 GLY 535 18.497 -5.764 -1.684 488 HA3 GLY 535 HA1 GLY 535 18.292 -4.110 -2.245 489 H ALA 536 HN ALA 536 18.755 -3.115 -0.321 490 HA ALA 536 HA ALA 536 17.594 -3.882 2.158 491 HB1 ALA 536 HB1 ALA 536 18.542 -1.820 3.026 492 HB2 ALA 536 HB2 ALA 536 18.855 -1.255 1.386 493 HB3 ALA 536 HB3 ALA 536 19.714 -2.661 2.013 494 H GLU 537 HN GLU 537 15.418 -3.895 2.235 495 HA GLU 537 HA GLU 537 13.850 -1.852 0.976 496 HB2 GLU 537 HB2 GLU 537 11.923 -3.032 1.999 497 HB3 GLU 537 HB1 GLU 537 12.950 -4.071 1.025 498 HG2 GLU 537 HG2 GLU 537 14.014 -4.891 3.087 499 HG3 GLU 537 HG1 GLU 537 12.897 -3.903 4.026 500 H GLU 538 HN GLU 538 15.220 -2.329 4.110 501 HA GLU 538 HA GLU 538 13.531 -0.643 5.592 502 HB2 GLU 538 HB2 GLU 538 16.505 -1.027 5.993 503 HB3 GLU 538 HB1 GLU 538 15.363 -0.425 7.184 504 HG2 GLU 538 HG2 GLU 538 15.561 -2.576 7.877 505 HG3 GLU 538 HG1 GLU 538 14.204 -2.744 6.763 506 H ASN 539 HN ASN 539 15.949 0.015 3.236 507 HA ASN 539 HA ASN 539 16.008 2.863 3.945 508 HB2 ASN 539 HB2 ASN 539 17.838 1.213 2.195 509 HB3 ASN 539 HB1 ASN 539 17.952 2.960 2.351 510 HD21 ASN 539 HD21 ASN 539 17.297 2.989 5.171 511 HD22 ASN 539 HD22 ASN 539 18.686 2.378 5.999 512 H ALA 540 HN ALA 540 13.969 1.181 2.361 513 HA ALA 540 HA ALA 540 13.979 1.899 -0.330 514 HB1 ALA 540 HB1 ALA 540 12.501 0.198 0.616 515 HB2 ALA 540 HB2 ALA 540 11.596 1.401 -0.302 516 HB3 ALA 540 HB3 ALA 540 11.595 1.455 1.460 517 HA PRO 541 HA PRO 541 13.024 6.233 -0.216 518 HB2 PRO 541 HB2 PRO 541 12.295 6.557 -2.796 519 HB3 PRO 541 HB1 PRO 541 13.978 6.295 -2.319 520 HG2 PRO 541 HG2 PRO 541 11.994 4.346 -3.415 521 HG3 PRO 541 HG1 PRO 541 13.706 4.533 -3.810 522 HD2 PRO 541 HD2 PRO 541 12.757 2.619 -2.121 523 HD3 PRO 541 HD1 PRO 541 14.388 3.311 -1.995 524 H LEU 542 HN LEU 542 11.167 7.703 -0.849 525 HA LEU 542 HA LEU 542 8.617 6.255 -0.611 526 HB2 LEU 542 HB2 LEU 542 9.470 7.347 1.513 527 HB3 LEU 542 HB1 LEU 542 9.243 8.888 0.714 528 HG LEU 542 HG LEU 542 6.833 8.421 0.509 529 HD11 LEU 542 HD11 LEU 542 7.511 5.929 2.064 530 HD12 LEU 542 HD12 LEU 542 6.878 6.008 0.419 531 HD13 LEU 542 HD13 LEU 542 5.880 6.532 1.774 532 HD21 LEU 542 HD21 LEU 542 7.709 9.651 2.438 533 HD22 LEU 542 HD22 LEU 542 7.899 8.134 3.314 534 HD23 LEU 542 HD23 LEU 542 6.290 8.695 2.864 535 H HIS 543 HN HIS 543 7.225 6.718 -2.179 536 HA HIS 543 HA HIS 543 7.761 8.945 -3.972 537 HB2 HIS 543 HB2 HIS 543 6.186 6.447 -4.092 538 HB3 HIS 543 HB1 HIS 543 5.501 7.817 -4.962 539 HD1 HIS 543 HD1 HIS 543 6.009 7.256 -7.335 540 HD2 HIS 543 HD2 HIS 543 9.323 6.828 -4.864 541 HE1 HIS 543 HE1 HIS 543 7.942 6.794 -8.869 542 HE2 HIS 543 HE2 HIS 543 9.946 6.585 -7.363 543 H LYS 544 HN LYS 544 5.932 10.302 -4.715 544 HA LYS 544 HA LYS 544 4.444 11.220 -2.377 545 HB2 LYS 544 HB2 LYS 544 4.029 13.269 -3.666 546 HB3 LYS 544 HB1 LYS 544 5.744 12.907 -3.555 547 HG2 LYS 544 HG2 LYS 544 5.627 11.938 -5.840 548 HG3 LYS 544 HG1 LYS 544 3.952 12.484 -5.935 549 HD2 LYS 544 HD2 LYS 544 4.671 14.791 -5.619 550 HD3 LYS 544 HD1 LYS 544 6.347 14.261 -5.471 551 HE2 LYS 544 HE2 LYS 544 5.990 15.094 -7.697 552 HE3 LYS 544 HE1 LYS 544 6.211 13.347 -7.773 553 HZ1 LYS 544 HZ1 LYS 544 3.782 13.118 -7.879 554 HZ2 LYS 544 HZ2 LYS 544 4.397 14.003 -9.180 555 HZ3 LYS 544 HZ3 LYS 544 3.624 14.807 -7.903 556 H LEU 545 HN LEU 545 2.228 11.554 -2.374 557 HA LEU 545 HA LEU 545 0.818 9.717 -4.171 558 HB2 LEU 545 HB2 LEU 545 0.861 9.721 -1.517 559 HB3 LEU 545 HB1 LEU 545 -0.424 10.885 -1.729 560 HG LEU 545 HG LEU 545 -1.022 8.406 -1.355 561 HD11 LEU 545 HD11 LEU 545 -2.682 10.061 -1.896 562 HD12 LEU 545 HD12 LEU 545 -2.987 8.592 -2.828 563 HD13 LEU 545 HD13 LEU 545 -2.244 9.991 -3.604 564 HD21 LEU 545 HD21 LEU 545 0.542 7.547 -3.070 565 HD22 LEU 545 HD22 LEU 545 -0.459 8.298 -4.314 566 HD23 LEU 545 HD23 LEU 545 -1.121 7.014 -3.305 567 H GLY 546 HN GLY 546 1.130 11.607 -5.710 568 HA2 GLY 546 HA2 GLY 546 -1.179 12.602 -6.606 569 HA3 GLY 546 HA1 GLY 546 -0.759 13.777 -5.367 570 H GLY 547 HN GLY 547 -0.829 15.148 -7.393 571 HA2 GLY 547 HA2 GLY 547 1.496 14.925 -9.114 572 HA3 GLY 547 HA1 GLY 547 0.234 16.146 -9.211 Start of MODEL 4 1 H1 ARG 472 HT1 ARG 472 1.223 -13.556 -3.934 2 H2 ARG 472 HT2 ARG 472 2.465 -12.802 -4.801 3 H3 ARG 472 HT3 ARG 472 0.888 -12.811 -5.414 4 HA ARG 472 HA ARG 472 1.758 -11.460 -2.932 5 HB2 ARG 472 HB2 ARG 472 1.400 -10.521 -5.739 6 HB3 ARG 472 HB1 ARG 472 0.948 -9.433 -4.440 7 HG2 ARG 472 HG2 ARG 472 3.657 -10.704 -4.732 8 HG3 ARG 472 HG1 ARG 472 3.236 -9.088 -5.296 9 HD2 ARG 472 HD2 ARG 472 4.103 -8.561 -3.249 10 HD3 ARG 472 HD1 ARG 472 2.414 -8.805 -2.804 11 HE ARG 472 HE ARG 472 3.827 -11.242 -2.575 12 HH11 ARG 472 HH11 ARG 472 3.488 -8.139 -1.003 13 HH12 ARG 472 HH12 ARG 472 3.992 -8.721 0.551 14 HH21 ARG 472 HH21 ARG 472 4.505 -12.019 -0.533 15 HH22 ARG 472 HH22 ARG 472 4.576 -10.930 0.816 16 H ASN 473 HN ASN 473 -0.024 -12.527 -1.856 17 HA ASN 473 HA ASN 473 -2.660 -11.490 -2.610 18 HB2 ASN 473 HB2 ASN 473 -1.742 -13.617 -0.707 19 HB3 ASN 473 HB1 ASN 473 -3.325 -12.880 -0.495 20 HD21 ASN 473 HD21 ASN 473 -4.350 -14.834 -0.914 21 HD22 ASN 473 HD22 ASN 473 -4.457 -15.490 -2.514 22 H LEU 474 HN LEU 474 -0.032 -10.750 -0.686 23 HA LEU 474 HA LEU 474 0.427 -9.077 0.756 24 HB2 LEU 474 HB2 LEU 474 -2.155 -8.072 -0.388 25 HB3 LEU 474 HB1 LEU 474 -1.300 -7.178 0.848 26 HG LEU 474 HG LEU 474 -0.691 -6.192 -1.206 27 HD11 LEU 474 HD11 LEU 474 1.560 -8.087 -0.585 28 HD12 LEU 474 HD12 LEU 474 1.192 -6.635 0.339 29 HD13 LEU 474 HD13 LEU 474 1.671 -6.502 -1.351 30 HD21 LEU 474 HD21 LEU 474 -1.441 -7.853 -2.738 31 HD22 LEU 474 HD22 LEU 474 -0.186 -8.972 -2.214 32 HD23 LEU 474 HD23 LEU 474 0.250 -7.498 -3.076 33 H ALA 475 HN ALA 475 -0.949 -11.439 1.714 34 HA ALA 475 HA ALA 475 -2.689 -10.461 3.823 35 HB1 ALA 475 HB1 ALA 475 -3.258 -12.536 2.627 36 HB2 ALA 475 HB2 ALA 475 -3.065 -12.792 4.361 37 HB3 ALA 475 HB3 ALA 475 -1.785 -13.279 3.250 38 H GLU 476 HN GLU 476 0.584 -11.297 3.322 39 HA GLU 476 HA GLU 476 1.115 -11.549 6.188 40 HB2 GLU 476 HB2 GLU 476 2.892 -11.967 3.778 41 HB3 GLU 476 HB1 GLU 476 3.415 -12.163 5.446 42 HG2 GLU 476 HG2 GLU 476 1.214 -13.737 4.132 43 HG3 GLU 476 HG1 GLU 476 2.873 -14.294 4.345 44 H LEU 477 HN LEU 477 0.374 -9.035 4.750 45 HA LEU 477 HA LEU 477 2.671 -7.393 4.550 46 HB2 LEU 477 HB2 LEU 477 -0.266 -6.928 4.569 47 HB3 LEU 477 HB1 LEU 477 0.797 -5.557 4.825 48 HG LEU 477 HG LEU 477 0.904 -7.378 2.420 49 HD11 LEU 477 HD11 LEU 477 -0.133 -5.582 1.190 50 HD12 LEU 477 HD12 LEU 477 -0.189 -4.578 2.641 51 HD13 LEU 477 HD13 LEU 477 -1.173 -6.038 2.542 52 HD21 LEU 477 HD21 LEU 477 3.049 -6.359 2.926 53 HD22 LEU 477 HD22 LEU 477 2.288 -4.773 3.052 54 HD23 LEU 477 HD23 LEU 477 2.343 -5.604 1.499 55 H HIS 478 HN HIS 478 3.761 -6.305 6.003 56 HA HIS 478 HA HIS 478 2.698 -6.161 8.743 57 HB2 HIS 478 HB2 HIS 478 5.581 -6.089 7.816 58 HB3 HIS 478 HB1 HIS 478 5.040 -6.017 9.490 59 HD1 HIS 478 HD1 HIS 478 6.803 -8.284 7.845 60 HD2 HIS 478 HD2 HIS 478 2.948 -8.573 9.385 61 HE1 HIS 478 HE1 HIS 478 6.370 -10.746 8.144 62 HE2 HIS 478 HE2 HIS 478 3.997 -10.899 8.969 63 H ILE 479 HN ILE 479 3.264 -4.206 9.959 64 HA ILE 479 HA ILE 479 2.562 -1.908 8.436 65 HB ILE 479 HB ILE 479 3.560 -2.005 11.286 66 HG12 ILE 479 HG12 ILE 479 1.622 -3.457 11.037 67 HG13 ILE 479 HG11 ILE 479 1.167 -2.004 11.915 68 HG21 ILE 479 HG21 ILE 479 2.402 0.123 11.541 69 HG22 ILE 479 HG22 ILE 479 1.926 0.078 9.844 70 HG23 ILE 479 HG23 ILE 479 3.631 0.219 10.277 71 HD11 ILE 479 HD11 ILE 479 0.614 -2.581 9.017 72 HD12 ILE 479 HD12 ILE 479 0.189 -1.093 9.862 73 HD13 ILE 479 HD13 ILE 479 -0.551 -2.621 10.340 74 H GLY 480 HN GLY 480 3.817 -0.492 7.426 75 HA2 GLY 480 HA2 GLY 480 5.633 0.936 7.125 76 HA3 GLY 480 HA1 GLY 480 6.463 0.121 8.443 77 H GLN 481 HN GLN 481 5.132 -2.003 6.173 78 HA GLN 481 HA GLN 481 7.795 -2.775 5.324 79 HB2 GLN 481 HB2 GLN 481 5.776 -4.289 6.064 80 HB3 GLN 481 HB1 GLN 481 5.263 -4.092 4.397 81 HG2 GLN 481 HG2 GLN 481 7.990 -5.098 5.139 82 HG3 GLN 481 HG1 GLN 481 6.604 -6.162 4.960 83 HE21 GLN 481 HE21 GLN 481 5.480 -4.593 2.769 84 HE22 GLN 481 HE22 GLN 481 6.470 -4.910 1.392 85 HA PRO 482 HA PRO 482 7.472 -0.304 1.648 86 HB2 PRO 482 HB2 PRO 482 9.567 -1.413 0.290 87 HB3 PRO 482 HB1 PRO 482 9.756 -0.230 1.587 88 HG2 PRO 482 HG2 PRO 482 10.001 -3.212 1.694 89 HG3 PRO 482 HG1 PRO 482 11.026 -1.977 2.448 90 HD2 PRO 482 HD2 PRO 482 9.155 -3.320 3.840 91 HD3 PRO 482 HD1 PRO 482 9.538 -1.620 4.181 92 H VAL 483 HN VAL 483 5.975 -0.585 0.179 93 HA VAL 483 HA VAL 483 5.930 -3.081 -1.380 94 HB VAL 483 HB VAL 483 3.438 -2.873 -1.505 95 HG11 VAL 483 HG11 VAL 483 4.435 -4.520 -0.049 96 HG12 VAL 483 HG12 VAL 483 3.007 -3.827 0.722 97 HG13 VAL 483 HG13 VAL 483 4.619 -3.319 1.229 98 HG21 VAL 483 HG21 VAL 483 2.287 -1.565 0.219 99 HG22 VAL 483 HG22 VAL 483 3.220 -0.537 -0.869 100 HG23 VAL 483 HG23 VAL 483 3.834 -0.902 0.744 101 H VAL 484 HN VAL 484 4.903 -2.829 -3.493 102 HA VAL 484 HA VAL 484 5.183 -0.068 -4.452 103 HB VAL 484 HB VAL 484 5.750 -0.947 -6.659 104 HG11 VAL 484 HG11 VAL 484 7.538 -0.436 -5.102 105 HG12 VAL 484 HG12 VAL 484 7.971 -1.815 -6.113 106 HG13 VAL 484 HG13 VAL 484 7.450 -2.072 -4.449 107 HG21 VAL 484 HG21 VAL 484 5.674 -3.649 -5.352 108 HG22 VAL 484 HG22 VAL 484 6.239 -3.304 -6.987 109 HG23 VAL 484 HG23 VAL 484 4.545 -3.044 -6.564 110 H HIS 485 HN HIS 485 3.577 0.860 -5.368 111 HA HIS 485 HA HIS 485 1.108 -0.668 -5.851 112 HB2 HIS 485 HB2 HIS 485 0.937 1.055 -4.107 113 HB3 HIS 485 HB1 HIS 485 1.517 2.272 -5.209 114 HD1 HIS 485 HD1 HIS 485 -0.554 3.721 -5.153 115 HD2 HIS 485 HD2 HIS 485 -1.373 -0.226 -6.158 116 HE1 HIS 485 HE1 HIS 485 -2.947 3.695 -5.911 117 HE2 HIS 485 HE2 HIS 485 -3.361 1.346 -6.712 118 H LEU 486 HN LEU 486 0.804 -1.090 -7.933 119 HA LEU 486 HA LEU 486 2.413 -0.162 -9.970 120 HB2 LEU 486 HB2 LEU 486 1.052 -1.358 -11.477 121 HB3 LEU 486 HB1 LEU 486 1.026 -2.234 -9.967 122 HG LEU 486 HG LEU 486 -1.143 -2.409 -10.770 123 HD11 LEU 486 HD11 LEU 486 -2.579 -1.119 -9.276 124 HD12 LEU 486 HD12 LEU 486 -1.212 -0.081 -8.871 125 HD13 LEU 486 HD13 LEU 486 -1.177 -1.790 -8.443 126 HD21 LEU 486 HD21 LEU 486 -1.090 0.519 -11.456 127 HD22 LEU 486 HD22 LEU 486 -2.492 -0.538 -11.617 128 HD23 LEU 486 HD23 LEU 486 -1.047 -0.837 -12.584 129 H GLU 487 HN GLU 487 -0.312 1.414 -8.633 130 HA GLU 487 HA GLU 487 -0.800 3.075 -10.937 131 HB2 GLU 487 HB2 GLU 487 -1.940 3.069 -8.146 132 HB3 GLU 487 HB1 GLU 487 -2.441 4.192 -9.405 133 HG2 GLU 487 HG2 GLU 487 -3.287 2.419 -10.750 134 HG3 GLU 487 HG1 GLU 487 -2.595 1.206 -9.677 135 H HIS 488 HN HIS 488 0.711 3.459 -7.727 136 HA HIS 488 HA HIS 488 1.486 6.167 -8.597 137 HB2 HIS 488 HB2 HIS 488 0.152 5.332 -6.183 138 HB3 HIS 488 HB1 HIS 488 1.648 6.189 -5.817 139 HD1 HIS 488 HD1 HIS 488 -1.824 6.780 -6.630 140 HD2 HIS 488 HD2 HIS 488 1.756 8.793 -7.246 141 HE1 HIS 488 HE1 HIS 488 -2.462 9.158 -7.096 142 HE2 HIS 488 HE2 HIS 488 -0.274 10.389 -7.299 143 H GLY 489 HN GLY 489 2.590 3.351 -6.707 144 HA2 GLY 489 HA2 GLY 489 4.952 2.847 -7.568 145 HA3 GLY 489 HA1 GLY 489 5.310 4.456 -6.962 146 H VAL 490 HN VAL 490 6.924 3.327 -5.722 147 HA VAL 490 HA VAL 490 6.276 1.433 -3.722 148 HB VAL 490 HB VAL 490 8.516 1.558 -4.603 149 HG11 VAL 490 HG11 VAL 490 8.837 4.253 -3.309 150 HG12 VAL 490 HG12 VAL 490 8.451 4.031 -5.016 151 HG13 VAL 490 HG13 VAL 490 9.966 3.408 -4.367 152 HG21 VAL 490 HG21 VAL 490 8.431 2.372 -1.702 153 HG22 VAL 490 HG22 VAL 490 9.842 1.698 -2.520 154 HG23 VAL 490 HG23 VAL 490 8.375 0.730 -2.345 155 H GLY 491 HN GLY 491 5.806 1.634 -1.611 156 HA2 GLY 491 HA2 GLY 491 5.999 4.199 -0.249 157 HA3 GLY 491 HA1 GLY 491 4.362 3.591 -0.488 158 H ARG 492 HN ARG 492 4.722 3.838 2.011 159 HA ARG 492 HA ARG 492 5.806 1.311 3.068 160 HB2 ARG 492 HB2 ARG 492 5.277 3.960 4.419 161 HB3 ARG 492 HB1 ARG 492 5.737 2.499 5.281 162 HG2 ARG 492 HG2 ARG 492 7.390 3.774 3.117 163 HG3 ARG 492 HG1 ARG 492 7.614 4.066 4.847 164 HD2 ARG 492 HD2 ARG 492 7.953 1.618 5.150 165 HD3 ARG 492 HD1 ARG 492 7.884 1.433 3.398 166 HE ARG 492 HE ARG 492 9.826 3.195 3.575 167 HH11 ARG 492 HH11 ARG 492 9.276 0.350 5.562 168 HH12 ARG 492 HH12 ARG 492 10.971 0.121 5.903 169 HH21 ARG 492 HH21 ARG 492 12.038 2.883 4.050 170 HH22 ARG 492 HH22 ARG 492 12.517 1.551 5.054 171 H TYR 493 HN TYR 493 4.233 -0.156 3.162 172 HA TYR 493 HA TYR 493 1.514 0.195 3.228 173 HB2 TYR 493 HB2 TYR 493 2.558 -1.997 2.893 174 HB3 TYR 493 HB1 TYR 493 3.091 -2.009 4.566 175 HD1 TYR 493 HD1 TYR 493 1.816 -3.142 6.110 176 HD2 TYR 493 HD2 TYR 493 -0.071 -1.657 2.599 177 HE1 TYR 493 HE1 TYR 493 -0.289 -4.199 6.803 178 HE2 TYR 493 HE2 TYR 493 -2.187 -2.715 3.278 179 HH TYR 493 HH TYR 493 -2.956 -4.531 4.702 180 H ALA 494 HN ALA 494 0.142 1.081 4.645 181 HA ALA 494 HA ALA 494 0.952 0.937 7.501 182 HB1 ALA 494 HB1 ALA 494 -0.032 3.130 7.874 183 HB2 ALA 494 HB2 ALA 494 -0.427 3.253 6.162 184 HB3 ALA 494 HB3 ALA 494 1.260 3.207 6.676 185 H GLY 495 HN GLY 495 -0.336 -0.798 7.981 186 HA2 GLY 495 HA2 GLY 495 -2.232 -1.890 8.644 187 HA3 GLY 495 HA1 GLY 495 -2.809 -0.287 9.054 188 H MET 496 HN MET 496 -4.904 -0.867 8.578 189 HA MET 496 HA MET 496 -5.586 -0.767 5.750 190 HB2 MET 496 HB2 MET 496 -6.254 -3.036 7.583 191 HB3 MET 496 HB1 MET 496 -7.400 -2.573 6.333 192 HG2 MET 496 HG2 MET 496 -5.748 -2.950 4.625 193 HG3 MET 496 HG1 MET 496 -4.530 -3.302 5.843 194 HE1 MET 496 HE1 MET 496 -8.310 -4.412 5.872 195 HE2 MET 496 HE2 MET 496 -8.216 -5.948 5.014 196 HE3 MET 496 HE3 MET 496 -7.862 -4.441 4.167 197 H THR 497 HN THR 497 -7.711 -0.130 5.342 198 HA THR 497 HA THR 497 -9.182 0.982 7.626 199 HB THR 497 HB THR 497 -7.887 2.830 6.742 200 HG1 THR 497 HG1 THR 497 -10.485 2.838 6.962 201 HG21 THR 497 HG21 THR 497 -8.156 3.600 4.421 202 HG22 THR 497 HG22 THR 497 -9.123 2.167 4.070 203 HG23 THR 497 HG23 THR 497 -7.421 1.997 4.512 204 H THR 498 HN THR 498 -11.426 0.890 7.403 205 HA THR 498 HA THR 498 -12.376 -0.621 5.093 206 HB THR 498 HB THR 498 -14.576 -0.411 6.615 207 HG1 THR 498 HG1 THR 498 -12.808 -0.773 8.704 208 HG21 THR 498 HG21 THR 498 -13.982 -2.595 7.574 209 HG22 THR 498 HG22 THR 498 -12.307 -2.347 7.085 210 HG23 THR 498 HG23 THR 498 -13.568 -2.499 5.861 211 H LEU 499 HN LEU 499 -13.709 0.175 3.576 212 HA LEU 499 HA LEU 499 -14.779 2.891 3.956 213 HB2 LEU 499 HB2 LEU 499 -13.579 1.779 1.416 214 HB3 LEU 499 HB1 LEU 499 -14.339 3.349 1.580 215 HG LEU 499 HG LEU 499 -11.784 2.485 2.945 216 HD11 LEU 499 HD11 LEU 499 -11.497 2.799 0.553 217 HD12 LEU 499 HD12 LEU 499 -10.717 4.100 1.452 218 HD13 LEU 499 HD13 LEU 499 -12.264 4.384 0.656 219 HD21 LEU 499 HD21 LEU 499 -13.188 5.154 2.916 220 HD22 LEU 499 HD22 LEU 499 -11.603 4.830 3.618 221 HD23 LEU 499 HD23 LEU 499 -13.041 4.073 4.301 222 H GLU 500 HN GLU 500 -16.756 3.317 2.935 223 HA GLU 500 HA GLU 500 -18.161 0.937 1.930 224 HB2 GLU 500 HB2 GLU 500 -19.258 3.322 3.427 225 HB3 GLU 500 HB1 GLU 500 -20.256 2.075 2.692 226 HG2 GLU 500 HG2 GLU 500 -19.147 0.400 4.138 227 HG3 GLU 500 HG1 GLU 500 -18.273 1.713 4.926 228 H ALA 501 HN ALA 501 -18.540 1.002 -0.176 229 HA ALA 501 HA ALA 501 -18.679 3.621 -1.501 230 HB1 ALA 501 HB1 ALA 501 -17.977 0.901 -2.597 231 HB2 ALA 501 HB2 ALA 501 -16.849 2.213 -2.253 232 HB3 ALA 501 HB3 ALA 501 -18.042 2.391 -3.540 233 H GLY 502 HN GLY 502 -20.100 3.631 -3.477 234 HA2 GLY 502 HA2 GLY 502 -22.744 2.851 -2.719 235 HA3 GLY 502 HA1 GLY 502 -22.282 3.655 -4.212 236 H GLY 503 HN GLY 503 -22.332 0.532 -2.583 237 HA2 GLY 503 HA2 GLY 503 -23.569 -1.161 -4.040 238 HA3 GLY 503 HA1 GLY 503 -22.322 -0.783 -5.221 239 H ILE 504 HN ILE 504 -20.062 -0.664 -3.722 240 HA ILE 504 HA ILE 504 -19.870 -3.421 -2.701 241 HB ILE 504 HB ILE 504 -17.787 -1.804 -4.177 242 HG12 ILE 504 HG12 ILE 504 -19.227 -4.365 -4.903 243 HG13 ILE 504 HG11 ILE 504 -19.517 -2.782 -5.618 244 HG21 ILE 504 HG21 ILE 504 -16.369 -3.814 -3.994 245 HG22 ILE 504 HG22 ILE 504 -17.573 -4.544 -2.933 246 HG23 ILE 504 HG23 ILE 504 -16.718 -3.087 -2.425 247 HD11 ILE 504 HD11 ILE 504 -17.239 -2.778 -6.504 248 HD12 ILE 504 HD12 ILE 504 -18.172 -4.159 -7.081 249 HD13 ILE 504 HD13 ILE 504 -16.972 -4.375 -5.806 250 H THR 505 HN THR 505 -19.535 -3.481 -0.593 251 HA THR 505 HA THR 505 -17.865 -1.373 0.600 252 HB THR 505 HB THR 505 -19.114 -1.715 2.700 253 HG1 THR 505 HG1 THR 505 -20.097 -3.636 2.693 254 HG21 THR 505 HG21 THR 505 -20.875 -1.050 0.343 255 HG22 THR 505 HG22 THR 505 -19.808 0.071 1.187 256 HG23 THR 505 HG23 THR 505 -21.199 -0.620 2.021 257 H GLY 506 HN GLY 506 -16.069 -2.063 1.651 258 HA2 GLY 506 HA2 GLY 506 -15.874 -4.700 2.767 259 HA3 GLY 506 HA1 GLY 506 -15.022 -4.558 1.240 260 H GLU 507 HN GLU 507 -13.099 -5.008 2.326 261 HA GLU 507 HA GLU 507 -12.127 -2.975 4.192 262 HB2 GLU 507 HB2 GLU 507 -11.042 -5.689 3.450 263 HB3 GLU 507 HB1 GLU 507 -10.213 -4.564 4.515 264 HG2 GLU 507 HG2 GLU 507 -11.299 -6.122 5.903 265 HG3 GLU 507 HG1 GLU 507 -12.243 -4.638 5.993 266 H TYR 508 HN TYR 508 -10.231 -1.839 3.826 267 HA TYR 508 HA TYR 508 -9.078 -2.050 1.135 268 HB2 TYR 508 HB2 TYR 508 -9.986 0.500 2.496 269 HB3 TYR 508 HB1 TYR 508 -8.996 0.451 1.041 270 HD1 TYR 508 HD1 TYR 508 -12.287 -0.627 2.395 271 HD2 TYR 508 HD2 TYR 508 -10.012 0.327 -1.067 272 HE1 TYR 508 HE1 TYR 508 -14.319 -0.773 1.036 273 HE2 TYR 508 HE2 TYR 508 -12.045 0.193 -2.443 274 HH TYR 508 HH TYR 508 -14.315 -1.033 -2.257 275 H LEU 509 HN LEU 509 -7.048 -1.271 0.910 276 HA LEU 509 HA LEU 509 -5.388 -1.665 3.238 277 HB2 LEU 509 HB2 LEU 509 -4.723 -2.917 1.395 278 HB3 LEU 509 HB1 LEU 509 -5.077 -1.628 0.272 279 HG LEU 509 HG LEU 509 -2.777 -1.356 2.163 280 HD11 LEU 509 HD11 LEU 509 -2.826 -2.824 -0.471 281 HD12 LEU 509 HD12 LEU 509 -2.530 -3.541 1.112 282 HD13 LEU 509 HD13 LEU 509 -1.370 -2.399 0.431 283 HD21 LEU 509 HD21 LEU 509 -3.911 0.138 0.016 284 HD22 LEU 509 HD22 LEU 509 -2.314 -0.429 -0.476 285 HD23 LEU 509 HD23 LEU 509 -2.502 0.521 1.000 286 H MET 510 HN MET 510 -4.034 -0.124 4.087 287 HA MET 510 HA MET 510 -4.305 2.577 2.960 288 HB2 MET 510 HB2 MET 510 -4.843 1.678 5.553 289 HB3 MET 510 HB1 MET 510 -3.301 2.508 5.675 290 HG2 MET 510 HG2 MET 510 -4.344 4.475 4.571 291 HG3 MET 510 HG1 MET 510 -5.889 3.636 4.646 292 HE1 MET 510 HE1 MET 510 -7.064 5.597 6.058 293 HE2 MET 510 HE2 MET 510 -5.562 6.483 5.802 294 HE3 MET 510 HE3 MET 510 -6.261 6.381 7.418 295 H LEU 511 HN LEU 511 -2.532 3.453 2.182 296 HA LEU 511 HA LEU 511 0.094 2.364 2.984 297 HB2 LEU 511 HB2 LEU 511 -1.073 2.980 0.432 298 HB3 LEU 511 HB1 LEU 511 0.347 3.970 0.680 299 HG LEU 511 HG LEU 511 0.780 1.893 -0.551 300 HD11 LEU 511 HD11 LEU 511 2.748 1.209 0.644 301 HD12 LEU 511 HD12 LEU 511 2.173 2.073 2.070 302 HD13 LEU 511 HD13 LEU 511 2.573 2.961 0.600 303 HD21 LEU 511 HD21 LEU 511 0.851 -0.226 0.699 304 HD22 LEU 511 HD22 LEU 511 -0.762 0.407 0.371 305 HD23 LEU 511 HD23 LEU 511 -0.060 0.577 1.981 306 H THR 512 HN THR 512 1.811 3.859 3.350 307 HA THR 512 HA THR 512 0.919 6.647 3.631 308 HB THR 512 HB THR 512 2.961 6.800 5.250 309 HG1 THR 512 HG1 THR 512 2.585 4.054 4.973 310 HG21 THR 512 HG21 THR 512 0.652 7.237 5.868 311 HG22 THR 512 HG22 THR 512 1.481 6.343 7.143 312 HG23 THR 512 HG23 THR 512 0.362 5.509 6.064 313 H TYR 513 HN TYR 513 1.822 8.010 2.354 314 HA TYR 513 HA TYR 513 4.438 7.377 1.167 315 HB2 TYR 513 HB2 TYR 513 2.081 8.920 0.090 316 HB3 TYR 513 HB1 TYR 513 3.688 9.081 -0.604 317 HD1 TYR 513 HD1 TYR 513 1.009 6.600 0.108 318 HD2 TYR 513 HD2 TYR 513 4.457 7.546 -2.190 319 HE1 TYR 513 HE1 TYR 513 0.578 4.659 -1.336 320 HE2 TYR 513 HE2 TYR 513 4.036 5.607 -3.638 321 HH TYR 513 HH TYR 513 2.869 3.463 -3.558 322 H ALA 514 HN ALA 514 5.159 9.844 0.241 323 HA ALA 514 HA ALA 514 6.255 11.104 2.458 324 HB1 ALA 514 HB1 ALA 514 6.812 12.941 0.967 325 HB2 ALA 514 HB2 ALA 514 5.663 12.335 -0.225 326 HB3 ALA 514 HB3 ALA 514 7.094 11.388 0.178 327 H ASN 515 HN ASN 515 5.755 12.900 3.650 328 HA ASN 515 HA ASN 515 4.498 14.460 4.707 329 HB2 ASN 515 HB2 ASN 515 3.112 14.555 2.027 330 HB3 ASN 515 HB1 ASN 515 2.699 15.625 3.357 331 HD21 ASN 515 HD21 ASN 515 4.132 17.231 3.969 332 HD22 ASN 515 HD22 ASN 515 5.461 17.708 2.973 333 H ASP 516 HN ASP 516 3.852 11.640 4.868 334 HA ASP 516 HA ASP 516 2.311 10.222 5.738 335 HB2 ASP 516 HB2 ASP 516 2.495 11.932 7.563 336 HB3 ASP 516 HB1 ASP 516 1.077 12.728 6.894 337 H ALA 517 HN ALA 517 1.811 10.816 3.144 338 HA ALA 517 HA ALA 517 -0.969 11.508 2.799 339 HB1 ALA 517 HB1 ALA 517 0.971 10.376 0.789 340 HB2 ALA 517 HB2 ALA 517 0.740 12.092 1.114 341 HB3 ALA 517 HB3 ALA 517 -0.581 11.136 0.448 342 H LYS 518 HN LYS 518 -2.658 10.130 2.533 343 HA LYS 518 HA LYS 518 -2.075 7.337 3.212 344 HB2 LYS 518 HB2 LYS 518 -4.663 8.880 3.461 345 HB3 LYS 518 HB1 LYS 518 -4.399 7.227 3.996 346 HG2 LYS 518 HG2 LYS 518 -2.969 9.651 5.071 347 HG3 LYS 518 HG1 LYS 518 -4.327 8.834 5.846 348 HD2 LYS 518 HD2 LYS 518 -3.015 6.805 6.067 349 HD3 LYS 518 HD1 LYS 518 -1.668 7.558 5.210 350 HE2 LYS 518 HE2 LYS 518 -1.273 7.581 7.607 351 HE3 LYS 518 HE1 LYS 518 -1.469 9.222 6.996 352 HZ1 LYS 518 HZ1 LYS 518 -3.588 7.645 8.356 353 HZ2 LYS 518 HZ2 LYS 518 -3.722 9.245 7.822 354 HZ3 LYS 518 HZ3 LYS 518 -2.662 8.861 9.077 355 H LEU 519 HN LEU 519 -2.261 5.852 1.733 356 HA LEU 519 HA LEU 519 -3.909 6.347 -0.651 357 HB2 LEU 519 HB2 LEU 519 -1.808 5.834 -1.440 358 HB3 LEU 519 HB1 LEU 519 -1.441 4.774 -0.100 359 HG LEU 519 HG LEU 519 -2.895 3.031 -1.093 360 HD11 LEU 519 HD11 LEU 519 -4.442 4.424 -2.338 361 HD12 LEU 519 HD12 LEU 519 -3.622 3.326 -3.447 362 HD13 LEU 519 HD13 LEU 519 -3.135 5.018 -3.360 363 HD21 LEU 519 HD21 LEU 519 -0.527 3.003 -1.558 364 HD22 LEU 519 HD22 LEU 519 -0.750 4.107 -2.914 365 HD23 LEU 519 HD23 LEU 519 -1.431 2.482 -2.976 366 H TYR 520 HN TYR 520 -5.643 5.095 -1.092 367 HA TYR 520 HA TYR 520 -6.190 2.835 0.720 368 HB2 TYR 520 HB2 TYR 520 -8.265 4.283 -0.916 369 HB3 TYR 520 HB1 TYR 520 -8.510 3.240 0.478 370 HD1 TYR 520 HD1 TYR 520 -7.391 4.104 2.703 371 HD2 TYR 520 HD2 TYR 520 -8.378 6.565 -0.618 372 HE1 TYR 520 HE1 TYR 520 -7.429 6.077 4.178 373 HE2 TYR 520 HE2 TYR 520 -8.414 8.543 0.842 374 HH TYR 520 HH TYR 520 -8.694 9.098 3.179 375 H VAL 521 HN VAL 521 -5.924 0.913 -0.213 376 HA VAL 521 HA VAL 521 -6.620 0.653 -3.069 377 HB VAL 521 HB VAL 521 -4.521 -0.896 -1.518 378 HG11 VAL 521 HG11 VAL 521 -5.464 -1.236 -4.370 379 HG12 VAL 521 HG12 VAL 521 -5.702 -2.380 -3.049 380 HG13 VAL 521 HG13 VAL 521 -4.076 -2.050 -3.647 381 HG21 VAL 521 HG21 VAL 521 -3.793 1.325 -2.214 382 HG22 VAL 521 HG22 VAL 521 -4.295 0.985 -3.871 383 HG23 VAL 521 HG23 VAL 521 -2.967 0.076 -3.147 384 HA PRO 522 HA PRO 522 -9.783 -2.098 -1.517 385 HB2 PRO 522 HB2 PRO 522 -10.452 -3.175 -3.947 386 HB3 PRO 522 HB1 PRO 522 -11.042 -1.611 -3.374 387 HG2 PRO 522 HG2 PRO 522 -8.802 -2.224 -5.255 388 HG3 PRO 522 HG1 PRO 522 -10.024 -0.941 -5.349 389 HD2 PRO 522 HD2 PRO 522 -7.502 -0.479 -4.509 390 HD3 PRO 522 HD1 PRO 522 -8.891 0.410 -3.857 391 H VAL 523 HN VAL 523 -9.756 -4.200 -0.863 392 HA VAL 523 HA VAL 523 -7.314 -5.592 -1.050 393 HB VAL 523 HB VAL 523 -8.512 -7.471 0.100 394 HG11 VAL 523 HG11 VAL 523 -7.362 -5.742 1.359 395 HG12 VAL 523 HG12 VAL 523 -8.836 -6.230 2.195 396 HG13 VAL 523 HG13 VAL 523 -8.795 -4.715 1.293 397 HG21 VAL 523 HG21 VAL 523 -10.742 -7.080 -0.845 398 HG22 VAL 523 HG22 VAL 523 -10.844 -5.558 0.042 399 HG23 VAL 523 HG23 VAL 523 -10.772 -7.086 0.917 400 H SER 524 HN SER 524 -10.074 -5.606 -3.075 401 HA SER 524 HA SER 524 -9.571 -8.173 -4.255 402 HB2 SER 524 HB2 SER 524 -11.218 -5.852 -5.271 403 HB3 SER 524 HB1 SER 524 -11.260 -7.499 -5.900 404 HG SER 524 HG SER 524 -11.654 -7.838 -3.397 405 H SER 525 HN SER 525 -8.055 -5.175 -4.478 406 HA SER 525 HA SER 525 -7.020 -5.781 -7.165 407 HB2 SER 525 HB2 SER 525 -6.951 -3.152 -5.663 408 HB3 SER 525 HB1 SER 525 -6.401 -3.422 -7.317 409 HG SER 525 HG SER 525 -8.400 -2.762 -7.679 410 H LEU 526 HN LEU 526 -6.220 -6.756 -4.364 411 HA LEU 526 HA LEU 526 -3.623 -5.753 -3.849 412 HB2 LEU 526 HB2 LEU 526 -4.977 -8.334 -3.090 413 HB3 LEU 526 HB1 LEU 526 -3.356 -7.924 -2.565 414 HG LEU 526 HG LEU 526 -5.848 -6.355 -1.934 415 HD11 LEU 526 HD11 LEU 526 -5.490 -7.131 0.359 416 HD12 LEU 526 HD12 LEU 526 -4.148 -8.131 -0.194 417 HD13 LEU 526 HD13 LEU 526 -5.786 -8.472 -0.747 418 HD21 LEU 526 HD21 LEU 526 -2.969 -5.958 -1.144 419 HD22 LEU 526 HD22 LEU 526 -4.329 -5.151 -0.361 420 HD23 LEU 526 HD23 LEU 526 -3.995 -4.857 -2.067 421 H HIS 527 HN HIS 527 -4.860 -7.903 -6.170 422 HA HIS 527 HA HIS 527 -2.599 -9.439 -6.789 423 HB2 HIS 527 HB2 HIS 527 -4.885 -9.878 -7.630 424 HB3 HIS 527 HB1 HIS 527 -4.779 -8.440 -8.634 425 HD1 HIS 527 HD1 HIS 527 -4.809 -9.443 -10.920 426 HD2 HIS 527 HD2 HIS 527 -2.034 -11.253 -8.419 427 HE1 HIS 527 HE1 HIS 527 -3.511 -11.020 -12.383 428 HE2 HIS 527 HE2 HIS 527 -1.737 -11.987 -10.884 429 H LEU 528 HN LEU 528 -3.233 -6.115 -7.234 430 HA LEU 528 HA LEU 528 -1.231 -5.829 -9.345 431 HB2 LEU 528 HB2 LEU 528 -2.977 -3.729 -8.068 432 HB3 LEU 528 HB1 LEU 528 -1.981 -3.528 -9.489 433 HG LEU 528 HG LEU 528 -4.399 -5.324 -9.300 434 HD11 LEU 528 HD11 LEU 528 -5.423 -3.686 -10.814 435 HD12 LEU 528 HD12 LEU 528 -3.990 -2.668 -10.668 436 HD13 LEU 528 HD13 LEU 528 -5.003 -2.973 -9.256 437 HD21 LEU 528 HD21 LEU 528 -2.746 -6.200 -10.851 438 HD22 LEU 528 HD22 LEU 528 -2.620 -4.625 -11.634 439 HD23 LEU 528 HD23 LEU 528 -4.124 -5.540 -11.732 440 H ILE 529 HN ILE 529 -1.388 -5.806 -5.994 441 HA ILE 529 HA ILE 529 0.710 -3.815 -5.638 442 HB ILE 529 HB ILE 529 -0.602 -5.581 -3.569 443 HG12 ILE 529 HG12 ILE 529 -2.206 -4.127 -4.815 444 HG13 ILE 529 HG11 ILE 529 -2.098 -3.763 -3.102 445 HG21 ILE 529 HG21 ILE 529 0.193 -3.877 -1.980 446 HG22 ILE 529 HG22 ILE 529 1.012 -3.045 -3.303 447 HG23 ILE 529 HG23 ILE 529 1.521 -4.667 -2.831 448 HD11 ILE 529 HD11 ILE 529 -0.766 -2.224 -5.318 449 HD12 ILE 529 HD12 ILE 529 -0.665 -1.849 -3.598 450 HD13 ILE 529 HD13 ILE 529 -2.211 -1.735 -4.437 451 H SER 530 HN SER 530 2.807 -4.288 -5.176 452 HA SER 530 HA SER 530 3.530 -7.114 -4.828 453 HB2 SER 530 HB2 SER 530 4.695 -5.107 -6.746 454 HB3 SER 530 HB1 SER 530 5.564 -6.561 -6.285 455 HG SER 530 HG SER 530 2.969 -7.026 -7.051 456 H ARG 531 HN ARG 531 5.891 -7.268 -4.089 457 HA ARG 531 HA ARG 531 6.171 -5.333 -1.903 458 HB2 ARG 531 HB2 ARG 531 6.001 -7.947 -1.624 459 HB3 ARG 531 HB1 ARG 531 7.712 -7.893 -2.038 460 HG2 ARG 531 HG2 ARG 531 7.968 -6.187 -0.197 461 HG3 ARG 531 HG1 ARG 531 6.327 -6.611 0.290 462 HD2 ARG 531 HD2 ARG 531 7.829 -7.887 1.628 463 HD3 ARG 531 HD1 ARG 531 7.083 -8.985 0.468 464 HE ARG 531 HE ARG 531 9.138 -9.020 -0.755 465 HH11 ARG 531 HH11 ARG 531 9.325 -7.320 2.301 466 HH12 ARG 531 HH12 ARG 531 11.040 -7.541 2.472 467 HH21 ARG 531 HH21 ARG 531 11.405 -9.287 -0.557 468 HH22 ARG 531 HH22 ARG 531 12.223 -8.660 0.837 469 H TYR 532 HN TYR 532 8.053 -4.216 -1.580 470 HA TYR 532 HA TYR 532 9.680 -3.711 -3.828 471 HB2 TYR 532 HB2 TYR 532 9.104 -2.110 -1.949 472 HB3 TYR 532 HB1 TYR 532 10.276 -2.978 -0.961 473 HD1 TYR 532 HD1 TYR 532 9.811 -0.754 -3.810 474 HD2 TYR 532 HD2 TYR 532 12.645 -2.747 -1.359 475 HE1 TYR 532 HE1 TYR 532 11.596 0.659 -4.746 476 HE2 TYR 532 HE2 TYR 532 14.449 -1.341 -2.275 477 HH TYR 532 HH TYR 532 14.932 0.003 -4.204 478 H ALA 533 HN ALA 533 11.604 -4.535 -4.417 479 HA ALA 533 HA ALA 533 13.000 -6.306 -2.531 480 HB1 ALA 533 HB1 ALA 533 12.471 -6.919 -5.436 481 HB2 ALA 533 HB2 ALA 533 11.694 -7.697 -4.058 482 HB3 ALA 533 HB3 ALA 533 13.423 -7.905 -4.328 483 H GLY 534 HN GLY 534 14.876 -5.311 -2.156 484 HA2 GLY 534 HA2 GLY 534 16.689 -4.825 -4.337 485 HA3 GLY 534 HA1 GLY 534 16.119 -3.345 -3.578 486 H GLY 535 HN GLY 535 16.958 -6.514 -2.209 487 HA2 GLY 535 HA2 GLY 535 18.597 -7.107 -0.704 488 HA3 GLY 535 HA1 GLY 535 19.386 -5.571 -1.033 489 H ALA 536 HN ALA 536 18.792 -3.732 0.161 490 HA ALA 536 HA ALA 536 17.820 -4.354 2.826 491 HB1 ALA 536 HB1 ALA 536 18.846 -1.750 1.700 492 HB2 ALA 536 HB2 ALA 536 19.818 -2.956 2.541 493 HB3 ALA 536 HB3 ALA 536 18.535 -2.104 3.399 494 H GLU 537 HN GLU 537 15.792 -4.114 3.401 495 HA GLU 537 HA GLU 537 13.812 -3.222 1.583 496 HB2 GLU 537 HB2 GLU 537 13.518 -3.701 4.552 497 HB3 GLU 537 HB1 GLU 537 12.236 -3.722 3.347 498 HG2 GLU 537 HG2 GLU 537 13.171 -5.696 2.323 499 HG3 GLU 537 HG1 GLU 537 14.548 -5.649 3.421 500 H GLU 538 HN GLU 538 15.589 -1.685 4.130 501 HA GLU 538 HA GLU 538 13.786 0.541 4.382 502 HB2 GLU 538 HB2 GLU 538 16.581 0.108 5.435 503 HB3 GLU 538 HB1 GLU 538 15.578 1.497 5.823 504 HG2 GLU 538 HG2 GLU 538 14.900 -1.368 6.442 505 HG3 GLU 538 HG1 GLU 538 15.553 -0.196 7.587 506 H ASN 539 HN ASN 539 15.990 -0.325 2.056 507 HA ASN 539 HA ASN 539 16.976 2.333 1.476 508 HB2 ASN 539 HB2 ASN 539 17.286 -0.341 0.143 509 HB3 ASN 539 HB1 ASN 539 17.763 1.134 -0.687 510 HD21 ASN 539 HD21 ASN 539 19.917 0.525 -0.719 511 HD22 ASN 539 HD22 ASN 539 20.902 0.552 0.704 512 H ALA 540 HN ALA 540 14.090 0.856 1.096 513 HA ALA 540 HA ALA 540 13.299 1.574 -1.511 514 HB1 ALA 540 HB1 ALA 540 12.052 -0.016 -0.132 515 HB2 ALA 540 HB2 ALA 540 11.017 1.301 -0.682 516 HB3 ALA 540 HB3 ALA 540 11.616 1.284 0.978 517 HA PRO 541 HA PRO 541 12.970 5.993 -0.892 518 HB2 PRO 541 HB2 PRO 541 11.954 6.598 -3.316 519 HB3 PRO 541 HB1 PRO 541 13.652 6.161 -3.096 520 HG2 PRO 541 HG2 PRO 541 11.376 4.479 -4.044 521 HG3 PRO 541 HG1 PRO 541 13.023 4.571 -4.673 522 HD2 PRO 541 HD2 PRO 541 12.174 2.585 -3.020 523 HD3 PRO 541 HD1 PRO 541 13.854 3.158 -3.067 524 H LEU 542 HN LEU 542 11.169 7.629 -1.078 525 HA LEU 542 HA LEU 542 8.587 6.297 -0.610 526 HB2 LEU 542 HB2 LEU 542 9.756 7.171 1.454 527 HB3 LEU 542 HB1 LEU 542 9.545 8.784 0.801 528 HG LEU 542 HG LEU 542 7.087 8.441 0.838 529 HD11 LEU 542 HD11 LEU 542 6.190 6.560 2.143 530 HD12 LEU 542 HD12 LEU 542 7.811 5.870 2.232 531 HD13 LEU 542 HD13 LEU 542 7.004 6.031 0.671 532 HD21 LEU 542 HD21 LEU 542 8.474 8.019 3.479 533 HD22 LEU 542 HD22 LEU 542 6.843 8.649 3.254 534 HD23 LEU 542 HD23 LEU 542 8.232 9.570 2.677 535 H HIS 543 HN HIS 543 7.326 6.763 -2.272 536 HA HIS 543 HA HIS 543 7.594 9.164 -3.820 537 HB2 HIS 543 HB2 HIS 543 5.701 6.834 -3.866 538 HB3 HIS 543 HB1 HIS 543 5.349 8.276 -4.805 539 HD1 HIS 543 HD1 HIS 543 5.600 6.911 -7.010 540 HD2 HIS 543 HD2 HIS 543 9.042 7.111 -4.684 541 HE1 HIS 543 HE1 HIS 543 7.466 6.097 -8.488 542 HE2 HIS 543 HE2 HIS 543 9.548 6.277 -7.083 543 H LYS 544 HN LYS 544 5.619 10.540 -4.260 544 HA LYS 544 HA LYS 544 4.220 11.080 -1.721 545 HB2 LYS 544 HB2 LYS 544 5.820 12.857 -2.266 546 HB3 LYS 544 HB1 LYS 544 5.078 13.055 -3.848 547 HG2 LYS 544 HG2 LYS 544 2.968 13.709 -2.736 548 HG3 LYS 544 HG1 LYS 544 3.793 13.611 -1.181 549 HD2 LYS 544 HD2 LYS 544 4.629 15.409 -3.453 550 HD3 LYS 544 HD1 LYS 544 3.627 15.918 -2.096 551 HE2 LYS 544 HE2 LYS 544 5.462 15.280 -0.560 552 HE3 LYS 544 HE1 LYS 544 6.461 14.898 -1.960 553 HZ1 LYS 544 HZ1 LYS 544 5.324 17.560 -1.307 554 HZ2 LYS 544 HZ2 LYS 544 6.244 17.208 -2.678 555 HZ3 LYS 544 HZ3 LYS 544 6.942 17.107 -1.143 556 H LEU 545 HN LEU 545 2.043 11.206 -1.765 557 HA LEU 545 HA LEU 545 0.648 10.798 -4.277 558 HB2 LEU 545 HB2 LEU 545 -0.407 11.178 -1.472 559 HB3 LEU 545 HB1 LEU 545 -1.383 10.770 -2.867 560 HG LEU 545 HG LEU 545 0.787 9.026 -1.698 561 HD11 LEU 545 HD11 LEU 545 -2.212 8.751 -1.577 562 HD12 LEU 545 HD12 LEU 545 -1.171 9.231 -0.237 563 HD13 LEU 545 HD13 LEU 545 -1.028 7.615 -0.927 564 HD21 LEU 545 HD21 LEU 545 0.505 8.714 -4.105 565 HD22 LEU 545 HD22 LEU 545 -1.226 8.481 -3.874 566 HD23 LEU 545 HD23 LEU 545 -0.083 7.318 -3.204 567 H GLY 546 HN GLY 546 -0.148 12.405 -5.479 568 HA2 GLY 546 HA2 GLY 546 -0.958 14.516 -6.018 569 HA3 GLY 546 HA1 GLY 546 -0.849 14.960 -4.319 570 H GLY 547 HN GLY 547 1.784 13.561 -6.121 571 HA2 GLY 547 HA2 GLY 547 3.055 16.142 -6.549 572 HA3 GLY 547 HA1 GLY 547 3.853 15.065 -5.410 Start of MODEL 5 1 H1 ARG 472 HT1 ARG 472 3.950 -12.181 -4.166 2 H2 ARG 472 HT2 ARG 472 5.537 -11.653 -3.934 3 H3 ARG 472 HT3 ARG 472 4.867 -11.663 -5.487 4 HA ARG 472 HA ARG 472 4.940 -9.433 -4.632 5 HB2 ARG 472 HB2 ARG 472 2.560 -8.853 -4.905 6 HB3 ARG 472 HB1 ARG 472 3.104 -9.988 -6.131 7 HG2 ARG 472 HG2 ARG 472 2.007 -11.803 -5.037 8 HG3 ARG 472 HG1 ARG 472 1.638 -10.801 -3.636 9 HD2 ARG 472 HD2 ARG 472 0.110 -9.469 -4.909 10 HD3 ARG 472 HD1 ARG 472 0.598 -10.255 -6.411 11 HE ARG 472 HE ARG 472 -0.483 -12.265 -5.649 12 HH11 ARG 472 HH11 ARG 472 -1.226 -9.374 -3.819 13 HH12 ARG 472 HH12 ARG 472 -2.622 -10.068 -3.061 14 HH21 ARG 472 HH21 ARG 472 -2.331 -13.159 -4.669 15 HH22 ARG 472 HH22 ARG 472 -3.253 -12.212 -3.542 16 H ASN 473 HN ASN 473 3.862 -11.775 -2.385 17 HA ASN 473 HA ASN 473 3.406 -11.750 -0.175 18 HB2 ASN 473 HB2 ASN 473 5.176 -9.923 -0.073 19 HB3 ASN 473 HB1 ASN 473 3.855 -8.765 -0.118 20 HD21 ASN 473 HD21 ASN 473 5.352 -11.325 1.730 21 HD22 ASN 473 HD22 ASN 473 4.644 -10.902 3.254 22 H LEU 474 HN LEU 474 2.123 -8.853 0.607 23 HA LEU 474 HA LEU 474 0.045 -7.998 0.818 24 HB2 LEU 474 HB2 LEU 474 -0.545 -9.717 -1.579 25 HB3 LEU 474 HB1 LEU 474 -1.786 -8.773 -0.778 26 HG LEU 474 HG LEU 474 -1.064 -7.519 -2.657 27 HD11 LEU 474 HD11 LEU 474 -1.361 -6.362 -0.436 28 HD12 LEU 474 HD12 LEU 474 -0.442 -5.488 -1.659 29 HD13 LEU 474 HD13 LEU 474 0.400 -6.309 -0.344 30 HD21 LEU 474 HD21 LEU 474 1.242 -6.887 -3.048 31 HD22 LEU 474 HD22 LEU 474 1.080 -8.642 -3.026 32 HD23 LEU 474 HD23 LEU 474 1.749 -7.799 -1.628 33 H ALA 475 HN ALA 475 -2.085 -8.525 1.640 34 HA ALA 475 HA ALA 475 -3.454 -9.579 3.100 35 HB1 ALA 475 HB1 ALA 475 -3.584 -11.390 1.456 36 HB2 ALA 475 HB2 ALA 475 -3.642 -12.004 3.107 37 HB3 ALA 475 HB3 ALA 475 -2.155 -12.139 2.170 38 H GLU 476 HN GLU 476 -0.385 -11.383 3.248 39 HA GLU 476 HA GLU 476 -0.430 -11.314 6.149 40 HB2 GLU 476 HB2 GLU 476 1.653 -12.458 4.279 41 HB3 GLU 476 HB1 GLU 476 1.516 -12.766 6.005 42 HG2 GLU 476 HG2 GLU 476 -0.541 -13.530 3.944 43 HG3 GLU 476 HG1 GLU 476 0.667 -14.616 4.625 44 H LEU 477 HN LEU 477 -0.190 -8.821 4.772 45 HA LEU 477 HA LEU 477 2.481 -7.905 4.612 46 HB2 LEU 477 HB2 LEU 477 -0.164 -6.489 4.808 47 HB3 LEU 477 HB1 LEU 477 1.357 -5.633 4.643 48 HG LEU 477 HG LEU 477 0.588 -7.721 2.641 49 HD11 LEU 477 HD11 LEU 477 -0.283 -4.836 2.646 50 HD12 LEU 477 HD12 LEU 477 -1.334 -6.247 2.777 51 HD13 LEU 477 HD13 LEU 477 -0.438 -5.949 1.289 52 HD21 LEU 477 HD21 LEU 477 2.869 -6.829 2.626 53 HD22 LEU 477 HD22 LEU 477 2.228 -5.192 2.484 54 HD23 LEU 477 HD23 LEU 477 1.981 -6.352 1.179 55 H HIS 478 HN HIS 478 3.573 -6.438 5.945 56 HA HIS 478 HA HIS 478 2.689 -6.451 8.755 57 HB2 HIS 478 HB2 HIS 478 5.470 -6.536 7.579 58 HB3 HIS 478 HB1 HIS 478 5.161 -6.172 9.272 59 HD1 HIS 478 HD1 HIS 478 5.156 -8.127 10.783 60 HD2 HIS 478 HD2 HIS 478 4.374 -9.213 6.847 61 HE1 HIS 478 HE1 HIS 478 5.024 -10.637 10.786 62 HE2 HIS 478 HE2 HIS 478 4.426 -11.264 8.419 63 H ILE 479 HN ILE 479 3.267 -4.550 10.009 64 HA ILE 479 HA ILE 479 2.511 -2.196 8.582 65 HB ILE 479 HB ILE 479 3.522 -2.369 11.421 66 HG12 ILE 479 HG12 ILE 479 1.652 -3.907 11.129 67 HG13 ILE 479 HG11 ILE 479 1.152 -2.517 12.084 68 HG21 ILE 479 HG21 ILE 479 3.457 -0.115 10.435 69 HG22 ILE 479 HG22 ILE 479 2.312 -0.305 11.767 70 HG23 ILE 479 HG23 ILE 479 1.736 -0.332 10.101 71 HD11 ILE 479 HD11 ILE 479 0.077 -1.558 10.111 72 HD12 ILE 479 HD12 ILE 479 -0.567 -3.150 10.507 73 HD13 ILE 479 HD13 ILE 479 0.567 -2.965 9.169 74 H GLY 480 HN GLY 480 3.728 -0.635 7.738 75 HA2 GLY 480 HA2 GLY 480 5.531 0.844 7.605 76 HA3 GLY 480 HA1 GLY 480 6.403 -0.151 8.763 77 H GLN 481 HN GLN 481 5.045 -2.046 6.361 78 HA GLN 481 HA GLN 481 7.660 -2.610 5.295 79 HB2 GLN 481 HB2 GLN 481 4.954 -3.854 4.991 80 HB3 GLN 481 HB1 GLN 481 6.242 -4.263 3.865 81 HG2 GLN 481 HG2 GLN 481 6.348 -4.582 6.852 82 HG3 GLN 481 HG1 GLN 481 6.099 -5.872 5.677 83 HE21 GLN 481 HE21 GLN 481 7.808 -6.505 4.363 84 HE22 GLN 481 HE22 GLN 481 9.457 -6.118 4.734 85 HA PRO 482 HA PRO 482 7.166 -0.134 1.684 86 HB2 PRO 482 HB2 PRO 482 9.308 -0.989 0.320 87 HB3 PRO 482 HB1 PRO 482 9.469 -0.021 1.789 88 HG2 PRO 482 HG2 PRO 482 9.806 -2.963 1.410 89 HG3 PRO 482 HG1 PRO 482 10.739 -1.847 2.424 90 HD2 PRO 482 HD2 PRO 482 8.720 -3.516 3.338 91 HD3 PRO 482 HD1 PRO 482 9.290 -2.055 4.169 92 H VAL 483 HN VAL 483 5.680 -0.466 0.201 93 HA VAL 483 HA VAL 483 5.848 -2.859 -1.484 94 HB VAL 483 HB VAL 483 3.337 -2.953 -1.534 95 HG11 VAL 483 HG11 VAL 483 3.120 -4.144 0.614 96 HG12 VAL 483 HG12 VAL 483 4.674 -3.479 1.119 97 HG13 VAL 483 HG13 VAL 483 4.591 -4.581 -0.255 98 HG21 VAL 483 HG21 VAL 483 3.576 -1.158 0.878 99 HG22 VAL 483 HG22 VAL 483 2.099 -1.950 0.324 100 HG23 VAL 483 HG23 VAL 483 2.872 -0.720 -0.678 101 H VAL 484 HN VAL 484 5.236 -2.542 -3.614 102 HA VAL 484 HA VAL 484 5.062 0.277 -4.364 103 HB VAL 484 HB VAL 484 5.722 -0.419 -6.618 104 HG11 VAL 484 HG11 VAL 484 8.014 -0.981 -6.119 105 HG12 VAL 484 HG12 VAL 484 7.552 -1.525 -4.505 106 HG13 VAL 484 HG13 VAL 484 7.401 0.177 -4.938 107 HG21 VAL 484 HG21 VAL 484 5.914 -3.183 -5.455 108 HG22 VAL 484 HG22 VAL 484 6.458 -2.696 -7.060 109 HG23 VAL 484 HG23 VAL 484 4.742 -2.635 -6.653 110 H HIS 485 HN HIS 485 3.424 1.115 -5.349 111 HA HIS 485 HA HIS 485 1.110 -0.581 -5.989 112 HB2 HIS 485 HB2 HIS 485 0.899 1.401 -4.391 113 HB3 HIS 485 HB1 HIS 485 1.202 2.438 -5.770 114 HD1 HIS 485 HD1 HIS 485 -1.180 3.474 -5.318 115 HD2 HIS 485 HD2 HIS 485 -1.184 -0.521 -6.464 116 HE1 HIS 485 HE1 HIS 485 -3.553 2.946 -5.927 117 HE2 HIS 485 HE2 HIS 485 -3.467 0.627 -6.887 118 H LEU 486 HN LEU 486 0.921 -1.090 -8.066 119 HA LEU 486 HA LEU 486 2.657 -0.263 -10.041 120 HB2 LEU 486 HB2 LEU 486 1.378 -1.528 -11.571 121 HB3 LEU 486 HB1 LEU 486 1.268 -2.335 -10.025 122 HG LEU 486 HG LEU 486 -0.861 -2.544 -10.922 123 HD11 LEU 486 HD11 LEU 486 -1.013 -0.104 -9.176 124 HD12 LEU 486 HD12 LEU 486 -1.014 -1.783 -8.642 125 HD13 LEU 486 HD13 LEU 486 -2.364 -1.159 -9.592 126 HD21 LEU 486 HD21 LEU 486 -0.641 -1.069 -12.810 127 HD22 LEU 486 HD22 LEU 486 -0.751 0.343 -11.761 128 HD23 LEU 486 HD23 LEU 486 -2.140 -0.724 -11.951 129 H GLU 487 HN GLU 487 -0.064 1.412 -8.887 130 HA GLU 487 HA GLU 487 -0.487 2.964 -11.278 131 HB2 GLU 487 HB2 GLU 487 -1.661 3.120 -8.499 132 HB3 GLU 487 HB1 GLU 487 -2.120 4.196 -9.816 133 HG2 GLU 487 HG2 GLU 487 -3.058 2.442 -11.064 134 HG3 GLU 487 HG1 GLU 487 -2.288 1.216 -10.064 135 H HIS 488 HN HIS 488 0.959 3.497 -8.044 136 HA HIS 488 HA HIS 488 1.894 6.087 -9.102 137 HB2 HIS 488 HB2 HIS 488 0.565 5.483 -6.568 138 HB3 HIS 488 HB1 HIS 488 1.994 6.503 -6.412 139 HD1 HIS 488 HD1 HIS 488 1.737 8.915 -7.012 140 HD2 HIS 488 HD2 HIS 488 -1.426 6.601 -8.392 141 HE1 HIS 488 HE1 HIS 488 0.043 10.548 -7.901 142 HE2 HIS 488 HE2 HIS 488 -1.742 9.105 -8.941 143 H GLY 489 HN GLY 489 2.841 3.395 -6.953 144 HA2 GLY 489 HA2 GLY 489 5.253 2.807 -7.621 145 HA3 GLY 489 HA1 GLY 489 5.590 4.453 -7.117 146 H VAL 490 HN VAL 490 7.072 3.673 -5.588 147 HA VAL 490 HA VAL 490 6.472 1.706 -3.648 148 HB VAL 490 HB VAL 490 8.544 3.870 -3.309 149 HG11 VAL 490 HG11 VAL 490 9.764 2.129 -2.097 150 HG12 VAL 490 HG12 VAL 490 8.437 1.002 -2.383 151 HG13 VAL 490 HG13 VAL 490 8.180 2.430 -1.381 152 HG21 VAL 490 HG21 VAL 490 8.877 1.303 -4.850 153 HG22 VAL 490 HG22 VAL 490 10.117 2.515 -4.542 154 HG23 VAL 490 HG23 VAL 490 8.738 2.906 -5.566 155 H GLY 491 HN GLY 491 5.624 1.807 -1.674 156 HA2 GLY 491 HA2 GLY 491 5.371 4.383 -0.305 157 HA3 GLY 491 HA1 GLY 491 3.891 3.488 -0.626 158 H ARG 492 HN ARG 492 4.278 3.960 1.931 159 HA ARG 492 HA ARG 492 5.491 1.513 3.027 160 HB2 ARG 492 HB2 ARG 492 5.050 4.220 4.278 161 HB3 ARG 492 HB1 ARG 492 5.508 2.796 5.206 162 HG2 ARG 492 HG2 ARG 492 7.082 3.892 2.893 163 HG3 ARG 492 HG1 ARG 492 7.417 4.257 4.590 164 HD2 ARG 492 HD2 ARG 492 7.839 1.924 5.045 165 HD3 ARG 492 HD1 ARG 492 7.367 1.484 3.407 166 HE ARG 492 HE ARG 492 9.387 3.162 2.942 167 HH11 ARG 492 HH11 ARG 492 9.090 0.495 5.188 168 HH12 ARG 492 HH12 ARG 492 10.773 0.077 5.108 169 HH21 ARG 492 HH21 ARG 492 11.606 2.607 2.821 170 HH22 ARG 492 HH22 ARG 492 12.197 1.265 3.756 171 H TYR 493 HN TYR 493 4.172 0.028 3.672 172 HA TYR 493 HA TYR 493 1.362 0.348 3.605 173 HB2 TYR 493 HB2 TYR 493 2.511 -1.763 3.072 174 HB3 TYR 493 HB1 TYR 493 3.047 -1.890 4.739 175 HD1 TYR 493 HD1 TYR 493 -0.041 -1.724 2.661 176 HD2 TYR 493 HD2 TYR 493 1.754 -2.999 6.304 177 HE1 TYR 493 HE1 TYR 493 -2.090 -2.960 3.237 178 HE2 TYR 493 HE2 TYR 493 -0.282 -4.231 6.890 179 HH TYR 493 HH TYR 493 -2.799 -4.802 4.650 180 H ALA 494 HN ALA 494 -0.074 0.817 5.180 181 HA ALA 494 HA ALA 494 0.809 0.503 7.969 182 HB1 ALA 494 HB1 ALA 494 -0.192 2.636 8.592 183 HB2 ALA 494 HB2 ALA 494 -0.581 2.956 6.902 184 HB3 ALA 494 HB3 ALA 494 1.105 2.865 7.418 185 H GLY 495 HN GLY 495 -0.474 -1.258 8.266 186 HA2 GLY 495 HA2 GLY 495 -2.360 -2.412 8.829 187 HA3 GLY 495 HA1 GLY 495 -2.995 -0.850 9.300 188 H MET 496 HN MET 496 -5.033 -1.565 8.720 189 HA MET 496 HA MET 496 -5.620 -1.258 5.883 190 HB2 MET 496 HB2 MET 496 -6.266 -3.680 7.513 191 HB3 MET 496 HB1 MET 496 -7.410 -3.149 6.284 192 HG2 MET 496 HG2 MET 496 -5.756 -3.372 4.571 193 HG3 MET 496 HG1 MET 496 -4.508 -3.721 5.759 194 HE1 MET 496 HE1 MET 496 -7.760 -4.995 3.988 195 HE2 MET 496 HE2 MET 496 -8.225 -5.055 5.689 196 HE3 MET 496 HE3 MET 496 -8.024 -6.550 4.777 197 H THR 497 HN THR 497 -7.689 -0.555 5.445 198 HA THR 497 HA THR 497 -9.245 0.324 7.768 199 HB THR 497 HB THR 497 -7.921 2.244 7.094 200 HG1 THR 497 HG1 THR 497 -10.688 2.234 6.656 201 HG21 THR 497 HG21 THR 497 -8.156 3.241 4.852 202 HG22 THR 497 HG22 THR 497 -9.111 1.846 4.348 203 HG23 THR 497 HG23 THR 497 -7.418 1.641 4.798 204 H THR 498 HN THR 498 -11.394 0.017 7.550 205 HA THR 498 HA THR 498 -12.352 -0.975 4.983 206 HB THR 498 HB THR 498 -14.483 -0.888 6.829 207 HG1 THR 498 HG1 THR 498 -13.311 -0.784 8.638 208 HG21 THR 498 HG21 THR 498 -14.091 -2.620 5.140 209 HG22 THR 498 HG22 THR 498 -14.305 -3.326 6.741 210 HG23 THR 498 HG23 THR 498 -12.690 -3.190 6.047 211 H LEU 499 HN LEU 499 -13.616 0.213 3.657 212 HA LEU 499 HA LEU 499 -14.354 2.890 4.618 213 HB2 LEU 499 HB2 LEU 499 -13.748 1.996 1.800 214 HB3 LEU 499 HB1 LEU 499 -14.228 3.614 2.269 215 HG LEU 499 HG LEU 499 -11.652 2.224 3.019 216 HD11 LEU 499 HD11 LEU 499 -12.216 4.589 1.238 217 HD12 LEU 499 HD12 LEU 499 -11.705 2.983 0.715 218 HD13 LEU 499 HD13 LEU 499 -10.616 3.986 1.672 219 HD21 LEU 499 HD21 LEU 499 -11.030 4.378 4.039 220 HD22 LEU 499 HD22 LEU 499 -12.390 3.614 4.861 221 HD23 LEU 499 HD23 LEU 499 -12.671 4.964 3.763 222 H GLU 500 HN GLU 500 -16.413 3.443 4.622 223 HA GLU 500 HA GLU 500 -18.322 1.624 3.327 224 HB2 GLU 500 HB2 GLU 500 -18.722 3.528 5.644 225 HB3 GLU 500 HB1 GLU 500 -20.010 2.611 4.885 226 HG2 GLU 500 HG2 GLU 500 -19.479 1.413 6.807 227 HG3 GLU 500 HG1 GLU 500 -18.683 0.533 5.507 228 H ALA 501 HN ALA 501 -19.485 2.364 1.688 229 HA ALA 501 HA ALA 501 -19.768 5.258 1.301 230 HB1 ALA 501 HB1 ALA 501 -19.314 4.939 -1.110 231 HB2 ALA 501 HB2 ALA 501 -18.892 3.255 -0.780 232 HB3 ALA 501 HB3 ALA 501 -17.919 4.559 -0.101 233 H GLY 502 HN GLY 502 -21.524 5.795 -0.194 234 HA2 GLY 502 HA2 GLY 502 -23.834 4.162 0.257 235 HA3 GLY 502 HA1 GLY 502 -23.770 5.639 -0.695 236 H GLY 503 HN GLY 503 -22.995 2.192 -0.765 237 HA2 GLY 503 HA2 GLY 503 -24.081 1.135 -2.824 238 HA3 GLY 503 HA1 GLY 503 -23.107 2.300 -3.709 239 H ILE 504 HN ILE 504 -20.745 2.178 -2.220 240 HA ILE 504 HA ILE 504 -19.893 -0.602 -2.726 241 HB ILE 504 HB ILE 504 -18.237 1.909 -3.052 242 HG12 ILE 504 HG12 ILE 504 -19.915 1.708 -4.823 243 HG13 ILE 504 HG11 ILE 504 -18.304 1.403 -5.461 244 HG21 ILE 504 HG21 ILE 504 -16.550 0.421 -4.023 245 HG22 ILE 504 HG22 ILE 504 -17.569 -0.969 -3.654 246 HG23 ILE 504 HG23 ILE 504 -16.900 0.004 -2.346 247 HD11 ILE 504 HD11 ILE 504 -18.741 -1.007 -5.362 248 HD12 ILE 504 HD12 ILE 504 -19.891 -0.155 -6.392 249 HD13 ILE 504 HD13 ILE 504 -20.369 -0.671 -4.775 250 H THR 505 HN THR 505 -19.705 -1.522 -0.771 251 HA THR 505 HA THR 505 -18.044 -0.112 1.212 252 HB THR 505 HB THR 505 -19.203 -1.376 2.976 253 HG1 THR 505 HG1 THR 505 -19.916 -3.051 1.319 254 HG21 THR 505 HG21 THR 505 -21.063 0.202 1.203 255 HG22 THR 505 HG22 THR 505 -20.014 0.853 2.462 256 HG23 THR 505 HG23 THR 505 -21.362 -0.198 2.894 257 H GLY 506 HN GLY 506 -16.159 -1.132 1.714 258 HA2 GLY 506 HA2 GLY 506 -15.971 -4.005 1.603 259 HA3 GLY 506 HA1 GLY 506 -15.144 -3.212 0.275 260 H GLU 507 HN GLU 507 -13.465 -4.569 1.475 261 HA GLU 507 HA GLU 507 -12.269 -3.163 3.741 262 HB2 GLU 507 HB2 GLU 507 -11.498 -5.762 2.406 263 HB3 GLU 507 HB1 GLU 507 -10.785 -5.112 3.876 264 HG2 GLU 507 HG2 GLU 507 -12.900 -5.350 5.037 265 HG3 GLU 507 HG1 GLU 507 -13.664 -5.932 3.558 266 H TYR 508 HN TYR 508 -10.360 -2.055 3.581 267 HA TYR 508 HA TYR 508 -9.018 -2.064 0.968 268 HB2 TYR 508 HB2 TYR 508 -9.916 0.388 2.494 269 HB3 TYR 508 HB1 TYR 508 -8.830 0.421 1.107 270 HD1 TYR 508 HD1 TYR 508 -12.271 -0.295 2.203 271 HD2 TYR 508 HD2 TYR 508 -9.664 0.178 -1.121 272 HE1 TYR 508 HE1 TYR 508 -14.208 -0.252 0.703 273 HE2 TYR 508 HE2 TYR 508 -11.601 0.233 -2.635 274 HH TYR 508 HH TYR 508 -14.798 0.575 -1.512 275 H LEU 509 HN LEU 509 -6.975 -1.635 0.903 276 HA LEU 509 HA LEU 509 -5.392 -1.982 3.263 277 HB2 LEU 509 HB2 LEU 509 -4.651 -3.117 1.365 278 HB3 LEU 509 HB1 LEU 509 -4.983 -1.763 0.310 279 HG LEU 509 HG LEU 509 -2.762 -1.603 2.312 280 HD11 LEU 509 HD11 LEU 509 -2.694 -2.833 -0.437 281 HD12 LEU 509 HD12 LEU 509 -2.464 -3.688 1.086 282 HD13 LEU 509 HD13 LEU 509 -1.280 -2.488 0.562 283 HD21 LEU 509 HD21 LEU 509 -1.906 0.047 0.897 284 HD22 LEU 509 HD22 LEU 509 -3.644 0.367 0.920 285 HD23 LEU 509 HD23 LEU 509 -2.913 -0.461 -0.456 286 H MET 510 HN MET 510 -4.126 -0.422 4.251 287 HA MET 510 HA MET 510 -4.534 2.322 3.271 288 HB2 MET 510 HB2 MET 510 -5.091 1.329 5.772 289 HB3 MET 510 HB1 MET 510 -3.486 2.012 5.994 290 HG2 MET 510 HG2 MET 510 -4.319 4.140 5.025 291 HG3 MET 510 HG1 MET 510 -5.931 3.441 4.993 292 HE1 MET 510 HE1 MET 510 -2.968 4.665 7.208 293 HE2 MET 510 HE2 MET 510 -3.136 3.001 7.771 294 HE3 MET 510 HE3 MET 510 -3.552 4.339 8.841 295 H LEU 511 HN LEU 511 -2.828 3.275 2.413 296 HA LEU 511 HA LEU 511 -0.151 2.337 3.210 297 HB2 LEU 511 HB2 LEU 511 -1.389 2.483 0.603 298 HB3 LEU 511 HB1 LEU 511 0.065 3.460 0.659 299 HG LEU 511 HG LEU 511 0.205 0.666 1.694 300 HD11 LEU 511 HD11 LEU 511 -0.975 0.740 -0.589 301 HD12 LEU 511 HD12 LEU 511 0.427 -0.308 -0.397 302 HD13 LEU 511 HD13 LEU 511 0.595 1.246 -1.216 303 HD21 LEU 511 HD21 LEU 511 2.102 2.199 1.905 304 HD22 LEU 511 HD22 LEU 511 2.103 2.427 0.156 305 HD23 LEU 511 HD23 LEU 511 2.470 0.845 0.840 306 H THR 512 HN THR 512 1.477 3.864 3.353 307 HA THR 512 HA THR 512 0.573 6.661 3.282 308 HB THR 512 HB THR 512 2.489 6.970 5.031 309 HG1 THR 512 HG1 THR 512 2.257 4.242 4.871 310 HG21 THR 512 HG21 THR 512 0.871 6.650 6.849 311 HG22 THR 512 HG22 THR 512 -0.170 5.743 5.750 312 HG23 THR 512 HG23 THR 512 0.149 7.452 5.454 313 H TYR 513 HN TYR 513 1.649 7.969 2.035 314 HA TYR 513 HA TYR 513 4.224 7.060 0.942 315 HB2 TYR 513 HB2 TYR 513 1.998 8.705 -0.219 316 HB3 TYR 513 HB1 TYR 513 3.630 8.845 -0.859 317 HD1 TYR 513 HD1 TYR 513 1.377 6.019 0.154 318 HD2 TYR 513 HD2 TYR 513 3.958 7.674 -2.794 319 HE1 TYR 513 HE1 TYR 513 0.980 4.067 -1.285 320 HE2 TYR 513 HE2 TYR 513 3.567 5.726 -4.240 321 HH TYR 513 HH TYR 513 2.885 3.326 -3.942 322 H ALA 514 HN ALA 514 5.001 9.558 -0.145 323 HA ALA 514 HA ALA 514 6.382 10.683 2.002 324 HB1 ALA 514 HB1 ALA 514 5.704 11.968 -0.640 325 HB2 ALA 514 HB2 ALA 514 7.099 10.937 -0.319 326 HB3 ALA 514 HB3 ALA 514 6.955 12.504 0.481 327 H ASN 515 HN ASN 515 6.075 12.434 3.278 328 HA ASN 515 HA ASN 515 5.031 14.072 4.437 329 HB2 ASN 515 HB2 ASN 515 3.466 14.386 1.866 330 HB3 ASN 515 HB1 ASN 515 3.324 15.474 3.237 331 HD21 ASN 515 HD21 ASN 515 4.054 17.246 2.138 332 HD22 ASN 515 HD22 ASN 515 5.696 17.438 1.638 333 H ASP 516 HN ASP 516 4.097 11.281 4.372 334 HA ASP 516 HA ASP 516 2.531 9.965 5.332 335 HB2 ASP 516 HB2 ASP 516 1.618 12.559 6.590 336 HB3 ASP 516 HB1 ASP 516 1.090 10.957 7.085 337 H ALA 517 HN ALA 517 2.000 10.814 2.741 338 HA ALA 517 HA ALA 517 -0.720 11.640 2.470 339 HB1 ALA 517 HB1 ALA 517 -0.443 11.116 0.110 340 HB2 ALA 517 HB2 ALA 517 1.082 10.301 0.456 341 HB3 ALA 517 HB3 ALA 517 0.933 12.039 0.711 342 H LYS 518 HN LYS 518 -2.524 10.407 1.959 343 HA LYS 518 HA LYS 518 -2.340 7.684 3.021 344 HB2 LYS 518 HB2 LYS 518 -4.723 9.513 2.695 345 HB3 LYS 518 HB1 LYS 518 -4.760 7.917 3.433 346 HG2 LYS 518 HG2 LYS 518 -3.033 10.146 4.467 347 HG3 LYS 518 HG1 LYS 518 -4.691 9.887 5.007 348 HD2 LYS 518 HD2 LYS 518 -2.556 7.766 5.132 349 HD3 LYS 518 HD1 LYS 518 -2.905 8.871 6.461 350 HE2 LYS 518 HE2 LYS 518 -4.794 6.879 5.216 351 HE3 LYS 518 HE1 LYS 518 -4.072 6.792 6.820 352 HZ1 LYS 518 HZ1 LYS 518 -5.255 8.918 7.318 353 HZ2 LYS 518 HZ2 LYS 518 -6.267 7.587 7.077 354 HZ3 LYS 518 HZ3 LYS 518 -6.090 8.742 5.856 355 H LEU 519 HN LEU 519 -2.342 6.081 1.639 356 HA LEU 519 HA LEU 519 -3.891 6.321 -0.855 357 HB2 LEU 519 HB2 LEU 519 -1.574 5.847 -1.293 358 HB3 LEU 519 HB1 LEU 519 -1.563 4.554 -0.110 359 HG LEU 519 HG LEU 519 -3.166 3.294 -1.555 360 HD11 LEU 519 HD11 LEU 519 -4.121 5.156 -2.779 361 HD12 LEU 519 HD12 LEU 519 -3.401 3.993 -3.891 362 HD13 LEU 519 HD13 LEU 519 -2.557 5.496 -3.520 363 HD21 LEU 519 HD21 LEU 519 -0.797 2.793 -1.597 364 HD22 LEU 519 HD22 LEU 519 -0.534 4.051 -2.806 365 HD23 LEU 519 HD23 LEU 519 -1.494 2.628 -3.209 366 H TYR 520 HN TYR 520 -5.467 4.823 -1.312 367 HA TYR 520 HA TYR 520 -5.906 2.699 0.672 368 HB2 TYR 