NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
275519 | 2koj | 16515 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 448 1HT GLY 448 -20.743 -6.507 -23.062 2 H2 GLY 448 2HT GLY 448 -19.690 -5.894 -24.225 3 H3 GLY 448 3HT GLY 448 -20.364 -4.867 -23.049 4 HA2 GLY 448 1HA GLY 448 -18.466 -7.061 -22.525 5 HA3 GLY 448 2HA GLY 448 -18.090 -5.344 -22.498 6 H SER 449 H SER 449 -17.548 -6.702 -20.257 7 HA SER 449 HA SER 449 -19.435 -5.579 -18.405 8 HB2 SER 449 2HB SER 449 -19.619 -7.749 -17.167 9 HB3 SER 449 1HB SER 449 -20.425 -7.746 -18.737 10 HG SER 449 HG SER 449 -19.240 -9.609 -18.404 11 H VAL 450 H VAL 450 -18.531 -5.315 -16.301 12 HA VAL 450 HA VAL 450 -15.716 -6.013 -16.087 13 HB VAL 450 HB VAL 450 -15.851 -3.602 -16.561 14 HG11 VAL 450 1HG1 VAL 450 -18.085 -3.113 -15.772 15 HG12 VAL 450 2HG1 VAL 450 -16.919 -2.034 -15.010 16 HG13 VAL 450 3HG1 VAL 450 -17.581 -3.397 -14.107 17 HG21 VAL 450 3HG2 VAL 450 -14.070 -4.334 -15.091 18 HG22 VAL 450 1HG2 VAL 450 -15.128 -4.168 -13.688 19 HG23 VAL 450 2HG2 VAL 450 -14.641 -2.740 -14.598 20 H TYR 451 H TYR 451 -15.158 -6.966 -14.235 21 HA TYR 451 HA TYR 451 -17.027 -6.851 -11.997 22 HB2 TYR 451 2HB TYR 451 -15.690 -9.365 -13.037 23 HB3 TYR 451 1HB TYR 451 -16.616 -9.252 -11.552 24 HD1 TYR 451 1HD TYR 451 -19.075 -8.993 -11.652 25 HD2 TYR 451 2HD TYR 451 -16.751 -9.526 -15.174 26 HE1 TYR 451 1HE TYR 451 -21.108 -9.591 -12.901 27 HE2 TYR 451 2HE TYR 451 -18.770 -10.117 -16.428 28 HH TYR 451 HH TYR 451 -20.943 -10.988 -15.990 29 H ASN 452 H ASN 452 -15.765 -5.609 -10.692 30 HA ASN 452 HA ASN 452 -12.964 -6.208 -10.415 31 HB2 ASN 452 2HB ASN 452 -13.774 -3.875 -10.086 32 HB3 ASN 452 1HB ASN 452 -14.723 -4.412 -8.700 33 HD21 ASN 452 1HD2 ASN 452 -13.602 -3.072 -7.248 34 HD22 ASN 452 2HD2 ASN 452 -11.972 -3.401 -6.799 35 H THR 453 H THR 453 -12.080 -7.519 -8.932 36 HA THR 453 HA THR 453 -13.816 -9.323 -7.676 37 HB THR 453 HB THR 453 -11.621 -10.238 -6.733 38 HG1 THR 453 1HG THR 453 -9.845 -9.360 -8.197 39 HG21 THR 453 3HG2 THR 453 -12.709 -11.164 -8.736 40 HG22 THR 453 1HG2 THR 453 -10.956 -11.167 -8.921 41 HG23 THR 453 2HG2 THR 453 -11.927 -9.939 -9.731 42 H LYS 454 H LYS 454 -14.975 -8.642 -5.981 43 HA LYS 454 HA LYS 454 -13.573 -7.142 -3.937 44 HB2 LYS 454 2HB LYS 454 -15.811 -6.271 -4.574 45 HB3 LYS 454 1HB LYS 454 -16.534 -7.801 -4.108 46 HG2 LYS 454 2HG LYS 454 -16.882 -6.054 -2.414 47 HG3 LYS 454 1HG LYS 454 -15.948 -7.409 -1.784 48 HD2 LYS 454 2HD LYS 454 -13.876 -6.143 -2.088 49 HD3 LYS 454 1HD LYS 454 -14.788 -4.797 -2.770 50 HE2 LYS 454 2HE LYS 454 -15.147 -5.884 0.018 51 HE3 LYS 454 1HE LYS 454 -14.151 -4.492 -0.383 52 HZ1 LYS 454 3HZ LYS 454 -16.117 -3.356 -1.180 53 HZ2 LYS 454 1HZ LYS 454 -16.323 -3.847 0.414 54 HZ3 LYS 454 2HZ LYS 454 -17.092 -4.689 -0.828 55 H LYS 455 H LYS 455 -12.266 -8.948 -3.676 56 HA LYS 455 HA LYS 455 -12.622 -10.474 -1.408 57 HB2 LYS 455 2HB LYS 455 -14.315 -11.638 -2.860 58 HB3 LYS 455 1HB LYS 455 -13.056 -11.973 -4.030 59 HG2 LYS 455 2HG LYS 455 -11.925 -13.410 -2.395 60 HG3 LYS 455 1HG LYS 455 -13.184 -13.036 -1.213 61 HD2 LYS 455 2HD LYS 455 -13.661 -14.372 -3.881 62 HD3 LYS 455 1HD LYS 455 -13.534 -15.220 -2.341 63 HE2 LYS 455 2HE LYS 455 -15.485 -14.021 -1.500 64 HE3 LYS 455 1HE LYS 455 -15.599 -13.105 -2.996 65 HZ1 LYS 455 3HZ LYS 455 -15.870 -16.043 -2.779 66 HZ2 LYS 455 1HZ LYS 455 -16.051 -15.130 -4.184 67 HZ3 LYS 455 2HZ LYS 455 -17.161 -14.972 -2.910 68 H VAL 456 H VAL 456 -10.655 -11.953 -1.303 69 HA VAL 456 HA VAL 456 -8.488 -12.493 -1.656 70 HB VAL 456 HB VAL 456 -8.882 -11.495 -4.524 71 HG11 VAL 456 1HG1 VAL 456 -7.044 -12.980 -5.150 72 HG12 VAL 456 2HG1 VAL 456 -6.794 -13.390 -3.454 73 HG13 VAL 456 3HG1 VAL 456 -6.523 -11.740 -4.011 74 HG21 VAL 456 3HG2 VAL 456 -10.507 -13.220 -4.011 75 HG22 VAL 456 1HG2 VAL 456 -9.227 -14.277 -3.413 76 HG23 VAL 456 2HG2 VAL 456 -9.288 -13.846 -5.121 77 H GLY 457 H GLY 457 -6.286 -11.511 -2.026 78 HA2 GLY 457 2HA GLY 457 -6.362 -8.725 -1.219 79 HA3 GLY 457 1HA GLY 457 -4.976 -9.802 -1.123 80 H LYS 458 H LYS 458 -5.864 -7.111 -2.455 81 HA LYS 458 HA LYS 458 -4.190 -7.506 -4.818 82 HB2 LYS 458 2HB LYS 458 -6.758 -5.876 -4.833 83 HB3 LYS 458 1HB LYS 458 -5.546 -5.790 -6.084 84 HG2 LYS 458 2HG LYS 458 -7.212 -7.172 -6.983 85 HG3 LYS 458 1HG LYS 458 -5.962 -8.280 -6.447 86 HD2 LYS 458 2HD LYS 458 -8.138 -9.153 -5.849 87 HD3 LYS 458 1HD LYS 458 -7.274 -8.693 -4.382 88 HE2 LYS 458 2HE LYS 458 -9.626 -7.986 -4.331 89 HE3 LYS 458 1HE LYS 458 -8.537 -6.606 -4.265 90 HZ1 LYS 458 3HZ LYS 458 -9.995 -7.590 -6.665 91 HZ2 LYS 458 1HZ LYS 458 -8.933 -6.272 -6.666 92 HZ3 LYS 458 2HZ LYS 458 -10.357 -6.214 -5.780 93 H ARG 459 H ARG 459 -3.350 -5.335 -5.633 94 HA ARG 459 HA ARG 459 -2.696 -3.812 -3.228 95 HB2 ARG 459 2HB ARG 459 -1.076 -4.101 -5.768 96 HB3 ARG 459 1HB ARG 459 -0.660 -3.088 -4.399 97 HG2 ARG 459 2HG ARG 459 0.695 -5.034 -4.155 98 HG3 ARG 459 1HG ARG 459 -0.638 -5.198 -3.029 99 HD2 ARG 459 2HD ARG 459 -0.210 -7.311 -4.199 100 HD3 ARG 459 1HD ARG 459 -1.801 -6.669 -4.607 101 HE ARG 459 HE ARG 459 0.056 -5.707 -6.439 102 HH11 ARG 459 1HH1 ARG 459 -1.469 -8.832 -5.628 103 HH12 ARG 459 2HH1 ARG 459 -1.339 -9.412 -7.218 104 HH21 ARG 459 1HH2 ARG 459 0.215 -6.547 -8.564 105 HH22 ARG 459 2HH2 ARG 459 -0.377 -8.097 -8.935 106 H LEU 460 H LEU 460 -2.845 -1.674 -3.225 107 HA LEU 460 HA LEU 460 -4.028 -0.381 -5.600 108 HB2 LEU 460 2HB LEU 460 -4.662 0.199 -2.712 109 HB3 LEU 460 1HB LEU 460 -5.335 1.017 -4.096 110 HG LEU 460 HG LEU 460 -5.853 -1.856 -3.321 111 HD11 LEU 460 1HD1 LEU 460 -7.605 0.590 -3.207 112 HD12 LEU 460 2HD1 LEU 460 -6.931 -0.279 -1.828 113 HD13 LEU 460 3HD1 LEU 460 -8.122 -1.060 -2.869 114 HD21 LEU 460 3HD2 LEU 460 -7.000 -0.200 -5.572 115 HD22 LEU 460 1HD2 LEU 460 -7.534 -1.816 -5.108 116 HD23 LEU 460 2HD2 LEU 460 -5.910 -1.578 -5.741 117 H ASN 461 H ASN 461 -3.135 1.553 -6.098 118 HA ASN 461 HA ASN 461 -1.049 2.558 -4.296 119 HB2 ASN 461 2HB ASN 461 -0.184 1.881 -6.492 120 HB3 ASN 461 1HB ASN 461 -1.327 2.964 -7.283 121 HD21 ASN 461 1HD2 ASN 461 1.571 2.759 -5.371 122 HD22 ASN 461 2HD2 ASN 461 2.107 4.363 -5.646 123 H ILE 462 H ILE 462 -1.552 4.252 -3.226 124 HA ILE 462 HA ILE 462 -3.685 5.991 -4.234 125 HB ILE 462 HB ILE 462 -2.841 5.523 -1.345 126 HG12 ILE 462 2HG1 ILE 462 -5.263 4.715 -1.088 127 HG13 ILE 462 1HG1 ILE 462 -5.320 4.636 -2.837 128 HG21 ILE 462 1HG2 ILE 462 -3.535 7.802 -1.664 129 HG22 ILE 462 2HG2 ILE 462 -4.738 6.917 -0.720 130 HG23 ILE 462 3HG2 ILE 462 -5.036 7.263 -2.418 131 HD11 ILE 462 3HD1 ILE 462 -4.922 2.459 -1.846 132 HD12 ILE 462 1HD1 ILE 462 -3.477 3.072 -1.048 133 HD13 ILE 462 2HD1 ILE 462 -3.535 2.967 -2.810 134 H GLN 463 H GLN 463 -3.088 7.957 -4.797 135 HA GLN 463 HA GLN 463 -0.492 9.042 -4.002 136 HB2 GLN 463 2HB GLN 463 -2.588 9.879 -5.990 137 HB3 GLN 463 1HB GLN 463 -1.140 10.823 -5.656 138 HG2 GLN 463 2HG GLN 463 0.232 9.279 -6.559 139 HG3 GLN 463 1HG GLN 463 -0.958 7.961 -6.508 140 HE21 GLN 463 1HE2 GLN 463 0.202 10.725 -8.204 141 HE22 GLN 463 2HE2 GLN 463 -0.797 10.558 -9.606 142 H LEU 464 H LEU 464 -0.337 10.522 -2.471 143 HA LEU 464 HA LEU 464 -2.758 12.016 -1.667 144 HB2 LEU 464 2HB LEU 464 -0.658 10.842 0.135 145 HB3 LEU 464 1HB LEU 464 -2.012 11.825 0.649 146 HG LEU 464 HG LEU 464 -2.208 9.094 -0.606 147 HD11 LEU 464 1HD1 LEU 464 -2.603 10.005 2.224 148 HD12 LEU 464 2HD1 LEU 464 -1.280 9.011 1.612 149 HD13 LEU 464 3HD1 LEU 464 -2.926 8.387 1.605 150 HD21 LEU 464 3HD2 LEU 464 -4.572 9.228 0.016 151 HD22 LEU 464 1HD2 LEU 464 -4.134 10.481 -1.144 152 HD23 LEU 464 2HD2 LEU 464 -4.331 10.889 0.561 153 H LYS 465 H LYS 465 -2.455 14.132 -1.357 154 HA LYS 465 HA LYS 465 0.285 15.238 -1.563 155 HB2 LYS 465 2HB LYS 465 -0.821 17.306 -2.244 156 HB3 LYS 465 1HB LYS 465 -1.230 15.997 -3.342 157 HG2 LYS 465 2HG LYS 465 -3.350 15.708 -2.203 158 HG3 LYS 465 1HG LYS 465 -2.929 17.017 -1.110 159 HD2 LYS 465 2HD LYS 465 -3.209 17.310 -4.109 160 HD3 LYS 465 1HD LYS 465 -4.452 17.762 -2.947 161 HE2 LYS 465 2HE LYS 465 -2.880 19.381 -1.934 162 HE3 LYS 465 1HE LYS 465 -1.678 18.927 -3.137 163 HZ1 LYS 465 3HZ LYS 465 -2.869 20.957 -3.721 164 HZ2 LYS 465 1HZ LYS 465 -4.322 20.105 -3.763 165 HZ3 LYS 465 2HZ LYS 465 -3.089 19.755 -4.868 166 H LYS 466 H LYS 466 0.983 16.561 -0.142 167 HA LYS 466 HA LYS 466 -0.167 16.261 2.460 168 HB2 LYS 466 2HB LYS 466 2.338 17.613 1.541 169 HB3 LYS 466 1HB LYS 466 1.718 17.862 3.155 170 HG2 LYS 466 2HG LYS 466 3.444 16.153 3.167 171 HG3 LYS 466 1HG LYS 466 1.888 15.472 3.600 172 HD2 LYS 466 2HD LYS 466 3.145 13.988 2.110 173 HD3 LYS 466 1HD LYS 466 1.644 14.577 1.374 174 HE2 LYS 466 2HE LYS 466 3.578 14.543 -0.134 175 HE3 LYS 466 1HE LYS 466 2.834 16.135 0.024 176 HZ1 LYS 466 3HZ LYS 466 4.667 16.655 1.654 177 HZ2 LYS 466 1HZ LYS 466 5.150 16.384 0.070 178 HZ3 LYS 466 2HZ LYS 466 5.401 15.196 1.225 179 H GLY 467 H GLY 467 -1.553 17.387 3.346 180 HA2 GLY 467 2HA GLY 467 -1.905 20.193 2.523 181 HA3 GLY 467 1HA GLY 467 -3.219 19.185 3.119 182 H THR 468 H THR 468 -3.821 20.187 4.966 183 HA THR 468 HA THR 468 -1.962 21.466 6.672 184 HB THR 468 HB THR 468 -3.952 21.716 8.190 185 HG1 THR 468 1HG THR 468 -5.631 20.587 7.816 186 HG21 THR 468 3HG2 THR 468 -3.403 23.419 6.508 187 HG22 THR 468 1HG2 THR 468 -5.152 23.256 6.684 188 HG23 THR 468 2HG2 THR 468 -4.330 22.532 5.300 189 H GLU 469 H GLU 469 -3.500 18.294 6.662 190 HA GLU 469 HA GLU 469 -2.319 17.677 9.262 191 HB2 GLU 469 2HB GLU 469 -4.102 16.044 7.450 192 HB3 GLU 469 1HB GLU 469 -3.594 15.592 9.067 193 HG2 GLU 469 2HG GLU 469 -5.300 17.969 8.367 194 HG3 GLU 469 1HG GLU 469 -5.884 16.432 8.996 195 H GLY 470 H GLY 470 -1.250 17.899 6.284 196 HA2 GLY 470 2HA GLY 470 0.556 16.998 5.174 197 HA3 GLY 470 1HA GLY 470 0.796 15.911 6.546 198 H LEU 471 H LEU 471 0.345 13.885 6.269 199 HA LEU 471 HA LEU 471 -1.000 13.024 3.855 200 HB2 LEU 471 2HB LEU 471 0.425 11.524 6.045 201 HB3 LEU 471 1HB LEU 471 -0.447 10.717 4.775 202 HG LEU 471 HG LEU 471 1.871 10.617 4.281 203 HD11 LEU 471 1HD1 LEU 471 0.525 12.595 2.478 204 HD12 LEU 471 2HD1 LEU 471 0.546 10.831 2.352 205 HD13 LEU 471 3HD1 LEU 471 2.027 11.756 2.111 206 HD21 LEU 471 3HD2 LEU 471 2.725 12.451 5.614 207 HD22 LEU 471 1HD2 LEU 471 1.951 13.617 4.536 208 HD23 LEU 471 2HD2 LEU 471 3.272 12.617 3.942 209 H GLY 472 H GLY 472 -1.344 12.666 7.344 210 HA2 GLY 472 2HA GLY 472 -3.399 12.812 8.480 211 HA3 GLY 472 1HA GLY 472 -4.235 12.483 6.970 212 H PHE 473 H PHE 473 -1.553 10.434 7.883 213 HA PHE 473 HA PHE 473 -3.296 8.600 9.209 214 HB2 PHE 473 2HB PHE 473 -2.929 6.683 7.746 215 HB3 PHE 473 1HB PHE 473 -3.703 7.980 6.858 216 HD1 PHE 473 1HD PHE 473 -2.159 9.429 5.401 217 HD2 PHE 473 2HD PHE 473 -1.055 5.612 6.904 218 HE1 PHE 473 1HE PHE 473 -0.466 9.206 3.625 219 HE2 PHE 473 2HE PHE 473 0.647 5.414 5.150 220 HZ PHE 473 HZ PHE 473 0.904 7.275 3.488 221 H SER 474 H SER 474 -2.155 6.664 9.880 222 HA SER 474 HA SER 474 0.670 7.180 10.458 223 HB2 SER 474 2HB SER 474 -0.764 7.896 12.359 224 HB3 SER 474 1HB SER 474 -1.482 6.293 12.408 225 HG SER 474 HG SER 474 1.275 6.779 12.687 226 H ILE 475 H ILE 475 1.752 5.076 11.132 227 HA ILE 475 HA ILE 475 0.412 2.743 9.945 228 HB ILE 475 HB ILE 475 2.683 1.897 9.407 229 HG12 ILE 475 2HG1 ILE 475 3.548 4.717 9.991 230 HG13 ILE 475 1HG1 ILE 475 3.892 3.246 10.917 231 HG21 ILE 475 1HG2 ILE 475 1.310 2.789 7.636 232 HG22 ILE 475 2HG2 ILE 475 3.016 3.085 7.379 233 HG23 ILE 475 3HG2 ILE 475 1.970 4.419 7.915 234 HD11 ILE 475 3HD1 ILE 475 5.753 4.093 9.454 235 HD12 ILE 475 1HD1 ILE 475 4.795 3.706 8.055 236 HD13 ILE 475 2HD1 ILE 475 5.325 2.413 9.123 237 H THR 476 H THR 476 0.808 0.774 10.918 238 HA THR 476 HA THR 476 2.068 0.772 13.557 239 HB THR 476 HB THR 476 -0.411 0.802 13.867 240 HG1 THR 476 1HG THR 476 -0.437 -1.509 14.823 241 HG21 THR 476 3HG2 THR 476 -1.079 -0.245 11.740 242 HG22 THR 476 1HG2 THR 476 -1.781 -1.098 13.117 243 HG23 THR 476 2HG2 THR 476 -0.383 -1.771 12.279 244 H SER 477 H SER 477 2.757 -1.359 14.170 245 HA SER 477 HA SER 477 3.130 -3.233 11.931 246 HB2 SER 477 2HB SER 477 5.346 -3.688 12.910 247 HB3 SER 477 1HB SER 477 5.230 -2.041 12.316 248 HG SER 477 HG SER 477 4.423 -2.137 14.883 249 H ARG 478 H ARG 478 2.760 -5.347 12.450 250 HA ARG 478 HA ARG 478 2.286 -5.902 15.271 251 HB2 ARG 478 2HB ARG 478 0.427 -7.377 14.700 252 HB3 ARG 478 1HB ARG 478 0.111 -5.718 14.226 253 HG2 ARG 478 2HG ARG 478 0.453 -6.220 11.924 254 HG3 ARG 478 1HG ARG 478 1.107 -7.816 12.313 255 HD2 ARG 478 2HD ARG 478 -1.707 -6.891 12.849 256 HD3 ARG 478 1HD ARG 478 -1.202 -7.947 11.526 257 HE ARG 478 HE ARG 478 -0.245 -9.209 13.729 258 HH11 ARG 478 1HH1 ARG 478 -3.475 -8.112 12.794 259 HH12 ARG 478 2HH1 ARG 478 -4.285 -9.268 13.737 260 HH21 ARG 478 1HH2 ARG 478 -1.314 -10.774 14.988 261 HH22 ARG 478 2HH2 ARG 478 -3.015 -10.851 15.022 262 H ASP 479 H ASP 479 2.980 -7.823 16.012 263 HA ASP 479 HA ASP 479 4.124 -9.777 16.173 264 HB2 ASP 479 2HB ASP 479 3.274 -10.145 13.284 265 HB3 ASP 479 1HB ASP 479 3.986 -11.396 14.285 266 H VAL 480 H VAL 480 5.345 -7.288 15.048 267 HA VAL 480 HA VAL 480 7.339 -8.245 13.234 268 HB VAL 480 HB VAL 480 8.270 -5.914 13.280 269 HG11 VAL 480 1HG1 VAL 480 6.450 -4.959 11.985 270 HG12 VAL 480 2HG1 VAL 480 5.330 -6.142 12.655 271 HG13 VAL 480 3HG1 VAL 480 6.641 -6.666 11.603 272 HG21 VAL 480 3HG2 VAL 480 5.833 -5.362 14.981 273 HG22 VAL 480 1HG2 VAL 480 6.910 -4.139 14.305 274 HG23 VAL 480 2HG2 VAL 480 7.509 -5.266 15.520 275 H THR 481 H THR 481 8.764 -9.545 14.039 276 HA THR 481 HA THR 481 10.143 -8.948 16.448 277 HB THR 481 HB THR 481 11.647 -10.838 15.653 278 HG1 THR 481 1HG THR 481 10.661 -12.023 13.862 279 HG21 THR 481 3HG2 THR 481 9.935 -12.577 15.923 280 HG22 THR 481 1HG2 THR 481 8.672 -11.376 15.672 281 HG23 THR 481 2HG2 THR 481 9.711 -11.278 17.094 282 H ILE 482 H ILE 482 10.839 -8.847 13.004 283 HA ILE 482 HA ILE 482 12.585 -6.534 13.395 284 HB ILE 482 HB ILE 482 13.327 -8.941 11.683 285 HG12 ILE 482 2HG1 ILE 482 14.710 -7.754 14.108 286 HG13 ILE 482 1HG1 ILE 482 13.815 -9.266 14.077 287 HG21 ILE 482 1HG2 ILE 482 14.751 -6.299 11.987 288 HG22 ILE 482 2HG2 ILE 482 13.919 -6.880 10.542 289 HG23 ILE 482 3HG2 ILE 482 15.374 -7.698 11.113 290 HD11 ILE 482 3HD1 ILE 482 16.215 -9.631 14.033 291 HD12 ILE 482 1HD1 ILE 482 16.349 -8.677 12.560 292 HD13 ILE 482 2HD1 ILE 482 15.465 -10.206 12.543 293 H GLY 483 H GLY 483 11.293 -8.670 10.826 294 HA2 GLY 483 2HA GLY 483 9.322 -7.254 9.778 295 HA3 GLY 483 1HA GLY 483 10.722 -6.403 9.133 296 H GLY 484 H GLY 484 8.998 -7.622 7.408 297 HA2 GLY 484 2HA GLY 484 9.971 -8.753 5.410 298 HA3 GLY 484 1HA GLY 484 10.535 -9.991 6.529 299 H SER 485 H SER 485 8.871 -11.156 7.751 300 HA SER 485 HA SER 485 6.572 -11.697 6.056 301 HB2 SER 485 2HB SER 485 7.948 -13.576 7.000 302 HB3 SER 485 1HB SER 485 7.491 -13.062 8.619 303 HG SER 485 HG SER 485 5.544 -13.869 8.352 304 H ALA 486 H ALA 486 7.519 -10.100 8.903 305 HA ALA 486 HA ALA 486 4.774 -9.518 9.693 306 HB1 ALA 486 1HB ALA 486 5.803 -8.670 11.759 307 HB2 ALA 486 2HB ALA 486 7.397 -9.048 11.108 308 HB3 ALA 486 3HB ALA 486 6.258 -10.348 11.453 309 HA PRO 487 HA PRO 487 5.972 -5.627 7.654 310 HB2 PRO 487 2HB PRO 487 3.698 -5.335 6.298 311 HB3 PRO 487 1HB PRO 487 4.922 -6.528 5.857 312 HG2 PRO 487 2HG PRO 487 2.252 -6.967 6.990 313 HG3 PRO 487 1HG PRO 487 3.345 -8.137 6.234 314 HD2 PRO 487 2HD PRO 487 2.914 -7.545 9.071 315 HD3 PRO 487 1HD PRO 487 3.713 -8.933 8.284 316 H ILE 488 H ILE 488 4.351 -3.679 7.027 317 HA ILE 488 HA ILE 488 3.350 -2.516 9.520 318 HB ILE 488 HB ILE 488 4.363 -1.259 6.932 319 HG12 ILE 488 2HG1 ILE 488 6.038 -2.080 8.647 320 HG13 ILE 488 1HG1 ILE 488 6.117 -0.384 8.181 321 HG21 ILE 488 1HG2 ILE 488 3.978 0.895 7.925 322 HG22 ILE 488 2HG2 ILE 488 3.168 0.076 9.276 323 HG23 ILE 488 3HG2 ILE 488 2.475 -0.007 7.657 324 HD11 ILE 488 3HD1 ILE 488 5.192 0.319 10.193 325 HD12 ILE 488 1HD1 ILE 488 6.456 -0.823 10.615 326 HD13 ILE 488 2HD1 ILE 488 4.738 -1.312 10.684 327 H TYR 489 H TYR 489 1.299 -1.805 9.657 328 HA TYR 489 HA TYR 489 -0.438 -1.847 7.281 329 HB2 TYR 489 2HB TYR 489 -1.222 -2.650 10.126 330 HB3 TYR 489 1HB TYR 489 -2.313 -2.513 8.761 331 HD1 TYR 489 2HD TYR 489 0.549 -4.425 10.091 332 HD2 TYR 489 1HD TYR 489 -2.572 -4.253 7.224 333 HE1 TYR 489 2HE TYR 489 1.042 -6.712 9.486 334 HE2 TYR 489 1HE TYR 489 -2.105 -6.577 6.559 335 HH TYR 489 HH TYR 489 -0.207 -8.667 8.384 336 H VAL 490 H VAL 490 -2.052 -0.205 7.353 337 HA VAL 490 HA VAL 490 -1.177 2.208 8.557 338 HB VAL 490 HB VAL 490 -3.920 1.558 7.442 339 HG11 VAL 490 1HG1 VAL 490 -2.607 4.226 7.970 340 HG12 VAL 490 2HG1 VAL 490 -3.961 3.538 8.866 341 HG13 VAL 490 3HG1 VAL 490 -4.162 3.986 7.174 342 HG21 VAL 490 3HG2 VAL 490 -2.154 1.221 5.803 343 HG22 VAL 490 1HG2 VAL 490 -1.532 2.843 6.122 344 HG23 VAL 490 2HG2 VAL 490 -3.132 2.632 5.405 345 H LYS 491 H LYS 491 -1.497 2.982 10.550 346 HA LYS 491 HA LYS 491 -2.904 1.294 12.460 347 HB2 LYS 491 2HB LYS 491 -0.657 2.419 12.889 348 HB3 LYS 491 1HB LYS 491 -1.552 3.913 12.988 349 HG2 LYS 491 2HG LYS 491 -2.864 3.092 14.864 350 HG3 LYS 491 1HG LYS 491 -2.029 1.545 14.813 351 HD2 LYS 491 2HD LYS 491 -0.993 2.796 16.547 352 HD3 LYS 491 1HD LYS 491 0.116 2.850 15.185 353 HE2 LYS 491 2HE LYS 491 -0.028 5.043 16.164 354 HE3 LYS 491 1HE LYS 491 -0.796 5.083 14.579 355 HZ1 LYS 491 3HZ LYS 491 -2.992 4.847 15.792 356 HZ2 LYS 491 1HZ LYS 491 -2.157 6.259 16.182 357 HZ3 LYS 491 2HZ LYS 491 -2.139 4.967 17.223 358 H ASN 492 H ASN 492 -3.327 4.463 10.952 359 HA ASN 492 HA ASN 492 -5.980 4.685 12.069 360 HB2 ASN 492 2HB ASN 492 -4.430 5.413 13.940 361 HB3 ASN 492 1HB ASN 492 -3.855 6.688 12.893 362 HD21 ASN 492 1HD2 ASN 492 -5.112 6.888 15.503 363 HD22 ASN 492 2HD2 ASN 492 -6.527 7.844 15.295 364 H ILE 493 H ILE 493 -7.161 5.897 10.750 365 HA ILE 493 HA ILE 493 -5.875 7.641 8.762 366 HB ILE 493 HB ILE 493 -8.610 6.287 8.738 367 HG12 ILE 493 2HG1 ILE 493 -6.764 4.758 8.209 368 HG13 ILE 493 1HG1 ILE 493 -7.829 5.039 6.835 369 HG21 ILE 493 1HG2 ILE 493 -7.400 8.124 6.682 370 HG22 ILE 493 2HG2 ILE 493 -8.844 8.442 7.662 371 HG23 ILE 493 3HG2 ILE 493 -8.849 7.163 6.451 372 HD11 ILE 493 3HD1 ILE 493 -5.531 5.004 6.100 373 HD12 ILE 493 1HD1 ILE 493 -5.108 6.265 7.266 374 HD13 ILE 493 2HD1 ILE 493 -6.193 6.626 5.929 375 H LEU 494 H LEU 494 -5.924 9.645 9.536 376 HA LEU 494 HA LEU 494 -7.672 10.332 11.657 377 HB2 LEU 494 2HB LEU 494 -5.659 12.001 10.131 378 HB3 LEU 494 1HB LEU 494 -6.642 12.608 11.442 379 HG LEU 494 HG LEU 494 -5.547 10.999 12.989 380 HD11 LEU 494 1HD1 LEU 494 -3.722 10.396 10.676 381 HD12 LEU 494 2HD1 LEU 494 -4.858 9.275 11.429 382 HD13 LEU 494 3HD1 LEU 494 -3.481 9.883 12.347 383 HD21 LEU 494 3HD2 LEU 494 -4.768 13.281 12.843 384 HD22 LEU 494 1HD2 LEU 494 -3.693 12.850 11.510 385 HD23 LEU 494 2HD2 LEU 494 -3.412 12.185 13.119 386 HA PRO 495 HA PRO 495 -11.294 11.795 9.657 387 HB2 PRO 495 2HB PRO 495 -11.029 14.151 11.483 388 HB3 PRO 495 1HB PRO 495 -12.432 13.124 11.167 389 HG2 PRO 495 2HG PRO 495 -11.034 12.802 13.379 390 HG3 PRO 495 1HG PRO 495 -11.620 11.391 12.481 391 HD2 PRO 495 2HD PRO 495 -8.854 12.519 12.642 392 HD3 PRO 495 1HD PRO 495 -9.398 10.832 12.535 393 H ARG 496 H ARG 496 -8.609 14.075 9.910 394 HA ARG 496 HA ARG 496 -9.530 15.246 7.379 395 HB2 ARG 496 2HB ARG 496 -7.911 16.702 9.515 396 HB3 ARG 496 1HB ARG 496 -8.273 17.334 7.926 397 HG2 ARG 496 2HG ARG 496 -9.710 18.414 9.459 398 HG3 ARG 496 1HG ARG 496 -10.697 17.242 8.590 399 HD2 ARG 496 2HD ARG 496 -10.483 15.694 10.434 400 HD3 ARG 496 1HD ARG 496 -9.503 16.864 11.318 401 HE ARG 496 HE ARG 496 -11.898 18.067 10.599 402 HH11 ARG 496 1HH1 ARG 496 -10.661 15.604 12.846 403 HH12 ARG 496 2HH1 ARG 496 -11.995 15.725 13.908 404 HH21 ARG 496 1HH2 ARG 496 -13.692 18.238 12.136 405 HH22 ARG 496 2HH2 ARG 496 -13.697 17.238 13.513 406 H GLY 497 H GLY 497 -8.003 15.377 5.765 407 HA2 GLY 497 2HA GLY 497 -5.474 15.560 5.600 408 HA3 GLY 497 1HA GLY 497 -5.500 13.980 6.350 409 H ALA 498 H ALA 498 -4.338 14.243 3.970 410 HA ALA 498 HA ALA 498 -5.943 14.067 1.692 411 HB1 ALA 498 1HB ALA 498 -3.178 12.957 2.136 412 HB2 ALA 498 2HB ALA 498 -3.560 14.600 1.636 413 HB3 ALA 498 3HB ALA 498 -3.944 13.242 0.576 414 H ALA 499 H ALA 499 -4.550 11.554 3.737 415 HA ALA 499 HA ALA 499 -5.167 9.312 2.213 416 HB1 ALA 499 1HB ALA 499 -3.697 9.206 4.131 417 HB2 ALA 499 2HB ALA 499 -4.994 8.028 4.303 418 HB3 ALA 499 3HB ALA 499 -5.045 9.533 5.216 419 H ILE 500 H ILE 500 -7.158 10.903 4.674 420 HA ILE 500 HA ILE 500 -9.187 8.935 4.378 421 HB ILE 500 HB ILE 500 -8.853 10.188 6.534 422 HG12 ILE 500 2HG1 ILE 500 -11.618 10.407 5.324 423 HG13 ILE 500 1HG1 ILE 500 -10.929 8.961 6.034 424 HG21 ILE 500 1HG2 ILE 500 -8.472 12.418 5.635 425 HG22 ILE 500 2HG2 ILE 500 -9.822 12.433 6.768 426 HG23 ILE 500 3HG2 ILE 500 -10.127 12.468 5.031 427 HD11 ILE 500 3HD1 ILE 500 -11.469 11.527 7.496 428 HD12 ILE 500 1HD1 ILE 500 -10.828 10.046 8.201 429 HD13 ILE 500 2HD1 ILE 500 -12.469 10.074 7.559 430 H GLN 501 H GLN 501 -8.541 12.047 2.942 431 HA GLN 501 HA GLN 501 -11.112 12.449 1.827 432 HB2 GLN 501 2HB GLN 501 -8.427 13.510 0.970 433 HB3 GLN 501 1HB GLN 501 -9.948 14.010 0.249 434 HG2 GLN 501 2HG GLN 501 -9.129 14.376 3.126 435 HG3 GLN 501 1HG GLN 501 -9.162 15.626 1.884 436 HE21 GLN 501 1HE2 GLN 501 -11.050 13.659 4.012 437 HE22 GLN 501 2HE2 GLN 501 -12.542 14.485 3.798 438 H ASP 502 H ASP 502 -8.280 10.707 0.744 439 HA ASP 502 HA ASP 502 -9.300 10.207 -1.871 440 HB2 ASP 502 2HB ASP 502 -6.893 10.019 -1.363 441 HB3 ASP 502 1HB ASP 502 -7.234 8.651 -0.305 442 H GLY 503 H GLY 503 -9.139 8.288 1.102 443 HA2 GLY 503 2HA GLY 503 -10.881 6.995 1.951 444 HA3 GLY 503 1HA GLY 503 -11.712 7.139 0.422 445 H ARG 504 H ARG 504 -9.013 6.168 -0.862 446 HA ARG 504 HA ARG 504 -9.803 3.398 -0.794 447 HB2 ARG 504 2HB ARG 504 -7.536 4.788 -2.204 448 HB3 ARG 504 1HB ARG 504 -7.900 3.074 -2.380 449 HG2 ARG 504 2HG ARG 504 -10.022 3.569 -3.379 450 HG3 ARG 504 1HG ARG 504 -9.818 5.292 -3.045 451 HD2 ARG 504 2HD ARG 504 -8.031 3.649 -4.826 452 HD3 ARG 504 1HD ARG 504 -9.321 4.719 -5.385 453 HE ARG 504 HE ARG 504 -7.755 6.254 -3.747 454 HH11 ARG 504 1HH1 ARG 504 -7.162 4.410 -6.717 455 HH12 ARG 504 2HH1 ARG 504 -5.976 5.491 -7.296 456 HH21 ARG 504 1HH2 ARG 504 -6.226 7.711 -4.550 457 HH22 ARG 504 2HH2 ARG 504 -5.397 7.414 -6.034 458 H LEU 505 H LEU 505 -7.432 5.357 0.676 459 HA LEU 505 HA LEU 505 -5.978 3.078 1.741 460 HB2 LEU 505 2HB LEU 505 -4.722 5.060 1.018 461 HB3 LEU 505 1HB LEU 505 -5.643 6.055 2.123 462 HG LEU 505 HG LEU 505 -4.634 4.872 4.023 463 HD11 LEU 505 1HD1 LEU 505 -3.044 3.440 1.901 464 HD12 LEU 505 2HD1 LEU 505 -4.183 2.704 3.041 465 HD13 LEU 505 3HD1 LEU 505 -2.686 3.440 3.622 466 HD21 LEU 505 3HD2 LEU 505 -2.643 5.951 2.049 467 HD22 LEU 505 1HD2 LEU 505 -2.386 5.794 3.784 468 HD23 LEU 505 2HD2 LEU 505 -3.608 6.908 3.171 469 H LYS 506 H LYS 506 -6.610 2.169 3.603 470 HA LYS 506 HA LYS 506 -8.178 3.771 5.456 471 HB2 LYS 506 2HB LYS 506 -8.718 0.926 4.659 472 HB3 LYS 506 1HB LYS 506 -9.591 1.813 5.894 473 HG2 LYS 506 2HG LYS 506 -10.433 3.337 4.167 474 HG3 LYS 506 1HG LYS 506 -9.552 2.415 2.942 475 HD2 LYS 506 2HD LYS 506 -10.793 0.391 3.640 476 HD3 LYS 506 1HD LYS 506 -11.717 1.397 4.752 477 HE2 LYS 506 2HE LYS 506 -12.576 2.699 2.878 478 HE3 LYS 506 1HE LYS 506 -11.625 1.720 1.760 479 HZ1 LYS 506 3HZ LYS 506 -13.929 0.971 1.882 480 HZ2 LYS 506 1HZ LYS 506 -13.768 0.711 3.535 481 HZ3 LYS 506 2HZ LYS 506 -12.896 -0.234 2.431 482 H ALA 507 H ALA 507 -8.380 2.428 7.590 483 HA ALA 507 HA ALA 507 -5.708 1.830 8.445 484 HB1 ALA 507 1HB ALA 507 -6.697 1.609 10.675 485 HB2 ALA 507 2HB ALA 507 -8.312 1.696 9.974 486 HB3 ALA 507 3HB ALA 507 -7.239 3.092 9.890 487 H GLY 508 H GLY 508 -4.821 -0.104 8.532 488 HA2 GLY 508 2HA GLY 508 -4.887 -2.411 9.150 489 HA3 GLY 508 1HA GLY 508 -6.528 -2.535 8.571 490 H ASP 509 H ASP 509 -5.252 -0.718 6.272 491 HA ASP 509 HA ASP 509 -4.637 -2.994 4.650 492 HB2 ASP 509 2HB ASP 509 -4.635 -0.036 3.982 493 HB3 ASP 509 1HB ASP 509 -4.230 -1.295 2.820 494 H ARG 510 H ARG 510 -2.710 -3.408 3.648 495 HA ARG 510 HA ARG 510 -0.560 -2.829 5.521 496 HB2 ARG 510 2HB ARG 510 -1.033 -5.135 5.187 497 HB3 ARG 510 1HB ARG 510 -0.860 -5.011 3.454 498 HG2 ARG 510 2HG ARG 510 1.493 -4.618 3.673 499 HG3 ARG 510 1HG ARG 510 1.347 -4.508 5.428 500 HD2 ARG 510 2HD ARG 510 2.206 -6.662 4.814 501 HD3 ARG 510 1HD ARG 510 0.593 -6.826 5.496 502 HE ARG 510 HE ARG 510 0.881 -6.755 2.610 503 HH11 ARG 510 1HH1 ARG 510 0.131 -8.643 5.567 504 HH12 ARG 510 2HH1 ARG 510 -0.212 -10.065 4.687 505 HH21 ARG 510 1HH2 ARG 510 0.384 -8.784 1.474 506 HH22 ARG 510 2HH2 ARG 510 -0.069 -10.153 2.387 507 H LEU 511 H LEU 511 1.148 -1.664 5.079 508 HA LEU 511 HA LEU 511 1.244 -0.291 2.547 509 HB2 LEU 511 2HB LEU 511 1.733 0.722 4.923 510 HB3 LEU 511 1HB LEU 511 3.233 -0.149 4.827 511 HG LEU 511 HG LEU 511 3.466 2.274 4.313 512 HD11 LEU 511 1HD1 LEU 511 5.118 0.755 3.441 513 HD12 LEU 511 2HD1 LEU 511 4.822 2.079 2.310 514 HD13 LEU 511 3HD1 LEU 511 4.135 0.479 2.005 515 HD21 LEU 511 3HD2 LEU 511 2.658 3.138 2.203 516 HD22 LEU 511 1HD2 LEU 511 1.322 2.624 3.233 517 HD23 LEU 511 2HD2 LEU 511 1.838 1.617 1.874 518 H ILE 512 H ILE 512 2.395 -1.005 0.827 519 HA ILE 512 HA ILE 512 4.211 -3.289 1.249 520 HB ILE 512 HB ILE 512 2.715 -2.455 -1.250 521 HG12 ILE 512 2HG1 ILE 512 1.181 -3.345 0.417 522 HG13 ILE 512 1HG1 ILE 512 1.384 -4.472 -0.900 523 HG21 ILE 512 1HG2 ILE 512 4.425 -4.888 -0.762 524 HG22 ILE 512 2HG2 ILE 512 4.811 -3.526 -1.815 525 HG23 ILE 512 3HG2 ILE 512 3.456 -4.585 -2.207 526 HD11 ILE 512 3HD1 ILE 512 2.923 -5.822 0.447 527 HD12 ILE 512 1HD1 ILE 512 1.360 -5.640 1.240 528 HD13 ILE 512 2HD1 ILE 512 2.736 -4.691 1.791 529 H GLU 513 H GLU 513 3.836 -0.357 -0.755 530 HA GLU 513 HA GLU 513 6.589 0.153 -0.529 531 HB2 GLU 513 2HB GLU 513 7.193 -0.033 -2.913 532 HB3 GLU 513 1HB GLU 513 6.780 -1.570 -2.183 533 HG2 GLU 513 2HG GLU 513 5.705 -1.812 -4.083 534 HG3 GLU 513 1HG GLU 513 4.455 -0.949 -3.151 535 H VAL 514 H VAL 514 7.256 1.971 -1.941 536 HA VAL 514 HA VAL 514 5.060 3.851 -2.200 537 HB VAL 514 HB VAL 514 6.154 4.270 -0.010 538 HG11 VAL 514 1HG1 VAL 514 8.473 5.181 0.070 539 HG12 VAL 514 2HG1 VAL 514 8.638 4.699 -1.641 540 HG13 VAL 514 3HG1 VAL 514 8.363 3.486 -0.415 541 HG21 VAL 514 3HG2 VAL 514 6.587 6.677 -0.290 542 HG22 VAL 514 1HG2 VAL 514 5.157 6.158 -1.185 543 HG23 VAL 514 2HG2 VAL 514 6.671 6.445 -2.037 544 H ASN 515 H ASN 515 5.236 4.984 -4.094 545 HA ASN 515 HA ASN 515 6.010 5.804 -6.096 546 HB2 ASN 515 2HB ASN 515 8.547 5.976 -4.480 547 HB3 ASN 515 1HB ASN 515 8.461 6.545 -6.139 548 HD21 ASN 515 1HD2 ASN 515 5.797 7.609 -5.983 549 HD22 ASN 515 2HD2 ASN 515 5.890 9.010 -4.996 550 H GLY 516 H GLY 516 6.487 2.752 -5.386 551 HA2 GLY 516 2HA GLY 516 6.819 1.169 -7.114 552 HA3 GLY 516 1HA GLY 516 7.907 2.303 -7.908 553 H VAL 517 H VAL 517 8.678 2.408 -4.679 554 HA VAL 517 HA VAL 517 10.954 0.653 -5.205 555 HB VAL 517 HB VAL 517 10.513 2.659 -2.968 556 HG11 VAL 517 1HG1 VAL 517 13.008 1.156 -3.768 557 HG12 VAL 517 2HG1 VAL 517 12.043 0.884 -2.319 558 HG13 VAL 517 3HG1 VAL 517 12.910 2.405 -2.528 559 HG21 VAL 517 3HG2 VAL 517 10.692 3.781 -5.130 560 HG22 VAL 517 1HG2 VAL 517 12.187 2.907 -5.472 561 HG23 VAL 517 2HG2 VAL 517 12.134 4.080 -4.156 562 H ASP 518 H ASP 518 10.852 -1.319 -4.412 563 HA ASP 518 HA ASP 518 8.706 -2.137 -2.726 564 HB2 ASP 518 2HB ASP 518 9.679 -3.589 -4.465 565 HB3 ASP 518 1HB ASP 518 11.168 -3.691 -3.525 566 H LEU 519 H LEU 519 8.638 -2.290 -0.594 567 HA LEU 519 HA LEU 519 11.147 -2.226 0.912 568 HB2 LEU 519 2HB LEU 519 10.132 -0.496 2.377 569 HB3 LEU 519 1HB LEU 519 10.493 0.045 0.748 570 HG LEU 519 HG LEU 519 8.017 -0.642 0.344 571 HD11 LEU 519 1HD1 LEU 519 7.871 0.016 3.247 572 HD12 LEU 519 2HD1 LEU 519 7.458 -1.513 2.453 573 HD13 LEU 519 3HD1 LEU 519 6.525 -0.051 2.112 574 HD21 LEU 519 3HD2 LEU 519 8.853 1.943 1.590 575 HD22 LEU 519 1HD2 LEU 519 7.319 1.656 0.740 576 HD23 LEU 519 2HD2 LEU 519 8.830 1.476 -0.131 577 H ALA 520 H ALA 520 8.592 -3.978 0.294 578 HA ALA 520 HA ALA 520 7.486 -4.434 2.887 579 HB1 ALA 520 1HB ALA 520 6.170 -4.813 0.854 580 HB2 ALA 520 2HB ALA 520 6.263 -6.277 1.836 581 HB3 ALA 520 3HB ALA 520 7.260 -6.117 0.390 582 H GLY 521 H GLY 521 10.390 -5.263 1.548 583 HA2 GLY 521 2HA GLY 521 10.677 -7.639 3.257 584 HA3 GLY 521 1HA GLY 521 11.711 -7.227 1.890 585 H LYS 522 H LYS 522 10.890 -4.524 3.637 586 HA LYS 522 HA LYS 522 13.523 -4.481 4.844 587 HB2 LYS 522 2HB LYS 522 11.584 -2.251 4.207 588 HB3 LYS 522 1HB LYS 522 13.015 -2.017 5.209 589 HG2 LYS 522 2HG LYS 522 13.017 -3.014 2.372 590 HG3 LYS 522 1HG LYS 522 13.373 -1.359 2.881 591 HD2 LYS 522 2HD LYS 522 15.261 -2.180 4.221 592 HD3 LYS 522 1HD LYS 522 14.919 -3.824 3.721 593 HE2 LYS 522 2HE LYS 522 15.689 -1.566 1.881 594 HE3 LYS 522 1HE LYS 522 16.754 -2.847 2.445 595 HZ1 LYS 522 3HZ LYS 522 14.369 -3.177 0.690 596 HZ2 LYS 522 1HZ LYS 522 15.295 -4.456 1.306 597 HZ3 LYS 522 2HZ LYS 522 16.001 -3.370 0.280 598 H SER 523 H SER 523 13.801 -3.508 6.952 599 HA SER 523 HA SER 523 12.202 -4.952 8.785 600 HB2 SER 523 2HB SER 523 14.314 -2.843 9.152 601 HB3 SER 523 1HB SER 523 13.698 -3.890 10.447 602 HG SER 523 HG SER 523 14.485 -5.298 8.264 603 H GLN 524 H GLN 524 10.946 -3.975 10.531 604 HA GLN 524 HA GLN 524 9.132 -2.110 9.521 605 HB2 GLN 524 2HB GLN 524 8.017 -2.198 11.672 606 HB3 GLN 524 1HB GLN 524 8.562 -3.805 11.243 607 HG2 GLN 524 2HG GLN 524 9.065 -3.680 13.540 608 HG3 GLN 524 1HG GLN 524 10.580 -3.237 12.741 609 HE21 GLN 524 1HE2 GLN 524 11.229 -2.221 14.619 610 HE22 GLN 524 2HE2 GLN 524 10.628 -0.646 15.024 611 H GLU 525 H GLU 525 11.982 -1.713 11.382 612 HA GLU 525 HA GLU 525 11.517 0.890 12.280 613 HB2 GLU 525 2HB GLU 525 13.231 -0.539 13.211 614 HB3 GLU 525 1HB GLU 525 14.126 -0.509 11.704 615 HG2 GLU 525 2HG GLU 525 14.454 1.930 11.971 616 HG3 GLU 525 1HG GLU 525 13.634 1.843 13.529 617 H GLU 526 H GLU 526 12.943 -0.410 9.337 618 HA GLU 526 HA GLU 526 13.964 1.937 8.210 619 HB2 GLU 526 2HB GLU 526 12.930 -0.569 6.911 620 HB3 GLU 526 1HB GLU 526 13.787 0.700 6.051 621 HG2 GLU 526 2HG GLU 526 14.900 -0.862 8.360 622 HG3 GLU 526 1HG GLU 526 15.181 -1.227 6.656 623 H VAL 527 H VAL 527 10.911 0.257 7.811 624 HA VAL 527 HA VAL 527 9.911 2.178 5.992 625 HB VAL 527 HB VAL 527 7.700 0.955 6.241 626 HG11 VAL 527 1HG1 VAL 527 8.583 -1.048 5.070 627 HG12 VAL 527 2HG1 VAL 527 10.175 -0.719 5.742 628 HG13 VAL 527 3HG1 VAL 527 9.493 0.378 4.540 629 HG21 VAL 527 3HG2 VAL 527 9.419 -0.861 7.887 630 HG22 VAL 527 1HG2 VAL 527 7.761 -1.171 7.379 631 HG23 VAL 527 2HG2 VAL 527 8.113 0.148 8.515 632 H VAL 528 H VAL 528 9.517 1.765 9.473 633 HA VAL 528 HA VAL 528 7.562 3.757 9.661 634 HB VAL 528 HB VAL 528 9.586 2.895 11.777 635 HG11 VAL 528 1HG1 VAL 528 8.825 5.194 12.239 636 HG12 VAL 528 2HG1 VAL 528 8.135 4.054 13.403 637 HG13 VAL 528 3HG1 VAL 528 7.149 4.666 12.082 638 HG21 VAL 528 3HG2 VAL 528 6.643 2.307 11.442 639 HG22 VAL 528 1HG2 VAL 528 7.655 1.746 12.771 640 HG23 VAL 528 2HG2 VAL 528 7.959 1.182 11.128 641 H SER 529 H SER 529 11.039 3.878 9.504 642 HA SER 529 HA SER 529 11.333 6.627 10.003 643 HB2 SER 529 2HB SER 529 13.206 4.988 10.067 644 HB3 SER 529 1HB SER 529 13.076 4.808 8.322 645 HG SER 529 HG SER 529 13.682 6.977 8.083 646 H LEU 530 H LEU 530 10.776 4.767 7.059 647 HA LEU 530 HA LEU 530 11.060 6.757 5.142 648 HB2 LEU 530 2HB LEU 530 9.275 4.418 5.349 649 HB3 LEU 530 1HB LEU 530 9.338 5.307 3.854 650 HG LEU 530 HG LEU 530 11.497 3.643 5.183 651 HD11 LEU 530 1HD1 LEU 530 10.174 3.412 2.492 652 HD12 LEU 530 2HD1 LEU 530 9.832 2.415 3.902 653 HD13 LEU 530 3HD1 LEU 530 11.418 2.335 3.130 654 HD21 LEU 530 3HD2 LEU 530 12.977 4.219 3.301 655 HD22 LEU 530 1HD2 LEU 530 12.585 5.628 4.283 656 HD23 LEU 530 2HD2 LEU 530 11.785 5.387 2.732 657 H LEU 531 H LEU 531 8.026 5.746 6.805 658 HA LEU 531 HA LEU 531 6.534 7.781 5.657 659 HB2 LEU 531 2HB LEU 531 6.081 5.898 7.962 660 HB3 LEU 531 1HB LEU 531 4.949 7.202 7.624 661 HG LEU 531 HG LEU 531 4.242 5.092 6.766 662 HD11 LEU 531 1HD1 LEU 531 3.529 7.082 5.579 663 HD12 LEU 531 2HD1 LEU 531 3.735 5.748 4.452 664 HD13 LEU 531 3HD1 LEU 531 4.961 7.008 4.546 665 HD21 LEU 531 3HD2 LEU 531 6.690 5.124 5.005 666 HD22 LEU 531 1HD2 LEU 531 5.348 3.990 4.846 667 HD23 LEU 531 2HD2 LEU 531 6.348 3.981 6.300 668 H ARG 532 H ARG 532 8.220 7.625 8.759 669 HA ARG 532 HA ARG 532 7.250 10.131 9.657 670 HB2 ARG 532 2HB ARG 532 9.716 8.626 10.504 671 HB3 ARG 532 1HB ARG 532 9.132 10.089 11.282 672 HG2 ARG 532 2HG ARG 532 7.731 7.427 11.138 673 HG3 ARG 532 1HG ARG 532 8.444 8.195 12.561 674 HD2 ARG 532 2HD ARG 532 6.051 9.151 10.985 675 HD3 ARG 532 1HD ARG 532 6.051 8.498 12.617 676 HE ARG 532 HE ARG 532 7.699 10.591 12.841 677 HH11 ARG 532 1HH1 ARG 532 4.450 10.294 11.497 678 HH12 ARG 532 2HH1 ARG 532 3.993 11.901 11.859 679 HH21 ARG 532 1HH2 ARG 532 7.062 12.821 13.334 680 HH22 ARG 532 2HH2 ARG 532 5.505 13.359 12.924 681 H SER 533 H SER 533 9.853 9.316 7.578 682 HA SER 533 HA SER 533 11.361 11.677 7.766 683 HB2 SER 533 2HB SER 533 12.217 9.598 6.758 684 HB3 SER 533 1HB SER 533 11.012 9.711 5.481 685 HG SER 533 HG SER 533 13.401 10.990 5.816 686 H THR 534 H THR 534 8.847 10.560 5.596 687 HA THR 534 HA THR 534 7.249 11.564 4.415 688 HB THR 534 HB THR 534 7.762 14.014 6.126 689 HG1 THR 534 1HG THR 534 6.890 11.531 6.755 690 HG21 THR 534 3HG2 THR 534 5.370 12.962 4.683 691 HG22 THR 534 1HG2 THR 534 6.327 14.359 4.175 692 HG23 THR 534 2HG2 THR 534 5.395 14.423 5.692 693 H LYS 535 H LYS 535 8.083 11.611 2.434 694 HA LYS 535 HA LYS 535 9.940 13.543 1.514 695 HB2 LYS 535 2HB LYS 535 9.471 12.557 -0.727 696 HB3 LYS 535 1HB LYS 535 9.842 11.381 0.507 697 HG2 LYS 535 2HG LYS 535 7.464 10.852 0.775 698 HG3 LYS 535 1HG LYS 535 7.076 12.036 -0.462 699 HD2 LYS 535 2HD LYS 535 7.001 9.860 -1.491 700 HD3 LYS 535 1HD LYS 535 8.417 10.683 -2.090 701 HE2 LYS 535 2HE LYS 535 8.469 8.624 0.136 702 HE3 LYS 535 1HE LYS 535 8.739 8.248 -1.555 703 HZ1 LYS 535 3HZ LYS 535 10.505 9.921 0.198 704 HZ2 LYS 535 1HZ LYS 535 10.683 9.756 -1.478 705 HZ3 LYS 535 2HZ LYS 535 10.814 8.435 -0.465 706 H MET 536 H MET 536 9.474 15.204 -0.240 707 HA MET 536 HA MET 536 6.887 16.512 0.374 708 HB2 MET 536 2HB MET 536 8.050 18.642 0.513 709 HB3 MET 536 1HB MET 536 8.470 17.541 1.835 710 HG2 MET 536 2HG MET 536 10.586 17.044 0.661 711 HG3 MET 536 1HG MET 536 10.118 18.155 -0.621 712 HE1 MET 536 3HE MET 536 8.764 20.553 1.030 713 HE2 MET 536 1HE MET 536 9.888 20.777 -0.314 714 HE3 MET 536 2HE MET 536 10.155 21.613 1.216 715 H GLU 537 H GLU 537 7.555 15.211 -2.126 716 HA GLU 537 HA GLU 537 8.213 17.252 -3.973 717 HB2 GLU 537 2HB GLU 537 8.656 14.898 -4.437 718 HB3 GLU 537 1HB GLU 537 6.937 14.548 -4.414 719 HG2 GLU 537 2HG GLU 537 6.713 15.984 -6.427 720 HG3 GLU 537 1HG GLU 537 8.463 16.145 -6.431 721 H GLY 538 H GLY 538 5.248 15.778 -2.849 722 HA2 GLY 538 2HA GLY 538 3.486 17.812 -2.876 723 HA3 GLY 538 1HA GLY 538 3.468 17.317 -4.560 724 H THR 539 H THR 539 3.141 15.048 -4.988 725 HA THR 539 HA THR 539 1.255 13.949 -3.088 726 HB THR 539 HB THR 539 0.871 12.295 -5.035 727 HG1 THR 539 1HG THR 539 1.801 14.404 -6.629 728 HG21 THR 539 3HG2 THR 539 -0.745 13.740 -6.126 729 HG22 THR 539 1HG2 THR 539 -0.019 15.170 -5.372 730 HG23 THR 539 2HG2 THR 539 -0.798 13.931 -4.374 731 H VAL 540 H VAL 540 1.581 11.968 -2.250 732 HA VAL 540 HA VAL 540 4.100 10.599 -2.889 733 HB VAL 540 HB VAL 540 2.393 10.301 -0.399 734 HG11 VAL 540 1HG1 VAL 540 3.655 8.341 -0.966 735 HG12 VAL 540 2HG1 VAL 540 4.321 9.074 0.499 736 HG13 VAL 540 3HG1 VAL 540 5.147 9.272 -1.052 737 HG21 VAL 540 3HG2 VAL 540 4.148 11.521 0.810 738 HG22 VAL 540 1HG2 VAL 540 3.386 12.520 -0.431 739 HG23 VAL 540 2HG2 VAL 540 4.980 11.815 -0.720 740 H SER 541 H SER 541 3.819 8.762 -3.965 741 HA SER 541 HA SER 541 1.130 7.670 -4.083 742 HB2 SER 541 2HB SER 541 3.582 6.978 -5.715 743 HB3 SER 541 1HB SER 541 1.925 6.470 -6.042 744 HG SER 541 HG SER 541 2.841 9.156 -5.998 745 H LEU 542 H LEU 542 0.726 6.132 -2.596 746 HA LEU 542 HA LEU 542 2.963 4.375 -1.863 747 HB2 LEU 542 2HB LEU 542 0.524 4.899 -0.170 748 HB3 LEU 542 1HB LEU 542 1.932 3.966 0.275 749 HG LEU 542 HG LEU 542 3.160 6.253 -0.066 750 HD11 LEU 542 1HD1 LEU 542 0.359 7.172 0.503 751 HD12 LEU 542 2HD1 LEU 542 1.308 7.472 -0.953 752 HD13 LEU 542 3HD1 LEU 542 1.814 8.171 0.584 753 HD21 LEU 542 3HD2 LEU 542 1.482 5.569 2.339 754 HD22 LEU 542 1HD2 LEU 542 2.790 6.765 2.319 755 HD23 LEU 542 2HD2 LEU 542 3.144 5.080 1.987 756 H LEU 543 H LEU 543 2.658 2.234 -1.907 757 HA LEU 543 HA LEU 543 0.157 1.379 -3.121 758 HB2 LEU 543 2HB LEU 543 2.332 1.205 -4.463 759 HB3 LEU 543 1HB LEU 543 2.865 0.138 -3.231 760 HG LEU 543 HG LEU 543 0.387 -0.640 -4.744 761 HD11 LEU 543 1HD1 LEU 543 3.247 -1.139 -5.573 762 HD12 LEU 543 2HD1 LEU 543 2.091 -0.113 -6.427 763 HD13 LEU 543 3HD1 LEU 543 1.810 -1.849 -6.306 764 HD21 LEU 543 3HD2 LEU 543 1.269 -2.897 -4.228 765 HD22 LEU 543 1HD2 LEU 543 0.995 -1.943 -2.766 766 HD23 LEU 543 2HD2 LEU 543 2.622 -2.146 -3.399 767 H VAL 544 H VAL 544 -1.067 0.226 -1.911 768 HA VAL 544 HA VAL 544 0.065 -1.159 0.414 769 HB VAL 544 HB VAL 544 -2.001 -0.806 1.622 770 HG11 VAL 544 1HG1 VAL 544 -0.956 1.782 0.502 771 HG12 VAL 544 2HG1 VAL 544 -0.324 0.894 1.892 772 HG13 VAL 544 3HG1 VAL 544 -1.930 1.607 1.962 773 HG21 VAL 544 3HG2 VAL 544 -3.492 -0.862 -0.247 774 HG22 VAL 544 1HG2 VAL 544 -2.945 0.718 -0.793 775 HG23 VAL 544 2HG2 VAL 544 -3.823 0.573 0.746 776 H PHE 545 H PHE 545 -1.232 -2.945 1.142 777 HA PHE 545 HA PHE 545 -2.408 -4.446 -1.106 778 HB2 PHE 545 2HB PHE 545 -0.286 -5.330 -0.121 779 HB3 PHE 545 1HB PHE 545 -1.107 -5.490 1.418 780 HD1 PHE 545 1HD PHE 545 -0.971 -6.677 -2.029 781 HD2 PHE 545 2HD PHE 545 -2.467 -7.409 1.864 782 HE1 PHE 545 1HE PHE 545 -1.590 -8.857 -2.734 783 HE2 PHE 545 2HE PHE 545 -3.121 -9.690 1.166 784 HZ PHE 545 HZ PHE 545 -2.692 -10.429 -1.134 785 H ARG 546 H ARG 546 -4.519 -4.534 -0.916 786 HA ARG 546 HA ARG 546 -5.711 -4.443 1.732 787 HB2 ARG 546 2HB ARG 546 -7.842 -3.865 0.578 788 HB3 ARG 546 1HB ARG 546 -6.575 -2.722 0.208 789 HG2 ARG 546 2HG ARG 546 -7.660 -2.997 -1.832 790 HG3 ARG 546 1HG ARG 546 -6.305 -4.113 -1.979 791 HD2 ARG 546 2HD ARG 546 -8.355 -5.136 -2.790 792 HD3 ARG 546 1HD ARG 546 -7.799 -5.970 -1.336 793 HE ARG 546 HE ARG 546 -9.645 -3.864 -0.820 794 HH11 ARG 546 1HH1 ARG 546 -9.470 -7.399 -1.620 795 HH12 ARG 546 2HH1 ARG 546 -11.058 -7.642 -1.026 796 HH21 ARG 546 1HH2 ARG 546 -11.820 -4.410 -0.054 797 HH22 ARG 546 2HH2 ARG 546 -12.314 -6.060 -0.169 798 H GLN 547 H GLN 547 -6.568 -6.231 2.595 799 HA GLN 547 HA GLN 547 -6.954 -8.492 0.780 800 HB2 GLN 547 2HB GLN 547 -4.713 -8.651 1.691 801 HB3 GLN 547 1HB GLN 547 -5.356 -8.580 3.318 802 HG2 GLN 547 2HG GLN 547 -6.537 -10.691 2.969 803 HG3 GLN 547 1HG GLN 547 -5.924 -10.762 1.322 804 HE21 GLN 547 1HE2 GLN 547 -4.888 -12.690 1.684 805 HE22 GLN 547 2HE2 GLN 547 -3.452 -12.832 2.626 806 H GLU 548 H GLU 548 -8.674 -9.634 1.140 807 HA GLU 548 HA GLU 548 -10.055 -9.307 3.665 808 HB2 GLU 548 2HB GLU 548 -10.993 -10.349 0.987 809 HB3 GLU 548 1HB GLU 548 -11.987 -10.355 2.441 810 HG2 GLU 548 2HG GLU 548 -11.807 -7.936 2.584 811 HG3 GLU 548 1HG GLU 548 -10.801 -7.920 1.145 812 H GLU 549 H GLU 549 -9.563 -10.753 5.077 813 HA GLU 549 HA GLU 549 -8.206 -13.172 4.352 814 HB2 GLU 549 2HB GLU 549 -7.489 -11.847 6.255 815 HB3 GLU 549 1HB GLU 549 -9.052 -12.063 7.020 816 HG2 GLU 549 2HG GLU 549 -8.622 -14.431 7.271 817 HG3 GLU 549 1HG GLU 549 -7.075 -14.251 6.432 818 H ALA 550 H ALA 550 -9.153 -15.006 3.912 819 HA ALA 550 HA ALA 550 -11.997 -15.332 4.406 820 HB1 ALA 550 1HB ALA 550 -10.084 -17.064 2.842 821 HB2 ALA 550 2HB ALA 550 -11.093 -15.778 2.174 822 HB3 ALA 550 3HB ALA 550 -11.842 -17.216 2.868 823 H PHE 551 H PHE 551 -9.634 -15.758 6.363 824 HA PHE 551 HA PHE 551 -10.377 -18.439 7.304 825 HB2 PHE 551 2HB PHE 551 -8.045 -16.666 7.998 826 HB3 PHE 551 1HB PHE 551 -8.356 -18.220 8.780 827 HD1 PHE 551 2HD PHE 551 -8.314 -20.291 7.324 828 HD2 PHE 551 1HD PHE 551 -6.865 -16.517 6.002 829 HE1 PHE 551 2HE PHE 551 -7.034 -21.412 5.552 830 HE2 PHE 551 1HE PHE 551 -5.582 -17.629 4.224 831 HZ PHE 551 HZ PHE 551 -5.665 -20.080 3.996 832 H HIS 552 H HIS 552 -10.848 -18.690 9.577 833 HA HIS 552 HA HIS 552 -11.717 -16.209 10.835 834 HB2 HIS 552 2HB HIS 552 -13.781 -17.306 11.645 835 HB3 HIS 552 1HB HIS 552 -13.722 -17.280 9.894 836 HD1 HIS 552 1HD HIS 552 -14.185 -19.514 8.761 837 HD2 HIS 552 2HD HIS 552 -13.148 -19.961 12.767 838 HE1 HIS 552 1HE HIS 552 -14.559 -21.921 9.292 839 HE2 HIS 552 2HE HIS 552 -14.195 -22.085 11.779 840 HA PRO 553 HA PRO 553 -9.580 -17.777 14.440 841 HB2 PRO 553 2HB PRO 553 -11.751 -16.656 16.092 842 HB3 PRO 553 1HB PRO 553 -10.034 -16.236 16.075 843 HG2 PRO 553 2HG PRO 553 -11.871 -14.560 15.099 844 HG3 PRO 553 1HG PRO 553 -10.282 -14.729 14.339 845 HD2 PRO 553 2HD PRO 553 -12.914 -15.889 13.505 846 HD3 PRO 553 1HD PRO 553 -11.626 -15.159 12.515 847 H ARG 554 H ARG 554 -9.725 -19.306 16.018 848 HA ARG 554 HA ARG 554 -11.730 -21.305 15.474 849 HB2 ARG 554 2HB ARG 554 -9.327 -21.365 17.287 850 HB3 ARG 554 1HB ARG 554 -10.291 -22.747 16.792 851 HG2 ARG 554 2HG ARG 554 -9.581 -22.499 14.504 852 HG3 ARG 554 1HG ARG 554 -8.715 -21.008 14.896 853 HD2 ARG 554 2HD ARG 554 -7.321 -22.244 16.433 854 HD3 ARG 554 1HD ARG 554 -8.133 -23.747 15.987 855 HE ARG 554 HE ARG 554 -7.113 -22.515 13.698 856 HH11 ARG 554 1HH1 ARG 554 -6.040 -24.179 16.612 857 HH12 ARG 554 2HH1 ARG 554 -4.566 -24.737 15.976 858 HH21 ARG 554 1HH2 ARG 554 -5.048 -23.223 12.779 859 HH22 ARG 554 2HH2 ARG 554 -3.973 -24.159 13.725 860 H GLU 555 H GLU 555 -13.107 -22.154 17.005 861 HA GLU 555 HA GLU 555 -14.171 -20.359 18.876 862 HB2 GLU 555 2HB GLU 555 -15.524 -22.039 17.711 863 HB3 GLU 555 1HB GLU 555 -14.644 -23.327 18.509 864 HG2 GLU 555 2HG GLU 555 -15.576 -22.676 20.645 865 HG3 GLU 555 1HG GLU 555 -16.393 -21.305 19.889 866 H MET 556 H MET 556 -12.163 -23.275 19.276 867 HA MET 556 HA MET 556 -11.041 -22.123 21.618 868 HB2 MET 556 2HB MET 556 -11.517 -23.998 23.169 869 HB3 MET 556 1HB MET 556 -12.968 -23.146 22.691 870 HG2 MET 556 2HG MET 556 -13.522 -25.441 22.755 871 HG3 MET 556 1HG MET 556 -13.381 -25.019 21.058 872 HE1 MET 556 3HE MET 556 -12.223 -28.787 21.252 873 HE2 MET 556 1HE MET 556 -13.359 -27.655 20.518 874 HE3 MET 556 2HE MET 556 -13.459 -28.006 22.241 875 H ASN 557 H ASN 557 -9.106 -23.035 22.238 876 HA ASN 557 HA ASN 557 -7.991 -24.937 20.293 877 HB2 ASN 557 2HB ASN 557 -6.676 -22.510 21.536 878 HB3 ASN 557 1HB ASN 557 -5.779 -23.763 20.697 879 HD21 ASN 557 1HD2 ASN 557 -7.976 -21.064 20.350 880 HD22 ASN 557 2HD2 ASN 557 -7.846 -20.924 18.649 881 H ALA 558 H ALA 558 -7.633 -26.793 21.282 882 HA ALA 558 HA ALA 558 -6.976 -26.779 24.116 883 HB1 ALA 558 1HB ALA 558 -8.809 -28.257 23.391 884 HB2 ALA 558 2HB ALA 558 -7.457 -29.184 24.034 885 HB3 ALA 558 3HB ALA 558 -7.705 -29.082 22.290 Start of MODEL 2 1 H1 GLY 448 1HT GLY 448 -9.259 -6.151 -22.533 2 H2 GLY 448 2HT GLY 448 -8.098 -6.620 -23.694 3 H3 GLY 448 3HT GLY 448 -8.004 -7.182 -22.101 4 HA2 GLY 448 1HA GLY 448 -10.194 -7.804 -23.968 5 HA3 GLY 448 2HA GLY 448 -8.852 -8.869 -23.563 6 H SER 449 H SER 449 -11.115 -9.971 -23.077 7 HA SER 449 HA SER 449 -12.161 -9.363 -20.498 8 HB2 SER 449 2HB SER 449 -12.528 -11.804 -22.255 9 HB3 SER 449 1HB SER 449 -13.514 -11.379 -20.859 10 HG SER 449 HG SER 449 -14.048 -9.432 -21.972 11 H VAL 450 H VAL 450 -10.880 -9.720 -18.794 12 HA VAL 450 HA VAL 450 -8.937 -11.828 -18.828 13 HB VAL 450 HB VAL 450 -9.660 -9.916 -16.584 14 HG11 VAL 450 1HG1 VAL 450 -8.552 -11.936 -15.784 15 HG12 VAL 450 2HG1 VAL 450 -7.495 -10.533 -15.631 16 HG13 VAL 450 3HG1 VAL 450 -7.246 -11.687 -16.941 17 HG21 VAL 450 3HG2 VAL 450 -7.413 -9.766 -18.591 18 HG22 VAL 450 1HG2 VAL 450 -7.659 -8.664 -17.237 19 HG23 VAL 450 2HG2 VAL 450 -8.835 -8.731 -18.554 20 H TYR 451 H TYR 451 -9.777 -13.769 -18.614 21 HA TYR 451 HA TYR 451 -12.113 -14.251 -16.975 22 HB2 TYR 451 2HB TYR 451 -10.353 -16.201 -18.470 23 HB3 TYR 451 1HB TYR 451 -11.870 -16.600 -17.676 24 HD1 TYR 451 1HD TYR 451 -13.995 -15.664 -18.558 25 HD2 TYR 451 2HD TYR 451 -10.316 -15.219 -20.627 26 HE1 TYR 451 1HE TYR 451 -15.224 -15.118 -20.605 27 HE2 TYR 451 2HE TYR 451 -11.538 -14.672 -22.688 28 HH TYR 451 HH TYR 451 -13.690 -15.044 -23.640 29 H ASN 452 H ASN 452 -8.744 -14.379 -16.662 30 HA ASN 452 HA ASN 452 -8.701 -16.243 -14.494 31 HB2 ASN 452 2HB ASN 452 -6.563 -14.401 -15.568 32 HB3 ASN 452 1HB ASN 452 -6.303 -15.616 -14.322 33 HD21 ASN 452 1HD2 ASN 452 -6.332 -17.786 -14.896 34 HD22 ASN 452 2HD2 ASN 452 -6.198 -18.314 -16.524 35 H THR 453 H THR 453 -9.549 -15.669 -12.650 36 HA THR 453 HA THR 453 -8.666 -13.208 -11.448 37 HB THR 453 HB THR 453 -10.766 -12.505 -12.433 38 HG1 THR 453 1HG THR 453 -11.167 -11.481 -10.684 39 HG21 THR 453 3HG2 THR 453 -12.058 -14.820 -10.971 40 HG22 THR 453 1HG2 THR 453 -11.856 -14.687 -12.718 41 HG23 THR 453 2HG2 THR 453 -12.920 -13.568 -11.864 42 H LYS 454 H LYS 454 -8.235 -13.405 -9.350 43 HA LYS 454 HA LYS 454 -9.390 -15.322 -7.640 44 HB2 LYS 454 2HB LYS 454 -7.332 -16.617 -7.211 45 HB3 LYS 454 1HB LYS 454 -7.898 -16.840 -8.856 46 HG2 LYS 454 2HG LYS 454 -6.200 -15.240 -9.642 47 HG3 LYS 454 1HG LYS 454 -5.620 -15.068 -7.984 48 HD2 LYS 454 2HD LYS 454 -5.106 -17.469 -7.931 49 HD3 LYS 454 1HD LYS 454 -5.668 -17.618 -9.595 50 HE2 LYS 454 2HE LYS 454 -3.925 -16.042 -10.309 51 HE3 LYS 454 1HE LYS 454 -3.361 -15.934 -8.642 52 HZ1 LYS 454 3HZ LYS 454 -3.386 -18.402 -10.294 53 HZ2 LYS 454 1HZ LYS 454 -2.907 -18.298 -8.695 54 HZ3 LYS 454 2HZ LYS 454 -2.014 -17.509 -9.880 55 H LYS 455 H LYS 455 -8.241 -15.144 -5.482 56 HA LYS 455 HA LYS 455 -6.967 -12.516 -5.297 57 HB2 LYS 455 2HB LYS 455 -8.881 -13.784 -3.379 58 HB3 LYS 455 1HB LYS 455 -7.890 -12.393 -2.988 59 HG2 LYS 455 2HG LYS 455 -8.998 -11.140 -4.781 60 HG3 LYS 455 1HG LYS 455 -10.020 -12.550 -5.101 61 HD2 LYS 455 2HD LYS 455 -10.856 -12.493 -2.845 62 HD3 LYS 455 1HD LYS 455 -9.800 -11.138 -2.456 63 HE2 LYS 455 2HE LYS 455 -10.986 -9.768 -4.113 64 HE3 LYS 455 1HE LYS 455 -12.041 -11.141 -4.460 65 HZ1 LYS 455 3HZ LYS 455 -12.868 -11.087 -2.246 66 HZ2 LYS 455 1HZ LYS 455 -13.009 -9.530 -2.880 67 HZ3 LYS 455 2HZ LYS 455 -11.732 -9.885 -1.819 68 H VAL 456 H VAL 456 -5.036 -12.568 -4.629 69 HA VAL 456 HA VAL 456 -4.328 -14.444 -2.475 70 HB VAL 456 HB VAL 456 -2.892 -14.633 -4.556 71 HG11 VAL 456 1HG1 VAL 456 -2.952 -12.353 -5.322 72 HG12 VAL 456 2HG1 VAL 456 -1.279 -12.871 -5.096 73 HG13 VAL 456 3HG1 VAL 456 -2.047 -11.820 -3.907 74 HG21 VAL 456 3HG2 VAL 456 -1.947 -15.301 -2.420 75 HG22 VAL 456 1HG2 VAL 456 -1.442 -13.641 -2.100 76 HG23 VAL 456 2HG2 VAL 456 -0.706 -14.550 -3.420 77 H GLY 457 H GLY 457 -5.059 -11.374 -3.457 78 HA2 GLY 457 2HA GLY 457 -5.478 -9.898 -1.415 79 HA3 GLY 457 1HA GLY 457 -3.713 -9.921 -1.317 80 H LYS 458 H LYS 458 -5.944 -7.902 -2.244 81 HA LYS 458 HA LYS 458 -5.023 -7.503 -4.976 82 HB2 LYS 458 2HB LYS 458 -7.475 -7.542 -4.247 83 HB3 LYS 458 1HB LYS 458 -7.159 -5.978 -3.515 84 HG2 LYS 458 2HG LYS 458 -8.149 -5.612 -5.645 85 HG3 LYS 458 1HG LYS 458 -6.442 -5.168 -5.772 86 HD2 LYS 458 2HD LYS 458 -5.929 -7.321 -6.757 87 HD3 LYS 458 1HD LYS 458 -7.599 -7.828 -6.563 88 HE2 LYS 458 2HE LYS 458 -8.283 -5.985 -8.096 89 HE3 LYS 458 1HE LYS 458 -6.578 -5.611 -8.332 90 HZ1 LYS 458 3HZ LYS 458 -7.867 -8.197 -8.972 91 HZ2 LYS 458 1HZ LYS 458 -6.257 -7.850 -9.237 92 HZ3 LYS 458 2HZ LYS 458 -7.451 -7.016 -10.101 93 H ARG 459 H ARG 459 -3.788 -5.749 -5.536 94 HA ARG 459 HA ARG 459 -3.133 -3.954 -3.344 95 HB2 ARG 459 2HB ARG 459 -1.432 -4.817 -5.671 96 HB3 ARG 459 1HB ARG 459 -1.029 -3.464 -4.619 97 HG2 ARG 459 2HG ARG 459 -0.966 -4.916 -2.703 98 HG3 ARG 459 1HG ARG 459 -1.425 -6.305 -3.686 99 HD2 ARG 459 2HD ARG 459 1.104 -4.655 -3.909 100 HD3 ARG 459 1HD ARG 459 0.976 -6.263 -3.219 101 HE ARG 459 HE ARG 459 0.061 -6.710 -5.637 102 HH11 ARG 459 1HH1 ARG 459 2.915 -4.802 -4.671 103 HH12 ARG 459 2HH1 ARG 459 3.824 -5.225 -6.037 104 HH21 ARG 459 1HH2 ARG 459 1.358 -7.296 -7.501 105 HH22 ARG 459 2HH2 ARG 459 2.938 -6.670 -7.678 106 H LEU 460 H LEU 460 -3.270 -1.904 -3.499 107 HA LEU 460 HA LEU 460 -4.280 -0.729 -6.014 108 HB2 LEU 460 2HB LEU 460 -5.273 -0.073 -3.232 109 HB3 LEU 460 1HB LEU 460 -5.680 0.831 -4.665 110 HG LEU 460 HG LEU 460 -6.808 -1.273 -5.529 111 HD11 LEU 460 1HD1 LEU 460 -6.481 -2.176 -2.681 112 HD12 LEU 460 2HD1 LEU 460 -5.748 -2.916 -4.102 113 HD13 LEU 460 3HD1 LEU 460 -7.499 -2.945 -3.896 114 HD21 LEU 460 3HD2 LEU 460 -7.866 -0.009 -3.012 115 HD22 LEU 460 1HD2 LEU 460 -8.820 -0.910 -4.189 116 HD23 LEU 460 2HD2 LEU 460 -8.054 0.609 -4.652 117 H ASN 461 H ASN 461 -3.814 1.501 -6.312 118 HA ASN 461 HA ASN 461 -1.525 2.391 -4.718 119 HB2 ASN 461 2HB ASN 461 -0.715 3.600 -6.715 120 HB3 ASN 461 1HB ASN 461 -0.867 1.878 -7.029 121 HD21 ASN 461 1HD2 ASN 461 -1.972 5.046 -7.865 122 HD22 ASN 461 2HD2 ASN 461 -2.971 4.574 -9.169 123 H ILE 462 H ILE 462 -1.708 4.186 -3.646 124 HA ILE 462 HA ILE 462 -3.907 6.031 -4.301 125 HB ILE 462 HB ILE 462 -2.970 5.263 -1.501 126 HG12 ILE 462 2HG1 ILE 462 -5.435 4.607 -1.179 127 HG13 ILE 462 1HG1 ILE 462 -5.571 4.691 -2.923 128 HG21 ILE 462 1HG2 ILE 462 -3.499 7.598 -1.578 129 HG22 ILE 462 2HG2 ILE 462 -4.729 6.736 -0.653 130 HG23 ILE 462 3HG2 ILE 462 -5.066 7.251 -2.306 131 HD11 ILE 462 3HD1 ILE 462 -5.320 2.423 -2.145 132 HD12 ILE 462 1HD1 ILE 462 -3.787 2.834 -1.372 133 HD13 ILE 462 2HD1 ILE 462 -3.934 2.893 -3.131 134 H GLN 463 H GLN 463 -3.267 8.149 -4.478 135 HA GLN 463 HA GLN 463 -0.517 8.733 -3.660 136 HB2 GLN 463 2HB GLN 463 -2.276 10.130 -5.671 137 HB3 GLN 463 1HB GLN 463 -0.687 10.694 -5.183 138 HG2 GLN 463 2HG GLN 463 0.324 8.735 -6.011 139 HG3 GLN 463 1HG GLN 463 -1.240 8.037 -6.487 140 HE21 GLN 463 1HE2 GLN 463 1.275 10.215 -7.209 141 HE22 GLN 463 2HE2 GLN 463 0.725 10.727 -8.762 142 H LEU 464 H LEU 464 -0.147 10.103 -2.124 143 HA LEU 464 HA LEU 464 -2.446 11.611 -1.090 144 HB2 LEU 464 2HB LEU 464 -0.052 10.573 0.430 145 HB3 LEU 464 1HB LEU 464 -1.342 11.524 1.118 146 HG LEU 464 HG LEU 464 -1.721 9.349 1.844 147 HD11 LEU 464 1HD1 LEU 464 -3.736 10.372 1.158 148 HD12 LEU 464 2HD1 LEU 464 -3.805 8.635 0.851 149 HD13 LEU 464 3HD1 LEU 464 -3.540 9.757 -0.484 150 HD21 LEU 464 3HD2 LEU 464 -0.217 8.122 0.386 151 HD22 LEU 464 1HD2 LEU 464 -1.313 8.350 -0.975 152 HD23 LEU 464 2HD2 LEU 464 -1.807 7.355 0.392 153 H LYS 465 H LYS 465 -2.203 13.725 -0.832 154 HA LYS 465 HA LYS 465 0.435 14.959 -1.357 155 HB2 LYS 465 2HB LYS 465 -1.191 15.359 -3.147 156 HB3 LYS 465 1HB LYS 465 -2.354 15.947 -1.959 157 HG2 LYS 465 2HG LYS 465 -0.816 17.785 -1.427 158 HG3 LYS 465 1HG LYS 465 0.296 17.186 -2.659 159 HD2 LYS 465 2HD LYS 465 -1.409 17.506 -4.360 160 HD3 LYS 465 1HD LYS 465 -2.536 18.097 -3.139 161 HE2 LYS 465 2HE LYS 465 -0.997 19.918 -2.619 162 HE3 LYS 465 1HE LYS 465 0.108 19.322 -3.850 163 HZ1 LYS 465 3HZ LYS 465 -1.176 21.126 -4.719 164 HZ2 LYS 465 1HZ LYS 465 -2.634 20.379 -4.326 165 HZ3 LYS 465 2HZ LYS 465 -1.627 19.709 -5.514 166 H LYS 466 H LYS 466 1.138 16.343 -0.003 167 HA LYS 466 HA LYS 466 -0.015 16.233 2.586 168 HB2 LYS 466 2HB LYS 466 2.391 17.681 1.570 169 HB3 LYS 466 1HB LYS 466 1.750 17.952 3.171 170 HG2 LYS 466 2HG LYS 466 3.604 16.405 3.244 171 HG3 LYS 466 1HG LYS 466 2.117 15.593 3.718 172 HD2 LYS 466 2HD LYS 466 3.527 14.198 2.255 173 HD3 LYS 466 1HD LYS 466 1.953 14.600 1.541 174 HE2 LYS 466 2HE LYS 466 3.902 14.743 0.018 175 HE3 LYS 466 1HE LYS 466 2.897 16.189 0.093 176 HZ1 LYS 466 3HZ LYS 466 4.564 17.108 1.700 177 HZ2 LYS 466 1HZ LYS 466 5.134 16.901 0.173 178 HZ3 LYS 466 2HZ LYS 466 5.555 15.768 1.394 179 H GLY 467 H GLY 467 -1.434 17.316 3.335 180 HA2 GLY 467 2HA GLY 467 -1.922 20.048 2.355 181 HA3 GLY 467 1HA GLY 467 -3.124 19.029 3.152 182 H THR 468 H THR 468 -3.578 20.375 4.852 183 HA THR 468 HA THR 468 -1.545 21.595 6.404 184 HB THR 468 HB THR 468 -3.349 22.118 7.977 185 HG1 THR 468 1HG THR 468 -4.694 20.416 8.018 186 HG21 THR 468 3HG2 THR 468 -3.110 23.514 5.976 187 HG22 THR 468 1HG2 THR 468 -4.805 23.365 6.435 188 HG23 THR 468 2HG2 THR 468 -4.172 22.428 5.083 189 H GLU 469 H GLU 469 -3.106 18.492 6.402 190 HA GLU 469 HA GLU 469 -2.170 17.865 9.087 191 HB2 GLU 469 2HB GLU 469 -3.807 16.203 7.188 192 HB3 GLU 469 1HB GLU 469 -3.558 15.921 8.906 193 HG2 GLU 469 2HG GLU 469 -5.086 18.171 7.631 194 HG3 GLU 469 1HG GLU 469 -5.736 16.843 8.589 195 H GLY 470 H GLY 470 -0.717 17.997 6.274 196 HA2 GLY 470 2HA GLY 470 1.069 16.911 5.351 197 HA3 GLY 470 1HA GLY 470 1.097 15.865 6.773 198 H LEU 471 H LEU 471 0.651 13.823 6.423 199 HA LEU 471 HA LEU 471 -0.629 13.069 3.943 200 HB2 LEU 471 2HB LEU 471 0.749 11.465 6.085 201 HB3 LEU 471 1HB LEU 471 -0.113 10.709 4.777 202 HG LEU 471 HG LEU 471 2.213 10.632 4.280 203 HD11 LEU 471 1HD1 LEU 471 0.928 12.751 2.587 204 HD12 LEU 471 2HD1 LEU 471 0.842 11.000 2.369 205 HD13 LEU 471 3HD1 LEU 471 2.373 11.850 2.165 206 HD21 LEU 471 3HD2 LEU 471 3.045 12.409 5.711 207 HD22 LEU 471 1HD2 LEU 471 2.296 13.620 4.665 208 HD23 LEU 471 2HD2 LEU 471 3.617 12.630 4.051 209 H GLY 472 H GLY 472 -1.163 12.617 7.411 210 HA2 GLY 472 2HA GLY 472 -3.303 12.797 8.411 211 HA3 GLY 472 1HA GLY 472 -4.020 12.582 6.824 212 H PHE 473 H PHE 473 -1.576 10.327 7.761 213 HA PHE 473 HA PHE 473 -3.433 8.542 9.023 214 HB2 PHE 473 2HB PHE 473 -3.080 6.671 7.492 215 HB3 PHE 473 1HB PHE 473 -3.829 8.009 6.638 216 HD1 PHE 473 1HD PHE 473 -2.299 9.499 5.248 217 HD2 PHE 473 2HD PHE 473 -1.139 5.655 6.671 218 HE1 PHE 473 1HE PHE 473 -0.563 9.367 3.520 219 HE2 PHE 473 2HE PHE 473 0.620 5.574 4.947 220 HZ PHE 473 HZ PHE 473 0.859 7.462 3.384 221 H SER 474 H SER 474 -2.322 6.645 9.812 222 HA SER 474 HA SER 474 0.555 7.126 10.127 223 HB2 SER 474 2HB SER 474 -1.375 6.215 12.269 224 HB3 SER 474 1HB SER 474 0.353 6.508 12.472 225 HG SER 474 HG SER 474 -0.175 8.716 11.719 226 H ILE 475 H ILE 475 1.644 5.081 10.868 227 HA ILE 475 HA ILE 475 0.325 2.726 9.694 228 HB ILE 475 HB ILE 475 2.591 1.927 9.158 229 HG12 ILE 475 2HG1 ILE 475 3.458 4.741 9.811 230 HG13 ILE 475 1HG1 ILE 475 3.800 3.279 10.743 231 HG21 ILE 475 1HG2 ILE 475 1.224 2.889 7.419 232 HG22 ILE 475 2HG2 ILE 475 2.923 3.235 7.163 233 HG23 ILE 475 3HG2 ILE 475 1.852 4.508 7.778 234 HD11 ILE 475 3HD1 ILE 475 5.665 4.081 9.327 235 HD12 ILE 475 1HD1 ILE 475 4.702 3.758 7.902 236 HD13 ILE 475 2HD1 ILE 475 5.186 2.420 8.950 237 H THR 476 H THR 476 0.779 0.765 10.719 238 HA THR 476 HA THR 476 1.933 0.916 13.399 239 HB THR 476 HB THR 476 -0.553 0.846 13.622 240 HG1 THR 476 1HG THR 476 0.729 -0.307 15.138 241 HG21 THR 476 3HG2 THR 476 -1.093 -0.266 11.492 242 HG22 THR 476 1HG2 THR 476 -1.828 -1.106 12.856 243 HG23 THR 476 2HG2 THR 476 -0.376 -1.759 12.095 244 H SER 477 H SER 477 2.863 -1.057 14.104 245 HA SER 477 HA SER 477 3.134 -3.144 12.109 246 HB2 SER 477 2HB SER 477 5.526 -3.294 12.690 247 HB3 SER 477 1HB SER 477 5.140 -1.736 11.993 248 HG SER 477 HG SER 477 6.445 -1.481 13.842 249 H ARG 478 H ARG 478 2.925 -5.120 13.040 250 HA ARG 478 HA ARG 478 3.046 -5.114 15.932 251 HB2 ARG 478 2HB ARG 478 1.388 -6.963 15.955 252 HB3 ARG 478 1HB ARG 478 0.738 -5.430 15.415 253 HG2 ARG 478 2HG ARG 478 0.805 -6.228 13.098 254 HG3 ARG 478 1HG ARG 478 1.481 -7.767 13.652 255 HD2 ARG 478 2HD ARG 478 -0.486 -8.188 14.987 256 HD3 ARG 478 1HD ARG 478 -1.153 -6.622 14.546 257 HE ARG 478 HE ARG 478 -0.687 -8.067 12.214 258 HH11 ARG 478 1HH1 ARG 478 -2.764 -8.170 15.061 259 HH12 ARG 478 2HH1 ARG 478 -4.060 -8.961 14.297 260 HH21 ARG 478 1HH2 ARG 478 -2.495 -9.124 11.111 261 HH22 ARG 478 2HH2 ARG 478 -3.908 -9.482 11.967 262 H ASP 479 H ASP 479 4.440 -6.350 16.797 263 HA ASP 479 HA ASP 479 6.045 -7.926 15.041 264 HB2 ASP 479 2HB ASP 479 6.395 -7.164 17.942 265 HB3 ASP 479 1HB ASP 479 7.493 -8.256 17.105 266 H VAL 480 H VAL 480 4.949 -9.563 14.473 267 HA VAL 480 HA VAL 480 4.240 -11.522 16.528 268 HB VAL 480 HB VAL 480 2.504 -12.396 14.963 269 HG11 VAL 480 1HG1 VAL 480 2.170 -9.477 15.647 270 HG12 VAL 480 2HG1 VAL 480 1.842 -10.843 16.714 271 HG13 VAL 480 3HG1 VAL 480 0.864 -10.600 15.264 272 HG21 VAL 480 3HG2 VAL 480 1.796 -11.051 13.037 273 HG22 VAL 480 1HG2 VAL 480 3.467 -11.588 12.866 274 HG23 VAL 480 2HG2 VAL 480 3.122 -9.925 13.336 275 H THR 481 H THR 481 4.147 -13.774 15.477 276 HA THR 481 HA THR 481 6.715 -14.317 14.561 277 HB THR 481 HB THR 481 5.692 -16.686 14.331 278 HG1 THR 481 1HG THR 481 3.588 -16.541 14.424 279 HG21 THR 481 3HG2 THR 481 7.107 -15.948 16.206 280 HG22 THR 481 1HG2 THR 481 5.788 -16.969 16.779 281 HG23 THR 481 2HG2 THR 481 5.701 -15.219 16.982 282 H ILE 482 H ILE 482 7.090 -13.378 12.687 283 HA ILE 482 HA ILE 482 6.066 -14.683 10.256 284 HB ILE 482 HB ILE 482 6.254 -11.665 10.631 285 HG12 ILE 482 2HG1 ILE 482 4.125 -12.686 11.368 286 HG13 ILE 482 1HG1 ILE 482 3.887 -11.589 10.009 287 HG21 ILE 482 1HG2 ILE 482 5.660 -11.408 8.255 288 HG22 ILE 482 2HG2 ILE 482 5.818 -13.150 8.046 289 HG23 ILE 482 3HG2 ILE 482 7.228 -12.185 8.487 290 HD11 ILE 482 3HD1 ILE 482 3.941 -14.608 9.922 291 HD12 ILE 482 1HD1 ILE 482 3.771 -13.557 8.514 292 HD13 ILE 482 2HD1 ILE 482 2.528 -13.570 9.760 293 H GLY 483 H GLY 483 8.421 -12.421 11.658 294 HA2 GLY 483 2HA GLY 483 10.654 -13.847 10.781 295 HA3 GLY 483 1HA GLY 483 10.353 -12.499 9.679 296 H GLY 484 H GLY 484 12.384 -11.606 10.467 297 HA2 GLY 484 2HA GLY 484 12.579 -10.795 13.209 298 HA3 GLY 484 1HA GLY 484 13.611 -10.254 11.888 299 H SER 485 H SER 485 11.258 -9.516 10.334 300 HA SER 485 HA SER 485 10.245 -7.205 11.801 301 HB2 SER 485 2HB SER 485 11.196 -7.269 8.924 302 HB3 SER 485 1HB SER 485 10.385 -5.905 9.694 303 HG SER 485 HG SER 485 12.890 -7.034 10.399 304 H ALA 486 H ALA 486 8.140 -6.593 11.150 305 HA ALA 486 HA ALA 486 6.731 -8.609 9.580 306 HB1 ALA 486 1HB ALA 486 4.761 -8.097 10.979 307 HB2 ALA 486 2HB ALA 486 5.739 -6.979 11.925 308 HB3 ALA 486 3HB ALA 486 6.112 -8.703 11.942 309 HA PRO 487 HA PRO 487 5.574 -5.364 6.780 310 HB2 PRO 487 2HB PRO 487 2.815 -6.446 6.887 311 HB3 PRO 487 1HB PRO 487 3.869 -6.196 5.491 312 HG2 PRO 487 2HG PRO 487 3.426 -8.646 6.418 313 HG3 PRO 487 1HG PRO 487 5.037 -8.159 5.855 314 HD2 PRO 487 2HD PRO 487 4.008 -8.439 8.649 315 HD3 PRO 487 1HD PRO 487 5.584 -8.900 7.965 316 H ILE 488 H ILE 488 4.216 -3.538 6.523 317 HA ILE 488 HA ILE 488 3.308 -2.467 9.072 318 HB ILE 488 HB ILE 488 4.165 -1.125 6.486 319 HG12 ILE 488 2HG1 ILE 488 5.932 -1.961 8.012 320 HG13 ILE 488 1HG1 ILE 488 5.913 -0.218 7.744 321 HG21 ILE 488 1HG2 ILE 488 3.815 0.991 7.570 322 HG22 ILE 488 2HG2 ILE 488 3.067 0.124 8.925 323 HG23 ILE 488 3HG2 ILE 488 2.301 0.096 7.334 324 HD11 ILE 488 3HD1 ILE 488 4.967 0.163 9.886 325 HD12 ILE 488 1HD1 ILE 488 6.397 -0.849 10.057 326 HD13 ILE 488 2HD1 ILE 488 4.795 -1.591 10.153 327 H TYR 489 H TYR 489 1.309 -1.806 9.405 328 HA TYR 489 HA TYR 489 -0.598 -1.869 7.163 329 HB2 TYR 489 2HB TYR 489 -1.133 -2.514 10.076 330 HB3 TYR 489 1HB TYR 489 -2.334 -2.496 8.792 331 HD1 TYR 489 1HD TYR 489 -2.348 -4.216 7.095 332 HD2 TYR 489 2HD TYR 489 0.407 -4.324 10.315 333 HE1 TYR 489 1HE TYR 489 -1.813 -6.572 6.556 334 HE2 TYR 489 2HE TYR 489 0.938 -6.630 9.839 335 HH TYR 489 HH TYR 489 -0.123 -8.540 8.724 336 H VAL 490 H VAL 490 -2.208 -0.278 7.309 337 HA VAL 490 HA VAL 490 -1.291 2.181 8.437 338 HB VAL 490 HB VAL 490 -4.019 1.503 7.310 339 HG11 VAL 490 1HG1 VAL 490 -2.724 4.187 7.809 340 HG12 VAL 490 2HG1 VAL 490 -4.075 3.513 8.717 341 HG13 VAL 490 3HG1 VAL 490 -4.276 3.929 7.014 342 HG21 VAL 490 3HG2 VAL 490 -2.253 1.164 5.684 343 HG22 VAL 490 1HG2 VAL 490 -1.630 2.788 6.000 344 HG23 VAL 490 2HG2 VAL 490 -3.227 2.576 5.278 345 H LYS 491 H LYS 491 -1.549 2.906 10.424 346 HA LYS 491 HA LYS 491 -2.798 1.242 12.404 347 HB2 LYS 491 2HB LYS 491 -0.719 2.607 12.834 348 HB3 LYS 491 1HB LYS 491 -1.720 4.035 12.742 349 HG2 LYS 491 2HG LYS 491 -2.964 3.420 14.695 350 HG3 LYS 491 1HG LYS 491 -2.180 1.846 14.762 351 HD2 LYS 491 2HD LYS 491 -1.193 3.293 16.425 352 HD3 LYS 491 1HD LYS 491 -0.012 2.986 15.157 353 HE2 LYS 491 2HE LYS 491 0.077 5.306 15.781 354 HE3 LYS 491 1HE LYS 491 -0.587 5.184 14.161 355 HZ1 LYS 491 3HZ LYS 491 -2.837 5.520 15.134 356 HZ2 LYS 491 1HZ LYS 491 -1.795 6.773 15.510 357 HZ3 LYS 491 2HZ LYS 491 -2.161 5.623 16.656 358 H ASN 492 H ASN 492 -3.641 4.239 10.784 359 HA ASN 492 HA ASN 492 -6.377 3.970 11.199 360 HB2 ASN 492 2HB ASN 492 -5.767 4.535 13.570 361 HB3 ASN 492 1HB ASN 492 -5.109 6.060 12.998 362 HD21 ASN 492 1HD2 ASN 492 -6.567 7.291 14.198 363 HD22 ASN 492 2HD2 ASN 492 -8.235 7.399 13.801 364 H ILE 493 H ILE 493 -7.488 5.682 10.254 365 HA ILE 493 HA ILE 493 -5.890 7.435 8.550 366 HB ILE 493 HB ILE 493 -8.810 6.579 8.392 367 HG12 ILE 493 2HG1 ILE 493 -7.314 4.724 7.869 368 HG13 ILE 493 1HG1 ILE 493 -8.173 5.278 6.437 369 HG21 ILE 493 1HG2 ILE 493 -7.182 8.142 6.388 370 HG22 ILE 493 2HG2 ILE 493 -8.489 8.801 7.384 371 HG23 ILE 493 3HG2 ILE 493 -8.824 7.577 6.162 372 HD11 ILE 493 3HD1 ILE 493 -5.880 4.763 5.916 373 HD12 ILE 493 1HD1 ILE 493 -5.308 5.906 7.133 374 HD13 ILE 493 2HD1 ILE 493 -6.181 6.484 5.710 375 H LEU 494 H LEU 494 -5.745 9.457 9.371 376 HA LEU 494 HA LEU 494 -7.252 10.239 11.617 377 HB2 LEU 494 2HB LEU 494 -5.356 11.770 9.827 378 HB3 LEU 494 1HB LEU 494 -6.194 12.544 11.149 379 HG LEU 494 HG LEU 494 -5.022 11.061 12.754 380 HD11 LEU 494 1HD1 LEU 494 -3.511 10.059 10.364 381 HD12 LEU 494 2HD1 LEU 494 -4.639 9.115 11.338 382 HD13 LEU 494 3HD1 LEU 494 -3.135 9.706 12.049 383 HD21 LEU 494 3HD2 LEU 494 -4.082 13.230 12.228 384 HD22 LEU 494 1HD2 LEU 494 -3.202 12.537 10.866 385 HD23 LEU 494 2HD2 LEU 494 -2.803 12.053 12.515 386 HA PRO 495 HA PRO 495 -10.979 11.797 9.901 387 HB2 PRO 495 2HB PRO 495 -10.693 14.159 11.680 388 HB3 PRO 495 1HB PRO 495 -12.021 12.998 11.560 389 HG2 PRO 495 2HG PRO 495 -10.360 12.921 13.618 390 HG3 PRO 495 1HG PRO 495 -10.928 11.420 12.867 391 HD2 PRO 495 2HD PRO 495 -8.287 12.799 12.577 392 HD3 PRO 495 1HD PRO 495 -8.648 11.066 12.735 393 H ARG 496 H ARG 496 -8.145 13.717 9.818 394 HA ARG 496 HA ARG 496 -9.266 15.326 7.628 395 HB2 ARG 496 2HB ARG 496 -7.412 16.363 9.774 396 HB3 ARG 496 1HB ARG 496 -8.086 17.280 8.438 397 HG2 ARG 496 2HG ARG 496 -10.318 17.048 9.424 398 HG3 ARG 496 1HG ARG 496 -9.628 16.098 10.738 399 HD2 ARG 496 2HD ARG 496 -8.172 18.028 11.292 400 HD3 ARG 496 1HD ARG 496 -9.014 18.960 10.062 401 HE ARG 496 HE ARG 496 -10.863 17.856 11.852 402 HH11 ARG 496 1HH1 ARG 496 -8.449 20.396 11.579 403 HH12 ARG 496 2HH1 ARG 496 -9.067 21.357 12.839 404 HH21 ARG 496 1HH2 ARG 496 -11.755 19.163 13.615 405 HH22 ARG 496 2HH2 ARG 496 -11.009 20.637 14.025 406 H GLY 497 H GLY 497 -7.919 15.198 5.843 407 HA2 GLY 497 2HA GLY 497 -5.452 15.691 5.444 408 HA3 GLY 497 1HA GLY 497 -5.192 14.191 6.300 409 H ALA 498 H ALA 498 -4.136 14.194 3.979 410 HA ALA 498 HA ALA 498 -5.553 13.902 1.631 411 HB1 ALA 498 1HB ALA 498 -2.962 12.581 2.387 412 HB2 ALA 498 2HB ALA 498 -3.135 14.220 1.769 413 HB3 ALA 498 3HB ALA 498 -3.559 12.843 0.752 414 H ALA 499 H ALA 499 -4.594 11.413 3.938 415 HA ALA 499 HA ALA 499 -5.379 9.231 2.360 416 HB1 ALA 499 1HB ALA 499 -3.879 8.948 4.209 417 HB2 ALA 499 2HB ALA 499 -5.274 7.904 4.397 418 HB3 ALA 499 3HB ALA 499 -5.151 9.379 5.362 419 H ILE 500 H ILE 500 -7.244 11.052 4.796 420 HA ILE 500 HA ILE 500 -9.428 9.249 4.431 421 HB ILE 500 HB ILE 500 -9.065 10.459 6.640 422 HG12 ILE 500 2HG1 ILE 500 -11.729 10.684 5.246 423 HG13 ILE 500 1HG1 ILE 500 -11.132 9.338 6.151 424 HG21 ILE 500 1HG2 ILE 500 -8.517 12.658 5.791 425 HG22 ILE 500 2HG2 ILE 500 -9.904 12.735 6.879 426 HG23 ILE 500 3HG2 ILE 500 -10.143 12.823 5.135 427 HD11 ILE 500 3HD1 ILE 500 -11.755 12.021 7.361 428 HD12 ILE 500 1HD1 ILE 500 -11.197 10.581 8.218 429 HD13 ILE 500 2HD1 ILE 500 -12.781 10.584 7.442 430 H GLN 501 H GLN 501 -8.501 12.351 3.154 431 HA GLN 501 HA GLN 501 -10.929 12.879 1.801 432 HB2 GLN 501 2HB GLN 501 -8.200 13.962 1.710 433 HB3 GLN 501 1HB GLN 501 -9.172 14.232 0.277 434 HG2 GLN 501 2HG GLN 501 -9.279 16.132 1.847 435 HG3 GLN 501 1HG GLN 501 -10.852 15.402 1.571 436 HE21 GLN 501 1HE2 GLN 501 -11.841 14.304 3.278 437 HE22 GLN 501 2HE2 GLN 501 -11.328 14.521 4.904 438 H ASP 502 H ASP 502 -8.146 10.963 0.940 439 HA ASP 502 HA ASP 502 -9.026 10.667 -1.782 440 HB2 ASP 502 2HB ASP 502 -6.618 10.364 -1.044 441 HB3 ASP 502 1HB ASP 502 -7.113 8.844 -0.309 442 H GLY 503 H GLY 503 -9.212 8.770 1.166 443 HA2 GLY 503 2HA GLY 503 -11.052 7.459 1.832 444 HA3 GLY 503 1HA GLY 503 -11.696 7.613 0.217 445 H ARG 504 H ARG 504 -9.054 6.603 -0.914 446 HA ARG 504 HA ARG 504 -9.875 3.858 -0.977 447 HB2 ARG 504 2HB ARG 504 -7.489 5.216 -2.177 448 HB3 ARG 504 1HB ARG 504 -8.020 3.579 -2.543 449 HG2 ARG 504 2HG ARG 504 -10.046 4.412 -3.494 450 HG3 ARG 504 1HG ARG 504 -9.633 6.063 -3.020 451 HD2 ARG 504 2HD ARG 504 -7.610 5.911 -4.423 452 HD3 ARG 504 1HD ARG 504 -8.131 4.313 -4.946 453 HE ARG 504 HE ARG 504 -9.935 5.270 -6.057 454 HH11 ARG 504 1HH1 ARG 504 -7.837 7.714 -4.576 455 HH12 ARG 504 2HH1 ARG 504 -8.182 8.920 -5.727 456 HH21 ARG 504 1HH2 ARG 504 -10.438 6.983 -7.646 457 HH22 ARG 504 2HH2 ARG 504 -9.681 8.500 -7.508 458 H LEU 505 H LEU 505 -7.552 5.665 0.749 459 HA LEU 505 HA LEU 505 -6.122 3.260 1.555 460 HB2 LEU 505 2HB LEU 505 -4.805 5.245 1.032 461 HB3 LEU 505 1HB LEU 505 -5.687 6.171 2.225 462 HG LEU 505 HG LEU 505 -4.715 4.789 4.009 463 HD11 LEU 505 1HD1 LEU 505 -3.153 3.495 1.771 464 HD12 LEU 505 2HD1 LEU 505 -4.324 2.689 2.822 465 HD13 LEU 505 3HD1 LEU 505 -2.809 3.323 3.483 466 HD21 LEU 505 3HD2 LEU 505 -2.706 5.992 2.123 467 HD22 LEU 505 1HD2 LEU 505 -2.441 5.659 3.833 468 HD23 LEU 505 2HD2 LEU 505 -3.640 6.856 3.339 469 H LYS 506 H LYS 506 -6.591 2.233 3.393 470 HA LYS 506 HA LYS 506 -8.267 3.571 5.333 471 HB2 LYS 506 2HB LYS 506 -8.659 0.821 4.174 472 HB3 LYS 506 1HB LYS 506 -9.466 1.403 5.619 473 HG2 LYS 506 2HG LYS 506 -10.615 3.100 4.340 474 HG3 LYS 506 1HG LYS 506 -9.718 2.651 2.888 475 HD2 LYS 506 2HD LYS 506 -11.987 1.704 2.901 476 HD3 LYS 506 1HD LYS 506 -10.741 0.458 2.912 477 HE2 LYS 506 2HE LYS 506 -11.057 0.174 5.331 478 HE3 LYS 506 1HE LYS 506 -12.308 1.420 5.309 479 HZ1 LYS 506 3HZ LYS 506 -13.632 0.022 3.875 480 HZ2 LYS 506 1HZ LYS 506 -13.219 -0.818 5.260 481 HZ3 LYS 506 2HZ LYS 506 -12.416 -1.151 3.822 482 H ALA 507 H ALA 507 -8.367 2.238 7.337 483 HA ALA 507 HA ALA 507 -5.714 1.734 8.218 484 HB1 ALA 507 1HB ALA 507 -6.743 1.392 10.390 485 HB2 ALA 507 2HB ALA 507 -8.342 1.362 9.638 486 HB3 ALA 507 3HB ALA 507 -7.388 2.841 9.618 487 H GLY 508 H GLY 508 -4.831 -0.217 8.803 488 HA2 GLY 508 2HA GLY 508 -4.727 -2.522 9.123 489 HA3 GLY 508 1HA GLY 508 -6.370 -2.690 8.558 490 H ASP 509 H ASP 509 -5.155 -0.815 6.246 491 HA ASP 509 HA ASP 509 -4.635 -3.075 4.575 492 HB2 ASP 509 2HB ASP 509 -4.451 -0.114 3.938 493 HB3 ASP 509 1HB ASP 509 -4.176 -1.395 2.766 494 H ARG 510 H ARG 510 -2.772 -3.502 3.512 495 HA ARG 510 HA ARG 510 -0.538 -3.060 5.334 496 HB2 ARG 510 2HB ARG 510 -1.109 -5.340 4.945 497 HB3 ARG 510 1HB ARG 510 -0.996 -5.194 3.218 498 HG2 ARG 510 2HG ARG 510 1.458 -4.712 3.530 499 HG3 ARG 510 1HG ARG 510 1.232 -5.058 5.244 500 HD2 ARG 510 2HD ARG 510 0.683 -6.967 2.966 501 HD3 ARG 510 1HD ARG 510 2.069 -7.014 4.067 502 HE ARG 510 HE ARG 510 0.094 -7.208 5.784 503 HH11 ARG 510 1HH1 ARG 510 0.584 -8.955 2.728 504 HH12 ARG 510 2HH1 ARG 510 -0.341 -10.299 3.210 505 HH21 ARG 510 1HH2 ARG 510 -1.125 -9.037 6.428 506 HH22 ARG 510 2HH2 ARG 510 -1.348 -10.346 5.360 507 H LEU 511 H LEU 511 1.087 -1.864 4.834 508 HA LEU 511 HA LEU 511 1.107 -0.432 2.345 509 HB2 LEU 511 2HB LEU 511 1.710 0.504 4.719 510 HB3 LEU 511 1HB LEU 511 3.180 -0.412 4.534 511 HG LEU 511 HG LEU 511 3.790 0.935 2.549 512 HD11 LEU 511 1HD1 LEU 511 2.533 2.967 2.093 513 HD12 LEU 511 2HD1 LEU 511 1.295 2.448 3.213 514 HD13 LEU 511 3HD1 LEU 511 1.596 1.507 1.754 515 HD21 LEU 511 3HD2 LEU 511 4.573 1.576 4.786 516 HD22 LEU 511 1HD2 LEU 511 3.115 2.555 4.999 517 HD23 LEU 511 2HD2 LEU 511 4.288 2.978 3.755 518 H ILE 512 H ILE 512 2.200 -1.131 0.557 519 HA ILE 512 HA ILE 512 4.000 -3.440 0.877 520 HB ILE 512 HB ILE 512 2.496 -2.478 -1.566 521 HG12 ILE 512 2HG1 ILE 512 1.010 -3.462 0.087 522 HG13 ILE 512 1HG1 ILE 512 1.181 -4.506 -1.300 523 HG21 ILE 512 1HG2 ILE 512 4.217 -4.936 -1.236 524 HG22 ILE 512 2HG2 ILE 512 4.594 -3.527 -2.229 525 HG23 ILE 512 3HG2 ILE 512 3.225 -4.565 -2.642 526 HD11 ILE 512 3HD1 ILE 512 2.764 -5.925 -0.098 527 HD12 ILE 512 1HD1 ILE 512 1.229 -5.812 0.755 528 HD13 ILE 512 2HD1 ILE 512 2.617 -4.896 1.329 529 H GLU 513 H GLU 513 3.689 -0.533 -1.160 530 HA GLU 513 HA GLU 513 6.525 -0.105 -1.037 531 HB2 GLU 513 2HB GLU 513 6.881 -0.304 -3.457 532 HB3 GLU 513 1HB GLU 513 6.410 -1.835 -2.733 533 HG2 GLU 513 2HG GLU 513 4.154 -1.487 -3.485 534 HG3 GLU 513 1HG GLU 513 4.659 0.026 -4.245 535 H VAL 514 H VAL 514 7.151 1.798 -1.970 536 HA VAL 514 HA VAL 514 4.956 3.633 -2.630 537 HB VAL 514 HB VAL 514 5.737 4.245 -0.355 538 HG11 VAL 514 1HG1 VAL 514 8.026 5.128 -0.016 539 HG12 VAL 514 2HG1 VAL 514 8.424 4.641 -1.666 540 HG13 VAL 514 3HG1 VAL 514 8.034 3.419 -0.467 541 HG21 VAL 514 3HG2 VAL 514 6.206 6.627 -0.781 542 HG22 VAL 514 1HG2 VAL 514 4.953 5.999 -1.852 543 HG23 VAL 514 2HG2 VAL 514 6.579 6.252 -2.468 544 H ASN 515 H ASN 515 5.220 4.668 -4.469 545 HA ASN 515 HA ASN 515 6.180 5.830 -6.191 546 HB2 ASN 515 2HB ASN 515 7.528 6.729 -4.235 547 HB3 ASN 515 1HB ASN 515 8.777 5.580 -4.666 548 HD21 ASN 515 1HD2 ASN 515 7.201 8.497 -5.345 549 HD22 ASN 515 2HD2 ASN 515 8.272 9.070 -6.555 550 H GLY 516 H GLY 516 6.814 2.703 -5.493 551 HA2 GLY 516 2HA GLY 516 7.196 1.138 -7.288 552 HA3 GLY 516 1HA GLY 516 8.383 2.269 -7.935 553 H VAL 517 H VAL 517 8.744 2.287 -4.605 554 HA VAL 517 HA VAL 517 10.969 0.376 -4.750 555 HB VAL 517 HB VAL 517 10.375 2.521 -2.692 556 HG11 VAL 517 1HG1 VAL 517 12.844 0.827 -3.086 557 HG12 VAL 517 2HG1 VAL 517 11.666 0.665 -1.781 558 HG13 VAL 517 3HG1 VAL 517 12.649 2.121 -1.905 559 HG21 VAL 517 3HG2 VAL 517 10.925 3.529 -4.842 560 HG22 VAL 517 1HG2 VAL 517 12.375 2.534 -4.956 561 HG23 VAL 517 2HG2 VAL 517 12.245 3.762 -3.695 562 H ASP 518 H ASP 518 10.658 -1.560 -3.933 563 HA ASP 518 HA ASP 518 8.327 -2.199 -2.425 564 HB2 ASP 518 2HB ASP 518 9.391 -3.842 -3.945 565 HB3 ASP 518 1HB ASP 518 10.795 -3.883 -2.882 566 H LEU 519 H LEU 519 8.051 -2.002 -0.381 567 HA LEU 519 HA LEU 519 10.405 -1.956 1.320 568 HB2 LEU 519 2HB LEU 519 9.180 -0.310 2.698 569 HB3 LEU 519 1HB LEU 519 9.668 0.271 1.121 570 HG LEU 519 HG LEU 519 7.243 -0.561 0.539 571 HD11 LEU 519 1HD1 LEU 519 6.879 0.259 3.368 572 HD12 LEU 519 2HD1 LEU 519 6.556 -1.331 2.646 573 HD13 LEU 519 3HD1 LEU 519 5.624 0.080 2.134 574 HD21 LEU 519 3HD2 LEU 519 7.911 2.132 1.671 575 HD22 LEU 519 1HD2 LEU 519 6.489 1.727 0.677 576 HD23 LEU 519 2HD2 LEU 519 8.098 1.530 0.008 577 H ALA 520 H ALA 520 8.158 -3.845 0.437 578 HA ALA 520 HA ALA 520 7.031 -4.630 2.963 579 HB1 ALA 520 1HB ALA 520 5.753 -4.929 0.885 580 HB2 ALA 520 2HB ALA 520 6.048 -6.479 1.670 581 HB3 ALA 520 3HB ALA 520 7.004 -6.002 0.266 582 H GLY 521 H GLY 521 9.695 -5.403 0.871 583 HA2 GLY 521 2HA GLY 521 10.553 -7.650 2.482 584 HA3 GLY 521 1HA GLY 521 11.421 -6.937 1.124 585 H LYS 522 H LYS 522 10.716 -4.339 2.685 586 HA LYS 522 HA LYS 522 13.266 -4.066 3.973 587 HB2 LYS 522 2HB LYS 522 10.928 -2.206 3.637 588 HB3 LYS 522 1HB LYS 522 12.270 -1.795 4.685 589 HG2 LYS 522 2HG LYS 522 12.542 -2.414 1.750 590 HG3 LYS 522 1HG LYS 522 12.397 -0.787 2.426 591 HD2 LYS 522 2HD LYS 522 14.422 -1.219 3.790 592 HD3 LYS 522 1HD LYS 522 14.574 -2.792 3.011 593 HE2 LYS 522 2HE LYS 522 14.847 -1.718 0.849 594 HE3 LYS 522 1HE LYS 522 14.620 -0.140 1.589 595 HZ1 LYS 522 3HZ LYS 522 16.956 -0.617 1.242 596 HZ2 LYS 522 1HZ LYS 522 16.865 -2.010 2.166 597 HZ3 LYS 522 2HZ LYS 522 16.642 -0.494 2.882 598 H SER 523 H SER 523 13.537 -3.365 6.142 599 HA SER 523 HA SER 523 12.046 -4.957 7.950 600 HB2 SER 523 2HB SER 523 14.153 -2.837 8.479 601 HB3 SER 523 1HB SER 523 13.590 -4.068 9.611 602 HG SER 523 HG SER 523 15.129 -4.374 7.283 603 H GLN 524 H GLN 524 10.865 -4.072 9.780 604 HA GLN 524 HA GLN 524 9.031 -2.138 8.941 605 HB2 GLN 524 2HB GLN 524 8.075 -2.343 11.259 606 HB3 GLN 524 1HB GLN 524 8.214 -3.842 10.356 607 HG2 GLN 524 2HG GLN 524 10.314 -4.309 11.595 608 HG3 GLN 524 1HG GLN 524 9.997 -2.882 12.580 609 HE21 GLN 524 1HE2 GLN 524 8.302 -2.950 14.047 610 HE22 GLN 524 2HE2 GLN 524 7.570 -4.434 14.540 611 H GLU 525 H GLU 525 11.882 -1.851 10.851 612 HA GLU 525 HA GLU 525 11.413 0.740 11.913 613 HB2 GLU 525 2HB GLU 525 13.181 -0.724 12.735 614 HB3 GLU 525 1HB GLU 525 13.986 -0.642 11.175 615 HG2 GLU 525 2HG GLU 525 14.272 1.806 11.517 616 HG3 GLU 525 1HG GLU 525 13.611 1.610 13.137 617 H GLU 526 H GLU 526 12.870 -0.434 8.940 618 HA GLU 526 HA GLU 526 13.900 1.897 7.833 619 HB2 GLU 526 2HB GLU 526 12.667 -0.501 6.484 620 HB3 GLU 526 1HB GLU 526 13.585 0.738 5.643 621 HG2 GLU 526 2HG GLU 526 14.688 -0.920 7.888 622 HG3 GLU 526 1HG GLU 526 14.845 -1.343 6.179 623 H VAL 527 H VAL 527 10.742 0.441 7.510 624 HA VAL 527 HA VAL 527 9.825 2.515 5.796 625 HB VAL 527 HB VAL 527 7.606 1.339 5.903 626 HG11 VAL 527 1HG1 VAL 527 8.455 -0.602 4.659 627 HG12 VAL 527 2HG1 VAL 527 10.052 -0.335 5.360 628 HG13 VAL 527 3HG1 VAL 527 9.370 0.855 4.242 629 HG21 VAL 527 3HG2 VAL 527 9.202 -0.620 7.521 630 HG22 VAL 527 1HG2 VAL 527 7.565 -0.849 6.912 631 HG23 VAL 527 2HG2 VAL 527 7.889 0.389 8.137 632 H VAL 528 H VAL 528 9.431 1.850 9.237 633 HA VAL 528 HA VAL 528 7.495 3.859 9.612 634 HB VAL 528 HB VAL 528 9.543 2.812 11.622 635 HG11 VAL 528 1HG1 VAL 528 8.757 5.053 12.266 636 HG12 VAL 528 2HG1 VAL 528 8.119 3.820 13.354 637 HG13 VAL 528 3HG1 VAL 528 7.086 4.517 12.108 638 HG21 VAL 528 3HG2 VAL 528 6.608 2.207 11.269 639 HG22 VAL 528 1HG2 VAL 528 7.646 1.565 12.542 640 HG23 VAL 528 2HG2 VAL 528 7.945 1.133 10.861 641 H SER 529 H SER 529 10.969 3.892 9.451 642 HA SER 529 HA SER 529 11.418 6.542 10.168 643 HB2 SER 529 2HB SER 529 13.216 4.841 9.942 644 HB3 SER 529 1HB SER 529 12.956 4.815 8.202 645 HG SER 529 HG SER 529 13.860 6.969 9.789 646 H LEU 530 H LEU 530 10.450 5.119 7.113 647 HA LEU 530 HA LEU 530 10.780 7.403 5.474 648 HB2 LEU 530 2HB LEU 530 9.033 5.035 5.366 649 HB3 LEU 530 1HB LEU 530 9.076 6.152 4.013 650 HG LEU 530 HG LEU 530 11.301 4.362 5.053 651 HD11 LEU 530 1HD1 LEU 530 9.827 4.390 2.423 652 HD12 LEU 530 2HD1 LEU 530 9.611 3.216 3.722 653 HD13 LEU 530 3HD1 LEU 530 11.145 3.303 2.857 654 HD21 LEU 530 3HD2 LEU 530 12.656 5.204 3.189 655 HD22 LEU 530 1HD2 LEU 530 12.270 6.478 4.336 656 HD23 LEU 530 2HD2 LEU 530 11.398 6.379 2.802 657 H LEU 531 H LEU 531 7.816 6.059 7.036 658 HA LEU 531 HA LEU 531 6.239 8.208 6.227 659 HB2 LEU 531 2HB LEU 531 5.814 5.930 8.144 660 HB3 LEU 531 1HB LEU 531 4.623 7.206 7.956 661 HG LEU 531 HG LEU 531 4.076 5.243 6.724 662 HD11 LEU 531 1HD1 LEU 531 3.319 7.365 5.824 663 HD12 LEU 531 2HD1 LEU 531 3.658 6.247 4.506 664 HD13 LEU 531 3HD1 LEU 531 4.802 7.532 4.890 665 HD21 LEU 531 3HD2 LEU 531 6.618 5.666 5.157 666 HD22 LEU 531 1HD2 LEU 531 5.344 4.530 4.712 667 HD23 LEU 531 2HD2 LEU 531 6.247 4.306 6.212 668 H ARG 532 H ARG 532 8.171 7.696 9.052 669 HA ARG 532 HA ARG 532 7.043 9.824 10.569 670 HB2 ARG 532 2HB ARG 532 8.376 8.029 11.590 671 HB3 ARG 532 1HB ARG 532 9.787 8.563 10.690 672 HG2 ARG 532 2HG ARG 532 9.734 10.696 11.916 673 HG3 ARG 532 1HG ARG 532 8.353 10.110 12.843 674 HD2 ARG 532 2HD ARG 532 11.075 8.818 12.753 675 HD3 ARG 532 1HD ARG 532 10.467 9.835 14.060 676 HE ARG 532 HE ARG 532 8.637 8.063 14.193 677 HH11 ARG 532 1HH1 ARG 532 11.990 7.293 13.252 678 HH12 ARG 532 2HH1 ARG 532 11.948 5.749 13.964 679 HH21 ARG 532 1HH2 ARG 532 8.669 5.902 15.189 680 HH22 ARG 532 2HH2 ARG 532 10.087 4.964 15.066 681 H SER 533 H SER 533 9.650 9.587 8.205 682 HA SER 533 HA SER 533 10.664 12.198 8.626 683 HB2 SER 533 2HB SER 533 10.986 10.373 6.241 684 HB3 SER 533 1HB SER 533 11.920 11.839 6.542 685 HG SER 533 HG SER 533 11.956 9.369 7.851 686 H THR 534 H THR 534 8.374 10.855 6.295 687 HA THR 534 HA THR 534 6.959 11.682 4.798 688 HB THR 534 HB THR 534 5.781 13.846 5.185 689 HG1 THR 534 1HG THR 534 7.975 14.294 6.811 690 HG21 THR 534 3HG2 THR 534 5.071 11.903 6.471 691 HG22 THR 534 1HG2 THR 534 4.884 13.378 7.423 692 HG23 THR 534 2HG2 THR 534 6.243 12.294 7.730 693 H LYS 535 H LYS 535 7.420 12.033 2.749 694 HA LYS 535 HA LYS 535 9.662 13.765 2.161 695 HB2 LYS 535 2HB LYS 535 9.645 11.539 1.163 696 HB3 LYS 535 1HB LYS 535 8.124 11.880 0.360 697 HG2 LYS 535 2HG LYS 535 9.161 13.518 -1.055 698 HG3 LYS 535 1HG LYS 535 10.656 13.409 -0.127 699 HD2 LYS 535 2HD LYS 535 9.467 11.136 -1.715 700 HD3 LYS 535 1HD LYS 535 10.743 12.203 -2.302 701 HE2 LYS 535 2HE LYS 535 10.901 10.360 0.097 702 HE3 LYS 535 1HE LYS 535 11.702 10.144 -1.453 703 HZ1 LYS 535 3HZ LYS 535 12.249 12.352 0.479 704 HZ2 LYS 535 1HZ LYS 535 12.976 12.195 -1.018 705 HZ3 LYS 535 2HZ LYS 535 13.245 11.045 0.160 706 H MET 536 H MET 536 9.601 15.676 1.192 707 HA MET 536 HA MET 536 7.004 16.992 1.063 708 HB2 MET 536 2HB MET 536 8.240 19.043 0.883 709 HB3 MET 536 1HB MET 536 8.756 18.128 2.309 710 HG2 MET 536 2HG MET 536 10.737 17.407 0.994 711 HG3 MET 536 1HG MET 536 10.175 18.415 -0.330 712 HE1 MET 536 3HE MET 536 12.509 19.615 -0.414 713 HE2 MET 536 1HE MET 536 13.070 18.596 0.915 714 HE3 MET 536 2HE MET 536 13.278 20.344 0.996 715 H GLU 537 H GLU 537 8.060 15.208 -1.194 716 HA GLU 537 HA GLU 537 8.490 16.924 -3.334 717 HB2 GLU 537 2HB GLU 537 9.048 14.544 -3.490 718 HB3 GLU 537 1HB GLU 537 7.370 14.108 -3.290 719 HG2 GLU 537 2HG GLU 537 8.483 15.530 -5.723 720 HG3 GLU 537 1HG GLU 537 8.294 13.790 -5.595 721 H GLY 538 H GLY 538 5.580 15.350 -2.191 722 HA2 GLY 538 2HA GLY 538 3.712 17.158 -2.205 723 HA3 GLY 538 1HA GLY 538 3.908 16.997 -3.945 724 H THR 539 H THR 539 4.171 14.504 -4.462 725 HA THR 539 HA THR 539 1.778 13.366 -3.280 726 HB THR 539 HB THR 539 1.858 11.894 -5.323 727 HG1 THR 539 1HG THR 539 3.971 13.454 -5.922 728 HG21 THR 539 3HG2 THR 539 0.536 13.520 -6.637 729 HG22 THR 539 1HG2 THR 539 1.067 14.803 -5.535 730 HG23 THR 539 2HG2 THR 539 0.093 13.451 -4.937 731 H VAL 540 H VAL 540 1.985 11.689 -2.124 732 HA VAL 540 HA VAL 540 4.330 9.993 -2.534 733 HB VAL 540 HB VAL 540 2.453 10.102 -0.150 734 HG11 VAL 540 1HG1 VAL 540 3.414 7.921 -0.568 735 HG12 VAL 540 2HG1 VAL 540 4.111 8.620 0.907 736 HG13 VAL 540 3HG1 VAL 540 5.028 8.618 -0.615 737 HG21 VAL 540 3HG2 VAL 540 4.337 11.121 1.055 738 HG22 VAL 540 1HG2 VAL 540 3.824 12.108 -0.318 739 HG23 VAL 540 2HG2 VAL 540 5.274 11.114 -0.444 740 H SER 541 H SER 541 3.928 8.333 -3.743 741 HA SER 541 HA SER 541 1.164 7.491 -3.961 742 HB2 SER 541 2HB SER 541 3.528 6.711 -5.677 743 HB3 SER 541 1HB SER 541 1.822 6.438 -6.040 744 HG SER 541 HG SER 541 3.123 8.913 -5.746 745 H LEU 542 H LEU 542 0.592 5.946 -2.680 746 HA LEU 542 HA LEU 542 2.596 4.019 -1.819 747 HB2 LEU 542 2HB LEU 542 -0.063 4.714 -0.637 748 HB3 LEU 542 1HB LEU 542 1.025 3.487 -0.031 749 HG LEU 542 HG LEU 542 1.506 6.452 -0.075 750 HD11 LEU 542 1HD1 LEU 542 0.985 4.472 2.102 751 HD12 LEU 542 2HD1 LEU 542 -0.031 5.851 1.623 752 HD13 LEU 542 3HD1 LEU 542 1.570 6.105 2.339 753 HD21 LEU 542 3HD2 LEU 542 3.285 4.212 0.878 754 HD22 LEU 542 1HD2 LEU 542 3.540 5.931 1.196 755 HD23 LEU 542 2HD2 LEU 542 3.592 5.317 -0.456 756 H LEU 543 H LEU 543 2.330 2.009 -2.135 757 HA LEU 543 HA LEU 543 -0.040 1.122 -3.607 758 HB2 LEU 543 2HB LEU 543 2.340 1.041 -4.632 759 HB3 LEU 543 1HB LEU 543 2.680 -0.112 -3.393 760 HG LEU 543 HG LEU 543 2.301 -1.142 -5.600 761 HD11 LEU 543 1HD1 LEU 543 1.993 -2.470 -3.633 762 HD12 LEU 543 2HD1 LEU 543 0.870 -2.912 -4.914 763 HD13 LEU 543 3HD1 LEU 543 0.302 -1.960 -3.533 764 HD21 LEU 543 3HD2 LEU 543 0.615 0.361 -6.451 765 HD22 LEU 543 1HD2 LEU 543 -0.535 -0.221 -5.245 766 HD23 LEU 543 2HD2 LEU 543 0.057 -1.315 -6.492 767 H VAL 544 H VAL 544 -1.347 -0.033 -2.345 768 HA VAL 544 HA VAL 544 -0.206 -1.327 0.043 769 HB VAL 544 HB VAL 544 -2.204 -0.930 1.312 770 HG11 VAL 544 1HG1 VAL 544 -1.223 1.622 0.073 771 HG12 VAL 544 2HG1 VAL 544 -0.546 0.776 1.473 772 HG13 VAL 544 3HG1 VAL 544 -2.155 1.489 1.567 773 HG21 VAL 544 3HG2 VAL 544 -3.800 -1.082 -0.407 774 HG22 VAL 544 1HG2 VAL 544 -3.274 0.436 -1.141 775 HG23 VAL 544 2HG2 VAL 544 -4.057 0.444 0.461 776 H PHE 545 H PHE 545 -1.482 -3.025 0.912 777 HA PHE 545 HA PHE 545 -2.627 -4.798 -1.170 778 HB2 PHE 545 2HB PHE 545 -0.412 -5.344 -0.335 779 HB3 PHE 545 1HB PHE 545 -1.001 -5.341 1.307 780 HD1 PHE 545 1HD PHE 545 -0.785 -7.092 -1.841 781 HD2 PHE 545 2HD PHE 545 -2.297 -7.247 2.113 782 HE1 PHE 545 1HE PHE 545 -1.108 -9.487 -2.076 783 HE2 PHE 545 2HE PHE 545 -2.616 -9.667 1.896 784 HZ PHE 545 HZ PHE 545 -2.023 -10.801 -0.195 785 H ARG 546 H ARG 546 -4.786 -4.978 -0.808 786 HA ARG 546 HA ARG 546 -5.590 -5.111 1.972 787 HB2 ARG 546 2HB ARG 546 -7.929 -4.504 1.303 788 HB3 ARG 546 1HB ARG 546 -6.776 -3.251 0.936 789 HG2 ARG 546 2HG ARG 546 -8.250 -3.263 -0.873 790 HG3 ARG 546 1HG ARG 546 -6.851 -4.150 -1.462 791 HD2 ARG 546 2HD ARG 546 -8.014 -6.262 -1.093 792 HD3 ARG 546 1HD ARG 546 -9.393 -5.402 -0.400 793 HE ARG 546 HE ARG 546 -8.775 -4.466 -3.008 794 HH11 ARG 546 1HH1 ARG 546 -10.511 -7.100 -1.344 795 HH12 ARG 546 2HH1 ARG 546 -11.485 -7.413 -2.696 796 HH21 ARG 546 1HH2 ARG 546 -10.142 -5.005 -4.813 797 HH22 ARG 546 2HH2 ARG 546 -11.264 -6.266 -4.677 798 H GLN 547 H GLN 547 -6.721 -6.807 2.760 799 HA GLN 547 HA GLN 547 -6.722 -9.114 0.935 800 HB2 GLN 547 2HB GLN 547 -4.585 -9.026 2.061 801 HB3 GLN 547 1HB GLN 547 -5.384 -8.944 3.619 802 HG2 GLN 547 2HG GLN 547 -6.334 -11.199 3.180 803 HG3 GLN 547 1HG GLN 547 -5.370 -11.269 1.710 804 HE21 GLN 547 1HE2 GLN 547 -5.288 -12.914 4.133 805 HE22 GLN 547 2HE2 GLN 547 -3.658 -12.845 4.703 806 H GLU 548 H GLU 548 -8.709 -9.960 1.006 807 HA GLU 548 HA GLU 548 -9.664 -10.754 3.629 808 HB2 GLU 548 2HB GLU 548 -11.996 -10.355 3.062 809 HB3 GLU 548 1HB GLU 548 -11.112 -8.862 2.873 810 HG2 GLU 548 2HG GLU 548 -11.975 -10.683 0.634 811 HG3 GLU 548 1HG GLU 548 -12.808 -9.217 1.134 812 H GLU 549 H GLU 549 -8.062 -11.808 1.538 813 HA GLU 549 HA GLU 549 -9.094 -13.767 -0.120 814 HB2 GLU 549 2HB GLU 549 -6.698 -13.030 0.093 815 HB3 GLU 549 1HB GLU 549 -6.593 -13.886 1.610 816 HG2 GLU 549 2HG GLU 549 -7.059 -15.189 -1.073 817 HG3 GLU 549 1HG GLU 549 -5.491 -15.001 -0.314 818 H ALA 550 H ALA 550 -8.119 -14.047 3.256 819 HA ALA 550 HA ALA 550 -10.097 -16.170 3.613 820 HB1 ALA 550 1HB ALA 550 -7.609 -15.528 5.225 821 HB2 ALA 550 2HB ALA 550 -7.816 -16.918 4.164 822 HB3 ALA 550 3HB ALA 550 -8.782 -16.779 5.633 823 H PHE 551 H PHE 551 -11.317 -15.893 5.672 824 HA PHE 551 HA PHE 551 -11.716 -13.050 6.087 825 HB2 PHE 551 2HB PHE 551 -13.651 -14.533 5.560 826 HB3 PHE 551 1HB PHE 551 -13.352 -15.411 7.052 827 HD1 PHE 551 1HD PHE 551 -13.943 -11.938 5.847 828 HD2 PHE 551 2HD PHE 551 -14.605 -14.831 8.891 829 HE1 PHE 551 1HE PHE 551 -15.428 -10.362 7.011 830 HE2 PHE 551 2HE PHE 551 -16.096 -13.260 10.059 831 HZ PHE 551 HZ PHE 551 -16.510 -11.028 9.120 832 H HIS 552 H HIS 552 -10.902 -12.068 7.787 833 HA HIS 552 HA HIS 552 -9.143 -13.331 9.577 834 HB2 HIS 552 2HB HIS 552 -10.465 -10.623 9.719 835 HB3 HIS 552 1HB HIS 552 -9.360 -11.181 10.959 836 HD1 HIS 552 1HD HIS 552 -7.116 -10.186 10.642 837 HD2 HIS 552 2HD HIS 552 -9.011 -10.828 6.992 838 HE1 HIS 552 1HE HIS 552 -5.539 -9.341 8.908 839 HE2 HIS 552 2HE HIS 552 -6.915 -9.325 6.838 840 HA PRO 553 HA PRO 553 -12.242 -14.940 12.462 841 HB2 PRO 553 2HB PRO 553 -9.864 -15.974 13.860 842 HB3 PRO 553 1HB PRO 553 -11.209 -16.886 13.168 843 HG2 PRO 553 2HG PRO 553 -8.747 -16.953 12.083 844 HG3 PRO 553 1HG PRO 553 -10.213 -17.042 11.097 845 HD2 PRO 553 2HD PRO 553 -8.407 -14.702 11.584 846 HD3 PRO 553 1HD PRO 553 -9.202 -15.247 10.087 847 H ARG 554 H ARG 554 -12.795 -14.257 14.533 848 HA ARG 554 HA ARG 554 -10.996 -12.223 15.644 849 HB2 ARG 554 2HB ARG 554 -12.830 -10.688 15.894 850 HB3 ARG 554 1HB ARG 554 -12.608 -11.113 14.200 851 HG2 ARG 554 2HG ARG 554 -14.500 -12.669 14.396 852 HG3 ARG 554 1HG ARG 554 -14.728 -12.141 16.065 853 HD2 ARG 554 2HD ARG 554 -15.010 -9.846 15.275 854 HD3 ARG 554 1HD ARG 554 -14.844 -10.418 13.615 855 HE ARG 554 HE ARG 554 -16.971 -11.358 15.396 856 HH11 ARG 554 1HH1 ARG 554 -15.944 -10.080 12.281 857 HH12 ARG 554 2HH1 ARG 554 -17.521 -10.020 11.624 858 HH21 ARG 554 1HH2 ARG 554 -19.123 -11.268 14.513 859 HH22 ARG 554 2HH2 ARG 554 -19.380 -10.714 12.927 860 H GLU 555 H GLU 555 -12.193 -11.299 17.647 861 HA GLU 555 HA GLU 555 -12.692 -13.498 19.464 862 HB2 GLU 555 2HB GLU 555 -12.519 -11.684 21.169 863 HB3 GLU 555 1HB GLU 555 -11.096 -11.788 20.139 864 HG2 GLU 555 2HG GLU 555 -11.990 -9.917 18.785 865 HG3 GLU 555 1HG GLU 555 -13.327 -9.780 19.919 866 H MET 556 H MET 556 -14.644 -13.554 20.711 867 HA MET 556 HA MET 556 -16.856 -12.227 19.347 868 HB2 MET 556 2HB MET 556 -16.905 -14.574 21.260 869 HB3 MET 556 1HB MET 556 -18.330 -13.856 20.524 870 HG2 MET 556 2HG MET 556 -17.474 -14.471 18.303 871 HG3 MET 556 1HG MET 556 -16.076 -15.222 19.067 872 HE1 MET 556 3HE MET 556 -16.569 -17.470 17.747 873 HE2 MET 556 1HE MET 556 -17.953 -16.698 16.976 874 HE3 MET 556 2HE MET 556 -18.137 -18.278 17.740 875 H ASN 557 H ASN 557 -16.815 -10.259 20.155 876 HA ASN 557 HA ASN 557 -17.290 -8.522 21.505 877 HB2 ASN 557 2HB ASN 557 -19.277 -9.752 22.276 878 HB3 ASN 557 1HB ASN 557 -18.306 -10.599 23.473 879 HD21 ASN 557 1HD2 ASN 557 -19.431 -9.837 25.234 880 HD22 ASN 557 2HD2 ASN 557 -19.391 -8.196 25.734 881 H ALA 558 H ALA 558 -16.253 -10.985 23.798 882 HA ALA 558 HA ALA 558 -13.735 -9.757 24.274 883 HB1 ALA 558 1HB ALA 558 -15.137 -8.258 25.620 884 HB2 ALA 558 2HB ALA 558 -14.138 -9.269 26.668 885 HB3 ALA 558 3HB ALA 558 -15.855 -9.640 26.436 Start of MODEL 3 1 H1 GLY 448 1HT GLY 448 -16.348 -0.851 -11.668 2 H2 GLY 448 2HT GLY 448 -17.748 -0.294 -12.430 3 H3 GLY 448 3HT GLY 448 -16.560 0.809 -11.964 4 HA2 GLY 448 1HA GLY 448 -16.518 0.393 -14.327 5 HA3 GLY 448 2HA GLY 448 -15.040 -0.197 -13.565 6 H SER 449 H SER 449 -15.591 -1.273 -15.950 7 HA SER 449 HA SER 449 -17.188 -3.642 -15.566 8 HB2 SER 449 2HB SER 449 -15.567 -2.739 -17.953 9 HB3 SER 449 1HB SER 449 -16.711 -4.085 -17.929 10 HG SER 449 HG SER 449 -18.143 -2.267 -17.028 11 H VAL 450 H VAL 450 -16.236 -5.003 -14.172 12 HA VAL 450 HA VAL 450 -13.538 -5.842 -14.858 13 HB VAL 450 HB VAL 450 -13.364 -6.800 -12.555 14 HG11 VAL 450 1HG1 VAL 450 -14.016 -3.862 -12.648 15 HG12 VAL 450 2HG1 VAL 450 -12.452 -4.596 -13.005 16 HG13 VAL 450 3HG1 VAL 450 -13.114 -4.672 -11.370 17 HG21 VAL 450 3HG2 VAL 450 -14.987 -6.143 -10.831 18 HG22 VAL 450 1HG2 VAL 450 -15.749 -7.124 -12.083 19 HG23 VAL 450 2HG2 VAL 450 -15.986 -5.373 -12.060 20 H TYR 451 H TYR 451 -13.155 -7.847 -15.418 21 HA TYR 451 HA TYR 451 -15.499 -9.595 -15.638 22 HB2 TYR 451 2HB TYR 451 -14.227 -8.873 -17.732 23 HB3 TYR 451 1HB TYR 451 -12.884 -9.841 -17.131 24 HD1 TYR 451 2HD TYR 451 -13.027 -12.290 -17.135 25 HD2 TYR 451 1HD TYR 451 -16.219 -9.886 -18.571 26 HE1 TYR 451 2HE TYR 451 -14.038 -14.264 -18.202 27 HE2 TYR 451 1HE TYR 451 -17.234 -11.845 -19.632 28 HH TYR 451 HH TYR 451 -16.247 -14.981 -18.928 29 H ASN 452 H ASN 452 -12.120 -9.383 -14.680 30 HA ASN 452 HA ASN 452 -12.407 -11.935 -13.287 31 HB2 ASN 452 2HB ASN 452 -9.895 -10.534 -14.234 32 HB3 ASN 452 1HB ASN 452 -9.898 -11.948 -13.194 33 HD21 ASN 452 1HD2 ASN 452 -10.364 -10.751 -16.403 34 HD22 ASN 452 2HD2 ASN 452 -10.446 -12.304 -17.166 35 H THR 453 H THR 453 -13.026 -11.521 -11.310 36 HA THR 453 HA THR 453 -11.298 -9.820 -9.774 37 HB THR 453 HB THR 453 -13.119 -8.279 -10.376 38 HG1 THR 453 1HG THR 453 -12.608 -7.644 -8.454 39 HG21 THR 453 3HG2 THR 453 -14.962 -10.270 -9.033 40 HG22 THR 453 1HG2 THR 453 -14.918 -9.903 -10.756 41 HG23 THR 453 2HG2 THR 453 -15.430 -8.666 -9.603 42 H LYS 454 H LYS 454 -10.834 -10.602 -7.895 43 HA LYS 454 HA LYS 454 -12.493 -12.607 -6.612 44 HB2 LYS 454 2HB LYS 454 -9.528 -12.886 -7.215 45 HB3 LYS 454 1HB LYS 454 -10.413 -13.947 -6.132 46 HG2 LYS 454 2HG LYS 454 -11.779 -14.743 -7.981 47 HG3 LYS 454 1HG LYS 454 -10.987 -13.618 -9.079 48 HD2 LYS 454 2HD LYS 454 -9.614 -15.865 -7.595 49 HD3 LYS 454 1HD LYS 454 -10.138 -15.936 -9.274 50 HE2 LYS 454 2HE LYS 454 -8.638 -14.037 -9.795 51 HE3 LYS 454 1HE LYS 454 -8.084 -14.035 -8.123 52 HZ1 LYS 454 3HZ LYS 454 -6.563 -15.223 -9.558 53 HZ2 LYS 454 1HZ LYS 454 -7.781 -16.259 -10.056 54 HZ3 LYS 454 2HZ LYS 454 -7.261 -16.297 -8.460 55 H LYS 455 H LYS 455 -12.194 -12.493 -4.324 56 HA LYS 455 HA LYS 455 -10.587 -10.188 -3.593 57 HB2 LYS 455 2HB LYS 455 -13.241 -10.959 -2.398 58 HB3 LYS 455 1HB LYS 455 -12.140 -9.855 -1.606 59 HG2 LYS 455 2HG LYS 455 -13.806 -8.573 -2.716 60 HG3 LYS 455 1HG LYS 455 -12.309 -8.368 -3.611 61 HD2 LYS 455 2HD LYS 455 -13.103 -10.022 -5.255 62 HD3 LYS 455 1HD LYS 455 -14.603 -10.183 -4.336 63 HE2 LYS 455 2HE LYS 455 -13.585 -7.659 -5.633 64 HE3 LYS 455 1HE LYS 455 -14.869 -8.677 -6.262 65 HZ1 LYS 455 3HZ LYS 455 -16.199 -8.164 -4.310 66 HZ2 LYS 455 1HZ LYS 455 -15.728 -6.761 -5.093 67 HZ3 LYS 455 2HZ LYS 455 -14.966 -7.211 -3.660 68 H VAL 456 H VAL 456 -8.862 -11.568 -3.341 69 HA VAL 456 HA VAL 456 -8.890 -12.797 -0.690 70 HB VAL 456 HB VAL 456 -6.923 -14.125 -1.340 71 HG11 VAL 456 1HG1 VAL 456 -9.184 -14.400 -3.307 72 HG12 VAL 456 2HG1 VAL 456 -9.096 -15.115 -1.698 73 HG13 VAL 456 3HG1 VAL 456 -7.982 -15.642 -2.956 74 HG21 VAL 456 3HG2 VAL 456 -7.248 -12.934 -4.099 75 HG22 VAL 456 1HG2 VAL 456 -6.101 -14.200 -3.653 76 HG23 VAL 456 2HG2 VAL 456 -5.937 -12.576 -2.978 77 H GLY 457 H GLY 457 -7.622 -10.374 -2.729 78 HA2 GLY 457 2HA GLY 457 -6.866 -8.563 -0.992 79 HA3 GLY 457 1HA GLY 457 -5.481 -9.658 -0.933 80 H LYS 458 H LYS 458 -6.483 -6.904 -2.266 81 HA LYS 458 HA LYS 458 -4.992 -7.404 -4.756 82 HB2 LYS 458 2HB LYS 458 -7.151 -5.304 -4.352 83 HB3 LYS 458 1HB LYS 458 -6.157 -5.465 -5.774 84 HG2 LYS 458 2HG LYS 458 -8.246 -6.381 -6.352 85 HG3 LYS 458 1HG LYS 458 -7.189 -7.762 -6.087 86 HD2 LYS 458 2HD LYS 458 -9.379 -8.168 -5.108 87 HD3 LYS 458 1HD LYS 458 -8.163 -8.046 -3.840 88 HE2 LYS 458 2HE LYS 458 -10.233 -6.854 -3.267 89 HE3 LYS 458 1HE LYS 458 -8.857 -5.767 -3.344 90 HZ1 LYS 458 3HZ LYS 458 -10.936 -6.071 -5.495 91 HZ2 LYS 458 1HZ LYS 458 -9.614 -5.021 -5.529 92 HZ3 LYS 458 2HZ LYS 458 -10.803 -4.834 -4.380 93 H ARG 459 H ARG 459 -3.844 -5.522 -5.565 94 HA ARG 459 HA ARG 459 -2.790 -3.919 -3.371 95 HB2 ARG 459 2HB ARG 459 -1.570 -4.863 -5.934 96 HB3 ARG 459 1HB ARG 459 -0.902 -3.502 -5.053 97 HG2 ARG 459 2HG ARG 459 -0.541 -4.921 -3.113 98 HG3 ARG 459 1HG ARG 459 -1.261 -6.287 -3.958 99 HD2 ARG 459 2HD ARG 459 0.494 -6.270 -5.588 100 HD3 ARG 459 1HD ARG 459 1.168 -4.787 -4.928 101 HE ARG 459 HE ARG 459 1.050 -6.980 -3.062 102 HH11 ARG 459 1HH1 ARG 459 2.970 -5.424 -5.586 103 HH12 ARG 459 2HH1 ARG 459 4.468 -5.971 -4.981 104 HH21 ARG 459 1HH2 ARG 459 3.084 -7.741 -2.237 105 HH22 ARG 459 2HH2 ARG 459 4.545 -7.340 -3.023 106 H LEU 460 H LEU 460 -2.973 -1.871 -3.381 107 HA LEU 460 HA LEU 460 -3.968 -0.472 -5.781 108 HB2 LEU 460 2HB LEU 460 -4.921 -0.002 -2.941 109 HB3 LEU 460 1HB LEU 460 -5.344 0.977 -4.314 110 HG LEU 460 HG LEU 460 -6.564 -1.052 -5.241 111 HD11 LEU 460 1HD1 LEU 460 -7.225 -2.798 -3.679 112 HD12 LEU 460 2HD1 LEU 460 -6.149 -2.116 -2.459 113 HD13 LEU 460 3HD1 LEU 460 -5.481 -2.793 -3.941 114 HD21 LEU 460 3HD2 LEU 460 -7.479 0.103 -2.615 115 HD22 LEU 460 1HD2 LEU 460 -8.507 -0.720 -3.789 116 HD23 LEU 460 2HD2 LEU 460 -7.727 0.804 -4.215 117 H ASN 461 H ASN 461 -3.089 1.602 -6.022 118 HA ASN 461 HA ASN 461 -1.276 2.408 -3.860 119 HB2 ASN 461 2HB ASN 461 0.221 3.490 -5.427 120 HB3 ASN 461 1HB ASN 461 -0.044 1.857 -6.011 121 HD21 ASN 461 1HD2 ASN 461 -1.253 1.565 -7.903 122 HD22 ASN 461 2HD2 ASN 461 -1.559 2.874 -8.983 123 H ILE 462 H ILE 462 -1.612 4.256 -2.942 124 HA ILE 462 HA ILE 462 -3.653 5.942 -4.176 125 HB ILE 462 HB ILE 462 -3.150 5.651 -1.181 126 HG12 ILE 462 2HG1 ILE 462 -5.595 4.782 -1.183 127 HG13 ILE 462 1HG1 ILE 462 -5.391 4.567 -2.908 128 HG21 ILE 462 1HG2 ILE 462 -3.870 7.876 -1.765 129 HG22 ILE 462 2HG2 ILE 462 -5.152 7.024 -0.900 130 HG23 ILE 462 3HG2 ILE 462 -5.250 7.219 -2.650 131 HD11 ILE 462 3HD1 ILE 462 -5.092 2.482 -1.696 132 HD12 ILE 462 1HD1 ILE 462 -3.789 3.196 -0.757 133 HD13 ILE 462 2HD1 ILE 462 -3.589 2.959 -2.496 134 H GLN 463 H GLN 463 -2.997 7.955 -4.686 135 HA GLN 463 HA GLN 463 -0.388 8.865 -3.738 136 HB2 GLN 463 2HB GLN 463 -2.323 10.051 -5.728 137 HB3 GLN 463 1HB GLN 463 -0.770 10.753 -5.320 138 HG2 GLN 463 2HG GLN 463 0.373 8.899 -6.200 139 HG3 GLN 463 1HG GLN 463 -1.132 8.015 -6.537 140 HE21 GLN 463 1HE2 GLN 463 1.037 10.505 -7.501 141 HE22 GLN 463 2HE2 GLN 463 0.336 10.849 -9.035 142 H LEU 464 H LEU 464 -0.185 10.233 -2.114 143 HA LEU 464 HA LEU 464 -2.483 11.941 -1.390 144 HB2 LEU 464 2HB LEU 464 -0.544 10.654 0.532 145 HB3 LEU 464 1HB LEU 464 -1.815 11.762 0.978 146 HG LEU 464 HG LEU 464 -2.602 9.720 1.640 147 HD11 LEU 464 1HD1 LEU 464 -4.309 10.838 0.471 148 HD12 LEU 464 2HD1 LEU 464 -4.457 9.097 0.186 149 HD13 LEU 464 3HD1 LEU 464 -3.786 10.141 -1.061 150 HD21 LEU 464 3HD2 LEU 464 -0.924 8.295 0.655 151 HD22 LEU 464 1HD2 LEU 464 -1.648 8.490 -0.943 152 HD23 LEU 464 2HD2 LEU 464 -2.530 7.641 0.330 153 H LYS 465 H LYS 465 -1.983 14.042 -1.052 154 HA LYS 465 HA LYS 465 0.871 14.803 -1.195 155 HB2 LYS 465 2HB LYS 465 0.147 16.986 -1.901 156 HB3 LYS 465 1HB LYS 465 -0.629 15.789 -2.933 157 HG2 LYS 465 2HG LYS 465 -2.686 16.020 -1.737 158 HG3 LYS 465 1HG LYS 465 -1.920 17.075 -0.560 159 HD2 LYS 465 2HD LYS 465 -3.210 18.419 -2.135 160 HD3 LYS 465 1HD LYS 465 -1.486 18.738 -2.316 161 HE2 LYS 465 2HE LYS 465 -1.459 17.176 -4.245 162 HE3 LYS 465 1HE LYS 465 -3.196 16.981 -4.069 163 HZ1 LYS 465 3HZ LYS 465 -1.784 19.510 -4.673 164 HZ2 LYS 465 1HZ LYS 465 -3.443 19.377 -4.456 165 HZ3 LYS 465 2HZ LYS 465 -2.698 18.616 -5.766 166 H LYS 466 H LYS 466 1.765 15.982 0.224 167 HA LYS 466 HA LYS 466 0.648 15.851 2.851 168 HB2 LYS 466 2HB LYS 466 3.175 17.094 1.831 169 HB3 LYS 466 1HB LYS 466 2.619 17.361 3.467 170 HG2 LYS 466 2HG LYS 466 4.287 15.609 3.443 171 HG3 LYS 466 1HG LYS 466 2.712 14.959 3.882 172 HD2 LYS 466 2HD LYS 466 3.861 13.450 2.359 173 HD3 LYS 466 1HD LYS 466 2.409 14.171 1.640 174 HE2 LYS 466 2HE LYS 466 4.350 14.016 0.132 175 HE3 LYS 466 1HE LYS 466 3.708 15.652 0.303 176 HZ1 LYS 466 3HZ LYS 466 5.516 16.152 1.821 177 HZ2 LYS 466 1HZ LYS 466 6.156 15.644 0.377 178 HZ3 LYS 466 2HZ LYS 466 6.156 14.617 1.733 179 H GLY 467 H GLY 467 -0.666 17.112 3.682 180 HA2 GLY 467 2HA GLY 467 -0.798 19.912 2.744 181 HA3 GLY 467 1HA GLY 467 -2.221 19.021 3.260 182 H THR 468 H THR 468 -2.913 19.877 5.108 183 HA THR 468 HA THR 468 -1.115 21.132 6.926 184 HB THR 468 HB THR 468 -3.145 21.465 8.314 185 HG1 THR 468 1HG THR 468 -4.497 19.921 8.009 186 HG21 THR 468 3HG2 THR 468 -2.590 23.086 6.558 187 HG22 THR 468 1HG2 THR 468 -4.338 22.923 6.719 188 HG23 THR 468 2HG2 THR 468 -3.497 22.136 5.385 189 H GLU 469 H GLU 469 -2.802 18.037 6.714 190 HA GLU 469 HA GLU 469 -1.906 17.290 9.393 191 HB2 GLU 469 2HB GLU 469 -3.529 15.664 7.449 192 HB3 GLU 469 1HB GLU 469 -3.403 15.457 9.186 193 HG2 GLU 469 2HG GLU 469 -4.808 17.668 7.716 194 HG3 GLU 469 1HG GLU 469 -5.542 16.372 8.653 195 H GLY 470 H GLY 470 -0.585 17.444 6.492 196 HA2 GLY 470 2HA GLY 470 1.216 16.378 5.527 197 HA3 GLY 470 1HA GLY 470 1.187 15.208 6.846 198 H LEU 471 H LEU 471 0.584 13.249 6.345 199 HA LEU 471 HA LEU 471 -0.715 12.725 3.799 200 HB2 LEU 471 2HB LEU 471 0.480 10.923 5.886 201 HB3 LEU 471 1HB LEU 471 -0.432 10.299 4.539 202 HG LEU 471 HG LEU 471 1.908 10.039 4.102 203 HD11 LEU 471 1HD1 LEU 471 0.716 12.202 2.402 204 HD12 LEU 471 2HD1 LEU 471 0.630 10.457 2.186 205 HD13 LEU 471 3HD1 LEU 471 2.175 11.313 1.997 206 HD21 LEU 471 3HD2 LEU 471 2.818 11.756 5.551 207 HD22 LEU 471 1HD2 LEU 471 2.169 13.009 4.491 208 HD23 LEU 471 2HD2 LEU 471 3.443 11.935 3.909 209 H GLY 472 H GLY 472 -1.373 12.341 7.223 210 HA2 GLY 472 2HA GLY 472 -3.552 12.582 8.125 211 HA3 GLY 472 1HA GLY 472 -4.226 12.196 6.554 212 H PHE 473 H PHE 473 -1.715 10.075 7.465 213 HA PHE 473 HA PHE 473 -3.447 8.336 8.950 214 HB2 PHE 473 2HB PHE 473 -3.177 6.395 7.489 215 HB3 PHE 473 1HB PHE 473 -3.956 7.695 6.608 216 HD1 PHE 473 1HD PHE 473 -2.380 9.129 5.099 217 HD2 PHE 473 2HD PHE 473 -1.386 5.246 6.552 218 HE1 PHE 473 1HE PHE 473 -0.754 8.849 3.279 219 HE2 PHE 473 2HE PHE 473 0.257 4.998 4.764 220 HZ PHE 473 HZ PHE 473 0.551 6.845 3.103 221 H SER 474 H SER 474 -2.228 6.439 9.725 222 HA SER 474 HA SER 474 0.659 6.894 9.834 223 HB2 SER 474 2HB SER 474 -1.110 6.463 12.255 224 HB3 SER 474 1HB SER 474 0.647 6.641 12.272 225 HG SER 474 HG SER 474 -0.266 8.670 10.929 226 H ILE 475 H ILE 475 1.750 4.890 10.814 227 HA ILE 475 HA ILE 475 0.227 2.513 9.953 228 HB ILE 475 HB ILE 475 2.381 1.561 9.316 229 HG12 ILE 475 2HG1 ILE 475 3.371 4.388 9.589 230 HG13 ILE 475 1HG1 ILE 475 3.773 2.987 10.593 231 HG21 ILE 475 1HG2 ILE 475 0.837 2.409 7.636 232 HG22 ILE 475 2HG2 ILE 475 2.503 2.599 7.161 233 HG23 ILE 475 3HG2 ILE 475 1.590 4.017 7.727 234 HD11 ILE 475 3HD1 ILE 475 5.547 3.572 8.940 235 HD12 ILE 475 1HD1 ILE 475 4.404 3.262 7.647 236 HD13 ILE 475 2HD1 ILE 475 4.916 1.947 8.701 237 H THR 476 H THR 476 0.705 0.568 10.973 238 HA THR 476 HA THR 476 2.283 0.611 13.429 239 HB THR 476 HB THR 476 -0.096 0.606 14.102 240 HG1 THR 476 1HG THR 476 1.398 -0.744 15.249 241 HG21 THR 476 3HG2 THR 476 -1.075 -0.298 12.039 242 HG22 THR 476 1HG2 THR 476 -1.612 -1.219 13.443 243 HG23 THR 476 2HG2 THR 476 -0.359 -1.871 12.383 244 H SER 477 H SER 477 3.092 -1.616 13.982 245 HA SER 477 HA SER 477 3.315 -3.289 11.596 246 HB2 SER 477 2HB SER 477 5.638 -3.714 12.245 247 HB3 SER 477 1HB SER 477 5.374 -2.010 11.938 248 HG SER 477 HG SER 477 5.751 -1.540 13.941 249 H ARG 478 H ARG 478 3.766 -5.548 12.117 250 HA ARG 478 HA ARG 478 3.634 -6.353 14.856 251 HB2 ARG 478 2HB ARG 478 1.870 -8.048 14.425 252 HB3 ARG 478 1HB ARG 478 1.280 -6.400 14.351 253 HG2 ARG 478 2HG ARG 478 1.290 -6.488 11.933 254 HG3 ARG 478 1HG ARG 478 1.927 -8.138 11.975 255 HD2 ARG 478 2HD ARG 478 -0.503 -8.070 11.626 256 HD3 ARG 478 1HD ARG 478 -0.069 -8.906 13.120 257 HE ARG 478 HE ARG 478 -0.641 -6.098 13.397 258 HH11 ARG 478 1HH1 ARG 478 -2.077 -9.359 13.453 259 HH12 ARG 478 2HH1 ARG 478 -3.356 -8.900 14.480 260 HH21 ARG 478 1HH2 ARG 478 -2.418 -5.525 14.798 261 HH22 ARG 478 2HH2 ARG 478 -3.549 -6.722 15.266 262 H ASP 479 H ASP 479 4.805 -8.131 15.225 263 HA ASP 479 HA ASP 479 6.228 -9.801 14.951 264 HB2 ASP 479 2HB ASP 479 4.505 -10.959 13.631 265 HB3 ASP 479 1HB ASP 479 5.053 -10.139 12.176 266 H VAL 480 H VAL 480 8.053 -8.870 15.202 267 HA VAL 480 HA VAL 480 9.257 -7.177 13.249 268 HB VAL 480 HB VAL 480 10.532 -8.362 15.725 269 HG11 VAL 480 1HG1 VAL 480 12.057 -6.442 15.604 270 HG12 VAL 480 2HG1 VAL 480 11.294 -5.943 14.094 271 HG13 VAL 480 3HG1 VAL 480 12.169 -7.472 14.179 272 HG21 VAL 480 3HG2 VAL 480 8.517 -7.137 16.346 273 HG22 VAL 480 1HG2 VAL 480 9.061 -5.746 15.408 274 HG23 VAL 480 2HG2 VAL 480 9.954 -6.240 16.843 275 H THR 481 H THR 481 9.626 -8.308 11.429 276 HA THR 481 HA THR 481 11.636 -10.411 11.599 277 HB THR 481 HB THR 481 9.418 -10.075 9.562 278 HG1 THR 481 1HG THR 481 8.351 -11.194 11.076 279 HG21 THR 481 3HG2 THR 481 11.465 -11.070 8.606 280 HG22 THR 481 1HG2 THR 481 10.153 -12.242 8.705 281 HG23 THR 481 2HG2 THR 481 11.460 -12.278 9.891 282 H ILE 482 H ILE 482 13.488 -9.758 10.827 283 HA ILE 482 HA ILE 482 13.604 -7.246 9.371 284 HB ILE 482 HB ILE 482 15.021 -7.502 11.337 285 HG12 ILE 482 2HG1 ILE 482 17.222 -6.862 10.368 286 HG13 ILE 482 1HG1 ILE 482 16.607 -7.326 8.784 287 HG21 ILE 482 1HG2 ILE 482 16.978 -8.986 11.331 288 HG22 ILE 482 2HG2 ILE 482 16.378 -9.717 9.841 289 HG23 ILE 482 3HG2 ILE 482 15.444 -9.854 11.329 290 HD11 ILE 482 3HD1 ILE 482 16.519 -4.927 9.114 291 HD12 ILE 482 1HD1 ILE 482 15.508 -5.153 10.542 292 HD13 ILE 482 2HD1 ILE 482 14.899 -5.603 8.944 293 H GLY 483 H GLY 483 14.216 -10.645 8.735 294 HA2 GLY 483 2HA GLY 483 15.561 -9.956 6.234 295 HA3 GLY 483 1HA GLY 483 15.458 -11.561 6.941 296 H GLY 484 H GLY 484 12.819 -11.860 7.357 297 HA2 GLY 484 2HA GLY 484 11.849 -12.527 4.780 298 HA3 GLY 484 1HA GLY 484 10.944 -12.636 6.282 299 H SER 485 H SER 485 9.777 -10.746 7.020 300 HA SER 485 HA SER 485 9.618 -8.449 5.345 301 HB2 SER 485 2HB SER 485 8.270 -10.047 4.028 302 HB3 SER 485 1HB SER 485 7.247 -10.335 5.435 303 HG SER 485 HG SER 485 7.674 -7.752 4.452 304 H ALA 486 H ALA 486 8.836 -6.762 6.465 305 HA ALA 486 HA ALA 486 7.698 -7.278 9.096 306 HB1 ALA 486 1HB ALA 486 8.245 -4.910 9.550 307 HB2 ALA 486 2HB ALA 486 8.879 -4.753 7.914 308 HB3 ALA 486 3HB ALA 486 9.674 -5.821 9.065 309 HA PRO 487 HA PRO 487 4.053 -6.113 6.783 310 HB2 PRO 487 2HB PRO 487 2.321 -7.140 8.772 311 HB3 PRO 487 1HB PRO 487 2.800 -7.901 7.270 312 HG2 PRO 487 2HG PRO 487 3.547 -8.731 9.858 313 HG3 PRO 487 1HG PRO 487 4.189 -9.327 8.325 314 HD2 PRO 487 2HD PRO 487 5.358 -7.398 10.241 315 HD3 PRO 487 1HD PRO 487 6.154 -8.461 9.060 316 H ILE 488 H ILE 488 3.817 -4.045 6.821 317 HA ILE 488 HA ILE 488 3.096 -2.642 9.271 318 HB ILE 488 HB ILE 488 4.148 -1.607 6.576 319 HG12 ILE 488 2HG1 ILE 488 5.768 -2.339 8.389 320 HG13 ILE 488 1HG1 ILE 488 5.851 -0.677 7.797 321 HG21 ILE 488 1HG2 ILE 488 3.839 0.611 7.325 322 HG22 ILE 488 2HG2 ILE 488 2.987 -0.044 8.741 323 HG23 ILE 488 3HG2 ILE 488 2.291 -0.248 7.134 324 HD11 ILE 488 3HD1 ILE 488 4.827 0.177 9.736 325 HD12 ILE 488 1HD1 ILE 488 6.142 -0.870 10.236 326 HD13 ILE 488 2HD1 ILE 488 4.474 -1.452 10.345 327 H TYR 489 H TYR 489 1.137 -1.913 9.592 328 HA TYR 489 HA TYR 489 -0.780 -1.942 7.351 329 HB2 TYR 489 2HB TYR 489 -1.412 -2.603 10.254 330 HB3 TYR 489 1HB TYR 489 -2.540 -2.565 8.916 331 HD1 TYR 489 1HD TYR 489 -2.616 -4.314 7.289 332 HD2 TYR 489 2HD TYR 489 0.185 -4.430 10.470 333 HE1 TYR 489 1HE TYR 489 -2.156 -6.666 6.782 334 HE2 TYR 489 2HE TYR 489 0.662 -6.775 9.988 335 HH TYR 489 HH TYR 489 -0.423 -8.692 8.908 336 H VAL 490 H VAL 490 -2.193 -0.257 7.313 337 HA VAL 490 HA VAL 490 -1.386 2.166 8.558 338 HB VAL 490 HB VAL 490 -4.068 1.513 7.302 339 HG11 VAL 490 1HG1 VAL 490 -2.757 4.161 7.891 340 HG12 VAL 490 2HG1 VAL 490 -4.176 3.500 8.703 341 HG13 VAL 490 3HG1 VAL 490 -4.259 3.946 6.996 342 HG21 VAL 490 3HG2 VAL 490 -2.266 1.155 5.722 343 HG22 VAL 490 1HG2 VAL 490 -1.598 2.750 6.099 344 HG23 VAL 490 2HG2 VAL 490 -3.174 2.618 5.331 345 H LYS 491 H LYS 491 -1.652 2.695 10.579 346 HA LYS 491 HA LYS 491 -3.240 1.062 12.338 347 HB2 LYS 491 2HB LYS 491 -1.009 1.948 12.940 348 HB3 LYS 491 1HB LYS 491 -1.632 3.570 12.866 349 HG2 LYS 491 2HG LYS 491 -2.663 1.530 14.839 350 HG3 LYS 491 1HG LYS 491 -1.289 2.573 15.180 351 HD2 LYS 491 2HD LYS 491 -2.721 4.548 14.895 352 HD3 LYS 491 1HD LYS 491 -4.087 3.495 14.513 353 HE2 LYS 491 2HE LYS 491 -3.965 2.506 16.682 354 HE3 LYS 491 1HE LYS 491 -2.550 3.490 17.086 355 HZ1 LYS 491 3HZ LYS 491 -5.307 4.506 16.555 356 HZ2 LYS 491 1HZ LYS 491 -3.962 5.472 16.865 357 HZ3 LYS 491 2HZ LYS 491 -4.546 4.445 18.050 358 H ASN 492 H ASN 492 -3.562 4.282 10.966 359 HA ASN 492 HA ASN 492 -6.351 4.404 11.743 360 HB2 ASN 492 2HB ASN 492 -5.229 5.123 13.832 361 HB3 ASN 492 1HB ASN 492 -4.392 6.386 12.945 362 HD21 ASN 492 1HD2 ASN 492 -5.256 8.036 14.143 363 HD22 ASN 492 2HD2 ASN 492 -6.926 8.490 14.064 364 H ILE 493 H ILE 493 -7.488 5.918 10.580 365 HA ILE 493 HA ILE 493 -6.038 7.552 8.611 366 HB ILE 493 HB ILE 493 -8.914 6.524 8.581 367 HG12 ILE 493 2HG1 ILE 493 -7.311 4.722 8.132 368 HG13 ILE 493 1HG1 ILE 493 -8.283 5.129 6.720 369 HG21 ILE 493 1HG2 ILE 493 -7.412 8.115 6.505 370 HG22 ILE 493 2HG2 ILE 493 -8.859 8.643 7.392 371 HG23 ILE 493 3HG2 ILE 493 -8.948 7.322 6.234 372 HD11 ILE 493 3HD1 ILE 493 -5.986 4.701 6.097 373 HD12 ILE 493 1HD1 ILE 493 -5.430 5.957 7.205 374 HD13 ILE 493 2HD1 ILE 493 -6.398 6.390 5.795 375 H LEU 494 H LEU 494 -5.967 9.615 9.339 376 HA LEU 494 HA LEU 494 -7.607 10.478 11.479 377 HB2 LEU 494 2HB LEU 494 -5.686 12.001 9.709 378 HB3 LEU 494 1HB LEU 494 -6.592 12.771 10.984 379 HG LEU 494 HG LEU 494 -5.424 11.302 12.636 380 HD11 LEU 494 1HD1 LEU 494 -3.772 10.462 10.276 381 HD12 LEU 494 2HD1 LEU 494 -4.827 9.431 11.240 382 HD13 LEU 494 3HD1 LEU 494 -3.377 10.146 11.961 383 HD21 LEU 494 3HD2 LEU 494 -4.646 13.559 12.216 384 HD22 LEU 494 1HD2 LEU 494 -3.647 12.986 10.882 385 HD23 LEU 494 2HD2 LEU 494 -3.283 12.482 12.530 386 HA PRO 495 HA PRO 495 -11.239 11.968 9.403 387 HB2 PRO 495 2HB PRO 495 -11.089 14.295 11.229 388 HB3 PRO 495 1HB PRO 495 -12.415 13.160 10.972 389 HG2 PRO 495 2HG PRO 495 -10.950 13.020 13.179 390 HG3 PRO 495 1HG PRO 495 -11.468 11.542 12.348 391 HD2 PRO 495 2HD PRO 495 -8.794 12.880 12.340 392 HD3 PRO 495 1HD PRO 495 -9.205 11.150 12.414 393 H ARG 496 H ARG 496 -8.427 13.868 9.718 394 HA ARG 496 HA ARG 496 -9.206 15.545 7.462 395 HB2 ARG 496 2HB ARG 496 -7.574 16.295 9.889 396 HB3 ARG 496 1HB ARG 496 -7.682 17.274 8.446 397 HG2 ARG 496 2HG ARG 496 -9.993 16.560 10.242 398 HG3 ARG 496 1HG ARG 496 -9.108 18.088 10.276 399 HD2 ARG 496 2HD ARG 496 -9.764 18.435 7.897 400 HD3 ARG 496 1HD ARG 496 -10.747 16.977 8.004 401 HE ARG 496 HE ARG 496 -11.528 18.576 10.093 402 HH11 ARG 496 1HH1 ARG 496 -11.544 18.792 6.558 403 HH12 ARG 496 2HH1 ARG 496 -12.833 19.888 6.472 404 HH21 ARG 496 1HH2 ARG 496 -13.335 20.085 9.987 405 HH22 ARG 496 2HH2 ARG 496 -13.891 20.616 8.465 406 H GLY 497 H GLY 497 -7.687 15.558 5.872 407 HA2 GLY 497 2HA GLY 497 -5.147 15.575 5.669 408 HA3 GLY 497 1HA GLY 497 -5.263 13.972 6.367 409 H ALA 498 H ALA 498 -4.072 14.238 4.002 410 HA ALA 498 HA ALA 498 -5.613 14.253 1.686 411 HB1 ALA 498 1HB ALA 498 -2.994 12.858 2.178 412 HB2 ALA 498 2HB ALA 498 -3.182 14.539 1.708 413 HB3 ALA 498 3HB ALA 498 -3.669 13.256 0.604 414 H ALA 499 H ALA 499 -4.554 11.524 3.675 415 HA ALA 499 HA ALA 499 -5.368 9.472 1.957 416 HB1 ALA 499 1HB ALA 499 -3.876 9.082 3.823 417 HB2 ALA 499 2HB ALA 499 -5.254 7.981 3.869 418 HB3 ALA 499 3HB ALA 499 -5.192 9.368 4.959 419 H ILE 500 H ILE 500 -7.228 11.113 4.459 420 HA ILE 500 HA ILE 500 -9.360 9.258 4.111 421 HB ILE 500 HB ILE 500 -8.905 10.415 6.319 422 HG12 ILE 500 2HG1 ILE 500 -11.679 10.687 5.164 423 HG13 ILE 500 1HG1 ILE 500 -10.986 9.222 5.823 424 HG21 ILE 500 1HG2 ILE 500 -8.531 12.681 5.480 425 HG22 ILE 500 2HG2 ILE 500 -9.841 12.659 6.661 426 HG23 ILE 500 3HG2 ILE 500 -10.206 12.773 4.940 427 HD11 ILE 500 3HD1 ILE 500 -11.530 11.740 7.353 428 HD12 ILE 500 1HD1 ILE 500 -10.867 10.240 8.014 429 HD13 ILE 500 2HD1 ILE 500 -12.513 10.276 7.386 430 H GLN 501 H GLN 501 -8.555 12.384 2.824 431 HA GLN 501 HA GLN 501 -11.027 13.149 1.740 432 HB2 GLN 501 2HB GLN 501 -8.214 13.683 0.796 433 HB3 GLN 501 1HB GLN 501 -9.634 14.448 0.096 434 HG2 GLN 501 2HG GLN 501 -10.142 15.535 2.166 435 HG3 GLN 501 1HG GLN 501 -8.863 14.645 2.991 436 HE21 GLN 501 1HE2 GLN 501 -7.915 16.528 3.616 437 HE22 GLN 501 2HE2 GLN 501 -6.997 17.545 2.552 438 H ASP 502 H ASP 502 -8.406 11.227 0.320 439 HA ASP 502 HA ASP 502 -9.983 10.714 -2.023 440 HB2 ASP 502 2HB ASP 502 -7.518 10.751 -2.173 441 HB3 ASP 502 1HB ASP 502 -7.432 9.363 -1.098 442 H GLY 503 H GLY 503 -9.140 8.989 0.904 443 HA2 GLY 503 2HA GLY 503 -10.345 7.534 2.133 444 HA3 GLY 503 1HA GLY 503 -11.713 7.936 1.128 445 H ARG 504 H ARG 504 -8.917 6.511 -0.354 446 HA ARG 504 HA ARG 504 -10.497 4.074 -0.837 447 HB2 ARG 504 2HB ARG 504 -7.595 4.377 -1.580 448 HB3 ARG 504 1HB ARG 504 -8.818 3.391 -2.354 449 HG2 ARG 504 2HG ARG 504 -8.568 6.373 -2.480 450 HG3 ARG 504 1HG ARG 504 -8.160 5.227 -3.743 451 HD2 ARG 504 2HD ARG 504 -10.468 4.631 -4.001 452 HD3 ARG 504 1HD ARG 504 -10.914 5.637 -2.614 453 HE ARG 504 HE ARG 504 -9.737 7.453 -4.068 454 HH11 ARG 504 1HH1 ARG 504 -12.068 4.992 -5.206 455 HH12 ARG 504 2HH1 ARG 504 -12.602 5.948 -6.492 456 HH21 ARG 504 1HH2 ARG 504 -10.531 8.730 -5.804 457 HH22 ARG 504 2HH2 ARG 504 -11.720 8.118 -6.858 458 H LEU 505 H LEU 505 -7.558 5.177 0.576 459 HA LEU 505 HA LEU 505 -6.612 2.797 1.739 460 HB2 LEU 505 2HB LEU 505 -5.245 4.723 1.090 461 HB3 LEU 505 1HB LEU 505 -6.058 5.706 2.277 462 HG LEU 505 HG LEU 505 -5.045 4.337 4.071 463 HD11 LEU 505 1HD1 LEU 505 -3.661 2.975 1.766 464 HD12 LEU 505 2HD1 LEU 505 -4.750 2.233 2.950 465 HD13 LEU 505 3HD1 LEU 505 -3.187 2.861 3.467 466 HD21 LEU 505 3HD2 LEU 505 -3.102 5.469 2.073 467 HD22 LEU 505 1HD2 LEU 505 -2.784 5.174 3.785 468 HD23 LEU 505 2HD2 LEU 505 -3.977 6.379 3.307 469 H LYS 506 H LYS 506 -7.056 1.953 3.699 470 HA LYS 506 HA LYS 506 -8.466 3.558 5.651 471 HB2 LYS 506 2HB LYS 506 -9.325 0.823 4.733 472 HB3 LYS 506 1HB LYS 506 -9.907 1.564 6.217 473 HG2 LYS 506 2HG LYS 506 -10.802 3.423 4.843 474 HG3 LYS 506 1HG LYS 506 -10.326 2.531 3.397 475 HD2 LYS 506 2HD LYS 506 -11.779 0.681 4.064 476 HD3 LYS 506 1HD LYS 506 -12.236 1.563 5.522 477 HE2 LYS 506 2HE LYS 506 -13.138 3.367 4.127 478 HE3 LYS 506 1HE LYS 506 -12.728 2.442 2.687 479 HZ1 LYS 506 3HZ LYS 506 -15.020 2.133 3.211 480 HZ2 LYS 506 1HZ LYS 506 -14.675 1.660 4.791 481 HZ3 LYS 506 2HZ LYS 506 -14.236 0.688 3.478 482 H ALA 507 H ALA 507 -8.569 2.328 7.763 483 HA ALA 507 HA ALA 507 -5.895 1.677 8.482 484 HB1 ALA 507 1HB ALA 507 -6.773 1.406 10.732 485 HB2 ALA 507 2HB ALA 507 -8.424 1.451 10.110 486 HB3 ALA 507 3HB ALA 507 -7.398 2.883 9.996 487 H GLY 508 H GLY 508 -4.974 -0.213 8.538 488 HA2 GLY 508 2HA GLY 508 -5.045 -2.550 9.151 489 HA3 GLY 508 1HA GLY 508 -6.636 -2.666 8.443 490 H ASP 509 H ASP 509 -5.380 -0.825 6.205 491 HA ASP 509 HA ASP 509 -4.711 -3.011 4.515 492 HB2 ASP 509 2HB ASP 509 -4.350 -0.033 4.033 493 HB3 ASP 509 1HB ASP 509 -4.040 -1.269 2.825 494 H ARG 510 H ARG 510 -2.765 -3.661 3.712 495 HA ARG 510 HA ARG 510 -0.581 -3.056 5.540 496 HB2 ARG 510 2HB ARG 510 -1.064 -5.379 5.298 497 HB3 ARG 510 1HB ARG 510 -0.961 -5.324 3.555 498 HG2 ARG 510 2HG ARG 510 1.451 -4.837 3.739 499 HG3 ARG 510 1HG ARG 510 1.312 -4.897 5.497 500 HD2 ARG 510 2HD ARG 510 0.625 -7.210 5.391 501 HD3 ARG 510 1HD ARG 510 0.647 -7.172 3.635 502 HE ARG 510 HE ARG 510 3.154 -6.416 4.675 503 HH11 ARG 510 1HH1 ARG 510 1.108 -9.264 4.159 504 HH12 ARG 510 2HH1 ARG 510 2.404 -10.358 4.034 505 HH21 ARG 510 1HH2 ARG 510 4.994 -7.999 4.503 506 HH22 ARG 510 2HH2 ARG 510 4.600 -9.615 4.242 507 H LEU 511 H LEU 511 1.043 -1.877 5.024 508 HA LEU 511 HA LEU 511 1.072 -0.586 2.449 509 HB2 LEU 511 2HB LEU 511 1.592 0.443 4.883 510 HB3 LEU 511 1HB LEU 511 3.149 -0.270 4.601 511 HG LEU 511 HG LEU 511 1.943 1.841 2.817 512 HD11 LEU 511 1HD1 LEU 511 2.315 2.731 5.006 513 HD12 LEU 511 2HD1 LEU 511 3.514 3.360 3.886 514 HD13 LEU 511 3HD1 LEU 511 3.965 2.091 5.024 515 HD21 LEU 511 3HD2 LEU 511 4.768 0.807 3.010 516 HD22 LEU 511 1HD2 LEU 511 4.207 2.097 1.949 517 HD23 LEU 511 2HD2 LEU 511 3.639 0.445 1.696 518 H ILE 512 H ILE 512 2.222 -1.283 0.740 519 HA ILE 512 HA ILE 512 4.032 -3.583 1.076 520 HB ILE 512 HB ILE 512 2.616 -2.503 -1.357 521 HG12 ILE 512 2HG1 ILE 512 1.057 -3.545 0.228 522 HG13 ILE 512 1HG1 ILE 512 1.198 -4.485 -1.237 523 HG21 ILE 512 1HG2 ILE 512 4.293 -4.990 -1.073 524 HG22 ILE 512 2HG2 ILE 512 4.694 -3.544 -2.002 525 HG23 ILE 512 3HG2 ILE 512 3.338 -4.560 -2.493 526 HD11 ILE 512 3HD1 ILE 512 2.675 -6.059 -0.129 527 HD12 ILE 512 1HD1 ILE 512 1.137 -5.926 0.714 528 HD13 ILE 512 2HD1 ILE 512 2.570 -5.133 1.377 529 H GLU 513 H GLU 513 3.778 -0.546 -0.780 530 HA GLU 513 HA GLU 513 6.608 -0.142 -0.619 531 HB2 GLU 513 2HB GLU 513 7.005 -0.094 -3.029 532 HB3 GLU 513 1HB GLU 513 6.528 -1.698 -2.487 533 HG2 GLU 513 2HG GLU 513 4.348 -1.414 -3.316 534 HG3 GLU 513 1HG GLU 513 4.680 0.292 -3.655 535 H VAL 514 H VAL 514 7.233 1.770 -1.790 536 HA VAL 514 HA VAL 514 5.068 3.657 -2.200 537 HB VAL 514 HB VAL 514 5.803 4.159 0.109 538 HG11 VAL 514 1HG1 VAL 514 8.132 5.017 0.500 539 HG12 VAL 514 2HG1 VAL 514 8.513 4.480 -1.144 540 HG13 VAL 514 3HG1 VAL 514 8.052 3.299 0.065 541 HG21 VAL 514 3HG2 VAL 514 6.355 6.549 -0.181 542 HG22 VAL 514 1HG2 VAL 514 5.103 6.038 -1.315 543 HG23 VAL 514 2HG2 VAL 514 6.748 6.259 -1.874 544 H ASN 515 H ASN 515 5.403 4.811 -3.987 545 HA ASN 515 HA ASN 515 6.408 6.055 -5.644 546 HB2 ASN 515 2HB ASN 515 7.723 6.849 -3.601 547 HB3 ASN 515 1HB ASN 515 8.986 5.742 -4.111 548 HD21 ASN 515 1HD2 ASN 515 7.367 8.695 -4.641 549 HD22 ASN 515 2HD2 ASN 515 8.443 9.317 -5.815 550 H GLY 516 H GLY 516 6.919 2.903 -5.193 551 HA2 GLY 516 2HA GLY 516 7.429 1.469 -7.033 552 HA3 GLY 516 1HA GLY 516 8.632 2.640 -7.565 553 H VAL 517 H VAL 517 8.987 2.524 -4.287 554 HA VAL 517 HA VAL 517 11.175 0.609 -4.532 555 HB VAL 517 HB VAL 517 10.559 2.608 -2.335 556 HG11 VAL 517 1HG1 VAL 517 13.023 0.931 -2.814 557 HG12 VAL 517 2HG1 VAL 517 11.846 0.711 -1.519 558 HG13 VAL 517 3HG1 VAL 517 12.850 2.162 -1.567 559 HG21 VAL 517 3HG2 VAL 517 11.131 3.747 -4.415 560 HG22 VAL 517 1HG2 VAL 517 12.590 2.768 -4.569 561 HG23 VAL 517 2HG2 VAL 517 12.439 3.917 -3.242 562 H ASP 518 H ASP 518 10.789 -1.380 -3.867 563 HA ASP 518 HA ASP 518 8.487 -2.050 -2.300 564 HB2 ASP 518 2HB ASP 518 9.434 -3.591 -4.034 565 HB3 ASP 518 1HB ASP 518 10.848 -3.809 -3.013 566 H LEU 519 H LEU 519 8.373 -2.449 -0.188 567 HA LEU 519 HA LEU 519 10.843 -2.291 1.338 568 HB2 LEU 519 2HB LEU 519 9.623 -0.701 2.864 569 HB3 LEU 519 1HB LEU 519 10.148 -0.075 1.313 570 HG LEU 519 HG LEU 519 7.783 -0.761 0.582 571 HD11 LEU 519 1HD1 LEU 519 7.148 -0.284 3.460 572 HD12 LEU 519 2HD1 LEU 519 7.008 -1.820 2.562 573 HD13 LEU 519 3HD1 LEU 519 6.046 -0.429 2.087 574 HD21 LEU 519 3HD2 LEU 519 8.343 1.753 2.115 575 HD22 LEU 519 1HD2 LEU 519 6.954 1.484 1.042 576 HD23 LEU 519 2HD2 LEU 519 8.584 1.410 0.387 577 H ALA 520 H ALA 520 8.757 -4.352 0.610 578 HA ALA 520 HA ALA 520 7.365 -4.977 3.004 579 HB1 ALA 520 1HB ALA 520 6.617 -5.785 0.806 580 HB2 ALA 520 2HB ALA 520 6.892 -7.124 1.923 581 HB3 ALA 520 3HB ALA 520 8.077 -6.764 0.670 582 H GLY 521 H GLY 521 10.497 -5.802 1.673 583 HA2 GLY 521 2HA GLY 521 11.039 -7.650 3.873 584 HA3 GLY 521 1HA GLY 521 12.044 -7.396 2.454 585 H LYS 522 H LYS 522 10.918 -4.551 3.823 586 HA LYS 522 HA LYS 522 13.537 -4.045 4.969 587 HB2 LYS 522 2HB LYS 522 11.334 -2.138 4.172 588 HB3 LYS 522 1HB LYS 522 12.788 -1.641 5.025 589 HG2 LYS 522 2HG LYS 522 12.669 -2.883 2.283 590 HG3 LYS 522 1HG LYS 522 13.013 -1.187 2.657 591 HD2 LYS 522 2HD LYS 522 14.974 -1.889 3.936 592 HD3 LYS 522 1HD LYS 522 14.649 -3.562 3.515 593 HE2 LYS 522 2HE LYS 522 14.921 -2.991 1.128 594 HE3 LYS 522 1HE LYS 522 15.342 -1.342 1.593 595 HZ1 LYS 522 3HZ LYS 522 17.326 -2.646 1.215 596 HZ2 LYS 522 1HZ LYS 522 16.828 -3.803 2.329 597 HZ3 LYS 522 2HZ LYS 522 17.245 -2.250 2.841 598 H SER 523 H SER 523 13.688 -2.874 6.938 599 HA SER 523 HA SER 523 12.189 -4.199 8.907 600 HB2 SER 523 2HB SER 523 14.497 -3.521 9.347 601 HB3 SER 523 1HB SER 523 14.062 -1.833 9.135 602 HG SER 523 HG SER 523 14.169 -2.823 11.381 603 H GLN 524 H GLN 524 10.803 -3.255 10.417 604 HA GLN 524 HA GLN 524 8.852 -1.518 9.450 605 HB2 GLN 524 2HB GLN 524 8.064 -1.423 11.815 606 HB3 GLN 524 1HB GLN 524 8.323 -3.054 11.221 607 HG2 GLN 524 2HG GLN 524 10.492 -3.106 12.382 608 HG3 GLN 524 1HG GLN 524 10.166 -1.491 13.009 609 HE21 GLN 524 1HE2 GLN 524 8.632 -1.234 14.618 610 HE22 GLN 524 2HE2 GLN 524 7.990 -2.577 15.493 611 H GLU 525 H GLU 525 11.813 -0.963 11.170 612 HA GLU 525 HA GLU 525 11.387 1.707 11.951 613 HB2 GLU 525 2HB GLU 525 13.227 0.369 12.825 614 HB3 GLU 525 1HB GLU 525 13.947 0.291 11.222 615 HG2 GLU 525 2HG GLU 525 14.276 2.719 11.275 616 HG3 GLU 525 1HG GLU 525 13.573 2.767 12.891 617 H GLU 526 H GLU 526 12.669 0.265 8.990 618 HA GLU 526 HA GLU 526 13.575 2.600 7.725 619 HB2 GLU 526 2HB GLU 526 12.526 0.042 6.552 620 HB3 GLU 526 1HB GLU 526 13.371 1.265 5.624 621 HG2 GLU 526 2HG GLU 526 14.455 -0.313 7.921 622 HG3 GLU 526 1HG GLU 526 14.814 -0.550 6.206 623 H VAL 527 H VAL 527 10.556 0.864 7.539 624 HA VAL 527 HA VAL 527 9.486 2.721 5.699 625 HB VAL 527 HB VAL 527 7.377 1.384 5.879 626 HG11 VAL 527 1HG1 VAL 527 8.403 -0.668 4.956 627 HG12 VAL 527 2HG1 VAL 527 9.964 -0.113 5.543 628 HG13 VAL 527 3HG1 VAL 527 9.127 0.805 4.281 629 HG21 VAL 527 3HG2 VAL 527 9.048 -0.227 7.777 630 HG22 VAL 527 1HG2 VAL 527 7.511 -0.725 7.072 631 HG23 VAL 527 2HG2 VAL 527 7.558 0.646 8.202 632 H VAL 528 H VAL 528 9.193 2.298 9.183 633 HA VAL 528 HA VAL 528 7.256 4.346 9.433 634 HB VAL 528 HB VAL 528 9.230 3.284 11.514 635 HG11 VAL 528 1HG1 VAL 528 8.582 5.589 12.080 636 HG12 VAL 528 2HG1 VAL 528 7.843 4.432 13.189 637 HG13 VAL 528 3HG1 VAL 528 6.881 5.150 11.899 638 HG21 VAL 528 3HG2 VAL 528 6.259 2.830 11.154 639 HG22 VAL 528 1HG2 VAL 528 7.242 2.182 12.464 640 HG23 VAL 528 2HG2 VAL 528 7.528 1.661 10.809 641 H SER 529 H SER 529 10.730 4.368 9.127 642 HA SER 529 HA SER 529 11.185 7.069 9.768 643 HB2 SER 529 2HB SER 529 12.631 5.386 7.689 644 HB3 SER 529 1HB SER 529 13.226 6.902 8.363 645 HG SER 529 HG SER 529 12.643 4.570 9.871 646 H LEU 530 H LEU 530 10.108 5.526 6.837 647 HA LEU 530 HA LEU 530 10.126 7.765 5.126 648 HB2 LEU 530 2HB LEU 530 8.508 5.290 5.228 649 HB3 LEU 530 1HB LEU 530 8.447 6.353 3.829 650 HG LEU 530 HG LEU 530 10.798 4.721 4.844 651 HD11 LEU 530 1HD1 LEU 530 9.195 4.521 2.310 652 HD12 LEU 530 2HD1 LEU 530 9.115 3.415 3.681 653 HD13 LEU 530 3HD1 LEU 530 10.593 3.532 2.726 654 HD21 LEU 530 3HD2 LEU 530 12.017 5.525 2.862 655 HD22 LEU 530 1HD2 LEU 530 11.616 6.846 3.959 656 HD23 LEU 530 2HD2 LEU 530 10.679 6.604 2.485 657 H LEU 531 H LEU 531 7.420 6.256 6.979 658 HA LEU 531 HA LEU 531 5.614 8.268 6.372 659 HB2 LEU 531 2HB LEU 531 5.644 6.031 8.384 660 HB3 LEU 531 1HB LEU 531 4.386 7.259 8.432 661 HG LEU 531 HG LEU 531 3.756 5.213 7.320 662 HD11 LEU 531 1HD1 LEU 531 2.643 7.296 6.698 663 HD12 LEU 531 2HD1 LEU 531 2.769 6.240 5.294 664 HD13 LEU 531 3HD1 LEU 531 3.866 7.608 5.466 665 HD21 LEU 531 3HD2 LEU 531 5.819 5.933 5.241 666 HD22 LEU 531 1HD2 LEU 531 4.595 4.678 5.056 667 HD23 LEU 531 2HD2 LEU 531 5.835 4.521 6.300 668 H ARG 532 H ARG 532 7.979 8.062 8.863 669 HA ARG 532 HA ARG 532 6.953 10.181 10.454 670 HB2 ARG 532 2HB ARG 532 8.590 8.515 11.273 671 HB3 ARG 532 1HB ARG 532 9.789 9.171 10.171 672 HG2 ARG 532 2HG ARG 532 10.214 9.993 12.386 673 HG3 ARG 532 1HG ARG 532 9.655 11.324 11.373 674 HD2 ARG 532 2HD ARG 532 7.407 11.099 12.313 675 HD3 ARG 532 1HD ARG 532 7.957 9.756 13.313 676 HE ARG 532 HE ARG 532 9.490 12.135 13.656 677 HH11 ARG 532 1HH1 ARG 532 6.545 10.473 14.739 678 HH12 ARG 532 2HH1 ARG 532 6.476 11.319 16.217 679 HH21 ARG 532 1HH2 ARG 532 9.363 13.252 15.658 680 HH22 ARG 532 2HH2 ARG 532 8.076 12.921 16.757 681 H SER 533 H SER 533 9.545 10.027 7.998 682 HA SER 533 HA SER 533 10.109 12.797 8.118 683 HB2 SER 533 2HB SER 533 11.534 12.330 6.103 684 HB3 SER 533 1HB SER 533 11.864 11.298 7.494 685 HG SER 533 HG SER 533 10.868 9.634 6.533 686 H THR 534 H THR 534 8.095 10.867 5.977 687 HA THR 534 HA THR 534 6.526 11.310 4.457 688 HB THR 534 HB THR 534 5.143 13.341 4.623 689 HG1 THR 534 1HG THR 534 7.385 14.329 5.996 690 HG21 THR 534 3HG2 THR 534 4.835 11.624 6.337 691 HG22 THR 534 1HG2 THR 534 4.521 13.232 6.988 692 HG23 THR 534 2HG2 THR 534 6.040 12.420 7.348 693 H LYS 535 H LYS 535 9.375 12.038 3.975 694 HA LYS 535 HA LYS 535 9.694 14.271 2.368 695 HB2 LYS 535 2HB LYS 535 11.575 13.142 3.324 696 HB3 LYS 535 1HB LYS 535 11.193 11.679 2.432 697 HG2 LYS 535 2HG LYS 535 11.796 12.737 0.344 698 HG3 LYS 535 1HG LYS 535 12.043 14.276 1.155 699 HD2 LYS 535 2HD LYS 535 14.177 13.128 0.731 700 HD3 LYS 535 1HD LYS 535 13.881 13.349 2.451 701 HE2 LYS 535 2HE LYS 535 13.088 10.998 2.576 702 HE3 LYS 535 1HE LYS 535 13.473 10.802 0.865 703 HZ1 LYS 535 3HZ LYS 535 15.397 11.449 3.029 704 HZ2 LYS 535 1HZ LYS 535 15.778 11.286 1.396 705 HZ3 LYS 535 2HZ LYS 535 15.244 9.951 2.276 706 H MET 536 H MET 536 8.876 14.810 0.526 707 HA MET 536 HA MET 536 8.975 13.428 -1.909 708 HB2 MET 536 2HB MET 536 7.090 12.119 -0.601 709 HB3 MET 536 1HB MET 536 6.238 13.650 -0.845 710 HG2 MET 536 2HG MET 536 5.457 12.349 -2.620 711 HG3 MET 536 1HG MET 536 6.710 13.363 -3.308 712 HE1 MET 536 3HE MET 536 9.210 12.416 -3.952 713 HE2 MET 536 1HE MET 536 9.629 10.714 -3.866 714 HE3 MET 536 2HE MET 536 9.489 11.637 -2.383 715 H GLU 537 H GLU 537 8.275 14.780 -3.514 716 HA GLU 537 HA GLU 537 8.229 17.476 -2.805 717 HB2 GLU 537 2HB GLU 537 7.591 16.223 -5.468 718 HB3 GLU 537 1HB GLU 537 7.895 17.935 -5.207 719 HG2 GLU 537 2HG GLU 537 10.154 17.427 -4.459 720 HG3 GLU 537 1HG GLU 537 9.847 15.709 -4.706 721 H GLY 538 H GLY 538 5.633 15.281 -3.662 722 HA2 GLY 538 2HA GLY 538 3.745 17.176 -2.584 723 HA3 GLY 538 1HA GLY 538 3.574 16.905 -4.311 724 H THR 539 H THR 539 3.063 14.785 -5.043 725 HA THR 539 HA THR 539 1.343 13.446 -3.170 726 HB THR 539 HB THR 539 0.911 11.966 -5.159 727 HG1 THR 539 1HG THR 539 2.837 12.691 -6.274 728 HG21 THR 539 3HG2 THR 539 -0.573 13.564 -6.230 729 HG22 THR 539 1HG2 THR 539 0.223 14.900 -5.375 730 HG23 THR 539 2HG2 THR 539 -0.666 13.656 -4.476 731 H VAL 540 H VAL 540 1.859 11.715 -2.134 732 HA VAL 540 HA VAL 540 4.233 10.181 -2.887 733 HB VAL 540 HB VAL 540 2.544 9.917 -0.408 734 HG11 VAL 540 1HG1 VAL 540 3.928 8.055 -0.940 735 HG12 VAL 540 2HG1 VAL 540 4.527 8.845 0.524 736 HG13 VAL 540 3HG1 VAL 540 5.355 9.086 -1.025 737 HG21 VAL 540 3HG2 VAL 540 4.167 11.297 0.783 738 HG22 VAL 540 1HG2 VAL 540 3.364 12.190 -0.520 739 HG23 VAL 540 2HG2 VAL 540 5.007 11.601 -0.742 740 H SER 541 H SER 541 3.740 8.404 -4.040 741 HA SER 541 HA SER 541 1.067 7.322 -3.794 742 HB2 SER 541 2HB SER 541 1.917 7.615 -6.097 743 HB3 SER 541 1HB SER 541 3.298 6.595 -5.720 744 HG SER 541 HG SER 541 0.715 5.894 -6.396 745 H LEU 542 H LEU 542 0.769 5.919 -2.227 746 HA LEU 542 HA LEU 542 2.956 4.068 -1.686 747 HB2 LEU 542 2HB LEU 542 0.628 4.679 0.139 748 HB3 LEU 542 1HB LEU 542 1.954 3.596 0.482 749 HG LEU 542 HG LEU 542 3.404 5.740 0.217 750 HD11 LEU 542 1HD1 LEU 542 0.736 6.949 0.834 751 HD12 LEU 542 2HD1 LEU 542 1.705 7.186 -0.622 752 HD13 LEU 542 3HD1 LEU 542 2.293 7.775 0.937 753 HD21 LEU 542 3HD2 LEU 542 1.661 5.217 2.612 754 HD22 LEU 542 1HD2 LEU 542 3.118 6.212 2.609 755 HD23 LEU 542 2HD2 LEU 542 3.223 4.488 2.233 756 H LEU 543 H LEU 543 2.657 2.054 -1.992 757 HA LEU 543 HA LEU 543 0.090 1.253 -3.111 758 HB2 LEU 543 2HB LEU 543 2.352 1.063 -4.414 759 HB3 LEU 543 1HB LEU 543 2.721 -0.133 -3.240 760 HG LEU 543 HG LEU 543 0.282 -0.529 -4.958 761 HD11 LEU 543 1HD1 LEU 543 3.113 -1.375 -5.552 762 HD12 LEU 543 2HD1 LEU 543 2.180 -0.186 -6.464 763 HD13 LEU 543 3HD1 LEU 543 1.681 -1.878 -6.442 764 HD21 LEU 543 3HD2 LEU 543 0.784 -2.880 -4.479 765 HD22 LEU 543 1HD2 LEU 543 0.509 -1.962 -2.992 766 HD23 LEU 543 2HD2 LEU 543 2.147 -2.393 -3.495 767 H VAL 544 H VAL 544 -1.141 0.093 -1.905 768 HA VAL 544 HA VAL 544 0.013 -1.350 0.369 769 HB VAL 544 HB VAL 544 -1.950 -0.902 1.679 770 HG11 VAL 544 1HG1 VAL 544 -0.945 1.658 0.464 771 HG12 VAL 544 2HG1 VAL 544 -0.232 0.792 1.822 772 HG13 VAL 544 3HG1 VAL 544 -1.825 1.524 1.983 773 HG21 VAL 544 3HG2 VAL 544 -3.595 -0.964 -0.035 774 HG22 VAL 544 1HG2 VAL 544 -3.024 0.560 -0.725 775 HG23 VAL 544 2HG2 VAL 544 -3.782 0.538 0.884 776 H PHE 545 H PHE 545 -1.340 -3.107 1.101 777 HA PHE 545 HA PHE 545 -2.655 -4.477 -1.133 778 HB2 PHE 545 2HB PHE 545 -0.558 -5.496 -0.273 779 HB3 PHE 545 1HB PHE 545 -1.298 -5.641 1.313 780 HD1 PHE 545 1HD PHE 545 -1.296 -6.830 -2.127 781 HD2 PHE 545 2HD PHE 545 -2.842 -7.425 1.770 782 HE1 PHE 545 1HE PHE 545 -2.113 -9.054 -2.806 783 HE2 PHE 545 2HE PHE 545 -3.662 -9.651 1.101 784 HZ PHE 545 HZ PHE 545 -3.291 -10.459 -1.184 785 H ARG 546 H ARG 546 -4.715 -4.515 -0.896 786 HA ARG 546 HA ARG 546 -5.924 -4.172 1.741 787 HB2 ARG 546 2HB ARG 546 -6.541 -2.561 -0.000 788 HB3 ARG 546 1HB ARG 546 -7.054 -3.877 -1.042 789 HG2 ARG 546 2HG ARG 546 -8.861 -4.404 0.464 790 HG3 ARG 546 1HG ARG 546 -8.315 -3.156 1.593 791 HD2 ARG 546 2HD ARG 546 -8.654 -1.461 -0.130 792 HD3 ARG 546 1HD ARG 546 -9.192 -2.705 -1.245 793 HE ARG 546 HE ARG 546 -11.028 -3.102 0.349 794 HH11 ARG 546 1HH1 ARG 546 -9.366 0.037 0.387 795 HH12 ARG 546 2HH1 ARG 546 -10.713 0.964 0.742 796 HH21 ARG 546 1HH2 ARG 546 -12.969 -1.852 0.868 797 HH22 ARG 546 2HH2 ARG 546 -12.884 -0.171 1.012 798 H GLN 547 H GLN 547 -6.672 -5.931 2.660 799 HA GLN 547 HA GLN 547 -7.274 -8.274 0.997 800 HB2 GLN 547 2HB GLN 547 -5.066 -8.466 1.970 801 HB3 GLN 547 1HB GLN 547 -5.712 -8.125 3.560 802 HG2 GLN 547 2HG GLN 547 -7.010 -10.197 3.468 803 HG3 GLN 547 1HG GLN 547 -6.306 -10.552 1.887 804 HE21 GLN 547 1HE2 GLN 547 -4.149 -11.185 1.761 805 HE22 GLN 547 2HE2 GLN 547 -3.249 -11.640 3.158 806 H GLU 548 H GLU 548 -9.249 -9.059 1.386 807 HA GLU 548 HA GLU 548 -10.318 -8.590 4.022 808 HB2 GLU 548 2HB GLU 548 -12.609 -9.050 3.041 809 HB3 GLU 548 1HB GLU 548 -11.846 -7.559 2.540 810 HG2 GLU 548 2HG GLU 548 -11.199 -8.678 0.416 811 HG3 GLU 548 1HG GLU 548 -12.120 -10.090 0.939 812 H GLU 549 H GLU 549 -9.131 -10.078 4.863 813 HA GLU 549 HA GLU 549 -10.201 -12.651 5.119 814 HB2 GLU 549 2HB GLU 549 -8.924 -12.921 2.974 815 HB3 GLU 549 1HB GLU 549 -7.484 -12.330 3.784 816 HG2 GLU 549 2HG GLU 549 -7.465 -14.754 3.544 817 HG3 GLU 549 1HG GLU 549 -7.483 -14.268 5.239 818 H ALA 550 H ALA 550 -8.882 -13.702 6.886 819 HA ALA 550 HA ALA 550 -7.304 -11.683 8.309 820 HB1 ALA 550 1HB ALA 550 -9.275 -13.564 9.581 821 HB2 ALA 550 2HB ALA 550 -9.512 -11.827 9.333 822 HB3 ALA 550 3HB ALA 550 -8.235 -12.400 10.410 823 H PHE 551 H PHE 551 -5.320 -12.345 8.427 824 HA PHE 551 HA PHE 551 -4.840 -15.185 8.921 825 HB2 PHE 551 2HB PHE 551 -3.080 -13.105 7.668 826 HB3 PHE 551 1HB PHE 551 -2.527 -14.736 8.056 827 HD1 PHE 551 2HD PHE 551 -4.098 -16.617 7.004 828 HD2 PHE 551 1HD PHE 551 -3.716 -12.662 5.525 829 HE1 PHE 551 2HE PHE 551 -4.843 -17.374 4.790 830 HE2 PHE 551 1HE PHE 551 -4.463 -13.412 3.311 831 HZ PHE 551 HZ PHE 551 -5.028 -15.771 2.938 832 H HIS 552 H HIS 552 -4.598 -15.455 10.991 833 HA HIS 552 HA HIS 552 -2.838 -13.620 12.453 834 HB2 HIS 552 2HB HIS 552 -5.299 -15.029 13.531 835 HB3 HIS 552 1HB HIS 552 -4.153 -14.132 14.509 836 HD1 HIS 552 1HD HIS 552 -7.164 -13.769 12.492 837 HD2 HIS 552 2HD HIS 552 -4.202 -11.285 13.992 838 HE1 HIS 552 1HE HIS 552 -8.094 -11.435 12.340 839 HE2 HIS 552 2HE HIS 552 -6.179 -9.963 13.014 840 HA PRO 553 HA PRO 553 -0.654 -17.426 13.196 841 HB2 PRO 553 2HB PRO 553 0.504 -16.061 15.538 842 HB3 PRO 553 1HB PRO 553 1.323 -16.730 14.124 843 HG2 PRO 553 2HG PRO 553 1.080 -14.078 14.521 844 HG3 PRO 553 1HG PRO 553 1.066 -14.793 12.898 845 HD2 PRO 553 2HD PRO 553 -1.201 -13.785 14.562 846 HD3 PRO 553 1HD PRO 553 -0.923 -13.671 12.809 847 H ARG 554 H ARG 554 -2.038 -18.904 13.968 848 HA ARG 554 HA ARG 554 -3.206 -20.216 15.347 849 HB2 ARG 554 2HB ARG 554 -1.742 -18.708 17.516 850 HB3 ARG 554 1HB ARG 554 -2.915 -19.953 17.884 851 HG2 ARG 554 2HG ARG 554 -0.672 -20.839 18.043 852 HG3 ARG 554 1HG ARG 554 -1.517 -21.590 16.701 853 HD2 ARG 554 2HD ARG 554 -0.336 -20.200 15.132 854 HD3 ARG 554 1HD ARG 554 0.438 -19.308 16.439 855 HE ARG 554 HE ARG 554 1.003 -21.987 16.797 856 HH11 ARG 554 1HH1 ARG 554 1.652 -19.606 14.267 857 HH12 ARG 554 2HH1 ARG 554 3.242 -20.144 13.970 858 HH21 ARG 554 1HH2 ARG 554 3.190 -22.773 16.322 859 HH22 ARG 554 2HH2 ARG 554 4.119 -21.972 15.139 860 H GLU 555 H GLU 555 -4.928 -20.200 17.078 861 HA GLU 555 HA GLU 555 -6.608 -17.868 16.631 862 HB2 GLU 555 2HB GLU 555 -7.343 -20.361 16.346 863 HB3 GLU 555 1HB GLU 555 -7.309 -20.435 18.094 864 HG2 GLU 555 2HG GLU 555 -9.040 -18.558 16.498 865 HG3 GLU 555 1HG GLU 555 -9.566 -20.124 17.074 866 H MET 556 H MET 556 -5.877 -16.358 17.942 867 HA MET 556 HA MET 556 -4.778 -17.107 20.541 868 HB2 MET 556 2HB MET 556 -3.256 -15.983 19.092 869 HB3 MET 556 1HB MET 556 -4.389 -14.674 18.827 870 HG2 MET 556 2HG MET 556 -4.163 -13.990 21.148 871 HG3 MET 556 1HG MET 556 -3.064 -15.328 21.455 872 HE1 MET 556 3HE MET 556 -1.286 -13.638 22.455 873 HE2 MET 556 1HE MET 556 -2.389 -12.299 22.150 874 HE3 MET 556 2HE MET 556 -0.713 -12.203 21.604 875 H ASN 557 H ASN 557 -5.755 -16.675 22.341 876 HA ASN 557 HA ASN 557 -7.593 -14.408 22.451 877 HB2 ASN 557 2HB ASN 557 -7.667 -17.003 24.015 878 HB3 ASN 557 1HB ASN 557 -8.619 -15.587 24.434 879 HD21 ASN 557 1HD2 ASN 557 -10.332 -15.010 23.135 880 HD22 ASN 557 2HD2 ASN 557 -11.010 -16.090 21.979 881 H ALA 558 H ALA 558 -7.686 -13.581 24.772 882 HA ALA 558 HA ALA 558 -4.936 -13.340 25.694 883 HB1 ALA 558 1HB ALA 558 -6.185 -11.267 25.337 884 HB2 ALA 558 2HB ALA 558 -5.783 -11.459 27.047 885 HB3 ALA 558 3HB ALA 558 -7.416 -11.803 26.477 Start of MODEL 4 1 H1 GLY 448 1HT GLY 448 -19.613 0.895 -7.394 2 H2 GLY 448 2HT GLY 448 -21.044 1.289 -6.603 3 H3 GLY 448 3HT GLY 448 -21.077 0.418 -8.087 4 HA2 GLY 448 1HA GLY 448 -19.963 -0.536 -5.534 5 HA3 GLY 448 2HA GLY 448 -21.473 -1.063 -6.268 6 H SER 449 H SER 449 -19.074 -2.600 -5.621 7 HA SER 449 HA SER 449 -18.116 -3.247 -8.278 8 HB2 SER 449 2HB SER 449 -17.085 -4.090 -5.572 9 HB3 SER 449 1HB SER 449 -16.323 -4.438 -7.125 10 HG SER 449 HG SER 449 -16.795 -1.844 -7.020 11 H VAL 450 H VAL 450 -19.840 -4.434 -9.021 12 HA VAL 450 HA VAL 450 -20.513 -6.821 -7.491 13 HB VAL 450 HB VAL 450 -22.425 -5.549 -8.452 14 HG11 VAL 450 1HG1 VAL 450 -21.282 -6.289 -11.118 15 HG12 VAL 450 2HG1 VAL 450 -21.446 -4.673 -10.438 16 HG13 VAL 450 3HG1 VAL 450 -22.887 -5.609 -10.857 17 HG21 VAL 450 3HG2 VAL 450 -22.108 -8.306 -9.631 18 HG22 VAL 450 1HG2 VAL 450 -23.634 -7.438 -9.467 19 HG23 VAL 450 2HG2 VAL 450 -22.735 -7.915 -8.026 20 H TYR 451 H TYR 451 -18.824 -5.774 -10.317 21 HA TYR 451 HA TYR 451 -18.335 -8.462 -11.206 22 HB2 TYR 451 2HB TYR 451 -18.455 -6.729 -12.925 23 HB3 TYR 451 1HB TYR 451 -17.178 -5.814 -12.133 24 HD1 TYR 451 1HD TYR 451 -17.831 -9.099 -13.787 25 HD2 TYR 451 2HD TYR 451 -14.954 -6.136 -12.782 26 HE1 TYR 451 1HE TYR 451 -16.136 -10.292 -15.132 27 HE2 TYR 451 2HE TYR 451 -13.262 -7.317 -14.115 28 HH TYR 451 HH TYR 451 -12.824 -9.513 -14.904 29 H ASN 452 H ASN 452 -17.079 -9.659 -10.092 30 HA ASN 452 HA ASN 452 -14.400 -8.911 -9.459 31 HB2 ASN 452 2HB ASN 452 -15.690 -8.060 -7.439 32 HB3 ASN 452 1HB ASN 452 -16.277 -9.694 -7.186 33 HD21 ASN 452 1HD2 ASN 452 -14.773 -8.058 -5.368 34 HD22 ASN 452 2HD2 ASN 452 -13.326 -8.913 -4.997 35 H THR 453 H THR 453 -13.773 -10.612 -10.655 36 HA THR 453 HA THR 453 -14.966 -13.190 -9.986 37 HB THR 453 HB THR 453 -15.366 -12.436 -12.328 38 HG1 THR 453 1HG THR 453 -15.357 -14.439 -12.743 39 HG21 THR 453 3HG2 THR 453 -13.501 -12.403 -13.938 40 HG22 THR 453 1HG2 THR 453 -12.365 -12.654 -12.612 41 HG23 THR 453 2HG2 THR 453 -13.303 -11.165 -12.697 42 H LYS 454 H LYS 454 -12.258 -11.330 -9.569 43 HA LYS 454 HA LYS 454 -10.555 -13.698 -9.267 44 HB2 LYS 454 2HB LYS 454 -9.671 -10.811 -9.542 45 HB3 LYS 454 1HB LYS 454 -8.626 -12.210 -9.449 46 HG2 LYS 454 2HG LYS 454 -10.515 -11.569 -11.715 47 HG3 LYS 454 1HG LYS 454 -8.772 -11.330 -11.721 48 HD2 LYS 454 2HD LYS 454 -8.448 -13.754 -11.486 49 HD3 LYS 454 1HD LYS 454 -10.197 -13.985 -11.477 50 HE2 LYS 454 2HE LYS 454 -10.340 -13.019 -13.724 51 HE3 LYS 454 1HE LYS 454 -8.596 -12.779 -13.734 52 HZ1 LYS 454 3HZ LYS 454 -9.220 -14.769 -14.939 53 HZ2 LYS 454 1HZ LYS 454 -9.979 -15.405 -13.578 54 HZ3 LYS 454 2HZ LYS 454 -8.311 -15.173 -13.591 55 H LYS 455 H LYS 455 -11.264 -14.220 -7.178 56 HA LYS 455 HA LYS 455 -11.242 -12.118 -5.215 57 HB2 LYS 455 2HB LYS 455 -11.894 -15.057 -4.883 58 HB3 LYS 455 1HB LYS 455 -12.002 -13.853 -3.613 59 HG2 LYS 455 2HG LYS 455 -13.720 -12.661 -4.897 60 HG3 LYS 455 1HG LYS 455 -13.620 -13.897 -6.152 61 HD2 LYS 455 2HD LYS 455 -14.309 -15.603 -4.536 62 HD3 LYS 455 1HD LYS 455 -14.377 -14.374 -3.272 63 HE2 LYS 455 2HE LYS 455 -16.133 -13.202 -4.507 64 HE3 LYS 455 1HE LYS 455 -16.053 -14.418 -5.779 65 HZ1 LYS 455 3HZ LYS 455 -16.838 -14.926 -2.953 66 HZ2 LYS 455 1HZ LYS 455 -16.756 -16.087 -4.156 67 HZ3 LYS 455 2HZ LYS 455 -17.886 -14.844 -4.277 68 H VAL 456 H VAL 456 -9.206 -11.542 -5.186 69 HA VAL 456 HA VAL 456 -7.360 -13.222 -3.657 70 HB VAL 456 HB VAL 456 -5.460 -12.421 -5.084 71 HG11 VAL 456 1HG1 VAL 456 -7.555 -13.947 -6.624 72 HG12 VAL 456 2HG1 VAL 456 -6.376 -14.636 -5.512 73 HG13 VAL 456 3HG1 VAL 456 -5.838 -13.883 -7.015 74 HG21 VAL 456 3HG2 VAL 456 -6.486 -10.406 -6.004 75 HG22 VAL 456 1HG2 VAL 456 -7.639 -11.389 -6.906 76 HG23 VAL 456 2HG2 VAL 456 -5.923 -11.454 -7.307 77 H GLY 457 H GLY 457 -5.300 -11.484 -3.419 78 HA2 GLY 457 2HA GLY 457 -6.490 -9.265 -1.981 79 HA3 GLY 457 1HA GLY 457 -4.798 -9.759 -1.948 80 H LYS 458 H LYS 458 -6.711 -7.366 -2.886 81 HA LYS 458 HA LYS 458 -5.391 -6.884 -5.451 82 HB2 LYS 458 2HB LYS 458 -7.668 -5.382 -4.131 83 HB3 LYS 458 1HB LYS 458 -6.899 -4.861 -5.613 84 HG2 LYS 458 2HG LYS 458 -8.942 -5.915 -6.196 85 HG3 LYS 458 1HG LYS 458 -7.649 -7.011 -6.658 86 HD2 LYS 458 2HD LYS 458 -8.061 -8.335 -4.632 87 HD3 LYS 458 1HD LYS 458 -9.343 -7.217 -4.167 88 HE2 LYS 458 2HE LYS 458 -9.298 -8.912 -6.667 89 HE3 LYS 458 1HE LYS 458 -10.238 -9.256 -5.225 90 HZ1 LYS 458 3HZ LYS 458 -11.601 -8.191 -6.931 91 HZ2 LYS 458 1HZ LYS 458 -10.543 -6.897 -7.006 92 HZ3 LYS 458 2HZ LYS 458 -11.443 -7.122 -5.624 93 H ARG 459 H ARG 459 -4.005 -5.233 -5.810 94 HA ARG 459 HA ARG 459 -3.257 -3.755 -3.423 95 HB2 ARG 459 2HB ARG 459 -1.538 -4.368 -5.842 96 HB3 ARG 459 1HB ARG 459 -1.080 -3.336 -4.496 97 HG2 ARG 459 2HG ARG 459 -0.006 -5.390 -4.028 98 HG3 ARG 459 1HG ARG 459 -1.439 -5.356 -3.024 99 HD2 ARG 459 2HD ARG 459 -1.185 -7.560 -4.047 100 HD3 ARG 459 1HD ARG 459 -2.641 -6.757 -4.640 101 HE ARG 459 HE ARG 459 -0.394 -6.253 -6.278 102 HH11 ARG 459 1HH1 ARG 459 -2.922 -8.684 -5.626 103 HH12 ARG 459 2HH1 ARG 459 -2.797 -9.429 -7.142 104 HH21 ARG 459 1HH2 ARG 459 -0.264 -7.245 -8.374 105 HH22 ARG 459 2HH2 ARG 459 -1.250 -8.575 -8.769 106 H LEU 460 H LEU 460 -3.427 -1.688 -3.392 107 HA LEU 460 HA LEU 460 -4.269 -0.341 -5.867 108 HB2 LEU 460 2HB LEU 460 -5.131 0.258 -3.026 109 HB3 LEU 460 1HB LEU 460 -5.525 1.245 -4.404 110 HG LEU 460 HG LEU 460 -6.852 -0.721 -5.309 111 HD11 LEU 460 1HD1 LEU 460 -7.564 -2.449 -3.759 112 HD12 LEU 460 2HD1 LEU 460 -6.448 -1.832 -2.539 113 HD13 LEU 460 3HD1 LEU 460 -5.822 -2.517 -4.037 114 HD21 LEU 460 3HD2 LEU 460 -7.690 0.427 -2.654 115 HD22 LEU 460 1HD2 LEU 460 -8.758 -0.319 -3.841 116 HD23 LEU 460 2HD2 LEU 460 -7.915 1.179 -4.233 117 H ASN 461 H ASN 461 -3.387 1.689 -6.241 118 HA ASN 461 HA ASN 461 -1.260 2.411 -4.379 119 HB2 ASN 461 2HB ASN 461 -0.091 3.563 -6.236 120 HB3 ASN 461 1HB ASN 461 -0.339 1.867 -6.605 121 HD21 ASN 461 1HD2 ASN 461 -1.794 1.312 -8.256 122 HD22 ASN 461 2HD2 ASN 461 -2.329 2.477 -9.413 123 H ILE 462 H ILE 462 -1.559 4.087 -3.223 124 HA ILE 462 HA ILE 462 -3.586 6.013 -4.093 125 HB ILE 462 HB ILE 462 -2.780 5.353 -1.227 126 HG12 ILE 462 2HG1 ILE 462 -5.251 4.651 -1.031 127 HG13 ILE 462 1HG1 ILE 462 -5.262 4.654 -2.785 128 HG21 ILE 462 1HG2 ILE 462 -3.369 7.675 -1.465 129 HG22 ILE 462 2HG2 ILE 462 -4.613 6.819 -0.550 130 HG23 ILE 462 3HG2 ILE 462 -4.890 7.234 -2.241 131 HD11 ILE 462 3HD1 ILE 462 -5.007 2.434 -1.879 132 HD12 ILE 462 1HD1 ILE 462 -3.537 2.927 -1.039 133 HD13 ILE 462 2HD1 ILE 462 -3.584 2.906 -2.810 134 H GLN 463 H GLN 463 -2.933 8.033 -4.361 135 HA GLN 463 HA GLN 463 -0.216 8.726 -3.496 136 HB2 GLN 463 2HB GLN 463 -2.033 9.962 -5.568 137 HB3 GLN 463 1HB GLN 463 -0.457 10.595 -5.134 138 HG2 GLN 463 2HG GLN 463 0.617 8.640 -5.925 139 HG3 GLN 463 1HG GLN 463 -0.931 7.843 -6.247 140 HE21 GLN 463 1HE2 GLN 463 1.395 10.176 -7.307 141 HE22 GLN 463 2HE2 GLN 463 0.689 10.474 -8.853 142 H LEU 464 H LEU 464 -0.005 10.121 -1.894 143 HA LEU 464 HA LEU 464 -2.409 11.647 -1.119 144 HB2 LEU 464 2HB LEU 464 -0.144 10.723 0.651 145 HB3 LEU 464 1HB LEU 464 -1.495 11.695 1.171 146 HG LEU 464 HG LEU 464 -1.889 9.544 1.977 147 HD11 LEU 464 1HD1 LEU 464 -3.866 10.535 1.123 148 HD12 LEU 464 2HD1 LEU 464 -3.906 8.788 0.865 149 HD13 LEU 464 3HD1 LEU 464 -3.555 9.867 -0.480 150 HD21 LEU 464 3HD2 LEU 464 -0.288 8.310 0.633 151 HD22 LEU 464 1HD2 LEU 464 -1.335 8.442 -0.773 152 HD23 LEU 464 2HD2 LEU 464 -1.862 7.498 0.621 153 H LYS 465 H LYS 465 -2.243 13.773 -0.967 154 HA LYS 465 HA LYS 465 0.409 15.045 -1.341 155 HB2 LYS 465 2HB LYS 465 -1.430 15.515 -3.021 156 HB3 LYS 465 1HB LYS 465 -2.355 16.184 -1.673 157 HG2 LYS 465 2HG LYS 465 -0.682 17.861 -1.311 158 HG3 LYS 465 1HG LYS 465 0.328 17.176 -2.589 159 HD2 LYS 465 2HD LYS 465 -1.529 17.626 -4.187 160 HD3 LYS 465 1HD LYS 465 -2.386 18.453 -2.885 161 HE2 LYS 465 2HE LYS 465 0.337 19.129 -3.896 162 HE3 LYS 465 1HE LYS 465 -1.134 20.018 -4.338 163 HZ1 LYS 465 3HZ LYS 465 0.110 19.800 -1.632 164 HZ2 LYS 465 1HZ LYS 465 -1.356 20.578 -1.945 165 HZ3 LYS 465 2HZ LYS 465 0.066 21.167 -2.605 166 H LYS 466 H LYS 466 1.161 16.223 0.182 167 HA LYS 466 HA LYS 466 -0.007 15.916 2.741 168 HB2 LYS 466 2HB LYS 466 2.398 17.393 1.785 169 HB3 LYS 466 1HB LYS 466 1.783 17.644 3.405 170 HG2 LYS 466 2HG LYS 466 3.606 16.023 3.403 171 HG3 LYS 466 1HG LYS 466 2.098 15.280 3.911 172 HD2 LYS 466 2HD LYS 466 3.356 13.808 2.430 173 HD3 LYS 466 1HD LYS 466 1.840 14.309 1.684 174 HE2 LYS 466 2HE LYS 466 3.735 14.301 0.175 175 HE3 LYS 466 1HE LYS 466 2.966 15.885 0.295 176 HZ1 LYS 466 3HZ LYS 466 4.784 16.582 1.802 177 HZ2 LYS 466 1HZ LYS 466 5.399 16.083 0.342 178 HZ3 LYS 466 2HZ LYS 466 5.514 15.081 1.675 179 H GLY 467 H GLY 467 -1.488 16.948 3.601 180 HA2 GLY 467 2HA GLY 467 -2.140 19.629 2.647 181 HA3 GLY 467 1HA GLY 467 -3.203 18.559 3.566 182 H THR 468 H THR 468 -3.607 20.121 5.154 183 HA THR 468 HA THR 468 -1.545 21.428 6.562 184 HB THR 468 HB THR 468 -4.374 20.846 7.485 185 HG1 THR 468 1HG THR 468 -3.579 23.288 6.353 186 HG21 THR 468 3HG2 THR 468 -2.860 21.682 9.253 187 HG22 THR 468 1HG2 THR 468 -4.084 22.882 8.830 188 HG23 THR 468 2HG2 THR 468 -2.430 23.053 8.235 189 H GLU 469 H GLU 469 -3.253 18.372 7.029 190 HA GLU 469 HA GLU 469 -1.836 17.827 9.523 191 HB2 GLU 469 2HB GLU 469 -3.844 16.207 7.968 192 HB3 GLU 469 1HB GLU 469 -3.197 15.779 9.540 193 HG2 GLU 469 2HG GLU 469 -4.796 18.249 8.950 194 HG3 GLU 469 1HG GLU 469 -5.441 16.761 9.636 195 H GLY 470 H GLY 470 -0.955 17.750 6.440 196 HA2 GLY 470 2HA GLY 470 0.801 16.693 5.397 197 HA3 GLY 470 1HA GLY 470 0.994 15.682 6.827 198 H LEU 471 H LEU 471 0.560 13.639 6.567 199 HA LEU 471 HA LEU 471 -0.791 12.714 4.191 200 HB2 LEU 471 2HB LEU 471 0.596 11.253 6.433 201 HB3 LEU 471 1HB LEU 471 -0.219 10.419 5.141 202 HG LEU 471 HG LEU 471 2.099 10.346 4.696 203 HD11 LEU 471 1HD1 LEU 471 0.889 12.420 2.898 204 HD12 LEU 471 2HD1 LEU 471 0.817 10.661 2.723 205 HD13 LEU 471 3HD1 LEU 471 2.347 11.517 2.555 206 HD21 LEU 471 3HD2 LEU 471 2.893 12.141 6.117 207 HD22 LEU 471 1HD2 LEU 471 2.180 13.334 5.024 208 HD23 LEU 471 2HD2 LEU 471 3.518 12.331 4.474 209 H GLY 472 H GLY 472 -1.252 12.479 7.685 210 HA2 GLY 472 2HA GLY 472 -3.339 12.616 8.775 211 HA3 GLY 472 1HA GLY 472 -4.114 12.418 7.215 212 H PHE 473 H PHE 473 -1.682 10.118 8.153 213 HA PHE 473 HA PHE 473 -3.599 8.406 9.390 214 HB2 PHE 473 2HB PHE 473 -3.329 6.512 7.861 215 HB3 PHE 473 1HB PHE 473 -4.038 7.882 7.025 216 HD1 PHE 473 1HD PHE 473 -2.483 9.305 5.615 217 HD2 PHE 473 2HD PHE 473 -1.447 5.423 7.022 218 HE1 PHE 473 1HE PHE 473 -0.771 9.110 3.866 219 HE2 PHE 473 2HE PHE 473 0.278 5.270 5.284 220 HZ PHE 473 HZ PHE 473 0.584 7.131 3.720 221 H SER 474 H SER 474 -2.604 6.444 10.134 222 HA SER 474 HA SER 474 0.227 6.906 10.751 223 HB2 SER 474 2HB SER 474 -1.323 7.372 12.649 224 HB3 SER 474 1HB SER 474 -1.944 5.734 12.525 225 HG SER 474 HG SER 474 -0.126 6.463 14.049 226 H ILE 475 H ILE 475 1.422 4.898 11.113 227 HA ILE 475 HA ILE 475 0.245 2.512 9.792 228 HB ILE 475 HB ILE 475 2.564 1.927 9.191 229 HG12 ILE 475 2HG1 ILE 475 3.139 4.783 9.912 230 HG13 ILE 475 1HG1 ILE 475 3.640 3.284 10.727 231 HG21 ILE 475 1HG2 ILE 475 1.080 2.713 7.507 232 HG22 ILE 475 2HG2 ILE 475 2.704 3.287 7.197 233 HG23 ILE 475 3HG2 ILE 475 1.493 4.409 7.848 234 HD11 ILE 475 3HD1 ILE 475 5.425 4.361 9.342 235 HD12 ILE 475 1HD1 ILE 475 4.450 4.061 7.907 236 HD13 ILE 475 2HD1 ILE 475 5.072 2.709 8.853 237 H THR 476 H THR 476 0.705 0.567 10.744 238 HA THR 476 HA THR 476 2.142 0.539 13.312 239 HB THR 476 HB THR 476 -0.282 0.495 13.822 240 HG1 THR 476 1HG THR 476 1.005 -0.794 15.168 241 HG21 THR 476 3HG2 THR 476 -1.103 -0.417 11.686 242 HG22 THR 476 1HG2 THR 476 -1.725 -1.347 13.050 243 HG23 THR 476 2HG2 THR 476 -0.394 -1.981 12.083 244 H SER 477 H SER 477 3.221 -1.481 13.777 245 HA SER 477 HA SER 477 3.334 -3.333 11.516 246 HB2 SER 477 2HB SER 477 5.758 -3.418 11.745 247 HB3 SER 477 1HB SER 477 5.240 -1.761 11.469 248 HG SER 477 HG SER 477 6.134 -2.887 13.899 249 H ARG 478 H ARG 478 4.015 -5.456 12.154 250 HA ARG 478 HA ARG 478 4.577 -5.964 14.910 251 HB2 ARG 478 2HB ARG 478 2.832 -7.714 15.170 252 HB3 ARG 478 1HB ARG 478 2.154 -6.109 14.998 253 HG2 ARG 478 2HG ARG 478 1.571 -6.605 12.668 254 HG3 ARG 478 1HG ARG 478 2.278 -8.216 12.838 255 HD2 ARG 478 2HD ARG 478 0.684 -8.714 14.634 256 HD3 ARG 478 1HD ARG 478 -0.018 -7.113 14.452 257 HE ARG 478 HE ARG 478 -0.211 -8.280 11.985 258 HH11 ARG 478 1HH1 ARG 478 -1.267 -9.219 15.243 259 HH12 ARG 478 2HH1 ARG 478 -2.712 -9.936 14.706 260 HH21 ARG 478 1HH2 ARG 478 -2.190 -9.258 11.274 261 HH22 ARG 478 2HH2 ARG 478 -3.250 -9.984 12.390 262 H ASP 479 H ASP 479 6.150 -7.418 15.003 263 HA ASP 479 HA ASP 479 7.086 -8.636 12.606 264 HB2 ASP 479 2HB ASP 479 8.667 -8.013 14.362 265 HB3 ASP 479 1HB ASP 479 7.899 -9.139 15.478 266 H VAL 480 H VAL 480 6.478 -10.450 11.710 267 HA VAL 480 HA VAL 480 4.964 -12.335 13.351 268 HB VAL 480 HB VAL 480 3.704 -12.955 11.310 269 HG11 VAL 480 1HG1 VAL 480 3.597 -10.008 11.954 270 HG12 VAL 480 2HG1 VAL 480 2.753 -11.295 12.814 271 HG13 VAL 480 3HG1 VAL 480 2.327 -10.925 11.143 272 HG21 VAL 480 3HG2 VAL 480 3.832 -11.528 9.308 273 HG22 VAL 480 1HG2 VAL 480 5.358 -12.352 9.631 274 HG23 VAL 480 2HG2 VAL 480 5.173 -10.647 10.035 275 H THR 481 H THR 481 5.285 -14.533 12.940 276 HA THR 481 HA THR 481 7.862 -15.118 11.797 277 HB THR 481 HB THR 481 7.338 -16.301 13.864 278 HG1 THR 481 1HG THR 481 7.331 -18.060 11.617 279 HG21 THR 481 3HG2 THR 481 5.541 -17.992 13.983 280 HG22 THR 481 1HG2 THR 481 5.007 -17.522 12.368 281 HG23 THR 481 2HG2 THR 481 4.897 -16.376 13.709 282 H ILE 482 H ILE 482 4.534 -15.342 10.922 283 HA ILE 482 HA ILE 482 5.138 -16.989 8.626 284 HB ILE 482 HB ILE 482 2.527 -15.630 9.397 285 HG12 ILE 482 2HG1 ILE 482 3.151 -17.353 11.021 286 HG13 ILE 482 1HG1 ILE 482 1.761 -17.864 10.078 287 HG21 ILE 482 1HG2 ILE 482 2.659 -16.036 6.994 288 HG22 ILE 482 2HG2 ILE 482 1.466 -17.101 7.738 289 HG23 ILE 482 3HG2 ILE 482 3.051 -17.731 7.287 290 HD11 ILE 482 3HD1 ILE 482 3.281 -19.713 10.399 291 HD12 ILE 482 1HD1 ILE 482 4.609 -18.778 9.721 292 HD13 ILE 482 2HD1 ILE 482 3.256 -19.259 8.695 293 H GLY 483 H GLY 483 6.596 -15.707 7.608 294 HA2 GLY 483 2HA GLY 483 6.318 -14.331 5.523 295 HA3 GLY 483 1HA GLY 483 5.639 -13.127 6.619 296 H GLY 484 H GLY 484 7.665 -12.155 5.379 297 HA2 GLY 484 2HA GLY 484 9.979 -12.531 7.146 298 HA3 GLY 484 1HA GLY 484 10.083 -11.993 5.471 299 H SER 485 H SER 485 10.580 -10.879 8.366 300 HA SER 485 HA SER 485 10.762 -8.866 9.299 301 HB2 SER 485 2HB SER 485 9.802 -7.792 6.630 302 HB3 SER 485 1HB SER 485 10.531 -6.829 7.916 303 HG SER 485 HG SER 485 12.010 -7.459 6.278 304 H ALA 486 H ALA 486 9.283 -6.640 9.475 305 HA ALA 486 HA ALA 486 6.793 -7.685 10.508 306 HB1 ALA 486 1HB ALA 486 6.661 -5.600 11.764 307 HB2 ALA 486 2HB ALA 486 8.109 -5.008 10.945 308 HB3 ALA 486 3HB ALA 486 8.208 -6.400 12.024 309 HA PRO 487 HA PRO 487 4.797 -5.797 6.948 310 HB2 PRO 487 2HB PRO 487 2.298 -6.609 7.617 311 HB3 PRO 487 1HB PRO 487 3.462 -7.658 6.811 312 HG2 PRO 487 2HG PRO 487 2.704 -7.538 9.694 313 HG3 PRO 487 1HG PRO 487 3.033 -8.950 8.675 314 HD2 PRO 487 2HD PRO 487 4.808 -7.936 10.425 315 HD3 PRO 487 1HD PRO 487 5.301 -8.761 8.935 316 H ILE 488 H ILE 488 3.787 -3.855 6.731 317 HA ILE 488 HA ILE 488 2.772 -2.745 9.192 318 HB ILE 488 HB ILE 488 4.155 -1.185 6.972 319 HG12 ILE 488 2HG1 ILE 488 4.712 -2.038 9.753 320 HG13 ILE 488 1HG1 ILE 488 5.768 -1.964 8.360 321 HG21 ILE 488 1HG2 ILE 488 3.669 0.794 8.118 322 HG22 ILE 488 2HG2 ILE 488 2.640 -0.079 9.269 323 HG23 ILE 488 3HG2 ILE 488 2.175 0.023 7.567 324 HD11 ILE 488 3HD1 ILE 488 5.871 0.456 8.519 325 HD12 ILE 488 1HD1 ILE 488 6.436 -0.328 10.006 326 HD13 ILE 488 2HD1 ILE 488 4.834 0.416 9.942 327 H TYR 489 H TYR 489 0.916 -2.039 9.425 328 HA TYR 489 HA TYR 489 -0.880 -1.930 7.095 329 HB2 TYR 489 2HB TYR 489 -1.576 -2.675 9.964 330 HB3 TYR 489 1HB TYR 489 -2.697 -2.584 8.616 331 HD1 TYR 489 2HD TYR 489 0.186 -4.434 9.970 332 HD2 TYR 489 1HD TYR 489 -2.921 -4.349 7.081 333 HE1 TYR 489 2HE TYR 489 0.716 -6.706 9.417 334 HE2 TYR 489 1HE TYR 489 -2.414 -6.677 6.456 335 HH TYR 489 HH TYR 489 -0.394 -8.665 8.325 336 H VAL 490 H VAL 490 -2.359 -0.268 7.132 337 HA VAL 490 HA VAL 490 -1.533 2.125 8.388 338 HB VAL 490 HB VAL 490 -4.255 1.447 7.243 339 HG11 VAL 490 1HG1 VAL 490 -2.968 4.125 7.806 340 HG12 VAL 490 2HG1 VAL 490 -4.327 3.422 8.681 341 HG13 VAL 490 3HG1 VAL 490 -4.516 3.884 6.991 342 HG21 VAL 490 3HG2 VAL 490 -2.474 1.141 5.624 343 HG22 VAL 490 1HG2 VAL 490 -1.885 2.777 5.945 344 HG23 VAL 490 2HG2 VAL 490 -3.488 2.522 5.228 345 H LYS 491 H LYS 491 -1.712 2.621 10.391 346 HA LYS 491 HA LYS 491 -3.015 0.922 12.273 347 HB2 LYS 491 2HB LYS 491 -0.845 2.043 12.664 348 HB3 LYS 491 1HB LYS 491 -1.630 3.591 12.588 349 HG2 LYS 491 2HG LYS 491 -2.260 1.551 14.718 350 HG3 LYS 491 1HG LYS 491 -0.981 2.748 14.882 351 HD2 LYS 491 2HD LYS 491 -2.646 4.529 14.621 352 HD3 LYS 491 1HD LYS 491 -3.914 3.311 14.463 353 HE2 LYS 491 2HE LYS 491 -3.396 2.486 16.672 354 HE3 LYS 491 1HE LYS 491 -2.131 3.715 16.835 355 HZ1 LYS 491 3HZ LYS 491 -5.036 4.242 16.504 356 HZ2 LYS 491 1HZ LYS 491 -3.859 5.433 16.676 357 HZ3 LYS 491 2HZ LYS 491 -4.190 4.387 17.939 358 H ASN 492 H ASN 492 -3.731 4.069 10.877 359 HA ASN 492 HA ASN 492 -6.508 3.910 11.474 360 HB2 ASN 492 2HB ASN 492 -5.636 4.381 13.779 361 HB3 ASN 492 1HB ASN 492 -4.937 5.874 13.176 362 HD21 ASN 492 1HD2 ASN 492 -6.145 7.109 14.597 363 HD22 ASN 492 2HD2 ASN 492 -7.833 7.352 14.404 364 H ILE 493 H ILE 493 -7.660 5.574 10.479 365 HA ILE 493 HA ILE 493 -6.136 7.424 8.788 366 HB ILE 493 HB ILE 493 -9.049 6.526 8.630 367 HG12 ILE 493 2HG1 ILE 493 -7.497 4.733 8.011 368 HG13 ILE 493 1HG1 ILE 493 -8.427 5.318 6.637 369 HG21 ILE 493 1HG2 ILE 493 -7.473 8.234 6.710 370 HG22 ILE 493 2HG2 ILE 493 -8.822 8.789 7.709 371 HG23 ILE 493 3HG2 ILE 493 -9.081 7.612 6.418 372 HD11 ILE 493 3HD1 ILE 493 -6.121 4.895 6.013 373 HD12 ILE 493 1HD1 ILE 493 -5.562 6.006 7.262 374 HD13 ILE 493 2HD1 ILE 493 -6.488 6.616 5.889 375 H LEU 494 H LEU 494 -6.094 9.490 9.444 376 HA LEU 494 HA LEU 494 -7.644 10.277 11.728 377 HB2 LEU 494 2HB LEU 494 -5.484 11.668 10.137 378 HB3 LEU 494 1HB LEU 494 -6.361 12.476 11.410 379 HG LEU 494 HG LEU 494 -5.443 10.871 13.063 380 HD11 LEU 494 1HD1 LEU 494 -3.821 9.786 10.783 381 HD12 LEU 494 2HD1 LEU 494 -5.120 8.926 11.613 382 HD13 LEU 494 3HD1 LEU 494 -3.647 9.353 12.485 383 HD21 LEU 494 3HD2 LEU 494 -4.283 12.960 12.640 384 HD22 LEU 494 1HD2 LEU 494 -3.344 12.194 11.360 385 HD23 LEU 494 2HD2 LEU 494 -3.145 11.673 13.032 386 HA PRO 495 HA PRO 495 -11.085 12.241 9.815 387 HB2 PRO 495 2HB PRO 495 -11.279 14.535 11.333 388 HB3 PRO 495 1HB PRO 495 -11.881 12.948 11.829 389 HG2 PRO 495 2HG PRO 495 -9.293 14.292 12.521 390 HG3 PRO 495 1HG PRO 495 -10.391 13.394 13.581 391 HD2 PRO 495 2HD PRO 495 -8.176 12.262 12.676 392 HD3 PRO 495 1HD PRO 495 -9.690 11.332 12.751 393 H ARG 496 H ARG 496 -8.146 14.036 10.142 394 HA ARG 496 HA ARG 496 -8.831 15.504 7.723 395 HB2 ARG 496 2HB ARG 496 -7.515 16.671 10.186 396 HB3 ARG 496 1HB ARG 496 -7.478 17.448 8.610 397 HG2 ARG 496 2HG ARG 496 -9.961 16.790 10.180 398 HG3 ARG 496 1HG ARG 496 -9.199 18.380 10.082 399 HD2 ARG 496 2HD ARG 496 -9.551 18.416 7.671 400 HD3 ARG 496 1HD ARG 496 -10.281 16.814 7.739 401 HE ARG 496 HE ARG 496 -11.626 18.536 9.462 402 HH11 ARG 496 1HH1 ARG 496 -11.153 17.992 5.991 403 HH12 ARG 496 2HH1 ARG 496 -12.694 18.574 5.553 404 HH21 ARG 496 1HH2 ARG 496 -13.750 19.342 8.834 405 HH22 ARG 496 2HH2 ARG 496 -14.164 19.362 7.175 406 H GLY 497 H GLY 497 -7.285 15.661 6.244 407 HA2 GLY 497 2HA GLY 497 -4.695 15.653 6.198 408 HA3 GLY 497 1HA GLY 497 -4.979 13.973 6.659 409 H ALA 498 H ALA 498 -3.966 13.415 4.644 410 HA ALA 498 HA ALA 498 -5.404 14.128 2.228 411 HB1 ALA 498 1HB ALA 498 -2.911 12.503 2.641 412 HB2 ALA 498 2HB ALA 498 -2.973 14.219 2.232 413 HB3 ALA 498 3HB ALA 498 -3.563 13.015 1.083 414 H ALA 499 H ALA 499 -4.488 11.264 4.075 415 HA ALA 499 HA ALA 499 -5.358 9.251 2.385 416 HB1 ALA 499 1HB ALA 499 -4.014 8.859 4.365 417 HB2 ALA 499 2HB ALA 499 -5.437 7.813 4.336 418 HB3 ALA 499 3HB ALA 499 -5.401 9.230 5.388 419 H ILE 500 H ILE 500 -7.231 10.793 4.951 420 HA ILE 500 HA ILE 500 -9.498 9.185 4.564 421 HB ILE 500 HB ILE 500 -9.030 10.485 6.664 422 HG12 ILE 500 2HG1 ILE 500 -11.719 10.884 5.345 423 HG13 ILE 500 1HG1 ILE 500 -11.200 9.502 6.260 424 HG21 ILE 500 1HG2 ILE 500 -8.343 12.604 5.692 425 HG22 ILE 500 2HG2 ILE 500 -9.695 12.845 6.800 426 HG23 ILE 500 3HG2 ILE 500 -9.969 12.854 5.057 427 HD11 ILE 500 3HD1 ILE 500 -11.561 12.261 7.403 428 HD12 ILE 500 1HD1 ILE 500 -11.081 10.809 8.290 429 HD13 ILE 500 2HD1 ILE 500 -12.688 10.913 7.568 430 H GLN 501 H GLN 501 -8.413 12.097 3.012 431 HA GLN 501 HA GLN 501 -10.938 12.775 1.837 432 HB2 GLN 501 2HB GLN 501 -8.155 13.701 1.226 433 HB3 GLN 501 1HB GLN 501 -9.604 14.391 0.517 434 HG2 GLN 501 2HG GLN 501 -8.838 14.412 3.428 435 HG3 GLN 501 1HG GLN 501 -8.804 15.775 2.315 436 HE21 GLN 501 1HE2 GLN 501 -10.217 15.424 4.798 437 HE22 GLN 501 2HE2 GLN 501 -11.891 15.662 4.476 438 H ASP 502 H ASP 502 -8.236 10.793 0.988 439 HA ASP 502 HA ASP 502 -8.857 10.697 -1.816 440 HB2 ASP 502 2HB ASP 502 -6.574 10.223 -0.899 441 HB3 ASP 502 1HB ASP 502 -7.217 8.744 -0.197 442 H GLY 503 H GLY 503 -9.253 8.532 0.928 443 HA2 GLY 503 2HA GLY 503 -11.233 7.332 1.369 444 HA3 GLY 503 1HA GLY 503 -11.706 7.552 -0.304 445 H ARG 504 H ARG 504 -8.980 6.507 -1.235 446 HA ARG 504 HA ARG 504 -9.811 3.757 -1.369 447 HB2 ARG 504 2HB ARG 504 -7.185 4.997 -2.155 448 HB3 ARG 504 1HB ARG 504 -7.717 3.382 -2.598 449 HG2 ARG 504 2HG ARG 504 -9.504 4.369 -3.943 450 HG3 ARG 504 1HG ARG 504 -8.952 5.985 -3.475 451 HD2 ARG 504 2HD ARG 504 -6.734 5.449 -4.434 452 HD3 ARG 504 1HD ARG 504 -7.381 3.911 -4.996 453 HE ARG 504 HE ARG 504 -8.899 6.151 -5.864 454 HH11 ARG 504 1HH1 ARG 504 -6.003 4.223 -6.582 455 HH12 ARG 504 2HH1 ARG 504 -5.944 4.663 -8.215 456 HH21 ARG 504 1HH2 ARG 504 -8.799 6.742 -8.165 457 HH22 ARG 504 2HH2 ARG 504 -7.563 6.087 -9.131 458 H LEU 505 H LEU 505 -7.505 5.588 0.444 459 HA LEU 505 HA LEU 505 -6.286 3.234 1.601 460 HB2 LEU 505 2HB LEU 505 -4.922 5.192 1.011 461 HB3 LEU 505 1HB LEU 505 -5.849 6.174 2.123 462 HG LEU 505 HG LEU 505 -4.968 4.856 4.005 463 HD11 LEU 505 1HD1 LEU 505 -3.368 3.452 1.863 464 HD12 LEU 505 2HD1 LEU 505 -4.529 2.698 2.972 465 HD13 LEU 505 3HD1 LEU 505 -3.027 3.403 3.580 466 HD21 LEU 505 3HD2 LEU 505 -2.857 5.956 2.164 467 HD22 LEU 505 1HD2 LEU 505 -2.689 5.700 3.900 468 HD23 LEU 505 2HD2 LEU 505 -3.835 6.892 3.293 469 H LYS 506 H LYS 506 -6.777 2.426 3.555 470 HA LYS 506 HA LYS 506 -8.576 3.848 5.334 471 HB2 LYS 506 2HB LYS 506 -8.908 0.990 4.427 472 HB3 LYS 506 1HB LYS 506 -9.920 1.812 5.599 473 HG2 LYS 506 2HG LYS 506 -10.798 3.240 3.831 474 HG3 LYS 506 1HG LYS 506 -9.711 2.473 2.665 475 HD2 LYS 506 2HD LYS 506 -10.757 0.289 3.215 476 HD3 LYS 506 1HD LYS 506 -11.910 1.147 4.230 477 HE2 LYS 506 2HE LYS 506 -12.757 2.352 2.314 478 HE3 LYS 506 1HE LYS 506 -11.540 1.602 1.278 479 HZ1 LYS 506 3HZ LYS 506 -13.685 0.465 1.078 480 HZ2 LYS 506 1HZ LYS 506 -13.700 0.157 2.724 481 HZ3 LYS 506 2HZ LYS 506 -12.526 -0.556 1.755 482 H ALA 507 H ALA 507 -8.667 2.452 7.416 483 HA ALA 507 HA ALA 507 -5.981 1.796 8.189 484 HB1 ALA 507 1HB ALA 507 -6.925 1.415 10.414 485 HB2 ALA 507 2HB ALA 507 -8.552 1.534 9.753 486 HB3 ALA 507 3HB ALA 507 -7.489 2.945 9.743 487 H GLY 508 H GLY 508 -5.180 -0.201 8.709 488 HA2 GLY 508 2HA GLY 508 -5.230 -2.518 9.018 489 HA3 GLY 508 1HA GLY 508 -6.865 -2.588 8.414 490 H ASP 509 H ASP 509 -5.514 -0.747 6.161 491 HA ASP 509 HA ASP 509 -4.928 -3.056 4.558 492 HB2 ASP 509 2HB ASP 509 -5.038 -0.128 3.769 493 HB3 ASP 509 1HB ASP 509 -4.612 -1.421 2.650 494 H ARG 510 H ARG 510 -3.075 -3.477 3.511 495 HA ARG 510 HA ARG 510 -0.871 -2.943 5.347 496 HB2 ARG 510 2HB ARG 510 -1.450 -5.231 5.034 497 HB3 ARG 510 1HB ARG 510 -1.289 -5.126 3.300 498 HG2 ARG 510 2HG ARG 510 1.121 -4.757 3.568 499 HG3 ARG 510 1HG ARG 510 0.929 -4.846 5.322 500 HD2 ARG 510 2HD ARG 510 0.083 -7.119 5.126 501 HD3 ARG 510 1HD ARG 510 0.244 -7.041 3.373 502 HE ARG 510 HE ARG 510 2.717 -6.503 4.142 503 HH11 ARG 510 1HH1 ARG 510 0.527 -8.998 5.434 504 HH12 ARG 510 2HH1 ARG 510 1.767 -10.133 5.681 505 HH21 ARG 510 1HH2 ARG 510 4.410 -8.116 4.508 506 HH22 ARG 510 2HH2 ARG 510 3.997 -9.629 5.126 507 H LEU 511 H LEU 511 0.866 -1.844 4.847 508 HA LEU 511 HA LEU 511 0.960 -0.533 2.291 509 HB2 LEU 511 2HB LEU 511 1.544 0.586 4.614 510 HB3 LEU 511 1HB LEU 511 2.966 -0.394 4.534 511 HG LEU 511 HG LEU 511 3.802 0.766 2.541 512 HD11 LEU 511 1HD1 LEU 511 2.660 2.580 1.562 513 HD12 LEU 511 2HD1 LEU 511 1.305 2.404 2.673 514 HD13 LEU 511 3HD1 LEU 511 1.647 1.147 1.480 515 HD21 LEU 511 3HD2 LEU 511 4.283 1.710 4.767 516 HD22 LEU 511 1HD2 LEU 511 2.825 2.698 4.641 517 HD23 LEU 511 2HD2 LEU 511 4.159 2.946 3.517 518 H ILE 512 H ILE 512 2.096 -1.300 0.581 519 HA ILE 512 HA ILE 512 3.804 -3.647 1.023 520 HB ILE 512 HB ILE 512 2.401 -2.704 -1.495 521 HG12 ILE 512 2HG1 ILE 512 0.820 -3.563 0.142 522 HG13 ILE 512 1HG1 ILE 512 0.998 -4.680 -1.186 523 HG21 ILE 512 1HG2 ILE 512 4.015 -5.200 -1.046 524 HG22 ILE 512 2HG2 ILE 512 4.463 -3.824 -2.058 525 HG23 ILE 512 3HG2 ILE 512 3.068 -4.817 -2.486 526 HD11 ILE 512 3HD1 ILE 512 2.471 -6.103 0.150 527 HD12 ILE 512 1HD1 ILE 512 0.920 -5.877 0.952 528 HD13 ILE 512 2HD1 ILE 512 2.328 -4.990 1.510 529 H GLU 513 H GLU 513 3.698 -0.658 -0.902 530 HA GLU 513 HA GLU 513 6.548 -0.356 -0.686 531 HB2 GLU 513 2HB GLU 513 7.002 -0.394 -3.076 532 HB3 GLU 513 1HB GLU 513 6.398 -1.954 -2.552 533 HG2 GLU 513 2HG GLU 513 4.247 -1.461 -3.405 534 HG3 GLU 513 1HG GLU 513 4.781 0.179 -3.804 535 H VAL 514 H VAL 514 7.275 1.542 -1.572 536 HA VAL 514 HA VAL 514 5.230 3.529 -2.152 537 HB VAL 514 HB VAL 514 5.678 3.880 0.270 538 HG11 VAL 514 1HG1 VAL 514 7.914 4.713 0.971 539 HG12 VAL 514 2HG1 VAL 514 8.513 4.294 -0.633 540 HG13 VAL 514 3HG1 VAL 514 7.933 3.024 0.447 541 HG21 VAL 514 3HG2 VAL 514 6.272 6.284 0.178 542 HG22 VAL 514 1HG2 VAL 514 5.144 5.840 -1.106 543 HG23 VAL 514 2HG2 VAL 514 6.830 6.078 -1.486 544 H ASN 515 H ASN 515 5.852 4.887 -3.716 545 HA ASN 515 HA ASN 515 7.126 6.242 -5.066 546 HB2 ASN 515 2HB ASN 515 8.182 6.652 -2.700 547 HB3 ASN 515 1HB ASN 515 9.508 5.685 -3.321 548 HD21 ASN 515 1HD2 ASN 515 7.510 8.010 -5.091 549 HD22 ASN 515 2HD2 ASN 515 8.812 9.093 -5.344 550 H GLY 516 H GLY 516 7.412 3.063 -4.957 551 HA2 GLY 516 2HA GLY 516 8.116 1.800 -6.858 552 HA3 GLY 516 1HA GLY 516 9.432 2.949 -7.084 553 H VAL 517 H VAL 517 9.181 2.380 -3.806 554 HA VAL 517 HA VAL 517 11.400 0.479 -3.955 555 HB VAL 517 HB VAL 517 10.595 2.319 -1.690 556 HG11 VAL 517 1HG1 VAL 517 13.063 0.621 -2.053 557 HG12 VAL 517 2HG1 VAL 517 11.759 0.329 -0.902 558 HG13 VAL 517 3HG1 VAL 517 12.784 1.754 -0.730 559 HG21 VAL 517 3HG2 VAL 517 11.388 3.609 -3.582 560 HG22 VAL 517 1HG2 VAL 517 12.822 2.589 -3.696 561 HG23 VAL 517 2HG2 VAL 517 12.586 3.622 -2.286 562 H ASP 518 H ASP 518 10.932 -1.497 -3.468 563 HA ASP 518 HA ASP 518 8.514 -2.295 -2.179 564 HB2 ASP 518 2HB ASP 518 10.981 -3.856 -2.954 565 HB3 ASP 518 1HB ASP 518 9.551 -4.578 -2.234 566 H LEU 519 H LEU 519 8.160 -2.661 -0.135 567 HA LEU 519 HA LEU 519 10.450 -2.620 1.663 568 HB2 LEU 519 2HB LEU 519 9.134 -1.075 3.118 569 HB3 LEU 519 1HB LEU 519 9.767 -0.397 1.631 570 HG LEU 519 HG LEU 519 7.424 -1.036 0.739 571 HD11 LEU 519 1HD1 LEU 519 6.737 -0.684 3.621 572 HD12 LEU 519 2HD1 LEU 519 6.471 -2.105 2.583 573 HD13 LEU 519 3HD1 LEU 519 5.639 -0.576 2.241 574 HD21 LEU 519 3HD2 LEU 519 7.944 1.430 2.354 575 HD22 LEU 519 1HD2 LEU 519 6.618 1.206 1.197 576 HD23 LEU 519 2HD2 LEU 519 8.282 1.117 0.640 577 H ALA 520 H ALA 520 8.448 -4.637 0.672 578 HA ALA 520 HA ALA 520 6.975 -5.408 3.000 579 HB1 ALA 520 1HB ALA 520 6.182 -5.980 0.742 580 HB2 ALA 520 2HB ALA 520 6.417 -7.422 1.728 581 HB3 ALA 520 3HB ALA 520 7.606 -6.991 0.503 582 H GLY 521 H GLY 521 10.159 -5.824 1.877 583 HA2 GLY 521 2HA GLY 521 10.652 -7.958 3.845 584 HA3 GLY 521 1HA GLY 521 11.733 -7.529 2.524 585 H LYS 522 H LYS 522 10.565 -4.748 3.793 586 HA LYS 522 HA LYS 522 13.096 -4.183 5.061 587 HB2 LYS 522 2HB LYS 522 10.738 -2.447 4.390 588 HB3 LYS 522 1HB LYS 522 12.096 -1.867 5.335 589 HG2 LYS 522 2HG LYS 522 12.269 -2.951 2.535 590 HG3 LYS 522 1HG LYS 522 12.250 -1.235 2.969 591 HD2 LYS 522 2HD LYS 522 14.278 -1.635 4.338 592 HD3 LYS 522 1HD LYS 522 14.321 -3.287 3.741 593 HE2 LYS 522 2HE LYS 522 14.503 -2.427 1.435 594 HE3 LYS 522 1HE LYS 522 14.511 -0.784 2.070 595 HZ1 LYS 522 3HZ LYS 522 16.738 -1.544 1.619 596 HZ2 LYS 522 1HZ LYS 522 16.535 -2.871 2.649 597 HZ3 LYS 522 2HZ LYS 522 16.547 -1.320 3.277 598 H SER 523 H SER 523 13.265 -3.132 7.098 599 HA SER 523 HA SER 523 11.641 -4.452 9.033 600 HB2 SER 523 2HB SER 523 14.069 -4.264 9.391 601 HB3 SER 523 1HB SER 523 13.959 -2.509 9.330 602 HG SER 523 HG SER 523 12.742 -4.202 11.263 603 H GLN 524 H GLN 524 10.644 -3.114 10.818 604 HA GLN 524 HA GLN 524 8.880 -1.225 9.757 605 HB2 GLN 524 2HB GLN 524 8.165 -0.696 12.002 606 HB3 GLN 524 1HB GLN 524 8.366 -2.430 11.833 607 HG2 GLN 524 2HG GLN 524 10.371 -2.409 13.099 608 HG3 GLN 524 1HG GLN 524 10.459 -0.648 13.043 609 HE21 GLN 524 1HE2 GLN 524 8.881 -3.371 14.444 610 HE22 GLN 524 2HE2 GLN 524 8.116 -2.493 15.724 611 H GLU 525 H GLU 525 12.009 -0.834 11.169 612 HA GLU 525 HA GLU 525 11.790 1.929 11.749 613 HB2 GLU 525 2HB GLU 525 13.571 0.591 12.743 614 HB3 GLU 525 1HB GLU 525 14.242 0.264 11.155 615 HG2 GLU 525 2HG GLU 525 14.748 2.640 10.880 616 HG3 GLU 525 1HG GLU 525 14.089 2.962 12.481 617 H GLU 526 H GLU 526 12.821 0.192 8.890 618 HA GLU 526 HA GLU 526 13.751 2.409 7.466 619 HB2 GLU 526 2HB GLU 526 12.572 -0.174 6.494 620 HB3 GLU 526 1HB GLU 526 13.412 0.985 5.472 621 HG2 GLU 526 2HG GLU 526 14.574 -0.505 7.800 622 HG3 GLU 526 1HG GLU 526 14.853 -0.864 6.098 623 H VAL 527 H VAL 527 10.655 0.767 7.568 624 HA VAL 527 HA VAL 527 9.505 2.526 5.653 625 HB VAL 527 HB VAL 527 7.357 1.258 6.115 626 HG11 VAL 527 1HG1 VAL 527 8.199 -0.807 5.140 627 HG12 VAL 527 2HG1 VAL 527 9.844 -0.342 5.582 628 HG13 VAL 527 3HG1 VAL 527 8.959 0.594 4.363 629 HG21 VAL 527 3HG2 VAL 527 9.191 -0.416 7.776 630 HG22 VAL 527 1HG2 VAL 527 7.492 -0.726 7.429 631 HG23 VAL 527 2HG2 VAL 527 7.959 0.659 8.439 632 H VAL 528 H VAL 528 9.308 2.299 9.181 633 HA VAL 528 HA VAL 528 7.292 4.240 9.358 634 HB VAL 528 HB VAL 528 9.305 3.394 11.489 635 HG11 VAL 528 1HG1 VAL 528 8.481 5.673 11.948 636 HG12 VAL 528 2HG1 VAL 528 7.847 4.512 13.114 637 HG13 VAL 528 3HG1 VAL 528 6.821 5.094 11.805 638 HG21 VAL 528 3HG2 VAL 528 6.375 2.732 11.130 639 HG22 VAL 528 1HG2 VAL 528 7.394 2.153 12.450 640 HG23 VAL 528 2HG2 VAL 528 7.711 1.636 10.806 641 H SER 529 H SER 529 10.771 4.454 9.184 642 HA SER 529 HA SER 529 10.882 7.213 9.707 643 HB2 SER 529 2HB SER 529 12.823 5.496 8.146 644 HB3 SER 529 1HB SER 529 13.155 7.117 8.757 645 HG SER 529 HG SER 529 12.840 4.700 10.105 646 H LEU 530 H LEU 530 10.095 5.398 6.859 647 HA LEU 530 HA LEU 530 10.457 7.436 4.939 648 HB2 LEU 530 2HB LEU 530 8.667 5.081 5.101 649 HB3 LEU 530 1HB LEU 530 8.712 6.038 3.643 650 HG LEU 530 HG LEU 530 10.941 4.383 4.860 651 HD11 LEU 530 1HD1 LEU 530 9.471 4.098 2.248 652 HD12 LEU 530 2HD1 LEU 530 9.241 3.091 3.677 653 HD13 LEU 530 3HD1 LEU 530 10.781 3.069 2.826 654 HD21 LEU 530 3HD2 LEU 530 12.280 4.994 2.900 655 HD22 LEU 530 1HD2 LEU 530 11.908 6.401 3.895 656 HD23 LEU 530 2HD2 LEU 530 11.022 6.126 2.398 657 H LEU 531 H LEU 531 7.489 6.388 6.686 658 HA LEU 531 HA LEU 531 5.934 8.494 5.679 659 HB2 LEU 531 2HB LEU 531 5.614 6.541 7.918 660 HB3 LEU 531 1HB LEU 531 4.412 7.772 7.637 661 HG LEU 531 HG LEU 531 3.738 5.670 6.744 662 HD11 LEU 531 1HD1 LEU 531 2.971 7.631 5.551 663 HD12 LEU 531 2HD1 LEU 531 3.222 6.309 4.414 664 HD13 LEU 531 3HD1 LEU 531 4.407 7.610 4.528 665 HD21 LEU 531 3HD2 LEU 531 6.170 5.749 4.966 666 HD22 LEU 531 1HD2 LEU 531 4.860 4.581 4.832 667 HD23 LEU 531 2HD2 LEU 531 5.875 4.609 6.275 668 H ARG 532 H ARG 532 7.950 8.130 8.474 669 HA ARG 532 HA ARG 532 7.079 10.461 9.826 670 HB2 ARG 532 2HB ARG 532 8.295 8.710 10.980 671 HB3 ARG 532 1HB ARG 532 9.687 8.959 9.939 672 HG2 ARG 532 2HG ARG 532 9.977 11.194 10.871 673 HG3 ARG 532 1HG ARG 532 8.602 10.917 11.944 674 HD2 ARG 532 2HD ARG 532 9.764 9.061 12.989 675 HD3 ARG 532 1HD ARG 532 11.111 9.262 11.864 676 HE ARG 532 HE ARG 532 10.622 11.663 13.222 677 HH11 ARG 532 1HH1 ARG 532 12.019 8.461 13.773 678 HH12 ARG 532 2HH1 ARG 532 13.096 9.000 14.981 679 HH21 ARG 532 1HH2 ARG 532 12.074 12.382 14.823 680 HH22 ARG 532 2HH2 ARG 532 13.120 11.277 15.620 681 H SER 533 H SER 533 9.651 9.870 7.446 682 HA SER 533 HA SER 533 10.802 12.454 7.663 683 HB2 SER 533 2HB SER 533 12.139 10.531 6.947 684 HB3 SER 533 1HB SER 533 11.092 10.298 5.553 685 HG SER 533 HG SER 533 13.018 12.258 6.059 686 H THR 534 H THR 534 8.797 10.789 5.279 687 HA THR 534 HA THR 534 7.339 11.444 3.743 688 HB THR 534 HB THR 534 7.308 14.164 5.096 689 HG1 THR 534 1HG THR 534 6.721 11.927 6.245 690 HG21 THR 534 3HG2 THR 534 5.366 12.624 3.469 691 HG22 THR 534 1HG2 THR 534 6.316 14.002 2.895 692 HG23 THR 534 2HG2 THR 534 5.072 14.242 4.145 693 H LYS 535 H LYS 535 7.899 11.763 1.624 694 HA LYS 535 HA LYS 535 10.067 13.554 1.091 695 HB2 LYS 535 2HB LYS 535 8.587 11.729 -0.802 696 HB3 LYS 535 1HB LYS 535 9.844 12.842 -1.316 697 HG2 LYS 535 2HG LYS 535 11.414 11.692 0.238 698 HG3 LYS 535 1HG LYS 535 10.149 10.499 0.551 699 HD2 LYS 535 2HD LYS 535 10.089 9.900 -1.804 700 HD3 LYS 535 1HD LYS 535 11.270 11.152 -2.178 701 HE2 LYS 535 2HE LYS 535 12.901 9.975 -0.719 702 HE3 LYS 535 1HE LYS 535 11.717 8.691 -0.486 703 HZ1 LYS 535 3HZ LYS 535 12.899 9.517 -3.075 704 HZ2 LYS 535 1HZ LYS 535 11.765 8.307 -2.915 705 HZ3 LYS 535 2HZ LYS 535 13.300 8.124 -2.238 706 H MET 536 H MET 536 10.095 15.240 -0.406 707 HA MET 536 HA MET 536 7.777 16.999 -0.242 708 HB2 MET 536 2HB MET 536 9.214 18.628 -1.273 709 HB3 MET 536 1HB MET 536 10.017 17.918 0.142 710 HG2 MET 536 2HG MET 536 11.312 16.504 -1.431 711 HG3 MET 536 1HG MET 536 10.520 17.320 -2.773 712 HE1 MET 536 3HE MET 536 12.820 17.969 -3.858 713 HE2 MET 536 1HE MET 536 13.663 17.107 -2.573 714 HE3 MET 536 2HE MET 536 14.133 18.759 -2.987 715 H GLU 537 H GLU 537 7.812 14.629 -2.023 716 HA GLU 537 HA GLU 537 8.021 15.487 -4.633 717 HB2 GLU 537 2HB GLU 537 6.464 13.130 -3.579 718 HB3 GLU 537 1HB GLU 537 6.853 13.396 -5.272 719 HG2 GLU 537 2HG GLU 537 8.813 12.950 -3.040 720 HG3 GLU 537 1HG GLU 537 8.349 11.781 -4.277 721 H GLY 538 H GLY 538 5.557 15.960 -2.386 722 HA2 GLY 538 2HA GLY 538 3.624 17.312 -2.754 723 HA3 GLY 538 1HA GLY 538 3.621 16.796 -4.442 724 H THR 539 H THR 539 3.485 14.441 -4.762 725 HA THR 539 HA THR 539 1.543 13.367 -2.906 726 HB THR 539 HB THR 539 1.133 11.730 -4.758 727 HG1 THR 539 1HG THR 539 1.837 13.518 -6.704 728 HG21 THR 539 3HG2 THR 539 -0.411 13.227 -5.961 729 HG22 THR 539 1HG2 THR 539 0.376 14.627 -5.219 730 HG23 THR 539 2HG2 THR 539 -0.484 13.448 -4.215 731 H VAL 540 H VAL 540 1.953 11.617 -1.865 732 HA VAL 540 HA VAL 540 4.433 10.162 -2.408 733 HB VAL 540 HB VAL 540 2.633 10.110 0.048 734 HG11 VAL 540 1HG1 VAL 540 3.749 8.005 -0.392 735 HG12 VAL 540 2HG1 VAL 540 4.388 8.768 1.074 736 HG13 VAL 540 3HG1 VAL 540 5.313 8.818 -0.437 737 HG21 VAL 540 3HG2 VAL 540 4.460 11.293 1.172 738 HG22 VAL 540 1HG2 VAL 540 3.837 12.210 -0.208 739 HG23 VAL 540 2HG2 VAL 540 5.361 11.337 -0.348 740 H SER 541 H SER 541 4.160 8.365 -3.558 741 HA SER 541 HA SER 541 1.483 7.296 -3.738 742 HB2 SER 541 2HB SER 541 3.960 6.593 -5.324 743 HB3 SER 541 1HB SER 541 2.327 6.013 -5.657 744 HG SER 541 HG SER 541 3.286 8.689 -5.814 745 H LEU 542 H LEU 542 0.880 5.865 -2.444 746 HA LEU 542 HA LEU 542 2.803 3.952 -1.335 747 HB2 LEU 542 2HB LEU 542 0.204 5.010 -0.273 748 HB3 LEU 542 1HB LEU 542 1.174 3.771 0.498 749 HG LEU 542 HG LEU 542 2.186 6.564 -0.022 750 HD11 LEU 542 1HD1 LEU 542 1.087 5.346 2.477 751 HD12 LEU 542 2HD1 LEU 542 0.273 6.557 1.469 752 HD13 LEU 542 3HD1 LEU 542 1.800 6.959 2.263 753 HD21 LEU 542 3HD2 LEU 542 3.161 4.382 1.801 754 HD22 LEU 542 1HD2 LEU 542 3.871 5.975 1.566 755 HD23 LEU 542 2HD2 LEU 542 3.867 4.804 0.238 756 H LEU 543 H LEU 543 2.539 1.974 -1.954 757 HA LEU 543 HA LEU 543 0.032 1.244 -3.256 758 HB2 LEU 543 2HB LEU 543 2.427 0.958 -4.360 759 HB3 LEU 543 1HB LEU 543 2.602 -0.250 -3.173 760 HG LEU 543 HG LEU 543 0.262 -0.570 -5.019 761 HD11 LEU 543 1HD1 LEU 543 3.099 -1.429 -5.569 762 HD12 LEU 543 2HD1 LEU 543 2.209 -0.188 -6.452 763 HD13 LEU 543 3HD1 LEU 543 1.671 -1.866 -6.509 764 HD21 LEU 543 3HD2 LEU 543 0.785 -2.943 -4.608 765 HD22 LEU 543 1HD2 LEU 543 0.430 -2.069 -3.101 766 HD23 LEU 543 2HD2 LEU 543 2.092 -2.464 -3.557 767 H VAL 544 H VAL 544 -1.326 0.119 -2.105 768 HA VAL 544 HA VAL 544 -0.300 -1.323 0.240 769 HB VAL 544 HB VAL 544 -2.346 -0.921 1.418 770 HG11 VAL 544 1HG1 VAL 544 -1.275 1.652 0.298 771 HG12 VAL 544 2HG1 VAL 544 -0.670 0.768 1.702 772 HG13 VAL 544 3HG1 VAL 544 -2.271 1.498 1.745 773 HG21 VAL 544 3HG2 VAL 544 -3.850 -0.994 -0.408 774 HG22 VAL 544 1HG2 VAL 544 -3.265 0.545 -1.036 775 HG23 VAL 544 2HG2 VAL 544 -4.143 0.499 0.511 776 H PHE 545 H PHE 545 -1.630 -3.052 0.937 777 HA PHE 545 HA PHE 545 -2.773 -4.606 -1.297 778 HB2 PHE 545 2HB PHE 545 -0.687 -5.474 -0.307 779 HB3 PHE 545 1HB PHE 545 -1.447 -5.490 1.272 780 HD1 PHE 545 1HD PHE 545 -1.314 -7.037 -2.023 781 HD2 PHE 545 2HD PHE 545 -2.907 -7.309 1.901 782 HE1 PHE 545 1HE PHE 545 -1.974 -9.317 -2.480 783 HE2 PHE 545 2HE PHE 545 -3.579 -9.635 1.470 784 HZ PHE 545 HZ PHE 545 -3.120 -10.655 -0.726 785 H ARG 546 H ARG 546 -4.912 -4.793 -1.115 786 HA ARG 546 HA ARG 546 -6.223 -4.390 1.448 787 HB2 ARG 546 2HB ARG 546 -7.093 -3.543 -0.846 788 HB3 ARG 546 1HB ARG 546 -7.421 -5.215 -1.228 789 HG2 ARG 546 2HG ARG 546 -8.707 -3.658 1.030 790 HG3 ARG 546 1HG ARG 546 -9.427 -3.918 -0.547 791 HD2 ARG 546 2HD ARG 546 -9.385 -6.386 -0.058 792 HD3 ARG 546 1HD ARG 546 -8.814 -6.001 1.566 793 HE ARG 546 HE ARG 546 -11.226 -4.632 0.801 794 HH11 ARG 546 1HH1 ARG 546 -9.991 -7.565 2.396 795 HH12 ARG 546 2HH1 ARG 546 -11.491 -7.902 3.154 796 HH21 ARG 546 1HH2 ARG 546 -13.265 -5.185 1.900 797 HH22 ARG 546 2HH2 ARG 546 -13.314 -6.586 2.881 798 H GLN 547 H GLN 547 -6.393 -6.073 2.715 799 HA GLN 547 HA GLN 547 -5.445 -8.607 1.762 800 HB2 GLN 547 2HB GLN 547 -4.602 -7.705 3.853 801 HB3 GLN 547 1HB GLN 547 -6.228 -7.594 4.492 802 HG2 GLN 547 2HG GLN 547 -6.386 -10.055 4.409 803 HG3 GLN 547 1HG GLN 547 -4.708 -10.113 3.869 804 HE21 GLN 547 1HE2 GLN 547 -3.087 -9.603 5.318 805 HE22 GLN 547 2HE2 GLN 547 -3.340 -9.511 7.014 806 H GLU 548 H GLU 548 -6.651 -10.395 1.491 807 HA GLU 548 HA GLU 548 -9.445 -10.203 1.386 808 HB2 GLU 548 2HB GLU 548 -8.233 -11.822 0.017 809 HB3 GLU 548 1HB GLU 548 -7.659 -12.639 1.464 810 HG2 GLU 548 2HG GLU 548 -9.898 -13.336 2.015 811 HG3 GLU 548 1HG GLU 548 -10.555 -12.410 0.667 812 H GLU 549 H GLU 549 -10.854 -10.389 2.876 813 HA GLU 549 HA GLU 549 -10.013 -10.561 5.547 814 HB2 GLU 549 2HB GLU 549 -12.524 -10.294 6.007 815 HB3 GLU 549 1HB GLU 549 -11.689 -8.997 5.170 816 HG2 GLU 549 2HG GLU 549 -12.562 -9.927 3.022 817 HG3 GLU 549 1HG GLU 549 -13.517 -11.059 3.976 818 H ALA 550 H ALA 550 -9.904 -12.117 6.847 819 HA ALA 550 HA ALA 550 -9.881 -14.751 5.966 820 HB1 ALA 550 1HB ALA 550 -9.896 -13.746 8.800 821 HB2 ALA 550 2HB ALA 550 -8.478 -13.894 7.765 822 HB3 ALA 550 3HB ALA 550 -9.368 -15.336 8.254 823 H PHE 551 H PHE 551 -11.224 -16.370 6.067 824 HA PHE 551 HA PHE 551 -13.888 -15.908 7.120 825 HB2 PHE 551 2HB PHE 551 -12.867 -18.034 5.220 826 HB3 PHE 551 1HB PHE 551 -14.532 -17.848 5.747 827 HD1 PHE 551 2HD PHE 551 -15.813 -15.835 5.065 828 HD2 PHE 551 1HD PHE 551 -11.979 -16.737 3.455 829 HE1 PHE 551 2HE PHE 551 -16.240 -14.304 3.201 830 HE2 PHE 551 1HE PHE 551 -12.395 -15.206 1.585 831 HZ PHE 551 HZ PHE 551 -14.536 -13.981 1.451 832 H HIS 552 H HIS 552 -13.998 -16.594 9.128 833 HA HIS 552 HA HIS 552 -12.335 -18.807 10.035 834 HB2 HIS 552 2HB HIS 552 -13.109 -18.230 12.337 835 HB3 HIS 552 1HB HIS 552 -12.348 -16.883 11.505 836 HD1 HIS 552 1HD HIS 552 -15.797 -18.104 12.597 837 HD2 HIS 552 2HD HIS 552 -13.924 -14.616 11.304 838 HE1 HIS 552 1HE HIS 552 -17.450 -16.255 12.954 839 HE2 HIS 552 2HE HIS 552 -16.163 -14.178 12.492 840 HA PRO 553 HA PRO 553 -15.512 -21.895 9.944 841 HB2 PRO 553 2HB PRO 553 -14.993 -23.121 12.392 842 HB3 PRO 553 1HB PRO 553 -14.166 -23.502 10.881 843 HG2 PRO 553 2HG PRO 553 -13.288 -21.752 13.135 844 HG3 PRO 553 1HG PRO 553 -12.333 -22.849 12.126 845 HD2 PRO 553 2HD PRO 553 -12.281 -20.202 11.755 846 HD3 PRO 553 1HD PRO 553 -12.187 -21.330 10.387 847 H ARG 554 H ARG 554 -17.458 -22.498 11.060 848 HA ARG 554 HA ARG 554 -18.547 -20.232 12.469 849 HB2 ARG 554 2HB ARG 554 -19.904 -22.739 11.436 850 HB3 ARG 554 1HB ARG 554 -20.737 -21.437 12.258 851 HG2 ARG 554 2HG ARG 554 -21.133 -21.188 9.922 852 HG3 ARG 554 1HG ARG 554 -20.029 -19.908 10.402 853 HD2 ARG 554 2HD ARG 554 -19.340 -20.860 8.274 854 HD3 ARG 554 1HD ARG 554 -18.146 -21.233 9.515 855 HE ARG 554 HE ARG 554 -20.122 -23.279 9.191 856 HH11 ARG 554 1HH1 ARG 554 -17.018 -22.092 7.897 857 HH12 ARG 554 2HH1 ARG 554 -16.561 -23.593 7.282 858 HH21 ARG 554 1HH2 ARG 554 -19.456 -25.336 8.293 859 HH22 ARG 554 2HH2 ARG 554 -17.951 -25.452 7.478 860 H GLU 555 H GLU 555 -18.410 -20.126 14.536 861 HA GLU 555 HA GLU 555 -17.872 -22.429 16.145 862 HB2 GLU 555 2HB GLU 555 -16.853 -20.227 16.607 863 HB3 GLU 555 1HB GLU 555 -18.451 -19.562 16.913 864 HG2 GLU 555 2HG GLU 555 -18.701 -21.066 18.824 865 HG3 GLU 555 1HG GLU 555 -17.096 -21.721 18.502 866 H MET 556 H MET 556 -19.478 -23.769 16.525 867 HA MET 556 HA MET 556 -22.231 -22.902 16.532 868 HB2 MET 556 2HB MET 556 -21.657 -25.040 15.503 869 HB3 MET 556 1HB MET 556 -21.008 -25.623 17.028 870 HG2 MET 556 2HG MET 556 -23.251 -25.458 18.028 871 HG3 MET 556 1HG MET 556 -23.888 -24.931 16.477 872 HE1 MET 556 3HE MET 556 -25.357 -28.531 16.833 873 HE2 MET 556 1HE MET 556 -25.714 -26.825 16.584 874 HE3 MET 556 2HE MET 556 -25.082 -27.375 18.137 875 H ASN 557 H ASN 557 -19.929 -24.263 18.841 876 HA ASN 557 HA ASN 557 -19.864 -24.437 21.069 877 HB2 ASN 557 2HB ASN 557 -20.076 -22.019 21.220 878 HB3 ASN 557 1HB ASN 557 -21.817 -22.107 20.980 879 HD21 ASN 557 1HD2 ASN 557 -22.203 -20.972 22.879 880 HD22 ASN 557 2HD2 ASN 557 -21.990 -21.671 24.440 881 H ALA 558 H ALA 558 -23.300 -23.598 20.870 882 HA ALA 558 HA ALA 558 -24.238 -26.236 21.037 883 HB1 ALA 558 1HB ALA 558 -24.339 -24.623 23.595 884 HB2 ALA 558 2HB ALA 558 -23.382 -26.078 23.345 885 HB3 ALA 558 3HB ALA 558 -25.145 -26.166 23.322 Start of MODEL 5 1 H1 GLY 448 1HT GLY 448 -15.480 9.111 -14.532 2 H2 GLY 448 2HT GLY 448 -14.947 7.635 -13.919 3 H3 GLY 448 3HT GLY 448 -15.781 8.666 -12.931 4 HA2 GLY 448 1HA GLY 448 -17.802 8.344 -14.185 5 HA3 GLY 448 2HA GLY 448 -16.917 7.262 -15.262 6 H SER 449 H SER 449 -18.300 5.504 -14.668 7 HA SER 449 HA SER 449 -18.491 4.685 -11.985 8 HB2 SER 449 2HB SER 449 -18.884 3.093 -14.526 9 HB3 SER 449 1HB SER 449 -19.431 2.620 -12.914 10 HG SER 449 HG SER 449 -20.538 4.797 -12.998 11 H VAL 450 H VAL 450 -16.718 4.164 -10.889 12 HA VAL 450 HA VAL 450 -14.436 2.983 -12.195 13 HB VAL 450 HB VAL 450 -14.040 4.745 -10.526 14 HG11 VAL 450 1HG1 VAL 450 -15.900 4.409 -9.044 15 HG12 VAL 450 2HG1 VAL 450 -14.389 4.362 -8.131 16 HG13 VAL 450 3HG1 VAL 450 -15.233 2.864 -8.515 17 HG21 VAL 450 3HG2 VAL 450 -12.263 3.101 -10.831 18 HG22 VAL 450 1HG2 VAL 450 -12.987 2.068 -9.599 19 HG23 VAL 450 2HG2 VAL 450 -12.318 3.637 -9.151 20 H TYR 451 H TYR 451 -13.736 0.932 -12.019 21 HA TYR 451 HA TYR 451 -15.381 -0.889 -10.421 22 HB2 TYR 451 2HB TYR 451 -14.073 -1.420 -13.097 23 HB3 TYR 451 1HB TYR 451 -14.844 -2.652 -12.103 24 HD1 TYR 451 1HD TYR 451 -17.271 -2.711 -11.860 25 HD2 TYR 451 2HD TYR 451 -15.383 0.196 -14.323 26 HE1 TYR 451 1HE TYR 451 -19.436 -2.192 -12.899 27 HE2 TYR 451 2HE TYR 451 -17.545 0.723 -15.366 28 HH TYR 451 HH TYR 451 -19.667 -0.312 -15.719 29 H ASN 452 H ASN 452 -14.143 -1.032 -8.655 30 HA ASN 452 HA ASN 452 -11.396 -1.904 -9.083 31 HB2 ASN 452 2HB ASN 452 -10.926 -1.224 -6.740 32 HB3 ASN 452 1HB ASN 452 -11.509 0.125 -7.693 33 HD21 ASN 452 1HD2 ASN 452 -11.455 -0.205 -4.832 34 HD22 ASN 452 2HD2 ASN 452 -13.087 -0.058 -4.283 35 H THR 453 H THR 453 -10.890 -3.925 -8.659 36 HA THR 453 HA THR 453 -13.037 -5.617 -7.792 37 HB THR 453 HB THR 453 -11.497 -7.481 -8.411 38 HG1 THR 453 1HG THR 453 -9.671 -6.350 -9.825 39 HG21 THR 453 3HG2 THR 453 -13.058 -6.547 -10.051 40 HG22 THR 453 1HG2 THR 453 -11.552 -7.052 -10.823 41 HG23 THR 453 2HG2 THR 453 -11.856 -5.339 -10.508 42 H LYS 454 H LYS 454 -13.048 -6.890 -6.036 43 HA LYS 454 HA LYS 454 -10.872 -6.532 -4.119 44 HB2 LYS 454 2HB LYS 454 -13.835 -7.007 -3.619 45 HB3 LYS 454 1HB LYS 454 -12.619 -7.267 -2.390 46 HG2 LYS 454 2HG LYS 454 -13.649 -5.139 -2.002 47 HG3 LYS 454 1HG LYS 454 -12.000 -4.873 -2.539 48 HD2 LYS 454 2HD LYS 454 -13.459 -3.245 -3.576 49 HD3 LYS 454 1HD LYS 454 -12.879 -4.360 -4.805 50 HE2 LYS 454 2HE LYS 454 -14.989 -5.551 -4.782 51 HE3 LYS 454 1HE LYS 454 -15.565 -4.568 -3.438 52 HZ1 LYS 454 3HZ LYS 454 -14.888 -3.534 -6.141 53 HZ2 LYS 454 1HZ LYS 454 -15.514 -2.627 -4.865 54 HZ3 LYS 454 2HZ LYS 454 -16.445 -3.827 -5.578 55 H LYS 455 H LYS 455 -9.617 -8.268 -4.129 56 HA LYS 455 HA LYS 455 -10.843 -10.853 -4.110 57 HB2 LYS 455 2HB LYS 455 -9.510 -11.722 -6.012 58 HB3 LYS 455 1HB LYS 455 -10.684 -10.508 -6.487 59 HG2 LYS 455 2HG LYS 455 -8.931 -8.847 -6.677 60 HG3 LYS 455 1HG LYS 455 -7.746 -10.011 -6.081 61 HD2 LYS 455 2HD LYS 455 -7.643 -9.793 -8.526 62 HD3 LYS 455 1HD LYS 455 -8.122 -11.419 -8.045 63 HE2 LYS 455 2HE LYS 455 -10.468 -10.856 -8.507 64 HE3 LYS 455 1HE LYS 455 -9.989 -9.223 -8.961 65 HZ1 LYS 455 3HZ LYS 455 -9.166 -11.721 -10.358 66 HZ2 LYS 455 1HZ LYS 455 -8.696 -10.160 -10.769 67 HZ3 LYS 455 2HZ LYS 455 -10.305 -10.622 -10.908 68 H VAL 456 H VAL 456 -8.959 -12.517 -4.249 69 HA VAL 456 HA VAL 456 -7.390 -12.114 -1.924 70 HB VAL 456 HB VAL 456 -7.369 -14.355 -3.962 71 HG11 VAL 456 1HG1 VAL 456 -5.273 -14.296 -2.732 72 HG12 VAL 456 2HG1 VAL 456 -6.253 -15.679 -2.236 73 HG13 VAL 456 3HG1 VAL 456 -6.163 -14.244 -1.210 74 HG21 VAL 456 3HG2 VAL 456 -9.518 -14.096 -2.793 75 HG22 VAL 456 1HG2 VAL 456 -8.672 -14.189 -1.249 76 HG23 VAL 456 2HG2 VAL 456 -8.685 -15.581 -2.322 77 H GLY 457 H GLY 457 -5.543 -10.996 -1.862 78 HA2 GLY 457 2HA GLY 457 -3.358 -10.510 -2.215 79 HA3 GLY 457 1HA GLY 457 -3.309 -11.838 -3.355 80 H LYS 458 H LYS 458 -5.028 -8.679 -3.365 81 HA LYS 458 HA LYS 458 -3.632 -8.201 -5.853 82 HB2 LYS 458 2HB LYS 458 -6.075 -8.744 -6.140 83 HB3 LYS 458 1HB LYS 458 -6.484 -7.372 -5.130 84 HG2 LYS 458 2HG LYS 458 -4.963 -7.098 -7.724 85 HG3 LYS 458 1HG LYS 458 -6.722 -7.086 -7.646 86 HD2 LYS 458 2HD LYS 458 -5.085 -5.325 -5.943 87 HD3 LYS 458 1HD LYS 458 -5.430 -4.838 -7.621 88 HE2 LYS 458 2HE LYS 458 -7.489 -5.545 -5.517 89 HE3 LYS 458 1HE LYS 458 -6.989 -3.900 -5.888 90 HZ1 LYS 458 3HZ LYS 458 -8.207 -5.717 -7.938 91 HZ2 LYS 458 1HZ LYS 458 -7.857 -4.103 -8.078 92 HZ3 LYS 458 2HZ LYS 458 -9.040 -4.575 -7.015 93 H ARG 459 H ARG 459 -2.914 -6.038 -6.154 94 HA ARG 459 HA ARG 459 -2.623 -4.610 -3.603 95 HB2 ARG 459 2HB ARG 459 -0.805 -4.626 -6.012 96 HB3 ARG 459 1HB ARG 459 -0.617 -3.569 -4.629 97 HG2 ARG 459 2HG ARG 459 0.973 -5.369 -4.324 98 HG3 ARG 459 1HG ARG 459 -0.364 -5.645 -3.231 99 HD2 ARG 459 2HD ARG 459 -1.245 -7.346 -4.640 100 HD3 ARG 459 1HD ARG 459 -0.071 -6.969 -5.915 101 HE ARG 459 HE ARG 459 1.127 -7.618 -3.409 102 HH11 ARG 459 1HH1 ARG 459 -0.182 -9.075 -6.368 103 HH12 ARG 459 2HH1 ARG 459 0.754 -10.475 -6.236 104 HH21 ARG 459 1HH2 ARG 459 2.373 -9.541 -3.232 105 HH22 ARG 459 2HH2 ARG 459 2.243 -10.774 -4.395 106 H LEU 460 H LEU 460 -2.863 -2.398 -3.507 107 HA LEU 460 HA LEU 460 -3.980 -1.100 -5.906 108 HB2 LEU 460 2HB LEU 460 -4.910 -0.606 -3.068 109 HB3 LEU 460 1HB LEU 460 -5.504 0.192 -4.490 110 HG LEU 460 HG LEU 460 -6.412 -2.072 -5.231 111 HD11 LEU 460 1HD1 LEU 460 -5.895 -2.781 -2.345 112 HD12 LEU 460 2HD1 LEU 460 -5.134 -3.517 -3.755 113 HD13 LEU 460 3HD1 LEU 460 -6.864 -3.722 -3.479 114 HD21 LEU 460 3HD2 LEU 460 -7.528 -0.814 -2.735 115 HD22 LEU 460 1HD2 LEU 460 -8.415 -1.868 -3.835 116 HD23 LEU 460 2HD2 LEU 460 -7.839 -0.297 -4.393 117 H ASN 461 H ASN 461 -3.143 0.916 -6.268 118 HA ASN 461 HA ASN 461 -1.470 1.967 -4.111 119 HB2 ASN 461 2HB ASN 461 0.040 3.046 -5.710 120 HB3 ASN 461 1HB ASN 461 -0.028 1.321 -6.015 121 HD21 ASN 461 1HD2 ASN 461 -0.755 4.480 -7.208 122 HD22 ASN 461 2HD2 ASN 461 -1.182 3.973 -8.807 123 H ILE 462 H ILE 462 -1.606 3.971 -3.485 124 HA ILE 462 HA ILE 462 -3.817 5.567 -4.612 125 HB ILE 462 HB ILE 462 -3.036 5.229 -1.695 126 HG12 ILE 462 2HG1 ILE 462 -5.526 4.237 -3.084 127 HG13 ILE 462 1HG1 ILE 462 -4.131 3.207 -2.740 128 HG21 ILE 462 1HG2 ILE 462 -3.971 7.441 -2.199 129 HG22 ILE 462 2HG2 ILE 462 -5.091 6.487 -1.222 130 HG23 ILE 462 3HG2 ILE 462 -5.371 6.676 -2.951 131 HD11 ILE 462 3HD1 ILE 462 -5.892 4.620 -0.753 132 HD12 ILE 462 1HD1 ILE 462 -4.487 3.628 -0.355 133 HD13 ILE 462 2HD1 ILE 462 -5.891 2.896 -1.128 134 H GLN 463 H GLN 463 -3.256 7.668 -4.995 135 HA GLN 463 HA GLN 463 -0.597 8.582 -4.185 136 HB2 GLN 463 2HB GLN 463 -2.626 9.740 -6.088 137 HB3 GLN 463 1HB GLN 463 -1.116 10.534 -5.672 138 HG2 GLN 463 2HG GLN 463 0.138 8.762 -6.616 139 HG3 GLN 463 1HG GLN 463 -1.323 7.813 -6.940 140 HE21 GLN 463 1HE2 GLN 463 0.726 8.743 -8.769 141 HE22 GLN 463 2HE2 GLN 463 -0.065 9.744 -9.921 142 H LEU 464 H LEU 464 -0.308 9.931 -2.583 143 HA LEU 464 HA LEU 464 -2.616 11.481 -1.614 144 HB2 LEU 464 2HB LEU 464 -0.343 10.339 0.032 145 HB3 LEU 464 1HB LEU 464 -1.549 11.438 0.647 146 HG LEU 464 HG LEU 464 -2.093 9.299 1.444 147 HD11 LEU 464 1HD1 LEU 464 -4.008 10.547 0.798 148 HD12 LEU 464 2HD1 LEU 464 -4.287 8.828 0.519 149 HD13 LEU 464 3HD1 LEU 464 -3.933 9.893 -0.839 150 HD21 LEU 464 3HD2 LEU 464 -0.771 7.959 -0.115 151 HD22 LEU 464 1HD2 LEU 464 -1.962 8.244 -1.376 152 HD23 LEU 464 2HD2 LEU 464 -2.404 7.307 0.058 153 H LYS 465 H LYS 465 -2.354 13.558 -1.349 154 HA LYS 465 HA LYS 465 0.283 14.850 -1.803 155 HB2 LYS 465 2HB LYS 465 -1.397 15.353 -3.507 156 HB3 LYS 465 1HB LYS 465 -2.554 15.740 -2.241 157 HG2 LYS 465 2HG LYS 465 -1.259 17.691 -1.608 158 HG3 LYS 465 1HG LYS 465 -0.013 17.274 -2.793 159 HD2 LYS 465 2HD LYS 465 -1.516 19.006 -3.671 160 HD3 LYS 465 1HD LYS 465 -1.626 17.515 -4.602 161 HE2 LYS 465 2HE LYS 465 -3.673 16.917 -3.282 162 HE3 LYS 465 1HE LYS 465 -3.575 18.499 -2.509 163 HZ1 LYS 465 3HZ LYS 465 -3.812 19.493 -4.712 164 HZ2 LYS 465 1HZ LYS 465 -5.127 18.511 -4.311 165 HZ3 LYS 465 2HZ LYS 465 -3.954 17.954 -5.391 166 H LYS 466 H LYS 466 1.035 15.869 -0.195 167 HA LYS 466 HA LYS 466 -0.264 15.610 2.316 168 HB2 LYS 466 2HB LYS 466 2.372 16.755 1.529 169 HB3 LYS 466 1HB LYS 466 1.719 17.014 3.129 170 HG2 LYS 466 2HG LYS 466 3.314 15.168 3.100 171 HG3 LYS 466 1HG LYS 466 1.704 14.614 3.532 172 HD2 LYS 466 2HD LYS 466 2.868 13.069 2.003 173 HD3 LYS 466 1HD LYS 466 1.381 13.733 1.319 174 HE2 LYS 466 2HE LYS 466 3.292 13.622 -0.226 175 HE3 LYS 466 1HE LYS 466 2.596 15.231 -0.067 176 HZ1 LYS 466 3HZ LYS 466 4.448 15.710 1.541 177 HZ2 LYS 466 1HZ LYS 466 4.834 15.485 -0.044 178 HZ3 LYS 466 2HZ LYS 466 5.177 14.239 1.043 179 H GLY 467 H GLY 467 -1.184 16.954 3.527 180 HA2 GLY 467 2HA GLY 467 -1.342 19.711 2.622 181 HA3 GLY 467 1HA GLY 467 -2.639 18.918 3.521 182 H THR 468 H THR 468 -2.480 20.473 5.253 183 HA THR 468 HA THR 468 0.000 20.851 6.613 184 HB THR 468 HB THR 468 -2.812 21.440 7.580 185 HG1 THR 468 1HG THR 468 -1.067 22.670 5.793 186 HG21 THR 468 3HG2 THR 468 -1.102 21.453 9.373 187 HG22 THR 468 1HG2 THR 468 -1.712 23.072 9.053 188 HG23 THR 468 2HG2 THR 468 -0.134 22.586 8.430 189 H GLU 469 H GLU 469 -2.382 18.365 6.780 190 HA GLU 469 HA GLU 469 -1.361 17.547 9.355 191 HB2 GLU 469 2HB GLU 469 -3.565 16.399 7.654 192 HB3 GLU 469 1HB GLU 469 -3.109 15.810 9.245 193 HG2 GLU 469 2HG GLU 469 -5.038 17.169 9.605 194 HG3 GLU 469 1HG GLU 469 -3.613 18.100 10.087 195 H GLY 470 H GLY 470 -0.128 17.405 6.501 196 HA2 GLY 470 2HA GLY 470 1.490 16.077 5.572 197 HA3 GLY 470 1HA GLY 470 1.366 15.031 6.985 198 H LEU 471 H LEU 471 0.857 13.059 6.461 199 HA LEU 471 HA LEU 471 -0.566 12.488 4.022 200 HB2 LEU 471 2HB LEU 471 0.656 10.741 6.146 201 HB3 LEU 471 1HB LEU 471 -0.350 10.089 4.891 202 HG LEU 471 HG LEU 471 1.947 9.695 4.362 203 HD11 LEU 471 1HD1 LEU 471 0.831 11.823 2.565 204 HD12 LEU 471 2HD1 LEU 471 0.545 10.085 2.469 205 HD13 LEU 471 3HD1 LEU 471 2.153 10.737 2.168 206 HD21 LEU 471 3HD2 LEU 471 3.026 11.456 5.635 207 HD22 LEU 471 1HD2 LEU 471 2.367 12.671 4.528 208 HD23 LEU 471 2HD2 LEU 471 3.535 11.496 3.938 209 H GLY 472 H GLY 472 -1.103 12.419 7.453 210 HA2 GLY 472 2HA GLY 472 -3.203 12.716 8.478 211 HA3 GLY 472 1HA GLY 472 -3.965 12.374 6.931 212 H PHE 473 H PHE 473 -1.563 10.134 7.837 213 HA PHE 473 HA PHE 473 -3.334 8.528 9.401 214 HB2 PHE 473 2HB PHE 473 -3.312 6.557 7.976 215 HB3 PHE 473 1HB PHE 473 -3.977 7.897 7.058 216 HD1 PHE 473 1HD PHE 473 -2.361 9.111 5.483 217 HD2 PHE 473 2HD PHE 473 -1.578 5.244 7.092 218 HE1 PHE 473 1HE PHE 473 -0.726 8.651 3.687 219 HE2 PHE 473 2HE PHE 473 0.052 4.848 5.299 220 HZ PHE 473 HZ PHE 473 0.438 6.577 3.627 221 H SER 474 H SER 474 -2.191 6.581 10.097 222 HA SER 474 HA SER 474 0.697 7.026 10.143 223 HB2 SER 474 2HB SER 474 -0.339 7.787 12.263 224 HB3 SER 474 1HB SER 474 -1.068 6.198 12.470 225 HG SER 474 HG SER 474 1.069 6.847 13.505 226 H ILE 475 H ILE 475 1.828 4.983 10.773 227 HA ILE 475 HA ILE 475 0.411 2.608 9.769 228 HB ILE 475 HB ILE 475 2.633 1.800 9.056 229 HG12 ILE 475 2HG1 ILE 475 3.468 4.657 9.460 230 HG13 ILE 475 1HG1 ILE 475 3.880 3.209 10.408 231 HG21 ILE 475 1HG2 ILE 475 1.088 2.557 7.413 232 HG22 ILE 475 2HG2 ILE 475 2.728 2.965 6.958 233 HG23 ILE 475 3HG2 ILE 475 1.649 4.235 7.573 234 HD11 ILE 475 3HD1 ILE 475 5.662 4.008 8.746 235 HD12 ILE 475 1HD1 ILE 475 4.562 3.543 7.475 236 HD13 ILE 475 2HD1 ILE 475 5.200 2.318 8.573 237 H THR 476 H THR 476 0.782 0.767 10.897 238 HA THR 476 HA THR 476 2.473 0.876 13.274 239 HB THR 476 HB THR 476 0.099 1.115 13.999 240 HG1 THR 476 1HG THR 476 0.738 0.024 15.619 241 HG21 THR 476 3HG2 THR 476 -0.987 -0.056 12.122 242 HG22 THR 476 1HG2 THR 476 -1.487 -0.737 13.672 243 HG23 THR 476 2HG2 THR 476 -0.298 -1.579 12.679 244 H SER 477 H SER 477 3.085 -1.287 13.993 245 HA SER 477 HA SER 477 2.992 -3.235 11.839 246 HB2 SER 477 2HB SER 477 5.335 -3.891 12.408 247 HB3 SER 477 1HB SER 477 5.209 -2.277 11.761 248 HG SER 477 HG SER 477 5.052 -1.616 14.043 249 H ARG 478 H ARG 478 2.606 -5.336 12.507 250 HA ARG 478 HA ARG 478 2.636 -5.913 15.339 251 HB2 ARG 478 2HB ARG 478 0.342 -6.823 15.270 252 HB3 ARG 478 1HB ARG 478 0.377 -5.090 14.999 253 HG2 ARG 478 2HG ARG 478 0.167 -5.510 12.568 254 HG3 ARG 478 1HG ARG 478 0.017 -7.234 12.919 255 HD2 ARG 478 2HD ARG 478 -2.156 -6.185 12.587 256 HD3 ARG 478 1HD ARG 478 -1.991 -6.798 14.234 257 HE ARG 478 HE ARG 478 -1.237 -4.297 14.594 258 HH11 ARG 478 1HH1 ARG 478 -4.018 -5.457 12.716 259 HH12 ARG 478 2HH1 ARG 478 -4.941 -4.059 13.022 260 HH21 ARG 478 1HH2 ARG 478 -2.505 -2.445 14.996 261 HH22 ARG 478 2HH2 ARG 478 -4.066 -2.301 14.345 262 H ASP 479 H ASP 479 2.765 -8.071 15.786 263 HA ASP 479 HA ASP 479 3.315 -10.223 15.545 264 HB2 ASP 479 2HB ASP 479 1.546 -10.481 13.801 265 HB3 ASP 479 1HB ASP 479 2.703 -9.957 12.586 266 H VAL 480 H VAL 480 5.302 -10.519 15.981 267 HA VAL 480 HA VAL 480 7.305 -9.109 14.595 268 HB VAL 480 HB VAL 480 8.965 -10.294 16.099 269 HG11 VAL 480 1HG1 VAL 480 8.232 -9.094 18.114 270 HG12 VAL 480 2HG1 VAL 480 6.633 -8.875 17.397 271 HG13 VAL 480 3HG1 VAL 480 8.047 -8.118 16.661 272 HG21 VAL 480 3HG2 VAL 480 7.702 -12.348 16.511 273 HG22 VAL 480 1HG2 VAL 480 6.436 -11.424 17.318 274 HG23 VAL 480 2HG2 VAL 480 8.042 -11.519 18.029 275 H THR 481 H THR 481 6.983 -9.839 12.502 276 HA THR 481 HA THR 481 8.790 -12.019 11.892 277 HB THR 481 HB THR 481 7.275 -12.509 9.887 278 HG1 THR 481 1HG THR 481 5.114 -11.639 11.415 279 HG21 THR 481 3HG2 THR 481 7.487 -14.077 11.764 280 HG22 THR 481 1HG2 THR 481 5.838 -14.058 11.136 281 HG23 THR 481 2HG2 THR 481 6.219 -13.209 12.631 282 H ILE 482 H ILE 482 10.174 -11.556 10.301 283 HA ILE 482 HA ILE 482 9.640 -9.156 8.695 284 HB ILE 482 HB ILE 482 12.083 -8.657 8.668 285 HG12 ILE 482 2HG1 ILE 482 12.234 -10.729 10.879 286 HG13 ILE 482 1HG1 ILE 482 12.912 -10.901 9.267 287 HG21 ILE 482 1HG2 ILE 482 10.794 -8.616 11.389 288 HG22 ILE 482 2HG2 ILE 482 10.631 -7.393 10.130 289 HG23 ILE 482 3HG2 ILE 482 12.191 -7.651 10.913 290 HD11 ILE 482 3HD1 ILE 482 13.746 -8.889 11.339 291 HD12 ILE 482 1HD1 ILE 482 14.442 -9.047 9.725 292 HD13 ILE 482 2HD1 ILE 482 14.628 -10.353 10.898 293 H GLY 483 H GLY 483 10.665 -12.427 8.829 294 HA2 GLY 483 2HA GLY 483 12.006 -12.566 6.324 295 HA3 GLY 483 1HA GLY 483 11.381 -13.924 7.246 296 H GLY 484 H GLY 484 8.705 -12.538 7.226 297 HA2 GLY 484 2HA GLY 484 7.934 -13.283 4.482 298 HA3 GLY 484 1HA GLY 484 6.874 -13.392 5.890 299 H SER 485 H SER 485 9.081 -10.818 5.001 300 HA SER 485 HA SER 485 8.890 -8.645 4.554 301 HB2 SER 485 2HB SER 485 5.962 -9.187 3.973 302 HB3 SER 485 1HB SER 485 6.876 -7.756 3.493 303 HG SER 485 HG SER 485 8.284 -9.653 2.574 304 H ALA 486 H ALA 486 8.634 -6.828 5.833 305 HA ALA 486 HA ALA 486 7.585 -7.314 8.447 306 HB1 ALA 486 1HB ALA 486 8.205 -4.982 8.920 307 HB2 ALA 486 2HB ALA 486 8.528 -4.724 7.206 308 HB3 ALA 486 3HB ALA 486 9.523 -5.848 8.129 309 HA PRO 487 HA PRO 487 3.570 -6.152 7.102 310 HB2 PRO 487 2HB PRO 487 2.161 -6.960 9.211 311 HB3 PRO 487 1HB PRO 487 2.899 -8.086 8.089 312 HG2 PRO 487 2HG PRO 487 3.813 -7.337 10.822 313 HG3 PRO 487 1HG PRO 487 3.941 -8.887 9.980 314 HD2 PRO 487 2HD PRO 487 5.971 -6.966 10.235 315 HD3 PRO 487 1HD PRO 487 5.958 -8.347 9.118 316 H ILE 488 H ILE 488 3.533 -4.025 6.938 317 HA ILE 488 HA ILE 488 2.992 -2.450 9.331 318 HB ILE 488 HB ILE 488 4.058 -1.510 6.588 319 HG12 ILE 488 2HG1 ILE 488 5.576 -2.482 8.453 320 HG13 ILE 488 1HG1 ILE 488 5.973 -0.929 7.732 321 HG21 ILE 488 1HG2 ILE 488 3.955 0.691 7.397 322 HG22 ILE 488 2HG2 ILE 488 3.183 0.065 8.864 323 HG23 ILE 488 3HG2 ILE 488 2.327 -0.034 7.324 324 HD11 ILE 488 3HD1 ILE 488 5.112 0.244 9.587 325 HD12 ILE 488 1HD1 ILE 488 6.232 -0.967 10.180 326 HD13 ILE 488 2HD1 ILE 488 4.470 -1.214 10.329 327 H TYR 489 H TYR 489 1.037 -1.784 9.660 328 HA TYR 489 HA TYR 489 -0.883 -1.784 7.420 329 HB2 TYR 489 2HB TYR 489 -1.448 -2.395 10.334 330 HB3 TYR 489 1HB TYR 489 -2.618 -2.393 9.024 331 HD1 TYR 489 1HD TYR 489 -2.638 -4.197 7.377 332 HD2 TYR 489 2HD TYR 489 0.080 -4.212 10.634 333 HE1 TYR 489 1HE TYR 489 -2.161 -6.566 6.951 334 HE2 TYR 489 2HE TYR 489 0.566 -6.559 10.246 335 HH TYR 489 HH TYR 489 -0.383 -8.493 9.182 336 H VAL 490 H VAL 490 -2.267 -0.078 7.372 337 HA VAL 490 HA VAL 490 -1.515 2.380 8.519 338 HB VAL 490 HB VAL 490 -4.248 1.556 7.506 339 HG11 VAL 490 1HG1 VAL 490 -3.081 4.303 7.959 340 HG12 VAL 490 2HG1 VAL 490 -4.382 3.557 8.879 341 HG13 VAL 490 3HG1 VAL 490 -4.623 3.963 7.180 342 HG21 VAL 490 3HG2 VAL 490 -2.527 1.282 5.816 343 HG22 VAL 490 1HG2 VAL 490 -1.981 2.944 6.086 344 HG23 VAL 490 2HG2 VAL 490 -3.595 2.632 5.441 345 H LYS 491 H LYS 491 -1.559 2.867 10.587 346 HA LYS 491 HA LYS 491 -2.949 1.274 12.482 347 HB2 LYS 491 2HB LYS 491 -0.836 2.461 12.993 348 HB3 LYS 491 1HB LYS 491 -1.705 3.979 12.912 349 HG2 LYS 491 2HG LYS 491 -3.100 3.384 14.779 350 HG3 LYS 491 1HG LYS 491 -2.390 1.777 14.836 351 HD2 LYS 491 2HD LYS 491 -1.495 3.179 16.591 352 HD3 LYS 491 1HD LYS 491 -0.227 2.765 15.442 353 HE2 LYS 491 2HE LYS 491 -0.388 4.955 14.440 354 HE3 LYS 491 1HE LYS 491 -1.757 5.368 15.475 355 HZ1 LYS 491 3HZ LYS 491 -0.310 5.170 17.399 356 HZ2 LYS 491 1HZ LYS 491 0.304 6.294 16.319 357 HZ3 LYS 491 2HZ LYS 491 0.999 4.768 16.427 358 H ASN 492 H ASN 492 -3.721 4.337 10.950 359 HA ASN 492 HA ASN 492 -6.451 4.217 11.591 360 HB2 ASN 492 2HB ASN 492 -5.671 4.674 13.897 361 HB3 ASN 492 1HB ASN 492 -4.834 6.110 13.339 362 HD21 ASN 492 1HD2 ASN 492 -7.942 4.671 14.026 363 HD22 ASN 492 2HD2 ASN 492 -8.840 6.133 14.047 364 H ILE 493 H ILE 493 -7.571 5.778 10.465 365 HA ILE 493 HA ILE 493 -5.980 7.584 8.801 366 HB ILE 493 HB ILE 493 -8.933 6.824 8.639 367 HG12 ILE 493 2HG1 ILE 493 -7.480 4.938 8.043 368 HG13 ILE 493 1HG1 ILE 493 -8.360 5.553 6.650 369 HG21 ILE 493 1HG2 ILE 493 -7.253 8.437 6.731 370 HG22 ILE 493 2HG2 ILE 493 -8.598 9.045 7.701 371 HG23 ILE 493 3HG2 ILE 493 -8.876 7.875 6.403 372 HD11 ILE 493 3HD1 ILE 493 -6.089 4.990 6.072 373 HD12 ILE 493 1HD1 ILE 493 -5.476 6.101 7.299 374 HD13 ILE 493 2HD1 ILE 493 -6.356 6.728 5.907 375 H LEU 494 H LEU 494 -5.740 9.544 9.611 376 HA LEU 494 HA LEU 494 -7.104 10.333 11.950 377 HB2 LEU 494 2HB LEU 494 -5.274 11.912 10.152 378 HB3 LEU 494 1HB LEU 494 -5.761 12.381 11.769 379 HG LEU 494 HG LEU 494 -4.077 9.979 11.056 380 HD11 LEU 494 1HD1 LEU 494 -2.886 12.069 10.801 381 HD12 LEU 494 2HD1 LEU 494 -2.287 11.160 12.188 382 HD13 LEU 494 3HD1 LEU 494 -3.348 12.547 12.436 383 HD21 LEU 494 3HD2 LEU 494 -5.461 9.513 13.002 384 HD22 LEU 494 1HD2 LEU 494 -4.942 11.019 13.755 385 HD23 LEU 494 2HD2 LEU 494 -3.780 9.723 13.481 386 HA PRO 495 HA PRO 495 -10.739 12.372 10.568 387 HB2 PRO 495 2HB PRO 495 -9.863 14.627 12.305 388 HB3 PRO 495 1HB PRO 495 -11.417 13.786 12.261 389 HG2 PRO 495 2HG PRO 495 -9.713 13.262 14.208 390 HG3 PRO 495 1HG PRO 495 -10.603 11.944 13.424 391 HD2 PRO 495 2HD PRO 495 -7.757 12.769 13.088 392 HD3 PRO 495 1HD PRO 495 -8.473 11.142 13.135 393 H ARG 496 H ARG 496 -7.743 14.194 10.501 394 HA ARG 496 HA ARG 496 -8.731 15.605 8.126 395 HB2 ARG 496 2HB ARG 496 -6.966 16.806 10.273 396 HB3 ARG 496 1HB ARG 496 -7.463 17.602 8.788 397 HG2 ARG 496 2HG ARG 496 -9.223 16.805 11.101 398 HG3 ARG 496 1HG ARG 496 -8.712 18.436 10.664 399 HD2 ARG 496 2HD ARG 496 -9.937 18.206 8.538 400 HD3 ARG 496 1HD ARG 496 -10.463 16.602 9.042 401 HE ARG 496 HE ARG 496 -11.063 18.745 10.864 402 HH11 ARG 496 1HH1 ARG 496 -12.274 16.719 8.222 403 HH12 ARG 496 2HH1 ARG 496 -13.913 17.079 8.514 404 HH21 ARG 496 1HH2 ARG 496 -13.346 19.216 11.259 405 HH22 ARG 496 2HH2 ARG 496 -14.534 18.518 10.273 406 H GLY 497 H GLY 497 -7.303 15.579 6.432 407 HA2 GLY 497 2HA GLY 497 -4.790 15.770 6.123 408 HA3 GLY 497 1HA GLY 497 -4.747 14.196 6.870 409 H ALA 498 H ALA 498 -3.684 14.317 4.490 410 HA ALA 498 HA ALA 498 -5.169 14.371 2.167 411 HB1 ALA 498 1HB ALA 498 -2.738 12.692 2.711 412 HB2 ALA 498 2HB ALA 498 -2.733 14.394 2.250 413 HB3 ALA 498 3HB ALA 498 -3.339 13.177 1.127 414 H ALA 499 H ALA 499 -4.343 11.533 4.102 415 HA ALA 499 HA ALA 499 -5.430 9.605 2.413 416 HB1 ALA 499 1HB ALA 499 -3.898 9.050 4.188 417 HB2 ALA 499 2HB ALA 499 -5.386 8.110 4.348 418 HB3 ALA 499 3HB ALA 499 -5.099 9.500 5.393 419 H ILE 500 H ILE 500 -7.018 11.401 5.026 420 HA ILE 500 HA ILE 500 -9.344 9.753 4.771 421 HB ILE 500 HB ILE 500 -8.701 10.903 6.964 422 HG12 ILE 500 2HG1 ILE 500 -11.488 11.377 5.895 423 HG13 ILE 500 1HG1 ILE 500 -10.892 9.873 6.543 424 HG21 ILE 500 1HG2 ILE 500 -8.174 13.130 6.066 425 HG22 ILE 500 2HG2 ILE 500 -9.431 13.229 7.299 426 HG23 ILE 500 3HG2 ILE 500 -9.845 13.346 5.592 427 HD11 ILE 500 3HD1 ILE 500 -11.175 12.428 8.101 428 HD12 ILE 500 1HD1 ILE 500 -10.608 10.884 8.731 429 HD13 ILE 500 2HD1 ILE 500 -12.267 11.044 8.162 430 H GLN 501 H GLN 501 -8.262 12.776 3.500 431 HA GLN 501 HA GLN 501 -10.772 13.582 2.400 432 HB2 GLN 501 2HB GLN 501 -7.953 14.421 1.763 433 HB3 GLN 501 1HB GLN 501 -9.397 15.252 1.177 434 HG2 GLN 501 2HG GLN 501 -10.040 15.801 3.449 435 HG3 GLN 501 1HG GLN 501 -8.678 14.889 4.081 436 HE21 GLN 501 1HE2 GLN 501 -8.447 16.975 1.257 437 HE22 GLN 501 2HE2 GLN 501 -7.481 18.165 2.040 438 H ASP 502 H ASP 502 -8.158 11.564 1.401 439 HA ASP 502 HA ASP 502 -8.993 11.314 -1.334 440 HB2 ASP 502 2HB ASP 502 -6.688 10.836 -0.773 441 HB3 ASP 502 1HB ASP 502 -7.185 9.629 0.406 442 H GLY 503 H GLY 503 -9.214 9.280 1.548 443 HA2 GLY 503 2HA GLY 503 -11.074 8.102 2.293 444 HA3 GLY 503 1HA GLY 503 -11.893 8.509 0.803 445 H ARG 504 H ARG 504 -9.167 7.194 -0.428 446 HA ARG 504 HA ARG 504 -10.499 4.652 -0.801 447 HB2 ARG 504 2HB ARG 504 -7.792 5.607 -1.751 448 HB3 ARG 504 1HB ARG 504 -8.579 4.123 -2.260 449 HG2 ARG 504 2HG ARG 504 -10.336 5.387 -3.338 450 HG3 ARG 504 1HG ARG 504 -9.642 6.895 -2.734 451 HD2 ARG 504 2HD ARG 504 -9.013 6.510 -5.063 452 HD3 ARG 504 1HD ARG 504 -7.609 6.484 -3.997 453 HE ARG 504 HE ARG 504 -8.819 3.930 -4.633 454 HH11 ARG 504 1HH1 ARG 504 -6.210 6.252 -5.341 455 HH12 ARG 504 2HH1 ARG 504 -5.232 5.133 -6.148 456 HH21 ARG 504 1HH2 ARG 504 -7.482 2.391 -5.758 457 HH22 ARG 504 2HH2 ARG 504 -5.978 2.854 -6.403 458 H LEU 505 H LEU 505 -7.711 5.891 0.802 459 HA LEU 505 HA LEU 505 -6.718 3.379 1.756 460 HB2 LEU 505 2HB LEU 505 -5.301 5.350 1.337 461 HB3 LEU 505 1HB LEU 505 -6.142 6.223 2.591 462 HG LEU 505 HG LEU 505 -5.187 4.711 4.283 463 HD11 LEU 505 1HD1 LEU 505 -3.750 3.468 1.943 464 HD12 LEU 505 2HD1 LEU 505 -4.902 2.658 3.030 465 HD13 LEU 505 3HD1 LEU 505 -3.350 3.254 3.638 466 HD21 LEU 505 3HD2 LEU 505 -3.169 5.902 2.412 467 HD22 LEU 505 1HD2 LEU 505 -2.896 5.483 4.099 468 HD23 LEU 505 2HD2 LEU 505 -4.038 6.761 3.684 469 H LYS 506 H LYS 506 -7.008 2.459 3.803 470 HA LYS 506 HA LYS 506 -8.757 3.787 5.686 471 HB2 LYS 506 2HB LYS 506 -10.113 2.359 3.991 472 HB3 LYS 506 1HB LYS 506 -9.218 1.008 4.667 473 HG2 LYS 506 2HG LYS 506 -10.886 2.677 6.499 474 HG3 LYS 506 1HG LYS 506 -11.672 1.536 5.430 475 HD2 LYS 506 2HD LYS 506 -9.469 0.762 7.335 476 HD3 LYS 506 1HD LYS 506 -11.171 0.743 7.777 477 HE2 LYS 506 2HE LYS 506 -10.467 -1.503 7.162 478 HE3 LYS 506 1HE LYS 506 -11.595 -0.901 5.961 479 HZ1 LYS 506 3HZ LYS 506 -9.776 -0.573 4.429 480 HZ2 LYS 506 1HZ LYS 506 -9.697 -2.112 5.053 481 HZ3 LYS 506 2HZ LYS 506 -8.632 -0.965 5.650 482 H ALA 507 H ALA 507 -8.660 2.618 7.769 483 HA ALA 507 HA ALA 507 -6.082 1.952 8.593 484 HB1 ALA 507 1HB ALA 507 -7.205 1.157 10.641 485 HB2 ALA 507 2HB ALA 507 -8.741 1.275 9.754 486 HB3 ALA 507 3HB ALA 507 -7.810 2.733 10.072 487 H GLY 508 H GLY 508 -5.133 -0.044 9.111 488 HA2 GLY 508 2HA GLY 508 -4.987 -2.364 9.239 489 HA3 GLY 508 1HA GLY 508 -6.585 -2.482 8.530 490 H ASP 509 H ASP 509 -5.323 -0.479 6.385 491 HA ASP 509 HA ASP 509 -4.714 -2.561 4.564 492 HB2 ASP 509 2HB ASP 509 -4.431 0.448 4.269 493 HB3 ASP 509 1HB ASP 509 -3.958 -0.666 2.993 494 H ARG 510 H ARG 510 -2.877 -3.384 3.866 495 HA ARG 510 HA ARG 510 -0.609 -2.806 5.587 496 HB2 ARG 510 2HB ARG 510 -1.305 -5.135 5.453 497 HB3 ARG 510 1HB ARG 510 -1.079 -5.165 3.718 498 HG2 ARG 510 2HG ARG 510 1.319 -4.833 4.018 499 HG3 ARG 510 1HG ARG 510 1.094 -4.713 5.760 500 HD2 ARG 510 2HD ARG 510 0.268 -7.021 5.808 501 HD3 ARG 510 1HD ARG 510 0.502 -7.158 4.070 502 HE ARG 510 HE ARG 510 2.899 -6.340 5.146 503 HH11 ARG 510 1HH1 ARG 510 0.833 -9.227 5.335 504 HH12 ARG 510 2HH1 ARG 510 2.105 -10.298 5.678 505 HH21 ARG 510 1HH2 ARG 510 4.666 -7.855 5.657 506 HH22 ARG 510 2HH2 ARG 510 4.335 -9.500 5.866 507 H LEU 511 H LEU 511 0.975 -1.636 4.976 508 HA LEU 511 HA LEU 511 1.033 -0.553 2.314 509 HB2 LEU 511 2HB LEU 511 1.537 0.744 4.558 510 HB3 LEU 511 1HB LEU 511 3.037 -0.112 4.504 511 HG LEU 511 HG LEU 511 3.709 0.990 2.400 512 HD11 LEU 511 1HD1 LEU 511 2.400 2.695 1.420 513 HD12 LEU 511 2HD1 LEU 511 1.097 2.427 2.578 514 HD13 LEU 511 3HD1 LEU 511 1.515 1.178 1.403 515 HD21 LEU 511 3HD2 LEU 511 4.225 2.061 4.550 516 HD22 LEU 511 1HD2 LEU 511 2.691 2.928 4.471 517 HD23 LEU 511 2HD2 LEU 511 3.941 3.235 3.268 518 H ILE 512 H ILE 512 2.335 -1.196 0.669 519 HA ILE 512 HA ILE 512 4.195 -3.415 1.222 520 HB ILE 512 HB ILE 512 2.704 -2.725 -1.310 521 HG12 ILE 512 2HG1 ILE 512 1.191 -3.592 0.388 522 HG13 ILE 512 1HG1 ILE 512 1.442 -4.755 -0.894 523 HG21 ILE 512 1HG2 ILE 512 4.477 -5.082 -0.687 524 HG22 ILE 512 2HG2 ILE 512 4.831 -3.772 -1.813 525 HG23 ILE 512 3HG2 ILE 512 3.505 -4.886 -2.147 526 HD11 ILE 512 3HD1 ILE 512 2.987 -6.026 0.490 527 HD12 ILE 512 1HD1 ILE 512 1.435 -5.850 1.303 528 HD13 ILE 512 2HD1 ILE 512 2.801 -4.862 1.809 529 H GLU 513 H GLU 513 3.777 -0.639 -1.019 530 HA GLU 513 HA GLU 513 6.572 -0.051 -0.845 531 HB2 GLU 513 2HB GLU 513 7.042 -0.332 -3.257 532 HB3 GLU 513 1HB GLU 513 6.726 -1.848 -2.435 533 HG2 GLU 513 2HG GLU 513 4.427 -1.748 -3.263 534 HG3 GLU 513 1HG GLU 513 4.877 -0.314 -4.190 535 H VAL 514 H VAL 514 7.166 1.820 -1.749 536 HA VAL 514 HA VAL 514 4.938 3.601 -2.431 537 HB VAL 514 HB VAL 514 5.750 4.162 -0.166 538 HG11 VAL 514 1HG1 VAL 514 7.993 5.112 0.204 539 HG12 VAL 514 2HG1 VAL 514 8.404 4.731 -1.469 540 HG13 VAL 514 3HG1 VAL 514 8.073 3.435 -0.329 541 HG21 VAL 514 3HG2 VAL 514 6.134 6.550 -0.487 542 HG22 VAL 514 1HG2 VAL 514 4.878 5.935 -1.563 543 HG23 VAL 514 2HG2 VAL 514 6.489 6.254 -2.195 544 H ASN 515 H ASN 515 5.109 4.531 -4.386 545 HA ASN 515 HA ASN 515 5.955 5.289 -6.392 546 HB2 ASN 515 2HB ASN 515 8.272 5.972 -4.574 547 HB3 ASN 515 1HB ASN 515 8.278 6.385 -6.276 548 HD21 ASN 515 1HD2 ASN 515 8.364 8.546 -5.864 549 HD22 ASN 515 2HD2 ASN 515 7.060 9.473 -5.228 550 H GLY 516 H GLY 516 6.561 2.470 -5.479 551 HA2 GLY 516 2HA GLY 516 7.354 0.729 -6.852 552 HA3 GLY 516 1HA GLY 516 8.439 1.869 -7.637 553 H VAL 517 H VAL 517 8.796 2.567 -4.473 554 HA VAL 517 HA VAL 517 11.241 1.039 -4.251 555 HB VAL 517 HB VAL 517 9.943 2.967 -2.298 556 HG11 VAL 517 1HG1 VAL 517 12.778 1.932 -2.407 557 HG12 VAL 517 2HG1 VAL 517 11.551 1.487 -1.220 558 HG13 VAL 517 3HG1 VAL 517 12.163 3.139 -1.275 559 HG21 VAL 517 3HG2 VAL 517 10.450 4.088 -4.392 560 HG22 VAL 517 1HG2 VAL 517 12.100 3.473 -4.333 561 HG23 VAL 517 2HG2 VAL 517 11.548 4.631 -3.122 562 H ASP 518 H ASP 518 11.265 -0.919 -3.413 563 HA ASP 518 HA ASP 518 8.927 -1.966 -2.145 564 HB2 ASP 518 2HB ASP 518 10.233 -3.455 -3.563 565 HB3 ASP 518 1HB ASP 518 11.639 -3.238 -2.520 566 H LEU 519 H LEU 519 8.465 -1.849 -0.166 567 HA LEU 519 HA LEU 519 10.637 -1.519 1.721 568 HB2 LEU 519 2HB LEU 519 9.123 -0.059 3.002 569 HB3 LEU 519 1HB LEU 519 9.603 0.587 1.450 570 HG LEU 519 HG LEU 519 7.336 -0.544 0.747 571 HD11 LEU 519 1HD1 LEU 519 6.761 0.186 3.578 572 HD12 LEU 519 2HD1 LEU 519 6.649 -1.416 2.806 573 HD13 LEU 519 3HD1 LEU 519 5.591 -0.090 2.284 574 HD21 LEU 519 3HD2 LEU 519 7.610 2.199 1.927 575 HD22 LEU 519 1HD2 LEU 519 6.280 1.619 0.890 576 HD23 LEU 519 2HD2 LEU 519 7.926 1.646 0.274 577 H ALA 520 H ALA 520 8.772 -3.694 0.614 578 HA ALA 520 HA ALA 520 7.531 -4.717 2.993 579 HB1 ALA 520 1HB ALA 520 6.579 -5.205 0.780 580 HB2 ALA 520 2HB ALA 520 7.057 -6.696 1.590 581 HB3 ALA 520 3HB ALA 520 8.067 -6.023 0.313 582 H GLY 521 H GLY 521 10.495 -5.137 1.145 583 HA2 GLY 521 2HA GLY 521 11.513 -7.233 2.847 584 HA3 GLY 521 1HA GLY 521 12.397 -6.385 1.580 585 H LYS 522 H LYS 522 11.054 -4.039 3.232 586 HA LYS 522 HA LYS 522 13.416 -3.500 4.817 587 HB2 LYS 522 2HB LYS 522 11.065 -1.848 3.965 588 HB3 LYS 522 1HB LYS 522 12.123 -1.305 5.252 589 HG2 LYS 522 2HG LYS 522 13.028 -1.955 2.453 590 HG3 LYS 522 1HG LYS 522 12.650 -0.331 3.042 591 HD2 LYS 522 2HD LYS 522 14.336 -0.665 4.840 592 HD3 LYS 522 1HD LYS 522 14.797 -2.180 4.083 593 HE2 LYS 522 2HE LYS 522 15.437 -0.984 2.057 594 HE3 LYS 522 1HE LYS 522 14.917 0.536 2.780 595 HZ1 LYS 522 3HZ LYS 522 17.272 0.327 2.978 596 HZ2 LYS 522 1HZ LYS 522 17.153 -1.188 3.672 597 HZ3 LYS 522 2HZ LYS 522 16.617 0.161 4.542 598 H SER 523 H SER 523 13.293 -2.995 7.010 599 HA SER 523 HA SER 523 11.255 -4.440 8.411 600 HB2 SER 523 2HB SER 523 13.612 -2.823 9.370 601 HB3 SER 523 1HB SER 523 12.602 -3.855 10.404 602 HG SER 523 HG SER 523 13.454 -5.178 8.220 603 H GLN 524 H GLN 524 10.153 -3.279 10.348 604 HA GLN 524 HA GLN 524 8.598 -1.208 9.323 605 HB2 GLN 524 2HB GLN 524 7.669 -0.807 11.533 606 HB3 GLN 524 1HB GLN 524 7.757 -2.535 11.216 607 HG2 GLN 524 2HG GLN 524 9.811 -1.040 12.806 608 HG3 GLN 524 1HG GLN 524 8.359 -1.724 13.546 609 HE21 GLN 524 1HE2 GLN 524 8.144 -3.804 13.547 610 HE22 GLN 524 2HE2 GLN 524 9.410 -4.976 13.427 611 H GLU 525 H GLU 525 11.364 -1.057 11.426 612 HA GLU 525 HA GLU 525 11.116 1.636 12.083 613 HB2 GLU 525 2HB GLU 525 13.474 -0.194 12.076 614 HB3 GLU 525 1HB GLU 525 13.541 1.444 12.763 615 HG2 GLU 525 2HG GLU 525 11.767 0.821 14.331 616 HG3 GLU 525 1HG GLU 525 11.693 -0.782 13.609 617 H GLU 526 H GLU 526 12.439 0.142 9.280 618 HA GLU 526 HA GLU 526 13.826 2.375 8.194 619 HB2 GLU 526 2HB GLU 526 12.431 0.040 6.893 620 HB3 GLU 526 1HB GLU 526 13.521 1.145 6.074 621 HG2 GLU 526 2HG GLU 526 14.317 -0.540 8.415 622 HG3 GLU 526 1HG GLU 526 14.476 -1.084 6.749 623 H VAL 527 H VAL 527 10.578 0.988 7.755 624 HA VAL 527 HA VAL 527 9.819 3.092 5.992 625 HB VAL 527 HB VAL 527 7.672 1.968 5.724 626 HG11 VAL 527 1HG1 VAL 527 8.534 -0.148 4.855 627 HG12 VAL 527 2HG1 VAL 527 10.037 0.133 5.727 628 HG13 VAL 527 3HG1 VAL 527 9.571 1.236 4.428 629 HG21 VAL 527 3HG2 VAL 527 8.702 0.017 7.751 630 HG22 VAL 527 1HG2 VAL 527 7.251 -0.142 6.764 631 HG23 VAL 527 2HG2 VAL 527 7.334 1.134 8.000 632 H VAL 528 H VAL 528 9.176 2.351 9.325 633 HA VAL 528 HA VAL 528 7.194 4.286 9.783 634 HB VAL 528 HB VAL 528 9.331 3.247 11.714 635 HG11 VAL 528 1HG1 VAL 528 8.439 5.384 12.485 636 HG12 VAL 528 2HG1 VAL 528 7.869 4.055 13.504 637 HG13 VAL 528 3HG1 VAL 528 6.796 4.766 12.304 638 HG21 VAL 528 3HG2 VAL 528 6.430 2.436 11.363 639 HG22 VAL 528 1HG2 VAL 528 7.510 1.791 12.596 640 HG23 VAL 528 2HG2 VAL 528 7.829 1.463 10.917 641 H SER 529 H SER 529 10.678 4.474 9.592 642 HA SER 529 HA SER 529 10.841 7.211 10.256 643 HB2 SER 529 2HB SER 529 12.806 5.759 10.355 644 HB3 SER 529 1HB SER 529 12.717 5.491 8.613 645 HG SER 529 HG SER 529 13.589 7.689 10.057 646 H LEU 530 H LEU 530 10.662 5.470 7.176 647 HA LEU 530 HA LEU 530 10.844 7.609 5.413 648 HB2 LEU 530 2HB LEU 530 9.376 5.066 5.336 649 HB3 LEU 530 1HB LEU 530 9.419 6.067 3.903 650 HG LEU 530 HG LEU 530 11.711 4.628 5.283 651 HD11 LEU 530 1HD1 LEU 530 10.533 4.330 2.525 652 HD12 LEU 530 2HD1 LEU 530 10.312 3.222 3.877 653 HD13 LEU 530 3HD1 LEU 530 11.911 3.434 3.163 654 HD21 LEU 530 3HD2 LEU 530 13.170 5.501 3.509 655 HD22 LEU 530 1HD2 LEU 530 12.530 6.795 4.516 656 HD23 LEU 530 2HD2 LEU 530 11.845 6.504 2.915 657 H LEU 531 H LEU 531 7.816 6.125 6.714 658 HA LEU 531 HA LEU 531 6.219 8.012 5.458 659 HB2 LEU 531 2HB LEU 531 5.714 5.909 7.552 660 HB3 LEU 531 1HB LEU 531 4.470 7.071 7.122 661 HG LEU 531 HG LEU 531 4.222 4.951 6.045 662 HD11 LEU 531 1HD1 LEU 531 3.360 6.920 4.901 663 HD12 LEU 531 2HD1 LEU 531 3.929 5.741 3.720 664 HD13 LEU 531 3HD1 LEU 531 4.909 7.154 4.088 665 HD21 LEU 531 3HD2 LEU 531 6.842 5.506 4.660 666 HD22 LEU 531 1HD2 LEU 531 5.730 4.208 4.220 667 HD23 LEU 531 2HD2 LEU 531 6.509 4.211 5.804 668 H ARG 532 H ARG 532 7.596 7.939 8.712 669 HA ARG 532 HA ARG 532 6.081 10.211 9.516 670 HB2 ARG 532 2HB ARG 532 7.028 8.623 11.160 671 HB3 ARG 532 1HB ARG 532 8.646 9.135 10.713 672 HG2 ARG 532 2HG ARG 532 7.992 10.202 12.783 673 HG3 ARG 532 1HG ARG 532 8.123 11.410 11.500 674 HD2 ARG 532 2HD ARG 532 5.673 11.309 11.194 675 HD3 ARG 532 1HD ARG 532 5.568 10.167 12.532 676 HE ARG 532 HE ARG 532 6.895 12.613 13.189 677 HH11 ARG 532 1HH1 ARG 532 3.722 11.007 13.012 678 HH12 ARG 532 2HH1 ARG 532 2.966 12.102 14.059 679 HH21 ARG 532 1HH2 ARG 532 5.790 14.120 14.634 680 HH22 ARG 532 2HH2 ARG 532 4.138 13.903 14.982 681 H SER 533 H SER 533 9.182 9.811 7.910 682 HA SER 533 HA SER 533 10.112 12.471 8.366 683 HB2 SER 533 2HB SER 533 11.630 10.498 7.833 684 HB3 SER 533 1HB SER 533 10.989 10.525 6.198 685 HG SER 533 HG SER 533 12.855 11.694 6.165 686 H THR 534 H THR 534 8.569 10.721 5.733 687 HA THR 534 HA THR 534 7.084 11.335 4.214 688 HB THR 534 HB THR 534 7.059 13.988 5.645 689 HG1 THR 534 1HG THR 534 6.126 11.560 6.305 690 HG21 THR 534 3HG2 THR 534 5.168 12.750 3.696 691 HG22 THR 534 1HG2 THR 534 6.210 14.148 3.380 692 HG23 THR 534 2HG2 THR 534 4.887 14.277 4.560 693 H LYS 535 H LYS 535 8.023 11.293 2.265 694 HA LYS 535 HA LYS 535 9.815 13.271 1.282 695 HB2 LYS 535 2HB LYS 535 9.764 11.038 0.260 696 HB3 LYS 535 1HB LYS 535 8.070 11.232 -0.151 697 HG2 LYS 535 2HG LYS 535 8.629 12.987 -1.736 698 HG3 LYS 535 1HG LYS 535 10.329 12.867 -1.280 699 HD2 LYS 535 2HD LYS 535 10.457 10.625 -2.157 700 HD3 LYS 535 1HD LYS 535 8.722 10.615 -2.484 701 HE2 LYS 535 2HE LYS 535 10.080 11.020 -4.514 702 HE3 LYS 535 1HE LYS 535 8.986 12.351 -4.160 703 HZ1 LYS 535 3HZ LYS 535 10.916 13.536 -3.158 704 HZ2 LYS 535 1HZ LYS 535 11.144 13.187 -4.784 705 HZ3 LYS 535 2HZ LYS 535 11.911 12.271 -3.599 706 H MET 536 H MET 536 9.201 15.326 1.002 707 HA MET 536 HA MET 536 6.351 15.913 0.742 708 HB2 MET 536 2HB MET 536 7.879 16.975 2.490 709 HB3 MET 536 1HB MET 536 8.605 17.859 1.150 710 HG2 MET 536 2HG MET 536 6.975 19.221 2.316 711 HG3 MET 536 1HG MET 536 6.462 18.894 0.659 712 HE1 MET 536 3HE MET 536 3.086 19.046 2.661 713 HE2 MET 536 1HE MET 536 4.007 19.704 1.309 714 HE3 MET 536 2HE MET 536 4.540 19.995 2.965 715 H GLU 537 H GLU 537 7.373 14.828 -1.500 716 HA GLU 537 HA GLU 537 8.298 16.764 -3.343 717 HB2 GLU 537 2HB GLU 537 8.718 14.326 -3.486 718 HB3 GLU 537 1HB GLU 537 7.030 14.085 -3.913 719 HG2 GLU 537 2HG GLU 537 8.380 14.007 -5.882 720 HG3 GLU 537 1HG GLU 537 7.401 15.479 -5.919 721 H GLY 538 H GLY 538 5.214 15.124 -2.839 722 HA2 GLY 538 2HA GLY 538 3.382 17.083 -3.173 723 HA3 GLY 538 1HA GLY 538 3.689 16.578 -4.823 724 H THR 539 H THR 539 2.968 14.655 -5.545 725 HA THR 539 HA THR 539 1.252 13.276 -3.719 726 HB THR 539 HB THR 539 0.851 11.852 -5.796 727 HG1 THR 539 1HG THR 539 2.469 12.569 -7.118 728 HG21 THR 539 3HG2 THR 539 -0.819 13.428 -6.651 729 HG22 THR 539 1HG2 THR 539 -0.075 14.732 -5.718 730 HG23 THR 539 2HG2 THR 539 -0.816 13.350 -4.896 731 H VAL 540 H VAL 540 1.700 11.531 -2.781 732 HA VAL 540 HA VAL 540 4.131 10.030 -3.471 733 HB