520 HB2 TYR 520 -8.096 4.292 -0.673 369 HB3 TYR 520 HB1 TYR 520 -8.301 3.050 0.554 370 HD1 TYR 520 HD1 TYR 520 -7.953 6.531 -0.037 371 HD2 TYR 520 HD2 TYR 520 -7.182 3.504 2.850 372 HE1 TYR 520 HE1 TYR 520 -7.790 8.248 1.715 373 HE2 TYR 520 HE2 TYR 520 -7.021 5.215 4.607 374 HH TYR 520 HH TYR 520 -7.989 8.448 4.130 375 H VAL 521 HN VAL 521 -5.860 0.770 -0.217 376 HA VAL 521 HA VAL 521 -6.488 0.520 -3.089 377 HB VAL 521 HB VAL 521 -4.453 -1.053 -1.485 378 HG11 VAL 521 HG11 VAL 521 -5.543 -2.477 -3.122 379 HG12 VAL 521 HG12 VAL 521 -3.887 -2.129 -3.619 380 HG13 VAL 521 HG13 VAL 521 -5.236 -1.291 -4.390 381 HG21 VAL 521 HG21 VAL 521 -2.811 -0.022 -2.990 382 HG22 VAL 521 HG22 VAL 521 -3.683 1.187 -2.048 383 HG23 VAL 521 HG23 VAL 521 -4.097 0.922 -3.741 384 HA PRO 522 HA PRO 522 -9.674 -2.254 -1.618 385 HB2 PRO 522 HB2 PRO 522 -10.271 -3.337 -4.066 386 HB3 PRO 522 HB1 PRO 522 -10.902 -1.792 -3.493 387 HG2 PRO 522 HG2 PRO 522 -8.645 -2.344 -5.361 388 HG3 PRO 522 HG1 PRO 522 -9.864 -1.060 -5.420 389 HD2 PRO 522 HD2 PRO 522 -7.330 -0.644 -4.557 390 HD3 PRO 522 HD1 PRO 522 -8.714 0.268 -3.932 391 H VAL 523 HN VAL 523 -9.744 -4.384 -1.052 392 HA VAL 523 HA VAL 523 -7.300 -5.805 -1.122 393 HB VAL 523 HB VAL 523 -8.574 -7.675 -0.066 394 HG11 VAL 523 HG11 VAL 523 -9.028 -6.458 2.019 395 HG12 VAL 523 HG12 VAL 523 -8.930 -4.934 1.137 396 HG13 VAL 523 HG13 VAL 523 -7.505 -5.964 1.280 397 HG21 VAL 523 HG21 VAL 523 -10.738 -7.306 -1.128 398 HG22 VAL 523 HG22 VAL 523 -10.896 -5.761 -0.293 399 HG23 VAL 523 HG23 VAL 523 -10.889 -7.264 0.628 400 H SER 524 HN SER 524 -9.781 -5.607 -3.397 401 HA SER 524 HA SER 524 -9.302 -8.219 -4.549 402 HB2 SER 524 HB2 SER 524 -10.827 -7.276 -6.373 403 HB3 SER 524 HB1 SER 524 -11.533 -7.449 -4.766 404 HG SER 524 HG SER 524 -11.799 -5.371 -4.688 405 H SER 525 HN SER 525 -7.684 -5.305 -4.564 406 HA SER 525 HA SER 525 -6.528 -5.848 -7.222 407 HB2 SER 525 HB2 SER 525 -6.635 -3.205 -5.750 408 HB3 SER 525 HB1 SER 525 -5.990 -3.471 -7.370 409 HG SER 525 HG SER 525 -8.391 -4.459 -7.452 410 H LEU 526 HN LEU 526 -5.824 -6.840 -4.431 411 HA LEU 526 HA LEU 526 -3.322 -5.663 -3.733 412 HB2 LEU 526 HB2 LEU 526 -4.481 -8.362 -3.040 413 HB3 LEU 526 HB1 LEU 526 -3.031 -7.689 -2.326 414 HG LEU 526 HG LEU 526 -5.826 -6.593 -2.058 415 HD11 LEU 526 HD11 LEU 526 -5.550 -7.172 0.304 416 HD12 LEU 526 HD12 LEU 526 -3.975 -7.878 -0.056 417 HD13 LEU 526 HD13 LEU 526 -5.437 -8.594 -0.734 418 HD21 LEU 526 HD21 LEU 526 -4.252 -4.764 -2.139 419 HD22 LEU 526 HD22 LEU 526 -3.210 -5.568 -0.967 420 HD23 LEU 526 HD23 LEU 526 -4.804 -4.990 -0.480 421 H HIS 527 HN HIS 527 -4.308 -7.928 -6.086 422 HA HIS 527 HA HIS 527 -1.896 -9.339 -6.482 423 HB2 HIS 527 HB2 HIS 527 -4.101 -10.030 -7.388 424 HB3 HIS 527 HB1 HIS 527 -4.060 -8.660 -8.488 425 HD1 HIS 527 HD1 HIS 527 -4.001 -9.952 -10.648 426 HD2 HIS 527 HD2 HIS 527 -0.999 -11.089 -8.005 427 HE1 HIS 527 HE1 HIS 527 -2.494 -11.484 -11.954 428 HE2 HIS 527 HE2 HIS 527 -0.749 -12.246 -10.306 429 H LEU 528 HN LEU 528 -2.823 -6.124 -7.172 430 HA LEU 528 HA LEU 528 -0.847 -5.758 -9.275 431 HB2 LEU 528 HB2 LEU 528 -2.678 -3.736 -7.993 432 HB3 LEU 528 HB1 LEU 528 -1.752 -3.524 -9.462 433 HG LEU 528 HG LEU 528 -4.052 -5.443 -9.105 434 HD11 LEU 528 HD11 LEU 528 -5.238 -3.949 -10.617 435 HD12 LEU 528 HD12 LEU 528 -3.845 -2.869 -10.660 436 HD13 LEU 528 HD13 LEU 528 -4.737 -3.096 -9.157 437 HD21 LEU 528 HD21 LEU 528 -2.421 -6.322 -10.665 438 HD22 LEU 528 HD22 LEU 528 -2.374 -4.782 -11.521 439 HD23 LEU 528 HD23 LEU 528 -3.844 -5.755 -11.539 440 H ILE 529 HN ILE 529 -0.890 -5.729 -5.946 441 HA ILE 529 HA ILE 529 1.119 -3.632 -5.660 442 HB ILE 529 HB ILE 529 -0.019 -5.463 -3.549 443 HG12 ILE 529 HG12 ILE 529 -1.729 -4.059 -4.768 444 HG13 ILE 529 HG11 ILE 529 -1.641 -3.809 -3.031 445 HG21 ILE 529 HG21 ILE 529 1.443 -2.833 -3.340 446 HG22 ILE 529 HG22 ILE 529 2.071 -4.420 -2.895 447 HG23 ILE 529 HG23 ILE 529 0.734 -3.714 -1.988 448 HD11 ILE 529 HD11 ILE 529 -0.339 -1.767 -3.399 449 HD12 ILE 529 HD12 ILE 529 -1.890 -1.700 -4.236 450 HD13 ILE 529 HD13 ILE 529 -0.413 -2.033 -5.141 451 H SER 530 HN SER 530 3.228 -4.044 -4.976 452 HA SER 530 HA SER 530 4.094 -6.842 -4.786 453 HB2 SER 530 HB2 SER 530 5.094 -4.755 -6.699 454 HB3 SER 530 HB1 SER 530 6.177 -6.020 -6.137 455 HG SER 530 HG SER 530 3.705 -6.353 -7.497 456 H ARG 531 HN ARG 531 5.478 -7.231 -3.268 457 HA ARG 531 HA ARG 531 6.231 -5.216 -1.419 458 HB2 ARG 531 HB2 ARG 531 5.835 -7.548 -0.765 459 HB3 ARG 531 HB1 ARG 531 7.202 -8.060 -1.746 460 HG2 ARG 531 HG2 ARG 531 8.676 -6.702 -0.344 461 HG3 ARG 531 HG1 ARG 531 7.293 -6.294 0.669 462 HD2 ARG 531 HD2 ARG 531 6.972 -8.646 1.207 463 HD3 ARG 531 HD1 ARG 531 8.321 -9.081 0.160 464 HE ARG 531 HE ARG 531 9.347 -7.293 1.986 465 HH11 ARG 531 HH11 ARG 531 7.773 -10.417 2.099 466 HH12 ARG 531 HH12 ARG 531 8.574 -10.909 3.558 467 HH21 ARG 531 HH21 ARG 531 10.412 -7.926 3.894 468 HH22 ARG 531 HH22 ARG 531 10.077 -9.493 4.579 469 H TYR 532 HN TYR 532 8.156 -4.168 -1.177 470 HA TYR 532 HA TYR 532 9.813 -3.845 -3.441 471 HB2 TYR 532 HB2 TYR 532 9.326 -2.215 -1.487 472 HB3 TYR 532 HB1 TYR 532 10.609 -3.074 -0.643 473 HD1 TYR 532 HD1 TYR 532 9.794 -0.692 -3.235 474 HD2 TYR 532 HD2 TYR 532 12.927 -2.982 -1.505 475 HE1 TYR 532 HE1 TYR 532 11.452 0.743 -4.355 476 HE2 TYR 532 HE2 TYR 532 14.595 -1.557 -2.618 477 HH TYR 532 HH TYR 532 14.632 -0.085 -4.729 478 H ALA 533 HN ALA 533 10.974 -5.553 -4.127 479 HA ALA 533 HA ALA 533 12.352 -7.215 -2.142 480 HB1 ALA 533 HB1 ALA 533 10.829 -8.369 -3.668 481 HB2 ALA 533 HB2 ALA 533 12.496 -8.902 -3.886 482 HB3 ALA 533 HB3 ALA 533 11.769 -7.787 -5.041 483 H GLY 534 HN GLY 534 14.458 -8.196 -2.994 484 HA2 GLY 534 HA2 GLY 534 16.390 -7.851 -4.444 485 HA3 GLY 534 HA1 GLY 534 16.036 -6.131 -4.397 486 H GLY 535 HN GLY 535 15.427 -7.197 -1.383 487 HA2 GLY 535 HA2 GLY 535 16.627 -7.289 0.594 488 HA3 GLY 535 HA1 GLY 535 18.111 -7.322 -0.349 489 H ALA 536 HN ALA 536 15.508 -4.926 -0.412 490 HA ALA 536 HA ALA 536 17.298 -2.943 0.770 491 HB1 ALA 536 HB1 ALA 536 17.808 -2.818 -1.586 492 HB2 ALA 536 HB2 ALA 536 16.924 -1.373 -1.091 493 HB3 ALA 536 HB3 ALA 536 16.097 -2.656 -1.976 494 H GLU 537 HN GLU 537 15.014 -4.063 1.885 495 HA GLU 537 HA GLU 537 12.677 -2.508 1.448 496 HB2 GLU 537 HB2 GLU 537 13.512 -4.175 3.832 497 HB3 GLU 537 HB1 GLU 537 11.901 -3.515 3.580 498 HG2 GLU 537 HG2 GLU 537 11.561 -4.872 1.657 499 HG3 GLU 537 HG1 GLU 537 13.246 -5.383 1.658 500 H GLU 538 HN GLU 538 15.514 -2.124 3.403 501 HA GLU 538 HA GLU 538 14.436 -0.136 5.154 502 HB2 GLU 538 HB2 GLU 538 16.482 -1.703 5.480 503 HB3 GLU 538 HB1 GLU 538 17.361 -0.499 4.555 504 HG2 GLU 538 HG2 GLU 538 15.823 0.214 7.026 505 HG3 GLU 538 HG1 GLU 538 17.484 -0.371 7.089 506 H ASN 539 HN ASN 539 16.324 -0.106 2.166 507 HA ASN 539 HA ASN 539 16.467 2.798 2.171 508 HB2 ASN 539 HB2 ASN 539 17.646 0.663 0.410 509 HB3 ASN 539 HB1 ASN 539 17.672 2.357 -0.072 510 HD21 ASN 539 HD21 ASN 539 19.000 3.784 0.991 511 HD22 ASN 539 HD22 ASN 539 20.221 3.277 2.107 512 H ALA 540 HN ALA 540 13.964 1.017 1.614 513 HA ALA 540 HA ALA 540 13.170 1.688 -1.035 514 HB1 ALA 540 HB1 ALA 540 10.953 0.948 -0.357 515 HB2 ALA 540 HB2 ALA 540 11.463 0.933 1.331 516 HB3 ALA 540 HB3 ALA 540 12.187 -0.190 0.180 517 HA PRO 541 HA PRO 541 12.373 5.957 -0.088 518 HB2 PRO 541 HB2 PRO 541 11.857 6.780 -2.576 519 HB3 PRO 541 HB1 PRO 541 13.478 6.265 -2.099 520 HG2 PRO 541 HG2 PRO 541 11.373 4.745 -3.589 521 HG3 PRO 541 HG1 PRO 541 13.111 4.857 -3.917 522 HD2 PRO 541 HD2 PRO 541 11.939 2.760 -2.599 523 HD3 PRO 541 HD1 PRO 541 13.629 3.248 -2.372 524 H LEU 542 HN LEU 542 10.686 7.599 -0.491 525 HA LEU 542 HA LEU 542 8.013 6.385 -0.565 526 HB2 LEU 542 HB2 LEU 542 9.190 8.693 0.912 527 HB3 LEU 542 HB1 LEU 542 7.500 8.771 0.476 528 HG LEU 542 HG LEU 542 7.815 7.982 2.770 529 HD11 LEU 542 HD11 LEU 542 6.450 5.944 2.617 530 HD12 LEU 542 HD12 LEU 542 6.732 5.917 0.876 531 HD13 LEU 542 HD13 LEU 542 5.862 7.262 1.610 532 HD21 LEU 542 HD21 LEU 542 8.774 5.788 3.214 533 HD22 LEU 542 HD22 LEU 542 9.972 6.879 2.516 534 HD23 LEU 542 HD23 LEU 542 9.221 5.636 1.516 535 H HIS 543 HN HIS 543 6.679 6.900 -2.185 536 HA HIS 543 HA HIS 543 7.478 8.958 -4.074 537 HB2 HIS 543 HB2 HIS 543 5.559 6.693 -4.100 538 HB3 HIS 543 HB1 HIS 543 5.153 8.088 -5.096 539 HD1 HIS 543 HD1 HIS 543 5.607 7.074 -7.361 540 HD2 HIS 543 HD2 HIS 543 8.817 6.701 -4.743 541 HE1 HIS 543 HE1 HIS 543 7.527 6.254 -8.757 542 HE2 HIS 543 HE2 HIS 543 9.400 5.867 -7.120 543 H LYS 544 HN LYS 544 5.813 10.478 -4.885 544 HA LYS 544 HA LYS 544 4.449 11.670 -2.579 545 HB2 LYS 544 HB2 LYS 544 5.443 12.877 -5.168 546 HB3 LYS 544 HB1 LYS 544 4.449 13.754 -4.018 547 HG2 LYS 544 HG2 LYS 544 6.703 14.397 -3.654 548 HG3 LYS 544 HG1 LYS 544 6.230 13.368 -2.305 549 HD2 LYS 544 HD2 LYS 544 7.364 11.468 -3.369 550 HD3 LYS 544 HD1 LYS 544 7.849 12.516 -4.705 551 HE2 LYS 544 HE2 LYS 544 9.185 13.864 -3.230 552 HE3 LYS 544 HE1 LYS 544 8.596 12.982 -1.822 553 HZ1 LYS 544 HZ1 LYS 544 10.795 12.243 -2.467 554 HZ2 LYS 544 HZ2 LYS 544 10.245 11.839 -4.013 555 HZ3 LYS 544 HZ3 LYS 544 9.677 10.990 -2.663 556 H LEU 545 HN LEU 545 2.297 11.678 -2.509 557 HA LEU 545 HA LEU 545 0.824 10.778 -4.856 558 HB2 LEU 545 HB2 LEU 545 -0.061 11.263 -2.011 559 HB3 LEU 545 HB1 LEU 545 -1.127 10.727 -3.293 560 HG LEU 545 HG LEU 545 1.221 9.206 -2.166 561 HD11 LEU 545 HD11 LEU 545 -0.479 7.628 -1.419 562 HD12 LEU 545 HD12 LEU 545 -1.743 8.673 -2.068 563 HD13 LEU 545 HD13 LEU 545 -0.746 9.226 -0.723 564 HD21 LEU 545 HD21 LEU 545 -0.660 8.510 -4.413 565 HD22 LEU 545 HD22 LEU 545 0.456 7.382 -3.647 566 HD23 LEU 545 HD23 LEU 545 1.079 8.774 -4.530 567 H GLY 546 HN GLY 546 1.641 12.991 -5.704 568 HA2 GLY 546 HA2 GLY 546 -0.567 14.907 -5.282 569 HA3 GLY 546 HA1 GLY 546 1.097 15.441 -5.473 570 H GLY 547 HN GLY 547 -0.695 12.929 -7.212 571 HA2 GLY 547 HA2 GLY 547 -0.288 14.501 -9.678 572 HA3 GLY 547 HA1 GLY 547 0.017 12.771 -9.617 Start of MODEL 6 1 H1 ARG 472 HT1 ARG 472 2.988 -12.993 -4.403 2 H2 ARG 472 HT2 ARG 472 3.996 -12.953 -3.047 3 H3 ARG 472 HT3 ARG 472 4.609 -12.541 -4.566 4 HA ARG 472 HA ARG 472 4.256 -10.561 -3.284 5 HB2 ARG 472 HB2 ARG 472 3.080 -9.308 -4.886 6 HB3 ARG 472 HB1 ARG 472 3.701 -10.677 -5.798 7 HG2 ARG 472 HG2 ARG 472 1.587 -11.721 -5.866 8 HG3 ARG 472 HG1 ARG 472 0.933 -10.648 -4.630 9 HD2 ARG 472 HD2 ARG 472 0.063 -9.955 -6.737 10 HD3 ARG 472 HD1 ARG 472 1.243 -8.753 -6.218 11 HE ARG 472 HE ARG 472 2.264 -10.829 -7.965 12 HH11 ARG 472 HH11 ARG 472 0.978 -7.580 -7.704 13 HH12 ARG 472 HH12 ARG 472 1.526 -7.110 -9.286 14 HH21 ARG 472 HH21 ARG 472 2.995 -10.203 -10.025 15 HH22 ARG 472 HH22 ARG 472 2.676 -8.594 -10.598 16 H ASN 473 HN ASN 473 2.102 -12.960 -2.596 17 HA ASN 473 HA ASN 473 -0.381 -11.849 -2.272 18 HB2 ASN 473 HB2 ASN 473 1.005 -13.971 -0.640 19 HB3 ASN 473 HB1 ASN 473 -0.694 -13.558 -0.424 20 HD21 ASN 473 HD21 ASN 473 -1.325 -15.634 -1.042 21 HD22 ASN 473 HD22 ASN 473 -1.279 -16.143 -2.696 22 H LEU 474 HN LEU 474 -1.076 -10.164 -1.225 23 HA LEU 474 HA LEU 474 0.602 -8.883 0.732 24 HB2 LEU 474 HB2 LEU 474 -2.012 -8.101 -0.538 25 HB3 LEU 474 HB1 LEU 474 -1.219 -7.125 0.677 26 HG LEU 474 HG LEU 474 -0.588 -6.098 -1.294 27 HD11 LEU 474 HD11 LEU 474 1.755 -6.495 -1.636 28 HD12 LEU 474 HD12 LEU 474 1.633 -8.085 -0.885 29 HD13 LEU 474 HD13 LEU 474 1.378 -6.633 0.080 30 HD21 LEU 474 HD21 LEU 474 0.205 -7.341 -3.293 31 HD22 LEU 474 HD22 LEU 474 -1.486 -7.599 -2.884 32 HD23 LEU 474 HD23 LEU 474 -0.289 -8.833 -2.494 33 H ALA 475 HN ALA 475 -1.339 -11.372 1.109 34 HA ALA 475 HA ALA 475 -2.971 -10.624 3.313 35 HB1 ALA 475 HB1 ALA 475 -3.422 -12.607 1.949 36 HB2 ALA 475 HB2 ALA 475 -3.264 -13.017 3.654 37 HB3 ALA 475 HB3 ALA 475 -1.938 -13.350 2.542 38 H GLU 476 HN GLU 476 0.364 -11.103 2.984 39 HA GLU 476 HA GLU 476 0.676 -11.425 5.891 40 HB2 GLU 476 HB2 GLU 476 2.471 -12.169 3.600 41 HB3 GLU 476 HB1 GLU 476 3.095 -11.997 5.236 42 HG2 GLU 476 HG2 GLU 476 0.883 -13.852 4.405 43 HG3 GLU 476 HG1 GLU 476 2.565 -14.319 4.670 44 H LEU 477 HN LEU 477 0.091 -8.964 4.384 45 HA LEU 477 HA LEU 477 2.442 -7.364 4.388 46 HB2 LEU 477 HB2 LEU 477 -0.476 -6.800 4.190 47 HB3 LEU 477 HB1 LEU 477 0.615 -5.475 4.554 48 HG LEU 477 HG LEU 477 0.793 -7.253 2.121 49 HD11 LEU 477 HD11 LEU 477 -1.172 -5.730 2.162 50 HD12 LEU 477 HD12 LEU 477 -0.027 -5.384 0.865 51 HD13 LEU 477 HD13 LEU 477 -0.059 -4.370 2.311 52 HD21 LEU 477 HD21 LEU 477 2.428 -5.575 1.352 53 HD22 LEU 477 HD22 LEU 477 2.971 -6.437 2.788 54 HD23 LEU 477 HD23 LEU 477 2.342 -4.795 2.930 55 H HIS 478 HN HIS 478 3.559 -6.950 6.105 56 HA HIS 478 HA HIS 478 2.244 -6.633 8.693 57 HB2 HIS 478 HB2 HIS 478 5.176 -6.797 7.957 58 HB3 HIS 478 HB1 HIS 478 4.558 -6.662 9.599 59 HD1 HIS 478 HD1 HIS 478 5.834 -9.112 7.435 60 HD2 HIS 478 HD2 HIS 478 2.561 -8.980 9.995 61 HE1 HIS 478 HE1 HIS 478 5.219 -11.512 7.872 62 HE2 HIS 478 HE2 HIS 478 3.298 -11.408 9.498 63 H ILE 479 HN ILE 479 3.027 -4.821 10.080 64 HA ILE 479 HA ILE 479 2.566 -2.364 8.716 65 HB ILE 479 HB ILE 479 3.604 -2.745 11.533 66 HG12 ILE 479 HG12 ILE 479 1.532 -3.992 11.257 67 HG13 ILE 479 HG11 ILE 479 1.238 -2.558 12.234 68 HG21 ILE 479 HG21 ILE 479 3.860 -0.478 10.663 69 HG22 ILE 479 HG22 ILE 479 2.657 -0.541 11.955 70 HG23 ILE 479 HG23 ILE 479 2.140 -0.432 10.273 71 HD11 ILE 479 HD11 ILE 479 0.568 -2.900 9.320 72 HD12 ILE 479 HD12 ILE 479 0.307 -1.434 10.266 73 HD13 ILE 479 HD13 ILE 479 -0.565 -2.913 10.670 74 H GLY 480 HN GLY 480 3.960 -0.887 7.943 75 HA2 GLY 480 HA2 GLY 480 5.954 0.269 7.665 76 HA3 GLY 480 HA1 GLY 480 6.697 -0.788 8.857 77 H GLN 481 HN GLN 481 4.955 -2.186 6.249 78 HA GLN 481 HA GLN 481 7.418 -3.275 5.149 79 HB2 GLN 481 HB2 GLN 481 5.468 -4.751 5.634 80 HB3 GLN 481 HB1 GLN 481 4.539 -3.870 4.431 81 HG2 GLN 481 HG2 GLN 481 5.305 -5.916 3.471 82 HG3 GLN 481 HG1 GLN 481 6.162 -4.578 2.712 83 HE21 GLN 481 HE21 GLN 481 6.951 -5.716 5.916 84 HE22 GLN 481 HE22 GLN 481 8.474 -6.420 5.499 85 HA PRO 482 HA PRO 482 7.182 -0.272 1.830 86 HB2 PRO 482 HB2 PRO 482 9.362 -1.094 0.479 87 HB3 PRO 482 HB1 PRO 482 9.482 -0.171 1.981 88 HG2 PRO 482 HG2 PRO 482 9.777 -3.114 1.538 89 HG3 PRO 482 HG1 PRO 482 10.732 -2.034 2.569 90 HD2 PRO 482 HD2 PRO 482 8.743 -3.659 3.507 91 HD3 PRO 482 HD1 PRO 482 9.220 -2.140 4.287 92 H VAL 483 HN VAL 483 5.806 -0.468 0.195 93 HA VAL 483 HA VAL 483 5.878 -2.909 -1.444 94 HB VAL 483 HB VAL 483 3.380 -2.766 -1.638 95 HG11 VAL 483 HG11 VAL 483 4.519 -3.296 1.101 96 HG12 VAL 483 HG12 VAL 483 4.391 -4.448 -0.230 97 HG13 VAL 483 HG13 VAL 483 2.933 -3.826 0.542 98 HG21 VAL 483 HG21 VAL 483 3.066 -0.473 -0.907 99 HG22 VAL 483 HG22 VAL 483 3.682 -0.878 0.697 100 HG23 VAL 483 HG23 VAL 483 2.161 -1.573 0.133 101 H VAL 484 HN VAL 484 4.791 -2.604 -3.562 102 HA VAL 484 HA VAL 484 5.090 0.181 -4.456 103 HB VAL 484 HB VAL 484 5.769 -0.635 -6.656 104 HG11 VAL 484 HG11 VAL 484 7.990 -1.453 -6.051 105 HG12 VAL 484 HG12 VAL 484 7.416 -1.774 -4.414 106 HG13 VAL 484 HG13 VAL 484 7.481 -0.117 -5.016 107 HG21 VAL 484 HG21 VAL 484 5.722 -3.372 -5.426 108 HG22 VAL 484 HG22 VAL 484 6.318 -2.961 -7.035 109 HG23 VAL 484 HG23 VAL 484 4.609 -2.762 -6.649 110 H HIS 485 HN HIS 485 3.558 1.075 -5.560 111 HA HIS 485 HA HIS 485 1.098 -0.455 -6.092 112 HB2 HIS 485 HB2 HIS 485 1.026 1.458 -4.451 113 HB3 HIS 485 HB1 HIS 485 1.456 2.535 -5.769 114 HD1 HIS 485 HD1 HIS 485 -0.760 3.834 -5.478 115 HD2 HIS 485 HD2 HIS 485 -1.252 -0.180 -6.445 116 HE1 HIS 485 HE1 HIS 485 -3.173 3.581 -6.118 117 HE2 HIS 485 HE2 HIS 485 -3.404 1.192 -6.873 118 H LEU 486 HN LEU 486 0.672 -0.850 -8.166 119 HA LEU 486 HA LEU 486 2.395 -0.148 -10.218 120 HB2 LEU 486 HB2 LEU 486 0.939 -1.263 -11.700 121 HB3 LEU 486 HB1 LEU 486 0.833 -2.093 -10.168 122 HG LEU 486 HG LEU 486 -1.341 -2.104 -10.978 123 HD11 LEU 486 HD11 LEU 486 -1.213 0.273 -9.146 124 HD12 LEU 486 HD12 LEU 486 -1.330 -1.420 -8.671 125 HD13 LEU 486 HD13 LEU 486 -2.663 -0.651 -9.532 126 HD21 LEU 486 HD21 LEU 486 -1.049 0.795 -11.726 127 HD22 LEU 486 HD22 LEU 486 -2.519 -0.164 -11.893 128 HD23 LEU 486 HD23 LEU 486 -1.084 -0.582 -12.828 129 H GLU 487 HN GLU 487 -0.123 1.717 -8.887 130 HA GLU 487 HA GLU 487 -0.487 3.354 -11.231 131 HB2 GLU 487 HB2 GLU 487 -1.601 3.526 -8.434 132 HB3 GLU 487 HB1 GLU 487 -1.990 4.681 -9.707 133 HG2 GLU 487 HG2 GLU 487 -2.911 2.880 -11.068 134 HG3 GLU 487 HG1 GLU 487 -2.505 1.718 -9.812 135 H HIS 488 HN HIS 488 1.053 3.736 -8.020 136 HA HIS 488 HA HIS 488 2.217 6.231 -9.085 137 HB2 HIS 488 HB2 HIS 488 0.858 5.757 -6.551 138 HB3 HIS 488 HB1 HIS 488 2.405 6.581 -6.378 139 HD1 HIS 488 HD1 HIS 488 2.391 9.033 -6.790 140 HD2 HIS 488 HD2 HIS 488 -0.908 7.143 -8.472 141 HE1 HIS 488 HE1 HIS 488 0.938 10.878 -7.687 142 HE2 HIS 488 HE2 HIS 488 -1.115 9.718 -8.572 143 H GLY 489 HN GLY 489 2.896 3.413 -7.045 144 HA2 GLY 489 HA2 GLY 489 5.191 2.543 -7.648 145 HA3 GLY 489 HA1 GLY 489 5.740 4.160 -7.243 146 H VAL 490 HN VAL 490 7.116 3.410 -5.673 147 HA VAL 490 HA VAL 490 6.408 1.563 -3.660 148 HB VAL 490 HB VAL 490 8.712 1.904 -4.382 149 HG11 VAL 490 HG11 VAL 490 8.724 4.257 -4.818 150 HG12 VAL 490 HG12 VAL 490 9.956 3.904 -3.609 151 HG13 VAL 490 HG13 VAL 490 8.425 4.621 -3.120 152 HG21 VAL 490 HG21 VAL 490 9.803 1.997 -2.174 153 HG22 VAL 490 HG22 VAL 490 8.386 0.945 -2.185 154 HG23 VAL 490 HG23 VAL 490 8.285 2.553 -1.467 155 H GLY 491 HN GLY 491 5.723 1.783 -1.619 156 HA2 GLY 491 HA2 GLY 491 5.576 4.409 -0.357 157 HA3 GLY 491 HA1 GLY 491 4.042 3.596 -0.648 158 H ARG 492 HN ARG 492 4.460 4.118 1.892 159 HA ARG 492 HA ARG 492 5.662 1.716 3.097 160 HB2 ARG 492 HB2 ARG 492 4.967 4.394 4.309 161 HB3 ARG 492 HB1 ARG 492 5.607 3.023 5.207 162 HG2 ARG 492 HG2 ARG 492 7.014 4.323 2.895 163 HG3 ARG 492 HG1 ARG 492 7.308 4.724 4.590 164 HD2 ARG 492 HD2 ARG 492 7.594 1.961 3.418 165 HD3 ARG 492 HD1 ARG 492 8.927 3.089 3.622 166 HE ARG 492 HE ARG 492 7.535 2.717 6.069 167 HH11 ARG 492 HH11 ARG 492 9.827 1.154 3.923 168 HH12 ARG 492 HH12 ARG 492 10.559 0.213 5.181 169 HH21 ARG 492 HH21 ARG 492 8.526 1.510 7.732 170 HH22 ARG 492 HH22 ARG 492 9.828 0.425 7.351 171 H TYR 493 HN TYR 493 4.359 0.175 3.765 172 HA TYR 493 HA TYR 493 1.528 0.468 3.639 173 HB2 TYR 493 HB2 TYR 493 2.701 -1.665 3.160 174 HB3 TYR 493 HB1 TYR 493 3.144 -1.778 4.856 175 HD1 TYR 493 HD1 TYR 493 1.743 -2.872 6.352 176 HD2 TYR 493 HD2 TYR 493 0.164 -1.553 2.621 177 HE1 TYR 493 HE1 TYR 493 -0.358 -4.051 6.832 178 HE2 TYR 493 HE2 TYR 493 -1.940 -2.737 3.093 179 HH TYR 493 HH TYR 493 -2.704 -4.649 4.483 180 H ALA 494 HN ALA 494 0.089 0.977 5.169 181 HA ALA 494 HA ALA 494 0.945 0.788 7.986 182 HB1 ALA 494 HB1 ALA 494 -0.466 3.149 6.754 183 HB2 ALA 494 HB2 ALA 494 1.198 3.119 7.342 184 HB3 ALA 494 HB3 ALA 494 -0.145 2.930 8.472 185 H GLY 495 HN GLY 495 -0.307 -0.994 8.355 186 HA2 GLY 495 HA2 GLY 495 -2.175 -2.181 8.911 187 HA3 GLY 495 HA1 GLY 495 -2.825 -0.623 9.379 188 H MET 496 HN MET 496 -4.867 -1.360 8.827 189 HA MET 496 HA MET 496 -5.498 -1.100 5.992 190 HB2 MET 496 HB2 MET 496 -5.963 -3.524 7.640 191 HB3 MET 496 HB1 MET 496 -7.287 -3.017 6.599 192 HG2 MET 496 HG2 MET 496 -5.826 -3.120 4.663 193 HG3 MET 496 HG1 MET 496 -4.472 -3.576 5.689 194 HE1 MET 496 HE1 MET 496 -4.158 -5.921 6.792 195 HE2 MET 496 HE2 MET 496 -5.419 -7.151 6.862 196 HE3 MET 496 HE3 MET 496 -5.629 -5.625 7.717 197 H THR 497 HN THR 497 -7.611 -0.447 5.579 198 HA THR 497 HA THR 497 -9.177 0.405 7.907 199 HB THR 497 HB THR 497 -7.996 2.391 7.214 200 HG1 THR 497 HG1 THR 497 -9.924 3.613 6.339 201 HG21 THR 497 HG21 THR 497 -9.053 1.849 4.436 202 HG22 THR 497 HG22 THR 497 -7.373 1.695 4.956 203 HG23 THR 497 HG23 THR 497 -8.148 3.278 4.934 204 H THR 498 HN THR 498 -11.386 0.201 7.637 205 HA THR 498 HA THR 498 -12.238 -1.036 5.140 206 HB THR 498 HB THR 498 -14.486 -1.066 6.597 207 HG1 THR 498 HG1 THR 498 -12.554 -1.447 8.622 208 HG21 THR 498 HG21 THR 498 -13.359 -3.009 5.641 209 HG22 THR 498 HG22 THR 498 -13.860 -3.327 7.303 210 HG23 THR 498 HG23 THR 498 -12.170 -2.972 6.944 211 H LEU 499 HN LEU 499 -13.395 -0.005 3.653 212 HA LEU 499 HA LEU 499 -14.242 2.740 4.296 213 HB2 LEU 499 HB2 LEU 499 -13.429 1.589 1.625 214 HB3 LEU 499 HB1 LEU 499 -13.999 3.224 1.886 215 HG LEU 499 HG LEU 499 -11.428 2.037 2.934 216 HD11 LEU 499 HD11 LEU 499 -11.970 4.165 0.872 217 HD12 LEU 499 HD12 LEU 499 -11.358 2.539 0.564 218 HD13 LEU 499 HD13 LEU 499 -10.378 3.695 1.467 219 HD21 LEU 499 HD21 LEU 499 -10.949 4.317 3.734 220 HD22 LEU 499 HD22 LEU 499 -12.319 3.582 4.566 221 HD23 LEU 499 HD23 LEU 499 -12.595 4.791 3.312 222 H GLU 500 HN GLU 500 -16.223 3.431 3.707 223 HA GLU 500 HA GLU 500 -18.093 1.346 2.812 224 HB2 GLU 500 HB2 GLU 500 -18.529 2.183 5.073 225 HB3 GLU 500 HB1 GLU 500 -18.563 3.834 4.474 226 HG2 GLU 500 HG2 GLU 500 -20.537 3.248 3.104 227 HG3 GLU 500 HG1 GLU 500 -20.529 1.647 3.847 228 H ALA 501 HN ALA 501 -18.142 1.622 0.633 229 HA ALA 501 HA ALA 501 -18.391 4.339 -0.440 230 HB1 ALA 501 HB1 ALA 501 -17.658 1.724 -1.742 231 HB2 ALA 501 HB2 ALA 501 -16.571 3.060 -1.359 232 HB3 ALA 501 HB3 ALA 501 -17.811 3.259 -2.597 233 H GLY 502 HN GLY 502 -19.795 4.504 -2.420 234 HA2 GLY 502 HA2 GLY 502 -22.420 3.464 -1.816 235 HA3 GLY 502 HA1 GLY 502 -22.003 4.566 -3.123 236 H GLY 503 HN GLY 503 -21.620 1.199 -2.101 237 HA2 GLY 503 HA2 GLY 503 -22.674 -0.298 -3.929 238 HA3 GLY 503 HA1 GLY 503 -21.417 0.417 -4.925 239 H ILE 504 HN ILE 504 -19.275 0.464 -3.222 240 HA ILE 504 HA ILE 504 -18.823 -2.412 -2.792 241 HB ILE 504 HB ILE 504 -16.660 -0.382 -3.356 242 HG12 ILE 504 HG12 ILE 504 -16.650 -1.697 -5.640 243 HG13 ILE 504 HG11 ILE 504 -18.344 -1.970 -5.259 244 HG21 ILE 504 HG21 ILE 504 -15.933 -2.402 -2.229 245 HG22 ILE 504 HG22 ILE 504 -15.330 -2.380 -3.886 246 HG23 ILE 504 HG23 ILE 504 -16.709 -3.397 -3.463 247 HD11 ILE 504 HD11 ILE 504 -17.009 0.715 -5.506 248 HD12 ILE 504 HD12 ILE 504 -18.713 0.432 -5.153 249 HD13 ILE 504 HD13 ILE 504 -18.045 -0.045 -6.714 250 H THR 505 HN THR 505 -18.928 -2.798 -0.663 251 HA THR 505 HA THR 505 -17.458 -0.960 1.106 252 HB THR 505 HB THR 505 -18.958 -1.678 2.929 253 HG1 THR 505 HG1 THR 505 -19.643 -3.688 2.125 254 HG21 THR 505 HG21 THR 505 -20.964 -0.466 2.207 255 HG22 THR 505 HG22 THR 505 -20.421 -0.574 0.533 256 HG23 THR 505 HG23 THR 505 -19.493 0.364 1.702 257 H GLY 506 HN GLY 506 -15.922 -1.859 2.434 258 HA2 GLY 506 HA2 GLY 506 -15.730 -4.423 3.370 259 HA3 GLY 506 HA1 GLY 506 -15.100 -4.527 1.739 260 H GLU 507 HN GLU 507 -13.119 -5.141 2.527 261 HA GLU 507 HA GLU 507 -11.667 -3.437 4.362 262 HB2 GLU 507 HB2 GLU 507 -10.886 -5.977 2.942 263 HB3 GLU 507 HB1 GLU 507 -9.906 -5.160 4.149 264 HG2 GLU 507 HG2 GLU 507 -11.589 -5.559 5.834 265 HG3 GLU 507 HG1 GLU 507 -12.650 -6.291 4.630 266 H TYR 508 HN TYR 508 -10.021 -2.118 3.888 267 HA TYR 508 HA TYR 508 -8.932 -2.113 1.166 268 HB2 TYR 508 HB2 TYR 508 -9.969 0.284 2.690 269 HB3 TYR 508 HB1 TYR 508 -8.919 0.411 1.283 270 HD1 TYR 508 HD1 TYR 508 -9.832 0.410 -0.871 271 HD2 TYR 508 HD2 TYR 508 -12.205 -0.929 2.389 272 HE1 TYR 508 HE1 TYR 508 -11.796 0.315 -2.345 273 HE2 TYR 508 HE2 TYR 508 -14.171 -1.040 0.929 274 HH TYR 508 HH TYR 508 -13.987 -0.918 -2.416 275 H LEU 509 HN LEU 509 -6.919 -1.482 0.954 276 HA LEU 509 HA LEU 509 -5.201 -1.828 3.218 277 HB2 LEU 509 HB2 LEU 509 -4.542 -2.915 1.263 278 HB3 LEU 509 HB1 LEU 509 -4.944 -1.550 0.252 279 HG LEU 509 HG LEU 509 -2.635 -1.387 2.150 280 HD11 LEU 509 HD11 LEU 509 -2.661 -2.561 -0.627 281 HD12 LEU 509 HD12 LEU 509 -2.368 -3.450 0.867 282 HD13 LEU 509 HD13 LEU 509 -1.215 -2.225 0.330 283 HD21 LEU 509 HD21 LEU 509 -3.644 0.578 0.807 284 HD22 LEU 509 HD22 LEU 509 -2.882 -0.197 -0.586 285 HD23 LEU 509 HD23 LEU 509 -1.899 0.331 0.779 286 H MET 510 HN MET 510 -3.974 -0.267 4.197 287 HA MET 510 HA MET 510 -4.396 2.490 3.263 288 HB2 MET 510 HB2 MET 510 -4.935 1.409 5.755 289 HB3 MET 510 HB1 MET 510 -3.382 2.200 5.983 290 HG2 MET 510 HG2 MET 510 -4.348 4.280 5.076 291 HG3 MET 510 HG1 MET 510 -5.907 3.474 4.964 292 HE1 MET 510 HE1 MET 510 -7.157 5.269 6.463 293 HE2 MET 510 HE2 MET 510 -5.646 6.175 6.426 294 HE3 MET 510 HE3 MET 510 -6.475 5.904 7.958 295 H LEU 511 HN LEU 511 -2.687 3.410 2.396 296 HA LEU 511 HA LEU 511 -0.008 2.478 3.198 297 HB2 LEU 511 HB2 LEU 511 -1.264 2.632 0.598 298 HB3 LEU 511 HB1 LEU 511 0.190 3.608 0.644 299 HG LEU 511 HG LEU 511 0.312 0.799 1.651 300 HD11 LEU 511 HD11 LEU 511 -0.834 0.895 -0.634 301 HD12 LEU 511 HD12 LEU 511 0.596 -0.119 -0.469 302 HD13 LEU 511 HD13 LEU 511 0.721 1.461 -1.243 303 HD21 LEU 511 HD21 LEU 511 2.587 0.983 0.821 304 HD22 LEU 511 HD22 LEU 511 2.215 2.307 1.925 305 HD23 LEU 511 HD23 LEU 511 2.237 2.588 0.183 306 H