VAL 540 HB VAL 540 2.606 10.227 -0.839 734 HG11 VAL 540 1HG1 VAL 540 3.611 8.032 -1.192 735 HG12 VAL 540 2HG1 VAL 540 4.416 8.917 0.114 736 HG13 VAL 540 3HG1 VAL 540 5.172 8.791 -1.479 737 HG21 VAL 540 3HG2 VAL 540 4.522 11.465 -0.034 738 HG22 VAL 540 1HG2 VAL 540 3.850 12.208 -1.501 739 HG23 VAL 540 2HG2 VAL 540 5.322 11.257 -1.610 740 H SER 541 H SER 541 3.838 7.950 -4.126 741 HA SER 541 HA SER 541 1.078 7.022 -4.162 742 HB2 SER 541 2HB SER 541 2.166 7.288 -6.373 743 HB3 SER 541 1HB SER 541 3.433 6.170 -5.879 744 HG SER 541 HG SER 541 2.070 4.539 -5.945 745 H LEU 542 H LEU 542 0.557 5.713 -2.731 746 HA LEU 542 HA LEU 542 2.550 3.931 -1.540 747 HB2 LEU 542 2HB LEU 542 -0.088 4.934 -0.543 748 HB3 LEU 542 1HB LEU 542 0.937 3.794 0.308 749 HG LEU 542 HG LEU 542 1.795 6.598 -0.402 750 HD11 LEU 542 1HD1 LEU 542 0.791 5.416 2.138 751 HD12 LEU 542 2HD1 LEU 542 -0.085 6.574 1.134 752 HD13 LEU 542 3HD1 LEU 542 1.422 7.069 1.923 753 HD21 LEU 542 3HD2 LEU 542 2.945 4.541 1.479 754 HD22 LEU 542 1HD2 LEU 542 3.539 6.177 1.214 755 HD23 LEU 542 2HD2 LEU 542 3.606 4.992 -0.098 756 H LEU 543 H LEU 543 2.426 1.925 -2.062 757 HA LEU 543 HA LEU 543 -0.014 0.902 -3.281 758 HB2 LEU 543 2HB LEU 543 2.346 0.818 -4.430 759 HB3 LEU 543 1HB LEU 543 2.730 -0.273 -3.177 760 HG LEU 543 HG LEU 543 0.415 -1.027 -4.923 761 HD11 LEU 543 1HD1 LEU 543 3.339 -1.486 -5.514 762 HD12 LEU 543 2HD1 LEU 543 2.246 -0.461 -6.449 763 HD13 LEU 543 3HD1 LEU 543 1.979 -2.202 -6.380 764 HD21 LEU 543 3HD2 LEU 543 1.278 -3.269 -4.383 765 HD22 LEU 543 1HD2 LEU 543 0.844 -2.355 -2.927 766 HD23 LEU 543 2HD2 LEU 543 2.534 -2.545 -3.409 767 H VAL 544 H VAL 544 -1.264 -0.326 -2.084 768 HA VAL 544 HA VAL 544 -0.154 -1.591 0.326 769 HB VAL 544 HB VAL 544 -2.306 -1.354 1.420 770 HG11 VAL 544 1HG1 VAL 544 -1.377 1.271 0.280 771 HG12 VAL 544 2HG1 VAL 544 -0.765 0.479 1.732 772 HG13 VAL 544 3HG1 VAL 544 -2.421 1.083 1.691 773 HG21 VAL 544 3HG2 VAL 544 -3.714 -1.555 -0.495 774 HG22 VAL 544 1HG2 VAL 544 -3.207 0.023 -1.096 775 HG23 VAL 544 2HG2 VAL 544 -4.155 -0.089 0.404 776 H PHE 545 H PHE 545 -1.369 -3.479 1.042 777 HA PHE 545 HA PHE 545 -2.157 -5.158 -1.261 778 HB2 PHE 545 2HB PHE 545 -0.044 -5.718 -0.116 779 HB3 PHE 545 1HB PHE 545 -0.934 -5.953 1.377 780 HD1 PHE 545 1HD PHE 545 -0.415 -7.173 -2.025 781 HD2 PHE 545 2HD PHE 545 -1.986 -8.043 1.814 782 HE1 PHE 545 1HE PHE 545 -0.638 -9.462 -2.685 783 HE2 PHE 545 2HE PHE 545 -2.232 -10.412 1.171 784 HZ PHE 545 HZ PHE 545 -1.563 -11.144 -1.075 785 H ARG 546 H ARG 546 -4.169 -6.039 -1.193 786 HA ARG 546 HA ARG 546 -5.394 -6.232 1.418 787 HB2 ARG 546 2HB ARG 546 -6.771 -5.421 -1.135 788 HB3 ARG 546 1HB ARG 546 -7.654 -6.001 0.274 789 HG2 ARG 546 2HG ARG 546 -6.627 -4.186 1.607 790 HG3 ARG 546 1HG ARG 546 -5.880 -3.578 0.132 791 HD2 ARG 546 2HD ARG 546 -8.071 -3.189 -0.842 792 HD3 ARG 546 1HD ARG 546 -8.837 -3.899 0.586 793 HE ARG 546 HE ARG 546 -7.247 -1.894 1.545 794 HH11 ARG 546 1HH1 ARG 546 -10.081 -2.141 -0.519 795 HH12 ARG 546 2HH1 ARG 546 -10.593 -0.538 -0.292 796 HH21 ARG 546 1HH2 ARG 546 -7.897 0.262 1.949 797 HH22 ARG 546 2HH2 ARG 546 -9.287 0.917 1.196 798 H GLN 547 H GLN 547 -5.869 -8.069 2.074 799 HA GLN 547 HA GLN 547 -5.809 -10.317 0.201 800 HB2 GLN 547 2HB GLN 547 -4.056 -10.214 1.919 801 HB3 GLN 547 1HB GLN 547 -5.277 -10.118 3.163 802 HG2 GLN 547 2HG GLN 547 -4.282 -12.325 3.041 803 HG3 GLN 547 1HG GLN 547 -5.998 -12.371 2.670 804 HE21 GLN 547 1HE2 GLN 547 -5.713 -14.331 1.676 805 HE22 GLN 547 2HE2 GLN 547 -4.996 -14.528 0.115 806 H GLU 548 H GLU 548 -7.767 -11.141 -0.208 807 HA GLU 548 HA GLU 548 -10.025 -10.549 1.418 808 HB2 GLU 548 2HB GLU 548 -10.264 -10.788 -0.994 809 HB3 GLU 548 1HB GLU 548 -9.715 -12.452 -0.908 810 HG2 GLU 548 2HG GLU 548 -11.682 -13.063 0.357 811 HG3 GLU 548 1HG GLU 548 -12.223 -11.387 0.357 812 H GLU 549 H GLU 549 -8.244 -13.558 0.702 813 HA GLU 549 HA GLU 549 -9.589 -14.871 2.887 814 HB2 GLU 549 2HB GLU 549 -9.005 -16.182 0.853 815 HB3 GLU 549 1HB GLU 549 -7.306 -15.860 1.147 816 HG2 GLU 549 2HG GLU 549 -7.494 -17.068 3.315 817 HG3 GLU 549 1HG GLU 549 -9.157 -17.470 2.899 818 H ALA 550 H ALA 550 -8.933 -13.561 4.614 819 HA ALA 550 HA ALA 550 -6.117 -13.379 5.195 820 HB1 ALA 550 1HB ALA 550 -7.586 -11.502 5.779 821 HB2 ALA 550 2HB ALA 550 -6.834 -12.205 7.217 822 HB3 ALA 550 3HB ALA 550 -8.513 -12.582 6.832 823 H PHE 551 H PHE 551 -5.295 -15.246 5.691 824 HA PHE 551 HA PHE 551 -6.953 -17.139 7.092 825 HB2 PHE 551 2HB PHE 551 -5.801 -17.883 5.097 826 HB3 PHE 551 1HB PHE 551 -4.243 -17.555 5.854 827 HD1 PHE 551 1HD PHE 551 -3.423 -18.939 7.692 828 HD2 PHE 551 2HD PHE 551 -7.118 -19.776 5.782 829 HE1 PHE 551 1HE PHE 551 -3.454 -21.136 8.744 830 HE2 PHE 551 2HE PHE 551 -7.161 -21.990 6.834 831 HZ PHE 551 HZ PHE 551 -5.325 -22.678 8.320 832 H HIS 552 H HIS 552 -6.996 -16.991 9.078 833 HA HIS 552 HA HIS 552 -6.504 -16.881 11.242 834 HB2 HIS 552 2HB HIS 552 -5.530 -19.093 10.478 835 HB3 HIS 552 1HB HIS 552 -3.960 -18.314 10.464 836 HD1 HIS 552 1HD HIS 552 -6.467 -19.867 12.661 837 HD2 HIS 552 2HD HIS 552 -2.954 -17.707 13.092 838 HE1 HIS 552 1HE HIS 552 -5.765 -20.181 15.038 839 HE2 HIS 552 2HE HIS 552 -3.682 -18.855 15.293 840 HA PRO 553 HA PRO 553 -3.479 -13.349 10.976 841 HB2 PRO 553 2HB PRO 553 -5.151 -11.276 11.227 842 HB3 PRO 553 1HB PRO 553 -4.914 -12.061 9.663 843 HG2 PRO 553 2HG PRO 553 -7.170 -12.343 11.598 844 HG3 PRO 553 1HG PRO 553 -7.216 -12.275 9.827 845 HD2 PRO 553 2HD PRO 553 -7.329 -14.601 11.344 846 HD3 PRO 553 1HD PRO 553 -6.861 -14.531 9.636 847 H ARG 554 H ARG 554 -5.582 -14.724 13.092 848 HA ARG 554 HA ARG 554 -5.682 -14.962 15.322 849 HB2 ARG 554 2HB ARG 554 -3.289 -13.138 15.464 850 HB3 ARG 554 1HB ARG 554 -3.835 -14.229 16.724 851 HG2 ARG 554 2HG ARG 554 -3.346 -16.155 15.289 852 HG3 ARG 554 1HG ARG 554 -2.773 -15.060 14.032 853 HD2 ARG 554 2HD ARG 554 -1.066 -14.222 15.590 854 HD3 ARG 554 1HD ARG 554 -1.612 -15.396 16.787 855 HE ARG 554 HE ARG 554 -0.577 -16.185 14.151 856 HH11 ARG 554 1HH1 ARG 554 -0.630 -16.605 17.663 857 HH12 ARG 554 2HH1 ARG 554 0.552 -17.825 17.679 858 HH21 ARG 554 1HH2 ARG 554 1.056 -17.866 14.181 859 HH22 ARG 554 2HH2 ARG 554 1.524 -18.547 15.681 860 H GLU 555 H GLU 555 -7.570 -14.020 15.743 861 HA GLU 555 HA GLU 555 -7.549 -11.118 16.151 862 HB2 GLU 555 2HB GLU 555 -9.969 -11.128 15.692 863 HB3 GLU 555 1HB GLU 555 -9.013 -11.718 14.348 864 HG2 GLU 555 2HG GLU 555 -9.610 -14.019 14.951 865 HG3 GLU 555 1HG GLU 555 -10.589 -13.400 16.286 866 H MET 556 H MET 556 -7.118 -13.551 18.010 867 HA MET 556 HA MET 556 -9.123 -13.079 20.044 868 HB2 MET 556 2HB MET 556 -6.473 -14.547 20.297 869 HB3 MET 556 1HB MET 556 -7.787 -14.571 21.451 870 HG2 MET 556 2HG MET 556 -9.206 -15.702 19.811 871 HG3 MET 556 1HG MET 556 -7.866 -15.691 18.667 872 HE1 MET 556 3HE MET 556 -5.398 -16.273 20.767 873 HE2 MET 556 1HE MET 556 -5.523 -16.949 19.141 874 HE3 MET 556 2HE MET 556 -5.255 -18.007 20.528 875 H ASN 557 H ASN 557 -9.078 -11.348 21.264 876 HA ASN 557 HA ASN 557 -8.461 -9.497 22.329 877 HB2 ASN 557 2HB ASN 557 -6.985 -10.869 23.742 878 HB3 ASN 557 1HB ASN 557 -5.713 -10.782 22.529 879 HD21 ASN 557 1HD2 ASN 557 -4.285 -9.858 23.985 880 HD22 ASN 557 2HD2 ASN 557 -4.397 -8.228 24.518 881 H ALA 558 H ALA 558 -8.897 -8.238 20.691 882 HA ALA 558 HA ALA 558 -6.698 -6.809 19.547 883 HB1 ALA 558 1HB ALA 558 -8.732 -8.215 17.795 884 HB2 ALA 558 2HB ALA 558 -7.015 -8.598 17.893 885 HB3 ALA 558 3HB ALA 558 -7.535 -7.047 17.233 Start of MODEL 6 1 H1 GLY 448 1HT GLY 448 -19.329 -6.198 -21.324 2 H2 GLY 448 2HT GLY 448 -19.392 -4.529 -21.420 3 H3 GLY 448 3HT GLY 448 -20.183 -5.464 -22.588 4 HA2 GLY 448 1HA GLY 448 -21.753 -4.547 -21.008 5 HA3 GLY 448 2HA GLY 448 -21.685 -6.297 -20.874 6 H SER 449 H SER 449 -22.277 -6.405 -18.702 7 HA SER 449 HA SER 449 -20.904 -4.771 -16.797 8 HB2 SER 449 2HB SER 449 -22.304 -6.023 -15.148 9 HB3 SER 449 1HB SER 449 -23.241 -5.231 -16.414 10 HG SER 449 HG SER 449 -22.427 -7.827 -16.940 11 H VAL 450 H VAL 450 -18.852 -5.262 -16.487 12 HA VAL 450 HA VAL 450 -18.254 -7.998 -15.674 13 HB VAL 450 HB VAL 450 -17.152 -7.591 -17.833 14 HG11 VAL 450 1HG1 VAL 450 -17.023 -5.185 -17.824 15 HG12 VAL 450 2HG1 VAL 450 -15.415 -5.874 -18.091 16 HG13 VAL 450 3HG1 VAL 450 -15.850 -5.229 -16.509 17 HG21 VAL 450 3HG2 VAL 450 -14.820 -8.064 -17.222 18 HG22 VAL 450 1HG2 VAL 450 -15.951 -8.977 -16.225 19 HG23 VAL 450 2HG2 VAL 450 -15.160 -7.549 -15.567 20 H TYR 451 H TYR 451 -17.316 -8.213 -13.720 21 HA TYR 451 HA TYR 451 -16.436 -5.758 -12.376 22 HB2 TYR 451 2HB TYR 451 -18.016 -8.015 -11.121 23 HB3 TYR 451 1HB TYR 451 -17.461 -6.561 -10.314 24 HD1 TYR 451 1HD TYR 451 -18.549 -4.355 -10.886 25 HD2 TYR 451 2HD TYR 451 -20.042 -8.069 -12.337 26 HE1 TYR 451 1HE TYR 451 -20.721 -3.291 -11.381 27 HE2 TYR 451 2HE TYR 451 -22.200 -7.014 -12.838 28 HH TYR 451 HH TYR 451 -22.708 -3.670 -12.861 29 H ASN 452 H ASN 452 -14.443 -6.004 -11.488 30 HA ASN 452 HA ASN 452 -13.351 -8.688 -11.438 31 HB2 ASN 452 2HB ASN 452 -11.887 -6.983 -12.412 32 HB3 ASN 452 1HB ASN 452 -12.006 -6.008 -10.950 33 HD21 ASN 452 1HD2 ASN 452 -9.763 -6.037 -10.714 34 HD22 ASN 452 2HD2 ASN 452 -8.902 -7.427 -10.158 35 H THR 453 H THR 453 -14.582 -9.507 -9.829 36 HA THR 453 HA THR 453 -13.839 -8.571 -7.189 37 HB THR 453 HB THR 453 -16.164 -9.281 -6.433 38 HG1 THR 453 1HG THR 453 -17.727 -9.061 -8.234 39 HG21 THR 453 3HG2 THR 453 -17.202 -7.147 -7.136 40 HG22 THR 453 1HG2 THR 453 -15.939 -6.944 -8.349 41 HG23 THR 453 2HG2 THR 453 -15.526 -6.917 -6.637 42 H LYS 454 H LYS 454 -12.233 -10.148 -7.207 43 HA LYS 454 HA LYS 454 -13.257 -12.814 -6.566 44 HB2 LYS 454 2HB LYS 454 -10.615 -12.090 -7.894 45 HB3 LYS 454 1HB LYS 454 -10.959 -13.665 -7.216 46 HG2 LYS 454 2HG LYS 454 -11.194 -13.793 -9.589 47 HG3 LYS 454 1HG LYS 454 -12.797 -13.906 -8.877 48 HD2 LYS 454 2HD LYS 454 -13.177 -11.535 -9.416 49 HD3 LYS 454 1HD LYS 454 -11.569 -11.452 -10.140 50 HE2 LYS 454 2HE LYS 454 -13.277 -11.744 -11.846 51 HE3 LYS 454 1HE LYS 454 -12.212 -13.146 -11.778 52 HZ1 LYS 454 3HZ LYS 454 -14.523 -13.802 -11.973 53 HZ2 LYS 454 1HZ LYS 454 -14.927 -12.961 -10.578 54 HZ3 LYS 454 2HZ LYS 454 -13.934 -14.317 -10.483 55 H LYS 455 H LYS 455 -12.169 -13.782 -4.766 56 HA LYS 455 HA LYS 455 -11.063 -11.681 -3.153 57 HB2 LYS 455 2HB LYS 455 -12.131 -14.356 -2.283 58 HB3 LYS 455 1HB LYS 455 -11.417 -13.171 -1.188 59 HG2 LYS 455 2HG LYS 455 -13.093 -11.526 -1.910 60 HG3 LYS 455 1HG LYS 455 -13.840 -12.761 -2.917 61 HD2 LYS 455 2HD LYS 455 -14.313 -14.086 -0.931 62 HD3 LYS 455 1HD LYS 455 -13.535 -12.860 0.075 63 HE2 LYS 455 2HE LYS 455 -15.150 -11.192 -0.735 64 HE3 LYS 455 1HE LYS 455 -15.956 -12.443 -1.670 65 HZ1 LYS 455 3HZ LYS 455 -15.658 -12.438 1.273 66 HZ2 LYS 455 1HZ LYS 455 -16.475 -13.593 0.370 67 HZ3 LYS 455 2HZ LYS 455 -17.065 -12.017 0.443 68 H VAL 456 H VAL 456 -9.323 -11.601 -4.307 69 HA VAL 456 HA VAL 456 -7.206 -13.519 -3.625 70 HB VAL 456 HB VAL 456 -6.025 -12.649 -5.658 71 HG11 VAL 456 1HG1 VAL 456 -8.798 -13.702 -6.209 72 HG12 VAL 456 2HG1 VAL 456 -7.370 -14.676 -5.866 73 HG13 VAL 456 3HG1 VAL 456 -7.454 -13.724 -7.347 74 HG21 VAL 456 3HG2 VAL 456 -7.061 -10.428 -5.760 75 HG22 VAL 456 1HG2 VAL 456 -8.611 -11.164 -6.159 76 HG23 VAL 456 2HG2 VAL 456 -7.264 -11.277 -7.292 77 H GLY 457 H GLY 457 -5.016 -11.988 -4.018 78 HA2 GLY 457 2HA GLY 457 -5.378 -9.857 -2.067 79 HA3 GLY 457 1HA GLY 457 -3.839 -10.534 -2.595 80 H LYS 458 H LYS 458 -5.753 -7.893 -2.791 81 HA LYS 458 HA LYS 458 -5.015 -7.234 -5.565 82 HB2 LYS 458 2HB LYS 458 -6.813 -5.606 -3.734 83 HB3 LYS 458 1HB LYS 458 -6.529 -5.337 -5.430 84 HG2 LYS 458 2HG LYS 458 -8.697 -6.251 -5.225 85 HG3 LYS 458 1HG LYS 458 -7.682 -7.543 -5.860 86 HD2 LYS 458 2HD LYS 458 -7.508 -8.528 -3.653 87 HD3 LYS 458 1HD LYS 458 -8.430 -7.196 -2.957 88 HE2 LYS 458 2HE LYS 458 -9.439 -9.156 -5.009 89 HE3 LYS 458 1HE LYS 458 -9.786 -9.214 -3.282 90 HZ1 LYS 458 3HZ LYS 458 -11.588 -8.214 -4.482 91 HZ2 LYS 458 1HZ LYS 458 -10.588 -7.025 -5.137 92 HZ3 LYS 458 2HZ LYS 458 -10.884 -7.068 -3.482 93 H ARG 459 H ARG 459 -3.817 -5.417 -6.038 94 HA ARG 459 HA ARG 459 -2.624 -4.032 -3.744 95 HB2 ARG 459 2HB ARG 459 -1.459 -4.738 -6.428 96 HB3 ARG 459 1HB ARG 459 -0.747 -3.514 -5.395 97 HG2 ARG 459 2HG ARG 459 -0.209 -5.046 -3.746 98 HG3 ARG 459 1HG ARG 459 -1.182 -6.342 -4.389 99 HD2 ARG 459 2HD ARG 459 1.117 -6.797 -4.931 100 HD3 ARG 459 1HD ARG 459 0.343 -6.286 -6.419 101 HE ARG 459 HE ARG 459 1.991 -4.506 -4.759 102 HH11 ARG 459 1HH1 ARG 459 0.990 -5.682 -7.939 103 HH12 ARG 459 2HH1 ARG 459 2.134 -4.751 -8.797 104 HH21 ARG 459 1HH2 ARG 459 3.619 -3.210 -5.989 105 HH22 ARG 459 2HH2 ARG 459 3.604 -3.332 -7.665 106 H LEU 460 H LEU 460 -2.990 -1.980 -3.629 107 HA LEU 460 HA LEU 460 -4.075 -0.596 -6.001 108 HB2 LEU 460 2HB LEU 460 -4.990 -0.223 -3.142 109 HB3 LEU 460 1HB LEU 460 -5.407 0.861 -4.438 110 HG LEU 460 HG LEU 460 -6.619 -1.045 -5.553 111 HD11 LEU 460 1HD1 LEU 460 -7.254 -2.975 -4.217 112 HD12 LEU 460 2HD1 LEU 460 -6.173 -2.441 -2.930 113 HD13 LEU 460 3HD1 LEU 460 -5.512 -2.919 -4.493 114 HD21 LEU 460 3HD2 LEU 460 -7.813 0.646 -4.298 115 HD22 LEU 460 1HD2 LEU 460 -7.546 -0.251 -2.801 116 HD23 LEU 460 2HD2 LEU 460 -8.562 -0.933 -4.069 117 H ASN 461 H ASN 461 -3.469 1.478 -6.350 118 HA ASN 461 HA ASN 461 -1.175 2.413 -4.754 119 HB2 ASN 461 2HB ASN 461 -0.694 1.888 -7.138 120 HB3 ASN 461 1HB ASN 461 -1.921 3.053 -7.616 121 HD21 ASN 461 1HD2 ASN 461 1.276 2.602 -6.432 122 HD22 ASN 461 2HD2 ASN 461 1.796 4.237 -6.580 123 H ILE 462 H ILE 462 -1.714 4.028 -3.441 124 HA ILE 462 HA ILE 462 -3.815 5.884 -4.306 125 HB ILE 462 HB ILE 462 -2.896 5.305 -1.463 126 HG12 ILE 462 2HG1 ILE 462 -5.371 4.488 -1.211 127 HG13 ILE 462 1HG1 ILE 462 -5.345 4.394 -2.957 128 HG21 ILE 462 1HG2 ILE 462 -3.617 7.588 -1.721 129 HG22 ILE 462 2HG2 ILE 462 -4.782 6.685 -0.751 130 HG23 ILE 462 3HG2 ILE 462 -5.135 7.049 -2.438 131 HD11 ILE 462 3HD1 ILE 462 -4.963 2.242 -1.921 132 HD12 ILE 462 1HD1 ILE 462 -3.539 2.874 -1.101 133 HD13 ILE 462 2HD1 ILE 462 -3.553 2.749 -2.863 134 H GLN 463 H GLN 463 -3.043 7.826 -4.900 135 HA GLN 463 HA GLN 463 -0.499 8.701 -3.745 136 HB2 GLN 463 2HB GLN 463 -1.930 9.705 -6.200 137 HB3 GLN 463 1HB GLN 463 -0.546 10.511 -5.494 138 HG2 GLN 463 2HG GLN 463 0.777 8.508 -5.841 139 HG3 GLN 463 1HG GLN 463 -0.598 7.737 -6.654 140 HE21 GLN 463 1HE2 GLN 463 -1.363 10.344 -7.917 141 HE22 GLN 463 2HE2 GLN 463 -0.187 10.591 -9.146 142 H LEU 464 H LEU 464 -0.388 10.248 -2.366 143 HA LEU 464 HA LEU 464 -2.740 11.987 -2.090 144 HB2 LEU 464 2HB LEU 464 -0.801 11.186 0.086 145 HB3 LEU 464 1HB LEU 464 -2.099 12.328 0.292 146 HG LEU 464 HG LEU 464 -2.842 10.414 1.319 147 HD11 LEU 464 1HD1 LEU 464 -4.563 11.306 -0.027 148 HD12 LEU 464 2HD1 LEU 464 -4.703 9.546 0.015 149 HD13 LEU 464 3HD1 LEU 464 -4.043 10.344 -1.410 150 HD21 LEU 464 3HD2 LEU 464 -1.167 8.881 0.582 151 HD22 LEU 464 1HD2 LEU 464 -1.885 8.789 -1.026 152 HD23 LEU 464 2HD2 LEU 464 -2.764 8.152 0.370 153 H LYS 465 H LYS 465 -2.424 14.065 -2.243 154 HA LYS 465 HA LYS 465 0.308 15.126 -2.363 155 HB2 LYS 465 2HB LYS 465 -0.978 15.695 -4.288 156 HB3 LYS 465 1HB LYS 465 -2.361 16.253 -3.323 157 HG2 LYS 465 2HG LYS 465 -0.917 18.106 -2.513 158 HG3 LYS 465 1HG LYS 465 0.380 17.528 -3.562 159 HD2 LYS 465 2HD LYS 465 -2.354 18.454 -4.484 160 HD3 LYS 465 1HD LYS 465 -0.877 19.412 -4.559 161 HE2 LYS 465 2HE LYS 465 -1.324 16.784 -6.000 162 HE3 LYS 465 1HE LYS 465 -1.475 18.374 -6.729 163 HZ1 LYS 465 3HZ LYS 465 1.084 17.332 -5.559 164 HZ2 LYS 465 1HZ LYS 465 0.844 18.779 -6.361 165 HZ3 LYS 465 2HZ LYS 465 0.681 17.339 -7.183 166 H LYS 466 H LYS 466 0.873 16.683 -0.959 167 HA LYS 466 HA LYS 466 -0.317 16.499 1.595 168 HB2 LYS 466 2HB LYS 466 2.032 17.584 0.440 169 HB3 LYS 466 1HB LYS 466 1.384 18.684 1.649 170 HG2 LYS 466 2HG LYS 466 3.086 17.065 2.484 171 HG3 LYS 466 1HG LYS 466 1.557 17.041 3.346 172 HD2 LYS 466 2HD LYS 466 2.519 14.784 2.905 173 HD3 LYS 466 1HD LYS 466 0.909 14.986 2.228 174 HE2 LYS 466 2HE LYS 466 2.447 13.821 0.724 175 HE3 LYS 466 1HE LYS 466 1.866 15.334 0.041 176 HZ1 LYS 466 3HZ LYS 466 3.939 16.364 0.734 177 HZ2 LYS 466 1HZ LYS 466 4.123 15.090 -0.353 178 HZ3 LYS 466 2HZ LYS 466 4.491 14.842 1.296 179 H GLY 467 H GLY 467 -1.859 17.457 2.403 180 HA2 GLY 467 2HA GLY 467 -2.640 20.014 1.317 181 HA3 GLY 467 1HA GLY 467 -3.681 18.969 2.293 182 H THR 468 H THR 468 -4.085 20.441 3.912 183 HA THR 468 HA THR 468 -1.963 21.852 5.154 184 HB THR 468 HB THR 468 -4.877 21.572 5.930 185 HG1 THR 468 1HG THR 468 -3.378 23.146 4.191 186 HG21 THR 468 3HG2 THR 468 -3.451 22.343 7.804 187 HG22 THR 468 1HG2 THR 468 -4.508 23.629 7.218 188 HG23 THR 468 2HG2 THR 468 -2.801 23.619 6.772 189 H GLU 469 H GLU 469 -3.586 18.746 5.800 190 HA GLU 469 HA GLU 469 -2.399 18.692 8.455 191 HB2 GLU 469 2HB GLU 469 -4.332 16.839 7.103 192 HB3 GLU 469 1HB GLU 469 -3.754 16.675 8.753 193 HG2 GLU 469 2HG GLU 469 -5.356 18.973 7.661 194 HG3 GLU 469 1HG GLU 469 -5.957 17.672 8.696 195 H GLY 470 H GLY 470 -1.269 18.081 5.548 196 HA2 GLY 470 2HA GLY 470 0.718 16.955 5.039 197 HA3 GLY 470 1HA GLY 470 0.580 16.079 6.555 198 H LEU 471 H LEU 471 0.420 13.981 6.185 199 HA LEU 471 HA LEU 471 -0.907 13.049 3.797 200 HB2 LEU 471 2HB LEU 471 0.553 11.558 5.991 201 HB3 LEU 471 1HB LEU 471 -0.304 10.750 4.715 202 HG LEU 471 HG LEU 471 1.999 10.686 4.227 203 HD11 LEU 471 1HD1 LEU 471 0.642 12.673 2.442 204 HD12 LEU 471 2HD1 LEU 471 0.622 10.914 2.323 205 HD13 LEU 471 3HD1 LEU 471 2.125 11.798 2.061 206 HD21 LEU 471 3HD2 LEU 471 2.837 12.519 5.571 207 HD22 LEU 471 1HD2 LEU 471 2.031 13.684 4.536 208 HD23 LEU 471 2HD2 LEU 471 3.378 12.729 3.900 209 H GLY 472 H GLY 472 -1.170 12.637 7.274 210 HA2 GLY 472 2HA GLY 472 -3.192 12.711 8.474 211 HA3 GLY 472 1HA GLY 472 -4.057 12.445 6.969 212 H PHE 473 H PHE 473 -1.357 10.356 7.771 213 HA PHE 473 HA PHE 473 -3.076 8.484 9.086 214 HB2 PHE 473 2HB PHE 473 -2.759 6.617 7.546 215 HB3 PHE 473 1HB PHE 473 -3.564 7.945 6.734 216 HD1 PHE 473 1HD PHE 473 -2.128 9.424 5.233 217 HD2 PHE 473 2HD PHE 473 -0.860 5.617 6.653 218 HE1 PHE 473 1HE PHE 473 -0.499 9.275 3.397 219 HE2 PHE 473 2HE PHE 473 0.781 5.489 4.844 220 HZ PHE 473 HZ PHE 473 0.945 7.337 3.205 221 H SER 474 H SER 474 -1.973 6.653 9.887 222 HA SER 474 HA SER 474 0.932 7.058 10.189 223 HB2 SER 474 2HB SER 474 -1.018 6.199 12.346 224 HB3 SER 474 1HB SER 474 0.715 6.442 12.540 225 HG SER 474 HG SER 474 -0.172 8.683 11.545 226 H ILE 475 H ILE 475 2.063 4.999 10.761 227 HA ILE 475 HA ILE 475 0.605 2.590 9.871 228 HB ILE 475 HB ILE 475 2.846 1.738 9.258 229 HG12 ILE 475 2HG1 ILE 475 3.648 4.623 9.500 230 HG13 ILE 475 1HG1 ILE 475 4.083 3.240 10.529 231 HG21 ILE 475 1HG2 ILE 475 1.321 2.354 7.545 232 HG22 ILE 475 2HG2 ILE 475 2.953 2.787 7.084 233 HG23 ILE 475 3HG2 ILE 475 1.829 4.054 7.615 234 HD11 ILE 475 3HD1 ILE 475 5.881 3.960 8.861 235 HD12 ILE 475 1HD1 ILE 475 4.800 3.481 7.588 236 HD13 ILE 475 2HD1 ILE 475 5.389 2.263 8.710 237 H THR 476 H THR 476 1.041 0.729 11.027 238 HA THR 476 HA THR 476 2.751 0.891 13.404 239 HB THR 476 HB THR 476 0.377 1.047 14.152 240 HG1 THR 476 1HG THR 476 2.026 -0.354 15.291 241 HG21 THR 476 3HG2 THR 476 -0.703 -0.087 12.256 242 HG22 THR 476 1HG2 THR 476 -1.182 -0.819 13.789 243 HG23 THR 476 2HG2 THR 476 0.013 -1.616 12.763 244 H SER 477 H SER 477 3.589 -1.250 14.035 245 HA SER 477 HA SER 477 3.331 -3.263 11.940 246 HB2 SER 477 2HB SER 477 5.688 -3.860 12.414 247 HB3 SER 477 1HB SER 477 5.540 -2.282 11.691 248 HG SER 477 HG SER 477 6.851 -2.761 13.731 249 H ARG 478 H ARG 478 3.219 -5.331 12.659 250 HA ARG 478 HA ARG 478 2.974 -5.655 15.589 251 HB2 ARG 478 2HB ARG 478 1.253 -7.321 15.205 252 HB3 ARG 478 1HB ARG 478 0.761 -5.754 14.593 253 HG2 ARG 478 2HG ARG 478 1.129 -6.452 12.329 254 HG3 ARG 478 1HG ARG 478 1.879 -7.956 12.865 255 HD2 ARG 478 2HD ARG 478 -0.394 -8.366 12.148 256 HD3 ARG 478 1HD ARG 478 -0.223 -8.646 13.876 257 HE ARG 478 HE ARG 478 -1.382 -6.171 12.779 258 HH11 ARG 478 1HH1 ARG 478 -1.584 -8.934 14.994 259 HH12 ARG 478 2HH1 ARG 478 -2.994 -8.363 15.771 260 HH21 ARG 478 1HH2 ARG 478 -3.330 -5.453 13.820 261 HH22 ARG 478 2HH2 ARG 478 -3.999 -6.365 15.107 262 H ASP 479 H ASP 479 4.270 -6.880 16.465 263 HA ASP 479 HA ASP 479 5.645 -8.946 14.968 264 HB2 ASP 479 2HB ASP 479 6.829 -7.601 16.766 265 HB3 ASP 479 1HB ASP 479 5.707 -8.271 17.942 266 H VAL 480 H VAL 480 5.407 -11.244 15.927 267 HA VAL 480 HA VAL 480 4.048 -13.012 16.339 268 HB VAL 480 HB VAL 480 2.278 -11.089 17.895 269 HG11 VAL 480 1HG1 VAL 480 1.172 -13.153 17.399 270 HG12 VAL 480 2HG1 VAL 480 1.533 -13.041 19.124 271 HG13 VAL 480 3HG1 VAL 480 2.520 -14.070 18.078 272 HG21 VAL 480 3HG2 VAL 480 3.470 -11.817 19.924 273 HG22 VAL 480 1HG2 VAL 480 4.493 -10.956 18.778 274 HG23 VAL 480 2HG2 VAL 480 4.611 -12.716 18.907 275 H THR 481 H THR 481 3.493 -13.216 14.192 276 HA THR 481 HA THR 481 0.825 -12.934 13.399 277 HB THR 481 HB THR 481 1.401 -10.509 13.379 278 HG1 THR 481 1HG THR 481 -0.055 -10.924 11.895 279 HG21 THR 481 3HG2 THR 481 3.509 -11.279 11.354 280 HG22 THR 481 1HG2 THR 481 3.804 -10.658 12.976 281 HG23 THR 481 2HG2 THR 481 3.052 -9.626 11.764 282 H ILE 482 H ILE 482 1.379 -12.662 10.615 283 HA ILE 482 HA ILE 482 2.216 -15.254 9.949 284 HB ILE 482 HB ILE 482 0.782 -13.982 8.428 285 HG12 ILE 482 2HG1 ILE 482 3.429 -14.610 7.086 286 HG13 ILE 482 1HG1 ILE 482 2.172 -15.781 7.450 287 HG21 ILE 482 1HG2 ILE 482 1.633 -11.750 8.780 288 HG22 ILE 482 2HG2 ILE 482 1.623 -12.126 7.055 289 HG23 ILE 482 3HG2 ILE 482 3.138 -12.164 7.959 290 HD11 ILE 482 3HD1 ILE 482 2.143 -15.147 5.106 291 HD12 ILE 482 1HD1 ILE 482 1.923 -13.455 5.556 292 HD13 ILE 482 2HD1 ILE 482 0.661 -14.635 5.913 293 H GLY 483 H GLY 483 4.013 -12.255 10.059 294 HA2 GLY 483 2HA GLY 483 6.247 -12.144 10.767 295 HA3 GLY 483 1HA GLY 483 6.441 -13.824 10.302 296 H GLY 484 H GLY 484 8.425 -12.879 9.443 297 HA2 GLY 484 2HA GLY 484 9.191 -13.105 7.110 298 HA3 GLY 484 1HA GLY 484 7.961 -11.917 6.695 299 H SER 485 H SER 485 8.214 -9.761 7.562 300 HA SER 485 HA SER 485 10.985 -9.036 8.230 301 HB2 SER 485 2HB SER 485 9.341 -7.741 6.041 302 HB3 SER 485 1HB SER 485 10.997 -7.338 6.498 303 HG SER 485 HG SER 485 10.260 -9.001 4.692 304 H ALA 486 H ALA 486 8.272 -9.106 9.597 305 HA ALA 486 HA ALA 486 6.945 -7.949 10.943 306 HB1 ALA 486 1HB ALA 486 7.713 -5.871 12.009 307 HB2 ALA 486 2HB ALA 486 8.982 -5.706 10.793 308 HB3 ALA 486 3HB ALA 486 9.028 -7.044 11.944 309 HA PRO 487 HA PRO 487 4.852 -6.052 7.477 310 HB2 PRO 487 2HB PRO 487 2.360 -6.806 8.193 311 HB3 PRO 487 1HB PRO 487 3.499 -7.895 7.401 312 HG2 PRO 487 2HG PRO 487 2.765 -7.700 10.285 313 HG3 PRO 487 1HG PRO 487 3.078 -9.141 9.302 314 HD2 PRO 487 2HD PRO 487 4.888 -8.041 11.034 315 HD3 PRO 487 1HD PRO 487 5.343 -9.001 9.613 316 H ILE 488 H ILE 488 4.099 -4.106 7.227 317 HA ILE 488 HA ILE 488 3.270 -2.541 9.537 318 HB ILE 488 HB ILE 488 4.274 -1.688 6.777 319 HG12 ILE 488 2HG1 ILE 488 5.919 -2.394 8.630 320 HG13 ILE 488 1HG1 ILE 488 6.121 -0.812 7.881 321 HG21 ILE 488 1HG2 ILE 488 4.042 0.585 7.492 322 HG22 ILE 488 2HG2 ILE 488 3.204 -0.030 8.933 323 HG23 ILE 488 3HG2 ILE 488 2.483 -0.259 7.339 324 HD11 ILE 488 3HD1 ILE 488 5.254 0.309 9.752 325 HD12 ILE 488 1HD1 ILE 488 6.412 -0.862 10.364 326 HD13 ILE 488 2HD1 ILE 488 4.683 -1.202 10.481 327 H TYR 489 H TYR 489 1.303 -1.819 9.758 328 HA TYR 489 HA TYR 489 -0.562 -1.897 7.483 329 HB2 TYR 489 2HB TYR 489 -1.199 -2.569 10.375 330 HB3 TYR 489 1HB TYR 489 -2.369 -2.481 9.064 331 HD1 TYR 489 2HD TYR 489 0.362 -4.403 10.525 332 HD2 TYR 489 1HD TYR 489 -2.526 -4.219 7.424 333 HE1 TYR 489 2HE TYR 489 0.815 -6.720 10.031 334 HE2 TYR 489 1HE TYR 489 -2.085 -6.600 6.871 335 HH TYR 489 HH TYR 489 -0.376 -8.626 8.970 336 H VAL 490 H VAL 490 -1.986 -0.176 7.428 337 HA VAL 490 HA VAL 490 -1.116 2.204 8.668 338 HB VAL 490 HB VAL 490 -3.791 1.623 7.357 339 HG11 VAL 490 1HG1 VAL 490 -2.494 4.264 8.053 340 HG12 VAL 490 2HG1 VAL 490 -3.916 3.573 8.836 341 HG13 VAL 490 3HG1 VAL 490 -3.990 4.062 7.143 342 HG21 VAL 490 3HG2 VAL 490 -1.896 1.320 5.858 343 HG22 VAL 490 1HG2 VAL 490 -1.293 2.926 6.281 344 HG23 VAL 490 2HG2 VAL 490 -2.832 2.753 5.432 345 H LYS 491 H LYS 491 -1.338 2.801 10.632 346 HA LYS 491 HA LYS 491 -2.907 1.276 12.499 347 HB2 LYS 491 2HB LYS 491 -0.682 2.168 13.056 348 HB3 LYS 491 1HB LYS 491 -1.319 3.789 12.924 349 HG2 LYS 491 2HG LYS 491 -2.817 3.429 14.797 350 HG3 LYS 491 1HG LYS 491 -2.292 1.753 14.930 351 HD2 LYS 491 2HD LYS 491 -1.218 3.144 16.623 352 HD3 LYS 491 1HD LYS 491 -0.025 2.515 15.494 353 HE2 LYS 491 2HE LYS 491 -0.017 4.668 14.320 354 HE3 LYS 491 1HE LYS 491 -1.222 5.286 15.450 355 HZ1 LYS 491 3HZ LYS 491 0.375 5.004 17.237 356 HZ2 LYS 491 1HZ LYS 491 1.015 5.982 16.026 357 HZ3 LYS 491 2HZ LYS 491 1.516 4.374 16.178 358 H ASN 492 H ASN 492 -3.224 4.412 10.948 359 HA ASN 492 HA ASN 492 -5.927 4.656 11.866 360 HB2 ASN 492 2HB ASN 492 -4.761 5.344 13.913 361 HB3 ASN 492 1HB ASN 492 -3.854 6.545 13.009 362 HD21 ASN 492 1HD2 ASN 492 -4.615 8.233 14.228 363 HD22 ASN 492 2HD2 ASN 492 -6.232 8.817 14.156 364 H ILE 493 H ILE 493 -7.003 5.829 10.473 365 HA ILE 493 HA ILE 493 -5.593 7.635 8.651 366 HB ILE 493 HB ILE 493 -8.415 6.497 8.567 367 HG12 ILE 493 2HG1 ILE 493 -6.696 4.828 8.007 368 HG13 ILE 493 1HG1 ILE 493 -7.720 5.240 6.634 369 HG21 ILE 493 1HG2 ILE 493 -7.025 8.284 6.579 370 HG22 ILE 493 2HG2 ILE 493 -8.395 8.700 7.605 371 HG23 ILE 493 3HG2 ILE 493 -8.585 7.505 6.322 372 HD11 ILE 493 3HD1 ILE 493 -5.408 5.008 5.958 373 HD12 ILE 493 1HD1 ILE 493 -4.922 6.243 7.120 374 HD13 ILE 493 2HD1 ILE 493 -5.948 6.674 5.752 375 H LEU 494 H LEU 494 -5.535 9.616 9.433 376 HA LEU 494 HA LEU 494 -7.152 10.450 11.594 377 HB2 LEU 494 2HB LEU 494 -5.204 11.946 9.838 378 HB3 LEU 494 1HB LEU 494 -6.087 12.733 11.119 379 HG LEU 494 HG LEU 494 -4.950 11.265 12.781 380 HD11 LEU 494 1HD1 LEU 494 -3.343 10.268 10.442 381 HD12 LEU 494 2HD1 LEU 494 -4.484 9.323 11.399 382 HD13 LEU 494 3HD1 LEU 494 -3.007 9.941 12.143 383 HD21 LEU 494 3HD2 LEU 494 -4.045 13.453 12.283 384 HD22 LEU 494 1HD2 LEU 494 -3.100 12.784 10.955 385 HD23 LEU 494 2HD2 LEU 494 -2.747 12.307 12.615 386 HA PRO 495 HA PRO 495 -10.825 11.798 9.564 387 HB2 PRO 495 2HB PRO 495 -11.401 13.955 11.224 388 HB3 PRO 495 1HB PRO 495 -11.870 12.283 11.531 389 HG2 PRO 495 2HG PRO 495 -9.558 13.834 12.609 390 HG3 PRO 495 1HG PRO 495 -10.578 12.630 13.412 391 HD2 PRO 495 2HD PRO 495 -8.115 12.025 12.574 392 HD3 PRO 495 1HD PRO 495 -9.435 10.844 12.463 393 H ARG 496 H ARG 496 -8.209 13.976 10.138 394 HA ARG 496 HA ARG 496 -9.122 15.591 7.873 395 HB2 ARG 496 2HB ARG 496 -7.614 16.571 10.308 396 HB3 ARG 496 1HB ARG 496 -8.020 17.540 8.897 397 HG2 ARG 496 2HG ARG 496 -10.005 16.271 10.766 398 HG3 ARG 496 1HG ARG 496 -9.539 17.972 10.772 399 HD2 ARG 496 2HD ARG 496 -10.412 18.214 8.492 400 HD3 ARG 496 1HD ARG 496 -10.828 16.507 8.471 401 HE ARG 496 HE ARG 496 -12.123 17.442 10.636 402 HH11 ARG 496 1HH1 ARG 496 -12.045 18.433 7.242 403 HH12 ARG 496 2HH1 ARG 496 -13.661 18.960 7.192 404 HH21 ARG 496 1HH2 ARG 496 -14.356 18.158 10.586 405 HH22 ARG 496 2HH2 ARG 496 -15.024 18.790 9.159 406 H GLY 497 H GLY 497 -7.879 15.215 6.213 407 HA2 GLY 497 2HA GLY 497 -5.383 15.826 5.814 408 HA3 GLY 497 1HA GLY 497 -5.135 14.257 6.553 409 H ALA 498 H ALA 498 -4.179 14.466 4.199 410 HA ALA 498 HA ALA 498 -5.811 14.417 1.939 411 HB1 ALA 498 1HB ALA 498 -3.057 13.223 2.236 412 HB2 ALA 498 2HB ALA 498 -3.412 14.912 1.899 413 HB3 ALA 498 3HB ALA 498 -3.856 13.669 0.728 414 H ALA 499 H ALA 499 -4.537 11.753 3.852 415 HA ALA 499 HA ALA 499 -5.223 9.682 2.099 416 HB1 ALA 499 1HB ALA 499 -3.634 9.358 3.901 417 HB2 ALA 499 2HB ALA 499 -4.937 8.176 4.003 418 HB3 ALA 499 3HB ALA 499 -4.919 9.564 5.091 419 H ILE 500 H ILE 500 -7.132 11.098 4.752 420 HA ILE 500 HA ILE 500 -9.164 9.108 4.408 421 HB ILE 500 HB ILE 500 -8.803 10.292 6.627 422 HG12 ILE 500 2HG1 ILE 500 -11.578 10.403 5.423 423 HG13 ILE 500 1HG1 ILE 500 -10.827 9.007 6.152 424 HG21 ILE 500 1HG2 ILE 500 -8.504 12.562 5.798 425 HG22 ILE 500 2HG2 ILE 500 -9.824 12.489 6.969 426 HG23 ILE 500 3HG2 ILE 500 -10.175 12.592 5.245 427 HD11 ILE 500 3HD1 ILE 500 -11.549 11.542 7.593 428 HD12 ILE 500 1HD1 ILE 500 -10.799 10.111 8.316 429 HD13 ILE 500 2HD1 ILE 500 -12.434 10.020 7.659 430 H GLN 501 H GLN 501 -8.570 12.296 3.196 431 HA GLN 501 HA GLN 501 -11.187 12.691 2.171 432 HB2 GLN 501 2HB GLN 501 -8.591 14.048 1.570 433 HB3 GLN 501 1HB GLN 501 -10.149 14.611 0.957 434 HG2 GLN 501 2HG GLN 501 -10.929 14.875 3.289 435 HG3 GLN 501 1HG GLN 501 -9.339 14.381 3.851 436 HE21 GLN 501 1HE2 GLN 501 -11.190 16.840 2.366 437 HE22 GLN 501 2HE2 GLN 501 -10.048 18.124 2.515 438 H ASP 502 H ASP 502 -8.360 11.127 1.016 439 HA ASP 502 HA ASP 502 -9.380 10.830 -1.679 440 HB2 ASP 502 2HB ASP 502 -6.982 10.723 -1.406 441 HB3 ASP 502 1HB ASP 502 -7.135 9.479 -0.172 442 H GLY 503 H GLY 503 -8.918 8.764 1.144 443 HA2 GLY 503 2HA GLY 503 -10.430 7.283 2.064 444 HA3 GLY 503 1HA GLY 503 -11.513 7.604 0.732 445 H ARG 504 H ARG 504 -8.576 6.636 -0.704 446 HA ARG 504 HA ARG 504 -9.710 3.979 -1.030 447 HB2 ARG 504 2HB ARG 504 -7.159 5.120 -2.190 448 HB3 ARG 504 1HB ARG 504 -7.953 3.636 -2.705 449 HG2 ARG 504 2HG ARG 504 -9.023 6.434 -2.981 450 HG3 ARG 504 1HG ARG 504 -8.339 5.452 -4.272 451 HD2 ARG 504 2HD ARG 504 -10.145 3.863 -4.050 452 HD3 ARG 504 1HD ARG 504 -10.792 4.759 -2.672 453 HE ARG 504 HE ARG 504 -10.651 6.599 -4.637 454 HH11 ARG 504 1HH1 ARG 504 -12.224 3.433 -4.430 455 HH12 ARG 504 2HH1 ARG 504 -13.527 3.861 -5.434 456 HH21 ARG 504 1HH2 ARG 504 -12.486 7.170 -6.027 457 HH22 ARG 504 2HH2 ARG 504 -13.660 5.987 -6.365 458 H LEU 505 H LEU 505 -7.259 5.564 0.679 459 HA LEU 505 HA LEU 505 -5.953 3.136 1.610 460 HB2 LEU 505 2HB LEU 505 -4.635 5.136 1.054 461 HB3 LEU 505 1HB LEU 505 -5.541 6.066 2.223 462 HG LEU 505 HG LEU 505 -4.561 4.723 4.037 463 HD11 LEU 505 1HD1 LEU 505 -2.978 3.442 1.812 464 HD12 LEU 505 2HD1 LEU 505 -4.118 2.623 2.893 465 HD13 LEU 505 3HD1 LEU 505 -2.621 3.313 3.523 466 HD21 LEU 505 3HD2 LEU 505 -2.569 5.943 2.147 467 HD22 LEU 505 1HD2 LEU 505 -2.312 5.639 3.862 468 HD23 LEU 505 2HD2 LEU 505 -3.527 6.808 3.346 469 H LYS 506 H LYS 506 -6.229 2.350 3.775 470 HA LYS 506 HA LYS 506 -8.133 3.752 5.450 471 HB2 LYS 506 2HB LYS 506 -8.562 0.937 4.424 472 HB3 LYS 506 1HB LYS 506 -9.429 1.616 5.789 473 HG2 LYS 506 2HG LYS 506 -9.511 2.709 2.975 474 HG3 LYS 506 1HG LYS 506 -10.731 1.659 3.697 475 HD2 LYS 506 2HD LYS 506 -11.210 3.343 5.391 476 HD3 LYS 506 1HD LYS 506 -9.944 4.384 4.748 477 HE2 LYS 506 2HE LYS 506 -12.159 5.100 4.019 478 HE3 LYS 506 1HE LYS 506 -11.165 4.592 2.655 479 HZ1 LYS 506 3HZ LYS 506 -13.424 3.773 2.480 480 HZ2 LYS 506 1HZ LYS 506 -13.308 2.994 3.956 481 HZ3 LYS 506 2HZ LYS 506 -12.375 2.463 2.663 482 H ALA 507 H ALA 507 -8.381 2.443 7.575 483 HA ALA 507 HA ALA 507 -5.706 1.822 8.413 484 HB1 ALA 507 1HB ALA 507 -6.598 1.675 10.670 485 HB2 ALA 507 2HB ALA 507 -8.245 1.727 10.050 486 HB3 ALA 507 3HB ALA 507 -7.200 3.139 9.891 487 H GLY 508 H GLY 508 -4.826 -0.046 8.751 488 HA2 GLY 508 2HA GLY 508 -4.845 -2.327 9.395 489 HA3 GLY 508 1HA GLY 508 -6.491 -2.491 8.856 490 H ASP 509 H ASP 509 -4.932 -0.799 6.466 491 HA ASP 509 HA ASP 509 -4.511 -3.294 5.105 492 HB2 ASP 509 2HB ASP 509 -4.262 -1.973 3.009 493 HB3 ASP 509 1HB ASP 509 -5.767 -1.679 3.872 494 H ARG 510 H ARG 510 -2.607 -3.507 3.726 495 HA ARG 510 HA ARG 510 -0.372 -2.840 5.480 496 HB2 ARG 510 2HB ARG 510 -0.630 -5.198 5.448 497 HB3 ARG 510 1HB ARG 510 -0.708 -5.283 3.702 498 HG2 ARG 510 2HG ARG 510 1.624 -4.551 3.561 499 HG3 ARG 510 1HG ARG 510 1.695 -4.414 5.314 500 HD2 ARG 510 2HD ARG 510 1.353 -6.816 5.517 501 HD3 ARG 510 1HD ARG 510 1.217 -6.968 3.762 502 HE ARG 510 HE ARG 510 3.615 -5.702 4.226 503 HH11 ARG 510 1HH1 ARG 510 2.282 -8.874 5.152 504 HH12 ARG 510 2HH1 ARG 510 3.818 -9.622 5.158 505 HH21 ARG 510 1HH2 ARG 510 5.670 -6.774 4.249 506 HH22 ARG 510 2HH2 ARG 510 5.755 -8.432 4.641 507 H LEU 511 H LEU 511 1.082 -1.578 4.866 508 HA LEU 511 HA LEU 511 1.061 -0.427 2.247 509 HB2 LEU 511 2HB LEU 511 1.695 0.643 4.666 510 HB3 LEU 511 1HB LEU 511 3.229 -0.072 4.309 511 HG LEU 511 HG LEU 511 1.934 2.031 2.573 512 HD11 LEU 511 1HD1 LEU 511 2.463 2.940 4.734 513 HD12 LEU 511 2HD1 LEU 511 3.581 3.559 3.531 514 HD13 LEU 511 3HD1 LEU 511 4.103 2.294 4.640 515 HD21 LEU 511 3HD2 LEU 511 4.761 0.982 2.590 516 HD22 LEU 511 1HD2 LEU 511 4.127 2.255 1.552 517 HD23 LEU 511 2HD2 LEU 511 3.541 0.601 1.363 518 H ILE 512 H ILE 512 2.114 -1.268 0.538 519 HA ILE 512 HA ILE 512 3.935 -3.556 0.869 520 HB ILE 512 HB ILE 512 2.473 -2.449 -1.517 521 HG12 ILE 512 2HG1 ILE 512 1.010 -3.549 0.116 522 HG13 ILE 512 1HG1 ILE 512 1.074 -4.421 -1.397 523 HG21 ILE 512 1HG2 ILE 512 4.175 -4.949 -1.365 524 HG22 ILE 512 2HG2 ILE 512 4.541 -3.486 -2.281 525 HG23 ILE 512 3HG2 ILE 512 3.171 -4.492 -2.741 526 HD11 ILE 512 3HD1 ILE 512 2.572 -6.039 -0.491 527 HD12 ILE 512 1HD1 ILE 512 1.146 -5.945 0.520 528 HD13 ILE 512 2HD1 ILE 512 2.654 -5.201 1.068 529 H GLU 513 H GLU 513 3.691 -0.486 -0.889 530 HA GLU 513 HA GLU 513 6.514 -0.115 -0.806 531 HB2 GLU 513 2HB GLU 513 6.819 -0.056 -3.253 532 HB3 GLU 513 1HB GLU 513 6.348 -1.653 -2.672 533 HG2 GLU 513 2HG GLU 513 4.084 -1.168 -3.267 534 HG3 GLU 513 1HG GLU 513 4.616 0.365 -3.980 535 H VAL 514 H VAL 514 7.133 1.897 -1.494 536 HA VAL 514 HA VAL 514 4.911 3.797 -1.690 537 HB VAL 514 HB VAL 514 5.844 3.820 0.616 538 HG11 VAL 514 1HG1 VAL 514 8.088 4.801 1.026 539 HG12 VAL 514 2HG1 VAL 514 8.383 4.696 -0.728 540 HG13 VAL 514 3HG1 VAL 514 8.131 3.238 0.200 541 HG21 VAL 514 3HG2 VAL 514 6.100 6.247 0.809 542 HG22 VAL 514 1HG2 VAL 514 4.802 5.806 -0.307 543 HG23 VAL 514 2HG2 VAL 514 6.354 6.347 -0.940 544 H ASN 515 H ASN 515 5.025 5.122 -3.289 545 HA ASN 515 HA ASN 515 5.719 6.384 -5.093 546 HB2 ASN 515 2HB ASN 515 8.385 6.406 -3.649 547 HB3 ASN 515 1HB ASN 515 7.948 7.452 -4.996 548 HD21 ASN 515 1HD2 ASN 515 8.737 8.110 -2.256 549 HD22 ASN 515 2HD2 ASN 515 7.432 9.032 -1.605 550 H GLY 516 H GLY 516 6.440 3.346 -4.819 551 HA2 GLY 516 2HA GLY 516 6.830 2.061 -6.822 552 HA3 GLY 516 1HA GLY 516 8.001 3.281 -7.311 553 H VAL 517 H VAL 517 8.640 3.097 -4.143 554 HA VAL 517 HA VAL 517 10.796 1.206 -4.584 555 HB VAL 517 HB VAL 517 10.212 2.998 -2.203 556 HG11 VAL 517 1HG1 VAL 517 12.713 1.471 -2.938 557 HG12 VAL 517 2HG1 VAL 517 11.606 1.086 -1.624 558 HG13 VAL 517 3HG1 VAL 517 12.547 2.575 -1.574 559 HG21 VAL 517 3HG2 VAL 517 10.640 4.339 -4.194 560 HG22 VAL 517 1HG2 VAL 517 12.122 3.435 -4.502 561 HG23 VAL 517 2HG2 VAL 517 11.996 4.458 -3.074 562 H ASP 518 H ASP 518 10.545 -0.813 -4.032 563 HA ASP 518 HA ASP 518 8.240 -1.598 -2.523 564 HB2 ASP 518 2HB ASP 518 8.919 -3.927 -2.960 565 HB3 ASP 518 1HB ASP 518 8.848 -2.972 -4.435 566 H LEU 519 H LEU 519 8.089 -2.456 -0.573 567 HA LEU 519 HA LEU 519 10.514 -2.563 1.028 568 HB2 LEU 519 2HB LEU 519 9.373 -1.122 2.707 569 HB3 LEU 519 1HB LEU 519 9.857 -0.314 1.231 570 HG LEU 519 HG LEU 519 7.429 -0.927 0.530 571 HD11 LEU 519 1HD1 LEU 519 6.967 -0.623 3.456 572 HD12 LEU 519 2HD1 LEU 519 6.755 -2.104 2.492 573 HD13 LEU 519 3HD1 LEU 519 5.776 -0.670 2.171 574 HD21 LEU 519 3HD2 LEU 519 8.081 1.483 2.208 575 HD22 LEU 519 1HD2 LEU 519 6.692 1.286 1.116 576 HD23 LEU 519 2HD2 LEU 519 8.315 1.248 0.459 577 H ALA 520 H ALA 520 8.272 -4.352 -0.029 578 HA ALA 520 HA ALA 520 6.832 -5.250 2.265 579 HB1 ALA 520 1HB ALA 520 5.973 -5.575 -0.014 580 HB2 ALA 520 2HB ALA 520 6.110 -7.108 0.846 581 HB3 ALA 520 3HB ALA 520 7.314 -6.664 -0.361 582 H GLY 521 H GLY 521 9.899 -5.967 0.850 583 HA2 GLY 521 2HA GLY 521 10.303 -8.216 2.688 584 HA3 GLY 521 1HA GLY 521 11.352 -7.801 1.340 585 H LYS 522 H LYS 522 10.428 -5.053 2.947 586 HA LYS 522 HA LYS 522 13.008 -4.925 4.275 587 HB2 LYS 522 2HB LYS 522 11.027 -2.784 3.525 588 HB3 LYS 522 1HB LYS 522 12.407 -2.484 4.569 589 HG2 LYS 522 2HG LYS 522 12.551 -3.490 1.736 590 HG3 LYS 522 1HG LYS 522 12.816 -1.820 2.251 591 HD2 LYS 522 2HD LYS 522 14.664 -2.602 3.699 592 HD3 LYS 522 1HD LYS 522 14.436 -4.225 3.094 593 HE2 LYS 522 2HE LYS 522 14.915 -3.461 0.797 594 HE3 LYS 522 1HE LYS 522 15.152 -1.829 1.401 595 HZ1 LYS 522 3HZ LYS 522 17.260 -2.984 1.084 596 HZ2 LYS 522 1HZ LYS 522 16.800 -4.170 2.183 597 HZ3 LYS 522 2HZ LYS 522 17.014 -2.588 2.696 598 H SER 523 H SER 523 13.130 -4.004 6.374 599 HA SER 523 HA SER 523 11.162 -5.247 7.992 600 HB2 SER 523 2HB SER 523 13.709 -3.809 8.567 601 HB3 SER 523 1HB SER 523 12.738 -4.634 9.818 602 HG SER 523 HG SER 523 12.988 -6.412 8.034 603 H GLN 524 H GLN 524 10.236 -4.090 9.836 604 HA GLN 524 HA GLN 524 8.695 -1.920 9.176 605 HB2 GLN 524 2HB GLN 524 8.165 -1.703 11.538 606 HB3 GLN 524 1HB GLN 524 8.259 -3.402 11.105 607 HG2 GLN 524 2HG GLN 524 10.483 -3.528 12.046 608 HG3 GLN 524 1HG GLN 524 10.441 -1.834 12.483 609 HE21 GLN 524 1HE2 GLN 524 10.591 -2.068 14.597 610 HE22 GLN 524 2HE2 GLN 524 9.434 -2.864 15.619 611 H GLU 525 H GLU 525 11.839 -1.904 10.745 612 HA GLU 525 HA GLU 525 11.858 0.806 11.517 613 HB2 GLU 525 2HB GLU 525 14.116 -1.071 10.947 614 HB3 GLU 525 1HB GLU 525 14.320 0.496 11.745 615 HG2 GLU 525 2HG GLU 525 12.836 -1.925 12.736 616 HG3 GLU 525 1HG GLU 525 14.358 -1.285 13.355 617 H GLU 526 H GLU 526 12.604 -0.732 8.504 618 HA GLU 526 HA GLU 526 14.110 1.382 7.365 619 HB2 GLU 526 2HB GLU 526 12.414 -0.702 6.000 620 HB3 GLU 526 1HB GLU 526 13.643 0.291 5.239 621 HG2 GLU 526 2HG GLU 526 14.079 -1.800 7.346 622 HG3 GLU 526 1HG GLU 526 14.465 -1.936 5.633 623 H VAL 527 H VAL 527 10.785 0.339 7.233 624 HA VAL 527 HA VAL 527 10.029 2.490 5.537 625 HB VAL 527 HB VAL 527 7.777 1.508 5.571 626 HG11 VAL 527 1HG1 VAL 527 8.484 -0.672 4.606 627 HG12 VAL 527 2HG1 VAL 527 10.091 -0.373 5.233 628 HG13 VAL 527 3HG1 VAL 527 9.433 0.694 3.985 629 HG21 VAL 527 3HG2 VAL 527 9.039 -0.439 7.473 630 HG22 VAL 527 1HG2 VAL 527 7.489 -0.660 6.658 631 HG23 VAL 527 2HG2 VAL 527 7.693 0.646 7.844 632 H VAL 528 H VAL 528 9.606 1.811 8.976 633 HA VAL 528 HA VAL 528 7.733 3.876 9.355 634 HB VAL 528 HB VAL 528 9.606 2.632 11.410 635 HG11 VAL 528 1HG1 VAL 528 8.812 4.819 12.158 636 HG12 VAL 528 2HG1 VAL 528 8.083 3.521 13.103 637 HG13 VAL 528 3HG1 VAL 528 7.149 4.325 11.841 638 HG21 VAL 528 3HG2 VAL 528 6.705 2.098 10.806 639 HG22 VAL 528 1HG2 VAL 528 7.647 1.355 12.099 640 HG23 VAL 528 2HG2 VAL 528 8.064 1.038 10.416 641 H SER 529 H SER 529 11.228 3.889 9.395 642 HA SER 529 HA SER 529 11.461 6.521 10.357 643 HB2 SER 529 2HB SER 529 13.775 6.400 9.332 644 HB3 SER 529 1HB SER 529 13.393 5.096 10.456 645 HG SER 529 HG SER 529 13.363 3.697 8.872 646 H LEU 530 H LEU 530 10.895 5.192 7.203 647 HA LEU 530 HA LEU 530 11.255 7.496 5.632 648 HB2 LEU 530 2HB LEU 530 9.455 5.147 5.388 649 HB3 LEU 530 1HB LEU 530 9.567 6.297 4.088 650 HG LEU 530 HG LEU 530 11.688 4.393 5.124 651 HD11 LEU 530 1HD1 LEU 530 10.351 4.628 2.436 652 HD12 LEU 530 2HD1 LEU 530 10.015 3.401 3.657 653 HD13 LEU 530 3HD1 LEU 530 11.593 3.457 2.880 654 HD21 LEU 530 3HD2 LEU 530 13.176 5.269 3.373 655 HD22 LEU 530 1HD2 LEU 530 12.795 6.492 4.577 656 HD23 LEU 530 2HD2 LEU 530 11.994 6.527 3.002 657 H LEU 531 H LEU 531 8.364 6.147 7.176 658 HA LEU 531 HA LEU 531 6.816 8.346 6.326 659 HB2 LEU 531 2HB LEU 531 6.074 6.033 8.105 660 HB3 LEU 531 1HB LEU 531 4.987 7.393 7.853 661 HG LEU 531 HG LEU 531 5.331 6.900 5.387 662 HD11 LEU 531 1HD1 LEU 531 5.700 4.597 4.739 663 HD12 LEU 531 2HD1 LEU 531 6.272 4.268 6.374 664 HD13 LEU 531 3HD1 LEU 531 7.123 5.433 5.363 665 HD21 LEU 531 3HD2 LEU 531 3.495 5.241 5.371 666 HD22 LEU 531 1HD2 LEU 531 3.211 6.631 6.410 667 HD23 LEU 531 2HD2 LEU 531 3.681 5.091 7.121 668 H ARG 532 H ARG 532 8.528 7.769 9.282 669 HA ARG 532 HA ARG 532 7.232 9.910 10.632 670 HB2 ARG 532 2HB ARG 532 9.927 8.634 11.177 671 HB3 ARG 532 1HB ARG 532 9.215 9.867 12.206 672 HG2 ARG 532 2HG ARG 532 7.291 8.368 12.617 673 HG3 ARG 532 1HG ARG 532 8.066 7.144 11.622 674 HD2 ARG 532 2HD ARG 532 9.953 7.058 13.186 675 HD3 ARG 532 1HD ARG 532 9.194 8.308 14.175 676 HE ARG 532 HE ARG 532 7.335 6.314 13.892 677 HH11 ARG 532 1HH1 ARG 532 10.538 6.578 15.370 678 HH12 ARG 532 2HH1 ARG 532 10.264 5.342 16.507 679 HH21 ARG 532 1HH2 ARG 532 6.969 4.619 15.437 680 HH22 ARG 532 2HH2 ARG 532 8.183 4.186 16.557 681 H SER 533 H SER 533 9.941 9.737 8.465 682 HA SER 533 HA SER 533 10.854 12.392 8.825 683 HB2 SER 533 2HB SER 533 12.272 10.641 7.860 684 HB3 SER 533 1HB SER 533 11.185 10.490 6.488 685 HG SER 533 HG SER 533 11.771 12.547 5.824 686 H THR 534 H THR 534 8.320 10.954 6.949 687 HA THR 534 HA THR 534 6.717 11.641 5.634 688 HB THR 534 HB THR 534 5.800 13.997 5.799 689 HG1 THR 534 1HG THR 534 8.165 14.413 6.954 690 HG21 THR 534 3HG2 THR 534 4.935 12.242 7.223 691 HG22 THR 534 1HG2 THR 534 5.006 13.758 8.113 692 HG23 THR 534 2HG2 THR 534 6.227 12.512 8.394 693 H LYS 535 H LYS 535 6.892 11.473 3.618 694 HA LYS 535 HA LYS 535 8.851 12.784 1.988 695 HB2 LYS 535 2HB LYS 535 7.860 10.519 1.571 696 HB3 LYS 535 1HB LYS 535 6.316 11.278 1.270 697 HG2 LYS 535 2HG LYS 535 7.308 10.668 -0.818 698 HG3 LYS 535 1HG LYS 535 7.328 12.424 -0.687 699 HD2 LYS 535 2HD LYS 535 9.667 12.405 -0.103 700 HD3 LYS 535 1HD LYS 535 9.672 10.640 -0.032 701 HE2 LYS 535 2HE LYS 535 9.153 10.546 -2.426 702 HE3 LYS 535 1HE LYS 535 9.120 12.305 -2.485 703 HZ1 LYS 535 3HZ LYS 535 11.386 12.398 -1.938 704 HZ2 LYS 535 1HZ LYS 535 11.244 11.365 -3.255 705 HZ3 LYS 535 2HZ LYS 535 11.524 10.721 -1.723 706 H MET 536 H MET 536 8.634 14.951 1.377 707 HA MET 536 HA MET 536 5.868 15.959 1.345 708 HB2 MET 536 2HB MET 536 6.589 18.060 2.276 709 HB3 MET 536 1HB MET 536 6.912 16.717 3.371 710 HG2 MET 536 2HG MET 536 9.271 16.787 2.690 711 HG3 MET 536 1HG MET 536 8.912 18.154 1.635 712 HE1 MET 536 3HE MET 536 6.708 19.694 3.530 713 HE2 MET 536 1HE MET 536 7.942 20.493 2.563 714 HE3 MET 536 2HE MET 536 7.783 20.877 4.278 715 H GLU 537 H GLU 537 8.036 15.297 -0.779 716 HA GLU 537 HA GLU 537 8.314 17.780 -2.060 717 HB2 GLU 537 2HB GLU 537 8.683 15.018 -3.230 718 HB3 GLU 537 1HB GLU 537 9.073 16.506 -4.074 719 HG2 GLU 537 2HG GLU 537 11.116 15.763 -3.253 720 HG3 GLU 537 1HG GLU 537 10.629 17.014 -2.126 721 H GLY 538 H GLY 538 5.801 15.424 -2.181 722 HA2 GLY 538 2HA GLY 538 3.851 17.147 -3.017 723 HA3 GLY 538 1HA GLY 538 4.415 16.488 -4.526 724 H THR 539 H THR 539 3.773 14.521 -5.133 725 HA THR 539 HA THR 539 1.710 13.386 -3.503 726 HB THR 539 HB THR 539 1.672 11.798 -5.547 727 HG1 THR 539 1HG THR 539 3.205 12.370 -6.891 728 HG21 THR 539 3HG2 THR 539 0.112 13.324 -6.701 729 HG22 THR 539 1HG2 THR 539 0.646 14.650 -5.654 730 HG23 THR 539 2HG2 THR 539 -0.169 13.233 -4.970 731 H VAL 540 H VAL 540 1.903 11.755 -2.336 732 HA VAL 540 HA VAL 540 4.279 10.054 -2.568 733 HB VAL 540 HB VAL 540 2.267 10.230 -0.310 734 HG11 VAL 540 1HG1 VAL 540 3.445 8.116 -0.480 735 HG12 VAL 540 2HG1 VAL 540 3.946 8.994 0.976 736 HG13 VAL 540 3HG1 VAL 540 4.991 8.963 -0.448 737 HG21 VAL 540 3HG2 VAL 540 3.965 11.522 0.902 738 HG22 VAL 540 1HG2 VAL 540 3.445 12.332 -0.584 739 HG23 VAL 540 2HG2 VAL 540 4.988 11.494 -0.539 740 H SER 541 H SER 541 3.991 8.032 -3.261 741 HA SER 541 HA SER 541 1.242 7.226 -3.804 742 HB2 SER 541 2HB SER 541 3.790 6.059 -4.927 743 HB3 SER 541 1HB SER 541 2.148 5.747 -5.472 744 HG SER 541 HG SER 541 2.766 8.388 -5.400 745 H LEU 542 H LEU 542 0.423 5.917 -2.308 746 HA LEU 542 HA LEU 542 2.209 4.034 -0.966 747 HB2 LEU 542 2HB LEU 542 -0.575 4.963 -0.219 748 HB3 LEU 542 1HB LEU 542 0.294 3.704 0.619 749 HG LEU 542 HG LEU 542 0.382 5.677 1.926 750 HD11 LEU 542 1HD1 LEU 542 2.774 6.068 2.149 751 HD12 LEU 542 2HD1 LEU 542 3.039 5.253 0.605 752 HD13 LEU 542 3HD1 LEU 542 2.370 4.360 1.969 753 HD21 LEU 542 3HD2 LEU 542 -0.076 7.327 0.216 754 HD22 LEU 542 1HD2 LEU 542 1.526 7.093 -0.474 755 HD23 LEU 542 2HD2 LEU 542 1.355 7.797 1.137 756 H LEU 543 H LEU 543 2.208 2.128 -1.758 757 HA LEU 543 HA LEU 543 -0.130 1.179 -3.243 758 HB2 LEU 543 2HB LEU 543 2.311 1.212 -4.182 759 HB3 LEU 543 1HB LEU 543 2.604 0.020 -2.977 760 HG LEU 543 HG LEU 543 2.394 -0.975 -5.196 761 HD11 LEU 543 1HD1 LEU 543 1.925 -2.380 -3.357 762 HD12 LEU 543 2HD1 LEU 543 0.877 -2.773 -4.708 763 HD13 LEU 543 3HD1 LEU 543 0.231 -1.871 -3.331 764 HD21 LEU 543 3HD2 LEU 543 0.805 0.534 -6.194 765 HD22 LEU 543 1HD2 LEU 543 -0.463 -0.052 -5.115 766 HD23 LEU 543 2HD2 LEU 543 0.239 -1.131 -6.323 767 H VAL 544 H VAL 544 -1.421 -0.074 -2.101 768 HA VAL 544 HA VAL 544 -0.310 -1.493 0.224 769 HB VAL 544 HB VAL 544 -2.341 -1.204 1.457 770 HG11 VAL 544 1HG1 VAL 544 -1.420 1.428 0.338 771 HG12 VAL 544 2HG1 VAL 544 -0.727 0.555 1.708 772 HG13 VAL 544 3HG1 VAL 544 -2.359 1.210 1.815 773 HG21 VAL 544 3HG2 VAL 544 -3.896 -1.311 -0.339 774 HG22 VAL 544 1HG2 VAL 544 -3.402 0.279 -0.938 775 HG23 VAL 544 2HG2 VAL 544 -4.228 0.125 0.634 776 H PHE 545 H PHE 545 -1.597 -3.332 0.924 777 HA PHE 545 HA PHE 545 -2.543 -4.843 -1.422 778 HB2 PHE 545 2HB PHE 545 -0.417 -5.525 -0.477 779 HB3 PHE 545 1HB PHE 545 -1.173 -5.813 1.085 780 HD1 PHE 545 1HD PHE 545 -0.889 -6.914 -2.401 781 HD2 PHE 545 2HD PHE 545 -2.290 -7.889 1.484 782 HE1 PHE 545 1HE PHE 545 -1.210 -9.242 -3.115 783 HE2 PHE 545 2HE PHE 545 -2.622 -10.228 0.775 784 HZ PHE 545 HZ PHE 545 -2.078 -10.901 -1.519 785 H ARG 546 H ARG 546 -4.526 -5.502 -1.362 786 HA ARG 546 HA ARG 546 -6.079 -5.458 1.143 787 HB2 ARG 546 2HB ARG 546 -6.961 -5.587 -1.751 788 HB3 ARG 546 1HB ARG 546 -8.056 -5.670 -0.385 789 HG2 ARG 546 2HG ARG 546 -6.251 -3.339 -0.969 790 HG3 ARG 546 1HG ARG 546 -7.948 -3.441 -1.459 791 HD2 ARG 546 2HD ARG 546 -8.633 -3.594 0.844 792 HD3 ARG 546 1HD ARG 546 -6.954 -3.643 1.377 793 HE ARG 546 HE ARG 546 -7.624 -1.329 -0.152 794 HH11 ARG 546 1HH1 ARG 546 -7.942 -2.742 3.058 795 HH12 ARG 546 2HH1 ARG 546 -7.607 -1.307 3.904 796 HH21 ARG 546 1HH2 ARG 546 -7.186 0.730 1.020 797 HH22 ARG 546 2HH2 ARG 546 -7.075 0.649 2.714 798 H GLN 547 H GLN 547 -6.239 -7.345 2.119 799 HA GLN 547 HA GLN 547 -6.402 -9.725 0.434 800 HB2 GLN 547 2HB GLN 547 -4.232 -9.443 1.780 801 HB3 GLN 547 1HB GLN 547 -5.220 -9.646 3.213 802 HG2 GLN 547 2HG GLN 547 -5.897 -11.868 2.464 803 HG3 GLN 547 1HG GLN 547 -4.938 -11.667 1.001 804 HE21 GLN 547 1HE2 GLN 547 -4.673 -13.735 2.946 805 HE22 GLN 547 2HE2 GLN 547 -3.092 -13.597 3.613 806 H GLU 548 H GLU 548 -8.197 -10.823 0.761 807 HA GLU 548 HA GLU 548 -10.105 -9.811 2.685 808 HB2 GLU 548 2HB GLU 548 -10.385 -11.908 0.534 809 HB3 GLU 548 1HB GLU 548 -11.700 -11.281 1.522 810 HG2 GLU 548 2HG GLU 548 -10.027 -9.696 -0.423 811 HG3 GLU 548 1HG GLU 548 -11.687 -10.234 -0.672 812 H GLU 549 H GLU 549 -7.753 -12.018 2.763 813 HA GLU 549 HA GLU 549 -9.122 -13.952 4.452 814 HB2 GLU 549 2HB GLU 549 -6.193 -13.745 3.764 815 HB3 GLU 549 1HB GLU 549 -7.009 -15.127 4.475 816 HG2 GLU 549 2HG GLU 549 -8.325 -15.379 2.413 817 HG3 GLU 549 1HG GLU 549 -7.425 -14.042 1.702 818 H ALA 550 H ALA 550 -8.373 -14.285 6.641 819 HA ALA 550 HA ALA 550 -7.876 -11.782 7.950 820 HB1 ALA 550 1HB ALA 550 -8.098 -14.558 9.121 821 HB2 ALA 550 2HB ALA 550 -9.430 -13.422 8.910 822 HB3 ALA 550 3HB ALA 550 -8.119 -13.045 10.026 823 H PHE 551 H PHE 551 -6.063 -11.154 9.059 824 HA PHE 551 HA PHE 551 -3.610 -12.531 8.335 825 HB2 PHE 551 2HB PHE 551 -4.047 -9.942 9.867 826 HB3 PHE 551 1HB PHE 551 -2.490 -10.561 9.337 827 HD1 PHE 551 2HD PHE 551 -2.094 -10.791 6.849 828 HD2 PHE 551 1HD PHE 551 -5.337 -8.584 8.484 829 HE1 PHE 551 2HE PHE 551 -2.333 -9.591 4.729 830 HE2 PHE 551 1HE PHE 551 -5.588 -7.370 6.360 831 HZ PHE 551 HZ PHE 551 -4.085 -7.869 4.475 832 H HIS 552 H HIS 552 -2.893 -14.064 9.694 833 HA HIS 552 HA HIS 552 -3.633 -13.776 12.511 834 HB2 HIS 552 2HB HIS 552 -4.252 -16.129 12.664 835 HB3 HIS 552 1HB HIS 552 -5.222 -15.330 11.438 836 HD1 HIS 552 1HD HIS 552 -4.876 -16.157 8.941 837 HD2 HIS 552 2HD HIS 552 -2.526 -18.133 11.756 838 HE1 HIS 552 1HE HIS 552 -3.901 -18.128 7.757 839 HE2 HIS 552 2HE HIS 552 -2.402 -19.243 9.452 840 HA PRO 553 HA PRO 553 0.607 -15.522 13.135 841 HB2 PRO 553 2HB PRO 553 0.386 -15.559 15.833 842 HB3 PRO 553 1HB PRO 553 0.785 -14.076 14.979 843 HG2 PRO 553 2HG PRO 553 -1.573 -14.702 16.492 844 HG3 PRO 553 1HG PRO 553 -1.168 -13.183 15.691 845 HD2 PRO 553 2HD PRO 553 -2.971 -15.329 14.825 846 HD3 PRO 553 1HD PRO 553 -2.852 -13.647 14.259 847 H ARG 554 H ARG 554 1.336 -16.997 14.963 848 HA ARG 554 HA ARG 554 -0.238 -19.438 14.617 849 HB2 ARG 554 2HB ARG 554 1.674 -18.966 13.014 850 HB3 ARG 554 1HB ARG 554 2.735 -19.091 14.403 851 HG2 ARG 554 2HG ARG 554 2.040 -21.356 14.744 852 HG3 ARG 554 1HG ARG 554 0.902 -21.182 13.385 853 HD2 ARG 554 2HD ARG 554 2.715 -20.601 11.949 854 HD3 ARG 554 1HD ARG 554 3.871 -20.875 13.239 855 HE ARG 554 HE ARG 554 2.144 -23.116 12.792 856 HH11 ARG 554 1HH1 ARG 554 5.198 -21.653 11.712 857 HH12 ARG 554 2HH1 ARG 554 5.847 -23.098 11.104 858 HH21 ARG 554 1HH2 ARG 554 3.032 -25.112 11.888 859 HH22 ARG 554 2HH2 ARG 554 4.580 -25.114 11.188 860 H GLU 555 H GLU 555 0.164 -17.374 16.623 861 HA GLU 555 HA GLU 555 1.967 -18.212 18.665 862 HB2 GLU 555 2HB GLU 555 1.384 -15.863 18.125 863 HB3 GLU 555 1HB GLU 555 -0.261 -16.170 18.609 864 HG2 GLU 555 2HG GLU 555 2.109 -16.319 20.460 865 HG3 GLU 555 1HG GLU 555 1.131 -14.881 20.237 866 H MET 556 H MET 556 -1.549 -18.002 18.335 867 HA MET 556 HA MET 556 -1.812 -19.775 20.626 868 HB2 MET 556 2HB MET 556 -2.906 -17.602 20.852 869 HB3 MET 556 1HB MET 556 -3.776 -17.846 19.359 870 HG2 MET 556 2HG MET 556 -4.167 -19.527 21.841 871 HG3 MET 556 1HG MET 556 -5.113 -18.092 21.469 872 HE1 MET 556 3HE MET 556 -6.491 -20.822 22.147 873 HE2 MET 556 1HE MET 556 -7.716 -20.926 20.884 874 HE3 MET 556 2HE MET 556 -7.384 -19.383 21.667 875 H ASN 557 H ASN 557 -1.855 -21.784 20.037 876 HA ASN 557 HA ASN 557 -3.950 -22.844 18.457 877 HB2 ASN 557 2HB ASN 557 -2.464 -22.230 16.584 878 HB3 ASN 557 1HB ASN 557 -1.123 -23.057 17.361 879 HD21 ASN 557 1HD2 ASN 557 -0.824 -24.390 15.587 880 HD22 ASN 557 2HD2 ASN 557 -1.881 -25.688 15.186 881 H ALA 558 H ALA 558 -4.423 -24.089 20.187 882 HA ALA 558 HA ALA 558 -2.701 -26.312 20.714 883 HB1 ALA 558 1HB ALA 558 -3.400 -24.388 22.935 884 HB2 ALA 558 2HB ALA 558 -1.792 -24.629 22.255 885 HB3 ALA 558 3HB ALA 558 -2.583 -25.940 23.131 Start of MODEL 7 1 H1 GLY 448 1HT GLY 448 -21.425 5.896 -11.565 2 H2 GLY 448 2HT GLY 448 -20.387 6.479 -12.776 3 H3 GLY 448 3HT GLY 448 -19.790 6.094 -11.235 4 HA2 GLY 448 1HA GLY 448 -20.948 4.133 -13.106 5 HA3 GLY 448 2HA GLY 448 -19.225 4.387 -12.831 6 H SER 449 H SER 449 -21.259 2.131 -12.221 7 HA SER 449 HA SER 449 -20.403 1.883 -9.451 8 HB2 SER 449 2HB SER 449 -23.101 1.095 -10.550 9 HB3 SER 449 1HB SER 449 -22.532 0.726 -8.921 10 HG SER 449 HG SER 449 -23.796 2.603 -8.966 11 H VAL 450 H VAL 450 -18.662 0.654 -9.974 12 HA VAL 450 HA VAL 450 -19.321 -2.126 -10.584 13 HB VAL 450 HB VAL 450 -16.757 -0.707 -11.439 14 HG11 VAL 450 1HG1 VAL 450 -17.636 -3.564 -11.895 15 HG12 VAL 450 2HG1 VAL 450 -16.349 -3.032 -10.817 16 HG13 VAL 450 3HG1 VAL 450 -16.180 -2.820 -12.560 17 HG21 VAL 450 3HG2 VAL 450 -19.007 -1.796 -13.136 18 HG22 VAL 450 1HG2 VAL 450 -17.494 -1.124 -13.744 19 HG23 VAL 450 2HG2 VAL 450 -18.633 -0.093 -12.872 20 H TYR 451 H TYR 451 -19.414 -2.674 -8.484 21 HA TYR 451 HA TYR 451 -17.023 -2.163 -6.893 22 HB2 TYR 451 2HB TYR 451 -19.867 -2.464 -5.891 23 HB3 TYR 451 1HB TYR 451 -18.446 -2.212 -4.883 24 HD1 TYR 451 1HD TYR 451 -17.338 -0.034 -4.841 25 HD2 TYR 451 2HD TYR 451 -20.837 -0.644 -7.158 26 HE1 TYR 451 1HE TYR 451 -17.609 2.407 -5.069 27 HE2 TYR 451 2HE TYR 451 -21.117 1.781 -7.394 28 HH TYR 451 HH TYR 451 -18.671 3.981 -6.614 29 H ASN 452 H ASN 452 -16.021 -3.989 -7.519 30 HA ASN 452 HA ASN 452 -17.292 -6.532 -6.811 31 HB2 ASN 452 2HB ASN 452 -14.868 -5.956 -8.555 32 HB3 ASN 452 1HB ASN 452 -15.428 -7.569 -8.143 33 HD21 ASN 452 1HD2 ASN 452 -15.684 -8.051 -10.324 34 HD22 ASN 452 2HD2 ASN 452 -16.986 -7.429 -11.269 35 H THR 453 H THR 453 -16.893 -6.828 -4.700 36 HA THR 453 HA THR 453 -14.186 -6.260 -3.778 37 HB THR 453 HB THR 453 -15.225 -6.120 -1.480 38 HG1 THR 453 1HG THR 453 -17.160 -7.251 -2.129 39 HG21 THR 453 3HG2 THR 453 -16.247 -4.175 -3.566 40 HG22 THR 453 1HG2 THR 453 -14.674 -4.097 -2.777 41 HG23 THR 453 2HG2 THR 453 -16.145 -3.856 -1.834 42 H LYS 454 H LYS 454 -13.112 -8.124 -4.000 43 HA LYS 454 HA LYS 454 -14.281 -10.609 -2.992 44 HB2 LYS 454 2HB LYS 454 -11.646 -10.088 -4.377 45 HB3 LYS 454 1HB LYS 454 -12.274 -11.662 -3.931 46 HG2 LYS 454 2HG LYS 454 -14.133 -11.339 -5.507 47 HG3 LYS 454 1HG LYS 454 -13.445 -9.777 -5.964 48 HD2 LYS 454 2HD LYS 454 -11.394 -10.867 -6.682 49 HD3 LYS 454 1HD LYS 454 -12.041 -12.435 -6.204 50 HE2 LYS 454 2HE LYS 454 -13.839 -12.161 -7.848 51 HE3 LYS 454 1HE LYS 454 -13.137 -10.617 -8.331 52 HZ1 LYS 454 3HZ LYS 454 -11.113 -11.804 -8.985 53 HZ2 LYS 454 1HZ LYS 454 -12.440 -12.405 -9.841 54 HZ3 LYS 454 2HZ LYS 454 -11.802 -13.255 -8.532 55 H LYS 455 H LYS 455 -13.099 -11.858 -1.420 56 HA LYS 455 HA LYS 455 -11.440 -10.167 0.248 57 HB2 LYS 455 2HB LYS 455 -12.860 -12.749 0.955 58 HB3 LYS 455 1HB LYS 455 -11.721 -11.948 2.024 59 HG2 LYS 455 2HG LYS 455 -13.896 -11.353 2.750 60 HG3 LYS 455 1HG LYS 455 -13.211 -9.939 1.966 61 HD2 LYS 455 2HD LYS 455 -14.480 -10.567 -0.099 62 HD3 LYS 455 1HD LYS 455 -15.261 -11.842 0.838 63 HE2 LYS 455 2HE LYS 455 -15.378 -8.877 1.375 64 HE3 LYS 455 1HE LYS 455 -16.689 -9.884 0.768 65 HZ1 LYS 455 3HZ LYS 455 -15.421 -10.055 3.452 66 HZ2 LYS 455 1HZ LYS 455 -16.657 -11.087 2.903 67 HZ3 LYS 455 2HZ LYS 455 -16.951 -9.443 3.099 68 H VAL 456 H VAL 456 -9.827 -10.308 -1.275 69 HA VAL 456 HA VAL 456 -8.018 -12.530 -0.819 70 HB VAL 456 HB VAL 456 -8.578 -11.314 -3.567 71 HG11 VAL 456 1HG1 VAL 456 -7.056 -13.011 -4.447 72 HG12 VAL 456 2HG1 VAL 456 -6.726 -13.565 -2.805 73 HG13 VAL 456 3HG1 VAL 456 -6.253 -11.940 -3.297 74 HG21 VAL 456 3HG2 VAL 456 -10.400 -12.821 -2.950 75 HG22 VAL 456 1HG2 VAL 456 -9.236 -14.098 -2.594 76 HG23 VAL 456 2HG2 VAL 456 -9.432 -13.515 -4.247 77 H GLY 457 H GLY 457 -5.894 -11.751 -0.789 78 HA2 GLY 457 2HA GLY 457 -5.594 -8.972 -0.274 79 HA3 GLY 457 1HA GLY 457 -4.295 -10.155 -0.338 80 H LYS 458 H LYS 458 -5.655 -7.563 -1.798 81 HA LYS 458 HA LYS 458 -4.373 -8.104 -4.402 82 HB2 LYS 458 2HB LYS 458 -6.058 -6.515 -5.324 83 HB3 LYS 458 1HB LYS 458 -6.756 -7.999 -4.679 84 HG2 LYS 458 2HG LYS 458 -7.276 -6.757 -2.584 85 HG3 LYS 458 1HG LYS 458 -6.716 -5.284 -3.374 86 HD2 LYS 458 2HD LYS 458 -8.445 -5.497 -5.054 87 HD3 LYS 458 1HD LYS 458 -8.968 -7.036 -4.356 88 HE2 LYS 458 2HE LYS 458 -9.475 -5.862 -2.248 89 HE3 LYS 458 1HE LYS 458 -9.037 -4.340 -3.019 90 HZ1 LYS 458 3HZ LYS 458 -11.223 -6.135 -3.877 91 HZ2 LYS 458 1HZ LYS 458 -10.824 -4.655 -4.587 92 HZ3 LYS 458 2HZ LYS 458 -11.410 -4.708 -3.001 93 H ARG 459 H ARG 459 -3.407 -6.233 -5.429 94 HA ARG 459 HA ARG 459 -2.474 -4.307 -3.426 95 HB2 ARG 459 2HB ARG 459 -1.124 -5.437 -5.865 96 HB3 ARG 459 1HB ARG 459 -0.492 -4.056 -4.974 97 HG2 ARG 459 2HG ARG 459 -0.062 -5.314 -3.065 98 HG3 ARG 459 1HG ARG 459 -1.078 -6.652 -3.554 99 HD2 ARG 459 2HD ARG 459 1.252 -7.266 -3.753 100 HD3 ARG 459 1HD ARG 459 0.548 -7.156 -5.357 101 HE ARG 459 HE ARG 459 1.961 -4.816 -4.391 102 HH11 ARG 459 1HH1 ARG 459 2.000 -7.744 -6.367 103 HH12 ARG 459 2HH1 ARG 459 3.409 -7.343 -7.225 104 HH21 ARG 459 1HH2 ARG 459 4.009 -4.228 -5.626 105 HH22 ARG 459 2HH2 ARG 459 4.507 -5.334 -6.796 106 H LEU 460 H LEU 460 -2.827 -2.265 -3.659 107 HA LEU 460 HA LEU 460 -3.875 -1.203 -6.204 108 HB2 LEU 460 2HB LEU 460 -4.998 -0.674 -3.447 109 HB3 LEU 460 1HB LEU 460 -5.545 0.071 -4.929 110 HG LEU 460 HG LEU 460 -5.809 -2.859 -4.243 111 HD11 LEU 460 1HD1 LEU 460 -7.863 -0.658 -4.323 112 HD12 LEU 460 2HD1 LEU 460 -7.242 -1.461 -2.881 113 HD13 LEU 460 3HD1 LEU 460 -8.192 -2.373 -4.053 114 HD21 LEU 460 3HD2 LEU 460 -6.860 -1.286 -6.602 115 HD22 LEU 460 1HD2 LEU 460 -7.257 -2.965 -6.226 116 HD23 LEU 460 2HD2 LEU 460 -5.602 -2.524 -6.643 117 H ASN 461 H ASN 461 -3.522 1.090 -6.418 118 HA ASN 461 HA ASN 461 -1.554 2.086 -4.529 119 HB2 ASN 461 2HB ASN 461 -0.477 3.388 -6.407 120 HB3 ASN 461 1HB ASN 461 -0.280 1.649 -6.475 121 HD21 ASN 461 1HD2 ASN 461 -3.209 3.382 -7.515 122 HD22 ASN 461 2HD2 ASN 461 -3.021 3.023 -9.185 123 H ILE 462 H ILE 462 -1.814 3.855 -3.557 124 HA ILE 462 HA ILE 462 -3.976 5.650 -4.422 125 HB ILE 462 HB ILE 462 -3.073 5.000 -1.592 126 HG12 ILE 462 2HG1 ILE 462 -5.620 4.438 -1.318 127 HG13 ILE 462 1HG1 ILE 462 -5.634 4.403 -3.062 128 HG21 ILE 462 1HG2 ILE 462 -3.520 7.340 -1.708 129 HG22 ILE 462 2HG2 ILE 462 -4.779 6.536 -0.776 130 HG23 ILE 462 3HG2 ILE 462 -5.098 7.043 -2.431 131 HD11 ILE 462 3HD1 ILE 462 -5.454 2.184 -2.122 132 HD12 ILE 462 1HD1 ILE 462 -3.986 2.644 -1.277 133 HD13 ILE 462 2HD1 ILE 462 -3.998 2.580 -3.047 134 H GLN 463 H GLN 463 -3.416 7.758 -4.732 135 HA GLN 463 HA GLN 463 -0.683 8.562 -4.031 136 HB2 GLN 463 2HB GLN 463 -2.685 9.732 -5.957 137 HB3 GLN 463 1HB GLN 463 -1.167 10.514 -5.548 138 HG2 GLN 463 2HG GLN 463 0.075 8.783 -6.445 139 HG3 GLN 463 1HG GLN 463 -1.352 7.752 -6.733 140 HE21 GLN 463 1HE2 GLN 463 0.607 10.382 -7.790 141 HE22 GLN 463 2HE2 GLN 463 -0.177 10.654 -9.295 142 H LEU 464 H LEU 464 -0.325 9.944 -2.468 143 HA LEU 464 HA LEU 464 -2.605 11.549 -1.494 144 HB2 LEU 464 2HB LEU 464 -0.297 10.504 0.162 145 HB3 LEU 464 1HB LEU 464 -1.573 11.538 0.747 146 HG LEU 464 HG LEU 464 -2.039 9.414 1.575 147 HD11 LEU 464 1HD1 LEU 464 -4.002 10.494 0.796 148 HD12 LEU 464 2HD1 LEU 464 -4.134 8.749 0.553 149 HD13 LEU 464 3HD1 LEU 464 -3.784 9.805 -0.815 150 HD21 LEU 464 3HD2 LEU 464 -0.561 8.088 0.198 151 HD22 LEU 464 1HD2 LEU 464 -1.624 8.299 -1.190 152 HD23 LEU 464 2HD2 LEU 464 -2.176 7.373 0.210 153 H LYS 465 H LYS 465 -2.307 13.664 -1.291 154 HA LYS 465 HA LYS 465 0.354 14.720 -1.909 155 HB2 LYS 465 2HB LYS 465 -1.329 15.482 -3.453 156 HB3 LYS 465 1HB LYS 465 -2.375 16.022 -2.126 157 HG2 LYS 465 2HG LYS 465 -0.587 17.672 -1.544 158 HG3 LYS 465 1HG LYS 465 0.282 17.166 -2.994 159 HD2 LYS 465 2HD LYS 465 -0.980 19.196 -3.436 160 HD3 LYS 465 1HD LYS 465 -1.649 17.853 -4.360 161 HE2 LYS 465 2HE LYS 465 -3.442 17.588 -2.749 162 HE3 LYS 465 1HE LYS 465 -2.748 18.849 -1.730 163 HZ1 LYS 465 3HZ LYS 465 -3.188 20.445 -3.475 164 HZ2 LYS 465 1HZ LYS 465 -4.595 19.631 -3.056 165 HZ3 LYS 465 2HZ LYS 465 -3.803 19.248 -4.486 166 H LYS 466 H LYS 466 1.376 15.884 -0.509 167 HA LYS 466 HA LYS 466 0.510 15.762 2.199 168 HB2 LYS 466 2HB LYS 466 3.018 16.402 0.810 169 HB3 LYS 466 1HB LYS 466 2.781 17.225 2.338 170 HG2 LYS 466 2HG LYS 466 4.050 15.023 2.399 171 HG3 LYS 466 1HG LYS 466 2.746 15.216 3.554 172 HD2 LYS 466 2HD LYS 466 2.772 12.971 2.561 173 HD3 LYS 466 1HD LYS 466 1.289 13.827 2.162 174 HE2 LYS 466 2HE LYS 466 2.135 12.595 0.267 175 HE3 LYS 466 1HE LYS 466 2.218 14.323 -0.046 176 HZ1 LYS 466 3HZ LYS 466 4.577 14.215 0.606 177 HZ2 LYS 466 1HZ LYS 466 4.165 13.348 -0.770 178 HZ3 LYS 466 2HZ LYS 466 4.433 12.526 0.691 179 H GLY 467 H GLY 467 -0.582 17.040 3.231 180 HA2 GLY 467 2HA GLY 467 -0.628 19.871 2.444 181 HA3 GLY 467 1HA GLY 467 -2.030 19.031 3.101 182 H THR 468 H THR 468 -2.408 19.834 5.077 183 HA THR 468 HA THR 468 -0.266 20.893 6.637 184 HB THR 468 HB THR 468 -2.024 21.333 8.329 185 HG1 THR 468 1HG THR 468 -3.495 19.806 8.181 186 HG21 THR 468 3HG2 THR 468 -1.651 22.954 6.526 187 HG22 THR 468 1HG2 THR 468 -3.358 22.891 6.973 188 HG23 THR 468 2HG2 THR 468 -2.800 22.087 5.507 189 H GLU 469 H GLU 469 -2.239 17.952 6.663 190 HA GLU 469 HA GLU 469 -1.082 17.122 9.191 191 HB2 GLU 469 2HB GLU 469 -2.951 15.576 7.405 192 HB3 GLU 469 1HB GLU 469 -2.634 15.313 9.113 193 HG2 GLU 469 2HG GLU 469 -4.132 17.591 7.849 194 HG3 GLU 469 1HG GLU 469 -4.765 16.335 8.904 195 H GLY 470 H GLY 470 0.107 17.227 6.251 196 HA2 GLY 470 2HA GLY 470 1.773 16.077 5.178 197 HA3 GLY 470 1HA GLY 470 1.828 14.961 6.545 198 H LEU 471 H LEU 471 1.036 13.005 6.279 199 HA LEU 471 HA LEU 471 -0.372 12.377 3.836 200 HB2 LEU 471 2HB LEU 471 0.737 10.653 6.049 201 HB3 LEU 471 1HB LEU 471 -0.283 10.007 4.799 202 HG LEU 471 HG LEU 471 1.966 9.468 4.319 203 HD11 LEU 471 1HD1 LEU 471 0.960 11.586 2.440 204 HD12 LEU 471 2HD1 LEU 471 0.640 9.864 2.406 205 HD13 LEU 471 3HD1 LEU 471 2.264 10.450 2.085 206 HD21 LEU 471 3HD2 LEU 471 3.155 11.156 5.576 207 HD22 LEU 471 1HD2 LEU 471 2.573 12.416 4.499 208 HD23 LEU 471 2HD2 LEU 471 3.711 11.200 3.897 209 H GLY 472 H GLY 472 -0.868 12.268 7.309 210 HA2 GLY 472 2HA GLY 472 -2.926 12.721 8.359 211 HA3 GLY 472 1HA GLY 472 -3.726 12.468 6.815 212 H PHE 473 H PHE 473 -1.461 10.033 7.713 213 HA PHE 473 HA PHE 473 -3.451 8.534 9.141 214 HB2 PHE 473 2HB PHE 473 -3.344 6.550 7.746 215 HB3 PHE 473 1HB PHE 473 -3.889 7.900 6.772 216 HD1 PHE 473 1HD PHE 473 -2.150 9.007 5.256 217 HD2 PHE 473 2HD PHE 473 -1.542 5.215 7.091 218 HE1 PHE 473 1HE PHE 473 -0.416 8.423 3.565 219 HE2 PHE 473 2HE PHE 473 0.187 4.696 5.405 220 HZ PHE 473 HZ PHE 473 0.694 6.343 3.662 221 H SER 474 H SER 474 -2.556 6.606 10.042 222 HA SER 474 HA SER 474 0.307 6.946 10.607 223 HB2 SER 474 2HB SER 474 -1.897 5.914 12.401 224 HB3 SER 474 1HB SER 474 -0.210 6.134 12.858 225 HG SER 474 HG SER 474 -0.593 8.407 12.199 226 H ILE 475 H ILE 475 1.417 4.896 11.160 227 HA ILE 475 HA ILE 475 0.217 2.547 9.827 228 HB ILE 475 HB ILE 475 2.534 1.862 9.331 229 HG12 ILE 475 2HG1 ILE 475 3.239 4.680 10.132 230 HG13 ILE 475 1HG1 ILE 475 3.586 3.173 10.999 231 HG21 ILE 475 1HG2 ILE 475 1.174 2.800 7.602 232 HG22 ILE 475 2HG2 ILE 475 2.847 3.255 7.382 233 HG23 ILE 475 3HG2 ILE 475 1.690 4.445 8.017 234 HD11 ILE 475 3HD1 ILE 475 5.507 4.119 9.734 235 HD12 ILE 475 1HD1 ILE 475 4.639 3.840 8.239 236 HD13 ILE 475 2HD1 ILE 475 5.108 2.469 9.248 237 H THR 476 H THR 476 0.596 0.570 10.817 238 HA THR 476 HA THR 476 1.997 0.568 13.384 239 HB THR 476 HB THR 476 -0.445 0.524 13.892 240 HG1 THR 476 1HG THR 476 -0.407 -1.709 14.853 241 HG21 THR 476 3HG2 THR 476 -1.255 -0.491 11.793 242 HG22 THR 476 1HG2 THR 476 -1.837 -1.377 13.201 243 HG23 THR 476 2HG2 THR 476 -0.497 -2.018 12.247 244 H SER 477 H SER 477 3.003 -1.427 13.901 245 HA SER 477 HA SER 477 3.092 -3.366 11.721 246 HB2 SER 477 2HB SER 477 5.470 -3.653 12.174 247 HB3 SER 477 1HB SER 477 5.151 -1.999 11.757 248 HG SER 477 HG SER 477 5.961 -1.419 13.577 249 H ARG 478 H ARG 478 2.921 -5.471 12.429 250 HA ARG 478 HA ARG 478 3.054 -5.883 15.330 251 HB2 ARG 478 2HB ARG 478 1.162 -7.447 15.235 252 HB3 ARG 478 1HB ARG 478 0.703 -5.791 14.900 253 HG2 ARG 478 2HG ARG 478 0.450 -6.264 12.575 254 HG3 ARG 478 1HG ARG 478 1.147 -7.873 12.771 255 HD2 ARG 478 2HD ARG 478 -0.702 -8.514 14.210 256 HD3 ARG 478 1HD ARG 478 -1.381 -6.898 14.078 257 HE ARG 478 HE ARG 478 -1.647 -7.367 11.680 258 HH11 ARG 478 1HH1 ARG 478 -1.479 -10.096 13.967 259 HH12 ARG 478 2HH1 ARG 478 -2.411 -11.117 12.965 260 HH21 ARG 478 1HH2 ARG 478 -2.969 -8.855 10.343 261 HH22 ARG 478 2HH2 ARG 478 -3.231 -10.415 10.938 262 H ASP 479 H ASP 479 4.264 -7.272 15.986 263 HA ASP 479 HA ASP 479 5.020 -9.501 14.237 264 HB2 ASP 479 2HB ASP 479 6.887 -7.854 14.693 265 HB3 ASP 479 1HB ASP 479 6.683 -8.178 16.404 266 H VAL 480 H VAL 480 3.422 -10.755 15.047 267 HA VAL 480 HA VAL 480 2.789 -10.859 17.790 268 HB VAL 480 HB VAL 480 1.088 -11.326 16.146 269 HG11 VAL 480 1HG1 VAL 480 2.404 -12.284 14.403 270 HG12 VAL 480 2HG1 VAL 480 1.049 -13.354 14.780 271 HG13 VAL 480 3HG1 VAL 480 2.679 -13.743 15.353 272 HG21 VAL 480 3HG2 VAL 480 0.129 -13.405 17.036 273 HG22 VAL 480 1HG2 VAL 480 0.777 -12.354 18.297 274 HG23 VAL 480 2HG2 VAL 480 1.681 -13.784 17.793 275 H THR 481 H THR 481 4.531 -13.173 15.738 276 HA THR 481 HA THR 481 6.240 -13.979 17.900 277 HB THR 481 HB THR 481 4.451 -16.111 16.594 278 HG1 THR 481 1HG THR 481 3.968 -14.454 18.690 279 HG21 THR 481 3HG2 THR 481 6.639 -16.925 17.406 280 HG22 THR 481 1HG2 THR 481 5.319 -17.580 18.372 281 HG23 THR 481 2HG2 THR 481 6.297 -16.254 18.999 282 H ILE 482 H ILE 482 6.564 -12.605 15.459 283 HA ILE 482 HA ILE 482 7.364 -14.555 13.462 284 HB ILE 482 HB ILE 482 7.454 -11.520 13.304 285 HG12 ILE 482 2HG1 ILE 482 5.313 -13.416 12.305 286 HG13 ILE 482 1HG1 ILE 482 5.143 -12.345 13.689 287 HG21 ILE 482 1HG2 ILE 482 8.896 -12.693 11.702 288 HG22 ILE 482 2HG2 ILE 482 7.536 -11.929 10.876 289 HG23 ILE 482 3HG2 ILE 482 7.525 -13.667 11.171 290 HD11 ILE 482 3HD1 ILE 482 5.556 -11.493 10.830 291 HD12 ILE 482 1HD1 ILE 482 5.368 -10.413 12.209 292 HD13 ILE 482 2HD1 ILE 482 4.032 -11.455 11.713 293 H GLY 483 H GLY 483 8.680 -11.890 15.372 294 HA2 GLY 483 2HA GLY 483 10.775 -11.680 16.317 295 HA3 GLY 483 1HA GLY 483 11.172 -13.277 15.686 296 H GLY 484 H GLY 484 10.157 -10.309 14.102 297 HA2 GLY 484 2HA GLY 484 11.933 -8.896 13.083 298 HA3 GLY 484 1HA GLY 484 12.677 -10.409 12.568 299 H SER 485 H SER 485 11.508 -8.030 11.123 300 HA SER 485 HA SER 485 10.430 -7.563 9.281 301 HB2 SER 485 2HB SER 485 10.335 -10.563 8.874 302 HB3 SER 485 1HB SER 485 9.876 -9.381 7.648 303 HG SER 485 HG SER 485 11.912 -8.621 7.597 304 H ALA 486 H ALA 486 8.835 -6.587 10.412 305 HA ALA 486 HA ALA 486 6.351 -8.086 10.695 306 HB1 ALA 486 1HB ALA 486 5.603 -6.203 12.110 307 HB2 ALA 486 2HB ALA 486 7.156 -5.409 11.846 308 HB3 ALA 486 3HB ALA 486 7.083 -6.949 12.715 309 HA PRO 487 HA PRO 487 4.944 -5.676 7.196 310 HB2 PRO 487 2HB PRO 487 2.229 -6.456 7.586 311 HB3 PRO 487 1HB PRO 487 3.389 -7.158 6.461 312 HG2 PRO 487 2HG PRO 487 2.318 -8.439 8.697 313 HG3 PRO 487 1HG PRO 487 3.756 -8.946 7.804 314 HD2 PRO 487 2HD PRO 487 3.540 -7.484 10.383 315 HD3 PRO 487 1HD PRO 487 4.772 -8.631 9.806 316 H ILE 488 H ILE 488 3.858 -3.776 6.803 317 HA ILE 488 HA ILE 488 2.913 -2.394 9.179 318 HB ILE 488 HB ILE 488 3.969 -1.234 6.545 319 HG12 ILE 488 2HG1 ILE 488 5.628 -2.011 8.279 320 HG13 ILE 488 1HG1 ILE 488 5.635 -0.303 7.827 321 HG21 ILE 488 1HG2 ILE 488 3.597 0.930 7.494 322 HG22 ILE 488 2HG2 ILE 488 2.717 0.112 8.812 323 HG23 ILE 488 3HG2 ILE 488 2.092 0.038 7.168 324 HD11 ILE 488 3HD1 ILE 488 4.640 0.349 9.839 325 HD12 ILE 488 1HD1 ILE 488 5.956 -0.758 10.235 326 HD13 ILE 488 2HD1 ILE 488 4.286 -1.336 10.280 327 H TYR 489 H TYR 489 0.942 -1.927 9.450 328 HA TYR 489 HA TYR 489 -0.890 -1.846 7.141 329 HB2 TYR 489 2HB TYR 489 -1.577 -2.700 9.980 330 HB3 TYR 489 1HB TYR 489 -2.691 -2.597 8.628 331 HD1 TYR 489 1HD TYR 489 -2.696 -4.221 6.881 332 HD2 TYR 489 2HD TYR 489 0.071 -4.478 10.085 333 HE1 TYR 489 1HE TYR 489 -2.105 -6.536 6.192 334 HE2 TYR 489 2HE TYR 489 0.662 -6.725 9.456 335 HH TYR 489 HH TYR 489 -0.425 -8.655 8.154 336 H VAL 490 H VAL 490 -2.413 -0.232 7.209 337 HA VAL 490 HA VAL 490 -1.624 2.156 8.471 338 HB VAL 490 HB VAL 490 -4.341 1.473 7.320 339 HG11 VAL 490 1HG1 VAL 490 -3.091 4.143 7.977 340 HG12 VAL 490 2HG1 VAL 490 -4.444 3.398 8.816 341 HG13 VAL 490 3HG1 VAL 490 -4.627 3.907 7.140 342 HG21 VAL 490 3HG2 VAL 490 -2.551 1.242 5.689 343 HG22 VAL 490 1HG2 VAL 490 -1.967 2.862 6.081 344 HG23 VAL 490 2HG2 VAL 490 -3.552 2.653 5.335 345 H LYS 491 H LYS 491 -1.755 2.667 10.444 346 HA LYS 491 HA LYS 491 -3.131 1.075 12.407 347 HB2 LYS 491 2HB LYS 491 -0.853 1.967 12.713 348 HB3 LYS 491 1HB LYS 491 -1.505 3.575 12.615 349 HG2 LYS 491 2HG LYS 491 -2.680 3.340 14.695 350 HG3 LYS 491 1HG LYS 491 -2.241 1.629 14.796 351 HD2 LYS 491 2HD LYS 491 -0.812 3.055 16.243 352 HD3 LYS 491 1HD LYS 491 0.122 2.216 15.007 353 HE2 LYS 491 2HE LYS 491 0.132 4.238 13.650 354 HE3 LYS 491 1HE LYS 491 -0.803 5.088 14.881 355 HZ1 LYS 491 3HZ LYS 491 1.064 4.791 16.398 356 HZ2 LYS 491 1HZ LYS 491 1.555 5.589 15.011 357 HZ3 LYS 491 2HZ LYS 491 1.930 3.963 15.214 358 H ASN 492 H ASN 492 -3.543 4.235 10.907 359 HA ASN 492 HA ASN 492 -6.154 4.495 11.995 360 HB2 ASN 492 2HB ASN 492 -4.864 5.125 13.975 361 HB3 ASN 492 1HB ASN 492 -3.998 6.341 13.047 362 HD21 ASN 492 1HD2 ASN 492 -7.015 5.461 14.487 363 HD22 ASN 492 2HD2 ASN 492 -7.717 7.037 14.448 364 H ILE 493 H ILE 493 -7.321 5.920 10.826 365 HA ILE 493 HA ILE 493 -5.926 7.568 8.834 366 HB ILE 493 HB ILE 493 -8.821 6.602 8.895 367 HG12 ILE 493 2HG1 ILE 493 -7.197 4.831 8.334 368 HG13 ILE 493 1HG1 ILE 493 -8.292 5.224 7.010 369 HG21 ILE 493 1HG2 ILE 493 -7.370 8.232 6.807 370 HG22 ILE 493 2HG2 ILE 493 -8.760 8.769 7.767 371 HG23 ILE 493 3HG2 ILE 493 -8.931 7.486 6.572 372 HD11 ILE 493 3HD1 ILE 493 -6.048 4.882 6.173 373 HD12 ILE 493 1HD1 ILE 493 -5.421 6.099 7.287 374 HD13 ILE 493 2HD1 ILE 493 -6.504 6.576 5.979 375 H LEU 494 H LEU 494 -5.677 9.541 9.690 376 HA LEU 494 HA LEU 494 -7.256 10.471 11.817 377 HB2 LEU 494 2HB LEU 494 -5.317 11.920 10.001 378 HB3 LEU 494 1HB LEU 494 -6.150 12.717 11.310 379 HG LEU 494 HG LEU 494 -4.997 11.174 12.916 380 HD11 LEU 494 1HD1 LEU 494 -3.413 10.295 10.517 381 HD12 LEU 494 2HD1 LEU 494 -4.526 9.299 11.457 382 HD13 LEU 494 3HD1 LEU 494 -3.048 9.912 12.199 383 HD21 LEU 494 3HD2 LEU 494 -4.137 13.394 12.503 384 HD22 LEU 494 1HD2 LEU 494 -3.203 12.804 11.130 385 HD23 LEU 494 2HD2 LEU 494 -2.814 12.259 12.761 386 HA PRO 495 HA PRO 495 -10.878 11.887 9.783 387 HB2 PRO 495 2HB PRO 495 -11.498 14.024 11.391 388 HB3 PRO 495 1HB PRO 495 -11.849 12.344 11.792 389 HG2 PRO 495 2HG PRO 495 -9.555 14.055 12.657 390 HG3 PRO 495 1HG PRO 495 -10.523 12.925 13.621 391 HD2 PRO 495 2HD PRO 495 -8.098 12.257 12.732 392 HD3 PRO 495 1HD PRO 495 -9.414 11.061 12.760 393 H ARG 496 H ARG 496 -8.098 13.706 9.920 394 HA ARG 496 HA ARG 496 -9.004 15.385 7.746 395 HB2 ARG 496 2HB ARG 496 -7.753 17.307 8.698 396 HB3 ARG 496 1HB ARG 496 -9.153 16.858 9.656 397 HG2 ARG 496 2HG ARG 496 -7.710 15.702 11.234 398 HG3 ARG 496 1HG ARG 496 -6.296 16.114 10.267 399 HD2 ARG 496 2HD ARG 496 -6.503 17.634 12.126 400 HD3 ARG 496 1HD ARG 496 -6.782 18.483 10.608 401 HE ARG 496 HE ARG 496 -9.251 17.673 11.531 402 HH11 ARG 496 1HH1 ARG 496 -6.650 19.811 12.568 403 HH12 ARG 496 2HH1 ARG 496 -7.633 20.860 13.469 404 HH21 ARG 496 1HH2 ARG 496 -10.645 19.115 12.786 405 HH22 ARG 496 2HH2 ARG 496 -9.946 20.447 13.599 406 H GLY 497 H GLY 497 -7.455 15.586 6.179 407 HA2 GLY 497 2HA GLY 497 -4.882 15.693 6.039 408 HA3 GLY 497 1HA GLY 497 -4.996 14.046 6.633 409 H ALA 498 H ALA 498 -3.806 13.755 4.515 410 HA ALA 498 HA ALA 498 -5.267 14.167 2.095 411 HB1 ALA 498 1HB ALA 498 -2.707 12.630 2.564 412 HB2 ALA 498 2HB ALA 498 -2.818 14.339 2.163 413 HB3 ALA 498 3HB ALA 498 -3.352 13.127 1.004 414 H ALA 499 H ALA 499 -4.321 11.340 3.985 415 HA ALA 499 HA ALA 499 -5.255 9.387 2.224 416 HB1 ALA 499 1HB ALA 499 -3.727 8.871 4.049 417 HB2 ALA 499 2HB ALA 499 -5.133 7.819 4.096 418 HB3 ALA 499 3HB ALA 499 -5.009 9.173 5.219 419 H ILE 500 H ILE 500 -7.031 10.964 4.869 420 HA ILE 500 HA ILE 500 -9.239 9.217 4.536 421 HB ILE 500 HB ILE 500 -8.828 10.445 6.688 422 HG12 ILE 500 2HG1 ILE 500 -11.531 10.849 5.394 423 HG13 ILE 500 1HG1 ILE 500 -10.975 9.404 6.189 424 HG21 ILE 500 1HG2 ILE 500 -8.220 12.632 5.793 425 HG22 ILE 500 2HG2 ILE 500 -9.572 12.775 6.917 426 HG23 ILE 500 3HG2 ILE 500 -9.856 12.848 5.176 427 HD11 ILE 500 3HD1 ILE 500 -11.394 12.052 7.553 428 HD12 ILE 500 1HD1 ILE 500 -10.893 10.534 8.308 429 HD13 ILE 500 2HD1 ILE 500 -12.498 10.670 7.599 430 H GLN 501 H GLN 501 -8.394 12.304 3.135 431 HA GLN 501 HA GLN 501 -10.936 12.784 1.937 432 HB2 GLN 501 2HB GLN 501 -8.216 13.827 1.314 433 HB3 GLN 501 1HB GLN 501 -9.662 14.409 0.496 434 HG2 GLN 501 2HG GLN 501 -10.553 15.141 2.688 435 HG3 GLN 501 1HG GLN 501 -9.050 14.623 3.442 436 HE21 GLN 501 1HE2 GLN 501 -7.224 15.780 3.105 437 HE22 GLN 501 2HE2 GLN 501 -7.199 17.390 2.468 438 H ASP 502 H ASP 502 -8.255 10.827 1.144 439 HA ASP 502 HA ASP 502 -8.947 10.512 -1.627 440 HB2 ASP 502 2HB ASP 502 -6.667 10.064 -0.976 441 HB3 ASP 502 1HB ASP 502 -7.199 8.873 0.208 442 H GLY 503 H GLY 503 -9.312 8.602 1.270 443 HA2 GLY 503 2HA GLY 503 -11.171 7.367 1.927 444 HA3 GLY 503 1HA GLY 503 -11.923 7.735 0.395 445 H ARG 504 H ARG 504 -8.984 6.427 -0.508 446 HA ARG 504 HA ARG 504 -10.213 3.773 -0.703 447 HB2 ARG 504 2HB ARG 504 -7.636 4.806 -1.908 448 HB3 ARG 504 1HB ARG 504 -8.386 3.255 -2.256 449 HG2 ARG 504 2HG ARG 504 -9.520 5.960 -2.895 450 HG3 ARG 504 1HG ARG 504 -8.749 4.866 -4.038 451 HD2 ARG 504 2HD ARG 504 -10.465 3.222 -3.654 452 HD3 ARG 504 1HD ARG 504 -11.227 4.269 -2.451 453 HE ARG 504 HE ARG 504 -10.935 5.659 -4.854 454 HH11 ARG 504 1HH1 ARG 504 -12.897 3.046 -3.496 455 HH12 ARG 504 2HH1 ARG 504 -14.227 3.341 -4.500 456 HH21 ARG 504 1HH2 ARG 504 -12.721 6.075 -6.200 457 HH22 ARG 504 2HH2 ARG 504 -14.141 5.123 -6.097 458 H LEU 505 H LEU 505 -7.375 5.425 0.402 459 HA LEU 505 HA LEU 505 -6.234 3.149 1.686 460 HB2 LEU 505 2HB LEU 505 -4.884 4.988 0.823 461 HB3 LEU 505 1HB LEU 505 -5.682 6.107 1.903 462 HG LEU 505 HG LEU 505 -4.652 4.984 3.832 463 HD11 LEU 505 1HD1 LEU 505 -3.249 3.312 1.744 464 HD12 LEU 505 2HD1 LEU 505 -4.435 2.727 2.916 465 HD13 LEU 505 3HD1 LEU 505 -2.876 3.356 3.466 466 HD21 LEU 505 3HD2 LEU 505 -2.713 5.780 1.675 467 HD22 LEU 505 1HD2 LEU 505 -2.377 5.728 3.406 468 HD23 LEU 505 2HD2 LEU 505 -3.555 6.875 2.770 469 H LYS 506 H LYS 506 -6.976 2.338 3.515 470 HA LYS 506 HA LYS 506 -8.127 4.081 5.493 471 HB2 LYS 506 2HB LYS 506 -9.444 1.571 4.438 472 HB3 LYS 506 1HB LYS 506 -9.948 2.388 5.911 473 HG2 LYS 506 2HG LYS 506 -10.502 4.381 4.614 474 HG3 LYS 506 1HG LYS 506 -9.969 3.574 3.142 475 HD2 LYS 506 2HD LYS 506 -11.721 1.891 3.428 476 HD3 LYS 506 1HD LYS 506 -12.234 2.679 4.924 477 HE2 LYS 506 2HE LYS 506 -12.772 4.709 3.678 478 HE3 LYS 506 1HE LYS 506 -12.232 3.949 2.189 479 HZ1 LYS 506 3HZ LYS 506 -14.613 3.897 2.387 480 HZ2 LYS 506 1HZ LYS 506 -14.541 3.071 3.844 481 HZ3 LYS 506 2HZ LYS 506 -14.018 2.330 2.416 482 H ALA 507 H ALA 507 -8.586 2.614 7.547 483 HA ALA 507 HA ALA 507 -6.053 1.745 8.402 484 HB1 ALA 507 1HB ALA 507 -7.157 1.150 10.485 485 HB2 ALA 507 2HB ALA 507 -8.737 1.304 9.712 486 HB3 ALA 507 3HB ALA 507 -7.707 2.725 9.916 487 H GLY 508 H GLY 508 -5.159 -0.216 8.551 488 HA2 GLY 508 2HA GLY 508 -5.155 -2.558 8.731 489 HA3 GLY 508 1HA GLY 508 -6.760 -2.647 8.063 490 H ASP 509 H ASP 509 -5.383 -0.577 5.988 491 HA ASP 509 HA ASP 509 -4.728 -2.669 4.140 492 HB2 ASP 509 2HB ASP 509 -4.491 0.352 3.859 493 HB3 ASP 509 1HB ASP 509 -4.103 -0.776 2.568 494 H ARG 510 H ARG 510 -2.786 -3.335 3.420 495 HA ARG 510 HA ARG 510 -0.643 -2.791 5.317 496 HB2 ARG 510 2HB ARG 510 -1.222 -5.116 4.838 497 HB3 ARG 510 1HB ARG 510 -0.883 -4.898 3.137 498 HG2 ARG 510 2HG ARG 510 1.482 -4.295 3.835 499 HG3 ARG 510 1HG ARG 510 1.048 -4.855 5.446 500 HD2 ARG 510 2HD ARG 510 0.974 -6.506 2.913 501 HD3 ARG 510 1HD ARG 510 2.207 -6.561 4.183 502 HE ARG 510 HE ARG 510 -0.035 -7.175 5.501 503 HH11 ARG 510 1HH1 ARG 510 1.416 -8.443 2.517 504 HH12 ARG 510 2HH1 ARG 510 0.804 -10.022 2.750 505 HH21 ARG 510 1HH2 ARG 510 -0.802 -9.345 5.805 506 HH22 ARG 510 2HH2 ARG 510 -0.472 -10.548 4.610 507 H LEU 511 H LEU 511 1.029 -1.578 4.814 508 HA LEU 511 HA LEU 511 1.067 -0.261 2.241 509 HB2 LEU 511 2HB LEU 511 1.560 0.773 4.665 510 HB3 LEU 511 1HB LEU 511 3.120 0.054 4.422 511 HG LEU 511 HG LEU 511 1.951 2.174 2.620 512 HD11 LEU 511 1HD1 LEU 511 2.373 3.051 4.813 513 HD12 LEU 511 2HD1 LEU 511 3.559 3.670 3.663 514 HD13 LEU 511 3HD1 LEU 511 4.008 2.392 4.792 515 HD21 LEU 511 3HD2 LEU 511 4.741 1.030 2.755 516 HD22 LEU 511 1HD2 LEU 511 4.231 2.384 1.740 517 HD23 LEU 511 2HD2 LEU 511 3.578 0.769 1.456 518 H ILE 512 H ILE 512 2.332 -0.897 0.536 519 HA ILE 512 HA ILE 512 4.195 -3.123 1.009 520 HB ILE 512 HB ILE 512 2.711 -2.336 -1.502 521 HG12 ILE 512 2HG1 ILE 512 1.255 -3.353 0.161 522 HG13 ILE 512 1HG1 ILE 512 1.485 -4.418 -1.211 523 HG21 ILE 512 1HG2 ILE 512 4.536 -4.691 -1.044 524 HG22 ILE 512 2HG2 ILE 512 4.874 -3.299 -2.070 525 HG23 ILE 512 3HG2 ILE 512 3.569 -4.411 -2.489 526 HD11 ILE 512 3HD1 ILE 512 3.113 -5.717 0.053 527 HD12 ILE 512 1HD1 ILE 512 1.544 -5.675 0.848 528 HD13 ILE 512 2HD1 ILE 512 2.858 -4.676 1.462 529 H GLU 513 H GLU 513 3.821 -0.407 -1.304 530 HA GLU 513 HA GLU 513 6.643 0.078 -1.118 531 HB2 GLU 513 2HB GLU 513 7.058 -0.218 -3.527 532 HB3 GLU 513 1HB GLU 513 6.600 -1.722 -2.744 533 HG2 GLU 513 2HG GLU 513 4.353 -1.485 -3.610 534 HG3 GLU 513 1HG GLU 513 4.824 0.025 -4.409 535 H VAL 514 H VAL 514 7.265 1.907 -2.477 536 HA VAL 514 HA VAL 514 5.022 3.742 -2.829 537 HB VAL 514 HB VAL 514 6.004 4.237 -0.645 538 HG11 VAL 514 1HG1 VAL 514 8.275 5.114 -0.395 539 HG12 VAL 514 2HG1 VAL 514 8.580 4.791 -2.104 540 HG13 VAL 514 3HG1 VAL 514 8.290 3.453 -1.004 541 HG21 VAL 514 3HG2 VAL 514 6.442 6.609 -0.981 542 HG22 VAL 514 1HG2 VAL 514 5.069 6.016 -1.927 543 HG23 VAL 514 2HG2 VAL 514 6.620 6.306 -2.713 544 H ASN 515 H ASN 515 4.990 4.508 -4.782 545 HA ASN 515 HA ASN 515 5.536 5.276 -6.871 546 HB2 ASN 515 2HB ASN 515 8.080 6.131 -5.469 547 HB3 ASN 515 1HB ASN 515 7.672 6.586 -7.109 548 HD21 ASN 515 1HD2 ASN 515 7.732 8.757 -6.539 549 HD22 ASN 515 2HD2 ASN 515 6.499 9.530 -5.631 550 H GLY 516 H GLY 516 6.714 2.534 -5.878 551 HA2 GLY 516 2HA GLY 516 7.379 0.909 -7.571 552 HA3 GLY 516 1HA GLY 516 8.394 2.164 -8.276 553 H VAL 517 H VAL 517 8.780 2.614 -5.101 554 HA VAL 517 HA VAL 517 11.192 0.973 -4.983 555 HB VAL 517 HB VAL 517 10.187 3.141 -3.100 556 HG11 VAL 517 1HG1 VAL 517 12.880 1.799 -3.250 557 HG12 VAL 517 2HG1 VAL 517 11.675 1.593 -1.974 558 HG13 VAL 517 3HG1 VAL 517 12.468 3.151 -2.194 559 HG21 VAL 517 3HG2 VAL 517 10.703 4.084 -5.288 560 HG22 VAL 517 1HG2 VAL 517 12.291 3.316 -5.261 561 HG23 VAL 517 2HG2 VAL 517 11.904 4.588 -4.101 562 H ASP 518 H ASP 518 11.078 -0.921 -3.919 563 HA ASP 518 HA ASP 518 8.679 -1.565 -2.423 564 HB2 ASP 518 2HB ASP 518 9.634 -3.252 -3.960 565 HB3 ASP 518 1HB ASP 518 11.101 -3.291 -2.990 566 H LEU 519 H LEU 519 8.425 -1.426 -0.397 567 HA LEU 519 HA LEU 519 10.740 -1.541 1.359 568 HB2 LEU 519 2HB LEU 519 9.311 -0.139 2.940 569 HB3 LEU 519 1HB LEU 519 10.104 0.675 1.605 570 HG LEU 519 HG LEU 519 7.227 -0.159 1.256 571 HD11 LEU 519 1HD1 LEU 519 8.194 2.388 2.560 572 HD12 LEU 519 2HD1 LEU 519 7.344 1.084 3.419 573 HD13 LEU 519 3HD1 LEU 519 6.538 1.956 2.109 574 HD21 LEU 519 3HD2 LEU 519 8.911 2.129 0.365 575 HD22 LEU 519 1HD2 LEU 519 7.248 1.800 -0.130 576 HD23 LEU 519 2HD2 LEU 519 8.552 0.692 -0.584 577 H ALA 520 H ALA 520 8.338 -3.285 0.292 578 HA ALA 520 HA ALA 520 7.088 -4.155 2.704 579 HB1 ALA 520 1HB ALA 520 5.946 -4.368 0.569 580 HB2 ALA 520 2HB ALA 520 6.173 -5.962 1.286 581 HB3 ALA 520 3HB ALA 520 7.219 -5.421 -0.033 582 H GLY 521 H GLY 521 9.891 -4.947 0.861 583 HA2 GLY 521 2HA GLY 521 10.502 -7.272 2.504 584 HA3 GLY 521 1HA GLY 521 11.469 -6.649 1.168 585 H LYS 522 H LYS 522 10.575 -4.126 3.115 586 HA LYS 522 HA LYS 522 13.180 -4.066 4.408 587 HB2 LYS 522 2HB LYS 522 11.102 -1.929 3.972 588 HB3 LYS 522 1HB LYS 522 12.419 -1.713 5.104 589 HG2 LYS 522 2HG LYS 522 12.681 -2.148 2.126 590 HG3 LYS 522 1HG LYS 522 12.893 -0.620 2.985 591 HD2 LYS 522 2HD LYS 522 14.714 -1.845 4.327 592 HD3 LYS 522 1HD LYS 522 14.598 -3.093 3.105 593 HE2 LYS 522 2HE LYS 522 16.421 -1.600 2.534 594 HE3 LYS 522 1HE LYS 522 15.117 -1.407 1.361 595 HZ1 LYS 522 3HZ LYS 522 15.602 0.416 3.683 596 HZ2 LYS 522 1HZ LYS 522 14.447 0.644 2.474 597 HZ3 LYS 522 2HZ LYS 522 16.064 0.734 2.106 598 H SER 523 H SER 523 13.329 -3.345 6.634 599 HA SER 523 HA SER 523 11.521 -4.861 8.244 600 HB2 SER 523 2HB SER 523 13.908 -3.148 8.950 601 HB3 SER 523 1HB SER 523 13.081 -4.268 10.049 602 HG SER 523 HG SER 523 14.401 -4.915 7.629 603 H GLN 524 H GLN 524 10.598 -3.715 10.354 604 HA GLN 524 HA GLN 524 8.867 -1.702 9.508 605 HB2 GLN 524 2HB GLN 524 8.166 -1.429 11.811 606 HB3 GLN 524 1HB GLN 524 8.344 -3.131 11.429 607 HG2 GLN 524 2HG GLN 524 10.361 -3.284 12.667 608 HG3 GLN 524 1HG GLN 524 10.468 -1.538 12.841 609 HE21 GLN 524 1HE2 GLN 524 8.867 -4.404 13.867 610 HE22 GLN 524 2HE2 GLN 524 8.104 -3.705 15.259 611 H GLU 525 H GLU 525 11.907 -1.480 11.201 612 HA GLU 525 HA GLU 525 11.748 1.199 11.980 613 HB2 GLU 525 2HB GLU 525 14.025 -0.635 11.438 614 HB3 GLU 525 1HB GLU 525 14.308 1.010 12.034 615 HG2 GLU 525 2HG GLU 525 13.056 0.499 14.019 616 HG3 GLU 525 1HG GLU 525 12.620 -1.085 13.402 617 H GLU 526 H GLU 526 12.611 -0.207 8.936 618 HA GLU 526 HA GLU 526 13.792 2.075 7.740 619 HB2 GLU 526 2HB GLU 526 12.298 -0.262 6.592 620 HB3 GLU 526 1HB GLU 526 13.173 0.918 5.631 621 HG2 GLU 526 2HG GLU 526 14.423 -0.777 7.752 622 HG3 GLU 526 1HG GLU 526 14.366 -1.240 6.061 623 H VAL 527 H VAL 527 10.570 0.659 7.739 624 HA VAL 527 HA VAL 527 9.553 2.698 6.041 625 HB VAL 527 HB VAL 527 7.409 1.469 6.126 626 HG11 VAL 527 1HG1 VAL 527 8.242 -0.534 5.014 627 HG12 VAL 527 2HG1 VAL 527 9.831 -0.266 5.749 628 HG13 VAL 527 3HG1 VAL 527 9.207 0.891 4.579 629 HG21 VAL 527 3HG2 VAL 527 8.905 -0.350 7.992 630 HG22 VAL 527 1HG2 VAL 527 7.341 -0.684 7.245 631 HG23 VAL 527 2HG2 VAL 527 7.494 0.643 8.399 632 H VAL 528 H VAL 528 9.338 2.014 9.472 633 HA VAL 528 HA VAL 528 7.361 3.935 10.014 634 HB VAL 528 HB VAL 528 9.591 2.921 11.840 635 HG11 VAL 528 1HG1 VAL 528 8.761 5.106 12.618 636 HG12 VAL 528 2HG1 VAL 528 8.262 3.812 13.708 637 HG13 VAL 528 3HG1 VAL 528 7.108 4.496 12.563 638 HG21 VAL 528 3HG2 VAL 528 6.667 2.201 11.670 639 HG22 VAL 528 1HG2 VAL 528 7.812 1.529 12.839 640 HG23 VAL 528 2HG2 VAL 528 7.999 1.190 11.123 641 H SER 529 H SER 529 10.818 4.144 9.633 642 HA SER 529 HA SER 529 11.025 6.852 10.359 643 HB2 SER 529 2HB SER 529 12.803 5.172 8.588 644 HB3 SER 529 1HB SER 529 13.227 6.752 9.250 645 HG SER 529 HG SER 529 12.982 4.274 10.506 646 H LEU 530 H LEU 530 10.369 5.222 7.318 647 HA LEU 530 HA LEU 530 10.583 7.402 5.574 648 HB2 LEU 530 2HB LEU 530 8.910 4.973 5.581 649 HB3 LEU 530 1HB LEU 530 8.903 6.029 4.184 650 HG LEU 530 HG LEU 530 11.218 4.406 5.285 651 HD11 LEU 530 1HD1 LEU 530 9.726 4.224 2.679 652 HD12 LEU 530 2HD1 LEU 530 9.569 3.112 4.040 653 HD13 LEU 530 3HD1 LEU 530 11.095 3.225 3.170 654 HD21 LEU 530 3HD2 LEU 530 12.488 5.205 3.352 655 HD22 LEU 530 1HD2 LEU 530 12.077 6.520 4.446 656 HD23 LEU 530 2HD2 LEU 530 11.177 6.307 2.942 657 H LEU 531 H LEU 531 7.624 6.101 7.181 658 HA LEU 531 HA LEU 531 6.042 8.192 6.238 659 HB2 LEU 531 2HB LEU 531 5.663 6.077 8.333 660 HB3 LEU 531 1HB LEU 531 4.460 7.327 8.084 661 HG LEU 531 HG LEU 531 3.885 5.273 7.011 662 HD11 LEU 531 1HD1 LEU 531 3.100 7.317 5.981 663 HD12 LEU 531 2HD1 LEU 531 3.418 6.108 4.738 664 HD13 LEU 531 3HD1 LEU 531 4.564 7.424 5.002 665 HD21 LEU 531 3HD2 LEU 531 6.382 5.588 5.355 666 HD22 LEU 531 1HD2 LEU 531 5.110 4.407 5.041 667 HD23 LEU 531 2HD2 LEU 531 6.053 4.318 6.529 668 H ARG 532 H ARG 532 7.898 7.785 9.174 669 HA ARG 532 HA ARG 532 6.853 10.038 10.500 670 HB2 ARG 532 2HB ARG 532 8.190 8.211 11.574 671 HB3 ARG 532 1HB ARG 532 9.614 8.791 10.745 672 HG2 ARG 532 2HG ARG 532 8.084 10.407 12.789 673 HG3 ARG 532 1HG ARG 532 9.445 9.369 13.182 674 HD2 ARG 532 2HD ARG 532 9.494 11.769 11.350 675 HD3 ARG 532 1HD ARG 532 10.124 11.707 12.999 676 HE ARG 532 HE ARG 532 11.487 9.751 11.880 677 HH11 ARG 532 1HH1 ARG 532 10.862 13.031 10.609 678 HH12 ARG 532 2HH1 ARG 532 12.343 13.090 9.774 679 HH21 ARG 532 1HH2 ARG 532 13.495 9.896 10.699 680 HH22 ARG 532 2HH2 ARG 532 13.836 11.318 9.822 681 H SER 533 H SER 533 9.406 9.683 8.099 682 HA SER 533 HA SER 533 10.582 12.214 8.367 683 HB2 SER 533 2HB SER 533 10.483 10.404 5.949 684 HB3 SER 533 1HB SER 533 11.537 11.806 6.111 685 HG SER 533 HG SER 533 11.513 9.438 7.663 686 H THR 534 H THR 534 7.835 11.198 6.418 687 HA THR 534 HA THR 534 6.358 12.225 5.125 688 HB THR 534 HB THR 534 5.507 14.505 5.815 689 HG1 THR 534 1HG THR 534 7.852 14.613 6.996 690 HG21 THR 534 3HG2 THR 534 5.835 12.475 8.026 691 HG22 THR 534 1HG2 THR 534 4.569 12.480 6.799 692 HG23 THR 534 2HG2 THR 534 4.636 13.769 8.000 693 H LYS 535 H LYS 535 7.294 12.158 3.215 694 HA LYS 535 HA LYS 535 9.152 14.003 2.150 695 HB2 LYS 535 2HB LYS 535 8.756 11.706 1.322 696 HB3 LYS 535 1HB LYS 535 7.168 12.194 0.759 697 HG2 LYS 535 2HG LYS 535 8.203 13.687 -0.860 698 HG3 LYS 535 1HG LYS 535 9.802 13.237 -0.258 699 HD2 LYS 535 2HD LYS 535 9.343 10.894 -0.848 700 HD3 LYS 535 1HD LYS 535 7.784 11.379 -1.509 701 HE2 LYS 535 2HE LYS 535 8.906 12.796 -3.139 702 HE3 LYS 535 1HE LYS 535 10.465 12.353 -2.457 703 HZ1 LYS 535 3HZ LYS 535 10.012 10.055 -3.058 704 HZ2 LYS 535 1HZ LYS 535 10.032 11.049 -4.413 705 HZ3 LYS 535 2HZ LYS 535 8.558 10.496 -3.779 706 H MET 536 H MET 536 8.819 16.070 1.458 707 HA MET 536 HA MET 536 6.053 17.098 1.290 708 HB2 MET 536 2HB MET 536 7.694 18.151 2.873 709 HB3 MET 536 1HB MET 536 8.673 18.600 1.492 710 HG2 MET 536 2HG MET 536 6.825 20.005 0.663 711 HG3 MET 536 1HG MET 536 5.884 19.573 2.086 712 HE1 MET 536 3HE MET 536 5.500 22.160 2.605 713 HE2 MET 536 1HE MET 536 6.439 22.556 1.166 714 HE3 MET 536 2HE MET 536 6.819 23.326 2.702 715 H GLU 537 H GLU 537 7.965 15.815 -0.866 716 HA GLU 537 HA GLU 537 8.239 17.651 -2.851 717 HB2 GLU 537 2HB GLU 537 9.295 15.475 -3.011 718 HB3 GLU 537 1HB GLU 537 7.734 14.690 -3.155 719 HG2 GLU 537 2HG GLU 537 7.391 15.758 -5.328 720 HG3 GLU 537 1HG GLU 537 8.961 16.546 -5.181 721 H GLY 538 H GLY 538 5.396 15.749 -2.133 722 HA2 GLY 538 2HA GLY 538 3.378 17.306 -2.802 723 HA3 GLY 538 1HA GLY 538 3.857 16.795 -4.413 724 H THR 539 H THR 539 3.144 14.878 -5.154 725 HA THR 539 HA THR 539 1.496 13.378 -3.332 726 HB THR 539 HB THR 539 1.068 11.958 -5.379 727 HG1 THR 539 1HG THR 539 1.848 14.057 -7.022 728 HG21 THR 539 3HG2 THR 539 -0.537 13.462 -6.332 729 HG22 THR 539 1HG2 THR 539 0.226 14.863 -5.544 730 HG23 THR 539 2HG2 THR 539 -0.552 13.586 -4.585 731 H VAL 540 H VAL 540 1.721 11.310 -2.896 732 HA VAL 540 HA VAL 540 4.191 9.941 -3.628 733 HB VAL 540 HB VAL 540 2.899 10.201 -0.886 734 HG11 VAL 540 1HG1 VAL 540 3.326 7.820 -1.313 735 HG12 VAL 540 2HG1 VAL 540 4.430 8.467 -0.097 736 HG13 VAL 540 3HG1 VAL 540 4.989 8.219 -1.751 737 HG21 VAL 540 3HG2 VAL 540 5.156 10.790 -0.197 738 HG22 VAL 540 1HG2 VAL 540 4.595 11.835 -1.506 739 HG23 VAL 540 2HG2 VAL 540 5.726 10.533 -1.846 740 H SER 541 H SER 541 3.784 7.977 -4.491 741 HA SER 541 HA SER 541 1.007 7.126 -4.456 742 HB2 SER 541 2HB SER 541 3.308 6.229 -6.203 743 HB3 SER 541 1HB SER 541 1.615 5.772 -6.396 744 HG SER 541 HG SER 541 2.207 8.491 -6.321 745 H LEU 542 H LEU 542 0.505 5.730 -3.006 746 HA LEU 542 HA LEU 542 2.566 3.956 -1.943 747 HB2 LEU 542 2HB LEU 542 -0.144 4.701 -0.886 748 HB3 LEU 542 1HB LEU 542 0.998 3.635 -0.102 749 HG LEU 542 HG LEU 542 1.455 6.573 -0.620 750 HD11 LEU 542 1HD1 LEU 542 0.834 5.064 1.878 751 HD12 LEU 542 2HD1 LEU 542 -0.294 6.116 1.005 752 HD13 LEU 542 3HD1 LEU 542 1.164 6.799 1.740 753 HD21 LEU 542 3HD2 LEU 542 3.019 4.553 0.964 754 HD22 LEU 542 1HD2 LEU 542 3.295 6.290 0.916 755 HD23 LEU 542 2HD2 LEU 542 3.525 5.322 -0.558 756 H LEU 543 H LEU 543 2.548 2.067 -2.718 757 HA LEU 543 HA LEU 543 0.125 0.925 -3.847 758 HB2 LEU 543 2HB LEU 543 2.441 0.852 -4.995 759 HB3 LEU 543 1HB LEU 543 2.920 -0.143 -3.672 760 HG LEU 543 HG LEU 543 2.518 -1.433 -5.736 761 HD11 LEU 543 1HD1 LEU 543 2.375 -2.573 -3.625 762 HD12 LEU 543 2HD1 LEU 543 1.263 -3.236 -4.812 763 HD13 LEU 543 3HD1 LEU 543 0.650 -2.198 -3.518 764 HD21 LEU 543 3HD2 LEU 543 0.697 -0.179 -6.692 765 HD22 LEU 543 1HD2 LEU 543 -0.361 -0.636 -5.356 766 HD23 LEU 543 2HD2 LEU 543 0.221 -1.864 -6.474 767 H VAL 544 H VAL 544 -1.071 -0.193 -2.521 768 HA VAL 544 HA VAL 544 0.139 -1.291 -0.098 769 HB VAL 544 HB VAL 544 -1.913 -0.884 1.113 770 HG11 VAL 544 1HG1 VAL 544 -0.997 1.610 -0.289 771 HG12 VAL 544 2HG1 VAL 544 -0.278 0.900 1.153 772 HG13 VAL 544 3HG1 VAL 544 -1.913 1.561 1.217 773 HG21 VAL 544 3HG2 VAL 544 -3.507 -1.156 -0.674 774 HG22 VAL 544 1HG2 VAL 544 -2.966 0.341 -1.435 775 HG23 VAL 544 2HG2 VAL 544 -3.785 0.389 0.135 776 H PHE 545 H PHE 545 -1.068 -3.044 0.810 777 HA PHE 545 HA PHE 545 -2.231 -4.836 -1.238 778 HB2 PHE 545 2HB PHE 545 -0.075 -5.503 -0.259 779 HB3 PHE 545 1HB PHE 545 -0.749 -5.417 1.352 780 HD1 PHE 545 1HD PHE 545 -0.470 -7.273 -1.734 781 HD2 PHE 545 2HD PHE 545 -2.250 -7.203 2.116 782 HE1 PHE 545 1HE PHE 545 -0.974 -9.642 -1.948 783 HE2 PHE 545 2HE PHE 545 -2.758 -9.599 1.929 784 HZ PHE 545 HZ PHE 545 -2.119 -10.835 -0.106 785 H ARG 546 H ARG 546 -4.280 -4.914 -0.983 786 HA ARG 546 HA ARG 546 -5.443 -4.172 1.565 787 HB2 ARG 546 2HB ARG 546 -6.068 -2.850 -0.407 788 HB3 ARG 546 1HB ARG 546 -6.639 -4.307 -1.197 789 HG2 ARG 546 2HG ARG 546 -8.462 -4.503 0.291 790 HG3 ARG 546 1HG ARG 546 -7.797 -3.267 1.368 791 HD2 ARG 546 2HD ARG 546 -8.012 -1.605 -0.405 792 HD3 ARG 546 1HD ARG 546 -8.691 -2.829 -1.469 793 HE ARG 546 HE ARG 546 -10.643 -2.792 -0.273 794 HH11 ARG 546 1HH1 ARG 546 -8.251 -0.733 1.384 795 HH12 ARG 546 2HH1 ARG 546 -9.350 0.350 2.024 796 HH21 ARG 546 1HH2 ARG 546 -12.248 -1.301 0.654 797 HH22 ARG 546 2HH2 ARG 546 -11.761 -0.009 1.623 798 H GLN 547 H GLN 547 -6.136 -5.675 2.754 799 HA GLN 547 HA GLN 547 -6.896 -8.289 1.675 800 HB2 GLN 547 2HB GLN 547 -4.603 -8.436 2.303 801 HB3 GLN 547 1HB GLN 547 -4.907 -7.613 3.820 802 HG2 GLN 547 2HG GLN 547 -6.295 -9.545 4.513 803 HG3 GLN 547 1HG GLN 547 -5.796 -10.364 3.029 804 HE21 GLN 547 1HE2 GLN 547 -4.725 -9.050 6.065 805 HE22 GLN 547 2HE2 GLN 547 -3.247 -9.922 6.139 806 H GLU 548 H GLU 548 -8.802 -8.881 2.581 807 HA GLU 548 HA GLU 548 -9.672 -7.410 4.929 808 HB2 GLU 548 2HB GLU 548 -11.306 -7.725 3.059 809 HB3 GLU 548 1HB GLU 548 -11.235 -9.464 3.329 810 HG2 GLU 548 2HG GLU 548 -12.086 -9.108 5.627 811 HG3 GLU 548 1HG GLU 548 -12.236 -7.391 5.284 812 H GLU 549 H GLU 549 -8.198 -8.259 6.338 813 HA GLU 549 HA GLU 549 -7.636 -9.463 8.144 814 HB2 GLU 549 2HB GLU 549 -9.961 -9.685 8.667 815 HB3 GLU 549 1HB GLU 549 -10.138 -11.013 7.530 816 HG2 GLU 549 2HG GLU 549 -8.633 -12.371 8.896 817 HG3 GLU 549 1HG GLU 549 -8.494 -11.036 10.035 818 H ALA 550 H ALA 550 -6.032 -10.833 8.462 819 HA ALA 550 HA ALA 550 -5.835 -13.215 6.757 820 HB1 ALA 550 1HB ALA 550 -3.667 -11.721 8.242 821 HB2 ALA 550 2HB ALA 550 -3.922 -11.701 6.489 822 HB3 ALA 550 3HB ALA 550 -3.440 -13.195 7.299 823 H PHE 551 H PHE 551 -6.534 -14.913 7.880 824 HA PHE 551 HA PHE 551 -6.491 -14.736 10.767 825 HB2 PHE 551 2HB PHE 551 -8.549 -15.421 9.620 826 HB3 PHE 551 1HB PHE 551 -7.724 -16.830 8.972 827 HD1 PHE 551 1HD PHE 551 -8.922 -15.239 12.068 828 HD2 PHE 551 2HD PHE 551 -7.420 -18.802 10.294 829 HE1 PHE 551 1HE PHE 551 -9.495 -16.488 14.104 830 HE2 PHE 551 2HE PHE 551 -7.990 -20.057 12.324 831 HZ PHE 551 HZ PHE 551 -9.030 -18.899 14.238 832 H HIS 552 H HIS 552 -5.311 -15.961 12.043 833 HA HIS 552 HA HIS 552 -3.544 -17.972 10.826 834 HB2 HIS 552 2HB HIS 552 -1.734 -17.317 12.355 835 HB3 HIS 552 1HB HIS 552 -2.247 -15.896 11.461 836 HD1 HIS 552 1HD HIS 552 -1.772 -17.182 14.895 837 HD2 HIS 552 2HD HIS 552 -3.830 -14.067 13.077 838 HE1 HIS 552 1HE HIS 552 -2.359 -15.623 16.720 839 HE2 HIS 552 2HE HIS 552 -3.930 -14.002 15.625 840 HA PRO 553 HA PRO 553 -5.219 -20.782 13.854 841 HB2 PRO 553 2HB PRO 553 -2.818 -21.813 14.866 842 HB3 PRO 553 1HB PRO 553 -3.717 -22.467 13.490 843 HG2 PRO 553 2HG PRO 553 -1.349 -20.661 13.533 844 HG3 PRO 553 1HG PRO 553 -1.751 -21.951 12.385 845 HD2 PRO 553 2HD PRO 553 -2.055 -19.378 11.736 846 HD3 PRO 553 1HD PRO 553 -3.234 -20.592 11.207 847 H ARG 554 H ARG 554 -5.834 -20.602 15.818 848 HA ARG 554 HA ARG 554 -4.996 -18.370 17.365 849 HB2 ARG 554 2HB ARG 554 -6.722 -19.116 18.976 850 HB3 ARG 554 1HB ARG 554 -7.323 -18.955 17.335 851 HG2 ARG 554 2HG ARG 554 -7.082 -21.420 17.071 852 HG3 ARG 554 1HG ARG 554 -6.636 -21.502 18.774 853 HD2 ARG 554 2HD ARG 554 -9.174 -20.345 17.714 854 HD3 ARG 554 1HD ARG 554 -9.026 -21.995 18.314 855 HE ARG 554 HE ARG 554 -8.180 -20.664 20.429 856 HH11 ARG 554 1HH1 ARG 554 -10.926 -19.835 18.341 857 HH12 ARG 554 2HH1 ARG 554 -11.882 -19.224 19.607 858 HH21 ARG 554 1HH2 ARG 554 -9.539 -19.818 22.195 859 HH22 ARG 554 2HH2 ARG 554 -11.079 -19.211 21.805 860 H GLU 555 H GLU 555 -3.856 -18.251 19.155 861 HA GLU 555 HA GLU 555 -2.005 -20.339 19.719 862 HB2 GLU 555 2HB GLU 555 -2.543 -17.771 21.221 863 HB3 GLU 555 1HB GLU 555 -1.132 -18.799 21.411 864 HG2 GLU 555 2HG GLU 555 -0.449 -18.308 19.131 865 HG3 GLU 555 1HG GLU 555 -1.883 -17.316 18.901 866 H MET 556 H MET 556 -2.835 -22.088 20.675 867 HA MET 556 HA MET 556 -4.760 -21.756 22.823 868 HB2 MET 556 2HB MET 556 -3.641 -24.290 21.589 869 HB3 MET 556 1HB MET 556 -4.884 -24.244 22.827 870 HG2 MET 556 2HG MET 556 -6.381 -23.069 21.285 871 HG3 MET 556 1HG MET 556 -5.132 -23.097 20.049 872 HE1 MET 556 3HE MET 556 -3.900 -26.058 20.469 873 HE2 MET 556 1HE MET 556 -4.235 -25.333 18.894 874 HE3 MET 556 2HE MET 556 -4.843 -26.945 19.279 875 H ASN 557 H ASN 557 -3.530 -20.777 24.335 876 HA ASN 557 HA ASN 557 -2.122 -22.337 26.192 877 HB2 ASN 557 2HB ASN 557 -0.325 -22.175 24.400 878 HB3 ASN 557 1HB ASN 557 -0.414 -20.427 24.539 879 HD21 ASN 557 1HD2 ASN 557 -0.520 -22.739 27.247 880 HD22 ASN 557 2HD2 ASN 557 0.947 -22.218 27.951 881 H ALA 558 H ALA 558 -1.316 -20.798 27.944 882 HA ALA 558 HA ALA 558 -2.410 -18.117 27.710 883 HB1 ALA 558 1HB ALA 558 -3.328 -18.286 29.991 884 HB2 ALA 558 2HB ALA 558 -2.861 -19.985 30.047 885 HB3 ALA 558 3HB ALA 558 -4.093 -19.449 28.904 Start of MODEL 8 1 H1 GLY 448 1HT GLY 448 -23.522 0.696 -17.325 2 H2 GLY 448 2HT GLY 448 -25.151 0.373 -17.181 3 H3 GLY 448 3HT GLY 448 -24.423 0.456 -18.722 4 HA2 GLY 448 1HA GLY 448 -24.820 -1.856 -18.002 5 HA3 GLY 448 2HA GLY 448 -23.108 -1.482 -18.222 6 H SER 449 H SER 449 -23.809 -3.597 -16.613 7 HA SER 449 HA SER 449 -23.883 -2.617 -13.912 8 HB2 SER 449 2HB SER 449 -23.670 -5.437 -14.975 9 HB3 SER 449 1HB SER 449 -23.904 -4.994 -13.280 10 HG SER 449 HG SER 449 -25.745 -3.697 -14.542 11 H VAL 450 H VAL 450 -22.012 -1.501 -13.616 12 HA VAL 450 HA VAL 450 -19.505 -2.869 -14.023 13 HB VAL 450 HB VAL 450 -20.004 -0.161 -12.734 14 HG11 VAL 450 1HG1 VAL 450 -17.627 0.252 -13.157 15 HG12 VAL 450 2HG1 VAL 450 -17.462 -1.386 -13.786 16 HG13 VAL 450 3HG1 VAL 450 -17.871 -1.132 -12.090 17 HG21 VAL 450 3HG2 VAL 450 -19.184 -0.787 -15.571 18 HG22 VAL 450 1HG2 VAL 450 -19.327 0.820 -14.856 19 HG23 VAL 450 2HG2 VAL 450 -20.762 -0.182 -15.057 20 H TYR 451 H TYR 451 -19.364 -4.467 -12.637 21 HA TYR 451 HA TYR 451 -19.225 -3.793 -9.838 22 HB2 TYR 451 2HB TYR 451 -21.567 -4.561 -10.189 23 HB3 TYR 451 1HB TYR 451 -20.956 -6.055 -10.878 24 HD1 TYR 451 1HD TYR 451 -21.075 -4.047 -7.761 25 HD2 TYR 451 2HD TYR 451 -20.420 -7.892 -9.463 26 HE1 TYR 451 1HE TYR 451 -21.082 -5.038 -5.516 27 HE2 TYR 451 2HE TYR 451 -20.425 -8.894 -7.220 28 HH TYR 451 HH TYR 451 -21.513 -7.191 -4.504 29 H ASN 452 H ASN 452 -17.096 -4.115 -9.923 30 HA ASN 452 HA ASN 452 -16.272 -6.818 -10.596 31 HB2 ASN 452 2HB ASN 452 -15.297 -5.263 -12.175 32 HB3 ASN 452 1HB ASN 452 -14.696 -4.252 -10.867 33 HD21 ASN 452 1HD2 ASN 452 -12.841 -4.852 -9.800 34 HD22 ASN 452 2HD2 ASN 452 -11.810 -6.117 -10.355 35 H THR 453 H THR 453 -16.422 -7.749 -8.701 36 HA THR 453 HA THR 453 -15.032 -6.524 -6.478 37 HB THR 453 HB THR 453 -17.062 -8.774 -6.504 38 HG1 THR 453 1HG THR 453 -17.141 -6.008 -5.999 39 HG21 THR 453 3HG2 THR 453 -17.047 -8.536 -4.056 40 HG22 THR 453 1HG2 THR 453 -15.781 -7.313 -4.172 41 HG23 THR 453 2HG2 THR 453 -15.442 -8.980 -4.640 42 H LYS 454 H LYS 454 -13.019 -7.114 -6.589 43 HA LYS 454 HA LYS 454 -12.394 -9.883 -7.229 44 HB2 LYS 454 2HB LYS 454 -11.284 -8.320 -8.679 45 HB3 LYS 454 1HB LYS 454 -10.647 -7.431 -7.301 46 HG2 LYS 454 2HG LYS 454 -9.281 -9.283 -6.666 47 HG3 LYS 454 1HG LYS 454 -9.939 -10.293 -7.954 48 HD2 LYS 454 2HD LYS 454 -8.371 -7.736 -8.344 49 HD3 LYS 454 1HD LYS 454 -7.713 -9.362 -8.493 50 HE2 LYS 454 2HE LYS 454 -9.956 -8.233 -10.179 51 HE3 LYS 454 1HE LYS 454 -8.276 -8.369 -10.680 52 HZ1 LYS 454 3HZ LYS 454 -9.602 -10.209 -11.516 53 HZ2 LYS 454 1HZ LYS 454 -10.043 -10.653 -9.953 54 HZ3 LYS 454 2HZ LYS 454 -8.440 -10.766 -10.449 55 H LYS 455 H LYS 455 -12.250 -11.084 -5.547 56 HA LYS 455 HA LYS 455 -11.079 -9.972 -3.142 57 HB2 LYS 455 2HB LYS 455 -12.298 -11.796 -1.928 58 HB3 LYS 455 1HB LYS 455 -13.322 -10.596 -2.692 59 HG2 LYS 455 2HG LYS 455 -13.717 -12.178 -4.546 60 HG3 LYS 455 1HG LYS 455 -12.760 -13.384 -3.681 61 HD2 LYS 455 2HD LYS 455 -14.299 -13.294 -1.812 62 HD3 LYS 455 1HD LYS 455 -15.238 -12.040 -2.619 63 HE2 LYS 455 2HE LYS 455 -15.661 -13.631 -4.469 64 HE3 LYS 455 1HE LYS 455 -14.836 -14.882 -3.538 65 HZ1 LYS 455 3HZ LYS 455 -16.503 -14.628 -1.799 66 HZ2 LYS 455 1HZ LYS 455 -17.275 -14.931 -3.289 67 HZ3 LYS 455 2HZ LYS 455 -17.222 -13.383 -2.671 68 H VAL 456 H VAL 456 -9.000 -10.299 -3.479 69 HA VAL 456 HA VAL 456 -7.892 -12.835 -2.955 70 HB VAL 456 HB VAL 456 -8.474 -12.924 -5.456 71 HG11 VAL 456 1HG1 VAL 456 -7.045 -11.752 -7.051 72 HG12 VAL 456 2HG1 VAL 456 -6.365 -10.822 -5.713 73 HG13 VAL 456 3HG1 VAL 456 -8.079 -10.691 -6.096 74 HG21 VAL 456 3HG2 VAL 456 -6.786 -14.428 -4.570 75 HG22 VAL 456 1HG2 VAL 456 -5.529 -13.207 -4.815 76 HG23 VAL 456 2HG2 VAL 456 -6.359 -13.910 -6.195 77 H GLY 457 H GLY 457 -5.307 -12.333 -3.344 78 HA2 GLY 457 2HA GLY 457 -4.760 -9.923 -1.931 79 HA3 GLY 457 1HA GLY 457 -3.577 -11.037 -2.614 80 H LYS 458 H LYS 458 -5.163 -8.050 -2.994 81 HA LYS 458 HA LYS 458 -3.933 -7.717 -5.633 82 HB2 LYS 458 2HB LYS 458 -5.810 -6.232 -6.195 83 HB3 LYS 458 1HB LYS 458 -6.346 -7.877 -5.868 84 HG2 LYS 458 2HG LYS 458 -7.005 -7.178 -3.602 85 HG3 LYS 458 1HG LYS 458 -6.521 -5.533 -3.983 86 HD2 LYS 458 2HD LYS 458 -8.187 -5.479 -5.784 87 HD3 LYS 458 1HD LYS 458 -8.671 -7.127 -5.361 88 HE2 LYS 458 2HE LYS 458 -9.273 -6.357 -3.107 89 HE3 LYS 458 1HE LYS 458 -8.819 -4.716 -3.557 90 HZ1 LYS 458 3HZ LYS 458 -11.022 -6.319 -4.737 91 HZ2 LYS 458 1HZ LYS 458 -10.564 -4.771 -5.252 92 HZ3 LYS 458 2HZ LYS 458 -11.176 -5.010 -3.710 93 H ARG 459 H ARG 459 -3.047 -5.667 -6.028 94 HA ARG 459 HA ARG 459 -2.788 -4.020 -3.646 95 HB2 ARG 459 2HB ARG 459 -0.840 -4.314 -5.925 96 HB3 ARG 459 1HB ARG 459 -0.741 -3.023 -4.738 97 HG2 ARG 459 2HG ARG 459 -0.615 -4.738 -2.974 98 HG3 ARG 459 1HG ARG 459 -0.529 -5.968 -4.223 99 HD2 ARG 459 2HD ARG 459 1.399 -3.696 -3.809 100 HD3 ARG 459 1HD ARG 459 1.676 -5.369 -3.357 101 HE ARG 459 HE ARG 459 1.228 -5.536 -6.014 102 HH11 ARG 459 1HH1 ARG 459 3.308 -3.485 -4.072 103 HH12 ARG 459 2HH1 ARG 459 4.554 -3.330 -5.210 104 HH21 ARG 459 1HH2 ARG 459 2.928 -5.397 -7.624 105 HH22 ARG 459 2HH2 ARG 459 4.331 -4.481 -7.312 106 H LEU 460 H LEU 460 -3.162 -2.014 -3.652 107 HA LEU 460 HA LEU 460 -4.391 -0.891 -6.078 108 HB2 LEU 460 2HB LEU 460 -4.994 -0.170 -3.201 109 HB3 LEU 460 1HB LEU 460 -5.661 0.641 -4.585 110 HG LEU 460 HG LEU 460 -6.834 -1.503 -5.205 111 HD11 LEU 460 1HD1 LEU 460 -5.967 -2.402 -2.466 112 HD12 LEU 460 2HD1 LEU 460 -5.464 -3.102 -4.007 113 HD13 LEU 460 3HD1 LEU 460 -7.150 -3.210 -3.497 114 HD21 LEU 460 3HD2 LEU 460 -7.493 -0.313 -2.518 115 HD22 LEU 460 1HD2 LEU 460 -8.593 -1.260 -3.520 116 HD23 LEU 460 2HD2 LEU 460 -8.009 0.303 -4.089 117 H ASN 461 H ASN 461 -3.707 1.042 -6.757 118 HA ASN 461 HA ASN 461 -1.385 2.142 -5.353 119 HB2 ASN 461 2HB ASN 461 -0.752 3.256 -7.464 120 HB3 ASN 461 1HB ASN 461 -0.976 1.541 -7.735 121 HD21 ASN 461 1HD2 ASN 461 -2.013 4.709 -8.520 122 HD22 ASN 461 2HD2 ASN 461 -3.183 4.275 -9.715 123 H ILE 462 H ILE 462 -1.718 3.778 -4.117 124 HA ILE 462 HA ILE 462 -3.998 5.548 -4.771 125 HB ILE 462 HB ILE 462 -2.984 4.836 -1.988 126 HG12 ILE 462 2HG1 ILE 462 -5.552 3.988 -3.349 127 HG13 ILE 462 1HG1 ILE 462 -4.148 2.934 -3.144 128 HG21 ILE 462 1HG2 ILE 462 -3.972 7.082 -2.166 129 HG22 ILE 462 2HG2 ILE 462 -4.990 6.000 -1.215 130 HG23 ILE 462 3HG2 ILE 462 -5.424 6.381 -2.878 131 HD11 ILE 462 3HD1 ILE 462 -5.843 4.156 -0.985 132 HD12 ILE 462 1HD1 ILE 462 -4.430 3.140 -0.709 133 HD13 ILE 462 2HD1 ILE 462 -5.859 2.468 -1.501 134 H GLN 463 H GLN 463 -3.344 7.564 -5.275 135 HA GLN 463 HA GLN 463 -0.716 8.449 -4.326 136 HB2 GLN 463 2HB GLN 463 -2.524 9.536 -6.481 137 HB3 GLN 463 1HB GLN 463 -1.051 10.332 -5.960 138 HG2 GLN 463 2HG GLN 463 0.272 8.543 -6.667 139 HG3 GLN 463 1HG GLN 463 -1.133 7.527 -7.049 140 HE21 GLN 463 1HE2 GLN 463 -0.872 10.963 -7.785 141 HE22 GLN 463 2HE2 GLN 463 -0.783 10.755 -9.491 142 H LEU 464 H LEU 464 -0.496 9.863 -2.801 143 HA LEU 464 HA LEU 464 -2.793 11.567 -2.117 144 HB2 LEU 464 2HB LEU 464 -0.785 10.372 -0.192 145 HB3 LEU 464 1HB LEU 464 -1.952 11.569 0.274 146 HG LEU 464 HG LEU 464 -3.734 9.855 -0.408 147 HD11 LEU 464 1HD1 LEU 464 -3.063 7.526 -0.298 148 HD12 LEU 464 2HD1 LEU 464 -1.372 8.026 -0.257 149 HD13 LEU 464 3HD1 LEU 464 -2.353 8.367 -1.682 150 HD21 LEU 464 3HD2 LEU 464 -3.580 8.692 1.722 151 HD22 LEU 464 1HD2 LEU 464 -3.300 10.415 1.885 152 HD23 LEU 464 2HD2 LEU 464 -1.932 9.291 1.936 153 H LYS 465 H LYS 465 -2.413 13.657 -1.891 154 HA LYS 465 HA LYS 465 0.319 14.616 -2.337 155 HB2 LYS 465 2HB LYS 465 -1.334 15.332 -3.997 156 HB3 LYS 465 1HB LYS 465 -2.373 15.934 -2.716 157 HG2 LYS 465 2HG LYS 465 -0.856 17.694 -2.203 158 HG3 LYS 465 1HG LYS 465 0.383 17.011 -3.259 159 HD2 LYS 465 2HD LYS 465 -0.757 18.921 -4.301 160 HD3 LYS 465 1HD LYS 465 -1.012 17.432 -5.205 161 HE2 LYS 465 2HE LYS 465 -3.230 17.205 -4.108 162 HE3 LYS 465 1HE LYS 465 -2.955 18.749 -3.304 163 HZ1 LYS 465 3HZ LYS 465 -2.808 19.800 -5.469 164 HZ2 LYS 465 1HZ LYS 465 -4.288 19.011 -5.281 165 HZ3 LYS 465 2HZ LYS 465 -3.064 18.315 -6.232 166 H LYS 466 H LYS 466 1.192 16.027 -0.993 167 HA LYS 466 HA LYS 466 0.413 15.756 1.732 168 HB2 LYS 466 2HB LYS 466 2.722 16.812 0.287 169 HB3 LYS 466 1HB LYS 466 2.381 17.625 1.800 170 HG2 LYS 466 2HG LYS 466 4.033 15.724 1.916 171 HG3 LYS 466 1HG LYS 466 2.702 15.650 3.056 172 HD2 LYS 466 2HD LYS 466 3.267 13.459 2.048 173 HD3 LYS 466 1HD LYS 466 1.609 13.943 1.729 174 HE2 LYS 466 2HE LYS 466 2.721 12.916 -0.201 175 HE3 LYS 466 1HE LYS 466 2.185 14.557 -0.522 176 HZ1 LYS 466 3HZ LYS 466 4.414 15.335 -0.311 177 HZ2 LYS 466 1HZ LYS 466 4.401 14.030 -1.373 178 HZ3 LYS 466 2HZ LYS 466 4.974 13.824 0.196 179 H GLY 467 H GLY 467 -0.912 16.847 2.804 180 HA2 GLY 467 2HA GLY 467 -1.497 19.589 1.984 181 HA3 GLY 467 1HA GLY 467 -2.616 18.523 2.837 182 H THR 468 H THR 468 -2.898 20.012 4.513 183 HA THR 468 HA THR 468 -0.828 21.247 5.941 184 HB THR 468 HB THR 468 -3.603 20.584 6.931 185 HG1 THR 468 1HG THR 468 -2.618 22.437 5.045 186 HG21 THR 468 3HG2 THR 468 -2.079 21.504 8.635 187 HG22 THR 468 1HG2 THR 468 -3.334 22.672 8.221 188 HG23 THR 468 2HG2 THR 468 -1.705 22.859 7.571 189 H GLU 469 H GLU 469 -2.574 18.176 6.484 190 HA GLU 469 HA GLU 469 -0.978 17.643 8.872 191 HB2 GLU 469 2HB GLU 469 -3.259 16.137 7.596 192 HB3 GLU 469 1HB GLU 469 -2.420 15.628 9.053 193 HG2 GLU 469 2HG GLU 469 -3.923 18.212 8.746 194 HG3 GLU 469 1HG GLU 469 -4.565 16.741 9.471 195 H GLY 470 H GLY 470 -0.230 17.529 5.841 196 HA2 GLY 470 2HA GLY 470 1.350 16.359 4.660 197 HA3 GLY 470 1HA GLY 470 1.627 15.377 6.097 198 H LEU 471 H LEU 471 0.990 13.353 6.041 199 HA LEU 471 HA LEU 471 -0.621 12.447 3.811 200 HB2 LEU 471 2HB LEU 471 0.902 10.970 5.955 201 HB3 LEU 471 1HB LEU 471 -0.162 10.160 4.843 202 HG LEU 471 HG LEU 471 2.077 9.838 4.124 203 HD11 LEU 471 1HD1 LEU 471 0.739 11.828 2.318 204 HD12 LEU 471 2HD1 LEU 471 0.513 10.080 2.348 205 HD13 LEU 471 3HD1 LEU 471 2.065 10.761 1.866 206 HD21 LEU 471 3HD2 LEU 471 3.175 11.697 5.233 207 HD22 LEU 471 1HD2 LEU 471 2.411 12.836 4.125 208 HD23 LEU 471 2HD2 LEU 471 3.596 11.675 3.520 209 H GLY 472 H GLY 472 -0.670 12.336 7.332 210 HA2 GLY 472 2HA GLY 472 -2.573 12.708 8.661 211 HA3 GLY 472 1HA GLY 472 -3.552 12.544 7.215 212 H PHE 473 H PHE 473 -1.223 10.063 7.933 213 HA PHE 473 HA PHE 473 -3.175 8.564 9.397 214 HB2 PHE 473 2HB PHE 473 -3.166 6.600 7.950 215 HB3 PHE 473 1HB PHE 473 -3.786 7.988 7.079 216 HD1 PHE 473 1HD PHE 473 -2.148 9.174 5.504 217 HD2 PHE 473 2HD PHE 473 -1.467 5.281 7.074 218 HE1 PHE 473 1HE PHE 473 -0.569 8.704 3.682 219 HE2 PHE 473 2HE PHE 473 0.112 4.833 5.268 220 HZ PHE 473 HZ PHE 473 0.545 6.583 3.567 221 H SER 474 H SER 474 -2.335 6.643 10.265 222 HA SER 474 HA SER 474 0.576 6.807 10.648 223 HB2 SER 474 2HB SER 474 -1.550 5.949 12.621 224 HB3 SER 474 1HB SER 474 0.184 6.021 12.936 225 HG SER 474 HG SER 474 -0.122 8.296 12.186 226 H ILE 475 H ILE 475 1.602 4.763 11.129 227 HA ILE 475 HA ILE 475 0.203 2.447 9.947 228 HB ILE 475 HB ILE 475 2.498 1.671 9.403 229 HG12 ILE 475 2HG1 ILE 475 3.179 4.549 9.940 230 HG13 ILE 475 1HG1 ILE 475 3.652 3.079 10.811 231 HG21 ILE 475 1HG2 ILE 475 0.986 2.416 7.680 232 HG22 ILE 475 2HG2 ILE 475 2.638 2.855 7.310 233 HG23 ILE 475 3HG2 ILE 475 1.508 4.099 7.899 234 HD11 ILE 475 3HD1 ILE 475 5.422 4.079 9.296 235 HD12 ILE 475 1HD1 ILE 475 4.404 3.676 7.940 236 HD13 ILE 475 2HD1 ILE 475 5.073 2.385 8.945 237 H THR 476 H THR 476 0.624 0.500 10.907 238 HA THR 476 HA THR 476 2.152 0.439 13.399 239 HB THR 476 HB THR 476 -0.271 0.432 14.001 240 HG1 THR 476 1HG THR 476 0.818 -0.742 15.388 241 HG21 THR 476 3HG2 THR 476 -1.186 -0.494 11.910 242 HG22 THR 476 1HG2 THR 476 -1.741 -1.419 13.303 243 HG23 THR 476 2HG2 THR 476 -0.452 -2.051 12.279 244 H SER 477 H SER 477 3.097 -1.670 13.787 245 HA SER 477 HA SER 477 3.059 -3.384 11.434 246 HB2 SER 477 2HB SER 477 5.453 -3.799 11.782 247 HB3 SER 477 1HB SER 477 5.154 -2.108 11.492 248 HG SER 477 HG SER 477 6.312 -3.196 13.608 249 H ARG 478 H ARG 478 3.432 -5.629 11.991 250 HA ARG 478 HA ARG 478 3.487 -6.207 14.806 251 HB2 ARG 478 2HB ARG 478 1.655 -7.837 14.649 252 HB3 ARG 478 1HB ARG 478 1.121 -6.183 14.432 253 HG2 ARG 478 2HG ARG 478 1.024 -6.595 11.995 254 HG3 ARG 478 1HG ARG 478 1.457 -8.282 12.303 255 HD2 ARG 478 2HD ARG 478 -0.502 -8.513 13.752 256 HD3 ARG 478 1HD ARG 478 -0.933 -6.837 13.423 257 HE ARG 478 HE ARG 478 -0.675 -8.523 11.110 258 HH11 ARG 478 1HH1 ARG 478 -2.864 -7.177 13.543 259 HH12 ARG 478 2HH1 ARG 478 -4.287 -7.541 12.695 260 HH21 ARG 478 1HH2 ARG 478 -2.689 -9.026 9.896 261 HH22 ARG 478 2HH2 ARG 478 -4.167 -8.583 10.579 262 H ASP 479 H ASP 479 4.519 -7.855 15.396 263 HA ASP 479 HA ASP 479 6.215 -9.063 13.398 264 HB2 ASP 479 2HB ASP 479 7.021 -8.069 15.616 265 HB3 ASP 479 1HB ASP 479 6.227 -9.410 16.419 266 H VAL 480 H VAL 480 6.629 -11.559 14.837 267 HA VAL 480 HA VAL 480 5.973 -13.690 14.658 268 HB VAL 480 HB VAL 480 3.125 -12.685 15.079 269 HG11 VAL 480 1HG1 VAL 480 3.205 -14.992 14.353 270 HG12 VAL 480 2HG1 VAL 480 2.688 -14.899 16.037 271 HG13 VAL 480 3HG1 VAL 480 4.340 -15.382 15.649 272 HG21 VAL 480 3HG2 VAL 480 3.460 -13.071 17.486 273 HG22 VAL 480 1HG2 VAL 480 4.534 -11.825 16.854 274 HG23 VAL 480 2HG2 VAL 480 5.163 -13.443 17.181 275 H THR 481 H THR 481 6.678 -13.393 12.495 276 HA THR 481 HA THR 481 4.504 -13.530 10.536 277 HB THR 481 HB THR 481 5.988 -12.297 8.967 278 HG1 THR 481 1HG THR 481 7.748 -11.105 10.123 279 HG21 THR 481 3HG2 THR 481 4.308 -11.063 10.234 280 HG22 THR 481 1HG2 THR 481 5.759 -10.088 10.019 281 HG23 THR 481 2HG2 THR 481 5.440 -10.868 11.571 282 H ILE 482 H ILE 482 5.728 -14.158 8.331 283 HA ILE 482 HA ILE 482 6.698 -16.807 8.730 284 HB ILE 482 HB ILE 482 6.953 -16.871 6.253 285 HG12 ILE 482 2HG1 ILE 482 5.984 -13.993 6.384 286 HG13 ILE 482 1HG1 ILE 482 7.584 -14.518 5.887 287 HG21 ILE 482 1HG2 ILE 482 4.313 -15.804 7.249 288 HG22 ILE 482 2HG2 ILE 482 4.839 -17.489 7.259 289 HG23 ILE 482 3HG2 ILE 482 4.562 -16.660 5.728 290 HD11 ILE 482 3HD1 ILE 482 6.613 -15.635 3.947 291 HD12 ILE 482 1HD1 ILE 482 6.186 -13.924 3.978 292 HD13 ILE 482 2HD1 ILE 482 5.002 -15.138 4.459 293 H GLY 483 H GLY 483 8.184 -13.713 8.324 294 HA2 GLY 483 2HA GLY 483 10.513 -13.765 9.232 295 HA3 GLY 483 1HA GLY 483 10.789 -15.031 8.048 296 H GLY 484 H GLY 484 11.984 -12.342 8.448 297 HA2 GLY 484 2HA GLY 484 12.910 -10.705 7.134 298 HA3 GLY 484 1HA GLY 484 12.637 -11.807 5.800 299 H SER 485 H SER 485 10.206 -10.231 7.810 300 HA SER 485 HA SER 485 9.590 -8.227 5.937 301 HB2 SER 485 2HB SER 485 7.292 -9.162 5.346 302 HB3 SER 485 1HB SER 485 8.661 -9.954 4.566 303 HG SER 485 HG SER 485 8.513 -11.619 6.041 304 H ALA 486 H ALA 486 8.767 -6.614 7.093 305 HA ALA 486 HA ALA 486 7.337 -7.280 9.548 306 HB1 ALA 486 1HB ALA 486 7.950 -5.025 10.320 307 HB2 ALA 486 2HB ALA 486 8.812 -4.748 8.806 308 HB3 ALA 486 3HB ALA 486 9.382 -5.982 9.930 309 HA PRO 487 HA PRO 487 4.105 -5.904 6.738 310 HB2 PRO 487 2HB PRO 487 2.319 -6.961 8.801 311 HB3 PRO 487 1HB PRO 487 2.469 -7.438 7.109 312 HG2 PRO 487 2HG PRO 487 3.307 -9.011 9.122 313 HG3 PRO 487 1HG PRO 487 4.133 -8.960 7.555 314 HD2 PRO 487 2HD PRO 487 4.895 -7.644 10.137 315 HD3 PRO 487 1HD PRO 487 5.904 -8.454 8.910 316 H ILE 488 H ILE 488 3.704 -3.874 6.747 317 HA ILE 488 HA ILE 488 2.905 -2.489 9.172 318 HB ILE 488 HB ILE 488 4.057 -1.485 6.534 319 HG12 ILE 488 2HG1 ILE 488 5.551 -2.039 8.501 320 HG13 ILE 488 1HG1 ILE 488 5.610 -0.412 7.815 321 HG21 ILE 488 1HG2 ILE 488 3.619 0.769 7.197 322 HG22 ILE 488 2HG2 ILE 488 2.571 0.095 8.475 323 HG23 ILE 488 3HG2 ILE 488 2.166 -0.166 6.785 324 HD11 ILE 488 3HD1 ILE 488 4.441 0.522 9.624 325 HD12 ILE 488 1HD1 ILE 488 5.735 -0.468 10.275 326 HD13 ILE 488 2HD1 ILE 488 4.071 -1.072 10.312 327 H TYR 489 H TYR 489 0.918 -1.930 9.497 328 HA TYR 489 HA TYR 489 -0.966 -1.862 7.242 329 HB2 TYR 489 2HB TYR 489 -1.621 -2.633 10.123 330 HB3 TYR 489 1HB TYR 489 -2.731 -2.557 8.777 331 HD1 TYR 489 2HD TYR 489 0.077 -4.435 10.204 332 HD2 TYR 489 1HD TYR 489 -2.877 -4.279 7.165 333 HE1 TYR 489 2HE TYR 489 0.578 -6.744 9.634 334 HE2 TYR 489 1HE TYR 489 -2.393 -6.610 6.562 335 HH TYR 489 HH TYR 489 -0.455 -8.660 8.503 336 H VAL 490 H VAL 490 -2.465 -0.209 7.355 337 HA VAL 490 HA VAL 490 -1.569 2.162 8.616 338 HB VAL 490 HB VAL 490 -4.296 1.557 7.444 339 HG11 VAL 490 1HG1 VAL 490 -2.977 4.192 8.099 340 HG12 VAL 490 2HG1 VAL 490 -4.364 3.488 8.932 341 HG13 VAL 490 3HG1 VAL 490 -4.509 4.000 7.248 342 HG21 VAL 490 3HG2 VAL 490 -2.502 1.277 5.824 343 HG22 VAL 490 1HG2 VAL 490 -1.888 2.887 6.213 344 HG23 VAL 490 2HG2 VAL 490 -3.476 2.701 5.462 345 H LYS 491 H LYS 491 -1.754 2.682 10.648 346 HA LYS 491 HA LYS 491 -3.303 1.053 12.480 347 HB2 LYS 491 2HB LYS 491 -1.003 1.921 12.975 348 HB3 LYS 491 1HB LYS 491 -1.690 3.528 13.043 349 HG2 LYS 491 2HG LYS 491 -3.169 2.797 14.899 350 HG3 LYS 491 1HG LYS 491 -2.362 1.233 14.886 351 HD2 LYS 491 2HD LYS 491 -1.390 2.569 16.643 352 HD3 LYS 491 1HD LYS 491 -0.209 2.425 15.340 353 HE2 LYS 491 2HE LYS 491 -0.827 4.649 14.523 354 HE3 LYS 491 1HE LYS 491 -2.039 4.792 15.788 355 HZ1 LYS 491 3HZ LYS 491 -0.214 4.672 17.431 356 HZ2 LYS 491 1HZ LYS 491 -0.035 5.972 16.376 357 HZ3 LYS 491 2HZ LYS 491 0.897 4.609 16.166 358 H ASN 492 H ASN 492 -3.504 4.285 11.082 359 HA ASN 492 HA ASN 492 -6.132 4.708 12.214 360 HB2 ASN 492 2HB ASN 492 -4.660 5.302 14.114 361 HB3 ASN 492 1HB ASN 492 -3.811 6.433 13.084 362 HD21 ASN 492 1HD2 ASN 492 -7.375 5.990 13.220 363 HD22 ASN 492 2HD2 ASN 492 -7.658 7.574 13.815 364 H ILE 493 H ILE 493 -7.233 6.038 10.903 365 HA ILE 493 HA ILE 493 -5.812 7.680 8.940 366 HB ILE 493 HB ILE 493 -8.724 6.760 9.091 367 HG12 ILE 493 2HG1 ILE 493 -7.177 4.951 8.503 368 HG13 ILE 493 1HG1 ILE 493 -8.262 5.381 7.182 369 HG21 ILE 493 1HG2 ILE 493 -7.336 8.306 6.915 370 HG22 ILE 493 2HG2 ILE 493 -8.630 8.926 7.953 371 HG23 ILE 493 3HG2 ILE 493 -8.935 7.616 6.799 372 HD11 ILE 493 3HD1 ILE 493 -6.034 4.959 6.335 373 HD12 ILE 493 1HD1 ILE 493 -5.360 6.175 7.431 374 HD13 ILE 493 2HD1 ILE 493 -6.452 6.658 6.136 375 H LEU 494 H LEU 494 -5.546 9.713 9.707 376 HA LEU 494 HA LEU 494 -6.994 10.565 11.986 377 HB2 LEU 494 2HB LEU 494 -4.933 11.975 10.285 378 HB3 LEU 494 1HB LEU 494 -5.744 12.762 11.615 379 HG LEU 494 HG LEU 494 -4.759 11.086 13.172 380 HD11 LEU 494 1HD1 LEU 494 -3.185 10.163 10.783 381 HD12 LEU 494 2HD1 LEU 494 -4.409 9.231 11.647 382 HD13 LEU 494 3HD1 LEU 494 -2.907 9.682 12.457 383 HD21 LEU 494 3HD2 LEU 494 -3.689 13.234 12.875 384 HD22 LEU 494 1HD2 LEU 494 -2.782 12.616 11.496 385 HD23 LEU 494 2HD2 LEU 494 -2.476 11.977 13.109 386 HA PRO 495 HA PRO 495 -10.551 12.627 10.380 387 HB2 PRO 495 2HB PRO 495 -9.790 14.906 12.125 388 HB3 PRO 495 1HB PRO 495 -11.317 14.026 12.039 389 HG2 PRO 495 2HG PRO 495 -9.684 13.601 14.064 390 HG3 PRO 495 1HG PRO 495 -10.507 12.238 13.287 391 HD2 PRO 495 2HD PRO 495 -7.672 13.144 13.011 392 HD3 PRO 495 1HD PRO 495 -8.331 11.494 13.118 393 H ARG 496 H ARG 496 -7.505 14.229 10.320 394 HA ARG 496 HA ARG 496 -8.378 15.831 8.020 395 HB2 ARG 496 2HB ARG 496 -6.406 16.705 10.141 396 HB3 ARG 496 1HB ARG 496 -6.892 17.627 8.731 397 HG2 ARG 496 2HG ARG 496 -9.114 17.881 9.638 398 HG3 ARG 496 1HG ARG 496 -8.694 16.852 11.012 399 HD2 ARG 496 2HD ARG 496 -7.476 19.525 10.317 400 HD3 ARG 496 1HD ARG 496 -8.565 19.180 11.659 401 HE ARG 496 HE ARG 496 -6.216 17.561 11.699 402 HH11 ARG 496 1HH1 ARG 496 -7.521 20.708 12.677 403 HH12 ARG 496 2HH1 ARG 496 -6.323 20.977 13.856 404 HH21 ARG 496 1HH2 ARG 496 -4.578 17.956 13.302 405 HH22 ARG 496 2HH2 ARG 496 -4.626 19.387 14.225 406 H GLY 497 H GLY 497 -6.962 15.707 6.308 407 HA2 GLY 497 2HA GLY 497 -4.476 15.481 5.918 408 HA3 GLY 497 1HA GLY 497 -4.691 13.932 6.714 409 H ALA 498 H ALA 498 -3.695 14.088 4.192 410 HA ALA 498 HA ALA 498 -5.521 14.033 2.094 411 HB1 ALA 498 1HB ALA 498 -2.847 12.658 2.276 412 HB2 ALA 498 2HB ALA 498 -3.115 14.334 1.800 413 HB3 ALA 498 3HB ALA 498 -3.732 13.023 0.798 414 H ALA 499 H ALA 499 -4.431 11.479 4.236 415 HA ALA 499 HA ALA 499 -5.404 9.317 2.719 416 HB1 ALA 499 1HB ALA 499 -3.792 8.996 4.490 417 HB2 ALA 499 2HB ALA 499 -5.205 7.983 4.747 418 HB3 ALA 499 3HB ALA 499 -4.991 9.457 5.697 419 H ILE 500 H ILE 500 -7.007 11.217 5.265 420 HA ILE 500 HA ILE 500 -9.271 9.492 5.179 421 HB ILE 500 HB ILE 500 -8.718 10.863 7.235 422 HG12 ILE 500 2HG1 ILE 500 -11.479 11.199 6.052 423 HG13 ILE 500 1HG1 ILE 500 -10.896 9.815 6.935 424 HG21 ILE 500 1HG2 ILE 500 -8.152 12.978 6.154 425 HG22 ILE 500 2HG2 ILE 500 -9.450 13.202 7.330 426 HG23 ILE 500 3HG2 ILE 500 -9.817 13.153 5.605 427 HD11 ILE 500 3HD1 ILE 500 -11.215 12.572 8.098 428 HD12 ILE 500 1HD1 ILE 500 -10.676 11.125 8.952 429 HD13 ILE 500 2HD1 ILE 500 -12.319 11.212 8.324 430 H GLN 501 H GLN 501 -8.302 12.363 3.546 431 HA GLN 501 HA GLN 501 -10.875 12.905 2.433 432 HB2 GLN 501 2HB GLN 501 -8.151 13.891 1.764 433 HB3 GLN 501 1HB GLN 501 -9.608 14.522 0.999 434 HG2 GLN 501 2HG GLN 501 -8.889 14.686 3.937 435 HG3 GLN 501 1HG GLN 501 -8.898 16.020 2.784 436 HE21 GLN 501 1HE2 GLN 501 -10.392 15.703 5.283 437 HE22 GLN 501 2HE2 GLN 501 -12.053 15.801 4.886 438 H ASP 502 H ASP 502 -8.183 10.913 1.560 439 HA ASP 502 HA ASP 502 -8.822 10.610 -1.195 440 HB2 ASP 502 2HB ASP 502 -6.631 9.933 -0.356 441 HB3 ASP 502 1HB ASP 502 -7.382 8.724 0.685 442 H GLY 503 H GLY 503 -9.483 8.721 1.650 443 HA2 GLY 503 2HA GLY 503 -11.602 7.747 2.173 444 HA3 GLY 503 1HA GLY 503 -12.060 7.949 0.498 445 H ARG 504 H ARG 504 -9.524 6.561 -0.414 446 HA ARG 504 HA ARG 504 -10.678 3.902 -0.309 447 HB2 ARG 504 2HB ARG 504 -8.232 4.976 -1.705 448 HB3 ARG 504 1HB ARG 504 -8.838 3.335 -1.873 449 HG2 ARG 504 2HG ARG 504 -10.820 4.098 -2.943 450 HG3 ARG 504 1HG ARG 504 -10.440 5.779 -2.555 451 HD2 ARG 504 2HD ARG 504 -8.794 3.987 -4.323 452 HD3 ARG 504 1HD ARG 504 -9.927 5.216 -4.896 453 HE ARG 504 HE ARG 504 -8.098 6.351 -3.079 454 HH11 ARG 504 1HH1 ARG 504 -8.211 5.151 -6.407 455 HH12 ARG 504 2HH1 ARG 504 -7.019 6.210 -6.982 456 HH21 ARG 504 1HH2 ARG 504 -6.524 7.807 -3.847 457 HH22 ARG 504 2HH2 ARG 504 -6.004 7.786 -5.479 458 H LEU 505 H LEU 505 -7.709 5.492 0.607 459 HA LEU 505 HA LEU 505 -6.563 3.223 1.890 460 HB2 LEU 505 2HB LEU 505 -5.205 5.078 1.054 461 HB3 LEU 505 1HB LEU 505 -5.987 6.172 2.175 462 HG LEU 505 HG LEU 505 -4.950 4.955 4.058 463 HD11 LEU 505 1HD1 LEU 505 -3.546 3.381 1.900 464 HD12 LEU 505 2HD1 LEU 505 -4.678 2.737 3.101 465 HD13 LEU 505 3HD1 LEU 505 -3.124 3.399 3.604 466 HD21 LEU 505 3HD2 LEU 505 -3.036 5.910 1.947 467 HD22 LEU 505 1HD2 LEU 505 -2.675 5.741 3.664 468 HD23 LEU 505 2HD2 LEU 505 -3.880 6.912 3.131 469 H LYS 506 H LYS 506 -7.215 2.366 3.756 470 HA LYS 506 HA LYS 506 -8.361 4.063 5.798 471 HB2 LYS 506 2HB LYS 506 -9.502 1.411 4.886 472 HB3 LYS 506 1HB LYS 506 -10.046 2.305 6.293 473 HG2 LYS 506 2HG LYS 506 -10.756 4.152 4.821 474 HG3 LYS 506 1HG LYS 506 -10.242 3.211 3.425 475 HD2 LYS 506 2HD LYS 506 -11.859 1.453 4.025 476 HD3 LYS 506 1HD LYS 506 -12.379 2.421 5.406 477 HE2 LYS 506 2HE LYS 506 -13.070 4.215 3.883 478 HE3 LYS 506 1HE LYS 506 -12.554 3.244 2.510 479 HZ1 LYS 506 3HZ LYS 506 -14.943 3.065 2.829 480 HZ2 LYS 506 1HZ LYS 506 -14.733 2.532 4.410 481 HZ3 LYS 506 2HZ LYS 506 -14.235 1.592 3.108 482 H ALA 507 H ALA 507 -8.548 2.620 7.877 483 HA ALA 507 HA ALA 507 -5.948 1.745 8.505 484 HB1 ALA 507 1HB ALA 507 -6.884 1.134 10.678 485 HB2 ALA 507 2HB ALA 507 -8.514 1.318 10.038 486 HB3 ALA 507 3HB ALA 507 -7.456 2.722 10.175 487 H GLY 508 H GLY 508 -5.183 -0.310 8.941 488 HA2 GLY 508 2HA GLY 508 -5.297 -2.643 9.089 489 HA3 GLY 508 1HA GLY 508 -6.875 -2.633 8.351 490 H ASP 509 H ASP 509 -5.498 -0.759 6.208 491 HA ASP 509 HA ASP 509 -4.820 -2.943 4.488 492 HB2 ASP 509 2HB ASP 509 -4.684 0.043 4.013 493 HB3 ASP 509 1HB ASP 509 -4.134 -1.127 2.818 494 H ARG 510 H ARG 510 -2.871 -3.408 3.518 495 HA ARG 510 HA ARG 510 -0.683 -2.834 5.358 496 HB2 ARG 510 2HB ARG 510 -1.230 -5.174 5.190 497 HB3 ARG 510 1HB ARG 510 -1.066 -5.165 3.449 498 HG2 ARG 510 2HG ARG 510 1.309 -4.893 3.618 499 HG3 ARG 510 1HG ARG 510 1.204 -4.595 5.353 500 HD2 ARG 510 2HD ARG 510 1.973 -6.872 4.893 501 HD3 ARG 510 1HD ARG 510 0.413 -6.883 5.710 502 HE ARG 510 HE ARG 510 0.628 -7.200 2.802 503 HH11 ARG 510 1HH1 ARG 510 -0.450 -8.510 5.965 504 HH12 ARG 510 2HH1 ARG 510 -1.166 -9.877 5.286 505 HH21 ARG 510 1HH2 ARG 510 -0.337 -9.110 1.941 506 HH22 ARG 510 2HH2 ARG 510 -1.153 -10.234 2.945 507 H LEU 511 H LEU 511 0.880 -1.593 4.834 508 HA LEU 511 HA LEU 511 0.946 -0.359 2.230 509 HB2 LEU 511 2HB LEU 511 1.383 0.761 4.666 510 HB3 LEU 511 1HB LEU 511 2.948 0.065 4.442 511 HG LEU 511 HG LEU 511 2.878 2.493 3.888 512 HD11 LEU 511 1HD1 LEU 511 4.642 1.164 2.972 513 HD12 LEU 511 2HD1 LEU 511 4.129 2.392 1.820 514 HD13 LEU 511 3HD1 LEU 511 3.628 0.716 1.593 515 HD21 LEU 511 3HD2 LEU 511 1.857 3.217 1.812 516 HD22 LEU 511 1HD2 LEU 511 0.650 2.568 2.921 517 HD23 LEU 511 2HD2 LEU 511 1.201 1.603 1.554 518 H ILE 512 H ILE 512 2.198 -1.051 0.555 519 HA ILE 512 HA ILE 512 4.061 -3.276 1.052 520 HB ILE 512 HB ILE 512 2.748 -2.374 -1.512 521 HG12 ILE 512 2HG1 ILE 512 1.152 -3.332 0.061 522 HG13 ILE 512 1HG1 ILE 512 1.426 -4.398 -1.301 523 HG21 ILE 512 1HG2 ILE 512 4.447 -4.809 -0.959 524 HG22 ILE 512 2HG2 ILE 512 4.904 -3.428 -1.956 525 HG23 ILE 512 3HG2 ILE 512 3.583 -4.484 -2.463 526 HD11 ILE 512 3HD1 ILE 512 2.887 -5.796 0.012 527 HD12 ILE 512 1HD1 ILE 512 1.322 -5.644 0.795 528 HD13 ILE 512 2HD1 ILE 512 2.700 -4.739 1.419 529 H GLU 513 H GLU 513 3.860 -0.332 -0.971 530 HA GLU 513 HA GLU 513 6.649 0.128 -0.591 531 HB2 GLU 513 2HB GLU 513 7.301 0.012 -2.917 532 HB3 GLU 513 1HB GLU 513 6.677 -1.548 -2.405 533 HG2 GLU 513 2HG GLU 513 4.568 -1.034 -3.463 534 HG3 GLU 513 1HG GLU 513 5.232 0.530 -3.950 535 H VAL 514 H VAL 514 7.315 2.118 -1.551 536 HA VAL 514 HA VAL 514 5.020 3.845 -2.059 537 HB VAL 514 HB VAL 514 5.854 4.257 0.213 538 HG11 VAL 514 1HG1 VAL 514 8.070 5.295 0.583 539 HG12 VAL 514 2HG1 VAL 514 8.451 4.997 -1.114 540 HG13 VAL 514 3HG1 VAL 514 8.189 3.639 -0.027 541 HG21 VAL 514 3HG2 VAL 514 6.092 6.670 0.030 542 HG22 VAL 514 1HG2 VAL 514 4.871 6.008 -1.086 543 HG23 VAL 514 2HG2 VAL 514 6.445 6.484 -1.697 544 H ASN 515 H ASN 515 5.095 4.919 -3.903 545 HA ASN 515 HA ASN 515 5.755 5.784 -5.900 546 HB2 ASN 515 2HB ASN 515 8.149 6.594 -4.246 547 HB3 ASN 515 1HB ASN 515 7.957 7.079 -5.924 548 HD21 ASN 515 1HD2 ASN 515 7.840 9.239 -5.432 549 HD22 ASN 515 2HD2 ASN 515 6.490 9.964 -4.644 550 H GLY 516 H GLY 516 6.770 3.000 -5.107 551 HA2 GLY 516 2HA GLY 516 7.463 1.473 -6.814 552 HA3 GLY 516 1HA GLY 516 8.470 2.746 -7.491 553 H VAL 517 H VAL 517 8.766 2.845 -4.161 554 HA VAL 517 HA VAL 517 11.231 1.285 -4.271 555 HB VAL 517 HB VAL 517 10.221 3.185 -2.133 556 HG11 VAL 517 1HG1 VAL 517 12.931 1.900 -2.477 557 HG12 VAL 517 2HG1 VAL 517 11.743 1.506 -1.234 558 HG13 VAL 517 3HG1 VAL 517 12.510 3.095 -1.248 559 HG21 VAL 517 3HG2 VAL 517 10.712 4.362 -4.202 560 HG22 VAL 517 1HG2 VAL 517 12.311 3.615 -4.266 561 HG23 VAL 517 2HG2 VAL 517 11.912 4.742 -2.967 562 H ASP 518 H ASP 518 11.135 -0.725 -3.557 563 HA ASP 518 HA ASP 518 8.809 -1.704 -2.213 564 HB2 ASP 518 2HB ASP 518 9.862 -3.900 -2.297 565 HB3 ASP 518 1HB ASP 518 10.016 -3.110 -3.858 566 H LEU 519 H LEU 519 8.555 -2.310 -0.148 567 HA LEU 519 HA LEU 519 10.795 -2.090 1.682 568 HB2 LEU 519 2HB LEU 519 9.529 -0.472 3.075 569 HB3 LEU 519 1HB LEU 519 10.104 0.170 1.549 570 HG LEU 519 HG LEU 519 7.739 -0.516 0.746 571 HD11 LEU 519 1HD1 LEU 519 7.094 -0.048 3.623 572 HD12 LEU 519 2HD1 LEU 519 6.927 -1.566 2.708 573 HD13 LEU 519 3HD1 LEU 519 5.970 -0.156 2.262 574 HD21 LEU 519 3HD2 LEU 519 8.244 2.019 2.288 575 HD22 LEU 519 1HD2 LEU 519 6.892 1.730 1.178 576 HD23 LEU 519 2HD2 LEU 519 8.530 1.686 0.564 577 H ALA 520 H ALA 520 8.442 -3.917 0.665 578 HA ALA 520 HA ALA 520 6.922 -4.512 3.011 579 HB1 ALA 520 1HB ALA 520 6.051 -4.929 0.754 580 HB2 ALA 520 2HB ALA 520 6.030 -6.391 1.739 581 HB3 ALA 520 3HB ALA 520 7.279 -6.169 0.511 582 H GLY 521 H GLY 521 9.963 -5.543 1.792 583 HA2 GLY 521 2HA GLY 521 10.074 -7.788 3.669 584 HA3 GLY 521 1HA GLY 521 11.244 -7.445 2.403 585 H LYS 522 H LYS 522 10.550 -4.587 3.732 586 HA LYS 522 HA LYS 522 13.028 -4.547 5.201 587 HB2 LYS 522 2HB LYS 522 11.144 -2.334 4.396 588 HB3 LYS 522 1HB LYS 522 12.534 -2.075 5.434 589 HG2 LYS 522 2HG LYS 522 12.620 -3.109 2.604 590 HG3 LYS 522 1HG LYS 522 13.013 -1.465 3.121 591 HD2 LYS 522 2HD LYS 522 14.802 -2.379 4.557 592 HD3 LYS 522 1HD LYS 522 14.441 -3.988 3.964 593 HE2 LYS 522 2HE LYS 522 16.341 -3.133 2.765 594 HE3 LYS 522 1HE LYS 522 14.970 -3.238 1.668 595 HZ1 LYS 522 3HZ LYS 522 14.639 -0.821 1.951 596 HZ2 LYS 522 1HZ LYS 522 16.140 -1.209 1.342 597 HZ3 LYS 522 2HZ LYS 522 16.015 -0.752 2.941 598 H SER 523 H SER 523 13.207 -3.512 7.239 599 HA SER 523 HA SER 523 11.410 -4.704 9.056 600 HB2 SER 523 2HB SER 523 13.739 -2.847 9.405 601 HB3 SER 523 1HB SER 523 12.946 -3.714 10.727 602 HG SER 523 HG SER 523 13.521 -5.410 8.762 603 H GLN 524 H GLN 524 10.263 -3.543 10.712 604 HA GLN 524 HA GLN 524 8.644 -1.499 9.819 605 HB2 GLN 524 2HB GLN 524 8.082 -1.201 12.284 606 HB3 GLN 524 1HB GLN 524 7.784 -2.769 11.550 607 HG2 GLN 524 2HG GLN 524 9.764 -3.664 12.543 608 HG3 GLN 524 1HG GLN 524 10.216 -2.087 13.186 609 HE21 GLN 524 1HE2 GLN 524 9.163 -1.336 14.943 610 HE22 GLN 524 2HE2 GLN 524 8.091 -2.258 15.938 611 H GLU 525 H GLU 525 11.555 -1.278 11.724 612 HA GLU 525 HA GLU 525 11.388 1.483 12.257 613 HB2 GLU 525 2HB GLU 525 13.573 -0.493 12.190 614 HB3 GLU 525 1HB GLU 525 14.030 1.207 12.433 615 HG2 GLU 525 2HG GLU 525 13.957 0.026 14.537 616 HG3 GLU 525 1HG GLU 525 12.581 1.119 14.478 617 H GLU 526 H GLU 526 12.428 -0.225 9.426 618 HA GLU 526 HA GLU 526 13.774 1.924 8.161 619 HB2 GLU 526 2HB GLU 526 12.400 -0.514 7.059 620 HB3 GLU 526 1HB GLU 526 13.360 0.584 6.088 621 HG2 GLU 526 2HG GLU 526 14.375 -0.987 8.436 622 HG3 GLU 526 1HG GLU 526 14.547 -1.452 6.742 623 H VAL 527 H VAL 527 10.545 0.571 7.984 624 HA VAL 527 HA VAL 527 9.714 2.472 6.032 625 HB VAL 527 HB VAL 527 7.495 1.334 6.132 626 HG11 VAL 527 1HG1 VAL 527 8.348 -0.790 5.228 627 HG12 VAL 527 2HG1 VAL 527 9.903 -0.463 6.000 628 HG13 VAL 527 3HG1 VAL 527 9.342 0.582 4.691 629 HG21 VAL 527 3HG2 VAL 527 8.896 -0.381 8.164 630 HG22 VAL 527 1HG2 VAL 527 7.350 -0.743 7.399 631 HG23 VAL 527 2HG2 VAL 527 7.495 0.664 8.466 632 H VAL 528 H VAL 528 9.227 2.132 9.493 633 HA VAL 528 HA VAL 528 7.313 4.210 9.599 634 HB VAL 528 HB VAL 528 9.107 3.143 11.823 635 HG11 VAL 528 1HG1 VAL 528 8.331 5.409 12.357 636 HG12 VAL 528 2HG1 VAL 528 7.533 4.218 13.387 637 HG13 VAL 528 3HG1 VAL 528 6.669 4.924 12.022 638 HG21 VAL 528 3HG2 VAL 528 6.207 2.571 11.177 639 HG22 VAL 528 1HG2 VAL 528 7.078 1.953 12.574 640 HG23 VAL 528 2HG2 VAL 528 7.560 1.465 10.950 641 H SER 529 H SER 529 10.793 4.146 9.596 642 HA SER 529 HA SER 529 11.254 6.791 10.363 643 HB2 SER 529 2HB SER 529 13.064 5.123 10.141 644 HB3 SER 529 1HB SER 529 12.821 5.096 8.396 645 HG SER 529 HG SER 529 14.326 6.534 8.508 646 H LEU 530 H LEU 530 10.329 5.386 7.312 647 HA LEU 530 HA LEU 530 10.648 7.615 5.642 648 HB2 LEU 530 2HB LEU 530 8.794 5.309 5.615 649 HB3 LEU 530 1HB LEU 530 8.909 6.382 4.235 650 HG LEU 530 HG LEU 530 11.012 4.508 5.351 651 HD11 LEU 530 1HD1 LEU 530 9.607 4.572 2.689 652 HD12 LEU 530 2HD1 LEU 530 9.301 3.434 4.001 653 HD13 LEU 530 3HD1 LEU 530 10.858 3.427 3.173 654 HD21 LEU 530 3HD2 LEU 530 12.464 5.255 3.528 655 HD22 LEU 530 1HD2 LEU 530 12.113 6.566 4.640 656 HD23 LEU 530 2HD2 LEU 530 11.285 6.488 3.083 657 H LEU 531 H LEU 531 7.808 6.396 7.370 658 HA LEU 531 HA LEU 531 6.254 8.617 6.586 659 HB2 LEU 531 2HB LEU 531 5.631 6.376 8.508 660 HB3 LEU 531 1HB LEU 531 4.547 7.750 8.307 661 HG LEU 531 HG LEU 531 4.606 7.174 5.848 662 HD11 LEU 531 1HD1 LEU 531 4.961 4.848 5.236 663 HD12 LEU 531 2HD1 LEU 531 5.761 4.604 6.797 664 HD13 LEU 531 3HD1 LEU 531 6.411 5.755 5.643 665 HD21 LEU 531 3HD2 LEU 531 2.831 5.484 6.088 666 HD22 LEU 531 1HD2 LEU 531 2.629 6.876 7.147 667 HD23 LEU 531 2HD2 LEU 531 3.240 5.356 7.800 668 H ARG 532 H ARG 532 8.211 8.026 9.300 669 HA ARG 532 HA ARG 532 7.281 10.198 10.869 670 HB2 ARG 532 2HB ARG 532 8.591 8.350 11.791 671 HB3 ARG 532 1HB ARG 532 9.957 8.791 10.786 672 HG2 ARG 532 2HG ARG 532 10.218 10.866 12.023 673 HG3 ARG 532 1HG ARG 532 8.803 10.467 13.003 674 HD2 ARG 532 2HD ARG 532 10.873 9.910 14.181 675 HD3 ARG 532 1HD ARG 532 9.916 8.468 13.834 676 HE ARG 532 HE ARG 532 12.057 9.197 11.990 677 HH11 ARG 532 1HH1 ARG 532 10.860 6.981 14.492 678 HH12 ARG 532 2HH1 ARG 532 12.090 5.837 14.253 679 HH21 ARG 532 1HH2 ARG 532 13.781 7.593 11.682 680 HH22 ARG 532 2HH2 ARG 532 13.776 6.200 12.640 681 H SER 533 H SER 533 9.906 9.846 8.482 682 HA SER 533 HA SER 533 10.839 12.500 8.756 683 HB2 SER 533 2HB SER 533 12.273 10.637 7.971 684 HB3 SER 533 1HB SER 533 11.319 10.544 6.494 685 HG SER 533 HG SER 533 12.471 12.980 7.258 686 H THR 534 H THR 534 8.706 10.946 6.369 687 HA THR 534 HA THR 534 7.291 11.666 4.839 688 HB THR 534 HB THR 534 6.072 13.874 5.163 689 HG1 THR 534 1HG THR 534 8.062 14.297 6.832 690 HG21 THR 534 3HG2 THR 534 6.122 11.949 7.476 691 HG22 THR 534 1HG2 THR 534 5.190 11.765 5.991 692 HG23 THR 534 2HG2 THR 534 4.822 13.080 7.105 693 H LYS 535 H LYS 535 7.339 12.238 2.829 694 HA LYS 535 HA LYS 535 9.314 14.226 2.018 695 HB2 LYS 535 2HB LYS 535 7.840 12.150 0.369 696 HB3 LYS 535 1HB LYS 535 9.069 13.245 -0.242 697 HG2 LYS 535 2HG LYS 535 10.706 12.214 1.285 698 HG3 LYS 535 1HG LYS 535 9.470 11.066 1.795 699 HD2 LYS 535 2HD LYS 535 9.279 10.253 -0.513 700 HD3 LYS 535 1HD LYS 535 10.518 11.407 -1.017 701 HE2 LYS 535 2HE LYS 535 12.083 10.338 0.576 702 HE3 LYS 535 1HE LYS 535 10.858 9.122 0.925 703 HZ1 LYS 535 3HZ LYS 535 12.482 8.364 -0.710 704 HZ2 LYS 535 1HZ LYS 535 12.104 9.645 -1.707 705 HZ3 LYS 535 2HZ LYS 535 10.965 8.437 -1.441 706 H MET 536 H MET 536 8.649 15.938 0.523 707 HA MET 536 HA MET 536 5.715 16.405 0.517 708 HB2 MET 536 2HB MET 536 6.830 17.605 2.429 709 HB3 MET 536 1HB MET 536 7.774 18.499 1.244 710 HG2 MET 536 2HG MET 536 5.702 19.464 0.334 711 HG3 MET 536 1HG MET 536 4.765 18.584 1.529 712 HE1 MET 536 3HE MET 536 6.603 18.880 4.123 713 HE2 MET 536 1HE MET 536 4.851 19.093 4.123 714 HE3 MET 536 2HE MET 536 5.890 20.318 4.857 715 H GLU 537 H GLU 537 7.496 15.576 -1.685 716 HA GLU 537 HA GLU 537 7.882 17.823 -3.329 717 HB2 GLU 537 2HB GLU 537 7.541 14.933 -4.213 718 HB3 GLU 537 1HB GLU 537 8.138 16.232 -5.218 719 HG2 GLU 537 2HG GLU 537 9.968 14.851 -4.492 720 HG3 GLU 537 1HG GLU 537 10.103 16.437 -3.734 721 H GLY 538 H GLY 538 5.356 15.347 -3.263 722 HA2 GLY 538 2HA GLY 538 3.229 17.102 -3.698 723 HA3 GLY 538 1HA GLY 538 3.682 16.486 -5.271 724 H THR 539 H THR 539 2.971 14.545 -5.884 725 HA THR 539 HA THR 539 1.235 13.215 -4.012 726 HB THR 539 HB THR 539 0.818 11.719 -6.021 727 HG1 THR 539 1HG THR 539 1.750 14.008 -7.435 728 HG21 THR 539 3HG2 THR 539 -0.886 13.251 -6.912 729 HG22 THR 539 1HG2 THR 539 -0.175 14.573 -5.963 730 HG23 THR 539 2HG2 THR 539 -0.870 13.154 -5.159 731 H VAL 540 H VAL 540 1.653 11.504 -3.019 732 HA VAL 540 HA VAL 540 4.033 9.956 -3.695 733 HB VAL 540 HB VAL 540 2.422 10.210 -1.129 734 HG11 VAL 540 1HG1 VAL 540 3.203 7.915 -1.460 735 HG12 VAL 540 2HG1 VAL 540 4.059 8.712 -0.130 736 HG13 VAL 540 3HG1 VAL 540 4.839 8.513 -1.702 737 HG21 VAL 540 3HG2 VAL 540 4.452 11.170 -0.245 738 HG22 VAL 540 1HG2 VAL 540 3.909 12.034 -1.694 739 HG23 VAL 540 2HG2 VAL 540 5.257 10.914 -1.803 740 H SER 541 H SER 541 3.771 7.947 -4.405 741 HA SER 541 HA SER 541 1.039 6.995 -4.721 742 HB2 SER 541 2HB SER 541 2.468 7.150 -6.756 743 HB3 SER 541 1HB SER 541 3.617 6.054 -5.998 744 HG SER 541 HG SER 541 1.140 5.539 -7.145 745 H LEU 542 H LEU 542 0.356 5.744 -3.204 746 HA LEU 542 HA LEU 542 2.250 4.054 -1.771 747 HB2 LEU 542 2HB LEU 542 -0.541 4.903 -1.070 748 HB3 LEU 542 1HB LEU 542 0.498 3.890 -0.090 749 HG LEU 542 HG LEU 542 0.993 6.784 -0.767 750 HD11 LEU 542 1HD1 LEU 542 0.241 5.438 1.794 751 HD12 LEU 542 2HD1 LEU 542 -0.855 6.391 0.793 752 HD13 LEU 542 3HD1 LEU 542 0.539 7.164 1.562 753 HD21 LEU 542 3HD2 LEU 542 2.530 4.909 1.038 754 HD22 LEU 542 1HD2 LEU 542 2.837 6.629 0.798 755 HD23 LEU 542 2HD2 LEU 542 3.044 5.511 -0.544 756 H LEU 543 H LEU 543 2.319 2.153 -2.420 757 HA LEU 543 HA LEU 543 -0.073 0.910 -3.546 758 HB2 LEU 543 2HB LEU 543 2.775 0.439 -3.692 759 HB3 LEU 543 1HB LEU 543 1.798 -1.038 -3.785 760 HG LEU 543 HG LEU 543 1.626 1.365 -5.655 761 HD11 LEU 543 1HD1 LEU 543 3.745 0.119 -5.896 762 HD12 LEU 543 2HD1 LEU 543 2.689 -0.104 -7.289 763 HD13 LEU 543 3HD1 LEU 543 2.825 -1.374 -6.074 764 HD21 LEU 543 3HD2 LEU 543 0.267 -0.134 -7.024 765 HD22 LEU 543 1HD2 LEU 543 -0.480 0.124 -5.451 766 HD23 LEU 543 2HD2 LEU 543 0.382 -1.378 -5.785 767 H VAL 544 H VAL 544 -1.333 -0.124 -2.287 768 HA VAL 544 HA VAL 544 -0.206 -1.369 0.127 769 HB VAL 544 HB VAL 544 -2.349 -1.094 1.229 770 HG11 VAL 544 1HG1 VAL 544 -1.439 1.504 0.020 771 HG12 VAL 544 2HG1 VAL 544 -0.817 0.745 1.490 772 HG13 VAL 544 3HG1 VAL 544 -2.474 1.344 1.437 773 HG21 VAL 544 3HG2 VAL 544 -3.779 -1.343 -0.664 774 HG22 VAL 544 1HG2 VAL 544 -3.278 0.218 -1.315 775 HG23 VAL 544 2HG2 VAL 544 -4.207 0.148 0.198 776 H PHE 545 H PHE 545 -1.297 -3.292 0.790 777 HA PHE 545 HA PHE 545 -2.304 -4.850 -1.510 778 HB2 PHE 545 2HB PHE 545 -0.093 -5.466 -0.553 779 HB3 PHE 545 1HB PHE 545 -0.886 -5.796 0.980 780 HD1 PHE 545 1HD PHE 545 -0.251 -6.888 -2.412 781 HD2 PHE 545 2HD PHE 545 -2.239 -7.817 1.215 782 HE1 PHE 545 1HE PHE 545 -0.527 -9.194 -3.179 783 HE2 PHE 545 2HE PHE 545 -2.516 -10.150 0.458 784 HZ PHE 545 HZ PHE 545 -1.659 -10.835 -1.740 785 H ARG 546 H ARG 546 -4.369 -5.170 -1.310 786 HA ARG 546 HA ARG 546 -5.470 -5.397 1.381 787 HB2 ARG 546 2HB ARG 546 -6.383 -3.493 0.135 788 HB3 ARG 546 1HB ARG 546 -6.815 -4.549 -1.194 789 HG2 ARG 546 2HG ARG 546 -8.496 -5.635 0.125 790 HG3 ARG 546 1HG ARG 546 -7.969 -4.775 1.575 791 HD2 ARG 546 2HD ARG 546 -9.063 -3.453 -0.907 792 HD3 ARG 546 1HD ARG 546 -10.008 -3.796 0.538 793 HE ARG 546 HE ARG 546 -7.826 -2.361 1.425 794 HH11 ARG 546 1HH1 ARG 546 -10.441 -1.731 -0.881 795 HH12 ARG 546 2HH1 ARG 546 -10.460 -0.061 -0.602 796 HH21 ARG 546 1HH2 ARG 546 -7.902 -0.132 1.876 797 HH22 ARG 546 2HH2 ARG 546 -8.946 0.918 1.041 798 H GLN 547 H GLN 547 -5.930 -7.321 1.927 799 HA GLN 547 HA GLN 547 -6.222 -9.353 -0.142 800 HB2 GLN 547 2HB GLN 547 -5.504 -10.947 1.637 801 HB3 GLN 547 1HB GLN 547 -4.299 -9.733 1.232 802 HG2 GLN 547 2HG GLN 547 -4.888 -8.456 3.235 803 HG3 GLN 547 1HG GLN 547 -6.112 -9.654 3.639 804 HE21 GLN 547 1HE2 GLN 547 -5.136 -10.069 5.600 805 HE22 GLN 547 2HE2 GLN 547 -3.688 -10.985 5.764 806 H GLU 548 H GLU 548 -8.128 -10.310 -0.349 807 HA GLU 548 HA GLU 548 -9.949 -9.946 1.873 808 HB2 GLU 548 2HB GLU 548 -10.796 -9.200 -0.345 809 HB3 GLU 548 1HB GLU 548 -10.650 -10.853 -0.923 810 HG2 GLU 548 2HG GLU 548 -12.961 -10.246 -0.308 811 HG3 GLU 548 1HG GLU 548 -12.335 -11.601 0.637 812 H GLU 549 H GLU 549 -8.773 -11.315 3.024 813 HA GLU 549 HA GLU 549 -9.552 -14.139 2.778 814 HB2 GLU 549 2HB GLU 549 -6.804 -13.091 3.491 815 HB3 GLU 549 1HB GLU 549 -7.305 -14.765 3.620 816 HG2 GLU 549 2HG GLU 549 -7.589 -14.824 1.171 817 HG3 GLU 549 1HG GLU 549 -7.008 -13.160 1.093 818 H ALA 550 H ALA 550 -10.318 -11.641 4.276 819 HA ALA 550 HA ALA 550 -9.242 -11.667 6.868 820 HB1 ALA 550 1HB ALA 550 -10.415 -9.730 5.923 821 HB2 ALA 550 2HB ALA 550 -11.105 -10.224 7.471 822 HB3 ALA 550 3HB ALA 550 -11.927 -10.641 5.968 823 H PHE 551 H PHE 551 -9.451 -13.139 8.357 824 HA PHE 551 HA PHE 551 -11.676 -15.002 8.221 825 HB2 PHE 551 2HB PHE 551 -9.246 -14.987 10.033 826 HB3 PHE 551 1HB PHE 551 -10.467 -16.248 9.971 827 HD1 PHE 551 2HD PHE 551 -10.773 -17.440 7.700 828 HD2 PHE 551 1HD PHE 551 -7.352 -15.123 8.718 829 HE1 PHE 551 2HE PHE 551 -9.473 -18.588 5.955 830 HE2 PHE 551 1HE PHE 551 -6.050 -16.267 6.972 831 HZ PHE 551 HZ PHE 551 -7.112 -18.003 5.589 832 H HIS 552 H HIS 552 -12.928 -15.411 10.068 833 HA HIS 552 HA HIS 552 -13.628 -13.050 11.507 834 HB2 HIS 552 2HB HIS 552 -14.553 -15.915 11.897 835 HB3 HIS 552 1HB HIS 552 -15.269 -14.520 12.684 836 HD1 HIS 552 1HD HIS 552 -15.837 -16.720 9.986 837 HD2 HIS 552 2HD HIS 552 -16.302 -12.626 10.518 838 HE1 HIS 552 1HE HIS 552 -17.445 -15.993 8.215 839 HE2 HIS 552 2HE HIS 552 -17.460 -13.514 8.370 840 HA PRO 553 HA PRO 553 -10.692 -13.866 14.850 841 HB2 PRO 553 2HB PRO 553 -12.419 -12.207 16.560 842 HB3 PRO 553 1HB PRO 553 -10.776 -11.890 16.012 843 HG2 PRO 553 2HG PRO 553 -12.831 -10.466 15.058 844 HG3 PRO 553 1HG PRO 553 -11.480 -10.943 14.014 845 HD2 PRO 553 2HD PRO 553 -14.183 -12.202 14.303 846 HD3 PRO 553 1HD PRO 553 -13.299 -11.747 12.829 847 H ARG 554 H ARG 554 -13.043 -15.635 14.495 848 HA ARG 554 HA ARG 554 -14.066 -17.380 15.442 849 HB2 ARG 554 2HB ARG 554 -12.228 -16.861 17.789 850 HB3 ARG 554 1HB ARG 554 -13.212 -18.303 17.573 851 HG2 ARG 554 2HG ARG 554 -11.982 -18.858 15.545 852 HG3 ARG 554 1HG ARG 554 -11.021 -17.391 15.721 853 HD2 ARG 554 2HD ARG 554 -10.150 -18.198 17.834 854 HD3 ARG 554 1HD ARG 554 -11.110 -19.677 17.688 855 HE ARG 554 HE ARG 554 -9.419 -19.225 15.439 856 HH11 ARG 554 1HH1 ARG 554 -9.392 -20.460 18.744 857 HH12 ARG 554 2HH1 ARG 554 -8.079 -21.508 18.512 858 HH21 ARG 554 1HH2 ARG 554 -7.604 -20.630 15.096 859 HH22 ARG 554 2HH2 ARG 554 -7.013 -21.612 16.344 860 H GLU 555 H GLU 555 -15.362 -18.060 17.525 861 HA GLU 555 HA GLU 555 -17.098 -15.825 17.907 862 HB2 GLU 555 2HB GLU 555 -17.403 -18.682 18.829 863 HB3 GLU 555 1HB GLU 555 -18.614 -17.423 19.067 864 HG2 GLU 555 2HG GLU 555 -18.759 -17.131 16.634 865 HG3 GLU 555 1HG GLU 555 -17.598 -18.434 16.420 866 H MET 556 H MET 556 -15.898 -14.517 19.003 867 HA MET 556 HA MET 556 -15.094 -15.171 21.727 868 HB2 MET 556 2HB MET 556 -13.390 -14.202 20.277 869 HB3 MET 556 1HB MET 556 -14.442 -12.861 19.885 870 HG2 MET 556 2HG MET 556 -14.275 -12.057 22.178 871 HG3 MET 556 1HG MET 556 -13.256 -13.428 22.596 872 HE1 MET 556 3HE MET 556 -11.425 -11.675 23.539 873 HE2 MET 556 1HE MET 556 -12.453 -10.326 23.044 874 HE3 MET 556 2HE MET 556 -10.757 -10.374 22.557 875 H ASN 557 H ASN 557 -17.169 -15.149 22.602 876 HA ASN 557 HA ASN 557 -18.465 -12.527 22.582 877 HB2 ASN 557 2HB ASN 557 -19.796 -15.220 23.038 878 HB3 ASN 557 1HB ASN 557 -20.599 -13.663 23.149 879 HD21 ASN 557 1HD2 ASN 557 -22.071 -14.108 21.544 880 HD22 ASN 557 2HD2 ASN 557 -21.657 -14.250 19.885 881 H ALA 558 H ALA 558 -17.338 -11.688 24.242 882 HA ALA 558 HA ALA 558 -18.338 -12.018 26.813 883 HB1 ALA 558 1HB ALA 558 -16.979 -14.075 26.874 884 HB2 ALA 558 2HB ALA 558 -16.349 -12.857 27.982 885 HB3 ALA 558 3HB ALA 558 -15.543 -13.143 26.443 Start of MODEL 9 1 H1 GLY 448 1HT GLY 448 -12.717 9.963 -17.152 2 H2 GLY 448 2HT GLY 448 -13.731 9.717 -18.453 3 H3 GLY 448 3HT GLY 448 -12.287 10.586 -18.668 4 HA2 GLY 448 1HA GLY 448 -12.076 8.361 -19.537 5 HA3 GLY 448 2HA GLY 448 -11.040 8.575 -18.129 6 H SER 449 H SER 449 -11.071 6.300 -17.745 7 HA SER 449 HA SER 449 -13.594 5.030 -17.248 8 HB2 SER 449 2HB SER 449 -10.765 4.020 -16.907 9 HB3 SER 449 1HB SER 449 -12.235 3.043 -16.857 10 HG SER 449 HG SER 449 -11.513 2.852 -18.867 11 H VAL 450 H VAL 450 -14.482 5.917 -15.432 12 HA VAL 450 HA VAL 450 -12.825 5.762 -13.072 13 HB VAL 450 HB VAL 450 -14.501 7.271 -11.919 14 HG11 VAL 450 1HG1 VAL 450 -13.161 8.360 -14.392 15 HG12 VAL 450 2HG1 VAL 450 -12.407 8.139 -12.813 16 HG13 VAL 450 3HG1 VAL 450 -13.700 9.320 -13.011 17 HG21 VAL 450 3HG2 VAL 450 -16.020 8.600 -13.326 18 HG22 VAL 450 1HG2 VAL 450 -16.418 6.879 -13.408 19 HG23 VAL 450 2HG2 VAL 450 -15.541 7.647 -14.729 20 H TYR 451 H TYR 451 -12.986 3.634 -12.815 21 HA TYR 451 HA TYR 451 -15.482 2.747 -11.551 22 HB2 TYR 451 2HB TYR 451 -13.725 0.995 -13.290 23 HB3 TYR 451 1HB TYR 451 -15.205 0.514 -12.481 24 HD1 TYR 451 1HD TYR 451 -17.403 1.548 -13.339 25 HD2 TYR 451 2HD TYR 451 -13.715 1.810 -15.443 26 HE1 TYR 451 1HE TYR 451 -18.625 2.000 -15.427 27 HE2 TYR 451 2HE TYR 451 -14.918 2.269 -17.520 28 HH TYR 451 HH TYR 451 -17.100 1.801 -18.427 29 H ASN 452 H ASN 452 -14.527 3.099 -9.533 30 HA ASN 452 HA ASN 452 -12.037 1.666 -9.114 31 HB2 ASN 452 2HB ASN 452 -11.772 2.942 -6.982 32 HB3 ASN 452 1HB ASN 452 -11.824 3.968 -8.399 33 HD21 ASN 452 1HD2 ASN 452 -13.548 5.365 -8.654 34 HD22 ASN 452 2HD2 ASN 452 -14.676 5.714 -7.390 35 H THR 453 H THR 453 -12.183 -0.282 -8.522 36 HA THR 453 HA THR 453 -14.329 -1.081 -6.707 37 HB THR 453 HB THR 453 -12.545 -2.769 -8.503 38 HG1 THR 453 1HG THR 453 -13.872 -1.897 -9.910 39 HG21 THR 453 3HG2 THR 453 -15.041 -3.510 -6.947 40 HG22 THR 453 1HG2 THR 453 -13.397 -3.978 -6.516 41 HG23 THR 453 2HG2 THR 453 -14.125 -4.586 -8.004 42 H LYS 454 H LYS 454 -13.715 -1.773 -4.688 43 HA LYS 454 HA LYS 454 -10.903 -1.540 -4.081 44 HB2 LYS 454 2HB LYS 454 -13.148 -2.237 -2.154 45 HB3 LYS 454 1HB LYS 454 -11.491 -1.914 -1.713 46 HG2 LYS 454 2HG LYS 454 -12.668 0.049 -1.154 47 HG3 LYS 454 1HG LYS 454 -11.837 0.436 -2.654 48 HD2 LYS 454 2HD LYS 454 -14.083 1.303 -2.766 49 HD3 LYS 454 1HD LYS 454 -13.959 -0.057 -3.882 50 HE2 LYS 454 2HE LYS 454 -14.995 -1.520 -2.150 51 HE3 LYS 454 1HE LYS 454 -15.148 -0.119 -1.102 52 HZ1 LYS 454 3HZ LYS 454 -16.639 0.888 -2.738 53 HZ2 LYS 454 1HZ LYS 454 -17.196 -0.615 -2.242 54 HZ3 LYS 454 2HZ LYS 454 -16.469 -0.448 -3.742 55 H LYS 455 H LYS 455 -10.112 -3.222 -5.236 56 HA LYS 455 HA LYS 455 -11.030 -5.893 -4.851 57 HB2 LYS 455 2HB LYS 455 -8.475 -4.874 -6.096 58 HB3 LYS 455 1HB LYS 455 -9.017 -6.540 -6.148 59 HG2 LYS 455 2HG LYS 455 -11.006 -5.831 -7.414 60 HG3 LYS 455 1HG LYS 455 -10.404 -4.173 -7.383 61 HD2 LYS 455 2HD LYS 455 -8.401 -4.848 -8.583 62 HD3 LYS 455 1HD LYS 455 -8.942 -6.526 -8.576 63 HE2 LYS 455 2HE LYS 455 -10.891 -5.896 -9.912 64 HE3 LYS 455 1HE LYS 455 -10.349 -4.220 -9.911 65 HZ1 LYS 455 3HZ LYS 455 -8.900 -6.518 -11.124 66 HZ2 LYS 455 1HZ LYS 455 -8.346 -4.923 -11.100 67 HZ3 LYS 455 2HZ LYS 455 -9.736 -5.314 -11.945 68 H VAL 456 H VAL 456 -10.833 -6.747 -2.890 69 HA VAL 456 HA VAL 456 -8.468 -6.156 -1.344 70 HB VAL 456 HB VAL 456 -10.885 -7.801 -0.530 71 HG11 VAL 456 1HG1 VAL 456 -9.024 -8.303 0.856 72 HG12 VAL 456 2HG1 VAL 456 -10.090 -7.220 1.753 73 HG13 VAL 456 3HG1 VAL 456 -8.614 -6.592 1.016 74 HG21 VAL 456 3HG2 VAL 456 -10.304 -4.883 -0.014 75 HG22 VAL 456 1HG2 VAL 456 -11.642 -5.799 0.673 76 HG23 VAL 456 2HG2 VAL 456 -11.568 -5.519 -1.068 77 H GLY 457 H GLY 457 -6.911 -7.620 -0.807 78 HA2 GLY 457 2HA GLY 457 -5.828 -9.699 -0.862 79 HA3 GLY 457 1HA GLY 457 -7.052 -10.294 -1.991 80 H LYS 458 H LYS 458 -6.319 -7.255 -2.755 81 HA LYS 458 HA LYS 458 -4.305 -7.937 -4.760 82 HB2 LYS 458 2HB LYS 458 -6.835 -6.316 -5.231 83 HB3 LYS 458 1HB LYS 458 -5.495 -6.359 -6.355 84 HG2 LYS 458 2HG LYS 458 -7.249 -7.811 -7.166 85 HG3 LYS 458 1HG LYS 458 -5.894 -8.809 -6.658 86 HD2 LYS 458 2HD LYS 458 -7.062 -9.261 -4.531 87 HD3 LYS 458 1HD LYS 458 -8.420 -8.286 -5.082 88 HE2 LYS 458 2HE LYS 458 -7.398 -10.779 -6.442 89 HE3 LYS 458 1HE LYS 458 -8.768 -10.721 -5.337 90 HZ1 LYS 458 3HZ LYS 458 -9.444 -10.720 -7.615 91 HZ2 LYS 458 1HZ LYS 458 -8.616 -9.299 -7.960 92 HZ3 LYS 458 2HZ LYS 458 -9.932 -9.309 -6.879 93 H ARG 459 H ARG 459 -3.299 -5.880 -5.695 94 HA ARG 459 HA ARG 459 -2.895 -4.093 -3.425 95 HB2 ARG 459 2HB ARG 459 -1.026 -4.665 -5.738 96 HB3 ARG 459 1HB ARG 459 -0.727 -3.497 -4.473 97 HG2 ARG 459 2HG ARG 459 0.540 -5.226 -3.612 98 HG3 ARG 459 1HG ARG 459 -1.036 -5.665 -2.985 99 HD2 ARG 459 2HD ARG 459 -0.066 -6.702 -5.616 100 HD3 ARG 459 1HD ARG 459 0.425 -7.475 -4.121 101 HE ARG 459 HE ARG 459 -2.203 -7.554 -3.891 102 HH11 ARG 459 1HH1 ARG 459 -0.253 -8.110 -6.799 103 HH12 ARG 459 2HH1 ARG 459 -1.164 -9.425 -7.354 104 HH21 ARG 459 1HH2 ARG 459 -3.507 -9.503 -4.696 105 HH22 ARG 459 2HH2 ARG 459 -3.012 -10.205 -6.156 106 H LEU 460 H LEU 460 -3.259 -1.991 -3.659 107 HA LEU 460 HA LEU 460 -3.910 -0.988 -6.335 108 HB2 LEU 460 2HB LEU 460 -5.403 -0.385 -3.772 109 HB3 LEU 460 1HB LEU 460 -5.579 0.551 -5.227 110 HG LEU 460 HG LEU 460 -6.498 -1.492 -6.364 111 HD11 LEU 460 1HD1 LEU 460 -6.535 -2.655 -3.601 112 HD12 LEU 460 2HD1 LEU 460 -5.567 -3.225 -4.960 113 HD13 LEU 460 3HD1 LEU 460 -7.327 -3.334 -5.020 114 HD21 LEU 460 3HD2 LEU 460 -7.958 0.230 -5.514 115 HD22 LEU 460 1HD2 LEU 460 -7.968 -0.530 -3.924 116 HD23 LEU 460 2HD2 LEU 460 -8.694 -1.357 -5.300 117 H ASN 461 H ASN 461 -3.291 1.082 -6.759 118 HA ASN 461 HA ASN 461 -1.365 2.150 -4.846 119 HB2 ASN 461 2HB ASN 461 -0.453 3.491 -6.727 120 HB3 ASN 461 1HB ASN 461 -0.411 1.768 -7.062 121 HD21 ASN 461 1HD2 ASN 461 -1.775 4.820 -7.923 122 HD22 ASN 461 2HD2 ASN 461 -2.572 4.288 -9.359 123 H ILE 462 H ILE 462 -1.533 4.075 -3.972 124 HA ILE 462 HA ILE 462 -3.930 5.664 -4.584 125 HB ILE 462 HB ILE 462 -2.798 4.971 -1.846 126 HG12 ILE 462 2HG1 ILE 462 -5.470 4.183 -3.053 127 HG13 ILE 462 1HG1 ILE 462 -4.061 3.122 -2.983 128 HG21 ILE 462 1HG2 ILE 462 -3.707 7.246 -1.902 129 HG22 ILE 462 2HG2 ILE 462 -4.717 6.182 -0.922 130 HG23 ILE 462 3HG2 ILE 462 -5.223 6.630 -2.543 131 HD11 ILE 462 3HD1 ILE 462 -5.635 2.604 -1.241 132 HD12 ILE 462 1HD1 ILE 462 -5.597 4.275 -0.677 133 HD13 ILE 462 2HD1 ILE 462 -4.161 3.266 -0.531 134 H GLN 463 H GLN 463 -3.407 7.736 -5.015 135 HA GLN 463 HA GLN 463 -0.772 8.724 -4.181 136 HB2 GLN 463 2HB GLN 463 -2.551 9.596 -6.444 137 HB3 GLN 463 1HB GLN 463 -1.159 10.529 -5.907 138 HG2 GLN 463 2HG GLN 463 0.294 8.762 -6.393 139 HG3 GLN 463 1HG GLN 463 -1.033 7.678 -6.870 140 HE21 GLN 463 1HE2 GLN 463 1.272 8.506 -8.324 141 HE22 GLN 463 2HE2 GLN 463 0.713 9.330 -9.749 142 H LEU 464 H LEU 464 -0.556 10.296 -2.819 143 HA LEU 464 HA LEU 464 -2.951 11.849 -2.101 144 HB2 LEU 464 2HB LEU 464 -0.796 10.890 -0.219 145 HB3 LEU 464 1HB LEU 464 -2.140 11.898 0.232 146 HG LEU 464 HG LEU 464 -3.620 9.896 -0.422 147 HD11 LEU 464 1HD1 LEU 464 -0.974 8.511 -0.213 148 HD12 LEU 464 2HD1 LEU 464 -1.990 8.615 -1.650 149 HD13 LEU 464 3HD1 LEU 464 -2.552 7.709 -0.239 150 HD21 LEU 464 3HD2 LEU 464 -3.250 8.820 1.727 151 HD22 LEU 464 1HD2 LEU 464 -3.303 10.572 1.848 152 HD23 LEU 464 2HD2 LEU 464 -1.748 9.732 1.917 153 H LYS 465 H LYS 465 -2.651 14.011 -1.856 154 HA LYS 465 HA LYS 465 0.081 15.135 -2.114 155 HB2 LYS 465 2HB LYS 465 -1.509 15.889 -3.837 156 HB3 LYS 465 1HB LYS 465 -2.647 16.380 -2.575 157 HG2 LYS 465 2HG LYS 465 -0.997 18.006 -1.773 158 HG3 LYS 465 1HG LYS 465 0.099 17.527 -3.069 159 HD2 LYS 465 2HD LYS 465 -1.583 18.241 -4.718 160 HD3 LYS 465 1HD LYS 465 -2.647 18.733 -3.398 161 HE2 LYS 465 2HE LYS 465 -0.929 20.304 -2.627 162 HE3 LYS 465 1HE LYS 465 0.090 19.833 -3.983 163 HZ1 LYS 465 3HZ LYS 465 -1.088 21.870 -4.471 164 HZ2 LYS 465 1HZ LYS 465 -2.575 21.139 -4.178 165 HZ3 LYS 465 2HZ LYS 465 -1.645 20.651 -5.488 166 H LYS 466 H LYS 466 0.864 16.099 -0.529 167 HA LYS 466 HA LYS 466 -0.336 15.782 2.024 168 HB2 LYS 466 2HB LYS 466 2.178 17.144 1.196 169 HB3 LYS 466 1HB LYS 466 1.551 17.263 2.823 170 HG2 LYS 466 2HG LYS 466 3.262 15.548 2.703 171 HG3 LYS 466 1HG LYS 466 1.701 14.826 3.051 172 HD2 LYS 466 2HD LYS 466 3.007 13.529 1.436 173 HD3 LYS 466 1HD LYS 466 1.472 14.151 0.801 174 HE2 LYS 466 2HE LYS 466 3.462 14.311 -0.689 175 HE3 LYS 466 1HE LYS 466 2.530 15.787 -0.478 176 HZ1 LYS 466 3HZ LYS 466 4.151 16.471 1.201 177 HZ2 LYS 466 1HZ LYS 466 4.849 16.320 -0.297 178 HZ3 LYS 466 2HZ LYS 466 5.091 15.105 0.877 179 H GLY 467 H GLY 467 -1.310 17.034 3.281 180 HA2 GLY 467 2HA GLY 467 -1.678 19.811 2.433 181 HA3 GLY 467 1HA GLY 467 -2.897 18.917 3.336 182 H THR 468 H THR 468 -3.007 19.729 5.315 183 HA THR 468 HA THR 468 -0.778 20.988 6.656 184 HB THR 468 HB THR 468 -3.505 20.276 7.742 185 HG1 THR 468 1HG THR 468 -3.876 21.609 6.072 186 HG21 THR 468 3HG2 THR 468 -1.815 20.850 9.457 187 HG22 THR 468 1HG2 THR 468 -3.073 22.082 9.346 188 HG23 THR 468 2HG2 THR 468 -1.496 22.367 8.613 189 H GLU 469 H GLU 469 -2.485 17.924 6.893 190 HA GLU 469 HA GLU 469 -0.879 17.160 9.192 191 HB2 GLU 469 2HB GLU 469 -3.130 15.692 7.789 192 HB3 GLU 469 1HB GLU 469 -2.353 15.191 9.281 193 HG2 GLU 469 2HG GLU 469 -4.455 16.168 9.858 194 HG3 GLU 469 1HG GLU 469 -3.176 17.316 10.294 195 H GLY 470 H GLY 470 -0.426 17.324 6.086 196 HA2 GLY 470 2HA GLY 470 1.181 16.359 4.748 197 HA3 GLY 470 1HA GLY 470 1.466 15.175 6.024 198 H LEU 471 H LEU 471 0.838 13.240 5.675 199 HA LEU 471 HA LEU 471 -0.870 12.667 3.417 200 HB2 LEU 471 2HB LEU 471 0.648 10.877 5.308 201 HB3 LEU 471 1HB LEU 471 -0.312 10.315 3.955 202 HG LEU 471 HG LEU 471 2.133 12.084 3.701 203 HD11 LEU 471 1HD1 LEU 471 3.238 10.100 2.819 204 HD12 LEU 471 2HD1 LEU 471 1.806 9.132 3.167 205 HD13 LEU 471 3HD1 LEU 471 2.731 9.851 4.489 206 HD21 LEU 471 3HD2 LEU 471 1.964 11.582 1.310 207 HD22 LEU 471 1HD2 LEU 471 0.513 12.378 1.879 208 HD23 LEU 471 2HD2 LEU 471 0.507 10.633 1.605 209 H GLY 472 H GLY 472 -0.854 12.316 6.914 210 HA2 GLY 472 2HA GLY 472 -2.715 12.484 8.291 211 HA3 GLY 472 1HA GLY 472 -3.766 12.379 6.898 212 H PHE 473 H PHE 473 -1.237 10.011 7.528 213 HA PHE 473 HA PHE 473 -3.064 8.328 8.942 214 HB2 PHE 473 2HB PHE 473 -2.973 6.405 7.458 215 HB3 PHE 473 1HB PHE 473 -3.667 7.772 6.615 216 HD1 PHE 473 1HD PHE 473 -2.099 9.057 5.025 217 HD2 PHE 473 2HD PHE 473 -1.234 5.170 6.534 218 HE1 PHE 473 1HE PHE 473 -0.559 8.638 3.136 219 HE2 PHE 473 2HE PHE 473 0.309 4.794 4.670 220 HZ PHE 473 HZ PHE 473 0.608 6.574 2.962 221 H SER 474 H SER 474 -2.123 6.654 9.985 222 HA SER 474 HA SER 474 0.810 6.842 10.150 223 HB2 SER 474 2HB SER 474 -1.171 6.224 12.349 224 HB3 SER 474 1HB SER 474 0.579 6.353 12.537 225 HG SER 474 HG SER 474 -0.123 8.563 11.371 226 H ILE 475 H ILE 475 1.850 4.786 10.862 227 HA ILE 475 HA ILE 475 0.350 2.440 9.913 228 HB ILE 475 HB ILE 475 2.552 1.558 9.266 229 HG12 ILE 475 2HG1 ILE 475 3.426 4.418 9.625 230 HG13 ILE 475 1HG1 ILE 475 3.874 2.979 10.552 231 HG21 ILE 475 1HG2 ILE 475 1.007 2.280 7.591 232 HG22 ILE 475 2HG2 ILE 475 2.653 2.666 7.121 233 HG23 ILE 475 3HG2 ILE 475 1.582 3.955 7.707 234 HD11 ILE 475 3HD1 ILE 475 5.642 3.723 8.924 235 HD12 ILE 475 1HD1 ILE 475 4.524 3.421 7.618 236 HD13 ILE 475 2HD1 ILE 475 5.083 2.084 8.625 237 H THR 476 H THR 476 0.777 0.534 10.945 238 HA THR 476 HA THR 476 2.490 0.517 13.290 239 HB THR 476 HB THR 476 0.110 0.641 14.097 240 HG1 THR 476 1HG THR 476 1.206 -0.430 15.535 241 HG21 THR 476 3HG2 THR 476 -0.990 -0.470 12.175 242 HG22 THR 476 1HG2 THR 476 -1.412 -1.256 13.699 243 HG23 THR 476 2HG2 THR 476 -0.220 -1.989 12.625 244 H SER 477 H SER 477 3.090 -1.752 13.826 245 HA SER 477 HA SER 477 3.073 -3.457 11.458 246 HB2 SER 477 2HB SER 477 5.283 -2.456 11.622 247 HB3 SER 477 1HB SER 477 5.345 -2.818 13.326 248 HG SER 477 HG SER 477 5.848 -4.416 11.125 249 H ARG 478 H ARG 478 3.270 -5.732 12.060 250 HA ARG 478 HA ARG 478 2.167 -6.158 14.767 251 HB2 ARG 478 2HB ARG 478 0.978 -8.086 13.970 252 HB3 ARG 478 1HB ARG 478 0.502 -6.659 13.074 253 HG2 ARG 478 2HG ARG 478 1.819 -7.366 11.182 254 HG3 ARG 478 1HG ARG 478 2.422 -8.753 12.090 255 HD2 ARG 478 2HD ARG 478 0.171 -9.621 12.326 256 HD3 ARG 478 1HD ARG 478 -0.479 -8.240 11.451 257 HE ARG 478 HE ARG 478 1.015 -9.125 9.573 258 HH11 ARG 478 1HH1 ARG 478 -0.654 -11.185 11.931 259 HH12 ARG 478 2HH1 ARG 478 -0.842 -12.490 10.865 260 HH21 ARG 478 1HH2 ARG 478 0.749 -10.916 8.096 261 HH22 ARG 478 2HH2 ARG 478 -0.034 -12.328 8.611 262 H ASP 479 H ASP 479 2.738 -7.565 16.024 263 HA ASP 479 HA ASP 479 5.323 -8.670 15.928 264 HB2 ASP 479 2HB ASP 479 4.309 -8.155 18.054 265 HB3 ASP 479 1HB ASP 479 2.894 -9.119 17.687 266 H VAL 480 H VAL 480 5.601 -11.124 16.178 267 HA VAL 480 HA VAL 480 5.487 -13.197 15.351 268 HB VAL 480 HB VAL 480 2.820 -12.518 14.048 269 HG11 VAL 480 1HG1 VAL 480 3.854 -14.451 13.073 270 HG12 VAL 480 2HG1 VAL 480 2.430 -14.923 14.001 271 HG13 VAL 480 3HG1 VAL 480 4.044 -15.193 14.664 272 HG21 VAL 480 3HG2 VAL 480 1.717 -13.623 15.968 273 HG22 VAL 480 1HG2 VAL 480 2.614 -12.169 16.403 274 HG23 VAL 480 2HG2 VAL 480 3.295 -13.758 16.768 275 H THR 481 H THR 481 7.088 -13.185 14.024 276 HA THR 481 HA THR 481 7.036 -11.526 11.692 277 HB THR 481 HB THR 481 9.081 -11.533 12.957 278 HG1 THR 481 1HG THR 481 10.482 -11.860 11.372 279 HG21 THR 481 3HG2 THR 481 10.512 -13.534 13.158 280 HG22 THR 481 1HG2 THR 481 9.249 -14.494 12.386 281 HG23 THR 481 2HG2 THR 481 8.963 -13.753 13.962 282 H ILE 482 H ILE 482 6.814 -12.106 9.671 283 HA ILE 482 HA ILE 482 6.145 -14.873 9.142 284 HB ILE 482 HB ILE 482 5.317 -14.008 6.900 285 HG12 ILE 482 2HG1 ILE 482 4.706 -11.554 6.813 286 HG13 ILE 482 1HG1 ILE 482 5.706 -11.291 8.224 287 HG21 ILE 482 1HG2 ILE 482 4.008 -12.970 9.396 288 HG22 ILE 482 2HG2 ILE 482 3.797 -14.560 8.667 289 HG23 ILE 482 3HG2 ILE 482 3.224 -13.122 7.823 290 HD11 ILE 482 3HD1 ILE 482 7.678 -11.960 6.916 291 HD12 ILE 482 1HD1 ILE 482 6.830 -10.595 6.189 292 HD13 ILE 482 2HD1 ILE 482 6.642 -12.214 5.509 293 H GLY 483 H GLY 483 8.845 -13.229 9.173 294 HA2 GLY 483 2HA GLY 483 10.694 -14.737 8.251 295 HA3 GLY 483 1HA GLY 483 9.928 -14.402 6.701 296 H GLY 484 H GLY 484 10.593 -12.329 9.486 297 HA2 GLY 484 2HA GLY 484 12.142 -10.600 9.629 298 HA3 GLY 484 1HA GLY 484 12.498 -10.800 7.917 299 H SER 485 H SER 485 12.281 -8.348 8.372 300 HA SER 485 HA SER 485 11.336 -6.456 7.637 301 HB2 SER 485 2HB SER 485 9.084 -8.187 6.578 302 HB3 SER 485 1HB SER 485 9.413 -6.514 6.126 303 HG SER 485 HG SER 485 11.647 -7.710 5.774 304 H ALA 486 H ALA 486 8.696 -8.475 8.852 305 HA ALA 486 HA ALA 486 7.010 -8.190 10.267 306 HB1 ALA 486 1HB ALA 486 7.063 -6.508 12.068 307 HB2 ALA 486 2HB ALA 486 8.431 -5.717 11.286 308 HB3 ALA 486 3HB ALA 486 8.608 -7.346 11.929 309 HA PRO 487 HA PRO 487 5.003 -5.911 7.034 310 HB2 PRO 487 2HB PRO 487 2.463 -6.824 7.677 311 HB3 PRO 487 1HB PRO 487 3.599 -7.631 6.592 312 HG2 PRO 487 2HG PRO 487 3.002 -8.179 9.461 313 HG3 PRO 487 1HG PRO 487 3.374 -9.312 8.152 314 HD2 PRO 487 2HD PRO 487 5.154 -8.642 10.023 315 HD3 PRO 487 1HD PRO 487 5.650 -8.994 8.354 316 H ILE 488 H ILE 488 4.194 -3.995 6.892 317 HA ILE 488 HA ILE 488 3.256 -2.657 9.289 318 HB ILE 488 HB ILE 488 4.374 -1.568 6.658 319 HG12 ILE 488 2HG1 ILE 488 5.909 -2.323 8.587 320 HG13 ILE 488 1HG1 ILE 488 6.080 -0.698 7.926 321 HG21 ILE 488 1HG2 ILE 488 3.986 0.627 7.455 322 HG22 ILE 488 2HG2 ILE 488 3.141 -0.096 8.836 323 HG23 ILE 488 3HG2 ILE 488 2.462 -0.268 7.214 324 HD11 ILE 488 3HD1 ILE 488 5.031 0.292 9.785 325 HD12 ILE 488 1HD1 ILE 488 6.217 -0.843 10.411 326 HD13 ILE 488 2HD1 ILE 488 4.504 -1.274 10.415 327 H TYR 489 H TYR 489 1.299 -2.027 9.517 328 HA TYR 489 HA TYR 489 -0.537 -1.981 7.209 329 HB2 TYR 489 2HB TYR 489 -1.204 -2.834 10.049 330 HB3 TYR 489 1HB TYR 489 -2.352 -2.694 8.727 331 HD1 TYR 489 2HD TYR 489 0.451 -4.627 10.067 332 HD2 TYR 489 1HD TYR 489 -2.497 -4.379 7.029 333 HE1 TYR 489 2HE TYR 489 0.942 -6.922 9.438 334 HE2 TYR 489 1HE TYR 489 -2.011 -6.705 6.357 335 HH TYR 489 HH TYR 489 -0.143 -8.369 6.569 336 H VAL 490 H VAL 490 -1.968 -0.293 7.208 337 HA VAL 490 HA VAL 490 -1.177 2.082 8.530 338 HB VAL 490 HB VAL 490 -3.836 1.477 7.198 339 HG11 VAL 490 1HG1 VAL 490 -2.547 4.112 7.897 340 HG12 VAL 490 2HG1 VAL 490 -3.990 3.429 8.645 341 HG13 VAL 490 3HG1 VAL 490 -4.019 3.917 6.949 342 HG21 VAL 490 3HG2 VAL 490 -1.997 1.158 5.654 343 HG22 VAL 490 1HG2 VAL 490 -1.326 2.734 6.102 344 HG23 VAL 490 2HG2 VAL 490 -2.881 2.641 5.277 345 H LYS 491 H LYS 491 -1.539 2.676 10.527 346 HA LYS 491 HA LYS 491 -3.242 1.031 12.215 347 HB2 LYS 491 2HB LYS 491 -1.051 1.613 12.981 348 HB3 LYS 491 1HB LYS 491 -1.408 3.320 12.828 349 HG2 LYS 491 2HG LYS 491 -3.139 3.122 14.549 350 HG3 LYS 491 1HG LYS 491 -2.743 1.418 14.735 351 HD2 LYS 491 2HD LYS 491 -0.526 1.980 15.511 352 HD3 LYS 491 1HD LYS 491 -0.821 3.694 15.187 353 HE2 LYS 491 2HE LYS 491 -2.600 3.716 16.761 354 HE3 LYS 491 1HE LYS 491 -2.392 1.999 17.103 355 HZ1 LYS 491 3HZ LYS 491 -1.344 3.378 18.798 356 HZ2 LYS 491 1HZ LYS 491 -0.390 4.139 17.651 357 HZ3 LYS 491 2HZ LYS 491 -0.164 2.503 17.993 358 H ASN 492 H ASN 492 -3.175 4.335 11.024 359 HA ASN 492 HA ASN 492 -5.878 4.748 12.054 360 HB2 ASN 492 2HB ASN 492 -4.457 5.400 13.936 361 HB3 ASN 492 1HB ASN 492 -3.548 6.483 12.893 362 HD21 ASN 492 1HD2 ASN 492 -4.009 8.275 14.123 363 HD22 ASN 492 2HD2 ASN 492 -5.561 9.012 14.223 364 H ILE 493 H ILE 493 -7.030 5.934 10.710 365 HA ILE 493 HA ILE 493 -5.697 7.548 8.667 366 HB ILE 493 HB ILE 493 -8.580 6.572 8.892 367 HG12 ILE 493 2HG1 ILE 493 -7.016 4.759 8.343 368 HG13 ILE 493 1HG1 ILE 493 -8.102 5.124 7.007 369 HG21 ILE 493 1HG2 ILE 493 -7.259 8.096 6.652 370 HG22 ILE 493 2HG2 ILE 493 -8.530 8.695 7.726 371 HG23 ILE 493 3HG2 ILE 493 -8.867 7.390 6.590 372 HD11 ILE 493 3HD1 ILE 493 -5.856 4.695 6.215 373 HD12 ILE 493 1HD1 ILE 493 -5.225 5.985 7.241 374 HD13 ILE 493 2HD1 ILE 493 -6.306 6.373 5.901 375 H LEU 494 H LEU 494 -5.441 9.568 9.387 376 HA LEU 494 HA LEU 494 -6.750 10.529 11.663 377 HB2 LEU 494 2HB LEU 494 -4.982 11.894 9.647 378 HB3 LEU 494 1HB LEU 494 -5.727 12.781 10.954 379 HG LEU 494 HG LEU 494 -4.507 11.374 12.592 380 HD11 LEU 494 1HD1 LEU 494 -3.123 10.184 10.203 381 HD12 LEU 494 2HD1 LEU 494 -4.217 9.342 11.301 382 HD13 LEU 494 3HD1 LEU 494 -2.668 9.945 11.888 383 HD21 LEU 494 3HD2 LEU 494 -3.573 13.500 11.902 384 HD22 LEU 494 1HD2 LEU 494 -2.761 12.721 10.546 385 HD23 LEU 494 2HD2 LEU 494 -2.288 12.328 12.197 386 HA PRO 495 HA PRO 495 -10.682 12.030 10.470 387 HB2 PRO 495 2HB PRO 495 -9.933 14.506 11.953 388 HB3 PRO 495 1HB PRO 495 -11.381 13.499 12.100 389 HG2 PRO 495 2HG PRO 495 -9.508 13.274 13.933 390 HG3 PRO 495 1HG PRO 495 -10.249 11.813 13.249 391 HD2 PRO 495 2HD PRO 495 -7.593 13.041 12.651 392 HD3 PRO 495 1HD PRO 495 -8.029 11.337 12.898 393 H ARG 496 H ARG 496 -7.969 14.215 9.991 394 HA ARG 496 HA ARG 496 -9.200 14.938 7.500 395 HB2 ARG 496 2HB ARG 496 -8.717 17.300 7.704 396 HB3 ARG 496 1HB ARG 496 -9.699 16.824 9.071 397 HG2 ARG 496 2HG ARG 496 -7.745 16.810 10.491 398 HG3 ARG 496 1HG ARG 496 -6.719 17.255 9.116 399 HD2 ARG 496 2HD ARG 496 -8.192 19.284 8.867 400 HD3 ARG 496 1HD ARG 496 -8.911 18.838 10.412 401 HE ARG 496 HE ARG 496 -6.043 19.063 10.388 402 HH11 ARG 496 1HH1 ARG 496 -9.109 20.723 11.011 403 HH12 ARG 496 2HH1 ARG 496 -8.412 21.982 11.913 404 HH21 ARG 496 1HH2 ARG 496 -5.088 20.798 11.645 405 HH22 ARG 496 2HH2 ARG 496 -6.107 22.021 12.275 406 H GLY 497 H GLY 497 -7.754 15.155 5.886 407 HA2 GLY 497 2HA GLY 497 -5.224 15.618 5.708 408 HA3 GLY 497 1HA GLY 497 -5.156 14.029 6.463 409 H ALA 498 H ALA 498 -4.060 14.201 4.072 410 HA ALA 498 HA ALA 498 -5.648 14.064 1.803 411 HB1 ALA 498 1HB ALA 498 -2.994 12.737 2.252 412 HB2 ALA 498 2HB ALA 498 -3.230 14.421 1.792 413 HB3 ALA 498 3HB ALA 498 -3.728 13.133 0.695 414 H ALA 499 H ALA 499 -4.532 11.431 3.883 415 HA ALA 499 HA ALA 499 -5.398 9.313 2.249 416 HB1 ALA 499 1HB ALA 499 -3.786 8.937 4.013 417 HB2 ALA 499 2HB ALA 499 -5.182 7.890 4.249 418 HB3 ALA 499 3HB ALA 499 -4.989 9.335 5.236 419 H ILE 500 H ILE 500 -7.077 10.985 4.882 420 HA ILE 500 HA ILE 500 -9.261 9.177 4.701 421 HB ILE 500 HB ILE 500 -8.723 10.468 6.830 422 HG12 ILE 500 2HG1 ILE 500 -11.539 10.721 5.754 423 HG13 ILE 500 1HG1 ILE 500 -10.838 9.290 6.481 424 HG21 ILE 500 1HG2 ILE 500 -8.334 12.666 5.849 425 HG22 ILE 500 2HG2 ILE 500 -9.614 12.735 7.061 426 HG23 ILE 500 3HG2 ILE 500 -10.024 12.748 5.346 427 HD11 ILE 500 3HD1 ILE 500 -11.280 11.906 7.893 428 HD12 ILE 500 1HD1 ILE 500 -10.624 10.431 8.603 429 HD13 ILE 500 2HD1 ILE 500 -12.294 10.469 8.038 430 H GLN 501 H GLN 501 -8.436 12.212 3.234 431 HA GLN 501 HA GLN 501 -11.025 12.702 2.160 432 HB2 GLN 501 2HB GLN 501 -8.339 13.774 1.347 433 HB3 GLN 501 1HB GLN 501 -9.859 14.326 0.656 434 HG2 GLN 501 2HG GLN 501 -8.997 14.570 3.536 435 HG3 GLN 501 1HG GLN 501 -9.108 15.876 2.358 436 HE21 GLN 501 1HE2 GLN 501 -10.421 15.637 4.905 437 HE22 GLN 501 2HE2 GLN 501 -12.122 15.665 4.611 438 H ASP 502 H ASP 502 -8.241 10.910 1.086 439 HA ASP 502 HA ASP 502 -9.168 10.528 -1.591 440 HB2 ASP 502 2HB ASP 502 -6.803 10.172 -0.988 441 HB3 ASP 502 1HB ASP 502 -7.277 8.829 0.044 442 H GLY 503 H GLY 503 -9.195 8.547 1.307 443 HA2 GLY 503 2HA GLY 503 -10.943 7.245 2.117 444 HA3 GLY 503 1HA GLY 503 -11.857 7.638 0.678 445 H ARG 504 H ARG 504 -9.015 6.435 -0.575 446 HA ARG 504 HA ARG 504 -10.220 3.789 -0.768 447 HB2 ARG 504 2HB ARG 504 -7.719 4.855 -2.106 448 HB3 ARG 504 1HB ARG 504 -8.477 3.308 -2.440 449 HG2 ARG 504 2HG ARG 504 -9.699 6.024 -2.985 450 HG3 ARG 504 1HG ARG 504 -8.961 4.969 -4.185 451 HD2 ARG 504 2HD ARG 504 -11.368 4.772 -4.323 452 HD3 ARG 504 1HD ARG 504 -10.680 3.278 -3.687 453 HE ARG 504 HE ARG 504 -11.325 4.785 -1.494 454 HH11 ARG 504 1HH1 ARG 504 -13.213 3.554 -4.233 455 HH12 ARG 504 2HH1 ARG 504 -14.588 3.272 -3.293 456 HH21 ARG 504 1HH2 ARG 504 -13.204 4.372 -0.230 457 HH22 ARG 504 2HH2 ARG 504 -14.605 3.762 -0.959 458 H LEU 505 H LEU 505 -7.802 5.388 0.899 459 HA LEU 505 HA LEU 505 -6.507 2.944 1.795 460 HB2 LEU 505 2HB LEU 505 -5.205 4.974 1.207 461 HB3 LEU 505 1HB LEU 505 -6.027 5.837 2.485 462 HG LEU 505 HG LEU 505 -4.948 4.392 4.150 463 HD11 LEU 505 1HD1 LEU 505 -3.590 3.180 1.743 464 HD12 LEU 505 2HD1 LEU 505 -4.676 2.354 2.867 465 HD13 LEU 505 3HD1 LEU 505 -3.107 2.935 3.420 466 HD21 LEU 505 3HD2 LEU 505 -3.068 5.635 2.167 467 HD22 LEU 505 1HD2 LEU 505 -2.702 5.255 3.850 468 HD23 LEU 505 2HD2 LEU 505 -3.914 6.475 3.464 469 H LYS 506 H LYS 506 -6.775 2.130 3.883 470 HA LYS 506 HA LYS 506 -8.444 3.556 5.775 471 HB2 LYS 506 2HB LYS 506 -9.921 2.038 4.368 472 HB3 LYS 506 1HB LYS 506 -8.886 0.715 4.886 473 HG2 LYS 506 2HG LYS 506 -9.620 1.020 7.190 474 HG3 LYS 506 1HG LYS 506 -10.661 2.355 6.680 475 HD2 LYS 506 2HD LYS 506 -11.936 0.854 5.257 476 HD3 LYS 506 1HD LYS 506 -10.856 -0.476 5.653 477 HE2 LYS 506 2HE LYS 506 -12.911 -0.666 6.931 478 HE3 LYS 506 1HE LYS 506 -11.557 -0.329 8.000 479 HZ1 LYS 506 3HZ LYS 506 -13.522 1.680 7.046 480 HZ2 LYS 506 1HZ LYS 506 -12.282 1.966 8.154 481 HZ3 LYS 506 2HZ LYS 506 -13.540 0.933 8.550 482 H ALA 507 H ALA 507 -8.301 2.326 7.899 483 HA ALA 507 HA ALA 507 -5.633 1.606 8.509 484 HB1 ALA 507 1HB ALA 507 -6.576 1.103 10.728 485 HB2 ALA 507 2HB ALA 507 -8.187 1.265 10.015 486 HB3 ALA 507 3HB ALA 507 -7.123 2.675 10.097 487 H GLY 508 H GLY 508 -4.781 -0.391 8.813 488 HA2 GLY 508 2HA GLY 508 -4.877 -2.746 9.151 489 HA3 GLY 508 1HA GLY 508 -6.475 -2.791 8.449 490 H ASP 509 H ASP 509 -5.117 -0.869 6.347 491 HA ASP 509 HA ASP 509 -4.523 -2.983 4.517 492 HB2 ASP 509 2HB ASP 509 -4.466 0.022 4.244 493 HB3 ASP 509 1HB ASP 509 -3.992 -1.066 2.937 494 H ARG 510 H ARG 510 -2.622 -3.479 3.548 495 HA ARG 510 HA ARG 510 -0.373 -3.013 5.355 496 HB2 ARG 510 2HB ARG 510 -0.853 -5.312 4.944 497 HB3 ARG 510 1HB ARG 510 -0.816 -5.137 3.214 498 HG2 ARG 510 2HG ARG 510 1.640 -4.620 3.405 499 HG3 ARG 510 1HG ARG 510 1.517 -4.933 5.135 500 HD2 ARG 510 2HD ARG 510 0.758 -7.226 4.664 501 HD3 ARG 510 1HD ARG 510 0.881 -6.907 2.939 502 HE ARG 510 HE ARG 510 3.376 -6.392 4.129 503 HH11 ARG 510 1HH1 ARG 510 1.284 -9.126 3.351 504 HH12 ARG 510 2HH1 ARG 510 2.524 -10.267 3.238 505 HH21 ARG 510 1HH2 ARG 510 5.115 -7.939 3.987 506 HH22 ARG 510 2HH2 ARG 510 4.797 -9.575 3.614 507 H LEU 511 H LEU 511 1.230 -1.759 4.877 508 HA LEU 511 HA LEU 511 1.199 -0.288 2.401 509 HB2 LEU 511 2HB LEU 511 1.820 0.638 4.785 510 HB3 LEU 511 1HB LEU 511 3.312 -0.224 4.554 511 HG LEU 511 HG LEU 511 3.823 1.177 2.545 512 HD11 LEU 511 1HD1 LEU 511 2.520 3.184 2.184 513 HD12 LEU 511 2HD1 LEU 511 1.322 2.609 3.329 514 HD13 LEU 511 3HD1 LEU 511 1.611 1.716 1.834 515 HD21 LEU 511 3HD2 LEU 511 4.683 1.773 4.768 516 HD22 LEU 511 1HD2 LEU 511 3.222 2.713 5.068 517 HD23 LEU 511 2HD2 LEU 511 4.333 3.197 3.787 518 H ILE 512 H ILE 512 2.309 -0.927 0.580 519 HA ILE 512 HA ILE 512 4.159 -3.191 0.870 520 HB ILE 512 HB ILE 512 2.635 -2.244 -1.566 521 HG12 ILE 512 2HG1 ILE 512 1.142 -3.220 0.087 522 HG13 ILE 512 1HG1 ILE 512 1.321 -4.301 -1.281 523 HG21 ILE 512 1HG2 ILE 512 4.355 -4.699 -1.210 524 HG22 ILE 512 2HG2 ILE 512 4.735 -3.299 -2.211 525 HG23 ILE 512 3HG2 ILE 512 3.368 -4.336 -2.625 526 HD11 ILE 512 3HD1 ILE 512 2.907 -5.655 -0.011 527 HD12 ILE 512 1HD1 ILE 512 1.351 -5.544 0.810 528 HD13 ILE 512 2HD1 ILE 512 2.718 -4.583 1.374 529 H GLU 513 H GLU 513 3.797 -0.290 -1.200 530 HA GLU 513 HA GLU 513 6.602 0.267 -0.958 531 HB2 GLU 513 2HB GLU 513 7.097 0.108 -3.337 532 HB3 GLU 513 1HB GLU 513 6.685 -1.463 -2.662 533 HG2 GLU 513 2HG GLU 513 4.494 -1.306 -3.558 534 HG3 GLU 513 1HG GLU 513 4.845 0.320 -4.159 535 H VAL 514 H VAL 514 7.192 2.068 -2.202 536 HA VAL 514 HA VAL 514 4.947 3.844 -2.797 537 HB VAL 514 HB VAL 514 5.756 4.624 -0.619 538 HG11 VAL 514 1HG1 VAL 514 8.040 5.519 -0.326 539 HG12 VAL 514 2HG1 VAL 514 8.445 4.936 -1.945 540 HG13 VAL 514 3HG1 VAL 514 8.044 3.787 -0.676 541 HG21 VAL 514 3HG2 VAL 514 6.239 6.968 -1.202 542 HG22 VAL 514 1HG2 VAL 514 4.967 6.264 -2.214 543 HG23 VAL 514 2HG2 VAL 514 6.574 6.482 -2.873 544 H ASN 515 H ASN 515 4.981 4.366 -4.798 545 HA ASN 515 HA ASN 515 5.651 5.309 -6.791 546 HB2 ASN 515 2HB ASN 515 6.734 6.849 -5.017 547 HB3 ASN 515 1HB ASN 515 8.230 6.018 -5.384 548 HD21 ASN 515 1HD2 ASN 515 7.552 8.762 -5.580 549 HD22 ASN 515 2HD2 ASN 515 7.761 9.243 -7.200 550 H GLY 516 H GLY 516 6.517 2.536 -5.813 551 HA2 GLY 516 2HA GLY 516 7.340 0.850 -7.288 552 HA3 GLY 516 1HA GLY 516 8.454 2.037 -7.953 553 H VAL 517 H VAL 517 8.830 2.775 -4.902 554 HA VAL 517 HA VAL 517 11.237 1.200 -4.617 555 HB VAL 517 HB VAL 517 10.000 3.272 -2.777 556 HG11 VAL 517 1HG1 VAL 517 12.800 2.170 -2.856 557 HG12 VAL 517 2HG1 VAL 517 11.590 1.853 -1.614 558 HG13 VAL 517 3HG1 VAL 517 12.244 3.480 -1.816 559 HG21 VAL 517 3HG2 VAL 517 10.488 4.240 -4.956 560 HG22 VAL 517 1HG2 VAL 517 12.135 3.613 -4.879 561 HG23 VAL 517 2HG2 VAL 517 11.610 4.851 -3.739 562 H ASP 518 H ASP 518 11.235 -0.729 -3.665 563 HA ASP 518 HA ASP 518 8.911 -1.692 -2.307 564 HB2 ASP 518 2HB ASP 518 10.344 -3.210 -3.648 565 HB3 ASP 518 1HB ASP 518 11.635 -2.987 -2.474 566 H LEU 519 H LEU 519 8.480 -1.771 -0.276 567 HA LEU 519 HA LEU 519 10.591 -1.456 1.662 568 HB2 LEU 519 2HB LEU 519 9.181 0.176 2.877 569 HB3 LEU 519 1HB LEU 519 9.820 0.768 1.360 570 HG LEU 519 HG LEU 519 7.527 -0.122 0.510 571 HD11 LEU 519 1HD1 LEU 519 6.797 0.635 3.303 572 HD12 LEU 519 2HD1 LEU 519 6.640 -0.956 2.522 573 HD13 LEU 519 3HD1 LEU 519 5.701 0.416 1.929 574 HD21 LEU 519 3HD2 LEU 519 7.919 2.561 1.777 575 HD22 LEU 519 1HD2 LEU 519 6.655 2.123 0.585 576 HD23 LEU 519 2HD2 LEU 519 8.352 2.033 0.144 577 H ALA 520 H ALA 520 8.602 -3.422 0.483 578 HA ALA 520 HA ALA 520 6.999 -4.188 2.757 579 HB1 ALA 520 1HB ALA 520 6.101 -4.490 0.497 580 HB2 ALA 520 2HB ALA 520 6.276 -6.046 1.316 581 HB3 ALA 520 3HB ALA 520 7.452 -5.553 0.098 582 H GLY 521 H GLY 521 9.987 -4.960 1.163 583 HA2 GLY 521 2HA GLY 521 10.508 -7.185 2.972 584 HA3 GLY 521 1HA GLY 521 11.521 -6.660 1.626 585 H LYS 522 H LYS 522 10.450 -4.086 3.443 586 HA LYS 522 HA LYS 522 13.082 -3.759 4.633 587 HB2 LYS 522 2HB LYS 522 10.814 -1.816 4.173 588 HB3 LYS 522 1HB LYS 522 12.230 -1.427 5.141 589 HG2 LYS 522 2HG LYS 522 12.305 -2.281 2.267 590 HG3 LYS 522 1HG LYS 522 12.344 -0.597 2.824 591 HD2 LYS 522 2HD LYS 522 14.367 -1.114 4.101 592 HD3 LYS 522 1HD LYS 522 14.317 -2.762 3.505 593 HE2 LYS 522 2HE LYS 522 14.563 -1.983 1.215 594 HE3 LYS 522 1HE LYS 522 14.565 -0.310 1.771 595 HZ1 LYS 522 3HZ LYS 522 16.801 -1.103 1.376 596 HZ2 LYS 522 1HZ LYS 522 16.574 -2.363 2.503 597 HZ3 LYS 522 2HZ LYS 522 16.571 -0.751 2.999 598 H SER 523 H SER 523 13.299 -3.002 6.786 599 HA SER 523 HA SER 523 11.710 -4.512 8.545 600 HB2 SER 523 2HB SER 523 14.101 -4.139 8.964 601 HB3 SER 523 1HB SER 523 13.823 -2.405 9.076 602 HG SER 523 HG SER 523 13.224 -4.448 10.857 603 H GLN 524 H GLN 524 10.375 -3.694 10.170 604 HA GLN 524 HA GLN 524 8.534 -1.736 9.567 605 HB2 GLN 524 2HB GLN 524 7.820 -1.910 11.905 606 HB3 GLN 524 1HB GLN 524 8.178 -3.497 11.246 607 HG2 GLN 524 2HG GLN 524 10.402 -3.394 12.367 608 HG3 GLN 524 1HG GLN 524 9.909 -1.876 13.108 609 HE21 GLN 524 1HE2 GLN 524 8.268 -1.915 14.693 610 HE22 GLN 524 2HE2 GLN 524 7.869 -3.385 15.508 611 H GLU 525 H GLU 525 11.566 -1.486 11.198 612 HA GLU 525 HA GLU 525 11.224 1.138 12.254 613 HB2 GLU 525 2HB GLU 525 12.801 -0.435 13.225 614 HB3 GLU 525 1HB GLU 525 13.687 -0.508 11.715 615 HG2 GLU 525 2HG GLU 525 14.317 1.835 11.983 616 HG3 GLU 525 1HG GLU 525 13.430 1.889 13.508 617 H GLU 526 H GLU 526 12.722 -0.133 9.326 618 HA GLU 526 HA GLU 526 13.844 2.250 8.365 619 HB2 GLU 526 2HB GLU 526 12.717 -0.091 6.839 620 HB3 GLU 526 1HB GLU 526 13.704 1.172 6.124 621 HG2 GLU 526 2HG GLU 526 14.564 -0.722 8.288 622 HG3 GLU 526 1HG GLU 526 14.946 -0.859 6.570 623 H VAL 527 H VAL 527 10.719 0.763 7.837 624 HA VAL 527 HA VAL 527 9.874 2.873 6.144 625 HB VAL 527 HB VAL 527 7.654 1.692 6.093 626 HG11 VAL 527 1HG1 VAL 527 8.545 -0.209 4.836 627 HG12 VAL 527 2HG1 VAL 527 10.118 0.041 5.599 628 HG13 VAL 527 3HG1 VAL 527 9.472 1.263 4.498 629 HG21 VAL 527 3HG2 VAL 527 9.158 -0.267 7.802 630 HG22 VAL 527 1HG2 VAL 527 7.632 -0.575 6.977 631 HG23 VAL 527 2HG2 VAL 527 7.710 0.640 8.267 632 H VAL 528 H VAL 528 9.189 2.116 9.558 633 HA VAL 528 HA VAL 528 7.327 4.237 9.750 634 HB VAL 528 HB VAL 528 9.037 3.019 11.976 635 HG11 VAL 528 1HG1 VAL 528 8.303 5.289 12.587 636 HG12 VAL 528 2HG1 VAL 528 7.466 4.072 13.552 637 HG13 VAL 528 3HG1 VAL 528 6.638 4.853 12.205 638 HG21 VAL 528 3HG2 VAL 528 6.140 2.587 11.241 639 HG22 VAL 528 1HG2 VAL 528 6.968 1.866 12.621 640 HG23 VAL 528 2HG2 VAL 528 7.459 1.447 10.981 641 H SER 529 H SER 529 10.796 4.107 9.954 642 HA SER 529 HA SER 529 11.247 6.769 10.702 643 HB2 SER 529 2HB SER 529 13.019 5.067 10.705 644 HB3 SER 529 1HB SER 529 12.876 4.915 8.960 645 HG SER 529 HG SER 529 14.182 6.758 10.491 646 H LEU 530 H LEU 530 10.644 5.281 7.574 647 HA LEU 530 HA LEU 530 11.004 7.558 5.960 648 HB2 LEU 530 2HB LEU 530 9.295 5.164 5.738 649 HB3 LEU 530 1HB LEU 530 9.376 6.300 4.403 650 HG LEU 530 HG LEU 530 11.564 4.505 5.501 651 HD11 LEU 530 1HD1 LEU 530 10.235 4.605 2.802 652 HD12 LEU 530 2HD1 LEU 530 9.954 3.392 4.049 653 HD13 LEU 530 3HD1 LEU 530 11.531 3.512 3.278 654 HD21 LEU 530 3HD2 LEU 530 13.014 5.408 3.733 655 HD22 LEU 530 1HD2 LEU 530 12.565 6.643 4.904 656 HD23 LEU 530 2HD2 LEU 530 11.771 6.596 3.328 657 H LEU 531 H LEU 531 8.070 6.201 7.423 658 HA LEU 531 HA LEU 531 6.537 8.379 6.529 659 HB2 LEU 531 2HB LEU 531 5.796 6.108 8.360 660 HB3 LEU 531 1HB LEU 531 4.720 7.489 8.148 661 HG LEU 531 HG LEU 531 4.919 7.022 5.682 662 HD11 LEU 531 1HD1 LEU 531 5.352 4.754 4.960 663 HD12 LEU 531 2HD1 LEU 531 6.019 4.407 6.557 664 HD13 LEU 531 3HD1 LEU 531 6.766 5.630 5.533 665 HD21 LEU 531 3HD2 LEU 531 3.155 5.292 5.731 666 HD22 LEU 531 1HD2 LEU 531 2.873 6.637 6.833 667 HD23 LEU 531 2HD2 LEU 531 3.454 5.095 7.457 668 H ARG 532 H ARG 532 8.288 7.952 9.455 669 HA ARG 532 HA ARG 532 7.058 10.152 10.778 670 HB2 ARG 532 2HB ARG 532 8.342 8.466 12.030 671 HB3 ARG 532 1HB ARG 532 9.807 8.934 11.183 672 HG2 ARG 532 2HG ARG 532 9.792 9.878 13.415 673 HG3 ARG 532 1HG ARG 532 9.674 11.164 12.213 674 HD2 ARG 532 2HD ARG 532 7.210 11.199 12.572 675 HD3 ARG 532 1HD ARG 532 7.421 9.993 13.840 676 HE ARG 532 HE ARG 532 9.101 12.109 14.414 677 HH11 ARG 532 1HH1 ARG 532 5.632 11.432 14.327 678 HH12 ARG 532 2HH1 ARG 532 5.208 12.743 15.344 679 HH21 ARG 532 1HH2 ARG 532 8.510 13.874 15.844 680 HH22 ARG 532 2HH2 ARG 532 6.857 14.139 16.216 681 H SER 533 H SER 533 9.956 9.785 8.777 682 HA SER 533 HA SER 533 10.776 12.497 8.903 683 HB2 SER 533 2HB SER 533 12.279 10.596 8.358 684 HB3 SER 533 1HB SER 533 11.402 10.367 6.853 685 HG SER 533 HG SER 533 13.451 11.652 6.964 686 H THR 534 H THR 534 8.596 10.680 6.912 687 HA THR 534 HA THR 534 7.107 11.091 5.408 688 HB THR 534 HB THR 534 6.106 13.366 5.056 689 HG1 THR 534 1HG THR 534 8.359 14.153 6.400 690 HG21 THR 534 3HG2 THR 534 5.233 11.932 6.801 691 HG22 THR 534 1HG2 THR 534 5.174 13.615 7.321 692 HG23 THR 534 2HG2 THR 534 6.431 12.543 7.937 693 H LYS 535 H LYS 535 6.635 12.653 3.348 694 HA LYS 535 HA LYS 535 9.140 12.955 1.912 695 HB2 LYS 535 2HB LYS 535 8.255 10.653 1.544 696 HB3 LYS 535 1HB LYS 535 6.741 11.337 0.985 697 HG2 LYS 535 2HG LYS 535 7.807 12.270 -0.939 698 HG3 LYS 535 1HG LYS 535 9.393 11.812 -0.326 699 HD2 LYS 535 2HD LYS 535 7.200 9.871 -1.076 700 HD3 LYS 535 1HD LYS 535 8.579 10.287 -2.093 701 HE2 LYS 535 2HE LYS 535 8.687 8.920 0.613 702 HE3 LYS 535 1HE LYS 535 8.975 8.179 -0.949 703 HZ1 LYS 535 3HZ LYS 535 10.660 10.300 0.291 704 HZ2 LYS 535 1HZ LYS 535 10.919 9.641 -1.232 705 HZ3 LYS 535 2HZ LYS 535 11.065 8.698 0.151 706 H MET 536 H MET 536 9.002 14.771 0.539 707 HA MET 536 HA MET 536 6.432 16.203 0.794 708 HB2 MET 536 2HB MET 536 7.656 18.266 1.155 709 HB3 MET 536 1HB MET 536 7.852 17.100 2.464 710 HG2 MET 536 2HG MET 536 10.059 16.517 1.532 711 HG3 MET 536 1HG MET 536 9.832 17.743 0.283 712 HE1 MET 536 3HE MET 536 8.373 20.067 1.986 713 HE2 MET 536 1HE MET 536 9.650 20.352 0.799 714 HE3 MET 536 2HE MET 536 9.778 21.036 2.421 715 H GLU 537 H GLU 537 7.814 14.926 -1.717 716 HA GLU 537 HA GLU 537 8.324 17.129 -3.327 717 HB2 GLU 537 2HB GLU 537 7.172 14.495 -4.301 718 HB3 GLU 537 1HB GLU 537 7.886 15.717 -5.326 719 HG2 GLU 537 2HG GLU 537 9.522 14.083 -5.121 720 HG3 GLU 537 1HG GLU 537 10.027 15.333 -3.989 721 H GLY 538 H GLY 538 5.278 15.393 -2.910 722 HA2 GLY 538 2HA GLY 538 3.507 17.483 -2.842 723 HA3 GLY 538 1HA GLY 538 3.704 17.195 -4.557 724 H THR 539 H THR 539 3.658 14.819 -5.127 725 HA THR 539 HA THR 539 1.431 13.639 -3.701 726 HB THR 539 HB THR 539 1.499 12.110 -5.808 727 HG1 THR 539 1HG THR 539 2.389 14.432 -7.080 728 HG21 THR 539 3HG2 THR 539 -0.057 13.577 -6.985 729 HG22 THR 539 1HG2 THR 539 0.385 14.928 -5.921 730 HG23 THR 539 2HG2 THR 539 -0.399 13.478 -5.268 731 H VAL 540 H VAL 540 1.605 11.701 -2.854 732 HA VAL 540 HA VAL 540 4.131 10.267 -3.226 733 HB VAL 540 HB VAL 540 2.360 10.248 -0.750 734 HG11 VAL 540 1HG1 VAL 540 3.487 8.140 -1.210 735 HG12 VAL 540 2HG1 VAL 540 4.139 8.896 0.253 736 HG13 VAL 540 3HG1 VAL 540 5.036 8.976 -1.266 737 HG21 VAL 540 3HG2 VAL 540 4.216 11.395 0.378 738 HG22 VAL 540 1HG2 VAL 540 3.569 12.349 -0.961 739 HG23 VAL 540 2HG2 VAL 540 5.087 11.480 -1.157 740 H SER 541 H SER 541 3.818 8.387 -4.223 741 HA SER 541 HA SER 541 1.083 7.433 -4.439 742 HB2 SER 541 2HB SER 541 3.547 6.552 -5.962 743 HB3 SER 541 1HB SER 541 1.868 6.203 -6.369 744 HG SER 541 HG SER 541 2.949 8.803 -6.191 745 H LEU 542 H LEU 542 0.559 5.930 -2.921 746 HA LEU 542 HA LEU 542 2.669 4.107 -2.007 747 HB2 LEU 542 2HB LEU 542 0.002 4.733 -0.726 748 HB3 LEU 542 1HB LEU 542 1.091 3.496 -0.166 749 HG LEU 542 HG LEU 542 1.292 5.292 1.297 750 HD11 LEU 542 1HD1 LEU 542 3.601 5.993 1.136 751 HD12 LEU 542 2HD1 LEU 542 3.656 5.408 -0.527 752 HD13 LEU 542 3HD1 LEU 542 3.394 4.273 0.796 753 HD21 LEU 542 3HD2 LEU 542 0.272 7.027 0.008 754 HD22 LEU 542 1HD2 LEU 542 1.664 7.109 -1.074 755 HD23 LEU 542 2HD2 LEU 542 1.829 7.594 0.619 756 H LEU 543 H LEU 543 2.565 2.095 -2.492 757 HA LEU 543 HA LEU 543 0.105 1.066 -3.727 758 HB2 LEU 543 2HB LEU 543 2.449 0.648 -4.799 759 HB3 LEU 543 1HB LEU 543 2.733 -0.324 -3.403 760 HG LEU 543 HG LEU 543 0.870 -1.822 -3.934 761 HD11 LEU 543 1HD1 LEU 543 0.629 -0.230 -6.464 762 HD12 LEU 543 2HD1 LEU 543 -0.560 -0.355 -5.167 763 HD13 LEU 543 3HD1 LEU 543 -0.171 -1.769 -6.141 764 HD21 LEU 543 3HD2 LEU 543 1.892 -2.964 -5.852 765 HD22 LEU 543 1HD2 LEU 543 3.097 -2.441 -4.677 766 HD23 LEU 543 2HD2 LEU 543 2.870 -1.530 -6.168 767 H VAL 544 H VAL 544 -1.235 0.078 -2.344 768 HA VAL 544 HA VAL 544 0.001 -1.189 -0.013 769 HB VAL 544 HB VAL 544 -1.977 -0.828 1.296 770 HG11 VAL 544 1HG1 VAL 544 -1.098 1.755 0.049 771 HG12 VAL 544 2HG1 VAL 544 -0.371 0.913 1.427 772 HG13 VAL 544 3HG1 VAL 544 -1.995 1.581 1.563 773 HG21 VAL 544 3HG2 VAL 544 -3.641 -1.009 -0.380 774 HG22 VAL 544 1HG2 VAL 544 -3.168 0.534 -1.115 775 HG23 VAL 544 2HG2 VAL 544 -3.892 0.494 0.511 776 H PHE 545 H PHE 545 -1.199 -2.945 0.837 777 HA PHE 545 HA PHE 545 -2.484 -4.521 -1.286 778 HB2 PHE 545 2HB PHE 545 -0.335 -5.415 -0.358 779 HB3 PHE 545 1HB PHE 545 -1.070 -5.452 1.236 780 HD1 PHE 545 2HD PHE 545 -3.035 -7.005 1.596 781 HD2 PHE 545 1HD PHE 545 -0.614 -7.129 -1.875 782 HE1 PHE 545 2HE PHE 545 -3.871 -9.270 1.095 783 HE2 PHE 545 1HE PHE 545 -1.406 -9.321 -2.404 784 HZ PHE 545 HZ PHE 545 -3.064 -10.448 -0.910 785 H ARG 546 H ARG 546 -4.592 -4.588 -0.961 786 HA ARG 546 HA ARG 546 -5.598 -3.874 1.649 787 HB2 ARG 546 2HB ARG 546 -7.160 -4.608 -0.826 788 HB3 ARG 546 1HB ARG 546 -7.795 -3.854 0.627 789 HG2 ARG 546 2HG ARG 546 -5.903 -2.063 -0.076 790 HG3 ARG 546 1HG ARG 546 -6.384 -2.668 -1.661 791 HD2 ARG 546 2HD ARG 546 -7.788 -0.800 -1.114 792 HD3 ARG 546 1HD ARG 546 -8.768 -2.272 -0.989 793 HE ARG 546 HE ARG 546 -7.429 -1.460 1.422 794 HH11 ARG 546 1HH1 ARG 546 -10.489 -1.337 -0.326 795 HH12 ARG 546 2HH1 ARG 546 -11.372 -0.887 1.086 796 HH21 ARG 546 1HH2 ARG 546 -8.577 -0.825 3.205 797 HH22 ARG 546 2HH2 ARG 546 -10.287 -0.603 3.135 798 H GLN 547 H GLN 547 -6.243 -5.309 3.061 799 HA GLN 547 HA GLN 547 -6.553 -8.057 2.145 800 HB2 GLN 547 2HB GLN 547 -4.282 -7.773 2.969 801 HB3 GLN 547 1HB GLN 547 -4.881 -7.082 4.465 802 HG2 GLN 547 2HG GLN 547 -5.925 -9.247 4.995 803 HG3 GLN 547 1HG GLN 547 -5.230 -9.908 3.515 804 HE21 GLN 547 1HE2 GLN 547 -4.563 -8.694 6.680 805 HE22 GLN 547 2HE2 GLN 547 -2.953 -9.323 6.803 806 H GLU 548 H GLU 548 -8.116 -9.207 3.301 807 HA GLU 548 HA GLU 548 -9.789 -7.731 5.149 808 HB2 GLU 548 2HB GLU 548 -9.964 -10.497 3.983 809 HB3 GLU 548 1HB GLU 548 -11.083 -9.929 5.198 810 HG2 GLU 548 2HG GLU 548 -10.701 -8.818 2.427 811 HG3 GLU 548 1HG GLU 548 -12.026 -9.797 3.002 812 H GLU 549 H GLU 549 -10.587 -9.402 6.974 813 HA GLU 549 HA GLU 549 -8.312 -9.703 8.649 814 HB2 GLU 549 2HB GLU 549 -11.170 -10.594 9.027 815 HB3 GLU 549 1HB GLU 549 -9.937 -10.533 10.283 816 HG2 GLU 549 2HG GLU 549 -9.772 -8.129 10.034 817 HG3 GLU 549 1HG GLU 549 -10.958 -8.165 8.739 818 H ALA 550 H ALA 550 -7.121 -11.456 8.909 819 HA ALA 550 HA ALA 550 -7.721 -13.775 7.293 820 HB1 ALA 550 1HB ALA 550 -5.377 -13.215 9.117 821 HB2 ALA 550 2HB ALA 550 -5.413 -12.928 7.373 822 HB3 ALA 550 3HB ALA 550 -5.525 -14.573 8.000 823 H PHE 551 H PHE 551 -9.052 -15.200 8.091 824 HA PHE 551 HA PHE 551 -9.363 -15.330 10.956 825 HB2 PHE 551 2HB PHE 551 -10.961 -16.554 8.739 826 HB3 PHE 551 1HB PHE 551 -11.339 -16.752 10.454 827 HD1 PHE 551 2HD PHE 551 -11.750 -14.620 11.799 828 HD2 PHE 551 1HD PHE 551 -11.781 -14.750 7.559 829 HE1 PHE 551 2HE PHE 551 -13.011 -12.512 11.747 830 HE2 PHE 551 1HE PHE 551 -13.041 -12.642 7.496 831 HZ PHE 551 HZ PHE 551 -13.656 -11.524 9.592 832 H HIS 552 H HIS 552 -9.159 -17.083 12.163 833 HA HIS 552 HA HIS 552 -7.762 -19.387 11.020 834 HB2 HIS 552 2HB HIS 552 -7.057 -17.923 13.597 835 HB3 HIS 552 1HB HIS 552 -6.288 -19.381 12.991 836 HD1 HIS 552 1HD HIS 552 -6.308 -15.666 12.611 837 HD2 HIS 552 2HD HIS 552 -4.482 -18.959 10.843 838 HE1 HIS 552 1HE HIS 552 -4.468 -14.745 11.250 839 HE2 HIS 552 2HE HIS 552 -3.146 -16.782 10.665 840 HA PRO 553 HA PRO 553 -10.850 -21.467 13.511 841 HB2 PRO 553 2HB PRO 553 -8.916 -23.562 14.267 842 HB3 PRO 553 1HB PRO 553 -10.377 -23.693 13.293 843 HG2 PRO 553 2HG PRO 553 -7.936 -23.885 12.180 844 HG3 PRO 553 1HG PRO 553 -9.298 -23.139 11.331 845 HD2 PRO 553 2HD PRO 553 -7.020 -21.834 12.770 846 HD3 PRO 553 1HD PRO 553 -7.757 -21.413 11.206 847 H ARG 554 H ARG 554 -8.166 -20.122 14.777 848 HA ARG 554 HA ARG 554 -7.596 -19.188 16.721 849 HB2 ARG 554 2HB ARG 554 -10.083 -20.390 17.968 850 HB3 ARG 554 1HB ARG 554 -9.078 -19.135 18.670 851 HG2 ARG 554 2HG ARG 554 -10.847 -18.927 16.247 852 HG3 ARG 554 1HG ARG 554 -11.067 -18.122 17.798 853 HD2 ARG 554 2HD ARG 554 -8.874 -17.621 15.777 854 HD3 ARG 554 1HD ARG 554 -10.231 -16.563 16.140 855 HE ARG 554 HE ARG 554 -8.801 -17.004 18.492 856 HH11 ARG 554 1HH1 ARG 554 -8.396 -15.340 15.388 857 HH12 ARG 554 2HH1 ARG 554 -7.258 -14.215 16.002 858 HH21 ARG 554 1HH2 ARG 554 -7.251 -15.428 19.303 859 HH22 ARG 554 2HH2 ARG 554 -6.605 -14.280 18.223 860 H GLU 555 H GLU 555 -6.105 -19.717 18.070 861 HA GLU 555 HA GLU 555 -5.529 -22.551 18.253 862 HB2 GLU 555 2HB GLU 555 -3.268 -21.777 18.899 863 HB3 GLU 555 1HB GLU 555 -3.804 -21.173 17.337 864 HG2 GLU 555 2HG GLU 555 -4.424 -19.030 18.452 865 HG3 GLU 555 1HG GLU 555 -3.705 -19.652 19.934 866 H MET 556 H MET 556 -6.854 -20.157 20.146 867 HA MET 556 HA MET 556 -7.620 -20.059 22.256 868 HB2 MET 556 2HB MET 556 -8.075 -22.497 22.167 869 HB3 MET 556 1HB MET 556 -6.415 -22.823 22.628 870 HG2 MET 556 2HG MET 556 -6.822 -21.772 24.811 871 HG3 MET 556 1HG MET 556 -8.484 -21.451 24.327 872 HE1 MET 556 3HE MET 556 -8.894 -24.255 27.023 873 HE2 MET 556 1HE MET 556 -9.359 -22.626 26.528 874 HE3 MET 556 2HE MET 556 -7.697 -22.959 27.017 875 H ASN 557 H ASN 557 -6.922 -19.240 24.206 876 HA ASN 557 HA ASN 557 -4.387 -18.061 24.226 877 HB2 ASN 557 2HB ASN 557 -6.309 -17.097 25.409 878 HB3 ASN 557 1HB ASN 557 -6.346 -18.476 26.494 879 HD21 ASN 557 1HD2 ASN 557 -4.703 -15.532 25.658 880 HD22 ASN 557 2HD2 ASN 557 -3.762 -15.405 27.084 881 H ALA 558 H ALA 558 -2.476 -18.861 24.723 882 HA ALA 558 HA ALA 558 -2.264 -20.978 26.696 883 HB1 ALA 558 1HB ALA 558 -2.283 -22.098 24.508 884 HB2 ALA 558 2HB ALA 558 -0.705 -22.230 25.286 885 HB3 ALA 558 3HB ALA 558 -0.948 -21.074 23.979 Start of MODEL 10 1 H1 GLY 448 1HT GLY 448 -17.078 1.104 -22.276 2 H2 GLY 448 2HT GLY 448 -15.958 -0.149 -21.904 3 H3 GLY 448 3HT GLY 448 -15.543 1.456 -21.657 4 HA2 GLY 448 1HA GLY 448 -17.168 1.720 -19.956 5 HA3 GLY 448 2HA GLY 448 -17.690 0.059 -20.222 6 H SER 449 H SER 449 -16.688 1.143 -17.770 7 HA SER 449 HA SER 449 -14.026 0.122 -17.487 8 HB2 SER 449 2HB SER 449 -14.828 1.964 -16.035 9 HB3 SER 449 1HB SER 449 -16.064 0.902 -15.366 10 HG SER 449 HG SER 449 -13.291 0.919 -14.959 11 H VAL 450 H VAL 450 -13.787 -1.968 -17.772 12 HA VAL 450 HA VAL 450 -15.896 -3.790 -17.209 13 HB VAL 450 HB VAL 450 -14.349 -5.573 -17.935 14 HG11 VAL 450 1HG1 VAL 450 -14.094 -4.810 -20.266 15 HG12 VAL 450 2HG1 VAL 450 -14.431 -3.163 -19.742 16 HG13 VAL 450 3HG1 VAL 450 -15.672 -4.407 -19.598 17 HG21 VAL 450 3HG2 VAL 450 -12.121 -4.999 -18.813 18 HG22 VAL 450 1HG2 VAL 450 -12.238 -4.644 -17.089 19 HG23 VAL 450 2HG2 VAL 450 -12.339 -3.336 -18.268 20 H TYR 451 H TYR 451 -16.086 -5.255 -15.632 21 HA TYR 451 HA TYR 451 -14.662 -4.596 -13.226 22 HB2 TYR 451 2HB TYR 451 -16.881 -6.591 -13.717 23 HB3 TYR 451 1HB TYR 451 -16.182 -6.234 -12.144 24 HD1 TYR 451 1HD TYR 451 -16.618 -4.095 -11.053 25 HD2 TYR 451 2HD TYR 451 -18.415 -5.061 -14.782 26 HE1 TYR 451 1HE TYR 451 -18.242 -2.275 -10.738 27 HE2 TYR 451 2HE TYR 451 -20.039 -3.238 -14.474 28 HH TYR 451 HH TYR 451 -19.651 -0.859 -12.099 29 H ASN 452 H ASN 452 -12.635 -5.251 -13.798 30 HA ASN 452 HA ASN 452 -12.259 -8.151 -13.680 31 HB2 ASN 452 2HB ASN 452 -11.828 -7.453 -15.978 32 HB3 ASN 452 1HB ASN 452 -10.727 -6.201 -15.418 33 HD21 ASN 452 1HD2 ASN 452 -11.152 -9.609 -15.954 34 HD22 ASN 452 2HD2 ASN 452 -9.492 -10.037 -15.752 35 H THR 453 H THR 453 -11.182 -8.692 -11.958 36 HA THR 453 HA THR 453 -8.861 -7.240 -11.205 37 HB THR 453 HB THR 453 -10.644 -6.051 -9.925 38 HG1 THR 453 1HG THR 453 -8.739 -6.105 -8.876 39 HG21 THR 453 3HG2 THR 453 -11.873 -7.229 -8.130 40 HG22 THR 453 1HG2 THR 453 -11.176 -8.756 -8.669 41 HG23 THR 453 2HG2 THR 453 -12.283 -7.875 -9.720 42 H LYS 454 H LYS 454 -7.513 -8.551 -9.931 43 HA LYS 454 HA LYS 454 -8.018 -11.377 -10.273 44 HB2 LYS 454 2HB LYS 454 -5.825 -10.305 -10.809 45 HB3 LYS 454 1HB LYS 454 -5.651 -9.893 -9.125 46 HG2 LYS 454 2HG LYS 454 -5.500 -12.208 -8.500 47 HG3 LYS 454 1HG LYS 454 -5.823 -12.716 -10.155 48 HD2 LYS 454 2HD LYS 454 -3.448 -11.007 -9.389 49 HD3 LYS 454 1HD LYS 454 -3.385 -12.761 -9.407 50 HE2 LYS 454 2HE LYS 454 -2.440 -11.799 -11.465 51 HE3 LYS 454 1HE LYS 454 -3.862 -12.768 -11.819 52 HZ1 LYS 454 3HZ LYS 454 -3.727 -10.656 -13.079 53 HZ2 LYS 454 1HZ LYS 454 -3.886 -9.764 -11.679 54 HZ3 LYS 454 2HZ LYS 454 -5.116 -10.801 -12.192 55 H LYS 455 H LYS 455 -8.990 -12.498 -8.688 56 HA LYS 455 HA LYS 455 -9.460 -11.070 -6.256 57 HB2 LYS 455 2HB LYS 455 -11.326 -12.215 -7.462 58 HB3 LYS 455 1HB LYS 455 -10.612 -13.756 -7.016 59 HG2 LYS 455 2HG LYS 455 -12.466 -13.154 -5.536 60 HG3 LYS 455 1HG LYS 455 -10.937 -13.244 -4.659 61 HD2 LYS 455 2HD LYS 455 -10.717 -10.838 -4.670 62 HD3 LYS 455 1HD LYS 455 -12.135 -10.673 -5.704 63 HE2 LYS 455 2HE LYS 455 -12.127 -11.794 -2.901 64 HE3 LYS 455 1HE LYS 455 -12.580 -10.147 -3.332 65 HZ1 LYS 455 3HZ LYS 455 -13.974 -12.605 -4.275 66 HZ2 LYS 455 1HZ LYS 455 -14.380 -11.015 -4.662 67 HZ3 LYS 455 2HZ LYS 455 -14.508 -11.544 -3.084 68 H VAL 456 H VAL 456 -7.502 -11.070 -5.481 69 HA VAL 456 HA VAL 456 -6.758 -13.251 -3.693 70 HB VAL 456 HB VAL 456 -4.755 -11.671 -5.425 71 HG11 VAL 456 1HG1 VAL 456 -3.051 -13.255 -4.633 72 HG12 VAL 456 2HG1 VAL 456 -4.253 -14.011 -3.592 73 HG13 VAL 456 3HG1 VAL 456 -3.765 -12.334 -3.318 74 HG21 VAL 456 3HG2 VAL 456 -5.964 -13.286 -6.841 75 HG22 VAL 456 1HG2 VAL 456 -5.475 -14.573 -5.744 76 HG23 VAL 456 2HG2 VAL 456 -4.251 -13.711 -6.667 77 H GLY 457 H GLY 457 -5.004 -11.909 -2.129 78 HA2 GLY 457 2HA GLY 457 -6.177 -9.527 -1.220 79 HA3 GLY 457 1HA GLY 457 -4.499 -10.004 -0.929 80 H LYS 458 H LYS 458 -6.450 -7.817 -2.495 81 HA LYS 458 HA LYS 458 -4.616 -7.564 -4.682 82 HB2 LYS 458 2HB LYS 458 -6.235 -6.045 -5.748 83 HB3 LYS 458 1HB LYS 458 -6.882 -7.631 -5.401 84 HG2 LYS 458 2HG LYS 458 -8.018 -6.627 -3.399 85 HG3 LYS 458 1HG LYS 458 -7.475 -5.042 -3.971 86 HD2 LYS 458 2HD LYS 458 -8.605 -5.497 -6.149 87 HD3 LYS 458 1HD LYS 458 -9.210 -7.000 -5.476 88 HE2 LYS 458 2HE LYS 458 -10.949 -5.319 -5.384 89 HE3 LYS 458 1HE LYS 458 -10.426 -5.714 -3.753 90 HZ1 LYS 458 3HZ LYS 458 -9.527 -3.331 -5.293 91 HZ2 LYS 458 1HZ LYS 458 -9.148 -3.707 -3.675 92 HZ3 LYS 458 2HZ LYS 458 -10.724 -3.335 -4.121 93 H ARG 459 H ARG 459 -3.603 -5.842 -5.314 94 HA ARG 459 HA ARG 459 -2.874 -4.056 -3.128 95 HB2 ARG 459 2HB ARG 459 -1.327 -5.179 -5.444 96 HB3 ARG 459 1HB ARG 459 -0.752 -3.854 -4.436 97 HG2 ARG 459 2HG ARG 459 -0.598 -5.213 -2.523 98 HG3 ARG 459 1HG ARG 459 -1.591 -6.470 -3.234 99 HD2 ARG 459 2HD ARG 459 1.127 -5.687 -4.266 100 HD3 ARG 459 1HD ARG 459 0.849 -7.007 -3.127 101 HE ARG 459 HE ARG 459 -0.757 -7.152 -5.496 102 HH11 ARG 459 1HH1 ARG 459 2.438 -7.977 -4.241 103 HH12 ARG 459 2HH1 ARG 459 2.608 -9.359 -5.230 104 HH21 ARG 459 1HH2 ARG 459 -0.523 -9.020 -6.812 105 HH22 ARG 459 2HH2 ARG 459 0.875 -9.989 -6.706 106 H LEU 460 H LEU 460 -3.001 -1.959 -3.381 107 HA LEU 460 HA LEU 460 -3.823 -0.907 -6.007 108 HB2 LEU 460 2HB LEU 460 -4.869 -0.028 -3.299 109 HB3 LEU 460 1HB LEU 460 -5.242 0.744 -4.816 110 HG LEU 460 HG LEU 460 -6.414 -1.397 -5.506 111 HD11 LEU 460 1HD1 LEU 460 -6.102 -2.091 -2.596 112 HD12 LEU 460 2HD1 LEU 460 -5.396 -2.957 -3.961 113 HD13 LEU 460 3HD1 LEU 460 -7.146 -2.921 -3.753 114 HD21 LEU 460 3HD2 LEU 460 -7.431 0.116 -3.113 115 HD22 LEU 460 1HD2 LEU 460 -8.400 -0.953 -4.132 116 HD23 LEU 460 2HD2 LEU 460 -7.682 0.492 -4.824 117 H ASN 461 H ASN 461 -3.157 1.227 -6.431 118 HA ASN 461 HA ASN 461 -0.937 2.145 -4.738 119 HB2 ASN 461 2HB ASN 461 -0.276 1.646 -7.069 120 HB3 ASN 461 1HB ASN 461 -1.508 2.761 -7.654 121 HD21 ASN 461 1HD2 ASN 461 1.587 2.462 -6.119 122 HD22 ASN 461 2HD2 ASN 461 2.091 4.079 -6.267 123 H ILE 462 H ILE 462 -1.134 4.026 -3.710 124 HA ILE 462 HA ILE 462 -3.395 5.767 -4.422 125 HB ILE 462 HB ILE 462 -2.505 5.021 -1.608 126 HG12 ILE 462 2HG1 ILE 462 -4.954 4.169 -3.155 127 HG13 ILE 462 1HG1 ILE 462 -3.580 3.141 -2.796 128 HG21 ILE 462 1HG2 ILE 462 -3.457 7.278 -1.790 129 HG22 ILE 462 2HG2 ILE 462 -4.547 6.208 -0.906 130 HG23 ILE 462 3HG2 ILE 462 -4.885 6.613 -2.585 131 HD11 ILE 462 3HD1 ILE 462 -5.474 4.344 -0.796 132 HD12 ILE 462 1HD1 ILE 462 -4.077 3.332 -0.410 133 HD13 ILE 462 2HD1 ILE 462 -5.431 2.661 -1.318 134 H GLN 463 H GLN 463 -2.873 7.916 -4.409 135 HA GLN 463 HA GLN 463 -0.120 8.623 -3.659 136 HB2 GLN 463 2HB GLN 463 -2.028 9.859 -5.636 137 HB3 GLN 463 1HB GLN 463 -0.490 10.576 -5.186 138 HG2 GLN 463 2HG GLN 463 0.704 8.795 -6.074 139 HG3 GLN 463 1HG GLN 463 -0.756 7.824 -6.349 140 HE21 GLN 463 1HE2 GLN 463 1.287 10.376 -7.473 141 HE22 GLN 463 2HE2 GLN 463 0.501 10.593 -8.998 142 H LEU 464 H LEU 464 0.135 9.953 -2.009 143 HA LEU 464 HA LEU 464 -2.210 11.550 -1.228 144 HB2 LEU 464 2HB LEU 464 -0.107 10.414 0.620 145 HB3 LEU 464 1HB LEU 464 -1.359 11.528 1.108 146 HG LEU 464 HG LEU 464 -2.011 9.404 1.863 147 HD11 LEU 464 1HD1 LEU 464 -3.835 10.660 0.997 148 HD12 LEU 464 2HD1 LEU 464 -4.093 8.938 0.698 149 HD13 LEU 464 3HD1 LEU 464 -3.581 9.991 -0.614 150 HD21 LEU 464 3HD2 LEU 464 -0.540 8.052 0.479 151 HD22 LEU 464 1HD2 LEU 464 -1.576 8.318 -0.917 152 HD23 LEU 464 2HD2 LEU 464 -2.184 7.401 0.468 153 H LYS 465 H LYS 465 -1.998 13.606 -0.964 154 HA LYS 465 HA LYS 465 0.631 14.891 -1.338 155 HB2 LYS 465 2HB LYS 465 -0.668 16.821 -2.088 156 HB3 LYS 465 1HB LYS 465 -1.061 15.416 -3.068 157 HG2 LYS 465 2HG LYS 465 -3.079 15.072 -1.778 158 HG3 LYS 465 1HG LYS 465 -2.659 16.443 -0.767 159 HD2 LYS 465 2HD LYS 465 -4.353 17.076 -2.446 160 HD3 LYS 465 1HD LYS 465 -2.843 17.954 -2.685 161 HE2 LYS 465 2HE LYS 465 -2.230 16.436 -4.484 162 HE3 LYS 465 1HE LYS 465 -3.696 15.492 -4.214 163 HZ1 LYS 465 3HZ LYS 465 -3.640 18.345 -5.027 164 HZ2 LYS 465 1HZ LYS 465 -5.017 17.355 -4.912 165 HZ3 LYS 465 2HZ LYS 465 -3.842 17.046 -6.070 166 H LYS 466 H LYS 466 1.246 16.346 0.044 167 HA LYS 466 HA LYS 466 0.158 15.999 2.662 168 HB2 LYS 466 2HB LYS 466 2.582 17.349 1.640 169 HB3 LYS 466 1HB LYS 466 1.937 17.896 3.174 170 HG2 LYS 466 2HG LYS 466 3.719 16.155 3.338 171 HG3 LYS 466 1HG LYS 466 2.214 15.744 4.152 172 HD2 LYS 466 2HD LYS 466 3.098 13.820 2.969 173 HD3 LYS 466 1HD LYS 466 1.591 14.347 2.231 174 HE2 LYS 466 2HE LYS 466 2.854 15.499 0.501 175 HE3 LYS 466 1HE LYS 466 4.352 14.944 1.280 176 HZ1 LYS 466 3HZ LYS 466 3.746 12.703 0.817 177 HZ2 LYS 466 1HZ LYS 466 3.739 13.644 -0.593 178 HZ3 LYS 466 2HZ LYS 466 2.276 13.188 0.088 179 H GLY 467 H GLY 467 -1.299 16.968 3.592 180 HA2 GLY 467 2HA GLY 467 -2.043 19.662 2.688 181 HA3 GLY 467 1HA GLY 467 -3.172 18.493 3.368 182 H THR 468 H THR 468 -3.859 19.618 5.134 183 HA THR 468 HA THR 468 -2.244 21.235 6.759 184 HB THR 468 HB THR 468 -4.854 19.840 7.378 185 HG1 THR 468 1HG THR 468 -4.182 22.210 5.982 186 HG21 THR 468 3HG2 THR 468 -3.765 20.780 9.395 187 HG22 THR 468 1HG2 THR 468 -5.220 21.682 8.973 188 HG23 THR 468 2HG2 THR 468 -3.634 22.340 8.589 189 H GLU 469 H GLU 469 -3.247 17.847 7.028 190 HA GLU 469 HA GLU 469 -1.752 17.562 9.540 191 HB2 GLU 469 2HB GLU 469 -3.543 15.575 8.139 192 HB3 GLU 469 1HB GLU 469 -2.812 15.371 9.720 193 HG2 GLU 469 2HG GLU 469 -4.871 17.418 8.951 194 HG3 GLU 469 1HG GLU 469 -5.116 15.989 9.955 195 H GLY 470 H GLY 470 -0.806 17.675 6.594 196 HA2 GLY 470 2HA GLY 470 0.995 16.794 5.498 197 HA3 GLY 470 1HA GLY 470 1.263 15.718 6.874 198 H LEU 471 H LEU 471 0.712 13.669 6.687 199 HA LEU 471 HA LEU 471 -0.585 12.830 4.236 200 HB2 LEU 471 2HB LEU 471 0.748 11.269 6.431 201 HB3 LEU 471 1HB LEU 471 -0.038 10.511 5.067 202 HG LEU 471 HG LEU 471 2.325 12.383 4.890 203 HD11 LEU 471 1HD1 LEU 471 3.588 10.374 4.297 204 HD12 LEU 471 2HD1 LEU 471 2.157 9.386 4.582 205 HD13 LEU 471 3HD1 LEU 471 2.916 10.248 5.924 206 HD21 LEU 471 3HD2 LEU 471 2.426 11.752 2.561 207 HD22 LEU 471 1HD2 LEU 471 0.849 12.430 2.906 208 HD23 LEU 471 2HD2 LEU 471 1.025 10.685 2.734 209 H GLY 472 H GLY 472 -1.160 12.462 7.718 210 HA2 GLY 472 2HA GLY 472 -3.319 12.671 8.680 211 HA3 GLY 472 1HA GLY 472 -3.996 12.486 7.068 212 H PHE 473 H PHE 473 -1.629 10.189 7.928 213 HA PHE 473 HA PHE 473 -3.491 8.406 9.162 214 HB2 PHE 473 2HB PHE 473 -3.237 6.576 7.570 215 HB3 PHE 473 1HB PHE 473 -3.920 7.966 6.756 216 HD1 PHE 473 1HD PHE 473 -2.270 9.424 5.407 217 HD2 PHE 473 2HD PHE 473 -1.392 5.449 6.676 218 HE1 PHE 473 1HE PHE 473 -0.547 9.227 3.664 219 HE2 PHE 473 2HE PHE 473 0.350 5.300 4.922 220 HZ PHE 473 HZ PHE 473 0.724 7.197 3.442 221 H SER 474 H SER 474 -2.399 6.450 9.827 222 HA SER 474 HA SER 474 0.446 6.991 10.315 223 HB2 SER 474 2HB SER 474 -1.558 5.791 12.227 224 HB3 SER 474 1HB SER 474 0.143 6.119 12.563 225 HG SER 474 HG SER 474 -0.456 8.368 11.986 226 H ILE 475 H ILE 475 1.680 5.021 10.765 227 HA ILE 475 HA ILE 475 0.489 2.577 9.639 228 HB ILE 475 HB ILE 475 2.815 1.951 9.047 229 HG12 ILE 475 2HG1 ILE 475 3.397 4.848 9.549 230 HG13 ILE 475 1HG1 ILE 475 3.823 3.416 10.519 231 HG21 ILE 475 1HG2 ILE 475 1.336 2.617 7.326 232 HG22 ILE 475 2HG2 ILE 475 2.945 3.196 6.983 233 HG23 ILE 475 3HG2 ILE 475 1.716 4.338 7.568 234 HD11 ILE 475 3HD1 ILE 475 5.691 4.333 9.059 235 HD12 ILE 475 1HD1 ILE 475 4.751 3.875 7.658 236 HD13 ILE 475 2HD1 ILE 475 5.330 2.632 8.757 237 H THR 476 H THR 476 0.808 0.798 10.820 238 HA THR 476 HA THR 476 2.475 0.875 13.228 239 HB THR 476 HB THR 476 0.066 1.072 13.931 240 HG1 THR 476 1HG THR 476 1.276 0.007 15.416 241 HG21 THR 476 3HG2 THR 476 -0.966 -0.105 12.025 242 HG22 THR 476 1HG2 THR 476 -1.476 -0.810 13.561 243 HG23 THR 476 2HG2 THR 476 -0.255 -1.618 12.578 244 H SER 477 H SER 477 3.130 -1.385 13.876 245 HA SER 477 HA SER 477 3.057 -3.113 11.536 246 HB2 SER 477 2HB SER 477 5.337 -3.842 12.106 247 HB3 SER 477 1HB SER 477 5.285 -2.118 11.796 248 HG SER 477 HG SER 477 6.026 -1.811 13.732 249 H ARG 478 H ARG 478 3.021 -5.388 12.098 250 HA ARG 478 HA ARG 478 2.290 -5.871 14.905 251 HB2 ARG 478 2HB ARG 478 1.698 -7.582 12.473 252 HB3 ARG 478 1HB ARG 478 1.319 -8.031 14.123 253 HG2 ARG 478 2HG ARG 478 -0.186 -6.047 14.239 254 HG3 ARG 478 1HG ARG 478 0.120 -5.783 12.518 255 HD2 ARG 478 2HD ARG 478 -1.051 -8.295 13.731 256 HD3 ARG 478 1HD ARG 478 -1.972 -7.043 12.902 257 HE ARG 478 HE ARG 478 -0.310 -7.704 10.987 258 HH11 ARG 478 1HH1 ARG 478 -2.017 -9.913 13.192 259 HH12 ARG 478 2HH1 ARG 478 -2.091 -11.175 12.066 260 HH21 ARG 478 1HH2 ARG 478 -0.482 -9.436 9.435 261 HH22 ARG 478 2HH2 ARG 478 -1.192 -10.906 9.879 262 H ASP 479 H ASP 479 3.722 -6.907 16.116 263 HA ASP 479 HA ASP 479 6.015 -8.058 14.778 264 HB2 ASP 479 2HB ASP 479 6.316 -6.645 16.853 265 HB3 ASP 479 1HB ASP 479 5.473 -7.891 17.763 266 H VAL 480 H VAL 480 4.931 -9.690 13.778 267 HA VAL 480 HA VAL 480 4.380 -11.974 15.487 268 HB VAL 480 HB VAL 480 2.476 -12.639 13.874 269 HG11 VAL 480 1HG1 VAL 480 2.132 -10.148 15.552 270 HG12 VAL 480 2HG1 VAL 480 2.035 -11.809 16.138 271 HG13 VAL 480 3HG1 VAL 480 0.831 -11.197 15.004 272 HG21 VAL 480 3HG2 VAL 480 1.370 -10.794 12.672 273 HG22 VAL 480 1HG2 VAL 480 3.012 -11.049 12.071 274 HG23 VAL 480 2HG2 VAL 480 2.671 -9.705 13.156 275 H THR 481 H THR 481 6.238 -12.894 15.077 276 HA THR 481 HA THR 481 7.843 -14.077 14.060 277 HB THR 481 HB THR 481 5.890 -14.338 11.797 278 HG1 THR 481 1HG THR 481 6.469 -16.143 13.941 279 HG21 THR 481 3HG2 THR 481 8.171 -14.957 11.135 280 HG22 THR 481 1HG2 THR 481 7.169 -16.407 11.229 281 HG23 THR 481 2HG2 THR 481 8.306 -16.028 12.524 282 H ILE 482 H ILE 482 9.189 -12.457 13.932 283 HA ILE 482 HA ILE 482 9.261 -10.964 11.409 284 HB ILE 482 HB ILE 482 10.537 -10.147 14.035 285 HG12 ILE 482 2HG1 ILE 482 8.085 -10.011 14.189 286 HG13 ILE 482 1HG1 ILE 482 8.793 -8.405 14.167 287 HG21 ILE 482 1HG2 ILE 482 10.901 -7.972 12.927 288 HG22 ILE 482 2HG2 ILE 482 10.239 -8.639 11.434 289 HG23 ILE 482 3HG2 ILE 482 11.741 -9.284 12.099 290 HD11 ILE 482 3HD1 ILE 482 7.461 -9.806 11.856 291 HD12 ILE 482 1HD1 ILE 482 8.195 -8.202 11.804 292 HD13 ILE 482 2HD1 ILE 482 6.780 -8.493 12.815 293 H GLY 483 H GLY 483 10.396 -12.379 10.236 294 HA2 GLY 483 2HA GLY 483 13.023 -13.211 11.141 295 HA3 GLY 483 1HA GLY 483 12.252 -13.655 9.617 296 H GLY 484 H GLY 484 11.467 -10.946 9.081 297 HA2 GLY 484 2HA GLY 484 13.757 -9.265 8.938 298 HA3 GLY 484 1HA GLY 484 13.465 -10.079 7.401 299 H SER 485 H SER 485 10.635 -10.171 7.545 300 HA SER 485 HA SER 485 10.097 -7.439 6.798 301 HB2 SER 485 2HB SER 485 8.034 -8.395 5.828 302 HB3 SER 485 1HB SER 485 9.488 -9.247 5.297 303 HG SER 485 HG SER 485 8.101 -10.161 7.539 304 H ALA 486 H ALA 486 8.987 -6.070 8.031 305 HA ALA 486 HA ALA 486 7.398 -7.193 10.210 306 HB1 ALA 486 1HB ALA 486 7.609 -4.992 11.305 307 HB2 ALA 486 2HB ALA 486 8.587 -4.420 9.957 308 HB3 ALA 486 3HB ALA 486 9.192 -5.707 11.001 309 HA PRO 487 HA PRO 487 4.247 -5.989 7.333 310 HB2 PRO 487 2HB PRO 487 2.128 -6.861 8.821 311 HB3 PRO 487 1HB PRO 487 3.115 -7.909 7.803 312 HG2 PRO 487 2HG PRO 487 3.231 -7.486 10.753 313 HG3 PRO 487 1HG PRO 487 3.421 -8.988 9.831 314 HD2 PRO 487 2HD PRO 487 5.505 -7.604 10.850 315 HD3 PRO 487 1HD PRO 487 5.636 -8.559 9.358 316 H ILE 488 H ILE 488 3.921 -3.906 7.175 317 HA ILE 488 HA ILE 488 2.962 -2.353 9.443 318 HB ILE 488 HB ILE 488 4.092 -1.457 6.737 319 HG12 ILE 488 2HG1 ILE 488 5.708 -2.083 8.630 320 HG13 ILE 488 1HG1 ILE 488 5.784 -0.471 7.911 321 HG21 ILE 488 1HG2 ILE 488 3.773 0.797 7.451 322 HG22 ILE 488 2HG2 ILE 488 2.787 0.143 8.791 323 HG23 ILE 488 3HG2 ILE 488 2.270 -0.087 7.128 324 HD11 ILE 488 3HD1 ILE 488 4.832 0.548 9.744 325 HD12 ILE 488 1HD1 ILE 488 6.070 -0.515 10.374 326 HD13 ILE 488 2HD1 ILE 488 4.349 -0.969 10.511 327 H TYR 489 H TYR 489 0.987 -1.735 9.586 328 HA TYR 489 HA TYR 489 -0.765 -1.802 7.228 329 HB2 TYR 489 2HB TYR 489 -1.548 -2.429 10.096 330 HB3 TYR 489 1HB TYR 489 -2.612 -2.424 8.699 331 HD1 TYR 489 2HD TYR 489 0.062 -4.196 10.425 332 HD2 TYR 489 1HD TYR 489 -2.613 -4.254 7.131 333 HE1 TYR 489 2HE TYR 489 0.592 -6.531 10.073 334 HE2 TYR 489 1HE TYR 489 -2.080 -6.626 6.733 335 HH TYR 489 HH TYR 489 -0.322 -8.254 7.260 336 H VAL 490 H VAL 490 -2.191 -0.099 7.142 337 HA VAL 490 HA VAL 490 -1.424 2.304 8.380 338 HB VAL 490 HB VAL 490 -4.093 1.595 7.131 339 HG11 VAL 490 1HG1 VAL 490 -2.842 4.281 7.709 340 HG12 VAL 490 2HG1 VAL 490 -4.249 3.593 8.512 341 HG13 VAL 490 3HG1 VAL 490 -4.336 4.022 6.804 342 HG21 VAL 490 3HG2 VAL 490 -2.233 1.262 5.591 343 HG22 VAL 490 1HG2 VAL 490 -1.667 2.906 5.908 344 HG23 VAL 490 2HG2 VAL 490 -3.231 2.639 5.129 345 H LYS 491 H LYS 491 -1.591 2.751 10.396 346 HA LYS 491 HA LYS 491 -3.084 1.171 12.251 347 HB2 LYS 491 2HB LYS 491 -0.915 2.223 12.776 348 HB3 LYS 491 1HB LYS 491 -1.675 3.790 12.679 349 HG2 LYS 491 2HG LYS 491 -3.106 3.297 14.583 350 HG3 LYS 491 1HG LYS 491 -2.448 1.667 14.681 351 HD2 LYS 491 2HD LYS 491 -1.440 3.109 16.370 352 HD3 LYS 491 1HD LYS 491 -0.222 2.614 15.199 353 HE2 LYS 491 2HE LYS 491 -0.479 4.788 14.065 354 HE3 LYS 491 1HE LYS 491 -1.660 5.270 15.287 355 HZ1 LYS 491 3HZ LYS 491 0.110 4.995 16.964 356 HZ2 LYS 491 1HZ LYS 491 0.548 6.143 15.806 357 HZ3 LYS 491 2HZ LYS 491 1.189 4.608 15.747 358 H ASN 492 H ASN 492 -3.657 4.278 10.716 359 HA ASN 492 HA ASN 492 -6.354 4.359 11.682 360 HB2 ASN 492 2HB ASN 492 -5.147 5.073 13.720 361 HB3 ASN 492 1HB ASN 492 -4.385 6.365 12.807 362 HD21 ASN 492 1HD2 ASN 492 -5.235 7.990 14.078 363 HD22 ASN 492 2HD2 ASN 492 -6.910 8.393 14.071 364 H ILE 493 H ILE 493 -7.549 5.766 10.496 365 HA ILE 493 HA ILE 493 -6.189 7.555 8.600 366 HB ILE 493 HB ILE 493 -9.039 6.462 8.576 367 HG12 ILE 493 2HG1 ILE 493 -7.423 4.723 8.005 368 HG13 ILE 493 1HG1 ILE 493 -8.401 5.198 6.616 369 HG21 ILE 493 1HG2 ILE 493 -7.635 8.188 6.531 370 HG22 ILE 493 2HG2 ILE 493 -9.034 8.665 7.505 371 HG23 ILE 493 3HG2 ILE 493 -9.183 7.412 6.287 372 HD11 ILE 493 3HD1 ILE 493 -6.085 4.847 5.978 373 HD12 ILE 493 1HD1 ILE 493 -5.561 6.057 7.153 374 HD13 ILE 493 2HD1 ILE 493 -6.544 6.537 5.768 375 H LEU 494 H LEU 494 -6.107 9.529 9.515 376 HA LEU 494 HA LEU 494 -7.770 10.206 11.705 377 HB2 LEU 494 2HB LEU 494 -5.828 11.859 10.086 378 HB3 LEU 494 1HB LEU 494 -6.729 12.523 11.425 379 HG LEU 494 HG LEU 494 -5.575 10.895 12.936 380 HD11 LEU 494 1HD1 LEU 494 -3.923 10.265 10.507 381 HD12 LEU 494 2HD1 LEU 494 -4.986 9.158 11.372 382 HD13 LEU 494 3HD1 LEU 494 -3.533 9.785 12.158 383 HD21 LEU 494 3HD2 LEU 494 -4.780 13.168 12.739 384 HD22 LEU 494 1HD2 LEU 494 -3.787 12.728 11.351 385 HD23 LEU 494 2HD2 LEU 494 -3.422 12.060 12.943 386 HA PRO 495 HA PRO 495 -11.359 11.906 9.748 387 HB2 PRO 495 2HB PRO 495 -11.912 13.989 11.461 388 HB3 PRO 495 1HB PRO 495 -12.299 12.302 11.810 389 HG2 PRO 495 2HG PRO 495 -9.963 13.939 12.723 390 HG3 PRO 495 1HG PRO 495 -10.951 12.792 13.643 391 HD2 PRO 495 2HD PRO 495 -8.535 12.118 12.720 392 HD3 PRO 495 1HD PRO 495 -9.869 10.948 12.747 393 H ARG 496 H ARG 496 -8.511 13.549 10.029 394 HA ARG 496 HA ARG 496 -9.185 15.439 7.973 395 HB2 ARG 496 2HB ARG 496 -7.781 17.143 9.311 396 HB3 ARG 496 1HB ARG 496 -9.447 16.877 9.810 397 HG2 ARG 496 2HG ARG 496 -8.623 15.307 11.537 398 HG3 ARG 496 1HG ARG 496 -6.975 15.725 11.080 399 HD2 ARG 496 2HD ARG 496 -9.005 17.748 11.893 400 HD3 ARG 496 1HD ARG 496 -7.963 16.945 13.079 401 HE ARG 496 HE ARG 496 -6.425 18.058 11.021 402 HH11 ARG 496 1HH1 ARG 496 -8.456 19.161 13.702 403 HH12 ARG 496 2HH1 ARG 496 -7.481 20.506 14.061 404 HH21 ARG 496 1HH2 ARG 496 -5.090 19.854 11.534 405 HH22 ARG 496 2HH2 ARG 496 -5.518 20.932 12.798 406 H GLY 497 H GLY 497 -7.483 15.819 6.649 407 HA2 GLY 497 2HA GLY 497 -4.934 15.595 6.529 408 HA3 GLY 497 1HA GLY 497 -5.273 13.933 7.023 409 H ALA 498 H ALA 498 -3.974 13.781 4.863 410 HA ALA 498 HA ALA 498 -5.469 14.339 2.472 411 HB1 ALA 498 1HB ALA 498 -2.865 12.859 2.833 412 HB2 ALA 498 2HB ALA 498 -3.037 14.586 2.535 413 HB3 ALA 498 3HB ALA 498 -3.545 13.424 1.312 414 H ALA 499 H ALA 499 -4.466 11.468 4.242 415 HA ALA 499 HA ALA 499 -5.256 9.536 2.400 416 HB1 ALA 499 1HB ALA 499 -3.870 9.007 4.305 417 HB2 ALA 499 2HB ALA 499 -5.289 7.964 4.275 418 HB3 ALA 499 3HB ALA 499 -5.216 9.316 5.399 419 H ILE 500 H ILE 500 -7.183 11.166 4.853 420 HA ILE 500 HA ILE 500 -9.387 9.440 4.348 421 HB ILE 500 HB ILE 500 -9.048 10.563 6.585 422 HG12 ILE 500 2HG1 ILE 500 -11.692 10.956 5.173 423 HG13 ILE 500 1HG1 ILE 500 -11.140 9.522 5.982 424 HG21 ILE 500 1HG2 ILE 500 -8.426 12.793 5.808 425 HG22 ILE 500 2HG2 ILE 500 -9.828 12.875 6.877 426 HG23 ILE 500 3HG2 ILE 500 -10.036 13.017 5.131 427 HD11 ILE 500 3HD1 ILE 500 -11.682 12.134 7.365 428 HD12 ILE 500 1HD1 ILE 500 -11.186 10.620 8.118 429 HD13 ILE 500 2HD1 ILE 500 -12.763 10.739 7.334 430 H GLN 501 H GLN 501 -8.304 12.518 3.109 431 HA GLN 501 HA GLN 501 -10.720 13.192 1.773 432 HB2 GLN 501 2HB GLN 501 -7.873 14.070 1.249 433 HB3 GLN 501 1HB GLN 501 -9.267 14.698 0.387 434 HG2 GLN 501 2HG GLN 501 -8.799 14.925 3.356 435 HG3 GLN 501 1HG GLN 501 -8.521 16.202 2.175 436 HE21 GLN 501 1HE2 GLN 501 -10.901 14.370 3.907 437 HE22 GLN 501 2HE2 GLN 501 -12.256 15.346 3.501 438 H ASP 502 H ASP 502 -7.928 11.267 0.940 439 HA ASP 502 HA ASP 502 -8.623 10.822 -1.776 440 HB2 ASP 502 2HB ASP 502 -6.366 10.291 -0.945 441 HB3 ASP 502 1HB ASP 502 -7.037 9.055 0.115 442 H GLY 503 H GLY 503 -9.189 8.962 1.173 443 HA2 GLY 503 2HA GLY 503 -11.236 8.004 1.771 444 HA3 GLY 503 1HA GLY 503 -11.783 8.200 0.119 445 H ARG 504 H ARG 504 -9.220 6.827 -0.816 446 HA ARG 504 HA ARG 504 -10.423 4.219 -0.873 447 HB2 ARG 504 2HB ARG 504 -9.345 5.255 -2.830 448 HB3 ARG 504 1HB ARG 504 -7.803 5.199 -1.997 449 HG2 ARG 504 2HG ARG 504 -7.979 2.732 -1.975 450 HG3 ARG 504 1HG ARG 504 -9.461 2.870 -2.926 451 HD2 ARG 504 2HD ARG 504 -6.732 3.862 -3.726 452 HD3 ARG 504 1HD ARG 504 -7.549 2.451 -4.383 453 HE ARG 504 HE ARG 504 -9.293 4.398 -4.891 454 HH11 ARG 504 1HH1 ARG 504 -5.789 4.217 -5.450 455 HH12 ARG 504 2HH1 ARG 504 -5.821 5.238 -6.802 456 HH21 ARG 504 1HH2 ARG 504 -9.310 5.777 -6.815 457 HH22 ARG 504 2HH2 ARG 504 -7.848 6.124 -7.606 458 H LEU 505 H LEU 505 -7.537 5.705 0.454 459 HA LEU 505 HA LEU 505 -6.412 3.323 1.537 460 HB2 LEU 505 2HB LEU 505 -5.083 5.337 1.008 461 HB3 LEU 505 1HB LEU 505 -5.931 6.220 2.249 462 HG LEU 505 HG LEU 505 -4.895 4.802 3.976 463 HD11 LEU 505 1HD1 LEU 505 -3.450 3.513 1.653 464 HD12 LEU 505 2HD1 LEU 505 -4.552 2.701 2.777 465 HD13 LEU 505 3HD1 LEU 505 -3.019 3.351 3.342 466 HD21 LEU 505 3HD2 LEU 505 -2.932 5.991 2.036 467 HD22 LEU 505 1HD2 LEU 505 -2.627 5.642 3.734 468 HD23 LEU 505 2HD2 LEU 505 -3.808 6.873 3.286 469 H LYS 506 H LYS 506 -6.766 2.357 3.470 470 HA LYS 506 HA LYS 506 -8.376 3.705 5.440 471 HB2 LYS 506 2HB LYS 506 -9.069 1.035 4.222 472 HB3 LYS 506 1HB LYS 506 -9.734 1.605 5.744 473 HG2 LYS 506 2HG LYS 506 -10.730 3.515 4.580 474 HG3 LYS 506 1HG LYS 506 -10.073 2.918 3.056 475 HD2 LYS 506 2HD LYS 506 -11.396 0.888 3.273 476 HD3 LYS 506 1HD LYS 506 -12.012 1.438 4.833 477 HE2 LYS 506 2HE LYS 506 -13.061 3.343 3.776 478 HE3 LYS 506 1HE LYS 506 -12.410 2.874 2.209 479 HZ1 LYS 506 3HZ LYS 506 -14.689 2.202 2.428 480 HZ2 LYS 506 1HZ LYS 506 -14.371 1.343 3.830 481 HZ3 LYS 506 2HZ LYS 506 -13.718 0.827 2.357 482 H ALA 507 H ALA 507 -8.561 2.143 7.386 483 HA ALA 507 HA ALA 507 -5.843 1.470 8.032 484 HB1 ALA 507 1HB ALA 507 -6.645 1.143 10.299 485 HB2 ALA 507 2HB ALA 507 -8.317 1.241 9.746 486 HB3 ALA 507 3HB ALA 507 -7.276 2.664 9.664 487 H GLY 508 H GLY 508 -5.107 -0.446 8.761 488 HA2 GLY 508 2HA GLY 508 -5.169 -2.769 9.076 489 HA3 GLY 508 1HA GLY 508 -6.739 -2.845 8.313 490 H ASP 509 H ASP 509 -5.076 -0.969 6.235 491 HA ASP 509 HA ASP 509 -4.213 -3.349 4.933 492 HB2 ASP 509 2HB ASP 509 -4.162 -2.145 2.735 493 HB3 ASP 509 1HB ASP 509 -5.722 -2.309 3.543 494 H ARG 510 H ARG 510 -2.462 -3.414 3.538 495 HA ARG 510 HA ARG 510 -0.314 -2.779 5.426 496 HB2 ARG 510 2HB ARG 510 -0.649 -5.099 5.356 497 HB3 ARG 510 1HB ARG 510 -0.683 -5.187 3.617 498 HG2 ARG 510 2HG ARG 510 1.735 -4.583 3.598 499 HG3 ARG 510 1HG ARG 510 1.713 -4.554 5.358 500 HD2 ARG 510 2HD ARG 510 1.073 -6.917 5.393 501 HD3 ARG 510 1HD ARG 510 1.082 -6.946 3.628 502 HE ARG 510 HE ARG 510 3.544 -6.154 4.074 503 HH11 ARG 510 1HH1 ARG 510 1.733 -8.790 5.709 504 HH12 ARG 510 2HH1 ARG 510 3.122 -9.651 6.123 505 HH21 ARG 510 1HH2 ARG 510 5.509 -7.484 4.634 506 HH22 ARG 510 2HH2 ARG 510 5.236 -8.918 5.504 507 H LEU 511 H LEU 511 1.277 -1.585 4.869 508 HA LEU 511 HA LEU 511 1.312 -0.464 2.253 509 HB2 LEU 511 2HB LEU 511 1.969 0.762 4.478 510 HB3 LEU 511 1HB LEU 511 3.421 -0.181 4.374 511 HG LEU 511 HG LEU 511 4.082 0.883 2.252 512 HD11 LEU 511 1HD1 LEU 511 2.850 2.678 1.321 513 HD12 LEU 511 2HD1 LEU 511 1.575 2.495 2.527 514 HD13 LEU 511 3HD1 LEU 511 1.872 1.224 1.339 515 HD21 LEU 511 3HD2 LEU 511 4.743 1.900 4.376 516 HD22 LEU 511 1HD2 LEU 511 3.265 2.869 4.352 517 HD23 LEU 511 2HD2 LEU 511 4.482 3.089 3.097 518 H ILE 512 H ILE 512 2.444 -1.169 0.544 519 HA ILE 512 HA ILE 512 4.189 -3.497 0.922 520 HB ILE 512 HB ILE 512 2.643 -2.543 -1.484 521 HG12 ILE 512 2HG1 ILE 512 1.224 -3.551 0.202 522 HG13 ILE 512 1HG1 ILE 512 1.338 -4.596 -1.195 523 HG21 ILE 512 1HG2 ILE 512 4.382 -5.003 -1.244 524 HG22 ILE 512 2HG2 ILE 512 4.728 -3.576 -2.222 525 HG23 ILE 512 3HG2 ILE 512 3.355 -4.611 -2.616 526 HD11 ILE 512 3HD1 ILE 512 2.971 -6.005 -0.045 527 HD12 ILE 512 1HD1 ILE 512 1.467 -5.907 0.866 528 HD13 ILE 512 2HD1 ILE 512 2.864 -4.977 1.390 529 H GLU 513 H GLU 513 3.964 -0.462 -0.985 530 HA GLU 513 HA GLU 513 6.755 -0.132 -0.712 531 HB2 GLU 513 2HB GLU 513 7.444 -0.267 -2.998 532 HB3 GLU 513 1HB GLU 513 6.664 -1.776 -2.539 533 HG2 GLU 513 2HG GLU 513 6.000 -1.390 -4.659 534 HG3 GLU 513 1HG GLU 513 4.651 -0.845 -3.622 535 H VAL 514 H VAL 514 7.537 1.702 -1.878 536 HA VAL 514 HA VAL 514 5.467 3.688 -2.308 537 HB VAL 514 HB VAL 514 6.154 4.045 0.033 538 HG11 VAL 514 1HG1 VAL 514 8.460 4.808 0.549 539 HG12 VAL 514 2HG1 VAL 514 8.920 4.371 -1.116 540 HG13 VAL 514 3HG1 VAL 514 8.381 3.134 -0.005 541 HG21 VAL 514 3HG2 VAL 514 6.742 6.430 -0.161 542 HG22 VAL 514 1HG2 VAL 514 5.507 5.928 -1.327 543 HG23 VAL 514 2HG2 VAL 514 7.153 6.181 -1.867 544 H ASN 515 H ASN 515 5.813 4.731 -4.087 545 HA ASN 515 HA ASN 515 6.819 6.055 -5.669 546 HB2 ASN 515 2HB ASN 515 7.935 6.902 -3.572 547 HB3 ASN 515 1HB ASN 515 9.291 5.854 -3.943 548 HD21 ASN 515 1HD2 ASN 515 7.545 8.666 -4.697 549 HD22 ASN 515 2HD2 ASN 515 8.700 9.431 -5.686 550 H GLY 516 H GLY 516 7.560 2.866 -5.289 551 HA2 GLY 516 2HA GLY 516 8.228 1.687 -7.316 552 HA3 GLY 516 1HA GLY 516 9.478 2.903 -7.521 553 H VAL 517 H VAL 517 9.366 2.412 -4.277 554 HA VAL 517 HA VAL 517 11.551 0.455 -4.449 555 HB VAL 517 HB VAL 517 10.853 2.351 -2.195 556 HG11 VAL 517 1HG1 VAL 517 13.321 0.687 -2.667 557 HG12 VAL 517 2HG1 VAL 517 12.083 0.399 -1.446 558 HG13 VAL 517 3HG1 VAL 517 13.101 1.837 -1.348 559 HG21 VAL 517 3HG2 VAL 517 11.515 3.622 -4.161 560 HG22 VAL 517 1HG2 VAL 517 12.979 2.654 -4.308 561 HG23 VAL 517 2HG2 VAL 517 12.756 3.716 -2.914 562 H ASP 518 H ASP 518 10.944 -1.538 -3.853 563 HA ASP 518 HA ASP 518 8.534 -1.825 -2.311 564 HB2 ASP 518 2HB ASP 518 8.726 -4.273 -2.722 565 HB3 ASP 518 1HB ASP 518 8.687 -3.329 -4.196 566 H LEU 519 H LEU 519 8.257 -2.594 -0.376 567 HA LEU 519 HA LEU 519 10.659 -2.869 1.283 568 HB2 LEU 519 2HB LEU 519 9.646 -1.138 2.765 569 HB3 LEU 519 1HB LEU 519 10.255 -0.551 1.227 570 HG LEU 519 HG LEU 519 7.797 -1.019 0.503 571 HD11 LEU 519 1HD1 LEU 519 7.296 -0.370 3.361 572 HD12 LEU 519 2HD1 LEU 519 6.857 -1.845 2.476 573 HD13 LEU 519 3HD1 LEU 519 6.120 -0.299 2.050 574 HD21 LEU 519 3HD2 LEU 519 8.611 1.537 1.855 575 HD22 LEU 519 1HD2 LEU 519 7.231 1.295 0.757 576 HD23 LEU 519 2HD2 LEU 519 8.854 1.035 0.163 577 H ALA 520 H ALA 520 8.059 -4.376 0.379 578 HA ALA 520 HA ALA 520 6.462 -4.700 2.691 579 HB1 ALA 520 1HB ALA 520 5.663 -5.165 0.435 580 HB2 ALA 520 2HB ALA 520 5.434 -6.552 1.502 581 HB3 ALA 520 3HB ALA 520 6.760 -6.540 0.331 582 H GLY 521 H GLY 521 9.470 -6.003 1.798 583 HA2 GLY 521 2HA GLY 521 9.231 -8.090 3.814 584 HA3 GLY 521 1HA GLY 521 10.400 -8.119 2.503 585 H LYS 522 H LYS 522 9.932 -5.091 3.965 586 HA LYS 522 HA LYS 522 12.551 -5.227 5.220 587 HB2 LYS 522 2HB LYS 522 10.795 -2.933 4.416 588 HB3 LYS 522 1HB LYS 522 12.157 -2.717 5.495 589 HG2 LYS 522 2HG LYS 522 12.282 -3.744 2.666 590 HG3 LYS 522 1HG LYS 522 12.719 -2.121 3.205 591 HD2 LYS 522 2HD LYS 522 14.366 -3.305 4.786 592 HD3 LYS 522 1HD LYS 522 14.084 -4.730 3.798 593 HE2 LYS 522 2HE LYS 522 16.060 -3.607 3.012 594 HE3 LYS 522 1HE LYS 522 14.789 -3.437 1.801 595 HZ1 LYS 522 3HZ LYS 522 14.369 -1.180 2.623 596 HZ2 LYS 522 1HZ LYS 522 15.977 -1.343 2.180 597 HZ3 LYS 522 2HZ LYS 522 15.552 -1.383 3.812 598 H SER 523 H SER 523 12.890 -4.173 7.304 599 HA SER 523 HA SER 523 10.915 -5.040 9.171 600 HB2 SER 523 2HB SER 523 13.509 -3.530 9.565 601 HB3 SER 523 1HB SER 523 12.543 -4.278 10.843 602 HG SER 523 HG SER 523 12.979 -6.102 8.956 603 H GLN 524 H GLN 524 10.423 -3.278 11.066 604 HA GLN 524 HA GLN 524 8.861 -1.419 9.623 605 HB2 GLN 524 2HB GLN 524 7.969 -0.614 11.725 606 HB3 GLN 524 1HB GLN 524 7.957 -2.365 11.668 607 HG2 GLN 524 2HG GLN 524 9.816 -2.480 13.156 608 HG3 GLN 524 1HG GLN 524 10.034 -0.729 13.083 609 HE21 GLN 524 1HE2 GLN 524 9.515 -2.441 15.351 610 HE22 GLN 524 2HE2 GLN 524 8.083 -1.846 16.093 611 H GLU 525 H GLU 525 11.861 -1.144 11.296 612 HA GLU 525 HA GLU 525 11.919 1.661 11.546 613 HB2 GLU 525 2HB GLU 525 13.518 0.240 12.720 614 HB3 GLU 525 1HB GLU 525 14.185 -0.296 11.187 615 HG2 GLU 525 2HG GLU 525 14.994 1.938 10.728 616 HG3 GLU 525 1HG GLU 525 14.287 2.525 12.230 617 H GLU 526 H GLU 526 12.675 -0.465 8.918 618 HA GLU 526 HA GLU 526 14.003 1.300 7.203 619 HB2 GLU 526 2HB GLU 526 12.179 -1.005 6.620 620 HB3 GLU 526 1HB GLU 526 13.261 -0.261 5.456 621 HG2 GLU 526 2HG GLU 526 14.158 -1.568 8.002 622 HG3 GLU 526 1HG GLU 526 14.085 -2.395 6.455 623 H VAL 527 H VAL 527 10.650 0.303 7.497 624 HA VAL 527 HA VAL 527 9.772 2.082 5.454 625 HB VAL 527 HB VAL 527 7.534 1.084 5.829 626 HG11 VAL 527 1HG1 VAL 527 8.207 -1.163 5.075 627 HG12 VAL 527 2HG1 VAL 527 9.838 -0.845 5.662 628 HG13 VAL 527 3HG1 VAL 527 9.193 0.092 4.305 629 HG21 VAL 527 3HG2 VAL 527 9.023 -0.470 7.915 630 HG22 VAL 527 1HG2 VAL 527 7.434 -0.890 7.279 631 HG23 VAL 527 2HG2 VAL 527 7.651 0.618 8.185 632 H VAL 528 H VAL 528 9.498 2.048 8.969 633 HA VAL 528 HA VAL 528 7.605 4.112 9.051 634 HB VAL 528 HB VAL 528 9.496 3.158 11.245 635 HG11 VAL 528 1HG1 VAL 528 8.847 5.495 11.682 636 HG12 VAL 528 2HG1 VAL 528 8.080 4.396 12.829 637 HG13 VAL 528 3HG1 VAL 528 7.150 5.056 11.485 638 HG21 VAL 528 3HG2 VAL 528 6.532 2.699 10.790 639 HG22 VAL 528 1HG2 VAL 528 7.450 2.094 12.160 640 HG23 VAL 528 2HG2 VAL 528 7.804 1.512 10.544 641 H SER 529 H SER 529 11.079 4.153 8.909 642 HA SER 529 HA SER 529 11.400 6.904 9.423 643 HB2 SER 529 2HB SER 529 13.121 5.079 7.728 644 HB3 SER 529 1HB SER 529 13.605 6.640 8.399 645 HG SER 529 HG SER 529 13.377 4.179 9.575 646 H LEU 530 H LEU 530 10.482 5.114 6.585 647 HA LEU 530 HA LEU 530 10.857 7.140 4.645 648 HB2 LEU 530 2HB LEU 530 9.112 4.762 4.854 649 HB3 LEU 530 1HB LEU 530 9.125 5.686 3.377 650 HG LEU 530 HG LEU 530 11.374 4.071 4.622 651 HD11 LEU 530 1HD1 LEU 530 9.905 3.758 2.015 652 HD12 LEU 530 2HD1 LEU 530 9.698 2.760 3.453 653 HD13 LEU 530 3HD1 LEU 530 11.233 2.747 2.583 654 HD21 LEU 530 3HD2 LEU 530 12.729 4.670 2.667 655 HD22 LEU 530 1HD2 LEU 530 12.347 6.077 3.647 656 HD23 LEU 530 2HD2 LEU 530 11.474 5.789 2.138 657 H LEU 531 H LEU 531 7.901 6.028 6.388 658 HA LEU 531 HA LEU 531 6.328 8.068 5.341 659 HB2 LEU 531 2HB LEU 531 5.945 6.147 7.642 660 HB3 LEU 531 1HB LEU 531 4.772 7.406 7.274 661 HG LEU 531 HG LEU 531 4.146 5.269 6.425 662 HD11 LEU 531 1HD1 LEU 531 3.400 7.222 5.193 663 HD12 LEU 531 2HD1 LEU 531 3.672 5.879 4.088 664 HD13 LEU 531 3HD1 LEU 531 4.853 7.181 4.192 665 HD21 LEU 531 3HD2 LEU 531 6.635 5.370 4.734 666 HD22 LEU 531 1HD2 LEU 531 5.344 4.181 4.570 667 HD23 LEU 531 2HD2 LEU 531 6.307 4.241 6.047 668 H ARG 532 H ARG 532 8.367 7.928 8.129 669 HA ARG 532 HA ARG 532 7.410 10.328 9.301 670 HB2 ARG 532 2HB ARG 532 8.737 8.674 10.551 671 HB3 ARG 532 1HB ARG 532 10.124 9.024 9.534 672 HG2 ARG 532 2HG ARG 532 10.198 11.303 10.401 673 HG3 ARG 532 1HG ARG 532 8.784 10.972 11.396 674 HD2 ARG 532 2HD ARG 532 10.825 10.775 12.700 675 HD3 ARG 532 1HD ARG 532 10.002 9.226 12.565 676 HE ARG 532 HE ARG 532 12.160 9.849 10.713 677 HH11 ARG 532 1HH1 ARG 532 10.931 7.891 13.410 678 HH12 ARG 532 2HH1 ARG 532 12.241 6.799 13.382 679 HH21 ARG 532 1HH2 ARG 532 13.973 8.312 10.702 680 HH22 ARG 532 2HH2 ARG 532 13.984 7.038 11.824 681 H SER 533 H SER 533 9.692 9.636 6.747 682 HA SER 533 HA SER 533 10.808 12.257 6.633 683 HB2 SER 533 2HB SER 533 10.756 10.064 4.531 684 HB3 SER 533 1HB SER 533 11.744 11.526 4.459 685 HG SER 533 HG SER 533 11.900 9.381 6.302 686 H THR 534 H THR 534 8.311 10.508 4.910 687 HA THR 534 HA THR 534 6.283 11.155 4.218 688 HB THR 534 HB THR 534 7.005 13.920 5.200 689 HG1 THR 534 1HG THR 534 6.339 11.565 6.484 690 HG21 THR 534 3HG2 THR 534 4.399 12.575 4.646 691 HG22 THR 534 1HG2 THR 534 5.105 13.883 3.694 692 HG23 THR 534 2HG2 THR 534 4.582 14.188 5.369 693 H LYS 535 H LYS 535 8.791 13.483 3.269 694 HA LYS 535 HA LYS 535 9.248 14.642 1.426 695 HB2 LYS 535 2HB LYS 535 7.859 12.363 0.021 696 HB3 LYS 535 1HB LYS 535 8.605 13.692 -0.845 697 HG2 LYS 535 2HG LYS 535 10.759 13.088 0.272 698 HG3 LYS 535 1HG LYS 535 9.941 11.651 0.906 699 HD2 LYS 535 2HD LYS 535 9.474 10.884 -1.347 700 HD3 LYS 535 1HD LYS 535 10.160 12.361 -2.020 701 HE2 LYS 535 2HE LYS 535 12.337 11.753 -1.004 702 HE3 LYS 535 1HE LYS 535 11.619 10.244 -0.458 703 HZ1 LYS 535 3HZ LYS 535 12.887 10.014 -2.521 704 HZ2 LYS 535 1HZ LYS 535 11.864 11.081 -3.301 705 HZ3 LYS 535 2HZ LYS 535 11.281 9.592 -2.777 706 H MET 536 H MET 536 8.416 16.539 1.409 707 HA MET 536 HA MET 536 5.536 16.941 0.964 708 HB2 MET 536 2HB MET 536 6.875 18.146 2.803 709 HB3 MET 536 1HB MET 536 7.664 19.013 1.494 710 HG2 MET 536 2HG MET 536 5.537 19.969 0.810 711 HG3 MET 536 1HG MET 536 4.709 19.063 2.072 712 HE1 MET 536 3HE MET 536 3.567 21.201 3.051 713 HE2 MET 536 1HE MET 536 4.298 22.161 1.765 714 HE3 MET 536 2HE MET 536 4.430 22.687 3.443 715 H GLU 537 H GLU 537 7.430 16.023 -0.983 716 HA GLU 537 HA GLU 537 7.957 17.832 -2.965 717 HB2 GLU 537 2HB GLU 537 8.931 15.606 -2.869 718 HB3 GLU 537 1HB GLU 537 7.362 14.877 -3.132 719 HG2 GLU 537 2HG GLU 537 7.335 15.876 -5.402 720 HG3 GLU 537 1HG GLU 537 8.965 16.482 -5.106 721 H GLY 538 H GLY 538 5.074 16.191 -2.080 722 HA2 GLY 538 2HA GLY 538 3.044 17.526 -2.993 723 HA3 GLY 538 1HA GLY 538 3.618 16.875 -4.516 724 H THR 539 H THR 539 2.801 15.014 -5.140 725 HA THR 539 HA THR 539 1.346 13.471 -3.220 726 HB THR 539 HB THR 539 1.006 12.009 -5.257 727 HG1 THR 539 1HG THR 539 2.450 12.726 -6.701 728 HG21 THR 539 3HG2 THR 539 -0.798 13.389 -6.102 729 HG22 THR 539 1HG2 THR 539 -0.148 14.809 -5.257 730 HG23 THR 539 2HG2 THR 539 -0.750 13.407 -4.349 731 H VAL 540 H VAL 540 2.094 11.719 -2.331 732 HA VAL 540 HA VAL 540 4.443 10.420 -3.519 733 HB VAL 540 HB VAL 540 3.522 10.415 -0.626 734 HG11 VAL 540 1HG1 VAL 540 4.371 8.207 -1.294 735 HG12 VAL 540 2HG1 VAL 540 5.486 9.003 -0.174 736 HG13 VAL 540 3HG1 VAL 540 5.843 8.956 -1.906 737 HG21 VAL 540 3HG2 VAL 540 5.653 11.525 -0.210 738 HG22 VAL 540 1HG2 VAL 540 4.691 12.405 -1.409 739 HG23 VAL 540 2HG2 VAL 540 6.041 11.411 -1.935 740 H SER 541 H SER 541 4.235 8.406 -4.224 741 HA SER 541 HA SER 541 1.588 7.255 -4.097 742 HB2 SER 541 2HB SER 541 3.976 6.458 -5.761 743 HB3 SER 541 1HB SER 541 2.336 5.837 -5.925 744 HG SER 541 HG SER 541 3.359 8.377 -6.551 745 H LEU 542 H LEU 542 1.074 5.742 -2.849 746 HA LEU 542 HA LEU 542 3.116 4.002 -1.672 747 HB2 LEU 542 2HB LEU 542 0.490 5.001 -0.598 748 HB3 LEU 542 1HB LEU 542 1.493 3.808 0.192 749 HG LEU 542 HG LEU 542 2.426 6.624 -0.377 750 HD11 LEU 542 1HD1 LEU 542 1.340 5.422 2.148 751 HD12 LEU 542 2HD1 LEU 542 0.487 6.553 1.095 752 HD13 LEU 542 3HD1 LEU 542 1.973 7.061 1.920 753 HD21 LEU 542 3HD2 LEU 542 3.420 4.512 1.508 754 HD22 LEU 542 1HD2 LEU 542 4.110 6.108 1.241 755 HD23 LEU 542 2HD2 LEU 542 4.156 4.900 -0.055 756 H LEU 543 H LEU 543 2.861 1.986 -2.160 757 HA LEU 543 HA LEU 543 0.334 1.104 -3.402 758 HB2 LEU 543 2HB LEU 543 2.719 0.796 -4.485 759 HB3 LEU 543 1HB LEU 543 2.905 -0.372 -3.222 760 HG LEU 543 HG LEU 543 0.717 -0.682 -5.280 761 HD11 LEU 543 1HD1 LEU 543 3.514 -1.808 -5.340 762 HD12 LEU 543 2HD1 LEU 543 2.859 -0.598 -6.443 763 HD13 LEU 543 3HD1 LEU 543 2.205 -2.235 -6.436 764 HD21 LEU 543 3HD2 LEU 543 0.919 -3.045 -4.649 765 HD22 LEU 543 1HD2 LEU 543 0.450 -2.043 -3.265 766 HD23 LEU 543 2HD2 LEU 543 2.114 -2.607 -3.437 767 H VAL 544 H VAL 544 -0.992 -0.079 -2.179 768 HA VAL 544 HA VAL 544 0.097 -1.326 0.245 769 HB VAL 544 HB VAL 544 -2.038 -1.019 1.371 770 HG11 VAL 544 1HG1 VAL 544 -0.920 1.582 0.349 771 HG12 VAL 544 2HG1 VAL 544 -0.388 0.650 1.761 772 HG13 VAL 544 3HG1 VAL 544 -1.990 1.372 1.743 773 HG21 VAL 544 3HG2 VAL 544 -3.482 -1.062 -0.475 774 HG22 VAL 544 1HG2 VAL 544 -2.854 0.472 -1.101 775 HG23 VAL 544 2HG2 VAL 544 -3.763 0.435 0.430 776 H PHE 545 H PHE 545 -1.156 -3.038 1.075 777 HA PHE 545 HA PHE 545 -2.286 -4.801 -1.003 778 HB2 PHE 545 2HB PHE 545 -0.224 -5.578 -0.026 779 HB3 PHE 545 1HB PHE 545 -0.867 -5.392 1.599 780 HD1 PHE 545 1HD PHE 545 -0.841 -7.375 -1.445 781 HD2 PHE 545 2HD PHE 545 -2.436 -7.062 2.479 782 HE1 PHE 545 1HE PHE 545 -1.578 -9.684 -1.577 783 HE2 PHE 545 2HE PHE 545 -3.179 -9.399 2.369 784 HZ PHE 545 HZ PHE 545 -2.750 -10.727 0.340 785 H ARG 546 H ARG 546 -4.378 -4.892 -0.837 786 HA ARG 546 HA ARG 546 -5.635 -4.449 1.726 787 HB2 ARG 546 2HB ARG 546 -6.407 -3.949 -1.097 788 HB3 ARG 546 1HB ARG 546 -7.685 -4.278 0.065 789 HG2 ARG 546 2HG ARG 546 -5.642 -2.288 0.837 790 HG3 ARG 546 1HG ARG 546 -6.779 -1.828 -0.429 791 HD2 ARG 546 2HD ARG 546 -7.392 -1.314 2.045 792 HD3 ARG 546 1HD ARG 546 -8.623 -1.975 0.982 793 HE ARG 546 HE ARG 546 -7.982 -4.179 2.015 794 HH11 ARG 546 1HH1 ARG 546 -7.523 -1.193 3.903 795 HH12 ARG 546 2HH1 ARG 546 -8.064 -1.872 5.361 796 HH21 ARG 546 1HH2 ARG 546 -8.696 -5.140 4.051 797 HH22 ARG 546 2HH2 ARG 546 -8.737 -4.176 5.447 798 H GLN 547 H GLN 547 -6.138 -6.124 2.753 799 HA GLN 547 HA GLN 547 -6.759 -8.613 1.437 800 HB2 GLN 547 2HB GLN 547 -5.296 -8.604 3.433 801 HB3 GLN 547 1HB GLN 547 -6.563 -7.816 4.353 802 HG2 GLN 547 2HG GLN 547 -7.977 -9.788 4.107 803 HG3 GLN 547 1HG GLN 547 -6.712 -10.575 3.164 804 HE21 GLN 547 1HE2 GLN 547 -7.667 -9.484 6.322 805 HE22 GLN 547 2HE2 GLN 547 -6.458 -10.344 7.195 806 H GLU 548 H GLU 548 -8.813 -9.268 1.257 807 HA GLU 548 HA GLU 548 -10.881 -7.392 1.631 808 HB2 GLU 548 2HB GLU 548 -10.770 -9.186 -0.142 809 HB3 GLU 548 1HB GLU 548 -11.107 -10.361 1.118 810 HG2 GLU 548 2HG GLU 548 -13.096 -9.795 -0.142 811 HG3 GLU 548 1HG GLU 548 -13.249 -9.296 1.548 812 H GLU 549 H GLU 549 -11.840 -6.952 3.494 813 HA GLU 549 HA GLU 549 -11.394 -8.455 5.814 814 HB2 GLU 549 2HB GLU 549 -13.286 -6.180 5.275 815 HB3 GLU 549 1HB GLU 549 -13.131 -6.934 6.857 816 HG2 GLU 549 2HG GLU 549 -10.922 -5.574 5.323 817 HG3 GLU 549 1HG GLU 549 -11.800 -4.886 6.684 818 H ALA 550 H ALA 550 -11.924 -10.361 5.438 819 HA ALA 550 HA ALA 550 -14.645 -11.222 5.930 820 HB1 ALA 550 1HB ALA 550 -12.934 -12.110 3.582 821 HB2 ALA 550 2HB ALA 550 -14.476 -11.263 3.479 822 HB3 ALA 550 3HB ALA 550 -14.421 -12.913 4.092 823 H PHE 551 H PHE 551 -12.654 -10.994 7.663 824 HA PHE 551 HA PHE 551 -10.875 -13.283 7.650 825 HB2 PHE 551 2HB PHE 551 -10.133 -10.954 8.218 826 HB3 PHE 551 1HB PHE 551 -11.200 -10.992 9.609 827 HD1 PHE 551 1HD PHE 551 -8.220 -12.530 8.097 828 HD2 PHE 551 2HD PHE 551 -10.468 -11.926 11.649 829 HE1 PHE 551 1HE PHE 551 -6.370 -13.449 9.409 830 HE2 PHE 551 2HE PHE 551 -8.619 -12.847 12.978 831 HZ PHE 551 HZ PHE 551 -6.562 -13.610 11.858 832 H HIS 552 H HIS 552 -10.872 -14.779 9.392 833 HA HIS 552 HA HIS 552 -13.468 -15.632 10.136 834 HB2 HIS 552 2HB HIS 552 -10.793 -16.601 11.162 835 HB3 HIS 552 1HB HIS 552 -12.329 -17.336 11.581 836 HD1 HIS 552 1HD HIS 552 -13.565 -18.650 9.659 837 HD2 HIS 552 2HD HIS 552 -9.756 -17.295 8.704 838 HE1 HIS 552 1HE HIS 552 -12.906 -19.886 7.588 839 HE2 HIS 552 2HE HIS 552 -10.591 -19.105 7.057 840 HA PRO 553 HA PRO 553 -14.033 -13.387 13.956 841 HB2 PRO 553 2HB PRO 553 -16.191 -14.746 14.833 842 HB3 PRO 553 1HB PRO 553 -16.305 -13.605 13.486 843 HG2 PRO 553 2HG PRO 553 -16.106 -16.590 13.430 844 HG3 PRO 553 1HG PRO 553 -17.157 -15.519 12.482 845 HD2 PRO 553 2HD PRO 553 -14.863 -16.578 11.498 846 HD3 PRO 553 1HD PRO 553 -15.489 -14.993 10.989 847 H ARG 554 H ARG 554 -14.654 -14.209 16.280 848 HA ARG 554 HA ARG 554 -12.691 -16.299 16.893 849 HB2 ARG 554 2HB ARG 554 -13.743 -14.098 18.666 850 HB3 ARG 554 1HB ARG 554 -12.500 -15.264 19.090 851 HG2 ARG 554 2HG ARG 554 -11.054 -14.332 17.348 852 HG3 ARG 554 1HG ARG 554 -12.301 -13.145 16.963 853 HD2 ARG 554 2HD ARG 554 -10.683 -12.130 18.402 854 HD3 ARG 554 1HD ARG 554 -12.201 -12.338 19.274 855 HE ARG 554 HE ARG 554 -10.104 -14.354 19.556 856 HH11 ARG 554 1HH1 ARG 554 -12.067 -11.809 21.086 857 HH12 ARG 554 2HH1 ARG 554 -11.529 -12.145 22.658 858 HH21 ARG 554 1HH2 ARG 554 -9.370 -14.806 21.779 859 HH22 ARG 554 2HH2 ARG 554 -9.975 -13.875 23.056 860 H GLU 555 H GLU 555 -13.264 -17.320 19.114 861 HA GLU 555 HA GLU 555 -15.981 -18.304 18.898 862 HB2 GLU 555 2HB GLU 555 -13.856 -19.749 19.237 863 HB3 GLU 555 1HB GLU 555 -13.800 -19.108 20.862 864 HG2 GLU 555 2HG GLU 555 -16.075 -20.740 19.731 865 HG3 GLU 555 1HG GLU 555 -14.751 -21.385 20.681 866 H MET 556 H MET 556 -17.495 -17.237 19.961 867 HA MET 556 HA MET 556 -17.069 -14.957 21.540 868 HB2 MET 556 2HB MET 556 -19.100 -15.315 20.239 869 HB3 MET 556 1HB MET 556 -19.541 -16.664 21.268 870 HG2 MET 556 2HG MET 556 -19.748 -15.125 23.170 871 HG3 MET 556 1HG MET 556 -19.347 -13.780 22.107 872 HE1 MET 556 3HE MET 556 -21.982 -13.927 23.946 873 HE2 MET 556 1HE MET 556 -23.159 -13.260 22.813 874 HE3 MET 556 2HE MET 556 -21.544 -12.561 22.918 875 H ASN 557 H ASN 557 -17.200 -18.252 22.471 876 HA ASN 557 HA ASN 557 -16.981 -19.349 24.334 877 HB2 ASN 557 2HB ASN 557 -15.405 -17.609 25.227 878 HB3 ASN 557 1HB ASN 557 -16.783 -16.711 25.845 879 HD21 ASN 557 1HD2 ASN 557 -17.824 -17.436 27.696 880 HD22 ASN 557 2HD2 ASN 557 -17.182 -18.687 28.696 881 H ALA 558 H ALA 558 -18.872 -20.117 23.907 882 HA ALA 558 HA ALA 558 -20.961 -19.466 25.778 883 HB1 ALA 558 1HB ALA 558 -21.504 -18.035 23.857 884 HB2 ALA 558 2HB ALA 558 -22.681 -19.334 24.021 885 HB3 ALA 558 3HB ALA 558 -21.428 -19.432 22.784 Start of MODEL 11 1 H1 GLY 448 1HT GLY 448 -5.507 -7.921 -23.623 2 H2 GLY 448 2HT GLY 448 -4.349 -6.673 -23.469 3 H3 GLY 448 3HT GLY 448 -5.983 -6.297 -23.596 4 HA2 GLY 448 1HA GLY 448 -6.441 -7.294 -21.496 5 HA3 GLY 448 2HA GLY 448 -4.741 -7.735 -21.362 6 H SER 449 H SER 449 -6.654 -5.833 -19.900 7 HA SER 449 HA SER 449 -5.021 -3.417 -20.085 8 HB2 SER 449 2HB SER 449 -7.701 -3.855 -18.736 9 HB3 SER 449 1HB SER 449 -6.866 -2.310 -18.928 10 HG SER 449 HG SER 449 -6.991 -2.683 -21.224 11 H VAL 450 H VAL 450 -6.218 -5.917 -17.879 12 HA VAL 450 HA VAL 450 -3.963 -5.613 -16.184 13 HB VAL 450 HB VAL 450 -5.447 -3.855 -15.240 14 HG11 VAL 450 1HG1 VAL 450 -7.608 -4.686 -15.893 15 HG12 VAL 450 2HG1 VAL 450 -7.567 -4.423 -14.150 16 HG13 VAL 450 3HG1 VAL 450 -7.443 -6.060 -14.801 17 HG21 VAL 450 3HG2 VAL 450 -3.967 -5.041 -13.712 18 HG22 VAL 450 1HG2 VAL 450 -5.198 -6.274 -13.452 19 HG23 VAL 450 2HG2 VAL 450 -5.477 -4.623 -12.899 20 H TYR 451 H TYR 451 -3.581 -7.541 -15.065 21 HA TYR 451 HA TYR 451 -5.651 -9.572 -15.147 22 HB2 TYR 451 2HB TYR 451 -4.411 -9.743 -17.303 23 HB3 TYR 451 1HB TYR 451 -2.923 -9.981 -16.400 24 HD1 TYR 451 1HD TYR 451 -6.159 -11.458 -17.311 25 HD2 TYR 451 2HD TYR 451 -2.400 -12.144 -15.447 26 HE1 TYR 451 1HE TYR 451 -6.600 -13.871 -17.323 27 HE2 TYR 451 2HE TYR 451 -2.837 -14.567 -15.448 28 HH TYR 451 HH TYR 451 -5.385 -15.931 -17.245 29 H ASN 452 H ASN 452 -5.579 -10.812 -13.372 30 HA ASN 452 HA ASN 452 -3.138 -10.779 -11.747 31 HB2 ASN 452 2HB ASN 452 -6.016 -11.046 -10.842 32 HB3 ASN 452 1HB ASN 452 -4.639 -11.329 -9.791 33 HD21 ASN 452 1HD2 ASN 452 -6.778 -9.435 -9.538 34 HD22 ASN 452 2HD2 ASN 452 -6.068 -7.867 -9.492 35 H THR 453 H THR 453 -2.126 -12.599 -11.772 36 HA THR 453 HA THR 453 -3.410 -15.035 -12.696 37 HB THR 453 HB THR 453 -0.540 -14.578 -11.841 38 HG1 THR 453 1HG THR 453 -0.528 -14.510 -14.393 39 HG21 THR 453 3HG2 THR 453 -1.224 -16.936 -12.103 40 HG22 THR 453 1HG2 THR 453 -0.075 -16.462 -13.356 41 HG23 THR 453 2HG2 THR 453 -1.791 -16.579 -13.738 42 H LYS 454 H LYS 454 -2.116 -13.551 -9.841 43 HA LYS 454 HA LYS 454 -2.725 -15.922 -8.218 44 HB2 LYS 454 2HB LYS 454 -0.308 -15.566 -8.415 45 HB3 LYS 454 1HB LYS 454 -0.504 -13.897 -7.920 46 HG2 LYS 454 2HG LYS 454 -1.289 -14.669 -5.715 47 HG3 LYS 454 1HG LYS 454 -1.005 -16.336 -6.216 48 HD2 LYS 454 2HD LYS 454 1.359 -15.852 -6.551 49 HD3 LYS 454 1HD LYS 454 1.086 -14.166 -6.114 50 HE2 LYS 454 2HE LYS 454 0.338 -14.906 -3.877 51 HE3 LYS 454 1HE LYS 454 0.703 -16.569 -4.331 52 HZ1 LYS 454 3HZ LYS 454 3.032 -15.933 -4.600 53 HZ2 LYS 454 1HZ LYS 454 2.490 -15.566 -3.050 54 HZ3 LYS 454 2HZ LYS 454 2.661 -14.346 -4.189 55 H LYS 455 H LYS 455 -4.603 -15.346 -7.162 56 HA LYS 455 HA LYS 455 -4.642 -12.623 -6.161 57 HB2 LYS 455 2HB LYS 455 -6.441 -13.071 -7.773 58 HB3 LYS 455 1HB LYS 455 -7.016 -14.381 -6.753 59 HG2 LYS 455 2HG LYS 455 -7.513 -12.793 -4.966 60 HG3 LYS 455 1HG LYS 455 -6.920 -11.471 -5.971 61 HD2 LYS 455 2HD LYS 455 -8.656 -11.959 -7.623 62 HD3 LYS 455 1HD LYS 455 -9.255 -13.272 -6.615 63 HE2 LYS 455 2HE LYS 455 -9.717 -11.646 -4.819 64 HE3 LYS 455 1HE LYS 455 -9.159 -10.351 -5.875 65 HZ1 LYS 455 3HZ LYS 455 -11.519 -12.100 -6.312 66 HZ2 LYS 455 1HZ LYS 455 -10.958 -10.953 -7.427 67 HZ3 LYS 455 2HZ LYS 455 -11.515 -10.471 -5.924 68 H VAL 456 H VAL 456 -3.669 -12.882 -4.282 69 HA VAL 456 HA VAL 456 -4.974 -14.545 -2.245 70 HB VAL 456 HB VAL 456 -2.430 -12.855 -2.102 71 HG11 VAL 456 1HG1 VAL 456 -1.942 -14.059 -0.026 72 HG12 VAL 456 2HG1 VAL 456 -3.492 -14.892 -0.148 73 HG13 VAL 456 3HG1 VAL 456 -3.449 -13.145 0.093 74 HG21 VAL 456 3HG2 VAL 456 -2.717 -15.839 -2.403 75 HG22 VAL 456 1HG2 VAL 456 -1.200 -14.975 -2.160 76 HG23 VAL 456 2HG2 VAL 456 -2.144 -14.715 -3.629 77 H GLY 457 H GLY 457 -4.812 -11.570 -3.676 78 HA2 GLY 457 2HA GLY 457 -6.860 -10.348 -2.366 79 HA3 GLY 457 1HA GLY 457 -5.359 -9.761 -1.632 80 H LYS 458 H LYS 458 -6.090 -7.722 -2.627 81 HA LYS 458 HA LYS 458 -4.997 -7.567 -5.337 82 HB2 LYS 458 2HB LYS 458 -6.712 -5.875 -5.915 83 HB3 LYS 458 1HB LYS 458 -7.433 -7.449 -5.595 84 HG2 LYS 458 2HG LYS 458 -7.960 -6.622 -3.295 85 HG3 LYS 458 1HG LYS 458 -7.394 -5.036 -3.794 86 HD2 LYS 458 2HD LYS 458 -9.665 -6.554 -5.081 87 HD3 LYS 458 1HD LYS 458 -9.880 -5.322 -3.853 88 HE2 LYS 458 2HE LYS 458 -10.345 -4.269 -5.955 89 HE3 LYS 458 1HE LYS 458 -8.766 -3.693 -5.457 90 HZ1 LYS 458 3HZ LYS 458 -9.297 -5.782 -7.533 91 HZ2 LYS 458 1HZ LYS 458 -7.757 -5.243 -7.083 92 HZ3 LYS 458 2HZ LYS 458 -8.834 -4.200 -7.787 93 H ARG 459 H ARG 459 -4.059 -5.485 -5.813 94 HA ARG 459 HA ARG 459 -3.243 -4.169 -3.328 95 HB2 ARG 459 2HB ARG 459 -1.754 -4.308 -5.954 96 HB3 ARG 459 1HB ARG 459 -1.293 -3.319 -4.588 97 HG2 ARG 459 2HG ARG 459 0.131 -5.236 -4.490 98 HG3 ARG 459 1HG ARG 459 -1.092 -5.428 -3.266 99 HD2 ARG 459 2HD ARG 459 -0.673 -7.532 -4.510 100 HD3 ARG 459 1HD ARG 459 -2.344 -6.980 -4.628 101 HE ARG 459 HE ARG 459 -1.461 -5.955 -6.832 102 HH11 ARG 459 1HH1 ARG 459 -0.433 -9.136 -5.557 103 HH12 ARG 459 2HH1 ARG 459 -0.214 -9.792 -7.110 104 HH21 ARG 459 1HH2 ARG 459 -1.153 -6.910 -8.930 105 HH22 ARG 459 2HH2 ARG 459 -0.652 -8.525 -9.067 106 H LEU 460 H LEU 460 -3.310 -2.023 -3.167 107 HA LEU 460 HA LEU 460 -4.605 -0.604 -5.380 108 HB2 LEU 460 2HB LEU 460 -5.006 -0.105 -2.426 109 HB3 LEU 460 1HB LEU 460 -5.659 0.873 -3.702 110 HG LEU 460 HG LEU 460 -7.439 -0.408 -2.837 111 HD11 LEU 460 1HD1 LEU 460 -7.530 -0.138 -5.194 112 HD12 LEU 460 2HD1 LEU 460 -8.225 -1.690 -4.730 113 HD13 LEU 460 3HD1 LEU 460 -6.610 -1.625 -5.437 114 HD21 LEU 460 3HD2 LEU 460 -7.467 -2.875 -2.753 115 HD22 LEU 460 1HD2 LEU 460 -6.228 -2.183 -1.704 116 HD23 LEU 460 2HD2 LEU 460 -5.776 -2.892 -3.252 117 H ASN 461 H ASN 461 -3.670 1.197 -5.944 118 HA ASN 461 HA ASN 461 -1.407 2.126 -4.332 119 HB2 ASN 461 2HB ASN 461 -0.381 3.002 -6.432 120 HB3 ASN 461 1HB ASN 461 -0.600 1.259 -6.477 121 HD21 ASN 461 1HD2 ASN 461 -2.176 0.391 -7.868 122 HD22 ASN 461 2HD2 ASN 461 -2.845 1.315 -9.159 123 H ILE 462 H ILE 462 -1.648 3.989 -3.404 124 HA ILE 462 HA ILE 462 -3.665 5.813 -4.497 125 HB ILE 462 HB ILE 462 -2.976 5.380 -1.561 126 HG12 ILE 462 2HG1 ILE 462 -5.477 4.752 -1.387 127 HG13 ILE 462 1HG1 ILE 462 -5.426 4.563 -3.127 128 HG21 ILE 462 1HG2 ILE 462 -3.516 7.685 -1.983 129 HG22 ILE 462 2HG2 ILE 462 -4.805 6.904 -1.060 130 HG23 ILE 462 3HG2 ILE 462 -5.019 7.200 -2.777 131 HD11 ILE 462 3HD1 ILE 462 -5.221 2.433 -1.980 132 HD12 ILE 462 1HD1 ILE 462 -3.784 3.011 -1.139 133 HD13 ILE 462 2HD1 ILE 462 -3.754 2.800 -2.890 134 H GLN 463 H GLN 463 -2.897 7.800 -4.958 135 HA GLN 463 HA GLN 463 -0.214 8.467 -4.043 136 HB2 GLN 463 2HB GLN 463 -2.003 9.807 -6.066 137 HB3 GLN 463 1HB GLN 463 -0.448 10.446 -5.553 138 HG2 GLN 463 2HG GLN 463 0.651 8.509 -6.358 139 HG3 GLN 463 1HG GLN 463 -0.890 7.788 -6.881 140 HE21 GLN 463 1HE2 GLN 463 -0.072 11.187 -7.177 141 HE22 GLN 463 2HE2 GLN 463 0.078 11.193 -8.885 142 H LEU 464 H LEU 464 0.154 9.815 -2.502 143 HA LEU 464 HA LEU 464 -2.086 11.472 -1.606 144 HB2 LEU 464 2HB LEU 464 0.121 10.294 0.081 145 HB3 LEU 464 1HB LEU 464 -1.080 11.417 0.656 146 HG LEU 464 HG LEU 464 -1.759 9.363 1.466 147 HD11 LEU 464 1HD1 LEU 464 -3.615 10.508 0.600 148 HD12 LEU 464 2HD1 LEU 464 -3.825 8.778 0.338 149 HD13 LEU 464 3HD1 LEU 464 -3.361 9.818 -1.008 150 HD21 LEU 464 3HD2 LEU 464 -0.330 7.872 0.263 151 HD22 LEU 464 1HD2 LEU 464 -1.229 8.131 -1.238 152 HD23 LEU 464 2HD2 LEU 464 -1.984 7.299 0.128 153 H LYS 465 H LYS 465 -1.717 13.563 -1.472 154 HA LYS 465 HA LYS 465 1.034 14.576 -1.822 155 HB2 LYS 465 2HB LYS 465 0.011 16.687 -2.448 156 HB3 LYS 465 1HB LYS 465 -0.661 15.416 -3.459 157 HG2 LYS 465 2HG LYS 465 -2.662 15.373 -2.080 158 HG3 LYS 465 1HG LYS 465 -1.953 16.608 -1.046 159 HD2 LYS 465 2HD LYS 465 -2.620 16.951 -3.979 160 HD3 LYS 465 1HD LYS 465 -3.573 17.572 -2.633 161 HE2 LYS 465 2HE LYS 465 -0.740 18.366 -3.338 162 HE3 LYS 465 1HE LYS 465 -2.187 19.323 -3.587 163 HZ1 LYS 465 3HZ LYS 465 -1.099 18.522 -0.927 164 HZ2 LYS 465 1HZ LYS 465 -2.507 19.423 -1.169 165 HZ3 LYS 465 2HZ LYS 465 -1.010 20.031 -1.623 166 H LYS 466 H LYS 466 1.814 15.947 -0.326 167 HA LYS 466 HA LYS 466 0.608 15.464 2.242 168 HB2 LYS 466 2HB LYS 466 3.315 16.215 1.336 169 HB3 LYS 466 1HB LYS 466 2.840 16.688 2.961 170 HG2 LYS 466 2HG LYS 466 4.096 14.522 2.831 171 HG3 LYS 466 1HG LYS 466 2.531 14.401 3.612 172 HD2 LYS 466 2HD LYS 466 2.971 12.487 2.144 173 HD3 LYS 466 1HD LYS 466 1.586 13.413 1.583 174 HE2 LYS 466 2HE LYS 466 2.987 12.698 -0.262 175 HE3 LYS 466 1HE LYS 466 2.985 14.448 -0.121 176 HZ1 LYS 466 3HZ LYS 466 5.133 14.297 0.993 177 HZ2 LYS 466 1HZ LYS 466 5.130 13.687 -0.563 178 HZ3 LYS 466 2HZ LYS 466 5.147 12.611 0.740 179 H GLY 467 H GLY 467 -0.583 16.729 3.233 180 HA2 GLY 467 2HA GLY 467 -0.615 19.543 2.463 181 HA3 GLY 467 1HA GLY 467 -1.935 18.697 3.250 182 H THR 468 H THR 468 -2.204 19.659 5.118 183 HA THR 468 HA THR 468 -0.043 20.826 6.543 184 HB THR 468 HB THR 468 -1.798 21.359 8.228 185 HG1 THR 468 1HG THR 468 -3.271 19.849 8.151 186 HG21 THR 468 3HG2 THR 468 -1.395 22.867 6.325 187 HG22 THR 468 1HG2 THR 468 -3.098 22.862 6.787 188 HG23 THR 468 2HG2 THR 468 -2.565 21.961 5.368 189 H GLU 469 H GLU 469 -1.908 17.818 6.757 190 HA GLU 469 HA GLU 469 -0.794 17.235 9.385 191 HB2 GLU 469 2HB GLU 469 -2.563 15.476 7.704 192 HB3 GLU 469 1HB GLU 469 -2.305 15.409 9.437 193 HG2 GLU 469 2HG GLU 469 -3.778 17.525 7.903 194 HG3 GLU 469 1HG GLU 469 -4.465 16.320 8.984 195 H GLY 470 H GLY 470 -0.058 16.770 6.163 196 HA2 GLY 470 2HA GLY 470 1.958 15.707 5.461 197 HA3 GLY 470 1HA GLY 470 1.796 14.591 6.819 198 H LEU 471 H LEU 471 1.028 12.657 6.389 199 HA LEU 471 HA LEU 471 -0.114 12.134 3.779 200 HB2 LEU 471 2HB LEU 471 0.858 10.359 5.991 201 HB3 LEU 471 1HB LEU 471 -0.153 9.713 4.728 202 HG LEU 471 HG LEU 471 2.116 9.183 4.266 203 HD11 LEU 471 1HD1 LEU 471 1.111 11.307 2.401 204 HD12 LEU 471 2HD1 LEU 471 0.780 9.586 2.345 205 HD13 LEU 471 3HD1 LEU 471 2.414 10.176 2.046 206 HD21 LEU 471 3HD2 LEU 471 3.268 10.891 5.519 207 HD22 LEU 471 1HD2 LEU 471 2.694 12.138 4.409 208 HD23 LEU 471 2HD2 LEU 471 3.832 10.912 3.845 209 H GLY 472 H GLY 472 -1.093 12.062 7.134 210 HA2 GLY 472 2HA GLY 472 -3.357 12.477 7.781 211 HA3 GLY 472 1HA GLY 472 -3.847 11.964 6.167 212 H PHE 473 H PHE 473 -1.575 9.867 7.371 213 HA PHE 473 HA PHE 473 -3.392 8.290 8.909 214 HB2 PHE 473 2HB PHE 473 -3.257 6.283 7.552 215 HB3 PHE 473 1HB PHE 473 -3.916 7.573 6.566 216 HD1 PHE 473 1HD PHE 473 -2.196 8.786 5.021 217 HD2 PHE 473 2HD PHE 473 -1.535 4.948 6.737 218 HE1 PHE 473 1HE PHE 473 -0.546 8.272 3.273 219 HE2 PHE 473 2HE PHE 473 0.116 4.453 5.013 220 HZ PHE 473 HZ PHE 473 0.605 6.122 3.270 221 H SER 474 H SER 474 -2.240 6.433 9.769 222 HA SER 474 HA SER 474 0.644 6.903 9.853 223 HB2 SER 474 2HB SER 474 -1.153 6.264 12.210 224 HB3 SER 474 1HB SER 474 0.597 6.496 12.269 225 HG SER 474 HG SER 474 -0.396 8.564 11.024 226 H ILE 475 H ILE 475 1.760 4.876 10.754 227 HA ILE 475 HA ILE 475 0.324 2.503 9.786 228 HB ILE 475 HB ILE 475 2.548 1.596 9.212 229 HG12 ILE 475 2HG1 ILE 475 3.435 4.463 9.508 230 HG13 ILE 475 1HG1 ILE 475 3.866 3.073 10.516 231 HG21 ILE 475 1HG2 ILE 475 1.039 2.334 7.501 232 HG22 ILE 475 2HG2 ILE 475 2.695 2.652 7.040 233 HG23 ILE 475 3HG2 ILE 475 1.661 3.987 7.585 234 HD11 ILE 475 3HD1 ILE 475 5.656 3.722 8.892 235 HD12 ILE 475 1HD1 ILE 475 4.553 3.356 7.579 236 HD13 ILE 475 2HD1 ILE 475 5.087 2.073 8.656 237 H THR 476 H THR 476 0.814 0.602 10.832 238 HA THR 476 HA THR 476 2.212 0.784 13.394 239 HB THR 476 HB THR 476 -0.228 0.739 13.838 240 HG1 THR 476 1HG THR 476 -0.250 -1.252 15.063 241 HG21 THR 476 3HG2 THR 476 -0.976 -0.375 11.778 242 HG22 THR 476 1HG2 THR 476 -1.591 -1.203 13.209 243 HG23 THR 476 2HG2 THR 476 -0.225 -1.877 12.319 244 H SER 477 H SER 477 2.988 -1.373 14.091 245 HA SER 477 HA SER 477 3.417 -3.210 11.852 246 HB2 SER 477 2HB SER 477 5.816 -3.191 12.265 247 HB3 SER 477 1HB SER 477 5.241 -1.604 11.806 248 HG SER 477 HG SER 477 5.112 -1.843 14.492 249 H ARG 478 H ARG 478 4.334 -5.267 12.575 250 HA ARG 478 HA ARG 478 4.519 -5.653 15.404 251 HB2 ARG 478 2HB ARG 478 3.076 -7.627 15.436 252 HB3 ARG 478 1HB ARG 478 2.163 -6.181 15.048 253 HG2 ARG 478 2HG ARG 478 2.143 -6.842 12.703 254 HG3 ARG 478 1HG ARG 478 3.092 -8.279 13.097 255 HD2 ARG 478 2HD ARG 478 0.322 -7.626 14.111 256 HD3 ARG 478 1HD ARG 478 0.747 -8.828 12.893 257 HE ARG 478 HE ARG 478 2.038 -9.199 15.452 258 HH11 ARG 478 1HH1 ARG 478 -0.817 -10.011 13.504 259 HH12 ARG 478 2HH1 ARG 478 -1.192 -11.411 14.407 260 HH21 ARG 478 1HH2 ARG 478 1.473 -11.151 16.711 261 HH22 ARG 478 2HH2 ARG 478 0.110 -12.047 16.246 262 H ASP 479 H ASP 479 6.121 -6.952 15.891 263 HA ASP 479 HA ASP 479 7.537 -8.329 13.737 264 HB2 ASP 479 2HB ASP 479 8.890 -6.851 15.108 265 HB3 ASP 479 1HB ASP 479 8.330 -7.624 16.581 266 H VAL 480 H VAL 480 7.400 -10.474 13.546 267 HA VAL 480 HA VAL 480 5.927 -11.857 15.652 268 HB VAL 480 HB VAL 480 6.354 -12.751 12.789 269 HG11 VAL 480 1HG1 VAL 480 4.617 -14.411 13.254 270 HG12 VAL 480 2HG1 VAL 480 4.552 -13.873 14.935 271 HG13 VAL 480 3HG1 VAL 480 6.018 -14.627 14.302 272 HG21 VAL 480 3HG2 VAL 480 3.987 -12.166 12.453 273 HG22 VAL 480 1HG2 VAL 480 4.952 -10.756 12.889 274 HG23 VAL 480 2HG2 VAL 480 3.919 -11.524 14.095 275 H THR 481 H THR 481 8.258 -13.139 13.243 276 HA THR 481 HA THR 481 10.101 -13.967 15.263 277 HB THR 481 HB THR 481 8.580 -16.146 13.742 278 HG1 THR 481 1HG THR 481 8.072 -14.873 16.084 279 HG21 THR 481 3HG2 THR 481 10.934 -16.695 14.336 280 HG22 THR 481 1HG2 THR 481 9.778 -17.691 15.221 281 HG23 THR 481 2HG2 THR 481 10.565 -16.336 16.019 282 H ILE 482 H ILE 482 12.088 -14.441 14.274 283 HA ILE 482 HA ILE 482 13.714 -14.674 12.718 284 HB ILE 482 HB ILE 482 11.477 -15.329 10.765 285 HG12 ILE 482 2HG1 ILE 482 11.679 -17.015 12.534 286 HG13 ILE 482 1HG1 ILE 482 12.209 -17.672 11.002 287 HG21 ILE 482 1HG2 ILE 482 13.393 -14.502 9.534 288 HG22 ILE 482 2HG2 ILE 482 13.203 -16.236 9.275 289 HG23 ILE 482 3HG2 ILE 482 14.449 -15.641 10.370 290 HD11 ILE 482 3HD1 ILE 482 14.005 -16.718 13.228 291 HD12 ILE 482 1HD1 ILE 482 14.544 -17.350 11.670 292 HD13 ILE 482 2HD1 ILE 482 13.662 -18.390 12.783 293 H GLY 483 H GLY 483 11.066 -13.167 10.922 294 HA2 GLY 483 2HA GLY 483 11.320 -10.675 10.696 295 HA3 GLY 483 1HA GLY 483 12.948 -11.057 10.127 296 H GLY 484 H GLY 484 12.900 -10.569 8.019 297 HA2 GLY 484 2HA GLY 484 12.555 -11.244 5.816 298 HA3 GLY 484 1HA GLY 484 11.209 -12.242 6.355 299 H SER 485 H SER 485 9.427 -10.798 7.434 300 HA SER 485 HA SER 485 9.095 -8.305 6.019 301 HB2 SER 485 2HB SER 485 8.218 -10.095 4.500 302 HB3 SER 485 1HB SER 485 7.055 -10.514 5.752 303 HG SER 485 HG SER 485 7.340 -7.946 4.610 304 H ALA 486 H ALA 486 8.741 -7.044 7.704 305 HA ALA 486 HA ALA 486 7.001 -7.903 9.869 306 HB1 ALA 486 1HB ALA 486 7.607 -5.728 10.889 307 HB2 ALA 486 2HB ALA 486 8.522 -5.315 9.437 308 HB3 ALA 486 3HB ALA 486 9.042 -6.657 10.452 309 HA PRO 487 HA PRO 487 3.849 -6.242 7.217 310 HB2 PRO 487 2HB PRO 487 1.683 -6.956 8.662 311 HB3 PRO 487 1HB PRO 487 2.616 -8.098 7.718 312 HG2 PRO 487 2HG PRO 487 2.746 -7.593 10.659 313 HG3 PRO 487 1HG PRO 487 2.776 -9.134 9.785 314 HD2 PRO 487 2HD PRO 487 5.017 -7.918 10.743 315 HD3 PRO 487 1HD PRO 487 5.017 -8.966 9.311 316 H ILE 488 H ILE 488 3.561 -4.229 7.029 317 HA ILE 488 HA ILE 488 3.045 -2.516 9.319 318 HB ILE 488 HB ILE 488 3.907 -1.795 6.437 319 HG12 ILE 488 2HG1 ILE 488 5.495 -2.821 8.215 320 HG13 ILE 488 1HG1 ILE 488 6.026 -1.409 7.335 321 HG21 ILE 488 1HG2 ILE 488 4.022 0.439 7.111 322 HG22 ILE 488 2HG2 ILE 488 3.399 -0.001 8.698 323 HG23 ILE 488 3HG2 ILE 488 2.362 -0.169 7.279 324 HD11 ILE 488 3HD1 ILE 488 5.385 0.000 9.230 325 HD12 ILE 488 1HD1 ILE 488 6.493 -1.269 9.756 326 HD13 ILE 488 2HD1 ILE 488 4.758 -1.439 10.055 327 H TYR 489 H TYR 489 1.085 -1.829 9.664 328 HA TYR 489 HA TYR 489 -0.867 -1.928 7.450 329 HB2 TYR 489 2HB TYR 489 -1.495 -2.367 10.394 330 HB3 TYR 489 1HB TYR 489 -2.633 -2.363 9.065 331 HD1 TYR 489 2HD TYR 489 0.091 -4.205 10.641 332 HD2 TYR 489 1HD TYR 489 -2.868 -4.214 7.608 333 HE1 TYR 489 2HE TYR 489 0.491 -6.554 10.331 334 HE2 TYR 489 1HE TYR 489 -2.492 -6.619 7.227 335 HH TYR 489 HH TYR 489 -0.748 -8.300 7.619 336 H VAL 490 H VAL 490 -2.408 -0.348 7.464 337 HA VAL 490 HA VAL 490 -1.541 2.198 8.399 338 HB VAL 490 HB VAL 490 -4.261 1.373 7.362 339 HG11 VAL 490 1HG1 VAL 490 -3.034 4.112 7.695 340 HG12 VAL 490 2HG1 VAL 490 -4.391 3.459 8.601 341 HG13 VAL 490 3HG1 VAL 490 -4.561 3.782 6.876 342 HG21 VAL 490 3HG2 VAL 490 -2.501 0.958 5.745 343 HG22 VAL 490 1HG2 VAL 490 -1.930 2.621 5.917 344 HG23 VAL 490 2HG2 VAL 490 -3.531 2.296 5.239 345 H LYS 491 H LYS 491 -1.528 2.631 10.454 346 HA LYS 491 HA LYS 491 -2.933 1.220 12.472 347 HB2 LYS 491 2HB LYS 491 -0.796 2.387 12.813 348 HB3 LYS 491 1HB LYS 491 -1.612 3.923 12.609 349 HG2 LYS 491 2HG LYS 491 -3.017 3.371 14.605 350 HG3 LYS 491 1HG LYS 491 -2.001 1.952 14.854 351 HD2 LYS 491 2HD LYS 491 -1.064 4.816 14.804 352 HD3 LYS 491 1HD LYS 491 -1.301 3.851 16.259 353 HE2 LYS 491 2HE LYS 491 0.463 2.321 15.542 354 HE3 LYS 491 1HE LYS 491 0.665 3.229 14.046 355 HZ1 LYS 491 3HZ LYS 491 1.153 4.279 16.777 356 HZ2 LYS 491 1HZ LYS 491 1.345 5.140 15.342 357 HZ3 LYS 491 2HZ LYS 491 2.339 3.825 15.672 358 H ASN 492 H ASN 492 -3.625 4.246 10.762 359 HA ASN 492 HA ASN 492 -6.329 4.348 11.650 360 HB2 ASN 492 2HB ASN 492 -5.161 5.022 13.756 361 HB3 ASN 492 1HB ASN 492 -4.418 6.347 12.885 362 HD21 ASN 492 1HD2 ASN 492 -7.793 5.254 12.577 363 HD22 ASN 492 2HD2 ASN 492 -8.472 6.703 13.180 364 H ILE 493 H ILE 493 -7.441 5.768 10.354 365 HA ILE 493 HA ILE 493 -5.935 7.487 8.535 366 HB ILE 493 HB ILE 493 -8.900 6.747 8.592 367 HG12 ILE 493 2HG1 ILE 493 -7.477 4.841 8.002 368 HG13 ILE 493 1HG1 ILE 493 -8.466 5.382 6.647 369 HG21 ILE 493 1HG2 ILE 493 -7.334 8.234 6.490 370 HG22 ILE 493 2HG2 ILE 493 -8.589 8.939 7.517 371 HG23 ILE 493 3HG2 ILE 493 -8.986 7.702 6.311 372 HD11 ILE 493 3HD1 ILE 493 -6.232 4.805 5.910 373 HD12 ILE 493 1HD1 ILE 493 -5.528 5.952 7.047 374 HD13 ILE 493 2HD1 ILE 493 -6.517 6.530 5.701 375 H LEU 494 H LEU 494 -5.740 9.555 9.134 376 HA LEU 494 HA LEU 494 -6.957 10.439 11.560 377 HB2 LEU 494 2HB LEU 494 -5.199 11.922 9.600 378 HB3 LEU 494 1HB LEU 494 -5.623 12.472 11.205 379 HG LEU 494 HG LEU 494 -3.944 10.048 10.557 380 HD11 LEU 494 1HD1 LEU 494 -2.779 12.124 10.114 381 HD12 LEU 494 2HD1 LEU 494 -2.114 11.329 11.540 382 HD13 LEU 494 3HD1 LEU 494 -3.189 12.715 11.724 383 HD21 LEU 494 3HD2 LEU 494 -4.690 11.248 13.227 384 HD22 LEU 494 1HD2 LEU 494 -3.527 9.945 12.979 385 HD23 LEU 494 2HD2 LEU 494 -5.226 9.689 12.598 386 HA PRO 495 HA PRO 495 -10.497 12.684 10.012 387 HB2 PRO 495 2HB PRO 495 -9.633 14.978 11.679 388 HB3 PRO 495 1HB PRO 495 -11.158 14.083 11.696 389 HG2 PRO 495 2HG PRO 495 -9.385 13.755 13.647 390 HG3 PRO 495 1HG PRO 495 -10.301 12.378 13.012 391 HD2 PRO 495 2HD PRO 495 -7.462 13.165 12.481 392 HD3 PRO 495 1HD PRO 495 -8.174 11.556 12.730 393 H ARG 496 H ARG 496 -7.353 14.089 9.829 394 HA ARG 496 HA ARG 496 -8.183 15.533 7.438 395 HB2 ARG 496 2HB ARG 496 -6.435 16.664 9.626 396 HB3 ARG 496 1HB ARG 496 -6.588 17.376 8.029 397 HG2 ARG 496 2HG ARG 496 -8.961 17.747 8.441 398 HG3 ARG 496 1HG ARG 496 -8.790 17.036 10.047 399 HD2 ARG 496 2HD ARG 496 -7.163 18.783 10.620 400 HD3 ARG 496 1HD ARG 496 -7.379 19.485 9.016 401 HE ARG 496 HE ARG 496 -9.880 19.310 10.106 402 HH11 ARG 496 1HH1 ARG 496 -6.865 20.970 10.878 403 HH12 ARG 496 2HH1 ARG 496 -7.610 22.273 11.674 404 HH21 ARG 496 1HH2 ARG 496 -10.929 21.111 11.202 405 HH22 ARG 496 2HH2 ARG 496 -9.987 22.356 11.855 406 H GLY 497 H GLY 497 -6.491 15.812 5.911 407 HA2 GLY 497 2HA GLY 497 -4.029 15.385 5.668 408 HA3 GLY 497 1HA GLY 497 -4.414 13.778 6.228 409 H ALA 498 H ALA 498 -3.423 13.311 4.027 410 HA ALA 498 HA ALA 498 -5.042 13.997 1.746 411 HB1 ALA 498 1HB ALA 498 -2.535 12.325 1.959 412 HB2 ALA 498 2HB ALA 498 -2.611 14.038 1.585 413 HB3 ALA 498 3HB ALA 498 -3.302 12.870 0.461 414 H ALA 499 H ALA 499 -4.089 11.078 3.486 415 HA ALA 499 HA ALA 499 -5.192 9.135 1.836 416 HB1 ALA 499 1HB ALA 499 -3.698 8.619 3.662 417 HB2 ALA 499 2HB ALA 499 -5.160 7.648 3.752 418 HB3 ALA 499 3HB ALA 499 -4.949 9.032 4.832 419 H ILE 500 H ILE 500 -6.759 10.816 4.499 420 HA ILE 500 HA ILE 500 -9.144 9.323 4.389 421 HB ILE 500 HB ILE 500 -8.504 10.627 6.379 422 HG12 ILE 500 2HG1 ILE 500 -11.145 11.296 5.089 423 HG13 ILE 500 1HG1 ILE 500 -10.774 9.993 6.179 424 HG21 ILE 500 1HG2 ILE 500 -7.528 12.586 5.314 425 HG22 ILE 500 2HG2 ILE 500 -8.783 13.061 6.460 426 HG23 ILE 500 3HG2 ILE 500 -9.115 13.074 4.728 427 HD11 ILE 500 3HD1 ILE 500 -10.777 12.896 6.920 428 HD12 ILE 500 1HD1 ILE 500 -10.429 11.541 7.998 429 HD13 ILE 500 2HD1 ILE 500 -12.037 11.719 7.281 430 H GLN 501 H GLN 501 -8.033 12.138 2.651 431 HA GLN 501 HA GLN 501 -10.642 12.800 1.688 432 HB2 GLN 501 2HB GLN 501 -7.933 13.817 0.935 433 HB3 GLN 501 1HB GLN 501 -9.434 14.476 0.277 434 HG2 GLN 501 2HG GLN 501 -8.510 14.505 3.149 435 HG3 GLN 501 1HG GLN 501 -8.665 15.888 2.069 436 HE21 GLN 501 1HE2 GLN 501 -9.909 15.393 4.670 437 HE22 GLN 501 2HE2 GLN 501 -11.608 15.479 4.405 438 H ASP 502 H ASP 502 -7.958 10.923 0.582 439 HA ASP 502 HA ASP 502 -8.972 10.653 -2.076 440 HB2 ASP 502 2HB ASP 502 -6.594 10.209 -1.605 441 HB3 ASP 502 1HB ASP 502 -7.053 8.836 -0.597 442 H GLY 503 H GLY 503 -9.079 8.640 0.812 443 HA2 GLY 503 2HA GLY 503 -10.972 7.496 1.566 444 HA3 GLY 503 1HA GLY 503 -11.732 7.783 0.014 445 H ARG 504 H ARG 504 -9.055 6.522 -1.156 446 HA ARG 504 HA ARG 504 -10.203 3.866 -1.139 447 HB2 ARG 504 2HB ARG 504 -7.774 4.903 -2.629 448 HB3 ARG 504 1HB ARG 504 -8.316 3.240 -2.709 449 HG2 ARG 504 2HG ARG 504 -9.071 4.380 -4.674 450 HG3 ARG 504 1HG ARG 504 -10.477 4.056 -3.666 451 HD2 ARG 504 2HD ARG 504 -10.391 6.363 -2.839 452 HD3 ARG 504 1HD ARG 504 -8.988 6.667 -3.855 453 HE ARG 504 HE ARG 504 -11.453 5.771 -5.085 454 HH11 ARG 504 1HH1 ARG 504 -9.117 8.400 -4.508 455 HH12 ARG 504 2HH1 ARG 504 -9.773 9.419 -5.700 456 HH21 ARG 504 1HH2 ARG 504 -12.349 7.217 -6.723 457 HH22 ARG 504 2HH2 ARG 504 -11.649 8.758 -6.964 458 H LEU 505 H LEU 505 -7.729 5.506 0.423 459 HA LEU 505 HA LEU 505 -6.578 3.044 1.446 460 HB2 LEU 505 2HB LEU 505 -5.054 4.825 0.744 461 HB3 LEU 505 1HB LEU 505 -5.823 5.938 1.852 462 HG LEU 505 HG LEU 505 -4.928 4.690 3.758 463 HD11 LEU 505 1HD1 LEU 505 -3.667 2.897 1.672 464 HD12 LEU 505 2HD1 LEU 505 -4.901 2.426 2.846 465 HD13 LEU 505 3HD1 LEU 505 -3.301 2.910 3.397 466 HD21 LEU 505 3HD2 LEU 505 -2.861 5.306 1.668 467 HD22 LEU 505 1HD2 LEU 505 -2.576 5.185 3.401 468 HD23 LEU 505 2HD2 LEU 505 -3.603 6.471 2.766 469 H LYS 506 H LYS 506 -6.910 2.362 3.488 470 HA LYS 506 HA LYS 506 -8.434 3.943 5.323 471 HB2 LYS 506 2HB LYS 506 -10.015 2.015 5.683 472 HB3 LYS 506 1HB LYS 506 -10.216 2.858 4.151 473 HG2 LYS 506 2HG LYS 506 -8.973 1.085 3.034 474 HG3 LYS 506 1HG LYS 506 -8.780 0.255 4.578 475 HD2 LYS 506 2HD LYS 506 -11.205 0.019 4.758 476 HD3 LYS 506 1HD LYS 506 -11.400 0.887 3.231 477 HE2 LYS 506 2HE LYS 506 -11.569 -1.542 2.944 478 HE3 LYS 506 1HE LYS 506 -10.211 -0.864 2.049 479 HZ1 LYS 506 3HZ LYS 506 -9.600 -2.910 3.206 480 HZ2 LYS 506 1HZ LYS 506 -10.002 -2.224 4.691 481 HZ3 LYS 506 2HZ LYS 506 -8.713 -1.619 3.767 482 H ALA 507 H ALA 507 -8.715 2.518 7.412 483 HA ALA 507 HA ALA 507 -6.016 1.902 8.151 484 HB1 ALA 507 1HB ALA 507 -6.860 1.759 10.422 485 HB2 ALA 507 2HB ALA 507 -8.515 1.826 9.821 486 HB3 ALA 507 3HB ALA 507 -7.445 3.217 9.624 487 H GLY 508 H GLY 508 -5.186 0.002 8.871 488 HA2 GLY 508 2HA GLY 508 -5.203 -2.237 9.497 489 HA3 GLY 508 1HA GLY 508 -6.832 -2.439 8.924 490 H ASP 509 H ASP 509 -5.342 -0.896 6.455 491 HA ASP 509 HA ASP 509 -4.808 -3.443 5.231 492 HB2 ASP 509 2HB ASP 509 -4.837 -0.689 3.996 493 HB3 ASP 509 1HB ASP 509 -4.370 -2.137 3.113 494 H ARG 510 H ARG 510 -2.959 -3.772 3.949 495 HA ARG 510 HA ARG 510 -0.666 -3.246 5.688 496 HB2 ARG 510 2HB ARG 510 -1.179 -5.506 5.556 497 HB3 ARG 510 1HB ARG 510 -1.399 -5.522 3.839 498 HG2 ARG 510 2HG ARG 510 1.083 -5.149 3.625 499 HG3 ARG 510 1HG ARG 510 1.193 -5.320 5.384 500 HD2 ARG 510 2HD ARG 510 0.267 -7.534 5.287 501 HD3 ARG 510 1HD ARG 510 -0.059 -7.366 3.572 502 HE ARG 510 HE ARG 510 2.709 -7.251 4.493 503 HH11 ARG 510 1HH1 ARG 510 0.128 -9.059 2.885 504 HH12 ARG 510 2HH1 ARG 510 1.158 -10.182 2.144 505 HH21 ARG 510 1HH2 ARG 510 4.142 -8.794 3.489 506 HH22 ARG 510 2HH2 ARG 510 3.527 -10.023 2.480 507 H LEU 511 H LEU 511 0.895 -2.003 5.041 508 HA LEU 511 HA LEU 511 0.834 -0.805 2.427 509 HB2 LEU 511 2HB LEU 511 1.482 0.402 4.672 510 HB3 LEU 511 1HB LEU 511 2.945 -0.516 4.562 511 HG LEU 511 HG LEU 511 3.595 0.614 2.472 512 HD11 LEU 511 1HD1 LEU 511 2.331 2.451 1.601 513 HD12 LEU 511 2HD1 LEU 511 1.069 2.192 2.809 514 HD13 LEU 511 3HD1 LEU 511 1.384 0.974 1.573 515 HD21 LEU 511 3HD2 LEU 511 4.265 1.568 4.638 516 HD22 LEU 511 1HD2 LEU 511 2.786 2.528 4.663 517 HD23 LEU 511 2HD2 LEU 511 4.003 2.812 3.417 518 H ILE 512 H ILE 512 2.068 -1.374 0.680 519 HA ILE 512 HA ILE 512 3.869 -3.681 1.049 520 HB ILE 512 HB ILE 512 2.315 -2.892 -1.446 521 HG12 ILE 512 2HG1 ILE 512 0.839 -3.773 0.279 522 HG13 ILE 512 1HG1 ILE 512 1.047 -4.913 -1.036 523 HG21 ILE 512 1HG2 ILE 512 4.060 -5.297 -0.950 524 HG22 ILE 512 2HG2 ILE 512 4.424 -3.947 -2.026 525 HG23 ILE 512 3HG2 ILE 512 3.062 -5.011 -2.375 526 HD11 ILE 512 3HD1 ILE 512 2.624 -6.222 0.309 527 HD12 ILE 512 1HD1 ILE 512 1.075 -6.055 1.136 528 HD13 ILE 512 2HD1 ILE 512 2.452 -5.079 1.638 529 H GLU 513 H GLU 513 3.488 -0.762 -0.990 530 HA GLU 513 HA GLU 513 6.348 -0.428 -0.949 531 HB2 GLU 513 2HB GLU 513 6.634 -0.455 -3.360 532 HB3 GLU 513 1HB GLU 513 6.147 -2.021 -2.734 533 HG2 GLU 513 2HG GLU 513 3.904 -1.633 -3.441 534 HG3 GLU 513 1HG GLU 513 4.379 -0.022 -4.007 535 H VAL 514 H VAL 514 7.055 1.388 -1.989 536 HA VAL 514 HA VAL 514 5.056 3.505 -2.390 537 HB VAL 514 HB VAL 514 6.089 3.770 -0.111 538 HG11 VAL 514 1HG1 VAL 514 8.398 4.523 0.151 539 HG12 VAL 514 2HG1 VAL 514 8.655 4.330 -1.578 540 HG13 VAL 514 3HG1 VAL 514 8.365 2.918 -0.589 541 HG21 VAL 514 3HG2 VAL 514 6.609 6.145 -0.318 542 HG22 VAL 514 1HG2 VAL 514 5.200 5.674 -1.279 543 HG23 VAL 514 2HG2 VAL 514 6.753 5.944 -2.067 544 H ASN 515 H ASN 515 5.234 4.386 -4.298 545 HA ASN 515 HA ASN 515 6.006 5.039 -6.364 546 HB2 ASN 515 2HB ASN 515 8.453 5.637 -4.697 547 HB3 ASN 515 1HB ASN 515 8.329 6.073 -6.393 548 HD21 ASN 515 1HD2 ASN 515 8.519 8.248 -5.891 549 HD22 ASN 515 2HD2 ASN 515 7.234 9.159 -5.197 550 H GLY 516 H GLY 516 6.497 2.197 -5.532 551 HA2 GLY 516 2HA GLY 516 7.114 0.520 -7.136 552 HA3 GLY 516 1HA GLY 516 8.407 1.584 -7.680 553 H VAL 517 H VAL 517 8.781 2.059 -4.599 554 HA VAL 517 HA VAL 517 10.846 0.031 -4.355 555 HB VAL 517 HB VAL 517 10.075 2.259 -2.454 556 HG11 VAL 517 1HG1 VAL 517 12.548 0.531 -2.548 557 HG12 VAL 517 2HG1 VAL 517 11.272 0.450 -1.335 558 HG13 VAL 517 3HG1 VAL 517 12.286 1.888 -1.451 559 HG21 VAL 517 3HG2 VAL 517 10.824 3.154 -4.579 560 HG22 VAL 517 1HG2 VAL 517 12.263 2.139 -4.519 561 HG23 VAL 517 2HG2 VAL 517 12.048 3.430 -3.338 562 H ASP 518 H ASP 518 10.485 -1.836 -3.570 563 HA ASP 518 HA ASP 518 8.055 -2.423 -2.170 564 HB2 ASP 518 2HB ASP 518 9.106 -4.045 -3.730 565 HB3 ASP 518 1HB ASP 518 10.476 -4.171 -2.631 566 H LEU 519 H LEU 519 7.772 -2.247 -0.114 567 HA LEU 519 HA LEU 519 10.147 -2.117 1.551 568 HB2 LEU 519 2HB LEU 519 8.827 -0.510 2.958 569 HB3 LEU 519 1HB LEU 519 9.374 0.066 1.398 570 HG LEU 519 HG LEU 519 7.036 -0.766 0.662 571 HD11 LEU 519 1HD1 LEU 519 6.331 -0.072 3.465 572 HD12 LEU 519 2HD1 LEU 519 6.276 -1.690 2.698 573 HD13 LEU 519 3HD1 LEU 519 5.295 -0.373 2.066 574 HD21 LEU 519 3HD2 LEU 519 7.587 1.874 1.950 575 HD22 LEU 519 1HD2 LEU 519 6.156 1.493 0.957 576 HD23 LEU 519 2HD2 LEU 519 7.753 1.337 0.261 577 H ALA 520 H ALA 520 7.764 -4.050 0.816 578 HA ALA 520 HA ALA 520 7.041 -4.918 3.458 579 HB1 ALA 520 1HB ALA 520 5.497 -5.280 1.586 580 HB2 ALA 520 2HB ALA 520 5.999 -6.827 2.269 581 HB3 ALA 520 3HB ALA 520 6.710 -6.251 0.758 582 H GLY 521 H GLY 521 9.590 -5.267 1.266 583 HA2 GLY 521 2HA GLY 521 10.716 -7.564 2.667 584 HA3 GLY 521 1HA GLY 521 11.417 -6.783 1.253 585 H LYS 522 H LYS 522 10.603 -4.267 2.967 586 HA LYS 522 HA LYS 522 13.213 -3.970 4.211 587 HB2 LYS 522 2HB LYS 522 10.975 -2.046 3.646 588 HB3 LYS 522 1HB LYS 522 12.264 -1.623 4.742 589 HG2 LYS 522 2HG LYS 522 12.560 -2.313 1.824 590 HG3 LYS 522 1HG LYS 522 12.664 -0.700 2.539 591 HD2 LYS 522 2HD LYS 522 14.577 -1.625 3.963 592 HD3 LYS 522 1HD LYS 522 14.547 -3.023 2.899 593 HE2 LYS 522 2HE LYS 522 16.238 -1.513 2.143 594 HE3 LYS 522 1HE LYS 522 14.911 -1.511 0.981 595 HZ1 LYS 522 3HZ LYS 522 15.391 0.558 3.072 596 HZ2 LYS 522 1HZ LYS 522 14.110 0.574 1.975 597 HZ3 LYS 522 2HZ LYS 522 15.675 0.739 1.421 598 H SER 523 H SER 523 13.374 -3.099 6.389 599 HA SER 523 HA SER 523 11.714 -4.635 8.125 600 HB2 SER 523 2HB SER 523 13.898 -2.631 8.675 601 HB3 SER 523 1HB SER 523 13.198 -3.709 9.884 602 HG SER 523 HG SER 523 14.199 -4.787 7.511 603 H GLN 524 H GLN 524 10.623 -3.572 10.018 604 HA GLN 524 HA GLN 524 8.760 -1.723 9.028 605 HB2 GLN 524 2HB GLN 524 7.792 -1.662 11.283 606 HB3 GLN 524 1HB GLN 524 8.133 -3.302 10.776 607 HG2 GLN 524 2HG GLN 524 8.853 -3.370 13.008 608 HG3 GLN 524 1HG GLN 524 10.313 -2.893 12.137 609 HE21 GLN 524 1HE2 GLN 524 7.707 -1.655 14.152 610 HE22 GLN 524 2HE2 GLN 524 8.602 -0.282 14.688 611 H GLU 525 H GLU 525 11.714 -1.259 10.615 612 HA GLU 525 HA GLU 525 11.163 1.271 11.638 613 HB2 GLU 525 2HB GLU 525 12.906 -0.170 12.515 614 HB3 GLU 525 1HB GLU 525 13.821 0.000 11.032 615 HG2 GLU 525 2HG GLU 525 14.133 2.378 11.456 616 HG3 GLU 525 1HG GLU 525 13.170 2.255 12.927 617 H GLU 526 H GLU 526 12.308 0.092 8.575 618 HA GLU 526 HA GLU 526 13.478 2.360 7.434 619 HB2 GLU 526 2HB GLU 526 11.881 0.140 6.186 620 HB3 GLU 526 1HB GLU 526 12.828 1.301 5.278 621 HG2 GLU 526 2HG GLU 526 13.919 -0.577 7.327 622 HG3 GLU 526 1HG GLU 526 13.896 -0.878 5.592 623 H VAL 527 H VAL 527 10.203 1.097 7.366 624 HA VAL 527 HA VAL 527 9.306 3.277 5.780 625 HB VAL 527 HB VAL 527 7.107 2.235 5.778 626 HG11 VAL 527 1HG1 VAL 527 7.793 0.134 4.701 627 HG12 VAL 527 2HG1 VAL 527 9.410 0.365 5.360 628 HG13 VAL 527 3HG1 VAL 527 8.767 1.514 4.179 629 HG21 VAL 527 3HG2 VAL 527 8.329 0.107 7.511 630 HG22 VAL 527 1HG2 VAL 527 6.686 0.191 6.843 631 HG23 VAL 527 2HG2 VAL 527 7.175 1.337 8.082 632 H VAL 528 H VAL 528 9.089 2.448 9.186 633 HA VAL 528 HA VAL 528 7.199 4.446 9.825 634 HB VAL 528 HB VAL 528 9.421 3.318 11.586 635 HG11 VAL 528 1HG1 VAL 528 8.642 5.476 12.436 636 HG12 VAL 528 2HG1 VAL 528 8.079 4.162 13.476 637 HG13 VAL 528 3HG1 VAL 528 6.971 4.920 12.339 638 HG21 VAL 528 3HG2 VAL 528 6.486 2.622 11.430 639 HG22 VAL 528 1HG2 VAL 528 7.655 1.940 12.563 640 HG23 VAL 528 2HG2 VAL 528 7.817 1.631 10.835 641 H SER 529 H SER 529 10.667 4.525 9.401 642 HA SER 529 HA SER 529 11.000 7.189 10.214 643 HB2 SER 529 2HB SER 529 12.878 5.581 10.019 644 HB3 SER 529 1HB SER 529 12.658 5.553 8.272 645 HG SER 529 HG SER 529 13.786 7.467 9.914 646 H LEU 530 H LEU 530 10.231 5.709 7.127 647 HA LEU 530 HA LEU 530 10.359 8.028 5.503 648 HB2 LEU 530 2HB LEU 530 8.888 5.487 5.353 649 HB3 LEU 530 1HB LEU 530 8.819 6.601 4.008 650 HG LEU 530 HG LEU 530 11.185 5.027 5.069 651 HD11 LEU 530 1HD1 LEU 530 9.790 5.007 2.399 652 HD12 LEU 530 2HD1 LEU 530 9.656 3.774 3.656 653 HD13 LEU 530 3HD1 LEU 530 11.196 4.041 2.837 654 HD21 LEU 530 3HD2 LEU 530 12.520 6.043 3.275 655 HD22 LEU 530 1HD2 LEU 530 11.985 7.248 4.444 656 HD23 LEU 530 2HD2 LEU 530 11.178 7.111 2.884 657 H LEU 531 H LEU 531 7.518 6.335 6.956 658 HA LEU 531 HA LEU 531 5.723 8.235 6.068 659 HB2 LEU 531 2HB LEU 531 5.563 5.944 8.009 660 HB3 LEU 531 1HB LEU 531 4.242 7.101 7.890 661 HG LEU 531 HG LEU 531 3.900 5.077 6.663 662 HD11 LEU 531 1HD1 LEU 531 2.806 7.111 5.881 663 HD12 LEU 531 2HD1 LEU 531 3.207 6.088 4.503 664 HD13 LEU 531 3HD1 LEU 531 4.196 7.500 4.871 665 HD21 LEU 531 3HD2 LEU 531 6.231 5.898 4.938 666 HD22 LEU 531 1HD2 LEU 531 5.108 4.591 4.559 667 HD23 LEU 531 2HD2 LEU 531 6.141 4.482 5.985 668 H ARG 532 H ARG 532 7.566 8.072 9.041 669 HA ARG 532 HA ARG 532 6.094 10.238 10.172 670 HB2 ARG 532 2HB ARG 532 7.267 8.583 11.598 671 HB3 ARG 532 1HB ARG 532 8.808 9.208 11.021 672 HG2 ARG 532 2HG ARG 532 8.310 11.381 11.979 673 HG3 ARG 532 1HG ARG 532 6.736 10.795 12.506 674 HD2 ARG 532 2HD ARG 532 7.868 9.131 13.918 675 HD3 ARG 532 1HD ARG 532 9.421 9.802 13.424 676 HE ARG 532 HE ARG 532 8.099 11.953 14.324 677 HH11 ARG 532 1HH1 ARG 532 8.701 8.785 15.756 678 HH12 ARG 532 2HH1 ARG 532 8.732 9.345 17.366 679 HH21 ARG 532 1HH2 ARG 532 8.158 12.741 16.559 680 HH22 ARG 532 2HH2 ARG 532 8.451 11.623 17.810 681 H SER 533 H SER 533 8.897 9.993 8.119 682 HA SER 533 HA SER 533 10.165 12.432 8.475 683 HB2 SER 533 2HB SER 533 11.021 10.585 7.039 684 HB3 SER 533 1HB SER 533 9.748 10.917 5.878 685 HG SER 533 HG SER 533 12.073 12.341 6.453 686 H THR 534 H THR 534 7.547 11.660 6.252 687 HA THR 534 HA THR 534 6.078 12.867 5.066 688 HB THR 534 HB THR 534 4.885 14.727 6.276 689 HG1 THR 534 1HG THR 534 7.085 14.627 7.798 690 HG21 THR 534 3HG2 THR 534 5.268 12.140 7.781 691 HG22 THR 534 1HG2 THR 534 4.126 12.432 6.466 692 HG23 THR 534 2HG2 THR 534 3.925 13.260 8.005 693 H LYS 535 H LYS 535 7.565 13.495 3.405 694 HA LYS 535 HA LYS 535 8.535 16.216 3.382 695 HB2 LYS 535 2HB LYS 535 8.234 14.202 1.142 696 HB3 LYS 535 1HB LYS 535 8.975 15.775 0.946 697 HG2 LYS 535 2HG LYS 535 10.721 15.112 2.565 698 HG3 LYS 535 1HG LYS 535 9.981 13.509 2.656 699 HD2 LYS 535 2HD LYS 535 10.336 13.175 0.281 700 HD3 LYS 535 1HD LYS 535 10.996 14.801 0.127 701 HE2 LYS 535 2HE LYS 535 12.838 14.176 1.613 702 HE3 LYS 535 1HE LYS 535 12.165 12.553 1.754 703 HZ1 LYS 535 3HZ LYS 535 13.955 12.663 0.108 704 HZ2 LYS 535 1HZ LYS 535 13.100 13.807 -0.767 705 HZ3 LYS 535 2HZ LYS 535 12.511 12.241 -0.634 706 H MET 536 H MET 536 7.504 17.974 2.571 707 HA MET 536 HA MET 536 4.651 17.671 1.832 708 HB2 MET 536 2HB MET 536 5.322 19.200 3.729 709 HB3 MET 536 1HB MET 536 6.229 20.151 2.571 710 HG2 MET 536 2HG MET 536 4.146 20.700 1.397 711 HG3 MET 536 1HG MET 536 3.239 19.740 2.559 712 HE1 MET 536 3HE MET 536 5.503 23.627 3.631 713 HE2 MET 536 1HE MET 536 5.459 22.935 2.010 714 HE3 MET 536 2HE MET 536 6.335 22.110 3.300 715 H GLU 537 H GLU 537 7.110 17.298 0.201 716 HA GLU 537 HA GLU 537 7.336 19.280 -1.664 717 HB2 GLU 537 2HB GLU 537 9.008 17.583 -1.323 718 HB3 GLU 537 1HB GLU 537 7.928 16.348 -1.934 719 HG2 GLU 537 2HG GLU 537 7.952 17.493 -4.120 720 HG3 GLU 537 1HG GLU 537 9.159 18.604 -3.466 721 H GLY 538 H GLY 538 5.338 16.291 -1.869 722 HA2 GLY 538 2HA GLY 538 3.282 17.467 -3.355 723 HA3 GLY 538 1HA GLY 538 4.404 16.777 -4.501 724 H THR 539 H THR 539 3.349 15.067 -5.286 725 HA THR 539 HA THR 539 1.832 13.401 -3.533 726 HB THR 539 HB THR 539 1.660 12.133 -5.825 727 HG1 THR 539 1HG THR 539 1.570 13.833 -7.501 728 HG21 THR 539 3HG2 THR 539 -0.357 13.423 -6.330 729 HG22 THR 539 1HG2 THR 539 0.146 14.671 -5.180 730 HG23 THR 539 2HG2 THR 539 -0.224 13.020 -4.630 731 H VAL 540 H VAL 540 2.337 11.462 -2.889 732 HA VAL 540 HA VAL 540 4.650 10.061 -4.028 733 HB VAL 540 HB VAL 540 3.809 10.210 -1.102 734 HG11 VAL 540 1HG1 VAL 540 4.575 7.965 -1.740 735 HG12 VAL 540 2HG1 VAL 540 5.722 8.749 -0.643 736 HG13 VAL 540 3HG1 VAL 540 6.059 8.666 -2.377 737 HG21 VAL 540 3HG2 VAL 540 6.024 11.180 -0.743 738 HG22 VAL 540 1HG2 VAL 540 5.046 12.152 -1.848 739 HG23 VAL 540 2HG2 VAL 540 6.323 11.117 -2.482 740 H SER 541 H SER 541 4.315 7.785 -4.263 741 HA SER 541 HA SER 541 1.484 7.128 -4.241 742 HB2 SER 541 2HB SER 541 3.775 5.849 -5.725 743 HB3 SER 541 1HB SER 541 2.062 5.469 -5.927 744 HG SER 541 HG SER 541 3.489 7.781 -6.654 745 H LEU 542 H LEU 542 0.864 5.977 -2.532 746 HA LEU 542 HA LEU 542 2.695 3.998 -1.406 747 HB2 LEU 542 2HB LEU 542 0.313 5.416 -0.204 748 HB3 LEU 542 1HB LEU 542 0.986 3.978 0.519 749 HG LEU 542 HG LEU 542 1.732 5.932 1.711 750 HD11 LEU 542 1HD1 LEU 542 4.158 5.650 1.609 751 HD12 LEU 542 2HD1 LEU 542 3.962 4.697 0.143 752 HD13 LEU 542 3HD1 LEU 542 3.286 4.121 1.661 753 HD21 LEU 542 3HD2 LEU 542 1.574 7.633 -0.041 754 HD22 LEU 542 1HD2 LEU 542 2.920 6.887 -0.891 755 HD23 LEU 542 2HD2 LEU 542 3.183 7.636 0.684 756 H LEU 543 H LEU 543 2.289 1.968 -1.660 757 HA LEU 543 HA LEU 543 -0.285 1.232 -2.863 758 HB2 LEU 543 2HB LEU 543 1.931 1.059 -4.249 759 HB3 LEU 543 1HB LEU 543 2.351 -0.140 -3.115 760 HG LEU 543 HG LEU 543 -0.175 -0.615 -4.657 761 HD11 LEU 543 1HD1 LEU 543 2.635 -1.231 -5.577 762 HD12 LEU 543 2HD1 LEU 543 1.537 -0.071 -6.330 763 HD13 LEU 543 3HD1 LEU 543 1.151 -1.790 -6.345 764 HD21 LEU 543 3HD2 LEU 543 0.548 -2.954 -4.339 765 HD22 LEU 543 1HD2 LEU 543 0.355 -2.104 -2.805 766 HD23 LEU 543 2HD2 LEU 543 1.964 -2.380 -3.467 767 H VAL 544 H VAL 544 -1.494 -0.154 -1.786 768 HA VAL 544 HA VAL 544 -0.322 -1.595 0.497 769 HB VAL 544 HB VAL 544 -2.382 -1.356 1.738 770 HG11 VAL 544 1HG1 VAL 544 -1.440 1.307 0.714 771 HG12 VAL 544 2HG1 VAL 544 -0.777 0.402 2.077 772 HG13 VAL 544 3HG1 VAL 544 -2.407 1.052 2.165 773 HG21 VAL 544 3HG2 VAL 544 -3.897 -1.397 -0.111 774 HG22 VAL 544 1HG2 VAL 544 -3.411 0.225 -0.604 775 HG23 VAL 544 2HG2 VAL 544 -4.260 -0.018 0.944 776 H PHE 545 H PHE 545 -1.585 -3.484 1.160 777 HA PHE 545 HA PHE 545 -2.673 -4.907 -1.183 778 HB2 PHE 545 2HB PHE 545 -0.527 -5.758 -0.273 779 HB3 PHE 545 1HB PHE 545 -1.321 -6.044 1.267 780 HD1 PHE 545 1HD PHE 545 -1.123 -7.054 -2.249 781 HD2 PHE 545 2HD PHE 545 -2.628 -8.028 1.597 782 HE1 PHE 545 1HE PHE 545 -1.677 -9.271 -3.058 783 HE2 PHE 545 2HE PHE 545 -3.197 -10.295 0.788 784 HZ PHE 545 HZ PHE 545 -2.723 -10.917 -1.533 785 H ARG 546 H ARG 546 -4.736 -5.292 -1.068 786 HA ARG 546 HA ARG 546 -6.124 -5.374 1.484 787 HB2 ARG 546 2HB ARG 546 -7.172 -3.992 -0.173 788 HB3 ARG 546 1HB ARG 546 -7.051 -5.262 -1.381 789 HG2 ARG 546 2HG ARG 546 -8.638 -6.621 -0.087 790 HG3 ARG 546 1HG ARG 546 -8.778 -5.307 1.081 791 HD2 ARG 546 2HD ARG 546 -9.715 -3.860 -0.535 792 HD3 ARG 546 1HD ARG 546 -9.347 -4.981 -1.847 793 HE ARG 546 HE ARG 546 -11.024 -6.170 0.096 794 HH11 ARG 546 1HH1 ARG 546 -11.094 -3.802 -2.527 795 HH12 ARG 546 2HH1 ARG 546 -12.693 -4.151 -3.000 796 HH21 ARG 546 1HH2 ARG 546 -13.235 -6.653 -0.568 797 HH22 ARG 546 2HH2 ARG 546 -13.933 -5.790 -1.852 798 H GLN 547 H GLN 547 -6.361 -7.322 2.374 799 HA GLN 547 HA GLN 547 -6.281 -9.669 0.609 800 HB2 GLN 547 2HB GLN 547 -4.370 -9.446 2.183 801 HB3 GLN 547 1HB GLN 547 -5.507 -9.431 3.512 802 HG2 GLN 547 2HG GLN 547 -6.196 -11.704 3.002 803 HG3 GLN 547 1HG GLN 547 -5.118 -11.736 1.611 804 HE21 GLN 547 1HE2 GLN 547 -5.166 -13.439 3.963 805 HE22 GLN 547 2HE2 GLN 547 -3.608 -13.306 4.699 806 H GLU 548 H GLU 548 -8.195 -10.616 0.424 807 HA GLU 548 HA GLU 548 -10.036 -10.393 2.646 808 HB2 GLU 548 2HB GLU 548 -11.769 -11.261 0.993 809 HB3 GLU 548 1HB GLU 548 -11.151 -9.646 0.696 810 HG2 GLU 548 2HG GLU 548 -9.752 -10.454 -1.076 811 HG3 GLU 548 1HG GLU 548 -10.181 -12.123 -0.699 812 H GLU 549 H GLU 549 -9.235 -11.777 3.963 813 HA GLU 549 HA GLU 549 -8.683 -13.644 5.006 814 HB2 GLU 549 2HB GLU 549 -10.681 -14.934 3.130 815 HB3 GLU 549 1HB GLU 549 -10.007 -15.706 4.558 816 HG2 GLU 549 2HG GLU 549 -11.726 -13.238 4.495 817 HG3 GLU 549 1HG GLU 549 -12.210 -14.848 5.033 818 H ALA 550 H ALA 550 -9.164 -15.439 2.060 819 HA ALA 550 HA ALA 550 -7.863 -16.697 0.754 820 HB1 ALA 550 1HB ALA 550 -5.621 -14.804 1.457 821 HB2 ALA 550 2HB ALA 550 -6.806 -14.541 0.178 822 HB3 ALA 550 3HB ALA 550 -5.683 -15.897 0.074 823 H PHE 551 H PHE 551 -5.513 -15.869 3.243 824 HA PHE 551 HA PHE 551 -5.373 -18.682 3.974 825 HB2 PHE 551 2HB PHE 551 -3.018 -16.913 3.315 826 HB3 PHE 551 1HB PHE 551 -2.881 -18.474 4.114 827 HD1 PHE 551 2HD PHE 551 -3.462 -20.529 2.865 828 HD2 PHE 551 1HD PHE 551 -3.298 -16.727 0.976 829 HE1 PHE 551 2HE PHE 551 -3.343 -21.629 0.680 830 HE2 PHE 551 1HE PHE 551 -3.180 -17.818 -1.223 831 HZ PHE 551 HZ PHE 551 -3.199 -20.278 -1.377 832 H HIS 552 H HIS 552 -5.043 -18.964 6.115 833 HA HIS 552 HA HIS 552 -4.676 -16.559 7.756 834 HB2 HIS 552 2HB HIS 552 -6.921 -17.884 7.859 835 HB3 HIS 552 1HB HIS 552 -5.991 -19.157 8.614 836 HD1 HIS 552 1HD HIS 552 -8.016 -16.296 9.384 837 HD2 HIS 552 2HD HIS 552 -4.782 -18.171 11.183 838 HE1 HIS 552 1HE HIS 552 -8.091 -15.608 11.772 839 HE2 HIS 552 2HE HIS 552 -6.040 -16.567 12.806 840 HA PRO 553 HA PRO 553 -0.844 -19.118 7.848 841 HB2 PRO 553 2HB PRO 553 0.855 -17.142 8.354 842 HB3 PRO 553 1HB PRO 553 0.078 -17.295 6.776 843 HG2 PRO 553 2HG PRO 553 -0.644 -15.500 9.068 844 HG3 PRO 553 1HG PRO 553 -0.506 -15.106 7.345 845 HD2 PRO 553 2HD PRO 553 -2.880 -15.600 8.562 846 HD3 PRO 553 1HD PRO 553 -2.585 -15.970 6.855 847 H ARG 554 H ARG 554 -2.514 -19.057 10.223 848 HA ARG 554 HA ARG 554 -0.738 -19.871 12.194 849 HB2 ARG 554 2HB ARG 554 -1.006 -17.954 13.786 850 HB3 ARG 554 1HB ARG 554 -0.020 -17.585 12.380 851 HG2 ARG 554 2HG ARG 554 -2.312 -16.706 11.424 852 HG3 ARG 554 1HG ARG 554 -2.702 -16.558 13.142 853 HD2 ARG 554 2HD ARG 554 -0.619 -15.274 13.474 854 HD3 ARG 554 1HD ARG 554 -0.331 -15.484 11.734 855 HE ARG 554 HE ARG 554 -2.809 -14.190 12.423 856 HH11 ARG 554 1HH1 ARG 554 0.585 -13.744 11.509 857 HH12 ARG 554 2HH1 ARG 554 0.373 -12.139 10.961 858 HH21 ARG 554 1HH2 ARG 554 -3.086 -11.967 11.721 859 HH22 ARG 554 2HH2 ARG 554 -1.754 -11.114 11.090 860 H GLU 555 H GLU 555 -1.980 -19.935 14.368 861 HA GLU 555 HA GLU 555 -3.740 -20.602 15.583 862 HB2 GLU 555 2HB GLU 555 -5.374 -19.077 13.559 863 HB3 GLU 555 1HB GLU 555 -6.004 -19.733 15.061 864 HG2 GLU 555 2HG GLU 555 -4.490 -18.301 16.322 865 HG3 GLU 555 1HG GLU 555 -3.857 -17.647 14.814 866 H MET 556 H MET 556 -4.064 -22.665 15.662 867 HA MET 556 HA MET 556 -4.841 -24.114 13.331 868 HB2 MET 556 2HB MET 556 -4.771 -26.147 14.799 869 HB3 MET 556 1HB MET 556 -3.264 -25.261 14.750 870 HG2 MET 556 2HG MET 556 -5.287 -25.146 16.990 871 HG3 MET 556 1HG MET 556 -3.823 -26.118 16.993 872 HE1 MET 556 3HE MET 556 -1.018 -23.336 17.062 873 HE2 MET 556 1HE MET 556 -1.714 -24.076 15.620 874 HE3 MET 556 2HE MET 556 -1.353 -25.067 17.033 875 H ASN 557 H ASN 557 -6.727 -22.981 12.974 876 HA ASN 557 HA ASN 557 -9.027 -24.292 14.110 877 HB2 ASN 557 2HB ASN 557 -8.848 -22.412 15.626 878 HB3 ASN 557 1HB ASN 557 -8.646 -21.295 14.283 879 HD21 ASN 557 1HD2 ASN 557 -10.386 -20.081 14.972 880 HD22 ASN 557 2HD2 ASN 557 -12.029 -20.577 14.791 881 H ALA 558 H ALA 558 -9.641 -25.116 12.257 882 HA ALA 558 HA ALA 558 -10.992 -23.503 10.392 883 HB1 ALA 558 1HB ALA 558 -9.688 -24.115 8.386 884 HB2 ALA 558 2HB ALA 558 -8.469 -24.873 9.410 885 HB3 ALA 558 3HB ALA 558 -8.727 -23.131 9.490 Start of MODEL 12 1 H1 GLY 448 1HT GLY 448 -22.448 -0.747 -17.403 2 H2 GLY 448 2HT GLY 448 -23.347 0.560 -16.807 3 H3 GLY 448 3HT GLY 448 -22.995 -0.769 -15.812 4 HA2 GLY 448 1HA GLY 448 -20.992 1.065 -16.967 5 HA3 GLY 448 2HA GLY 448 -21.541 1.090 -15.296 6 H SER 449 H SER 449 -19.217 0.771 -14.917 7 HA SER 449 HA SER 449 -18.043 -1.704 -15.640 8 HB2 SER 449 2HB SER 449 -17.181 0.352 -13.619 9 HB3 SER 449 1HB SER 449 -16.184 -0.959 -14.252 10 HG SER 449 HG SER 449 -15.876 1.070 -15.258 11 H VAL 450 H VAL 450 -19.167 -3.405 -14.829 12 HA VAL 450 HA VAL 450 -19.547 -3.556 -11.926 13 HB VAL 450 HB VAL 450 -20.612 -5.407 -14.089 14 HG11 VAL 450 1HG1 VAL 450 -22.064 -6.304 -12.326 15 HG12 VAL 450 2HG1 VAL 450 -21.268 -5.261 -11.149 16 HG13 VAL 450 3HG1 VAL 450 -20.356 -6.538 -11.951 17 HG21 VAL 450 3HG2 VAL 450 -21.641 -3.199 -14.259 18 HG22 VAL 450 1HG2 VAL 450 -22.042 -3.238 -12.542 19 HG23 VAL 450 2HG2 VAL 450 -22.805 -4.378 -13.654 20 H TYR 451 H TYR 451 -18.142 -4.717 -10.784 21 HA TYR 451 HA TYR 451 -16.247 -6.435 -12.220 22 HB2 TYR 451 2HB TYR 451 -16.136 -5.247 -9.451 23 HB3 TYR 451 1HB TYR 451 -14.933 -6.334 -10.117 24 HD1 TYR 451 2HD TYR 451 -13.405 -5.552 -11.863 25 HD2 TYR 451 1HD TYR 451 -16.238 -2.929 -10.076 26 HE1 TYR 451 2HE TYR 451 -12.146 -3.626 -12.713 27 HE2 TYR 451 1HE TYR 451 -14.987 -0.991 -10.931 28 HH TYR 451 HH TYR 451 -12.549 -1.285 -13.257 29 H ASN 452 H ASN 452 -16.084 -8.579 -11.754 30 HA ASN 452 HA ASN 452 -18.034 -9.713 -9.919 31 HB2 ASN 452 2HB ASN 452 -16.006 -11.056 -11.743 32 HB3 ASN 452 1HB ASN 452 -17.100 -11.938 -10.689 33 HD21 ASN 452 1HD2 ASN 452 -19.312 -11.971 -11.187 34 HD22 ASN 452 2HD2 ASN 452 -19.883 -11.578 -12.766 35 H THR 453 H THR 453 -17.492 -9.500 -7.883 36 HA THR 453 HA THR 453 -14.851 -9.018 -7.057 37 HB THR 453 HB THR 453 -17.292 -9.601 -5.366 38 HG1 THR 453 1HG THR 453 -16.234 -7.275 -6.574 39 HG21 THR 453 3HG2 THR 453 -15.100 -9.643 -4.169 40 HG22 THR 453 1HG2 THR 453 -16.110 -8.284 -3.672 41 HG23 THR 453 2HG2 THR 453 -14.780 -8.016 -4.780 42 H LYS 454 H LYS 454 -13.360 -10.478 -6.826 43 HA LYS 454 HA LYS 454 -14.050 -13.218 -6.059 44 HB2 LYS 454 2HB LYS 454 -11.501 -12.089 -7.245 45 HB3 LYS 454 1HB LYS 454 -11.760 -13.776 -6.838 46 HG2 LYS 454 2HG LYS 454 -13.259 -12.199 -8.925 47 HG3 LYS 454 1HG LYS 454 -12.018 -13.419 -9.223 48 HD2 LYS 454 2HD LYS 454 -13.440 -15.115 -8.157 49 HD3 LYS 454 1HD LYS 454 -14.660 -13.880 -7.855 50 HE2 LYS 454 2HE LYS 454 -14.912 -13.532 -10.250 51 HE3 LYS 454 1HE LYS 454 -13.696 -14.769 -10.558 52 HZ1 LYS 454 3HZ LYS 454 -15.929 -15.642 -10.770 53 HZ2 LYS 454 1HZ LYS 454 -16.285 -15.203 -9.181 54 HZ3 LYS 454 2HZ LYS 454 -15.125 -16.395 -9.496 55 H LYS 455 H LYS 455 -12.761 -14.230 -4.435 56 HA LYS 455 HA LYS 455 -12.170 -12.370 -2.301 57 HB2 LYS 455 2HB LYS 455 -12.011 -15.388 -2.324 58 HB3 LYS 455 1HB LYS 455 -11.937 -14.354 -0.904 59 HG2 LYS 455 2HG LYS 455 -14.240 -13.614 -1.367 60 HG3 LYS 455 1HG LYS 455 -14.279 -14.728 -2.734 61 HD2 LYS 455 2HD LYS 455 -13.830 -16.592 -1.182 62 HD3 LYS 455 1HD LYS 455 -13.915 -15.458 0.166 63 HE2 LYS 455 2HE LYS 455 -16.042 -16.605 -0.098 64 HE3 LYS 455 1HE LYS 455 -16.217 -14.891 -0.462 65 HZ1 LYS 455 3HZ LYS 455 -15.930 -17.057 -2.481 66 HZ2 LYS 455 1HZ LYS 455 -16.116 -15.424 -2.831 67 HZ3 LYS 455 2HZ LYS 455 -17.365 -16.276 -2.094 68 H VAL 456 H VAL 456 -10.324 -11.357 -2.990 69 HA VAL 456 HA VAL 456 -7.894 -12.970 -2.951 70 HB VAL 456 HB VAL 456 -6.978 -11.846 -4.961 71 HG11 VAL 456 1HG1 VAL 456 -9.546 -13.324 -5.501 72 HG12 VAL 456 2HG1 VAL 456 -7.955 -14.047 -5.262 73 HG13 VAL 456 3HG1 VAL 456 -8.266 -13.041 -6.677 74 HG21 VAL 456 3HG2 VAL 456 -8.325 -9.817 -4.942 75 HG22 VAL 456 1HG2 VAL 456 -9.773 -10.753 -5.310 76 HG23 VAL 456 2HG2 VAL 456 -8.475 -10.632 -6.500 77 H GLY 457 H GLY 457 -5.944 -11.546 -2.984 78 HA2 GLY 457 2HA GLY 457 -6.425 -9.167 -1.365 79 HA3 GLY 457 1HA GLY 457 -4.896 -10.042 -1.509 80 H LYS 458 H LYS 458 -6.048 -7.210 -2.187 81 HA LYS 458 HA LYS 458 -4.943 -7.116 -4.907 82 HB2 LYS 458 2HB LYS 458 -7.020 -5.374 -3.618 83 HB3 LYS 458 1HB LYS 458 -6.319 -5.094 -5.204 84 HG2 LYS 458 2HG LYS 458 -7.234 -7.154 -6.017 85 HG3 LYS 458 1HG LYS 458 -7.848 -7.547 -4.406 86 HD2 LYS 458 2HD LYS 458 -9.266 -5.608 -4.451 87 HD3 LYS 458 1HD LYS 458 -8.637 -5.147 -6.037 88 HE2 LYS 458 2HE LYS 458 -9.532 -7.163 -7.007 89 HE3 LYS 458 1HE LYS 458 -10.063 -7.719 -5.421 90 HZ1 LYS 458 3HZ LYS 458 -11.863 -6.769 -6.693 91 HZ2 LYS 458 1HZ LYS 458 -11.059 -5.293 -6.807 92 HZ3 LYS 458 2HZ LYS 458 -11.576 -5.863 -5.307 93 H ARG 459 H ARG 459 -3.649 -5.437 -5.454 94 HA ARG 459 HA ARG 459 -2.583 -3.887 -3.232 95 HB2 ARG 459 2HB ARG 459 -1.337 -4.677 -5.850 96 HB3 ARG 459 1HB ARG 459 -0.679 -3.441 -4.793 97 HG2 ARG 459 2HG ARG 459 -0.379 -5.108 -3.038 98 HG3 ARG 459 1HG ARG 459 -1.069 -6.329 -4.091 99 HD2 ARG 459 2HD ARG 459 0.728 -5.947 -5.729 100 HD3 ARG 459 1HD ARG 459 1.390 -4.693 -4.695 101 HE ARG 459 HE ARG 459 1.266 -7.172 -3.319 102 HH11 ARG 459 1HH1 ARG 459 3.100 -5.411 -5.762 103 HH12 ARG 459 2HH1 ARG 459 4.555 -6.239 -5.539 104 HH21 ARG 459 1HH2 ARG 459 3.269 -8.369 -2.979 105 HH22 ARG 459 2HH2 ARG 459 4.641 -7.995 -3.913 106 H LEU 460 H LEU 460 -2.811 -1.893 -3.257 107 HA LEU 460 HA LEU 460 -3.922 -0.513 -5.644 108 HB2 LEU 460 2HB LEU 460 -4.750 -0.034 -2.783 109 HB3 LEU 460 1HB LEU 460 -5.372 0.794 -4.185 110 HG LEU 460 HG LEU 460 -5.811 -2.123 -3.529 111 HD11 LEU 460 1HD1 LEU 460 -7.690 0.228 -3.440 112 HD12 LEU 460 2HD1 LEU 460 -7.030 -0.633 -2.049 113 HD13 LEU 460 3HD1 LEU 460 -8.127 -1.458 -3.156 114 HD21 LEU 460 3HD2 LEU 460 -6.872 -0.430 -5.793 115 HD22 LEU 460 1HD2 LEU 460 -7.395 -2.072 -5.409 116 HD23 LEU 460 2HD2 LEU 460 -5.741 -1.775 -5.928 117 H ASN 461 H ASN 461 -3.068 1.489 -6.006 118 HA ASN 461 HA ASN 461 -1.207 2.476 -3.966 119 HB2 ASN 461 2HB ASN 461 0.222 3.458 -5.709 120 HB3 ASN 461 1HB ASN 461 0.083 1.729 -5.937 121 HD21 ASN 461 1HD2 ASN 461 -0.578 4.849 -7.233 122 HD22 ASN 461 2HD2 ASN 461 -1.125 4.325 -8.779 123 H ILE 462 H ILE 462 -1.629 4.291 -3.094 124 HA ILE 462 HA ILE 462 -3.539 6.035 -4.487 125 HB ILE 462 HB ILE 462 -3.154 5.806 -1.466 126 HG12 ILE 462 2HG1 ILE 462 -5.606 5.021 -1.511 127 HG13 ILE 462 1HG1 ILE 462 -5.369 4.748 -3.224 128 HG21 ILE 462 1HG2 ILE 462 -3.794 8.039 -2.147 129 HG22 ILE 462 2HG2 ILE 462 -5.114 7.252 -1.274 130 HG23 ILE 462 3HG2 ILE 462 -5.170 7.386 -3.032 131 HD11 ILE 462 3HD1 ILE 462 -5.191 2.711 -1.948 132 HD12 ILE 462 1HD1 ILE 462 -3.877 3.399 -0.997 133 HD13 ILE 462 2HD1 ILE 462 -3.646 3.095 -2.725 134 H GLN 463 H GLN 463 -2.851 8.093 -4.883 135 HA GLN 463 HA GLN 463 -0.230 8.897 -3.871 136 HB2 GLN 463 2HB GLN 463 -2.134 10.241 -5.793 137 HB3 GLN 463 1HB GLN 463 -0.553 10.860 -5.353 138 HG2 GLN 463 2HG GLN 463 0.528 9.067 -6.355 139 HG3 GLN 463 1HG GLN 463 -0.991 8.200 -6.691 140 HE21 GLN 463 1HE2 GLN 463 1.191 10.696 -7.645 141 HE22 GLN 463 2HE2 GLN 463 0.397 11.108 -9.119 142 H LEU 464 H LEU 464 -0.048 10.195 -2.163 143 HA LEU 464 HA LEU 464 -2.412 11.762 -1.430 144 HB2 LEU 464 2HB LEU 464 -0.359 10.563 0.416 145 HB3 LEU 464 1HB LEU 464 -1.602 11.676 0.932 146 HG LEU 464 HG LEU 464 -2.330 9.582 1.615 147 HD11 LEU 464 1HD1 LEU 464 -4.113 10.794 0.659 148 HD12 LEU 464 2HD1 LEU 464 -4.326 9.071 0.342 149 HD13 LEU 464 3HD1 LEU 464 -3.762 10.136 -0.940 150 HD21 LEU 464 3HD2 LEU 464 -0.797 8.172 0.405 151 HD22 LEU 464 1HD2 LEU 464 -1.659 8.472 -1.104 152 HD23 LEU 464 2HD2 LEU 464 -2.444 7.576 0.200 153 H LYS 465 H LYS 465 -2.171 13.849 -1.097 154 HA LYS 465 HA LYS 465 0.533 15.041 -1.339 155 HB2 LYS 465 2HB LYS 465 -1.137 15.727 -3.058 156 HB3 LYS 465 1HB LYS 465 -2.189 16.241 -1.738 157 HG2 LYS 465 2HG LYS 465 -0.610 17.934 -1.065 158 HG3 LYS 465 1HG LYS 465 0.538 17.398 -2.293 159 HD2 LYS 465 2HD LYS 465 -0.650 19.387 -3.022 160 HD3 LYS 465 1HD LYS 465 -1.075 18.014 -4.042 161 HE2 LYS 465 2HE LYS 465 -3.153 17.716 -2.807 162 HE3 LYS 465 1HE LYS 465 -2.721 19.049 -1.736 163 HZ1 LYS 465 3HZ LYS 465 -2.777 20.529 -3.615 164 HZ2 LYS 465 1HZ LYS 465 -4.251 19.724 -3.455 165 HZ3 LYS 465 2HZ LYS 465 -3.175 19.259 -4.653 166 H LYS 466 H LYS 466 1.270 16.209 0.193 167 HA LYS 466 HA LYS 466 0.033 15.822 2.721 168 HB2 LYS 466 2HB LYS 466 2.658 17.038 1.977 169 HB3 LYS 466 1HB LYS 466 2.013 17.144 3.599 170 HG2 LYS 466 2HG LYS 466 3.575 15.296 3.433 171 HG3 LYS 466 1HG LYS 466 1.951 14.699 3.748 172 HD2 LYS 466 2HD LYS 466 3.102 13.313 2.109 173 HD3 LYS 466 1HD LYS 466 1.716 14.149 1.392 174 HE2 LYS 466 2HE LYS 466 3.702 14.153 -0.020 175 HE3 LYS 466 1HE LYS 466 3.139 15.771 0.385 176 HZ1 LYS 466 3HZ LYS 466 4.856 15.797 2.177 177 HZ2 LYS 466 1HZ LYS 466 5.480 15.754 0.660 178 HZ3 LYS 466 2HZ LYS 466 5.473 14.338 1.587 179 H GLY 467 H GLY 467 -1.240 16.944 3.696 180 HA2 GLY 467 2HA GLY 467 -1.419 19.805 3.122 181 HA3 GLY 467 1HA GLY 467 -2.696 18.845 3.882 182 H THR 468 H THR 468 -2.814 20.108 5.762 183 HA THR 468 HA THR 468 -0.553 20.773 7.320 184 HB THR 468 HB THR 468 -3.442 20.519 8.204 185 HG1 THR 468 1HG THR 468 -2.032 22.357 6.686 186 HG21 THR 468 3HG2 THR 468 -1.843 20.666 10.087 187 HG22 THR 468 1HG2 THR 468 -2.806 22.137 9.948 188 HG23 THR 468 2HG2 THR 468 -1.143 22.116 9.367 189 H GLU 469 H GLU 469 -2.741 17.955 7.353 190 HA GLU 469 HA GLU 469 -1.353 16.881 9.661 191 HB2 GLU 469 2HB GLU 469 -3.568 15.708 7.981 192 HB3 GLU 469 1HB GLU 469 -2.943 15.022 9.473 193 HG2 GLU 469 2HG GLU 469 -4.379 17.647 9.176 194 HG3 GLU 469 1HG GLU 469 -5.010 16.157 9.880 195 H GLY 470 H GLY 470 -0.472 17.216 6.656 196 HA2 GLY 470 2HA GLY 470 1.143 16.189 5.410 197 HA3 GLY 470 1HA GLY 470 1.289 14.979 6.684 198 H LEU 471 H LEU 471 0.713 13.037 6.164 199 HA LEU 471 HA LEU 471 -0.656 12.517 3.692 200 HB2 LEU 471 2HB LEU 471 0.525 10.701 5.787 201 HB3 LEU 471 1HB LEU 471 -0.359 10.097 4.418 202 HG LEU 471 HG LEU 471 1.942 9.823 3.988 203 HD11 LEU 471 1HD1 LEU 471 0.867 12.106 2.384 204 HD12 LEU 471 2HD1 LEU 471 0.700 10.384 2.087 205 HD13 LEU 471 3HD1 LEU 471 2.288 11.162 1.946 206 HD21 LEU 471 3HD2 LEU 471 2.889 11.413 5.544 207 HD22 LEU 471 1HD2 LEU 471 2.309 12.757 4.558 208 HD23 LEU 471 2HD2 LEU 471 3.557 11.682 3.933 209 H GLY 472 H GLY 472 -1.322 12.317 7.105 210 HA2 GLY 472 2HA GLY 472 -3.498 12.466 8.025 211 HA3 GLY 472 1HA GLY 472 -4.147 12.047 6.446 212 H PHE 473 H PHE 473 -1.611 9.998 7.303 213 HA PHE 473 HA PHE 473 -3.214 8.223 8.870 214 HB2 PHE 473 2HB PHE 473 -3.077 6.300 7.377 215 HB3 PHE 473 1HB PHE 473 -3.899 7.606 6.548 216 HD1 PHE 473 1HD PHE 473 -2.433 9.031 4.957 217 HD2 PHE 473 2HD PHE 473 -1.323 5.154 6.330 218 HE1 PHE 473 1HE PHE 473 -0.886 8.783 3.061 219 HE2 PHE 473 2HE PHE 473 0.229 4.935 4.464 220 HZ PHE 473 HZ PHE 473 0.424 6.789 2.811 221 H SER 474 H SER 474 -1.975 6.463 9.643 222 HA SER 474 HA SER 474 0.910 6.928 9.538 223 HB2 SER 474 2HB SER 474 -0.073 7.822 11.659 224 HB3 SER 474 1HB SER 474 -0.760 6.237 11.989 225 HG SER 474 HG SER 474 1.983 6.906 11.777 226 H ILE 475 H ILE 475 2.046 4.879 10.270 227 HA ILE 475 HA ILE 475 0.488 2.513 9.488 228 HB ILE 475 HB ILE 475 2.645 1.540 8.786 229 HG12 ILE 475 2HG1 ILE 475 3.603 4.379 8.878 230 HG13 ILE 475 1HG1 ILE 475 4.031 3.036 9.958 231 HG21 ILE 475 1HG2 ILE 475 1.027 2.262 7.152 232 HG22 ILE 475 2HG2 ILE 475 2.670 2.408 6.605 233 HG23 ILE 475 3HG2 ILE 475 1.777 3.875 7.089 234 HD11 ILE 475 3HD1 ILE 475 5.774 3.548 8.223 235 HD12 ILE 475 1HD1 ILE 475 4.590 3.130 6.986 236 HD13 ILE 475 2HD1 ILE 475 5.149 1.905 8.124 237 H THR 476 H THR 476 0.945 0.662 10.582 238 HA THR 476 HA THR 476 2.514 0.886 13.033 239 HB THR 476 HB THR 476 0.097 1.049 13.613 240 HG1 THR 476 1HG THR 476 0.271 -1.394 14.603 241 HG21 THR 476 3HG2 THR 476 -0.827 -0.147 11.663 242 HG22 THR 476 1HG2 THR 476 -1.434 -0.817 13.175 243 HG23 THR 476 2HG2 THR 476 -0.165 -1.656 12.278 244 H SER 477 H SER 477 3.219 -1.256 13.784 245 HA SER 477 HA SER 477 3.260 -3.236 11.663 246 HB2 SER 477 2HB SER 477 5.546 -3.795 12.426 247 HB3 SER 477 1HB SER 477 5.464 -2.154 11.817 248 HG SER 477 HG SER 477 6.425 -1.785 13.701 249 H ARG 478 H ARG 478 3.064 -5.358 12.505 250 HA ARG 478 HA ARG 478 2.778 -5.489 15.368 251 HB2 ARG 478 2HB ARG 478 0.702 -6.834 15.194 252 HB3 ARG 478 1HB ARG 478 0.521 -5.176 14.659 253 HG2 ARG 478 2HG ARG 478 0.727 -5.998 12.311 254 HG3 ARG 478 1HG ARG 478 0.689 -7.643 12.950 255 HD2 ARG 478 2HD ARG 478 -1.478 -7.155 14.015 256 HD3 ARG 478 1HD ARG 478 -1.439 -5.541 13.312 257 HE ARG 478 HE ARG 478 -1.241 -7.818 11.538 258 HH11 ARG 478 1HH1 ARG 478 -3.196 -5.114 12.748 259 HH12 ARG 478 2HH1 ARG 478 -4.445 -5.323 11.620 260 HH21 ARG 478 1HH2 ARG 478 -2.971 -8.095 9.954 261 HH22 ARG 478 2HH2 ARG 478 -4.319 -7.059 10.014 262 H ASP 479 H ASP 479 3.715 -7.057 16.254 263 HA ASP 479 HA ASP 479 5.395 -8.706 14.713 264 HB2 ASP 479 2HB ASP 479 6.158 -7.897 16.846 265 HB3 ASP 479 1HB ASP 479 4.840 -8.707 17.681 266 H VAL 480 H VAL 480 4.468 -10.140 13.502 267 HA VAL 480 HA VAL 480 2.836 -12.156 14.805 268 HB VAL 480 HB VAL 480 2.357 -13.035 12.514 269 HG11 VAL 480 1HG1 VAL 480 1.786 -10.096 12.837 270 HG12 VAL 480 2HG1 VAL 480 0.842 -11.426 13.509 271 HG13 VAL 480 3HG1 VAL 480 0.930 -11.202 11.762 272 HG21 VAL 480 3HG2 VAL 480 3.915 -10.625 11.551 273 HG22 VAL 480 1HG2 VAL 480 2.980 -11.719 10.533 274 HG23 VAL 480 2HG2 VAL 480 4.410 -12.309 11.382 275 H THR 481 H THR 481 3.601 -14.178 15.081 276 HA THR 481 HA THR 481 6.452 -14.365 14.792 277 HB THR 481 HB THR 481 4.539 -16.287 16.076 278 HG1 THR 481 1HG THR 481 5.161 -13.838 16.727 279 HG21 THR 481 3HG2 THR 481 6.764 -17.235 15.576 280 HG22 THR 481 1HG2 THR 481 6.544 -17.042 17.316 281 HG23 THR 481 2HG2 THR 481 7.524 -15.884 16.415 282 H ILE 482 H ILE 482 6.994 -14.830 12.838 283 HA ILE 482 HA ILE 482 6.866 -17.402 11.811 284 HB ILE 482 HB ILE 482 4.526 -16.978 11.241 285 HG12 ILE 482 2HG1 ILE 482 4.575 -17.397 8.773 286 HG13 ILE 482 1HG1 ILE 482 6.286 -16.994 8.780 287 HG21 ILE 482 1HG2 ILE 482 4.498 -14.578 11.108 288 HG22 ILE 482 2HG2 ILE 482 3.833 -15.264 9.624 289 HG23 ILE 482 3HG2 ILE 482 5.470 -14.616 9.638 290 HD11 ILE 482 3HD1 ILE 482 5.022 -19.278 10.284 291 HD12 ILE 482 1HD1 ILE 482 6.739 -18.885 10.239 292 HD13 ILE 482 2HD1 ILE 482 5.918 -19.403 8.767 293 H GLY 483 H GLY 483 7.196 -13.965 10.906 294 HA2 GLY 483 2HA GLY 483 9.407 -14.777 9.139 295 HA3 GLY 483 1HA GLY 483 8.433 -13.338 8.901 296 H GLY 484 H GLY 484 10.726 -12.509 8.767 297 HA2 GLY 484 2HA GLY 484 12.035 -12.130 11.333 298 HA3 GLY 484 1HA GLY 484 12.628 -11.605 9.765 299 H SER 485 H SER 485 10.572 -10.075 8.837 300 HA SER 485 HA SER 485 10.691 -7.858 10.725 301 HB2 SER 485 2HB SER 485 11.664 -7.479 8.486 302 HB3 SER 485 1HB SER 485 10.114 -7.873 7.748 303 HG SER 485 HG SER 485 10.167 -5.698 7.864 304 H ALA 486 H ALA 486 8.909 -7.128 11.672 305 HA ALA 486 HA ALA 486 6.417 -8.429 11.373 306 HB1 ALA 486 1HB ALA 486 5.605 -6.722 12.959 307 HB2 ALA 486 2HB ALA 486 7.120 -5.842 12.767 308 HB3 ALA 486 3HB ALA 486 7.118 -7.445 13.499 309 HA PRO 487 HA PRO 487 5.228 -6.146 7.709 310 HB2 PRO 487 2HB PRO 487 2.488 -7.043 8.348 311 HB3 PRO 487 1HB PRO 487 3.459 -7.345 6.904 312 HG2 PRO 487 2HG PRO 487 2.982 -9.279 8.693 313 HG3 PRO 487 1HG PRO 487 4.528 -9.159 7.836 314 HD2 PRO 487 2HD PRO 487 3.850 -8.365 10.637 315 HD3 PRO 487 1HD PRO 487 5.309 -9.154 9.986 316 H ILE 488 H ILE 488 4.193 -4.298 7.135 317 HA ILE 488 HA ILE 488 3.269 -2.615 9.328 318 HB ILE 488 HB ILE 488 4.379 -1.871 6.570 319 HG12 ILE 488 2HG1 ILE 488 5.879 -2.574 8.582 320 HG13 ILE 488 1HG1 ILE 488 6.267 -1.098 7.724 321 HG21 ILE 488 1HG2 ILE 488 4.118 0.395 7.169 322 HG22 ILE 488 2HG2 ILE 488 3.309 -0.145 8.653 323 HG23 ILE 488 3HG2 ILE 488 2.549 -0.447 7.088 324 HD11 ILE 488 3HD1 ILE 488 5.222 0.221 9.458 325 HD12 ILE 488 1HD1 ILE 488 6.417 -0.849 10.187 326 HD13 ILE 488 2HD1 ILE 488 4.689 -1.230 10.290 327 H TYR 489 H TYR 489 1.304 -1.902 9.439 328 HA TYR 489 HA TYR 489 -0.497 -2.071 7.115 329 HB2 TYR 489 2HB TYR 489 -1.202 -2.701 10.006 330 HB3 TYR 489 1HB TYR 489 -2.338 -2.664 8.658 331 HD1 TYR 489 1HD TYR 489 -2.335 -4.388 7.003 332 HD2 TYR 489 2HD TYR 489 0.350 -4.511 10.274 333 HE1 TYR 489 1HE TYR 489 -1.739 -6.764 6.451 334 HE2 TYR 489 2HE TYR 489 0.912 -6.821 9.776 335 HH TYR 489 HH TYR 489 -0.088 -8.723 8.628 336 H VAL 490 H VAL 490 -1.955 -0.374 6.991 337 HA VAL 490 HA VAL 490 -1.162 2.053 8.161 338 HB VAL 490 HB VAL 490 -3.825 1.311 6.917 339 HG11 VAL 490 1HG1 VAL 490 -2.693 4.047 7.564 340 HG12 VAL 490 2HG1 VAL 490 -4.066 3.292 8.369 341 HG13 VAL 490 3HG1 VAL 490 -4.181 3.745 6.668 342 HG21 VAL 490 3HG2 VAL 490 -1.971 1.108 5.390 343 HG22 VAL 490 1HG2 VAL 490 -1.420 2.739 5.804 344 HG23 VAL 490 2HG2 VAL 490 -2.964 2.512 4.986 345 H LYS 491 H LYS 491 -1.399 2.777 10.097 346 HA LYS 491 HA LYS 491 -2.622 1.225 12.155 347 HB2 LYS 491 2HB LYS 491 -0.604 2.493 12.533 348 HB3 LYS 491 1HB LYS 491 -1.434 3.973 12.124 349 HG2 LYS 491 2HG LYS 491 -2.892 3.710 14.073 350 HG3 LYS 491 1HG LYS 491 -2.010 2.242 14.501 351 HD2 LYS 491 2HD LYS 491 0.011 3.482 14.832 352 HD3 LYS 491 1HD LYS 491 -0.739 4.957 14.217 353 HE2 LYS 491 2HE LYS 491 -0.673 4.999 16.648 354 HE3 LYS 491 1HE LYS 491 -2.330 4.909 16.031 355 HZ1 LYS 491 3HZ LYS 491 -2.380 2.560 16.527 356 HZ2 LYS 491 1HZ LYS 491 -1.984 3.405 17.917 357 HZ3 LYS 491 2HZ LYS 491 -0.791 2.586 17.088 358 H ASN 492 H ASN 492 -3.516 4.231 10.509 359 HA ASN 492 HA ASN 492 -6.249 4.073 11.274 360 HB2 ASN 492 2HB ASN 492 -5.321 4.713 13.476 361 HB3 ASN 492 1HB ASN 492 -4.522 6.091 12.742 362 HD21 ASN 492 1HD2 ASN 492 -5.542 7.563 14.025 363 HD22 ASN 492 2HD2 ASN 492 -7.215 7.954 13.904 364 H ILE 493 H ILE 493 -7.443 5.687 10.282 365 HA ILE 493 HA ILE 493 -6.023 7.417 8.389 366 HB ILE 493 HB ILE 493 -8.928 6.495 8.430 367 HG12 ILE 493 2HG1 ILE 493 -7.450 4.651 7.855 368 HG13 ILE 493 1HG1 ILE 493 -8.394 5.182 6.465 369 HG21 ILE 493 1HG2 ILE 493 -7.459 8.075 6.318 370 HG22 ILE 493 2HG2 ILE 493 -8.764 8.684 7.355 371 HG23 ILE 493 3HG2 ILE 493 -9.078 7.429 6.160 372 HD11 ILE 493 3HD1 ILE 493 -6.091 4.661 5.843 373 HD12 ILE 493 1HD1 ILE 493 -5.502 5.863 6.991 374 HD13 ILE 493 2HD1 ILE 493 -6.447 6.368 5.589 375 H LEU 494 H LEU 494 -5.801 9.378 9.245 376 HA LEU 494 HA LEU 494 -7.171 10.216 11.570 377 HB2 LEU 494 2HB LEU 494 -5.531 11.826 9.615 378 HB3 LEU 494 1HB LEU 494 -6.019 12.368 11.204 379 HG LEU 494 HG LEU 494 -4.121 10.096 10.607 380 HD11 LEU 494 1HD1 LEU 494 -3.151 12.276 10.157 381 HD12 LEU 494 2HD1 LEU 494 -2.429 11.561 11.597 382 HD13 LEU 494 3HD1 LEU 494 -3.632 12.837 11.756 383 HD21 LEU 494 3HD2 LEU 494 -5.006 11.262 13.244 384 HD22 LEU 494 1HD2 LEU 494 -3.727 10.067 13.031 385 HD23 LEU 494 2HD2 LEU 494 -5.396 9.654 12.638 386 HA PRO 495 HA PRO 495 -10.886 12.002 9.942 387 HB2 PRO 495 2HB PRO 495 -11.170 14.121 11.661 388 HB3 PRO 495 1HB PRO 495 -11.598 12.457 12.076 389 HG2 PRO 495 2HG PRO 495 -9.111 13.993 12.713 390 HG3 PRO 495 1HG PRO 495 -10.050 12.911 13.758 391 HD2 PRO 495 2HD PRO 495 -7.780 12.103 12.605 392 HD3 PRO 495 1HD PRO 495 -9.162 10.999 12.777 393 H ARG 496 H ARG 496 -7.950 13.696 10.074 394 HA ARG 496 HA ARG 496 -8.841 15.584 8.031 395 HB2 ARG 496 2HB ARG 496 -6.941 16.157 10.318 396 HB3 ARG 496 1HB ARG 496 -7.316 17.277 9.018 397 HG2 ARG 496 2HG ARG 496 -9.224 16.268 11.123 398 HG3 ARG 496 1HG ARG 496 -8.431 17.839 11.113 399 HD2 ARG 496 2HD ARG 496 -9.597 18.401 9.025 400 HD3 ARG 496 1HD ARG 496 -10.386 16.823 9.047 401 HE ARG 496 HE ARG 496 -10.912 17.962 11.477 402 HH11 ARG 496 1HH1 ARG 496 -11.605 18.813 8.104 403 HH12 ARG 496 2HH1 ARG 496 -13.061 19.623 8.453 404 HH21 ARG 496 1HH2 ARG 496 -12.903 19.099 11.965 405 HH22 ARG 496 2HH2 ARG 496 -13.821 19.780 10.703 406 H GLY 497 H GLY 497 -7.423 15.546 6.300 407 HA2 GLY 497 2HA GLY 497 -4.880 15.491 5.980 408 HA3 GLY 497 1HA GLY 497 -5.040 13.862 6.604 409 H ALA 498 H ALA 498 -3.945 13.843 4.294 410 HA ALA 498 HA ALA 498 -5.557 14.194 2.010 411 HB1 ALA 498 1HB ALA 498 -3.011 12.600 2.316 412 HB2 ALA 498 2HB ALA 498 -3.111 14.315 1.958 413 HB3 ALA 498 3HB ALA 498 -3.726 13.137 0.801 414 H ALA 499 H ALA 499 -4.547 11.289 3.752 415 HA ALA 499 HA ALA 499 -5.610 9.398 2.010 416 HB1 ALA 499 1HB ALA 499 -4.016 8.838 3.753 417 HB2 ALA 499 2HB ALA 499 -5.438 7.799 3.826 418 HB3 ALA 499 3HB ALA 499 -5.250 9.119 4.982 419 H ILE 500 H ILE 500 -7.217 11.085 4.644 420 HA ILE 500 HA ILE 500 -9.489 9.373 4.447 421 HB ILE 500 HB ILE 500 -8.910 10.562 6.606 422 HG12 ILE 500 2HG1 ILE 500 -11.674 10.976 5.452 423 HG13 ILE 500 1HG1 ILE 500 -11.079 9.555 6.258 424 HG21 ILE 500 1HG2 ILE 500 -8.329 12.752 5.702 425 HG22 ILE 500 2HG2 ILE 500 -9.608 12.889 6.906 426 HG23 ILE 500 3HG2 ILE 500 -9.999 12.993 5.191 427 HD11 ILE 500 3HD1 ILE 500 -11.421 12.234 7.575 428 HD12 ILE 500 1HD1 ILE 500 -10.872 10.740 8.340 429 HD13 ILE 500 2HD1 ILE 500 -12.518 10.855 7.722 430 H GLN 501 H GLN 501 -8.525 12.391 3.015 431 HA GLN 501 HA GLN 501 -11.098 13.020 2.032 432 HB2 GLN 501 2HB GLN 501 -8.402 14.004 1.121 433 HB3 GLN 501 1HB GLN 501 -9.937 14.641 0.537 434 HG2 GLN 501 2HG GLN 501 -8.864 14.739 3.345 435 HG3 GLN 501 1HG GLN 501 -9.101 16.097 2.246 436 HE21 GLN 501 1HE2 GLN 501 -10.173 15.627 4.890 437 HE22 GLN 501 2HE2 GLN 501 -11.896 15.698 4.746 438 H ASP 502 H ASP 502 -8.380 11.277 0.673 439 HA ASP 502 HA ASP 502 -9.767 10.775 -1.767 440 HB2 ASP 502 2HB ASP 502 -7.360 9.419 -0.537 441 HB3 ASP 502 1HB ASP 502 -8.065 8.879 -2.053 442 H GLY 503 H GLY 503 -9.289 8.867 1.187 443 HA2 GLY 503 2HA GLY 503 -10.702 7.359 2.179 444 HA3 GLY 503 1HA GLY 503 -11.930 7.814 1.014 445 H ARG 504 H ARG 504 -9.066 6.828 -0.413 446 HA ARG 504 HA ARG 504 -10.277 4.311 -1.239 447 HB2 ARG 504 2HB ARG 504 -9.336 5.900 -2.907 448 HB3 ARG 504 1HB ARG 504 -7.768 5.735 -2.154 449 HG2 ARG 504 2HG ARG 504 -7.648 3.413 -2.845 450 HG3 ARG 504 1HG ARG 504 -9.273 3.523 -3.538 451 HD2 ARG 504 2HD ARG 504 -8.532 5.226 -5.086 452 HD3 ARG 504 1HD ARG 504 -6.927 5.222 -4.376 453 HE ARG 504 HE ARG 504 -7.873 2.706 -5.470 454 HH11 ARG 504 1HH1 ARG 504 -6.032 5.679 -6.075 455 HH12 ARG 504 2HH1 ARG 504 -5.064 4.982 -7.282 456 HH21 ARG 504 1HH2 ARG 504 -6.568 1.801 -7.169 457 HH22 ARG 504 2HH2 ARG 504 -5.370 2.745 -7.925 458 H LEU 505 H LEU 505 -7.751 5.639 0.656 459 HA LEU 505 HA LEU 505 -6.542 3.066 1.272 460 HB2 LEU 505 2HB LEU 505 -5.079 4.958 0.755 461 HB3 LEU 505 1HB LEU 505 -5.849 5.913 1.994 462 HG LEU 505 HG LEU 505 -4.886 4.445 3.720 463 HD11 LEU 505 1HD1 LEU 505 -3.526 3.051 1.403 464 HD12 LEU 505 2HD1 LEU 505 -4.693 2.335 2.521 465 HD13 LEU 505 3HD1 LEU 505 -3.133 2.882 3.111 466 HD21 LEU 505 3HD2 LEU 505 -2.917 5.523 1.736 467 HD22 LEU 505 1HD2 LEU 505 -2.587 5.150 3.427 468 HD23 LEU 505 2HD2 LEU 505 -3.722 6.436 3.017 469 H LYS 506 H LYS 506 -6.690 2.221 3.409 470 HA LYS 506 HA LYS 506 -8.261 3.670 5.314 471 HB2 LYS 506 2HB LYS 506 -9.884 2.285 3.921 472 HB3 LYS 506 1HB LYS 506 -8.985 0.869 4.469 473 HG2 LYS 506 2HG LYS 506 -9.610 1.300 6.759 474 HG3 LYS 506 1HG LYS 506 -10.459 2.766 6.262 475 HD2 LYS 506 2HD LYS 506 -11.141 -0.038 5.390 476 HD3 LYS 506 1HD LYS 506 -11.957 0.851 6.679 477 HE2 LYS 506 2HE LYS 506 -12.586 2.572 5.012 478 HE3 LYS 506 1HE LYS 506 -11.853 1.577 3.755 479 HZ1 LYS 506 3HZ LYS 506 -14.261 1.255 3.918 480 HZ2 LYS 506 1HZ LYS 506 -14.086 0.733 5.503 481 HZ3 LYS 506 2HZ LYS 506 -13.424 -0.175 4.251 482 H ALA 507 H ALA 507 -8.249 2.238 7.374 483 HA ALA 507 HA ALA 507 -5.511 1.510 7.797 484 HB1 ALA 507 1HB ALA 507 -6.198 1.255 10.128 485 HB2 ALA 507 2HB ALA 507 -7.883 1.439 9.585 486 HB3 ALA 507 3HB ALA 507 -6.770 2.788 9.427 487 H GLY 508 H GLY 508 -4.726 -0.430 8.488 488 HA2 GLY 508 2HA GLY 508 -4.861 -2.706 9.055 489 HA3 GLY 508 1HA GLY 508 -6.454 -2.833 8.372 490 H ASP 509 H ASP 509 -4.985 -1.195 6.031 491 HA ASP 509 HA ASP 509 -4.284 -3.673 4.797 492 HB2 ASP 509 2HB ASP 509 -4.059 -2.391 2.632 493 HB3 ASP 509 1HB ASP 509 -5.640 -2.339 3.409 494 H ARG 510 H ARG 510 -2.405 -3.809 3.450 495 HA ARG 510 HA ARG 510 -0.242 -3.304 5.369 496 HB2 ARG 510 2HB ARG 510 -0.818 -5.621 4.951 497 HB3 ARG 510 1HB ARG 510 -0.523 -5.435 3.237 498 HG2 ARG 510 2HG ARG 510 1.847 -4.904 3.791 499 HG3 ARG 510 1HG ARG 510 1.481 -5.276 5.475 500 HD2 ARG 510 2HD ARG 510 1.172 -7.183 3.154 501 HD3 ARG 510 1HD ARG 510 2.500 -7.151 4.332 502 HE ARG 510 HE ARG 510 0.487 -7.549 5.952 503 HH11 ARG 510 1HH1 ARG 510 0.945 -8.989 2.758 504 HH12 ARG 510 2HH1 ARG 510 0.298 -10.497 3.208 505 HH21 ARG 510 1HH2 ARG 510 -0.375 -9.605 6.546 506 HH22 ARG 510 2HH2 ARG 510 -0.466 -10.866 5.383 507 H LEU 511 H LEU 511 1.344 -2.000 4.827 508 HA LEU 511 HA LEU 511 1.317 -0.729 2.262 509 HB2 LEU 511 2HB LEU 511 1.989 0.384 4.519 510 HB3 LEU 511 1HB LEU 511 3.466 -0.520 4.371 511 HG LEU 511 HG LEU 511 4.029 0.694 2.262 512 HD11 LEU 511 1HD1 LEU 511 2.747 2.536 1.542 513 HD12 LEU 511 2HD1 LEU 511 1.544 2.244 2.792 514 HD13 LEU 511 3HD1 LEU 511 1.784 1.069 1.497 515 HD21 LEU 511 3HD2 LEU 511 4.796 1.543 4.452 516 HD22 LEU 511 1HD2 LEU 511 3.326 2.517 4.559 517 HD23 LEU 511 2HD2 LEU 511 4.502 2.825 3.282 518 H ILE 512 H ILE 512 2.453 -1.248 0.464 519 HA ILE 512 HA ILE 512 4.230 -3.594 0.623 520 HB ILE 512 HB ILE 512 2.592 -2.541 -1.685 521 HG12 ILE 512 2HG1 ILE 512 1.217 -3.610 0.006 522 HG13 ILE 512 1HG1 ILE 512 1.300 -4.591 -1.440 523 HG21 ILE 512 1HG2 ILE 512 4.349 -4.986 -1.562 524 HG22 ILE 512 2HG2 ILE 512 4.633 -3.533 -2.520 525 HG23 ILE 512 3HG2 ILE 512 3.259 -4.580 -2.885 526 HD11 ILE 512 3HD1 ILE 512 2.954 -6.038 -0.390 527 HD12 ILE 512 1HD1 ILE 512 1.458 -5.988 0.529 528 HD13 ILE 512 2HD1 ILE 512 2.868 -5.085 1.096 529 H GLU 513 H GLU 513 3.837 -0.551 -1.231 530 HA GLU 513 HA GLU 513 6.681 -0.155 -1.214 531 HB2 GLU 513 2HB GLU 513 6.938 -0.118 -3.650 532 HB3 GLU 513 1HB GLU 513 6.528 -1.721 -3.062 533 HG2 GLU 513 2HG GLU 513 4.221 -1.322 -3.692 534 HG3 GLU 513 1HG GLU 513 4.705 0.254 -4.327 535 H VAL 514 H VAL 514 7.311 1.773 -1.919 536 HA VAL 514 HA VAL 514 5.179 3.759 -2.287 537 HB VAL 514 HB VAL 514 6.143 4.031 -0.012 538 HG11 VAL 514 1HG1 VAL 514 8.425 4.827 0.328 539 HG12 VAL 514 2HG1 VAL 514 8.728 4.673 -1.402 540 HG13 VAL 514 3HG1 VAL 514 8.436 3.228 -0.433 541 HG21 VAL 514 3HG2 VAL 514 6.639 6.423 -0.136 542 HG22 VAL 514 1HG2 VAL 514 5.269 5.979 -1.164 543 HG23 VAL 514 2HG2 VAL 514 6.848 6.278 -1.881 544 H ASN 515 H ASN 515 5.239 4.673 -4.144 545 HA ASN 515 HA ASN 515 5.893 5.465 -6.168 546 HB2 ASN 515 2HB ASN 515 8.313 6.301 -4.553 547 HB3 ASN 515 1HB ASN 515 8.037 6.816 -6.209 548 HD21 ASN 515 1HD2 ASN 515 7.897 8.963 -5.663 549 HD22 ASN 515 2HD2 ASN 515 6.525 9.628 -4.829 550 H GLY 516 H GLY 516 6.707 2.672 -5.477 551 HA2 GLY 516 2HA GLY 516 7.470 1.161 -7.185 552 HA3 GLY 516 1HA GLY 516 8.640 2.377 -7.674 553 H VAL 517 H VAL 517 8.968 2.633 -4.522 554 HA VAL 517 HA VAL 517 11.217 0.806 -4.461 555 HB VAL 517 HB VAL 517 10.243 2.756 -2.352 556 HG11 VAL 517 1HG1 VAL 517 12.874 1.291 -2.590 557 HG12 VAL 517 2HG1 VAL 517 11.611 0.969 -1.403 558 HG13 VAL 517 3HG1 VAL 517 12.481 2.504 -1.369 559 HG21 VAL 517 3HG2 VAL 517 10.899 3.912 -4.392 560 HG22 VAL 517 1HG2 VAL 517 12.436 3.046 -4.404 561 HG23 VAL 517 2HG2 VAL 517 12.079 4.195 -3.113 562 H ASP 518 H ASP 518 11.049 -1.157 -3.784 563 HA ASP 518 HA ASP 518 8.617 -2.176 -2.671 564 HB2 ASP 518 2HB ASP 518 11.288 -3.596 -2.880 565 HB3 ASP 518 1HB ASP 518 9.718 -4.335 -2.651 566 H LEU 519 H LEU 519 8.098 -2.421 -0.572 567 HA LEU 519 HA LEU 519 10.291 -2.304 1.298 568 HB2 LEU 519 2HB LEU 519 9.068 -0.673 2.678 569 HB3 LEU 519 1HB LEU 519 9.612 -0.064 1.132 570 HG LEU 519 HG LEU 519 7.218 -0.740 0.397 571 HD11 LEU 519 1HD1 LEU 519 6.676 -0.209 3.267 572 HD12 LEU 519 2HD1 LEU 519 6.484 -1.758 2.404 573 HD13 LEU 519 3HD1 LEU 519 5.534 -0.351 1.926 574 HD21 LEU 519 3HD2 LEU 519 7.849 1.788 1.888 575 HD22 LEU 519 1HD2 LEU 519 6.439 1.519 0.836 576 HD23 LEU 519 2HD2 LEU 519 8.050 1.409 0.158 577 H ALA 520 H ALA 520 7.933 -4.156 0.298 578 HA ALA 520 HA ALA 520 6.521 -4.808 2.693 579 HB1 ALA 520 1HB ALA 520 5.588 -5.264 0.457 580 HB2 ALA 520 2HB ALA 520 5.659 -6.721 1.450 581 HB3 ALA 520 3HB ALA 520 6.856 -6.461 0.183 582 H GLY 521 H GLY 521 9.612 -5.444 1.612 583 HA2 GLY 521 2HA GLY 521 9.909 -7.673 3.522 584 HA3 GLY 521 1HA GLY 521 10.934 -7.454 2.102 585 H LYS 522 H LYS 522 10.072 -4.587 3.619 586 HA LYS 522 HA LYS 522 12.792 -4.235 4.597 587 HB2 LYS 522 2HB LYS 522 10.548 -2.272 4.184 588 HB3 LYS 522 1HB LYS 522 12.084 -1.853 4.924 589 HG2 LYS 522 2HG LYS 522 11.754 -2.978 2.177 590 HG3 LYS 522 1HG LYS 522 11.957 -1.244 2.532 591 HD2 LYS 522 2HD LYS 522 14.093 -1.861 3.612 592 HD3 LYS 522 1HD LYS 522 13.858 -3.509 3.072 593 HE2 LYS 522 2HE LYS 522 14.090 -1.083 1.276 594 HE3 LYS 522 1HE LYS 522 15.307 -2.334 1.481 595 HZ1 LYS 522 3HZ LYS 522 12.609 -2.681 0.226 596 HZ2 LYS 522 1HZ LYS 522 13.702 -3.938 0.528 597 HZ3 LYS 522 2HZ LYS 522 14.096 -2.700 -0.527 598 H SER 523 H SER 523 13.129 -3.152 6.665 599 HA SER 523 HA SER 523 11.417 -4.445 8.517 600 HB2 SER 523 2HB SER 523 13.933 -4.402 8.720 601 HB3 SER 523 1HB SER 523 13.819 -2.679 9.055 602 HG SER 523 HG SER 523 13.014 -3.075 11.013 603 H GLN 524 H GLN 524 10.422 -3.068 10.301 604 HA GLN 524 HA GLN 524 8.797 -1.118 9.202 605 HB2 GLN 524 2HB GLN 524 8.118 -0.510 11.459 606 HB3 GLN 524 1HB GLN 524 8.198 -2.255 11.275 607 HG2 GLN 524 2HG GLN 524 10.270 -2.330 12.434 608 HG3 GLN 524 1HG GLN 524 10.391 -0.597 12.498 609 HE21 GLN 524 1HE2 GLN 524 10.336 -2.552 14.614 610 HE22 GLN 524 2HE2 GLN 524 9.031 -2.131 15.656 611 H GLU 525 H GLU 525 11.818 -0.758 10.880 612 HA GLU 525 HA GLU 525 11.711 1.960 11.462 613 HB2 GLU 525 2HB GLU 525 14.102 0.361 10.697 614 HB3 GLU 525 1HB GLU 525 14.164 1.894 11.609 615 HG2 GLU 525 2HG GLU 525 14.497 0.345 13.253 616 HG3 GLU 525 1HG GLU 525 12.731 0.371 13.262 617 H GLU 526 H GLU 526 12.615 0.296 8.530 618 HA GLU 526 HA GLU 526 13.835 2.399 7.170 619 HB2 GLU 526 2HB GLU 526 12.254 0.080 6.077 620 HB3 GLU 526 1HB GLU 526 13.348 1.098 5.154 621 HG2 GLU 526 2HG GLU 526 14.148 -0.633 7.479 622 HG3 GLU 526 1HG GLU 526 14.309 -1.064 5.777 623 H VAL 527 H VAL 527 10.564 1.108 7.178 624 HA VAL 527 HA VAL 527 9.602 3.126 5.398 625 HB VAL 527 HB VAL 527 7.480 1.962 5.398 626 HG11 VAL 527 1HG1 VAL 527 8.289 -0.180 4.531 627 HG12 VAL 527 2HG1 VAL 527 9.851 0.140 5.280 628 HG13 VAL 527 3HG1 VAL 527 9.284 1.174 3.961 629 HG21 VAL 527 3HG2 VAL 527 8.734 0.153 7.438 630 HG22 VAL 527 1HG2 VAL 527 7.202 -0.078 6.582 631 HG23 VAL 527 2HG2 VAL 527 7.371 1.253 7.738 632 H VAL 528 H VAL 528 9.303 2.526 8.841 633 HA VAL 528 HA VAL 528 7.255 4.408 9.274 634 HB VAL 528 HB VAL 528 9.354 3.381 11.240 635 HG11 VAL 528 1HG1 VAL 528 8.472 5.549 11.998 636 HG12 VAL 528 2HG1 VAL 528 7.886 4.237 13.020 637 HG13 VAL 528 3HG1 VAL 528 6.824 4.948 11.808 638 HG21 VAL 528 3HG2 VAL 528 6.443 2.631 10.861 639 HG22 VAL 528 1HG2 VAL 528 7.513 1.988 12.105 640 HG23 VAL 528 2HG2 VAL 528 7.828 1.646 10.407 641 H SER 529 H SER 529 10.751 4.704 9.102 642 HA SER 529 HA SER 529 10.764 7.400 9.896 643 HB2 SER 529 2HB SER 529 12.813 5.949 9.900 644 HB3 SER 529 1HB SER 529 12.790 5.970 8.140 645 HG SER 529 HG SER 529 14.165 7.498 9.341 646 H LEU 530 H LEU 530 10.163 5.805 6.864 647 HA LEU 530 HA LEU 530 10.311 8.091 5.185 648 HB2 LEU 530 2HB LEU 530 8.836 5.532 5.005 649 HB3 LEU 530 1HB LEU 530 8.828 6.673 3.665 650 HG LEU 530 HG LEU 530 11.187 5.125 4.779 651 HD11 LEU 530 1HD1 LEU 530 9.794 4.991 2.109 652 HD12 LEU 530 2HD1 LEU 530 9.663 3.799 3.400 653 HD13 LEU 530 3HD1 LEU 530 11.207 4.050 2.586 654 HD21 LEU 530 3HD2 LEU 530 12.479 6.112 2.943 655 HD22 LEU 530 1HD2 LEU 530 11.919 7.345 4.074 656 HD23 LEU 530 2HD2 LEU 530 11.102 7.130 2.526 657 H LEU 531 H LEU 531 7.494 6.415 6.680 658 HA LEU 531 HA LEU 531 5.652 8.319 5.867 659 HB2 LEU 531 2HB LEU 531 5.591 6.094 7.910 660 HB3 LEU 531 1HB LEU 531 4.278 7.260 7.819 661 HG LEU 531 HG LEU 531 3.881 5.162 6.674 662 HD11 LEU 531 1HD1 LEU 531 2.686 7.167 5.953 663 HD12 LEU 531 2HD1 LEU 531 3.010 6.130 4.565 664 HD13 LEU 531 3HD1 LEU 531 3.988 7.568 4.833 665 HD21 LEU 531 3HD2 LEU 531 6.051 6.027 4.764 666 HD22 LEU 531 1HD2 LEU 531 4.946 4.677 4.499 667 HD23 LEU 531 2HD2 LEU 531 6.091 4.628 5.836 668 H ARG 532 H ARG 532 7.717 8.225 8.616 669 HA ARG 532 HA ARG 532 6.563 10.449 9.965 670 HB2 ARG 532 2HB ARG 532 7.969 8.792 11.120 671 HB3 ARG 532 1HB ARG 532 9.314 9.166 10.082 672 HG2 ARG 532 2HG ARG 532 8.157 11.141 12.059 673 HG3 ARG 532 1HG ARG 532 9.446 10.016 12.461 674 HD2 ARG 532 2HD ARG 532 9.521 12.173 10.359 675 HD3 ARG 532 1HD ARG 532 10.376 12.186 11.903 676 HE ARG 532 HE ARG 532 11.278 9.935 10.751 677 HH11 ARG 532 1HH1 ARG 532 11.119 13.278 9.600 678 HH12 ARG 532 2HH1 ARG 532 12.437 13.123 8.541 679 HH21 ARG 532 1HH2 ARG 532 13.058 9.689 9.244 680 HH22 ARG 532 2HH2 ARG 532 13.557 11.007 8.310 681 H SER 533 H SER 533 9.187 10.043 7.618 682 HA SER 533 HA SER 533 10.150 12.674 7.588 683 HB2 SER 533 2HB SER 533 11.356 10.664 6.750 684 HB3 SER 533 1HB SER 533 10.244 10.594 5.392 685 HG SER 533 HG SER 533 12.461 11.908 5.621 686 H THR 534 H THR 534 7.590 11.090 5.873 687 HA THR 534 HA THR 534 5.868 11.683 4.698 688 HB THR 534 HB THR 534 4.918 13.983 4.684 689 HG1 THR 534 1HG THR 534 7.455 14.631 5.661 690 HG21 THR 534 3HG2 THR 534 4.433 12.517 6.569 691 HG22 THR 534 1HG2 THR 534 4.553 14.189 7.108 692 HG23 THR 534 2HG2 THR 534 5.887 13.076 7.396 693 H LYS 535 H LYS 535 8.841 13.044 3.827 694 HA LYS 535 HA LYS 535 9.916 13.420 1.894 695 HB2 LYS 535 2HB LYS 535 9.108 11.011 1.597 696 HB3 LYS 535 1HB LYS 535 7.845 11.663 0.569 697 HG2 LYS 535 2HG LYS 535 9.644 10.829 -0.792 698 HG3 LYS 535 1HG LYS 535 9.593 12.592 -0.924 699 HD2 LYS 535 2HD LYS 535 11.432 12.789 0.658 700 HD3 LYS 535 1HD LYS 535 11.445 11.043 0.907 701 HE2 LYS 535 2HE LYS 535 12.045 10.746 -1.448 702 HE3 LYS 535 1HE LYS 535 12.072 12.496 -1.664 703 HZ1 LYS 535 3HZ LYS 535 13.866 12.614 -0.030 704 HZ2 LYS 535 1HZ LYS 535 14.301 11.602 -1.302 705 HZ3 LYS 535 2HZ LYS 535 13.837 10.935 0.152 706 H MET 536 H MET 536 9.842 15.422 1.177 707 HA MET 536 HA MET 536 7.365 16.770 0.615 708 HB2 MET 536 2HB MET 536 9.403 17.719 1.792 709 HB3 MET 536 1HB MET 536 10.136 17.770 0.189 710 HG2 MET 536 2HG MET 536 8.432 19.314 -0.588 711 HG3 MET 536 1HG MET 536 7.640 19.259 0.986 712 HE1 MET 536 3HE MET 536 10.176 19.235 2.949 713 HE2 MET 536 1HE MET 536 8.744 20.224 3.230 714 HE3 MET 536 2HE MET 536 10.347 20.954 3.276 715 H GLU 537 H GLU 537 7.584 14.798 -1.253 716 HA GLU 537 HA GLU 537 8.545 15.785 -3.743 717 HB2 GLU 537 2HB GLU 537 8.136 13.346 -3.164 718 HB3 GLU 537 1HB GLU 537 6.422 13.668 -3.216 719 HG2 GLU 537 2HG GLU 537 8.348 13.728 -5.552 720 HG3 GLU 537 1HG GLU 537 7.166 12.484 -5.209 721 H GLY 538 H GLY 538 5.497 15.459 -2.121 722 HA2 GLY 538 2HA GLY 538 3.873 17.399 -2.371 723 HA3 GLY 538 1HA GLY 538 3.986 17.046 -4.093 724 H THR 539 H THR 539 3.951 14.622 -4.513 725 HA THR 539 HA THR 539 1.734 13.517 -2.982 726 HB THR 539 HB THR 539 1.406 12.092 -5.038 727 HG1 THR 539 1HG THR 539 3.473 13.499 -5.908 728 HG21 THR 539 3HG2 THR 539 -0.023 13.725 -6.149 729 HG22 THR 539 1HG2 THR 539 0.745 15.037 -5.231 730 HG23 THR 539 2HG2 THR 539 -0.199 13.790 -4.401 731 H VAL 540 H VAL 540 2.068 11.668 -2.066 732 HA VAL 540 HA VAL 540 4.469 10.173 -2.829 733 HB VAL 540 HB VAL 540 3.047 10.196 -0.142 734 HG11 VAL 540 1HG1 VAL 540 4.102 8.082 -0.715 735 HG12 VAL 540 2HG1 VAL 540 4.936 8.867 0.635 736 HG13 VAL 540 3HG1 VAL 540 5.637 8.907 -0.991 737 HG21 VAL 540 3HG2 VAL 540 4.997 11.388 0.713 738 HG22 VAL 540 1HG2 VAL 540 4.210 12.285 -0.591 739 HG23 VAL 540 2HG2 VAL 540 5.699 11.405 -0.917 740 H SER 541 H SER 541 4.076 8.154 -3.586 741 HA SER 541 HA SER 541 1.284 7.401 -3.598 742 HB2 SER 541 2HB SER 541 3.577 6.364 -5.277 743 HB3 SER 541 1HB SER 541 1.866 6.001 -5.503 744 HG SER 541 HG SER 541 3.145 8.496 -5.706 745 H LEU 542 H LEU 542 0.744 6.055 -2.058 746 HA LEU 542 HA LEU 542 2.715 4.098 -1.165 747 HB2 LEU 542 2HB LEU 542 0.222 5.100 0.221 748 HB3 LEU 542 1HB LEU 542 1.141 3.729 0.785 749 HG LEU 542 HG LEU 542 1.715 5.544 2.154 750 HD11 LEU 542 1HD1 LEU 542 4.088 5.895 1.800 751 HD12 LEU 542 2HD1 LEU 542 3.949 5.123 0.222 752 HD13 LEU 542 3HD1 LEU 542 3.600 4.211 1.684 753 HD21 LEU 542 3HD2 LEU 542 0.929 7.398 0.823 754 HD22 LEU 542 1HD2 LEU 542 2.231 7.155 -0.333 755 HD23 LEU 542 2HD2 LEU 542 2.600 7.695 1.309 756 H LEU 543 H LEU 543 2.539 2.210 -1.913 757 HA LEU 543 HA LEU 543 -0.014 1.357 -3.006 758 HB2 LEU 543 2HB LEU 543 2.271 1.435 -4.351 759 HB3 LEU 543 1HB LEU 543 2.671 0.118 -3.339 760 HG LEU 543 HG LEU 543 0.196 -0.161 -5.007 761 HD11 LEU 543 1HD1 LEU 543 3.021 -0.763 -5.872 762 HD12 LEU 543 2HD1 LEU 543 1.989 0.499 -6.542 763 HD13 LEU 543 3HD1 LEU 543 1.552 -1.196 -6.746 764 HD21 LEU 543 3HD2 LEU 543 0.926 -2.515 -4.930 765 HD22 LEU 543 1HD2 LEU 543 0.545 -1.860 -3.324 766 HD23 LEU 543 2HD2 LEU 543 2.222 -2.074 -3.854 767 H VAL 544 H VAL 544 -1.137 0.050 -1.859 768 HA VAL 544 HA VAL 544 0.131 -1.446 0.330 769 HB VAL 544 HB VAL 544 -1.962 -1.233 1.572 770 HG11 VAL 544 1HG1 VAL 544 -0.881 1.429 0.667 771 HG12 VAL 544 2HG1 VAL 544 -0.278 0.435 2.004 772 HG13 VAL 544 3HG1 VAL 544 -1.882 1.149 2.090 773 HG21 VAL 544 3HG2 VAL 544 -3.480 -1.107 -0.282 774 HG22 VAL 544 1HG2 VAL 544 -2.867 0.490 -0.723 775 HG23 VAL 544 2HG2 VAL 544 -3.749 0.264 0.802 776 H PHE 545 H PHE 545 -0.991 -3.320 0.962 777 HA PHE 545 HA PHE 545 -2.433 -4.729 -1.186 778 HB2 PHE 545 2HB PHE 545 -0.252 -5.702 -0.647 779 HB3 PHE 545 1HB PHE 545 -0.691 -5.776 1.052 780 HD1 PHE 545 1HD PHE 545 -1.385 -7.134 -2.283 781 HD2 PHE 545 2HD PHE 545 -1.924 -7.625 1.896 782 HE1 PHE 545 1HE PHE 545 -2.209 -9.389 -2.676 783 HE2 PHE 545 2HE PHE 545 -2.757 -9.912 1.529 784 HZ PHE 545 HZ PHE 545 -2.905 -10.806 -0.759 785 H ARG 546 H ARG 546 -4.483 -4.877 -0.695 786 HA ARG 546 HA ARG 546 -5.189 -4.836 2.130 787 HB2 ARG 546 2HB ARG 546 -6.184 -3.047 0.785 788 HB3 ARG 546 1HB ARG 546 -6.923 -4.239 -0.267 789 HG2 ARG 546 2HG ARG 546 -8.385 -4.975 1.464 790 HG3 ARG 546 1HG ARG 546 -7.520 -4.029 2.677 791 HD2 ARG 546 2HD ARG 546 -9.026 -2.901 0.317 792 HD3 ARG 546 1HD ARG 546 -9.592 -2.912 1.991 793 HE ARG 546 HE ARG 546 -7.201 -1.685 2.177 794 HH11 ARG 546 1HH1 ARG 546 -10.044 -1.024 0.199 795 HH12 ARG 546 2HH1 ARG 546 -9.718 0.633 0.044 796 HH21 ARG 546 1HH2 ARG 546 -6.740 0.520 1.967 797 HH22 ARG 546 2HH2 ARG 546 -7.783 1.541 1.030 798 H GLN 547 H GLN 547 -5.635 -6.583 3.010 799 HA GLN 547 HA GLN 547 -6.227 -8.976 1.470 800 HB2 GLN 547 2HB GLN 547 -4.331 -9.002 3.021 801 HB3 GLN 547 1HB GLN 547 -5.383 -8.535 4.340 802 HG2 GLN 547 2HG GLN 547 -6.602 -10.661 4.071 803 HG3 GLN 547 1HG GLN 547 -5.456 -11.120 2.811 804 HE21 GLN 547 1HE2 GLN 547 -5.903 -10.528 6.173 805 HE22 GLN 547 2HE2 GLN 547 -4.438 -11.282 6.709 806 H GLU 548 H GLU 548 -8.038 -10.209 1.915 807 HA GLU 548 HA GLU 548 -10.460 -9.056 2.675 808 HB2 GLU 548 2HB GLU 548 -9.591 -11.922 2.891 809 HB3 GLU 548 1HB GLU 548 -11.245 -11.363 2.987 810 HG2 GLU 548 2HG GLU 548 -11.195 -10.660 0.705 811 HG3 GLU 548 1HG GLU 548 -9.469 -11.042 0.587 812 H GLU 549 H GLU 549 -11.428 -8.760 4.619 813 HA GLU 549 HA GLU 549 -9.954 -9.405 7.017 814 HB2 GLU 549 2HB GLU 549 -11.165 -7.190 6.652 815 HB3 GLU 549 1HB GLU 549 -12.672 -8.069 6.693 816 HG2 GLU 549 2HG GLU 549 -10.721 -7.855 8.990 817 HG3 GLU 549 1HG GLU 549 -12.159 -6.866 8.791 818 H ALA 550 H ALA 550 -10.037 -11.550 7.318 819 HA ALA 550 HA ALA 550 -12.631 -12.807 7.661 820 HB1 ALA 550 1HB ALA 550 -10.456 -13.906 5.874 821 HB2 ALA 550 2HB ALA 550 -12.012 -13.269 5.338 822 HB3 ALA 550 3HB ALA 550 -11.946 -14.742 6.308 823 H PHE 551 H PHE 551 -12.221 -15.070 8.572 824 HA PHE 551 HA PHE 551 -10.308 -14.728 10.722 825 HB2 PHE 551 2HB PHE 551 -12.654 -15.320 11.208 826 HB3 PHE 551 1HB PHE 551 -12.465 -16.801 10.289 827 HD1 PHE 551 1HD PHE 551 -11.210 -14.989 13.266 828 HD2 PHE 551 2HD PHE 551 -11.684 -18.745 11.330 829 HE1 PHE 551 1HE PHE 551 -10.498 -16.130 15.317 830 HE2 PHE 551 2HE PHE 551 -10.971 -19.893 13.375 831 HZ PHE 551 HZ PHE 551 -10.375 -18.589 15.374 832 H HIS 552 H HIS 552 -8.485 -15.799 10.833 833 HA HIS 552 HA HIS 552 -7.839 -17.775 8.772 834 HB2 HIS 552 2HB HIS 552 -6.060 -16.394 10.811 835 HB3 HIS 552 1HB HIS 552 -5.497 -17.565 9.629 836 HD1 HIS 552 1HD HIS 552 -4.696 -16.608 7.466 837 HD2 HIS 552 2HD HIS 552 -7.144 -13.969 9.539 838 HE1 HIS 552 1HE HIS 552 -4.634 -14.454 6.179 839 HE2 HIS 552 2HE HIS 552 -6.426 -13.074 7.276 840 HA PRO 553 HA PRO 553 -8.448 -21.061 11.668 841 HB2 PRO 553 2HB PRO 553 -6.784 -22.934 10.537 842 HB3 PRO 553 1HB PRO 553 -8.409 -22.589 9.935 843 HG2 PRO 553 2HG PRO 553 -5.769 -21.665 8.899 844 HG3 PRO 553 1HG PRO 553 -7.229 -22.123 8.010 845 HD2 PRO 553 2HD PRO 553 -6.478 -19.538 8.433 846 HD3 PRO 553 1HD PRO 553 -8.173 -20.033 8.251 847 H ARG 554 H ARG 554 -7.688 -20.983 13.528 848 HA ARG 554 HA ARG 554 -5.062 -20.051 14.093 849 HB2 ARG 554 2HB ARG 554 -7.224 -21.034 15.921 850 HB3 ARG 554 1HB ARG 554 -5.770 -20.192 16.425 851 HG2 ARG 554 2HG ARG 554 -6.464 -18.238 15.146 852 HG3 ARG 554 1HG ARG 554 -7.942 -19.079 14.665 853 HD2 ARG 554 2HD ARG 554 -8.433 -17.626 16.477 854 HD3 ARG 554 1HD ARG 554 -8.523 -19.300 17.027 855 HE ARG 554 HE ARG 554 -5.944 -18.451 17.541 856 HH11 ARG 554 1HH1 ARG 554 -9.203 -17.598 18.703 857 HH12 ARG 554 2HH1 ARG 554 -8.670 -16.974 20.179 858 HH21 ARG 554 1HH2 ARG 554 -5.211 -17.590 19.624 859 HH22 ARG 554 2HH2 ARG 554 -6.345 -16.954 20.710 860 H GLU 555 H GLU 555 -3.363 -21.141 14.628 861 HA GLU 555 HA GLU 555 -3.462 -24.030 14.876 862 HB2 GLU 555 2HB GLU 555 -1.736 -22.837 13.514 863 HB3 GLU 555 1HB GLU 555 -1.145 -22.095 14.995 864 HG2 GLU 555 2HG GLU 555 -0.632 -24.356 15.843 865 HG3 GLU 555 1HG GLU 555 -1.119 -25.008 14.278 866 H MET 556 H MET 556 -4.274 -24.485 16.870 867 HA MET 556 HA MET 556 -3.377 -22.829 19.087 868 HB2 MET 556 2HB MET 556 -5.793 -22.924 18.689 869 HB3 MET 556 1HB MET 556 -5.765 -24.667 18.899 870 HG2 MET 556 2HG MET 556 -5.036 -24.368 21.220 871 HG3 MET 556 1HG MET 556 -5.074 -22.623 21.002 872 HE1 MET 556 3HE MET 556 -7.754 -22.354 19.145 873 HE2 MET 556 1HE MET 556 -7.340 -21.258 20.465 874 HE3 MET 556 2HE MET 556 -8.932 -22.010 20.408 875 H ASN 557 H ASN 557 -2.329 -23.669 20.762 876 HA ASN 557 HA ASN 557 -1.930 -26.559 20.879 877 HB2 ASN 557 2HB ASN 557 0.467 -26.171 21.419 878 HB3 ASN 557 1HB ASN 557 0.056 -25.651 19.791 879 HD21 ASN 557 1HD2 ASN 557 1.148 -24.631 22.941 880 HD22 ASN 557 2HD2 ASN 557 1.444 -23.001 22.480 881 H ALA 558 H ALA 558 -1.581 -27.356 22.958 882 HA ALA 558 HA ALA 558 -2.270 -25.473 25.086 883 HB1 ALA 558 1HB ALA 558 -3.992 -27.179 24.701 884 HB2 ALA 558 2HB ALA 558 -3.221 -27.403 26.272 885 HB3 ALA 558 3HB ALA 558 -2.786 -28.448 24.919 Start of MODEL 13 1 H1 GLY 448 1HT GLY 448 -27.132 -5.033 -16.306 2 H2 GLY 448 2HT GLY 448 -27.306 -3.850 -17.515 3 H3 GLY 448 3HT GLY 448 -25.994 -3.824 -16.458 4 HA2 GLY 448 1HA GLY 448 -26.504 -6.000 -18.374 5 HA3 GLY 448 2HA GLY 448 -25.356 -4.693 -18.620 6 H SER 449 H SER 449 -23.516 -4.578 -17.283 7 HA SER 449 HA SER 449 -22.969 -6.578 -15.346 8 HB2 SER 449 2HB SER 449 -20.991 -7.473 -16.667 9 HB3 SER 449 1HB SER 449 -22.574 -7.987 -17.255 10 HG SER 449 HG SER 449 -22.292 -5.950 -18.612 11 H VAL 450 H VAL 450 -21.011 -6.060 -14.201 12 HA VAL 450 HA VAL 450 -19.921 -3.455 -14.947 13 HB VAL 450 HB VAL 450 -19.472 -3.009 -12.554 14 HG11 VAL 450 1HG1 VAL 450 -22.363 -3.662 -13.096 15 HG12 VAL 450 2HG1 VAL 450 -21.536 -2.161 -13.512 16 HG13 VAL 450 3HG1 VAL 450 -21.777 -2.598 -11.819 17 HG21 VAL 450 3HG2 VAL 450 -19.295 -5.319 -11.778 18 HG22 VAL 450 1HG2 VAL 450 -21.023 -5.542 -12.032 19 HG23 VAL 450 2HG2 VAL 450 -20.453 -4.412 -10.803 20 H TYR 451 H TYR 451 -17.670 -3.142 -14.146 21 HA TYR 451 HA TYR 451 -16.259 -5.664 -14.575 22 HB2 TYR 451 2HB TYR 451 -15.357 -2.856 -15.238 23 HB3 TYR 451 1HB TYR 451 -14.462 -4.336 -15.580 24 HD1 TYR 451 2HD TYR 451 -15.580 -6.056 -17.128 25 HD2 TYR 451 1HD TYR 451 -16.910 -2.030 -16.796 26 HE1 TYR 451 2HE TYR 451 -16.759 -6.275 -19.271 27 HE2 TYR 451 1HE TYR 451 -18.098 -2.242 -18.935 28 HH TYR 451 HH TYR 451 -18.647 -5.239 -20.402 29 H ASN 452 H ASN 452 -14.083 -5.741 -13.614 30 HA ASN 452 HA ASN 452 -12.650 -5.715 -11.906 31 HB2 ASN 452 2HB ASN 452 -14.081 -3.232 -10.929 32 HB3 ASN 452 1HB ASN 452 -12.626 -3.898 -10.210 33 HD21 ASN 452 1HD2 ASN 452 -11.437 -4.581 -12.831 34 HD22 ASN 452 2HD2 ASN 452 -10.974 -3.061 -13.495 35 H THR 453 H THR 453 -13.306 -7.618 -11.188 36 HA THR 453 HA THR 453 -15.426 -7.690 -9.293 37 HB THR 453 HB THR 453 -15.285 -9.597 -10.770 38 HG1 THR 453 1HG THR 453 -14.830 -11.306 -9.115 39 HG21 THR 453 3HG2 THR 453 -13.376 -11.177 -10.775 40 HG22 THR 453 1HG2 THR 453 -12.506 -10.109 -9.673 41 HG23 THR 453 2HG2 THR 453 -12.891 -9.568 -11.306 42 H LYS 454 H LYS 454 -14.714 -6.341 -7.765 43 HA LYS 454 HA LYS 454 -12.223 -6.949 -6.478 44 HB2 LYS 454 2HB LYS 454 -12.563 -4.802 -5.207 45 HB3 LYS 454 1HB LYS 454 -12.374 -4.646 -6.941 46 HG2 LYS 454 2HG LYS 454 -14.800 -4.350 -7.170 47 HG3 LYS 454 1HG LYS 454 -14.980 -4.487 -5.419 48 HD2 LYS 454 2HD LYS 454 -13.516 -2.517 -5.132 49 HD3 LYS 454 1HD LYS 454 -13.366 -2.394 -6.882 50 HE2 LYS 454 2HE LYS 454 -14.990 -0.796 -6.016 51 HE3 LYS 454 1HE LYS 454 -15.756 -1.984 -7.067 52 HZ1 LYS 454 3HZ LYS 454 -17.023 -1.517 -5.016 53 HZ2 LYS 454 1HZ LYS 454 -15.737 -2.106 -4.107 54 HZ3 LYS 454 2HZ LYS 454 -16.570 -3.144 -5.142 55 H LYS 455 H LYS 455 -12.896 -8.870 -5.719 56 HA LYS 455 HA LYS 455 -14.056 -8.639 -3.017 57 HB2 LYS 455 2HB LYS 455 -14.621 -10.842 -5.006 58 HB3 LYS 455 1HB LYS 455 -15.073 -10.887 -3.315 59 HG2 LYS 455 2HG LYS 455 -16.539 -8.974 -3.647 60 HG3 LYS 455 1HG LYS 455 -16.070 -8.906 -5.346 61 HD2 LYS 455 2HD