THR 512 HN THR 512 1.661 4.050 3.217 307 HA THR 512 HA THR 512 0.681 6.824 3.197 308 HB THR 512 HB THR 512 2.704 7.204 4.802 309 HG1 THR 512 HG1 THR 512 2.372 4.426 4.831 310 HG21 THR 512 HG21 THR 512 0.123 5.929 5.706 311 HG22 THR 512 HG22 THR 512 0.406 7.646 5.414 312 HG23 THR 512 HG23 THR 512 1.229 6.830 6.743 313 H TYR 513 HN TYR 513 1.636 8.180 1.923 314 HA TYR 513 HA TYR 513 4.246 7.479 0.761 315 HB2 TYR 513 HB2 TYR 513 1.886 8.976 -0.366 316 HB3 TYR 513 HB1 TYR 513 3.497 9.183 -1.039 317 HD1 TYR 513 HD1 TYR 513 1.147 6.413 -0.115 318 HD2 TYR 513 HD2 TYR 513 4.087 7.864 -2.825 319 HE1 TYR 513 HE1 TYR 513 0.810 4.436 -1.536 320 HE2 TYR 513 HE2 TYR 513 3.757 5.891 -4.251 321 HH TYR 513 HH TYR 513 2.934 3.540 -3.979 322 H ALA 514 HN ALA 514 5.049 9.889 -0.199 323 HA ALA 514 HA ALA 514 6.071 11.204 2.032 324 HB1 ALA 514 HB1 ALA 514 6.820 12.921 0.506 325 HB2 ALA 514 HB2 ALA 514 5.696 12.347 -0.725 326 HB3 ALA 514 HB3 ALA 514 7.042 11.327 -0.218 327 H ASN 515 HN ASN 515 5.667 13.243 2.921 328 HA ASN 515 HA ASN 515 4.376 14.778 3.973 329 HB2 ASN 515 HB2 ASN 515 4.033 15.469 1.490 330 HB3 ASN 515 HB1 ASN 515 2.442 14.740 1.663 331 HD21 ASN 515 HD21 ASN 515 3.020 17.471 1.111 332 HD22 ASN 515 HD22 ASN 515 2.379 18.409 2.412 333 H ASP 516 HN ASP 516 3.868 11.880 4.135 334 HA ASP 516 HA ASP 516 2.464 10.409 5.133 335 HB2 ASP 516 HB2 ASP 516 1.417 12.959 6.377 336 HB3 ASP 516 HB1 ASP 516 0.982 11.342 6.919 337 H ALA 517 HN ALA 517 1.746 11.061 2.567 338 HA ALA 517 HA ALA 517 -1.060 11.651 2.418 339 HB1 ALA 517 HB1 ALA 517 -0.839 11.228 0.052 340 HB2 ALA 517 HB2 ALA 517 0.744 10.493 0.299 341 HB3 ALA 517 HB3 ALA 517 0.516 12.215 0.599 342 H LYS 518 HN LYS 518 -2.739 10.250 2.343 343 HA LYS 518 HA LYS 518 -2.075 7.481 2.989 344 HB2 LYS 518 HB2 LYS 518 -4.553 9.131 3.381 345 HB3 LYS 518 HB1 LYS 518 -4.610 7.377 3.478 346 HG2 LYS 518 HG2 LYS 518 -4.379 8.135 5.685 347 HG3 LYS 518 HG1 LYS 518 -2.787 7.541 5.217 348 HD2 LYS 518 HD2 LYS 518 -2.128 9.874 4.696 349 HD3 LYS 518 HD1 LYS 518 -3.691 10.414 5.311 350 HE2 LYS 518 HE2 LYS 518 -1.644 8.872 6.900 351 HE3 LYS 518 HE1 LYS 518 -1.862 10.619 6.968 352 HZ1 LYS 518 HZ1 LYS 518 -4.129 10.253 7.751 353 HZ2 LYS 518 HZ2 LYS 518 -2.998 9.546 8.788 354 HZ3 LYS 518 HZ3 LYS 518 -3.884 8.579 7.721 355 H LEU 519 HN LEU 519 -2.210 5.958 1.577 356 HA LEU 519 HA LEU 519 -3.864 6.322 -0.822 357 HB2 LEU 519 HB2 LEU 519 -1.592 5.808 -1.363 358 HB3 LEU 519 HB1 LEU 519 -1.544 4.504 -0.196 359 HG LEU 519 HG LEU 519 -3.188 3.260 -1.592 360 HD11 LEU 519 HD11 LEU 519 -4.216 5.123 -2.750 361 HD12 LEU 519 HD12 LEU 519 -3.524 3.992 -3.912 362 HD13 LEU 519 HD13 LEU 519 -2.689 5.500 -3.545 363 HD21 LEU 519 HD21 LEU 519 -0.635 4.057 -2.975 364 HD22 LEU 519 HD22 LEU 519 -1.584 2.606 -3.299 365 HD23 LEU 519 HD23 LEU 519 -0.799 2.813 -1.734 366 H TYR 520 HN TYR 520 -5.557 4.986 -1.220 367 HA TYR 520 HA TYR 520 -6.059 2.846 0.740 368 HB2 TYR 520 HB2 TYR 520 -8.101 4.582 -0.649 369 HB3 TYR 520 HB1 TYR 520 -8.451 3.309 0.510 370 HD1 TYR 520 HD1 TYR 520 -8.154 3.656 2.865 371 HD2 TYR 520 HD2 TYR 520 -7.113 6.718 0.104 372 HE1 TYR 520 HE1 TYR 520 -7.994 5.269 4.715 373 HE2 TYR 520 HE2 TYR 520 -6.943 8.337 1.951 374 HH TYR 520 HH TYR 520 -7.796 8.627 4.234 375 H VAL 521 HN VAL 521 -5.918 0.937 -0.179 376 HA VAL 521 HA VAL 521 -6.694 0.666 -3.012 377 HB VAL 521 HB VAL 521 -4.519 -0.845 -1.538 378 HG11 VAL 521 HG11 VAL 521 -5.494 -1.117 -4.383 379 HG12 VAL 521 HG12 VAL 521 -5.669 -2.310 -3.096 380 HG13 VAL 521 HG13 VAL 521 -4.066 -1.907 -3.713 381 HG21 VAL 521 HG21 VAL 521 -3.865 1.419 -2.165 382 HG22 VAL 521 HG22 VAL 521 -4.362 1.117 -3.829 383 HG23 VAL 521 HG23 VAL 521 -3.006 0.226 -3.137 384 HA PRO 522 HA PRO 522 -9.691 -2.204 -1.355 385 HB2 PRO 522 HB2 PRO 522 -10.454 -3.247 -3.772 386 HB3 PRO 522 HB1 PRO 522 -11.065 -1.719 -3.131 387 HG2 PRO 522 HG2 PRO 522 -8.926 -2.210 -5.153 388 HG3 PRO 522 HG1 PRO 522 -10.181 -0.957 -5.128 389 HD2 PRO 522 HD2 PRO 522 -7.612 -0.474 -4.425 390 HD3 PRO 522 HD1 PRO 522 -8.976 0.386 -3.690 391 H VAL 523 HN VAL 523 -9.567 -4.319 -0.767 392 HA VAL 523 HA VAL 523 -7.124 -5.680 -1.163 393 HB VAL 523 HB VAL 523 -8.215 -7.604 -0.006 394 HG11 VAL 523 HG11 VAL 523 -8.475 -6.443 2.142 395 HG12 VAL 523 HG12 VAL 523 -8.533 -4.899 1.291 396 HG13 VAL 523 HG13 VAL 523 -7.063 -5.874 1.250 397 HG21 VAL 523 HG21 VAL 523 -10.494 -7.246 -0.848 398 HG22 VAL 523 HG22 VAL 523 -10.604 -5.767 0.106 399 HG23 VAL 523 HG23 VAL 523 -10.448 -7.327 0.912 400 H SER 524 HN SER 524 -9.872 -5.505 -3.105 401 HA SER 524 HA SER 524 -9.477 -8.061 -4.396 402 HB2 SER 524 HB2 SER 524 -11.735 -7.041 -4.161 403 HB3 SER 524 HB1 SER 524 -11.224 -5.740 -5.230 404 HG SER 524 HG SER 524 -10.632 -7.795 -6.600 405 H SER 525 HN SER 525 -7.899 -5.135 -4.483 406 HA SER 525 HA SER 525 -7.057 -5.544 -7.280 407 HB2 SER 525 HB2 SER 525 -6.919 -3.015 -5.620 408 HB3 SER 525 HB1 SER 525 -6.392 -3.177 -7.295 409 HG SER 525 HG SER 525 -8.420 -2.401 -7.445 410 H LEU 526 HN LEU 526 -6.140 -6.810 -4.731 411 HA LEU 526 HA LEU 526 -3.570 -5.789 -4.088 412 HB2 LEU 526 HB2 LEU 526 -4.896 -8.443 -3.585 413 HB3 LEU 526 HB1 LEU 526 -3.278 -8.080 -3.024 414 HG LEU 526 HG LEU 526 -5.809 -6.651 -2.223 415 HD11 LEU 526 HD11 LEU 526 -5.304 -7.561 -0.001 416 HD12 LEU 526 HD12 LEU 526 -3.944 -8.450 -0.685 417 HD13 LEU 526 HD13 LEU 526 -5.588 -8.831 -1.191 418 HD21 LEU 526 HD21 LEU 526 -4.058 -5.033 -2.304 419 HD22 LEU 526 HD22 LEU 526 -2.930 -6.131 -1.508 420 HD23 LEU 526 HD23 LEU 526 -4.302 -5.473 -0.612 421 H HIS 527 HN HIS 527 -4.748 -7.877 -6.571 422 HA HIS 527 HA HIS 527 -2.276 -9.121 -7.191 423 HB2 HIS 527 HB2 HIS 527 -3.330 -9.723 -9.352 424 HB3 HIS 527 HB1 HIS 527 -4.321 -10.138 -7.965 425 HD1 HIS 527 HD1 HIS 527 -6.662 -9.255 -7.934 426 HD2 HIS 527 HD2 HIS 527 -4.313 -7.433 -10.841 427 HE1 HIS 527 HE1 HIS 527 -8.248 -7.893 -9.330 428 HE2 HIS 527 HE2 HIS 527 -6.835 -6.979 -11.204 429 H LEU 528 HN LEU 528 -3.077 -5.938 -7.379 430 HA LEU 528 HA LEU 528 -1.356 -5.418 -9.694 431 HB2 LEU 528 HB2 LEU 528 -3.063 -3.531 -8.070 432 HB3 LEU 528 HB1 LEU 528 -2.148 -3.105 -9.499 433 HG LEU 528 HG LEU 528 -4.457 -5.049 -9.450 434 HD11 LEU 528 HD11 LEU 528 -5.165 -2.749 -9.012 435 HD12 LEU 528 HD12 LEU 528 -5.702 -3.305 -10.597 436 HD13 LEU 528 HD13 LEU 528 -4.322 -2.214 -10.466 437 HD21 LEU 528 HD21 LEU 528 -4.318 -4.876 -11.893 438 HD22 LEU 528 HD22 LEU 528 -2.851 -5.563 -11.196 439 HD23 LEU 528 HD23 LEU 528 -2.870 -3.883 -11.733 440 H ILE 529 HN ILE 529 -1.380 -5.442 -6.281 441 HA ILE 529 HA ILE 529 0.774 -3.536 -5.953 442 HB ILE 529 HB ILE 529 -0.506 -5.390 -3.934 443 HG12 ILE 529 HG12 ILE 529 -2.072 -3.766 -5.023 444 HG13 ILE 529 HG11 ILE 529 -1.903 -3.557 -3.286 445 HG21 ILE 529 HG21 ILE 529 0.424 -3.877 -2.252 446 HG22 ILE 529 HG22 ILE 529 1.203 -2.937 -3.523 447 HG23 ILE 529 HG23 ILE 529 1.696 -4.606 -3.232 448 HD11 ILE 529 HD11 ILE 529 -0.530 -1.894 -5.392 449 HD12 ILE 529 HD12 ILE 529 -0.417 -1.663 -3.647 450 HD13 ILE 529 HD13 ILE 529 -1.956 -1.420 -4.471 451 H SER 530 HN SER 530 2.860 -4.042 -5.279 452 HA SER 530 HA SER 530 3.608 -6.870 -5.083 453 HB2 SER 530 HB2 SER 530 4.935 -4.767 -6.808 454 HB3 SER 530 HB1 SER 530 5.707 -6.289 -6.393 455 HG SER 530 HG SER 530 3.265 -6.824 -7.289 456 H ARG 531 HN ARG 531 5.703 -7.138 -3.971 457 HA ARG 531 HA ARG 531 5.825 -5.087 -1.881 458 HB2 ARG 531 HB2 ARG 531 5.152 -7.464 -1.311 459 HB3 ARG 531 HB1 ARG 531 6.814 -7.923 -1.667 460 HG2 ARG 531 HG2 ARG 531 7.611 -6.399 0.047 461 HG3 ARG 531 HG1 ARG 531 5.950 -5.919 0.390 462 HD2 ARG 531 HD2 ARG 531 6.767 -7.554 2.018 463 HD3 ARG 531 HD1 ARG 531 5.412 -8.184 1.082 464 HE ARG 531 HE ARG 531 7.014 -9.490 -0.196 465 HH11 ARG 531 HH11 ARG 531 8.221 -8.066 2.771 466 HH12 ARG 531 HH12 ARG 531 9.433 -9.286 3.003 467 HH21 ARG 531 HH21 ARG 531 8.625 -11.075 0.098 468 HH22 ARG 531 HH22 ARG 531 9.669 -10.990 1.485 469 H TYR 532 HN TYR 532 7.684 -4.121 -1.324 470 HA TYR 532 HA TYR 532 9.903 -4.302 -3.153 471 HB2 TYR 532 HB2 TYR 532 8.840 -2.213 -1.950 472 HB3 TYR 532 HB1 TYR 532 9.909 -2.677 -0.635 473 HD1 TYR 532 HD1 TYR 532 9.602 -0.899 -3.666 474 HD2 TYR 532 HD2 TYR 532 12.416 -2.917 -1.209 475 HE1 TYR 532 HE1 TYR 532 11.430 0.330 -4.767 476 HE2 TYR 532 HE2 TYR 532 14.259 -1.696 -2.295 477 HH TYR 532 HH TYR 532 14.713 -0.528 -4.383 478 H ALA 533 HN ALA 533 10.778 -6.361 -2.746 479 HA ALA 533 HA ALA 533 12.099 -6.623 -0.129 480 HB1 ALA 533 HB1 ALA 533 10.154 -8.107 -0.208 481 HB2 ALA 533 HB2 ALA 533 11.664 -9.017 -0.146 482 HB3 ALA 533 HB3 ALA 533 10.790 -8.859 -1.671 483 H GLY 534 HN GLY 534 14.216 -6.910 -0.256 484 HA2 GLY 534 HA2 GLY 534 15.544 -8.711 -1.882 485 HA3 GLY 534 HA1 GLY 534 15.546 -7.195 -2.766 486 H GLY 535 HN GLY 535 15.622 -7.342 0.713 487 HA2 GLY 535 HA2 GLY 535 17.342 -6.968 2.216 488 HA3 GLY 535 HA1 GLY 535 18.487 -7.010 0.880 489 H ALA 536 HN ALA 536 15.718 -4.988 0.616 490 HA ALA 536 HA ALA 536 17.264 -2.613 1.356 491 HB1 ALA 536 HB1 ALA 536 16.754 -1.504 -0.766 492 HB2 ALA 536 HB2 ALA 536 15.999 -2.983 -1.360 493 HB3 ALA 536 HB3 ALA 536 17.729 -2.951 -1.018 494 H GLU 537 HN GLU 537 14.960 -4.030 2.446 495 HA GLU 537 HA GLU 537 12.556 -2.714 1.769 496 HB2 GLU 537 HB2 GLU 537 13.329 -4.213 4.279 497 HB3 GLU 537 HB1 GLU 537 11.701 -3.664 3.919 498 HG2 GLU 537 HG2 GLU 537 11.722 -5.921 3.327 499 HG3 GLU 537 HG1 GLU 537 11.857 -5.056 1.802 500 H GLU 538 HN GLU 538 14.978 -2.131 4.272 501 HA GLU 538 HA GLU 538 13.553 0.097 5.401 502 HB2 GLU 538 HB2 GLU 538 15.069 -1.232 6.780 503 HB3 GLU 538 HB1 GLU 538 16.417 -0.816 5.733 504 HG2 GLU 538 HG2 GLU 538 16.190 1.532 6.378 505 HG3 GLU 538 HG1 GLU 538 14.851 1.105 7.442 506 H ASN 539 HN ASN 539 15.829 -0.433 2.874 507 HA ASN 539 HA ASN 539 16.548 2.383 2.676 508 HB2 ASN 539 HB2 ASN 539 17.530 -0.101 1.279 509 HB3 ASN 539 HB1 ASN 539 18.001 1.515 0.761 510 HD21 ASN 539 HD21 ASN 539 18.267 -0.890 3.257 511 HD22 ASN 539 HD22 ASN 539 19.584 -0.151 4.101 512 H ALA 540 HN ALA 540 13.883 0.984 1.945 513 HA ALA 540 HA ALA 540 13.547 1.427 -0.848 514 HB1 ALA 540 HB1 ALA 540 11.170 1.097 -0.400 515 HB2 ALA 540 HB2 ALA 540 11.473 1.205 1.334 516 HB3 ALA 540 HB3 ALA 540 12.139 -0.136 0.404 517 HA PRO 541 HA PRO 541 13.081 5.849 -0.651 518 HB2 PRO 541 HB2 PRO 541 12.198 6.219 -3.192 519 HB3 PRO 541 HB1 PRO 541 13.888 5.882 -2.804 520 HG2 PRO 541 HG2 PRO 541 11.774 4.036 -3.816 521 HG3 PRO 541 HG1 PRO 541 13.482 4.122 -4.253 522 HD2 PRO 541 HD2 PRO 541 12.459 2.270 -2.534 523 HD3 PRO 541 HD1 PRO 541 14.133 2.853 -2.464 524 H LEU 542 HN LEU 542 11.334 7.493 -1.173 525 HA LEU 542 HA LEU 542 8.682 6.290 -0.735 526 HB2 LEU 542 HB2 LEU 542 9.687 7.237 1.340 527 HB3 LEU 542 HB1 LEU 542 9.730 8.806 0.561 528 HG LEU 542 HG LEU 542 7.267 8.785 0.403 529 HD11 LEU 542 HD11 LEU 542 6.857 6.410 0.308 530 HD12 LEU 542 HD12 LEU 542 6.021 7.090 1.703 531 HD13 LEU 542 HD13 LEU 542 7.523 6.196 1.926 532 HD21 LEU 542 HD21 LEU 542 8.368 8.318 3.171 533 HD22 LEU 542 HD22 LEU 542 6.830 9.095 2.796 534 HD23 LEU 542 HD23 LEU 542 8.343 9.853 2.304 535 H HIS 543 HN HIS 543 7.327 6.784 -2.308 536 HA HIS 543 HA HIS 543 7.763 9.130 -3.979 537 HB2 HIS 543 HB2 HIS 543 5.975 6.726 -4.150 538 HB3 HIS 543 HB1 HIS 543 5.591 8.163 -5.090 539 HD1 HIS 543 HD1 HIS 543 6.040 6.874 -7.308 540 HD2 HIS 543 HD2 HIS 543 9.330 7.163 -4.780 541 HE1 HIS 543 HE1 HIS 543 8.025 6.199 -8.698 542 HE2 HIS 543 HE2 HIS 543 10.018 6.483 -7.177 543 H LYS 544 HN LYS 544 5.772 10.453 -4.544 544 HA LYS 544 HA LYS 544 4.259 11.005 -2.074 545 HB2 LYS 544 HB2 LYS 544 5.939 12.740 -2.689 546 HB3 LYS 544 HB1 LYS 544 5.097 12.973 -4.213 547 HG2 LYS 544 HG2 LYS 544 3.110 13.711 -3.013 548 HG3 LYS 544 HG1 LYS 544 3.940 13.458 -1.476 549 HD2 LYS 544 HD2 LYS 544 5.587 15.141 -2.063 550 HD3 LYS 544 HD1 LYS 544 4.829 15.361 -3.641 551 HE2 LYS 544 HE2 LYS 544 3.532 15.901 -0.973 552 HE3 LYS 544 HE1 LYS 544 4.180 17.123 -2.066 553 HZ1 LYS 544 HZ1 LYS 544 1.926 15.278 -2.650 554 HZ2 LYS 544 HZ2 LYS 544 2.566 16.408 -3.733 555 HZ3 LYS 544 HZ3 LYS 544 1.804 16.932 -2.319 556 H LEU 545 HN LEU 545 2.086 11.684 -2.289 557 HA LEU 545 HA LEU 545 0.816 10.939 -4.825 558 HB2 LEU 545 HB2 LEU 545 -0.406 11.419 -2.101 559 HB3 LEU 545 HB1 LEU 545 -1.289 10.931 -3.534 560 HG LEU 545 HG LEU 545 0.796 9.294 -2.089 561 HD11 LEU 545 HD11 LEU 545 -1.080 7.821 -1.559 562 HD12 LEU 545 HD12 LEU 545 -2.187 8.944 -2.347 563 HD13 LEU 545 HD13 LEU 545 -1.319 9.434 -0.892 564 HD21 LEU 545 HD21 LEU 545 0.140 7.497 -3.641 565 HD22 LEU 545 HD22 LEU 545 0.910 8.854 -4.463 566 HD23 LEU 545 HD23 LEU 545 -0.840 8.656 -4.537 567 H GLY 546 HN GLY 546 -0.655 12.349 -5.838 568 HA2 GLY 546 HA2 GLY 546 0.066 15.139 -5.506 569 HA3 GLY 546 HA1 GLY 546 -0.911 14.457 -6.797 570 H GLY 547 HN GLY 547 -1.036 15.024 -3.291 571 HA2 GLY 547 HA2 GLY 547 -3.324 16.624 -3.360 572 HA3 GLY 547 HA1 GLY 547 -3.841 14.966 -3.080 Start of MODEL 7 1 H1 ARG 472 HT1 ARG 472 5.025 -12.988 -4.016 2 H2 ARG 472 HT2 ARG 472 3.665 -13.785 -4.627 3 H3 ARG 472 HT3 ARG 472 4.040 -13.896 -2.984 4 HA ARG 472 HA ARG 472 3.620 -11.578 -2.671 5 HB2 ARG 472 HB2 ARG 472 4.228 -10.605 -4.732 6 HB3 ARG 472 HB1 ARG 472 3.162 -11.666 -5.643 7 HG2 ARG 472 HG2 ARG 472 1.223 -10.531 -4.772 8 HG3 ARG 472 HG1 ARG 472 2.241 -9.525 -3.742 9 HD2 ARG 472 HD2 ARG 472 1.486 -8.366 -5.775 10 HD3 ARG 472 HD1 ARG 472 3.241 -8.489 -5.662 11 HE ARG 472 HE ARG 472 2.365 -10.661 -7.164 12 HH11 ARG 472 HH11 ARG 472 2.268 -7.175 -7.394 13 HH12 ARG 472 HH12 ARG 472 2.440 -7.154 -9.123 14 HH21 ARG 472 HH21 ARG 472 2.572 -10.640 -9.449 15 HH22 ARG 472 HH22 ARG 472 2.611 -9.123 -10.290 16 H ASN 473 HN ASN 473 1.856 -11.576 -1.464 17 HA ASN 473 HA ASN 473 -0.677 -12.456 -2.637 18 HB2 ASN 473 HB2 ASN 473 0.553 -13.555 -0.126 19 HB3 ASN 473 HB1 ASN 473 -1.194 -13.510 -0.321 20 HD21 ASN 473 HD21 ASN 473 0.719 -15.751 -0.126 21 HD22 ASN 473 HD22 ASN 473 0.415 -16.722 -1.524 22 H LEU 474 HN LEU 474 1.110 -10.418 -0.556 23 HA LEU 474 HA LEU 474 0.625 -8.688 0.820 24 HB2 LEU 474 HB2 LEU 474 -1.808 -8.494 -0.960 25 HB3 LEU 474 HB1 LEU 474 -1.338 -7.272 0.198 26 HG LEU 474 HG LEU 474 -0.535 -6.359 -1.738 27 HD11 LEU 474 HD11 LEU 474 1.717 -8.052 -0.715 28 HD12 LEU 474 HD12 LEU 474 1.374 -6.358 -0.374 29 HD13 LEU 474 HD13 LEU 474 1.917 -6.839 -1.975 30 HD21 LEU 474 HD21 LEU 474 -1.144 -7.976 -3.297 31 HD22 LEU 474 HD22 LEU 474 0.011 -9.146 -2.658 32 HD23 LEU 474 HD23 LEU 474 0.584 -7.720 -3.520 33 H ALA 475 HN ALA 475 -2.183 -7.844 1.468 34 HA ALA 475 HA ALA 475 -3.830 -8.199 2.976 35 HB1 ALA 475 HB1 ALA 475 -4.651 -10.442 3.406 36 HB2 ALA 475 HB2 ALA 475 -3.204 -11.132 2.670 37 HB3 ALA 475 HB3 ALA 475 -4.344 -10.215 1.685 38 H GLU 476 HN GLU 476 -1.455 -10.722 3.791 39 HA GLU 476 HA GLU 476 -1.540 -10.002 6.595 40 HB2 GLU 476 HB2 GLU 476 0.214 -12.003 5.154 41 HB3 GLU 476 HB1 GLU 476 -0.016 -11.885 6.893 42 HG2 GLU 476 HG2 GLU 476 -2.295 -12.567 6.709 43 HG3 GLU 476 HG1 GLU 476 -2.232 -12.475 4.950 44 H LEU 477 HN LEU 477 -0.595 -8.059 4.687 45 HA LEU 477 HA LEU 477 2.197 -7.786 4.632 46 HB2 LEU 477 HB2 LEU 477 -0.119 -5.916 4.314 47 HB3 LEU 477 HB1 LEU 477 1.520 -5.296 4.322 48 HG LEU 477 HG LEU 477 0.843 -7.521 2.446 49 HD11 LEU 477 HD11 LEU 477 -0.957 -5.803 2.227 50 HD12 LEU 477 HD12 LEU 477 0.036 -5.997 0.785 51 HD13 LEU 477 HD13 LEU 477 0.293 -4.616 1.853 52 HD21 LEU 477 HD21 LEU 477 2.561 -6.455 1.121 53 HD22 LEU 477 HD22 LEU 477 3.153 -6.706 2.763 54 HD23 LEU 477 HD23 LEU 477 2.626 -5.101 2.249 55 H HIS 478 HN HIS 478 3.618 -6.768 5.948 56 HA HIS 478 HA HIS 478 2.760 -6.373 8.693 57 HB2 HIS 478 HB2 HIS 478 5.479 -6.456 7.385 58 HB3 HIS 478 HB1 HIS 478 5.247 -6.083 9.090 59 HD1 HIS 478 HD1 HIS 478 4.866 -8.021 10.663 60 HD2 HIS 478 HD2 HIS 478 4.783 -9.141 6.666 61 HE1 HIS 478 HE1 HIS 478 4.865 -10.534 10.669 62 HE2 HIS 478 HE2 HIS 478 4.622 -11.180 8.247 63 H ILE 479 HN ILE 479 3.303 -4.485 9.903 64 HA ILE 479 HA ILE 479 2.560 -2.115 8.507 65 HB ILE 479 HB ILE 479 3.654 -2.314 11.314 66 HG12 ILE 479 HG12 ILE 479 1.784 -3.838 11.146 67 HG13 ILE 479 HG11 ILE 479 1.272 -2.409 12.031 68 HG21 ILE 479 HG21 ILE 479 2.426 -0.248 11.703 69 HG22 ILE 479 HG22 ILE 479 1.868 -0.254 10.030 70 HG23 ILE 479 HG23 ILE 479 3.585 -0.056 10.385 71 HD11 ILE 479 HD11 ILE 479 -0.451 -3.130 10.506 72 HD12 ILE 479 HD12 ILE 479 0.673 -3.024 9.150 73 HD13 ILE 479 HD13 ILE 479 0.184 -1.562 10.008 74 H GLY 480 HN GLY 480 3.800 -0.594 7.602 75 HA2 GLY 480 HA2 GLY 480 5.611 0.875 7.462 76 HA3 GLY 480 HA1 GLY 480 6.483 -0.124 8.614 77 H GLN 481 HN GLN 481 5.112 -2.023 6.227 78 HA GLN 481 HA GLN 481 7.687 -2.571 5.073 79 HB2 GLN 481 HB2 GLN 481 4.953 -3.745 4.792 80 HB3 GLN 481 HB1 GLN 481 6.176 -4.112 3.584 81 HG2 GLN 481 HG2 GLN 481 6.526 -4.556 6.532 82 HG3 GLN 481 HG1 GLN 481 5.992 -5.790 5.393 83 HE21 GLN 481 HE21 GLN 481 8.654 -3.911 6.549 84 HE22 GLN 481 HE22 GLN 481 9.899 -4.767 5.698 85 HA PRO 482 HA PRO 482 7.177 0.078 1.554 86 HB2 PRO 482 HB2 PRO 482 9.306 -0.777 0.144 87 HB3 PRO 482 HB1 PRO 482 9.481 0.213 1.597 88 HG2 PRO 482 HG2 PRO 482 9.828 -2.737 1.260 89 HG3 PRO 482 HG1 PRO 482 10.783 -1.598 2.227 90 HD2 PRO 482 HD2 PRO 482 8.829 -3.251 3.254 91 HD3 PRO 482 HD1 PRO 482 9.349 -1.728 4.002 92 H VAL 483 HN VAL 483 5.669 -0.254 0.072 93 HA VAL 483 HA VAL 483 5.800 -2.667 -1.595 94 HB VAL 483 HB VAL 483 3.295 -2.776 -1.579 95 HG11 VAL 483 HG11 VAL 483 4.595 -4.356 -0.279 96 HG12 VAL 483 HG12 VAL 483 3.126 -3.918 0.590 97 HG13 VAL 483 HG13 VAL 483 4.674 -3.220 1.065 98 HG21 VAL 483 HG21 VAL 483 3.578 -0.911 0.774 99 HG22 VAL 483 HG22 VAL 483 2.095 -1.731 0.285 100 HG23 VAL 483 HG23 VAL 483 2.830 -0.527 -0.776 101 H VAL 484 HN VAL 484 4.827 -2.427 -3.669 102 HA VAL 484 HA VAL 484 4.755 0.384 -4.516 103 HB VAL 484 HB VAL 484 5.289 -0.429 -6.786 104 HG11 VAL 484 HG11 VAL 484 7.236 -1.301 -4.657 105 HG12 VAL 484 HG12 VAL 484 7.067 0.330 -5.305 106 HG13 VAL 484 HG13 VAL 484 7.632 -0.977 -6.345 107 HG21 VAL 484 HG21 VAL 484 5.611 -3.106 -5.444 108 HG22 VAL 484 HG22 VAL 484 6.065 -2.725 -7.104 109 HG23 VAL 484 HG23 VAL 484 4.370 -2.673 -6.620 110 H HIS 485 HN HIS 485 3.171 1.156 -5.727 111 HA HIS 485 HA HIS 485 0.822 -0.559 -6.230 112 HB2 HIS 485 HB2 HIS 485 0.572 1.283 -4.500 113 HB3 HIS 485 HB1 HIS 485 0.868 2.439 -5.782 114 HD1 HIS 485 HD1 HIS 485 -1.493 3.461 -5.353 115 HD2 HIS 485 HD2 HIS 485 -1.542 -0.498 -6.614 116 HE1 HIS 485 HE1 HIS 485 -3.870 2.991 -6.005 117 HE2 HIS 485 HE2 HIS 485 -3.910 0.549 -6.602 118 H LEU 486 HN LEU 486 0.423 -0.863 -8.327 119 HA LEU 486 HA LEU 486 2.018 0.064 -10.371 120 HB2 LEU 486 HB2 LEU 486 0.560 -0.994 -11.880 121 HB3 LEU 486 HB1 LEU 486 0.490 -1.919 -10.401 122 HG LEU 486 HG LEU 486 -1.703 -1.921 -11.119 123 HD11 LEU 486 HD11 LEU 486 -1.642 0.494 -9.335 124 HD12 LEU 486 HD12 LEU 486 -1.585 -1.180 -8.791 125 HD13 LEU 486 HD13 LEU 486 -3.018 -0.572 -9.622 126 HD21 LEU 486 HD21 LEU 486 -1.453 0.983 -11.849 127 HD22 LEU 486 HD22 LEU 486 -2.911 0.004 -12.012 128 HD23 LEU 486 HD23 LEU 486 -1.478 -0.383 -12.965 129 H GLU 487 HN GLU 487 -0.476 1.769 -8.829 130 HA GLU 487 HA GLU 487 -1.039 3.570 -10.991 131 HB2 GLU 487 HB2 GLU 487 -1.791 3.520 -8.077 132 HB3 GLU 487 HB1 GLU 487 -2.239 4.843 -9.145 133 HG2 GLU 487 HG2 GLU 487 -2.946 1.985 -9.731 134 HG3 GLU 487 HG1 GLU 487 -3.974 3.047 -8.771 135 H HIS 488 HN HIS 488 0.698 3.833 -7.861 136 HA HIS 488 HA HIS 488 1.822 6.336 -8.924 137 HB2 HIS 488 HB2 HIS 488 0.743 5.715 -6.217 138 HB3 HIS 488 HB1 HIS 488 2.026 6.910 -6.375 139 HD1 HIS 488 HD1 HIS 488 -1.557 6.636 -6.446 140 HD2 HIS 488 HD2 HIS 488 1.263 8.992 -8.386 141 HE1 HIS 488 HE1 HIS 488 -2.820 8.625 -7.307 142 HE2 HIS 488 HE2 HIS 488 -1.130 9.942 -8.626 143 H GLY 489 HN GLY 489 2.546 3.539 -6.833 144 HA2 GLY 489 HA2 GLY 489 4.851 2.688 -7.559 145 HA3 GLY 489 HA1 GLY 489 5.382 4.295 -7.096 146 H VAL 490 HN VAL 490 6.735 3.703 -5.479 147 HA VAL 490 HA VAL 490 5.999 1.711 -3.543 148 HB VAL 490 HB VAL 490 8.293 1.843 -4.329 149 HG11 VAL 490 HG11 VAL 490 8.328 4.573 -3.056 150 HG12 VAL 490 HG12 VAL 490 8.479 4.202 -4.773 151 HG13 VAL 490 HG13 VAL 490 9.747 3.718 -3.651 152 HG21 VAL 490 HG21 VAL 490 8.056 2.559 -1.407 153 HG22 VAL 490 HG22 VAL 490 9.461 1.815 -2.172 154 HG23 VAL 490 HG23 VAL 490 7.929 0.942 -2.100 155 H GLY 491 HN GLY 491 5.296 1.950 -1.528 156 HA2 GLY 491 HA2 GLY 491 5.542 4.543 -0.177 157 HA3 GLY 491 HA1 GLY 491 3.929 3.858 -0.356 158 H ARG 492 HN ARG 492 4.300 4.144 2.125 159 HA ARG 492 HA ARG 492 5.506 1.679 3.198 160 HB2 ARG 492 HB2 ARG 492 4.747 4.236 4.617 161 HB3 ARG 492 HB1 ARG 492 5.424 2.812 5.393 162 HG2 ARG 492 HG2 ARG 492 6.772 4.483 3.296 163 HG3 ARG 492 HG1 ARG 492 7.112 4.526 5.029 164 HD2 ARG 492 HD2 ARG 492 7.613 2.026 4.801 165 HD3 ARG 492 HD1 ARG 492 7.639 2.315 3.061 166 HE ARG 492 HE ARG 492 9.526 3.382 5.039 167 HH11 ARG 492 HH11 ARG 492 8.596 2.969 1.682 168 HH12 ARG 492 HH12 ARG 492 10.147 3.438 1.065 169 HH21 ARG 492 HH21 ARG 492 11.561 3.975 4.233 170 HH22 ARG 492 HH22 ARG 492 11.846 3.995 2.518 171 H TYR 493 HN TYR 493 4.157 0.108 3.638 172 HA TYR 493 HA TYR 493 1.345 0.384 3.564 173 HB2 TYR 493 HB2 TYR 493 2.557 -1.701 3.006 174 HB3 TYR 493 HB1 TYR 493 3.021 -1.866 4.694 175 HD1 TYR 493 HD1 TYR 493 1.496 -2.719 6.320 176 HD2 TYR 493 HD2 TYR 493 0.188 -1.962 2.339 177 HE1 TYR 493 HE1 TYR 493 -0.571 -3.966 6.772 178 HE2 TYR 493 HE2 TYR 493 -1.872 -3.224 2.783 179 HH TYR 493 HH TYR 493 -2.877 -4.086 5.889 180 H ALA 494 HN ALA 494 -0.132 0.755 5.151 181 HA ALA 494 HA ALA 494 0.789 0.500 7.935 182 HB1 ALA 494 HB1 ALA 494 -0.233 2.619 8.553 183 HB2 ALA 494 HB2 ALA 494 -0.683 2.907 6.872 184 HB3 ALA 494 HB3 ALA 494 1.018 2.860 7.335 185 H GLY 495 HN GLY 495 -0.436 -1.279 8.302 186 HA2 GLY 495 HA2 GLY 495 -2.283 -2.478 8.915 187 HA3 GLY 495 HA1 GLY 495 -2.945 -0.923 9.371 188 H MET 496 HN MET 496 -4.979 -1.543 8.839 189 HA MET 496 HA MET 496 -5.577 -1.341 5.990 190 HB2 MET 496 HB2 MET 496 -6.278 -3.632 7.748 191 HB3 MET 496 HB1 MET 496 -7.505 -3.082 6.616 192 HG2 MET 496 HG2 MET 496 -5.980 -3.404 4.766 193 HG3 MET 496 HG1 MET 496 -4.706 -3.888 5.880 194 HE1 MET 496 HE1 MET 496 -5.685 -5.574 3.322 195 HE2 MET 496 HE2 MET 496 -5.674 -7.207 3.989 196 HE3 MET 496 HE3 MET 496 -4.366 -6.089 4.375 197 H THR 497 HN THR 497 -7.577 -0.497 5.507 198 HA THR 497 HA THR 497 -9.097 0.620 7.758 199 HB THR 497 HB THR 497 -7.598 2.381 6.908 200 HG1 THR 497 HG1 THR 497 -9.320 3.455 7.512 201 HG21 THR 497 HG21 THR 497 -7.849 3.258 4.638 202 HG22 THR 497 HG22 THR 497 -9.005 1.977 4.264 203 HG23 THR 497 HG23 THR 497 -7.324 1.575 4.613 204 H THR 498 HN THR 498 -11.333 0.703 7.394 205 HA THR 498 HA THR 498 -12.177 -0.695 4.965 206 HB THR 498 HB THR 498 -14.438 -0.713 6.320 207 HG1 THR 498 HG1 THR 498 -12.677 -0.876 8.513 208 HG21 THR 498 HG21 THR 498 -12.093 -2.492 6.986 209 HG22 THR 498 HG22 THR 498 -13.180 -2.679 5.608 210 HG23 THR 498 HG23 THR 498 -13.795 -2.882 7.250 211 H LEU 499 HN LEU 499 -13.342 0.231 3.450 212 HA LEU 499 HA LEU 499 -14.205 3.006 3.913 213 HB2 LEU 499 HB2 LEU 499 -13.438 1.668 1.315 214 HB3 LEU 499 HB1 LEU 499 -13.997 3.320 1.474 215 HG LEU 499 HG LEU 499 -11.423 2.207 2.597 216 HD11 LEU 499 HD11 LEU 499 -10.365 3.675 0.943 217 HD12 LEU 499 HD12 LEU 499 -11.955 4.108 0.316 218 HD13 LEU 499 HD13 LEU 499 -11.374 2.448 0.179 219 HD21 LEU 499 HD21 LEU 499 -12.341 3.949 4.034 220 HD22 LEU 499 HD22 LEU 499 -12.520 5.016 2.641 221 HD23 LEU 499 HD23 LEU 499 -10.913 4.527 3.177 222 H GLU 500 HN GLU 500 -16.283 3.474 3.700 223 HA GLU 500 HA GLU 500 -18.079 1.314 2.889 224 HB2 GLU 500 HB2 GLU 500 -18.623 3.908 4.354 225 HB3 GLU 500 HB1 GLU 500 -19.839 2.696 3.974 226 HG2 GLU 500 HG2 GLU 500 -18.764 1.088 5.392 227 HG3 GLU 500 HG1 GLU 500 -17.408 2.178 5.670 228 H ALA 501 HN ALA 501 -19.181 1.400 1.013 229 HA ALA 501 HA ALA 501 -19.352 3.986 -0.368 230 HB1 ALA 501 HB1 ALA 501 -17.512 2.755 -1.356 231 HB2 ALA 501 HB2 ALA 501 -18.859 2.841 -2.491 232 HB3 ALA 501 HB3 ALA 501 -18.553 1.352 -1.595 233 H GLY 502 HN GLY 502 -21.498 3.893 0.610 234 HA2 GLY 502 HA2 GLY 502 -23.763 3.642 0.354 235 HA3 GLY 502 HA1 GLY 502 -23.437 2.961 -1.235 236 H GLY 503 HN GLY 503 -24.351 1.034 -1.425 237 HA2 GLY 503 HA2 GLY 503 -24.801 -0.632 0.900 238 HA3 GLY 503 HA1 GLY 503 -25.296 -0.982 -0.751 239 H ILE 504 HN ILE 504 -22.279 -0.224 -1.313 240 HA ILE 504 HA ILE 504 -21.380 -2.999 -0.967 241 HB ILE 504 HB ILE 504 -20.390 -0.950 -2.964 242 HG12 ILE 504 HG12 ILE 504 -21.442 -2.681 -4.594 243 HG13 ILE 504 HG11 ILE 504 -22.379 -3.195 -3.199 244 HG21 ILE 504 HG21 ILE 504 -18.670 -2.540 -2.334 245 HG22 ILE 504 HG22 ILE 504 -19.208 -2.843 -3.986 246 HG23 ILE 504 HG23 ILE 504 -19.760 -3.884 -2.674 247 HD11 ILE 504 HD11 ILE 504 -22.350 -0.435 -4.396 248 HD12 ILE 504 HD12 ILE 504 -23.290 -0.938 -2.992 249 HD13 ILE 504 HD13 ILE 504 -23.625 -1.637 -4.575 250 H THR 505 HN THR 505 -20.143 -3.132 0.785 251 HA THR 505 HA THR 505 -18.065 -1.077 1.148 252 HB THR 505 HB THR 505 -18.164 -1.491 3.563 253 HG1 THR 505 HG1 THR 505 -19.808 -3.545 2.728 254 HG21 THR 505 HG21 THR 505 -20.235 -0.360 4.022 255 HG22 THR 505 HG22 THR 505 -20.925 -0.911 2.496 256 HG23 THR 505 HG23 THR 505 -19.603 0.255 2.493 257 H GLY 506 HN GLY 506 -16.046 -1.888 2.109 258 HA2 GLY 506 HA2 GLY 506 -15.640 -4.744 2.159 259 HA3 GLY 506 HA1 GLY 506 -14.924 -3.962 0.759 260 H GLU 507 HN GLU 507 -13.117 -5.140 2.041 261 HA GLU 507 HA GLU 507 -11.975 -3.423 4.108 262 HB2 GLU 507 HB2 GLU 507 -10.988 -6.054 2.999 263 HB3 GLU 507 HB1 GLU 507 -10.333 -5.210 4.395 264 HG2 GLU 507 HG2 GLU 507 -12.522 -5.477 5.522 265 HG3 GLU 507 HG1 GLU 507 -13.070 -6.435 4.148 266 H TYR 508 HN TYR 508 -10.136 -2.219 3.804 267 HA TYR 508 HA TYR 508 -8.952 -2.279 1.119 268 HB2 TYR 508 HB2 TYR 508 -9.933 0.162 2.602 269 HB3 TYR 508 HB1 TYR 508 -8.873 0.235 1.198 270 HD1 TYR 508 HD1 TYR 508 -9.759 0.142 -0.977 271 HD2 TYR 508 HD2 TYR 508 -12.215 -0.913 2.327 272 HE1 TYR 508 HE1 TYR 508 -11.716 0.069 -2.461 273 HE2 TYR 508 HE2 TYR 508 -14.175 -0.999 0.857 274 HH TYR 508 HH TYR 508 -13.958 -1.030 -2.504 275 H LEU 509 HN LEU 509 -6.933 -1.692 0.908 276 HA LEU 509 HA LEU 509 -5.211 -2.018 3.171 277 HB2 LEU 509 HB2 LEU 509 -4.649 -3.124 1.159 278 HB3 LEU 509 HB1 LEU 509 -4.933 -1.692 0.201 279 HG LEU 509 HG LEU 509 -2.664 -1.775 2.146 280 HD11 LEU 509 HD11 LEU 509 -2.712 -2.816 -0.682 281 HD12 LEU 509 HD12 LEU 509 -2.516 -3.792 0.772 282 HD13 LEU 509 HD13 LEU 509 -1.267 -2.629 0.316 283 HD21 LEU 509 HD21 LEU 509 -2.908 -0.430 -0.528 284 HD22 LEU 509 HD22 LEU 509 -1.731 -0.119 0.749 285 HD23 LEU 509 HD23 LEU 509 -3.422 0.333 0.976 286 H MET 510 HN MET 510 -4.113 -0.412 4.205 287 HA MET 510 HA MET 510 -4.519 2.316 3.200 288 HB2 MET 510 HB2 MET 510 -5.178 1.388 5.641 289 HB3 MET 510 HB1 MET 510 -3.523 1.884 5.956 290 HG2 MET 510 HG2 MET 510 -4.088 4.123 5.040 291 HG3 MET 510 HG1 MET 510 -5.758 3.594 4.922 292 HE1 MET 510 HE1 MET 510 -4.868 6.207 6.460 293 HE2 MET 510 HE2 MET 510 -5.797 6.093 7.953 294 HE3 MET 510 HE3 MET 510 -6.552 5.682 6.414 295 H LEU 511 HN LEU 511 -2.827 3.317 2.385 296 HA LEU 511 HA LEU 511 -0.138 2.415 3.183 297 HB2 LEU 511 HB2 LEU 511 -1.365 2.556 0.576 298 HB3 LEU 511 HB1 LEU 511 0.050 3.588 0.644 299 HG LEU 511 HG LEU 511 0.304 0.794 1.651 300 HD11 LEU 511 HD11 LEU 511 -0.907 0.888 -0.635 301 HD12 LEU 511 HD12 LEU 511 0.491 -0.167 -0.437 302 HD13 LEU 511 HD13 LEU 511 0.668 1.388 -1.255 303 HD21 LEU 511 HD21 LEU 511 2.115 2.636 0.099 304 HD22 LEU 511 HD22 LEU 511 2.553 1.069 0.778 305 HD23 LEU 511 HD23 LEU 511 2.142 2.409 1.848 306 H THR 512 HN THR 512 1.486 3.941 3.287 307 HA THR 512 HA THR 512 0.583 6.741 3.276 308 HB THR 512 HB THR 512 2.761 6.227 5.137 309 HG1 THR 512 HG1 THR 512 1.085 4.293 5.124 310 HG21 THR 512 HG21 THR 512 -0.005 7.392 5.442 311 HG22 THR 512 HG22 THR 512 1.464 8.291 5.066 312 HG23 THR 512 HG23 THR 512 1.288 7.504 6.635 313 H TYR 513 HN TYR 513 1.647 7.826 1.785 314 HA TYR 513 HA TYR 513 4.265 6.877 0.901 315 HB2 TYR 513 HB2 TYR 513 2.193 8.701 -0.292 316 HB3 TYR 513 HB1 TYR 513 3.843 8.705 -0.896 317 HD1 TYR 513 HD1 TYR 513 3.956 7.623 -2.922 318 HD2 TYR 513 HD2 TYR 513 1.487 5.978 0.126 319 HE1 TYR 513 HE1 TYR 513 3.425 5.722 -4.387 320 HE2 TYR 513 HE2 TYR 513 0.953 4.072 -1.330 321 HH TYR 513 HH TYR 513 2.668 3.290 -4.051 322 H ALA 514 HN ALA 514 5.321 9.254 -0.075 323 HA ALA 514 HA ALA 514 6.515 10.374 2.208 324 HB1 ALA 514 HB1 ALA 514 7.631 10.447 0.081 325 HB2 ALA 514 HB2 ALA 514 7.373 12.100 0.647 326 HB3 ALA 514 HB3 ALA 514 6.335 11.423 -0.606 327 H ASN 515 HN ASN 515 6.348 12.498 3.054 328 HA ASN 515 HA ASN 515 5.252 14.278 3.937 329 HB2 ASN 515 HB2 ASN 515 3.463 14.142 1.498 330 HB3 ASN 515 HB1 ASN 515 3.664 15.514 2.575 331 HD21 ASN 515 HD21 ASN 515 4.033 15.320 -0.288 332 HD22 ASN 515 HD22 ASN 515 5.661 15.822 -0.598 333 H ASP 516 HN ASP 516 4.366 11.429 4.232 334 HA ASP 516 HA ASP 516 2.747 10.160 5.177 335 HB2 ASP 516 HB2 ASP 516 3.073 12.182 6.854 336 HB3 ASP 516 HB1 ASP 516 1.432 12.575 6.352 337 H ALA 517 HN ALA 517 2.260 10.779 2.584 338 HA ALA 517 HA ALA 517 -0.414 11.766 2.215 339 HB1 ALA 517 HB1 ALA 517 1.416 10.324 0.300 340 HB2 ALA 517 HB2 ALA 517 1.267 12.070 0.478 341 HB3 ALA 517 HB3 ALA 517 -0.092 11.126 -0.129 342 H LYS 518 HN LYS 518 -2.250 10.548 1.620 343 HA LYS 518 HA LYS 518 -2.178 7.879 2.827 344 HB2 LYS 518 HB2 LYS 518 -4.566 9.628 2.216 345 HB3 LYS 518 HB1 LYS 518 -4.585 8.118 3.116 346 HG2 LYS 518 HG2 LYS 518 -3.298 10.707 3.950 347 HG3 LYS 518 HG1 LYS 518 -4.736 9.956 4.645 348 HD2 LYS 518 HD2 LYS 518 -3.317 8.007 5.287 349 HD3 LYS 518 HD1 LYS 518 -1.907 8.917 4.742 350 HE2 LYS 518 HE2 LYS 518 -2.549 10.719 6.346 351 HE3 LYS 518 HE1 LYS 518 -3.807 9.648 6.963 352 HZ1 LYS 518 HZ1 LYS 518 -2.022 9.324 8.383 353 HZ2 LYS 518 HZ2 LYS 518 -0.875 9.353 7.142 354 HZ3 LYS 518 HZ3 LYS 518 -1.896 8.013 7.322 355 H LEU 519 HN LEU 519 -2.666 6.083 1.745 356 HA LEU 519 HA LEU 519 -3.947 6.326 -0.891 357 HB2 LEU 519 HB2 LEU 519 -1.603 5.894 -1.302 358 HB3 LEU 519 HB1 LEU 519 -1.602 4.576 -0.148 359 HG LEU 519 HG LEU 519 -3.208 3.361 -1.636 360 HD11 LEU 519 HD11 LEU 519 -3.349 4.120 -3.983 361 HD12 LEU 519 HD12 LEU 519 -2.553 5.624 -3.515 362 HD13 LEU 519 HD13 LEU 519 -4.135 5.221 -2.851 363 HD21 LEU 519 HD21 LEU 519 -1.520 2.705 -3.280 364 HD22 LEU 519 HD22 LEU 519 -0.854 2.815 -1.651 365 HD23 LEU 519 HD23 LEU 519 -0.542 4.099 -2.821 366 H TYR 520 HN TYR 520 -5.572 4.883 -1.257 367 HA TYR 520 HA TYR 520 -5.861 2.655 0.653 368 HB2 TYR 520 HB2 TYR 520 -8.144 4.091 -0.698 369 HB3 TYR 520 HB1 TYR 520 -8.252 2.880 0.570 370 HD1 TYR 520 HD1 TYR 520 -6.619 3.642 2.684 371 HD2 TYR 520 HD2 TYR 520 -8.715 6.199 0.011 372 HE1 TYR 520 HE1 TYR 520 -6.603 5.422 4.381 373 HE2 TYR 520 HE2 TYR 520 -8.707 7.984 1.701 374 HH TYR 520 HH TYR 520 -8.552 8.009 4.358 375 H VAL 521 HN VAL 521 -5.955 0.699 -0.229 376 HA VAL 521 HA VAL 521 -6.564 0.493 -3.107 377 HB VAL 521 HB VAL 521 -4.492 -1.106 -1.591 378 HG11 VAL 521 HG11 VAL 521 -5.248 -1.200 -4.506 379 HG12 VAL 521 HG12 VAL 521 -5.615 -2.434 -3.302 380 HG13 VAL 521 HG13 VAL 521 -3.941 -2.106 -3.743 381 HG21 VAL 521 HG21 VAL 521 -2.850 0.018 -2.981 382 HG22 VAL 521 HG22 VAL 521 -3.783 1.197 -2.060 383 HG23 VAL 521 HG23 VAL 521 -4.125 0.943 -3.772 384 HA PRO 522 HA PRO 522 -9.637 -2.401 -1.613 385 HB2 PRO 522 HB2 PRO 522 -10.264 -3.455 -4.063 386 HB3 PRO 522 HB1 PRO 522 -10.916 -1.931 -3.453 387 HG2 PRO 522 HG2 PRO 522 -8.679 -2.402 -5.373 388 HG3 PRO 522 HG1 PRO 522 -9.940 -1.156 -5.401 389 HD2 PRO 522 HD2 PRO 522 -7.409 -0.662 -4.576 390 HD3 PRO 522 HD1 PRO 522 -8.814 0.189 -3.911 391 H VAL 523 HN VAL 523 -9.464 -4.466 -0.919 392 HA VAL 523 HA VAL 523 -7.016 -5.844 -1.312 393 HB VAL 523 HB VAL 523 -8.028 -7.670 0.025 394 HG11 VAL 523 HG11 VAL 523 -8.288 -6.363 2.086 395 HG12 VAL 523 HG12 VAL 523 -8.410 -4.888 1.127 396 HG13 VAL 523 HG13 VAL 523 -6.911 -5.817 1.128 397 HG21 VAL 523 HG21 VAL 523 -10.482 -5.912 -0.009 398 HG22 VAL 523 HG22 VAL 523 -10.261 -7.349 0.989 399 HG23 VAL 523 HG23 VAL 523 -10.327 -7.497 -0.767 400 H SER 524 HN SER 524 -9.730 -5.697 -3.237 401 HA SER 524 HA SER 524 -9.461 -8.358 -4.348 402 HB2 SER 524 HB2 SER 524 -11.189 -7.344 -6.004 403 HB3 SER 524 HB1 SER 524 -11.689 -7.636 -4.338 404 HG SER 524 HG SER 524 -11.621 -5.321 -5.687 405 H SER 525 HN SER 525 -7.830 -5.485 -4.623 406 HA SER 525 HA SER 525 -6.993 -6.072 -7.387 407 HB2 SER 525 HB2 SER 525 -6.984 -3.389 -5.986 408 HB3 SER 525 HB1 SER 525 -6.502 -3.694 -7.655 409 HG SER 525 HG SER 525 -8.851 -4.693 -7.581 410 H LEU 526 HN LEU 526 -5.956 -7.131 -4.825 411 HA LEU 526 HA LEU 526 -3.564 -5.804 -4.108 412 HB2 LEU 526 HB2 LEU 526 -4.577 -8.588 -3.631 413 HB3 LEU 526 HB1 LEU 526 -3.012 -8.062 -3.049 414 HG LEU 526 HG LEU 526 -5.661 -6.827 -2.302 415 HD11 LEU 526 HD11 LEU 526 -5.216 -7.777 -0.089 416 HD12 LEU 526 HD12 LEU 526 -3.783 -8.580 -0.729 417 HD13 LEU 526 HD13 LEU 526 -5.382 -9.027 -1.321 418 HD21 LEU 526 HD21 LEU 526 -4.287 -5.619 -0.614 419 HD22 LEU 526 HD22 LEU 526 -3.952 -5.147 -2.279 420 HD23 LEU 526 HD23 LEU 526 -2.841 -6.221 -1.429 421 H HIS 527 HN HIS 527 -4.295 -7.899 -6.737 422 HA HIS 527 HA HIS 527 -1.654 -8.862 -7.196 423 HB2 HIS 527 HB2 HIS 527 -3.733 -9.871 -8.164 424 HB3 HIS 527 HB1 HIS 527 -3.865 -8.477 -9.228 425 HD1 HIS 527 HD1 HIS 527 -3.552 -9.786 -11.390 426 HD2 HIS 527 HD2 HIS 527 -0.435 -10.314 -8.689 427 HE1 HIS 527 HE1 HIS 527 -1.748 -10.982 -12.668 428 HE2 HIS 527 HE2 HIS 527 0.171 -11.194 -11.047 429 H LEU 528 HN LEU 528 -3.007 -5.804 -7.441 430 HA LEU 528 HA LEU 528 -1.187 -4.896 -9.539 431 HB2 LEU 528 HB2 LEU 528 -3.216 -3.316 -7.966 432 HB3 LEU 528 HB1 LEU 528 -2.372 -2.795 -9.408 433 HG LEU 528 HG LEU 528 -4.437 -4.988 -9.260 434 HD11 LEU 528 HD11 LEU 528 -5.343 -2.721 -9.063 435 HD12 LEU 528 HD12 LEU 528 -5.799 -3.481 -10.588 436 HD13 LEU 528 HD13 LEU 528 -4.520 -2.266 -10.554 437 HD21 LEU 528 HD21 LEU 528 -2.896 -3.915 -11.622 438 HD22 LEU 528 HD22 LEU 528 -4.241 -5.051 -11.706 439 HD23 LEU 528 HD23 LEU 528 -2.738 -5.523 -10.916 440 H ILE 529 HN ILE 529 -1.126 -5.387 -6.273 441 HA ILE 529 HA ILE 529 0.831 -3.260 -5.741 442 HB ILE 529 HB ILE 529 -0.407 -5.264 -3.840 443 HG12 ILE 529 HG12 ILE 529 -2.019 -3.680 -4.973 444 HG13 ILE 529 HG11 ILE 529 -1.993 -3.630 -3.217 445 HG21 ILE 529 HG21 ILE 529 1.698 -4.350 -3.025 446 HG22 ILE 529 HG22 ILE 529 0.344 -3.734 -2.076 447 HG23 ILE 529 HG23 ILE 529 1.106 -2.711 -3.294 448 HD11 ILE 529 HD11 ILE 529 -0.589 -1.682 -5.039 449 HD12 ILE 529 HD12 ILE 529 -0.656 -1.600 -3.278 450 HD13 ILE 529 HD13 ILE 529 -2.127 -1.396 -4.229 451 H SER 530 HN SER 530 2.891 -3.924 -4.736 452 HA SER 530 HA SER 530 3.522 -6.737 -4.590 453 HB2 SER 530 HB2 SER 530 3.960 -5.833 -7.035 454 HB3 SER 530 HB1 SER 530 5.379 -5.108 -6.292 455 HG SER 530 HG SER 530 5.678 -7.267 -7.192 456 H ARG 531 HN ARG 531 5.474 -7.122 -3.430 457 HA ARG 531 HA ARG 531 5.993 -4.927 -1.603 458 HB2 ARG 531 HB2 ARG 531 5.552 -7.388 -0.932 459 HB3 ARG 531 HB1 ARG 531 7.227 -7.660 -1.407 460 HG2 ARG 531 HG2 ARG 531 7.937 -5.928 0.173 461 HG3 ARG 531 HG1 ARG 531 6.258 -5.718 0.667 462 HD2 ARG 531 HD2 ARG 531 7.391 -7.119 2.271 463 HD3 ARG 531 HD1 ARG 531 6.207 -8.079 1.388 464 HE ARG 531 HE ARG 531 8.077 -8.982 0.085 465 HH11 ARG 531 HH11 ARG 531 8.843 -7.398 3.129 466 HH12 ARG 531 HH12 ARG 531 10.306 -8.302 3.366 467 HH21 ARG 531 HH21 ARG 531 10.006 -10.155 0.406 468 HH22 ARG 531 HH22 ARG 531 10.954 -9.877 1.833 469 H TYR 532 HN TYR 532 8.003 -4.026 -1.240 470 HA TYR 532 HA TYR 532 9.720 -3.960 -3.534 471 HB2 TYR 532 HB2 TYR 532 9.123 -2.139 -1.642 472 HB3 TYR 532 HB1 TYR 532 10.628 -2.764 -0.973 473 HD1 TYR 532 HD1 TYR 532 9.106 -0.748 -3.559 474 HD2 TYR 532 HD2 TYR 532 12.734 -2.571 -2.293 475 HE1 TYR 532 HE1 TYR 532 10.360 0.691 -5.110 476 HE2 TYR 532 HE2 TYR 532 13.998 -1.135 -3.839 477 HH TYR 532 HH TYR 532 12.630 1.576 -5.375 478 H ALA 533 HN ALA 533 10.516 -6.043 -3.729 479 HA ALA 533 HA ALA 533 11.775 -7.400 -1.549 480 HB1 ALA 533 HB1 ALA 533 12.287 -9.126 -3.201 481 HB2 ALA 533 HB2 ALA 533 11.745 -8.052 -4.490 482 HB3 ALA 533 HB3 ALA 533 10.597 -8.632 -3.285 483 H GLY 534 HN GLY 534 13.381 -5.927 -0.909 484 HA2 GLY 534 HA2 GLY 534 15.862 -6.363 -2.404 485 HA3 GLY 534 HA1 GLY 534 15.435 -4.711 -1.970 486 H GLY 535 HN GLY 535 17.752 -6.248 -1.088 487 HA2 GLY 535 HA2 GLY 535 17.465 -7.338 1.467 488 HA3 GLY 535 HA1 GLY 535 18.938 -6.607 0.846 489 H ALA 536 HN ALA 536 18.371 -4.026 0.574 490 HA ALA 536 HA ALA 536 18.085 -3.112 3.300 491 HB1 ALA 536 HB1 ALA 536 19.834 -2.185 1.861 492 HB2 ALA 536 HB2 ALA 536 18.720 -0.931 2.408 493 HB3 ALA 536 HB3 ALA 536 18.601 -1.561 0.765 494 H GLU 537 HN GLU 537 15.786 -3.909 3.299 495 HA GLU 537 HA GLU 537 13.807 -2.623 1.747 496 HB2 GLU 537 HB2 GLU 537 12.206 -3.559 3.415 497 HB3 GLU 537 HB1 GLU 537 13.311 -4.750 2.745 498 HG2 GLU 537 HG2 GLU 537 14.640 -4.717 4.751 499 HG3 GLU 537 HG1 GLU 537 13.665 -3.408 5.416 500 H GLU 538 HN GLU 538 15.402 -1.762 4.723 501 HA GLU 538 HA GLU 538 13.481 0.233 5.480 502 HB2 GLU 538 HB2 GLU 538 16.351 0.071 6.397 503 HB3 GLU 538 HB1 GLU 538 14.998 0.824 7.228 504 HG2 GLU 538 HG2 GLU 538 15.044 -1.077 8.419 505 HG3 GLU 538 HG1 GLU 538 14.080 -1.686 7.075 506 H ASN 539 HN ASN 539 16.000 0.082 3.206 507 HA ASN 539 HA ASN 539 16.307 3.002 3.145 508 HB2 ASN 539 HB2 ASN 539 18.350 1.499 3.124 509 HB3 ASN 539 HB1 ASN 539 17.848 0.966 1.523 510 HD21 ASN 539 HD21 ASN 539 19.598 1.778 0.453 511 HD22 ASN 539 HD22 ASN 539 19.892 3.472 0.261 512 H ALA 540 HN ALA 540 14.109 1.042 2.091 513 HA ALA 540 HA ALA 540 13.978 1.372 -0.704 514 HB1 ALA 540 HB1 ALA 540 12.636 -0.285 0.486 515 HB2 ALA 540 HB2 ALA 540 11.611 0.786 -0.467 516 HB3 ALA 540 HB3 ALA 540 11.731 1.005 1.279 517 HA PRO 541 HA PRO 541 13.169 5.667 -1.062 518 HB2 PRO 541 HB2 PRO 541 11.820 5.642 -3.453 519 HB3 PRO 541 HB1 PRO 541 13.577 5.532 -3.302 520 HG2 PRO 541 HG2 PRO 541 11.571 3.360 -3.723 521 HG3 PRO 541 HG1 PRO 541 13.173 3.557 -4.445 522 HD2 PRO 541 HD2 PRO 541 12.706 1.843 -2.422 523 HD3 PRO 541 HD1 PRO 541 14.249 2.705 -2.593 524 H LEU 542 HN LEU 542 11.472 7.221 -1.085 525 HA LEU 542 HA LEU 542 8.778 6.131 -0.643 526 HB2 LEU 542 HB2 LEU 542 9.928 6.645 1.514 527 HB3 LEU 542 HB1 LEU 542 10.061 8.315 1.001 528 HG LEU 542 HG LEU 542 7.600 8.487 0.952 529 HD11 LEU 542 HD11 LEU 542 7.007 6.205 0.478 530 HD12 LEU 542 HD12 LEU 542 6.276 6.683 2.011 531 HD13 LEU 542 HD13 LEU 542 7.716 5.665 1.999 532 HD21 LEU 542 HD21 LEU 542 8.849 9.121 2.961 533 HD22 LEU 542 HD22 LEU 542 8.706 7.472 3.570 534 HD23 LEU 542 HD23 LEU 542 7.262 8.465 3.365 535 H HIS 543 HN HIS 543 7.626 6.889 -2.283 536 HA HIS 543 HA HIS 543 8.232 9.548 -3.367 537 HB2 HIS 543 HB2 HIS 543 6.550 7.311 -4.532 538 HB3 HIS 543 HB1 HIS 543 6.928 8.831 -5.334 539 HD1 HIS 543 HD1 HIS 543 7.716 6.231 -6.708 540 HD2 HIS 543 HD2 HIS 543 10.227 8.294 -4.113 541 HE1 HIS 543 HE1 HIS 543 10.047 5.481 -7.280 542 HE2 HIS 543 HE2 HIS 543 11.553 6.833 -5.785 543 H LYS 544 HN LYS 544 6.251 10.815 -4.125 544 HA LYS 544 HA LYS 544 4.113 10.549 -2.107 545 HB2 LYS 544 HB2 LYS 544 3.790 12.952 -2.232 546 HB3 LYS 544 HB1 LYS 544 5.471 12.609 -1.856 547 HG2 LYS 544 HG2 LYS 544 6.108 13.045 -4.152 548 HG3 LYS 544 HG1 LYS 544 4.420 13.312 -4.589 549 HD2 LYS 544 HD2 LYS 544 4.349 15.202 -2.994 550 HD3 LYS 544 HD1 LYS 544 6.068 14.958 -2.674 551 HE2 LYS 544 HE2 LYS 544 6.564 15.379 -5.034 552 HE3 LYS 544 HE1 LYS 544 4.847 15.621 -5.351 553 HZ1 LYS 544 HZ1 LYS 544 5.942 17.726 -5.101 554 HZ2 LYS 544 HZ2 LYS 544 6.562 17.286 -3.594 555 HZ3 LYS 544 HZ3 LYS 544 4.896 17.494 -3.793 556 H LEU 545 HN LEU 545 1.959 10.806 -2.788 557 HA LEU 545 HA LEU 545 1.618 10.715 -5.698 558 HB2 LEU 545 HB2 LEU 545 -0.689 9.700 -4.981 559 HB3 LEU 545 HB1 LEU 545 0.748 8.713 -5.120 560 HG LEU 545 HG LEU 545 1.020 9.060 -2.592 561 HD11 LEU 545 HD11 LEU 545 -1.890 9.789 -2.847 562 HD12 LEU 545 HD12 LEU 545 -0.599 10.898 -2.384 563 HD13 LEU 545 HD13 LEU 545 -0.999 9.526 -1.349 564 HD21 LEU 545 HD21 LEU 545 -1.338 7.498 -3.618 565 HD22 LEU 545 HD22 LEU 545 -0.441 7.198 -2.130 566 HD23 LEU 545 HD23 LEU 545 0.344 6.976 -3.693 567 H GLY 546 HN GLY 546 1.880 13.121 -5.198 568 HA2 GLY 546 HA2 GLY 546 -0.571 14.388 -5.720 569 HA3 GLY 546 HA1 GLY 546 -0.162 14.623 -4.026 570 H GLY 547 HN GLY 547 -0.162 16.919 -4.812 571 HA2 GLY 547 HA2 GLY 547 1.540 18.620 -4.678 572 HA3 GLY 547 HA1 GLY 547 2.572 17.598 -5.668 Start of MODEL 8 1 H1 ARG 472 HT1 ARG 472 2.652 -12.724 -6.708 2 H2 ARG 472 HT2 ARG 472 1.188 -11.938 -7.021 3 H3 ARG 472 HT3 ARG 472 1.196 -13.398 -6.172 4 HA ARG 472 HA ARG 472 2.363 -12.386 -4.341 5 HB2 ARG 472 HB2 ARG 472 3.345 -10.625 -6.050 6 HB3 ARG 472 HB1 ARG 472 1.923 -9.701 -5.606 7 HG2 ARG 472 HG2 ARG 472 4.069 -10.657 -3.716 8 HG3 ARG 472 HG1 ARG 472 3.883 -9.020 -4.330 9 HD2 ARG 472 HD2 ARG 472 1.635 -8.950 -3.238 10 HD3 ARG 472 HD1 ARG 472 2.009 -10.508 -2.500 11 HE ARG 472 HE ARG 472 3.331 -7.950 -1.924 12 HH11 ARG 472 HH11 ARG 472 2.853 -11.330 -1.131 13 HH12 ARG 472 HH12 ARG 472 3.597 -11.195 0.431 14 HH21 ARG 472 HH21 ARG 472 4.272 -7.778 0.163 15 HH22 ARG 472 HH22 ARG 472 4.391 -9.188 1.167 16 H ASN 473 HN ASN 473 0.723 -12.685 -2.959 17 HA ASN 473 HA ASN 473 -1.684 -11.027 -3.312 18 HB2 ASN 473 HB2 ASN 473 -2.061 -13.474 -3.010 19 HB3 ASN 473 HB1 ASN 473 -1.281 -13.368 -1.436 20 HD21 ASN 473 HD21 ASN 473 -3.140 -14.056 -0.368 21 HD22 ASN 473 HD22 ASN 473 -4.520 -13.029 -0.181 22 H LEU 474 HN LEU 474 -2.431 -9.811 -1.489 23 HA LEU 474 HA LEU 474 -0.165 -8.922 0.137 24 HB2 LEU 474 HB2 LEU 474 -2.742 -7.623 -0.661 25 HB3 LEU 474 HB1 LEU 474 -1.682 -6.931 0.550 26 HG LEU 474 HG LEU 474 -1.196 -7.252 -2.403 27 HD11 LEU 474 HD11 LEU 474 -1.490 -5.018 -0.469 28 HD12 LEU 474 HD12 LEU 474 -2.169 -5.217 -2.084 29 HD13 LEU 474 HD13 LEU 474 -0.471 -4.796 -1.885 30 HD21 LEU 474 HD21 LEU 474 0.849 -6.688 -0.264 31 HD22 LEU 474 HD22 LEU 474 1.097 -6.405 -1.986 32 HD23 LEU 474 HD23 LEU 474 0.833 -8.044 -1.390 33 H ALA 475 HN ALA 475 -0.900 -11.139 1.209 34 HA ALA 475 HA ALA 475 -2.779 -10.492 3.379 35 HB1 ALA 475 HB1 ALA 475 -1.729 -13.187 2.518 36 HB2 ALA 475 HB2 ALA 475 -3.303 -12.515 2.090 37 HB3 ALA 475 HB3 ALA 475 -2.932 -12.889 3.772 38 H GLU 476 HN GLU 476 0.495 -11.383 2.619 39 HA GLU 476 HA GLU 476 1.206 -11.573 5.448 40 HB2 GLU 476 HB2 GLU 476 2.789 -12.196 2.955 41 HB3 GLU 476 HB1 GLU 476 3.393 -12.378 4.595 42 HG2 GLU 476 HG2 GLU 476 1.769 -14.084 5.060 43 HG3 GLU 476 HG1 GLU 476 1.003 -13.833 3.492 44 H LEU 477 HN LEU 477 0.518 -9.024 4.257 45 HA LEU 477 HA LEU 477 2.890 -7.561 3.692 46 HB2 LEU 477 HB2 LEU 477 0.042 -6.871 4.176 47 HB3 LEU 477 HB1 LEU 477 1.238 -5.595 4.290 48 HG LEU 477 HG LEU 477 0.840 -7.341 1.861 49 HD11 LEU 477 HD11 LEU 477 -0.102 -4.540 2.443 50 HD12 LEU 477 HD12 LEU 477 -1.117 -5.966 2.232 51 HD13 LEU 477 HD13 LEU 477 -0.183 -5.338 0.874 52 HD21 LEU 477 HD21 LEU 477 2.473 -4.851 2.345 53 HD22 LEU 477 HD22 LEU 477 2.191 -5.574 0.764 54 HD23 LEU 477 HD23 LEU 477 3.088 -6.467 1.991 55 H HIS 478 HN HIS 478 4.272 -6.597 4.994 56 HA HIS 478 HA HIS 478 3.870 -6.744 7.873 57 HB2 HIS 478 HB2 HIS 478 6.237 -5.719 6.283 58 HB3 HIS 478 HB1 HIS 478 6.204 -5.985 8.021 59 HD1 HIS 478 HD1 HIS 478 7.525 -7.485 5.163 60 HD2 HIS 478 HD2 HIS 478 5.382 -8.959 8.410 61 HE1 HIS 478 HE1 HIS 478 7.994 -9.950 5.222 62 HE2 HIS 478 HE2 HIS 478 6.574 -10.841 7.099 63 H ILE 479 HN ILE 479 3.996 -4.891 9.243 64 HA ILE 479 HA ILE 479 2.736 -2.569 8.079 65 HB ILE 479 HB ILE 479 3.638 -3.035 10.923 66 HG12 ILE 479 HG12 ILE 479 1.945 -4.666 10.216 67 HG13 ILE 479 HG11 ILE 479 1.279 -3.539 11.387 68 HG21 ILE 479 HG21 ILE 479 1.742 -0.968 9.821 69 HG22 ILE 479 HG22 ILE 479 3.408 -0.663 10.312 70 HG23 ILE 479 HG23 ILE 479 2.213 -1.171 11.508 71 HD11 ILE 479 HD11 ILE 479 0.846 -3.465 8.413 72 HD12 ILE 479 HD12 ILE 479 0.195 -2.308 9.572 73 HD13 ILE 479 HD13 ILE 479 -0.315 -3.994 9.630 74 H GLY 480 HN GLY 480 3.685 -0.722 7.500 75 HA2 GLY 480 HA2 GLY 480 5.273 0.969 7.417 76 HA3 GLY 480 HA1 GLY 480 6.242 0.080 8.586 77 H GLN 481 HN GLN 481 5.097 -1.690 5.912 78 HA GLN 481 HA GLN 481 7.836 -2.209 5.114 79 HB2 GLN 481 HB2 GLN 481 6.163 -4.018 5.530 80 HB3 GLN 481 HB1 GLN 481 5.250 -3.444 4.149 81 HG2 GLN 481 HG2 GLN 481 6.401 -5.199 3.245 82 HG3 GLN 481 HG1 GLN 481 7.461 -3.849 2.852 83 HE21 GLN 481 HE21 GLN 481 8.462 -3.634 5.622 84 HE22 GLN 481 HE22 GLN 481 9.557 -4.963 5.811 85 HA PRO 482 HA PRO 482 7.507 0.361 1.467 86 HB2 PRO 482 HB2 PRO 482 9.688 -0.615 0.164 87 HB3 PRO 482 HB1 PRO 482 9.794 0.549 1.488 88 HG2 PRO 482 HG2 PRO 482 10.217 -2.409 1.527 89 HG3 PRO 482 HG1 PRO 482 11.118 -1.136 2.367 90 HD2 PRO 482 HD2 PRO 482 9.243 -2.681 3.585 91 HD3 PRO 482 HD1 PRO 482 9.594 -1.014 4.077 92 H VAL 483 HN VAL 483 6.051 -0.046 -0.027 93 HA VAL 483 HA VAL 483 6.147 -2.603 -1.469 94 HB VAL 483 HB VAL 483 3.646 -2.565 -1.569 95 HG11 VAL 483 HG11 VAL 483 4.795 -4.058 -0.039 96 HG12 VAL 483 HG12 VAL 483 3.318 -3.444 0.705 97 HG13 VAL 483 HG13 VAL 483 4.884 -2.781 1.173 98 HG21 VAL 483 HG21 VAL 483 3.257 -0.232 -1.047 99 HG22 VAL 483 HG22 VAL 483 3.961 -0.448 0.556 100 HG23 VAL 483 HG23 VAL 483 2.450 -1.257 0.141 101 H VAL 484 HN VAL 484 5.762 -2.518 -3.618 102 HA VAL 484 HA VAL 484 5.822 0.143 -4.792 103 HB VAL 484 HB VAL 484 6.443 -0.920 -6.859 104 HG11 VAL 484 HG11 VAL 484 8.505 -2.045 -6.204 105 HG12 VAL 484 HG12 VAL 484 7.892 -2.207 -4.558 106 HG13 VAL 484 HG13 VAL 484 8.221 -0.607 -5.225 107 HG21 VAL 484 HG21 VAL 484 4.960 -2.821 -6.764 108 HG22 VAL 484 HG22 VAL 484 5.932 -3.525 -5.472 109 HG23 VAL 484 HG23 VAL 484 6.615 -3.332 -7.087 110 H HIS 485 HN HIS 485 4.313 0.800 -6.382 111 HA HIS 485 HA HIS 485 1.738 -0.616 -6.249 112 HB2 HIS 485 HB2 HIS 485 2.366 1.448 -4.591 113 HB3 HIS 485 HB1 HIS 485 1.605 2.296 -5.934 114 HD1 HIS 485 HD1 HIS 485 0.867 0.332 -2.970 115 HD2 HIS 485 HD2 HIS 485 -1.028 1.316 -6.510 116 HE1 HIS 485 HE1 HIS 485 -1.565 -0.167 -2.590 117 HE2 HIS 485 HE2 HIS 485 -2.716 0.630 -4.710 118 H LEU 486 HN LEU 486 1.013 -0.836 -8.213 119 HA LEU 486 HA LEU 486 2.096 0.366 -10.482 120 HB2 LEU 486 HB2 LEU 486 0.429 -0.766 -11.741 121 HB3 LEU 486 HB1 LEU 486 0.907 -1.805 -10.422 122 HG LEU 486 HG LEU 486 -1.399 -2.114 -10.637 123 HD11 LEU 486 HD11 LEU 486 -1.032 -0.123 -8.418 124 HD12 LEU 486 HD12 LEU 486 -0.813 -1.870 -8.326 125 HD13 LEU 486 HD13 LEU 486 -2.419 -1.196 -8.609 126 HD21 LEU 486 HD21 LEU 486 -3.053 -0.325 -10.765 127 HD22 LEU 486 HD22 LEU 486 -1.905 -0.256 -12.101 128 HD23 LEU 486 HD23 LEU 486 -1.758 0.871 -10.752 129 H GLU 487 HN GLU 487 -0.183 1.615 -8.298 130 HA GLU 487 HA GLU 487 -1.444 3.401 -10.174 131 HB2 GLU 487 HB2 GLU 487 -1.557 3.301 -7.155 132 HB3 GLU 487 HB1 GLU 487 -2.543 4.344 -8.166 133 HG2 GLU 487 HG2 GLU 487 -3.661 2.452 -9.130 134 HG3 GLU 487 HG1 GLU 487 -2.582 1.338 -8.290 135 H HIS 488 HN HIS 488 0.741 3.831 -7.355 136 HA HIS 488 HA HIS 488 1.386 6.468 -8.490 137 HB2 HIS 488 HB2 HIS 488 0.941 5.753 -5.602 138 HB3 HIS 488 HB1 HIS 488 1.711 7.253 -6.112 139 HD1 HIS 488 HD1 HIS 488 0.184 8.845 -7.666 140 HD2 HIS 488 HD2 HIS 488 -1.791 5.803 -5.633 141 HE1 HIS 488 HE1 HIS 488 -2.256 9.435 -7.768 142 HE2 HIS 488 HE2 HIS 488 -3.435 7.586 -6.526 143 H GLY 489 HN GLY 489 2.688 3.754 -6.621 144 HA2 GLY 489 HA2 GLY 489 5.079 3.376 -7.570 145 HA3 GLY 489 HA1 GLY 489 5.355 4.953 -6.847 146 H VAL 490 HN VAL 490 7.007 3.782 -5.614 147 HA VAL 490 HA VAL 490 6.310 1.744 -3.764 148 HB VAL 490 HB VAL 490 8.605 1.983 -4.484 149 HG11 VAL 490 HG11 VAL 490 8.688 4.382 -4.839 150 HG12 VAL 490 HG12 VAL 490 10.006 3.869 -3.790 151 HG13 VAL 490 HG13 VAL 490 8.590 4.661 -3.102 152 HG21 VAL 490 HG21 VAL 490 8.277 1.010 -2.288 153 HG22 VAL 490 HG22 VAL 490 8.319 2.610 -1.548 154 HG23 VAL 490 HG23 VAL 490 9.767 1.955 -2.317 155 H GLY 491 HN GLY 491 5.564 1.843 -1.717 156 HA2 GLY 491 HA2 GLY 491 5.469 4.449 -0.348 157 HA3 GLY 491 HA1 GLY 491 3.962 3.572 -0.599 158 H ARG 492 HN ARG 492 4.346 4.075 1.902 159 HA ARG 492 HA ARG 492 5.597 1.691 3.099 160 HB2 ARG 492 HB2 ARG 492 4.889 4.364 4.322 161 HB3 ARG 492 HB1 ARG 492 5.495 2.990 5.236 162 HG2 ARG 492 HG2 ARG 492 6.967 4.336 2.986 163 HG3 ARG 492 HG1 ARG 492 7.236 4.651 4.702 164 HD2 ARG 492 HD2 ARG 492 7.894 2.343 5.047 165 HD3 ARG 492 HD1 ARG 492 7.538 1.967 3.364 166 HE ARG 492 HE ARG 492 9.370 3.953 3.185 167 HH11 ARG 492 HH11 ARG 492 9.295 0.950 4.981 168 HH12 ARG 492 HH12 ARG 492 10.995 0.652 4.797 169 HH21 ARG 492 HH21 ARG 492 11.603 3.573 2.945 170 HH22 ARG 492 HH22 ARG 492 12.305 2.147 3.642 171 H TYR 493 HN TYR 493 4.162 0.133 3.347 172 HA TYR 493 HA TYR 493 1.363 0.487 3.404 173 HB2 TYR 493 HB2 TYR 493 2.468 -1.593 2.679 174 HB3 TYR 493 HB1 TYR 493 3.025 -1.867 4.321 175 HD1 TYR 493 HD1 TYR 493 1.748 -3.127 5.785 176 HD2 TYR 493 HD2 TYR 493 -0.114 -1.455 2.338 177 HE1 TYR 493 HE1 TYR 493 -0.298 -4.387 6.290 178 HE2 TYR 493 HE2 TYR 493 -2.166 -2.722 2.837 179 HH TYR 493 HH TYR 493 -2.691 -4.296 5.815 180 H ALA 494 HN ALA 494 -0.046 0.833 5.048 181 HA ALA 494 HA ALA 494 0.961 0.460 7.790 182 HB1 ALA 494 HB1 ALA 494 -0.013 2.567 8.491 183 HB2 ALA 494 HB2 ALA 494 -0.557 2.883 6.844 184 HB3 ALA 494 HB3 ALA 494 1.170 2.839 7.210 185 H GLY 495 HN GLY 495 -0.271 -1.322 8.149 