LYS 455 -16.960 -11.133 -5.708 62 HD3 LYS 455 1HD LYS 455 -17.378 -11.262 -3.999 63 HE2 LYS 455 2HE LYS 455 -18.944 -9.433 -4.221 64 HE3 LYS 455 1HE LYS 455 -18.502 -9.206 -5.909 65 HZ1 LYS 455 3HZ LYS 455 -19.790 -11.602 -4.731 66 HZ2 LYS 455 1HZ LYS 455 -19.310 -11.460 -6.334 67 HZ3 LYS 455 2HZ LYS 455 -20.528 -10.461 -5.733 68 H VAL 456 H VAL 456 -11.386 -9.234 -4.706 69 HA VAL 456 HA VAL 456 -10.490 -11.428 -2.971 70 HB VAL 456 HB VAL 456 -8.834 -12.010 -4.718 71 HG11 VAL 456 1HG1 VAL 456 -11.679 -11.975 -5.721 72 HG12 VAL 456 2HG1 VAL 456 -10.951 -13.198 -4.680 73 HG13 VAL 456 3HG1 VAL 456 -10.385 -13.001 -6.339 74 HG21 VAL 456 3HG2 VAL 456 -10.258 -9.935 -6.401 75 HG22 VAL 456 1HG2 VAL 456 -9.029 -11.054 -6.985 76 HG23 VAL 456 2HG2 VAL 456 -8.609 -9.823 -5.791 77 H GLY 457 H GLY 457 -7.896 -11.366 -3.044 78 HA2 GLY 457 2HA GLY 457 -7.178 -8.837 -1.859 79 HA3 GLY 457 1HA GLY 457 -6.185 -10.296 -1.923 80 H LYS 458 H LYS 458 -6.001 -7.313 -2.785 81 HA LYS 458 HA LYS 458 -4.566 -7.884 -5.227 82 HB2 LYS 458 2HB LYS 458 -5.609 -6.096 -6.537 83 HB3 LYS 458 1HB LYS 458 -6.763 -7.349 -6.133 84 HG2 LYS 458 2HG LYS 458 -6.553 -4.699 -4.695 85 HG3 LYS 458 1HG LYS 458 -7.639 -4.998 -6.045 86 HD2 LYS 458 2HD LYS 458 -8.706 -6.801 -4.714 87 HD3 LYS 458 1HD LYS 458 -7.645 -6.393 -3.370 88 HE2 LYS 458 2HE LYS 458 -8.609 -4.152 -3.281 89 HE3 LYS 458 1HE LYS 458 -9.648 -4.542 -4.653 90 HZ1 LYS 458 3HZ LYS 458 -10.696 -6.276 -3.301 91 HZ2 LYS 458 1HZ LYS 458 -10.848 -4.796 -2.556 92 HZ3 LYS 458 2HZ LYS 458 -9.710 -5.892 -2.005 93 H ARG 459 H ARG 459 -3.425 -6.003 -6.044 94 HA ARG 459 HA ARG 459 -2.356 -4.389 -3.840 95 HB2 ARG 459 2HB ARG 459 -1.250 -5.362 -6.435 96 HB3 ARG 459 1HB ARG 459 -0.606 -3.911 -5.705 97 HG2 ARG 459 2HG ARG 459 0.055 -5.147 -3.768 98 HG3 ARG 459 1HG ARG 459 -0.622 -6.642 -4.391 99 HD2 ARG 459 2HD ARG 459 0.892 -6.561 -6.288 100 HD3 ARG 459 1HD ARG 459 1.456 -4.970 -5.800 101 HE ARG 459 HE ARG 459 1.895 -7.358 -4.158 102 HH11 ARG 459 1HH1 ARG 459 3.117 -4.468 -5.851 103 HH12 ARG 459 2HH1 ARG 459 4.680 -4.561 -5.198 104 HH21 ARG 459 1HH2 ARG 459 4.116 -7.533 -3.310 105 HH22 ARG 459 2HH2 ARG 459 5.262 -6.380 -3.767 106 H LEU 460 H LEU 460 -2.613 -2.321 -3.914 107 HA LEU 460 HA LEU 460 -3.551 -1.028 -6.382 108 HB2 LEU 460 2HB LEU 460 -4.727 -0.612 -3.632 109 HB3 LEU 460 1HB LEU 460 -5.160 0.282 -5.065 110 HG LEU 460 HG LEU 460 -5.667 -2.671 -4.661 111 HD11 LEU 460 1HD1 LEU 460 -7.551 -0.325 -4.568 112 HD12 LEU 460 2HD1 LEU 460 -7.036 -1.303 -3.190 113 HD13 LEU 460 3HD1 LEU 460 -8.012 -2.024 -4.465 114 HD21 LEU 460 3HD2 LEU 460 -6.549 -0.787 -6.853 115 HD22 LEU 460 1HD2 LEU 460 -7.056 -2.468 -6.678 116 HD23 LEU 460 2HD2 LEU 460 -5.369 -2.085 -7.017 117 H ASN 461 H ASN 461 -2.750 1.010 -6.641 118 HA ASN 461 HA ASN 461 -1.009 1.945 -4.486 119 HB2 ASN 461 2HB ASN 461 0.346 3.180 -6.134 120 HB3 ASN 461 1HB ASN 461 0.307 1.471 -6.530 121 HD21 ASN 461 1HD2 ASN 461 -0.693 0.821 -8.429 122 HD22 ASN 461 2HD2 ASN 461 -1.195 1.953 -9.629 123 H ILE 462 H ILE 462 -1.507 3.649 -3.492 124 HA ILE 462 HA ILE 462 -3.633 5.359 -4.577 125 HB ILE 462 HB ILE 462 -2.846 4.811 -1.689 126 HG12 ILE 462 2HG1 ILE 462 -5.404 4.059 -3.124 127 HG13 ILE 462 1HG1 ILE 462 -4.055 2.933 -2.876 128 HG21 ILE 462 1HG2 ILE 462 -3.658 7.097 -1.964 129 HG22 ILE 462 2HG2 ILE 462 -4.846 6.127 -1.092 130 HG23 ILE 462 3HG2 ILE 462 -5.090 6.499 -2.797 131 HD11 ILE 462 3HD1 ILE 462 -5.744 4.283 -0.786 132 HD12 ILE 462 1HD1 ILE 462 -4.402 3.185 -0.458 133 HD13 ILE 462 2HD1 ILE 462 -5.838 2.595 -1.293 134 H GLN 463 H GLN 463 -3.112 7.427 -4.958 135 HA GLN 463 HA GLN 463 -0.476 8.379 -4.099 136 HB2 GLN 463 2HB GLN 463 -2.407 9.451 -6.155 137 HB3 GLN 463 1HB GLN 463 -0.879 10.210 -5.734 138 HG2 GLN 463 2HG GLN 463 0.330 8.380 -6.545 139 HG3 GLN 463 1HG GLN 463 -1.142 7.430 -6.871 140 HE21 GLN 463 1HE2 GLN 463 0.994 9.923 -7.912 141 HE22 GLN 463 2HE2 GLN 463 0.243 10.217 -9.439 142 H LEU 464 H LEU 464 -0.339 9.784 -2.526 143 HA LEU 464 HA LEU 464 -2.735 11.369 -1.871 144 HB2 LEU 464 2HB LEU 464 -0.505 10.524 -0.000 145 HB3 LEU 464 1HB LEU 464 -1.789 11.624 0.426 146 HG LEU 464 HG LEU 464 -2.278 9.566 1.439 147 HD11 LEU 464 1HD1 LEU 464 -4.207 10.644 0.555 148 HD12 LEU 464 2HD1 LEU 464 -4.398 8.894 0.487 149 HD13 LEU 464 3HD1 LEU 464 -4.025 9.795 -0.981 150 HD21 LEU 464 3HD2 LEU 464 -0.829 8.105 0.153 151 HD22 LEU 464 1HD2 LEU 464 -1.907 8.220 -1.236 152 HD23 LEU 464 2HD2 LEU 464 -2.458 7.428 0.240 153 H LYS 465 H LYS 465 -2.545 13.498 -1.867 154 HA LYS 465 HA LYS 465 0.112 14.640 -2.375 155 HB2 LYS 465 2HB LYS 465 -1.484 15.104 -4.137 156 HB3 LYS 465 1HB LYS 465 -2.673 15.723 -2.971 157 HG2 LYS 465 2HG LYS 465 -1.110 17.556 -2.471 158 HG3 LYS 465 1HG LYS 465 0.015 16.892 -3.655 159 HD2 LYS 465 2HD LYS 465 -1.217 18.745 -4.630 160 HD3 LYS 465 1HD LYS 465 -1.673 17.239 -5.419 161 HE2 LYS 465 2HE LYS 465 -3.717 17.145 -4.099 162 HE3 LYS 465 1HE LYS 465 -3.251 18.609 -3.237 163 HZ1 LYS 465 3HZ LYS 465 -3.368 19.820 -5.341 164 HZ2 LYS 465 1HZ LYS 465 -4.831 19.068 -4.987 165 HZ3 LYS 465 2HZ LYS 465 -3.809 18.402 -6.146 166 H LYS 466 H LYS 466 0.883 16.058 -1.029 167 HA LYS 466 HA LYS 466 -0.072 16.008 1.649 168 HB2 LYS 466 2HB LYS 466 2.261 17.081 0.243 169 HB3 LYS 466 1HB LYS 466 1.785 18.006 1.651 170 HG2 LYS 466 2HG LYS 466 3.544 16.256 2.042 171 HG3 LYS 466 1HG LYS 466 2.154 16.179 3.101 172 HD2 LYS 466 2HD LYS 466 2.964 13.957 2.321 173 HD3 LYS 466 1HD LYS 466 1.284 14.274 1.922 174 HE2 LYS 466 2HE LYS 466 2.552 13.174 0.115 175 HE3 LYS 466 1HE LYS 466 1.862 14.715 -0.360 176 HZ1 LYS 466 3HZ LYS 466 4.013 15.730 -0.088 177 HZ2 LYS 466 1HZ LYS 466 4.103 14.434 -1.157 178 HZ3 LYS 466 2HZ LYS 466 4.681 14.249 0.421 179 H GLY 467 H GLY 467 -1.543 17.135 2.535 180 HA2 GLY 467 2HA GLY 467 -2.273 19.717 1.379 181 HA3 GLY 467 1HA GLY 467 -3.295 18.741 2.437 182 H THR 468 H THR 468 -3.569 20.552 3.833 183 HA THR 468 HA THR 468 -1.440 21.967 4.988 184 HB THR 468 HB THR 468 -3.131 22.660 6.687 185 HG1 THR 468 1HG THR 468 -4.523 21.187 7.016 186 HG21 THR 468 3HG2 THR 468 -2.980 23.864 4.545 187 HG22 THR 468 1HG2 THR 468 -4.650 23.793 5.111 188 HG23 THR 468 2HG2 THR 468 -4.110 22.716 3.825 189 H GLU 469 H GLU 469 -3.081 18.946 5.904 190 HA GLU 469 HA GLU 469 -1.696 18.924 8.468 191 HB2 GLU 469 2HB GLU 469 -3.634 16.895 7.420 192 HB3 GLU 469 1HB GLU 469 -3.215 17.238 9.078 193 HG2 GLU 469 2HG GLU 469 -4.762 19.051 7.259 194 HG3 GLU 469 1HG GLU 469 -5.477 18.069 8.517 195 H GLY 470 H GLY 470 -1.001 18.117 5.412 196 HA2 GLY 470 2HA GLY 470 0.729 16.828 4.589 197 HA3 GLY 470 1HA GLY 470 0.917 16.111 6.189 198 H LEU 471 H LEU 471 0.696 14.006 6.034 199 HA LEU 471 HA LEU 471 -0.948 12.813 3.994 200 HB2 LEU 471 2HB LEU 471 0.717 11.602 6.186 201 HB3 LEU 471 1HB LEU 471 -0.196 10.661 5.036 202 HG LEU 471 HG LEU 471 2.070 12.534 4.332 203 HD11 LEU 471 1HD1 LEU 471 3.318 10.483 3.848 204 HD12 LEU 471 2HD1 LEU 471 1.959 9.518 4.427 205 HD13 LEU 471 3HD1 LEU 471 2.843 10.556 5.544 206 HD21 LEU 471 3HD2 LEU 471 1.913 11.518 2.105 207 HD22 LEU 471 1HD2 LEU 471 0.414 12.339 2.524 208 HD23 LEU 471 2HD2 LEU 471 0.512 10.584 2.611 209 H GLY 472 H GLY 472 -0.937 12.638 7.550 210 HA2 GLY 472 2HA GLY 472 -2.871 12.812 8.888 211 HA3 GLY 472 1HA GLY 472 -3.844 12.654 7.437 212 H PHE 473 H PHE 473 -1.341 10.362 7.980 213 HA PHE 473 HA PHE 473 -3.053 8.601 9.455 214 HB2 PHE 473 2HB PHE 473 -3.046 6.761 7.896 215 HB3 PHE 473 1HB PHE 473 -3.695 8.153 7.053 216 HD1 PHE 473 1HD PHE 473 -2.018 9.472 5.588 217 HD2 PHE 473 2HD PHE 473 -1.342 5.497 6.951 218 HE1 PHE 473 1HE PHE 473 -0.362 9.112 3.802 219 HE2 PHE 473 2HE PHE 473 0.311 5.175 5.177 220 HZ PHE 473 HZ PHE 473 0.777 7.002 3.613 221 H SER 474 H SER 474 -1.836 6.622 10.006 222 HA SER 474 HA SER 474 1.045 7.026 9.830 223 HB2 SER 474 2HB SER 474 -0.527 6.392 12.312 224 HB3 SER 474 1HB SER 474 1.244 6.510 12.228 225 HG SER 474 HG SER 474 0.036 8.645 11.165 226 H ILE 475 H ILE 475 2.140 4.922 10.554 227 HA ILE 475 HA ILE 475 0.469 2.654 9.725 228 HB ILE 475 HB ILE 475 2.544 1.625 8.885 229 HG12 ILE 475 2HG1 ILE 475 3.705 4.395 9.160 230 HG13 ILE 475 1HG1 ILE 475 4.103 2.962 10.128 231 HG21 ILE 475 1HG2 ILE 475 0.970 2.575 7.332 232 HG22 ILE 475 2HG2 ILE 475 2.620 2.801 6.766 233 HG23 ILE 475 3HG2 ILE 475 1.735 4.166 7.466 234 HD11 ILE 475 3HD1 ILE 475 5.776 3.505 8.297 235 HD12 ILE 475 1HD1 ILE 475 4.505 3.146 7.137 236 HD13 ILE 475 2HD1 ILE 475 5.085 1.894 8.223 237 H THR 476 H THR 476 0.954 0.690 10.737 238 HA THR 476 HA THR 476 2.528 0.886 13.189 239 HB THR 476 HB THR 476 0.070 0.975 13.734 240 HG1 THR 476 1HG THR 476 0.553 -1.483 14.769 241 HG21 THR 476 3HG2 THR 476 -0.781 -0.373 11.851 242 HG22 THR 476 1HG2 THR 476 -1.318 -1.032 13.399 243 HG23 THR 476 2HG2 THR 476 0.003 -1.801 12.520 244 H SER 477 H SER 477 3.236 -1.289 13.925 245 HA SER 477 HA SER 477 3.494 -3.174 11.716 246 HB2 SER 477 2HB SER 477 5.907 -3.249 12.167 247 HB3 SER 477 1HB SER 477 5.361 -1.699 11.546 248 HG SER 477 HG SER 477 6.723 -1.328 13.256 249 H ARG 478 H ARG 478 3.584 -5.281 12.367 250 HA ARG 478 HA ARG 478 4.520 -5.939 14.947 251 HB2 ARG 478 2HB ARG 478 2.534 -7.009 15.792 252 HB3 ARG 478 1HB ARG 478 2.157 -5.341 15.429 253 HG2 ARG 478 2HG ARG 478 1.192 -6.241 13.237 254 HG3 ARG 478 1HG ARG 478 1.307 -7.830 13.997 255 HD2 ARG 478 2HD ARG 478 -0.448 -5.509 14.700 256 HD3 ARG 478 1HD ARG 478 -0.843 -7.215 14.553 257 HE ARG 478 HE ARG 478 0.349 -5.863 16.835 258 HH11 ARG 478 1HH1 ARG 478 -0.818 -8.967 15.543 259 HH12 ARG 478 2HH1 ARG 478 -0.947 -9.653 17.107 260 HH21 ARG 478 1HH2 ARG 478 0.109 -6.879 18.915 261 HH22 ARG 478 2HH2 ARG 478 -0.393 -8.511 18.972 262 H ASP 479 H ASP 479 5.427 -7.925 14.897 263 HA ASP 479 HA ASP 479 5.703 -9.280 12.394 264 HB2 ASP 479 2HB ASP 479 6.472 -10.118 15.195 265 HB3 ASP 479 1HB ASP 479 6.822 -11.082 13.772 266 H VAL 480 H VAL 480 4.104 -9.998 15.399 267 HA VAL 480 HA VAL 480 2.938 -12.367 14.486 268 HB VAL 480 HB VAL 480 3.272 -12.089 16.857 269 HG11 VAL 480 1HG1 VAL 480 3.130 -9.683 17.026 270 HG12 VAL 480 2HG1 VAL 480 2.072 -10.452 18.212 271 HG13 VAL 480 3HG1 VAL 480 1.395 -9.753 16.740 272 HG21 VAL 480 3HG2 VAL 480 1.386 -13.468 16.247 273 HG22 VAL 480 1HG2 VAL 480 0.328 -12.056 16.236 274 HG23 VAL 480 2HG2 VAL 480 1.047 -12.609 17.750 275 H THR 481 H THR 481 1.738 -12.353 12.861 276 HA THR 481 HA THR 481 -0.858 -11.442 12.743 277 HB THR 481 HB THR 481 0.134 -9.157 12.471 278 HG1 THR 481 1HG THR 481 -1.666 -9.169 11.485 279 HG21 THR 481 3HG2 THR 481 1.390 -8.554 10.424 280 HG22 THR 481 1HG2 THR 481 1.407 -10.255 9.961 281 HG23 THR 481 2HG2 THR 481 2.261 -9.733 11.409 282 H ILE 482 H ILE 482 2.067 -12.146 10.998 283 HA ILE 482 HA ILE 482 0.992 -14.563 9.909 284 HB ILE 482 HB ILE 482 1.751 -14.187 7.563 285 HG12 ILE 482 2HG1 ILE 482 1.869 -11.242 8.258 286 HG13 ILE 482 1HG1 ILE 482 3.264 -12.273 7.951 287 HG21 ILE 482 1HG2 ILE 482 -0.505 -12.390 8.376 288 HG22 ILE 482 2HG2 ILE 482 -0.598 -14.100 7.956 289 HG23 ILE 482 3HG2 ILE 482 -0.162 -12.908 6.729 290 HD11 ILE 482 3HD1 ILE 482 2.486 -12.612 5.657 291 HD12 ILE 482 1HD1 ILE 482 2.727 -10.903 6.021 292 HD13 ILE 482 2HD1 ILE 482 1.095 -11.576 5.981 293 H GLY 483 H GLY 483 3.624 -12.286 10.341 294 HA2 GLY 483 2HA GLY 483 5.665 -12.940 11.266 295 HA3 GLY 483 1HA GLY 483 5.453 -14.537 10.558 296 H GLY 484 H GLY 484 7.573 -14.301 9.721 297 HA2 GLY 484 2HA GLY 484 8.997 -14.057 7.963 298 HA3 GLY 484 1HA GLY 484 7.595 -13.613 7.006 299 H SER 485 H SER 485 7.521 -11.646 6.242 300 HA SER 485 HA SER 485 9.699 -9.876 6.573 301 HB2 SER 485 2HB SER 485 7.063 -9.430 5.182 302 HB3 SER 485 1HB SER 485 8.567 -8.556 4.898 303 HG SER 485 HG SER 485 7.771 -10.596 3.613 304 H ALA 486 H ALA 486 6.620 -10.180 8.117 305 HA ALA 486 HA ALA 486 5.356 -8.940 9.491 306 HB1 ALA 486 1HB ALA 486 6.445 -7.372 11.052 307 HB2 ALA 486 2HB ALA 486 7.897 -7.382 10.053 308 HB3 ALA 486 3HB ALA 486 7.399 -8.849 10.897 309 HA PRO 487 HA PRO 487 4.538 -5.919 6.214 310 HB2 PRO 487 2HB PRO 487 1.749 -6.415 6.984 311 HB3 PRO 487 1HB PRO 487 2.524 -6.599 5.410 312 HG2 PRO 487 2HG PRO 487 1.774 -8.725 6.860 313 HG3 PRO 487 1HG PRO 487 3.236 -8.743 5.858 314 HD2 PRO 487 2HD PRO 487 2.978 -8.368 8.820 315 HD3 PRO 487 1HD PRO 487 4.148 -9.341 7.897 316 H ILE 488 H ILE 488 3.589 -3.885 6.180 317 HA ILE 488 HA ILE 488 3.248 -2.676 8.801 318 HB ILE 488 HB ILE 488 4.026 -1.470 6.072 319 HG12 ILE 488 2HG1 ILE 488 5.765 -2.517 7.591 320 HG13 ILE 488 1HG1 ILE 488 5.972 -0.835 7.119 321 HG21 ILE 488 1HG2 ILE 488 3.955 0.656 7.003 322 HG22 ILE 488 2HG2 ILE 488 3.340 -0.022 8.514 323 HG23 ILE 488 3HG2 ILE 488 2.345 -0.084 7.056 324 HD11 ILE 488 3HD1 ILE 488 5.183 -0.082 9.241 325 HD12 ILE 488 1HD1 ILE 488 6.521 -1.200 9.469 326 HD13 ILE 488 2HD1 ILE 488 4.862 -1.759 9.740 327 H TYR 489 H TYR 489 1.294 -1.925 9.372 328 HA TYR 489 HA TYR 489 -0.769 -1.870 7.253 329 HB2 TYR 489 2HB TYR 489 -1.338 -2.387 10.208 330 HB3 TYR 489 1HB TYR 489 -2.437 -2.416 8.866 331 HD1 TYR 489 2HD TYR 489 0.344 -4.234 10.421 332 HD2 TYR 489 1HD TYR 489 -2.695 -4.279 7.455 333 HE1 TYR 489 2HE TYR 489 0.722 -6.610 10.113 334 HE2 TYR 489 1HE TYR 489 -2.351 -6.663 7.113 335 HH TYR 489 HH TYR 489 -0.586 -8.587 9.278 336 H VAL 490 H VAL 490 -2.130 -0.155 7.279 337 HA VAL 490 HA VAL 490 -1.192 2.258 8.403 338 HB VAL 490 HB VAL 490 -4.006 1.585 7.494 339 HG11 VAL 490 1HG1 VAL 490 -2.667 4.260 7.917 340 HG12 VAL 490 2HG1 VAL 490 -3.964 3.578 8.894 341 HG13 VAL 490 3HG1 VAL 490 -4.271 4.018 7.215 342 HG21 VAL 490 3HG2 VAL 490 -2.363 1.244 5.732 343 HG22 VAL 490 1HG2 VAL 490 -1.727 2.869 5.991 344 HG23 VAL 490 2HG2 VAL 490 -3.372 2.651 5.395 345 H LYS 491 H LYS 491 -1.286 2.941 10.417 346 HA LYS 491 HA LYS 491 -2.391 1.300 12.472 347 HB2 LYS 491 2HB LYS 491 -0.329 2.683 12.749 348 HB3 LYS 491 1HB LYS 491 -1.333 4.115 12.669 349 HG2 LYS 491 2HG LYS 491 -2.498 3.478 14.690 350 HG3 LYS 491 1HG LYS 491 -1.565 1.989 14.802 351 HD2 LYS 491 2HD LYS 491 -0.664 3.628 16.325 352 HD3 LYS 491 1HD LYS 491 0.495 3.368 15.022 353 HE2 LYS 491 2HE LYS 491 -0.296 5.402 13.926 354 HE3 LYS 491 1HE LYS 491 -1.461 5.668 15.226 355 HZ1 LYS 491 3HZ LYS 491 0.444 5.884 16.760 356 HZ2 LYS 491 1HZ LYS 491 0.511 7.025 15.531 357 HZ3 LYS 491 2HZ LYS 491 1.505 5.683 15.465 358 H ASN 492 H ASN 492 -3.408 4.274 10.878 359 HA ASN 492 HA ASN 492 -6.116 4.044 11.477 360 HB2 ASN 492 2HB ASN 492 -5.294 4.523 13.819 361 HB3 ASN 492 1HB ASN 492 -4.693 6.055 13.229 362 HD21 ASN 492 1HD2 ASN 492 -6.023 7.200 14.633 363 HD22 ASN 492 2HD2 ASN 492 -7.720 7.388 14.362 364 H ILE 493 H ILE 493 -7.248 5.681 10.390 365 HA ILE 493 HA ILE 493 -5.618 7.583 8.908 366 HB ILE 493 HB ILE 493 -8.573 6.882 8.631 367 HG12 ILE 493 2HG1 ILE 493 -7.175 4.985 7.980 368 HG13 ILE 493 1HG1 ILE 493 -7.976 5.749 6.605 369 HG21 ILE 493 1HG2 ILE 493 -6.772 8.564 6.898 370 HG22 ILE 493 2HG2 ILE 493 -8.218 9.107 7.777 371 HG23 ILE 493 3HG2 ILE 493 -8.348 7.969 6.435 372 HD11 ILE 493 3HD1 ILE 493 -5.692 5.106 6.066 373 HD12 ILE 493 1HD1 ILE 493 -5.091 6.131 7.369 374 HD13 ILE 493 2HD1 ILE 493 -5.908 6.854 5.982 375 H LEU 494 H LEU 494 -5.472 9.544 9.730 376 HA LEU 494 HA LEU 494 -6.947 10.217 12.101 377 HB2 LEU 494 2HB LEU 494 -4.839 11.738 10.567 378 HB3 LEU 494 1HB LEU 494 -5.423 12.126 12.174 379 HG LEU 494 HG LEU 494 -3.912 9.611 11.442 380 HD11 LEU 494 1HD1 LEU 494 -2.493 11.579 11.313 381 HD12 LEU 494 2HD1 LEU 494 -2.065 10.557 12.680 382 HD13 LEU 494 3HD1 LEU 494 -2.972 12.044 12.948 383 HD21 LEU 494 3HD2 LEU 494 -5.439 9.254 13.308 384 HD22 LEU 494 1HD2 LEU 494 -4.795 10.676 14.127 385 HD23 LEU 494 2HD2 LEU 494 -3.767 9.268 13.866 386 HA PRO 495 HA PRO 495 -10.108 12.666 10.199 387 HB2 PRO 495 2HB PRO 495 -10.384 14.678 12.033 388 HB3 PRO 495 1HB PRO 495 -11.008 13.040 12.274 389 HG2 PRO 495 2HG PRO 495 -8.465 14.261 13.279 390 HG3 PRO 495 1HG PRO 495 -9.641 13.261 14.148 391 HD2 PRO 495 2HD PRO 495 -7.371 12.211 13.224 392 HD3 PRO 495 1HD PRO 495 -8.895 11.299 13.163 393 H ARG 496 H ARG 496 -7.020 13.842 10.641 394 HA ARG 496 HA ARG 496 -7.571 16.231 9.024 395 HB2 ARG 496 2HB ARG 496 -5.546 15.875 11.214 396 HB3 ARG 496 1HB ARG 496 -5.607 17.284 10.189 397 HG2 ARG 496 2HG ARG 496 -7.705 16.345 12.104 398 HG3 ARG 496 1HG ARG 496 -6.610 17.720 12.324 399 HD2 ARG 496 2HD ARG 496 -7.645 18.757 10.303 400 HD3 ARG 496 1HD ARG 496 -8.786 17.410 10.270 401 HE ARG 496 HE ARG 496 -8.733 18.613 12.797 402 HH11 ARG 496 1HH1 ARG 496 -10.095 19.062 9.536 403 HH12 ARG 496 2HH1 ARG 496 -11.337 20.091 10.078 404 HH21 ARG 496 1HH2 ARG 496 -10.439 20.026 13.490 405 HH22 ARG 496 2HH2 ARG 496 -11.534 20.667 12.348 406 H GLY 497 H GLY 497 -6.843 15.788 7.040 407 HA2 GLY 497 2HA GLY 497 -4.500 15.951 6.055 408 HA3 GLY 497 1HA GLY 497 -4.270 14.363 6.753 409 H ALA 498 H ALA 498 -3.717 14.428 4.311 410 HA ALA 498 HA ALA 498 -5.718 14.498 2.339 411 HB1 ALA 498 1HB ALA 498 -3.032 13.164 2.250 412 HB2 ALA 498 2HB ALA 498 -3.358 14.862 1.892 413 HB3 ALA 498 3HB ALA 498 -4.034 13.597 0.866 414 H ALA 499 H ALA 499 -4.367 11.832 4.202 415 HA ALA 499 HA ALA 499 -5.324 9.744 2.600 416 HB1 ALA 499 1HB ALA 499 -3.620 9.392 4.292 417 HB2 ALA 499 2HB ALA 499 -4.969 8.294 4.526 418 HB3 ALA 499 3HB ALA 499 -4.796 9.707 5.570 419 H ILE 500 H ILE 500 -6.892 11.468 5.258 420 HA ILE 500 HA ILE 500 -9.112 9.676 5.174 421 HB ILE 500 HB ILE 500 -8.525 10.928 7.306 422 HG12 ILE 500 2HG1 ILE 500 -11.310 11.280 6.206 423 HG13 ILE 500 1HG1 ILE 500 -10.681 9.864 7.009 424 HG21 ILE 500 1HG2 ILE 500 -8.013 13.104 6.336 425 HG22 ILE 500 2HG2 ILE 500 -9.260 13.225 7.582 426 HG23 ILE 500 3HG2 ILE 500 -9.707 13.282 5.880 427 HD11 ILE 500 3HD1 ILE 500 -10.998 12.550 8.314 428 HD12 ILE 500 1HD1 ILE 500 -10.471 11.044 9.078 429 HD13 ILE 500 2HD1 ILE 500 -12.117 11.188 8.468 430 H GLN 501 H GLN 501 -8.265 12.665 3.685 431 HA GLN 501 HA GLN 501 -10.819 13.375 2.678 432 HB2 GLN 501 2HB GLN 501 -8.070 14.020 1.603 433 HB3 GLN 501 1HB GLN 501 -9.564 14.770 1.069 434 HG2 GLN 501 2HG GLN 501 -8.389 14.935 3.834 435 HG3 GLN 501 1HG GLN 501 -8.334 16.204 2.619 436 HE21 GLN 501 1HE2 GLN 501 -10.244 14.556 4.929 437 HE22 GLN 501 2HE2 GLN 501 -11.601 15.607 4.892 438 H ASP 502 H ASP 502 -8.155 11.439 1.420 439 HA ASP 502 HA ASP 502 -9.271 10.977 -1.148 440 HB2 ASP 502 2HB ASP 502 -6.889 10.622 -0.705 441 HB3 ASP 502 1HB ASP 502 -7.280 9.321 0.410 442 H GLY 503 H GLY 503 -9.195 8.971 1.782 443 HA2 GLY 503 2HA GLY 503 -11.021 7.798 2.621 444 HA3 GLY 503 1HA GLY 503 -11.847 8.038 1.095 445 H ARG 504 H ARG 504 -9.366 6.913 -0.340 446 HA ARG 504 HA ARG 504 -10.363 4.229 -0.329 447 HB2 ARG 504 2HB ARG 504 -8.063 5.492 -1.814 448 HB3 ARG 504 1HB ARG 504 -8.561 3.820 -2.024 449 HG2 ARG 504 2HG ARG 504 -10.353 6.194 -2.529 450 HG3 ARG 504 1HG ARG 504 -9.401 5.394 -3.775 451 HD2 ARG 504 2HD ARG 504 -11.668 4.565 -3.849 452 HD3 ARG 504 1HD ARG 504 -10.583 3.296 -3.299 453 HE ARG 504 HE ARG 504 -12.241 4.863 -1.423 454 HH11 ARG 504 1HH1 ARG 504 -11.089 1.722 -2.588 455 HH12 ARG 504 2HH1 ARG 504 -12.018 0.800 -1.513 456 HH21 ARG 504 1HH2 ARG 504 -13.504 3.613 0.066 457 HH22 ARG 504 2HH2 ARG 504 -13.444 1.916 0.073 458 H LEU 505 H LEU 505 -7.496 5.817 0.772 459 HA LEU 505 HA LEU 505 -6.333 3.419 1.830 460 HB2 LEU 505 2HB LEU 505 -4.950 5.319 1.118 461 HB3 LEU 505 1HB LEU 505 -5.723 6.339 2.308 462 HG LEU 505 HG LEU 505 -4.700 4.996 4.109 463 HD11 LEU 505 1HD1 LEU 505 -3.314 3.531 1.856 464 HD12 LEU 505 2HD1 LEU 505 -4.474 2.844 2.997 465 HD13 LEU 505 3HD1 LEU 505 -2.917 3.426 3.574 466 HD21 LEU 505 3HD2 LEU 505 -2.759 6.038 2.061 467 HD22 LEU 505 1HD2 LEU 505 -2.418 5.773 3.769 468 HD23 LEU 505 2HD2 LEU 505 -3.593 6.995 3.285 469 H LYS 506 H LYS 506 -6.914 2.493 3.717 470 HA LYS 506 HA LYS 506 -8.195 4.122 5.719 471 HB2 LYS 506 2HB LYS 506 -9.185 1.453 4.728 472 HB3 LYS 506 1HB LYS 506 -9.782 2.254 6.177 473 HG2 LYS 506 2HG LYS 506 -10.496 4.156 4.767 474 HG3 LYS 506 1HG LYS 506 -9.984 3.254 3.345 475 HD2 LYS 506 2HD LYS 506 -11.595 1.512 3.853 476 HD3 LYS 506 1HD LYS 506 -12.067 2.360 5.328 477 HE2 LYS 506 2HE LYS 506 -12.380 3.380 2.506 478 HE3 LYS 506 1HE LYS 506 -13.669 2.792 3.559 479 HZ1 LYS 506 3HZ LYS 506 -13.638 5.156 3.568 480 HZ2 LYS 506 1HZ LYS 506 -12.009 5.222 3.977 481 HZ3 LYS 506 2HZ LYS 506 -13.148 4.628 5.087 482 H ALA 507 H ALA 507 -8.421 2.675 7.783 483 HA ALA 507 HA ALA 507 -5.727 1.987 8.421 484 HB1 ALA 507 1HB ALA 507 -6.544 1.701 10.689 485 HB2 ALA 507 2HB ALA 507 -8.207 1.775 10.110 486 HB3 ALA 507 3HB ALA 507 -7.174 3.197 9.989 487 H GLY 508 H GLY 508 -4.858 0.065 8.338 488 HA2 GLY 508 2HA GLY 508 -4.951 -2.263 8.931 489 HA3 GLY 508 1HA GLY 508 -6.598 -2.327 8.357 490 H ASP 509 H ASP 509 -5.458 -0.507 6.012 491 HA ASP 509 HA ASP 509 -4.851 -2.676 4.257 492 HB2 ASP 509 2HB ASP 509 -4.457 0.321 3.870 493 HB3 ASP 509 1HB ASP 509 -4.166 -0.874 2.615 494 H ARG 510 H ARG 510 -2.930 -3.365 3.466 495 HA ARG 510 HA ARG 510 -0.843 -2.643 5.339 496 HB2 ARG 510 2HB ARG 510 0.203 -4.785 5.064 497 HB3 ARG 510 1HB ARG 510 -1.503 -5.023 5.333 498 HG2 ARG 510 2HG ARG 510 -1.784 -5.432 2.908 499 HG3 ARG 510 1HG ARG 510 -0.016 -5.300 2.767 500 HD2 ARG 510 2HD ARG 510 0.237 -7.109 4.427 501 HD3 ARG 510 1HD ARG 510 -1.512 -7.285 4.474 502 HE ARG 510 HE ARG 510 -0.250 -7.575 1.888 503 HH11 ARG 510 1HH1 ARG 510 -1.637 -9.248 4.725 504 HH12 ARG 510 2HH1 ARG 510 -1.723 -10.749 3.966 505 HH21 ARG 510 1HH2 ARG 510 -0.365 -9.719 0.856 506 HH22 ARG 510 2HH2 ARG 510 -0.992 -11.017 1.729 507 H LEU 511 H LEU 511 0.844 -1.674 4.831 508 HA LEU 511 HA LEU 511 1.106 -0.537 2.213 509 HB2 LEU 511 2HB LEU 511 1.584 0.527 4.640 510 HB3 LEU 511 1HB LEU 511 3.088 -0.317 4.467 511 HG LEU 511 HG LEU 511 3.308 2.056 3.926 512 HD11 LEU 511 1HD1 LEU 511 4.862 0.561 2.890 513 HD12 LEU 511 2HD1 LEU 511 4.463 1.887 1.800 514 HD13 LEU 511 3HD1 LEU 511 3.750 0.291 1.543 515 HD21 LEU 511 3HD2 LEU 511 2.318 2.970 1.906 516 HD22 LEU 511 1HD2 LEU 511 1.087 2.470 3.065 517 HD23 LEU 511 2HD2 LEU 511 1.429 1.471 1.650 518 H ILE 512 H ILE 512 2.254 -1.447 0.615 519 HA ILE 512 HA ILE 512 3.983 -3.762 1.192 520 HB ILE 512 HB ILE 512 2.800 -2.792 -1.410 521 HG12 ILE 512 2HG1 ILE 512 1.055 -3.625 0.131 522 HG13 ILE 512 1HG1 ILE 512 1.248 -4.656 -1.271 523 HG21 ILE 512 1HG2 ILE 512 4.271 -5.344 -0.763 524 HG22 ILE 512 2HG2 ILE 512 4.859 -4.010 -1.755 525 HG23 ILE 512 3HG2 ILE 512 3.493 -4.980 -2.302 526 HD11 ILE 512 3HD1 ILE 512 2.528 -6.230 0.020 527 HD12 ILE 512 1HD1 ILE 512 0.947 -5.969 0.738 528 HD13 ILE 512 2HD1 ILE 512 2.382 -5.227 1.469 529 H GLU 513 H GLU 513 3.876 -0.901 -0.906 530 HA GLU 513 HA GLU 513 6.663 -0.466 -0.505 531 HB2 GLU 513 2HB GLU 513 7.274 -0.665 -2.891 532 HB3 GLU 513 1HB GLU 513 6.827 -2.201 -2.168 533 HG2 GLU 513 2HG GLU 513 4.612 -1.993 -3.169 534 HG3 GLU 513 1HG GLU 513 5.137 -0.487 -3.933 535 H VAL 514 H VAL 514 7.410 1.422 -1.580 536 HA VAL 514 HA VAL 514 5.216 3.245 -2.128 537 HB VAL 514 HB VAL 514 6.285 3.806 0.049 538 HG11 VAL 514 1HG1 VAL 514 8.547 4.749 0.152 539 HG12 VAL 514 2HG1 VAL 514 8.748 4.369 -1.558 540 HG13 VAL 514 3HG1 VAL 514 8.575 3.058 -0.388 541 HG21 VAL 514 3HG2 VAL 514 6.652 6.186 -0.331 542 HG22 VAL 514 1HG2 VAL 514 5.274 5.603 -1.275 543 HG23 VAL 514 2HG2 VAL 514 6.825 5.881 -2.054 544 H ASN 515 H ASN 515 5.321 4.101 -4.137 545 HA ASN 515 HA ASN 515 6.016 4.701 -6.241 546 HB2 ASN 515 2HB ASN 515 8.611 5.278 -4.797 547 HB3 ASN 515 1HB ASN 515 8.295 5.741 -6.459 548 HD21 ASN 515 1HD2 ASN 515 6.838 7.380 -6.852 549 HD22 ASN 515 2HD2 ASN 515 6.346 8.490 -5.612 550 H GLY 516 H GLY 516 6.950 1.879 -5.057 551 HA2 GLY 516 2HA GLY 516 7.426 0.065 -6.543 552 HA3 GLY 516 1HA GLY 516 8.403 1.158 -7.512 553 H VAL 517 H VAL 517 8.987 1.842 -4.321 554 HA VAL 517 HA VAL 517 11.495 0.398 -4.316 555 HB VAL 517 HB VAL 517 10.270 2.293 -2.277 556 HG11 VAL 517 1HG1 VAL 517 13.059 1.168 -2.460 557 HG12 VAL 517 2HG1 VAL 517 11.863 0.783 -1.227 558 HG13 VAL 517 3HG1 VAL 517 12.546 2.413 -1.321 559 HG21 VAL 517 3HG2 VAL 517 10.768 3.407 -4.385 560 HG22 VAL 517 1HG2 VAL 517 12.412 2.769 -4.350 561 HG23 VAL 517 2HG2 VAL 517 11.886 3.933 -3.130 562 H ASP 518 H ASP 518 11.621 -1.572 -3.562 563 HA ASP 518 HA ASP 518 9.397 -2.767 -2.226 564 HB2 ASP 518 2HB ASP 518 12.133 -3.936 -2.735 565 HB3 ASP 518 1HB ASP 518 10.736 -4.827 -2.148 566 H LEU 519 H LEU 519 9.072 -1.981 -0.337 567 HA LEU 519 HA LEU 519 11.247 -2.043 1.605 568 HB2 LEU 519 2HB LEU 519 9.735 -0.696 2.999 569 HB3 LEU 519 1HB LEU 519 10.174 0.071 1.491 570 HG LEU 519 HG LEU 519 7.874 -1.080 0.762 571 HD11 LEU 519 1HD1 LEU 519 7.257 -0.369 3.589 572 HD12 LEU 519 2HD1 LEU 519 7.355 -2.021 2.909 573 HD13 LEU 519 3HD1 LEU 519 6.192 -0.853 2.282 574 HD21 LEU 519 3HD2 LEU 519 8.198 1.616 2.053 575 HD22 LEU 519 1HD2 LEU 519 6.821 1.105 1.060 576 HD23 LEU 519 2HD2 LEU 519 8.425 1.166 0.352 577 H ALA 520 H ALA 520 8.917 -3.990 0.513 578 HA ALA 520 HA ALA 520 8.580 -5.366 3.007 579 HB1 ALA 520 1HB ALA 520 6.817 -5.560 1.278 580 HB2 ALA 520 2HB ALA 520 7.517 -7.139 1.637 581 HB3 ALA 520 3HB ALA 520 7.985 -6.280 0.171 582 H GLY 521 H GLY 521 10.736 -5.325 3.474 583 HA2 GLY 521 2HA GLY 521 12.227 -7.607 3.271 584 HA3 GLY 521 1HA GLY 521 12.779 -6.598 1.928 585 H LYS 522 H LYS 522 12.190 -4.152 3.135 586 HA LYS 522 HA LYS 522 14.417 -3.747 4.879 587 HB2 LYS 522 2HB LYS 522 12.180 -1.910 4.006 588 HB3 LYS 522 1HB LYS 522 13.456 -1.413 5.098 589 HG2 LYS 522 2HG LYS 522 13.766 -2.275 2.235 590 HG3 LYS 522 1HG LYS 522 13.923 -0.645 2.874 591 HD2 LYS 522 2HD LYS 522 15.792 -1.409 4.303 592 HD3 LYS 522 1HD LYS 522 15.678 -2.994 3.570 593 HE2 LYS 522 2HE LYS 522 16.310 -0.431 2.087 594 HE3 LYS 522 1HE LYS 522 17.475 -1.670 2.530 595 HZ1 LYS 522 3HZ LYS 522 15.222 -1.956 0.608 596 HZ2 LYS 522 1HZ LYS 522 16.229 -3.232 1.075 597 HZ3 LYS 522 2HZ LYS 522 16.841 -1.898 0.246 598 H SER 523 H SER 523 14.178 -2.794 6.999 599 HA SER 523 HA SER 523 12.489 -4.440 8.486 600 HB2 SER 523 2HB SER 523 14.647 -3.741 9.362 601 HB3 SER 523 1HB SER 523 14.163 -2.055 9.310 602 HG SER 523 HG SER 523 13.499 -4.045 11.133 603 H GLN 524 H GLN 524 10.772 -3.732 9.860 604 HA GLN 524 HA GLN 524 8.899 -2.033 8.676 605 HB2 GLN 524 2HB GLN 524 7.590 -2.322 10.757 606 HB3 GLN 524 1HB GLN 524 8.236 -3.842 10.177 607 HG2 GLN 524 2HG GLN 524 8.517 -3.941 12.536 608 HG3 GLN 524 1HG GLN 524 10.096 -3.485 11.889 609 HE21 GLN 524 1HE2 GLN 524 10.651 -2.711 13.930 610 HE22 GLN 524 2HE2 GLN 524 10.096 -1.167 14.471 611 H GLU 525 H GLU 525 11.441 -1.483 10.825 612 HA GLU 525 HA GLU 525 10.483 0.842 11.988 613 HB2 GLU 525 2HB GLU 525 12.123 -0.581 13.046 614 HB3 GLU 525 1HB GLU 525 13.285 -0.226 11.781 615 HG2 GLU 525 2HG GLU 525 13.418 2.056 12.494 616 HG3 GLU 525 1HG GLU 525 12.165 1.788 13.708 617 H GLU 526 H GLU 526 12.342 0.066 9.143 618 HA GLU 526 HA GLU 526 13.531 2.505 8.440 619 HB2 GLU 526 2HB GLU 526 12.451 0.263 6.756 620 HB3 GLU 526 1HB GLU 526 13.423 1.538 6.071 621 HG2 GLU 526 2HG GLU 526 14.243 -0.422 8.178 622 HG3 GLU 526 1HG GLU 526 14.688 -0.450 6.468 623 H VAL 527 H VAL 527 10.461 1.054 7.612 624 HA VAL 527 HA VAL 527 9.727 3.322 6.091 625 HB VAL 527 HB VAL 527 7.642 2.149 5.553 626 HG11 VAL 527 1HG1 VAL 527 8.785 0.300 4.367 627 HG12 VAL 527 2HG1 VAL 527 10.201 0.592 5.352 628 HG13 VAL 527 3HG1 VAL 527 9.653 1.833 4.218 629 HG21 VAL 527 3HG2 VAL 527 8.791 -0.062 7.253 630 HG22 VAL 527 1HG2 VAL 527 7.377 -0.163 6.205 631 HG23 VAL 527 2HG2 VAL 527 7.327 0.871 7.634 632 H VAL 528 H VAL 528 8.921 2.161 9.300 633 HA VAL 528 HA VAL 528 6.795 3.925 9.803 634 HB VAL 528 HB VAL 528 8.879 2.850 11.747 635 HG11 VAL 528 1HG1 VAL 528 7.881 4.938 12.615 636 HG12 VAL 528 2HG1 VAL 528 7.323 3.534 13.528 637 HG13 VAL 528 3HG1 VAL 528 6.273 4.275 12.322 638 HG21 VAL 528 3HG2 VAL 528 6.019 2.096 11.208 639 HG22 VAL 528 1HG2 VAL 528 7.058 1.369 12.437 640 HG23 VAL 528 2HG2 VAL 528 7.439 1.172 10.721 641 H SER 529 H SER 529 10.297 4.469 10.151 642 HA SER 529 HA SER 529 9.880 7.106 10.981 643 HB2 SER 529 2HB SER 529 12.371 7.344 10.476 644 HB3 SER 529 1HB SER 529 11.927 6.123 11.663 645 HG SER 529 HG SER 529 12.940 5.863 9.098 646 H LEU 530 H LEU 530 10.116 5.676 7.836 647 HA LEU 530 HA LEU 530 10.521 8.084 6.373 648 HB2 LEU 530 2HB LEU 530 9.294 5.478 5.697 649 HB3 LEU 530 1HB LEU 530 9.439 6.726 4.471 650 HG LEU 530 HG LEU 530 11.683 5.272 5.904 651 HD11 LEU 530 1HD1 LEU 530 10.806 5.233 3.020 652 HD12 LEU 530 2HD1 LEU 530 10.567 3.938 4.193 653 HD13 LEU 530 3HD1 LEU 530 12.197 4.380 3.688 654 HD21 LEU 530 3HD2 LEU 530 13.192 6.500 4.412 655 HD22 LEU 530 1HD2 LEU 530 12.323 7.595 5.482 656 HD23 LEU 530 2HD2 LEU 530 11.833 7.430 3.793 657 H LEU 531 H LEU 531 7.500 6.222 7.058 658 HA LEU 531 HA LEU 531 5.857 8.098 5.878 659 HB2 LEU 531 2HB LEU 531 5.384 5.791 7.748 660 HB3 LEU 531 1HB LEU 531 4.081 6.909 7.371 661 HG LEU 531 HG LEU 531 4.045 4.872 6.096 662 HD11 LEU 531 1HD1 LEU 531 3.040 6.870 5.126 663 HD12 LEU 531 2HD1 LEU 531 3.742 5.879 3.850 664 HD13 LEU 531 3HD1 LEU 531 4.583 7.324 4.400 665 HD21 LEU 531 3HD2 LEU 531 6.628 5.797 4.842 666 HD22 LEU 531 1HD2 LEU 531 5.647 4.452 4.257 667 HD23 LEU 531 2HD2 LEU 531 6.399 4.370 5.850 668 H ARG 532 H ARG 532 6.974 7.855 9.210 669 HA ARG 532 HA ARG 532 5.264 9.956 10.075 670 HB2 ARG 532 2HB ARG 532 6.125 8.347 11.693 671 HB3 ARG 532 1HB ARG 532 7.774 8.843 11.364 672 HG2 ARG 532 2HG ARG 532 6.974 9.768 13.480 673 HG3 ARG 532 1HG ARG 532 7.307 11.051 12.318 674 HD2 ARG 532 2HD ARG 532 4.902 11.195 11.803 675 HD3 ARG 532 1HD ARG 532 4.580 9.919 12.979 676 HE ARG 532 HE ARG 532 5.916 11.786 14.401 677 HH11 ARG 532 1HH1 ARG 532 2.978 11.925 12.410 678 HH12 ARG 532 2HH1 ARG 532 2.267 13.177 13.281 679 HH21 ARG 532 1HH2 ARG 532 4.925 13.498 15.613 680 HH22 ARG 532 2HH2 ARG 532 3.371 14.084 15.181 681 H SER 533 H SER 533 8.434 9.917 8.592 682 HA SER 533 HA SER 533 9.128 12.596 9.298 683 HB2 SER 533 2HB SER 533 10.808 10.807 8.646 684 HB3 SER 533 1HB SER 533 10.195 10.912 6.999 685 HG SER 533 HG SER 533 11.311 12.666 6.711 686 H THR 534 H THR 534 7.738 10.935 6.555 687 HA THR 534 HA THR 534 6.252 11.501 5.035 688 HB THR 534 HB THR 534 5.916 14.097 6.549 689 HG1 THR 534 1HG THR 534 5.235 11.568 7.198 690 HG21 THR 534 3HG2 THR 534 4.230 12.691 4.527 691 HG22 THR 534 1HG2 THR 534 5.101 14.202 4.263 692 HG23 THR 534 2HG2 THR 534 3.738 14.153 5.408 693 H LYS 535 H LYS 535 7.318 11.536 3.218 694 HA LYS 535 HA LYS 535 8.988 13.570 2.147 695 HB2 LYS 535 2HB LYS 535 8.851 11.179 1.425 696 HB3 LYS 535 1HB LYS 535 7.234 11.466 0.832 697 HG2 LYS 535 2HG LYS 535 8.087 12.862 -0.929 698 HG3 LYS 535 1HG LYS 535 9.725 12.749 -0.264 699 HD2 LYS 535 2HD LYS 535 9.699 10.322 -0.584 700 HD3 LYS 535 1HD LYS 535 8.069 10.419 -1.238 701 HE2 LYS 535 2HE LYS 535 9.804 10.183 -2.961 702 HE3 LYS 535 1HE LYS 535 8.870 11.661 -3.141 703 HZ1 LYS 535 3HZ LYS 535 10.643 12.925 -2.271 704 HZ2 LYS 535 1HZ LYS 535 11.333 11.897 -3.419 705 HZ3 LYS 535 2HZ LYS 535 11.518 11.570 -1.788 706 H MET 536 H MET 536 8.314 15.500 0.913 707 HA MET 536 HA MET 536 5.391 15.940 1.143 708 HB2 MET 536 2HB MET 536 5.665 18.074 2.101 709 HB3 MET 536 1HB MET 536 6.551 16.911 3.077 710 HG2 MET 536 2HG MET 536 7.741 18.820 1.065 711 HG3 MET 536 1HG MET 536 7.751 19.021 2.812 712 HE1 MET 536 3HE MET 536 10.372 19.468 2.649 713 HE2 MET 536 1HE MET 536 10.305 19.224 0.904 714 HE3 MET 536 2HE MET 536 11.505 18.366 1.871 715 H GLU 537 H GLU 537 7.706 15.999 -1.154 716 HA GLU 537 HA GLU 537 7.401 18.474 -2.240 717 HB2 GLU 537 2HB GLU 537 7.726 16.010 -3.924 718 HB3 GLU 537 1HB GLU 537 8.171 17.638 -4.398 719 HG2 GLU 537 2HG GLU 537 10.208 16.642 -3.872 720 HG3 GLU 537 1HG GLU 537 9.803 17.526 -2.399 721 H GLY 538 H GLY 538 5.382 15.654 -3.007 722 HA2 GLY 538 2HA GLY 538 3.126 17.356 -3.493 723 HA3 GLY 538 1HA GLY 538 3.677 16.620 -4.975 724 H THR 539 H THR 539 3.458 14.441 -5.291 725 HA THR 539 HA THR 539 1.494 13.253 -3.510 726 HB THR 539 HB THR 539 1.278 11.614 -5.431 727 HG1 THR 539 1HG THR 539 1.957 13.283 -7.374 728 HG21 THR 539 3HG2 THR 539 -0.219 13.038 -6.694 729 HG22 THR 539 1HG2 THR 539 0.456 14.486 -5.917 730 HG23 THR 539 2HG2 THR 539 -0.428 13.279 -4.963 731 H VAL 540 H VAL 540 1.737 11.223 -2.793 732 HA VAL 540 HA VAL 540 4.326 9.902 -3.252 733 HB VAL 540 HB VAL 540 2.636 9.805 -0.716 734 HG11 VAL 540 1HG1 VAL 540 3.768 7.705 -1.173 735 HG12 VAL 540 2HG1 VAL 540 4.474 8.503 0.235 736 HG13 VAL 540 3HG1 VAL 540 5.309 8.546 -1.321 737 HG21 VAL 540 3HG2 VAL 540 4.490 10.969 0.378 738 HG22 VAL 540 1HG2 VAL 540 3.832 11.936 -0.948 739 HG23 VAL 540 2HG2 VAL 540 5.342 11.053 -1.163 740 H SER 541 H SER 541 4.100 7.903 -4.153 741 HA SER 541 HA SER 541 1.389 6.868 -4.316 742 HB2 SER 541 2HB SER 541 3.889 6.078 -5.821 743 HB3 SER 541 1HB SER 541 2.311 5.324 -6.038 744 HG SER 541 HG SER 541 2.508 8.114 -6.277 745 H LEU 542 H LEU 542 0.793 5.556 -2.844 746 HA LEU 542 HA LEU 542 2.762 3.825 -1.547 747 HB2 LEU 542 2HB LEU 542 0.029 4.710 -0.691 748 HB3 LEU 542 1HB LEU 542 1.112 3.696 0.241 749 HG LEU 542 HG LEU 542 1.694 6.550 -0.538 750 HD11 LEU 542 1HD1 LEU 542 0.865 5.373 2.084 751 HD12 LEU 542 2HD1 LEU 542 -0.164 6.329 1.011 752 HD13 LEU 542 3HD1 LEU 542 1.276 7.061 1.746 753 HD21 LEU 542 3HD2 LEU 542 3.083 4.707 1.389 754 HD22 LEU 542 1HD2 LEU 542 3.501 6.379 1.040 755 HD23 LEU 542 2HD2 LEU 542 3.678 5.148 -0.215 756 H LEU 543 H LEU 543 2.694 1.796 -2.161 757 HA LEU 543 HA LEU 543 0.279 0.845 -3.463 758 HB2 LEU 543 2HB LEU 543 2.703 0.668 -4.483 759 HB3 LEU 543 1HB LEU 543 2.940 -0.506 -3.250 760 HG LEU 543 HG LEU 543 0.742 -0.903 -5.279 761 HD11 LEU 543 1HD1 LEU 543 3.586 -1.880 -5.399 762 HD12 LEU 543 2HD1 LEU 543 2.848 -0.693 -6.475 763 HD13 LEU 543 3HD1 LEU 543 2.279 -2.361 -6.481 764 HD21 LEU 543 3HD2 LEU 543 0.986 -3.245 -4.632 765 HD22 LEU 543 1HD2 LEU 543 0.616 -2.245 -3.227 766 HD23 LEU 543 2HD2 LEU 543 2.266 -2.810 -3.507 767 H VAL 544 H VAL 544 -1.063 -0.238 -2.274 768 HA VAL 544 HA VAL 544 -0.067 -1.595 0.131 769 HB VAL 544 HB VAL 544 -2.233 -1.223 1.185 770 HG11 VAL 544 1HG1 VAL 544 -1.061 1.345 0.136 771 HG12 VAL 544 2HG1 VAL 544 -0.571 0.468 1.583 772 HG13 VAL 544 3HG1 VAL 544 -2.167 1.209 1.506 773 HG21 VAL 544 3HG2 VAL 544 -3.632 -1.250 -0.774 774 HG22 VAL 544 1HG2 VAL 544 -2.971 0.298 -1.311 775 HG23 VAL 544 2HG2 VAL 544 -3.949 0.214 0.165 776 H PHE 545 H PHE 545 -1.332 -3.450 0.743 777 HA PHE 545 HA PHE 545 -2.548 -4.778 -1.584 778 HB2 PHE 545 2HB PHE 545 -0.455 -5.835 -0.645 779 HB3 PHE 545 1HB PHE 545 -1.352 -6.115 0.851 780 HD1 PHE 545 2HD PHE 545 -3.306 -7.704 0.801 781 HD2 PHE 545 1HD PHE 545 -0.689 -7.209 -2.501 782 HE1 PHE 545 2HE PHE 545 -4.116 -9.823 -0.158 783 HE2 PHE 545 1HE PHE 545 -1.495 -9.323 -3.469 784 HZ PHE 545 HZ PHE 545 -3.212 -10.629 -2.293 785 H ARG 546 H ARG 546 -4.624 -4.912 -1.401 786 HA ARG 546 HA ARG 546 -5.787 -4.758 1.273 787 HB2 ARG 546 2HB ARG 546 -6.312 -2.948 -0.375 788 HB3 ARG 546 1HB ARG 546 -7.063 -4.157 -1.398 789 HG2 ARG 546 2HG ARG 546 -8.788 -4.535 0.182 790 HG3 ARG 546 1HG ARG 546 -7.960 -3.562 1.402 791 HD2 ARG 546 2HD ARG 546 -8.144 -1.606 -0.062 792 HD3 ARG 546 1HD ARG 546 -9.043 -2.573 -1.224 793 HE ARG 546 HE ARG 546 -10.774 -2.809 0.445 794 HH11 ARG 546 1HH1 ARG 546 -8.338 -0.365 1.186 795 HH12 ARG 546 2HH1 ARG 546 -9.358 0.751 1.907 796 HH21 ARG 546 1HH2 ARG 546 -12.294 -1.315 1.450 797 HH22 ARG 546 2HH2 ARG 546 -11.772 0.158 2.077 798 H GLN 547 H GLN 547 -6.576 -6.528 2.020 799 HA GLN 547 HA GLN 547 -6.991 -8.821 0.236 800 HB2 GLN 547 2HB GLN 547 -4.960 -8.992 1.612 801 HB3 GLN 547 1HB GLN 547 -5.907 -8.736 3.061 802 HG2 GLN 547 2HG GLN 547 -5.317 -11.062 2.805 803 HG3 GLN 547 1HG GLN 547 -7.061 -10.841 2.698 804 HE21 GLN 547 1HE2 GLN 547 -4.175 -11.701 0.970 805 HE22 GLN 547 2HE2 GLN 547 -4.976 -12.290 -0.433 806 H GLU 548 H GLU 548 -8.671 -10.228 0.681 807 HA GLU 548 HA GLU 548 -11.163 -9.382 1.439 808 HB2 GLU 548 2HB GLU 548 -10.041 -12.164 1.873 809 HB3 GLU 548 1HB GLU 548 -11.741 -11.753 1.745 810 HG2 GLU 548 2HG GLU 548 -11.430 -11.070 -0.563 811 HG3 GLU 548 1HG GLU 548 -9.707 -11.401 -0.442 812 H GLU 549 H GLU 549 -8.911 -11.198 3.494 813 HA GLU 549 HA GLU 549 -9.885 -9.639 5.743 814 HB2 GLU 549 2HB GLU 549 -10.740 -11.942 6.013 815 HB3 GLU 549 1HB GLU 549 -9.106 -12.563 5.828 816 HG2 GLU 549 2HG GLU 549 -8.414 -11.416 7.857 817 HG3 GLU 549 1HG GLU 549 -10.034 -10.758 8.040 818 H ALA 550 H ALA 550 -8.259 -8.207 5.680 819 HA ALA 550 HA ALA 550 -5.510 -9.156 5.538 820 HB1 ALA 550 1HB ALA 550 -4.912 -6.785 5.405 821 HB2 ALA 550 2HB ALA 550 -6.584 -6.340 5.739 822 HB3 ALA 550 3HB ALA 550 -6.186 -7.153 4.236 823 H PHE 551 H PHE 551 -7.806 -8.606 7.783 824 HA PHE 551 HA PHE 551 -6.102 -7.504 9.831 825 HB2 PHE 551 2HB PHE 551 -8.983 -8.252 9.749 826 HB3 PHE 551 1HB PHE 551 -8.212 -7.494 11.152 827 HD1 PHE 551 1HD PHE 551 -7.284 -5.169 10.848 828 HD2 PHE 551 2HD PHE 551 -9.784 -7.023 7.960 829 HE1 PHE 551 1HE PHE 551 -7.768 -2.976 9.865 830 HE2 PHE 551 2HE PHE 551 -10.273 -4.825 6.964 831 HZ PHE 551 HZ PHE 551 -9.262 -2.797 7.918 832 H HIS 552 H HIS 552 -5.435 -8.590 11.590 833 HA HIS 552 HA HIS 552 -6.355 -11.316 12.012 834 HB2 HIS 552 2HB HIS 552 -3.467 -10.400 11.992 835 HB3 HIS 552 1HB HIS 552 -3.981 -11.906 12.740 836 HD1 HIS 552 1HD HIS 552 -4.231 -13.889 11.213 837 HD2 HIS 552 2HD HIS 552 -3.735 -10.324 9.136 838 HE1 HIS 552 1HE HIS 552 -3.891 -14.544 8.820 839 HE2 HIS 552 2HE HIS 552 -3.962 -12.372 7.584 840 HA PRO 553 HA PRO 553 -7.259 -9.569 16.016 841 HB2 PRO 553 2HB PRO 553 -7.000 -12.417 16.846 842 HB3 PRO 553 1HB PRO 553 -8.329 -11.287 17.129 843 HG2 PRO 553 2HG PRO 553 -8.587 -13.202 15.317 844 HG3 PRO 553 1HG PRO 553 -9.198 -11.572 14.988 845 HD2 PRO 553 2HD PRO 553 -6.721 -12.900 13.973 846 HD3 PRO 553 1HD PRO 553 -7.871 -11.820 13.148 847 H ARG 554 H ARG 554 -6.233 -9.128 17.891 848 HA ARG 554 HA ARG 554 -3.374 -9.673 17.856 849 HB2 ARG 554 2HB ARG 554 -4.987 -7.628 19.365 850 HB3 ARG 554 1HB ARG 554 -3.231 -7.741 19.349 851 HG2 ARG 554 2HG ARG 554 -3.172 -7.241 17.000 852 HG3 ARG 554 1HG ARG 554 -4.932 -7.256 16.917 853 HD2 ARG 554 2HD ARG 554 -5.001 -5.399 18.485 854 HD3 ARG 554 1HD ARG 554 -3.235 -5.340 18.506 855 HE ARG 554 HE ARG 554 -4.202 -5.189 15.866 856 HH11 ARG 554 1HH1 ARG 554 -3.942 -3.202 18.799 857 HH12 ARG 554 2HH1 ARG 554 -3.953 -1.728 17.964 858 HH21 ARG 554 1HH2 ARG 554 -4.204 -3.155 14.725 859 HH22 ARG 554 2HH2 ARG 554 -4.129 -1.696 15.582 860 H GLU 555 H GLU 555 -2.321 -10.182 19.752 861 HA GLU 555 HA GLU 555 -3.370 -12.249 21.299 862 HB2 GLU 555 2HB GLU 555 -1.125 -10.455 22.224 863 HB3 GLU 555 1HB GLU 555 -1.371 -12.140 22.607 864 HG2 GLU 555 2HG GLU 555 0.455 -12.071 21.130 865 HG3 GLU 555 1HG GLU 555 -0.909 -12.607 20.149 866 H MET 556 H MET 556 -4.876 -12.082 22.834 867 HA MET 556 HA MET 556 -5.418 -9.550 24.039 868 HB2 MET 556 2HB MET 556 -6.633 -12.260 24.605 869 HB3 MET 556 1HB MET 556 -7.177 -10.757 25.342 870 HG2 MET 556 2HG MET 556 -7.732 -9.878 23.123 871 HG3 MET 556 1HG MET 556 -7.211 -11.398 22.403 872 HE1 MET 556 3HE MET 556 -8.335 -13.532 24.540 873 HE2 MET 556 1HE MET 556 -8.476 -13.726 22.793 874 HE3 MET 556 2HE MET 556 -9.900 -13.901 23.815 875 H ASN 557 H ASN 557 -3.796 -8.907 25.174 876 HA ASN 557 HA ASN 557 -3.220 -10.163 27.726 877 HB2 ASN 557 2HB ASN 557 -1.587 -11.209 26.194 878 HB3 ASN 557 1HB ASN 557 -1.080 -9.618 25.648 879 HD21 ASN 557 1HD2 ASN 557 1.014 -9.887 26.267 880 HD22 ASN 557 2HD2 ASN 557 1.524 -9.925 27.909 881 H ALA 558 H ALA 558 -3.272 -8.491 29.153 882 HA ALA 558 HA ALA 558 -2.029 -5.975 28.507 883 HB1 ALA 558 1HB ALA 558 -4.039 -4.645 28.960 884 HB2 ALA 558 2HB ALA 558 -4.981 -6.125 29.133 885 HB3 ALA 558 3HB ALA 558 -4.286 -5.713 27.578 Start of MODEL 14 1 H1 GLY 448 1HT GLY 448 -15.622 -7.299 -24.474 2 H2 GLY 448 2HT GLY 448 -14.607 -8.510 -23.900 3 H3 GLY 448 3HT GLY 448 -14.707 -7.021 -23.105 4 HA2 GLY 448 1HA GLY 448 -16.946 -8.942 -23.368 5 HA3 GLY 448 2HA GLY 448 -15.982 -8.698 -21.912 6 H SER 449 H SER 449 -18.610 -8.334 -21.644 7 HA SER 449 HA SER 449 -19.281 -5.552 -22.092 8 HB2 SER 449 2HB SER 449 -20.830 -7.745 -20.702 9 HB3 SER 449 1HB SER 449 -21.463 -6.187 -21.238 10 HG SER 449 HG SER 449 -20.483 -6.973 -23.331 11 H VAL 450 H VAL 450 -19.434 -7.682 -19.245 12 HA VAL 450 HA VAL 450 -18.760 -5.362 -17.598 13 HB VAL 450 HB VAL 450 -20.090 -7.956 -16.768 14 HG11 VAL 450 1HG1 VAL 450 -20.609 -6.777 -14.681 15 HG12 VAL 450 2HG1 VAL 450 -19.704 -5.376 -15.252 16 HG13 VAL 450 3HG1 VAL 450 -18.872 -6.901 -14.951 17 HG21 VAL 450 3HG2 VAL 450 -21.328 -5.250 -17.275 18 HG22 VAL 450 1HG2 VAL 450 -22.170 -6.642 -16.593 19 HG23 VAL 450 2HG2 VAL 450 -21.557 -6.701 -18.247 20 H TYR 451 H TYR 451 -16.780 -5.361 -16.814 21 HA TYR 451 HA TYR 451 -15.297 -7.859 -16.805 22 HB2 TYR 451 2HB TYR 451 -14.356 -5.006 -16.466 23 HB3 TYR 451 1HB TYR 451 -13.309 -6.424 -16.416 24 HD1 TYR 451 2HD TYR 451 -13.057 -7.827 -18.459 25 HD2 TYR 451 1HD TYR 451 -15.039 -4.065 -18.533 26 HE1 TYR 451 2HE TYR 451 -12.806 -7.750 -20.897 27 HE2 TYR 451 1HE TYR 451 -14.795 -3.985 -20.974 28 HH TYR 451 HH TYR 451 -13.305 -4.959 -22.688 29 H ASN 452 H ASN 452 -15.260 -8.965 -15.015 30 HA ASN 452 HA ASN 452 -15.311 -7.503 -12.476 31 HB2 ASN 452 2HB ASN 452 -17.534 -8.503 -12.886 32 HB3 ASN 452 1HB ASN 452 -16.781 -10.078 -13.095 33 HD21 ASN 452 1HD2 ASN 452 -17.653 -7.599 -10.833 34 HD22 ASN 452 2HD2 ASN 452 -17.443 -8.537 -9.406 35 H THR 453 H THR 453 -13.778 -8.097 -11.097 36 HA THR 453 HA THR 453 -12.455 -10.662 -11.414 37 HB THR 453 HB THR 453 -10.973 -8.009 -11.297 38 HG1 THR 453 1HG THR 453 -11.650 -9.768 -13.389 39 HG21 THR 453 3HG2 THR 453 -9.967 -10.846 -11.617 40 HG22 THR 453 1HG2 THR 453 -9.780 -9.852 -10.174 41 HG23 THR 453 2HG2 THR 453 -8.965 -9.402 -11.676 42 H LYS 454 H LYS 454 -12.837 -11.489 -9.440 43 HA LYS 454 HA LYS 454 -12.962 -9.698 -7.168 44 HB2 LYS 454 2HB LYS 454 -13.581 -12.633 -7.377 45 HB3 LYS 454 1HB LYS 454 -13.750 -11.676 -5.917 46 HG2 LYS 454 2HG LYS 454 -15.431 -10.283 -7.033 47 HG3 LYS 454 1HG LYS 454 -15.262 -11.272 -8.487 48 HD2 LYS 454 2HD LYS 454 -15.972 -13.235 -7.248 49 HD3 LYS 454 1HD LYS 454 -16.099 -12.275 -5.776 50 HE2 LYS 454 2HE LYS 454 -17.838 -10.912 -6.832 51 HE3 LYS 454 1HE LYS 454 -17.715 -11.886 -8.295 52 HZ1 LYS 454 3HZ LYS 454 -19.563 -12.599 -6.905 53 HZ2 LYS 454 1HZ LYS 454 -18.514 -12.895 -5.619 54 HZ3 LYS 454 2HZ LYS 454 -18.409 -13.821 -7.013 55 H LYS 455 H LYS 455 -11.369 -9.388 -5.868 56 HA LYS 455 HA LYS 455 -9.368 -11.494 -5.462 57 HB2 LYS 455 2HB LYS 455 -8.866 -8.518 -5.649 58 HB3 LYS 455 1HB LYS 455 -7.658 -9.716 -5.215 59 HG2 LYS 455 2HG LYS 455 -7.850 -10.666 -7.478 60 HG3 LYS 455 1HG LYS 455 -9.037 -9.422 -7.885 61 HD2 LYS 455 2HD LYS 455 -7.338 -7.688 -7.356 62 HD3 LYS 455 1HD LYS 455 -6.173 -8.969 -7.057 63 HE2 LYS 455 2HE LYS 455 -6.391 -9.726 -9.365 64 HE3 LYS 455 1HE LYS 455 -7.589 -8.467 -9.663 65 HZ1 LYS 455 3HZ LYS 455 -4.751 -8.003 -8.909 66 HZ2 LYS 455 1HZ LYS 455 -5.875 -6.794 -9.199 67 HZ3 LYS 455 2HZ LYS 455 -5.398 -7.814 -10.453 68 H VAL 456 H VAL 456 -9.509 -12.061 -3.375 69 HA VAL 456 HA VAL 456 -10.874 -10.410 -1.469 70 HB VAL 456 HB VAL 456 -9.198 -12.907 -0.997 71 HG11 VAL 456 1HG1 VAL 456 -9.537 -11.640 1.053 72 HG12 VAL 456 2HG1 VAL 456 -10.462 -13.142 1.089 73 HG13 VAL 456 3HG1 VAL 456 -11.279 -11.613 0.760 74 HG21 VAL 456 3HG2 VAL 456 -12.167 -12.622 -1.435 75 HG22 VAL 456 1HG2 VAL 456 -11.340 -14.118 -1.001 76 HG23 VAL 456 2HG2 VAL 456 -11.015 -13.346 -2.553 77 H GLY 457 H GLY 457 -7.648 -11.099 -2.403 78 HA2 GLY 457 2HA GLY 457 -6.712 -8.963 -0.624 79 HA3 GLY 457 1HA GLY 457 -5.711 -10.330 -1.131 80 H LYS 458 H LYS 458 -6.674 -7.192 -1.883 81 HA LYS 458 HA LYS 458 -5.683 -7.512 -4.632 82 HB2 LYS 458 2HB LYS 458 -7.102 -5.535 -5.155 83 HB3 LYS 458 1HB LYS 458 -7.994 -6.989 -4.723 84 HG2 LYS 458 2HG LYS 458 -8.411 -6.116 -2.502 85 HG3 LYS 458 1HG LYS 458 -7.418 -4.704 -2.847 86 HD2 LYS 458 2HD LYS 458 -9.749 -4.148 -3.010 87 HD3 LYS 458 1HD LYS 458 -8.998 -4.038 -4.602 88 HE2 LYS 458 2HE LYS 458 -11.187 -5.071 -4.792 89 HE3 LYS 458 1HE LYS 458 -9.949 -6.271 -5.146 90 HZ1 LYS 458 3HZ LYS 458 -10.262 -7.253 -3.015 91 HZ2 LYS 458 1HZ LYS 458 -11.744 -7.067 -3.741 92 HZ3 LYS 458 2HZ LYS 458 -11.308 -6.028 -2.495 93 H ARG 459 H ARG 459 -4.323 -5.882 -5.467 94 HA ARG 459 HA ARG 459 -3.207 -4.106 -3.423 95 HB2 ARG 459 2HB ARG 459 -1.944 -5.213 -5.927 96 HB3 ARG 459 1HB ARG 459 -1.246 -3.893 -5.005 97 HG2 ARG 459 2HG ARG 459 -1.036 -5.323 -3.075 98 HG3 ARG 459 1HG ARG 459 -1.797 -6.652 -3.971 99 HD2 ARG 459 2HD ARG 459 0.072 -6.602 -5.574 100 HD3 ARG 459 1HD ARG 459 0.794 -5.260 -4.691 101 HE ARG 459 HE ARG 459 0.371 -7.660 -3.129 102 HH11 ARG 459 1HH1 ARG 459 2.668 -5.871 -5.169 103 HH12 ARG 459 2HH1 ARG 459 4.026 -6.675 -4.581 104 HH21 ARG 459 1HH2 ARG 459 2.273 -8.746 -2.313 105 HH22 ARG 459 2HH2 ARG 459 3.812 -8.352 -2.908 106 H LEU 460 H LEU 460 -3.224 -2.071 -3.660 107 HA LEU 460 HA LEU 460 -4.170 -0.884 -6.201 108 HB2 LEU 460 2HB LEU 460 -5.109 0.010 -3.459 109 HB3 LEU 460 1HB LEU 460 -5.480 0.808 -4.961 110 HG LEU 460 HG LEU 460 -6.739 -1.324 -5.603 111 HD11 LEU 460 1HD1 LEU 460 -6.453 -1.863 -2.662 112 HD12 LEU 460 2HD1 LEU 460 -5.790 -2.837 -3.976 113 HD13 LEU 460 3HD1 LEU 460 -7.536 -2.708 -3.766 114 HD21 LEU 460 3HD2 LEU 460 -7.710 0.318 -3.269 115 HD22 LEU 460 1HD2 LEU 460 -8.723 -0.660 -4.330 116 HD23 LEU 460 2HD2 LEU 460 -7.862 0.733 -4.977 117 H ASN 461 H ASN 461 -3.448 1.230 -6.592 118 HA ASN 461 HA ASN 461 -1.375 2.134 -4.741 119 HB2 ASN 461 2HB ASN 461 -0.192 3.221 -6.634 120 HB3 ASN 461 1HB ASN 461 -0.304 1.484 -6.860 121 HD21 ASN 461 1HD2 ASN 461 -1.581 0.694 -8.547 122 HD22 ASN 461 2HD2 ASN 461 -2.153 1.702 -9.818 123 H ILE 462 H ILE 462 -1.723 3.944 -3.775 124 HA ILE 462 HA ILE 462 -3.821 5.732 -4.826 125 HB ILE 462 HB ILE 462 -3.141 5.110 -1.922 126 HG12 ILE 462 2HG1 ILE 462 -5.603 4.328 -3.490 127 HG13 ILE 462 1HG1 ILE 462 -4.262 3.228 -3.151 128 HG21 ILE 462 1HG2 ILE 462 -3.998 7.392 -2.203 129 HG22 ILE 462 2HG2 ILE 462 -5.203 6.366 -1.407 130 HG23 ILE 462 3HG2 ILE 462 -5.378 6.762 -3.105 131 HD11 ILE 462 3HD1 ILE 462 -6.060 4.567 -1.151 132 HD12 ILE 462 1HD1 ILE 462 -4.734 3.472 -0.767 133 HD13 ILE 462 2HD1 ILE 462 -6.140 2.880 -1.659 134 H GLN 463 H GLN 463 -3.005 7.696 -5.332 135 HA GLN 463 HA GLN 463 -0.416 8.487 -4.240 136 HB2 GLN 463 2HB GLN 463 -2.100 9.730 -6.416 137 HB3 GLN 463 1HB GLN 463 -0.584 10.398 -5.837 138 HG2 GLN 463 2HG GLN 463 0.588 8.464 -6.543 139 HG3 GLN 463 1HG GLN 463 -0.912 7.692 -7.112 140 HE21 GLN 463 1HE2 GLN 463 1.548 10.034 -7.690 141 HE22 GLN 463 2HE2 GLN 463 1.080 10.466 -9.280 142 H LEU 464 H LEU 464 -0.171 9.916 -2.745 143 HA LEU 464 HA LEU 464 -2.463 11.611 -2.029 144 HB2 LEU 464 2HB LEU 464 -0.500 10.275 -0.199 145 HB3 LEU 464 1HB LEU 464 -1.789 11.345 0.304 146 HG LEU 464 HG LEU 464 -2.127 8.618 -0.942 147 HD11 LEU 464 1HD1 LEU 464 -2.576 9.603 1.858 148 HD12 LEU 464 2HD1 LEU 464 -1.288 8.525 1.321 149 HD13 LEU 464 3HD1 LEU 464 -2.971 7.995 1.254 150 HD21 LEU 464 3HD2 LEU 464 -4.505 8.897 -0.405 151 HD22 LEU 464 1HD2 LEU 464 -3.960 10.107 -1.568 152 HD23 LEU 464 2HD2 LEU 464 -4.190 10.547 0.125 153 H LYS 465 H LYS 465 -1.955 13.711 -1.743 154 HA LYS 465 HA LYS 465 0.892 14.513 -1.905 155 HB2 LYS 465 2HB LYS 465 0.116 16.706 -2.489 156 HB3 LYS 465 1HB LYS 465 -0.598 15.544 -3.591 157 HG2 LYS 465 2HG LYS 465 -2.694 15.660 -2.415 158 HG3 LYS 465 1HG LYS 465 -1.965 16.712 -1.205 159 HD2 LYS 465 2HD LYS 465 -2.245 17.410 -4.141 160 HD3 LYS 465 1HD LYS 465 -3.316 17.998 -2.866 161 HE2 LYS 465 2HE LYS 465 -1.383 19.071 -1.767 162 HE3 LYS 465 1HE LYS 465 -0.338 18.509 -3.065 163 HZ1 LYS 465 3HZ LYS 465 -0.980 20.791 -3.370 164 HZ2 LYS 465 1HZ LYS 465 -2.618 20.380 -3.381 165 HZ3 LYS 465 2HZ LYS 465 -1.616 19.849 -4.615 166 H LYS 466 H LYS 466 1.769 15.704 -0.484 167 HA LYS 466 HA LYS 466 0.771 15.387 2.175 168 HB2 LYS 466 2HB LYS 466 3.326 16.547 1.108 169 HB3 LYS 466 1HB LYS 466 2.863 16.798 2.778 170 HG2 LYS 466 2HG LYS 466 4.417 14.899 2.521 171 HG3 LYS 466 1HG LYS 466 2.873 14.402 3.197 172 HD2 LYS 466 2HD LYS 466 3.559 12.772 1.591 173 HD3 LYS 466 1HD LYS 466 2.197 13.658 0.915 174 HE2 LYS 466 2HE LYS 466 3.763 13.400 -0.818 175 HE3 LYS 466 1HE LYS 466 3.856 15.068 -0.302 176 HZ1 LYS 466 3HZ LYS 466 5.838 14.581 0.973 177 HZ2 LYS 466 1HZ LYS 466 6.065 14.105 -0.616 178 HZ3 LYS 466 2HZ LYS 466 5.772 12.952 0.548 179 H GLY 467 H GLY 467 -0.461 16.595 3.257 180 HA2 GLY 467 2HA GLY 467 -0.796 19.414 2.466 181 HA3 GLY 467 1HA GLY 467 -2.031 18.437 3.253 182 H THR 468 H THR 468 -2.360 19.602 5.107 183 HA THR 468 HA THR 468 -0.212 20.732 6.552 184 HB THR 468 HB THR 468 -2.028 21.155 8.287 185 HG1 THR 468 1HG THR 468 -4.026 20.523 7.879 186 HG21 THR 468 3HG2 THR 468 -1.401 22.829 6.597 187 HG22 THR 468 1HG2 THR 468 -3.135 22.868 6.910 188 HG23 THR 468 2HG2 THR 468 -2.521 22.094 5.449 189 H GLU 469 H GLU 469 -2.120 17.812 6.882 190 HA GLU 469 HA GLU 469 -0.693 17.054 9.328 191 HB2 GLU 469 2HB GLU 469 -2.849 15.609 7.794 192 HB3 GLU 469 1HB GLU 469 -2.220 15.146 9.365 193 HG2 GLU 469 2HG GLU 469 -3.769 17.666 8.749 194 HG3 GLU 469 1HG GLU 469 -4.348 16.186 9.522 195 H GLY 470 H GLY 470 0.123 17.055 6.253 196 HA2 GLY 470 2HA GLY 470 1.801 15.890 5.155 197 HA3 GLY 470 1HA GLY 470 1.774 14.689 6.448 198 H LEU 471 H LEU 471 1.116 12.779 5.812 199 HA LEU 471 HA LEU 471 -0.512 12.487 3.423 200 HB2 LEU 471 2HB LEU 471 0.769 10.477 5.249 201 HB3 LEU 471 1HB LEU 471 -0.242 10.082 3.872 202 HG LEU 471 HG LEU 471 2.337 11.640 3.649 203 HD11 LEU 471 1HD1 LEU 471 3.289 9.586 2.758 204 HD12 LEU 471 2HD1 LEU 471 1.782 8.729 3.070 205 HD13 LEU 471 3HD1 LEU 471 2.745 9.339 4.417 206 HD21 LEU 471 3HD2 LEU 471 2.108 11.130 1.275 207 HD22 LEU 471 1HD2 LEU 471 0.722 12.051 1.854 208 HD23 LEU 471 2HD2 LEU 471 0.580 10.315 1.593 209 H GLY 472 H GLY 472 -0.900 12.007 6.864 210 HA2 GLY 472 2HA GLY 472 -3.034 12.418 7.853 211 HA3 GLY 472 1HA GLY 472 -3.754 11.998 6.305 212 H PHE 473 H PHE 473 -1.298 9.873 7.525 213 HA PHE 473 HA PHE 473 -3.218 8.289 8.905 214 HB2 PHE 473 2HB PHE 473 -3.060 6.279 7.558 215 HB3 PHE 473 1HB PHE 473 -3.692 7.598 6.595 216 HD1 PHE 473 1HD PHE 473 -1.891 8.833 5.060 217 HD2 PHE 473 2HD PHE 473 -1.395 4.939 6.757 218 HE1 PHE 473 1HE PHE 473 -0.235 8.267 3.357 219 HE2 PHE 473 2HE PHE 473 0.268 4.423 5.045 220 HZ PHE 473 HZ PHE 473 0.825 6.122 3.339 221 H SER 474 H SER 474 -2.273 6.297 9.752 222 HA SER 474 HA SER 474 0.597 6.666 10.293 223 HB2 SER 474 2HB SER 474 -1.552 5.668 12.171 224 HB3 SER 474 1HB SER 474 0.154 5.899 12.557 225 HG SER 474 HG SER 474 -0.770 8.145 11.521 226 H ILE 475 H ILE 475 1.771 4.682 10.503 227 HA ILE 475 HA ILE 475 0.341 2.272 9.603 228 HB ILE 475 HB ILE 475 2.513 1.546 8.703 229 HG12 ILE 475 2HG1 ILE 475 3.285 4.432 9.034 230 HG13 ILE 475 1HG1 ILE 475 3.820 3.019 9.972 231 HG21 ILE 475 1HG2 ILE 475 0.800 2.273 7.206 232 HG22 ILE 475 2HG2 ILE 475 2.389 2.747 6.627 233 HG23 ILE 475 3HG2 ILE 475 1.324 3.964 7.354 234 HD11 ILE 475 3HD1 ILE 475 5.465 3.810 8.176 235 HD12 ILE 475 1HD1 ILE 475 4.270 3.307 6.988 236 HD13 ILE 475 2HD1 ILE 475 4.983 2.127 8.074 237 H THR 476 H THR 476 0.904 0.406 10.585 238 HA THR 476 HA THR 476 2.742 0.456 12.871 239 HB THR 476 HB THR 476 0.415 0.552 13.723 240 HG1 THR 476 1HG THR 476 1.979 -0.727 14.857 241 HG21 THR 476 3HG2 THR 476 -0.745 -0.487 11.823 242 HG22 THR 476 1HG2 THR 476 -1.148 -1.308 13.333 243 HG23 THR 476 2HG2 THR 476 0.003 -2.034 12.212 244 H SER 477 H SER 477 3.580 -1.723 13.339 245 HA SER 477 HA SER 477 3.194 -3.585 11.155 246 HB2 SER 477 2HB SER 477 5.410 -2.569 10.897 247 HB3 SER 477 1HB SER 477 5.758 -2.932 12.579 248 HG SER 477 HG SER 477 5.694 -4.612 10.338 249 H ARG 478 H ARG 478 3.021 -5.706 11.861 250 HA ARG 478 HA ARG 478 2.804 -6.007 14.774 251 HB2 ARG 478 2HB ARG 478 1.282 -7.887 14.329 252 HB3 ARG 478 1HB ARG 478 0.687 -6.399 13.612 253 HG2 ARG 478 2HG ARG 478 1.435 -7.104 11.431 254 HG3 ARG 478 1HG ARG 478 2.167 -8.550 12.122 255 HD2 ARG 478 2HD ARG 478 0.050 -9.061 11.087 256 HD3 ARG 478 1HD ARG 478 -0.033 -9.330 12.824 257 HE ARG 478 HE ARG 478 -1.000 -6.820 12.554 258 HH11 ARG 478 1HH1 ARG 478 -1.786 -9.859 10.952 259 HH12 ARG 478 2HH1 ARG 478 -3.420 -9.498 10.715 260 HH21 ARG 478 1HH2 ARG 478 -3.228 -6.299 12.251 261 HH22 ARG 478 2HH2 ARG 478 -4.288 -7.402 11.479 262 H ASP 479 H ASP 479 3.778 -7.786 15.755 263 HA ASP 479 HA ASP 479 6.018 -8.893 14.383 264 HB2 ASP 479 2HB ASP 479 6.126 -8.548 16.815 265 HB3 ASP 479 1HB ASP 479 4.787 -9.665 17.046 266 H VAL 480 H VAL 480 6.076 -10.644 13.217 267 HA VAL 480 HA VAL 480 3.668 -12.297 13.136 268 HB VAL 480 HB VAL 480 4.383 -12.939 10.828 269 HG11 VAL 480 1HG1 VAL 480 4.022 -9.979 11.304 270 HG12 VAL 480 2HG1 VAL 480 2.730 -11.172 11.163 271 HG13 VAL 480 3HG1 VAL 480 3.753 -10.813 9.773 272 HG21 VAL 480 3HG2 VAL 480 6.445 -10.760 11.214 273 HG22 VAL 480 1HG2 VAL 480 6.089 -11.573 9.692 274 HG23 VAL 480 2HG2 VAL 480 6.776 -12.482 11.038 275 H THR 481 H THR 481 3.829 -14.511 13.047 276 HA THR 481 HA THR 481 6.045 -15.629 14.466 277 HB THR 481 HB THR 481 3.652 -16.983 13.181 278 HG1 THR 481 1HG THR 481 3.996 -15.521 15.543 279 HG21 THR 481 3HG2 THR 481 5.478 -18.517 13.844 280 HG22 THR 481 1HG2 THR 481 4.045 -18.743 14.842 281 HG23 THR 481 2HG2 THR 481 5.427 -17.855 15.477 282 H ILE 482 H ILE 482 4.964 -15.359 11.186 283 HA ILE 482 HA ILE 482 6.581 -17.480 10.182 284 HB ILE 482 HB ILE 482 5.927 -16.697 7.916 285 HG12 ILE 482 2HG1 ILE 482 4.050 -14.952 7.779 286 HG13 ILE 482 1HG1 ILE 482 4.492 -14.477 9.409 287 HG21 ILE 482 1HG2 ILE 482 3.537 -17.168 8.122 288 HG22 ILE 482 2HG2 ILE 482 3.671 -16.982 9.870 289 HG23 ILE 482 3HG2 ILE 482 4.544 -18.280 9.052 290 HD11 ILE 482 3HD1 ILE 482 6.702 -13.818 8.596 291 HD12 ILE 482 1HD1 ILE 482 5.412 -12.967 7.745 292 HD13 ILE 482 2HD1 ILE 482 6.244 -14.313 6.966 293 H GLY 483 H GLY 483 8.297 -17.212 8.571 294 HA2 GLY 483 2HA GLY 483 10.185 -15.250 9.564 295 HA3 GLY 483 1HA GLY 483 10.533 -16.580 8.468 296 H GLY 484 H GLY 484 11.287 -13.752 8.295 297 HA2 GLY 484 2HA GLY 484 11.706 -13.045 5.929 298 HA3 GLY 484 1HA GLY 484 9.955 -13.096 5.755 299 H SER 485 H SER 485 8.797 -11.339 6.292 300 HA SER 485 HA SER 485 10.147 -9.238 7.785 301 HB2 SER 485 2HB SER 485 9.070 -7.611 6.171 302 HB3 SER 485 1HB SER 485 10.382 -8.578 5.494 303 HG SER 485 HG SER 485 9.039 -9.631 4.295 304 H ALA 486 H ALA 486 8.683 -7.747 8.777 305 HA ALA 486 HA ALA 486 6.105 -8.937 9.427 306 HB1 ALA 486 1HB ALA 486 6.135 -7.384 11.336 307 HB2 ALA 486 2HB ALA 486 7.666 -6.722 10.769 308 HB3 ALA 486 3HB ALA 486 7.577 -8.398 11.311 309 HA PRO 487 HA PRO 487 4.631 -6.052 6.301 310 HB2 PRO 487 2HB PRO 487 2.006 -6.925 7.382 311 HB3 PRO 487 1HB PRO 487 2.580 -6.893 5.712 312 HG2 PRO 487 2HG PRO 487 2.401 -9.194 7.025 313 HG3 PRO 487 1HG PRO 487 3.771 -8.869 5.949 314 HD2 PRO 487 2HD PRO 487 3.649 -8.770 8.936 315 HD3 PRO 487 1HD PRO 487 4.933 -9.388 7.871 316 H ILE 488 H ILE 488 3.729 -4.069 6.221 317 HA ILE 488 HA ILE 488 3.221 -2.740 8.774 318 HB ILE 488 HB ILE 488 4.059 -1.549 6.042 319 HG12 ILE 488 2HG1 ILE 488 5.717 -2.550 7.806 320 HG13 ILE 488 1HG1 ILE 488 6.045 -0.990 7.076 321 HG21 ILE 488 1HG2 ILE 488 3.895 0.590 6.964 322 HG22 ILE 488 2HG2 ILE 488 3.206 -0.125 8.430 323 HG23 ILE 488 3HG2 ILE 488 2.308 -0.213 6.916 324 HD11 ILE 488 3HD1 ILE 488 5.282 0.156 8.992 325 HD12 ILE 488 1HD1 ILE 488 6.434 -1.050 9.534 326 HD13 ILE 488 2HD1 ILE 488 4.668 -1.293 9.746 327 H TYR 489 H TYR 489 1.248 -2.195 9.280 328 HA TYR 489 HA TYR 489 -0.781 -2.090 7.121 329 HB2 TYR 489 2HB TYR 489 -1.462 -2.803 10.034 330 HB3 TYR 489 1HB TYR 489 -2.473 -2.735 8.649 331 HD1 TYR 489 2HD TYR 489 0.521 -4.589 9.831 332 HD2 TYR 489 1HD TYR 489 -2.967 -4.553 7.416 333 HE1 TYR 489 2HE TYR 489 0.883 -6.942 9.305 334 HE2 TYR 489 1HE TYR 489 -2.622 -6.909 6.869 335 HH TYR 489 HH TYR 489 -0.827 -8.516 6.803 336 H VAL 490 H VAL 490 -2.134 -0.421 7.123 337 HA VAL 490 HA VAL 490 -1.347 1.962 8.440 338 HB VAL 490 HB VAL 490 -4.024 1.279 7.179 339 HG11 VAL 490 1HG1 VAL 490 -2.817 3.949 7.906 340 HG12 VAL 490 2HG1 VAL 490 -4.209 3.192 8.671 341 HG13 VAL 490 3HG1 VAL 490 -4.311 3.715 6.991 342 HG21 VAL 490 3HG2 VAL 490 -2.185 1.070 5.611 343 HG22 VAL 490 1HG2 VAL 490 -1.623 2.691 6.032 344 HG23 VAL 490 2HG2 VAL 490 -3.181 2.478 5.235 345 H LYS 491 H LYS 491 -1.567 2.385 10.523 346 HA LYS 491 HA LYS 491 -3.202 0.637 12.173 347 HB2 LYS 491 2HB LYS 491 -0.962 1.495 12.861 348 HB3 LYS 491 1HB LYS 491 -1.676 3.085 13.041 349 HG2 LYS 491 2HG LYS 491 -3.161 2.273 14.797 350 HG3 LYS 491 1HG LYS 491 -2.537 0.638 14.599 351 HD2 LYS 491 2HD LYS 491 -1.489 1.620 16.525 352 HD3 LYS 491 1HD LYS 491 -0.272 1.494 15.267 353 HE2 LYS 491 2HE LYS 491 -0.034 3.625 16.328 354 HE3 LYS 491 1HE LYS 491 -0.692 3.898 14.720 355 HZ1 LYS 491 3HZ LYS 491 -2.911 4.113 15.726 356 HZ2 LYS 491 1HZ LYS 491 -1.836 5.232 16.357 357 HZ3 LYS 491 2HZ LYS 491 -2.241 3.861 17.251 358 H ASN 492 H ASN 492 -3.357 3.958 11.047 359 HA ASN 492 HA ASN 492 -6.131 4.177 11.756 360 HB2 ASN 492 2HB ASN 492 -4.127 5.986 13.146 361 HB3 ASN 492 1HB ASN 492 -5.840 6.325 13.032 362 HD21 ASN 492 1HD2 ASN 492 -7.270 5.050 14.239 363 HD22 ASN 492 2HD2 ASN 492 -6.720 4.132 15.597 364 H ILE 493 H ILE 493 -7.083 5.990 10.861 365 HA ILE 493 HA ILE 493 -5.501 7.410 8.842 366 HB ILE 493 HB ILE 493 -8.507 6.885 8.988 367 HG12 ILE 493 2HG1 ILE 493 -7.257 4.866 8.432 368 HG13 ILE 493 1HG1 ILE 493 -8.201 5.472 7.067 369 HG21 ILE 493 1HG2 ILE 493 -6.882 8.158 6.793 370 HG22 ILE 493 2HG2 ILE 493 -8.044 8.995 7.862 371 HG23 ILE 493 3HG2 ILE 493 -8.589 7.767 6.715 372 HD11 ILE 493 3HD1 ILE 493 -6.006 4.692 6.344 373 HD12 ILE 493 1HD1 ILE 493 -5.232 5.803 7.464 374 HD13 ILE 493 2HD1 ILE 493 -6.159 6.432 6.099 375 H LEU 494 H LEU 494 -5.321 9.577 9.167 376 HA LEU 494 HA LEU 494 -6.202 10.551 11.722 377 HB2 LEU 494 2HB LEU 494 -4.614 11.955 9.566 378 HB3 LEU 494 1HB LEU 494 -4.822 12.501 11.213 379 HG LEU 494 HG LEU 494 -3.287 10.063 10.312 380 HD11 LEU 494 1HD1 LEU 494 -2.122 12.130 9.864 381 HD12 LEU 494 2HD1 LEU 494 -1.345 11.251 11.179 382 HD13 LEU 494 3HD1 LEU 494 -2.364 12.646 11.532 383 HD21 LEU 494 3HD2 LEU 494 -3.722 11.119 13.105 384 HD22 LEU 494 1HD2 LEU 494 -2.627 9.810 12.663 385 HD23 LEU 494 2HD2 LEU 494 -4.366 9.614 12.446 386 HA PRO 495 HA PRO 495 -9.926 12.753 10.717 387 HB2 PRO 495 2HB PRO 495 -8.503 15.066 11.964 388 HB3 PRO 495 1HB PRO 495 -10.146 14.481 12.248 389 HG2 PRO 495 2HG PRO 495 -8.237 13.924 13.988 390 HG3 PRO 495 1HG PRO 495 -9.426 12.687 13.540 391 HD2 PRO 495 2HD PRO 495 -6.565 12.925 12.754 392 HD3 PRO 495 1HD PRO 495 -7.558 11.482 13.011 393 H ARG 496 H ARG 496 -6.870 14.405 10.016 394 HA ARG 496 HA ARG 496 -8.107 15.441 7.565 395 HB2 ARG 496 2HB ARG 496 -6.070 16.822 9.314 396 HB3 ARG 496 1HB ARG 496 -6.556 17.382 7.717 397 HG2 ARG 496 2HG ARG 496 -8.794 17.773 8.577 398 HG3 ARG 496 1HG ARG 496 -8.288 17.172 10.164 399 HD2 ARG 496 2HD ARG 496 -6.595 18.918 10.287 400 HD3 ARG 496 1HD ARG 496 -7.088 19.518 8.706 401 HE ARG 496 HE ARG 496 -9.329 19.504 10.290 402 HH11 ARG 496 1HH1 ARG 496 -6.174 21.057 10.285 403 HH12 ARG 496 2HH1 ARG 496 -6.683 22.472 11.080 404 HH21 ARG 496 1HH2 ARG 496 -10.083 21.479 11.357 405 HH22 ARG 496 2HH2 ARG 496 -8.979 22.726 11.683 406 H GLY 497 H GLY 497 -6.628 15.598 5.777 407 HA2 GLY 497 2HA GLY 497 -4.180 15.309 5.260 408 HA3 GLY 497 1HA GLY 497 -4.369 13.763 6.073 409 H ALA 498 H ALA 498 -3.503 13.995 3.475 410 HA ALA 498 HA ALA 498 -5.461 13.939 1.487 411 HB1 ALA 498 1HB ALA 498 -2.771 12.622 1.494 412 HB2 ALA 498 2HB ALA 498 -3.102 14.295 1.042 413 HB3 ALA 498 3HB ALA 498 -3.744 12.971 0.066 414 H ALA 499 H ALA 499 -4.115 11.315 3.419 415 HA ALA 499 HA ALA 499 -5.130 9.151 1.969 416 HB1 ALA 499 1HB ALA 499 -3.473 8.838 3.722 417 HB2 ALA 499 2HB ALA 499 -4.881 7.841 4.034 418 HB3 ALA 499 3HB ALA 499 -4.637 9.329 4.951 419 H ILE 500 H ILE 500 -6.614 11.006 4.588 420 HA ILE 500 HA ILE 500 -8.926 9.351 4.492 421 HB ILE 500 HB ILE 500 -8.182 10.499 6.626 422 HG12 ILE 500 2HG1 ILE 500 -11.017 11.108 5.767 423 HG13 ILE 500 1HG1 ILE 500 -10.452 9.542 6.306 424 HG21 ILE 500 1HG2 ILE 500 -7.638 12.688 5.723 425 HG22 ILE 500 2HG2 ILE 500 -8.845 12.828 7.005 426 HG23 ILE 500 3HG2 ILE 500 -9.332 12.953 5.313 427 HD11 ILE 500 3HD1 ILE 500 -10.470 12.046 7.976 428 HD12 ILE 500 1HD1 ILE 500 -9.955 10.444 8.498 429 HD13 ILE 500 2HD1 ILE 500 -11.644 10.728 8.067 430 H GLN 501 H GLN 501 -7.947 12.369 3.050 431 HA GLN 501 HA GLN 501 -10.474 13.217 2.114 432 HB2 GLN 501 2HB GLN 501 -7.798 13.609 0.745 433 HB3 GLN 501 1HB GLN 501 -9.262 14.500 0.388 434 HG2 GLN 501 2HG GLN 501 -7.691 14.589 2.954 435 HG3 GLN 501 1HG GLN 501 -7.714 15.823 1.705 436 HE21 GLN 501 1HE2 GLN 501 -10.660 15.533 1.330 437 HE22 GLN 501 2HE2 GLN 501 -11.345 16.310 2.699 438 H ASP 502 H ASP 502 -8.024 11.094 0.725 439 HA ASP 502 HA ASP 502 -9.384 10.536 -1.696 440 HB2 ASP 502 2HB ASP 502 -6.982 10.092 -1.376 441 HB3 ASP 502 1HB ASP 502 -7.369 8.861 -0.179 442 H GLY 503 H GLY 503 -9.131 8.750 1.368 443 HA2 GLY 503 2HA GLY 503 -10.878 7.735 2.494 444 HA3 GLY 503 1HA GLY 503 -11.896 7.960 1.092 445 H ARG 504 H ARG 504 -9.399 6.535 -0.369 446 HA ARG 504 HA ARG 504 -10.633 3.949 -0.120 447 HB2 ARG 504 2HB ARG 504 -8.276 4.894 -1.727 448 HB3 ARG 504 1HB ARG 504 -8.880 3.241 -1.768 449 HG2 ARG 504 2HG ARG 504 -10.970 3.966 -2.673 450 HG3 ARG 504 1HG ARG 504 -10.517 5.661 -2.472 451 HD2 ARG 504 2HD ARG 504 -9.071 3.683 -4.216 452 HD3 ARG 504 1HD ARG 504 -10.252 4.864 -4.792 453 HE ARG 504 HE ARG 504 -8.395 6.268 -3.335 454 HH11 ARG 504 1HH1 ARG 504 -8.280 4.239 -6.223 455 HH12 ARG 504 2HH1 ARG 504 -7.053 5.156 -6.982 456 HH21 ARG 504 1HH2 ARG 504 -6.798 7.498 -4.349 457 HH22 ARG 504 2HH2 ARG 504 -6.149 7.088 -5.874 458 H LEU 505 H LEU 505 -7.587 5.404 0.693 459 HA LEU 505 HA LEU 505 -6.481 3.072 1.903 460 HB2 LEU 505 2HB LEU 505 -5.122 4.904 0.966 461 HB3 LEU 505 1HB LEU 505 -5.757 5.989 2.180 462 HG LEU 505 HG LEU 505 -4.615 4.702 3.936 463 HD11 LEU 505 1HD1 LEU 505 -3.536 3.082 1.634 464 HD12 LEU 505 2HD1 LEU 505 -4.607 2.494 2.917 465 HD13 LEU 505 3HD1 LEU 505 -2.971 3.015 3.297 466 HD21 LEU 505 3HD2 LEU 505 -2.839 5.520 1.651 467 HD22 LEU 505 1HD2 LEU 505 -2.344 5.329 3.330 468 HD23 LEU 505 2HD2 LEU 505 -3.498 6.587 2.895 469 H LYS 506 H LYS 506 -7.053 2.282 3.783 470 HA LYS 506 HA LYS 506 -7.929 3.963 5.936 471 HB2 LYS 506 2HB LYS 506 -9.704 1.829 4.759 472 HB3 LYS 506 1HB LYS 506 -9.927 2.424 6.396 473 HG2 LYS 506 2HG LYS 506 -10.256 4.695 5.497 474 HG3 LYS 506 1HG LYS 506 -10.067 4.055 3.868 475 HD2 LYS 506 2HD LYS 506 -12.034 2.670 4.166 476 HD3 LYS 506 1HD LYS 506 -12.212 3.242 5.830 477 HE2 LYS 506 2HE LYS 506 -12.548 5.516 5.028 478 HE3 LYS 506 1HE LYS 506 -12.300 4.985 3.370 479 HZ1 LYS 506 3HZ LYS 506 -14.624 5.260 3.896 480 HZ2 LYS 506 1HZ LYS 506 -14.513 4.129 5.144 481 HZ3 LYS 506 2HZ LYS 506 -14.293 3.644 3.538 482 H ALA 507 H ALA 507 -8.115 2.772 7.967 483 HA ALA 507 HA ALA 507 -5.699 1.432 8.372 484 HB1 ALA 507 1HB ALA 507 -6.362 1.183 10.669 485 HB2 ALA 507 2HB ALA 507 -8.048 1.494 10.250 486 HB3 ALA 507 3HB ALA 507 -6.851 2.778 10.088 487 H GLY 508 H GLY 508 -5.047 -0.495 8.668 488 HA2 GLY 508 2HA GLY 508 -5.272 -2.756 9.191 489 HA3 GLY 508 1HA GLY 508 -6.902 -2.795 8.612 490 H ASP 509 H ASP 509 -5.421 -1.121 6.214 491 HA ASP 509 HA ASP 509 -4.829 -3.585 4.813 492 HB2 ASP 509 2HB ASP 509 -4.701 -2.272 2.732 493 HB3 ASP 509 1HB ASP 509 -6.143 -1.909 3.685 494 H ARG 510 H ARG 510 -2.867 -3.696 3.454 495 HA ARG 510 HA ARG 510 -0.811 -2.841 5.318 496 HB2 ARG 510 2HB ARG 510 0.424 -4.880 5.069 497 HB3 ARG 510 1HB ARG 510 -1.251 -5.241 5.431 498 HG2 ARG 510 2HG ARG 510 -1.606 -5.772 3.053 499 HG3 ARG 510 1HG ARG 510 0.144 -5.527 2.802 500 HD2 ARG 510 2HD ARG 510 0.536 -7.231 4.596 501 HD3 ARG 510 1HD ARG 510 -1.188 -7.568 4.580 502 HE ARG 510 HE ARG 510 0.465 -7.895 2.177 503 HH11 ARG 510 1HH1 ARG 510 -1.993 -9.272 4.395 504 HH12 ARG 510 2HH1 ARG 510 -1.923 -10.802 3.694 505 HH21 ARG 510 1HH2 ARG 510 0.494 -10.018 1.231 506 HH22 ARG 510 2HH2 ARG 510 -0.515 -11.245 1.860 507 H LEU 511 H LEU 511 0.776 -1.775 4.676 508 HA LEU 511 HA LEU 511 0.775 -0.742 2.002 509 HB2 LEU 511 2HB LEU 511 1.475 0.340 4.428 510 HB3 LEU 511 1HB LEU 511 3.018 -0.276 3.916 511 HG LEU 511 HG LEU 511 1.372 1.817 2.521 512 HD11 LEU 511 1HD1 LEU 511 2.442 2.656 4.454 513 HD12 LEU 511 2HD1 LEU 511 3.247 3.293 3.023 514 HD13 LEU 511 3HD1 LEU 511 3.995 1.992 3.945 515 HD21 LEU 511 3HD2 LEU 511 4.052 0.713 1.627 516 HD22 LEU 511 1HD2 LEU 511 3.197 2.081 0.926 517 HD23 LEU 511 2HD2 LEU 511 2.510 0.463 0.821 518 H ILE 512 H ILE 512 1.805 -1.643 0.367 519 HA ILE 512 HA ILE 512 3.583 -3.909 0.832 520 HB ILE 512 HB ILE 512 2.332 -2.858 -1.722 521 HG12 ILE 512 2HG1 ILE 512 0.661 -3.802 -0.220 522 HG13 ILE 512 1HG1 ILE 512 0.918 -4.861 -1.589 523 HG21 ILE 512 1HG2 ILE 512 3.933 -5.374 -1.268 524 HG22 ILE 512 2HG2 ILE 512 4.433 -3.967 -2.205 525 HG23 ILE 512 3HG2 ILE 512 3.079 -4.957 -2.752 526 HD11 ILE 512 3HD1 ILE 512 2.357 -6.300 -0.224 527 HD12 ILE 512 1HD1 ILE 512 0.736 -6.163 0.441 528 HD13 ILE 512 2HD1 ILE 512 2.060 -5.264 1.173 529 H GLU 513 H GLU 513 3.506 -1.043 -1.260 530 HA GLU 513 HA GLU 513 6.273 -0.654 -0.676 531 HB2 GLU 513 2HB GLU 513 6.957 -0.556 -3.042 532 HB3 GLU 513 1HB GLU 513 6.436 -2.163 -2.562 533 HG2 GLU 513 2HG GLU 513 4.257 -1.700 -3.615 534 HG3 GLU 513 1HG GLU 513 4.916 -0.153 -4.159 535 H VAL 514 H VAL 514 6.925 1.286 -1.003 536 HA VAL 514 HA VAL 514 5.002 3.323 -1.910 537 HB VAL 514 HB VAL 514 5.020 3.359 0.546 538 HG11 VAL 514 1HG1 VAL 514 7.085 4.005 1.785 539 HG12 VAL 514 2HG1 VAL 514 7.976 3.809 0.248 540 HG13 VAL 514 3HG1 VAL 514 7.192 2.434 0.980 541 HG21 VAL 514 3HG2 VAL 514 5.548 5.719 0.886 542 HG22 VAL 514 1HG2 VAL 514 4.741 5.469 -0.674 543 HG23 VAL 514 2HG2 VAL 514 6.475 5.722 -0.611 544 H ASN 515 H ASN 515 5.839 4.780 -3.351 545 HA ASN 515 HA ASN 515 7.332 5.921 -4.700 546 HB2 ASN 515 2HB ASN 515 9.136 5.609 -2.282 547 HB3 ASN 515 1HB ASN 515 9.568 6.551 -3.698 548 HD21 ASN 515 1HD2 ASN 515 6.880 7.638 -4.078 549 HD22 ASN 515 2HD2 ASN 515 6.656 8.785 -2.823 550 H GLY 516 H GLY 516 7.281 2.920 -4.583 551 HA2 GLY 516 2HA GLY 516 8.256 1.385 -6.057 552 HA3 GLY 516 1HA GLY 516 9.545 2.550 -6.353 553 H VAL 517 H VAL 517 9.052 2.265 -3.039 554 HA VAL 517 HA VAL 517 11.348 0.485 -2.807 555 HB VAL 517 HB VAL 517 10.039 2.369 -0.816 556 HG11 VAL 517 1HG1 VAL 517 12.511 0.663 -0.509 557 HG12 VAL 517 2HG1 VAL 517 10.980 0.480 0.365 558 HG13 VAL 517 3HG1 VAL 517 11.982 1.901 0.627 559 HG21 VAL 517 3HG2 VAL 517 11.252 3.567 -2.559 560 HG22 VAL 517 1HG2 VAL 517 12.682 2.583 -2.259 561 HG23 VAL 517 2HG2 VAL 517 12.100 3.694 -1.018 562 H ASP 518 H ASP 518 10.857 -1.550 -2.349 563 HA ASP 518 HA ASP 518 8.224 -2.163 -1.359 564 HB2 ASP 518 2HB ASP 518 8.850 -4.522 -1.594 565 HB3 ASP 518 1HB ASP 518 9.183 -3.640 -3.075 566 H LEU 519 H LEU 519 7.707 -2.630 0.615 567 HA LEU 519 HA LEU 519 9.860 -2.506 2.516 568 HB2 LEU 519 2HB LEU 519 7.656 -2.258 4.107 569 HB3 LEU 519 1HB LEU 519 8.658 -0.994 3.407 570 HG LEU 519 HG LEU 519 6.195 -1.874 1.891 571 HD11 LEU 519 1HD1 LEU 519 6.323 0.197 4.081 572 HD12 LEU 519 2HD1 LEU 519 5.477 -1.361 4.211 573 HD13 LEU 519 3HD1 LEU 519 4.966 -0.161 3.024 574 HD21 LEU 519 3HD2 LEU 519 7.675 0.734 2.176 575 HD22 LEU 519 1HD2 LEU 519 6.294 0.405 1.129 576 HD23 LEU 519 2HD2 LEU 519 7.828 -0.407 0.838 577 H ALA 520 H ALA 520 8.933 -4.785 0.982 578 HA ALA 520 HA ALA 520 8.484 -6.707 3.107 579 HB1 ALA 520 1HB ALA 520 7.477 -7.140 0.904 580 HB2 ALA 520 2HB ALA 520 8.659 -8.389 1.301 581 HB3 ALA 520 3HB ALA 520 9.077 -7.108 0.164 582 H GLY 521 H GLY 521 11.012 -5.313 1.176 583 HA2 GLY 521 2HA GLY 521 13.039 -7.032 2.378 584 HA3 GLY 521 1HA GLY 521 13.302 -5.850 1.101 585 H LYS 522 H LYS 522 12.016 -3.655 2.281 586 HA LYS 522 HA LYS 522 14.031 -2.700 4.032 587 HB2 LYS 522 2HB LYS 522 11.422 -1.548 3.099 588 HB3 LYS 522 1HB LYS 522 12.353 -0.767 4.356 589 HG2 LYS 522 2HG LYS 522 13.440 -1.401 1.624 590 HG3 LYS 522 1HG LYS 522 12.698 0.143 2.069 591 HD2 LYS 522 2HD LYS 522 14.365 0.394 3.867 592 HD3 LYS 522 1HD LYS 522 15.150 -1.095 3.342 593 HE2 LYS 522 2HE LYS 522 15.615 -0.069 1.172 594 HE3 LYS 522 1HE LYS 522 14.775 1.390 1.682 595 HZ1 LYS 522 3HZ LYS 522 17.153 1.630 1.894 596 HZ2 LYS 522 1HZ LYS 522 17.246 0.304 2.927 597 HZ3 LYS 522 2HZ LYS 522 16.437 1.691 3.430 598 H SER 523 H SER 523 13.927 -2.129 6.165 599 HA SER 523 HA SER 523 12.397 -3.858 7.802 600 HB2 SER 523 2HB SER 523 14.665 -3.194 8.452 601 HB3 SER 523 1HB SER 523 14.179 -1.505 8.507 602 HG SER 523 HG SER 523 14.271 -2.699 10.541 603 H GLN 524 H GLN 524 10.961 -3.137 9.459 604 HA GLN 524 HA GLN 524 8.886 -1.492 8.557 605 HB2 GLN 524 2HB GLN 524 7.979 -1.733 10.872 606 HB3 GLN 524 1HB GLN 524 8.426 -3.259 10.127 607 HG2 GLN 524 2HG GLN 524 10.518 -3.247 11.416 608 HG3 GLN 524 1HG GLN 524 10.030 -1.736 12.176 609 HE21 GLN 524 1HE2 GLN 524 8.356 -1.769 13.678 610 HE22 GLN 524 2HE2 GLN 524 7.807 -3.225 14.421 611 H GLU 525 H GLU 525 11.678 -0.817 10.451 612 HA GLU 525 HA GLU 525 10.881 1.656 11.616 613 HB2 GLU 525 2HB GLU 525 12.785 0.401 12.473 614 HB3 GLU 525 1HB GLU 525 13.635 0.618 10.952 615 HG2 GLU 525 2HG GLU 525 13.596 3.071 11.350 616 HG3 GLU 525 1HG GLU 525 12.894 2.761 12.931 617 H GLU 526 H GLU 526 12.456 0.742 8.637 618 HA GLU 526 HA GLU 526 13.400 3.167 7.679 619 HB2 GLU 526 2HB GLU 526 12.231 0.838 6.179 620 HB3 GLU 526 1HB GLU 526 13.142 2.144 5.443 621 HG2 GLU 526 2HG GLU 526 14.199 0.333 7.569 622 HG3 GLU 526 1HG GLU 526 14.407 0.045 5.844 623 H VAL 527 H VAL 527 10.316 1.558 7.205 624 HA VAL 527 HA VAL 527 9.378 3.748 5.673 625 HB VAL 527 HB VAL 527 7.293 2.511 5.346 626 HG11 VAL 527 1HG1 VAL 527 8.286 0.692 4.104 627 HG12 VAL 527 2HG1 VAL 527 9.782 0.881 5.018 628 HG13 VAL 527 3HG1 VAL 527 9.254 2.165 3.914 629 HG21 VAL 527 3HG2 VAL 527 8.588 0.386 7.047 630 HG22 VAL 527 1HG2 VAL 527 7.055 0.247 6.163 631 HG23 VAL 527 2HG2 VAL 527 7.187 1.349 7.530 632 H VAL 528 H VAL 528 8.864 2.669 8.962 633 HA VAL 528 HA VAL 528 6.716 4.397 9.487 634 HB VAL 528 HB VAL 528 8.875 3.394 11.391 635 HG11 VAL 528 1HG1 VAL 528 7.873 5.477 12.252 636 HG12 VAL 528 2HG1 VAL 528 7.368 4.080 13.208 637 HG13 VAL 528 3HG1 VAL 528 6.266 4.789 12.027 638 HG21 VAL 528 3HG2 VAL 528 6.008 2.548 10.952 639 HG22 VAL 528 1HG2 VAL 528 7.103 1.876 12.154 640 HG23 VAL 528 2HG2 VAL 528 7.437 1.655 10.437 641 H SER 529 H SER 529 10.177 4.983 9.560 642 HA SER 529 HA SER 529 9.898 7.653 10.420 643 HB2 SER 529 2HB SER 529 12.023 6.319 10.593 644 HB3 SER 529 1HB SER 529 12.199 6.446 8.847 645 HG SER 529 HG SER 529 12.889 8.431 9.060 646 H LEU 530 H LEU 530 9.987 6.166 7.225 647 HA LEU 530 HA LEU 530 10.092 8.500 5.647 648 HB2 LEU 530 2HB LEU 530 8.998 5.799 5.253 649 HB3 LEU 530 1HB LEU 530 8.888 6.944 3.937 650 HG LEU 530 HG LEU 530 11.400 5.788 5.197 651 HD11 LEU 530 1HD1 LEU 530 10.214 5.457 2.443 652 HD12 LEU 530 2HD1 LEU 530 10.223 4.240 3.721 653 HD13 LEU 530 3HD1 LEU 530 11.741 4.775 3.002 654 HD21 LEU 530 3HD2 LEU 530 12.638 7.001 3.466 655 HD22 LEU 530 1HD2 LEU 530 11.787 8.112 4.539 656 HD23 LEU 530 2HD2 LEU 530 11.142 7.769 2.933 657 H LEU 531 H LEU 531 7.247 6.543 6.663 658 HA LEU 531 HA LEU 531 5.408 8.267 5.483 659 HB2 LEU 531 2HB LEU 531 5.193 5.968 7.417 660 HB3 LEU 531 1HB LEU 531 3.795 6.948 7.014 661 HG LEU 531 HG LEU 531 3.912 4.865 5.802 662 HD11 LEU 531 1HD1 LEU 531 2.753 6.717 4.778 663 HD12 LEU 531 2HD1 LEU 531 3.541 5.742 3.540 664 HD13 LEU 531 3HD1 LEU 531 4.250 7.278 4.031 665 HD21 LEU 531 3HD2 LEU 531 6.395 5.941 4.478 666 HD22 LEU 531 1HD2 LEU 531 5.519 4.496 3.977 667 HD23 LEU 531 2HD2 LEU 531 6.304 4.550 5.557 668 H ARG 532 H ARG 532 6.801 8.217 8.693 669 HA ARG 532 HA ARG 532 4.937 10.151 9.669 670 HB2 ARG 532 2HB ARG 532 7.549 9.193 10.803 671 HB3 ARG 532 1HB ARG 532 6.573 10.435 11.569 672 HG2 ARG 532 2HG ARG 532 5.691 7.611 11.009 673 HG3 ARG 532 1HG ARG 532 6.233 8.235 12.569 674 HD2 ARG 532 2HD ARG 532 4.364 9.880 12.499 675 HD3 ARG 532 1HD ARG 532 3.800 9.121 11.014 676 HE ARG 532 HE ARG 532 4.054 7.103 12.826 677 HH11 ARG 532 1HH1 ARG 532 2.130 10.055 12.593 678 HH12 ARG 532 2HH1 ARG 532 0.875 9.489 13.604 679 HH21 ARG 532 1HH2 ARG 532 2.343 6.314 14.185 680 HH22 ARG 532 2HH2 ARG 532 1.003 7.303 14.540 681 H SER 533 H SER 533 8.282 10.422 8.457 682 HA SER 533 HA SER 533 8.465 13.163 9.171 683 HB2 SER 533 2HB SER 533 10.426 11.648 8.941 684 HB3 SER 533 1HB SER 533 10.143 11.571 7.208 685 HG SER 533 HG SER 533 11.638 13.218 8.430 686 H THR 534 H THR 534 8.078 11.584 5.976 687 HA THR 534 HA THR 534 7.580 12.406 3.929 688 HB THR 534 HB THR 534 5.225 13.330 3.860 689 HG1 THR 534 1HG THR 534 5.734 13.723 6.391 690 HG21 THR 534 3HG2 THR 534 5.778 10.745 5.314 691 HG22 THR 534 1HG2 THR 534 5.708 10.969 3.568 692 HG23 THR 534 2HG2 THR 534 4.250 11.166 4.541 693 H LYS 535 H LYS 535 8.915 13.942 3.048 694 HA LYS 535 HA LYS 535 8.743 16.740 3.725 695 HB2 LYS 535 2HB LYS 535 9.787 15.535 1.137 696 HB3 LYS 535 1HB LYS 535 10.063 17.171 1.697 697 HG2 LYS 535 2HG LYS 535 11.322 16.230 3.607 698 HG3 LYS 535 1HG LYS 535 11.108 14.630 2.874 699 HD2 LYS 535 2HD LYS 535 12.243 15.428 0.844 700 HD3 LYS 535 1HD LYS 535 12.498 16.992 1.615 701 HE2 LYS 535 2HE LYS 535 14.520 15.693 1.789 702 HE3 LYS 535 1HE LYS 535 13.796 15.850 3.386 703 HZ1 LYS 535 3HZ LYS 535 14.578 13.613 2.963 704 HZ2 LYS 535 1HZ LYS 535 13.558 13.474 1.620 705 HZ3 LYS 535 2HZ LYS 535 12.904 13.596 3.157 706 H MET 536 H MET 536 8.256 18.310 1.655 707 HA MET 536 HA MET 536 5.699 17.325 0.636 708 HB2 MET 536 2HB MET 536 5.545 19.339 2.157 709 HB3 MET 536 1HB MET 536 6.501 20.185 0.931 710 HG2 MET 536 2HG MET 536 4.738 19.834 -0.718 711 HG3 MET 536 1HG MET 536 3.765 18.999 0.487 712 HE1 MET 536 3HE MET 536 4.811 23.491 0.614 713 HE2 MET 536 1HE MET 536 5.304 22.387 -0.667 714 HE3 MET 536 2HE MET 536 6.010 22.239 0.945 715 H GLU 537 H GLU 537 7.367 16.332 -0.946 716 HA GLU 537 HA GLU 537 8.169 18.156 -2.952 717 HB2 GLU 537 2HB GLU 537 9.301 15.960 -2.656 718 HB3 GLU 537 1HB GLU 537 7.838 15.141 -3.179 719 HG2 GLU 537 2HG GLU 537 9.369 15.183 -5.006 720 HG3 GLU 537 1HG GLU 537 8.053 16.301 -5.367 721 H GLY 538 H GLY 538 5.523 15.867 -2.551 722 HA2 GLY 538 2HA GLY 538 3.470 17.383 -3.530 723 HA3 GLY 538 1HA GLY 538 4.100 16.570 -4.947 724 H THR 539 H THR 539 3.763 14.418 -5.246 725 HA THR 539 HA THR 539 1.766 13.275 -3.464 726 HB THR 539 HB THR 539 1.485 11.660 -5.389 727 HG1 THR 539 1HG THR 539 3.182 12.008 -6.634 728 HG21 THR 539 3HG2 THR 539 0.015 13.151 -6.628 729 HG22 THR 539 1HG2 THR 539 0.737 14.561 -5.827 730 HG23 THR 539 2HG2 THR 539 -0.176 13.364 -4.892 731 H VAL 540 H VAL 540 2.048 11.345 -2.555 732 HA VAL 540 HA VAL 540 4.412 9.734 -3.223 733 HB VAL 540 HB VAL 540 2.935 9.987 -0.561 734 HG11 VAL 540 1HG1 VAL 540 3.538 7.649 -1.004 735 HG12 VAL 540 2HG1 VAL 540 4.519 8.325 0.298 736 HG13 VAL 540 3HG1 VAL 540 5.200 8.140 -1.322 737 HG21 VAL 540 3HG2 VAL 540 5.059 10.727 0.307 738 HG22 VAL 540 1HG2 VAL 540 4.599 11.727 -1.092 739 HG23 VAL 540 2HG2 VAL 540 5.802 10.465 -1.266 740 H SER 541 H SER 541 3.918 7.742 -4.034 741 HA SER 541 HA SER 541 1.119 7.033 -4.129 742 HB2 SER 541 2HB SER 541 3.508 5.736 -5.409 743 HB3 SER 541 1HB SER 541 1.817 5.427 -5.786 744 HG SER 541 HG SER 541 2.766 6.871 -7.279 745 H LEU 542 H LEU 542 0.336 5.727 -2.684 746 HA LEU 542 HA LEU 542 2.124 3.947 -1.207 747 HB2 LEU 542 2HB LEU 542 -0.710 4.846 -0.633 748 HB3 LEU 542 1HB LEU 542 0.169 3.685 0.332 749 HG LEU 542 HG LEU 542 0.133 5.724 1.493 750 HD11 LEU 542 1HD1 LEU 542 2.494 6.281 1.743 751 HD12 LEU 542 2HD1 LEU 542 2.841 5.361 0.279 752 HD13 LEU 542 3HD1 LEU 542 2.183 4.542 1.697 753 HD21 LEU 542 3HD2 LEU 542 -0.357 7.284 -0.303 754 HD22 LEU 542 1HD2 LEU 542 1.272 7.079 -0.950 755 HD23 LEU 542 2HD2 LEU 542 1.037 7.841 0.623 756 H LEU 543 H LEU 543 2.169 1.931 -1.958 757 HA LEU 543 HA LEU 543 -0.197 0.994 -3.383 758 HB2 LEU 543 2HB LEU 543 2.370 0.956 -4.284 759 HB3 LEU 543 1HB LEU 543 2.433 -0.382 -3.228 760 HG LEU 543 HG LEU 543 0.356 -0.383 -5.402 761 HD11 LEU 543 1HD1 LEU 543 3.164 -1.458 -5.538 762 HD12 LEU 543 2HD1 LEU 543 2.511 -0.116 -6.475 763 HD13 LEU 543 3HD1 LEU 543 1.890 -1.746 -6.724 764 HD21 LEU 543 3HD2 LEU 543 0.479 -2.808 -5.084 765 HD22 LEU 543 1HD2 LEU 543 0.036 -1.988 -3.582 766 HD23 LEU 543 2HD2 LEU 543 1.683 -2.583 -3.817 767 H VAL 544 H VAL 544 -1.475 -0.209 -2.199 768 HA VAL 544 HA VAL 544 -0.345 -1.601 0.130 769 HB VAL 544 HB VAL 544 -2.414 -1.266 1.344 770 HG11 VAL 544 1HG1 VAL 544 -1.352 1.370 0.359 771 HG12 VAL 544 2HG1 VAL 544 -0.713 0.394 1.697 772 HG13 VAL 544 3HG1 VAL 544 -2.323 1.068 1.814 773 HG21 VAL 544 3HG2 VAL 544 -3.941 -1.221 -0.467 774 HG22 VAL 544 1HG2 VAL 544 -3.323 0.338 -1.032 775 HG23 VAL 544 2HG2 VAL 544 -4.182 0.222 0.523 776 H PHE 545 H PHE 545 -1.572 -3.375 0.858 777 HA PHE 545 HA PHE 545 -3.042 -4.782 -1.268 778 HB2 PHE 545 2HB PHE 545 -0.927 -5.798 -0.586 779 HB3 PHE 545 1HB PHE 545 -1.434 -5.795 1.092 780 HD1 PHE 545 2HD PHE 545 -3.161 -7.395 1.826 781 HD2 PHE 545 1HD PHE 545 -1.637 -7.390 -2.127 782 HE1 PHE 545 2HE PHE 545 -4.040 -9.665 1.493 783 HE2 PHE 545 1HE PHE 545 -2.502 -9.636 -2.479 784 HZ PHE 545 HZ PHE 545 -3.708 -10.797 -0.664 785 H ARG 546 H ARG 546 -5.097 -4.662 -0.835 786 HA ARG 546 HA ARG 546 -5.981 -4.143 1.877 787 HB2 ARG 546 2HB ARG 546 -6.957 -2.939 -0.164 788 HB3 ARG 546 1HB ARG 546 -7.682 -4.475 -0.616 789 HG2 ARG 546 2HG ARG 546 -9.326 -3.111 0.497 790 HG3 ARG 546 1HG ARG 546 -8.908 -4.480 1.538 791 HD2 ARG 546 2HD ARG 546 -7.358 -3.069 2.766 792 HD3 ARG 546 1HD ARG 546 -7.803 -1.671 1.776 793 HE ARG 546 HE ARG 546 -10.015 -2.905 3.058 794 HH11 ARG 546 1HH1 ARG 546 -7.335 -0.552 3.579 795 HH12 ARG 546 2HH1 ARG 546 -7.969 0.115 4.931 796 HH21 ARG 546 1HH2 ARG 546 -10.957 -1.906 4.943 797 HH22 ARG 546 2HH2 ARG 546 -10.150 -0.638 5.764 798 H GLN 547 H GLN 547 -6.387 -5.843 3.118 799 HA GLN 547 HA GLN 547 -6.702 -8.392 1.764 800 HB2 GLN 547 2HB GLN 547 -5.821 -9.436 3.799 801 HB3 GLN 547 1HB GLN 547 -4.698 -8.278 3.120 802 HG2 GLN 547 2HG GLN 547 -5.396 -6.641 4.833 803 HG3 GLN 547 1HG GLN 547 -6.466 -7.859 5.523 804 HE21 GLN 547 1HE2 GLN 547 -5.431 -7.907 7.477 805 HE22 GLN 547 2HE2 GLN 547 -3.868 -8.583 7.707 806 H GLU 548 H GLU 548 -8.572 -9.282 1.738 807 HA GLU 548 HA GLU 548 -10.506 -10.220 2.399 808 HB2 GLU 548 2HB GLU 548 -9.770 -9.213 5.140 809 HB3 GLU 548 1HB GLU 548 -11.040 -10.374 4.785 810 HG2 GLU 548 2HG GLU 548 -9.435 -11.994 4.048 811 HG3 GLU 548 1HG GLU 548 -8.131 -10.808 4.169 812 H GLU 549 H GLU 549 -12.570 -9.599 3.753 813 HA GLU 549 HA GLU 549 -13.134 -6.758 3.471 814 HB2 GLU 549 2HB GLU 549 -15.433 -7.345 2.711 815 HB3 GLU 549 1HB GLU 549 -14.187 -7.794 1.562 816 HG2 GLU 549 2HG GLU 549 -15.511 -9.726 3.473 817 HG3 GLU 549 1HG GLU 549 -16.057 -9.447 1.826 818 H ALA 550 H ALA 550 -15.192 -6.175 4.724 819 HA ALA 550 HA ALA 550 -16.288 -5.952 6.653 820 HB1 ALA 550 1HB ALA 550 -15.829 -8.923 7.043 821 HB2 ALA 550 2HB ALA 550 -17.182 -8.211 6.161 822 HB3 ALA 550 3HB ALA 550 -17.016 -7.934 7.892 823 H PHE 551 H PHE 551 -16.000 -6.788 9.227 824 HA PHE 551 HA PHE 551 -13.239 -5.987 9.763 825 HB2 PHE 551 2HB PHE 551 -15.677 -5.669 11.514 826 HB3 PHE 551 1HB PHE 551 -14.049 -5.170 11.943 827 HD1 PHE 551 1HD PHE 551 -12.921 -3.437 10.420 828 HD2 PHE 551 2HD PHE 551 -17.106 -4.210 10.416 829 HE1 PHE 551 1HE PHE 551 -13.323 -1.250 9.370 830 HE2 PHE 551 2HE PHE 551 -17.512 -2.031 9.368 831 HZ PHE 551 HZ PHE 551 -15.622 -0.544 8.842 832 H HIS 552 H HIS 552 -12.155 -6.910 11.513 833 HA HIS 552 HA HIS 552 -12.941 -9.703 11.997 834 HB2 HIS 552 2HB HIS 552 -10.194 -8.409 11.965 835 HB3 HIS 552 1HB HIS 552 -10.500 -10.088 12.374 836 HD1 HIS 552 1HD HIS 552 -10.294 -7.719 9.494 837 HD2 HIS 552 2HD HIS 552 -10.963 -11.757 10.173 838 HE1 HIS 552 1HE HIS 552 -10.159 -8.815 7.255 839 HE2 HIS 552 2HE HIS 552 -10.132 -11.251 7.803 840 HA PRO 553 HA PRO 553 -13.127 -8.750 16.348 841 HB2 PRO 553 2HB PRO 553 -11.872 -10.993 17.385 842 HB3 PRO 553 1HB PRO 553 -13.574 -10.942 16.911 843 HG2 PRO 553 2HG PRO 553 -11.213 -11.969 15.385 844 HG3 PRO 553 1HG PRO 553 -12.839 -12.663 15.524 845 HD2 PRO 553 2HD PRO 553 -12.089 -11.314 13.341 846 HD3 PRO 553 1HD PRO 553 -13.736 -11.165 13.988 847 H ARG 554 H ARG 554 -11.745 -7.856 17.892 848 HA ARG 554 HA ARG 554 -8.914 -7.983 17.165 849 HB2 ARG 554 2HB ARG 554 -8.504 -5.690 17.834 850 HB3 ARG 554 1HB ARG 554 -9.787 -5.714 16.649 851 HG2 ARG 554 2HG ARG 554 -10.195 -5.436 19.620 852 HG3 ARG 554 1HG ARG 554 -10.088 -4.083 18.506 853 HD2 ARG 554 2HD ARG 554 -12.083 -4.957 17.332 854 HD3 ARG 554 1HD ARG 554 -12.179 -6.258 18.524 855 HE ARG 554 HE ARG 554 -12.065 -3.826 19.855 856 HH11 ARG 554 1HH1 ARG 554 -14.326 -5.609 17.802 857 HH12 ARG 554 2HH1 ARG 554 -15.725 -4.902 18.458 858 HH21 ARG 554 1HH2 ARG 554 -13.969 -2.839 20.762 859 HH22 ARG 554 2HH2 ARG 554 -15.508 -3.298 20.207 860 H GLU 555 H GLU 555 -7.557 -7.089 19.130 861 HA GLU 555 HA GLU 555 -8.240 -8.985 21.209 862 HB2 GLU 555 2HB GLU 555 -5.732 -7.389 20.739 863 HB3 GLU 555 1HB GLU 555 -5.934 -8.675 21.923 864 HG2 GLU 555 2HG GLU 555 -6.294 -10.290 20.159 865 HG3 GLU 555 1HG GLU 555 -6.191 -9.016 18.950 866 H MET 556 H MET 556 -8.600 -8.432 23.284 867 HA MET 556 HA MET 556 -9.117 -5.616 23.780 868 HB2 MET 556 2HB MET 556 -9.824 -8.057 25.422 869 HB3 MET 556 1HB MET 556 -10.266 -6.401 25.819 870 HG2 MET 556 2HG MET 556 -11.125 -7.917 23.376 871 HG3 MET 556 1HG MET 556 -12.121 -7.591 24.797 872 HE1 MET 556 3HE MET 556 -12.888 -6.926 21.744 873 HE2 MET 556 1HE MET 556 -13.657 -5.355 21.954 874 HE3 MET 556 2HE MET 556 -13.961 -6.648 23.114 875 H ASN 557 H ASN 557 -7.420 -4.563 24.397 876 HA ASN 557 HA ASN 557 -5.817 -5.658 26.559 877 HB2 ASN 557 2HB ASN 557 -3.739 -4.956 25.402 878 HB3 ASN 557 1HB ASN 557 -4.593 -6.222 24.530 879 HD21 ASN 557 1HD2 ASN 557 -5.591 -5.706 22.545 880 HD22 ASN 557 2HD2 ASN 557 -5.215 -4.269 21.681 881 H ALA 558 H ALA 558 -5.100 -4.147 27.981 882 HA ALA 558 HA ALA 558 -4.963 -1.390 27.452 883 HB1 ALA 558 1HB ALA 558 -6.744 -0.680 29.021 884 HB2 ALA 558 2HB ALA 558 -7.262 -2.361 29.174 885 HB3 ALA 558 3HB ALA 558 -7.403 -1.534 27.625 Start of MODEL 15 1 H1 GLY 448 1HT GLY 448 -9.905 1.032 -11.192 2 H2 GLY 448 2HT GLY 448 -9.295 1.684 -12.622 3 H3 GLY 448 3HT GLY 448 -8.231 1.135 -11.442 4 HA2 GLY 448 1HA GLY 448 -8.379 -0.430 -13.260 5 HA3 GLY 448 2HA GLY 448 -9.002 -1.119 -11.768 6 H SER 449 H SER 449 -9.610 -0.763 -14.985 7 HA SER 449 HA SER 449 -12.454 -0.505 -14.737 8 HB2 SER 449 2HB SER 449 -10.755 -1.116 -17.160 9 HB3 SER 449 1HB SER 449 -12.476 -0.715 -17.174 10 HG SER 449 HG SER 449 -11.523 1.206 -15.848 11 H VAL 450 H VAL 450 -13.013 -2.215 -13.504 12 HA VAL 450 HA VAL 450 -13.232 -4.683 -15.017 13 HB VAL 450 HB VAL 450 -11.375 -5.157 -13.500 14 HG11 VAL 450 1HG1 VAL 450 -13.218 -4.425 -11.246 15 HG12 VAL 450 2HG1 VAL 450 -11.787 -3.532 -11.776 16 HG13 VAL 450 3HG1 VAL 450 -11.618 -5.147 -11.075 17 HG21 VAL 450 3HG2 VAL 450 -12.839 -7.006 -13.944 18 HG22 VAL 450 1HG2 VAL 450 -13.910 -6.526 -12.625 19 HG23 VAL 450 2HG2 VAL 450 -12.277 -7.103 -12.280 20 H TYR 451 H TYR 451 -14.334 -2.873 -12.164 21 HA TYR 451 HA TYR 451 -16.304 -2.458 -11.303 22 HB2 TYR 451 2HB TYR 451 -17.303 -3.267 -14.025 23 HB3 TYR 451 1HB TYR 451 -18.354 -2.625 -12.767 24 HD1 TYR 451 1HD TYR 451 -18.191 -0.331 -12.067 25 HD2 TYR 451 2HD TYR 451 -15.665 -1.833 -15.129 26 HE1 TYR 451 1HE TYR 451 -17.589 1.965 -12.677 27 HE2 TYR 451 2HE TYR 451 -15.050 0.464 -15.757 28 HH TYR 451 HH TYR 451 -15.898 2.680 -15.557 29 H ASN 452 H ASN 452 -15.271 -5.352 -11.593 30 HA ASN 452 HA ASN 452 -17.630 -6.665 -10.468 31 HB2 ASN 452 2HB ASN 452 -16.415 -7.868 -12.284 32 HB3 ASN 452 1HB ASN 452 -14.956 -7.834 -11.306 33 HD21 ASN 452 1HD2 ASN 452 -18.052 -9.301 -11.745 34 HD22 ASN 452 2HD2 ASN 452 -17.826 -10.581 -10.610 35 H THR 453 H THR 453 -17.495 -7.535 -8.362 36 HA THR 453 HA THR 453 -15.901 -6.085 -6.570 37 HB THR 453 HB THR 453 -16.833 -7.730 -4.881 38 HG1 THR 453 1HG THR 453 -17.135 -9.261 -6.795 39 HG21 THR 453 3HG2 THR 453 -19.118 -6.838 -5.053 40 HG22 THR 453 1HG2 THR 453 -18.793 -6.327 -6.708 41 HG23 THR 453 2HG2 THR 453 -17.923 -5.582 -5.368 42 H LYS 454 H LYS 454 -13.784 -6.346 -6.614 43 HA LYS 454 HA LYS 454 -12.520 -8.856 -7.107 44 HB2 LYS 454 2HB LYS 454 -11.356 -6.227 -6.194 45 HB3 LYS 454 1HB LYS 454 -10.402 -7.631 -6.653 46 HG2 LYS 454 2HG LYS 454 -11.344 -7.522 -8.918 47 HG3 LYS 454 1HG LYS 454 -12.276 -6.104 -8.453 48 HD2 LYS 454 2HD LYS 454 -9.261 -6.302 -8.433 49 HD3 LYS 454 1HD LYS 454 -10.200 -5.527 -9.696 50 HE2 LYS 454 2HE LYS 454 -11.090 -3.943 -7.991 51 HE3 LYS 454 1HE LYS 454 -10.043 -4.704 -6.793 52 HZ1 LYS 454 3HZ LYS 454 -8.119 -4.046 -8.173 53 HZ2 LYS 454 1HZ LYS 454 -9.020 -2.716 -7.668 54 HZ3 LYS 454 2HZ LYS 454 -9.154 -3.277 -9.240 55 H LYS 455 H LYS 455 -11.604 -10.220 -5.743 56 HA LYS 455 HA LYS 455 -11.757 -9.661 -2.892 57 HB2 LYS 455 2HB LYS 455 -12.489 -12.007 -2.453 58 HB3 LYS 455 1HB LYS 455 -13.692 -11.068 -3.295 59 HG2 LYS 455 2HG LYS 455 -11.860 -13.064 -4.647 60 HG3 LYS 455 1HG LYS 455 -13.465 -13.454 -4.040 61 HD2 LYS 455 2HD LYS 455 -14.410 -11.756 -5.577 62 HD3 LYS 455 1HD LYS 455 -12.794 -11.450 -6.207 63 HE2 LYS 455 2HE LYS 455 -12.642 -13.793 -6.929 64 HE3 LYS 455 1HE LYS 455 -14.258 -14.077 -6.295 65 HZ1 LYS 455 3HZ LYS 455 -14.335 -13.729 -8.654 66 HZ2 LYS 455 1HZ LYS 455 -13.547 -12.269 -8.547 67 HZ3 LYS 455 2HZ LYS 455 -15.113 -12.439 -7.896 68 H VAL 456 H VAL 456 -10.591 -11.817 -1.778 69 HA VAL 456 HA VAL 456 -8.601 -12.726 -1.302 70 HB VAL 456 HB VAL 456 -8.026 -12.541 -4.316 71 HG11 VAL 456 1HG1 VAL 456 -6.475 -14.421 -3.999 72 HG12 VAL 456 2HG1 VAL 456 -6.748 -14.345 -2.258 73 HG13 VAL 456 3HG1 VAL 456 -5.977 -12.995 -3.092 74 HG21 VAL 456 3HG2 VAL 456 -10.072 -13.776 -3.913 75 HG22 VAL 456 1HG2 VAL 456 -9.244 -14.814 -2.755 76 HG23 VAL 456 2HG2 VAL 456 -8.804 -14.867 -4.464 77 H GLY 457 H GLY 457 -6.062 -12.159 -1.488 78 HA2 GLY 457 2HA GLY 457 -5.654 -9.556 -0.642 79 HA3 GLY 457 1HA GLY 457 -4.394 -10.607 -1.275 80 H LYS 458 H LYS 458 -6.027 -7.782 -1.709 81 HA LYS 458 HA LYS 458 -5.221 -7.596 -4.517 82 HB2 LYS 458 2HB LYS 458 -7.150 -5.984 -4.769 83 HB3 LYS 458 1HB LYS 458 -7.604 -7.660 -4.521 84 HG2 LYS 458 2HG LYS 458 -7.958 -7.141 -2.114 85 HG3 LYS 458 1HG LYS 458 -7.663 -5.443 -2.494 86 HD2 LYS 458 2HD LYS 458 -9.556 -5.423 -4.002 87 HD3 LYS 458 1HD LYS 458 -9.814 -7.151 -3.739 88 HE2 LYS 458 2HE LYS 458 -10.229 -6.712 -1.357 89 HE3 LYS 458 1HE LYS 458 -9.995 -4.992 -1.655 90 HZ1 LYS 458 3HZ LYS 458 -12.130 -6.641 -2.908 91 HZ2 LYS 458 1HZ LYS 458 -11.957 -4.967 -3.045 92 HZ3 LYS 458 2HZ LYS 458 -12.335 -5.667 -1.558 93 H ARG 459 H ARG 459 -4.203 -5.746 -5.165 94 HA ARG 459 HA ARG 459 -3.345 -4.035 -2.971 95 HB2 ARG 459 2HB ARG 459 -1.923 -4.899 -5.477 96 HB3 ARG 459 1HB ARG 459 -1.363 -3.565 -4.478 97 HG2 ARG 459 2HG ARG 459 -1.007 -5.004 -2.613 98 HG3 ARG 459 1HG ARG 459 -1.815 -6.341 -3.426 99 HD2 ARG 459 2HD ARG 459 0.709 -5.033 -4.415 100 HD3 ARG 459 1HD ARG 459 0.676 -6.484 -3.414 101 HE ARG 459 HE ARG 459 -0.970 -7.069 -5.473 102 HH11 ARG 459 1HH1 ARG 459 2.420 -5.966 -5.335 103 HH12 ARG 459 2HH1 ARG 459 2.898 -6.827 -6.700 104 HH21 ARG 459 1HH2 ARG 459 -0.261 -8.300 -7.385 105 HH22 ARG 459 2HH2 ARG 459 1.352 -8.191 -7.885 106 H LEU 460 H LEU 460 -3.460 -1.940 -3.080 107 HA LEU 460 HA LEU 460 -4.649 -0.708 -5.474 108 HB2 LEU 460 2HB LEU 460 -5.136 0.085 -2.596 109 HB3 LEU 460 1HB LEU 460 -5.761 0.913 -3.982 110 HG LEU 460 HG LEU 460 -7.111 -1.179 -4.501 111 HD11 LEU 460 1HD1 LEU 460 -7.591 -2.712 -2.675 112 HD12 LEU 460 2HD1 LEU 460 -6.346 -1.933 -1.693 113 HD13 LEU 460 3HD1 LEU 460 -5.899 -2.795 -3.167 114 HD21 LEU 460 3HD2 LEU 460 -7.667 0.297 -1.936 115 HD22 LEU 460 1HD2 LEU 460 -8.845 -0.630 -2.865 116 HD23 LEU 460 2HD2 LEU 460 -8.110 0.815 -3.561 117 H ASN 461 H ASN 461 -3.651 1.093 -6.134 118 HA ASN 461 HA ASN 461 -1.346 2.020 -4.547 119 HB2 ASN 461 2HB ASN 461 -0.870 1.253 -6.888 120 HB3 ASN 461 1HB ASN 461 -1.920 2.532 -7.476 121 HD21 ASN 461 1HD2 ASN 461 0.308 2.862 -4.735 122 HD22 ASN 461 2HD2 ASN 461 1.349 3.974 -5.532 123 H ILE 462 H ILE 462 -1.570 3.897 -3.534 124 HA ILE 462 HA ILE 462 -3.677 5.734 -4.451 125 HB ILE 462 HB ILE 462 -2.859 5.153 -1.588 126 HG12 ILE 462 2HG1 ILE 462 -5.371 4.267 -3.029 127 HG13 ILE 462 1HG1 ILE 462 -3.987 3.218 -2.734 128 HG21 ILE 462 1HG2 ILE 462 -3.769 7.406 -1.980 129 HG22 ILE 462 2HG2 ILE 462 -4.896 6.428 -1.035 130 HG23 ILE 462 3HG2 ILE 462 -5.186 6.702 -2.753 131 HD11 ILE 462 3HD1 ILE 462 -5.719 4.537 -0.669 132 HD12 ILE 462 1HD1 ILE 462 -4.320 3.512 -0.330 133 HD13 ILE 462 2HD1 ILE 462 -5.743 2.833 -1.125 134 H GLN 463 H GLN 463 -2.808 7.669 -4.945 135 HA GLN 463 HA GLN 463 -0.218 8.416 -3.758 136 HB2 GLN 463 2HB GLN 463 -1.616 9.489 -6.195 137 HB3 GLN 463 1HB GLN 463 -0.131 10.161 -5.545 138 HG2 GLN 463 2HG GLN 463 0.983 8.048 -5.928 139 HG3 GLN 463 1HG GLN 463 -0.501 7.378 -6.626 140 HE21 GLN 463 1HE2 GLN 463 -1.107 10.004 -7.918 141 HE22 GLN 463 2HE2 GLN 463 -0.034 10.073 -9.258 142 H LEU 464 H LEU 464 -0.103 9.981 -2.319 143 HA LEU 464 HA LEU 464 -2.356 11.869 -2.220 144 HB2 LEU 464 2HB LEU 464 -0.739 10.865 0.131 145 HB3 LEU 464 1HB LEU 464 -1.889 12.160 0.234 146 HG LEU 464 HG LEU 464 -2.959 10.340 1.152 147 HD11 LEU 464 1HD1 LEU 464 -4.431 11.479 -0.296 148 HD12 LEU 464 2HD1 LEU 464 -4.809 9.757 -0.300 149 HD13 LEU 464 3HD1 LEU 464 -3.943 10.470 -1.662 150 HD21 LEU 464 3HD2 LEU 464 -1.472 8.591 0.531 151 HD22 LEU 464 1HD2 LEU 464 -2.019 8.640 -1.149 152 HD23 LEU 464 2HD2 LEU 464 -3.116 8.103 0.133 153 H LYS 465 H LYS 465 -1.911 13.942 -2.245 154 HA LYS 465 HA LYS 465 0.899 14.865 -2.292 155 HB2 LYS 465 2HB LYS 465 -0.561 15.516 -4.182 156 HB3 LYS 465 1HB LYS 465 -1.688 16.263 -3.055 157 HG2 LYS 465 2HG LYS 465 -0.085 17.892 -2.423 158 HG3 LYS 465 1HG LYS 465 1.194 17.074 -3.323 159 HD2 LYS 465 2HD LYS 465 -0.042 17.503 -5.410 160 HD3 LYS 465 1HD LYS 465 -1.270 18.372 -4.488 161 HE2 LYS 465 2HE LYS 465 1.638 19.042 -4.562 162 HE3 LYS 465 1HE LYS 465 0.424 19.860 -5.557 163 HZ1 LYS 465 3HZ LYS 465 0.588 19.844 -2.578 164 HZ2 LYS 465 1HZ LYS 465 -0.663 20.536 -3.451 165 HZ3 LYS 465 2HZ LYS 465 0.894 21.156 -3.589 166 H LYS 466 H LYS 466 1.545 16.357 -0.842 167 HA LYS 466 HA LYS 466 0.285 16.001 1.706 168 HB2 LYS 466 2HB LYS 466 2.882 17.086 0.769 169 HB3 LYS 466 1HB LYS 466 2.292 17.584 2.332 170 HG2 LYS 466 2HG LYS 466 3.919 15.640 2.285 171 HG3 LYS 466 1HG LYS 466 2.457 15.419 3.215 172 HD2 LYS 466 2HD LYS 466 3.169 13.417 1.913 173 HD3 LYS 466 1HD LYS 466 1.541 13.959 1.559 174 HE2 LYS 466 2HE LYS 466 2.827 13.234 -0.423 175 HE3 LYS 466 1HE LYS 466 2.233 14.864 -0.517 176 HZ1 LYS 466 3HZ LYS 466 4.343 15.734 -0.142 177 HZ2 LYS 466 1HZ LYS 466 4.495 14.535 -1.309 178 HZ3 LYS 466 2HZ LYS 466 5.009 14.202 0.268 179 H GLY 467 H GLY 467 -1.129 17.200 2.538 180 HA2 GLY 467 2HA GLY 467 -1.370 19.929 1.586 181 HA3 GLY 467 1HA GLY 467 -2.651 19.023 2.377 182 H THR 468 H THR 468 -3.089 20.035 4.225 183 HA THR 468 HA THR 468 -1.147 21.508 5.710 184 HB THR 468 HB THR 468 -3.989 20.734 6.408 185 HG1 THR 468 1HG THR 468 -4.501 22.737 5.458 186 HG21 THR 468 3HG2 THR 468 -2.712 21.543 8.337 187 HG22 THR 468 1HG2 THR 468 -3.920 22.727 7.849 188 HG23 THR 468 2HG2 THR 468 -2.222 22.976 7.432 189 H GLU 469 H GLU 469 -2.783 18.387 6.053 190 HA GLU 469 HA GLU 469 -1.402 17.838 8.569 191 HB2 GLU 469 2HB GLU 469 -3.525 16.343 7.049 192 HB3 GLU 469 1HB GLU 469 -2.888 15.884 8.621 193 HG2 GLU 469 2HG GLU 469 -4.240 18.508 8.086 194 HG3 GLU 469 1HG GLU 469 -5.083 17.061 8.629 195 H GLY 470 H GLY 470 -0.590 17.759 5.516 196 HA2 GLY 470 2HA GLY 470 0.961 16.607 4.298 197 HA3 GLY 470 1HA GLY 470 1.308 15.660 5.748 198 H LEU 471 H LEU 471 0.635 13.673 5.832 199 HA LEU 471 HA LEU 471 -0.893 12.637 3.602 200 HB2 LEU 471 2HB LEU 471 0.539 11.233 5.850 201 HB3 LEU 471 1HB LEU 471 -0.447 10.386 4.687 202 HG LEU 471 HG LEU 471 1.794 10.082 4.062 203 HD11 LEU 471 1HD1 LEU 471 0.551 12.121 2.245 204 HD12 LEU 471 2HD1 LEU 471 0.354 10.376 2.202 205 HD13 LEU 471 3HD1 LEU 471 1.922 11.092 1.834 206 HD21 LEU 471 3HD2 LEU 471 2.845 11.902 5.294 207 HD22 LEU 471 1HD2 LEU 471 2.173 13.078 4.166 208 HD23 LEU 471 2HD2 LEU 471 3.378 11.916 3.612 209 H GLY 472 H GLY 472 -1.094 12.456 7.147 210 HA2 GLY 472 2HA GLY 472 -3.095 12.761 8.361 211 HA3 GLY 472 1HA GLY 472 -4.000 12.473 6.885 212 H PHE 473 H PHE 473 -1.474 10.203 7.597 213 HA PHE 473 HA PHE 473 -3.227 8.502 9.102 214 HB2 PHE 473 2HB PHE 473 -3.121 6.588 7.602 215 HB3 PHE 473 1HB PHE 473 -3.824 7.944 6.744 216 HD1 PHE 473 1HD PHE 473 -2.310 9.225 5.141 217 HD2 PHE 473 2HD PHE 473 -1.292 5.415 6.739 218 HE1 PHE 473 1HE PHE 473 -0.698 8.883 3.313 219 HE2 PHE 473 2HE PHE 473 0.324 5.084 4.931 220 HZ PHE 473 HZ PHE 473 0.613 6.835 3.210 221 H SER 474 H SER 474 -2.059 6.518 9.757 222 HA SER 474 HA SER 474 0.839 6.866 9.764 223 HB2 SER 474 2HB SER 474 -0.855 6.409 12.238 224 HB3 SER 474 1HB SER 474 0.910 6.446 12.198 225 HG SER 474 HG SER 474 0.017 8.616 10.992 226 H ILE 475 H ILE 475 1.892 4.778 10.678 227 HA ILE 475 HA ILE 475 0.299 2.472 9.792 228 HB ILE 475 HB ILE 475 2.442 1.456 9.106 229 HG12 ILE 475 2HG1 ILE 475 3.502 4.266 9.381 230 HG13 ILE 475 1HG1 ILE 475 3.883 2.861 10.388 231 HG21 ILE 475 1HG2 ILE 475 0.909 2.307 7.462 232 HG22 ILE 475 2HG2 ILE 475 2.568 2.546 6.951 233 HG23 ILE 475 3HG2 ILE 475 1.629 3.921 7.560 234 HD11 ILE 475 3HD1 ILE 475 5.609 3.460 8.658 235 HD12 ILE 475 1HD1 ILE 475 4.445 3.023 7.431 236 HD13 ILE 475 2HD1 ILE 475 5.040 1.797 8.560 237 H THR 476 H THR 476 0.756 0.501 10.764 238 HA THR 476 HA THR 476 2.266 0.515 13.254 239 HB THR 476 HB THR 476 -0.153 0.644 13.835 240 HG1 THR 476 1HG THR 476 -0.041 -0.852 15.290 241 HG21 THR 476 3HG2 THR 476 -1.075 -0.392 11.794 242 HG22 THR 476 1HG2 THR 476 -1.672 -1.193 13.250 243 HG23 THR 476 2HG2 THR 476 -0.400 -1.945 12.288 244 H SER 477 H SER 477 2.969 -1.648 13.873 245 HA SER 477 HA SER 477 2.982 -3.576 11.672 246 HB2 SER 477 2HB SER 477 5.286 -4.183 12.422 247 HB3 SER 477 1HB SER 477 5.207 -2.549 11.809 248 HG SER 477 HG SER 477 5.412 -1.731 13.759 249 H ARG 478 H ARG 478 2.478 -5.654 12.328 250 HA ARG 478 HA ARG 478 2.310 -6.027 15.193 251 HB2 ARG 478 2HB ARG 478 0.186 -7.282 14.991 252 HB3 ARG 478 1HB ARG 478 0.041 -5.579 14.617 253 HG2 ARG 478 2HG ARG 478 -0.110 -6.063 12.258 254 HG3 ARG 478 1HG ARG 478 0.214 -7.776 12.560 255 HD2 ARG 478 2HD ARG 478 -1.825 -7.962 13.861 256 HD3 ARG 478 1HD ARG 478 -2.137 -6.245 13.664 257 HE ARG 478 HE ARG 478 -2.574 -6.620 11.368 258 HH11 ARG 478 1HH1 ARG 478 -2.182 -9.616 13.212 259 HH12 ARG 478 2HH1 ARG 478 -3.205 -10.549 12.242 260 HH21 ARG 478 1HH2 ARG 478 -4.025 -7.903 10.009 261 HH22 ARG 478 2HH2 ARG 478 -4.283 -9.545 10.358 262 H ASP 479 H ASP 479 2.824 -7.843 16.006 263 HA ASP 479 HA ASP 479 3.644 -9.855 16.332 264 HB2 ASP 479 2HB ASP 479 1.878 -10.712 14.782 265 HB3 ASP 479 1HB ASP 479 3.011 -10.535 13.453 266 H VAL 480 H VAL 480 5.634 -10.774 16.342 267 HA VAL 480 HA VAL 480 7.594 -9.225 14.811 268 HB VAL 480 HB VAL 480 9.228 -9.837 16.544 269 HG11 VAL 480 1HG1 VAL 480 8.266 -8.511 18.372 270 HG12 VAL 480 2HG1 VAL 480 6.669 -8.679 17.639 271 HG13 VAL 480 3HG1 VAL 480 7.936 -7.790 16.795 272 HG21 VAL 480 3HG2 VAL 480 6.898 -11.224 17.883 273 HG22 VAL 480 1HG2 VAL 480 8.475 -10.932 18.617 274 HG23 VAL 480 2HG2 VAL 480 8.341 -11.998 17.222 275 H THR 481 H THR 481 6.176 -11.967 14.115 276 HA THR 481 HA THR 481 8.497 -13.681 13.873 277 HB THR 481 HB THR 481 5.735 -14.112 12.715 278 HG1 THR 481 1HG THR 481 5.361 -13.779 14.724 279 HG21 THR 481 3HG2 THR 481 7.518 -15.673 11.989 280 HG22 THR 481 1HG2 THR 481 6.300 -16.472 12.980 281 HG23 THR 481 2HG2 THR 481 7.856 -16.044 13.680 282 H ILE 482 H ILE 482 9.558 -14.108 11.982 283 HA ILE 482 HA ILE 482 10.401 -13.888 9.949 284 HB ILE 482 HB ILE 482 7.609 -13.066 9.067 285 HG12 ILE 482 2HG1 ILE 482 7.631 -15.318 10.019 286 HG13 ILE 482 1HG1 ILE 482 7.411 -15.403 8.282 287 HG21 ILE 482 1HG2 ILE 482 9.289 -12.345 7.444 288 HG22 ILE 482 2HG2 ILE 482 8.338 -13.681 6.793 289 HG23 ILE 482 3HG2 ILE 482 9.969 -13.971 7.402 290 HD11 ILE 482 3HD1 ILE 482 9.987 -15.923 9.764 291 HD12 ILE 482 1HD1 ILE 482 9.777 -15.992 8.012 292 HD13 ILE 482 2HD1 ILE 482 8.923 -17.128 9.055 293 H GLY 483 H GLY 483 11.874 -12.422 10.151 294 HA2 GLY 483 2HA GLY 483 11.156 -9.602 10.129 295 HA3 GLY 483 1HA GLY 483 12.747 -10.281 10.466 296 H GLY 484 H GLY 484 10.804 -11.196 7.736 297 HA2 GLY 484 2HA GLY 484 12.849 -10.650 5.853 298 HA3 GLY 484 1HA GLY 484 11.168 -11.021 5.467 299 H SER 485 H SER 485 9.943 -9.040 6.841 300 HA SER 485 HA SER 485 11.071 -6.492 6.121 301 HB2 SER 485 2HB SER 485 9.931 -7.261 4.027 302 HB3 SER 485 1HB SER 485 8.423 -7.371 4.928 303 HG SER 485 HG SER 485 9.748 -4.959 5.135 304 H ALA 486 H ALA 486 8.464 -8.468 7.437 305 HA ALA 486 HA ALA 486 7.137 -8.350 9.144 306 HB1 ALA 486 1HB ALA 486 7.463 -6.766 11.009 307 HB2 ALA 486 2HB ALA 486 8.593 -5.837 10.021 308 HB3 ALA 486 3HB ALA 486 9.000 -7.480 10.514 309 HA PRO 487 HA PRO 487 4.267 -6.184 6.652 310 HB2 PRO 487 2HB PRO 487 2.016 -7.068 7.958 311 HB3 PRO 487 1HB PRO 487 2.873 -7.963 6.707 312 HG2 PRO 487 2HG PRO 487 3.052 -8.231 9.677 313 HG3 PRO 487 1HG PRO 487 3.033 -9.496 8.435 314 HD2 PRO 487 2HD PRO 487 5.287 -8.728 9.639 315 HD3 PRO 487 1HD PRO 487 5.275 -9.196 7.924 316 H ILE 488 H ILE 488 3.869 -4.186 6.728 317 HA ILE 488 HA ILE 488 3.117 -2.837 9.195 318 HB ILE 488 HB ILE 488 4.115 -1.727 6.499 319 HG12 ILE 488 2HG1 ILE 488 5.765 -2.676 8.223 320 HG13 ILE 488 1HG1 ILE 488 6.003 -1.028 7.654 321 HG21 ILE 488 1HG2 ILE 488 3.936 0.441 7.395 322 HG22 ILE 488 2HG2 ILE 488 3.210 -0.247 8.855 323 HG23 ILE 488 3HG2 ILE 488 2.344 -0.346 7.318 324 HD11 ILE 488 3HD1 ILE 488 5.120 -0.121 9.656 325 HD12 ILE 488 1HD1 ILE 488 6.357 -1.293 10.080 326 HD13 ILE 488 2HD1 ILE 488 4.648 -1.730 10.236 327 H TYR 489 H TYR 489 1.139 -2.075 9.479 328 HA TYR 489 HA TYR 489 -0.744 -2.067 7.224 329 HB2 TYR 489 2HB TYR 489 -1.349 -2.819 10.111 330 HB3 TYR 489 1HB TYR 489 -2.531 -2.674 8.822 331 HD1 TYR 489 2HD TYR 489 0.269 -4.681 10.101 332 HD2 TYR 489 1HD TYR 489 -2.809 -4.386 7.193 333 HE1 TYR 489 2HE TYR 489 0.654 -7.004 9.503 334 HE2 TYR 489 1HE TYR 489 -2.438 -6.732 6.548 335 HH TYR 489 HH TYR 489 -0.514 -8.891 8.390 336 H VAL 490 H VAL 490 -2.293 -0.436 7.348 337 HA VAL 490 HA VAL 490 -1.364 2.013 8.434 338 HB VAL 490 HB VAL 490 -4.163 1.335 7.494 339 HG11 VAL 490 1HG1 VAL 490 -2.788 4.007 7.800 340 HG12 VAL 490 2HG1 VAL 490 -4.094 3.395 8.811 341 HG13 VAL 490 3HG1 VAL 490 -4.388 3.752 7.110 342 HG21 VAL 490 3HG2 VAL 490 -2.488 0.886 5.775 343 HG22 VAL 490 1HG2 VAL 490 -1.856 2.527 5.962 344 HG23 VAL 490 2HG2 VAL 490 -3.498 2.278 5.369 345 H LYS 491 H LYS 491 -1.515 2.750 10.413 346 HA LYS 491 HA LYS 491 -2.766 1.167 12.461 347 HB2 LYS 491 2HB LYS 491 -0.622 2.253 12.824 348 HB3 LYS 491 1HB LYS 491 -1.356 3.816 12.550 349 HG2 LYS 491 2HG LYS 491 -2.753 3.535 14.508 350 HG3 LYS 491 1HG LYS 491 -2.021 1.959 14.815 351 HD2 LYS 491 2HD LYS 491 0.148 3.007 15.105 352 HD3 LYS 491 1HD LYS 491 -0.550 4.585 14.725 353 HE2 LYS 491 2HE LYS 491 -1.997 4.445 16.603 354 HE3 LYS 491 1HE LYS 491 -1.413 2.836 17.013 355 HZ1 LYS 491 3HZ LYS 491 -0.343 4.504 18.400 356 HZ2 LYS 491 1HZ LYS 491 0.202 5.345 17.049 357 HZ3 LYS 491 2HZ LYS 491 0.795 3.803 17.403 358 H ASN 492 H ASN 492 -3.393 4.289 10.941 359 HA ASN 492 HA ASN 492 -6.154 4.241 11.632 360 HB2 ASN 492 2HB ASN 492 -5.194 4.844 13.856 361 HB3 ASN 492 1HB ASN 492 -4.447 6.257 13.125 362 HD21 ASN 492 1HD2 ASN 492 -5.572 7.725 14.441 363 HD22 ASN 492 2HD2 ASN 492 -7.260 7.977 14.275 364 H ILE 493 H ILE 493 -7.281 5.858 10.596 365 HA ILE 493 HA ILE 493 -5.785 7.592 8.765 366 HB ILE 493 HB ILE 493 -8.727 6.776 8.752 367 HG12 ILE 493 2HG1 ILE 493 -7.284 4.864 8.203 368 HG13 ILE 493 1HG1 ILE 493 -8.227 5.386 6.816 369 HG21 ILE 493 1HG2 ILE 493 -7.126 8.290 6.697 370 HG22 ILE 493 2HG2 ILE 493 -8.448 8.941 7.686 371 HG23 ILE 493 3HG2 ILE 493 -8.765 7.704 6.474 372 HD11 ILE 493 3HD1 ILE 493 -5.976 4.809 6.173 373 HD12 ILE 493 1HD1 ILE 493 -5.317 5.985 7.310 374 HD13 ILE 493 2HD1 ILE 493 -6.259 6.527 5.917 375 H LEU 494 H LEU 494 -5.629 9.621 9.539 376 HA LEU 494 HA LEU 494 -7.070 10.321 11.890 377 HB2 LEU 494 2HB LEU 494 -5.007 11.828 10.272 378 HB3 LEU 494 1HB LEU 494 -5.806 12.518 11.667 379 HG LEU 494 HG LEU 494 -4.825 10.720 13.081 380 HD11 LEU 494 1HD1 LEU 494 -3.253 9.993 10.627 381 HD12 LEU 494 2HD1 LEU 494 -4.476 8.993 11.411 382 HD13 LEU 494 3HD1 LEU 494 -2.970 9.379 12.253 383 HD21 LEU 494 3HD2 LEU 494 -3.764 12.887 12.958 384 HD22 LEU 494 1HD2 LEU 494 -2.850 12.386 11.533 385 HD23 LEU 494 2HD2 LEU 494 -2.545 11.619 13.091 386 HA PRO 495 HA PRO 495 -10.565 12.446 10.410 387 HB2 PRO 495 2HB PRO 495 -9.982 14.790 12.137 388 HB3 PRO 495 1HB PRO 495 -11.382 13.719 12.117 389 HG2 PRO 495 2HG PRO 495 -9.562 13.575 14.065 390 HG3 PRO 495 1HG PRO 495 -10.362 12.127 13.435 391 HD2 PRO 495 2HD PRO 495 -7.612 13.164 12.896 392 HD3 PRO 495 1HD PRO 495 -8.166 11.492 13.132 393 H ARG 496 H ARG 496 -7.538 14.183 10.192 394 HA ARG 496 HA ARG 496 -8.703 15.623 7.934 395 HB2 ARG 496 2HB ARG 496 -6.586 16.798 9.749 396 HB3 ARG 496 1HB ARG 496 -7.266 17.587 8.334 397 HG2 ARG 496 2HG ARG 496 -8.254 18.665 10.124 398 HG3 ARG 496 1HG ARG 496 -9.468 17.454 9.706 399 HD2 ARG 496 2HD ARG 496 -9.101 17.541 12.122 400 HD3 ARG 496 1HD ARG 496 -8.603 15.983 11.442 401 HE ARG 496 HE ARG 496 -6.335 17.548 11.460 402 HH11 ARG 496 1HH1 ARG 496 -8.548 16.312 13.945 403 HH12 ARG 496 2HH1 ARG 496 -7.367 16.294 15.158 404 HH21 ARG 496 1HH2 ARG 496 -4.771 17.564 13.076 405 HH22 ARG 496 2HH2 ARG 496 -5.127 17.065 14.658 406 H GLY 497 H GLY 497 -7.343 15.796 6.134 407 HA2 GLY 497 2HA GLY 497 -4.839 15.791 5.671 408 HA3 GLY 497 1HA GLY 497 -4.913 14.145 6.259 409 H ALA 498 H ALA 498 -3.938 14.346 3.909 410 HA ALA 498 HA ALA 498 -5.706 14.584 1.721 411 HB1 ALA 498 1HB ALA 498 -2.995 13.253 1.901 412 HB2 ALA 498 2HB ALA 498 -3.292 14.949 1.538 413 HB3 ALA 498 3HB ALA 498 -3.836 13.704 0.417 414 H ALA 499 H ALA 499 -4.500 11.882 3.600 415 HA ALA 499 HA ALA 499 -5.359 9.813 1.897 416 HB1 ALA 499 1HB ALA 499 -3.674 9.450 3.591 417 HB2 ALA 499 2HB ALA 499 -5.036 8.342 3.818 418 HB3 ALA 499 3HB ALA 499 -4.864 9.749 4.856 419 H ILE 500 H ILE 500 -6.972 11.334 4.676 420 HA ILE 500 HA ILE 500 -9.092 9.457 4.638 421 HB ILE 500 HB ILE 500 -8.546 10.758 6.698 422 HG12 ILE 500 2HG1 ILE 500 -11.378 11.077 5.683 423 HG13 ILE 500 1HG1 ILE 500 -10.714 9.671 6.473 424 HG21 ILE 500 1HG2 ILE 500 -8.074 12.925 5.708 425 HG22 ILE 500 2HG2 ILE 500 -9.321 13.072 6.948 426 HG23 ILE 500 3HG2 ILE 500 -9.765 13.100 5.240 427 HD11 ILE 500 3HD1 ILE 500 -11.048 12.370 7.754 428 HD12 ILE 500 1HD1 ILE 500 -10.423 10.921 8.535 429 HD13 ILE 500 2HD1 ILE 500 -12.098 10.969 7.988 430 H GLN 501 H GLN 501 -8.533 12.470 3.023 