186 HA2 GLY 495 HA2 GLY 495 -2.122 -2.561 8.667 187 HA3 GLY 495 HA1 GLY 495 -2.778 -1.038 9.233 188 H MET 496 HN MET 496 -4.838 -1.602 8.642 189 HA MET 496 HA MET 496 -5.402 -1.182 5.811 190 HB2 MET 496 HB2 MET 496 -6.085 -3.620 7.352 191 HB3 MET 496 HB1 MET 496 -7.354 -2.964 6.330 192 HG2 MET 496 HG2 MET 496 -5.839 -3.066 4.409 193 HG3 MET 496 HG1 MET 496 -4.596 -3.767 5.441 194 HE1 MET 496 HE1 MET 496 -5.745 -6.752 3.150 195 HE2 MET 496 HE2 MET 496 -4.386 -5.751 3.659 196 HE3 MET 496 HE3 MET 496 -5.682 -5.050 2.691 197 H THR 497 HN THR 497 -7.537 -0.449 5.391 198 HA THR 497 HA THR 497 -8.991 0.495 7.758 199 HB THR 497 HB THR 497 -7.713 2.404 6.948 200 HG1 THR 497 HG1 THR 497 -10.072 2.545 7.563 201 HG21 THR 497 HG21 THR 497 -9.080 1.917 4.300 202 HG22 THR 497 HG22 THR 497 -7.358 1.733 4.641 203 HG23 THR 497 HG23 THR 497 -8.104 3.329 4.703 204 H THR 498 HN THR 498 -11.157 0.206 7.638 205 HA THR 498 HA THR 498 -12.185 -0.976 5.179 206 HB THR 498 HB THR 498 -13.985 -0.673 7.501 207 HG1 THR 498 HG1 THR 498 -12.089 -2.744 7.702 208 HG21 THR 498 HG21 THR 498 -14.456 -3.040 6.934 209 HG22 THR 498 HG22 THR 498 -13.210 -2.952 5.685 210 HG23 THR 498 HG23 THR 498 -14.656 -1.949 5.561 211 H LEU 499 HN LEU 499 -13.429 0.141 3.806 212 HA LEU 499 HA LEU 499 -14.283 2.822 4.668 213 HB2 LEU 499 HB2 LEU 499 -13.609 1.855 1.886 214 HB3 LEU 499 HB1 LEU 499 -14.149 3.472 2.297 215 HG LEU 499 HG LEU 499 -11.546 2.202 3.153 216 HD11 LEU 499 HD11 LEU 499 -12.136 4.420 1.205 217 HD12 LEU 499 HD12 LEU 499 -11.569 2.798 0.805 218 HD13 LEU 499 HD13 LEU 499 -10.530 3.896 1.713 219 HD21 LEU 499 HD21 LEU 499 -12.372 3.697 4.878 220 HD22 LEU 499 HD22 LEU 499 -12.640 4.962 3.679 221 HD23 LEU 499 HD23 LEU 499 -11.000 4.424 4.044 222 H GLU 500 HN GLU 500 -16.375 3.037 4.916 223 HA GLU 500 HA GLU 500 -18.172 1.198 3.529 224 HB2 GLU 500 HB2 GLU 500 -18.687 3.107 5.813 225 HB3 GLU 500 HB1 GLU 500 -19.893 2.046 5.100 226 HG2 GLU 500 HG2 GLU 500 -18.509 0.106 5.756 227 HG3 GLU 500 HG1 GLU 500 -17.403 1.214 6.566 228 H ALA 501 HN ALA 501 -19.940 1.926 2.358 229 HA ALA 501 HA ALA 501 -20.066 4.776 1.713 230 HB1 ALA 501 HB1 ALA 501 -19.943 2.531 -0.303 231 HB2 ALA 501 HB2 ALA 501 -18.718 3.774 -0.043 232 HB3 ALA 501 HB3 ALA 501 -20.301 4.217 -0.685 233 H GLY 502 HN GLY 502 -22.136 5.147 0.361 234 HA2 GLY 502 HA2 GLY 502 -24.304 4.032 1.883 235 HA3 GLY 502 HA1 GLY 502 -24.433 5.236 0.610 236 H GLY 503 HN GLY 503 -23.557 1.806 0.969 237 HA2 GLY 503 HA2 GLY 503 -25.471 0.472 -0.258 238 HA3 GLY 503 HA1 GLY 503 -24.734 1.254 -1.648 239 H ILE 504 HN ILE 504 -22.073 1.116 -1.105 240 HA ILE 504 HA ILE 504 -21.614 -1.797 -0.981 241 HB ILE 504 HB ILE 504 -20.140 0.211 -2.698 242 HG12 ILE 504 HG12 ILE 504 -22.040 -2.009 -3.490 243 HG13 ILE 504 HG11 ILE 504 -22.429 -0.292 -3.496 244 HG21 ILE 504 HG21 ILE 504 -18.685 -1.584 -1.932 245 HG22 ILE 504 HG22 ILE 504 -19.018 -1.750 -3.656 246 HG23 ILE 504 HG23 ILE 504 -19.846 -2.786 -2.493 247 HD11 ILE 504 HD11 ILE 504 -20.730 0.089 -5.200 248 HD12 ILE 504 HD12 ILE 504 -21.921 -1.099 -5.729 249 HD13 ILE 504 HD13 ILE 504 -20.328 -1.628 -5.187 250 H THR 505 HN THR 505 -20.335 -2.416 0.618 251 HA THR 505 HA THR 505 -18.354 -0.497 1.659 252 HB THR 505 HB THR 505 -18.620 -1.533 3.863 253 HG1 THR 505 HG1 THR 505 -19.291 -3.607 3.339 254 HG21 THR 505 HG21 THR 505 -20.032 0.394 3.328 255 HG22 THR 505 HG22 THR 505 -20.869 -0.725 4.403 256 HG23 THR 505 HG23 THR 505 -21.268 -0.687 2.686 257 H GLY 506 HN GLY 506 -16.351 -1.513 2.516 258 HA2 GLY 506 HA2 GLY 506 -15.826 -4.266 2.138 259 HA3 GLY 506 HA1 GLY 506 -15.272 -3.371 0.733 260 H GLU 507 HN GLU 507 -13.424 -4.731 2.061 261 HA GLU 507 HA GLU 507 -12.112 -2.982 3.976 262 HB2 GLU 507 HB2 GLU 507 -11.326 -5.662 2.846 263 HB3 GLU 507 HB1 GLU 507 -10.395 -4.779 4.045 264 HG2 GLU 507 HG2 GLU 507 -12.349 -4.885 5.563 265 HG3 GLU 507 HG1 GLU 507 -13.168 -5.897 4.372 266 H TYR 508 HN TYR 508 -10.206 -1.921 3.636 267 HA TYR 508 HA TYR 508 -9.108 -1.963 0.913 268 HB2 TYR 508 HB2 TYR 508 -10.006 0.479 2.444 269 HB3 TYR 508 HB1 TYR 508 -8.942 0.555 1.041 270 HD1 TYR 508 HD1 TYR 508 -12.327 -0.422 2.168 271 HD2 TYR 508 HD2 TYR 508 -9.815 0.415 -1.157 272 HE1 TYR 508 HE1 TYR 508 -14.288 -0.435 0.697 273 HE2 TYR 508 HE2 TYR 508 -11.773 0.416 -2.641 274 HH TYR 508 HH TYR 508 -15.004 0.378 -1.430 275 H LEU 509 HN LEU 509 -7.070 -1.508 0.684 276 HA LEU 509 HA LEU 509 -5.306 -1.928 2.863 277 HB2 LEU 509 HB2 LEU 509 -4.711 -2.834 0.790 278 HB3 LEU 509 HB1 LEU 509 -5.111 -1.371 -0.069 279 HG LEU 509 HG LEU 509 -2.751 -1.450 1.776 280 HD11 LEU 509 HD11 LEU 509 -1.391 -2.135 -0.117 281 HD12 LEU 509 HD12 LEU 509 -2.832 -2.239 -1.132 282 HD13 LEU 509 HD13 LEU 509 -2.620 -3.356 0.216 283 HD21 LEU 509 HD21 LEU 509 -2.921 0.023 -0.801 284 HD22 LEU 509 HD22 LEU 509 -2.067 0.441 0.689 285 HD23 LEU 509 HD23 LEU 509 -3.815 0.643 0.587 286 H MET 510 HN MET 510 -4.090 -0.456 3.974 287 HA MET 510 HA MET 510 -4.554 2.373 3.322 288 HB2 MET 510 HB2 MET 510 -5.068 1.083 5.692 289 HB3 MET 510 HB1 MET 510 -3.463 1.744 5.977 290 HG2 MET 510 HG2 MET 510 -4.250 3.970 5.446 291 HG3 MET 510 HG1 MET 510 -5.848 3.337 5.073 292 HE1 MET 510 HE1 MET 510 -7.037 5.001 6.679 293 HE2 MET 510 HE2 MET 510 -5.484 5.744 7.064 294 HE3 MET 510 HE3 MET 510 -6.578 5.261 8.361 295 H LEU 511 HN LEU 511 -2.869 3.264 2.347 296 HA LEU 511 HA LEU 511 -0.175 2.379 3.147 297 HB2 LEU 511 HB2 LEU 511 -1.391 2.432 0.564 298 HB3 LEU 511 HB1 LEU 511 -0.092 3.603 0.592 299 HG LEU 511 HG LEU 511 0.457 0.863 1.622 300 HD11 LEU 511 HD11 LEU 511 0.927 0.031 -0.558 301 HD12 LEU 511 HD12 LEU 511 0.529 1.581 -1.294 302 HD13 LEU 511 HD13 LEU 511 -0.737 0.609 -0.553 303 HD21 LEU 511 HD21 LEU 511 2.121 2.640 1.811 304 HD22 LEU 511 HD22 LEU 511 2.048 2.890 0.067 305 HD23 LEU 511 HD23 LEU 511 2.656 1.367 0.715 306 H THR 512 HN THR 512 1.464 3.931 3.200 307 HA THR 512 HA THR 512 0.526 6.717 3.227 308 HB THR 512 HB THR 512 2.714 6.262 5.068 309 HG1 THR 512 HG1 THR 512 1.793 4.225 5.413 310 HG21 THR 512 HG21 THR 512 -0.111 7.264 5.426 311 HG22 THR 512 HG22 THR 512 1.301 8.251 5.049 312 HG23 THR 512 HG23 THR 512 1.188 7.427 6.605 313 H TYR 513 HN TYR 513 1.662 7.971 1.927 314 HA TYR 513 HA TYR 513 4.334 7.072 1.117 315 HB2 TYR 513 HB2 TYR 513 2.320 8.827 -0.276 316 HB3 TYR 513 HB1 TYR 513 3.999 8.712 -0.786 317 HD1 TYR 513 HD1 TYR 513 4.178 7.516 -2.722 318 HD2 TYR 513 HD2 TYR 513 1.445 6.163 0.241 319 HE1 TYR 513 HE1 TYR 513 3.648 5.564 -4.112 320 HE2 TYR 513 HE2 TYR 513 0.909 4.206 -1.145 321 HH TYR 513 HH TYR 513 2.783 3.296 -3.828 322 H ALA 514 HN ALA 514 5.338 9.445 0.135 323 HA ALA 514 HA ALA 514 6.270 10.740 2.438 324 HB1 ALA 514 HB1 ALA 514 7.445 10.736 0.275 325 HB2 ALA 514 HB2 ALA 514 7.258 12.361 0.936 326 HB3 ALA 514 HB3 ALA 514 6.214 11.816 -0.373 327 H ASN 515 HN ASN 515 5.832 12.771 3.305 328 HA ASN 515 HA ASN 515 4.538 14.445 4.118 329 HB2 ASN 515 HB2 ASN 515 4.598 15.151 1.669 330 HB3 ASN 515 HB1 ASN 515 3.015 14.400 1.507 331 HD21 ASN 515 HD21 ASN 515 1.977 16.311 1.029 332 HD22 ASN 515 HD22 ASN 515 1.723 17.558 2.200 333 H ASP 516 HN ASP 516 3.790 11.604 4.314 334 HA ASP 516 HA ASP 516 2.188 10.298 5.221 335 HB2 ASP 516 HB2 ASP 516 1.315 13.010 6.171 336 HB3 ASP 516 HB1 ASP 516 0.402 11.565 6.584 337 H ALA 517 HN ALA 517 1.826 11.207 2.471 338 HA ALA 517 HA ALA 517 -0.917 11.682 1.962 339 HB1 ALA 517 HB1 ALA 517 -0.399 11.104 -0.344 340 HB2 ALA 517 HB2 ALA 517 1.155 10.440 0.158 341 HB3 ALA 517 HB3 ALA 517 0.840 12.166 0.325 342 H LYS 518 HN LYS 518 -2.602 10.321 1.754 343 HA LYS 518 HA LYS 518 -2.130 7.583 2.662 344 HB2 LYS 518 HB2 LYS 518 -4.661 9.229 2.529 345 HB3 LYS 518 HB1 LYS 518 -4.574 7.579 3.126 346 HG2 LYS 518 HG2 LYS 518 -3.008 9.852 4.315 347 HG3 LYS 518 HG1 LYS 518 -4.606 9.367 4.881 348 HD2 LYS 518 HD2 LYS 518 -3.748 7.130 5.384 349 HD3 LYS 518 HD1 LYS 518 -2.152 7.609 4.802 350 HE2 LYS 518 HE2 LYS 518 -1.960 9.256 6.555 351 HE3 LYS 518 HE1 LYS 518 -3.605 8.925 7.092 352 HZ1 LYS 518 HZ1 LYS 518 -1.840 7.855 8.445 353 HZ2 LYS 518 HZ2 LYS 518 -1.434 6.903 7.110 354 HZ3 LYS 518 HZ3 LYS 518 -2.965 6.764 7.810 355 H LEU 519 HN LEU 519 -2.597 5.832 1.505 356 HA LEU 519 HA LEU 519 -3.958 6.185 -1.085 357 HB2 LEU 519 HB2 LEU 519 -1.606 5.733 -1.448 358 HB3 LEU 519 HB1 LEU 519 -1.661 4.367 -0.357 359 HG LEU 519 HG LEU 519 -3.063 3.129 -1.931 360 HD11 LEU 519 HD11 LEU 519 -3.450 4.035 -4.191 361 HD12 LEU 519 HD12 LEU 519 -2.795 5.588 -3.664 362 HD13 LEU 519 HD13 LEU 519 -4.281 4.966 -2.944 363 HD21 LEU 519 HD21 LEU 519 -0.639 2.967 -2.089 364 HD22 LEU 519 HD22 LEU 519 -0.622 4.306 -3.237 365 HD23 LEU 519 HD23 LEU 519 -1.411 2.784 -3.664 366 H TYR 520 HN TYR 520 -5.783 5.031 -1.292 367 HA TYR 520 HA TYR 520 -6.221 2.791 0.572 368 HB2 TYR 520 HB2 TYR 520 -8.332 4.537 -0.711 369 HB3 TYR 520 HB1 TYR 520 -8.593 3.293 0.503 370 HD1 TYR 520 HD1 TYR 520 -7.831 6.753 -0.075 371 HD2 TYR 520 HD2 TYR 520 -7.601 3.637 2.805 372 HE1 TYR 520 HE1 TYR 520 -7.540 8.425 1.703 373 HE2 TYR 520 HE2 TYR 520 -7.314 5.302 4.593 374 HH TYR 520 HH TYR 520 -7.871 8.626 4.115 375 H VAL 521 HN VAL 521 -6.222 0.883 -0.372 376 HA VAL 521 HA VAL 521 -6.898 0.722 -3.236 377 HB VAL 521 HB VAL 521 -4.674 -0.718 -1.771 378 HG11 VAL 521 HG11 VAL 521 -4.012 -1.479 -4.087 379 HG12 VAL 521 HG12 VAL 521 -5.617 -0.966 -4.628 380 HG13 VAL 521 HG13 VAL 521 -5.461 -2.250 -3.424 381 HG21 VAL 521 HG21 VAL 521 -3.212 0.602 -3.187 382 HG22 VAL 521 HG22 VAL 521 -4.263 1.640 -2.224 383 HG23 VAL 521 HG23 VAL 521 -4.608 1.375 -3.933 384 HA PRO 522 HA PRO 522 -9.941 -2.145 -1.793 385 HB2 PRO 522 HB2 PRO 522 -10.497 -3.259 -4.248 386 HB3 PRO 522 HB1 PRO 522 -11.189 -1.745 -3.661 387 HG2 PRO 522 HG2 PRO 522 -8.919 -2.194 -5.541 388 HG3 PRO 522 HG1 PRO 522 -10.180 -0.950 -5.578 389 HD2 PRO 522 HD2 PRO 522 -7.663 -0.450 -4.728 390 HD3 PRO 522 HD1 PRO 522 -9.075 0.388 -4.060 391 H VAL 523 HN VAL 523 -9.954 -4.236 -1.146 392 HA VAL 523 HA VAL 523 -7.539 -5.710 -1.336 393 HB VAL 523 HB VAL 523 -8.790 -7.532 -0.157 394 HG11 VAL 523 HG11 VAL 523 -7.572 -5.796 1.055 395 HG12 VAL 523 HG12 VAL 523 -9.020 -6.288 1.933 396 HG13 VAL 523 HG13 VAL 523 -9.006 -4.769 1.037 397 HG21 VAL 523 HG21 VAL 523 -11.014 -7.077 -1.087 398 HG22 VAL 523 HG22 VAL 523 -11.061 -5.544 -0.219 399 HG23 VAL 523 HG23 VAL 523 -11.034 -7.062 0.676 400 H SER 524 HN SER 524 -10.005 -5.402 -3.529 401 HA SER 524 HA SER 524 -9.796 -8.064 -4.645 402 HB2 SER 524 HB2 SER 524 -11.931 -6.842 -4.733 403 HB3 SER 524 HB1 SER 524 -11.167 -5.576 -5.688 404 HG SER 524 HG SER 524 -10.789 -8.041 -6.779 405 H SER 525 HN SER 525 -7.967 -5.245 -4.748 406 HA SER 525 HA SER 525 -6.898 -5.887 -7.420 407 HB2 SER 525 HB2 SER 525 -6.824 -3.224 -5.981 408 HB3 SER 525 HB1 SER 525 -6.273 -3.544 -7.626 409 HG SER 525 HG SER 525 -8.274 -2.830 -7.964 410 H LEU 526 HN LEU 526 -6.119 -7.054 -4.822 411 HA LEU 526 HA LEU 526 -3.737 -5.764 -3.916 412 HB2 LEU 526 HB2 LEU 526 -4.913 -8.461 -3.333 413 HB3 LEU 526 HB1 LEU 526 -3.481 -7.843 -2.541 414 HG LEU 526 HG LEU 526 -6.245 -6.641 -2.393 415 HD11 LEU 526 HD11 LEU 526 -6.177 -7.362 -0.054 416 HD12 LEU 526 HD12 LEU 526 -4.625 -8.146 -0.343 417 HD13 LEU 526 HD13 LEU 526 -6.073 -8.730 -1.160 418 HD21 LEU 526 HD21 LEU 526 -5.269 -5.172 -0.685 419 HD22 LEU 526 HD22 LEU 526 -4.526 -4.928 -2.266 420 HD23 LEU 526 HD23 LEU 526 -3.676 -5.852 -1.028 421 H HIS 527 HN HIS 527 -4.374 -8.093 -6.393 422 HA HIS 527 HA HIS 527 -1.776 -9.327 -6.287 423 HB2 HIS 527 HB2 HIS 527 -3.982 -9.441 -8.339 424 HB3 HIS 527 HB1 HIS 527 -2.442 -10.263 -8.555 425 HD1 HIS 527 HD1 HIS 527 -2.344 -12.583 -7.679 426 HD2 HIS 527 HD2 HIS 527 -5.344 -10.353 -5.871 427 HE1 HIS 527 HE1 HIS 527 -3.564 -14.186 -6.173 428 HE2 HIS 527 HE2 HIS 527 -5.475 -12.848 -5.218 429 H LEU 528 HN LEU 528 -2.868 -6.368 -7.403 430 HA LEU 528 HA LEU 528 -0.988 -6.079 -9.573 431 HB2 LEU 528 HB2 LEU 528 -2.471 -3.923 -8.067 432 HB3 LEU 528 HB1 LEU 528 -1.694 -3.769 -9.626 433 HG LEU 528 HG LEU 528 -4.134 -5.450 -9.060 434 HD11 LEU 528 HD11 LEU 528 -3.824 -2.811 -10.487 435 HD12 LEU 528 HD12 LEU 528 -4.598 -3.064 -8.923 436 HD13 LEU 528 HD13 LEU 528 -5.311 -3.756 -10.381 437 HD21 LEU 528 HD21 LEU 528 -4.247 -5.659 -11.503 438 HD22 LEU 528 HD22 LEU 528 -2.779 -6.385 -10.848 439 HD23 LEU 528 HD23 LEU 528 -2.708 -4.811 -11.639 440 H ILE 529 HN ILE 529 -0.944 -5.863 -6.184 441 HA ILE 529 HA ILE 529 1.108 -3.800 -6.072 442 HB ILE 529 HB ILE 529 0.012 -5.258 -3.689 443 HG12 ILE 529 HG12 ILE 529 -1.894 -4.511 -5.156 444 HG13 ILE 529 HG11 ILE 529 -1.875 -3.789 -3.555 445 HG21 ILE 529 HG21 ILE 529 1.889 -3.723 -3.352 446 HG22 ILE 529 HG22 ILE 529 0.427 -3.119 -2.572 447 HG23 ILE 529 HG23 ILE 529 0.962 -2.420 -4.100 448 HD11 ILE 529 HD11 ILE 529 -1.130 -1.710 -4.402 449 HD12 ILE 529 HD12 ILE 529 -2.456 -2.250 -5.433 450 HD13 ILE 529 HD13 ILE 529 -0.790 -2.408 -5.990 451 H SER 530 HN SER 530 3.176 -4.124 -5.262 452 HA SER 530 HA SER 530 3.953 -6.877 -4.613 453 HB2 SER 530 HB2 SER 530 5.273 -5.029 -6.609 454 HB3 SER 530 HB1 SER 530 6.072 -6.453 -5.959 455 HG SER 530 HG SER 530 3.594 -7.076 -6.823 456 H ARG 531 HN ARG 531 6.342 -6.769 -3.657 457 HA ARG 531 HA ARG 531 6.544 -4.317 -2.061 458 HB2 ARG 531 HB2 ARG 531 6.504 -5.352 -0.012 459 HB3 ARG 531 HB1 ARG 531 5.367 -6.355 -0.894 460 HG2 ARG 531 HG2 ARG 531 8.271 -7.034 -0.489 461 HG3 ARG 531 HG1 ARG 531 6.958 -7.608 0.536 462 HD2 ARG 531 HD2 ARG 531 5.934 -8.677 -1.446 463 HD3 ARG 531 HD1 ARG 531 7.328 -8.168 -2.401 464 HE ARG 531 HE ARG 531 7.980 -9.708 -0.046 465 HH11 ARG 531 HH11 ARG 531 7.215 -9.833 -3.460 466 HH12 ARG 531 HH12 ARG 531 7.981 -11.367 -3.702 467 HH21 ARG 531 HH21 ARG 531 8.974 -11.726 -0.360 468 HH22 ARG 531 HH22 ARG 531 8.979 -12.446 -1.940 469 H TYR 532 HN TYR 532 8.611 -3.996 -1.033 470 HA TYR 532 HA TYR 532 10.796 -4.726 -2.716 471 HB2 TYR 532 HB2 TYR 532 10.381 -3.013 -0.344 472 HB3 TYR 532 HB1 TYR 532 12.003 -3.672 -0.530 473 HD1 TYR 532 HD1 TYR 532 13.474 -2.862 -2.188 474 HD2 TYR 532 HD2 TYR 532 9.423 -1.541 -2.137 475 HE1 TYR 532 HE1 TYR 532 14.031 -1.110 -3.814 476 HE2 TYR 532 HE2 TYR 532 9.977 0.212 -3.770 477 HH TYR 532 HH TYR 532 12.993 0.287 -5.436 478 H ALA 533 HN ALA 533 10.956 -6.942 -2.675 479 HA ALA 533 HA ALA 533 11.102 -8.464 -0.278 480 HB1 ALA 533 HB1 ALA 533 11.719 -10.320 -1.718 481 HB2 ALA 533 HB2 ALA 533 11.998 -9.209 -3.059 482 HB3 ALA 533 HB3 ALA 533 10.369 -9.424 -2.416 483 H GLY 534 HN GLY 534 12.732 -8.292 1.122 484 HA2 GLY 534 HA2 GLY 534 15.204 -9.175 0.958 485 HA3 GLY 534 HA1 GLY 534 15.400 -7.635 0.138 486 H GLY 535 HN GLY 535 16.976 -7.400 1.943 487 HA2 GLY 535 HA2 GLY 535 15.740 -6.745 4.517 488 HA3 GLY 535 HA1 GLY 535 17.460 -6.935 4.211 489 H ALA 536 HN ALA 536 16.221 -5.148 1.744 490 HA ALA 536 HA ALA 536 17.284 -2.683 2.836 491 HB1 ALA 536 HB1 ALA 536 17.018 -1.803 0.578 492 HB2 ALA 536 HB2 ALA 536 16.145 -3.260 0.099 493 HB3 ALA 536 HB3 ALA 536 17.850 -3.358 0.542 494 H GLU 537 HN GLU 537 15.127 -3.367 4.281 495 HA GLU 537 HA GLU 537 12.638 -2.463 3.241 496 HB2 GLU 537 HB2 GLU 537 13.446 -2.867 6.125 497 HB3 GLU 537 HB1 GLU 537 11.804 -2.772 5.506 498 HG2 GLU 537 HG2 GLU 537 12.157 -4.824 4.235 499 HG3 GLU 537 HG1 GLU 537 13.805 -4.921 4.856 500 H GLU 538 HN GLU 538 14.913 -1.089 5.601 501 HA GLU 538 HA GLU 538 13.384 1.337 5.822 502 HB2 GLU 538 HB2 GLU 538 14.682 0.343 7.708 503 HB3 GLU 538 HB1 GLU 538 16.163 0.735 6.847 504 HG2 GLU 538 HG2 GLU 538 15.599 3.107 6.957 505 HG3 GLU 538 HG1 GLU 538 14.115 2.712 7.823 506 H ASN 539 HN ASN 539 16.080 0.198 3.974 507 HA ASN 539 HA ASN 539 17.101 2.787 3.286 508 HB2 ASN 539 HB2 ASN 539 18.479 0.693 3.347 509 HB3 ASN 539 HB1 ASN 539 17.627 0.148 1.905 510 HD21 ASN 539 HD21 ASN 539 19.905 2.420 3.206 511 HD22 ASN 539 HD22 ASN 539 20.550 2.948 1.691 512 H ALA 540 HN ALA 540 14.575 0.803 2.126 513 HA ALA 540 HA ALA 540 14.433 1.479 -0.572 514 HB1 ALA 540 HB1 ALA 540 13.080 -0.272 0.479 515 HB2 ALA 540 HB2 ALA 540 12.086 0.860 -0.437 516 HB3 ALA 540 HB3 ALA 540 12.144 0.961 1.323 517 HA PRO 541 HA PRO 541 13.305 5.762 -0.515 518 HB2 PRO 541 HB2 PRO 541 12.477 6.036 -3.045 519 HB3 PRO 541 HB1 PRO 541 14.172 5.690 -2.669 520 HG2 PRO 541 HG2 PRO 541 12.003 3.798 -3.520 521 HG3 PRO 541 HG1 PRO 541 13.661 3.928 -4.127 522 HD2 PRO 541 HD2 PRO 541 12.909 2.080 -2.284 523 HD3 PRO 541 HD1 PRO 541 14.542 2.776 -2.339 524 H LEU 542 HN LEU 542 11.421 7.209 -1.058 525 HA LEU 542 HA LEU 542 8.861 5.779 -0.912 526 HB2 LEU 542 HB2 LEU 542 9.966 7.172 1.202 527 HB3 LEU 542 HB1 LEU 542 8.880 8.344 0.483 528 HG LEU 542 HG LEU 542 8.143 5.621 1.549 529 HD11 LEU 542 HD11 LEU 542 6.795 6.899 3.134 530 HD12 LEU 542 HD12 LEU 542 7.406 8.400 2.442 531 HD13 LEU 542 HD13 LEU 542 8.507 7.298 3.268 532 HD21 LEU 542 HD21 LEU 542 5.887 6.070 0.936 533 HD22 LEU 542 HD22 LEU 542 6.889 6.209 -0.506 534 HD23 LEU 542 HD23 LEU 542 6.316 7.661 0.313 535 H HIS 543 HN HIS 543 7.449 6.411 -2.369 536 HA HIS 543 HA HIS 543 7.946 8.789 -3.989 537 HB2 HIS 543 HB2 HIS 543 7.246 6.362 -4.766 538 HB3 HIS 543 HB1 HIS 543 5.630 6.915 -4.351 539 HD1 HIS 543 HD1 HIS 543 7.869 6.731 -7.122 540 HD2 HIS 543 HD2 HIS 543 5.046 9.471 -5.814 541 HE1 HIS 543 HE1 HIS 543 7.264 8.085 -9.149 542 HE2 HIS 543 HE2 HIS 543 5.663 9.835 -8.301 543 H LYS 544 HN LYS 544 6.023 10.254 -4.434 544 HA LYS 544 HA LYS 544 4.223 10.339 -2.103 545 HB2 LYS 544 HB2 LYS 544 4.156 12.749 -2.252 546 HB3 LYS 544 HB1 LYS 544 5.825 12.224 -2.129 547 HG2 LYS 544 HG2 LYS 544 6.120 12.554 -4.521 548 HG3 LYS 544 HG1 LYS 544 4.435 13.064 -4.661 549 HD2 LYS 544 HD2 LYS 544 4.889 14.927 -3.125 550 HD3 LYS 544 HD1 LYS 544 6.578 14.425 -3.028 551 HE2 LYS 544 HE2 LYS 544 6.321 16.264 -4.594 552 HE3 LYS 544 HE1 LYS 544 6.825 14.799 -5.432 553 HZ1 LYS 544 HZ1 LYS 544 4.039 15.818 -5.294 554 HZ2 LYS 544 HZ2 LYS 544 4.559 14.455 -6.148 555 HZ3 LYS 544 HZ3 LYS 544 5.078 15.992 -6.617 556 H LEU 545 HN LEU 545 2.085 11.275 -2.524 557 HA LEU 545 HA LEU 545 1.268 11.209 -5.318 558 HB2 LEU 545 HB2 LEU 545 -0.690 9.815 -4.798 559 HB3 LEU 545 HB1 LEU 545 0.828 8.970 -4.607 560 HG LEU 545 HG LEU 545 0.536 9.601 -2.078 561 HD11 LEU 545 HD11 LEU 545 -1.762 9.691 -1.352 562 HD12 LEU 545 HD12 LEU 545 -2.326 9.607 -3.020 563 HD13 LEU 545 HD13 LEU 545 -1.444 11.029 -2.461 564 HD21 LEU 545 HD21 LEU 545 -1.114 7.472 -3.420 565 HD22 LEU 545 HD22 LEU 545 -0.601 7.488 -1.731 566 HD23 LEU 545 HD23 LEU 545 0.597 7.351 -3.017 567 H GLY 546 HN GLY 546 -1.070 11.954 -5.525 568 HA2 GLY 546 HA2 GLY 546 -2.597 13.319 -3.809 569 HA3 GLY 546 HA1 GLY 546 -1.253 14.435 -4.018 570 H GLY 547 HN GLY 547 -0.894 13.450 -6.808 571 HA2 GLY 547 HA2 GLY 547 -2.992 13.588 -8.494 572 HA3 GLY 547 HA1 GLY 547 -2.741 15.276 -8.068 Start of MODEL 9 1 H1 ARG 472 HT1 ARG 472 1.220 -11.764 -6.750 2 H2 ARG 472 HT2 ARG 472 0.839 -13.126 -5.830 3 H3 ARG 472 HT3 ARG 472 2.448 -12.632 -5.978 4 HA ARG 472 HA ARG 472 1.593 -12.031 -3.831 5 HB2 ARG 472 HB2 ARG 472 3.260 -10.562 -4.811 6 HB3 ARG 472 HB1 ARG 472 2.024 -9.705 -5.717 7 HG2 ARG 472 HG2 ARG 472 2.736 -8.402 -3.811 8 HG3 ARG 472 HG1 ARG 472 1.052 -8.894 -3.621 9 HD2 ARG 472 HD2 ARG 472 2.245 -9.147 -1.526 10 HD3 ARG 472 HD1 ARG 472 1.764 -10.722 -2.152 11 HE ARG 472 HE ARG 472 4.418 -9.962 -2.939 12 HH11 ARG 472 HH11 ARG 472 2.521 -11.462 -0.401 13 HH12 ARG 472 HH12 ARG 472 3.872 -12.327 0.262 14 HH21 ARG 472 HH21 ARG 472 6.190 -11.104 -2.053 15 HH22 ARG 472 HH22 ARG 472 5.942 -12.131 -0.675 16 H ASN 473 HN ASN 473 -0.337 -12.145 -2.911 17 HA ASN 473 HA ASN 473 -2.472 -10.406 -3.963 18 HB2 ASN 473 HB2 ASN 473 -4.104 -11.952 -3.100 19 HB3 ASN 473 HB1 ASN 473 -2.958 -12.860 -4.078 20 HD21 ASN 473 HD21 ASN 473 -4.747 -13.744 -1.955 21 HD22 ASN 473 HD22 ASN 473 -3.747 -14.492 -0.760 22 H LEU 474 HN LEU 474 -0.224 -10.082 -1.910 23 HA LEU 474 HA LEU 474 0.129 -8.999 0.063 24 HB2 LEU 474 HB2 LEU 474 -2.670 -8.017 -0.459 25 HB3 LEU 474 HB1 LEU 474 -1.570 -7.336 0.722 26 HG LEU 474 HG LEU 474 -1.393 -7.218 -2.273 27 HD11 LEU 474 HD11 LEU 474 -0.909 -4.784 -1.579 28 HD12 LEU 474 HD12 LEU 474 -1.601 -5.262 -0.030 29 HD13 LEU 474 HD13 LEU 474 -2.558 -5.390 -1.505 30 HD21 LEU 474 HD21 LEU 474 0.838 -6.151 -1.950 31 HD22 LEU 474 HD22 LEU 474 0.801 -7.882 -1.640 32 HD23 LEU 474 HD23 LEU 474 0.824 -6.750 -0.292 33 H ALA 475 HN ALA 475 -2.193 -8.400 1.939 34 HA ALA 475 HA ALA 475 -3.180 -9.307 3.768 35 HB1 ALA 475 HB1 ALA 475 -2.924 -11.984 2.404 36 HB2 ALA 475 HB2 ALA 475 -4.273 -10.867 2.200 37 HB3 ALA 475 HB3 ALA 475 -3.957 -11.588 3.777 38 H GLU 476 HN GLU 476 -0.556 -11.432 2.622 39 HA GLU 476 HA GLU 476 0.463 -11.833 5.286 40 HB2 GLU 476 HB2 GLU 476 1.531 -12.535 2.554 41 HB3 GLU 476 HB1 GLU 476 2.384 -12.912 4.046 42 HG2 GLU 476 HG2 GLU 476 -0.380 -13.862 3.334 43 HG3 GLU 476 HG1 GLU 476 1.098 -14.815 3.197 44 H LEU 477 HN LEU 477 0.170 -9.143 4.413 45 HA LEU 477 HA LEU 477 2.798 -8.060 3.915 46 HB2 LEU 477 HB2 LEU 477 0.037 -6.979 4.229 47 HB3 LEU 477 HB1 LEU 477 1.395 -5.886 4.420 48 HG LEU 477 HG LEU 477 0.909 -7.553 1.954 49 HD11 LEU 477 HD11 LEU 477 0.196 -4.688 2.557 50 HD12 LEU 477 HD12 LEU 477 -0.927 -6.012 2.242 51 HD13 LEU 477 HD13 LEU 477 0.135 -5.429 0.960 52 HD21 LEU 477 HD21 LEU 477 2.484 -5.976 0.937 53 HD22 LEU 477 HD22 LEU 477 3.226 -6.865 2.268 54 HD23 LEU 477 HD23 LEU 477 2.704 -5.195 2.503 55 H HIS 478 HN HIS 478 3.879 -6.619 5.332 56 HA HIS 478 HA HIS 478 3.243 -7.041 8.175 57 HB2 HIS 478 HB2 HIS 478 5.855 -6.364 6.803 58 HB3 HIS 478 HB1 HIS 478 5.638 -6.323 8.549 59 HD1 HIS 478 HD1 HIS 478 5.874 -8.489 9.783 60 HD2 HIS 478 HD2 HIS 478 5.620 -9.017 5.669 61 HE1 HIS 478 HE1 HIS 478 6.373 -10.918 9.381 62 HE2 HIS 478 HE2 HIS 478 6.038 -11.249 6.910 63 H ILE 479 HN ILE 479 3.245 -5.258 9.568 64 HA ILE 479 HA ILE 479 2.287 -2.838 8.378 65 HB ILE 479 HB ILE 479 3.053 -3.286 11.269 66 HG12 ILE 479 HG12 ILE 479 1.452 -5.000 10.584 67 HG13 ILE 479 HG11 ILE 479 0.681 -3.838 11.655 68 HG21 ILE 479 HG21 ILE 479 1.154 -1.317 10.000 69 HG22 ILE 479 HG22 ILE 479 2.764 -0.949 10.624 70 HG23 ILE 479 HG23 ILE 479 1.487 -1.475 11.725 71 HD11 ILE 479 HD11 ILE 479 -0.348 -2.753 9.723 72 HD12 ILE 479 HD12 ILE 479 -0.788 -4.456 9.836 73 HD13 ILE 479 HD13 ILE 479 0.418 -3.933 8.660 74 H GLY 480 HN GLY 480 3.355 -0.967 8.001 75 HA2 GLY 480 HA2 GLY 480 5.047 0.597 8.009 76 HA3 GLY 480 HA1 GLY 480 5.812 -0.305 9.311 77 H GLN 481 HN GLN 481 4.906 -1.732 6.274 78 HA GLN 481 HA GLN 481 7.742 -2.296 5.750 79 HB2 GLN 481 HB2 GLN 481 6.200 -4.213 6.206 80 HB3 GLN 481 HB1 GLN 481 5.287 -3.769 4.773 81 HG2 GLN 481 HG2 GLN 481 7.219 -4.213 3.378 82 HG3 GLN 481 HG1 GLN 481 8.175 -4.605 4.808 83 HE21 GLN 481 HE21 GLN 481 8.603 -6.673 4.218 84 HE22 GLN 481 HE22 GLN 481 7.403 -7.915 4.160 85 HA PRO 482 HA PRO 482 7.328 0.085 1.986 86 HB2 PRO 482 HB2 PRO 482 9.510 -0.822 0.669 87 HB3 PRO 482 HB1 PRO 482 9.619 0.306 2.025 88 HG2 PRO 482 HG2 PRO 482 10.038 -2.657 1.988 89 HG3 PRO 482 HG1 PRO 482 10.981 -1.405 2.817 90 HD2 PRO 482 HD2 PRO 482 9.129 -2.942 4.078 91 HD3 PRO 482 HD1 PRO 482 9.506 -1.281 4.572 92 H VAL 483 HN VAL 483 6.072 -0.269 0.293 93 HA VAL 483 HA VAL 483 6.278 -2.777 -1.208 94 HB VAL 483 HB VAL 483 3.802 -2.898 -1.427 95 HG11 VAL 483 HG11 VAL 483 3.356 -3.848 0.795 96 HG12 VAL 483 HG12 VAL 483 4.840 -3.108 1.394 97 HG13 VAL 483 HG13 VAL 483 4.917 -4.358 0.153 98 HG21 VAL 483 HG21 VAL 483 2.395 -1.696 0.186 99 HG22 VAL 483 HG22 VAL 483 3.251 -0.595 -0.894 100 HG23 VAL 483 HG23 VAL 483 3.816 -0.824 0.760 101 H VAL 484 HN VAL 484 4.913 -2.516 -3.321 102 HA VAL 484 HA VAL 484 5.140 0.281 -4.212 103 HB VAL 484 HB VAL 484 5.803 -0.489 -6.434 104 HG11 VAL 484 HG11 VAL 484 7.556 -1.589 -4.253 105 HG12 VAL 484 HG12 VAL 484 7.538 0.076 -4.831 106 HG13 VAL 484 HG13 VAL 484 8.068 -1.223 -5.901 107 HG21 VAL 484 HG21 VAL 484 4.733 -2.650 -6.438 108 HG22 VAL 484 HG22 VAL 484 5.869 -3.229 -5.218 109 HG23 VAL 484 HG23 VAL 484 6.446 -2.798 -6.827 110 H HIS 485 HN HIS 485 3.624 1.064 -5.550 111 HA HIS 485 HA HIS 485 1.207 -0.583 -5.957 112 HB2 HIS 485 HB2 HIS 485 1.046 1.402 -4.380 113 HB3 HIS 485 HB1 HIS 485 1.381 2.433 -5.756 114 HD1 HIS 485 HD1 HIS 485 -0.931 3.583 -5.418 115 HD2 HIS 485 HD2 HIS 485 -1.140 -0.465 -6.341 116 HE1 HIS 485 HE1 HIS 485 -3.327 3.146 -6.022 117 HE2 HIS 485 HE2 HIS 485 -3.456 0.677 -6.484 118 H LEU 486 HN LEU 486 0.696 -0.969 -8.023 119 HA LEU 486 HA LEU 486 2.324 -0.265 -10.149 120 HB2 LEU 486 HB2 LEU 486 0.818 -1.394 -11.554 121 HB3 LEU 486 HB1 LEU 486 0.732 -2.198 -10.007 122 HG LEU 486 HG LEU 486 -1.462 -2.188 -10.718 123 HD11 LEU 486 HD11 LEU 486 -2.723 -0.659 -9.324 124 HD12 LEU 486 HD12 LEU 486 -1.274 0.314 -9.067 125 HD13 LEU 486 HD13 LEU 486 -1.346 -1.338 -8.455 126 HD21 LEU 486 HD21 LEU 486 -2.626 -0.290 -11.724 127 HD22 LEU 486 HD22 LEU 486 -1.216 -0.784 -12.664 128 HD23 LEU 486 HD23 LEU 486 -1.138 0.653 -11.645 129 H GLU 487 HN GLU 487 0.016 1.691 -8.652 130 HA GLU 487 HA GLU 487 -0.516 3.344 -10.957 131 HB2 GLU 487 HB2 GLU 487 -1.287 3.546 -8.053 132 HB3 GLU 487 HB1 GLU 487 -1.692 4.784 -9.233 133 HG2 GLU 487 HG2 GLU 487 -2.473 1.911 -9.603 134 HG3 GLU 487 HG1 GLU 487 -3.468 3.052 -8.702 135 H HIS 488 HN HIS 488 1.152 3.829 -7.797 136 HA HIS 488 HA HIS 488 2.496 6.124 -9.063 137 HB2 HIS 488 HB2 HIS 488 1.091 5.958 -6.492 138 HB3 HIS 488 HB1 HIS 488 2.646 6.783 -6.436 139 HD1 HIS 488 HD1 HIS 488 2.267 9.218 -6.604 140 HD2 HIS 488 HD2 HIS 488 -0.319 7.083 -9.064 141 HE1 HIS 488 HE1 HIS 488 0.949 10.946 -7.869 142 HE2 HIS 488 HE2 HIS 488 -0.473 9.630 -9.476 143 H GLY 489 HN GLY 489 2.985 3.304 -7.028 144 HA2 GLY 489 HA2 GLY 489 5.185 2.284 -7.495 145 HA3 GLY 489 HA1 GLY 489 5.870 3.886 -7.301 146 H VAL 490 HN VAL 490 7.261 3.416 -5.701 147 HA VAL 490 HA VAL 490 6.833 1.679 -3.563 148 HB VAL 490 HB VAL 490 8.740 4.017 -3.583 149 HG11 VAL 490 HG11 VAL 490 8.488 2.930 -1.410 150 HG12 VAL 490 HG12 VAL 490 10.087 2.643 -2.095 151 HG13 VAL 490 HG13 VAL 490 8.866 1.372 -2.145 152 HG21 VAL 490 HG21 VAL 490 8.998 2.704 -5.621 153 HG22 VAL 490 HG22 VAL 490 9.150 1.233 -4.662 154 HG23 VAL 490 HG23 VAL 490 10.381 2.488 -4.550 155 H GLY 491 HN GLY 491 5.868 1.827 -1.684 156 HA2 GLY 491 HA2 GLY 491 5.468 4.427 -0.396 157 HA3 GLY 491 HA1 GLY 491 4.028 3.477 -0.755 158 H ARG 492 HN ARG 492 4.321 4.014 1.819 159 HA ARG 492 HA ARG 492 5.602 1.638 3.000 160 HB2 ARG 492 HB2 ARG 492 4.909 4.291 4.267 161 HB3 ARG 492 HB1 ARG 492 5.602 2.918 5.121 162 HG2 ARG 492 HG2 ARG 492 6.895 4.332 2.808 163 HG3 ARG 492 HG1 ARG 492 7.269 4.623 4.507 164 HD2 ARG 492 HD2 ARG 492 7.542 1.966 3.110 165 HD3 ARG 492 HD1 ARG 492 8.862 3.090 3.383 166 HE ARG 492 HE ARG 492 7.347 2.053 5.672 167 HH11 ARG 492 HH11 ARG 492 10.358 2.334 3.906 168 HH12 ARG 492 HH12 ARG 492 11.307 1.612 5.167 169 HH21 ARG 492 HH21 ARG 492 8.604 1.080 7.319 170 HH22 ARG 492 HH22 ARG 492 10.315 0.891 7.090 171 H TYR 493 HN TYR 493 4.341 0.106 3.717 172 HA TYR 493 HA TYR 493 1.493 0.379 3.567 173 HB2 TYR 493 HB2 TYR 493 2.660 -1.696 2.939 174 HB3 TYR 493 HB1 TYR 493 3.189 -1.902 4.602 175 HD1 TYR 493 HD1 TYR 493 0.127 -1.671 2.499 176 HD2 TYR 493 HD2 TYR 493 1.875 -3.082 6.111 177 HE1 TYR 493 HE1 TYR 493 -1.909 -2.955 2.985 178 HE2 TYR 493 HE2 TYR 493 -0.161 -4.362 6.606 179 HH TYR 493 HH TYR 493 -2.624 -4.863 4.290 180 H ALA 494 HN ALA 494 0.030 0.713 5.158 181 HA ALA 494 HA ALA 494 0.918 0.388 7.949 182 HB1 ALA 494 HB1 ALA 494 -0.124 2.508 8.573 183 HB2 ALA 494 HB2 ALA 494 -0.505 2.821 6.879 184 HB3 ALA 494 HB3 ALA 494 1.178 2.751 7.408 185 H GLY 495 HN GLY 495 -0.371 -1.405 8.262 186 HA2 GLY 495 HA2 GLY 495 -2.266 -2.571 8.803 187 HA3 GLY 495 HA1 GLY 495 -2.889 -1.011 9.306 188 H MET 496 HN MET 496 -4.961 -1.647 8.715 189 HA MET 496 HA MET 496 -5.564 -1.332 5.885 190 HB2 MET 496 HB2 MET 496 -6.189 -3.784 7.489 191 HB3 MET 496 HB1 MET 496 -7.297 -3.267 6.226 192 HG2 MET 496 HG2 MET 496 -5.620 -3.490 4.557 193 HG3 MET 496 HG1 MET 496 -4.375 -3.751 5.769 194 HE1 MET 496 HE1 MET 496 -8.019 -5.251 5.711 195 HE2 MET 496 HE2 MET 496 -7.750 -6.765 4.847 196 HE3 MET 496 HE3 MET 496 -7.552 -5.225 4.010 197 H THR 497 HN THR 497 -7.661 -0.666 5.464 198 HA THR 497 HA THR 497 -9.305 0.065 7.783 199 HB THR 497 HB THR 497 -8.006 2.060 7.181 200 HG1 THR 497 HG1 THR 497 -9.808 2.967 7.786 201 HG21 THR 497 HG21 THR 497 -8.374 3.160 5.003 202 HG22 THR 497 HG22 THR 497 -9.281 1.746 4.463 203 HG23 THR 497 HG23 THR 497 -7.564 1.601 4.846 204 H THR 498 HN THR 498 -11.513 -0.143 7.421 205 HA THR 498 HA THR 498 -12.251 -1.280 4.823 206 HB THR 498 HB THR 498 -14.285 -1.092 6.971 207 HG1 THR 498 HG1 THR 498 -13.328 -2.777 8.162 208 HG21 THR 498 HG21 THR 498 -13.343 -3.350 5.205 209 HG22 THR 498 HG22 THR 498 -14.680 -2.260 4.845 210 HG23 THR 498 HG23 THR 498 -14.783 -3.358 6.222 211 H LEU 499 HN LEU 499 -13.452 -0.166 3.379 212 HA LEU 499 HA LEU 499 -14.416 2.475 4.254 213 HB2 LEU 499 HB2 LEU 499 -13.523 1.600 1.507 214 HB3 LEU 499 HB1 LEU 499 -14.160 3.183 1.900 215 HG LEU 499 HG LEU 499 -11.559 1.998 2.875 216 HD11 LEU 499 HD11 LEU 499 -12.149 4.324 1.051 217 HD12 LEU 499 HD12 LEU 499 -11.509 2.755 0.562 218 HD13 LEU 499 HD13 LEU 499 -10.551 3.815 1.595 219 HD21 LEU 499 HD21 LEU 499 -11.173 4.170 3.940 220 HD22 LEU 499 HD22 LEU 499 -12.566 3.343 4.634 221 HD23 LEU 499 HD23 LEU 499 -12.806 4.672 3.503 222 H GLU 500 HN GLU 500 -16.514 2.377 4.596 223 HA GLU 500 HA GLU 500 -18.211 0.836 2.791 224 HB2 GLU 500 HB2 GLU 500 -18.620 0.577 5.193 225 HB3 GLU 500 HB1 GLU 500 -18.870 2.311 5.350 226 HG2 GLU 500 HG2 GLU 500 -20.838 2.171 3.933 227 HG3 GLU 500 HG1 GLU 500 -20.576 0.441 3.722 228 H ALA 501 HN ALA 501 -18.390 1.974 0.947 229 HA ALA 501 HA ALA 501 -19.069 4.821 1.109 230 HB1 ALA 501 HB1 ALA 501 -17.178 4.277 -0.310 231 HB2 ALA 501 HB2 ALA 501 -18.524 4.845 -1.298 232 HB3 ALA 501 HB3 ALA 501 -18.159 3.122 -1.212 233 H GLY 502 HN GLY 502 -20.762 5.596 -0.380 234 HA2 GLY 502 HA2 GLY 502 -23.126 3.998 -0.125 235 HA3 GLY 502 HA1 GLY 502 -23.010 5.577 -0.886 236 H GLY 503 HN GLY 503 -22.102 2.195 -1.415 237 HA2 GLY 503 HA2 GLY 503 -23.349 1.454 -3.598 238 HA3 GLY 503 HA1 GLY 503 -22.237 2.616 -4.310 239 H ILE 504 HN ILE 504 -19.932 2.180 -2.931 240 HA ILE 504 HA ILE 504 -19.320 -0.632 -3.583 241 HB ILE 504 HB ILE 504 -17.473 1.748 -3.878 242 HG12 ILE 504 HG12 ILE 504 -18.783 0.061 -6.024 243 HG13 ILE 504 HG11 ILE 504 -19.303 1.680 -5.566 244 HG21 ILE 504 HG21 ILE 504 -16.280 -0.291 -3.304 245 HG22 ILE 504 HG22 ILE 504 -15.966 0.152 -4.981 246 HG23 ILE 504 HG23 ILE 504 -17.090 -1.155 -4.611 247 HD11 ILE 504 HD11 ILE 504 -16.628 0.948 -6.735 248 HD12 ILE 504 HD12 ILE 504 -17.146 2.571 -6.277 249 HD13 ILE 504 HD13 ILE 504 -17.965 1.720 -7.589 250 H THR 505 HN THR 505 -19.089 -1.656 -1.703 251 HA THR 505 HA THR 505 -17.595 -0.309 0.448 252 HB THR 505 HB THR 505 -18.775 -1.790 2.019 253 HG1 THR 505 HG1 THR 505 -19.347 -3.571 0.872 254 HG21 THR 505 HG21 THR 505 -20.990 -0.777 1.864 255 HG22 THR 505 HG22 THR 505 -20.670 -0.311 0.194 256 HG23 THR 505 HG23 THR 505 -19.738 0.412 1.504 257 H GLY 506 HN GLY 506 -16.165 -1.715 1.743 258 HA2 GLY 506 HA2 GLY 506 -15.631 -4.345 1.415 259 HA3 GLY 506 HA1 GLY 506 -14.830 -3.621 0.031 260 H GLU 507 HN GLU 507 -13.164 -4.881 1.443 261 HA GLU 507 HA GLU 507 -12.067 -3.271 3.595 262 HB2 GLU 507 HB2 GLU 507 -11.104 -5.849 2.361 263 HB3 GLU 507 HB1 GLU 507 -10.425 -5.092 3.792 264 HG2 GLU 507 HG2 GLU 507 -12.502 -5.428 4.990 265 HG3 GLU 507 HG1 GLU 507 -13.242 -6.115 3.544 266 H TYR 508 HN TYR 508 -10.273 -2.053 3.470 267 HA TYR 508 HA TYR 508 -8.779 -2.023 0.939 268 HB2 TYR 508 HB2 TYR 508 -9.800 0.347 2.515 269 HB3 TYR 508 HB1 TYR 508 -8.569 0.478 1.265 270 HD1 TYR 508 HD1 TYR 508 -11.984 -0.977 1.689 271 HD2 TYR 508 HD2 TYR 508 -9.292 1.133 -0.829 272 HE1 TYR 508 HE1 TYR 508 -13.761 -0.729 0.026 273 HE2 TYR 508 HE2 TYR 508 -11.064 1.391 -2.516 274 HH TYR 508 HH TYR 508 -13.171 0.264 -3.164 275 H LEU 509 HN LEU 509 -6.617 -1.153 1.158 276 HA LEU 509 HA LEU 509 -5.550 -1.527 3.857 277 HB2 LEU 509 HB2 LEU 509 -3.403 -1.914 2.832 278 HB3 LEU 509 HB1 LEU 509 -4.597 -2.958 2.099 279 HG LEU 509 HG LEU 509 -4.686 -1.247 0.207 280 HD11 LEU 509 HD11 LEU 509 -2.051 -0.449 1.422 281 HD12 LEU 509 HD12 LEU 509 -3.495 0.563 1.326 282 HD13 LEU 509 HD13 LEU 509 -2.674 0.055 -0.148 283 HD21 LEU 509 HD21 LEU 509 -2.210 -2.899 0.694 284 HD22 LEU 509 HD22 LEU 509 -2.737 -2.284 -0.872 285 HD23 LEU 509 HD23 LEU 509 -3.724 -3.464 -0.012 286 H MET 510 HN MET 510 -4.068 -0.000 4.709 287 HA MET 510 HA MET 510 -4.380 2.676 3.535 288 HB2 MET 510 HB2 MET 510 -4.364 1.668 6.271 289 HB3 MET 510 HB1 MET 510 -3.254 3.012 6.047 290 HG2 MET 510 HG2 MET 510 -5.092 4.357 5.150 291 HG3 MET 510 HG1 MET 510 -6.194 3.006 5.408 292 HE1 MET 510 HE1 MET 510 -7.334 5.466 8.213 293 HE2 MET 510 HE2 MET 510 -7.861 4.413 6.901 294 HE3 MET 510 HE3 MET 510 -6.866 5.826 6.551 295 H LEU 511 HN LEU 511 -2.719 3.181 2.289 296 HA LEU 511 HA LEU 511 -0.023 2.407 3.164 297 HB2 LEU 511 HB2 LEU 511 -1.303 2.601 0.574 298 HB3 LEU 511 HB1 LEU 511 0.175 3.536 0.626 299 HG LEU 511 HG LEU 511 0.263 0.737 1.642 300 HD11 LEU 511 HD11 LEU 511 -0.991 0.773 -0.564 301 HD12 LEU 511 HD12 LEU 511 0.462 -0.219 -0.487 302 HD13 LEU 511 HD13 LEU 511 0.510 1.355 -1.284 303 HD21 LEU 511 HD21 LEU 511 2.206 2.219 1.792 304 HD22 LEU 511 HD22 LEU 511 2.154 2.454 0.046 305 HD23 LEU 511 HD23 LEU 511 2.506 0.860 0.709 306 H THR 512 HN THR 512 1.606 3.927 3.307 307 HA THR 512 HA THR 512 0.701 6.726 3.299 308 HB THR 512 HB THR 512 2.712 6.940 5.006 309 HG1 THR 512 HG1 THR 512 2.093 4.215 4.965 310 HG21 THR 512 HG21 THR 512 -0.030 5.920 5.744 311 HG22 THR 512 HG22 THR 512 0.427 7.604 5.470 312 HG23 THR 512 HG23 THR 512 1.092 6.720 6.845 313 H TYR 513 HN TYR 513 1.702 8.004 1.981 314 HA TYR 513 HA TYR 513 4.322 7.195 0.910 315 HB2 TYR 513 HB2 TYR 513 2.020 8.701 -0.307 316 HB3 TYR 513 HB1 TYR 513 3.644 8.858 -0.959 317 HD1 TYR 513 HD1 TYR 513 1.342 6.092 0.098 318 HD2 TYR 513 HD2 TYR 513 4.127 7.544 -2.767 319 HE1 TYR 513 HE1 TYR 513 0.992 4.075 -1.263 320 HE2 TYR 513 HE2 TYR 513 3.786 5.532 -4.133 321 HH TYR 513 HH TYR 513 3.042 3.181 -3.782 322 H ALA 514 HN ALA 514 4.945 9.690 -0.269 323 HA ALA 514 HA ALA 514 6.254 11.011 1.803 324 HB1 ALA 514 HB1 ALA 514 6.909 11.193 -0.543 325 HB2 ALA 514 HB2 ALA 514 6.690 12.783 0.185 326 HB3 ALA 514 HB3 ALA 514 5.451 12.123 -0.881 327 H ASN 515 HN ASN 515 5.890 12.930 2.893 328 HA ASN 515 HA ASN 515 4.705 14.426 4.113 329 HB2 ASN 515 HB2 ASN 515 4.391 15.401 1.803 330 HB3 ASN 515 HB1 ASN 515 2.837 14.579 1.733 331 HD21 ASN 515 HD21 ASN 515 4.681 17.090 3.322 332 HD22 ASN 515 HD22 ASN 515 3.322 17.957 3.948 333 H ASP 516 HN ASP 516 4.074 11.574 4.205 334 HA ASP 516 HA ASP 516 2.627 10.122 5.170 335 HB2 ASP 516 HB2 ASP 516 1.679 12.705 6.407 336 HB3 ASP 516 HB1 ASP 516 1.001 11.143 6.844 337 H ALA 517 HN ALA 517 1.996 10.958 2.562 338 HA ALA 517 HA ALA 517 -0.745 11.626 2.295 339 HB1 ALA 517 HB1 ALA 517 -0.469 11.096 -0.052 340 HB2 ALA 517 HB2 ALA 517 1.066 10.297 0.287 341 HB3 ALA 517 HB3 ALA 517 0.906 12.035 0.525 342 H LYS 518 HN LYS 518 -2.519 10.376 2.163 343 HA LYS 518 HA LYS 518 -2.174 7.622 3.067 344 HB2 LYS 518 HB2 LYS 518 -4.688 9.294 2.936 345 HB3 LYS 518 HB1 LYS 518 -4.506 7.744 3.742 346 HG2 LYS 518 HG2 LYS 518 -3.061 10.272 4.506 347 HG3 LYS 518 HG1 LYS 518 -4.501 9.638 5.304 348 HD2 LYS 518 HD2 LYS 518 -3.242 7.579 5.849 349 HD3 LYS 518 HD1 LYS 518 -1.802 8.299 5.125 350 HE2 LYS 518 HE2 LYS 518 -1.795 8.539 7.561 351 HE3 LYS 518 HE1 LYS 518 -1.867 10.105 6.756 352 HZ1 LYS 518 HZ1 LYS 518 -4.241 8.682 7.826 353 HZ2 LYS 518 HZ2 LYS 518 -4.183 10.264 7.228 354 HZ3 LYS 518 HZ3 LYS 518 -3.395 9.878 8.671 355 H LEU 519 HN LEU 519 -2.218 6.070 1.620 356 HA LEU 519 HA LEU 519 -3.874 6.367 -0.796 357 HB2 LEU 519 HB2 LEU 519 -1.574 5.874 -1.300 358 HB3 LEU 519 HB1 LEU 519 -1.548 4.558 -0.146 359 HG LEU 519 HG LEU 519 -3.189 3.340 -1.587 360 HD11 LEU 519 HD11 LEU 519 -2.591 5.575 -3.521 361 HD12 LEU 519 HD12 LEU 519 -4.144 5.246 -2.755 362 HD13 LEU 519 HD13 LEU 519 -3.464 4.092 -3.901 363 HD21 LEU 519 HD21 LEU 519 -0.826 2.829 -1.679 364 HD22 LEU 519 HD22 LEU 519 -0.572 4.117 -2.859 365 HD23 LEU 519 HD23 LEU 519 -1.545 2.708 -3.285 366 H TYR 520 HN TYR 520 -5.533 4.974 -1.193 367 HA TYR 520 HA TYR 520 -5.982 2.853 0.802 368 HB2 TYR 520 HB2 TYR 520 -8.087 4.487 -0.611 369 HB3 TYR 520 HB1 TYR 520 -8.384 3.229 0.577 370 HD1 TYR 520 HD1 TYR 520 -8.002 3.633 2.939 371 HD2 TYR 520 HD2 TYR 520 -7.260 6.678 0.068 372 HE1 TYR 520 HE1 TYR 520 -7.877 5.296 4.744 373 HE2 TYR 520 HE2 TYR 520 -7.131 8.349 1.864 374 HH TYR 520 HH TYR 520 -7.904 8.649 4.163 375 H VAL 521 HN VAL 521 -5.824 0.943 -0.053 376 HA VAL 521 HA VAL 521 -6.600 0.560 -2.863 377 HB VAL 521 HB VAL 521 -4.213 -0.411 -1.360 378 HG11 VAL 521 HG11 VAL 521 -3.850 -2.056 -3.259 379 HG12 VAL 521 HG12 VAL 521 -5.581 -1.890 -3.584 380 HG13 VAL 521 HG13 VAL 521 -5.025 -2.504 -2.017 381 HG21 VAL 521 HG21 VAL 521 -4.056 1.538 -2.807 382 HG22 VAL 521 HG22 VAL 521 -4.624 0.573 -4.172 383 HG23 VAL 521 HG23 VAL 521 -3.074 0.203 -3.416 384 HA PRO 522 HA PRO 522 -9.507 -2.230 -1.020 385 HB2 PRO 522 HB2 PRO 522 -10.559 -3.211 -3.311 386 HB3 PRO 522 HB1 PRO 522 -10.924 -1.590 -2.713 387 HG2 PRO 522 HG2 PRO 522 -9.026 -2.436 -4.855 388 HG3 PRO 522 HG1 PRO 522 -10.116 -1.039 -4.809 389 HD2 PRO 522 HD2 PRO 522 -7.438 -0.896 -4.287 390 HD3 PRO 522 HD1 PRO 522 -8.629 0.228 -3.611 391 H VAL 523 HN VAL 523 -9.724 -4.393 -0.603 392 HA VAL 523 HA VAL 523 -7.458 -6.028 -1.014 393 HB VAL 523 HB VAL 523 -8.836 -7.861 -0.028 394 HG11 VAL 523 HG11 VAL 523 -7.507 -6.399 1.376 395 HG12 VAL 523 HG12 VAL 523 -9.022 -6.802 2.183 396 HG13 VAL 523 HG13 VAL 523 -8.819 -5.222 1.430 397 HG21 VAL 523 HG21 VAL 523 -10.958 -5.722 0.123 398 HG22 VAL 523 HG22 VAL 523 -11.046 -7.327 0.849 399 HG23 VAL 523 HG23 VAL 523 -11.012 -7.152 -0.905 400 H SER 524 HN SER 524 -9.894 -5.296 -3.140 401 HA SER 524 HA SER 524 -9.808 -7.844 -4.539 402 HB2 SER 524 HB2 SER 524 -11.361 -6.597 -6.136 403 HB3 SER 524 HB1 SER 524 -11.970 -6.862 -4.502 404 HG SER 524 HG SER 524 -12.327 -4.767 -4.698 405 H SER 525 HN SER 525 -7.927 -5.125 -4.332 406 HA SER 525 HA SER 525 -6.853 -5.567 -7.042 407 HB2 SER 525 HB2 SER 525 -6.889 -2.974 -5.476 408 HB3 SER 525 HB1 SER 525 -6.149 -3.204 -7.059 409 HG SER 525 HG SER 525 -8.637 -4.096 -7.213 410 H LEU 526 HN LEU 526 -6.216 -6.814 -4.436 411 HA LEU 526 HA LEU 526 -3.813 -5.778 -3.375 412 HB2 LEU 526 HB2 LEU 526 -4.938 -8.577 -3.325 413 HB3 LEU 526 HB1 LEU 526 -3.558 -8.050 -2.381 414 HG LEU 526 HG LEU 526 -6.348 -6.940 -2.133 415 HD11 LEU 526 HD11 LEU 526 -4.835 -8.841 -0.348 416 HD12 LEU 526 HD12 LEU 526 -6.232 -9.241 -1.346 417 HD13 LEU 526 HD13 LEU 526 -6.407 -8.125 0.009 418 HD21 LEU 526 HD21 LEU 526 -3.848 -6.473 -0.517 419 HD22 LEU 526 HD22 LEU 526 -5.456 -5.879 -0.096 420 HD23 LEU 526 HD23 LEU 526 -4.658 -5.302 -1.560 421 H HIS 527 HN HIS 527 -4.514 -7.789 -6.097 422 HA HIS 527 HA HIS 527 -1.904 -8.919 -6.353 423 HB2 HIS 527 HB2 HIS 527 -4.117 -9.842 -7.261 424 HB3 HIS 527 HB1 HIS 527 -3.944 -8.670 -8.559 425 HD1 HIS 527 HD1 HIS 527 -2.529 -11.872 -7.259 426 HD2 HIS 527 HD2 HIS 527 -1.978 -9.284 -10.463 427 HE1 HIS 527 HE1 HIS 527 -1.089 -13.119 -8.895 428 HE2 HIS 527 HE2 HIS 527 -0.603 -11.459 -10.723 429 H LEU 528 HN LEU 528 -3.073 -5.830 -6.884 430 HA LEU 528 HA LEU 528 -1.248 -5.238 -9.086 431 HB2 LEU 528 HB2 LEU 528 -3.101 -3.384 -7.595 432 HB3 LEU 528 HB1 LEU 528 -2.222 -3.014 -9.058 433 HG LEU 528 HG LEU 528 -4.493 -4.978 -8.790 434 HD11 LEU 528 HD11 LEU 528 -4.264 -2.333 -10.222 435 HD12 LEU 528 HD12 LEU 528 -5.186 -2.645 -8.752 436 HD13 LEU 528 HD13 LEU 528 -5.660 -3.411 -10.268 437 HD21 LEU 528 HD21 LEU 528 -2.839 -5.784 -10.398 438 HD22 LEU 528 HD22 LEU 528 -2.871 -4.224 -11.221 439 HD23 LEU 528 HD23 LEU 528 -4.308 -5.247 -11.213 440 H ILE 529 HN ILE 529 -1.195 -5.371 -5.742 441 HA ILE 529 HA ILE 529 0.909 -3.357 -5.490 442 HB ILE 529 HB ILE 529 -0.380 -5.090 -3.379 443 HG12 ILE 529 HG12 ILE 529 -1.853 -3.397 -4.593 444 HG13 ILE 529 HG11 ILE 529 -1.787 -3.279 -2.842 445 HG21 ILE 529 HG21 ILE 529 0.621 -3.468 -1.796 446 HG22 ILE 529 HG22 ILE 529 1.456 -2.701 -3.145 447 HG23 ILE 529 HG23 ILE 529 1.834 -4.366 -2.708 448 HD11 ILE 529 HD11 ILE 529 -0.229 -1.416 -3.018 449 HD12 ILE 529 HD12 ILE 529 -1.708 -1.088 -3.922 450 HD13 ILE 529 HD13 ILE 529 -0.241 -1.563 -4.775 451 H SER 530 HN SER 530 3.018 -3.878 -5.089 452 HA SER 530 HA SER 530 3.680 -6.743 -4.895 453 HB2 SER 530 HB2 SER 530 5.068 -4.578 -6.477 454 HB3 SER 530 HB1 SER 530 5.786 -6.145 -6.170 455 HG SER 530 HG SER 530 3.631 -5.437 -7.806 456 H ARG 531 HN ARG 531 5.416 -7.302 -3.671 457 HA ARG 531 HA ARG 531 5.778 -5.518 -1.421 458 HB2 ARG 531 HB2 ARG 531 5.125 -7.812 -1.003 459 HB3 ARG 531 HB1 ARG 531 6.524 -8.402 -1.884 460 HG2 ARG 531 HG2 ARG 531 7.995 -7.501 -0.211 461 HG3 ARG 531 HG1 ARG 531 6.619 -6.809 0.650 462 HD2 ARG 531 HD2 ARG 531 5.752 -8.973 1.157 463 HD3 ARG 531 HD1 ARG 531 6.919 -9.752 0.093 464 HE ARG 531 HE ARG 531 8.529 -8.563 1.860 465 HH11 ARG 531 HH11 ARG 531 5.629 -10.466 2.353 466 HH12 ARG 531 HH12 ARG 531 6.180 -11.161 3.840 467 HH21 ARG 531 HH21 ARG 531 9.262 -9.489 3.824 468 HH22 ARG 531 HH22 ARG 531 8.245 -10.609 4.676 469 H TYR 532 HN TYR 532 7.573 -4.436 -0.997 470 HA TYR 532 HA TYR 532 9.702 -4.379 -2.907 471 HB2 TYR 532 HB2 TYR 532 8.727 -2.412 -1.594 472 HB3 TYR 532 HB1 TYR 532 9.632 -3.018 -0.214 473 HD1 TYR 532 HD1 TYR 532 12.126 -3.081 -0.324 474 HD2 TYR 532 HD2 TYR 532 9.759 -1.164 -3.282 475 HE1 TYR 532 HE1 TYR 532 14.107 -1.824 -1.073 476 HE2 TYR 532 HE2 TYR 532 11.731 0.100 -4.053 477 HH TYR 532 HH TYR 532 13.883 0.806 -3.292 478 H ALA 533 HN ALA 533 10.625 -6.433 -2.795 479 HA ALA 533 HA ALA 533 11.666 -7.374 -0.247 480 HB1 ALA 533 HB1 ALA 533 11.746 -8.665 -2.972 481 HB2 ALA 533 HB2 ALA 533 10.533 -8.962 -1.727 482 HB3 ALA 533 HB3 ALA 533 12.213 -9.422 -1.449 483 H GLY 534 HN GLY 534 13.930 -8.487 -0.507 484 HA2 GLY 534 HA2 GLY 534 16.110 -8.244 -1.604 485 HA3 GLY 534 HA1 GLY 534 15.723 -6.542 -1.815 486 H GLY 535 HN GLY 535 18.062 -7.035 -0.674 487 HA2 GLY 535 HA2 GLY 535 17.979 -7.389 2.149 488 HA3 GLY 535 HA1 GLY 535 19.348 -6.805 1.215 489 H ALA 536 HN ALA 536 18.547 -4.508 0.138 490 HA ALA 536 HA ALA 536 18.409 -2.809 2.480 491 HB1 ALA 536 HB1 ALA 536 18.736 -2.050 -0.419 492 HB2 ALA 536 HB2 ALA 536 20.055 -2.371 0.707 493 HB3 ALA 536 HB3 ALA 536 18.981 -0.998 0.976 494 H GLU 537 HN GLU 537 16.123 -3.630 2.815 495 HA GLU 537 HA GLU 537 14.035 -2.684 1.129 496 HB2 GLU 537 HB2 GLU 537 12.550 -3.235 3.053 497 HB3 GLU 537 HB1 GLU 537 13.612 -4.557 2.585 498 HG2 GLU 537 HG2 GLU 537 15.105 -4.021 4.437 499 HG3 GLU 537 HG1 GLU 537 14.052 -2.684 4.900 500 H GLU 538 HN GLU 538 15.903 -1.258 3.660 501 HA GLU 538 HA GLU 538 14.057 0.854 4.250 502 HB2 GLU 538 HB2 GLU 538 15.795 0.027 5.848 503 HB3 GLU 538 HB1 GLU 538 17.023 0.743 4.814 504 HG2 GLU 538 HG2 GLU 538 15.988 2.951 5.169 505 HG3 GLU 538 HG1 GLU 538 14.836 2.205 6.272 506 H ASN 539 HN ASN 539 16.131 0.210 1.687 507 HA ASN 539 HA ASN 539 16.786 2.955 1.061 508 HB2 ASN 539 HB2 ASN 539 18.286 1.000 0.515 509 HB3 ASN 539 HB1 ASN 539 17.110 0.518 -0.702 510 HD21 ASN 539 HD21 ASN 539 18.003 3.829 0.080 511 HD22 ASN 539 HD22 ASN 539 18.747 4.178 -1.440 512 H ALA 540 HN ALA 540 13.969 1.666 1.154 513 HA ALA 540 HA ALA 540 12.901 2.053 -1.466 514 HB1 ALA 540 HB1 ALA 540 10.725 1.815 -0.370 515 HB2 ALA 540 HB2 ALA 540 11.506 1.915 1.207 516 HB3 ALA 540 HB3 ALA 540 11.841 0.550 0.144 517 HA PRO 541 HA PRO 541 12.653 6.501 -0.956 518 HB2 PRO 541 HB2 PRO 541 12.073 7.085 -3.508 519 HB3 PRO 541 HB1 PRO 541 13.689 6.587 -3.005 520 HG2 PRO 541 HG2 PRO 541 11.566 5.021 -4.392 521 HG3 PRO 541 HG1 PRO 541 13.322 4.958 -4.604 522 HD2 PRO 541 HD2 PRO 541 11.804 3.166 -3.110 523 HD3 PRO 541 HD1 PRO 541 13.557 3.390 -2.978 524 H LEU 542 HN LEU 542 10.997 7.797 -0.448 525 HA LEU 542 HA LEU 542 8.331 6.712 -0.647 526 HB2 LEU 542 HB2 LEU 542 9.636 8.839 0.888 527 HB3 LEU 542 HB1 LEU 542 7.997 9.212 0.401 528 HG LEU 542 HG LEU 542 7.956 8.265 2.608 529 HD11 LEU 542 HD11 LEU 542 6.408 6.474 2.297 530 HD12 LEU 542 HD12 LEU 542 7.028 6.152 0.679 531 HD13 LEU 542 HD13 LEU 542 6.165 7.654 1.009 532 HD21 LEU 542 HD21 LEU 542 10.069 7.065 2.567 533 HD22 LEU 542 HD22 LEU 542 9.399 5.901 1.423 534 HD23 LEU 542 HD23 LEU 542 8.756 5.997 3.061 535 H HIS 543 HN HIS 543 7.258 6.917 -2.449 536 HA HIS 543 HA HIS 543 7.558 9.217 -4.175 537 HB2 HIS 543 HB2 HIS 543 5.754 6.789 -4.271 538 HB3 HIS 543 HB1 HIS 543 5.656 8.092 -5.449 539 HD1 HIS 543 HD1 HIS 543 6.292 6.175 -7.218 540 HD2 HIS 543 HD2 HIS 543 9.254 7.233 -4.499 541 HE1 HIS 543 HE1 HIS 543 8.433 5.229 -8.141 542 HE2 HIS 543 HE2 HIS 543 10.232 6.037 -6.573 543 H LYS 544 HN LYS 544 5.523 10.392 -4.859 544 HA LYS 544 HA LYS 544 4.003 11.052 -2.426 545 HB2 LYS 544 HB2 LYS 544 3.572 13.213 -3.415 546 HB3 LYS 544 HB1 LYS 544 5.299 12.894 -3.485 547 HG2 LYS 544 HG2 LYS 544 5.197 12.406 -5.809 548 HG3 LYS 544 HG1 LYS 544 3.434 12.409 -5.793 549 HD2 LYS 544 HD2 LYS 544 5.231 14.782 -5.304 550 HD3 LYS 544 HD1 LYS 544 4.293 14.470 -6.764 551 HE2 LYS 544 HE2 LYS 544 2.234 14.504 -5.316 552 HE3 LYS 544 HE1 LYS 544 3.258 15.079 -4.001 553 HZ1 LYS 544 HZ1 LYS 544 2.248 16.943 -5.049 554 HZ2 LYS 544 HZ2 LYS 544 2.738 16.434 -6.586 555 HZ3 LYS 544 HZ3 LYS 544 3.891 16.958 -5.460 556 H LEU 545 HN LEU 545 1.719 11.766 -2.820 557 HA LEU 545 HA LEU 545 0.484 10.155 -4.948 558 HB2 LEU 545 HB2 LEU 545 -0.678 11.076 -2.317 559 HB3 LEU 545 HB1 LEU 545 -1.577 10.229 -3.561 560 HG LEU 545 HG LEU 545 0.767 9.114 -2.017 561 HD11 LEU 545 HD11 LEU 545 -1.304 9.361 -0.707 562 HD12 LEU 545 HD12 LEU 545 -0.859 7.676 -0.965 563 HD13 LEU 545 HD13 LEU 545 -2.157 8.401 -1.914 564 HD21 LEU 545 HD21 LEU 545 -1.018 7.821 -4.074 565 HD22 LEU 545 HD22 LEU 545 0.212 7.000 -3.115 566 HD23 LEU 545 HD23 LEU 545 0.682 8.230 -4.288 567 H GLY 546 HN GLY 546 -1.317 11.078 -6.064 568 HA2 GLY 546 HA2 GLY 546 -2.633 12.988 -6.685 569 HA3 GLY 546 HA1 GLY 546 -1.400 14.019 -5.972 570 H GLY 547 HN GLY 547 0.330 14.667 -7.187 571 HA2 GLY 547 HA2 GLY 547 1.395 13.428 -9.411 572 HA3 GLY 547 HA1 GLY 547 0.108 14.461 -10.016 Start of MODEL 10 1 H1 ARG 472 HT1 ARG 472 0.277 -10.186 -6.222 2 H2 ARG 472 HT2 ARG 472 -0.553 -11.601 -6.615 3 H3 ARG 472 HT3 ARG 472 1.133 -11.558 -6.717 4 HA ARG 472 HA ARG 472 0.408 -12.750 -4.762 5 HB2 ARG 472 HB2 ARG 472 1.874 -11.715 -3.216 6 HB3 ARG 472 HB1 ARG 472 2.513 -11.301 -4.799 7 HG2 ARG 472 HG2 ARG 472 1.666 -9.090 -4.650 8 HG3 ARG 472 HG1 ARG 472 0.756 -9.478 -3.189 9 HD2 ARG 472 HD2 ARG 472 2.725 -8.288 -2.545 10 HD3 ARG 472 HD1 ARG 472 2.905 -9.967 -2.051 11 HE ARG 472 HE ARG 472 4.121 -9.029 -4.568 12 HH11 ARG 472 HH11 ARG 472 4.457 -10.432 -1.366 13 HH12 ARG 472 HH12 ARG 472 6.144 -10.779 -1.559 14 HH21 ARG 472 HH21 ARG 472 6.357 -9.470 -4.796 15 HH22 ARG 472 HH22 ARG 472 7.220 -10.223 -3.493 16 H ASN 473 HN ASN 473 -0.630 -12.634 -2.648 17 HA ASN 473 HA ASN 473 -3.108 -11.125 -2.957 18 HB2 ASN 473 HB2 ASN 473 -2.368 -13.552 -1.351 19 HB3 ASN 473 HB1 ASN 473 -3.868 -12.678 -1.056 20 HD21 ASN 473 HD21 ASN 473 -5.503 -12.754 -2.567 21 HD22 ASN 473 HD22 ASN 473 -5.502 -13.868 -3.889 22 H LEU 474 HN LEU 474 -0.294 -10.561 -1.408 23 HA LEU 474 HA LEU 474 0.363 -9.130 0.233 24 HB2 LEU 474 HB2 LEU 474 -2.340 -8.034 -0.454 25 HB3 LEU 474 HB1 LEU 474 -1.353 -7.280 0.776 26 HG LEU 474 HG LEU 474 -0.910 -6.026 -1.125 27 HD11 LEU 474 HD11 LEU 474 1.146 -6.817 0.008 28 HD12 LEU 474 HD12 LEU 474 1.378 -6.414 -1.691 29 HD13 LEU 474 HD13 LEU 474 1.266 -8.100 -1.191 30 HD21 LEU 474 HD21 LEU 474 -0.951 -8.628 -2.585 31 HD22 LEU 474 HD22 LEU 474 -0.249 -7.174 -3.290 32 HD23 LEU 474 HD23 LEU 474 -1.949 -7.196 -2.831 33 H ALA 475 HN ALA 475 -0.897 -11.618 1.048 34 HA ALA 475 HA ALA 475 -2.489 -10.994 3.379 35 HB1 ALA 475 HB1 ALA 475 -3.012 -12.961 2.028 36 HB2 ALA 475 HB2 ALA 475 -2.609 -13.412 3.686 37 HB3 ALA 475 HB3 ALA 475 -1.427 -13.642 2.398 38 H GLU 476 HN GLU 476 0.810 -11.667 2.605 39 HA GLU 476 HA GLU 476 1.498 -12.022 5.431 40 HB2 GLU 476 HB2 GLU 476 3.148 -12.395 2.931 41 HB3 GLU 476 HB1 GLU 476 3.743 -12.641 4.567 42 HG2 GLU 476 HG2 GLU 476 1.498 -14.159 3.267 43 HG3 GLU 476 HG1 GLU 476 3.148 -14.743 3.493 44 H LEU 477 HN LEU 477 0.669 -9.463 4.316 45 HA LEU 477 HA LEU 477 2.976 -7.815 4.032 46 HB2 LEU 477 HB2 LEU 477 0.054 -7.304 4.364 47 HB3 LEU 477 HB1 LEU 477 1.185 -5.980 4.576 48 HG LEU 477 HG LEU 477 0.920 -7.664 2.084 49 HD11 LEU 477 HD11 LEU 477 0.102 -4.807 2.583 50 HD12 LEU 477 HD12 LEU 477 -1.003 -6.177 2.498 51 HD13 LEU 477 HD13 LEU 477 -0.072 -5.708 1.075 52 HD21 LEU 477 HD21 LEU 477 2.642 -5.287 2.758 53 HD22 LEU 477 HD22 LEU 477 2.370 -5.867 1.118 54 HD23 LEU 477 HD23 LEU 477 3.175 -6.904 2.294 55 H HIS 478 HN HIS 478 3.736 -6.226 5.443 56 HA HIS 478 HA HIS 478 3.181 -6.722 8.291 57 HB2 HIS 478 HB2 HIS 478 5.810 -6.228 6.897 58 HB3 HIS 478 HB1 HIS 478 5.608 -5.975 8.624 59 HD1 HIS 478 HD1 HIS 478 6.001 -7.947 10.068 60 HD2 HIS 478 HD2 HIS 478 5.299 -9.019 6.116 61 HE1 HIS 478 HE1 HIS 478 6.393 -10.428 9.960 62 HE2 HIS 478 HE2 HIS 478 5.800 -11.075 7.603 63 H ILE 479 