431 HA GLN 501 HA GLN 501 -11.211 12.793 2.091 432 HB2 GLN 501 2HB GLN 501 -8.633 13.954 1.116 433 HB3 GLN 501 1HB GLN 501 -10.219 14.474 0.545 434 HG2 GLN 501 2HG GLN 501 -9.106 14.728 3.341 435 HG3 GLN 501 1HG GLN 501 -9.400 16.036 2.195 436 HE21 GLN 501 1HE2 GLN 501 -10.425 15.606 4.863 437 HE22 GLN 501 2HE2 GLN 501 -12.149 15.618 4.744 438 H ASP 502 H ASP 502 -8.450 11.019 1.034 439 HA ASP 502 HA ASP 502 -9.298 10.654 -1.669 440 HB2 ASP 502 2HB ASP 502 -6.967 10.280 -1.020 441 HB3 ASP 502 1HB ASP 502 -7.461 8.953 0.027 442 H GLY 503 H GLY 503 -9.472 8.696 1.222 443 HA2 GLY 503 2HA GLY 503 -11.353 7.452 1.892 444 HA3 GLY 503 1HA GLY 503 -12.018 7.688 0.289 445 H ARG 504 H ARG 504 -9.233 6.552 -0.816 446 HA ARG 504 HA ARG 504 -10.240 3.856 -0.859 447 HB2 ARG 504 2HB ARG 504 -7.791 5.105 -2.085 448 HB3 ARG 504 1HB ARG 504 -7.936 3.369 -2.007 449 HG2 ARG 504 2HG ARG 504 -8.548 3.992 -4.189 450 HG3 ARG 504 1HG ARG 504 -10.048 3.608 -3.381 451 HD2 ARG 504 2HD ARG 504 -8.979 6.393 -3.805 452 HD3 ARG 504 1HD ARG 504 -10.107 5.602 -4.895 453 HE ARG 504 HE ARG 504 -10.626 6.429 -2.141 454 HH11 ARG 504 1HH1 ARG 504 -11.845 5.472 -5.328 455 HH12 ARG 504 2HH1 ARG 504 -13.391 6.108 -5.112 456 HH21 ARG 504 1HH2 ARG 504 -12.785 7.363 -1.840 457 HH22 ARG 504 2HH2 ARG 504 -13.948 7.230 -3.074 458 H LEU 505 H LEU 505 -7.790 5.563 0.823 459 HA LEU 505 HA LEU 505 -6.586 3.167 1.875 460 HB2 LEU 505 2HB LEU 505 -5.263 5.182 1.336 461 HB3 LEU 505 1HB LEU 505 -6.126 6.063 2.574 462 HG LEU 505 HG LEU 505 -5.143 4.607 4.293 463 HD11 LEU 505 1HD1 LEU 505 -3.666 3.373 1.964 464 HD12 LEU 505 2HD1 LEU 505 -4.796 2.554 3.051 465 HD13 LEU 505 3HD1 LEU 505 -3.261 3.161 3.667 466 HD21 LEU 505 3HD2 LEU 505 -3.161 5.860 2.412 467 HD22 LEU 505 1HD2 LEU 505 -2.861 5.431 4.095 468 HD23 LEU 505 2HD2 LEU 505 -4.048 6.671 3.708 469 H LYS 506 H LYS 506 -6.929 2.301 3.863 470 HA LYS 506 HA LYS 506 -8.717 3.652 5.713 471 HB2 LYS 506 2HB LYS 506 -9.937 1.966 4.142 472 HB3 LYS 506 1HB LYS 506 -8.937 0.760 4.942 473 HG2 LYS 506 2HG LYS 506 -11.002 0.584 5.990 474 HG3 LYS 506 1HG LYS 506 -10.027 1.509 7.116 475 HD2 LYS 506 2HD LYS 506 -12.110 2.623 5.206 476 HD3 LYS 506 1HD LYS 506 -12.322 2.385 6.930 477 HE2 LYS 506 2HE LYS 506 -10.491 4.064 7.301 478 HE3 LYS 506 1HE LYS 506 -10.467 4.308 5.553 479 HZ1 LYS 506 3HZ LYS 506 -12.735 5.041 5.618 480 HZ2 LYS 506 1HZ LYS 506 -11.813 5.966 6.683 481 HZ3 LYS 506 2HZ LYS 506 -12.822 4.759 7.274 482 H ALA 507 H ALA 507 -8.631 2.303 7.808 483 HA ALA 507 HA ALA 507 -5.899 1.798 8.434 484 HB1 ALA 507 1HB ALA 507 -6.749 1.447 10.690 485 HB2 ALA 507 2HB ALA 507 -8.396 1.449 10.040 486 HB3 ALA 507 3HB ALA 507 -7.424 2.920 9.966 487 H GLY 508 H GLY 508 -4.971 -0.174 8.757 488 HA2 GLY 508 2HA GLY 508 -5.037 -2.494 9.269 489 HA3 GLY 508 1HA GLY 508 -6.666 -2.584 8.650 490 H ASP 509 H ASP 509 -5.293 -0.803 6.367 491 HA ASP 509 HA ASP 509 -4.788 -3.107 4.744 492 HB2 ASP 509 2HB ASP 509 -4.573 -0.164 4.056 493 HB3 ASP 509 1HB ASP 509 -4.323 -1.472 2.904 494 H ARG 510 H ARG 510 -2.889 -3.552 3.670 495 HA ARG 510 HA ARG 510 -0.636 -3.117 5.479 496 HB2 ARG 510 2HB ARG 510 -1.219 -5.369 5.141 497 HB3 ARG 510 1HB ARG 510 -1.237 -5.230 3.407 498 HG2 ARG 510 2HG ARG 510 1.210 -4.918 3.446 499 HG3 ARG 510 1HG ARG 510 1.179 -5.081 5.205 500 HD2 ARG 510 2HD ARG 510 0.252 -7.314 5.010 501 HD3 ARG 510 1HD ARG 510 0.200 -7.160 3.258 502 HE ARG 510 HE ARG 510 2.790 -6.751 3.791 503 HH11 ARG 510 1HH1 ARG 510 0.574 -9.290 4.913 504 HH12 ARG 510 2HH1 ARG 510 1.782 -10.497 4.908 505 HH21 ARG 510 1HH2 ARG 510 4.398 -8.412 3.821 506 HH22 ARG 510 2HH2 ARG 510 3.977 -10.001 4.293 507 H LEU 511 H LEU 511 1.102 -2.017 4.950 508 HA LEU 511 HA LEU 511 1.084 -0.601 2.434 509 HB2 LEU 511 2HB LEU 511 1.650 0.461 4.749 510 HB3 LEU 511 1HB LEU 511 3.121 -0.448 4.677 511 HG LEU 511 HG LEU 511 3.368 1.974 4.106 512 HD11 LEU 511 1HD1 LEU 511 5.071 0.419 3.377 513 HD12 LEU 511 2HD1 LEU 511 4.821 1.686 2.180 514 HD13 LEU 511 3HD1 LEU 511 4.148 0.079 1.909 515 HD21 LEU 511 3HD2 LEU 511 2.699 2.701 1.870 516 HD22 LEU 511 1HD2 LEU 511 1.318 2.332 2.901 517 HD23 LEU 511 2HD2 LEU 511 1.818 1.193 1.647 518 H ILE 512 H ILE 512 2.134 -1.253 0.673 519 HA ILE 512 HA ILE 512 3.974 -3.562 0.826 520 HB ILE 512 HB ILE 512 2.362 -2.469 -1.481 521 HG12 ILE 512 2HG1 ILE 512 0.925 -3.549 0.143 522 HG13 ILE 512 1HG1 ILE 512 1.058 -4.544 -1.281 523 HG21 ILE 512 1HG2 ILE 512 4.123 -4.914 -1.376 524 HG22 ILE 512 2HG2 ILE 512 4.419 -3.434 -2.291 525 HG23 ILE 512 3HG2 ILE 512 3.058 -4.475 -2.715 526 HD11 ILE 512 3HD1 ILE 512 2.701 -5.983 -0.171 527 HD12 ILE 512 1HD1 ILE 512 1.187 -5.933 0.727 528 HD13 ILE 512 2HD1 ILE 512 2.574 -5.010 1.294 529 H GLU 513 H GLU 513 3.668 -0.459 -0.884 530 HA GLU 513 HA GLU 513 6.507 -0.165 -0.718 531 HB2 GLU 513 2HB GLU 513 6.936 0.103 -3.100 532 HB3 GLU 513 1HB GLU 513 6.297 -1.493 -2.796 533 HG2 GLU 513 2HG GLU 513 4.203 -0.939 -3.617 534 HG3 GLU 513 1HG GLU 513 4.592 0.786 -3.660 535 H VAL 514 H VAL 514 7.155 1.876 -1.686 536 HA VAL 514 HA VAL 514 4.988 3.762 -1.756 537 HB VAL 514 HB VAL 514 5.859 3.798 0.574 538 HG11 VAL 514 1HG1 VAL 514 8.090 4.823 1.028 539 HG12 VAL 514 2HG1 VAL 514 8.414 4.697 -0.709 540 HG13 VAL 514 3HG1 VAL 514 8.166 3.244 0.235 541 HG21 VAL 514 3HG2 VAL 514 6.092 6.217 0.763 542 HG22 VAL 514 1HG2 VAL 514 4.826 5.742 -0.381 543 HG23 VAL 514 2HG2 VAL 514 6.382 6.311 -0.980 544 H ASN 515 H ASN 515 5.275 5.188 -3.395 545 HA ASN 515 HA ASN 515 6.205 6.427 -5.148 546 HB2 ASN 515 2HB ASN 515 8.637 6.267 -3.361 547 HB3 ASN 515 1HB ASN 515 8.630 7.162 -4.868 548 HD21 ASN 515 1HD2 ASN 515 6.001 8.254 -4.667 549 HD22 ASN 515 2HD2 ASN 515 6.044 9.404 -3.386 550 H GLY 516 H GLY 516 6.619 3.342 -4.935 551 HA2 GLY 516 2HA GLY 516 7.195 1.917 -6.699 552 HA3 GLY 516 1HA GLY 516 8.217 3.193 -7.360 553 H VAL 517 H VAL 517 8.773 2.915 -4.041 554 HA VAL 517 HA VAL 517 11.253 1.500 -4.517 555 HB VAL 517 HB VAL 517 10.194 2.844 -2.011 556 HG11 VAL 517 1HG1 VAL 517 12.966 1.844 -2.658 557 HG12 VAL 517 2HG1 VAL 517 11.844 1.123 -1.505 558 HG13 VAL 517 3HG1 VAL 517 12.503 2.734 -1.203 559 HG21 VAL 517 3HG2 VAL 517 10.549 4.465 -3.797 560 HG22 VAL 517 1HG2 VAL 517 12.185 3.854 -4.040 561 HG23 VAL 517 2HG2 VAL 517 11.763 4.662 -2.531 562 H ASP 518 H ASP 518 11.351 -0.593 -4.202 563 HA ASP 518 HA ASP 518 9.163 -2.004 -3.039 564 HB2 ASP 518 2HB ASP 518 11.843 -3.047 -3.990 565 HB3 ASP 518 1HB ASP 518 10.504 -4.059 -3.466 566 H LEU 519 H LEU 519 8.883 -2.003 -1.002 567 HA LEU 519 HA LEU 519 11.223 -2.126 0.764 568 HB2 LEU 519 2HB LEU 519 9.829 -0.951 2.437 569 HB3 LEU 519 1HB LEU 519 10.224 -0.008 1.015 570 HG LEU 519 HG LEU 519 7.879 -0.889 0.229 571 HD11 LEU 519 1HD1 LEU 519 7.436 -0.881 3.162 572 HD12 LEU 519 2HD1 LEU 519 7.374 -2.303 2.079 573 HD13 LEU 519 3HD1 LEU 519 6.255 -0.950 1.871 574 HD21 LEU 519 3HD2 LEU 519 8.298 1.403 2.115 575 HD22 LEU 519 1HD2 LEU 519 6.891 1.175 1.058 576 HD23 LEU 519 2HD2 LEU 519 8.496 1.365 0.358 577 H ALA 520 H ALA 520 9.014 -4.091 -0.384 578 HA ALA 520 HA ALA 520 8.650 -5.532 2.067 579 HB1 ALA 520 1HB ALA 520 7.032 -5.852 0.229 580 HB2 ALA 520 2HB ALA 520 7.822 -7.375 0.635 581 HB3 ALA 520 3HB ALA 520 8.322 -6.478 -0.799 582 H GLY 521 H GLY 521 10.702 -5.374 2.721 583 HA2 GLY 521 2HA GLY 521 12.400 -7.480 2.725 584 HA3 GLY 521 1HA GLY 521 12.943 -6.535 1.328 585 H LYS 522 H LYS 522 11.857 -4.116 2.671 586 HA LYS 522 HA LYS 522 14.178 -3.313 4.137 587 HB2 LYS 522 2HB LYS 522 11.539 -2.002 3.519 588 HB3 LYS 522 1HB LYS 522 12.730 -1.255 4.566 589 HG2 LYS 522 2HG LYS 522 13.218 -2.035 1.704 590 HG3 LYS 522 1HG LYS 522 12.743 -0.418 2.236 591 HD2 LYS 522 2HD LYS 522 14.734 -0.371 3.686 592 HD3 LYS 522 1HD LYS 522 15.235 -1.915 3.036 593 HE2 LYS 522 2HE LYS 522 15.343 -0.935 0.771 594 HE3 LYS 522 1HE LYS 522 14.825 0.615 1.422 595 HZ1 LYS 522 3HZ LYS 522 17.178 0.648 1.158 596 HZ2 LYS 522 1HZ LYS 522 17.397 -0.774 2.023 597 HZ3 LYS 522 2HZ LYS 522 16.867 0.632 2.784 598 H SER 523 H SER 523 14.155 -2.687 6.301 599 HA SER 523 HA SER 523 12.660 -4.385 7.918 600 HB2 SER 523 2HB SER 523 14.868 -3.739 8.591 601 HB3 SER 523 1HB SER 523 14.447 -2.033 8.605 602 HG SER 523 HG SER 523 14.236 -3.854 10.522 603 H GLN 524 H GLN 524 11.135 -3.692 9.547 604 HA GLN 524 HA GLN 524 9.173 -1.917 8.645 605 HB2 GLN 524 2HB GLN 524 8.151 -2.117 10.870 606 HB3 GLN 524 1HB GLN 524 8.647 -3.682 10.249 607 HG2 GLN 524 2HG GLN 524 10.608 -3.645 11.694 608 HG3 GLN 524 1HG GLN 524 10.155 -2.046 12.282 609 HE21 GLN 524 1HE2 GLN 524 7.849 -4.564 11.631 610 HE22 GLN 524 2HE2 GLN 524 7.405 -4.858 13.269 611 H GLU 525 H GLU 525 11.985 -1.494 10.598 612 HA GLU 525 HA GLU 525 11.451 1.022 11.731 613 HB2 GLU 525 2HB GLU 525 13.265 -0.399 12.508 614 HB3 GLU 525 1HB GLU 525 14.064 -0.270 10.953 615 HG2 GLU 525 2HG GLU 525 14.412 2.122 11.333 616 HG3 GLU 525 1HG GLU 525 13.603 1.985 12.892 617 H GLU 526 H GLU 526 12.640 0.073 8.591 618 HA GLU 526 HA GLU 526 13.629 2.597 7.756 619 HB2 GLU 526 2HB GLU 526 12.485 0.385 6.066 620 HB3 GLU 526 1HB GLU 526 13.559 1.665 5.530 621 HG2 GLU 526 2HG GLU 526 14.217 -0.499 7.480 622 HG3 GLU 526 1HG GLU 526 14.702 -0.463 5.788 623 H VAL 527 H VAL 527 10.610 0.860 7.307 624 HA VAL 527 HA VAL 527 9.529 2.962 5.742 625 HB VAL 527 HB VAL 527 7.481 1.613 5.588 626 HG11 VAL 527 1HG1 VAL 527 8.557 -0.339 4.496 627 HG12 VAL 527 2HG1 VAL 527 10.085 0.166 5.206 628 HG13 VAL 527 3HG1 VAL 527 9.274 1.206 4.035 629 HG21 VAL 527 3HG2 VAL 527 8.954 -0.301 7.373 630 HG22 VAL 527 1HG2 VAL 527 7.429 -0.620 6.535 631 HG23 VAL 527 2HG2 VAL 527 7.488 0.594 7.822 632 H VAL 528 H VAL 528 9.181 1.958 9.096 633 HA VAL 528 HA VAL 528 7.121 3.790 9.687 634 HB VAL 528 HB VAL 528 9.255 2.625 11.532 635 HG11 VAL 528 1HG1 VAL 528 8.330 4.741 12.434 636 HG12 VAL 528 2HG1 VAL 528 7.811 3.342 13.375 637 HG13 VAL 528 3HG1 VAL 528 6.705 4.090 12.228 638 HG21 VAL 528 3HG2 VAL 528 6.360 1.935 11.101 639 HG22 VAL 528 1HG2 VAL 528 7.427 1.187 12.290 640 HG23 VAL 528 2HG2 VAL 528 7.748 0.981 10.569 641 H SER 529 H SER 529 10.619 4.113 9.600 642 HA SER 529 HA SER 529 10.619 6.768 10.529 643 HB2 SER 529 2HB SER 529 12.671 5.340 8.819 644 HB3 SER 529 1HB SER 529 12.934 6.854 9.687 645 HG SER 529 HG SER 529 12.728 4.253 10.613 646 H LEU 530 H LEU 530 10.257 5.383 7.330 647 HA LEU 530 HA LEU 530 10.412 7.760 5.825 648 HB2 LEU 530 2HB LEU 530 8.889 5.244 5.460 649 HB3 LEU 530 1HB LEU 530 8.907 6.469 4.200 650 HG LEU 530 HG LEU 530 11.236 4.818 5.226 651 HD11 LEU 530 1HD1 LEU 530 9.879 4.890 2.536 652 HD12 LEU 530 2HD1 LEU 530 9.719 3.612 3.738 653 HD13 LEU 530 3HD1 LEU 530 11.276 3.905 2.966 654 HD21 LEU 530 3HD2 LEU 530 12.565 5.915 3.480 655 HD22 LEU 530 1HD2 LEU 530 12.013 7.060 4.700 656 HD23 LEU 530 2HD2 LEU 530 11.211 6.988 3.129 657 H LEU 531 H LEU 531 7.502 6.072 7.150 658 HA LEU 531 HA LEU 531 5.772 8.083 6.373 659 HB2 LEU 531 2HB LEU 531 5.544 5.743 8.249 660 HB3 LEU 531 1HB LEU 531 4.276 6.957 8.183 661 HG LEU 531 HG LEU 531 3.837 4.974 6.888 662 HD11 LEU 531 1HD1 LEU 531 2.783 7.075 6.218 663 HD12 LEU 531 2HD1 LEU 531 3.130 6.102 4.790 664 HD13 LEU 531 3HD1 LEU 531 4.166 7.466 5.195 665 HD21 LEU 531 3HD2 LEU 531 6.147 5.811 5.141 666 HD22 LEU 531 1HD2 LEU 531 4.977 4.555 4.731 667 HD23 LEU 531 2HD2 LEU 531 6.044 4.348 6.117 668 H ARG 532 H ARG 532 7.630 7.722 9.314 669 HA ARG 532 HA ARG 532 6.326 9.937 10.569 670 HB2 ARG 532 2HB ARG 532 8.991 8.657 11.187 671 HB3 ARG 532 1HB ARG 532 8.277 9.942 12.144 672 HG2 ARG 532 2HG ARG 532 6.368 8.495 12.654 673 HG3 ARG 532 1HG ARG 532 7.102 7.203 11.702 674 HD2 ARG 532 2HD ARG 532 9.043 7.214 13.202 675 HD3 ARG 532 1HD ARG 532 8.295 8.498 14.152 676 HE ARG 532 HE ARG 532 6.464 6.463 14.058 677 HH11 ARG 532 1HH1 ARG 532 9.769 6.845 15.284 678 HH12 ARG 532 2HH1 ARG 532 9.630 5.666 16.496 679 HH21 ARG 532 1HH2 ARG 532 6.238 4.853 15.760 680 HH22 ARG 532 2HH2 ARG 532 7.568 4.490 16.772 681 H SER 533 H SER 533 9.050 9.651 8.392 682 HA SER 533 HA SER 533 10.132 12.216 8.806 683 HB2 SER 533 2HB SER 533 11.421 10.419 7.727 684 HB3 SER 533 1HB SER 533 10.302 10.418 6.369 685 HG SER 533 HG SER 533 11.490 12.862 6.990 686 H THR 534 H THR 534 7.644 11.005 6.677 687 HA THR 534 HA THR 534 6.189 11.930 5.280 688 HB THR 534 HB THR 534 5.142 14.143 5.894 689 HG1 THR 534 1HG THR 534 7.417 14.373 7.332 690 HG21 THR 534 3HG2 THR 534 5.500 12.208 8.186 691 HG22 THR 534 1HG2 THR 534 4.312 12.065 6.893 692 HG23 THR 534 2HG2 THR 534 4.208 13.398 8.045 693 H LYS 535 H LYS 535 7.494 11.886 3.462 694 HA LYS 535 HA LYS 535 9.080 14.119 2.689 695 HB2 LYS 535 2HB LYS 535 9.488 11.853 1.839 696 HB3 LYS 535 1HB LYS 535 7.933 11.852 1.031 697 HG2 LYS 535 2HG LYS 535 8.668 13.589 -0.489 698 HG3 LYS 535 1HG LYS 535 10.190 13.751 0.381 699 HD2 LYS 535 2HD LYS 535 9.268 11.258 -1.068 700 HD3 LYS 535 1HD LYS 535 10.433 12.427 -1.692 701 HE2 LYS 535 2HE LYS 535 11.917 11.947 0.221 702 HE3 LYS 535 1HE LYS 535 10.758 10.772 0.822 703 HZ1 LYS 535 3HZ LYS 535 12.541 9.708 -0.371 704 HZ2 LYS 535 1HZ LYS 535 12.210 10.595 -1.761 705 HZ3 LYS 535 2HZ LYS 535 11.097 9.478 -1.202 706 H MET 536 H MET 536 8.466 15.973 1.696 707 HA MET 536 HA MET 536 5.565 16.268 1.179 708 HB2 MET 536 2HB MET 536 6.456 17.417 3.206 709 HB3 MET 536 1HB MET 536 7.551 18.318 2.183 710 HG2 MET 536 2HG MET 536 5.649 19.409 1.106 711 HG3 MET 536 1HG MET 536 4.543 18.467 2.105 712 HE1 MET 536 3HE MET 536 3.350 20.711 2.852 713 HE2 MET 536 1HE MET 536 4.472 21.661 1.879 714 HE3 MET 536 2HE MET 536 4.196 22.079 3.572 715 H GLU 537 H GLU 537 7.897 15.656 -0.677 716 HA GLU 537 HA GLU 537 8.300 17.869 -2.263 717 HB2 GLU 537 2HB GLU 537 9.762 15.968 -2.317 718 HB3 GLU 537 1HB GLU 537 8.478 14.954 -2.940 719 HG2 GLU 537 2HG GLU 537 8.504 16.182 -5.031 720 HG3 GLU 537 1HG GLU 537 9.760 17.250 -4.395 721 H GLY 538 H GLY 538 5.976 15.206 -2.816 722 HA2 GLY 538 2HA GLY 538 4.025 16.993 -3.940 723 HA3 GLY 538 1HA GLY 538 4.728 15.994 -5.180 724 H THR 539 H THR 539 4.162 13.898 -5.364 725 HA THR 539 HA THR 539 2.068 13.138 -3.523 726 HB THR 539 HB THR 539 1.679 11.274 -5.164 727 HG1 THR 539 1HG THR 539 2.816 12.738 -7.208 728 HG21 THR 539 3HG2 THR 539 0.427 12.658 -6.733 729 HG22 THR 539 1HG2 THR 539 1.272 14.103 -6.150 730 HG23 THR 539 2HG2 THR 539 0.199 13.194 -5.070 731 H VAL 540 H VAL 540 2.152 11.422 -2.322 732 HA VAL 540 HA VAL 540 4.547 9.768 -2.446 733 HB VAL 540 HB VAL 540 2.564 10.204 -0.169 734 HG11 VAL 540 1HG1 VAL 540 3.297 7.872 -0.344 735 HG12 VAL 540 2HG1 VAL 540 3.935 8.644 1.111 736 HG13 VAL 540 3HG1 VAL 540 4.980 8.393 -0.297 737 HG21 VAL 540 3HG2 VAL 540 4.470 11.131 1.019 738 HG22 VAL 540 1HG2 VAL 540 4.265 11.960 -0.530 739 HG23 VAL 540 2HG2 VAL 540 5.519 10.748 -0.354 740 H SER 541 H SER 541 4.232 7.903 -3.419 741 HA SER 541 HA SER 541 1.511 7.090 -3.944 742 HB2 SER 541 2HB SER 541 4.102 5.941 -4.993 743 HB3 SER 541 1HB SER 541 2.485 5.676 -5.642 744 HG SER 541 HG SER 541 3.167 7.262 -6.895 745 H LEU 542 H LEU 542 0.645 5.752 -2.476 746 HA LEU 542 HA LEU 542 2.406 3.893 -1.055 747 HB2 LEU 542 2HB LEU 542 -0.452 4.699 -0.447 748 HB3 LEU 542 1HB LEU 542 0.494 3.570 0.482 749 HG LEU 542 HG LEU 542 0.352 5.556 1.697 750 HD11 LEU 542 1HD1 LEU 542 2.675 6.357 1.875 751 HD12 LEU 542 2HD1 LEU 542 3.064 5.380 0.468 752 HD13 LEU 542 3HD1 LEU 542 2.483 4.612 1.957 753 HD21 LEU 542 3HD2 LEU 542 -0.300 7.085 -0.043 754 HD22 LEU 542 1HD2 LEU 542 1.328 7.061 -0.712 755 HD23 LEU 542 2HD2 LEU 542 1.048 7.762 0.885 756 H LEU 543 H LEU 543 2.354 1.886 -1.732 757 HA LEU 543 HA LEU 543 -0.056 0.961 -3.165 758 HB2 LEU 543 2HB LEU 543 2.323 0.493 -4.124 759 HB3 LEU 543 1HB LEU 543 2.495 -0.515 -2.727 760 HG LEU 543 HG LEU 543 0.641 -1.959 -3.394 761 HD11 LEU 543 1HD1 LEU 543 0.555 -0.311 -5.902 762 HD12 LEU 543 2HD1 LEU 543 -0.696 -0.418 -4.664 763 HD13 LEU 543 3HD1 LEU 543 -0.299 -1.831 -5.639 764 HD21 LEU 543 3HD2 LEU 543 1.737 -3.066 -5.295 765 HD22 LEU 543 1HD2 LEU 543 2.891 -2.602 -4.043 766 HD23 LEU 543 2HD2 LEU 543 2.758 -1.645 -5.517 767 H VAL 544 H VAL 544 -1.473 -0.122 -1.965 768 HA VAL 544 HA VAL 544 -0.407 -1.369 0.458 769 HB VAL 544 HB VAL 544 -2.503 -1.015 1.586 770 HG11 VAL 544 1HG1 VAL 544 -1.494 1.541 0.363 771 HG12 VAL 544 2HG1 VAL 544 -0.863 0.743 1.804 772 HG13 VAL 544 3HG1 VAL 544 -2.489 1.426 1.815 773 HG21 VAL 544 3HG2 VAL 544 -3.951 -1.208 -0.277 774 HG22 VAL 544 1HG2 VAL 544 -3.398 0.334 -0.940 775 HG23 VAL 544 2HG2 VAL 544 -4.326 0.294 0.584 776 H PHE 545 H PHE 545 -1.503 -3.157 1.189 777 HA PHE 545 HA PHE 545 -2.708 -4.826 -0.916 778 HB2 PHE 545 2HB PHE 545 -0.516 -5.533 -0.167 779 HB3 PHE 545 1HB PHE 545 -1.035 -5.533 1.505 780 HD1 PHE 545 1HD PHE 545 -1.217 -7.202 -1.724 781 HD2 PHE 545 2HD PHE 545 -2.296 -7.402 2.375 782 HE1 PHE 545 1HE PHE 545 -1.756 -9.559 -1.998 783 HE2 PHE 545 2HE PHE 545 -2.845 -9.784 2.118 784 HZ PHE 545 HZ PHE 545 -2.574 -10.870 -0.068 785 H ARG 546 H ARG 546 -4.795 -4.991 -0.563 786 HA ARG 546 HA ARG 546 -5.728 -4.894 2.169 787 HB2 ARG 546 2HB ARG 546 -6.842 -3.299 0.710 788 HB3 ARG 546 1HB ARG 546 -7.260 -4.585 -0.422 789 HG2 ARG 546 2HG ARG 546 -8.673 -5.633 1.225 790 HG3 ARG 546 1HG ARG 546 -8.194 -4.448 2.429 791 HD2 ARG 546 2HD ARG 546 -9.270 -2.696 1.178 792 HD3 ARG 546 1HD ARG 546 -9.689 -3.820 -0.117 793 HE ARG 546 HE ARG 546 -10.632 -4.862 2.267 794 HH11 ARG 546 1HH1 ARG 546 -11.352 -2.095 0.195 795 HH12 ARG 546 2HH1 ARG 546 -12.981 -1.992 0.692 796 HH21 ARG 546 1HH2 ARG 546 -12.835 -4.722 2.917 797 HH22 ARG 546 2HH2 ARG 546 -13.836 -3.514 2.262 798 H GLN 547 H GLN 547 -6.261 -6.623 3.090 799 HA GLN 547 HA GLN 547 -6.682 -9.053 1.514 800 HB2 GLN 547 2HB GLN 547 -5.866 -10.274 3.499 801 HB3 GLN 547 1HB GLN 547 -4.669 -9.151 2.874 802 HG2 GLN 547 2HG GLN 547 -5.350 -7.547 4.653 803 HG3 GLN 547 1HG GLN 547 -6.386 -8.808 5.319 804 HE21 GLN 547 1HE2 GLN 547 -5.301 -9.003 7.212 805 HE22 GLN 547 2HE2 GLN 547 -3.701 -9.647 7.341 806 H GLU 548 H GLU 548 -8.414 -10.418 2.148 807 HA GLU 548 HA GLU 548 -10.629 -8.895 3.076 808 HB2 GLU 548 2HB GLU 548 -10.462 -11.824 2.422 809 HB3 GLU 548 1HB GLU 548 -11.939 -10.959 2.801 810 HG2 GLU 548 2HG GLU 548 -11.583 -9.543 0.824 811 HG3 GLU 548 1HG GLU 548 -10.141 -10.485 0.437 812 H GLU 549 H GLU 549 -10.290 -8.325 5.114 813 HA GLU 549 HA GLU 549 -9.788 -10.270 7.125 814 HB2 GLU 549 2HB GLU 549 -10.493 -7.348 7.347 815 HB3 GLU 549 1HB GLU 549 -10.109 -8.374 8.719 816 HG2 GLU 549 2HG GLU 549 -8.259 -7.797 6.418 817 HG3 GLU 549 1HG GLU 549 -8.201 -7.006 7.990 818 H ALA 550 H ALA 550 -11.357 -11.694 7.166 819 HA ALA 550 HA ALA 550 -14.113 -10.794 7.619 820 HB1 ALA 550 1HB ALA 550 -13.021 -13.588 7.177 821 HB2 ALA 550 2HB ALA 550 -13.787 -12.577 5.953 822 HB3 ALA 550 3HB ALA 550 -14.728 -13.165 7.324 823 H PHE 551 H PHE 551 -11.398 -11.441 9.243 824 HA PHE 551 HA PHE 551 -12.783 -12.040 11.732 825 HB2 PHE 551 2HB PHE 551 -10.209 -13.193 10.701 826 HB3 PHE 551 1HB PHE 551 -10.811 -13.443 12.346 827 HD1 PHE 551 2HD PHE 551 -12.860 -14.791 12.662 828 HD2 PHE 551 1HD PHE 551 -10.971 -14.431 8.875 829 HE1 PHE 551 2HE PHE 551 -14.091 -16.743 11.869 830 HE2 PHE 551 1HE PHE 551 -12.202 -16.389 8.065 831 HZ PHE 551 HZ PHE 551 -13.766 -17.556 9.562 832 H HIS 552 H HIS 552 -11.716 -10.940 13.497 833 HA HIS 552 HA HIS 552 -9.370 -9.409 12.779 834 HB2 HIS 552 2HB HIS 552 -10.215 -7.310 13.756 835 HB3 HIS 552 1HB HIS 552 -11.221 -7.828 12.415 836 HD1 HIS 552 1HD HIS 552 -11.304 -6.948 15.967 837 HD2 HIS 552 2HD HIS 552 -13.817 -8.809 13.249 838 HE1 HIS 552 1HE HIS 552 -13.554 -6.986 17.059 839 HE2 HIS 552 2HE HIS 552 -15.061 -8.139 15.404 840 HA PRO 553 HA PRO 553 -7.873 -10.854 16.680 841 HB2 PRO 553 2HB PRO 553 -6.499 -8.224 16.845 842 HB3 PRO 553 1HB PRO 553 -5.819 -9.851 16.928 843 HG2 PRO 553 2HG PRO 553 -5.488 -8.381 14.746 844 HG3 PRO 553 1HG PRO 553 -5.823 -10.118 14.624 845 HD2 PRO 553 2HD PRO 553 -7.663 -7.803 14.215 846 HD3 PRO 553 1HD PRO 553 -7.510 -9.322 13.298 847 H ARG 554 H ARG 554 -8.364 -10.640 18.829 848 HA ARG 554 HA ARG 554 -10.184 -8.461 19.449 849 HB2 ARG 554 2HB ARG 554 -9.681 -11.028 20.976 850 HB3 ARG 554 1HB ARG 554 -10.777 -9.762 21.501 851 HG2 ARG 554 2HG ARG 554 -12.144 -11.404 20.533 852 HG3 ARG 554 1HG ARG 554 -12.016 -10.137 19.316 853 HD2 ARG 554 2HD ARG 554 -11.809 -12.295 18.250 854 HD3 ARG 554 1HD ARG 554 -10.246 -11.477 18.190 855 HE ARG 554 HE ARG 554 -10.137 -12.949 20.463 856 HH11 ARG 554 1HH1 ARG 554 -10.721 -13.784 17.078 857 HH12 ARG 554 2HH1 ARG 554 -10.170 -15.388 17.278 858 HH21 ARG 554 1HH2 ARG 554 -9.402 -15.081 20.688 859 HH22 ARG 554 2HH2 ARG 554 -9.417 -16.152 19.341 860 H GLU 555 H GLU 555 -9.986 -7.222 21.274 861 HA GLU 555 HA GLU 555 -7.234 -6.635 21.892 862 HB2 GLU 555 2HB GLU 555 -8.201 -4.631 23.028 863 HB3 GLU 555 1HB GLU 555 -8.609 -4.758 21.324 864 HG2 GLU 555 2HG GLU 555 -10.818 -5.594 21.895 865 HG3 GLU 555 1HG GLU 555 -10.413 -5.539 23.606 866 H MET 556 H MET 556 -6.239 -7.016 23.752 867 HA MET 556 HA MET 556 -7.758 -8.311 25.884 868 HB2 MET 556 2HB MET 556 -5.821 -9.569 25.079 869 HB3 MET 556 1HB MET 556 -4.778 -8.183 25.352 870 HG2 MET 556 2HG MET 556 -4.526 -9.873 27.094 871 HG3 MET 556 1HG MET 556 -5.132 -8.348 27.742 872 HE1 MET 556 3HE MET 556 -5.214 -11.087 29.329 873 HE2 MET 556 1HE MET 556 -6.836 -11.048 30.021 874 HE3 MET 556 2HE MET 556 -5.852 -9.581 29.995 875 H ASN 557 H ASN 557 -8.437 -6.974 27.375 876 HA ASN 557 HA ASN 557 -6.833 -4.594 27.967 877 HB2 ASN 557 2HB ASN 557 -9.779 -5.071 28.410 878 HB3 ASN 557 1HB ASN 557 -8.913 -3.639 28.943 879 HD21 ASN 557 1HD2 ASN 557 -10.276 -5.337 26.249 880 HD22 ASN 557 2HD2 ASN 557 -10.113 -4.048 25.119 881 H ALA 558 H ALA 558 -6.133 -4.209 29.941 882 HA ALA 558 HA ALA 558 -7.109 -5.815 32.155 883 HB1 ALA 558 1HB ALA 558 -5.017 -6.871 31.400 884 HB2 ALA 558 2HB ALA 558 -4.786 -6.087 32.963 885 HB3 ALA 558 3HB ALA 558 -4.193 -5.316 31.493 Start of MODEL 16 1 H1 GLY 448 1HT GLY 448 -0.854 1.840 -15.766 2 H2 GLY 448 2HT GLY 448 -0.115 0.414 -15.210 3 H3 GLY 448 3HT GLY 448 -1.035 1.354 -14.155 4 HA2 GLY 448 1HA GLY 448 -3.009 0.872 -15.414 5 HA3 GLY 448 2HA GLY 448 -2.022 -0.113 -16.490 6 H SER 449 H SER 449 -4.019 -1.419 -15.426 7 HA SER 449 HA SER 449 -2.784 -3.038 -13.338 8 HB2 SER 449 2HB SER 449 -4.557 -1.670 -12.325 9 HB3 SER 449 1HB SER 449 -5.691 -2.196 -13.565 10 HG SER 449 HG SER 449 -4.496 -3.717 -11.510 11 H VAL 450 H VAL 450 -2.426 -4.994 -14.182 12 HA VAL 450 HA VAL 450 -3.715 -5.896 -16.558 13 HB VAL 450 HB VAL 450 -1.396 -6.582 -15.959 14 HG11 VAL 450 1HG1 VAL 450 -2.670 -8.192 -13.767 15 HG12 VAL 450 2HG1 VAL 450 -1.590 -6.814 -13.571 16 HG13 VAL 450 3HG1 VAL 450 -0.990 -8.315 -14.279 17 HG21 VAL 450 3HG2 VAL 450 -2.604 -7.957 -17.541 18 HG22 VAL 450 1HG2 VAL 450 -3.313 -8.898 -16.226 19 HG23 VAL 450 2HG2 VAL 450 -1.576 -8.974 -16.532 20 H TYR 451 H TYR 451 -5.434 -7.285 -16.782 21 HA TYR 451 HA TYR 451 -7.058 -7.580 -14.411 22 HB2 TYR 451 2HB TYR 451 -8.075 -6.782 -16.539 23 HB3 TYR 451 1HB TYR 451 -7.668 -8.319 -17.288 24 HD1 TYR 451 1HD TYR 451 -9.858 -6.630 -14.881 25 HD2 TYR 451 2HD TYR 451 -8.996 -10.317 -16.821 26 HE1 TYR 451 1HE TYR 451 -12.017 -7.518 -14.133 27 HE2 TYR 451 2HE TYR 451 -11.162 -11.222 -16.077 28 HH TYR 451 HH TYR 451 -12.786 -10.814 -14.278 29 H ASN 452 H ASN 452 -7.612 -9.504 -13.493 30 HA ASN 452 HA ASN 452 -6.777 -11.973 -14.731 31 HB2 ASN 452 2HB ASN 452 -4.793 -11.240 -13.377 32 HB3 ASN 452 1HB ASN 452 -5.821 -11.199 -11.957 33 HD21 ASN 452 1HD2 ASN 452 -4.295 -13.250 -14.300 34 HD22 ASN 452 2HD2 ASN 452 -4.421 -14.710 -13.394 35 H THR 453 H THR 453 -7.942 -13.771 -13.850 36 HA THR 453 HA THR 453 -10.462 -12.959 -12.847 37 HB THR 453 HB THR 453 -10.948 -15.443 -12.912 38 HG1 THR 453 1HG THR 453 -9.178 -16.386 -14.440 39 HG21 THR 453 3HG2 THR 453 -11.029 -15.487 -15.360 40 HG22 THR 453 1HG2 THR 453 -9.912 -14.123 -15.425 41 HG23 THR 453 2HG2 THR 453 -11.521 -13.917 -14.736 42 H LYS 454 H LYS 454 -7.637 -14.489 -11.429 43 HA LYS 454 HA LYS 454 -9.156 -14.686 -8.951 44 HB2 LYS 454 2HB LYS 454 -6.663 -16.165 -9.756 45 HB3 LYS 454 1HB LYS 454 -7.394 -16.242 -8.162 46 HG2 LYS 454 2HG LYS 454 -9.430 -17.183 -9.168 47 HG3 LYS 454 1HG LYS 454 -8.640 -17.149 -10.750 48 HD2 LYS 454 2HD LYS 454 -6.909 -18.645 -9.916 49 HD3 LYS 454 1HD LYS 454 -7.671 -18.657 -8.326 50 HE2 LYS 454 2HE LYS 454 -9.698 -19.625 -9.337 51 HE3 LYS 454 1HE LYS 454 -8.877 -19.658 -10.895 52 HZ1 LYS 454 3HZ LYS 454 -8.796 -21.791 -9.778 53 HZ2 LYS 454 1HZ LYS 454 -7.978 -21.115 -8.471 54 HZ3 LYS 454 2HZ LYS 454 -7.252 -21.172 -9.995 55 H LYS 455 H LYS 455 -8.920 -12.556 -8.394 56 HA LYS 455 HA LYS 455 -6.243 -11.993 -7.408 57 HB2 LYS 455 2HB LYS 455 -8.365 -9.991 -8.182 58 HB3 LYS 455 1HB LYS 455 -6.943 -9.573 -7.251 59 HG2 LYS 455 2HG LYS 455 -5.552 -10.354 -9.174 60 HG3 LYS 455 1HG LYS 455 -7.050 -10.571 -10.084 61 HD2 LYS 455 2HD LYS 455 -7.594 -8.224 -9.832 62 HD3 LYS 455 1HD LYS 455 -6.180 -7.977 -8.811 63 HE2 LYS 455 2HE LYS 455 -4.732 -8.576 -10.692 64 HE3 LYS 455 1HE LYS 455 -6.152 -8.800 -11.713 65 HZ1 LYS 455 3HZ LYS 455 -6.692 -6.459 -11.391 66 HZ2 LYS 455 1HZ LYS 455 -5.166 -6.645 -12.071 67 HZ3 LYS 455 2HZ LYS 455 -5.312 -6.244 -10.438 68 H VAL 456 H VAL 456 -6.612 -13.219 -5.602 69 HA VAL 456 HA VAL 456 -8.731 -12.421 -3.837 70 HB VAL 456 HB VAL 456 -7.968 -14.796 -3.857 71 HG11 VAL 456 1HG1 VAL 456 -5.627 -14.552 -4.286 72 HG12 VAL 456 2HG1 VAL 456 -5.862 -15.464 -2.800 73 HG13 VAL 456 3HG1 VAL 456 -5.381 -13.769 -2.724 74 HG21 VAL 456 3HG2 VAL 456 -9.069 -13.986 -1.857 75 HG22 VAL 456 1HG2 VAL 456 -7.531 -13.425 -1.205 76 HG23 VAL 456 2HG2 VAL 456 -7.820 -15.151 -1.426 77 H GLY 457 H GLY 457 -5.427 -11.766 -4.410 78 HA2 GLY 457 2HA GLY 457 -5.385 -9.864 -2.177 79 HA3 GLY 457 1HA GLY 457 -3.953 -10.586 -2.907 80 H LYS 458 H LYS 458 -6.091 -8.017 -2.971 81 HA LYS 458 HA LYS 458 -5.455 -7.211 -5.703 82 HB2 LYS 458 2HB LYS 458 -7.192 -5.910 -3.610 83 HB3 LYS 458 1HB LYS 458 -7.079 -5.436 -5.297 84 HG2 LYS 458 2HG LYS 458 -8.075 -7.534 -5.985 85 HG3 LYS 458 1HG LYS 458 -8.105 -8.092 -4.308 86 HD2 LYS 458 2HD LYS 458 -9.583 -6.212 -3.732 87 HD3 LYS 458 1HD LYS 458 -9.582 -5.705 -5.419 88 HE2 LYS 458 2HE LYS 458 -10.617 -7.810 -6.070 89 HE3 LYS 458 1HE LYS 458 -10.566 -8.371 -4.402 90 HZ1 LYS 458 3HZ LYS 458 -12.758 -7.528 -4.943 91 HZ2 LYS 458 1HZ LYS 458 -12.119 -6.025 -5.378 92 HZ3 LYS 458 2HZ LYS 458 -12.040 -6.577 -3.787 93 H ARG 459 H ARG 459 -3.884 -5.742 -6.114 94 HA ARG 459 HA ARG 459 -2.922 -4.138 -3.873 95 HB2 ARG 459 2HB ARG 459 -1.504 -5.063 -6.373 96 HB3 ARG 459 1HB ARG 459 -0.882 -3.775 -5.355 97 HG2 ARG 459 2HG ARG 459 -0.600 -5.215 -3.528 98 HG3 ARG 459 1HG ARG 459 -1.482 -6.529 -4.284 99 HD2 ARG 459 2HD ARG 459 1.143 -5.352 -5.218 100 HD3 ARG 459 1HD ARG 459 0.945 -6.889 -4.374 101 HE ARG 459 HE ARG 459 -0.681 -6.937 -6.614 102 HH11 ARG 459 1HH1 ARG 459 2.766 -6.879 -5.911 103 HH12 ARG 459 2HH1 ARG 459 3.246 -7.706 -7.307 104 HH21 ARG 459 1HH2 ARG 459 -0.076 -8.072 -8.553 105 HH22 ARG 459 2HH2 ARG 459 1.568 -8.386 -8.869 106 H LEU 460 H LEU 460 -3.153 -2.089 -3.919 107 HA LEU 460 HA LEU 460 -4.166 -0.808 -6.391 108 HB2 LEU 460 2HB LEU 460 -5.107 -0.293 -3.576 109 HB3 LEU 460 1HB LEU 460 -5.690 0.502 -5.018 110 HG LEU 460 HG LEU 460 -6.069 -2.427 -4.377 111 HD11 LEU 460 1HD1 LEU 460 -8.012 -0.131 -4.288 112 HD12 LEU 460 2HD1 LEU 460 -7.352 -1.000 -2.899 113 HD13 LEU 460 3HD1 LEU 460 -8.400 -1.834 -4.050 114 HD21 LEU 460 3HD2 LEU 460 -7.173 -0.737 -6.623 115 HD22 LEU 460 1HD2 LEU 460 -7.615 -2.411 -6.277 116 HD23 LEU 460 2HD2 LEU 460 -5.969 -2.015 -6.776 117 H ASN 461 H ASN 461 -3.370 1.186 -6.792 118 HA ASN 461 HA ASN 461 -1.361 2.164 -4.905 119 HB2 ASN 461 2HB ASN 461 -0.324 3.430 -6.752 120 HB3 ASN 461 1HB ASN 461 -0.405 1.721 -7.133 121 HD21 ASN 461 1HD2 ASN 461 -0.127 4.061 -8.876 122 HD22 ASN 461 2HD2 ASN 461 -1.432 3.981 -9.988 123 H ILE 462 H ILE 462 -1.672 3.888 -3.830 124 HA ILE 462 HA ILE 462 -3.853 5.716 -4.594 125 HB ILE 462 HB ILE 462 -2.925 4.901 -1.818 126 HG12 ILE 462 2HG1 ILE 462 -5.582 4.364 -3.172 127 HG13 ILE 462 1HG1 ILE 462 -4.285 3.173 -3.027 128 HG21 ILE 462 1HG2 ILE 462 -3.625 7.236 -1.866 129 HG22 ILE 462 2HG2 ILE 462 -4.790 6.252 -0.980 130 HG23 ILE 462 3HG2 ILE 462 -5.154 6.779 -2.622 131 HD11 ILE 462 3HD1 ILE 462 -6.023 2.823 -1.385 132 HD12 ILE 462 1HD1 ILE 462 -5.826 4.473 -0.801 133 HD13 ILE 462 2HD1 ILE 462 -4.523 3.305 -0.588 134 H GLN 463 H GLN 463 -3.056 7.657 -5.116 135 HA GLN 463 HA GLN 463 -0.470 8.473 -4.017 136 HB2 GLN 463 2HB GLN 463 -2.103 9.623 -6.271 137 HB3 GLN 463 1HB GLN 463 -0.676 10.406 -5.617 138 HG2 GLN 463 2HG GLN 463 0.667 8.554 -6.239 139 HG3 GLN 463 1HG GLN 463 -0.741 7.683 -6.893 140 HE21 GLN 463 1HE2 GLN 463 1.533 10.266 -7.311 141 HE22 GLN 463 2HE2 GLN 463 1.128 10.640 -8.929 142 H LEU 464 H LEU 464 -0.318 9.907 -2.528 143 HA LEU 464 HA LEU 464 -2.727 11.468 -1.884 144 HB2 LEU 464 2HB LEU 464 -0.611 10.405 -0.038 145 HB3 LEU 464 1HB LEU 464 -1.954 11.418 0.445 146 HG LEU 464 HG LEU 464 -2.191 8.637 -0.702 147 HD11 LEU 464 1HD1 LEU 464 -2.553 9.650 2.099 148 HD12 LEU 464 2HD1 LEU 464 -1.248 8.616 1.508 149 HD13 LEU 464 3HD1 LEU 464 -2.905 8.016 1.537 150 HD21 LEU 464 3HD2 LEU 464 -4.541 8.817 -0.049 151 HD22 LEU 464 1HD2 LEU 464 -4.117 10.010 -1.271 152 HD23 LEU 464 2HD2 LEU 464 -4.285 10.498 0.417 153 H LYS 465 H LYS 465 -2.514 13.579 -1.722 154 HA LYS 465 HA LYS 465 0.129 14.800 -2.090 155 HB2 LYS 465 2HB LYS 465 -1.540 15.402 -3.745 156 HB3 LYS 465 1HB LYS 465 -2.684 15.821 -2.471 157 HG2 LYS 465 2HG LYS 465 -1.300 17.710 -1.841 158 HG3 LYS 465 1HG LYS 465 -0.087 17.244 -3.033 159 HD2 LYS 465 2HD LYS 465 -1.504 19.058 -3.879 160 HD3 LYS 465 1HD LYS 465 -1.696 17.593 -4.839 161 HE2 LYS 465 2HE LYS 465 -3.864 18.595 -4.461 162 HE3 LYS 465 1HE LYS 465 -3.766 17.081 -3.575 163 HZ1 LYS 465 3HZ LYS 465 -3.317 18.383 -1.546 164 HZ2 LYS 465 1HZ LYS 465 -4.782 18.823 -2.261 165 HZ3 LYS 465 2HZ LYS 465 -3.418 19.797 -2.433 166 H LYS 466 H LYS 466 0.972 15.929 -0.589 167 HA LYS 466 HA LYS 466 0.009 15.497 2.043 168 HB2 LYS 466 2HB LYS 466 2.451 16.710 0.897 169 HB3 LYS 466 1HB LYS 466 2.041 17.108 2.554 170 HG2 LYS 466 2HG LYS 466 3.643 15.213 2.321 171 HG3 LYS 466 1HG LYS 466 2.196 14.821 3.229 172 HD2 LYS 466 2HD LYS 466 2.834 12.993 1.737 173 HD3 LYS 466 1HD LYS 466 1.280 13.670 1.275 174 HE2 LYS 466 2HE LYS 466 2.687 13.187 -0.663 175 HE3 LYS 466 1HE LYS 466 2.312 14.889 -0.522 176 HZ1 LYS 466 3HZ LYS 466 4.413 15.326 0.373 177 HZ2 LYS 466 1HZ LYS 466 4.634 14.456 -1.075 178 HZ3 LYS 466 2HZ LYS 466 4.867 13.700 0.402 179 H GLY 467 H GLY 467 -1.260 16.553 3.175 180 HA2 GLY 467 2HA GLY 467 -1.856 19.323 2.458 181 HA3 GLY 467 1HA GLY 467 -2.978 18.231 3.267 182 H THR 468 H THR 468 -3.322 19.578 5.013 183 HA THR 468 HA THR 468 -1.484 21.032 6.456 184 HB THR 468 HB THR 468 -3.962 19.694 7.534 185 HG1 THR 468 1HG THR 468 -3.667 22.043 5.922 186 HG21 THR 468 3HG2 THR 468 -2.614 20.916 9.179 187 HG22 THR 468 1HG2 THR 468 -4.133 21.758 8.867 188 HG23 THR 468 2HG2 THR 468 -2.635 22.341 8.139 189 H GLU 469 H GLU 469 -2.571 17.674 6.933 190 HA GLU 469 HA GLU 469 -0.723 17.386 9.174 191 HB2 GLU 469 2HB GLU 469 -2.910 15.550 8.219 192 HB3 GLU 469 1HB GLU 469 -1.871 15.246 9.604 193 HG2 GLU 469 2HG GLU 469 -3.792 17.535 9.286 194 HG3 GLU 469 1HG GLU 469 -4.018 16.094 10.278 195 H GLY 470 H GLY 470 -0.295 17.228 6.060 196 HA2 GLY 470 2HA GLY 470 1.411 16.195 4.875 197 HA3 GLY 470 1HA GLY 470 1.673 15.117 6.245 198 H LEU 471 H LEU 471 1.106 13.072 5.958 199 HA LEU 471 HA LEU 471 -0.364 12.325 3.612 200 HB2 LEU 471 2HB LEU 471 0.918 10.734 5.812 201 HB3 LEU 471 1HB LEU 471 -0.118 9.976 4.630 202 HG LEU 471 HG LEU 471 2.148 9.583 4.036 203 HD11 LEU 471 1HD1 LEU 471 0.956 11.628 2.182 204 HD12 LEU 471 2HD1 LEU 471 0.684 9.894 2.174 205 HD13 LEU 471 3HD1 LEU 471 2.281 10.536 1.790 206 HD21 LEU 471 3HD2 LEU 471 3.234 11.408 5.221 207 HD22 LEU 471 1HD2 LEU 471 2.564 12.567 4.074 208 HD23 LEU 471 2HD2 LEU 471 3.746 11.380 3.530 209 H GLY 472 H GLY 472 -0.915 12.153 7.085 210 HA2 GLY 472 2HA GLY 472 -3.079 12.536 8.015 211 HA3 GLY 472 1HA GLY 472 -3.775 12.081 6.464 212 H PHE 473 H PHE 473 -1.311 9.967 7.437 213 HA PHE 473 HA PHE 473 -2.993 8.337 9.067 214 HB2 PHE 473 2HB PHE 473 -2.940 6.351 7.678 215 HB3 PHE 473 1HB PHE 473 -3.664 7.647 6.749 216 HD1 PHE 473 1HD PHE 473 -1.961 8.942 5.213 217 HD2 PHE 473 2HD PHE 473 -1.356 4.990 6.671 218 HE1 PHE 473 1HE PHE 473 -0.404 8.481 3.374 219 HE2 PHE 473 2HE PHE 473 0.205 4.555 4.850 220 HZ PHE 473 HZ PHE 473 0.660 6.343 3.182 221 H SER 474 H SER 474 -1.771 6.461 9.803 222 HA SER 474 HA SER 474 1.104 6.885 9.657 223 HB2 SER 474 2HB SER 474 -0.507 6.321 12.159 224 HB3 SER 474 1HB SER 474 1.254 6.425 12.084 225 HG SER 474 HG SER 474 0.216 8.560 10.920 226 H ILE 475 H ILE 475 2.211 4.799 10.558 227 HA ILE 475 HA ILE 475 0.665 2.536 9.488 228 HB ILE 475 HB ILE 475 2.806 1.596 8.772 229 HG12 ILE 475 2HG1 ILE 475 3.875 4.364 9.294 230 HG13 ILE 475 1HG1 ILE 475 4.238 2.867 10.172 231 HG21 ILE 475 1HG2 ILE 475 1.314 2.571 7.177 232 HG22 ILE 475 2HG2 ILE 475 2.981 2.867 6.713 233 HG23 ILE 475 3HG2 ILE 475 2.017 4.178 7.420 234 HD11 ILE 475 3HD1 ILE 475 6.031 3.535 8.542 235 HD12 ILE 475 1HD1 ILE 475 4.855 3.350 7.254 236 HD13 ILE 475 2HD1 ILE 475 5.342 1.953 8.211 237 H THR 476 H THR 476 1.053 0.548 10.358 238 HA THR 476 HA THR 476 2.429 0.399 12.927 239 HB THR 476 HB THR 476 -0.038 0.544 13.338 240 HG1 THR 476 1HG THR 476 0.340 -0.780 14.923 241 HG21 THR 476 3HG2 THR 476 -0.830 -0.444 11.232 242 HG22 THR 476 1HG2 THR 476 -1.514 -1.294 12.617 243 HG23 THR 476 2HG2 THR 476 -0.174 -2.006 11.719 244 H SER 477 H SER 477 2.958 -1.866 13.449 245 HA SER 477 HA SER 477 3.416 -3.397 10.997 246 HB2 SER 477 2HB SER 477 5.600 -3.973 11.922 247 HB3 SER 477 1HB SER 477 5.437 -2.238 11.753 248 HG SER 477 HG SER 477 5.692 -3.745 14.058 249 H ARG 478 H ARG 478 3.675 -5.695 11.459 250 HA ARG 478 HA ARG 478 2.554 -6.476 14.050 251 HB2 ARG 478 2HB ARG 478 2.121 -8.724 12.926 252 HB3 ARG 478 1HB ARG 478 1.103 -7.391 12.407 253 HG2 ARG 478 2HG ARG 478 2.318 -7.161 10.372 254 HG3 ARG 478 1HG ARG 478 3.564 -8.253 10.952 255 HD2 ARG 478 2HD ARG 478 0.727 -9.177 10.671 256 HD3 ARG 478 1HD ARG 478 1.835 -9.188 9.294 257 HE ARG 478 HE ARG 478 3.294 -10.481 11.026 258 HH11 ARG 478 1HH1 ARG 478 -0.194 -10.930 10.572 259 HH12 ARG 478 2HH1 ARG 478 -0.136 -12.606 10.817 260 HH21 ARG 478 1HH2 ARG 478 3.356 -12.778 11.315 261 HH22 ARG 478 2HH2 ARG 478 1.928 -13.695 11.260 262 H ASP 479 H ASP 479 3.912 -7.345 15.377 263 HA ASP 479 HA ASP 479 6.406 -8.421 14.287 264 HB2 ASP 479 2HB ASP 479 5.940 -7.062 16.963 265 HB3 ASP 479 1HB ASP 479 7.439 -7.845 16.499 266 H VAL 480 H VAL 480 6.157 -10.526 14.284 267 HA VAL 480 HA VAL 480 5.065 -11.769 16.729 268 HB VAL 480 HB VAL 480 4.235 -13.664 15.441 269 HG11 VAL 480 1HG1 VAL 480 3.277 -11.041 14.336 270 HG12 VAL 480 2HG1 VAL 480 2.697 -11.846 15.792 271 HG13 VAL 480 3HG1 VAL 480 2.418 -12.574 14.209 272 HG21 VAL 480 3HG2 VAL 480 5.218 -12.190 12.997 273 HG22 VAL 480 1HG2 VAL 480 4.202 -13.633 12.969 274 HG23 VAL 480 2HG2 VAL 480 5.835 -13.718 13.623 275 H THR 481 H THR 481 7.597 -11.759 14.401 276 HA THR 481 HA THR 481 9.207 -13.426 16.116 277 HB THR 481 HB THR 481 8.743 -14.096 13.194 278 HG1 THR 481 1HG THR 481 7.539 -14.899 15.474 279 HG21 THR 481 3HG2 THR 481 11.053 -14.529 13.901 280 HG22 THR 481 1HG2 THR 481 10.196 -16.048 13.635 281 HG23 THR 481 2HG2 THR 481 10.464 -15.463 15.275 282 H ILE 482 H ILE 482 10.951 -12.216 16.357 283 HA ILE 482 HA ILE 482 12.695 -10.849 16.007 284 HB ILE 482 HB ILE 482 12.151 -11.223 13.035 285 HG12 ILE 482 2HG1 ILE 482 14.228 -12.548 14.797 286 HG13 ILE 482 1HG1 ILE 482 12.733 -13.314 14.265 287 HG21 ILE 482 1HG2 ILE 482 14.581 -10.079 14.421 288 HG22 ILE 482 2HG2 ILE 482 13.423 -9.177 13.450 289 HG23 ILE 482 3HG2 ILE 482 14.449 -10.395 12.693 290 HD11 ILE 482 3HD1 ILE 482 14.635 -14.037 12.936 291 HD12 ILE 482 1HD1 ILE 482 14.973 -12.362 12.490 292 HD13 ILE 482 2HD1 ILE 482 13.486 -13.137 11.949 293 H GLY 483 H GLY 483 11.964 -9.048 16.926 294 HA2 GLY 483 2HA GLY 483 9.988 -7.347 15.856 295 HA3 GLY 483 1HA GLY 483 11.129 -6.941 17.137 296 H GLY 484 H GLY 484 10.129 -5.870 14.364 297 HA2 GLY 484 2HA GLY 484 11.494 -3.981 13.453 298 HA3 GLY 484 1HA GLY 484 12.851 -5.105 13.486 299 H SER 485 H SER 485 11.832 -7.372 12.492 300 HA SER 485 HA SER 485 11.349 -6.694 9.719 301 HB2 SER 485 2HB SER 485 12.927 -8.571 10.334 302 HB3 SER 485 1HB SER 485 11.577 -9.427 11.069 303 HG SER 485 HG SER 485 12.238 -9.966 8.827 304 H ALA 486 H ALA 486 9.306 -5.860 9.662 305 HA ALA 486 HA ALA 486 7.148 -7.612 10.483 306 HB1 ALA 486 1HB ALA 486 6.148 -5.925 11.868 307 HB2 ALA 486 2HB ALA 486 7.515 -4.835 11.569 308 HB3 ALA 486 3HB ALA 486 7.747 -6.342 12.461 309 HA PRO 487 HA PRO 487 5.514 -5.785 6.654 310 HB2 PRO 487 2HB PRO 487 3.094 -7.086 7.782 311 HB3 PRO 487 1HB PRO 487 3.761 -7.199 6.149 312 HG2 PRO 487 2HG PRO 487 4.029 -9.231 7.855 313 HG3 PRO 487 1HG PRO 487 5.350 -8.782 6.761 314 HD2 PRO 487 2HD PRO 487 5.062 -8.266 9.688 315 HD3 PRO 487 1HD PRO 487 6.511 -8.634 8.731 316 H ILE 488 H ILE 488 4.357 -3.946 6.348 317 HA ILE 488 HA ILE 488 3.389 -2.672 8.754 318 HB ILE 488 HB ILE 488 4.420 -1.453 6.143 319 HG12 ILE 488 2HG1 ILE 488 6.057 -2.269 7.918 320 HG13 ILE 488 1HG1 ILE 488 6.142 -0.578 7.451 321 HG21 ILE 488 1HG2 ILE 488 4.010 0.679 7.094 322 HG22 ILE 488 2HG2 ILE 488 3.167 -0.156 8.426 323 HG23 ILE 488 3HG2 ILE 488 2.513 -0.233 6.793 324 HD11 ILE 488 3HD1 ILE 488 5.060 0.113 9.461 325 HD12 ILE 488 1HD1 ILE 488 6.416 -0.919 9.866 326 HD13 ILE 488 2HD1 ILE 488 4.778 -1.574 9.948 327 H TYR 489 H TYR 489 1.456 -1.958 9.022 328 HA TYR 489 HA TYR 489 -0.531 -2.005 6.849 329 HB2 TYR 489 2HB TYR 489 -0.981 -2.676 9.790 330 HB3 TYR 489 1HB TYR 489 -2.233 -2.539 8.575 331 HD1 TYR 489 2HD TYR 489 0.764 -4.508 9.509 332 HD2 TYR 489 1HD TYR 489 -2.843 -4.381 7.276 333 HE1 TYR 489 2HE TYR 489 1.017 -6.876 8.992 334 HE2 TYR 489 1HE TYR 489 -2.604 -6.769 6.741 335 HH TYR 489 HH TYR 489 -0.462 -8.767 8.371 336 H VAL 490 H VAL 490 -2.253 -0.436 7.314 337 HA VAL 490 HA VAL 490 -1.159 2.044 8.248 338 HB VAL 490 HB VAL 490 -4.020 1.373 7.502 339 HG11 VAL 490 1HG1 VAL 490 -2.668 4.049 7.851 340 HG12 VAL 490 2HG1 VAL 490 -3.920 3.372 8.887 341 HG13 VAL 490 3HG1 VAL 490 -4.295 3.805 7.217 342 HG21 VAL 490 3HG2 VAL 490 -2.484 1.020 5.657 343 HG22 VAL 490 1HG2 VAL 490 -1.818 2.642 5.882 344 HG23 VAL 490 2HG2 VAL 490 -3.499 2.434 5.384 345 H LYS 491 H LYS 491 -1.163 2.806 10.243 346 HA LYS 491 HA LYS 491 -2.255 1.264 12.394 347 HB2 LYS 491 2HB LYS 491 -0.132 2.423 12.688 348 HB3 LYS 491 1HB LYS 491 -0.888 3.954 12.321 349 HG2 LYS 491 2HG LYS 491 -0.473 3.701 14.721 350 HG3 LYS 491 1HG LYS 491 -2.190 3.867 14.359 351 HD2 LYS 491 2HD LYS 491 -2.376 1.388 14.461 352 HD3 LYS 491 1HD LYS 491 -0.696 1.335 15.006 353 HE2 LYS 491 2HE LYS 491 -1.283 2.708 16.920 354 HE3 LYS 491 1HE LYS 491 -2.948 2.775 16.323 355 HZ1 LYS 491 3HZ LYS 491 -3.120 0.394 16.581 356 HZ2 LYS 491 1HZ LYS 491 -2.692 1.090 18.055 357 HZ3 LYS 491 2HZ LYS 491 -1.534 0.285 17.132 358 H ASN 492 H ASN 492 -3.129 4.247 10.775 359 HA ASN 492 HA ASN 492 -5.797 4.219 11.695 360 HB2 ASN 492 2HB ASN 492 -5.776 6.188 13.172 361 HB3 ASN 492 1HB ASN 492 -4.810 4.889 13.851 362 HD21 ASN 492 1HD2 ASN 492 -4.736 7.733 14.418 363 HD22 ASN 492 2HD2 ASN 492 -3.125 8.255 14.070 364 H ILE 493 H ILE 493 -6.963 6.114 11.023 365 HA ILE 493 HA ILE 493 -5.612 7.629 8.902 366 HB ILE 493 HB ILE 493 -8.564 6.866 9.137 367 HG12 ILE 493 2HG1 ILE 493 -7.178 4.951 8.483 368 HG13 ILE 493 1HG1 ILE 493 -8.230 5.463 7.170 369 HG21 ILE 493 1HG2 ILE 493 -7.134 8.371 6.949 370 HG22 ILE 493 2HG2 ILE 493 -8.416 9.024 7.996 371 HG23 ILE 493 3HG2 ILE 493 -8.761 7.757 6.829 372 HD11 ILE 493 3HD1 ILE 493 -6.037 4.883 6.337 373 HD12 ILE 493 1HD1 ILE 493 -5.283 6.052 7.426 374 HD13 ILE 493 2HD1 ILE 493 -6.335 6.604 6.117 375 H LEU 494 H LEU 494 -5.354 9.691 9.488 376 HA LEU 494 HA LEU 494 -6.579 10.630 11.882 377 HB2 LEU 494 2HB LEU 494 -4.677 11.961 9.941 378 HB3 LEU 494 1HB LEU 494 -5.347 12.807 11.312 379 HG LEU 494 HG LEU 494 -3.105 12.132 11.820 380 HD11 LEU 494 1HD1 LEU 494 -3.420 10.844 13.855 381 HD12 LEU 494 2HD1 LEU 494 -5.046 10.415 13.331 382 HD13 LEU 494 3HD1 LEU 494 -4.640 12.101 13.662 383 HD21 LEU 494 3HD2 LEU 494 -2.402 9.778 11.919 384 HD22 LEU 494 1HD2 LEU 494 -2.842 10.264 10.282 385 HD23 LEU 494 2HD2 LEU 494 -3.958 9.295 11.244 386 HA PRO 495 HA PRO 495 -10.176 12.545 10.233 387 HB2 PRO 495 2HB PRO 495 -9.675 14.846 12.042 388 HB3 PRO 495 1HB PRO 495 -11.077 13.778 11.942 389 HG2 PRO 495 2HG PRO 495 -9.373 13.541 13.967 390 HG3 PRO 495 1HG PRO 495 -10.071 12.106 13.196 391 HD2 PRO 495 2HD PRO 495 -7.352 13.310 12.839 392 HD3 PRO 495 1HD PRO 495 -7.823 11.606 13.027 393 H ARG 496 H ARG 496 -7.161 14.198 10.159 394 HA ARG 496 HA ARG 496 -8.145 15.855 7.946 395 HB2 ARG 496 2HB ARG 496 -5.902 16.727 9.792 396 HB3 ARG 496 1HB ARG 496 -6.652 17.665 8.524 397 HG2 ARG 496 2HG ARG 496 -7.438 18.623 10.489 398 HG3 ARG 496 1HG ARG 496 -8.767 17.566 10.007 399 HD2 ARG 496 2HD ARG 496 -8.309 17.382 12.412 400 HD3 ARG 496 1HD ARG 496 -7.967 15.864 11.579 401 HE ARG 496 HE ARG 496 -5.581 17.147 11.575 402 HH11 ARG 496 1HH1 ARG 496 -7.804 16.265 14.192 403 HH12 ARG 496 2HH1 ARG 496 -6.582 16.064 15.347 404 HH21 ARG 496 1HH2 ARG 496 -3.875 16.844 13.189 405 HH22 ARG 496 2HH2 ARG 496 -4.321 16.415 14.773 406 H GLY 497 H GLY 497 -6.723 15.873 6.174 407 HA2 GLY 497 2HA GLY 497 -4.230 15.563 5.739 408 HA3 GLY 497 1HA GLY 497 -4.502 13.985 6.462 409 H ALA 498 H ALA 498 -3.474 13.847 4.078 410 HA ALA 498 HA ALA 498 -5.201 14.142 1.866 411 HB1 ALA 498 1HB ALA 498 -2.701 12.494 2.153 412 HB2 ALA 498 2HB ALA 498 -2.777 14.192 1.679 413 HB3 ALA 498 3HB ALA 498 -3.481 12.956 0.641 414 H ALA 499 H ALA 499 -4.117 11.322 3.700 415 HA ALA 499 HA ALA 499 -5.287 9.317 2.191 416 HB1 ALA 499 1HB ALA 499 -3.682 8.826 3.930 417 HB2 ALA 499 2HB ALA 499 -5.163 7.927 4.211 418 HB3 ALA 499 3HB ALA 499 -4.809 9.362 5.177 419 H ILE 500 H ILE 500 -6.727 11.174 4.823 420 HA ILE 500 HA ILE 500 -9.107 9.620 4.686 421 HB ILE 500 HB ILE 500 -8.357 10.662 6.829 422 HG12 ILE 500 2HG1 ILE 500 -11.111 11.416 5.843 423 HG13 ILE 500 1HG1 ILE 500 -10.633 9.897 6.550 424 HG21 ILE 500 1HG2 ILE 500 -7.581 12.802 6.004 425 HG22 ILE 500 2HG2 ILE 500 -8.815 13.043 7.242 426 HG23 ILE 500 3HG2 ILE 500 -9.220 13.241 5.539 427 HD11 ILE 500 3HD1 ILE 500 -10.657 12.532 7.990 428 HD12 ILE 500 1HD1 ILE 500 -10.216 10.968 8.681 429 HD13 ILE 500 2HD1 ILE 500 -11.870 11.259 8.139 430 H GLN 501 H GLN 501 -8.047 12.655 3.236 431 HA GLN 501 HA GLN 501 -10.692 13.357 2.378 432 HB2 GLN 501 2HB GLN 501 -8.018 14.427 1.472 433 HB3 GLN 501 1HB GLN 501 -9.568 15.068 0.948 434 HG2 GLN 501 2HG GLN 501 -8.489 15.046 3.758 435 HG3 GLN 501 1HG GLN 501 -8.655 16.448 2.699 436 HE21 GLN 501 1HE2 GLN 501 -10.304 14.186 4.706 437 HE22 GLN 501 2HE2 GLN 501 -11.813 15.017 4.776 438 H ASP 502 H ASP 502 -8.006 11.652 1.000 439 HA ASP 502 HA ASP 502 -9.101 11.243 -1.570 440 HB2 ASP 502 2HB ASP 502 -6.780 10.788 -1.233 441 HB3 ASP 502 1HB ASP 502 -7.122 9.723 0.122 442 H GLY 503 H GLY 503 -9.105 9.309 1.392 443 HA2 GLY 503 2HA GLY 503 -10.755 8.050 2.317 444 HA3 GLY 503 1HA GLY 503 -11.839 8.619 1.069 445 H ARG 504 H ARG 504 -9.040 7.156 -0.289 446 HA ARG 504 HA ARG 504 -10.602 4.743 -0.738 447 HB2 ARG 504 2HB ARG 504 -7.899 5.550 -1.842 448 HB3 ARG 504 1HB ARG 504 -8.795 4.113 -2.288 449 HG2 ARG 504 2HG ARG 504 -9.637 6.967 -2.828 450 HG3 ARG 504 1HG ARG 504 -8.925 5.866 -4.002 451 HD2 ARG 504 2HD ARG 504 -11.278 5.906 -4.395 452 HD3 ARG 504 1HD ARG 504 -10.895 4.363 -3.639 453 HE ARG 504 HE ARG 504 -11.609 6.224 -1.664 454 HH11 ARG 504 1HH1 ARG 504 -13.138 4.322 -4.224 455 HH12 ARG 504 2HH1 ARG 504 -14.675 4.312 -3.478 456 HH21 ARG 504 1HH2 ARG 504 -13.737 6.211 -0.671 457 HH22 ARG 504 2HH2 ARG 504 -15.022 5.383 -1.450 458 H LEU 505 H LEU 505 -7.718 5.902 0.765 459 HA LEU 505 HA LEU 505 -6.806 3.355 1.682 460 HB2 LEU 505 2HB LEU 505 -5.285 5.229 1.227 461 HB3 LEU 505 1HB LEU 505 -6.041 6.162 2.496 462 HG LEU 505 HG LEU 505 -5.168 4.597 4.177 463 HD11 LEU 505 1HD1 LEU 505 -3.844 3.271 1.821 464 HD12 LEU 505 2HD1 LEU 505 -5.071 2.547 2.871 465 HD13 LEU 505 3HD1 LEU 505 -3.466 2.972 3.509 466 HD21 LEU 505 3HD2 LEU 505 -3.104 5.639 2.265 467 HD22 LEU 505 1HD2 LEU 505 -2.825 5.193 3.947 468 HD23 LEU 505 2HD2 LEU 505 -3.874 6.553 3.558 469 H LYS 506 H LYS 506 -6.908 2.518 3.791 470 HA LYS 506 HA LYS 506 -8.734 3.770 5.674 471 HB2 LYS 506 2HB LYS 506 -8.811 0.901 4.729 472 HB3 LYS 506 1HB LYS 506 -9.723 1.527 6.090 473 HG2 LYS 506 2HG LYS 506 -10.925 2.999 4.588 474 HG3 LYS 506 1HG LYS 506 -10.015 2.358 3.215 475 HD2 LYS 506 2HD LYS 506 -10.928 0.142 3.652 476 HD3 LYS 506 1HD LYS 506 -11.808 0.760 5.053 477 HE2 LYS 506 2HE LYS 506 -12.178 1.579 2.186 478 HE3 LYS 506 1HE LYS 506 -13.277 0.583 3.135 479 HZ1 LYS 506 3HZ LYS 506 -14.056 2.855 3.042 480 HZ2 LYS 506 1HZ LYS 506 -12.607 3.433 3.659 481 HZ3 LYS 506 2HZ LYS 506 -13.611 2.488 4.630 482 H ALA 507 H ALA 507 -8.584 2.530 7.769 483 HA ALA 507 HA ALA 507 -5.823 2.158 8.452 484 HB1 ALA 507 1HB ALA 507 -6.667 1.826 10.734 485 HB2 ALA 507 2HB ALA 507 -8.320 1.815 10.126 486 HB3 ALA 507 3HB ALA 507 -7.349 3.282 10.012 487 H GLY 508 H GLY 508 -4.814 0.237 8.839 488 HA2 GLY 508 2HA GLY 508 -4.723 -2.038 9.324 489 HA3 GLY 508 1HA GLY 508 -6.404 -2.211 8.878 490 H ASP 509 H ASP 509 -5.343 -0.459 6.376 491 HA ASP 509 HA ASP 509 -5.061 -2.727 4.696 492 HB2 ASP 509 2HB ASP 509 -4.512 0.200 4.118 493 HB3 ASP 509 1HB ASP 509 -4.321 -1.064 2.915 494 H ARG 510 H ARG 510 -3.269 -3.529 3.643 495 HA ARG 510 HA ARG 510 -0.896 -3.100 5.243 496 HB2 ARG 510 2HB ARG 510 -1.433 -5.381 5.180 497 HB3 ARG 510 1HB ARG 510 -1.700 -5.389 3.451 498 HG2 ARG 510 2HG ARG 510 0.620 -5.285 3.004 499 HG3 ARG 510 1HG ARG 510 0.995 -4.847 4.669 500 HD2 ARG 510 2HD ARG 510 1.512 -7.218 4.046 501 HD3 ARG 510 1HD ARG 510 0.472 -7.024 5.448 502 HE ARG 510 HE ARG 510 -1.362 -7.410 3.632 503 HH11 ARG 510 1HH1 ARG 510 1.795 -9.035 3.760 504 HH12 ARG 510 2HH1 ARG 510 1.181 -10.541 3.268 505 HH21 ARG 510 1HH2 ARG 510 -2.191 -9.502 3.007 506 HH22 ARG 510 2HH2 ARG 510 -1.128 -10.823 2.841 507 H LEU 511 H LEU 511 0.797 -2.099 4.642 508 HA LEU 511 HA LEU 511 0.726 -0.852 2.048 509 HB2 LEU 511 2HB LEU 511 1.255 0.414 4.297 510 HB3 LEU 511 1HB LEU 511 2.739 -0.474 4.252 511 HG LEU 511 HG LEU 511 3.482 0.642 2.206 512 HD11 LEU 511 1HD1 LEU 511 2.199 2.314 1.140 513 HD12 LEU 511 2HD1 LEU 511 0.865 2.081 2.266 514 HD13 LEU 511 3HD1 LEU 511 1.311 0.799 1.134 515 HD21 LEU 511 3HD2 LEU 511 3.887 1.742 4.383 516 HD22 LEU 511 1HD2 LEU 511 2.360 2.604 4.207 517 HD23 LEU 511 2HD2 LEU 511 3.675 2.900 3.070 518 H ILE 512 H ILE 512 1.859 -1.602 0.405 519 HA ILE 512 HA ILE 512 3.668 -3.863 0.821 520 HB ILE 512 HB ILE 512 2.351 -2.785 -1.679 521 HG12 ILE 512 2HG1 ILE 512 0.749 -3.822 -0.143 522 HG13 ILE 512 1HG1 ILE 512 0.963 -4.788 -1.578 523 HG21 ILE 512 1HG2 ILE 512 4.001 -5.285 -1.321 524 HG22 ILE 512 2HG2 ILE 512 4.469 -3.837 -2.215 525 HG23 ILE 512 3HG2 ILE 512 3.119 -4.821 -2.778 526 HD11 ILE 512 3HD1 ILE 512 2.474 -6.296 -0.384 527 HD12 ILE 512 1HD1 ILE 512 0.897 -6.231 0.382 528 HD13 ILE 512 2HD1 ILE 512 2.261 -5.361 1.097 529 H GLU 513 H GLU 513 3.530 -1.018 -1.315 530 HA GLU 513 HA GLU 513 6.295 -0.559 -0.792 531 HB2 GLU 513 2HB GLU 513 6.949 -0.527 -3.162 532 HB3 GLU 513 1HB GLU 513 6.433 -2.113 -2.628 533 HG2 GLU 513 2HG GLU 513 4.315 -1.830 -3.707 534 HG3 GLU 513 1HG GLU 513 4.756 -0.191 -4.186 535 H VAL 514 H VAL 514 7.001 1.444 -1.693 536 HA VAL 514 HA VAL 514 4.820 3.324 -2.255 537 HB VAL 514 HB VAL 514 5.497 3.538 0.148 538 HG11 VAL 514 1HG1 VAL 514 7.681 4.506 0.733 539 HG12 VAL 514 2HG1 VAL 514 8.139 4.391 -0.970 540 HG13 VAL 514 3HG1 VAL 514 7.853 2.916 -0.048 541 HG21 VAL 514 3HG2 VAL 514 5.790 5.949 0.167 542 HG22 VAL 514 1HG2 VAL 514 4.625 5.474 -1.081 543 HG23 VAL 514 2HG2 VAL 514 6.267 5.908 -1.523 544 H ASN 515 H ASN 515 5.171 4.476 -4.006 545 HA ASN 515 HA ASN 515 6.152 5.474 -5.823 546 HB2 ASN 515 2HB ASN 515 8.394 5.846 -3.831 547 HB3 ASN 515 1HB ASN 515 8.416 6.552 -5.441 548 HD21 ASN 515 1HD2 ASN 515 7.098 8.272 -5.876 549 HD22 ASN 515 2HD2 ASN 515 6.269 9.152 -4.650 550 H GLY 516 H GLY 516 6.863 2.507 -5.146 551 HA2 GLY 516 2HA GLY 516 7.664 1.026 -6.828 552 HA3 GLY 516 1HA GLY 516 8.813 2.265 -7.332 553 H VAL 517 H VAL 517 8.870 2.354 -4.069 554 HA VAL 517 HA VAL 517 11.171 0.570 -3.932 555 HB VAL 517 HB VAL 517 10.123 2.609 -1.937 556 HG11 VAL 517 1HG1 VAL 517 12.704 1.037 -1.931 557 HG12 VAL 517 2HG1 VAL 517 11.346 0.828 -0.823 558 HG13 VAL 517 3HG1 VAL 517 12.285 2.322 -0.798 559 HG21 VAL 517 3HG2 VAL 517 10.966 3.685 -3.956 560 HG22 VAL 517 1HG2 VAL 517 12.471 2.779 -3.827 561 HG23 VAL 517 2HG2 VAL 517 12.058 3.978 -2.601 562 H ASP 518 H ASP 518 10.810 -1.396 -3.185 563 HA ASP 518 HA ASP 518 8.293 -2.110 -1.957 564 HB2 ASP 518 2HB ASP 518 9.406 -3.613 -3.583 565 HB3 ASP 518 1HB ASP 518 10.760 -3.786 -2.477 566 H LEU 519 H LEU 519 7.850 -2.259 0.083 567 HA LEU 519 HA LEU 519 10.086 -2.276 1.937 568 HB2 LEU 519 2HB LEU 519 8.360 -1.269 3.570 569 HB3 LEU 519 1HB LEU 519 9.234 -0.248 2.439 570 HG LEU 519 HG LEU 519 6.507 -1.197 1.618 571 HD11 LEU 519 1HD1 LEU 519 7.083 1.125 3.462 572 HD12 LEU 519 2HD1 LEU 519 6.253 -0.360 3.971 573 HD13 LEU 519 3HD1 LEU 519 5.537 0.702 2.741 574 HD21 LEU 519 3HD2 LEU 519 8.044 1.350 1.376 575 HD22 LEU 519 1HD2 LEU 519 6.517 0.976 0.590 576 HD23 LEU 519 2HD2 LEU 519 7.986 0.080 0.161 577 H ALA 520 H ALA 520 8.234 -4.403 0.709 578 HA ALA 520 HA ALA 520 6.998 -5.524 3.037 579 HB1 ALA 520 1HB ALA 520 6.096 -5.974 0.801 580 HB2 ALA 520 2HB ALA 520 6.554 -7.473 1.608 581 HB3 ALA 520 3HB ALA 520 7.595 -6.789 0.360 582 H GLY 521 H GLY 521 10.102 -5.527 1.637 583 HA2 GLY 521 2HA GLY 521 10.983 -7.660 3.461 584 HA3 GLY 521 1HA GLY 521 11.851 -7.152 2.019 585 H LYS 522 H LYS 522 10.538 -4.555 3.659 586 HA LYS 522 HA LYS 522 13.158 -3.799 4.676 587 HB2 LYS 522 2HB LYS 522 10.655 -2.199 4.198 588 HB3 LYS 522 1HB LYS 522 11.991 -1.576 5.145 589 HG2 LYS 522 2HG LYS 522 12.140 -2.432 2.264 590 HG3 LYS 522 1HG LYS 522 12.024 -0.773 2.841 591 HD2 LYS 522 2HD LYS 522 14.137 -1.116 4.089 592 HD3 LYS 522 1HD LYS 522 14.265 -2.718 3.382 593 HE2 LYS 522 2HE LYS 522 14.266 -1.723 1.129 594 HE3 LYS 522 1HE LYS 522 14.181 -0.122 1.849 595 HZ1 LYS 522 3HZ LYS 522 16.433 -0.662 1.244 596 HZ2 LYS 522 1HZ LYS 522 16.407 -2.066 2.139 597 HZ3 LYS 522 2HZ LYS 522 16.332 -0.569 2.921 598 H SER 523 H SER 523 13.336 -2.797 6.746 599 HA SER 523 HA SER 523 11.817 -4.283 8.659 600 HB2 SER 523 2HB SER 523 13.956 -2.179 8.980 601 HB3 SER 523 1HB SER 523 13.368 -3.294 10.234 602 HG SER 523 HG SER 523 14.240 -5.009 9.049 603 H GLN 524 H GLN 524 10.553 -3.132 10.279 604 HA GLN 524 HA GLN 524 8.853 -1.197 9.209 605 HB2 GLN 524 2HB GLN 524 8.001 -0.851 11.478 606 HB3 GLN 524 1HB GLN 524 8.149 -2.557 11.073 607 HG2 GLN 524 2HG GLN 524 10.037 -2.820 12.419 608 HG3 GLN 524 1HG GLN 524 10.274 -1.086 12.587 609 HE21 GLN 524 1HE2 GLN 524 9.955 -3.140 14.589 610 HE22 GLN 524 2HE2 GLN 524 8.599 -2.659 15.532 611 H GLU 525 H GLU 525 11.741 -0.841 11.099 612 HA GLU 525 HA GLU 525 11.307 1.819 11.887 613 HB2 GLU 525 2HB GLU 525 13.834 0.226 11.680 614 HB3 GLU 525 1HB GLU 525 13.751 1.825 12.433 615 HG2 GLU 525 2HG GLU 525 12.133 0.896 14.066 616 HG3 GLU 525 1HG GLU 525 12.335 -0.685 13.318 617 H GLU 526 H GLU 526 12.586 0.416 9.010 618 HA GLU 526 HA GLU 526 13.931 2.639 7.959 619 HB2 GLU 526 2HB GLU 526 12.466 0.385 6.615 620 HB3 GLU 526 1HB GLU 526 13.549 1.451 5.755 621 HG2 GLU 526 2HG GLU 526 14.261 -0.404 8.005 622 HG3 GLU 526 1HG GLU 526 14.593 -0.656 6.290 623 H VAL 527 H VAL 527 10.686 1.339 7.568 624 HA VAL 527 HA VAL 527 9.897 3.538 5.955 625 HB VAL 527 HB VAL 527 7.798 2.389 5.579 626 HG11 VAL 527 1HG1 VAL 527 8.778 0.427 4.496 627 HG12 VAL 527 2HG1 VAL 527 10.222 0.641 5.479 628 HG13 VAL 527 3HG1 VAL 527 9.796 1.859 4.271 629 HG21 VAL 527 3HG2 VAL 527 8.870 0.314 7.497 630 HG22 VAL 527 1HG2 VAL 527 7.459 0.165 6.449 631 HG23 VAL 527 2HG2 VAL 527 7.455 1.346 7.770 632 H VAL 528 H VAL 528 9.235 2.591 9.275 633 HA VAL 528 HA VAL 528 7.170 4.459 9.745 634 HB VAL 528 HB VAL 528 9.248 3.398 11.722 635 HG11 VAL 528 1HG1 VAL 528 8.249 5.490 12.542 636 HG12 VAL 528 2HG1 VAL 528 7.700 4.109 13.491 637 HG13 VAL 528 3HG1 VAL 528 6.638 4.823 12.279 638 HG21 VAL 528 3HG2 VAL 528 6.382 2.535 11.229 639 HG22 VAL 528 1HG2 VAL 528 7.443 1.887 12.477 640 HG23 VAL 528 2HG2 VAL 528 7.828 1.632 10.781 641 H SER 529 H SER 529 10.644 4.811 9.695 642 HA SER 529 HA SER 529 10.755 7.448 10.620 643 HB2 SER 529 2HB SER 529 12.567 6.056 8.633 644 HB3 SER 529 1HB SER 529 12.936 7.556 9.482 645 HG SER 529 HG SER 529 12.917 4.926 10.404 646 H LEU 530 H LEU 530 10.316 6.114 7.411 647 HA LEU 530 HA LEU 530 10.376 8.537 5.967 648 HB2 LEU 530 2HB LEU 530 9.143 5.904 5.506 649 HB3 LEU 530 1HB LEU 530 9.142 7.110 4.233 650 HG LEU 530 HG LEU 530 11.505 5.666 5.473 651 HD11 LEU 530 1HD1 LEU 530 10.410 5.647 2.668 652 HD12 LEU 530 2HD1 LEU 530 10.262 4.353 3.856 653 HD13 LEU 530 3HD1 LEU 530 11.847 4.790 3.223 654 HD21 LEU 530 3HD2 LEU 530 12.927 6.888 3.885 655 HD22 LEU 530 1HD2 LEU 530 12.164 7.969 5.043 656 HD23 LEU 530 2HD2 LEU 530 11.539 7.861 3.392 657 H LEU 531 H LEU 531 7.556 6.549 7.070 658 HA LEU 531 HA LEU 531 5.693 8.366 6.133 659 HB2 LEU 531 2HB LEU 531 5.525 6.011 8.014 660 HB3 LEU 531 1HB LEU 531 4.153 7.082 7.771 661 HG LEU 531 HG LEU 531 4.066 5.059 6.491 662 HD11 LEU 531 1HD1 LEU 531 2.912 7.028 5.635 663 HD12 LEU 531 2HD1 LEU 531 3.509 6.057 4.295 664 HD13 LEU 531 3HD1 LEU 531 4.360 7.526 4.760 665 HD21 LEU 531 3HD2 LEU 531 6.493 6.073 5.014 666 HD22 LEU 531 1HD2 LEU 531 5.507 4.701 4.504 667 HD23 LEU 531 2HD2 LEU 531 6.403 4.631 6.023 668 H ARG 532 H ARG 532 7.161 8.123 9.337 669 HA ARG 532 HA ARG 532 5.490 10.216 10.330 670 HB2 ARG 532 2HB ARG 532 7.940 8.907 11.483 671 HB3 ARG 532 1HB ARG 532 7.149 10.265 12.265 672 HG2 ARG 532 2HG ARG 532 5.823 7.630 11.628 673 HG3 ARG 532 1HG ARG 532 6.470 8.090 13.206 674 HD2 ARG 532 2HD ARG 532 4.911 10.033 13.228 675 HD3 ARG 532 1HD ARG 532 4.232 9.469 11.708 676 HE ARG 532 HE ARG 532 3.919 7.328 13.243 677 HH11 ARG 532 1HH1 ARG 532 3.111 10.743 13.839 678 HH12 ARG 532 2HH1 ARG 532 1.811 10.417 14.880 679 HH21 ARG 532 1HH2 ARG 532 2.089 6.887 14.693 680 HH22 ARG 532 2HH2 ARG 532 1.216 8.182 15.370 681 H SER 533 H SER 533 8.627 10.211 8.786 682 HA SER 533 HA SER 533 9.284 12.881 9.562 683 HB2 SER 533 2HB SER 533 11.036 11.260 8.930 684 HB3 SER 533 1HB SER 533 10.372 11.186 7.300 685 HG SER 533 HG SER 533 12.197 12.549 7.608 686 H THR 534 H THR 534 7.732 11.296 6.888 687 HA THR 534 HA THR 534 6.218 11.996 5.427 688 HB THR 534 HB THR 534 6.436 14.739 6.694 689 HG1 THR 534 1HG THR 534 5.890 12.834 8.020 690 HG21 THR 534 3HG2 THR 534 4.295 13.361 5.148 691 HG22 THR 534 1HG2 THR 534 5.340 14.643 4.512 692 HG23 THR 534 2HG2 THR 534 4.167 14.998 5.809 693 H LYS 535 H LYS 535 7.452 11.680 3.599 694 HA LYS 535 HA LYS 535 9.340 13.644 2.665 695 HB2 LYS 535 2HB LYS 535 9.381 11.102 2.228 696 HB3 LYS 535 1HB LYS 535 8.065 11.374 1.100 697 HG2 LYS 535 2HG LYS 535 9.506 12.778 -0.271 698 HG3 LYS 535 1HG LYS 535 10.816 12.581 0.898 699 HD2 LYS 535 2HD LYS 535 10.683 10.104 0.496 700 HD3 LYS 535 1HD LYS 535 9.555 10.443 -0.816 701 HE2 LYS 535 2HE LYS 535 12.401 11.448 -0.631 702 HE3 LYS 535 1HE LYS 535 11.850 10.118 -1.635 703 HZ1 LYS 535 3HZ LYS 535 10.960 12.952 -1.908 704 HZ2 LYS 535 1HZ LYS 535 10.491 11.676 -2.886 705 HZ3 LYS 535 2HZ LYS 535 12.089 12.179 -2.878 706 H MET 536 H MET 536 8.852 15.329 1.171 707 HA MET 536 HA MET 536 6.078 15.401 0.345 708 HB2 MET 536 2HB MET 536 5.830 17.730 1.162 709 HB3 MET 536 1HB MET 536 5.770 16.442 2.380 710 HG2 MET 536 2HG MET 536 8.151 16.970 2.912 711 HG3 MET 536 1HG MET 536 8.082 18.299 1.764 712 HE1 MET 536 3HE MET 536 5.147 19.475 2.268 713 HE2 MET 536 1HE MET 536 6.599 20.463 2.101 714 HE3 MET 536 2HE MET 536 5.519 20.713 3.467 715 H GLU 537 H GLU 537 7.317 15.108 -1.752 716 HA GLU 537 HA GLU 537 8.093 17.588 -2.936 717 HB2 GLU 537 2HB GLU 537 7.260 14.994 -4.281 718 HB3 GLU 537 1HB GLU 537 7.948 16.372 -5.108 719 HG2 GLU 537 2HG GLU 537 9.595 14.637 -4.821 720 HG3 GLU 537 1HG GLU 537 10.040 16.056 -3.883 721 H GLY 538 H GLY 538 5.323 15.474 -3.078 722 HA2 GLY 538 2HA GLY 538 3.356 17.488 -3.044 723 HA3 GLY 538 1HA GLY 538 3.563 16.957 -4.706 724 H THR 539 H THR 539 3.758 14.443 -4.867 725 HA THR 539 HA THR 539 1.599 13.354 -3.223 726 HB THR 539 HB THR 539 1.327 11.719 -5.132 727 HG1 THR 539 1HG THR 539 2.402 13.631 -6.838 728 HG21 THR 539 3HG2 THR 539 -0.083 13.171 -6.449 729 HG22 THR 539 1HG2 THR 539 0.659 14.613 -5.726 730 HG23 THR 539 2HG2 THR 539 -0.302 13.497 -4.738 731 H VAL 540 H VAL 540 1.786 11.325 -2.451 732 HA VAL 540 HA VAL 540 4.299 9.885 -2.912 733 HB VAL 540 HB VAL 540 2.615 9.997 -0.358 734 HG11 VAL 540 1HG1 VAL 540 3.428 7.724 -0.770 735 HG12 VAL 540 2HG1 VAL 540 4.250 8.453 0.612 736 HG13 VAL 540 3HG1 VAL 540 5.067 8.342 -0.950 737 HG21 VAL 540 3HG2 VAL 540 4.636 10.876 0.688 738 HG22 VAL 540 1HG2 VAL 540 4.141 11.893 -0.666 739 HG23 VAL 540 2HG2 VAL 540 5.482 10.772 -0.856 740 H SER 541 H SER 541 3.996 7.777 -3.604 741 HA SER 541 HA SER 541 1.189 7.054 -4.028 742 HB2 SER 541 2HB SER 541 2.554 7.422 -6.090 743 HB3 SER 541 1HB SER 541 3.631 6.131 -5.575 744 HG SER 541 HG SER 541 2.120 5.381 -7.039 745 H LEU 542 H LEU 542 0.482 5.585 -2.718 746 HA LEU 542 HA LEU 542 2.339 3.679 -1.470 747 HB2 LEU 542 2HB LEU 542 -0.462 4.507 -0.673 748 HB3 LEU 542 1HB LEU 542 0.475 3.288 0.145 749 HG LEU 542 HG LEU 542 0.474 5.217 1.475 750 HD11 LEU 542 1HD1 LEU 542 2.840 5.854 1.636 751 HD12 LEU 542 2HD1 LEU 542 3.135 4.985 0.138 752 HD13 LEU 542 3HD1 LEU 542 2.571 4.118 1.567 753 HD21 LEU 542 3HD2 LEU 542 -0.163 6.913 -0.126 754 HD22 LEU 542 1HD2 LEU 542 1.408 6.804 -0.914 755 HD23 LEU 542 2HD2 LEU 542 1.291 7.432 0.731 756 H LEU 543 H LEU 543 2.211 1.600 -2.087 757 HA LEU 543 HA LEU 543 -0.163 0.731 -3.577 758 HB2 LEU 543 2HB LEU 543 2.276 0.291 -4.432 759 HB3 LEU 543 1HB LEU 543 2.377 -0.789 -3.086 760 HG LEU 543 HG LEU 543 0.448 -2.099 -3.927 761 HD11 LEU 543 1HD1 LEU 543 0.737 -0.392 -6.377 762 HD12 LEU 543 2HD1 LEU 543 -0.644 -0.468 -5.286 763 HD13 LEU 543 3HD1 LEU 543 -0.223 -1.869 -6.264 764 HD21 LEU 543 3HD2 LEU 543 1.678 -3.224 -5.757 765 HD22 LEU 543 1HD2 LEU 543 2.682 -2.916 -4.337 766 HD23 LEU 543 2HD2 LEU 543 2.828 -1.889 -5.759 767 H VAL 544 H VAL 544 -1.625 -0.366 -2.400 768 HA VAL 544 HA VAL 544 -0.636 -1.677 0.042 769 HB VAL 544 HB VAL 544 -2.740 -1.363 1.131 770 HG11 VAL 544 1HG1 VAL 544 -1.875 1.234 -0.105 771 HG12 VAL 544 2HG1 VAL 544 -1.238 0.489 1.363 772 HG13 VAL 544 3HG1 VAL 544 -2.901 1.072 1.316 773 HG21 VAL 544 3HG2 VAL 544 -4.172 -1.689 -0.699 774 HG22 VAL 544 1HG2 VAL 544 -3.719 -0.146 -1.437 775 HG23 VAL 544 2HG2 VAL 544 -4.626 -0.172 0.103 776 H PHE 545 H PHE 545 -1.889 -3.526 0.731 777 HA PHE 545 HA PHE 545 -2.838 -5.140 -1.562 778 HB2 PHE 545 2HB PHE 545 -0.651 -5.758 -0.671 779 HB3 PHE 545 1HB PHE 545 -1.360 -6.016 0.917 780 HD1 PHE 545 1HD PHE 545 -0.892 -7.280 -2.448 781 HD2 PHE 545 2HD PHE 545 -2.729 -8.017 1.304 782 HE1 PHE 545 1HE PHE 545 -1.228 -9.613 -3.086 783 HE2 PHE 545 2HE PHE 545 -3.058 -10.365 0.689 784 HZ PHE 545 HZ PHE 545 -2.309 -11.178 -1.511 785 H ARG 546 H ARG 546 -4.857 -5.718 -1.376 786 HA ARG 546 HA ARG 546 -5.989 -6.067 1.303 787 HB2 ARG 546 2HB ARG 546 -7.333 -5.028 -1.191 788 HB3 ARG 546 1HB ARG 546 -8.209 -5.517 0.254 789 HG2 ARG 546 2HG ARG 546 -7.047 -3.811 1.537 790 HG3 ARG 546 1HG ARG 546 -6.156 -3.333 0.093 791 HD2 ARG 546 2HD ARG 546 -8.168 -2.617 -0.980 792 HD3 ARG 546 1HD ARG 546 -9.160 -3.259 0.337 793 HE ARG 546 HE ARG 546 -7.570 -1.609 1.645 794 HH11 ARG 546 1HH1 ARG 546 -9.451 -1.015 -1.321 795 HH12 ARG 546 2HH1 ARG 546 -9.648 0.635 -1.000 796 HH21 ARG 546 1HH2 ARG 546 -7.856 0.593 2.077 797 HH22 ARG 546 2HH2 ARG 546 -8.721 1.600 0.996 798 H GLN 547 H GLN 547 -6.357 -8.140 1.672 799 HA GLN 547 HA GLN 547 -7.021 -9.741 -0.658 800 HB2 GLN 547 2HB GLN 547 -6.291 -11.753 0.566 801 HB3 GLN 547 1HB GLN 547 -5.003 -10.601 0.300 802 HG2 GLN 547 2HG GLN 547 -5.159 -9.882 2.621 803 HG3 GLN 547 1HG GLN 547 -6.501 -10.995 2.881 804 HE21 GLN 547 1HE2 GLN 547 -6.090 -13.215 2.963 805 HE22 GLN 547 2HE2 GLN 547 -4.508 -13.844 3.180 806 H GLU 548 H GLU 548 -8.841 -10.675 -0.852 807 HA GLU 548 HA GLU 548 -10.880 -10.159 1.082 808 HB2 GLU 548 2HB GLU 548 -10.995 -11.823 -1.436 809 HB3 GLU 548 1HB GLU 548 -12.376 -11.373 -0.455 810 HG2 GLU 548 2HG GLU 548 -11.909 -9.013 -0.938 811 HG3 GLU 548 1HG GLU 548 -10.587 -9.519 -1.995 812 H GLU 549 H GLU 549 -10.281 -11.208 2.885 813 HA GLU 549 HA GLU 549 -11.004 -13.974 2.999 814 HB2 GLU 549 2HB GLU 549 -8.638 -14.175 2.410 815 HB3 GLU 549 1HB GLU 549 -8.202 -13.107 3.737 816 HG2 GLU 549 2HG GLU 549 -9.024 -14.746 5.341 817 HG3 GLU 549 1HG GLU 549 -9.499 -15.812 4.023 818 H ALA 550 H ALA 550 -12.115 -14.219 4.762 819 HA ALA 550 HA ALA 550 -11.406 -12.695 7.143 820 HB1 ALA 550 1HB ALA 550 -14.180 -13.370 6.160 821 HB2 ALA 550 2HB ALA 550 -13.470 -11.753 6.205 822 HB3 ALA 550 3HB ALA 550 -13.802 -12.616 7.711 823 H PHE 551 H PHE 551 -10.324 -14.336 8.087 824 HA PHE 551 HA PHE 551 -11.466 -17.000 7.933 825 HB2 PHE 551 2HB PHE 551 -9.175 -16.757 7.264 826 HB3 PHE 551 1HB PHE 551 -8.745 -16.066 8.824 827 HD1 PHE 551 2HD PHE 551 -9.936 -19.157 7.171 828 HD2 PHE 551 1HD PHE 551 -8.228 -17.456 10.677 829 HE1 PHE 551 2HE PHE 551 -9.503 -21.406 8.050 830 HE2 PHE 551 1HE PHE 551 -7.792 -19.706 11.559 831 HZ PHE 551 HZ PHE 551 -8.433 -21.686 10.248 832 H HIS 552 H HIS 552 -12.825 -17.488 9.415 833 HA HIS 552 HA HIS 552 -11.967 -17.360 12.146 834 HB2 HIS 552 2HB HIS 552 -13.152 -15.214 11.907 835 HB3 HIS 552 1HB HIS 552 -14.564 -16.066 11.286 836 HD1 HIS 552 1HD HIS 552 -16.215 -16.910 12.985 837 HD2 HIS 552 2HD HIS 552 -12.589 -15.806 14.672 838 HE1 HIS 552 1HE HIS 552 -16.525 -17.093 15.456 839 HE2 HIS 552 2HE HIS 552 -14.232 -16.750 16.390 840 HA PRO 553 HA PRO 553 -14.262 -21.169 11.437 841 HB2 PRO 553 2HB PRO 553 -12.748 -22.747 12.986 842 HB3 PRO 553 1HB PRO 553 -12.201 -22.241 11.386 843 HG2 PRO 553 2HG PRO 553 -11.357 -21.260 14.069 844 HG3 PRO 553 1HG PRO 553 -10.410 -21.429 12.585 845 HD2 PRO 553 2HD PRO 553 -11.548 -19.054 13.565 846 HD3 PRO 553 1HD PRO 553 -10.905 -19.310 11.931 847 H ARG 554 H ARG 554 -15.578 -22.472 12.853 848 HA ARG 554 HA ARG 554 -16.212 -21.122 15.380 849 HB2 ARG 554 2HB ARG 554 -17.820 -23.283 13.955 850 HB3 ARG 554 1HB ARG 554 -18.301 -22.404 15.382 851 HG2 ARG 554 2HG ARG 554 -19.552 -21.560 13.552 852 HG3 ARG 554 1HG ARG 554 -18.361 -20.330 13.974 853 HD2 ARG 554 2HD ARG 554 -16.963 -21.032 12.105 854 HD3 ARG 554 1HD ARG 554 -18.089 -22.334 11.732 855 HE ARG 554 HE ARG 554 -19.392 -19.852 11.752 856 HH11 ARG 554 1HH1 ARG 554 -17.199 -21.790 9.755 857 HH12 ARG 554 2HH1 ARG 554 -17.692 -21.103 8.292 858 HH21 ARG 554 1HH2 ARG 554 -20.079 -18.904 9.728 859 HH22 ARG 554 2HH2 ARG 554 -19.351 -19.417 8.277 860 H GLU 555 H GLU 555 -16.341 -24.397 14.136 861 HA GLU 555 HA GLU 555 -15.713 -26.392 14.815 862 HB2 GLU 555 2HB GLU 555 -13.718 -24.998 16.622 863 HB3 GLU 555 1HB GLU 555 -13.683 -26.687 16.130 864 HG2 GLU 555 2HG GLU 555 -13.323 -24.300 14.335 865 HG3 GLU 555 1HG GLU 555 -12.063 -25.410 14.861 866 H MET 556 H MET 556 -17.405 -27.243 15.755 867 HA MET 556 HA MET 556 -18.184 -26.346 18.376 868 HB2 MET 556 2HB MET 556 -19.939 -26.600 16.722 869 HB3 MET 556 1HB MET 556 -19.528 -28.289 16.502 870 HG2 MET 556 2HG MET 556 -20.284 -28.783 18.756 871 HG3 MET 556 1HG MET 556 -20.630 -27.077 19.035 872 HE1 MET 556 3HE MET 556 -22.763 -29.498 19.435 873 HE2 MET 556 1HE MET 556 -24.208 -28.733 18.782 874 HE3 MET 556 2HE MET 556 -23.108 -27.808 19.807 875 H ASN 557 H ASN 557 -16.265 -27.104 19.318 876 HA ASN 557 HA ASN 557 -16.618 -29.108 21.129 877 HB2 ASN 557 2HB ASN 557 -16.304 -30.717 19.171 878 HB3 ASN 557 1HB ASN 557 -14.703 -30.029 18.929 879 HD21 ASN 557 1HD2 ASN 557 -13.717 -32.018 19.292 880 HD22 ASN 557 2HD2 ASN 557 -13.606 -32.704 20.879 881 H ALA 558 H ALA 558 -14.462 -29.464 22.310 882 HA ALA 558 HA ALA 558 -13.212 -26.897 22.560 883 HB1 ALA 558 1HB ALA 558 -13.745 -28.279 24.514 884 HB2 ALA 558 2HB ALA 558 -12.015 -27.932 24.429 885 HB3 ALA 558 3HB ALA 558 -12.627 -29.511 23.945 Start of MODEL 17 1 H1 GLY 448 1HT GLY 448 -6.343 -27.382 -19.246 2 H2 GLY 448 2HT GLY 448 -6.105 -28.729 -18.243 3 H3 GLY 448 3HT GLY 448 -4.901 -27.546 -18.409 4 HA2 GLY 448 1HA GLY 448 -7.556 -27.044 -17.250 5 HA3 GLY 448 2HA GLY 448 -6.078 -27.269 -16.321 6 H SER 449 H SER 449 -7.082 -24.993 -15.738 7 HA SER 449 HA SER 449 -5.532 -23.085 -17.259 8 HB2 SER 449 2HB SER 449 -7.496 -21.505 -17.201 9 HB3 SER 449 1HB SER 449 -7.714 -22.904 -18.255 10 HG SER 449 HG SER 449 -8.755 -23.865 -16.304 11 H VAL 450 H VAL 450 -4.960 -21.222 -16.010 12 HA VAL 450 HA VAL 450 -4.910 -21.681 -13.174 13 HB VAL 450 HB VAL 450 -3.957 -19.277 -14.777 14 HG11 VAL 450 1HG1 VAL 450 -4.357 -18.707 -12.449 15 HG12 VAL 450 2HG1 VAL 450 -2.624 -18.732 -12.779 16 HG13 VAL 450 3HG1 VAL 450 -3.378 -20.077 -11.925 17 HG21 VAL 450 3HG2 VAL 450 -2.757 -21.290 -15.417 18 HG22 VAL 450 1HG2 VAL 450 -2.414 -21.650 -13.726 19 HG23 VAL 450 2HG2 VAL 450 -1.700 -20.230 -14.486 20 H TYR 451 H TYR 451 -6.660 -21.228 -12.035 21 HA TYR 451 HA TYR 451 -8.311 -18.963 -12.893 22 HB2 TYR 451 2HB TYR 451 -9.348 -21.064 -13.543 23 HB3 TYR 451 1HB TYR 451 -9.225 -21.660 -11.899 24 HD1 TYR 451 2HD TYR 451 -10.878 -19.128 -14.039 25 HD2 TYR 451 1HD TYR 451 -10.919 -21.184 -10.318 26 HE1 TYR 451 2HE TYR 451 -13.120 -18.242 -13.578 27 HE2 TYR 451 1HE TYR 451 -13.156 -20.301 -9.847 28 HH TYR 451 HH TYR 451 -14.519 -18.429 -10.494 29 H ASN 452 H ASN 452 -8.092 -17.445 -11.414 30 HA ASN 452 HA ASN 452 -8.779 -18.095 -8.681 31 HB2 ASN 452 2HB ASN 452 -6.245 -18.099 -8.772 32 HB3 ASN 452 1HB ASN 452 -6.313 -16.436 -9.335 33 HD21 ASN 452 1HD2 ASN 452 -5.042 -17.489 -6.974 34 HD22 ASN 452 2HD2 ASN 452 -5.749 -16.683 -5.620 35 H THR 453 H THR 453 -10.681 -17.058 -9.106 36 HA THR 453 HA THR 453 -10.536 -14.277 -9.981 37 HB THR 453 HB THR 453 -12.972 -16.098 -9.772 38 HG1 THR 453 1HG THR 453 -10.912 -15.895 -11.597 39 HG21 THR 453 3HG2 THR 453 -13.980 -14.504 -11.358 40 HG22 THR 453 1HG2 THR 453 -12.498 -13.547 -11.355 41 HG23 THR 453 2HG2 THR 453 -13.477 -13.666 -9.891 42 H LYS 454 H LYS 454 -10.132 -15.646 -7.181 43 HA LYS 454 HA LYS 454 -12.130 -14.089 -5.741 44 HB2 LYS 454 2HB LYS 454 -10.264 -16.226 -4.712 45 HB3 LYS 454 1HB LYS 454 -11.381 -15.313 -3.713 46 HG2 LYS 454 2HG LYS 454 -13.256 -16.212 -5.007 47 HG3 LYS 454 1HG LYS 454 -12.123 -17.163 -5.967 48 HD2 LYS 454 2HD LYS 454 -11.386 -18.312 -3.927 49 HD3 LYS 454 1HD LYS 454 -12.543 -17.372 -2.988 50 HE2 LYS 454 2HE LYS 454 -14.372 -18.325 -4.310 51 HE3 LYS 454 1HE LYS 454 -13.211 -19.291 -5.218 52 HZ1 LYS 454 3HZ LYS 454 -13.703 -19.458 -2.299 53 HZ2 LYS 454 1HZ LYS 454 -12.604 -20.411 -3.148 54 HZ3 LYS 454 2HZ LYS 454 -14.260 -20.562 -3.439 55 H LYS 455 H LYS 455 -8.720 -14.878 -5.096 56 HA LYS 455 HA LYS 455 -7.071 -13.731 -4.153 57 HB2 LYS 455 2HB LYS 455 -8.187 -11.472 -5.834 58 HB3 LYS 455 1HB LYS 455 -6.635 -11.402 -5.010 59 HG2 LYS 455 2HG LYS 455 -5.860 -13.330 -6.326 60 HG3 LYS 455 1HG LYS 455 -7.407 -13.372 -7.160 61 HD2 LYS 455 2HD LYS 455 -5.477 -11.041 -7.200 62 HD3 LYS 455 1HD LYS 455 -5.614 -12.253 -8.467 63 HE2 LYS 455 2HE LYS 455 -7.962 -11.578 -8.825 64 HE3 LYS 455 1HE LYS 455 -7.776 -10.335 -7.585 65 HZ1 LYS 455 3HZ LYS 455 -6.191 -10.497 -10.082 66 HZ2 LYS 455 1HZ LYS 455 -6.088 -9.269 -8.944 67 HZ3 LYS 455 2HZ LYS 455 -7.489 -9.468 -9.870 68 H VAL 456 H VAL 456 -7.348 -13.725 -2.068 69 HA VAL 456 HA VAL 456 -9.389 -12.344 -0.700 70 HB VAL 456 HB VAL 456 -8.246 -14.398 0.145 71 HG11 VAL 456 1HG1 VAL 456 -5.962 -13.883 -0.346 72 HG12 VAL 456 2HG1 VAL 456 -6.145 -14.236 1.373 73 HG13 VAL 456 3HG1 VAL 456 -5.971 -12.566 0.828 74 HG21 VAL 456 3HG2 VAL 456 -8.249 -12.074 2.059 75 HG22 VAL 456 1HG2 VAL 456 -8.237 -13.773 2.527 76 HG23 VAL 456 2HG2 VAL 456 -9.622 -13.103 1.658 77 H GLY 457 H GLY 457 -6.313 -11.332 -1.801 78 HA2 GLY 457 2HA GLY 457 -6.758 -8.768 -0.463 79 HA3 GLY 457 1HA GLY 457 -5.152 -9.488 -0.523 80 H LYS 458 H LYS 458 -6.447 -7.030 -1.643 81 HA LYS 458 HA LYS 458 -5.673 -7.371 -4.475 82 HB2 LYS 458 2HB LYS 458 -7.585 -5.363 -3.234 83 HB3 LYS 458 1HB LYS 458 -7.027 -5.287 -4.887 84 HG2 LYS 458 2HG LYS 458 -9.279 -6.155 -4.822 85 HG3 LYS 458 1HG LYS 458 -8.186 -7.433 -5.334 86 HD2 LYS 458 2HD LYS 458 -8.276 -8.433 -3.130 87 HD3 LYS 458 1HD LYS 458 -9.244 -7.087 -2.525 88 HE2 LYS 458 2HE LYS 458 -11.055 -7.684 -4.017 89 HE3 LYS 458 1HE LYS 458 -10.078 -8.961 -4.736 90 HZ1 LYS 458 3HZ LYS 458 -10.094 -10.141 -2.677 91 HZ2 LYS 458 1HZ LYS 458 -11.660 -9.799 -3.095 92 HZ3 LYS 458 2HZ LYS 458 -10.927 -8.906 -1.871 93 H ARG 459 H ARG 459 -4.347 -5.726 -5.352 94 HA ARG 459 HA ARG 459 -3.067 -4.020 -3.348 95 HB2 ARG 459 2HB ARG 459 -2.002 -5.165 -5.920 96 HB3 ARG 459 1HB ARG 459 -1.195 -3.861 -5.061 97 HG2 ARG 459 2HG ARG 459 -0.800 -5.212 -3.180 98 HG3 ARG 459 1HG ARG 459 -1.838 -6.510 -3.788 99 HD2 ARG 459 2HD ARG 459 0.498 -7.082 -4.057 100 HD3 ARG 459 1HD ARG 459 -0.229 -6.827 -5.643 101 HE ARG 459 HE ARG 459 0.917 -4.431 -4.846 102 HH11 ARG 459 1HH1 ARG 459 1.950 -7.707 -5.658 103 HH12 ARG 459 2HH1 ARG 459 3.504 -7.254 -6.183 104 HH21 ARG 459 1HH2 ARG 459 3.147 -3.791 -5.609 105 HH22 ARG 459 2HH2 ARG 459 4.167 -5.033 -6.158 106 H LEU 460 H LEU 460 -3.205 -1.968 -3.478 107 HA LEU 460 HA LEU 460 -4.402 -0.752 -5.884 108 HB2 LEU 460 2HB LEU 460 -4.924 -0.006 -2.992 109 HB3 LEU 460 1HB LEU 460 -5.493 0.901 -4.364 110 HG LEU 460 HG LEU 460 -6.905 -1.119 -4.974 111 HD11 LEU 460 1HD1 LEU 460 -7.409 -2.736 -3.226 112 HD12 LEU 460 2HD1 LEU 460 -6.133 -2.046 -2.222 113 HD13 LEU 460 3HD1 LEU 460 -5.726 -2.835 -3.744 114 HD21 LEU 460 3HD2 LEU 460 -7.408 0.207 -2.319 115 HD22 LEU 460 1HD2 LEU 460 -8.613 -0.631 -3.295 116 HD23 LEU 460 2HD2 LEU 460 -7.850 0.839 -3.905 117 H ASN 461 H ASN 461 -3.687 1.375 -6.336 118 HA ASN 461 HA ASN 461 -1.370 2.212 -4.760 119 HB2 ASN 461 2HB ASN 461 -0.453 3.322 -6.812 120 HB3 ASN 461 1HB ASN 461 -0.573 1.582 -6.971 121 HD21 ASN 461 1HD2 ASN 461 -1.694 4.656 -8.130 122 HD22 ASN 461 2HD2 ASN 461 -2.599 4.039 -9.464 123 H ILE 462 H ILE 462 -1.690 3.901 -3.586 124 HA ILE 462 HA ILE 462 -3.765 5.817 -4.399 125 HB ILE 462 HB ILE 462 -2.773 5.155 -1.602 126 HG12 ILE 462 2HG1 ILE 462 -5.265 4.615 -1.196 127 HG13 ILE 462 1HG1 ILE 462 -5.422 4.607 -2.942 128 HG21 ILE 462 1HG2 ILE 462 -3.207 7.500 -1.725 129 HG22 ILE 462 2HG2 ILE 462 -4.447 6.717 -0.747 130 HG23 ILE 462 3HG2 ILE 462 -4.805 7.212 -2.402 131 HD11 ILE 462 3HD1 ILE 462 -5.214 2.379 -2.028 132 HD12 ILE 462 1HD1 ILE 462 -3.667 2.801 -1.309 133 HD13 ILE 462 2HD1 ILE 462 -3.832 2.753 -3.071 134 H GLN 463 H GLN 463 -3.039 7.808 -4.906 135 HA GLN 463 HA GLN 463 -0.408 8.585 -3.876 136 HB2 GLN 463 2HB GLN 463 -1.996 9.715 -6.182 137 HB3 GLN 463 1HB GLN 463 -0.545 10.469 -5.545 138 HG2 GLN 463 2HG GLN 463 0.730 8.541 -6.086 139 HG3 GLN 463 1HG GLN 463 -0.707 7.710 -6.737 140 HE21 GLN 463 1HE2 GLN 463 1.730 10.109 -7.211 141 HE22 GLN 463 2HE2 GLN 463 1.359 10.455 -8.853 142 H LEU 464 H LEU 464 -0.246 10.056 -2.406 143 HA LEU 464 HA LEU 464 -2.631 11.684 -1.823 144 HB2 LEU 464 2HB LEU 464 -0.530 10.666 0.075 145 HB3 LEU 464 1HB LEU 464 -1.830 11.741 0.518 146 HG LEU 464 HG LEU 464 -2.120 8.888 -0.411 147 HD11 LEU 464 1HD1 LEU 464 -2.515 10.171 2.275 148 HD12 LEU 464 2HD1 LEU 464 -1.213 9.070 1.817 149 HD13 LEU 464 3HD1 LEU 464 -2.881 8.496 1.869 150 HD21 LEU 464 3HD2 LEU 464 -4.484 9.157 0.159 151 HD22 LEU 464 1HD2 LEU 464 -4.019 10.244 -1.148 152 HD23 LEU 464 2HD2 LEU 464 -4.212 10.868 0.489 153 H LYS 465 H LYS 465 -2.372 13.793 -1.723 154 HA LYS 465 HA LYS 465 0.359 14.890 -1.953 155 HB2 LYS 465 2HB LYS 465 -1.157 15.471 -3.831 156 HB3 LYS 465 1HB LYS 465 -2.303 16.164 -2.677 157 HG2 LYS 465 2HG LYS 465 -0.623 17.835 -2.051 158 HG3 LYS 465 1HG LYS 465 0.515 17.115 -3.180 159 HD2 LYS 465 2HD LYS 465 -0.500 19.099 -4.154 160 HD3 LYS 465 1HD LYS 465 -1.000 17.663 -5.044 161 HE2 LYS 465 2HE LYS 465 -3.144 17.678 -3.873 162 HE3 LYS 465 1HE LYS 465 -2.645 19.069 -2.927 163 HZ1 LYS 465 3HZ LYS 465 -2.500 20.347 -4.993 164 HZ2 LYS 465 1HZ LYS 465 -4.041 19.733 -4.753 165 HZ3 LYS 465 2HZ LYS 465 -3.015 19.001 -5.868 166 H LYS 466 H LYS 466 1.097 15.968 -0.401 167 HA LYS 466 HA LYS 466 -0.257 15.921 2.093 168 HB2 LYS 466 2HB LYS 466 2.391 16.967 1.225 169 HB3 LYS 466 1HB LYS 466 1.773 17.356 2.816 170 HG2 LYS 466 2HG LYS 466 3.312 15.442 2.843 171 HG3 LYS 466 1HG LYS 466 1.699 15.013 3.405 172 HD2 LYS 466 2HD LYS 466 2.608 13.263 2.002 173 HD3 LYS 466 1HD LYS 466 1.239 14.022 1.194 174 HE2 LYS 466 2HE LYS 466 3.060 13.591 -0.337 175 HE3 LYS 466 1HE LYS 466 2.761 15.309 -0.181 176 HZ1 LYS 466 3HZ LYS 466 4.665 15.613 1.094 177 HZ2 LYS 466 1HZ LYS 466 5.128 14.540 -0.132 178 HZ3 LYS 466 2HZ LYS 466 4.813 13.917 1.388 179 H GLY 467 H GLY 467 -1.604 17.221 2.866 180 HA2 GLY 467 2HA GLY 467 -1.666 19.974 1.815 181 HA3 GLY 467 1HA GLY 467 -3.090 19.094 2.370 182 H THR 468 H THR 468 -3.816 20.026 4.125 183 HA THR 468 HA THR 468 -2.212 21.608 5.802 184 HB THR 468 HB THR 468 -4.973 20.472 6.325 185 HG1 THR 468 1HG THR 468 -4.821 23.053 5.463 186 HG21 THR 468 3HG2 THR 468 -3.893 21.506 8.293 187 HG22 THR 468 1HG2 THR 468 -5.250 22.478 7.720 188 HG23 THR 468 2HG2 THR 468 -3.596 22.971 7.355 189 H GLU 469 H GLU 469 -3.419 18.256 6.043 190 HA GLU 469 HA GLU 469 -2.164 18.015 8.678 191 HB2 GLU 469 2HB GLU 469 -3.900 16.080 7.169 192 HB3 GLU 469 1HB GLU 469 -3.317 15.882 8.809 193 HG2 GLU 469 2HG GLU 469 -5.184 18.034 7.854 194 HG3 GLU 469 1HG GLU 469 -5.624 16.605 8.788 195 H GLY 470 H GLY 470 -1.204 17.748 5.618 196 HA2 GLY 470 2HA GLY 470 0.694 16.755 4.723 197 HA3 GLY 470 1HA GLY 470 0.910 15.885 6.246 198 H LEU 471 H LEU 471 0.477 13.781 6.249 199 HA LEU 471 HA LEU 471 -0.875 12.676 3.951 200 HB2 LEU 471 2HB LEU 471 0.535 11.324 6.271 201 HB3 LEU 471 1HB LEU 471 -0.365 10.449 5.075 202 HG LEU 471 HG LEU 471 1.947 10.238 4.611 203 HD11 LEU 471 1HD1 LEU 471 0.667 12.070 2.617 204 HD12 LEU 471 2HD1 LEU 471 0.570 10.310 2.683 205 HD13 LEU 471 3HD1 LEU 471 2.107 11.096 2.331 206 HD21 LEU 471 3HD2 LEU 471 2.827 12.193 5.755 207 HD22 LEU 471 1HD2 LEU 471 2.103 13.251 4.547 208 HD23 LEU 471 2HD2 LEU 471 3.410 12.157 4.089 209 H GLY 472 H GLY 472 -1.170 12.487 7.478 210 HA2 GLY 472 2HA GLY 472 -3.208 12.817 8.644 211 HA3 GLY 472 1HA GLY 472 -4.060 12.541 7.134 212 H PHE 473 H PHE 473 -1.608 10.258 8.061 213 HA PHE 473 HA PHE 473 -3.514 8.600 9.428 214 HB2 PHE 473 2HB PHE 473 -3.339 6.682 7.958 215 HB3 PHE 473 1HB PHE 473 -3.943 8.045 7.030 216 HD1 PHE 473 1HD PHE 473 -2.199 9.313 5.618 217 HD2 PHE 473 2HD PHE 473 -1.545 5.413 7.188 218 HE1 PHE 473 1HE PHE 473 -0.453 8.906 3.933 219 HE2 PHE 473 2HE PHE 473 0.201 5.036 5.530 220 HZ PHE 473 HZ PHE 473 0.732 6.816 3.889 221 H SER 474 H SER 474 -2.486 6.663 10.235 222 HA SER 474 HA SER 474 0.400 7.054 10.571 223 HB2 SER 474 2HB SER 474 -1.589 5.967 12.580 224 HB3 SER 474 1HB SER 474 0.153 6.100 12.832 225 HG SER 474 HG SER 474 -1.276 8.353 12.048 226 H ILE 475 H ILE 475 1.566 5.008 10.973 227 HA ILE 475 HA ILE 475 0.246 2.657 9.780 228 HB ILE 475 HB ILE 475 2.481 1.982 9.049 229 HG12 ILE 475 2HG1 ILE 475 3.325 4.762 9.848 230 HG13 ILE 475 1HG1 ILE 475 3.756 3.218 10.604 231 HG21 ILE 475 1HG2 ILE 475 1.038 2.949 7.419 232 HG22 ILE 475 2HG2 ILE 475 2.703 3.419 7.113 233 HG23 ILE 475 3HG2 ILE 475 1.584 4.584 7.835 234 HD11 ILE 475 3HD1 ILE 475 5.556 4.174 9.171 235 HD12 ILE 475 1HD1 ILE 475 4.491 4.026 7.779 236 HD13 ILE 475 2HD1 ILE 475 5.030 2.584 8.631 237 H THR 476 H THR 476 0.703 0.693 10.845 238 HA THR 476 HA THR 476 2.225 0.874 13.341 239 HB THR 476 HB THR 476 -0.217 0.895 13.924 240 HG1 THR 476 1HG THR 476 0.061 -1.422 15.003 241 HG21 THR 476 3HG2 THR 476 -1.031 -0.380 11.955 242 HG22 THR 476 1HG2 THR 476 -1.595 -1.097 13.465 243 HG23 THR 476 2HG2 THR 476 -0.255 -1.826 12.589 244 H SER 477 H SER 477 3.114 -1.184 14.028 245 HA SER 477 HA SER 477 3.321 -3.037 11.790 246 HB2 SER 477 2HB SER 477 5.699 -3.280 12.388 247 HB3 SER 477 1HB SER 477 5.286 -1.648 11.861 248 HG SER 477 HG SER 477 6.558 -2.192 13.933 249 H ARG 478 H ARG 478 3.134 -5.069 12.289 250 HA ARG 478 HA ARG 478 3.715 -5.897 14.996 251 HB2 ARG 478 2HB ARG 478 1.911 -7.594 14.891 252 HB3 ARG 478 1HB ARG 478 1.231 -5.993 14.705 253 HG2 ARG 478 2HG ARG 478 1.084 -6.374 12.272 254 HG3 ARG 478 1HG ARG 478 1.707 -8.007 12.522 255 HD2 ARG 478 2HD ARG 478 -0.231 -8.440 14.039 256 HD3 ARG 478 1HD ARG 478 -0.869 -6.857 13.593 257 HE ARG 478 HE ARG 478 -0.274 -8.534 11.355 258 HH11 ARG 478 1HH1 ARG 478 -2.814 -7.702 13.687 259 HH12 ARG 478 2HH1 ARG 478 -4.079 -8.345 12.750 260 HH21 ARG 478 1HH2 ARG 478 -1.960 -9.426 10.098 261 HH22 ARG 478 2HH2 ARG 478 -3.574 -9.392 10.633 262 H ASP 479 H ASP 479 5.261 -7.428 14.955 263 HA ASP 479 HA ASP 479 6.151 -7.993 12.255 264 HB2 ASP 479 2HB ASP 479 7.705 -6.790 13.784 265 HB3 ASP 479 1HB ASP 479 7.745 -8.218 14.808 266 H VAL 480 H VAL 480 5.113 -9.675 11.629 267 HA VAL 480 HA VAL 480 5.420 -12.162 13.136 268 HB VAL 480 HB VAL 480 3.299 -11.468 11.066 269 HG11 VAL 480 1HG1 VAL 480 2.227 -13.560 11.741 270 HG12 VAL 480 2HG1 VAL 480 3.559 -13.888 12.844 271 HG13 VAL 480 3HG1 VAL 480 3.850 -13.842 11.106 272 HG21 VAL 480 3HG2 VAL 480 1.690 -11.466 12.929 273 HG22 VAL 480 1HG2 VAL 480 2.918 -10.212 13.125 274 HG23 VAL 480 2HG2 VAL 480 3.018 -11.701 14.066 275 H THR 481 H THR 481 6.972 -13.298 12.239 276 HA THR 481 HA THR 481 7.916 -12.671 9.627 277 HB THR 481 HB THR 481 9.620 -14.470 10.143 278 HG1 THR 481 1HG THR 481 7.964 -15.347 11.778 279 HG21 THR 481 3HG2 THR 481 10.761 -13.104 11.842 280 HG22 THR 481 1HG2 THR 481 9.252 -12.252 12.169 281 HG23 THR 481 2HG2 THR 481 10.034 -12.088 10.597 282 H ILE 482 H ILE 482 6.424 -13.266 8.132 283 HA ILE 482 HA ILE 482 5.784 -16.131 7.975 284 HB ILE 482 HB ILE 482 3.987 -15.495 6.371 285 HG12 ILE 482 2HG1 ILE 482 4.720 -12.645 7.112 286 HG13 ILE 482 1HG1 ILE 482 4.970 -13.402 5.541 287 HG21 ILE 482 1HG2 ILE 482 3.438 -15.809 8.707 288 HG22 ILE 482 2HG2 ILE 482 2.453 -14.514 8.021 289 HG23 ILE 482 3HG2 ILE 482 3.836 -14.123 9.040 290 HD11 ILE 482 3HD1 ILE 482 2.558 -13.608 5.258 291 HD12 ILE 482 1HD1 ILE 482 3.032 -11.933 5.533 292 HD13 ILE 482 2HD1 ILE 482 2.303 -12.872 6.839 293 H GLY 483 H GLY 483 8.043 -14.187 6.945 294 HA2 GLY 483 2HA GLY 483 9.153 -15.807 5.060 295 HA3 GLY 483 1HA GLY 483 8.112 -14.721 4.143 296 H GLY 484 H GLY 484 10.116 -14.195 7.017 297 HA2 GLY 484 2HA GLY 484 12.202 -13.029 6.922 298 HA3 GLY 484 1HA GLY 484 11.631 -12.206 5.475 299 H SER 485 H SER 485 11.817 -10.150 6.173 300 HA SER 485 HA SER 485 10.917 -9.275 8.721 301 HB2 SER 485 2HB SER 485 11.663 -7.727 6.237 302 HB3 SER 485 1HB SER 485 11.555 -7.066 7.869 303 HG SER 485 HG SER 485 13.132 -8.773 8.400 304 H ALA 486 H ALA 486 8.940 -8.579 9.270 305 HA ALA 486 HA ALA 486 6.789 -8.912 7.438 306 HB1 ALA 486 1HB ALA 486 5.365 -8.427 9.363 307 HB2 ALA 486 2HB ALA 486 6.790 -7.950 10.280 308 HB3 ALA 486 3HB ALA 486 6.604 -9.624 9.755 309 HA PRO 487 HA PRO 487 6.445 -4.564 6.293 310 HB2 PRO 487 2HB PRO 487 3.758 -5.098 5.379 311 HB3 PRO 487 1HB PRO 487 5.191 -4.739 4.411 312 HG2 PRO 487 2HG PRO 487 4.009 -7.200 4.407 313 HG3 PRO 487 1HG PRO 487 5.743 -6.968 4.152 314 HD2 PRO 487 2HD PRO 487 4.288 -7.813 6.624 315 HD3 PRO 487 1HD PRO 487 5.814 -8.407 5.924 316 H ILE 488 H ILE 488 4.436 -2.948 6.267 317 HA ILE 488 HA ILE 488 3.335 -3.019 8.958 318 HB ILE 488 HB ILE 488 4.533 -0.731 7.421 319 HG12 ILE 488 2HG1 ILE 488 5.097 -2.114 10.005 320 HG13 ILE 488 1HG1 ILE 488 6.157 -1.768 8.652 321 HG21 ILE 488 1HG2 ILE 488 3.877 0.794 9.102 322 HG22 ILE 488 2HG2 ILE 488 2.771 -0.410 9.789 323 HG23 ILE 488 3HG2 ILE 488 2.515 0.203 8.144 324 HD11 ILE 488 3HD1 ILE 488 6.079 0.646 9.241 325 HD12 ILE 488 1HD1 ILE 488 6.774 -0.362 10.522 326 HD13 ILE 488 2HD1 ILE 488 5.119 0.227 10.645 327 H TYR 489 H TYR 489 1.342 -2.063 9.363 328 HA TYR 489 HA TYR 489 -0.497 -1.948 7.064 329 HB2 TYR 489 2HB TYR 489 -1.113 -2.783 9.930 330 HB3 TYR 489 1HB TYR 489 -2.226 -2.767 8.576 331 HD1 TYR 489 2HD TYR 489 0.823 -4.377 9.884 332 HD2 TYR 489 1HD TYR 489 -2.365 -4.530 7.103 333 HE1 TYR 489 2HE TYR 489 1.524 -6.616 9.294 334 HE2 TYR 489 1HE TYR 489 -1.623 -6.865 6.442 335 HH TYR 489 HH TYR 489 0.532 -8.644 8.256 336 H VAL 490 H VAL 490 -2.007 -0.313 7.129 337 HA VAL 490 HA VAL 490 -1.291 2.081 8.434 338 HB VAL 490 HB VAL 490 -3.953 1.325 7.201 339 HG11 VAL 490 1HG1 VAL 490 -2.884 4.043 7.998 340 HG12 VAL 490 2HG1 VAL 490 -4.220 3.196 8.778 341 HG13 VAL 490 3HG1 VAL 490 -4.378 3.750 7.109 342 HG21 VAL 490 3HG2 VAL 490 -2.091 1.283 5.656 343 HG22 VAL 490 1HG2 VAL 490 -1.632 2.918 6.139 344 HG23 VAL 490 2HG2 VAL 490 -3.171 2.634 5.318 345 H LYS 491 H LYS 491 -1.611 2.783 10.372 346 HA LYS 491 HA LYS 491 -2.749 1.057 12.400 347 HB2 LYS 491 2HB LYS 491 -0.656 2.263 12.692 348 HB3 LYS 491 1HB LYS 491 -1.496 3.766 12.466 349 HG2 LYS 491 2HG LYS 491 -2.796 3.388 14.491 350 HG3 LYS 491 1HG LYS 491 -1.913 1.888 14.775 351 HD2 LYS 491 2HD LYS 491 0.174 3.117 14.928 352 HD3 LYS 491 1HD LYS 491 -0.672 4.627 14.562 353 HE2 LYS 491 2HE LYS 491 -2.017 4.346 16.533 354 HE3 LYS 491 1HE LYS 491 -1.165 2.848 16.922 355 HZ1 LYS 491 3HZ LYS 491 -0.222 4.619 18.214 356 HZ2 LYS 491 1HZ LYS 491 0.038 5.584 16.840 357 HZ3 LYS 491 2HZ LYS 491 0.901 4.162 17.060 358 H ASN 492 H ASN 492 -3.505 4.164 10.936 359 HA ASN 492 HA ASN 492 -6.188 4.229 11.932 360 HB2 ASN 492 2HB ASN 492 -5.021 4.755 14.023 361 HB3 ASN 492 1HB ASN 492 -4.121 6.028 13.220 362 HD21 ASN 492 1HD2 ASN 492 -4.851 7.538 14.684 363 HD22 ASN 492 2HD2 ASN 492 -6.470 8.153 14.658 364 H ILE 493 H ILE 493 -7.362 5.693 10.799 365 HA ILE 493 HA ILE 493 -5.962 7.474 8.941 366 HB ILE 493 HB ILE 493 -8.813 6.384 8.895 367 HG12 ILE 493 2HG1 ILE 493 -7.143 4.660 8.361 368 HG13 ILE 493 1HG1 ILE 493 -8.168 5.066 6.990 369 HG21 ILE 493 1HG2 ILE 493 -7.368 8.058 6.853 370 HG22 ILE 493 2HG2 ILE 493 -8.756 8.557 7.847 371 HG23 ILE 493 3HG2 ILE 493 -8.932 7.297 6.623 372 HD11 ILE 493 3HD1 ILE 493 -5.887 4.779 6.255 373 HD12 ILE 493 1HD1 ILE 493 -5.326 5.976 7.431 374 HD13 ILE 493 2HD1 ILE 493 -6.356 6.471 6.094 375 H LEU 494 H LEU 494 -5.921 9.529 9.720 376 HA LEU 494 HA LEU 494 -7.575 10.287 11.911 377 HB2 LEU 494 2HB LEU 494 -5.561 11.832 10.273 378 HB3 LEU 494 1HB LEU 494 -6.483 12.578 11.553 379 HG LEU 494 HG LEU 494 -4.290 12.091 12.359 380 HD11 LEU 494 1HD1 LEU 494 -4.742 10.719 14.301 381 HD12 LEU 494 2HD1 LEU 494 -6.240 10.160 13.558 382 HD13 LEU 494 3HD1 LEU 494 -6.036 11.865 13.968 383 HD21 LEU 494 3HD2 LEU 494 -3.372 9.816 12.512 384 HD22 LEU 494 1HD2 LEU 494 -3.629 10.311 10.839 385 HD23 LEU 494 2HD2 LEU 494 -4.762 9.202 11.614 386 HA PRO 495 HA PRO 495 -11.178 11.944 9.991 387 HB2 PRO 495 2HB PRO 495 -10.744 14.366 11.680 388 HB3 PRO 495 1HB PRO 495 -12.185 13.356 11.505 389 HG2 PRO 495 2HG PRO 495 -10.679 13.143 13.674 390 HG3 PRO 495 1HG PRO 495 -11.361 11.697 12.904 391 HD2 PRO 495 2HD PRO 495 -8.567 12.753 12.820 392 HD3 PRO 495 1HD PRO 495 -9.145 11.078 12.905 393 H ARG 496 H ARG 496 -8.366 13.999 10.220 394 HA ARG 496 HA ARG 496 -9.153 15.262 7.700 395 HB2 ARG 496 2HB ARG 496 -7.723 16.511 10.037 396 HB3 ARG 496 1HB ARG 496 -7.763 17.230 8.437 397 HG2 ARG 496 2HG ARG 496 -10.158 16.647 10.165 398 HG3 ARG 496 1HG ARG 496 -9.416 18.231 9.891 399 HD2 ARG 496 2HD ARG 496 -9.852 17.960 7.468 400 HD3 ARG 496 1HD ARG 496 -10.702 16.461 7.822 401 HE ARG 496 HE ARG 496 -11.922 18.336 9.354 402 HH11 ARG 496 1HH1 ARG 496 -11.199 17.970 5.920 403 HH12 ARG 496 2HH1 ARG 496 -12.568 18.838 5.395 404 HH21 ARG 496 1HH2 ARG 496 -13.812 19.519 8.624 405 HH22 ARG 496 2HH2 ARG 496 -14.080 19.729 6.947 406 H GLY 497 H GLY 497 -7.702 15.368 6.098 407 HA2 GLY 497 2HA GLY 497 -5.188 15.485 5.797 408 HA3 GLY 497 1HA GLY 497 -5.219 13.897 6.555 409 H ALA 498 H ALA 498 -4.118 14.194 4.135 410 HA ALA 498 HA ALA 498 -5.674 14.027 1.853 411 HB1 ALA 498 1HB ALA 498 -3.016 12.687 2.346 412 HB2 ALA 498 2HB ALA 498 -3.236 14.366 1.865 413 HB3 ALA 498 3HB ALA 498 -3.720 13.069 0.778 414 H ALA 499 H ALA 499 -4.466 11.416 3.896 415 HA ALA 499 HA ALA 499 -5.223 9.227 2.369 416 HB1 ALA 499 1HB ALA 499 -3.765 9.039 4.292 417 HB2 ALA 499 2HB ALA 499 -5.122 7.924 4.443 418 HB3 ALA 499 3HB ALA 499 -5.105 9.423 5.367 419 H ILE 500 H ILE 500 -7.129 10.887 4.857 420 HA ILE 500 HA ILE 500 -9.264 9.022 4.545 421 HB ILE 500 HB ILE 500 -8.808 10.162 6.727 422 HG12 ILE 500 2HG1 ILE 500 -11.577 10.607 5.599 423 HG13 ILE 500 1HG1 ILE 500 -10.971 9.095 6.239 424 HG21 ILE 500 1HG2 ILE 500 -8.291 12.388 5.919 425 HG22 ILE 500 2HG2 ILE 500 -9.618 12.446 7.082 426 HG23 ILE 500 3HG2 ILE 500 -9.952 12.582 5.355 427 HD11 ILE 500 3HD1 ILE 500 -11.332 11.635 7.799 428 HD12 ILE 500 1HD1 ILE 500 -10.739 10.104 8.440 429 HD13 ILE 500 2HD1 ILE 500 -12.392 10.224 7.840 430 H GLN 501 H GLN 501 -8.489 12.170 3.242 431 HA GLN 501 HA GLN 501 -11.075 12.693 2.193 432 HB2 GLN 501 2HB GLN 501 -8.385 13.776 1.340 433 HB3 GLN 501 1HB GLN 501 -9.928 14.355 0.735 434 HG2 GLN 501 2HG GLN 501 -8.989 14.477 3.592 435 HG3 GLN 501 1HG GLN 501 -9.027 15.818 2.446 436 HE21 GLN 501 1HE2 GLN 501 -10.889 13.731 4.462 437 HE22 GLN 501 2HE2 GLN 501 -12.376 14.587 4.386 438 H ASP 502 H ASP 502 -8.204 11.110 0.950 439 HA ASP 502 HA ASP 502 -9.174 10.728 -1.674 440 HB2 ASP 502 2HB ASP 502 -6.802 10.490 -1.168 441 HB3 ASP 502 1HB ASP 502 -7.145 9.116 -0.118 442 H GLY 503 H GLY 503 -9.141 8.577 1.135 443 HA2 GLY 503 2HA GLY 503 -10.992 7.312 1.813 444 HA3 GLY 503 1HA GLY 503 -11.711 7.551 0.237 445 H ARG 504 H ARG 504 -8.928 6.546 -0.890 446 HA ARG 504 HA ARG 504 -9.868 3.830 -0.989 447 HB2 ARG 504 2HB ARG 504 -7.425 5.083 -2.280 448 HB3 ARG 504 1HB ARG 504 -7.855 3.394 -2.470 449 HG2 ARG 504 2HG ARG 504 -8.534 4.566 -4.439 450 HG3 ARG 504 1HG ARG 504 -9.995 4.151 -3.555 451 HD2 ARG 504 2HD ARG 504 -10.060 6.438 -2.653 452 HD3 ARG 504 1HD ARG 504 -8.609 6.832 -3.564 453 HE ARG 504 HE ARG 504 -10.980 5.894 -4.976 454 HH11 ARG 504 1HH1 ARG 504 -8.670 8.566 -4.334 455 HH12 ARG 504 2HH1 ARG 504 -9.334 9.562 -5.527 456 HH21 ARG 504 1HH2 ARG 504 -11.848 7.312 -6.576 457 HH22 ARG 504 2HH2 ARG 504 -11.200 8.881 -6.812 458 H LEU 505 H LEU 505 -7.384 5.574 0.607 459 HA LEU 505 HA LEU 505 -6.099 3.201 1.671 460 HB2 LEU 505 2HB LEU 505 -4.796 5.195 1.048 461 HB3 LEU 505 1HB LEU 505 -5.702 6.150 2.197 462 HG LEU 505 HG LEU 505 -4.693 4.840 4.045 463 HD11 LEU 505 1HD1 LEU 505 -3.081 3.562 1.841 464 HD12 LEU 505 2HD1 LEU 505 -4.217 2.729 2.913 465 HD13 LEU 505 3HD1 LEU 505 -2.749 3.454 3.559 466 HD21 LEU 505 3HD2 LEU 505 -2.728 6.046 2.128 467 HD22 LEU 505 1HD2 LEU 505 -2.469 5.785 3.849 468 HD23 LEU 505 2HD2 LEU 505 -3.701 6.928 3.304 469 H LYS 506 H LYS 506 -6.696 2.281 3.531 470 HA LYS 506 HA LYS 506 -8.163 3.744 5.557 471 HB2 LYS 506 2HB LYS 506 -9.327 1.274 4.226 472 HB3 LYS 506 1HB LYS 506 -9.904 1.915 5.752 473 HG2 LYS 506 2HG LYS 506 -9.958 3.380 3.110 474 HG3 LYS 506 1HG LYS 506 -11.333 2.563 3.852 475 HD2 LYS 506 2HD LYS 506 -11.190 4.091 5.779 476 HD3 LYS 506 1HD LYS 506 -9.805 4.889 5.042 477 HE2 LYS 506 2HE LYS 506 -11.829 6.185 4.685 478 HE3 LYS 506 1HE LYS 506 -11.203 5.575 3.155 479 HZ1 LYS 506 3HZ LYS 506 -13.611 5.328 3.290 480 HZ2 LYS 506 1HZ LYS 506 -13.467 4.405 4.689 481 HZ3 LYS 506 2HZ LYS 506 -12.879 3.822 3.226 482 H ALA 507 H ALA 507 -8.177 2.703 7.610 483 HA ALA 507 HA ALA 507 -5.668 1.624 8.158 484 HB1 ALA 507 1HB ALA 507 -6.378 1.429 10.461 485 HB2 ALA 507 2HB ALA 507 -8.063 1.595 9.974 486 HB3 ALA 507 3HB ALA 507 -6.951 2.952 9.778 487 H GLY 508 H GLY 508 -4.827 -0.245 8.335 488 HA2 GLY 508 2HA GLY 508 -4.810 -2.506 8.937 489 HA3 GLY 508 1HA GLY 508 -6.438 -2.764 8.446 490 H ASP 509 H ASP 509 -5.190 -0.867 6.042 491 HA ASP 509 HA ASP 509 -4.607 -3.245 4.570 492 HB2 ASP 509 2HB ASP 509 -4.211 -1.834 2.580 493 HB3 ASP 509 1HB ASP 509 -5.754 -1.494 3.340 494 H ARG 510 H ARG 510 -2.740 -3.473 3.357 495 HA ARG 510 HA ARG 510 -0.540 -3.141 5.268 496 HB2 ARG 510 2HB ARG 510 -1.060 -5.410 4.869 497 HB3 ARG 510 1HB ARG 510 -1.023 -5.269 3.143 498 HG2 ARG 510 2HG ARG 510 1.453 -4.688 3.418 499 HG3 ARG 510 1HG ARG 510 1.259 -5.195 5.097 500 HD2 ARG 510 2HD ARG 510 0.651 -6.902 2.680 501 HD3 ARG 510 1HD ARG 510 2.116 -7.006 3.659 502 HE ARG 510 HE ARG 510 0.329 -7.490 5.509 503 HH11 ARG 510 1HH1 ARG 510 0.329 -8.715 2.158 504 HH12 ARG 510 2HH1 ARG 510 -0.429 -10.171 2.575 505 HH21 ARG 510 1HH2 ARG 510 -0.722 -9.477 6.035 506 HH22 ARG 510 2HH2 ARG 510 -1.088 -10.599 4.809 507 H LEU 511 H LEU 511 0.896 -1.690 4.793 508 HA LEU 511 HA LEU 511 0.942 -0.424 2.245 509 HB2 LEU 511 2HB LEU 511 1.558 0.531 4.708 510 HB3 LEU 511 1HB LEU 511 3.091 -0.194 4.379 511 HG LEU 511 HG LEU 511 3.131 2.211 3.953 512 HD11 LEU 511 1HD1 LEU 511 4.661 0.888 2.695 513 HD12 LEU 511 2HD1 LEU 511 4.075 2.232 1.713 514 HD13 LEU 511 3HD1 LEU 511 3.452 0.602 1.446 515 HD21 LEU 511 3HD2 LEU 511 1.901 3.184 2.113 516 HD22 LEU 511 1HD2 LEU 511 0.802 2.505 3.316 517 HD23 LEU 511 2HD2 LEU 511 1.109 1.645 1.807 518 H ILE 512 H ILE 512 2.008 -1.199 0.508 519 HA ILE 512 HA ILE 512 3.710 -3.559 0.825 520 HB ILE 512 HB ILE 512 2.266 -2.453 -1.611 521 HG12 ILE 512 2HG1 ILE 512 0.761 -3.466 0.010 522 HG13 ILE 512 1HG1 ILE 512 0.886 -4.460 -1.427 523 HG21 ILE 512 1HG2 ILE 512 3.920 -4.949 -1.406 524 HG22 ILE 512 2HG2 ILE 512 4.310 -3.491 -2.323 525 HG23 ILE 512 3HG2 ILE 512 2.918 -4.480 -2.783 526 HD11 ILE 512 3HD1 ILE 512 2.453 -5.947 -0.257 527 HD12 ILE 512 1HD1 ILE 512 0.891 -5.848 0.551 528 HD13 ILE 512 2HD1 ILE 512 2.267 -4.972 1.204 529 H GLU 513 H GLU 513 3.636 -0.561 -1.068 530 HA GLU 513 HA GLU 513 6.425 -0.168 -0.646 531 HB2 GLU 513 2HB GLU 513 7.099 -0.185 -3.001 532 HB3 GLU 513 1HB GLU 513 6.578 -1.772 -2.480 533 HG2 GLU 513 2HG GLU 513 4.431 -1.386 -3.527 534 HG3 GLU 513 1HG GLU 513 5.014 0.189 -4.074 535 H VAL 514 H VAL 514 7.109 1.772 -1.104 536 HA VAL 514 HA VAL 514 4.994 3.651 -1.731 537 HB VAL 514 HB VAL 514 5.580 3.869 0.653 538 HG11 VAL 514 1HG1 VAL 514 7.788 4.701 1.361 539 HG12 VAL 514 2HG1 VAL 514 8.367 4.518 -0.296 540 HG13 VAL 514 3HG1 VAL 514 7.884 3.098 0.621 541 HG21 VAL 514 3HG2 VAL 514 5.972 6.269 0.717 542 HG22 VAL 514 1HG2 VAL 514 4.910 5.827 -0.628 543 HG23 VAL 514 2HG2 VAL 514 6.589 6.204 -0.946 544 H ASN 515 H ASN 515 5.482 5.081 -3.328 545 HA ASN 515 HA ASN 515 6.505 6.098 -5.089 546 HB2 ASN 515 2HB ASN 515 9.113 5.623 -3.588 547 HB3 ASN 515 1HB ASN 515 8.954 6.609 -5.027 548 HD21 ASN 515 1HD2 ASN 515 7.949 8.648 -4.842 549 HD22 ASN 515 2HD2 ASN 515 7.714 9.422 -3.342 550 H GLY 516 H GLY 516 8.665 3.539 -4.107 551 HA2 GLY 516 2HA GLY 516 8.081 1.718 -6.128 552 HA3 GLY 516 1HA GLY 516 9.435 2.702 -6.685 553 H VAL 517 H VAL 517 9.301 2.381 -3.267 554 HA VAL 517 HA VAL 517 11.689 0.730 -3.325 555 HB VAL 517 HB VAL 517 10.282 2.067 -0.990 556 HG11 VAL 517 1HG1 VAL 517 13.056 0.905 -1.190 557 HG12 VAL 517 2HG1 VAL 517 11.699 0.226 -0.292 558 HG13 VAL 517 3HG1 VAL 517 12.407 1.764 0.204 559 HG21 VAL 517 3HG2 VAL 517 11.052 3.744 -2.603 560 HG22 VAL 517 1HG2 VAL 517 12.681 3.059 -2.541 561 HG23 VAL 517 2HG2 VAL 517 11.986 3.811 -1.112 562 H ASP 518 H ASP 518 11.488 -1.409 -3.075 563 HA ASP 518 HA ASP 518 8.990 -2.623 -2.345 564 HB2 ASP 518 2HB ASP 518 11.704 -3.958 -2.588 565 HB3 ASP 518 1HB ASP 518 10.159 -4.782 -2.492 566 H LEU 519 H LEU 519 8.485 -1.986 -0.351 567 HA LEU 519 HA LEU 519 10.382 -2.537 1.805 568 HB2 LEU 519 2HB LEU 519 8.965 -1.094 3.147 569 HB3 LEU 519 1HB LEU 519 9.552 -0.288 1.710 570 HG LEU 519 HG LEU 519 7.248 -1.081 0.763 571 HD11 LEU 519 1HD1 LEU 519 6.581 -0.815 3.658 572 HD12 LEU 519 2HD1 LEU 519 6.477 -2.288 2.666 573 HD13 LEU 519 3HD1 LEU 519 5.459 -0.891 2.298 574 HD21 LEU 519 3HD2 LEU 519 7.618 1.352 2.488 575 HD22 LEU 519 1HD2 LEU 519 6.317 1.083 1.310 576 HD23 LEU 519 2HD2 LEU 519 7.976 1.141 0.756 577 H ALA 520 H ALA 520 7.917 -4.041 0.301 578 HA ALA 520 HA ALA 520 7.065 -5.487 2.605 579 HB1 ALA 520 1HB ALA 520 5.630 -5.385 0.587 580 HB2 ALA 520 2HB ALA 520 6.033 -7.055 0.993 581 HB3 ALA 520 3HB ALA 520 6.865 -6.237 -0.330 582 H GLY 521 H GLY 521 9.095 -5.747 3.442 583 HA2 GLY 521 2HA GLY 521 10.290 -8.117 3.587 584 HA3 GLY 521 1HA GLY 521 11.027 -7.476 2.117 585 H LYS 522 H LYS 522 10.396 -4.786 3.636 586 HA LYS 522 HA LYS 522 12.981 -4.622 4.910 587 HB2 LYS 522 2HB LYS 522 10.941 -2.557 4.105 588 HB3 LYS 522 1HB LYS 522 12.340 -2.170 5.092 589 HG2 LYS 522 2HG LYS 522 12.454 -3.350 2.330 590 HG3 LYS 522 1HG LYS 522 12.674 -1.640 2.721 591 HD2 LYS 522 2HD LYS 522 14.560 -2.243 4.181 592 HD3 LYS 522 1HD LYS 522 14.368 -3.922 3.736 593 HE2 LYS 522 2HE LYS 522 14.829 -3.406 1.404 594 HE3 LYS 522 1HE LYS 522 14.967 -1.692 1.797 595 HZ1 LYS 522 3HZ LYS 522 17.129 -2.648 1.642 596 HZ2 LYS 522 1HZ LYS 522 16.759 -3.871 2.747 597 HZ3 LYS 522 2HZ LYS 522 16.843 -2.253 3.247 598 H SER 523 H SER 523 13.138 -3.559 6.980 599 HA SER 523 HA SER 523 11.257 -4.785 8.697 600 HB2 SER 523 2HB SER 523 13.734 -3.177 9.133 601 HB3 SER 523 1HB SER 523 12.803 -3.927 10.451 602 HG SER 523 HG SER 523 13.106 -5.908 9.338 603 H GLN 524 H GLN 524 10.198 -3.651 10.385 604 HA GLN 524 HA GLN 524 8.554 -1.609 9.615 605 HB2 GLN 524 2HB GLN 524 7.957 -1.376 11.963 606 HB3 GLN 524 1HB GLN 524 8.115 -3.067 11.511 607 HG2 GLN 524 2HG GLN 524 10.305 -3.153 12.554 608 HG3 GLN 524 1HG GLN 524 10.202 -1.453 12.966 609 HE21 GLN 524 1HE2 GLN 524 10.259 -1.695 15.101 610 HE22 GLN 524 2HE2 GLN 524 9.053 -2.466 16.061 611 H GLU 525 H GLU 525 11.642 -1.378 11.210 612 HA GLU 525 HA GLU 525 11.472 1.339 11.972 613 HB2 GLU 525 2HB GLU 525 13.840 -0.420 11.477 614 HB3 GLU 525 1HB GLU 525 13.910 1.140 12.317 615 HG2 GLU 525 2HG GLU 525 12.506 -1.378 13.182 616 HG3 GLU 525 1HG GLU 525 13.969 -0.697 13.890 617 H GLU 526 H GLU 526 12.408 -0.264 9.041 618 HA GLU 526 HA GLU 526 13.783 1.908 7.861 619 HB2 GLU 526 2HB GLU 526 12.423 -0.471 6.603 620 HB3 GLU 526 1HB GLU 526 13.521 0.616 5.769 621 HG2 GLU 526 2HG GLU 526 14.221 -1.142 8.106 622 HG3 GLU 526 1HG GLU 526 14.595 -1.462 6.416 623 H VAL 527 H VAL 527 10.561 0.571 7.670 624 HA VAL 527 HA VAL 527 9.677 2.523 5.789 625 HB VAL 527 HB VAL 527 7.413 1.442 6.028 626 HG11 VAL 527 1HG1 VAL 527 8.148 -0.681 5.053 627 HG12 VAL 527 2HG1 VAL 527 9.787 -0.353 5.600 628 HG13 VAL 527 3HG1 VAL 527 9.064 0.682 4.360 629 HG21 VAL 527 3HG2 VAL 527 8.946 -0.443 7.767 630 HG22 VAL 527 1HG2 VAL 527 7.251 -0.590 7.271 631 HG23 VAL 527 2HG2 VAL 527 7.773 0.729 8.336 632 H VAL 528 H VAL 528 9.291 2.162 9.302 633 HA VAL 528 HA VAL 528 7.411 4.238 9.577 634 HB VAL 528 HB VAL 528 9.547 3.352 11.569 635 HG11 VAL 528 1HG1 VAL 528 8.829 5.661 12.034 636 HG12 VAL 528 2HG1 VAL 528 8.245 4.548 13.269 637 HG13 VAL 528 3HG1 VAL 528 7.141 5.136 12.023 638 HG21 VAL 528 3HG2 VAL 528 6.587 2.778 11.425 639 HG22 VAL 528 1HG2 VAL 528 7.675 2.239 12.703 640 HG23 VAL 528 2HG2 VAL 528 7.878 1.639 11.057 641 H SER 529 H SER 529 10.876 4.262 9.344 642 HA SER 529 HA SER 529 11.261 6.981 9.810 643 HB2 SER 529 2HB SER 529 12.883 5.037 8.175 644 HB3 SER 529 1HB SER 529 13.442 6.636 8.672 645 HG SER 529 HG SER 529 13.110 4.307 10.154 646 H LEU 530 H LEU 530 10.322 5.264 6.923 647 HA LEU 530 HA LEU 530 10.746 7.324 5.045 648 HB2 LEU 530 2HB LEU 530 8.838 5.063 5.192 649 HB3 LEU 530 1HB LEU 530 8.969 6.019 3.728 650 HG LEU 530 HG LEU 530 11.073 4.223 4.985 651 HD11 LEU 530 1HD1 LEU 530 9.609 4.005 2.363 652 HD12 LEU 530 2HD1 LEU 530 9.303 3.028 3.798 653 HD13 LEU 530 3HD1 LEU 530 10.847 2.903 2.960 654 HD21 LEU 530 3HD2 LEU 530 12.467 4.734 3.035 655 HD22 LEU 530 1HD2 LEU 530 12.164 6.168 4.008 656 HD23 LEU 530 2HD2 LEU 530 11.283 5.927 2.500 657 H LEU 531 H LEU 531 7.749 6.364 6.799 658 HA LEU 531 HA LEU 531 6.270 8.540 5.811 659 HB2 LEU 531 2HB LEU 531 5.821 6.515 7.962 660 HB3 LEU 531 1HB LEU 531 4.665 7.786 7.674 661 HG LEU 531 HG LEU 531 3.969 5.742 6.684 662 HD11 LEU 531 1HD1 LEU 531 3.327 7.774 5.520 663 HD12 LEU 531 2HD1 LEU 531 3.562 6.470 4.356 664 HD13 LEU 531 3HD1 LEU 531 4.798 7.716 4.551 665 HD21 LEU 531 3HD2 LEU 531 6.486 5.780 5.022 666 HD22 LEU 531 1HD2 LEU 531 5.133 4.674 4.778 667 HD23 LEU 531 2HD2 LEU 531 6.069 4.609 6.273 668 H ARG 532 H ARG 532 8.216 8.047 8.655 669 HA ARG 532 HA ARG 532 7.262 10.327 10.071 670 HB2 ARG 532 2HB ARG 532 8.394 8.486 11.211 671 HB3 ARG 532 1HB ARG 532 9.861 8.820 10.308 672 HG2 ARG 532 2HG ARG 532 10.016 11.016 11.394 673 HG3 ARG 532 1HG ARG 532 8.567 10.637 12.328 674 HD2 ARG 532 2HD ARG 532 9.712 8.709 13.308 675 HD3 ARG 532 1HD ARG 532 11.149 9.092 12.365 676 HE ARG 532 HE ARG 532 10.488 11.351 13.807 677 HH11 ARG 532 1HH1 ARG 532 11.518 8.039 14.468 678 HH12 ARG 532 2HH1 ARG 532 12.320 8.409 15.921 679 HH21 ARG 532 1HH2 ARG 532 11.602 11.880 15.836 680 HH22 ARG 532 2HH2 ARG 532 12.348 10.643 16.711 681 H SER 533 H SER 533 10.024 9.754 7.916 682 HA SER 533 HA SER 533 11.342 12.171 8.272 683 HB2 SER 533 2HB SER 533 12.358 10.203 7.198 684 HB3 SER 533 1HB SER 533 11.268 10.380 5.831 685 HG SER 533 HG SER 533 13.457 11.915 6.617 686 H THR 534 H THR 534 8.688 11.323 6.148 687 HA THR 534 HA THR 534 7.449 12.420 4.663 688 HB THR 534 HB THR 534 6.693 14.748 5.228 689 HG1 THR 534 1HG THR 534 8.935 14.795 6.652 690 HG21 THR 534 3HG2 THR 534 6.689 12.791 7.525 691 HG22 THR 534 1HG2 THR 534 5.540 12.835 6.188 692 HG23 THR 534 2HG2 THR 534 5.587 14.156 7.355 693 H LYS 535 H LYS 535 8.417 12.356 2.775 694 HA LYS 535 HA LYS 535 10.746 13.739 2.076 695 HB2 LYS 535 2HB LYS 535 8.622 12.580 0.264 696 HB3 LYS 535 1HB LYS 535 10.230 13.073 -0.248 697 HG2 LYS 535 2HG LYS 535 11.214 11.386 1.245 698 HG3 LYS 535 1HG LYS 535 9.595 10.881 1.716 699 HD2 LYS 535 2HD LYS 535 9.108 10.238 -0.587 700 HD3 LYS 535 1HD LYS 535 10.700 10.800 -1.096 701 HE2 LYS 535 2HE LYS 535 11.731 9.126 0.413 702 HE3 LYS 535 1HE LYS 535 10.125 8.546 0.837 703 HZ1 LYS 535 3HZ LYS 535 11.324 8.503 -1.877 704 HZ2 LYS 535 1HZ LYS 535 9.802 7.876 -1.496 705 HZ3 LYS 535 2HZ LYS 535 11.203 7.188 -0.864 706 H MET 536 H MET 536 7.443 14.649 1.806 707 HA MET 536 HA MET 536 6.341 16.621 1.439 708 HB2 MET 536 2HB MET 536 7.975 17.331 3.244 709 HB3 MET 536 1HB MET 536 9.005 17.933 1.950 710 HG2 MET 536 2HG MET 536 7.349 19.555 1.306 711 HG3 MET 536 1HG MET 536 6.206 18.907 2.479 712 HE1 MET 536 3HE MET 536 9.600 20.788 1.970 713 HE2 MET 536 1HE MET 536 10.077 19.454 3.018 714 HE3 MET 536 2HE MET 536 10.101 21.105 3.630 715 H GLU 537 H GLU 537 7.610 15.299 -0.745 716 HA GLU 537 HA GLU 537 8.427 17.267 -2.598 717 HB2 GLU 537 2HB GLU 537 7.932 15.084 -4.151 718 HB3 GLU 537 1HB GLU 537 9.444 15.401 -3.315 719 HG2 GLU 537 2HG GLU 537 8.618 13.070 -3.031 720 HG3 GLU 537 1HG GLU 537 8.841 13.939 -1.523 721 H GLY 538 H GLY 538 5.451 15.323 -2.285 722 HA2 GLY 538 2HA GLY 538 3.603 17.246 -2.792 723 HA3 GLY 538 1HA GLY 538 4.072 16.764 -4.406 724 H THR 539 H THR 539 3.935 14.438 -4.903 725 HA THR 539 HA THR 539 1.648 13.305 -3.503 726 HB THR 539 HB THR 539 1.599 11.839 -5.578 727 HG1 THR 539 1HG THR 539 2.226 13.754 -7.301 728 HG21 THR 539 3HG2 THR 539 0.058 13.360 -6.713 729 HG22 THR 539 1HG2 THR 539 0.620 14.702 -5.690 730 HG23 THR 539 2HG2 THR 539 -0.211 13.305 -4.982 731 H VAL 540 H VAL 540 1.931 11.617 -2.384 732 HA VAL 540 HA VAL 540 4.303 9.979 -2.836 733 HB VAL 540 HB VAL 540 2.492 10.194 -0.410 734 HG11 VAL 540 1HG1 VAL 540 3.338 7.920 -0.752 735 HG12 VAL 540 2HG1 VAL 540 4.083 8.667 0.668 736 HG13 VAL 540 3HG1 VAL 540 4.979 8.549 -0.851 737 HG21 VAL 540 3HG2 VAL 540 4.404 11.184 0.665 738 HG22 VAL 540 1HG2 VAL 540 4.017 12.054 -0.821 739 HG23 VAL 540 2HG2 VAL 540 5.378 10.934 -0.796 740 H SER 541 H SER 541 4.000 8.186 -3.866 741 HA SER 541 HA SER 541 1.327 7.155 -4.188 742 HB2 SER 541 2HB SER 541 2.787 7.470 -6.183 743 HB3 SER 541 1HB SER 541 3.934 6.331 -5.484 744 HG SER 541 HG SER 541 2.851 4.884 -6.423 745 H LEU 542 H LEU 542 0.647 5.817 -2.803 746 HA LEU 542 HA LEU 542 2.468 4.051 -1.339 747 HB2 LEU 542 2HB LEU 542 -0.350 4.922 -0.776 748 HB3 LEU 542 1HB LEU 542 0.649 3.925 0.258 749 HG LEU 542 HG LEU 542 1.282 6.788 -0.443 750 HD11 LEU 542 1HD1 LEU 542 0.076 5.590 2.019 751 HD12 LEU 542 2HD1 LEU 542 -0.762 6.608 0.832 752 HD13 LEU 542 3HD1 LEU 542 0.560 7.275 1.805 753 HD21 LEU 542 3HD2 LEU 542 2.412 4.965 1.675 754 HD22 LEU 542 1HD2 LEU 542 2.874 6.633 1.355 755 HD23 LEU 542 2HD2 LEU 542 3.199 5.372 0.156 756 H LEU 543 H LEU 543 2.446 2.067 -2.138 757 HA LEU 543 HA LEU 543 0.027 1.139 -3.501 758 HB2 LEU 543 2HB LEU 543 2.605 0.909 -4.334 759 HB3 LEU 543 1HB LEU 543 2.557 -0.396 -3.223 760 HG LEU 543 HG LEU 543 0.617 -0.283 -5.533 761 HD11 LEU 543 1HD1 LEU 543 3.214 -1.777 -5.333 762 HD12 LEU 543 2HD1 LEU 543 2.859 -0.425 -6.411 763 HD13 LEU 543 3HD1 LEU 543 2.013 -1.961 -6.609 764 HD21 LEU 543 3HD2 LEU 543 0.327 -2.652 -5.076 765 HD22 LEU 543 1HD2 LEU 543 -0.120 -1.686 -3.669 766 HD23 LEU 543 2HD2 LEU 543 1.426 -2.536 -3.697 767 H VAL 544 H VAL 544 -1.343 0.020 -2.280 768 HA VAL 544 HA VAL 544 -0.298 -1.298 0.130 769 HB VAL 544 HB VAL 544 -2.321 -0.856 1.319 770 HG11 VAL 544 1HG1 VAL 544 -1.220 1.661 0.126 771 HG12 VAL 544 2HG1 VAL 544 -0.674 0.784 1.569 772 HG13 VAL 544 3HG1 VAL 544 -2.258 1.541 1.566 773 HG21 VAL 544 3HG2 VAL 544 -3.889 -0.959 -0.472 774 HG22 VAL 544 1HG2 VAL 544 -3.303 0.566 -1.146 775 HG23 VAL 544 2HG2 VAL 544 -4.120 0.545 0.432 776 H PHE 545 H PHE 545 -1.591 -2.974 0.927 777 HA PHE 545 HA PHE 545 -2.965 -4.558 -1.153 778 HB2 PHE 545 2HB PHE 545 -0.844 -5.435 -0.310 779 HB3 PHE 545 1HB PHE 545 -1.433 -5.334 1.333 780 HD1 PHE 545 1HD PHE 545 -1.686 -7.059 -1.866 781 HD2 PHE 545 2HD PHE 545 -2.781 -7.093 2.227 782 HE1 PHE 545 1HE PHE 545 -2.371 -9.389 -2.084 783 HE2 PHE 545 2HE PHE 545 -3.480 -9.440 2.030 784 HZ PHE 545 HZ PHE 545 -3.271 -10.602 -0.127 785 H ARG 546 H ARG 546 -5.086 -4.434 -0.810 786 HA ARG 546 HA ARG 546 -6.133 -3.925 1.884 787 HB2 ARG 546 2HB ARG 546 -6.893 -2.610 -0.259 788 HB3 ARG 546 1HB ARG 546 -7.775 -4.070 -0.670 789 HG2 ARG 546 2HG ARG 546 -8.182 -2.417 1.832 790 HG3 ARG 546 1HG ARG 546 -9.188 -2.350 0.399 791 HD2 ARG 546 2HD ARG 546 -9.946 -4.614 0.772 792 HD3 ARG 546 1HD ARG 546 -8.796 -4.822 2.094 793 HE ARG 546 HE ARG 546 -10.384 -2.621 2.676 794 HH11 ARG 546 1HH1 ARG 546 -10.919 -6.120 2.282 795 HH12 ARG 546 2HH1 ARG 546 -12.132 -6.164 3.479 796 HH21 ARG 546 1HH2 ARG 546 -12.006 -2.738 4.283 797 HH22 ARG 546 2HH2 ARG 546 -12.764 -4.208 4.674 798 H GLN 547 H GLN 547 -7.138 -5.548 2.929 799 HA GLN 547 HA GLN 547 -7.192 -8.119 1.524 800 HB2 GLN 547 2HB GLN 547 -5.964 -9.011 3.500 801 HB3 