HN ILE 479 3.389 -4.886 9.666 64 HA ILE 479 HA ILE 479 2.411 -2.488 8.418 65 HB ILE 479 HB ILE 479 3.216 -2.866 11.304 66 HG12 ILE 479 HG12 ILE 479 1.595 -4.587 10.740 67 HG13 ILE 479 HG11 ILE 479 0.825 -3.357 11.735 68 HG21 ILE 479 HG21 ILE 479 1.664 -1.030 11.724 69 HG22 ILE 479 HG22 ILE 479 1.325 -0.918 9.998 70 HG23 ILE 479 HG23 ILE 479 2.943 -0.551 10.603 71 HD11 ILE 479 HD11 ILE 479 -0.194 -2.390 9.741 72 HD12 ILE 479 HD12 ILE 479 -0.634 -4.085 9.946 73 HD13 ILE 479 HD13 ILE 479 0.578 -3.628 8.750 74 H GLY 480 HN GLY 480 3.524 -0.682 7.930 75 HA2 GLY 480 HA2 GLY 480 5.262 0.836 7.864 76 HA3 GLY 480 HA1 GLY 480 6.010 -0.036 9.198 77 H GLN 481 HN GLN 481 5.045 -1.653 6.287 78 HA GLN 481 HA GLN 481 7.873 -2.104 5.633 79 HB2 GLN 481 HB2 GLN 481 6.671 -4.148 6.159 80 HB3 GLN 481 HB1 GLN 481 5.398 -3.737 5.021 81 HG2 GLN 481 HG2 GLN 481 6.599 -5.291 3.843 82 HG3 GLN 481 HG1 GLN 481 7.301 -3.785 3.263 83 HE21 GLN 481 HE21 GLN 481 8.791 -3.464 5.852 84 HE22 GLN 481 HE22 GLN 481 10.124 -4.556 5.719 85 HA PRO 482 HA PRO 482 7.172 0.255 1.890 86 HB2 PRO 482 HB2 PRO 482 9.385 -0.606 0.538 87 HB3 PRO 482 HB1 PRO 482 9.423 0.654 1.776 88 HG2 PRO 482 HG2 PRO 482 10.113 -2.247 2.004 89 HG3 PRO 482 HG1 PRO 482 10.941 -0.840 2.697 90 HD2 PRO 482 HD2 PRO 482 9.297 -2.412 4.151 91 HD3 PRO 482 HD1 PRO 482 9.445 -0.669 4.449 92 H VAL 483 HN VAL 483 5.752 -0.302 0.405 93 HA VAL 483 HA VAL 483 6.091 -2.826 -1.061 94 HB VAL 483 HB VAL 483 3.651 -3.151 -1.123 95 HG11 VAL 483 HG11 VAL 483 4.792 -2.994 1.665 96 HG12 VAL 483 HG12 VAL 483 4.928 -4.353 0.551 97 HG13 VAL 483 HG13 VAL 483 3.354 -3.901 1.202 98 HG21 VAL 483 HG21 VAL 483 2.186 -1.906 0.376 99 HG22 VAL 483 HG22 VAL 483 2.971 -0.827 -0.779 100 HG23 VAL 483 HG23 VAL 483 3.546 -0.906 0.886 101 H VAL 484 HN VAL 484 5.071 -2.770 -3.204 102 HA VAL 484 HA VAL 484 5.231 -0.031 -4.242 103 HB VAL 484 HB VAL 484 5.740 -1.012 -6.432 104 HG11 VAL 484 HG11 VAL 484 7.546 -0.381 -4.937 105 HG12 VAL 484 HG12 VAL 484 7.992 -1.794 -5.893 106 HG13 VAL 484 HG13 VAL 484 7.518 -1.985 -4.205 107 HG21 VAL 484 HG21 VAL 484 4.575 -3.132 -6.209 108 HG22 VAL 484 HG22 VAL 484 5.723 -3.649 -4.972 109 HG23 VAL 484 HG23 VAL 484 6.268 -3.393 -6.630 110 H HIS 485 HN HIS 485 3.729 0.864 -5.381 111 HA HIS 485 HA HIS 485 1.211 -0.588 -5.912 112 HB2 HIS 485 HB2 HIS 485 1.298 1.500 -4.369 113 HB3 HIS 485 HB1 HIS 485 1.587 2.409 -5.837 114 HD1 HIS 485 HD1 HIS 485 -0.751 3.502 -4.832 115 HD2 HIS 485 HD2 HIS 485 -0.978 -0.213 -6.670 116 HE1 HIS 485 HE1 HIS 485 -3.168 3.196 -5.432 117 HE2 HIS 485 HE2 HIS 485 -3.222 1.074 -6.779 118 H LEU 486 HN LEU 486 0.832 -0.985 -8.012 119 HA LEU 486 HA LEU 486 2.644 -0.463 -10.019 120 HB2 LEU 486 HB2 LEU 486 1.116 -1.399 -11.543 121 HB3 LEU 486 HB1 LEU 486 0.870 -2.211 -10.017 122 HG LEU 486 HG LEU 486 -1.272 -1.970 -10.866 123 HD11 LEU 486 HD11 LEU 486 -0.968 0.461 -9.132 124 HD12 LEU 486 HD12 LEU 486 -1.169 -1.191 -8.558 125 HD13 LEU 486 HD13 LEU 486 -2.462 -0.411 -9.468 126 HD21 LEU 486 HD21 LEU 486 -2.181 0.070 -11.865 127 HD22 LEU 486 HD22 LEU 486 -0.774 -0.533 -12.741 128 HD23 LEU 486 HD23 LEU 486 -0.613 0.855 -11.665 129 H GLU 487 HN GLU 487 0.338 1.697 -8.765 130 HA GLU 487 HA GLU 487 0.183 3.371 -11.105 131 HB2 GLU 487 HB2 GLU 487 -0.793 3.717 -8.273 132 HB3 GLU 487 HB1 GLU 487 -1.082 4.880 -9.560 133 HG2 GLU 487 HG2 GLU 487 -2.484 3.417 -10.723 134 HG3 GLU 487 HG1 GLU 487 -1.928 2.015 -9.808 135 H HIS 488 HN HIS 488 1.576 3.717 -7.805 136 HA HIS 488 HA HIS 488 3.052 6.031 -8.881 137 HB2 HIS 488 HB2 HIS 488 1.592 5.727 -6.299 138 HB3 HIS 488 HB1 HIS 488 3.001 6.782 -6.365 139 HD1 HIS 488 HD1 HIS 488 2.663 9.071 -7.317 140 HD2 HIS 488 HD2 HIS 488 -0.515 6.527 -8.158 141 HE1 HIS 488 HE1 HIS 488 0.895 10.519 -8.374 142 HE2 HIS 488 HE2 HIS 488 -1.043 8.972 -8.817 143 H GLY 489 HN GLY 489 3.359 3.045 -7.211 144 HA2 GLY 489 HA2 GLY 489 5.530 2.012 -7.459 145 HA3 GLY 489 HA1 GLY 489 6.256 3.583 -7.165 146 H VAL 490 HN VAL 490 7.538 2.819 -5.543 147 HA VAL 490 HA VAL 490 6.683 1.252 -3.379 148 HB VAL 490 HB VAL 490 8.989 1.270 -3.970 149 HG11 VAL 490 HG11 VAL 490 9.027 3.554 -4.906 150 HG12 VAL 490 HG12 VAL 490 10.407 3.193 -3.874 151 HG13 VAL 490 HG13 VAL 490 9.091 4.193 -3.261 152 HG21 VAL 490 HG21 VAL 490 8.618 0.898 -1.617 153 HG22 VAL 490 HG22 VAL 490 8.613 2.636 -1.311 154 HG23 VAL 490 HG23 VAL 490 10.096 1.840 -1.838 155 H GLY 491 HN GLY 491 5.806 1.680 -1.500 156 HA2 GLY 491 HA2 GLY 491 5.848 4.391 -0.386 157 HA3 GLY 491 HA1 GLY 491 4.278 3.648 -0.675 158 H ARG 492 HN ARG 492 4.361 4.157 1.809 159 HA ARG 492 HA ARG 492 5.620 1.900 3.225 160 HB2 ARG 492 HB2 ARG 492 4.482 4.435 4.415 161 HB3 ARG 492 HB1 ARG 492 5.444 3.216 5.236 162 HG2 ARG 492 HG2 ARG 492 6.410 4.986 3.004 163 HG3 ARG 492 HG1 ARG 492 6.735 5.230 4.720 164 HD2 ARG 492 HD2 ARG 492 7.951 3.141 4.819 165 HD3 ARG 492 HD1 ARG 492 7.546 2.793 3.140 166 HE ARG 492 HE ARG 492 8.828 5.215 3.082 167 HH11 ARG 492 HH11 ARG 492 9.639 2.033 4.286 168 HH12 ARG 492 HH12 ARG 492 11.327 2.183 3.919 169 HH21 ARG 492 HH21 ARG 492 11.047 5.417 2.587 170 HH22 ARG 492 HH22 ARG 492 12.126 4.105 2.933 171 H TYR 493 HN TYR 493 4.308 0.255 3.702 172 HA TYR 493 HA TYR 493 1.461 0.483 3.529 173 HB2 TYR 493 HB2 TYR 493 2.680 -1.595 2.949 174 HB3 TYR 493 HB1 TYR 493 3.143 -1.776 4.636 175 HD1 TYR 493 HD1 TYR 493 0.286 -1.799 2.299 176 HD2 TYR 493 HD2 TYR 493 1.638 -2.693 6.232 177 HE1 TYR 493 HE1 TYR 493 -1.788 -3.036 2.727 178 HE2 TYR 493 HE2 TYR 493 -0.439 -3.930 6.674 179 HH TYR 493 HH TYR 493 -2.768 -3.967 5.813 180 H ALA 494 HN ALA 494 -0.012 0.829 5.113 181 HA ALA 494 HA ALA 494 0.905 0.645 7.906 182 HB1 ALA 494 HB1 ALA 494 1.085 2.981 7.282 183 HB2 ALA 494 HB2 ALA 494 -0.250 2.760 8.416 184 HB3 ALA 494 HB3 ALA 494 -0.579 2.974 6.694 185 H GLY 495 HN GLY 495 -0.300 -1.181 8.289 186 HA2 GLY 495 HA2 GLY 495 -2.145 -2.428 8.840 187 HA3 GLY 495 HA1 GLY 495 -2.827 -0.892 9.318 188 H MET 496 HN MET 496 -4.857 -1.525 8.756 189 HA MET 496 HA MET 496 -5.446 -1.366 5.898 190 HB2 MET 496 HB2 MET 496 -6.164 -3.604 7.720 191 HB3 MET 496 HB1 MET 496 -7.386 -3.074 6.573 192 HG2 MET 496 HG2 MET 496 -5.856 -3.471 4.731 193 HG3 MET 496 HG1 MET 496 -4.602 -3.958 5.865 194 HE1 MET 496 HE1 MET 496 -6.259 -5.659 8.009 195 HE2 MET 496 HE2 MET 496 -4.707 -6.157 7.338 196 HE3 MET 496 HE3 MET 496 -6.068 -7.277 7.338 197 H THR 497 HN THR 497 -7.521 -0.592 5.421 198 HA THR 497 HA THR 497 -8.960 0.617 7.673 199 HB THR 497 HB THR 497 -7.582 2.402 6.832 200 HG1 THR 497 HG1 THR 497 -9.851 2.857 7.269 201 HG21 THR 497 HG21 THR 497 -7.599 3.126 4.519 202 HG22 THR 497 HG22 THR 497 -8.728 1.839 4.098 203 HG23 THR 497 HG23 THR 497 -7.091 1.441 4.621 204 H THR 498 HN THR 498 -11.137 0.450 7.513 205 HA THR 498 HA THR 498 -12.171 -0.830 5.088 206 HB THR 498 HB THR 498 -13.999 -0.438 7.363 207 HG1 THR 498 HG1 THR 498 -11.516 -1.765 7.599 208 HG21 THR 498 HG21 THR 498 -13.180 -2.832 5.714 209 HG22 THR 498 HG22 THR 498 -14.592 -1.810 5.440 210 HG23 THR 498 HG23 THR 498 -14.494 -2.806 6.892 211 H LEU 499 HN LEU 499 -13.296 0.326 3.662 212 HA LEU 499 HA LEU 499 -14.257 2.980 4.501 213 HB2 LEU 499 HB2 LEU 499 -13.534 2.051 1.718 214 HB3 LEU 499 HB1 LEU 499 -14.051 3.664 2.164 215 HG LEU 499 HG LEU 499 -11.465 2.337 2.989 216 HD11 LEU 499 HD11 LEU 499 -12.041 4.608 1.094 217 HD12 LEU 499 HD12 LEU 499 -11.486 2.992 0.655 218 HD13 LEU 499 HD13 LEU 499 -10.437 4.063 1.585 219 HD21 LEU 499 HD21 LEU 499 -12.507 5.107 3.575 220 HD22 LEU 499 HD22 LEU 499 -10.889 4.515 3.948 221 HD23 LEU 499 HD23 LEU 499 -12.292 3.807 4.748 222 H GLU 500 HN GLU 500 -16.370 2.924 4.863 223 HA GLU 500 HA GLU 500 -18.025 1.239 3.131 224 HB2 GLU 500 HB2 GLU 500 -18.643 2.508 5.803 225 HB3 GLU 500 HB1 GLU 500 -19.800 1.588 4.846 226 HG2 GLU 500 HG2 GLU 500 -18.295 -0.364 4.979 227 HG3 GLU 500 HG1 GLU 500 -17.236 0.564 6.035 228 H ALA 501 HN ALA 501 -18.368 2.403 1.359 229 HA ALA 501 HA ALA 501 -19.090 5.219 1.538 230 HB1 ALA 501 HB1 ALA 501 -17.451 4.580 -0.122 231 HB2 ALA 501 HB2 ALA 501 -18.921 5.127 -0.930 232 HB3 ALA 501 HB3 ALA 501 -18.568 3.401 -0.810 233 H GLY 502 HN GLY 502 -20.872 5.874 -0.091 234 HA2 GLY 502 HA2 GLY 502 -23.285 4.477 0.637 235 HA3 GLY 502 HA1 GLY 502 -23.171 5.922 -0.360 236 H GLY 503 HN GLY 503 -22.261 2.494 -0.485 237 HA2 GLY 503 HA2 GLY 503 -23.673 1.412 -2.408 238 HA3 GLY 503 HA1 GLY 503 -22.695 2.505 -3.377 239 H ILE 504 HN ILE 504 -20.238 2.364 -2.320 240 HA ILE 504 HA ILE 504 -19.544 -0.475 -2.697 241 HB ILE 504 HB ILE 504 -17.737 1.928 -3.017 242 HG12 ILE 504 HG12 ILE 504 -19.511 1.948 -4.711 243 HG13 ILE 504 HG11 ILE 504 -17.955 1.567 -5.439 244 HG21 ILE 504 HG21 ILE 504 -17.360 -0.965 -3.783 245 HG22 ILE 504 HG22 ILE 504 -16.548 -0.122 -2.463 246 HG23 ILE 504 HG23 ILE 504 -16.233 0.345 -4.134 247 HD11 ILE 504 HD11 ILE 504 -20.100 -0.422 -4.741 248 HD12 ILE 504 HD12 ILE 504 -18.553 -0.786 -5.506 249 HD13 ILE 504 HD13 ILE 504 -19.747 0.199 -6.351 250 H THR 505 HN THR 505 -19.334 -1.423 -0.780 251 HA THR 505 HA THR 505 -17.678 -0.085 1.257 252 HB THR 505 HB THR 505 -18.954 -1.243 2.982 253 HG1 THR 505 HG1 THR 505 -19.942 -2.596 0.803 254 HG21 THR 505 HG21 THR 505 -19.750 0.963 2.319 255 HG22 THR 505 HG22 THR 505 -21.102 -0.077 2.765 256 HG23 THR 505 HG23 THR 505 -20.753 0.237 1.065 257 H GLY 506 HN GLY 506 -16.098 -1.393 2.293 258 HA2 GLY 506 HA2 GLY 506 -15.969 -4.125 2.371 259 HA3 GLY 506 HA1 GLY 506 -15.306 -3.713 0.799 260 H GLU 507 HN GLU 507 -13.434 -4.827 1.761 261 HA GLU 507 HA GLU 507 -11.980 -3.394 3.818 262 HB2 GLU 507 HB2 GLU 507 -11.357 -5.899 2.266 263 HB3 GLU 507 HB1 GLU 507 -10.306 -5.219 3.497 264 HG2 GLU 507 HG2 GLU 507 -12.135 -5.495 5.142 265 HG3 GLU 507 HG1 GLU 507 -13.082 -6.301 3.891 266 H TYR 508 HN TYR 508 -10.196 -2.195 3.533 267 HA TYR 508 HA TYR 508 -8.912 -2.145 0.900 268 HB2 TYR 508 HB2 TYR 508 -9.735 0.310 2.476 269 HB3 TYR 508 HB1 TYR 508 -8.750 0.327 1.017 270 HD1 TYR 508 HD1 TYR 508 -9.742 0.039 -1.149 271 HD2 TYR 508 HD2 TYR 508 -12.115 -0.265 2.361 272 HE1 TYR 508 HE1 TYR 508 -11.777 0.138 -2.520 273 HE2 TYR 508 HE2 TYR 508 -14.155 -0.175 1.004 274 HH TYR 508 HH TYR 508 -14.259 -0.704 -2.207 275 H LEU 509 HN LEU 509 -6.708 -1.689 0.965 276 HA LEU 509 HA LEU 509 -5.514 -1.881 3.610 277 HB2 LEU 509 HB2 LEU 509 -3.437 -2.324 2.507 278 HB3 LEU 509 HB1 LEU 509 -4.672 -3.313 1.768 279 HG LEU 509 HG LEU 509 -4.756 -1.559 -0.070 280 HD11 LEU 509 HD11 LEU 509 -2.143 -0.775 1.189 281 HD12 LEU 509 HD12 LEU 509 -3.568 0.247 0.969 282 HD13 LEU 509 HD13 LEU 509 -2.663 -0.319 -0.434 283 HD21 LEU 509 HD21 LEU 509 -2.838 -2.584 -1.213 284 HD22 LEU 509 HD22 LEU 509 -3.821 -3.777 -0.366 285 HD23 LEU 509 HD23 LEU 509 -2.290 -3.245 0.327 286 H MET 510 HN MET 510 -3.986 -0.338 4.379 287 HA MET 510 HA MET 510 -4.382 2.300 3.150 288 HB2 MET 510 HB2 MET 510 -5.015 1.598 5.695 289 HB3 MET 510 HB1 MET 510 -3.366 2.167 5.915 290 HG2 MET 510 HG2 MET 510 -4.016 4.262 4.721 291 HG3 MET 510 HG1 MET 510 -5.679 3.691 4.765 292 HE1 MET 510 HE1 MET 510 -2.689 5.164 6.714 293 HE2 MET 510 HE2 MET 510 -2.733 3.549 7.422 294 HE3 MET 510 HE3 MET 510 -3.152 4.954 8.402 295 H LEU 511 HN LEU 511 -2.676 2.862 2.006 296 HA LEU 511 HA LEU 511 -0.004 2.330 3.108 297 HB2 LEU 511 HB2 LEU 511 -1.052 2.660 0.372 298 HB3 LEU 511 HB1 LEU 511 0.431 3.530 0.686 299 HG LEU 511 HG LEU 511 0.530 0.759 1.601 300 HD11 LEU 511 HD11 LEU 511 0.876 0.086 -0.901 301 HD12 LEU 511 HD12 LEU 511 -0.239 1.431 -1.207 302 HD13 LEU 511 HD13 LEU 511 -0.734 0.078 -0.186 303 HD21 LEU 511 HD21 LEU 511 2.462 2.260 1.462 304 HD22 LEU 511 HD22 LEU 511 2.219 2.400 -0.280 305 HD23 LEU 511 HD23 LEU 511 2.660 0.847 0.425 306 H THR 512 HN THR 512 1.528 4.053 3.114 307 HA THR 512 HA THR 512 0.374 6.748 3.026 308 HB THR 512 HB THR 512 2.214 7.124 4.934 309 HG1 THR 512 HG1 THR 512 1.818 4.427 4.862 310 HG21 THR 512 HG21 THR 512 -0.088 7.833 5.121 311 HG22 THR 512 HG22 THR 512 0.376 6.975 6.591 312 HG23 THR 512 HG23 THR 512 -0.615 6.168 5.374 313 H TYR 513 HN TYR 513 1.487 8.047 1.761 314 HA TYR 513 HA TYR 513 4.218 7.269 1.017 315 HB2 TYR 513 HB2 TYR 513 2.065 8.790 -0.428 316 HB3 TYR 513 HB1 TYR 513 3.751 8.970 -0.888 317 HD1 TYR 513 HD1 TYR 513 1.781 5.958 0.119 318 HD2 TYR 513 HD2 TYR 513 4.037 7.901 -2.916 319 HE1 TYR 513 HE1 TYR 513 1.593 3.966 -1.297 320 HE2 TYR 513 HE2 TYR 513 3.851 5.907 -4.341 321 HH TYR 513 HH TYR 513 3.468 3.387 -3.952 322 H ALA 514 HN ALA 514 5.136 9.690 0.053 323 HA ALA 514 HA ALA 514 5.944 11.017 2.389 324 HB1 ALA 514 HB1 ALA 514 5.954 12.033 -0.444 325 HB2 ALA 514 HB2 ALA 514 7.236 11.102 0.326 326 HB3 ALA 514 HB3 ALA 514 6.856 12.728 0.898 327 H ASN 515 HN ASN 515 5.446 13.085 3.172 328 HA ASN 515 HA ASN 515 4.108 14.792 3.830 329 HB2 ASN 515 HB2 ASN 515 2.786 14.465 1.126 330 HB3 ASN 515 HB1 ASN 515 2.617 15.850 2.195 331 HD21 ASN 515 HD21 ASN 515 4.378 17.244 2.480 332 HD22 ASN 515 HD22 ASN 515 5.683 17.295 1.345 333 H ASP 516 HN ASP 516 3.431 11.988 4.283 334 HA ASP 516 HA ASP 516 1.822 10.688 5.202 335 HB2 ASP 516 HB2 ASP 516 0.621 13.374 5.889 336 HB3 ASP 516 HB1 ASP 516 0.076 11.841 6.552 337 H ALA 517 HN ALA 517 1.567 11.197 2.426 338 HA ALA 517 HA ALA 517 -1.120 11.724 1.711 339 HB1 ALA 517 HB1 ALA 517 1.004 10.185 0.232 340 HB2 ALA 517 HB2 ALA 517 0.667 11.907 0.085 341 HB3 ALA 517 HB3 ALA 517 -0.527 10.725 -0.453 342 H LYS 518 HN LYS 518 -2.857 10.452 1.676 343 HA LYS 518 HA LYS 518 -2.565 7.858 2.986 344 HB2 LYS 518 HB2 LYS 518 -5.046 9.506 2.450 345 HB3 LYS 518 HB1 LYS 518 -4.991 8.016 3.379 346 HG2 LYS 518 HG2 LYS 518 -3.558 10.563 4.102 347 HG3 LYS 518 HG1 LYS 518 -5.082 10.016 4.798 348 HD2 LYS 518 HD2 LYS 518 -4.001 8.050 5.707 349 HD3 LYS 518 HD1 LYS 518 -2.480 8.494 4.929 350 HE2 LYS 518 HE2 LYS 518 -2.421 9.092 7.275 351 HE3 LYS 518 HE1 LYS 518 -2.403 10.544 6.276 352 HZ1 LYS 518 HZ1 LYS 518 -4.794 9.428 7.642 353 HZ2 LYS 518 HZ2 LYS 518 -4.753 10.841 6.715 354 HZ3 LYS 518 HZ3 LYS 518 -3.896 10.761 8.171 355 H LEU 519 HN LEU 519 -2.552 6.099 1.838 356 HA LEU 519 HA LEU 519 -3.769 6.080 -0.828 357 HB2 LEU 519 HB2 LEU 519 -1.412 5.572 -0.769 358 HB3 LEU 519 HB1 LEU 519 -1.666 4.358 0.459 359 HG LEU 519 HG LEU 519 -2.849 4.077 -2.259 360 HD11 LEU 519 HD11 LEU 519 -0.933 2.719 -2.891 361 HD12 LEU 519 HD12 LEU 519 -0.128 3.267 -1.420 362 HD13 LEU 519 HD13 LEU 519 -0.558 4.428 -2.674 363 HD21 LEU 519 HD21 LEU 519 -3.778 2.315 -1.343 364 HD22 LEU 519 HD22 LEU 519 -2.775 2.446 0.093 365 HD23 LEU 519 HD23 LEU 519 -2.166 1.604 -1.334 366 H TYR 520 HN TYR 520 -5.501 4.857 -1.229 367 HA TYR 520 HA TYR 520 -6.149 2.701 0.670 368 HB2 TYR 520 HB2 TYR 520 -8.122 4.298 -0.953 369 HB3 TYR 520 HB1 TYR 520 -8.506 3.063 0.230 370 HD1 TYR 520 HD1 TYR 520 -7.960 3.507 2.652 371 HD2 TYR 520 HD2 TYR 520 -7.865 6.555 -0.307 372 HE1 TYR 520 HE1 TYR 520 -8.125 5.216 4.416 373 HE2 TYR 520 HE2 TYR 520 -8.023 8.274 1.446 374 HH TYR 520 HH TYR 520 -7.621 7.562 4.773 375 H VAL 521 HN VAL 521 -6.079 0.757 -0.209 376 HA VAL 521 HA VAL 521 -6.678 0.497 -3.070 377 HB VAL 521 HB VAL 521 -4.345 -0.558 -1.542 378 HG11 VAL 521 HG11 VAL 521 -5.704 -1.983 -3.810 379 HG12 VAL 521 HG12 VAL 521 -5.174 -2.637 -2.250 380 HG13 VAL 521 HG13 VAL 521 -3.981 -2.176 -3.472 381 HG21 VAL 521 HG21 VAL 521 -4.658 0.400 -4.373 382 HG22 VAL 521 HG22 VAL 521 -3.146 0.110 -3.507 383 HG23 VAL 521 HG23 VAL 521 -4.219 1.417 -3.001 384 HA PRO 522 HA PRO 522 -9.712 -2.338 -1.540 385 HB2 PRO 522 HB2 PRO 522 -10.553 -3.249 -3.956 386 HB3 PRO 522 HB1 PRO 522 -11.003 -1.664 -3.319 387 HG2 PRO 522 HG2 PRO 522 -8.923 -2.381 -5.335 388 HG3 PRO 522 HG1 PRO 522 -10.037 -1.002 -5.313 389 HD2 PRO 522 HD2 PRO 522 -7.415 -0.837 -4.577 390 HD3 PRO 522 HD1 PRO 522 -8.678 0.225 -3.934 391 H VAL 523 HN VAL 523 -9.850 -4.488 -1.112 392 HA VAL 523 HA VAL 523 -7.498 -6.032 -1.474 393 HB VAL 523 HB VAL 523 -8.761 -7.869 -0.374 394 HG11 VAL 523 HG11 VAL 523 -9.010 -6.723 1.788 395 HG12 VAL 523 HG12 VAL 523 -8.917 -5.168 0.961 396 HG13 VAL 523 HG13 VAL 523 -7.527 -6.254 0.956 397 HG21 VAL 523 HG21 VAL 523 -11.018 -5.866 -0.325 398 HG22 VAL 523 HG22 VAL 523 -10.999 -7.426 0.497 399 HG23 VAL 523 HG23 VAL 523 -10.983 -7.358 -1.265 400 H SER 524 HN SER 524 -10.072 -5.480 -3.523 401 HA SER 524 HA SER 524 -10.008 -8.046 -4.848 402 HB2 SER 524 HB2 SER 524 -11.278 -5.460 -5.762 403 HB3 SER 524 HB1 SER 524 -11.617 -7.077 -6.380 404 HG SER 524 HG SER 524 -12.423 -7.618 -4.305 405 H SER 525 HN SER 525 -8.169 -5.201 -4.878 406 HA SER 525 HA SER 525 -7.139 -5.777 -7.578 407 HB2 SER 525 HB2 SER 525 -7.054 -3.145 -6.081 408 HB3 SER 525 HB1 SER 525 -6.513 -3.426 -7.737 409 HG SER 525 HG SER 525 -8.532 -2.649 -7.967 410 H LEU 526 HN LEU 526 -6.348 -6.971 -4.986 411 HA LEU 526 HA LEU 526 -3.976 -5.838 -3.998 412 HB2 LEU 526 HB2 LEU 526 -5.092 -8.627 -3.903 413 HB3 LEU 526 HB1 LEU 526 -3.564 -8.218 -3.148 414 HG LEU 526 HG LEU 526 -6.223 -6.963 -2.482 415 HD11 LEU 526 HD11 LEU 526 -4.569 -8.964 -0.952 416 HD12 LEU 526 HD12 LEU 526 -6.103 -9.287 -1.760 417 HD13 LEU 526 HD13 LEU 526 -6.048 -8.190 -0.381 418 HD21 LEU 526 HD21 LEU 526 -4.461 -5.386 -2.103 419 HD22 LEU 526 HD22 LEU 526 -3.469 -6.609 -1.310 420 HD23 LEU 526 HD23 LEU 526 -4.953 -6.042 -0.542 421 H HIS 527 HN HIS 527 -4.557 -7.925 -6.725 422 HA HIS 527 HA HIS 527 -1.939 -8.918 -7.040 423 HB2 HIS 527 HB2 HIS 527 -2.604 -9.594 -9.258 424 HB3 HIS 527 HB1 HIS 527 -3.943 -9.873 -8.156 425 HD1 HIS 527 HD1 HIS 527 -3.441 -8.809 -11.431 426 HD2 HIS 527 HD2 HIS 527 -5.706 -7.307 -8.291 427 HE1 HIS 527 HE1 HIS 527 -5.206 -7.371 -12.494 428 HE2 HIS 527 HE2 HIS 527 -6.664 -6.617 -10.589 429 H LEU 528 HN LEU 528 -2.861 -5.775 -7.167 430 HA LEU 528 HA LEU 528 -0.907 -5.046 -9.227 431 HB2 LEU 528 HB2 LEU 528 -2.977 -3.353 -7.830 432 HB3 LEU 528 HB1 LEU 528 -1.909 -2.813 -9.106 433 HG LEU 528 HG LEU 528 -4.075 -4.893 -9.391 434 HD11 LEU 528 HD11 LEU 528 -3.879 -2.051 -10.376 435 HD12 LEU 528 HD12 LEU 528 -4.976 -2.663 -9.138 436 HD13 LEU 528 HD13 LEU 528 -5.148 -3.197 -10.809 437 HD21 LEU 528 HD21 LEU 528 -3.572 -4.788 -11.785 438 HD22 LEU 528 HD22 LEU 528 -2.188 -5.366 -10.859 439 HD23 LEU 528 HD23 LEU 528 -2.220 -3.706 -11.454 440 H ILE 529 HN ILE 529 -1.096 -5.479 -5.924 441 HA ILE 529 HA ILE 529 1.035 -3.517 -5.389 442 HB ILE 529 HB ILE 529 -0.487 -5.169 -3.374 443 HG12 ILE 529 HG12 ILE 529 -1.946 -3.661 -4.786 444 HG13 ILE 529 HG11 ILE 529 -2.002 -3.392 -3.050 445 HG21 ILE 529 HG21 ILE 529 1.639 -4.267 -2.585 446 HG22 ILE 529 HG22 ILE 529 0.282 -3.480 -1.778 447 HG23 ILE 529 HG23 ILE 529 1.142 -2.645 -3.073 448 HD11 ILE 529 HD11 ILE 529 -0.419 -1.757 -5.034 449 HD12 ILE 529 HD12 ILE 529 -0.533 -1.458 -3.299 450 HD13 ILE 529 HD13 ILE 529 -1.962 -1.293 -4.319 451 H SER 530 HN SER 530 2.975 -4.224 -4.411 452 HA SER 530 HA SER 530 3.334 -7.038 -3.853 453 HB2 SER 530 HB2 SER 530 4.245 -5.858 -6.326 454 HB3 SER 530 HB1 SER 530 5.610 -6.455 -5.384 455 HG SER 530 HG SER 530 4.519 -7.987 -6.850 456 H ARG 531 HN ARG 531 5.196 -7.509 -2.693 457 HA ARG 531 HA ARG 531 5.900 -5.414 -0.867 458 HB2 ARG 531 HB2 ARG 531 5.484 -7.910 -0.379 459 HB3 ARG 531 HB1 ARG 531 7.107 -8.166 -1.002 460 HG2 ARG 531 HG2 ARG 531 7.994 -6.674 0.712 461 HG3 ARG 531 HG1 ARG 531 6.357 -6.449 1.338 462 HD2 ARG 531 HD2 ARG 531 6.192 -8.820 1.828 463 HD3 ARG 531 HD1 ARG 531 7.790 -9.097 1.141 464 HE ARG 531 HE ARG 531 8.134 -7.233 3.149 465 HH11 ARG 531 HH11 ARG 531 6.960 -10.514 2.875 466 HH12 ARG 531 HH12 ARG 531 7.470 -10.974 4.468 467 HH21 ARG 531 HH21 ARG 531 8.818 -7.820 5.257 468 HH22 ARG 531 HH22 ARG 531 8.540 -9.435 5.824 469 H TYR 532 HN TYR 532 7.817 -4.328 -0.750 470 HA TYR 532 HA TYR 532 9.256 -3.904 -3.076 471 HB2 TYR 532 HB2 TYR 532 9.083 -2.335 -1.141 472 HB3 TYR 532 HB1 TYR 532 10.211 -3.362 -0.261 473 HD1 TYR 532 HD1 TYR 532 12.552 -3.310 -0.731 474 HD2 TYR 532 HD2 TYR 532 9.826 -1.079 -3.105 475 HE1 TYR 532 HE1 TYR 532 14.442 -2.104 -1.743 476 HE2 TYR 532 HE2 TYR 532 11.707 0.140 -4.132 477 HH TYR 532 HH TYR 532 14.024 0.693 -3.667 478 H ALA 533 HN ALA 533 10.429 -5.365 -4.087 479 HA ALA 533 HA ALA 533 12.272 -7.040 -2.519 480 HB1 ALA 533 HB1 ALA 533 12.263 -8.582 -4.412 481 HB2 ALA 533 HB2 ALA 533 11.178 -7.507 -5.294 482 HB3 ALA 533 HB3 ALA 533 10.625 -8.302 -3.820 483 H GLY 534 HN GLY 534 14.159 -5.972 -2.435 484 HA2 GLY 534 HA2 GLY 534 15.515 -5.395 -4.934 485 HA3 GLY 534 HA1 GLY 534 15.195 -4.002 -3.913 486 H GLY 535 HN GLY 535 17.307 -3.528 -3.433 487 HA2 GLY 535 HA2 GLY 535 19.166 -5.520 -2.558 488 HA3 GLY 535 HA1 GLY 535 19.398 -3.780 -2.487 489 H ALA 536 HN ALA 536 17.555 -2.850 -0.875 490 HA ALA 536 HA ALA 536 17.361 -4.486 1.523 491 HB1 ALA 536 HB1 ALA 536 18.728 -1.793 1.531 492 HB2 ALA 536 HB2 ALA 536 19.514 -3.351 1.783 493 HB3 ALA 536 HB3 ALA 536 18.338 -2.757 2.955 494 H GLU 537 HN GLU 537 15.539 -4.058 2.652 495 HA GLU 537 HA GLU 537 13.550 -2.447 1.415 496 HB2 GLU 537 HB2 GLU 537 12.158 -3.082 3.393 497 HB3 GLU 537 HB1 GLU 537 12.857 -4.445 2.533 498 HG2 GLU 537 HG2 GLU 537 14.589 -4.643 4.228 499 HG3 GLU 537 HG1 GLU 537 13.920 -3.255 5.083 500 H GLU 538 HN GLU 538 15.848 -1.883 3.946 501 HA GLU 538 HA GLU 538 14.521 0.481 4.928 502 HB2 GLU 538 HB2 GLU 538 16.520 0.794 6.294 503 HB3 GLU 538 HB1 GLU 538 15.941 -0.862 6.409 504 HG2 GLU 538 HG2 GLU 538 17.659 -1.488 4.704 505 HG3 GLU 538 HG1 GLU 538 18.303 0.146 4.850 506 H ASN 539 HN ASN 539 16.292 -0.257 2.208 507 HA ASN 539 HA ASN 539 17.367 2.450 1.887 508 HB2 ASN 539 HB2 ASN 539 18.811 0.462 1.358 509 HB3 ASN 539 HB1 ASN 539 17.694 0.052 0.063 510 HD21 ASN 539 HD21 ASN 539 19.236 0.268 -1.533 511 HD22 ASN 539 HD22 ASN 539 19.863 1.803 -2.021 512 H ALA 540 HN ALA 540 14.486 1.358 1.719 513 HA ALA 540 HA ALA 540 13.672 1.769 -0.990 514 HB1 ALA 540 HB1 ALA 540 12.018 1.687 1.531 515 HB2 ALA 540 HB2 ALA 540 12.440 0.296 0.530 516 HB3 ALA 540 HB3 ALA 540 11.406 1.569 -0.119 517 HA PRO 541 HA PRO 541 13.247 6.212 -0.690 518 HB2 PRO 541 HB2 PRO 541 12.307 6.644 -3.158 519 HB3 PRO 541 HB1 PRO 541 13.981 6.139 -2.894 520 HG2 PRO 541 HG2 PRO 541 11.622 4.517 -3.736 521 HG3 PRO 541 HG1 PRO 541 13.279 4.461 -4.341 522 HD2 PRO 541 HD2 PRO 541 12.249 2.697 -2.505 523 HD3 PRO 541 HD1 PRO 541 13.975 3.075 -2.670 524 H LEU 542 HN LEU 542 11.419 7.831 -1.139 525 HA LEU 542 HA LEU 542 8.838 6.554 -0.542 526 HB2 LEU 542 HB2 LEU 542 9.879 7.394 1.521 527 HB3 LEU 542 HB1 LEU 542 9.966 8.996 0.819 528 HG LEU 542 HG LEU 542 7.504 9.081 0.730 529 HD11 LEU 542 HD11 LEU 542 7.683 6.412 2.114 530 HD12 LEU 542 HD12 LEU 542 7.002 6.731 0.520 531 HD13 LEU 542 HD13 LEU 542 6.215 7.376 1.960 532 HD21 LEU 542 HD21 LEU 542 8.641 8.424 3.442 533 HD22 LEU 542 HD22 LEU 542 7.136 9.291 3.140 534 HD23 LEU 542 HD23 LEU 542 8.675 10.000 2.653 535 H HIS 543 HN HIS 543 7.653 6.934 -2.256 536 HA HIS 543 HA HIS 543 7.829 9.405 -3.769 537 HB2 HIS 543 HB2 HIS 543 6.177 6.896 -4.098 538 HB3 HIS 543 HB1 HIS 543 6.010 8.295 -5.149 539 HD1 HIS 543 HD1 HIS 543 6.710 6.318 -6.932 540 HD2 HIS 543 HD2 HIS 543 9.680 7.787 -4.418 541 HE1 HIS 543 HE1 HIS 543 8.890 5.664 -7.999 542 HE2 HIS 543 HE2 HIS 543 10.665 6.709 -6.552 543 H LYS 544 HN LYS 544 5.693 10.509 -4.379 544 HA LYS 544 HA LYS 544 3.816 10.441 -2.113 545 HB2 LYS 544 HB2 LYS 544 3.605 12.797 -2.082 546 HB3 LYS 544 HB1 LYS 544 5.322 12.464 -2.113 547 HG2 LYS 544 HG2 LYS 544 5.272 14.122 -3.643 548 HG3 LYS 544 HG1 LYS 544 4.956 12.762 -4.720 549 HD2 LYS 544 HD2 LYS 544 3.423 14.611 -5.166 550 HD3 LYS 544 HD1 LYS 544 2.553 13.196 -4.571 551 HE2 LYS 544 HE2 LYS 544 2.403 14.176 -2.361 552 HE3 LYS 544 HE1 LYS 544 3.380 15.548 -2.874 553 HZ1 LYS 544 HZ1 LYS 544 0.971 16.002 -2.814 554 HZ2 LYS 544 HZ2 LYS 544 0.740 14.854 -4.035 555 HZ3 LYS 544 HZ3 LYS 544 1.652 16.245 -4.343 556 H LEU 545 HN LEU 545 1.611 10.829 -2.602 557 HA LEU 545 HA LEU 545 0.931 11.035 -5.432 558 HB2 LEU 545 HB2 LEU 545 -0.873 9.314 -5.080 559 HB3 LEU 545 HB1 LEU 545 0.769 8.725 -5.186 560 HG LEU 545 HG LEU 545 0.719 8.709 -2.606 561 HD11 LEU 545 HD11 LEU 545 -1.476 8.380 -1.621 562 HD12 LEU 545 HD12 LEU 545 -2.239 8.723 -3.174 563 HD13 LEU 545 HD13 LEU 545 -1.345 9.991 -2.333 564 HD21 LEU 545 HD21 LEU 545 0.786 6.731 -4.015 565 HD22 LEU 545 HD22 LEU 545 -0.966 6.797 -4.205 566 HD23 LEU 545 HD23 LEU 545 -0.261 6.481 -2.619 567 H GLY 546 HN GLY 546 -1.632 11.208 -5.582 568 HA2 GLY 546 HA2 GLY 546 -2.803 12.645 -3.366 569 HA3 GLY 546 HA1 GLY 546 -2.369 13.671 -4.726 570 H GLY 547 HN GLY 547 -4.021 10.577 -4.124 571 HA2 GLY 547 HA2 GLY 547 -6.363 11.562 -5.521 572 HA3 GLY 547 HA1 GLY 547 -5.540 10.213 -6.293
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