GLN 547 1HB GLN 547 -5.052 -7.921 2.451 802 HG2 GLN 547 2HG GLN 547 -5.730 -6.066 4.024 803 HG3 GLN 547 1HG GLN 547 -6.248 -7.325 5.132 804 HE21 GLN 547 1HE2 GLN 547 -4.273 -5.305 5.415 805 HE22 GLN 547 2HE2 GLN 547 -2.784 -6.098 5.707 806 H GLU 548 H GLU 548 -8.836 -9.355 2.024 807 HA GLU 548 HA GLU 548 -10.553 -8.563 4.209 808 HB2 GLU 548 2HB GLU 548 -10.950 -10.621 2.041 809 HB3 GLU 548 1HB GLU 548 -12.057 -10.419 3.385 810 HG2 GLU 548 2HG GLU 548 -13.008 -9.289 1.553 811 HG3 GLU 548 1HG GLU 548 -12.390 -8.056 2.629 812 H GLU 549 H GLU 549 -11.151 -9.896 5.836 813 HA GLU 549 HA GLU 549 -10.917 -11.253 7.509 814 HB2 GLU 549 2HB GLU 549 -10.210 -13.127 5.313 815 HB3 GLU 549 1HB GLU 549 -10.099 -13.674 6.984 816 HG2 GLU 549 2HG GLU 549 -12.270 -14.227 5.959 817 HG3 GLU 549 1HG GLU 549 -12.424 -13.187 7.362 818 H ALA 550 H ALA 550 -8.425 -9.820 6.420 819 HA ALA 550 HA ALA 550 -6.549 -10.991 8.288 820 HB1 ALA 550 1HB ALA 550 -5.140 -9.039 7.724 821 HB2 ALA 550 2HB ALA 550 -6.473 -8.383 6.777 822 HB3 ALA 550 3HB ALA 550 -5.683 -9.875 6.263 823 H PHE 551 H PHE 551 -6.756 -10.582 10.369 824 HA PHE 551 HA PHE 551 -8.742 -8.625 11.086 825 HB2 PHE 551 2HB PHE 551 -7.529 -10.854 12.692 826 HB3 PHE 551 1HB PHE 551 -8.694 -9.702 13.333 827 HD1 PHE 551 1HD PHE 551 -10.993 -9.638 12.391 828 HD2 PHE 551 2HD PHE 551 -8.221 -12.697 11.363 829 HE1 PHE 551 1HE PHE 551 -12.843 -11.032 11.576 830 HE2 PHE 551 2HE PHE 551 -10.069 -14.098 10.543 831 HZ PHE 551 HZ PHE 551 -12.382 -13.267 10.647 832 H HIS 552 H HIS 552 -8.196 -6.738 11.513 833 HA HIS 552 HA HIS 552 -5.928 -6.275 13.275 834 HB2 HIS 552 2HB HIS 552 -5.669 -4.995 11.197 835 HB3 HIS 552 1HB HIS 552 -7.319 -4.397 11.328 836 HD1 HIS 552 1HD HIS 552 -7.410 -2.088 12.111 837 HD2 HIS 552 2HD HIS 552 -4.133 -4.083 13.674 838 HE1 HIS 552 1HE HIS 552 -6.229 -0.401 13.567 839 HE2 HIS 552 2HE HIS 552 -4.514 -1.808 14.776 840 HA PRO 553 HA PRO 553 -9.430 -6.022 16.015 841 HB2 PRO 553 2HB PRO 553 -7.963 -5.309 18.255 842 HB3 PRO 553 1HB PRO 553 -8.257 -6.967 17.730 843 HG2 PRO 553 2HG PRO 553 -5.846 -5.270 17.366 844 HG3 PRO 553 1HG PRO 553 -5.960 -7.013 17.608 845 HD2 PRO 553 2HD PRO 553 -5.457 -5.879 15.201 846 HD3 PRO 553 1HD PRO 553 -6.291 -7.436 15.376 847 H ARG 554 H ARG 554 -10.753 -4.493 16.042 848 HA ARG 554 HA ARG 554 -9.981 -1.825 16.789 849 HB2 ARG 554 2HB ARG 554 -11.128 -0.913 14.758 850 HB3 ARG 554 1HB ARG 554 -9.604 -1.727 14.443 851 HG2 ARG 554 2HG ARG 554 -10.914 -3.761 13.795 852 HG3 ARG 554 1HG ARG 554 -12.380 -2.788 13.932 853 HD2 ARG 554 2HD ARG 554 -11.500 -1.230 12.282 854 HD3 ARG 554 1HD ARG 554 -10.020 -2.212 12.231 855 HE ARG 554 HE ARG 554 -11.853 -4.001 11.564 856 HH11 ARG 554 1HH1 ARG 554 -11.248 -0.734 10.318 857 HH12 ARG 554 2HH1 ARG 554 -11.841 -1.073 8.748 858 HH21 ARG 554 1HH2 ARG 554 -12.646 -4.461 9.319 859 HH22 ARG 554 2HH2 ARG 554 -12.625 -3.192 8.187 860 H GLU 555 H GLU 555 -11.670 -0.681 17.604 861 HA GLU 555 HA GLU 555 -13.827 -2.304 18.571 862 HB2 GLU 555 2HB GLU 555 -12.606 -0.772 20.039 863 HB3 GLU 555 1HB GLU 555 -13.155 0.590 19.072 864 HG2 GLU 555 2HG GLU 555 -15.461 0.026 19.672 865 HG3 GLU 555 1HG GLU 555 -14.842 -1.277 20.690 866 H MET 556 H MET 556 -15.331 -2.670 17.016 867 HA MET 556 HA MET 556 -17.033 -0.531 16.303 868 HB2 MET 556 2HB MET 556 -16.860 -0.773 13.847 869 HB3 MET 556 1HB MET 556 -15.367 -0.177 14.538 870 HG2 MET 556 2HG MET 556 -14.762 -1.701 12.839 871 HG3 MET 556 1HG MET 556 -14.489 -2.539 14.358 872 HE1 MET 556 3HE MET 556 -14.313 -4.848 13.047 873 HE2 MET 556 1HE MET 556 -14.573 -3.998 11.523 874 HE3 MET 556 2HE MET 556 -15.529 -5.428 11.911 875 H ASN 557 H ASN 557 -18.992 -1.272 15.461 876 HA ASN 557 HA ASN 557 -19.353 -4.032 14.885 877 HB2 ASN 557 2HB ASN 557 -19.499 -4.116 17.350 878 HB3 ASN 557 1HB ASN 557 -20.730 -2.862 17.318 879 HD21 ASN 557 1HD2 ASN 557 -20.603 -5.577 15.006 880 HD22 ASN 557 2HD2 ASN 557 -22.041 -6.307 15.604 881 H ALA 558 H ALA 558 -19.809 -2.993 12.963 882 HA ALA 558 HA ALA 558 -22.539 -2.539 12.483 883 HB1 ALA 558 1HB ALA 558 -20.632 -0.203 12.165 884 HB2 ALA 558 2HB ALA 558 -21.983 -0.279 13.293 885 HB3 ALA 558 3HB ALA 558 -22.284 -0.258 11.554 Start of MODEL 18 1 H1 GLY 448 1HT GLY 448 -23.092 -4.101 -23.456 2 H2 GLY 448 2HT GLY 448 -21.478 -4.618 -23.620 3 H3 GLY 448 3HT GLY 448 -21.813 -3.025 -23.200 4 HA2 GLY 448 1HA GLY 448 -22.690 -3.707 -21.107 5 HA3 GLY 448 2HA GLY 448 -22.457 -5.390 -21.572 6 H SER 449 H SER 449 -21.281 -3.569 -19.412 7 HA SER 449 HA SER 449 -18.501 -3.558 -20.134 8 HB2 SER 449 2HB SER 449 -18.251 -2.590 -17.827 9 HB3 SER 449 1HB SER 449 -19.289 -1.649 -18.905 10 HG SER 449 HG SER 449 -20.306 -3.614 -17.161 11 H VAL 450 H VAL 450 -17.737 -5.574 -20.208 12 HA VAL 450 HA VAL 450 -18.255 -7.345 -17.932 13 HB VAL 450 HB VAL 450 -17.518 -9.227 -19.342 14 HG11 VAL 450 1HG1 VAL 450 -19.423 -9.251 -20.883 15 HG12 VAL 450 2HG1 VAL 450 -19.658 -7.528 -20.600 16 HG13 VAL 450 3HG1 VAL 450 -19.867 -8.671 -19.273 17 HG21 VAL 450 3HG2 VAL 450 -17.182 -8.917 -21.762 18 HG22 VAL 450 1HG2 VAL 450 -15.964 -8.049 -20.823 19 HG23 VAL 450 2HG2 VAL 450 -17.312 -7.173 -21.547 20 H TYR 451 H TYR 451 -15.706 -5.647 -19.598 21 HA TYR 451 HA TYR 451 -13.743 -7.250 -18.257 22 HB2 TYR 451 2HB TYR 451 -13.343 -4.940 -20.150 23 HB3 TYR 451 1HB TYR 451 -12.028 -5.839 -19.397 24 HD1 TYR 451 1HD TYR 451 -12.114 -8.445 -19.782 25 HD2 TYR 451 2HD TYR 451 -14.102 -5.597 -22.235 26 HE1 TYR 451 1HE TYR 451 -12.208 -10.091 -21.604 27 HE2 TYR 451 2HE TYR 451 -14.206 -7.233 -24.061 28 HH TYR 451 HH TYR 451 -13.023 -9.245 -24.790 29 H ASN 452 H ASN 452 -14.430 -6.790 -16.241 30 HA ASN 452 HA ASN 452 -12.834 -4.714 -14.999 31 HB2 ASN 452 2HB ASN 452 -15.759 -5.179 -14.270 32 HB3 ASN 452 1HB ASN 452 -14.640 -4.186 -13.360 33 HD21 ASN 452 1HD2 ASN 452 -16.641 -4.405 -16.134 34 HD22 ASN 452 2HD2 ASN 452 -16.499 -2.743 -16.627 35 H THR 453 H THR 453 -11.605 -5.812 -13.648 36 HA THR 453 HA THR 453 -12.500 -8.493 -13.082 37 HB THR 453 HB THR 453 -10.420 -8.467 -14.184 38 HG1 THR 453 1HG THR 453 -9.427 -9.823 -12.953 39 HG21 THR 453 3HG2 THR 453 -8.408 -7.326 -13.345 40 HG22 THR 453 1HG2 THR 453 -9.354 -6.628 -12.032 41 HG23 THR 453 2HG2 THR 453 -9.700 -6.186 -13.706 42 H LYS 454 H LYS 454 -13.467 -8.878 -11.321 43 HA LYS 454 HA LYS 454 -13.258 -7.257 -8.979 44 HB2 LYS 454 2HB LYS 454 -15.380 -8.295 -9.637 45 HB3 LYS 454 1HB LYS 454 -14.652 -9.886 -9.527 46 HG2 LYS 454 2HG LYS 454 -16.045 -9.493 -7.608 47 HG3 LYS 454 1HG LYS 454 -14.352 -9.548 -7.109 48 HD2 LYS 454 2HD LYS 454 -14.298 -7.108 -7.038 49 HD3 LYS 454 1HD LYS 454 -15.982 -7.052 -7.560 50 HE2 LYS 454 2HE LYS 454 -16.630 -8.297 -5.543 51 HE3 LYS 454 1HE LYS 454 -14.949 -8.307 -5.022 52 HZ1 LYS 454 3HZ LYS 454 -15.000 -5.908 -4.935 53 HZ2 LYS 454 1HZ LYS 454 -16.131 -6.569 -3.920 54 HZ3 LYS 454 2HZ LYS 454 -16.637 -5.887 -5.386 55 H LYS 455 H LYS 455 -11.356 -7.425 -7.940 56 HA LYS 455 HA LYS 455 -10.246 -10.108 -7.528 57 HB2 LYS 455 2HB LYS 455 -8.818 -7.453 -7.673 58 HB3 LYS 455 1HB LYS 455 -8.060 -8.968 -7.207 59 HG2 LYS 455 2HG LYS 455 -8.529 -9.880 -9.418 60 HG3 LYS 455 1HG LYS 455 -9.327 -8.375 -9.873 61 HD2 LYS 455 2HD LYS 455 -7.259 -7.152 -9.593 62 HD3 LYS 455 1HD LYS 455 -6.442 -8.609 -9.021 63 HE2 LYS 455 2HE LYS 455 -6.819 -9.672 -11.181 64 HE3 LYS 455 1HE LYS 455 -7.666 -8.242 -11.750 65 HZ1 LYS 455 3HZ LYS 455 -4.795 -8.331 -10.957 66 HZ2 LYS 455 1HZ LYS 455 -5.610 -6.983 -11.539 67 HZ3 LYS 455 2HZ LYS 455 -5.374 -8.295 -12.536 68 H VAL 456 H VAL 456 -9.701 -10.735 -5.551 69 HA VAL 456 HA VAL 456 -10.088 -8.856 -3.355 70 HB VAL 456 HB VAL 456 -10.744 -10.793 -1.925 71 HG11 VAL 456 1HG1 VAL 456 -12.950 -11.245 -2.862 72 HG12 VAL 456 2HG1 VAL 456 -12.421 -10.588 -4.409 73 HG13 VAL 456 3HG1 VAL 456 -12.514 -9.540 -2.996 74 HG21 VAL 456 3HG2 VAL 456 -11.241 -12.989 -2.925 75 HG22 VAL 456 1HG2 VAL 456 -9.534 -12.578 -3.099 76 HG23 VAL 456 2HG2 VAL 456 -10.625 -12.417 -4.476 77 H GLY 457 H GLY 457 -8.388 -8.864 -1.785 78 HA2 GLY 457 2HA GLY 457 -6.216 -9.208 -1.101 79 HA3 GLY 457 1HA GLY 457 -6.236 -10.734 -1.996 80 H LYS 458 H LYS 458 -6.652 -7.383 -2.887 81 HA LYS 458 HA LYS 458 -4.792 -7.780 -5.115 82 HB2 LYS 458 2HB LYS 458 -6.088 -6.072 -6.317 83 HB3 LYS 458 1HB LYS 458 -7.088 -7.444 -5.869 84 HG2 LYS 458 2HG LYS 458 -7.990 -6.158 -3.984 85 HG3 LYS 458 1HG LYS 458 -6.995 -4.781 -4.467 86 HD2 LYS 458 2HD LYS 458 -8.173 -4.742 -6.642 87 HD3 LYS 458 1HD LYS 458 -9.182 -6.077 -6.094 88 HE2 LYS 458 2HE LYS 458 -10.007 -4.683 -4.240 89 HE3 LYS 458 1HE LYS 458 -9.013 -3.355 -4.822 90 HZ1 LYS 458 3HZ LYS 458 -11.277 -4.609 -6.289 91 HZ2 LYS 458 1HZ LYS 458 -10.297 -3.405 -6.909 92 HZ3 LYS 458 2HZ LYS 458 -11.272 -3.091 -5.577 93 H ARG 459 H ARG 459 -3.754 -5.715 -5.844 94 HA ARG 459 HA ARG 459 -2.983 -4.203 -3.467 95 HB2 ARG 459 2HB ARG 459 -1.404 -4.588 -6.035 96 HB3 ARG 459 1HB ARG 459 -0.888 -3.638 -4.663 97 HG2 ARG 459 2HG ARG 459 0.343 -5.661 -4.441 98 HG3 ARG 459 1HG ARG 459 -1.000 -5.793 -3.339 99 HD2 ARG 459 2HD ARG 459 -2.237 -7.205 -4.826 100 HD3 ARG 459 1HD ARG 459 -1.056 -6.972 -6.113 101 HE ARG 459 HE ARG 459 0.175 -8.047 -3.802 102 HH11 ARG 459 1HH1 ARG 459 -1.936 -9.060 -6.482 103 HH12 ARG 459 2HH1 ARG 459 -1.381 -10.661 -6.476 104 HH21 ARG 459 1HH2 ARG 459 0.901 -10.216 -3.804 105 HH22 ARG 459 2HH2 ARG 459 0.273 -11.359 -4.906 106 H LEU 460 H LEU 460 -3.411 -2.133 -3.431 107 HA LEU 460 HA LEU 460 -4.552 -0.935 -5.870 108 HB2 LEU 460 2HB LEU 460 -5.092 -0.153 -2.999 109 HB3 LEU 460 1HB LEU 460 -5.767 0.625 -4.396 110 HG LEU 460 HG LEU 460 -6.972 -1.553 -4.908 111 HD11 LEU 460 1HD1 LEU 460 -6.120 -2.249 -2.108 112 HD12 LEU 460 2HD1 LEU 460 -5.635 -3.080 -3.586 113 HD13 LEU 460 3HD1 LEU 460 -7.321 -3.115 -3.067 114 HD21 LEU 460 3HD2 LEU 460 -7.617 -0.144 -2.324 115 HD22 LEU 460 1HD2 LEU 460 -8.729 -1.146 -3.256 116 HD23 LEU 460 2HD2 LEU 460 -8.110 0.358 -3.944 117 H ASN 461 H ASN 461 -3.785 0.971 -6.551 118 HA ASN 461 HA ASN 461 -1.509 2.063 -5.076 119 HB2 ASN 461 2HB ASN 461 -0.828 3.179 -7.189 120 HB3 ASN 461 1HB ASN 461 -0.932 1.441 -7.385 121 HD21 ASN 461 1HD2 ASN 461 -2.154 4.502 -8.366 122 HD22 ASN 461 2HD2 ASN 461 -3.207 3.938 -9.610 123 H ILE 462 H ILE 462 -1.827 3.781 -3.950 124 HA ILE 462 HA ILE 462 -4.075 5.553 -4.652 125 HB ILE 462 HB ILE 462 -3.080 4.833 -1.869 126 HG12 ILE 462 2HG1 ILE 462 -5.702 4.080 -3.170 127 HG13 ILE 462 1HG1 ILE 462 -4.324 2.973 -3.052 128 HG21 ILE 462 1HG2 ILE 462 -3.987 7.110 -2.033 129 HG22 ILE 462 2HG2 ILE 462 -5.056 6.069 -1.092 130 HG23 ILE 462 3HG2 ILE 462 -5.460 6.470 -2.757 131 HD11 ILE 462 3HD1 ILE 462 -5.982 2.529 -1.353 132 HD12 ILE 462 1HD1 ILE 462 -5.899 4.202 -0.806 133 HD13 ILE 462 2HD1 ILE 462 -4.504 3.140 -0.603 134 H GLN 463 H GLN 463 -3.339 7.531 -5.159 135 HA GLN 463 HA GLN 463 -0.721 8.369 -4.173 136 HB2 GLN 463 2HB GLN 463 -2.515 9.634 -6.240 137 HB3 GLN 463 1HB GLN 463 -0.981 10.301 -5.716 138 HG2 GLN 463 2HG GLN 463 0.168 8.355 -6.541 139 HG3 GLN 463 1HG GLN 463 -1.368 7.653 -7.089 140 HE21 GLN 463 1HE2 GLN 463 1.065 10.047 -7.633 141 HE22 GLN 463 2HE2 GLN 463 0.529 10.552 -9.182 142 H LEU 464 H LEU 464 -0.482 9.742 -2.644 143 HA LEU 464 HA LEU 464 -2.804 11.331 -1.788 144 HB2 LEU 464 2HB LEU 464 -0.480 10.248 -0.205 145 HB3 LEU 464 1HB LEU 464 -1.551 11.444 0.456 146 HG LEU 464 HG LEU 464 -3.422 9.760 0.197 147 HD11 LEU 464 1HD1 LEU 464 -2.847 7.426 0.000 148 HD12 LEU 464 2HD1 LEU 464 -1.153 7.849 -0.289 149 HD13 LEU 464 3HD1 LEU 464 -2.387 8.321 -1.455 150 HD21 LEU 464 3HD2 LEU 464 -2.766 8.490 2.150 151 HD22 LEU 464 1HD2 LEU 464 -2.416 10.202 2.317 152 HD23 LEU 464 2HD2 LEU 464 -1.103 9.067 1.973 153 H LYS 465 H LYS 465 -2.541 13.470 -1.674 154 HA LYS 465 HA LYS 465 0.062 14.582 -2.518 155 HB2 LYS 465 2HB LYS 465 -1.190 16.560 -3.193 156 HB3 LYS 465 1HB LYS 465 -1.796 15.093 -3.966 157 HG2 LYS 465 2HG LYS 465 -3.629 15.001 -2.417 158 HG3 LYS 465 1HG LYS 465 -2.908 16.361 -1.551 159 HD2 LYS 465 2HD LYS 465 -4.827 17.103 -2.936 160 HD3 LYS 465 1HD LYS 465 -3.315 17.824 -3.469 161 HE2 LYS 465 2HE LYS 465 -3.167 16.173 -5.278 162 HE3 LYS 465 1HE LYS 465 -4.672 15.437 -4.729 163 HZ1 LYS 465 3HZ LYS 465 -4.355 18.213 -5.722 164 HZ2 LYS 465 1HZ LYS 465 -5.804 17.532 -5.191 165 HZ3 LYS 465 2HZ LYS 465 -5.056 16.941 -6.579 166 H LYS 466 H LYS 466 0.950 16.196 -1.409 167 HA LYS 466 HA LYS 466 0.579 15.905 1.399 168 HB2 LYS 466 2HB LYS 466 2.665 16.624 -0.271 169 HB3 LYS 466 1HB LYS 466 2.320 18.074 0.657 170 HG2 LYS 466 2HG LYS 466 4.051 16.632 1.680 171 HG3 LYS 466 1HG LYS 466 2.661 16.919 2.727 172 HD2 LYS 466 2HD LYS 466 3.522 14.544 2.679 173 HD3 LYS 466 1HD LYS 466 1.809 14.695 2.347 174 HE2 LYS 466 2HE LYS 466 2.877 13.104 0.805 175 HE3 LYS 466 1HE LYS 466 2.276 14.495 -0.078 176 HZ1 LYS 466 3HZ LYS 466 4.466 15.383 -0.165 177 HZ2 LYS 466 1HZ LYS 466 4.449 13.809 -0.772 178 HZ3 LYS 466 2HZ LYS 466 5.107 14.120 0.752 179 H GLY 467 H GLY 467 -0.743 16.909 2.618 180 HA2 GLY 467 2HA GLY 467 -1.656 19.582 1.864 181 HA3 GLY 467 1HA GLY 467 -2.503 18.477 2.949 182 H THR 468 H THR 468 -2.432 20.437 4.394 183 HA THR 468 HA THR 468 0.149 21.072 5.443 184 HB THR 468 HB THR 468 -1.638 22.821 5.391 185 HG1 THR 468 1HG THR 468 -0.971 22.268 8.098 186 HG21 THR 468 3HG2 THR 468 -3.459 22.779 7.055 187 HG22 THR 468 1HG2 THR 468 -2.945 21.169 7.561 188 HG23 THR 468 2HG2 THR 468 -3.584 21.422 5.940 189 H GLU 469 H GLU 469 -2.312 18.669 6.123 190 HA GLU 469 HA GLU 469 -1.324 18.150 8.759 191 HB2 GLU 469 2HB GLU 469 -3.154 16.399 7.126 192 HB3 GLU 469 1HB GLU 469 -3.046 16.529 8.870 193 HG2 GLU 469 2HG GLU 469 -4.999 17.644 8.501 194 HG3 GLU 469 1HG GLU 469 -3.872 18.991 8.411 195 H GLY 470 H GLY 470 -0.333 17.593 5.676 196 HA2 GLY 470 2HA GLY 470 1.464 16.333 4.938 197 HA3 GLY 470 1HA GLY 470 1.407 15.408 6.441 198 H LEU 471 H LEU 471 1.070 13.388 5.979 199 HA LEU 471 HA LEU 471 -0.649 12.647 3.767 200 HB2 LEU 471 2HB LEU 471 1.001 10.985 5.658 201 HB3 LEU 471 1HB LEU 471 -0.033 10.324 4.407 202 HG LEU 471 HG LEU 471 2.376 12.092 3.921 203 HD11 LEU 471 1HD1 LEU 471 3.421 10.096 3.042 204 HD12 LEU 471 2HD1 LEU 471 2.001 9.135 3.445 205 HD13 LEU 471 3HD1 LEU 471 2.978 9.851 4.728 206 HD21 LEU 471 3HD2 LEU 471 2.036 11.430 1.575 207 HD22 LEU 471 1HD2 LEU 471 0.696 12.397 2.192 208 HD23 LEU 471 2HD2 LEU 471 0.533 10.645 2.024 209 H GLY 472 H GLY 472 -0.562 12.520 7.252 210 HA2 GLY 472 2HA GLY 472 -2.379 12.625 8.672 211 HA3 GLY 472 1HA GLY 472 -3.436 12.496 7.282 212 H PHE 473 H PHE 473 -0.941 10.078 7.894 213 HA PHE 473 HA PHE 473 -2.784 8.476 9.399 214 HB2 PHE 473 2HB PHE 473 -2.878 6.560 7.936 215 HB3 PHE 473 1HB PHE 473 -3.444 7.956 7.040 216 HD1 PHE 473 1HD PHE 473 -1.628 9.111 5.547 217 HD2 PHE 473 2HD PHE 473 -1.356 5.118 6.998 218 HE1 PHE 473 1HE PHE 473 -0.027 8.539 3.763 219 HE2 PHE 473 2HE PHE 473 0.234 4.583 5.243 220 HZ PHE 473 HZ PHE 473 0.884 6.315 3.620 221 H SER 474 H SER 474 -1.820 6.548 10.198 222 HA SER 474 HA SER 474 1.111 6.738 10.294 223 HB2 SER 474 2HB SER 474 -0.805 5.846 12.463 224 HB3 SER 474 1HB SER 474 0.953 5.883 12.605 225 HG SER 474 HG SER 474 0.088 8.240 11.752 226 H ILE 475 H ILE 475 2.152 4.609 10.700 227 HA ILE 475 HA ILE 475 0.563 2.367 9.657 228 HB ILE 475 HB ILE 475 2.673 1.472 8.806 229 HG12 ILE 475 2HG1 ILE 475 3.761 4.226 9.331 230 HG13 ILE 475 1HG1 ILE 475 4.127 2.712 10.179 231 HG21 ILE 475 1HG2 ILE 475 1.118 2.467 7.294 232 HG22 ILE 475 2HG2 ILE 475 2.764 2.760 6.775 233 HG23 ILE 475 3HG2 ILE 475 1.834 4.072 7.529 234 HD11 ILE 475 3HD1 ILE 475 5.881 3.396 8.484 235 HD12 ILE 475 1HD1 ILE 475 4.651 3.181 7.248 236 HD13 ILE 475 2HD1 ILE 475 5.174 1.805 8.201 237 H THR 476 H THR 476 0.946 0.401 10.631 238 HA THR 476 HA THR 476 2.678 0.307 12.988 239 HB THR 476 HB THR 476 0.292 0.519 13.751 240 HG1 THR 476 1HG THR 476 1.851 -0.888 14.865 241 HG21 THR 476 3HG2 THR 476 -0.810 -0.495 11.791 242 HG22 THR 476 1HG2 THR 476 -1.318 -1.285 13.284 243 HG23 THR 476 2HG2 THR 476 -0.141 -2.066 12.232 244 H SER 477 H SER 477 3.297 -1.986 13.454 245 HA SER 477 HA SER 477 3.109 -3.605 11.036 246 HB2 SER 477 2HB SER 477 5.335 -2.599 11.121 247 HB3 SER 477 1HB SER 477 5.547 -3.165 12.752 248 HG SER 477 HG SER 477 5.110 -4.831 10.504 249 H ARG 478 H ARG 478 2.892 -5.758 11.362 250 HA ARG 478 HA ARG 478 2.488 -6.595 14.129 251 HB2 ARG 478 2HB ARG 478 1.414 -7.781 11.550 252 HB3 ARG 478 1HB ARG 478 1.097 -8.411 13.162 253 HG2 ARG 478 2HG ARG 478 -0.065 -6.359 13.758 254 HG3 ARG 478 1HG ARG 478 0.287 -5.685 12.171 255 HD2 ARG 478 2HD ARG 478 -1.983 -6.508 12.238 256 HD3 ARG 478 1HD ARG 478 -1.021 -7.489 11.140 257 HE ARG 478 HE ARG 478 -1.035 -8.652 13.706 258 HH11 ARG 478 1HH1 ARG 478 -3.154 -8.162 10.881 259 HH12 ARG 478 2HH1 ARG 478 -4.103 -9.517 11.227 260 HH21 ARG 478 1HH2 ARG 478 -2.387 -10.541 14.121 261 HH22 ARG 478 2HH2 ARG 478 -3.668 -10.873 13.047 262 H ASP 479 H ASP 479 3.886 -8.013 14.885 263 HA ASP 479 HA ASP 479 6.125 -8.582 13.190 264 HB2 ASP 479 2HB ASP 479 6.514 -7.697 15.428 265 HB3 ASP 479 1HB ASP 479 5.732 -9.110 16.126 266 H VAL 480 H VAL 480 5.842 -10.227 11.875 267 HA VAL 480 HA VAL 480 5.478 -12.864 13.040 268 HB VAL 480 HB VAL 480 4.033 -13.598 11.137 269 HG11 VAL 480 1HG1 VAL 480 2.816 -11.404 12.802 270 HG12 VAL 480 2HG1 VAL 480 2.999 -13.099 13.266 271 HG13 VAL 480 3HG1 VAL 480 1.938 -12.664 11.930 272 HG21 VAL 480 3HG2 VAL 480 2.830 -11.917 9.794 273 HG22 VAL 480 1HG2 VAL 480 4.573 -11.858 9.524 274 HG23 VAL 480 2HG2 VAL 480 3.799 -10.649 10.545 275 H THR 481 H THR 481 6.468 -14.525 11.843 276 HA THR 481 HA THR 481 8.496 -13.524 10.081 277 HB THR 481 HB THR 481 9.405 -15.926 10.377 278 HG1 THR 481 1HG THR 481 8.194 -16.211 12.779 279 HG21 THR 481 3HG2 THR 481 10.379 -15.370 12.573 280 HG22 THR 481 1HG2 THR 481 9.171 -14.098 12.775 281 HG23 THR 481 2HG2 THR 481 10.377 -13.971 11.499 282 H ILE 482 H ILE 482 7.828 -13.360 8.104 283 HA ILE 482 HA ILE 482 6.321 -15.579 6.876 284 HB ILE 482 HB ILE 482 4.837 -13.694 7.397 285 HG12 ILE 482 2HG1 ILE 482 5.329 -13.915 4.416 286 HG13 ILE 482 1HG1 ILE 482 4.364 -15.032 5.367 287 HG21 ILE 482 1HG2 ILE 482 6.418 -11.884 7.391 288 HG22 ILE 482 2HG2 ILE 482 5.092 -11.513 6.291 289 HG23 ILE 482 3HG2 ILE 482 6.647 -12.041 5.649 290 HD11 ILE 482 3HD1 ILE 482 2.969 -13.498 4.139 291 HD12 ILE 482 1HD1 ILE 482 3.767 -12.120 4.898 292 HD13 ILE 482 2HD1 ILE 482 2.804 -13.230 5.874 293 H GLY 483 H GLY 483 9.172 -13.932 6.811 294 HA2 GLY 483 2HA GLY 483 10.794 -14.656 5.148 295 HA3 GLY 483 1HA GLY 483 9.521 -14.504 3.944 296 H GLY 484 H GLY 484 8.546 -12.033 5.040 297 HA2 GLY 484 2HA GLY 484 10.396 -10.222 3.751 298 HA3 GLY 484 1HA GLY 484 8.838 -9.788 4.453 299 H SER 485 H SER 485 10.556 -7.981 5.101 300 HA SER 485 HA SER 485 12.045 -8.804 7.408 301 HB2 SER 485 2HB SER 485 11.624 -6.059 6.227 302 HB3 SER 485 1HB SER 485 12.751 -6.435 7.534 303 HG SER 485 HG SER 485 13.600 -8.054 5.971 304 H ALA 486 H ALA 486 9.412 -6.391 6.966 305 HA ALA 486 HA ALA 486 8.096 -7.429 9.294 306 HB1 ALA 486 1HB ALA 486 8.082 -5.309 10.527 307 HB2 ALA 486 2HB ALA 486 9.135 -4.591 9.311 308 HB3 ALA 486 3HB ALA 486 9.730 -5.906 10.327 309 HA PRO 487 HA PRO 487 5.054 -6.003 6.350 310 HB2 PRO 487 2HB PRO 487 2.890 -7.180 7.524 311 HB3 PRO 487 1HB PRO 487 4.031 -8.053 6.497 312 HG2 PRO 487 2HG PRO 487 3.800 -8.016 9.463 313 HG3 PRO 487 1HG PRO 487 4.267 -9.338 8.386 314 HD2 PRO 487 2HD PRO 487 6.032 -7.817 9.866 315 HD3 PRO 487 1HD PRO 487 6.464 -8.729 8.409 316 H ILE 488 H ILE 488 4.291 -4.021 6.347 317 HA ILE 488 HA ILE 488 3.378 -2.821 8.825 318 HB ILE 488 HB ILE 488 4.377 -1.514 6.228 319 HG12 ILE 488 2HG1 ILE 488 5.989 -2.258 8.075 320 HG13 ILE 488 1HG1 ILE 488 5.990 -0.571 7.562 321 HG21 ILE 488 1HG2 ILE 488 3.841 0.589 7.153 322 HG22 ILE 488 2HG2 ILE 488 3.035 -0.283 8.484 323 HG23 ILE 488 3HG2 ILE 488 2.386 -0.397 6.849 324 HD11 ILE 488 3HD1 ILE 488 4.902 0.148 9.462 325 HD12 ILE 488 1HD1 ILE 488 6.170 -0.919 10.031 326 HD13 ILE 488 2HD1 ILE 488 4.458 -1.457 9.976 327 H TYR 489 H TYR 489 1.425 -2.149 9.166 328 HA TYR 489 HA TYR 489 -0.575 -2.182 7.002 329 HB2 TYR 489 2HB TYR 489 -1.015 -2.944 9.921 330 HB3 TYR 489 1HB TYR 489 -2.250 -2.831 8.684 331 HD1 TYR 489 2HD TYR 489 0.703 -4.746 9.776 332 HD2 TYR 489 1HD TYR 489 -2.622 -4.550 7.148 333 HE1 TYR 489 2HE TYR 489 1.102 -7.073 9.144 334 HE2 TYR 489 1HE TYR 489 -2.224 -6.901 6.471 335 HH TYR 489 HH TYR 489 -0.198 -8.941 8.239 336 H VAL 490 H VAL 490 -2.112 -0.548 7.185 337 HA VAL 490 HA VAL 490 -1.171 1.893 8.262 338 HB VAL 490 HB VAL 490 -3.977 1.154 7.431 339 HG11 VAL 490 1HG1 VAL 490 -2.688 3.874 7.770 340 HG12 VAL 490 2HG1 VAL 490 -3.933 3.186 8.802 341 HG13 VAL 490 3HG1 VAL 490 -4.302 3.582 7.122 342 HG21 VAL 490 3HG2 VAL 490 -2.360 0.817 5.654 343 HG22 VAL 490 1HG2 VAL 490 -1.771 2.469 5.857 344 HG23 VAL 490 2HG2 VAL 490 -3.429 2.171 5.306 345 H LYS 491 H LYS 491 -1.284 2.666 10.258 346 HA LYS 491 HA LYS 491 -2.436 1.020 12.319 347 HB2 LYS 491 2HB LYS 491 -0.201 2.103 12.507 348 HB3 LYS 491 1HB LYS 491 -0.969 3.662 12.470 349 HG2 LYS 491 2HG LYS 491 -1.500 1.669 14.672 350 HG3 LYS 491 1HG LYS 491 -0.167 2.810 14.729 351 HD2 LYS 491 2HD LYS 491 -1.763 4.670 14.600 352 HD3 LYS 491 1HD LYS 491 -3.091 3.512 14.502 353 HE2 LYS 491 2HE LYS 491 -2.846 4.413 16.753 354 HE3 LYS 491 1HE LYS 491 -2.555 2.676 16.716 355 HZ1 LYS 491 3HZ LYS 491 -0.952 3.891 18.086 356 HZ2 LYS 491 1HZ LYS 491 -0.434 4.764 16.756 357 HZ3 LYS 491 2HZ LYS 491 -0.169 3.101 16.827 358 H ASN 492 H ASN 492 -3.197 4.151 10.829 359 HA ASN 492 HA ASN 492 -5.904 4.118 11.604 360 HB2 ASN 492 2HB ASN 492 -4.807 4.508 13.880 361 HB3 ASN 492 1HB ASN 492 -4.203 6.031 13.256 362 HD21 ASN 492 1HD2 ASN 492 -5.924 5.464 15.516 363 HD22 ASN 492 2HD2 ASN 492 -7.393 6.331 15.269 364 H ILE 493 H ILE 493 -6.977 5.882 10.695 365 HA ILE 493 HA ILE 493 -5.392 7.584 8.895 366 HB ILE 493 HB ILE 493 -8.346 6.864 8.838 367 HG12 ILE 493 2HG1 ILE 493 -6.981 4.930 8.224 368 HG13 ILE 493 1HG1 ILE 493 -7.865 5.590 6.847 369 HG21 ILE 493 1HG2 ILE 493 -6.717 8.437 6.852 370 HG22 ILE 493 2HG2 ILE 493 -8.034 9.042 7.873 371 HG23 ILE 493 3HG2 ILE 493 -8.364 7.878 6.597 372 HD11 ILE 493 3HD1 ILE 493 -5.618 4.926 6.217 373 HD12 ILE 493 1HD1 ILE 493 -4.945 6.020 7.427 374 HD13 ILE 493 2HD1 ILE 493 -5.838 6.668 6.053 375 H LEU 494 H LEU 494 -5.190 9.645 9.604 376 HA LEU 494 HA LEU 494 -6.665 10.570 11.845 377 HB2 LEU 494 2HB LEU 494 -4.694 11.939 10.009 378 HB3 LEU 494 1HB LEU 494 -5.514 12.803 11.288 379 HG LEU 494 HG LEU 494 -4.417 11.335 12.960 380 HD11 LEU 494 1HD1 LEU 494 -2.893 10.205 10.633 381 HD12 LEU 494 2HD1 LEU 494 -4.076 9.335 11.609 382 HD13 LEU 494 3HD1 LEU 494 -2.564 9.888 12.334 383 HD21 LEU 494 3HD2 LEU 494 -3.418 13.465 12.369 384 HD22 LEU 494 1HD2 LEU 494 -2.525 12.698 11.058 385 HD23 LEU 494 2HD2 LEU 494 -2.172 12.273 12.732 386 HA PRO 495 HA PRO 495 -10.312 12.272 10.015 387 HB2 PRO 495 2HB PRO 495 -9.803 14.673 11.695 388 HB3 PRO 495 1HB PRO 495 -11.253 13.666 11.577 389 HG2 PRO 495 2HG PRO 495 -9.657 13.456 13.684 390 HG3 PRO 495 1HG PRO 495 -10.379 12.011 12.955 391 HD2 PRO 495 2HD PRO 495 -7.583 13.052 12.744 392 HD3 PRO 495 1HD PRO 495 -8.171 11.381 12.871 393 H ARG 496 H ARG 496 -7.388 14.149 10.060 394 HA ARG 496 HA ARG 496 -8.286 15.493 7.630 395 HB2 ARG 496 2HB ARG 496 -6.659 16.756 9.839 396 HB3 ARG 496 1HB ARG 496 -6.987 17.473 8.270 397 HG2 ARG 496 2HG ARG 496 -9.380 17.497 8.796 398 HG3 ARG 496 1HG ARG 496 -9.016 16.831 10.389 399 HD2 ARG 496 2HD ARG 496 -7.638 18.761 10.902 400 HD3 ARG 496 1HD ARG 496 -7.945 19.421 9.301 401 HE ARG 496 HE ARG 496 -10.361 18.933 10.639 402 HH11 ARG 496 1HH1 ARG 496 -7.614 21.144 10.644 403 HH12 ARG 496 2HH1 ARG 496 -8.465 22.475 11.266 404 HH21 ARG 496 1HH2 ARG 496 -11.576 20.769 11.518 405 HH22 ARG 496 2HH2 ARG 496 -10.799 22.259 11.753 406 H GLY 497 H GLY 497 -6.928 15.316 5.986 407 HA2 GLY 497 2HA GLY 497 -4.509 15.668 5.540 408 HA3 GLY 497 1HA GLY 497 -4.222 14.199 6.423 409 H ALA 498 H ALA 498 -3.339 14.095 4.024 410 HA ALA 498 HA ALA 498 -4.948 13.890 1.801 411 HB1 ALA 498 1HB ALA 498 -2.370 12.445 2.293 412 HB2 ALA 498 2HB ALA 498 -2.529 14.121 1.776 413 HB3 ALA 498 3HB ALA 498 -3.094 12.820 0.727 414 H ALA 499 H ALA 499 -3.993 11.295 3.996 415 HA ALA 499 HA ALA 499 -4.864 9.122 2.463 416 HB1 ALA 499 1HB ALA 499 -3.420 8.845 4.400 417 HB2 ALA 499 2HB ALA 499 -4.865 7.853 4.564 418 HB3 ALA 499 3HB ALA 499 -4.725 9.363 5.463 419 H ILE 500 H ILE 500 -6.606 10.989 4.889 420 HA ILE 500 HA ILE 500 -8.910 9.353 4.566 421 HB ILE 500 HB ILE 500 -8.366 10.539 6.745 422 HG12 ILE 500 2HG1 ILE 500 -11.076 10.994 5.506 423 HG13 ILE 500 1HG1 ILE 500 -10.536 9.542 6.301 424 HG21 ILE 500 1HG2 ILE 500 -7.746 12.714 5.847 425 HG22 ILE 500 2HG2 ILE 500 -9.070 12.869 7.007 426 HG23 ILE 500 3HG2 ILE 500 -9.394 12.955 5.276 427 HD11 ILE 500 3HD1 ILE 500 -10.869 12.206 7.637 428 HD12 ILE 500 1HD1 ILE 500 -10.367 10.702 8.414 429 HD13 ILE 500 2HD1 ILE 500 -11.987 10.843 7.736 430 H GLN 501 H GLN 501 -7.722 12.296 3.178 431 HA GLN 501 HA GLN 501 -10.200 13.176 2.098 432 HB2 GLN 501 2HB GLN 501 -7.383 13.797 1.240 433 HB3 GLN 501 1HB GLN 501 -8.810 14.585 0.582 434 HG2 GLN 501 2HG GLN 501 -7.936 14.646 3.460 435 HG3 GLN 501 1HG GLN 501 -7.718 15.945 2.290 436 HE21 GLN 501 1HE2 GLN 501 -10.004 14.224 4.261 437 HE22 GLN 501 2HE2 GLN 501 -11.301 15.343 4.116 438 H ASP 502 H ASP 502 -7.746 10.967 0.982 439 HA ASP 502 HA ASP 502 -8.989 10.676 -1.593 440 HB2 ASP 502 2HB ASP 502 -6.629 10.124 -1.357 441 HB3 ASP 502 1HB ASP 502 -7.011 8.917 -0.131 442 H GLY 503 H GLY 503 -8.841 8.725 1.352 443 HA2 GLY 503 2HA GLY 503 -10.693 7.737 2.395 444 HA3 GLY 503 1HA GLY 503 -11.639 8.045 0.954 445 H ARG 504 H ARG 504 -9.195 6.619 -0.526 446 HA ARG 504 HA ARG 504 -10.450 4.019 -0.453 447 HB2 ARG 504 2HB ARG 504 -7.960 4.995 -1.863 448 HB3 ARG 504 1HB ARG 504 -8.729 3.435 -2.129 449 HG2 ARG 504 2HG ARG 504 -10.651 4.448 -3.089 450 HG3 ARG 504 1HG ARG 504 -10.138 6.054 -2.576 451 HD2 ARG 504 2HD ARG 504 -8.214 5.926 -4.060 452 HD3 ARG 504 1HD ARG 504 -8.693 4.305 -4.552 453 HE ARG 504 HE ARG 504 -10.678 5.280 -5.516 454 HH11 ARG 504 1HH1 ARG 504 -8.188 7.708 -4.645 455 HH12 ARG 504 2HH1 ARG 504 -8.514 8.681 -5.993 456 HH21 ARG 504 1HH2 ARG 504 -11.101 6.703 -7.353 457 HH22 ARG 504 2HH2 ARG 504 -10.180 8.130 -7.540 458 H LEU 505 H LEU 505 -7.733 5.577 0.871 459 HA LEU 505 HA LEU 505 -6.592 3.157 1.946 460 HB2 LEU 505 2HB LEU 505 -5.153 5.005 1.199 461 HB3 LEU 505 1HB LEU 505 -5.893 6.063 2.374 462 HG LEU 505 HG LEU 505 -4.911 4.723 4.197 463 HD11 LEU 505 1HD1 LEU 505 -3.605 3.164 1.963 464 HD12 LEU 505 2HD1 LEU 505 -4.730 2.524 3.175 465 HD13 LEU 505 3HD1 LEU 505 -3.142 3.125 3.652 466 HD21 LEU 505 3HD2 LEU 505 -2.922 5.630 2.135 467 HD22 LEU 505 1HD2 LEU 505 -2.607 5.403 3.852 468 HD23 LEU 505 2HD2 LEU 505 -3.722 6.664 3.316 469 H LYS 506 H LYS 506 -6.949 2.394 3.923 470 HA LYS 506 HA LYS 506 -8.227 3.968 5.960 471 HB2 LYS 506 2HB LYS 506 -9.806 2.068 6.446 472 HB3 LYS 506 1HB LYS 506 -10.150 2.921 4.950 473 HG2 LYS 506 2HG LYS 506 -9.181 1.170 3.658 474 HG3 LYS 506 1HG LYS 506 -8.602 0.356 5.107 475 HD2 LYS 506 2HD LYS 506 -10.878 -0.093 5.802 476 HD3 LYS 506 1HD LYS 506 -11.501 0.829 4.429 477 HE2 LYS 506 2HE LYS 506 -11.531 -1.640 4.089 478 HE3 LYS 506 1HE LYS 506 -10.615 -0.761 2.869 479 HZ1 LYS 506 3HZ LYS 506 -9.360 -2.712 3.586 480 HZ2 LYS 506 1HZ LYS 506 -9.400 -2.199 5.199 481 HZ3 LYS 506 2HZ LYS 506 -8.584 -1.338 3.992 482 H ALA 507 H ALA 507 -8.255 2.540 8.030 483 HA ALA 507 HA ALA 507 -5.546 1.762 8.358 484 HB1 ALA 507 1HB ALA 507 -6.088 1.477 10.705 485 HB2 ALA 507 2HB ALA 507 -7.811 1.613 10.338 486 HB3 ALA 507 3HB ALA 507 -6.752 2.992 10.086 487 H GLY 508 H GLY 508 -4.687 -0.209 8.706 488 HA2 GLY 508 2HA GLY 508 -4.752 -2.473 9.247 489 HA3 GLY 508 1HA GLY 508 -6.415 -2.589 8.780 490 H ASP 509 H ASP 509 -5.395 -0.961 6.234 491 HA ASP 509 HA ASP 509 -4.857 -3.371 4.773 492 HB2 ASP 509 2HB ASP 509 -4.800 -0.488 3.817 493 HB3 ASP 509 1HB ASP 509 -4.490 -1.872 2.773 494 H ARG 510 H ARG 510 -2.995 -3.715 3.516 495 HA ARG 510 HA ARG 510 -0.736 -3.165 5.281 496 HB2 ARG 510 2HB ARG 510 -1.104 -5.477 4.998 497 HB3 ARG 510 1HB ARG 510 -1.175 -5.379 3.257 498 HG2 ARG 510 2HG ARG 510 1.203 -4.717 3.239 499 HG3 ARG 510 1HG ARG 510 1.233 -4.866 4.992 500 HD2 ARG 510 2HD ARG 510 0.748 -7.222 4.823 501 HD3 ARG 510 1HD ARG 510 0.614 -7.100 3.060 502 HE ARG 510 HE ARG 510 3.065 -6.067 3.832 503 HH11 ARG 510 1HH1 ARG 510 1.490 -9.231 3.821 504 HH12 ARG 510 2HH1 ARG 510 2.926 -10.100 3.545 505 HH21 ARG 510 1HH2 ARG 510 5.000 -7.215 3.508 506 HH22 ARG 510 2HH2 ARG 510 5.002 -8.924 3.377 507 H LEU 511 H LEU 511 0.945 -2.009 4.691 508 HA LEU 511 HA LEU 511 0.760 -0.751 2.099 509 HB2 LEU 511 2HB LEU 511 1.332 0.505 4.377 510 HB3 LEU 511 1HB LEU 511 2.863 -0.283 4.199 511 HG LEU 511 HG LEU 511 3.377 0.931 2.124 512 HD11 LEU 511 1HD1 LEU 511 1.918 2.547 1.210 513 HD12 LEU 511 2HD1 LEU 511 0.676 2.178 2.409 514 HD13 LEU 511 3HD1 LEU 511 1.156 0.975 1.209 515 HD21 LEU 511 3HD2 LEU 511 3.885 2.011 4.292 516 HD22 LEU 511 1HD2 LEU 511 2.296 2.771 4.261 517 HD23 LEU 511 2HD2 LEU 511 3.492 3.177 3.031 518 H ILE 512 H ILE 512 1.869 -1.481 0.394 519 HA ILE 512 HA ILE 512 3.749 -3.686 0.795 520 HB ILE 512 HB ILE 512 2.315 -2.771 -1.742 521 HG12 ILE 512 2HG1 ILE 512 0.779 -3.769 -0.111 522 HG13 ILE 512 1HG1 ILE 512 1.009 -4.822 -1.481 523 HG21 ILE 512 1HG2 ILE 512 4.078 -5.163 -1.315 524 HG22 ILE 512 2HG2 ILE 512 4.448 -3.743 -2.299 525 HG23 ILE 512 3HG2 ILE 512 3.124 -4.820 -2.758 526 HD11 ILE 512 3HD1 ILE 512 2.599 -6.192 -0.190 527 HD12 ILE 512 1HD1 ILE 512 1.025 -6.118 0.594 528 HD13 ILE 512 2HD1 ILE 512 2.363 -5.146 1.202 529 H GLU 513 H GLU 513 3.502 -0.885 -1.393 530 HA GLU 513 HA GLU 513 6.281 -0.373 -0.881 531 HB2 GLU 513 2HB GLU 513 6.910 -0.240 -3.239 532 HB3 GLU 513 1HB GLU 513 6.361 -1.852 -2.839 533 HG2 GLU 513 2HG GLU 513 4.247 -1.441 -3.886 534 HG3 GLU 513 1HG GLU 513 4.704 0.240 -4.170 535 H VAL 514 H VAL 514 6.883 1.636 -1.476 536 HA VAL 514 HA VAL 514 4.719 3.499 -2.162 537 HB VAL 514 HB VAL 514 5.095 3.758 0.235 538 HG11 VAL 514 1HG1 VAL 514 7.237 4.531 1.152 539 HG12 VAL 514 2HG1 VAL 514 7.963 4.400 -0.452 540 HG13 VAL 514 3HG1 VAL 514 7.406 2.953 0.369 541 HG21 VAL 514 3HG2 VAL 514 5.544 6.144 0.299 542 HG22 VAL 514 1HG2 VAL 514 4.547 5.702 -1.086 543 HG23 VAL 514 2HG2 VAL 514 6.260 6.053 -1.318 544 H ASN 515 H ASN 515 5.111 4.524 -3.958 545 HA ASN 515 HA ASN 515 6.103 5.665 -5.669 546 HB2 ASN 515 2HB ASN 515 8.136 6.332 -3.529 547 HB3 ASN 515 1HB ASN 515 8.098 7.089 -5.113 548 HD21 ASN 515 1HD2 ASN 515 7.769 8.229 -2.447 549 HD22 ASN 515 2HD2 ASN 515 6.255 9.046 -2.451 550 H GLY 516 H GLY 516 7.098 2.837 -4.941 551 HA2 GLY 516 2HA GLY 516 8.228 1.518 -6.616 552 HA3 GLY 516 1HA GLY 516 9.326 2.870 -6.868 553 H VAL 517 H VAL 517 8.895 2.739 -3.642 554 HA VAL 517 HA VAL 517 11.274 1.076 -3.291 555 HB VAL 517 HB VAL 517 9.895 2.935 -1.319 556 HG11 VAL 517 1HG1 VAL 517 12.557 1.524 -1.127 557 HG12 VAL 517 2HG1 VAL 517 11.108 1.155 -0.193 558 HG13 VAL 517 3HG1 VAL 517 11.933 2.698 0.035 559 HG21 VAL 517 3HG2 VAL 517 10.870 4.196 -3.157 560 HG22 VAL 517 1HG2 VAL 517 12.412 3.371 -2.930 561 HG23 VAL 517 2HG2 VAL 517 11.800 4.453 -1.679 562 H ASP 518 H ASP 518 10.930 -0.957 -2.686 563 HA ASP 518 HA ASP 518 8.320 -1.785 -1.761 564 HB2 ASP 518 2HB ASP 518 9.472 -3.216 -3.356 565 HB3 ASP 518 1HB ASP 518 10.859 -3.344 -2.278 566 H LEU 519 H LEU 519 7.743 -2.035 0.236 567 HA LEU 519 HA LEU 519 9.872 -1.975 2.173 568 HB2 LEU 519 2HB LEU 519 7.903 -1.327 3.780 569 HB3 LEU 519 1HB LEU 519 8.827 -0.168 2.840 570 HG LEU 519 HG LEU 519 6.215 -1.167 1.726 571 HD11 LEU 519 1HD1 LEU 519 6.671 1.062 3.709 572 HD12 LEU 519 2HD1 LEU 519 5.779 -0.425 4.074 573 HD13 LEU 519 3HD1 LEU 519 5.177 0.717 2.849 574 HD21 LEU 519 3HD2 LEU 519 7.702 1.422 1.680 575 HD22 LEU 519 1HD2 LEU 519 6.254 1.026 0.757 576 HD23 LEU 519 2HD2 LEU 519 7.780 0.190 0.422 577 H ALA 520 H ALA 520 8.270 -4.260 0.792 578 HA ALA 520 HA ALA 520 7.496 -5.770 3.102 579 HB1 ALA 520 1HB ALA 520 6.551 -6.288 0.889 580 HB2 ALA 520 2HB ALA 520 7.424 -7.682 1.527 581 HB3 ALA 520 3HB ALA 520 8.161 -6.666 0.284 582 H GLY 521 H GLY 521 10.294 -5.183 1.198 583 HA2 GLY 521 2HA GLY 521 11.952 -7.043 2.712 584 HA3 GLY 521 1HA GLY 521 12.483 -6.020 1.380 585 H LYS 522 H LYS 522 10.767 -4.007 3.292 586 HA LYS 522 HA LYS 522 13.174 -3.145 4.691 587 HB2 LYS 522 2HB LYS 522 10.594 -1.613 4.266 588 HB3 LYS 522 1HB LYS 522 11.941 -1.075 5.211 589 HG2 LYS 522 2HG LYS 522 12.122 -1.663 2.271 590 HG3 LYS 522 1HG LYS 522 11.940 -0.060 2.988 591 HD2 LYS 522 2HD LYS 522 14.015 -0.436 4.255 592 HD3 LYS 522 1HD LYS 522 14.200 -1.984 3.467 593 HE2 LYS 522 2HE LYS 522 14.349 -0.915 1.276 594 HE3 LYS 522 1HE LYS 522 14.096 0.666 2.011 595 HZ1 LYS 522 3HZ LYS 522 16.433 0.247 1.547 596 HZ2 LYS 522 1HZ LYS 522 16.435 -1.112 2.524 597 HZ3 LYS 522 2HZ LYS 522 16.196 0.408 3.194 598 H SER 523 H SER 523 13.109 -2.526 6.843 599 HA SER 523 HA SER 523 11.405 -4.275 8.308 600 HB2 SER 523 2HB SER 523 13.832 -4.124 8.814 601 HB3 SER 523 1HB SER 523 13.618 -2.437 9.260 602 HG SER 523 HG SER 523 13.022 -4.742 10.611 603 H GLN 524 H GLN 524 10.261 -3.331 10.237 604 HA GLN 524 HA GLN 524 8.468 -1.370 9.419 605 HB2 GLN 524 2HB GLN 524 7.633 -1.368 11.751 606 HB3 GLN 524 1HB GLN 524 7.804 -2.974 11.068 607 HG2 GLN 524 2HG GLN 524 9.890 -3.271 12.315 608 HG3 GLN 524 1HG GLN 524 9.702 -1.652 12.996 609 HE21 GLN 524 1HE2 GLN 524 8.115 -1.294 14.516 610 HE22 GLN 524 2HE2 GLN 524 7.311 -2.574 15.350 611 H GLU 525 H GLU 525 11.340 -1.073 11.298 612 HA GLU 525 HA GLU 525 10.987 1.514 12.348 613 HB2 GLU 525 2HB GLU 525 12.684 0.031 13.169 614 HB3 GLU 525 1HB GLU 525 13.448 -0.022 11.586 615 HG2 GLU 525 2HG GLU 525 14.013 2.343 11.807 616 HG3 GLU 525 1HG GLU 525 13.282 2.351 13.414 617 H GLU 526 H GLU 526 12.382 0.373 9.362 618 HA GLU 526 HA GLU 526 13.553 2.745 8.462 619 HB2 GLU 526 2HB GLU 526 12.388 0.505 6.837 620 HB3 GLU 526 1HB GLU 526 13.627 1.614 6.286 621 HG2 GLU 526 2HG GLU 526 15.007 0.723 8.262 622 HG3 GLU 526 1HG GLU 526 13.737 -0.483 8.349 623 H VAL 527 H VAL 527 10.496 1.244 7.841 624 HA VAL 527 HA VAL 527 9.635 3.388 6.204 625 HB VAL 527 HB VAL 527 7.531 2.070 5.950 626 HG11 VAL 527 1HG1 VAL 527 8.659 0.282 4.737 627 HG12 VAL 527 2HG1 VAL 527 10.140 0.633 5.626 628 HG13 VAL 527 3HG1 VAL 527 9.498 1.823 4.475 629 HG21 VAL 527 3HG2 VAL 527 9.055 0.133 7.666 630 HG22 VAL 527 1HG2 VAL 527 7.583 -0.229 6.760 631 HG23 VAL 527 2HG2 VAL 527 7.533 0.927 8.107 632 H VAL 528 H VAL 528 8.896 2.396 9.541 633 HA VAL 528 HA VAL 528 6.832 4.268 9.902 634 HB VAL 528 HB VAL 528 8.787 3.164 11.971 635 HG11 VAL 528 1HG1 VAL 528 7.884 5.333 12.732 636 HG12 VAL 528 2HG1 VAL 528 7.226 4.000 13.683 637 HG13 VAL 528 3HG1 VAL 528 6.246 4.755 12.426 638 HG21 VAL 528 3HG2 VAL 528 5.892 2.505 11.400 639 HG22 VAL 528 1HG2 VAL 528 6.877 1.789 12.674 640 HG23 VAL 528 2HG2 VAL 528 7.279 1.502 10.984 641 H SER 529 H SER 529 10.295 4.583 10.066 642 HA SER 529 HA SER 529 10.371 7.235 10.962 643 HB2 SER 529 2HB SER 529 12.326 5.677 10.936 644 HB3 SER 529 1HB SER 529 12.343 5.773 9.181 645 HG SER 529 HG SER 529 13.118 7.591 11.105 646 H LEU 530 H LEU 530 10.161 5.868 7.726 647 HA LEU 530 HA LEU 530 10.371 8.275 6.260 648 HB2 LEU 530 2HB LEU 530 9.092 5.673 5.740 649 HB3 LEU 530 1HB LEU 530 9.161 6.905 4.475 650 HG LEU 530 HG LEU 530 11.496 5.461 5.778 651 HD11 LEU 530 1HD1 LEU 530 10.387 5.321 2.976 652 HD12 LEU 530 2HD1 LEU 530 10.234 4.072 4.209 653 HD13 LEU 530 3HD1 LEU 530 11.823 4.481 3.561 654 HD21 LEU 530 3HD2 LEU 530 12.883 6.615 4.120 655 HD22 LEU 530 1HD2 LEU 530 12.111 7.754 5.219 656 HD23 LEU 530 2HD2 LEU 530 11.478 7.535 3.583 657 H LEU 531 H LEU 531 7.445 6.389 7.222 658 HA LEU 531 HA LEU 531 5.670 8.276 6.207 659 HB2 LEU 531 2HB LEU 531 5.364 5.926 8.047 660 HB3 LEU 531 1HB LEU 531 4.021 7.000 7.717 661 HG LEU 531 HG LEU 531 3.970 4.982 6.415 662 HD11 LEU 531 1HD1 LEU 531 2.924 6.972 5.487 663 HD12 LEU 531 2HD1 LEU 531 3.599 5.990 4.189 664 HD13 LEU 531 3HD1 LEU 531 4.444 7.440 4.721 665 HD21 LEU 531 3HD2 LEU 531 6.508 5.935 5.098 666 HD22 LEU 531 1HD2 LEU 531 5.520 4.587 4.530 667 HD23 LEU 531 2HD2 LEU 531 6.321 4.497 6.101 668 H ARG 532 H ARG 532 7.206 8.040 9.315 669 HA ARG 532 HA ARG 532 5.518 10.024 10.486 670 HB2 ARG 532 2HB ARG 532 6.759 8.349 11.852 671 HB3 ARG 532 1HB ARG 532 8.274 9.054 11.337 672 HG2 ARG 532 2HG ARG 532 6.226 10.601 12.919 673 HG3 ARG 532 1HG ARG 532 7.446 9.600 13.693 674 HD2 ARG 532 2HD ARG 532 9.203 10.952 12.653 675 HD3 ARG 532 1HD ARG 532 7.984 11.929 11.842 676 HE ARG 532 HE ARG 532 7.216 12.333 14.264 677 HH11 ARG 532 1HH1 ARG 532 10.603 12.015 13.253 678 HH12 ARG 532 2HH1 ARG 532 11.205 13.161 14.351 679 HH21 ARG 532 1HH2 ARG 532 8.045 13.915 15.808 680 HH22 ARG 532 2HH2 ARG 532 9.702 14.276 15.851 681 H SER 533 H SER 533 8.598 10.043 8.764 682 HA SER 533 HA SER 533 9.219 12.756 9.211 683 HB2 SER 533 2HB SER 533 10.924 11.114 8.506 684 HB3 SER 533 1HB SER 533 10.106 10.919 6.961 685 HG SER 533 HG SER 533 11.141 13.391 7.907 686 H THR 534 H THR 534 7.660 11.128 6.450 687 HA THR 534 HA THR 534 6.604 11.833 4.634 688 HB THR 534 HB THR 534 4.879 13.654 4.882 689 HG1 THR 534 1HG THR 534 6.346 14.187 7.072 690 HG21 THR 534 3HG2 THR 534 4.908 11.549 7.032 691 HG22 THR 534 1HG2 THR 534 4.343 11.342 5.371 692 HG23 THR 534 2HG2 THR 534 3.484 12.423 6.468 693 H LYS 535 H LYS 535 7.885 12.419 3.029 694 HA LYS 535 HA LYS 535 9.271 14.956 3.139 695 HB2 LYS 535 2HB LYS 535 9.098 13.007 0.828 696 HB3 LYS 535 1HB LYS 535 10.295 14.266 1.072 697 HG2 LYS 535 2HG LYS 535 9.991 11.749 2.711 698 HG3 LYS 535 1HG LYS 535 11.266 12.102 1.546 699 HD2 LYS 535 2HD LYS 535 12.015 13.967 2.950 700 HD3 LYS 535 1HD LYS 535 10.731 13.605 4.106 701 HE2 LYS 535 2HE LYS 535 11.700 11.379 4.460 702 HE3 LYS 535 1HE LYS 535 13.007 11.773 3.351 703 HZ1 LYS 535 3HZ LYS 535 12.409 13.057 5.949 704 HZ2 LYS 535 1HZ LYS 535 13.608 13.619 4.878 705 HZ3 LYS 535 2HZ LYS 535 13.715 12.090 5.593 706 H MET 536 H MET 536 8.896 16.657 1.547 707 HA MET 536 HA MET 536 6.056 16.634 0.802 708 HB2 MET 536 2HB MET 536 6.889 18.340 2.510 709 HB3 MET 536 1HB MET 536 7.788 19.037 1.166 710 HG2 MET 536 2HG MET 536 5.769 19.570 -0.020 711 HG3 MET 536 1HG MET 536 4.785 18.757 1.192 712 HE1 MET 536 3HE MET 536 7.088 22.685 1.907 713 HE2 MET 536 1HE MET 536 7.054 21.825 0.366 714 HE3 MET 536 2HE MET 536 7.902 21.131 1.750 715 H GLU 537 H GLU 537 7.459 15.368 -1.068 716 HA GLU 537 HA GLU 537 8.359 17.178 -3.078 717 HB2 GLU 537 2HB GLU 537 9.176 14.839 -3.036 718 HB3 GLU 537 1HB GLU 537 7.552 14.262 -3.359 719 HG2 GLU 537 2HG GLU 537 7.604 15.436 -5.532 720 HG3 GLU 537 1HG GLU 537 9.273 15.886 -5.199 721 H GLY 538 H GLY 538 5.482 15.236 -2.617 722 HA2 GLY 538 2HA GLY 538 3.555 17.078 -3.204 723 HA3 GLY 538 1HA GLY 538 3.950 16.394 -4.770 724 H THR 539 H THR 539 3.334 14.383 -5.289 725 HA THR 539 HA THR 539 1.393 13.272 -3.521 726 HB THR 539 HB THR 539 1.272 11.571 -5.498 727 HG1 THR 539 1HG THR 539 2.789 12.005 -6.893 728 HG21 THR 539 3HG2 THR 539 -0.276 13.045 -6.692 729 HG22 THR 539 1HG2 THR 539 0.337 14.435 -5.781 730 HG23 THR 539 2HG2 THR 539 -0.511 13.129 -4.951 731 H VAL 540 H VAL 540 1.495 11.211 -2.778 732 HA VAL 540 HA VAL 540 4.004 9.700 -2.992 733 HB VAL 540 HB VAL 540 2.077 9.888 -0.640 734 HG11 VAL 540 1HG1 VAL 540 2.980 7.650 -0.920 735 HG12 VAL 540 2HG1 VAL 540 3.621 8.419 0.539 736 HG13 VAL 540 3HG1 VAL 540 4.615 8.298 -0.919 737 HG21 VAL 540 3HG2 VAL 540 3.965 10.855 0.579 738 HG22 VAL 540 1HG2 VAL 540 3.534 11.835 -0.830 739 HG23 VAL 540 2HG2 VAL 540 4.941 10.780 -0.886 740 H SER 541 H SER 541 3.651 7.840 -4.066 741 HA SER 541 HA SER 541 0.902 6.930 -4.295 742 HB2 SER 541 2HB SER 541 2.212 7.292 -6.407 743 HB3 SER 541 1HB SER 541 3.350 6.064 -5.858 744 HG SER 541 HG SER 541 1.908 4.511 -6.231 745 H LEU 542 H LEU 542 0.293 5.519 -2.965 746 HA LEU 542 HA LEU 542 2.220 3.743 -1.662 747 HB2 LEU 542 2HB LEU 542 -0.600 4.486 -0.986 748 HB3 LEU 542 1HB LEU 542 0.430 3.433 -0.042 749 HG LEU 542 HG LEU 542 0.954 6.362 -0.537 750 HD11 LEU 542 1HD1 LEU 542 -0.072 4.917 1.880 751 HD12 LEU 542 2HD1 LEU 542 -1.039 5.908 0.786 752 HD13 LEU 542 3HD1 LEU 542 0.251 6.653 1.742 753 HD21 LEU 542 3HD2 LEU 542 2.260 4.399 1.353 754 HD22 LEU 542 1HD2 LEU 542 2.622 6.115 1.194 755 HD23 LEU 542 2HD2 LEU 542 2.961 5.005 -0.139 756 H LEU 543 H LEU 543 2.187 1.715 -2.243 757 HA LEU 543 HA LEU 543 -0.178 0.679 -3.634 758 HB2 LEU 543 2HB LEU 543 2.317 0.291 -4.461 759 HB3 LEU 543 1HB LEU 543 2.382 -0.749 -3.099 760 HG LEU 543 HG LEU 543 0.545 -2.142 -3.892 761 HD11 LEU 543 1HD1 LEU 543 0.661 -0.452 -6.374 762 HD12 LEU 543 2HD1 LEU 543 -0.677 -0.572 -5.232 763 HD13 LEU 543 3HD1 LEU 543 -0.226 -1.967 -6.205 764 HD21 LEU 543 3HD2 LEU 543 1.749 -3.248 -5.734 765 HD22 LEU 543 1HD2 LEU 543 2.813 -2.833 -4.392 766 HD23 LEU 543 2HD2 LEU 543 2.817 -1.848 -5.851 767 H VAL 544 H VAL 544 -1.589 -0.298 -2.306 768 HA VAL 544 HA VAL 544 -0.474 -1.533 0.129 769 HB VAL 544 HB VAL 544 -2.561 -1.209 1.287 770 HG11 VAL 544 1HG1 VAL 544 -1.639 1.372 0.062 771 HG12 VAL 544 2HG1 VAL 544 -1.012 0.577 1.513 772 HG13 VAL 544 3HG1 VAL 544 -2.659 1.202 1.503 773 HG21 VAL 544 3HG2 VAL 544 -4.044 -1.465 -0.512 774 HG22 VAL 544 1HG2 VAL 544 -3.555 0.069 -1.240 775 HG23 VAL 544 2HG2 VAL 544 -4.429 0.056 0.317 776 H PHE 545 H PHE 545 -1.614 -3.342 0.927 777 HA PHE 545 HA PHE 545 -2.892 -4.907 -1.196 778 HB2 PHE 545 2HB PHE 545 -0.691 -5.760 -0.363 779 HB3 PHE 545 1HB PHE 545 -1.412 -5.944 1.234 780 HD1 PHE 545 2HD PHE 545 -3.275 -7.636 1.534 781 HD2 PHE 545 1HD PHE 545 -1.016 -7.303 -2.046 782 HE1 PHE 545 2HE PHE 545 -4.040 -9.876 0.837 783 HE2 PHE 545 1HE PHE 545 -1.746 -9.487 -2.749 784 HZ PHE 545 HZ PHE 545 -3.277 -10.817 -1.300 785 H ARG 546 H ARG 546 -4.923 -5.110 -0.841 786 HA ARG 546 HA ARG 546 -5.988 -4.850 1.856 787 HB2 ARG 546 2HB ARG 546 -6.999 -3.510 0.038 788 HB3 ARG 546 1HB ARG 546 -7.333 -4.980 -0.856 789 HG2 ARG 546 2HG ARG 546 -8.923 -5.679 0.818 790 HG3 ARG 546 1HG ARG 546 -8.517 -4.286 1.827 791 HD2 ARG 546 2HD ARG 546 -9.282 -2.784 0.069 792 HD3 ARG 546 1HD ARG 546 -9.677 -4.162 -0.951 793 HE ARG 546 HE ARG 546 -11.205 -4.781 0.966 794 HH11 ARG 546 1HH1 ARG 546 -10.450 -1.398 0.133 795 HH12 ARG 546 2HH1 ARG 546 -11.978 -0.793 0.503 796 HH21 ARG 546 1HH2 ARG 546 -13.374 -3.907 1.569 797 HH22 ARG 546 2HH2 ARG 546 -13.676 -2.266 1.367 798 H GLN 547 H GLN 547 -6.616 -6.678 2.917 799 HA GLN 547 HA GLN 547 -5.925 -9.181 1.621 800 HB2 GLN 547 2HB GLN 547 -5.321 -8.696 3.982 801 HB3 GLN 547 1HB GLN 547 -7.031 -8.619 4.377 802 HG2 GLN 547 2HG GLN 547 -7.251 -10.979 3.692 803 HG3 GLN 547 1HG GLN 547 -5.511 -11.034 3.424 804 HE21 GLN 547 1HE2 GLN 547 -4.137 -10.842 5.202 805 HE22 GLN 547 2HE2 GLN 547 -4.673 -11.215 6.802 806 H GLU 548 H GLU 548 -7.330 -10.228 0.460 807 HA GLU 548 HA GLU 548 -9.259 -10.745 -0.617 808 HB2 GLU 548 2HB GLU 548 -10.197 -10.977 2.255 809 HB3 GLU 548 1HB GLU 548 -10.998 -11.705 0.869 810 HG2 GLU 548 2HG GLU 548 -8.983 -13.026 0.426 811 HG3 GLU 548 1HG GLU 548 -8.239 -12.337 1.868 812 H GLU 549 H GLU 549 -11.990 -10.206 0.389 813 HA GLU 549 HA GLU 549 -11.885 -7.327 0.714 814 HB2 GLU 549 2HB GLU 549 -12.713 -8.019 -1.553 815 HB3 GLU 549 1HB GLU 549 -14.023 -8.882 -0.770 816 HG2 GLU 549 2HG GLU 549 -14.942 -6.853 0.072 817 HG3 GLU 549 1HG GLU 549 -13.541 -5.933 -0.481 818 H ALA 550 H ALA 550 -11.966 -9.882 2.239 819 HA ALA 550 HA ALA 550 -14.410 -9.672 3.789 820 HB1 ALA 550 1HB ALA 550 -12.117 -11.622 3.972 821 HB2 ALA 550 2HB ALA 550 -13.631 -11.894 3.108 822 HB3 ALA 550 3HB ALA 550 -13.636 -11.721 4.863 823 H PHE 551 H PHE 551 -11.823 -7.946 3.680 824 HA PHE 551 HA PHE 551 -11.194 -7.967 6.499 825 HB2 PHE 551 2HB PHE 551 -9.390 -7.650 4.830 826 HB3 PHE 551 1HB PHE 551 -10.157 -6.154 4.307 827 HD1 PHE 551 2HD PHE 551 -8.446 -7.801 7.114 828 HD2 PHE 551 1HD PHE 551 -9.936 -4.132 5.562 829 HE1 PHE 551 2HE PHE 551 -7.287 -6.575 8.900 830 HE2 PHE 551 1HE PHE 551 -8.774 -2.903 7.351 831 HZ PHE 551 HZ PHE 551 -7.450 -4.149 9.027 832 H HIS 552 H HIS 552 -12.199 -6.738 7.856 833 HA HIS 552 HA HIS 552 -13.894 -4.554 6.856 834 HB2 HIS 552 2HB HIS 552 -14.402 -6.377 9.245 835 HB3 HIS 552 1HB HIS 552 -15.487 -5.152 8.610 836 HD1 HIS 552 1HD HIS 552 -15.132 -8.681 8.622 837 HD2 HIS 552 2HD HIS 552 -16.123 -5.902 5.699 838 HE1 HIS 552 1HE HIS 552 -16.296 -9.978 6.833 839 HE2 HIS 552 2HE HIS 552 -16.710 -8.343 5.003 840 HA PRO 553 HA PRO 553 -11.718 -2.006 9.888 841 HB2 PRO 553 2HB PRO 553 -14.320 -1.458 11.242 842 HB3 PRO 553 1HB PRO 553 -13.123 -0.309 10.636 843 HG2 PRO 553 2HG PRO 553 -15.398 -0.686 9.329 844 HG3 PRO 553 1HG PRO 553 -13.874 -0.470 8.449 845 HD2 PRO 553 2HD PRO 553 -15.430 -2.965 8.976 846 HD3 PRO 553 1HD PRO 553 -14.540 -2.487 7.516 847 H ARG 554 H ARG 554 -10.615 -3.226 11.044 848 HA ARG 554 HA ARG 554 -11.498 -5.362 12.582 849 HB2 ARG 554 2HB ARG 554 -9.131 -5.479 13.331 850 HB3 ARG 554 1HB ARG 554 -9.357 -5.426 11.585 851 HG2 ARG 554 2HG ARG 554 -8.869 -3.015 11.633 852 HG3 ARG 554 1HG ARG 554 -8.534 -3.150 13.358 853 HD2 ARG 554 2HD ARG 554 -6.758 -4.767 12.850 854 HD3 ARG 554 1HD ARG 554 -7.135 -4.555 11.125 855 HE ARG 554 HE ARG 554 -6.696 -2.079 11.804 856 HH11 ARG 554 1HH1 ARG 554 -4.778 -4.937 12.555 857 HH12 ARG 554 2HH1 ARG 554 -3.294 -4.119 12.712 858 HH21 ARG 554 1HH2 ARG 554 -4.641 -0.910 11.973 859 HH22 ARG 554 2HH2 ARG 554 -3.225 -1.762 12.388 860 H GLU 555 H GLU 555 -11.828 -5.679 14.614 861 HA GLU 555 HA GLU 555 -12.507 -3.491 16.312 862 HB2 GLU 555 2HB GLU 555 -13.838 -5.522 16.271 863 HB3 GLU 555 1HB GLU 555 -12.444 -6.474 16.741 864 HG2 GLU 555 2HG GLU 555 -12.401 -5.363 18.908 865 HG3 GLU 555 1HG GLU 555 -13.790 -4.383 18.442 866 H MET 556 H MET 556 -11.194 -2.528 17.730 867 HA MET 556 HA MET 556 -9.080 -4.025 18.991 868 HB2 MET 556 2HB MET 556 -7.300 -2.504 18.387 869 HB3 MET 556 1HB MET 556 -8.023 -3.160 16.924 870 HG2 MET 556 2HG MET 556 -9.238 -1.116 16.550 871 HG3 MET 556 1HG MET 556 -8.675 -0.460 18.085 872 HE1 MET 556 3HE MET 556 -5.973 -1.223 14.429 873 HE2 MET 556 1HE MET 556 -7.713 -1.505 14.450 874 HE3 MET 556 2HE MET 556 -6.642 -2.524 15.412 875 H ASN 557 H ASN 557 -8.451 -3.103 20.875 876 HA ASN 557 HA ASN 557 -9.724 -0.571 21.605 877 HB2 ASN 557 2HB ASN 557 -10.599 -2.406 22.984 878 HB3 ASN 557 1HB ASN 557 -8.960 -2.885 23.412 879 HD21 ASN 557 1HD2 ASN 557 -7.853 -1.718 24.945 880 HD22 ASN 557 2HD2 ASN 557 -8.589 -0.513 25.924 881 H ALA 558 H ALA 558 -6.810 -2.510 21.507 882 HA ALA 558 HA ALA 558 -5.136 -0.253 21.463 883 HB1 ALA 558 1HB ALA 558 -5.584 -0.322 23.908 884 HB2 ALA 558 2HB ALA 558 -3.889 -0.652 23.527 885 HB3 ALA 558 3HB ALA 558 -4.976 -1.973 23.939 Start of MODEL 19 1 H1 GLY 448 1HT GLY 448 -15.586 -5.410 -17.708 2 H2 GLY 448 2HT GLY 448 -14.292 -5.606 -18.773 3 H3 GLY 448 3HT GLY 448 -14.751 -4.055 -18.267 4 HA2 GLY 448 1HA GLY 448 -12.774 -4.813 -17.103 5 HA3 GLY 448 2HA GLY 448 -14.142 -4.563 -16.022 6 H SER 449 H SER 449 -11.675 -6.443 -16.176 7 HA SER 449 HA SER 449 -13.015 -9.022 -15.980 8 HB2 SER 449 2HB SER 449 -10.099 -8.252 -15.670 9 HB3 SER 449 1HB SER 449 -10.723 -9.899 -15.683 10 HG SER 449 HG SER 449 -11.291 -9.689 -17.758 11 H VAL 450 H VAL 450 -12.921 -10.280 -14.022 12 HA VAL 450 HA VAL 450 -12.958 -8.704 -11.642 13 HB VAL 450 HB VAL 450 -13.346 -10.840 -10.426 14 HG11 VAL 450 1HG1 VAL 450 -15.045 -10.531 -12.895 15 HG12 VAL 450 2HG1 VAL 450 -15.256 -9.685 -11.362 16 HG13 VAL 450 3HG1 VAL 450 -15.499 -11.430 -11.445 17 HG21 VAL 450 3HG2 VAL 450 -13.081 -12.152 -13.140 18 HG22 VAL 450 1HG2 VAL 450 -13.600 -12.956 -11.659 19 HG23 VAL 450 2HG2 VAL 450 -11.954 -12.331 -11.797 20 H TYR 451 H TYR 451 -11.409 -8.587 -10.077 21 HA TYR 451 HA TYR 451 -8.825 -9.195 -11.149 22 HB2 TYR 451 2HB TYR 451 -9.588 -7.490 -8.787 23 HB3 TYR 451 1HB TYR 451 -7.921 -7.819 -9.248 24 HD1 TYR 451 1HD TYR 451 -11.025 -6.095 -10.218 25 HD2 TYR 451 2HD TYR 451 -6.934 -6.747 -11.175 26 HE1 TYR 451 1HE TYR 451 -11.086 -4.188 -11.787 27 HE2 TYR 451 2HE TYR 451 -6.991 -4.845 -12.741 28 HH TYR 451 HH TYR 451 -8.627 -3.588 -14.040 29 H ASN 452 H ASN 452 -9.064 -11.408 -10.948 30 HA ASN 452 HA ASN 452 -8.292 -12.405 -8.294 31 HB2 ASN 452 2HB ASN 452 -10.116 -13.679 -9.461 32 HB3 ASN 452 1HB ASN 452 -9.020 -13.972 -10.801 33 HD21 ASN 452 1HD2 ASN 452 -10.395 -15.886 -9.133 34 HD22 ASN 452 2HD2 ASN 452 -9.199 -16.877 -8.385 35 H THR 453 H THR 453 -6.236 -11.664 -8.236 36 HA THR 453 HA THR 453 -4.306 -13.040 -9.845 37 HB THR 453 HB THR 453 -4.259 -9.974 -9.792 38 HG1 THR 453 1HG THR 453 -5.672 -11.718 -11.349 39 HG21 THR 453 3HG2 THR 453 -2.882 -12.003 -11.567 40 HG22 THR 453 1HG2 THR 453 -2.105 -11.130 -10.250 41 HG23 THR 453 2HG2 THR 453 -2.690 -10.258 -11.665 42 H LYS 454 H LYS 454 -2.025 -12.206 -8.885 43 HA LYS 454 HA LYS 454 -0.662 -11.964 -7.152 44 HB2 LYS 454 2HB LYS 454 -2.986 -10.448 -5.912 45 HB3 LYS 454 1HB LYS 454 -1.456 -10.649 -5.087 46 HG2 LYS 454 2HG LYS 454 -1.582 -8.452 -6.081 47 HG3 LYS 454 1HG LYS 454 -0.343 -9.383 -6.910 48 HD2 LYS 454 2HD LYS 454 -1.936 -9.823 -8.724 49 HD3 LYS 454 1HD LYS 454 -3.152 -8.865 -7.878 50 HE2 LYS 454 2HE LYS 454 -1.704 -6.895 -8.047 51 HE3 LYS 454 1HE LYS 454 -0.489 -7.866 -8.873 52 HZ1 LYS 454 3HZ LYS 454 -1.849 -6.578 -10.418 53 HZ2 LYS 454 1HZ LYS 454 -3.238 -7.377 -9.926 54 HZ3 LYS 454 2HZ LYS 454 -1.971 -8.223 -10.676 55 H LYS 455 H LYS 455 -0.862 -12.232 -4.517 56 HA LYS 455 HA LYS 455 -1.458 -15.033 -4.256 57 HB2 LYS 455 2HB LYS 455 -0.349 -14.756 -2.067 58 HB3 LYS 455 1HB LYS 455 0.629 -14.158 -3.395 59 HG2 LYS 455 2HG LYS 455 -0.132 -11.849 -2.841 60 HG3 LYS 455 1HG LYS 455 -0.963 -12.515 -1.435 61 HD2 LYS 455 2HD LYS 455 2.002 -12.654 -1.986 62 HD3 LYS 455 1HD LYS 455 1.203 -11.583 -0.842 63 HE2 LYS 455 2HE LYS 455 0.442 -13.504 0.458 64 HE3 LYS 455 1HE LYS 455 1.184 -14.601 -0.705 65 HZ1 LYS 455 3HZ LYS 455 2.661 -12.626 0.958 66 HZ2 LYS 455 1HZ LYS 455 3.342 -13.725 -0.123 67 HZ3 LYS 455 2HZ LYS 455 2.568 -14.283 1.252 68 H VAL 456 H VAL 456 -3.743 -13.513 -4.670 69 HA VAL 456 HA VAL 456 -5.844 -13.204 -4.018 70 HB VAL 456 HB VAL 456 -5.085 -14.675 -1.454 71 HG11 VAL 456 1HG1 VAL 456 -7.487 -15.010 -1.115 72 HG12 VAL 456 2HG1 VAL 456 -7.830 -14.029 -2.542 73 HG13 VAL 456 3HG1 VAL 456 -7.086 -13.296 -1.119 74 HG21 VAL 456 3HG2 VAL 456 -6.472 -15.653 -3.948 75 HG22 VAL 456 1HG2 VAL 456 -6.213 -16.597 -2.482 76 HG23 VAL 456 2HG2 VAL 456 -4.831 -16.059 -3.440 77 H GLY 457 H GLY 457 -5.909 -11.105 -4.006 78 HA2 GLY 457 2HA GLY 457 -6.611 -9.479 -2.120 79 HA3 GLY 457 1HA GLY 457 -4.897 -9.616 -1.728 80 H LYS 458 H LYS 458 -6.607 -7.387 -2.859 81 HA LYS 458 HA LYS 458 -5.266 -7.066 -5.417 82 HB2 LYS 458 2HB LYS 458 -6.789 -5.182 -5.845 83 HB3 LYS 458 1HB LYS 458 -7.649 -6.671 -5.512 84 HG2 LYS 458 2HG LYS 458 -8.111 -5.881 -3.232 85 HG3 LYS 458 1HG LYS 458 -7.256 -4.379 -3.588 86 HD2 LYS 458 2HD LYS 458 -8.881 -3.888 -5.369 87 HD3 LYS 458 1HD LYS 458 -9.720 -5.397 -5.010 88 HE2 LYS 458 2HE LYS 458 -10.204 -4.589 -2.749 89 HE3 LYS 458 1HE LYS 458 -9.355 -3.088 -3.102 90 HZ1 LYS 458 3HZ LYS 458 -11.865 -4.036 -4.416 91 HZ2 LYS 458 1HZ LYS 458 -11.037 -2.622 -4.834 92 HZ3 LYS 458 2HZ LYS 458 -11.719 -2.801 -3.319 93 H ARG 459 H ARG 459 -3.970 -5.427 -5.943 94 HA ARG 459 HA ARG 459 -2.874 -3.883 -3.720 95 HB2 ARG 459 2HB ARG 459 -1.672 -4.906 -6.297 96 HB3 ARG 459 1HB ARG 459 -0.888 -3.678 -5.316 97 HG2 ARG 459 2HG ARG 459 -0.540 -5.132 -3.542 98 HG3 ARG 459 1HG ARG 459 -1.697 -6.318 -4.135 99 HD2 ARG 459 2HD ARG 459 0.611 -7.078 -4.433 100 HD3 ARG 459 1HD ARG 459 -0.167 -6.838 -5.987 101 HE ARG 459 HE ARG 459 1.032 -4.560 -5.830 102 HH11 ARG 459 1HH1 ARG 459 2.332 -7.714 -4.818 103 HH12 ARG 459 2HH1 ARG 459 3.940 -7.304 -5.115 104 HH21 ARG 459 1HH2 ARG 459 3.285 -4.018 -6.286 105 HH22 ARG 459 2HH2 ARG 459 4.495 -5.166 -5.976 106 H LEU 460 H LEU 460 -3.069 -1.791 -3.803 107 HA LEU 460 HA LEU 460 -4.159 -0.584 -6.265 108 HB2 LEU 460 2HB LEU 460 -4.955 0.051 -3.431 109 HB3 LEU 460 1HB LEU 460 -5.533 0.870 -4.860 110 HG LEU 460 HG LEU 460 -6.079 -2.011 -4.141 111 HD11 LEU 460 1HD1 LEU 460 -7.861 0.415 -4.129 112 HD12 LEU 460 2HD1 LEU 460 -7.248 -0.456 -2.718 113 HD13 LEU 460 3HD1 LEU 460 -8.373 -1.246 -3.825 114 HD21 LEU 460 3HD2 LEU 460 -7.077 -0.347 -6.461 115 HD22 LEU 460 1HD2 LEU 460 -7.651 -1.958 -6.029 116 HD23 LEU 460 2HD2 LEU 460 -5.984 -1.733 -6.551 117 H ASN 461 H ASN 461 -3.456 1.406 -6.799 118 HA ASN 461 HA ASN 461 -1.152 2.440 -5.326 119 HB2 ASN 461 2HB ASN 461 -0.900 2.070 -7.769 120 HB3 ASN 461 1HB ASN 461 -2.229 3.188 -8.056 121 HD21 ASN 461 1HD2 ASN 461 -1.021 4.641 -9.206 122 HD22 ASN 461 2HD2 ASN 461 0.204 5.623 -8.501 123 H ILE 462 H ILE 462 -1.584 3.965 -3.920 124 HA ILE 462 HA ILE 462 -3.886 5.749 -4.359 125 HB ILE 462 HB ILE 462 -2.433 5.076 -1.781 126 HG12 ILE 462 2HG1 ILE 462 -5.202 4.215 -2.643 127 HG13 ILE 462 1HG1 ILE 462 -3.778 3.161 -2.713 128 HG21 ILE 462 1HG2 ILE 462 -3.409 7.317 -1.781 129 HG22 ILE 462 2HG2 ILE 462 -4.296 6.255 -0.684 130 HG23 ILE 462 3HG2 ILE 462 -4.969 6.652 -2.266 131 HD11 ILE 462 3HD1 ILE 462 -5.159 2.706 -0.781 132 HD12 ILE 462 1HD1 ILE 462 -5.029 4.399 -0.283 133 HD13 ILE 462 2HD1 ILE 462 -3.599 3.367 -0.279 134 H GLN 463 H GLN 463 -3.233 7.715 -5.022 135 HA GLN 463 HA GLN 463 -0.554 8.644 -4.279 136 HB2 GLN 463 2HB GLN 463 -2.542 9.741 -6.268 137 HB3 GLN 463 1HB GLN 463 -1.059 10.567 -5.832 138 HG2 GLN 463 2HG GLN 463 0.241 8.765 -6.692 139 HG3 GLN 463 1HG GLN 463 -1.219 7.841 -7.109 140 HE21 GLN 463 1HE2 GLN 463 0.853 10.506 -7.910 141 HE22 GLN 463 2HE2 GLN 463 0.131 10.852 -9.445 142 H LEU 464 H LEU 464 -0.287 10.052 -2.749 143 HA LEU 464 HA LEU 464 -2.615 11.646 -1.907 144 HB2 LEU 464 2HB LEU 464 -0.460 10.473 -0.156 145 HB3 LEU 464 1HB LEU 464 -1.710 11.549 0.413 146 HG LEU 464 HG LEU 464 -2.100 8.748 -0.640 147 HD11 LEU 464 1HD1 LEU 464 -2.410 9.917 2.104 148 HD12 LEU 464 2HD1 LEU 464 -1.128 8.836 1.557 149 HD13 LEU 464 3HD1 LEU 464 -2.796 8.262 1.632 150 HD21 LEU 464 3HD2 LEU 464 -4.447 9.027 -0.008 151 HD22 LEU 464 1HD2 LEU 464 -3.991 10.163 -1.274 152 HD23 LEU 464 2HD2 LEU 464 -4.145 10.717 0.394 153 H LYS 465 H LYS 465 -2.302 13.714 -1.673 154 HA LYS 465 HA LYS 465 0.377 14.896 -2.132 155 HB2 LYS 465 2HB LYS 465 -0.903 16.882 -2.838 156 HB3 LYS 465 1HB LYS 465 -1.333 15.486 -3.818 157 HG2 LYS 465 2HG LYS 465 -3.322 15.157 -2.508 158 HG3 LYS 465 1HG LYS 465 -2.823 16.492 -1.475 159 HD2 LYS 465 2HD LYS 465 -4.567 17.217 -3.063 160 HD3 LYS 465 1HD LYS 465 -3.040 18.047 -3.349 161 HE2 LYS 465 2HE LYS 465 -2.553 16.591 -5.217 162 HE3 LYS 465 1HE LYS 465 -3.997 15.637 -4.892 163 HZ1 LYS 465 3HZ LYS 465 -4.020 18.515 -5.640 164 HZ2 LYS 465 1HZ LYS 465 -5.350 17.531 -5.399 165 HZ3 LYS 465 2HZ LYS 465 -4.327 17.261 -6.710 166 H LYS 466 H LYS 466 1.012 16.405 -0.746 167 HA LYS 466 HA LYS 466 0.261 15.907 1.963 168 HB2 LYS 466 2HB LYS 466 2.301 17.553 0.627 169 HB3 LYS 466 1HB LYS 466 1.796 18.067 2.205 170 HG2 LYS 466 2HG LYS 466 3.879 16.590 2.047 171 HG3 LYS 466 1HG LYS 466 2.683 16.186 3.254 172 HD2 LYS 466 2HD LYS 466 3.666 14.232 2.043 173 HD3 LYS 466 1HD LYS 466 1.917 14.330 1.979 174 HE2 LYS 466 2HE LYS 466 2.927 13.633 -0.127 175 HE3 LYS 466 1HE LYS 466 2.002 15.108 -0.276 176 HZ1 LYS 466 3HZ LYS 466 4.028 16.360 -0.307 177 HZ2 LYS 466 1HZ LYS 466 4.006 15.175 -1.490 178 HZ3 LYS 466 2HZ LYS 466 4.954 14.917 -0.112 179 H GLY 467 H GLY 467 -1.331 16.674 2.971 180 HA2 GLY 467 2HA GLY 467 -2.345 19.330 2.329 181 HA3 GLY 467 1HA GLY 467 -3.187 18.088 3.266 182 H THR 468 H THR 468 -3.516 19.625 4.925 183 HA THR 468 HA THR 468 -1.424 21.021 6.179 184 HB THR 468 HB THR 468 -4.138 20.226 7.247 185 HG1 THR 468 1HG THR 468 -3.196 22.078 5.393 186 HG21 THR 468 3HG2 THR 468 -2.578 21.139 8.933 187 HG22 THR 468 1HG2 THR 468 -3.925 22.236 8.609 188 HG23 THR 468 2HG2 THR 468 -2.334 22.569 7.928 189 H GLU 469 H GLU 469 -2.947 17.912 6.773 190 HA GLU 469 HA GLU 469 -1.167 17.369 9.037 191 HB2 GLU 469 2HB GLU 469 -3.469 15.801 7.876 192 HB3 GLU 469 1HB GLU 469 -2.520 15.296 9.264 193 HG2 GLU 469 2HG GLU 469 -4.188 17.795 9.105 194 HG3 GLU 469 1HG GLU 469 -4.661 16.275 9.867 195 H GLY 470 H GLY 470 -0.718 17.352 5.903 196 HA2 GLY 470 2HA GLY 470 0.736 16.248 4.524 197 HA3 GLY 470 1HA GLY 470 1.196 15.239 5.895 198 H LEU 471 H LEU 471 0.628 13.198 5.820 199 HA LEU 471 HA LEU 471 -1.143 12.296 3.719 200 HB2 LEU 471 2HB LEU 471 0.843 10.948 5.487 201 HB3 LEU 471 1HB LEU 471 -0.433 9.979 4.787 202 HG LEU 471 HG LEU 471 0.350 10.467 2.544 203 HD11 LEU 471 1HD1 LEU 471 0.996 12.734 2.858 204 HD12 LEU 471 2HD1 LEU 471 2.301 11.820 2.111 205 HD13 LEU 471 3HD1 LEU 471 2.395 12.246 3.827 206 HD21 LEU 471 3HD2 LEU 471 1.457 8.641 3.707 207 HD22 LEU 471 1HD2 LEU 471 2.660 9.767 4.343 208 HD23 LEU 471 2HD2 LEU 471 2.568 9.461 2.611 209 H GLY 472 H GLY 472 -1.016 12.208 7.234 210 HA2 GLY 472 2HA GLY 472 -2.933 12.400 8.598 211 HA3 GLY 472 1HA GLY 472 -3.907 12.040 7.184 212 H PHE 473 H PHE 473 -1.290 9.886 7.812 213 HA PHE 473 HA PHE 473 -2.891 8.211 9.493 214 HB2 PHE 473 2HB PHE 473 -2.939 6.262 8.062 215 HB3 PHE 473 1HB PHE 473 -3.662 7.590 7.177 216 HD1 PHE 473 1HD PHE 473 -2.158 8.798 5.492 217 HD2 PHE 473 2HD PHE 473 -1.227 4.961 7.105 218 HE1 PHE 473 1HE PHE 473 -0.647 8.347 3.614 219 HE2 PHE 473 2HE PHE 473 0.284 4.543 5.259 220 HZ PHE 473 HZ PHE 473 0.575 6.237 3.503 221 H SER 474 H SER 474 -1.697 6.451 10.271 222 HA SER 474 HA SER 474 1.211 6.894 10.137 223 HB2 SER 474 2HB SER 474 -0.483 5.879 12.434 224 HB3 SER 474 1HB SER 474 1.271 6.074 12.479 225 HG SER 474 HG SER 474 0.844 8.306 11.957 226 H ILE 475 H ILE 475 2.456 4.805 10.596 227 HA ILE 475 HA ILE 475 0.977 2.491 9.526 228 HB ILE 475 HB ILE 475 3.091 1.732 8.603 229 HG12 ILE 475 2HG1 ILE 475 4.094 4.501 9.179 230 HG13 ILE 475 1HG1 ILE 475 4.452 2.977 10.025 231 HG21 ILE 475 1HG2 ILE 475 1.489 2.745 7.137 232 HG22 ILE 475 2HG2 ILE 475 3.130 3.138 6.639 233 HG23 ILE 475 3HG2 ILE 475 2.148 4.363 7.463 234 HD11 ILE 475 3HD1 ILE 475 6.233 3.722 8.333 235 HD12 ILE 475 1HD1 ILE 475 5.030 3.446 7.095 236 HD13 ILE 475 2HD1 ILE 475 5.599 2.101 8.082 237 H THR 476 H THR 476 1.314 0.593 10.538 238 HA THR 476 HA THR 476 3.187 0.467 12.783 239 HB THR 476 HB THR 476 0.913 0.806 13.724 240 HG1 THR 476 1HG THR 476 2.302 -0.624 14.853 241 HG21 THR 476 3HG2 THR 476 -0.386 -0.081 11.823 242 HG22 THR 476 1HG2 THR 476 -0.872 -0.831 13.348 243 HG23 THR 476 2HG2 THR 476 0.165 -1.707 12.223 244 H SER 477 H SER 477 3.839 -1.790 13.257 245 HA SER 477 HA SER 477 3.088 -3.563 11.111 246 HB2 SER 477 2HB SER 477 5.295 -4.634 11.127 247 HB3 SER 477 1HB SER 477 5.519 -2.917 10.934 248 HG SER 477 HG SER 477 5.499 -3.379 13.524 249 H ARG 478 H ARG 478 2.441 -5.665 11.994 250 HA ARG 478 HA ARG 478 2.329 -5.508 14.897 251 HB2 ARG 478 2HB ARG 478 0.282 -6.955 14.748 252 HB3 ARG 478 1HB ARG 478 0.143 -5.318 14.130 253 HG2 ARG 478 2HG ARG 478 0.460 -6.239 11.835 254 HG3 ARG 478 1HG ARG 478 0.389 -7.859 12.532 255 HD2 ARG 478 2HD ARG 478 -1.796 -7.123 11.649 256 HD3 ARG 478 1HD ARG 478 -1.840 -7.416 13.388 257 HE ARG 478 HE ARG 478 -1.321 -4.816 13.359 258 HH11 ARG 478 1HH1 ARG 478 -3.782 -6.579 11.471 259 HH12 ARG 478 2HH1 ARG 478 -4.829 -5.268 11.435 260 HH21 ARG 478 1HH2 ARG 478 -2.780 -3.050 13.264 261 HH22 ARG 478 2HH2 ARG 478 -4.258 -3.214 12.442 262 H ASP 479 H ASP 479 3.193 -6.827 16.086 263 HA ASP 479 HA ASP 479 3.812 -9.520 15.338 264 HB2 ASP 479 2HB ASP 479 5.706 -8.411 14.352 265 HB3 ASP 479 1HB ASP 479 5.922 -7.399 15.772 266 H VAL 480 H VAL 480 2.902 -10.381 17.038 267 HA VAL 480 HA VAL 480 3.269 -9.146 19.665 268 HB VAL 480 HB VAL 480 1.305 -11.287 18.808 269 HG11 VAL 480 1HG1 VAL 480 1.511 -9.740 21.381 270 HG12 VAL 480 2HG1 VAL 480 1.865 -11.452 21.155 271 HG13 VAL 480 3HG1 VAL 480 0.214 -10.861 20.960 272 HG21 VAL 480 3HG2 VAL 480 -0.404 -9.526 18.988 273 HG22 VAL 480 1HG2 VAL 480 0.797 -9.144 17.754 274 HG23 VAL 480 2HG2 VAL 480 0.858 -8.345 19.324 275 H THR 481 H THR 481 3.419 -12.270 17.999 276 HA THR 481 HA THR 481 5.256 -13.139 20.046 277 HB THR 481 HB THR 481 3.254 -14.044 20.866 278 HG1 THR 481 1HG THR 481 4.890 -15.567 20.851 279 HG21 THR 481 3HG2 THR 481 2.608 -15.038 18.082 280 HG22 THR 481 1HG2 THR 481 1.797 -13.728 18.935 281 HG23 THR 481 2HG2 THR 481 1.658 -15.384 19.529 282 H ILE 482 H ILE 482 7.061 -13.478 19.059 283 HA ILE 482 HA ILE 482 8.654 -14.288 17.734 284 HB ILE 482 HB ILE 482 6.574 -16.356 16.952 285 HG12 ILE 482 2HG1 ILE 482 8.774 -16.397 19.040 286 HG13 ILE 482 1HG1 ILE 482 7.050 -16.283 19.351 287 HG21 ILE 482 1HG2 ILE 482 9.574 -16.418 16.600 288 HG22 ILE 482 2HG2 ILE 482 8.391 -16.263 15.303 289 HG23 ILE 482 3HG2 ILE 482 8.470 -17.749 16.251 290 HD11 ILE 482 3HD1 ILE 482 7.889 -18.517 19.765 291 HD12 ILE 482 1HD1 ILE 482 8.470 -18.619 18.104 292 HD13 ILE 482 2HD1 ILE 482 6.739 -18.514 18.425 293 H GLY 483 H GLY 483 9.213 -12.816 16.299 294 HA2 GLY 483 2HA GLY 483 8.712 -13.150 13.590 295 HA3 GLY 483 1HA GLY 483 7.609 -11.911 14.179 296 H GLY 484 H GLY 484 8.912 -10.417 15.851 297 HA2 GLY 484 2HA GLY 484 10.667 -8.931 16.173 298 HA3 GLY 484 1HA GLY 484 11.592 -9.803 14.946 299 H SER 485 H SER 485 8.596 -8.033 15.165 300 HA SER 485 HA SER 485 7.628 -6.415 13.965 301 HB2 SER 485 2HB SER 485 9.845 -5.217 13.787 302 HB3 SER 485 1HB SER 485 10.216 -6.163 12.355 303 HG SER 485 HG SER 485 7.984 -4.387 12.594 304 H ALA 486 H ALA 486 7.008 -6.007 11.513 305 HA ALA 486 HA ALA 486 6.812 -8.501 10.057 306 HB1 ALA 486 1HB ALA 486 4.518 -7.162 11.503 307 HB2 ALA 486 2HB ALA 486 5.122 -8.779 11.784 308 HB3 ALA 486 3HB ALA 486 4.257 -8.394 10.290 309 HA PRO 487 HA PRO 487 5.961 -5.523 6.700 310 HB2 PRO 487 2HB PRO 487 3.374 -6.120 5.862 311 HB3 PRO 487 1HB PRO 487 4.832 -6.923 5.268 312 HG2 PRO 487 2HG PRO 487 2.932 -7.789 7.410 313 HG3 PRO 487 1HG PRO 487 3.694 -8.756 6.136 314 HD2 PRO 487 2HD PRO 487 4.640 -8.894 8.575 315 HD3 PRO 487 1HD PRO 487 5.745 -8.773 7.208 316 H ILE 488 H ILE 488 4.408 -3.730 6.121 317 HA ILE 488 HA ILE 488 3.477 -2.669 8.639 318 HB ILE 488 HB ILE 488 4.499 -1.266 6.137 319 HG12 ILE 488 2HG1 ILE 488 6.117 -2.008 7.907 320 HG13 ILE 488 1HG1 ILE 488 6.010 -0.283 7.552 321 HG21 ILE 488 1HG2 ILE 488 3.948 0.806 7.102 322 HG22 ILE 488 2HG2 ILE 488 3.020 -0.088 8.352 323 HG23 ILE 488 3HG2 ILE 488 2.520 -0.155 6.665 324 HD11 ILE 488 3HD1 ILE 488 4.910 0.186 9.541 325 HD12 ILE 488 1HD1 ILE 488 6.268 -0.827 9.976 326 HD13 ILE 488 2HD1 ILE 488 4.627 -1.502 9.935 327 H TYR 489 H TYR 489 1.559 -2.018 9.039 328 HA TYR 489 HA TYR 489 -0.469 -1.950 6.931 329 HB2 TYR 489 2HB TYR 489 -0.827 -2.924 9.801 330 HB3 TYR 489 1HB TYR 489 -2.108 -2.708 8.630 331 HD1 TYR 489 2HD TYR 489 0.896 -4.706 9.404 332 HD2 TYR 489 1HD TYR 489 -2.593 -4.355 7.012 333 HE1 TYR 489 2HE TYR 489 1.238 -6.977 8.611 334 HE2 TYR 489 1HE TYR 489 -2.273 -6.644 6.191 335 HH TYR 489 HH TYR 489 -0.055 -8.785 7.639 336 H VAL 490 H VAL 490 -2.053 -0.380 7.327 337 HA VAL 490 HA VAL 490 -1.082 2.033 8.407 338 HB VAL 490 HB VAL 490 -3.932 1.296 7.736 339 HG11 VAL 490 1HG1 VAL 490 -2.665 4.004 8.157 340 HG12 VAL 490 2HG1 VAL 490 -3.861 3.238 9.201 341 HG13 VAL 490 3HG1 VAL 490 -4.301 3.722 7.565 342 HG21 VAL 490 3HG2 VAL 490 -2.435 1.066 5.852 343 HG22 VAL 490 1HG2 VAL 490 -1.814 2.701 6.127 344 HG23 VAL 490 2HG2 VAL 490 -3.502 2.456 5.661 345 H LYS 491 H LYS 491 -0.986 2.744 10.376 346 HA LYS 491 HA LYS 491 -1.968 1.217 12.592 347 HB2 LYS 491 2HB LYS 491 0.164 2.324 12.677 348 HB3 LYS 491 1HB LYS 491 -0.588 3.863 12.369 349 HG2 LYS 491 2HG LYS 491 -1.767 3.724 14.516 350 HG3 LYS 491 1HG LYS 491 -0.947 2.195 14.836 351 HD2 LYS 491 2HD LYS 491 1.193 3.278 14.816 352 HD3 LYS 491 1HD LYS 491 0.465 4.802 14.304 353 HE2 LYS 491 2HE LYS 491 0.901 4.915 16.674 354 HE3 LYS 491 1HE LYS 491 -0.834 4.836 16.334 355 HZ1 LYS 491 3HZ LYS 491 -0.865 2.521 16.965 356 HZ2 LYS 491 1HZ LYS 491 -0.160 3.406 18.207 357 HZ3 LYS 491 2HZ LYS 491 0.809 2.515 17.170 358 H ASN 492 H ASN 492 -2.930 4.279 11.057 359 HA ASN 492 HA ASN 492 -5.540 4.231 12.237 360 HB2 ASN 492 2HB ASN 492 -4.153 4.879 14.229 361 HB3 ASN 492 1HB ASN 492 -3.581 6.278 13.350 362 HD21 ASN 492 1HD2 ASN 492 -4.980 6.047 15.870 363 HD22 ASN 492 2HD2 ASN 492 -6.405 7.006 15.771 364 H ILE 493 H ILE 493 -6.865 5.559 11.088 365 HA ILE 493 HA ILE 493 -5.682 7.374 9.098 366 HB ILE 493 HB ILE 493 -8.524 6.272 9.326 367 HG12 ILE 493 2HG1 ILE 493 -6.888 4.549 8.671 368 HG13 ILE 493 1HG1 ILE 493 -8.020 4.913 7.377 369 HG21 ILE 493 1HG2 ILE 493 -7.292 7.921 7.112 370 HG22 ILE 493 2HG2 ILE 493 -8.574 8.466 8.200 371 HG23 ILE 493 3HG2 ILE 493 -8.866 7.170 7.042 372 HD11 ILE 493 3HD1 ILE 493 -5.807 4.640 6.494 373 HD12 ILE 493 1HD1 ILE 493 -5.172 5.875 7.582 374 HD13 ILE 493 2HD1 ILE 493 -6.310 6.311 6.303 375 H LEU 494 H LEU 494 -5.547 9.417 9.831 376 HA LEU 494 HA LEU 494 -7.060 10.265 12.084 377 HB2 LEU 494 2HB LEU 494 -5.063 11.698 10.329 378 HB3 LEU 494 1HB LEU 494 -5.897 12.502 11.636 379 HG LEU 494 HG LEU 494 -4.827 10.910 13.238 380 HD11 LEU 494 1HD1 LEU 494 -3.225 10.010 10.859 381 HD12 LEU 494 2HD1 LEU 494 -4.385 9.033 11.760 382 HD13 LEU 494 3HD1 LEU 494 -2.900 9.589 12.538 383 HD21 LEU 494 3HD2 LEU 494 -3.892 13.100 12.872 384 HD22 LEU 494 1HD2 LEU 494 -2.957 12.503 11.504 385 HD23 LEU 494 2HD2 LEU 494 -2.602 11.928 13.132 386 HA PRO 495 HA PRO 495 -10.564 12.121 10.148 387 HB2 PRO 495 2HB PRO 495 -10.293 14.492 11.883 388 HB3 PRO 495 1HB PRO 495 -11.605 13.312 11.803 389 HG2 PRO 495 2HG PRO 495 -9.925 13.373 13.876 390 HG3 PRO 495 1HG PRO 495 -10.547 11.839 13.235 391 HD2 PRO 495 2HD PRO 495 -7.879 13.131 12.829 392 HD3 PRO 495 1HD PRO 495 -8.279 11.427 13.138 393 H ARG 496 H ARG 496 -7.605 13.794 10.269 394 HA ARG 496 HA ARG 496 -8.422 15.506 8.054 395 HB2 ARG 496 2HB ARG 496 -6.619 16.240 10.370 396 HB3 ARG 496 1HB ARG 496 -6.824 17.225 8.928 397 HG2 ARG 496 2HG ARG 496 -9.204 17.515 9.508 398 HG3 ARG 496 1HG ARG 496 -8.948 16.532 10.953 399 HD2 ARG 496 2HD ARG 496 -7.535 19.125 10.332 400 HD3 ARG 496 1HD ARG 496 -8.898 18.950 11.436 401 HE ARG 496 HE ARG 496 -7.269 17.256 12.539 402 HH11 ARG 496 1HH1 ARG 496 -6.391 20.398 11.164 403 HH12 ARG 496 2HH1 ARG 496 -5.127 20.699 12.250 404 HH21 ARG 496 1HH2 ARG 496 -5.535 17.667 14.046 405 HH22 ARG 496 2HH2 ARG 496 -4.625 19.100 13.954 406 H GLY 497 H GLY 497 -7.064 15.405 6.344 407 HA2 GLY 497 2HA GLY 497 -4.489 15.196 6.003 408 HA3 GLY 497 1HA GLY 497 -4.812 13.589 6.633 409 H ALA 498 H ALA 498 -3.658 13.787 4.239 410 HA ALA 498 HA ALA 498 -5.278 14.062 1.978 411 HB1 ALA 498 1HB ALA 498 -2.749 12.454 2.307 412 HB2 ALA 498 2HB ALA 498 -2.828 14.172 1.968 413 HB3 ALA 498 3HB ALA 498 -3.438 13.016 0.786 414 H ALA 499 H ALA 499 -4.326 11.181 3.791 415 HA ALA 499 HA ALA 499 -5.331 9.250 2.044 416 HB1 ALA 499 1HB ALA 499 -3.746 8.745 3.836 417 HB2 ALA 499 2HB ALA 499 -5.165 7.699 3.901 418 HB3 ALA 499 3HB ALA 499 -5.012 9.044 5.029 419 H ILE 500 H ILE 500 -6.903 10.815 4.808 420 HA ILE 500 HA ILE 500 -9.194 9.148 4.544 421 HB ILE 500 HB ILE 500 -8.473 10.157 6.748 422 HG12 ILE 500 2HG1 ILE 500 -11.318 10.641 5.824 423 HG13 ILE 500 1HG1 ILE 500 -10.667 9.174 6.487 424 HG21 ILE 500 1HG2 ILE 500 -7.942 12.413 6.005 425 HG22 ILE 500 2HG2 ILE 500 -9.161 12.454 7.282 426 HG23 ILE 500 3HG2 ILE 500 -9.636 12.696 5.603 427 HD11 ILE 500 3HD1 ILE 500 -10.956 11.756 7.996 428 HD12 ILE 500 1HD1 ILE 500 -10.333 10.240 8.646 429 HD13 ILE 500 2HD1 ILE 500 -12.013 10.350 8.128 430 H GLN 501 H GLN 501 -8.280 12.311 3.349 431 HA GLN 501 HA GLN 501 -10.834 13.121 2.467 432 HB2 GLN 501 2HB GLN 501 -8.090 13.919 1.530 433 HB3 GLN 501 1HB GLN 501 -9.562 14.606 0.866 434 HG2 GLN 501 2HG GLN 501 -10.172 15.441 3.066 435 HG3 GLN 501 1HG GLN 501 -8.703 14.739 3.744 436 HE21 GLN 501 1HE2 GLN 501 -8.036 16.751 4.407 437 HE22 GLN 501 2HE2 GLN 501 -7.413 17.945 3.338 438 H ASP 502 H ASP 502 -8.320 11.227 0.892 439 HA ASP 502 HA ASP 502 -9.733 11.102 -1.616 440 HB2 ASP 502 2HB ASP 502 -7.219 10.645 -1.289 441 HB3 ASP 502 1HB ASP 502 -7.684 9.085 -0.626 442 H GLY 503 H GLY 503 -9.712 9.343 1.368 443 HA2 GLY 503 2HA GLY 503 -11.126 7.738 2.249 444 HA3 GLY 503 1HA GLY 503 -12.233 8.117 0.930 445 H ARG 504 H ARG 504 -8.988 6.938 0.839 446 HA ARG 504 HA ARG 504 -9.876 4.756 -0.954 447 HB2 ARG 504 2HB ARG 504 -8.222 6.725 -1.513 448 HB3 ARG 504 1HB ARG 504 -7.076 5.713 -0.662 449 HG2 ARG 504 2HG ARG 504 -6.886 5.344 -3.004 450 HG3 ARG 504 1HG ARG 504 -7.594 3.893 -2.268 451 HD2 ARG 504 2HD ARG 504 -9.722 4.405 -3.055 452 HD3 ARG 504 1HD ARG 504 -9.301 6.085 -3.386 453 HE ARG 504 HE ARG 504 -8.539 3.743 -4.955 454 HH11 ARG 504 1HH1 ARG 504 -8.647 7.281 -4.515 455 HH12 ARG 504 2HH1 ARG 504 -8.429 7.652 -6.143 456 HH21 ARG 504 1HH2 ARG 504 -8.202 4.235 -7.220 457 HH22 ARG 504 2HH2 ARG 504 -8.134 5.863 -7.747 458 H LEU 505 H LEU 505 -7.411 5.648 1.336 459 HA LEU 505 HA LEU 505 -6.578 2.999 2.027 460 HB2 LEU 505 2HB LEU 505 -5.109 4.961 1.785 461 HB3 LEU 505 1HB LEU 505 -5.939 5.723 3.113 462 HG LEU 505 HG LEU 505 -5.088 3.895 4.588 463 HD11 LEU 505 1HD1 LEU 505 -3.481 3.229 2.139 464 HD12 LEU 505 2HD1 LEU 505 -4.599 2.147 3.008 465 HD13 LEU 505 3HD1 LEU 505 -3.106 2.738 3.779 466 HD21 LEU 505 3HD2 LEU 505 -3.091 5.576 3.125 467 HD22 LEU 505 1HD2 LEU 505 -2.843 4.794 4.683 468 HD23 LEU 505 2HD2 LEU 505 -4.063 6.048 4.526 469 H LYS 506 H LYS 506 -6.973 1.987 4.038 470 HA LYS 506 HA LYS 506 -8.636 3.403 5.989 471 HB2 LYS 506 2HB LYS 506 -9.908 1.401 6.452 472 HB3 LYS 506 1HB LYS 506 -10.001 1.671 4.721 473 HG2 LYS 506 2HG LYS 506 -8.330 -0.047 4.335 474 HG3 LYS 506 1HG LYS 506 -8.124 -0.252 6.066 475 HD2 LYS 506 2HD LYS 506 -10.470 -0.982 6.259 476 HD3 LYS 506 1HD LYS 506 -10.647 -0.814 4.509 477 HE2 LYS 506 2HE LYS 506 -8.958 -2.510 4.145 478 HE3 LYS 506 1HE LYS 506 -8.666 -2.626 5.877 479 HZ1 LYS 506 3HZ LYS 506 -11.201 -3.346 4.492 480 HZ2 LYS 506 1HZ LYS 506 -10.944 -3.434 6.146 481 HZ3 LYS 506 2HZ LYS 506 -10.071 -4.422 5.104 482 H ALA 507 H ALA 507 -8.454 2.086 8.113 483 HA ALA 507 HA ALA 507 -5.681 1.687 8.660 484 HB1 ALA 507 1HB ALA 507 -6.437 1.157 10.936 485 HB2 ALA 507 2HB ALA 507 -8.110 1.158 10.378 486 HB3 ALA 507 3HB ALA 507 -7.170 2.651 10.347 487 H GLY 508 H GLY 508 -4.614 -0.183 8.485 488 HA2 GLY 508 2HA GLY 508 -4.492 -2.553 8.888 489 HA3 GLY 508 1HA GLY 508 -6.177 -2.677 8.422 490 H ASP 509 H ASP 509 -4.760 -0.593 6.221 491 HA ASP 509 HA ASP 509 -4.496 -2.735 4.327 492 HB2 ASP 509 2HB ASP 509 -4.007 0.233 3.989 493 HB3 ASP 509 1HB ASP 509 -3.752 -0.936 2.704 494 H ARG 510 H ARG 510 -2.724 -3.480 3.347 495 HA ARG 510 HA ARG 510 -0.366 -3.268 5.028 496 HB2 ARG 510 2HB ARG 510 -1.234 -5.467 4.651 497 HB3 ARG 510 1HB ARG 510 -1.244 -5.267 2.923 498 HG2 ARG 510 2HG ARG 510 1.210 -5.317 2.906 499 HG3 ARG 510 1HG ARG 510 1.220 -5.430 4.672 500 HD2 ARG 510 2HD ARG 510 0.011 -7.533 4.589 501 HD3 ARG 510 1HD ARG 510 -0.126 -7.414 2.841 502 HE ARG 510 HE ARG 510 2.433 -7.531 2.936 503 HH11 ARG 510 1HH1 ARG 510 0.398 -9.134 5.370 504 HH12 ARG 510 2HH1 ARG 510 1.382 -10.510 5.488 505 HH21 ARG 510 1HH2 ARG 510 3.779 -9.455 3.116 506 HH22 ARG 510 2HH2 ARG 510 3.325 -10.714 4.180 507 H LEU 511 H LEU 511 1.141 -1.938 4.464 508 HA LEU 511 HA LEU 511 1.092 -0.659 1.883 509 HB2 LEU 511 2HB LEU 511 1.744 0.334 4.355 510 HB3 LEU 511 1HB LEU 511 3.291 -0.293 3.884 511 HG LEU 511 HG LEU 511 1.764 1.865 2.455 512 HD11 LEU 511 1HD1 LEU 511 2.676 2.639 4.503 513 HD12 LEU 511 2HD1 LEU 511 3.587 3.322 3.156 514 HD13 LEU 511 3HD1 LEU 511 4.264 1.992 4.096 515 HD21 LEU 511 3HD2 LEU 511 3.824 2.156 1.077 516 HD22 LEU 511 1HD2 LEU 511 2.974 0.645 0.791 517 HD23 LEU 511 2HD2 LEU 511 4.442 0.641 1.752 518 H ILE 512 H ILE 512 2.195 -1.396 0.164 519 HA ILE 512 HA ILE 512 4.071 -3.622 0.518 520 HB ILE 512 HB ILE 512 2.702 -2.579 -1.985 521 HG12 ILE 512 2HG1 ILE 512 1.113 -3.612 -0.433 522 HG13 ILE 512 1HG1 ILE 512 1.323 -4.575 -1.873 523 HG21 ILE 512 1HG2 ILE 512 4.380 -5.053 -1.619 524 HG22 ILE 512 2HG2 ILE 512 4.824 -3.618 -2.546 525 HG23 ILE 512 3HG2 ILE 512 3.476 -4.635 -3.068 526 HD11 ILE 512 3HD1 ILE 512 2.823 -6.088 -0.673 527 HD12 ILE 512 1HD1 ILE 512 1.233 -5.998 0.079 528 HD13 ILE 512 2HD1 ILE 512 2.596 -5.142 0.804 529 H GLU 513 H GLU 513 3.779 -0.611 -1.362 530 HA GLU 513 HA GLU 513 6.585 -0.168 -1.103 531 HB2 GLU 513 2HB GLU 513 7.029 -0.027 -3.528 532 HB3 GLU 513 1HB GLU 513 6.598 -1.654 -3.033 533 HG2 GLU 513 2HG GLU 513 4.409 -1.413 -3.933 534 HG3 GLU 513 1HG GLU 513 4.702 0.302 -4.241 535 H VAL 514 H VAL 514 7.184 1.860 -1.810 536 HA VAL 514 HA VAL 514 5.004 3.765 -2.336 537 HB VAL 514 HB VAL 514 5.580 3.988 0.048 538 HG11 VAL 514 1HG1 VAL 514 7.796 4.761 0.779 539 HG12 VAL 514 2HG1 VAL 514 8.374 4.618 -0.885 540 HG13 VAL 514 3HG1 VAL 514 7.879 3.178 -0.004 541 HG21 VAL 514 3HG2 VAL 514 6.059 6.377 0.100 542 HG22 VAL 514 1HG2 VAL 514 4.933 5.977 -1.211 543 HG23 VAL 514 2HG2 VAL 514 6.622 6.296 -1.569 544 H ASN 515 H ASN 515 5.354 4.913 -4.100 545 HA ASN 515 HA ASN 515 6.288 5.973 -5.883 546 HB2 ASN 515 2HB ASN 515 8.532 6.489 -3.927 547 HB3 ASN 515 1HB ASN 515 8.399 7.261 -5.499 548 HD21 ASN 515 1HD2 ASN 515 8.446 8.442 -2.870 549 HD22 ASN 515 2HD2 ASN 515 6.973 9.340 -2.726 550 H GLY 516 H GLY 516 7.197 3.070 -5.266 551 HA2 GLY 516 2HA GLY 516 8.148 1.740 -7.055 552 HA3 GLY 516 1HA GLY 516 9.284 3.051 -7.353 553 H VAL 517 H VAL 517 8.975 2.753 -4.077 554 HA VAL 517 HA VAL 517 11.373 1.074 -3.908 555 HB VAL 517 HB VAL 517 10.180 2.979 -1.862 556 HG11 VAL 517 1HG1 VAL 517 12.814 1.512 -1.852 557 HG12 VAL 517 2HG1 VAL 517 11.431 1.184 -0.809 558 HG13 VAL 517 3HG1 VAL 517 12.307 2.709 -0.660 559 HG21 VAL 517 3HG2 VAL 517 11.050 4.202 -3.782 560 HG22 VAL 517 1HG2 VAL 517 12.584 3.347 -3.647 561 HG23 VAL 517 2HG2 VAL 517 12.077 4.456 -2.371 562 H ASP 518 H ASP 518 11.043 -0.926 -3.198 563 HA ASP 518 HA ASP 518 8.482 -1.686 -2.072 564 HB2 ASP 518 2HB ASP 518 10.924 -3.277 -2.822 565 HB3 ASP 518 1HB ASP 518 9.559 -3.996 -1.984 566 H LEU 519 H LEU 519 8.019 -1.982 -0.056 567 HA LEU 519 HA LEU 519 10.213 -2.161 1.854 568 HB2 LEU 519 2HB LEU 519 8.595 -0.979 3.432 569 HB3 LEU 519 1HB LEU 519 9.551 -0.017 2.318 570 HG LEU 519 HG LEU 519 6.714 -0.749 1.582 571 HD11 LEU 519 1HD1 LEU 519 7.620 1.527 3.361 572 HD12 LEU 519 2HD1 LEU 519 6.597 0.170 3.873 573 HD13 LEU 519 3HD1 LEU 519 6.011 1.306 2.660 574 HD21 LEU 519 3HD2 LEU 519 8.464 1.629 1.166 575 HD22 LEU 519 1HD2 LEU 519 6.872 1.362 0.463 576 HD23 LEU 519 2HD2 LEU 519 8.234 0.322 0.007 577 H ALA 520 H ALA 520 8.078 -3.927 0.533 578 HA ALA 520 HA ALA 520 6.386 -4.929 2.542 579 HB1 ALA 520 1HB ALA 520 5.994 -5.311 0.180 580 HB2 ALA 520 2HB ALA 520 6.103 -6.845 1.042 581 HB3 ALA 520 3HB ALA 520 7.465 -6.275 0.078 582 H GLY 521 H GLY 521 9.724 -5.501 1.838 583 HA2 GLY 521 2HA GLY 521 9.788 -7.693 3.806 584 HA3 GLY 521 1HA GLY 521 10.959 -7.463 2.512 585 H LYS 522 H LYS 522 9.961 -4.606 4.066 586 HA LYS 522 HA LYS 522 12.568 -4.426 5.353 587 HB2 LYS 522 2HB LYS 522 10.499 -2.319 4.741 588 HB3 LYS 522 1HB LYS 522 11.910 -2.041 5.718 589 HG2 LYS 522 2HG LYS 522 11.990 -2.929 2.847 590 HG3 LYS 522 1HG LYS 522 12.245 -1.273 3.422 591 HD2 LYS 522 2HD LYS 522 14.056 -2.208 4.897 592 HD3 LYS 522 1HD LYS 522 13.885 -3.709 4.019 593 HE2 LYS 522 2HE LYS 522 14.464 -2.613 1.943 594 HE3 LYS 522 1HE LYS 522 14.568 -1.062 2.779 595 HZ1 LYS 522 3HZ LYS 522 16.283 -3.429 3.239 596 HZ2 LYS 522 1HZ LYS 522 16.318 -2.032 4.185 597 HZ3 LYS 522 2HZ LYS 522 16.763 -1.963 2.559 598 H SER 523 H SER 523 12.752 -3.524 7.452 599 HA SER 523 HA SER 523 10.790 -4.689 9.206 600 HB2 SER 523 2HB SER 523 13.393 -3.235 9.705 601 HB3 SER 523 1HB SER 523 12.440 -4.044 10.963 602 HG SER 523 HG SER 523 14.192 -5.071 9.157 603 H GLN 524 H GLN 524 9.778 -3.316 10.944 604 HA GLN 524 HA GLN 524 8.559 -1.119 9.782 605 HB2 GLN 524 2HB GLN 524 7.567 -0.575 11.912 606 HB3 GLN 524 1HB GLN 524 7.539 -2.311 11.659 607 HG2 GLN 524 2HG GLN 524 9.366 -2.598 13.186 608 HG3 GLN 524 1HG GLN 524 9.527 -0.848 13.371 609 HE21 GLN 524 1HE2 GLN 524 9.017 -2.880 15.328 610 HE22 GLN 524 2HE2 GLN 524 7.532 -2.447 16.097 611 H GLU 525 H GLU 525 11.391 -1.206 11.809 612 HA GLU 525 HA GLU 525 11.464 1.543 12.457 613 HB2 GLU 525 2HB GLU 525 12.844 -0.238 13.520 614 HB3 GLU 525 1HB GLU 525 13.808 -0.294 12.040 615 HG2 GLU 525 2HG GLU 525 14.448 2.049 12.410 616 HG3 GLU 525 1HG GLU 525 13.539 2.038 13.924 617 H GLU 526 H GLU 526 12.426 -0.205 9.622 618 HA GLU 526 HA GLU 526 14.092 1.800 8.533 619 HB2 GLU 526 2HB GLU 526 12.579 -0.376 7.137 620 HB3 GLU 526 1HB GLU 526 13.957 0.491 6.486 621 HG2 GLU 526 2HG GLU 526 15.216 -0.423 8.532 622 HG3 GLU 526 1HG GLU 526 13.795 -1.414 8.723 623 H VAL 527 H VAL 527 10.844 0.703 8.020 624 HA VAL 527 HA VAL 527 10.265 2.698 6.072 625 HB VAL 527 HB VAL 527 8.027 1.610 5.963 626 HG11 VAL 527 1HG1 VAL 527 8.926 -0.535 5.193 627 HG12 VAL 527 2HG1 VAL 527 10.466 -0.138 5.959 628 HG13 VAL 527 3HG1 VAL 527 9.879 0.827 4.589 629 HG21 VAL 527 3HG2 VAL 527 9.255 -0.170 8.032 630 HG22 VAL 527 1HG2 VAL 527 7.774 -0.496 7.135 631 HG23 VAL 527 2HG2 VAL 527 7.838 0.866 8.279 632 H VAL 528 H VAL 528 9.366 2.186 9.444 633 HA VAL 528 HA VAL 528 7.489 4.236 9.609 634 HB VAL 528 HB VAL 528 9.241 3.003 11.784 635 HG11 VAL 528 1HG1 VAL 528 8.605 5.271 12.466 636 HG12 VAL 528 2HG1 VAL 528 7.748 4.056 13.415 637 HG13 VAL 528 3HG1 VAL 528 6.916 4.903 12.110 638 HG21 VAL 528 3HG2 VAL 528 6.284 2.649 11.146 639 HG22 VAL 528 1HG2 VAL 528 7.144 1.868 12.461 640 HG23 VAL 528 2HG2 VAL 528 7.540 1.476 10.803 641 H SER 529 H SER 529 10.977 4.317 9.857 642 HA SER 529 HA SER 529 11.151 7.032 10.590 643 HB2 SER 529 2HB SER 529 13.159 5.347 9.067 644 HB3 SER 529 1HB SER 529 13.496 6.878 9.875 645 HG SER 529 HG SER 529 13.137 4.342 10.918 646 H LEU 530 H LEU 530 10.703 5.456 7.525 647 HA LEU 530 HA LEU 530 11.343 7.728 5.900 648 HB2 LEU 530 2HB LEU 530 9.905 5.192 5.473 649 HB3 LEU 530 1HB LEU 530 10.219 6.266 4.122 650 HG LEU 530 HG LEU 530 12.182 4.672 5.796 651 HD11 LEU 530 1HD1 LEU 530 11.512 4.566 2.866 652 HD12 LEU 530 2HD1 LEU 530 11.031 3.392 4.092 653 HD13 LEU 530 3HD1 LEU 530 12.734 3.590 3.679 654 HD21 LEU 530 3HD2 LEU 530 13.970 5.581 4.394 655 HD22 LEU 530 1HD2 LEU 530 13.172 6.852 5.317 656 HD23 LEU 530 2HD2 LEU 530 12.811 6.642 3.600 657 H LEU 531 H LEU 531 8.242 6.031 6.728 658 HA LEU 531 HA LEU 531 6.703 7.927 5.424 659 HB2 LEU 531 2HB LEU 531 6.041 5.711 7.343 660 HB3 LEU 531 1HB LEU 531 4.818 6.826 6.771 661 HG LEU 531 HG LEU 531 4.800 4.757 5.586 662 HD11 LEU 531 1HD1 LEU 531 4.063 6.729 4.395 663 HD12 LEU 531 2HD1 LEU 531 4.841 5.616 3.269 664 HD13 LEU 531 3HD1 LEU 531 5.702 7.047 3.836 665 HD21 LEU 531 3HD2 LEU 531 7.581 5.412 4.626 666 HD22 LEU 531 1HD2 LEU 531 6.576 4.109 3.992 667 HD23 LEU 531 2HD2 LEU 531 7.117 4.069 5.671 668 H ARG 532 H ARG 532 7.834 7.817 8.728 669 HA ARG 532 HA ARG 532 6.089 9.904 9.535 670 HB2 ARG 532 2HB ARG 532 8.636 8.890 10.781 671 HB3 ARG 532 1HB ARG 532 7.670 10.184 11.482 672 HG2 ARG 532 2HG ARG 532 5.767 8.636 11.653 673 HG3 ARG 532 1HG ARG 532 6.771 7.358 10.974 674 HD2 ARG 532 2HD ARG 532 6.631 7.228 13.423 675 HD3 ARG 532 1HD ARG 532 8.279 7.489 12.862 676 HE ARG 532 HE ARG 532 7.610 9.965 13.344 677 HH11 ARG 532 1HH1 ARG 532 6.829 7.124 15.335 678 HH12 ARG 532 2HH1 ARG 532 6.844 7.990 16.799 679 HH21 ARG 532 1HH2 ARG 532 7.647 11.112 15.305 680 HH22 ARG 532 2HH2 ARG 532 7.303 10.321 16.798 681 H SER 533 H SER 533 9.133 9.866 7.896 682 HA SER 533 HA SER 533 9.824 12.577 8.466 683 HB2 SER 533 2HB SER 533 11.526 10.887 7.806 684 HB3 SER 533 1HB SER 533 10.742 10.715 6.243 685 HG SER 533 HG SER 533 11.723 13.199 7.178 686 H THR 534 H THR 534 8.524 10.830 5.674 687 HA THR 534 HA THR 534 7.025 11.322 4.110 688 HB THR 534 HB THR 534 6.411 13.873 5.636 689 HG1 THR 534 1HG THR 534 6.076 11.332 6.383 690 HG21 THR 534 3HG2 THR 534 4.841 12.187 3.739 691 HG22 THR 534 1HG2 THR 534 5.527 13.772 3.371 692 HG23 THR 534 2HG2 THR 534 4.226 13.629 4.577 693 H LYS 535 H LYS 535 7.442 11.965 2.088 694 HA LYS 535 HA LYS 535 9.311 14.112 1.533 695 HB2 LYS 535 2HB LYS 535 9.327 11.946 0.259 696 HB3 LYS 535 1HB LYS 535 7.724 12.316 -0.335 697 HG2 LYS 535 2HG LYS 535 8.631 14.270 -1.529 698 HG3 LYS 535 1HG LYS 535 10.243 13.865 -0.937 699 HD2 LYS 535 2HD LYS 535 10.089 11.671 -2.054 700 HD3 LYS 535 1HD LYS 535 8.508 12.110 -2.670 701 HE2 LYS 535 2HE LYS 535 10.192 12.416 -4.389 702 HE3 LYS 535 1HE LYS 535 9.519 13.974 -3.922 703 HZ1 LYS 535 3HZ LYS 535 11.506 14.377 -2.575 704 HZ2 LYS 535 1HZ LYS 535 11.919 14.061 -4.161 705 HZ3 LYS 535 2HZ LYS 535 12.132 12.884 -2.985 706 H MET 536 H MET 536 8.584 16.174 1.243 707 HA MET 536 HA MET 536 5.680 16.592 1.045 708 HB2 MET 536 2HB MET 536 6.121 18.877 1.747 709 HB3 MET 536 1HB MET 536 6.750 17.719 2.922 710 HG2 MET 536 2HG MET 536 8.353 19.262 0.868 711 HG3 MET 536 1HG MET 536 8.228 19.662 2.577 712 HE1 MET 536 3HE MET 536 10.873 19.760 2.707 713 HE2 MET 536 1HE MET 536 11.002 19.327 0.999 714 HE3 MET 536 2HE MET 536 11.930 18.442 2.206 715 H GLU 537 H GLU 537 7.376 15.961 -1.278 716 HA GLU 537 HA GLU 537 7.636 18.385 -2.692 717 HB2 GLU 537 2HB GLU 537 9.170 16.616 -3.053 718 HB3 GLU 537 1HB GLU 537 7.891 15.534 -3.563 719 HG2 GLU 537 2HG GLU 537 7.524 16.917 -5.532 720 HG3 GLU 537 1HG GLU 537 8.829 17.991 -5.017 721 H GLY 538 H GLY 538 5.347 15.665 -3.022 722 HA2 GLY 538 2HA GLY 538 3.194 17.355 -3.866 723 HA3 GLY 538 1HA GLY 538 3.832 16.519 -5.244 724 H THR 539 H THR 539 3.137 14.572 -5.682 725 HA THR 539 HA THR 539 1.329 13.445 -3.732 726 HB THR 539 HB THR 539 0.776 11.803 -5.556 727 HG1 THR 539 1HG THR 539 2.206 13.661 -7.162 728 HG21 THR 539 3HG2 THR 539 -0.660 13.336 -6.781 729 HG22 THR 539 1HG2 THR 539 0.238 14.721 -6.136 730 HG23 THR 539 2HG2 THR 539 -0.689 13.670 -5.052 731 H VAL 540 H VAL 540 1.750 11.628 -2.713 732 HA VAL 540 HA VAL 540 4.210 10.138 -3.300 733 HB VAL 540 HB VAL 540 2.404 10.106 -0.857 734 HG11 VAL 540 1HG1 VAL 540 3.516 7.988 -1.255 735 HG12 VAL 540 2HG1 VAL 540 4.165 8.776 0.187 736 HG13 VAL 540 3HG1 VAL 540 5.078 8.799 -1.328 737 HG21 VAL 540 3HG2 VAL 540 4.159 11.331 0.284 738 HG22 VAL 540 1HG2 VAL 540 3.653 12.180 -1.189 739 HG23 VAL 540 2HG2 VAL 540 5.159 11.283 -1.182 740 H SER 541 H SER 541 3.990 8.212 -4.260 741 HA SER 541 HA SER 541 1.290 7.210 -4.561 742 HB2 SER 541 2HB SER 541 3.854 6.387 -5.936 743 HB3 SER 541 1HB SER 541 2.235 5.808 -6.336 744 HG SER 541 HG SER 541 3.500 8.127 -6.994 745 H LEU 542 H LEU 542 0.630 5.866 -3.174 746 HA LEU 542 HA LEU 542 2.491 4.108 -1.763 747 HB2 LEU 542 2HB LEU 542 -0.297 5.008 -1.125 748 HB3 LEU 542 1HB LEU 542 0.687 3.947 -0.134 749 HG LEU 542 HG LEU 542 1.425 6.796 -0.789 750 HD11 LEU 542 1HD1 LEU 542 0.173 5.584 1.633 751 HD12 LEU 542 2HD1 LEU 542 -0.603 6.699 0.497 752 HD13 LEU 542 3HD1 LEU 542 0.759 7.245 1.498 753 HD21 LEU 542 3HD2 LEU 542 2.486 4.834 1.229 754 HD22 LEU 542 1HD2 LEU 542 3.017 6.505 1.025 755 HD23 LEU 542 2HD2 LEU 542 3.293 5.326 -0.261 756 H LEU 543 H LEU 543 2.478 2.135 -2.480 757 HA LEU 543 HA LEU 543 0.086 1.123 -3.826 758 HB2 LEU 543 2HB LEU 543 2.539 1.059 -4.812 759 HB3 LEU 543 1HB LEU 543 2.771 -0.127 -3.591 760 HG LEU 543 HG LEU 543 2.422 -1.114 -5.812 761 HD11 LEU 543 1HD1 LEU 543 2.034 -2.478 -3.882 762 HD12 LEU 543 2HD1 LEU 543 0.897 -2.873 -5.165 763 HD13 LEU 543 3HD1 LEU 543 0.364 -1.913 -3.779 764 HD21 LEU 543 3HD2 LEU 543 0.788 0.418 -6.720 765 HD22 LEU 543 1HD2 LEU 543 -0.402 -0.111 -5.529 766 HD23 LEU 543 2HD2 LEU 543 0.168 -1.234 -6.761 767 H VAL 544 H VAL 544 -1.184 -0.020 -2.551 768 HA VAL 544 HA VAL 544 0.033 -1.410 -0.265 769 HB VAL 544 HB VAL 544 -1.926 -0.996 1.087 770 HG11 VAL 544 1HG1 VAL 544 -0.943 1.578 -0.128 771 HG12 VAL 544 2HG1 VAL 544 -0.190 0.705 1.201 772 HG13 VAL 544 3HG1 VAL 544 -1.784 1.428 1.412 773 HG21 VAL 544 3HG2 VAL 544 -3.542 -1.039 -0.665 774 HG22 VAL 544 1HG2 VAL 544 -3.012 0.533 -1.263 775 HG23 VAL 544 2HG2 VAL 544 -3.777 0.402 0.343 776 H PHE 545 H PHE 545 -1.192 -3.183 0.514 777 HA PHE 545 HA PHE 545 -2.643 -4.697 -1.574 778 HB2 PHE 545 2HB PHE 545 -0.443 -5.577 -0.946 779 HB3 PHE 545 1HB PHE 545 -0.909 -5.586 0.745 780 HD1 PHE 545 1HD PHE 545 -1.180 -7.210 -2.475 781 HD2 PHE 545 2HD PHE 545 -2.428 -7.323 1.580 782 HE1 PHE 545 1HE PHE 545 -1.923 -9.500 -2.788 783 HE2 PHE 545 2HE PHE 545 -3.184 -9.638 1.288 784 HZ PHE 545 HZ PHE 545 -2.933 -10.743 -0.901 785 H ARG 546 H ARG 546 -4.750 -4.886 -1.044 786 HA ARG 546 HA ARG 546 -5.493 -4.484 1.742 787 HB2 ARG 546 2HB ARG 546 -6.892 -3.553 -0.206 788 HB3 ARG 546 1HB ARG 546 -7.374 -5.215 -0.507 789 HG2 ARG 546 2HG ARG 546 -8.159 -5.353 1.859 790 HG3 ARG 546 1HG ARG 546 -7.852 -3.625 1.993 791 HD2 ARG 546 2HD ARG 546 -10.150 -3.891 1.555 792 HD3 ARG 546 1HD ARG 546 -9.416 -3.317 0.057 793 HE ARG 546 HE ARG 546 -9.388 -6.007 -0.215 794 HH11 ARG 546 1HH1 ARG 546 -11.910 -3.636 0.501 795 HH12 ARG 546 2HH1 ARG 546 -13.191 -4.590 -0.089 796 HH21 ARG 546 1HH2 ARG 546 -11.124 -7.339 -1.024 797 HH22 ARG 546 2HH2 ARG 546 -12.714 -6.775 -1.007 798 H GLN 547 H GLN 547 -5.693 -6.171 3.042 799 HA GLN 547 HA GLN 547 -5.673 -8.806 1.774 800 HB2 GLN 547 2HB GLN 547 -3.804 -8.307 3.314 801 HB3 GLN 547 1HB GLN 547 -4.959 -8.044 4.610 802 HG2 GLN 547 2HG GLN 547 -5.699 -10.399 4.373 803 HG3 GLN 547 1HG GLN 547 -4.445 -10.636 3.163 804 HE21 GLN 547 1HE2 GLN 547 -4.819 -11.947 5.722 805 HE22 GLN 547 2HE2 GLN 547 -3.376 -11.655 6.632 806 H GLU 548 H GLU 548 -7.368 -10.094 2.003 807 HA GLU 548 HA GLU 548 -9.687 -9.324 3.450 808 HB2 GLU 548 2HB GLU 548 -8.896 -11.891 2.057 809 HB3 GLU 548 1HB GLU 548 -10.379 -11.768 2.977 810 HG2 GLU 548 2HG GLU 548 -10.713 -11.521 0.551 811 HG3 GLU 548 1HG GLU 548 -11.247 -10.111 1.451 812 H GLU 549 H GLU 549 -9.338 -9.088 5.526 813 HA GLU 549 HA GLU 549 -7.614 -10.718 7.048 814 HB2 GLU 549 2HB GLU 549 -8.186 -8.364 7.589 815 HB3 GLU 549 1HB GLU 549 -9.816 -8.875 7.988 816 HG2 GLU 549 2HG GLU 549 -8.990 -10.194 9.832 817 HG3 GLU 549 1HG GLU 549 -7.324 -9.802 9.400 818 H ALA 550 H ALA 550 -7.975 -12.560 8.029 819 HA ALA 550 HA ALA 550 -10.731 -13.507 8.247 820 HB1 ALA 550 1HB ALA 550 -8.400 -15.166 7.284 821 HB2 ALA 550 2HB ALA 550 -9.698 -14.535 6.268 822 HB3 ALA 550 3HB ALA 550 -10.056 -15.728 7.517 823 H PHE 551 H PHE 551 -7.582 -14.968 9.083 824 HA PHE 551 HA PHE 551 -8.424 -14.849 11.874 825 HB2 PHE 551 2HB PHE 551 -7.459 -17.323 10.450 826 HB3 PHE 551 1HB PHE 551 -7.687 -17.202 12.194 827 HD1 PHE 551 2HD PHE 551 -10.047 -16.741 13.027 828 HD2 PHE 551 1HD PHE 551 -9.184 -17.922 9.033 829 HE1 PHE 551 2HE PHE 551 -12.379 -17.439 12.737 830 HE2 PHE 551 1HE PHE 551 -11.520 -18.625 8.733 831 HZ PHE 551 HZ PHE 551 -13.122 -18.386 10.587 832 H HIS 552 H HIS 552 -6.723 -15.171 13.376 833 HA HIS 552 HA HIS 552 -3.954 -15.232 12.529 834 HB2 HIS 552 2HB HIS 552 -5.151 -12.920 14.132 835 HB3 HIS 552 1HB HIS 552 -3.433 -13.237 14.048 836 HD1 HIS 552 1HD HIS 552 -6.055 -11.301 12.513 837 HD2 HIS 552 2HD HIS 552 -2.434 -12.901 11.282 838 HE1 HIS 552 1HE HIS 552 -5.453 -10.058 10.436 839 HE2 HIS 552 2HE HIS 552 -3.107 -10.788 9.963 840 HA PRO 553 HA PRO 553 -3.765 -17.485 16.457 841 HB2 PRO 553 2HB PRO 553 -1.627 -16.199 17.718 842 HB3 PRO 553 1HB PRO 553 -1.454 -17.565 16.615 843 HG2 PRO 553 2HG PRO 553 -1.091 -14.651 16.098 844 HG3 PRO 553 1HG PRO 553 -0.205 -16.027 15.425 845 HD2 PRO 553 2HD PRO 553 -2.047 -14.703 13.995 846 HD3 PRO 553 1HD PRO 553 -1.838 -16.456 13.833 847 H ARG 554 H ARG 554 -5.143 -17.204 17.958 848 HA ARG 554 HA ARG 554 -6.096 -14.586 18.607 849 HB2 ARG 554 2HB ARG 554 -7.821 -15.763 19.875 850 HB3 ARG 554 1HB ARG 554 -7.649 -16.434 18.261 851 HG2 ARG 554 2HG ARG 554 -6.303 -18.266 19.225 852 HG3 ARG 554 1HG ARG 554 -6.631 -17.610 20.833 853 HD2 ARG 554 2HD ARG 554 -8.632 -18.549 18.819 854 HD3 ARG 554 1HD ARG 554 -8.148 -19.431 20.266 855 HE ARG 554 HE ARG 554 -9.060 -16.953 21.127 856 HH11 ARG 554 1HH1 ARG 554 -10.449 -19.771 19.495 857 HH12 ARG 554 2HH1 ARG 554 -12.026 -19.498 20.053 858 HH21 ARG 554 1HH2 ARG 554 -11.282 -16.588 21.912 859 HH22 ARG 554 2HH2 ARG 554 -12.501 -17.677 21.445 860 H GLU 555 H GLU 555 -6.531 -14.026 20.909 861 HA GLU 555 HA GLU 555 -4.086 -13.949 22.293 862 HB2 GLU 555 2HB GLU 555 -6.845 -13.304 23.327 863 HB3 GLU 555 1HB GLU 555 -5.325 -12.814 24.070 864 HG2 GLU 555 2HG GLU 555 -4.799 -11.567 21.976 865 HG3 GLU 555 1HG GLU 555 -6.427 -11.937 21.415 866 H MET 556 H MET 556 -3.462 -14.931 24.170 867 HA MET 556 HA MET 556 -4.999 -17.268 24.965 868 HB2 MET 556 2HB MET 556 -2.840 -18.563 25.060 869 HB3 MET 556 1HB MET 556 -3.408 -18.175 23.443 870 HG2 MET 556 2HG MET 556 -1.811 -16.295 23.371 871 HG3 MET 556 1HG MET 556 -1.234 -16.773 24.965 872 HE1 MET 556 3HE MET 556 1.233 -16.732 23.815 873 HE2 MET 556 1HE MET 556 0.503 -16.376 22.249 874 HE3 MET 556 2HE MET 556 1.639 -17.710 22.403 875 H ASN 557 H ASN 557 -5.128 -17.598 27.011 876 HA ASN 557 HA ASN 557 -4.925 -17.516 29.189 877 HB2 ASN 557 2HB ASN 557 -2.542 -18.035 28.996 878 HB3 ASN 557 1HB ASN 557 -2.168 -16.331 28.762 879 HD21 ASN 557 1HD2 ASN 557 -3.120 -18.774 31.035 880 HD22 ASN 557 2HD2 ASN 557 -2.822 -17.862 32.460 881 H ALA 558 H ALA 558 -6.513 -16.260 29.723 882 HA ALA 558 HA ALA 558 -5.924 -13.536 30.488 883 HB1 ALA 558 1HB ALA 558 -7.904 -12.637 29.330 884 HB2 ALA 558 2HB ALA 558 -8.197 -14.217 28.604 885 HB3 ALA 558 3HB ALA 558 -6.745 -13.310 28.181 Start of MODEL 20 1 H1 GLY 448 1HT GLY 448 -16.559 8.551 -12.441 2 H2 GLY 448 2HT GLY 448 -15.189 9.347 -11.849 3 H3 GLY 448 3HT GLY 448 -16.319 8.653 -10.782 4 HA2 GLY 448 1HA GLY 448 -14.660 7.145 -12.686 5 HA3 GLY 448 2HA GLY 448 -14.383 7.269 -10.950 6 H SER 449 H SER 449 -14.594 4.911 -11.006 7 HA SER 449 HA SER 449 -17.235 4.099 -10.369 8 HB2 SER 449 2HB SER 449 -17.264 3.950 -12.867 9 HB3 SER 449 1HB SER 449 -15.874 2.877 -12.805 10 HG SER 449 HG SER 449 -18.351 2.295 -11.518 11 H VAL 450 H VAL 450 -16.964 2.660 -8.724 12 HA VAL 450 HA VAL 450 -14.307 1.551 -8.424 13 HB VAL 450 HB VAL 450 -14.906 1.117 -6.030 14 HG11 VAL 450 1HG1 VAL 450 -15.205 3.957 -6.979 15 HG12 VAL 450 2HG1 VAL 450 -13.691 3.111 -6.665 16 HG13 VAL 450 3HG1 VAL 450 -14.797 3.468 -5.334 17 HG21 VAL 450 3HG2 VAL 450 -16.879 2.202 -5.068 18 HG22 VAL 450 1HG2 VAL 450 -17.356 1.003 -6.273 19 HG23 VAL 450 2HG2 VAL 450 -17.391 2.727 -6.670 20 H TYR 451 H TYR 451 -14.002 -0.353 -9.194 21 HA TYR 451 HA TYR 451 -16.159 -2.305 -9.106 22 HB2 TYR 451 2HB TYR 451 -14.940 -1.962 -11.279 23 HB3 TYR 451 1HB TYR 451 -13.461 -2.463 -10.482 24 HD1 TYR 451 1HD TYR 451 -16.788 -3.615 -11.604 25 HD2 TYR 451 2HD TYR 451 -12.952 -4.779 -10.189 26 HE1 TYR 451 1HE TYR 451 -17.281 -5.947 -12.194 27 HE2 TYR 451 2HE TYR 451 -13.440 -7.114 -10.776 28 HH TYR 451 HH TYR 451 -16.077 -7.931 -12.734 29 H ASN 452 H ASN 452 -16.152 -3.578 -7.363 30 HA ASN 452 HA ASN 452 -13.659 -3.846 -5.876 31 HB2 ASN 452 2HB ASN 452 -15.729 -3.282 -4.630 32 HB3 ASN 452 1HB ASN 452 -16.413 -4.838 -5.104 33 HD21 ASN 452 1HD2 ASN 452 -14.059 -3.229 -3.154 34 HD22 ASN 452 2HD2 ASN 452 -13.688 -4.541 -2.115 35 H THR 453 H THR 453 -12.374 -5.340 -6.682 36 HA THR 453 HA THR 453 -13.425 -7.738 -7.876 37 HB THR 453 HB THR 453 -10.530 -7.024 -7.344 38 HG1 THR 453 1HG THR 453 -10.947 -6.444 -9.773 39 HG21 THR 453 3HG2 THR 453 -11.010 -9.341 -8.033 40 HG22 THR 453 1HG2 THR 453 -10.143 -8.459 -9.293 41 HG23 THR 453 2HG2 THR 453 -11.881 -8.731 -9.437 42 H LYS 454 H LYS 454 -13.722 -9.587 -6.745 43 HA LYS 454 HA LYS 454 -12.809 -9.760 -4.025 44 HB2 LYS 454 2HB LYS 454 -14.490 -11.650 -5.691 45 HB3 LYS 454 1HB LYS 454 -14.006 -11.993 -4.043 46 HG2 LYS 454 2HG LYS 454 -16.280 -11.203 -4.045 47 HG3 LYS 454 1HG LYS 454 -15.244 -9.986 -3.308 48 HD2 LYS 454 2HD LYS 454 -15.273 -8.697 -5.387 49 HD3 LYS 454 1HD LYS 454 -16.279 -9.937 -6.140 50 HE2 LYS 454 2HE LYS 454 -17.618 -8.027 -5.390 51 HE3 LYS 454 1HE LYS 454 -18.049 -9.503 -4.525 52 HZ1 LYS 454 3HZ LYS 454 -16.305 -7.318 -3.471 53 HZ2 LYS 454 1HZ LYS 454 -16.724 -8.736 -2.652 54 HZ3 LYS 454 2HZ LYS 454 -17.907 -7.631 -3.046 55 H LYS 455 H LYS 455 -10.807 -10.334 -3.697 56 HA LYS 455 HA LYS 455 -9.682 -12.593 -5.219 57 HB2 LYS 455 2HB LYS 455 -8.200 -10.056 -4.462 58 HB3 LYS 455 1HB LYS 455 -7.502 -11.447 -5.260 59 HG2 LYS 455 2HG LYS 455 -9.593 -9.606 -6.413 60 HG3 LYS 455 1HG LYS 455 -7.874 -9.575 -6.786 61 HD2 LYS 455 2HD LYS 455 -9.732 -11.899 -7.323 62 HD3 LYS 455 1HD LYS 455 -9.232 -10.706 -8.516 63 HE2 LYS 455 2HE LYS 455 -6.894 -11.404 -8.220 64 HE3 LYS 455 1HE LYS 455 -7.406 -12.601 -7.034 65 HZ1 LYS 455 3HZ LYS 455 -7.090 -13.575 -9.225 66 HZ2 LYS 455 1HZ LYS 455 -8.230 -12.530 -9.878 67 HZ3 LYS 455 2HZ LYS 455 -8.712 -13.692 -8.770 68 H VAL 456 H VAL 456 -7.538 -13.163 -4.007 69 HA VAL 456 HA VAL 456 -8.089 -13.188 -1.136 70 HB VAL 456 HB VAL 456 -6.215 -14.862 -1.004 71 HG11 VAL 456 1HG1 VAL 456 -8.385 -15.495 -2.969 72 HG12 VAL 456 2HG1 VAL 456 -8.497 -15.634 -1.219 73 HG13 VAL 456 3HG1 VAL 456 -7.409 -16.700 -2.119 74 HG21 VAL 456 3HG2 VAL 456 -6.252 -14.660 -4.010 75 HG22 VAL 456 1HG2 VAL 456 -5.340 -15.842 -3.072 76 HG23 VAL 456 2HG2 VAL 456 -4.943 -14.124 -2.955 77 H GLY 457 H GLY 457 -7.334 -10.836 -2.521 78 HA2 GLY 457 2HA GLY 457 -5.903 -9.350 -1.008 79 HA3 GLY 457 1HA GLY 457 -4.603 -10.339 -1.664 80 H LYS 458 H LYS 458 -6.709 -7.713 -2.212 81 HA LYS 458 HA LYS 458 -5.782 -7.508 -4.939 82 HB2 LYS 458 2HB LYS 458 -8.228 -7.330 -4.528 83 HB3 LYS 458 1HB LYS 458 -7.934 -5.954 -3.474 84 HG2 LYS 458 2HG LYS 458 -8.707 -5.257 -5.684 85 HG3 LYS 458 1HG LYS 458 -7.062 -4.682 -5.365 86 HD2 LYS 458 2HD LYS 458 -6.180 -6.584 -6.566 87 HD3 LYS 458 1HD LYS 458 -7.811 -7.126 -6.941 88 HE2 LYS 458 2HE LYS 458 -8.211 -5.040 -8.190 89 HE3 LYS 458 1HE LYS 458 -6.581 -4.494 -7.801 90 HZ1 LYS 458 3HZ LYS 458 -7.299 -6.859 -9.431 91 HZ2 LYS 458 1HZ LYS 458 -5.725 -6.430 -9.037 92 HZ3 LYS 458 2HZ LYS 458 -6.653 -5.426 -10.015 93 H ARG 459 H ARG 459 -4.420 -5.834 -5.518 94 HA ARG 459 HA ARG 459 -3.535 -4.111 -3.334 95 HB2 ARG 459 2HB ARG 459 -2.082 -5.128 -5.765 96 HB3 ARG 459 1HB ARG 459 -1.482 -3.801 -4.780 97 HG2 ARG 459 2HG ARG 459 -1.240 -5.206 -2.886 98 HG3 ARG 459 1HG ARG 459 -2.092 -6.537 -3.688 99 HD2 ARG 459 2HD ARG 459 0.539 -5.326 -4.535 100 HD3 ARG 459 1HD ARG 459 0.347 -6.846 -3.656 101 HE ARG 459 HE ARG 459 -1.213 -7.144 -5.836 102 HH11 ARG 459 1HH1 ARG 459 2.234 -6.367 -5.402 103 HH12 ARG 459 2HH1 ARG 459 2.719 -7.121 -6.847 104 HH21 ARG 459 1HH2 ARG 459 -0.510 -8.174 -7.856 105 HH22 ARG 459 2HH2 ARG 459 1.147 -8.188 -8.233 106 H LEU 460 H LEU 460 -3.581 -2.039 -3.503 107 HA LEU 460 HA LEU 460 -4.705 -0.871 -5.960 108 HB2 LEU 460 2HB LEU 460 -5.148 0.036 -3.124 109 HB3 LEU 460 1HB LEU 460 -5.806 0.795 -4.549 110 HG LEU 460 HG LEU 460 -6.528 -1.967 -3.551 111 HD11 LEU 460 1HD1 LEU 460 -8.096 0.607 -3.547 112 HD12 LEU 460 2HD1 LEU 460 -7.414 -0.205 -2.138 113 HD13 LEU 460 3HD1 LEU 460 -8.705 -0.976 -3.062 114 HD21 LEU 460 3HD2 LEU 460 -7.633 -0.377 -5.876 115 HD22 LEU 460 1HD2 LEU 460 -8.263 -1.915 -5.289 116 HD23 LEU 460 2HD2 LEU 460 -6.651 -1.836 -5.994 117 H ASN 461 H ASN 461 -3.740 0.909 -6.714 118 HA ASN 461 HA ASN 461 -1.300 1.813 -5.336 119 HB2 ASN 461 2HB ASN 461 -1.088 0.868 -7.676 120 HB3 ASN 461 1HB ASN 461 -2.107 2.178 -8.243 121 HD21 ASN 461 1HD2 ASN 461 0.603 1.440 -8.958 122 HD22 ASN 461 2HD2 ASN 461 1.603 2.804 -8.666 123 H ILE 462 H ILE 462 -1.545 3.677 -4.299 124 HA ILE 462 HA ILE 462 -3.676 5.531 -5.200 125 HB ILE 462 HB ILE 462 -2.859 4.955 -2.333 126 HG12 ILE 462 2HG1 ILE 462 -5.411 4.079 -3.693 127 HG13 ILE 462 1HG1 ILE 462 -4.027 2.997 -3.465 128 HG21 ILE 462 1HG2 ILE 462 -3.778 7.190 -2.727 129 HG22 ILE 462 2HG2 ILE 462 -4.889 6.201 -1.775 130 HG23 ILE 462 3HG2 ILE 462 -5.195 6.468 -3.489 131 HD11 ILE 462 3HD1 ILE 462 -5.754 2.659 -1.786 132 HD12 ILE 462 1HD1 ILE 462 -5.645 4.357 -1.321 133 HD13 ILE 462 2HD1 ILE 462 -4.277 3.284 -1.044 134 H GLN 463 H GLN 463 -2.859 7.597 -5.569 135 HA GLN 463 HA GLN 463 -0.347 8.292 -4.222 136 HB2 GLN 463 2HB GLN 463 -1.743 9.704 -6.497 137 HB3 GLN 463 1HB GLN 463 -0.318 10.320 -5.682 138 HG2 GLN 463 2HG GLN 463 0.902 8.336 -6.407 139 HG3 GLN 463 1HG GLN 463 -0.524 7.821 -7.341 140 HE21 GLN 463 1HE2 GLN 463 2.139 10.034 -7.082 141 HE22 GLN 463 2HE2 GLN 463 1.938 10.752 -8.631 142 H LEU 464 H LEU 464 -0.222 9.774 -2.716 143 HA LEU 464 HA LEU 464 -2.635 11.367 -2.178 144 HB2 LEU 464 2HB LEU 464 -0.712 10.215 -0.146 145 HB3 LEU 464 1HB LEU 464 -1.996 11.324 0.241 146 HG LEU 464 HG LEU 464 -3.600 9.519 -0.598 147 HD11 LEU 464 1HD1 LEU 464 -1.149 7.808 -0.328 148 HD12 LEU 464 2HD1 LEU 464 -2.026 8.155 -1.818 149 HD13 LEU 464 3HD1 LEU 464 -2.808 7.231 -0.533 150 HD21 LEU 464 3HD2 LEU 464 -3.528 8.309 1.490 151 HD22 LEU 464 1HD2 LEU 464 -3.320 10.037 1.737 152 HD23 LEU 464 2HD2 LEU 464 -1.921 8.960 1.832 153 H LYS 465 H LYS 465 -2.321 13.479 -1.928 154 HA LYS 465 HA LYS 465 0.401 14.540 -2.215 155 HB2 LYS 465 2HB LYS 465 -0.712 16.673 -2.683 156 HB3 LYS 465 1HB LYS 465 -1.253 15.416 -3.787 157 HG2 LYS 465 2HG LYS 465 -3.265 15.113 -2.516 158 HG3 LYS 465 1HG LYS 465 -2.649 16.253 -1.322 159 HD2 LYS 465 2HD LYS 465 -3.196 17.011 -4.201 160 HD3 LYS 465 1HD LYS 465 -4.377 17.229 -2.910 161 HE2 LYS 465 2HE LYS 465 -2.789 18.675 -1.715 162 HE3 LYS 465 1HE LYS 465 -1.618 18.462 -3.009 163 HZ1 LYS 465 3HZ LYS 465 -2.819 20.539 -3.236 164 HZ2 LYS 465 1HZ LYS 465 -4.292 19.711 -3.311 165 HZ3 LYS 465 2HZ LYS 465 -3.149 19.516 -4.525 166 H LYS 466 H LYS 466 1.243 15.860 -0.831 167 HA LYS 466 HA LYS 466 0.460 15.544 1.922 168 HB2 LYS 466 2HB LYS 466 2.828 16.494 0.485 169 HB3 LYS 466 1HB LYS 466 2.513 17.322 1.997 170 HG2 LYS 466 2HG LYS 466 4.091 15.363 2.112 171 HG3 LYS 466 1HG LYS 466 2.758 15.343 3.251 172 HD2 LYS 466 2HD LYS 466 3.247 13.135 2.238 173 HD3 LYS 466 1HD LYS 466 1.602 13.678 1.946 174 HE2 LYS 466 2HE LYS 466 2.646 12.618 -0.011 175 HE3 LYS 466 1HE LYS 466 2.169 14.282 -0.301 176 HZ1 LYS 466 3HZ LYS 466 4.405 14.983 -0.039 177 HZ2 LYS 466 1HZ LYS 466 4.336 13.739 -1.200 178 HZ3 LYS 466 2HZ LYS 466 4.940 13.438 0.358 179 H GLY 467 H GLY 467 -0.838 16.757 2.958 180 HA2 GLY 467 2HA GLY 467 -1.171 19.528 2.075 181 HA3 GLY 467 1HA GLY 467 -2.400 18.597 2.930 182 H THR 468 H THR 468 -2.530 20.158 4.602 183 HA THR 468 HA THR 468 -0.209 20.863 6.073 184 HB THR 468 HB THR 468 -1.998 21.819 7.648 185 HG1 THR 468 1HG THR 468 -3.790 20.717 7.027 186 HG21 THR 468 3HG2 THR 468 -0.714 23.165 6.036 187 HG22 THR 468 1HG2 THR 468 -2.377 23.724 6.148 188 HG23 THR 468 2HG2 THR 468 -1.867 22.745 4.770 189 H GLU 469 H GLU 469 -2.355 18.195 6.237 190 HA GLU 469 HA GLU 469 -1.302 17.576 8.867 191 HB2 GLU 469 2HB GLU 469 -3.443 16.203 7.235 192 HB3 GLU 469 1HB GLU 469 -2.902 15.677 8.816 193 HG2 GLU 469 2HG GLU 469 -4.933 16.883 9.192 194 HG3 GLU 469 1HG GLU 469 -3.570 17.918 9.654 195 H GLY 470 H GLY 470 -0.140 17.399 5.949 196 HA2 GLY 470 2HA GLY 470 1.569 16.159 5.033 197 HA3 GLY 470 1HA GLY 470 1.559 15.150 6.479 198 H LEU 471 H LEU 471 0.937 13.140 6.199 199 HA LEU 471 HA LEU 471 -0.481 12.391 3.791 200 HB2 LEU 471 2HB LEU 471 0.804 10.799 5.996 201 HB3 LEU 471 1HB LEU 471 -0.245 10.048 4.829 202 HG LEU 471 HG LEU 471 2.002 9.609 4.228 203 HD11 LEU 471 1HD1 LEU 471 0.868 11.658 2.350 204 HD12 LEU 471 2HD1 LEU 471 0.561 9.921 2.368 205 HD13 LEU 471 3HD1 LEU 471 2.162 10.530 1.976 206 HD21 LEU 471 3HD2 LEU 471 3.148 11.374 5.389 207 HD22 LEU 471 1HD2 LEU 471 2.491 12.583 4.283 208 HD23 LEU 471 2HD2 LEU 471 3.632 11.373 3.692 209 H GLY 472 H GLY 472 -0.932 12.387 7.266 210 HA2 GLY 472 2HA GLY 472 -3.031 12.753 8.312 211 HA3 GLY 472 1HA GLY 472 -3.809 12.320 6.795 212 H PHE 473 H PHE 473 -1.381 10.133 7.679 213 HA PHE 473 HA PHE 473 -3.080 8.519 9.338 214 HB2 PHE 473 2HB PHE 473 -3.122 6.573 7.930 215 HB3 PHE 473 1HB PHE 473 -3.760 7.911 6.986 216 HD1 PHE 473 1HD PHE 473 -2.096 9.061 5.395 217 HD2 PHE 473 2HD PHE 473 -1.443 5.227 7.095 218 HE1 PHE 473 1HE PHE 473 -0.479 8.533 3.624 219 HE2 PHE 473 2HE PHE 473 0.170 4.718 5.344 220 HZ PHE 473 HZ PHE 473 0.638 6.405 3.602 221 H SER 474 H SER 474 -1.875 6.560 9.997 222 HA SER 474 HA SER 474 1.011 6.955 9.774 223 HB2 SER 474 2HB SER 474 0.161 7.833 11.970 224 HB3 SER 474 1HB SER 474 -0.458 6.226 12.321 225 HG SER 474 HG SER 474 2.181 7.133 12.131 226 H ILE 475 H ILE 475 2.122 4.872 10.528 227 HA ILE 475 HA ILE 475 0.581 2.536 9.589 228 HB ILE 475 HB ILE 475 2.715 1.658 8.757 229 HG12 ILE 475 2HG1 ILE 475 3.692 4.476 9.162 230 HG13 ILE 475 1HG1 ILE 475 4.165 3.011 10.034 231 HG21 ILE 475 1HG2 ILE 475 1.077 2.546 7.234 232 HG22 ILE 475 2HG2 ILE 475 2.706 2.814 6.671 233 HG23 ILE 475 3HG2 ILE 475 1.785 4.170 7.365 234 HD11 ILE 475 3HD1 ILE 475 5.823 3.723 8.290 235 HD12 ILE 475 1HD1 ILE 475 4.582 3.474 7.080 236 HD13 ILE 475 2HD1 ILE 475 5.177 2.103 8.009 237 H THR 476 H THR 476 1.103 0.575 10.564 238 HA THR 476 HA THR 476 2.798 0.636 12.950 239 HB THR 476 HB THR 476 0.419 0.728 13.675 240 HG1 THR 476 1HG THR 476 0.950 -1.895 14.268 241 HG21 THR 476 3HG2 THR 476 -0.624 -0.335 11.726 242 HG22 THR 476 1HG2 THR 476 -1.104 -1.156 13.213 243 HG23 THR 476 2HG2 THR 476 0.117 -1.874 12.161 244 H SER 477 H SER 477 3.615 -1.545 13.512 245 HA SER 477 HA SER 477 3.553 -3.421 11.262 246 HB2 SER 477 2HB SER 477 5.939 -3.879 11.672 247 HB3 SER 477 1HB SER 477 5.690 -2.234 11.137 248 HG SER 477 HG SER 477 6.542 -3.204 13.580 249 H ARG 478 H ARG 478 4.218 -5.617 11.927 250 HA ARG 478 HA ARG 478 4.120 -6.209 14.737 251 HB2 ARG 478 2HB ARG 478 2.268 -7.816 14.468 252 HB3 ARG 478 1HB ARG 478 1.738 -6.159 14.237 253 HG2 ARG 478 2HG ARG 478 1.817 -6.504 11.803 254 HG3 ARG 478 1HG ARG 478 2.317 -8.171 12.073 255 HD2 ARG 478 2HD ARG 478 -0.020 -8.121 11.614 256 HD3 ARG 478 1HD ARG 478 0.215 -8.545 13.311 257 HE ARG 478 HE ARG 478 -0.135 -5.808 13.173 258 HH11 ARG 478 1HH1 ARG 478 -1.983 -8.755 12.519 259 HH12 ARG 478 2HH1 ARG 478 -3.509 -8.055 12.752 260 HH21 ARG 478 1HH2 ARG 478 -2.265 -4.804 13.521 261 HH22 ARG 478 2HH2 ARG 478 -3.648 -5.758 13.346 262 H ASP 479 H ASP 479 5.606 -7.727 15.046 263 HA ASP 479 HA ASP 479 6.864 -9.610 14.883 264 HB2 ASP 479 2HB ASP 479 4.731 -10.757 14.516 265 HB3 ASP 479 1HB ASP 479 4.826 -10.431 12.794 266 H VAL 480 H VAL 480 6.707 -7.498 12.343 267 HA VAL 480 HA VAL 480 8.094 -8.724 10.286 268 HB VAL 480 HB VAL 480 6.913 -6.674 9.868 269 HG11 VAL 480 1HG1 VAL 480 8.939 -5.280 11.580 270 HG12 VAL 480 2HG1 VAL 480 7.233 -5.538 11.950 271 HG13 VAL 480 3HG1 VAL 480 7.699 -4.498 10.600 272 HG21 VAL 480 3HG2 VAL 480 8.560 -5.426 8.534 273 HG22 VAL 480 1HG2 VAL 480 8.743 -7.174 8.340 274 HG23 VAL 480 2HG2 VAL 480 9.855 -6.277 9.373 275 H THR 481 H THR 481 9.824 -9.812 10.565 276 HA THR 481 HA THR 481 12.186 -8.404 11.563 277 HB THR 481 HB THR 481 11.408 -10.081 13.156 278 HG1 THR 481 1HG THR 481 13.816 -9.843 12.289 279 HG21 THR 481 3HG2 THR 481 11.821 -12.064 10.920 280 HG22 THR 481 1HG2 THR 481 10.291 -11.629 11.677 281 HG23 THR 481 2HG2 THR 481 11.510 -12.503 12.603 282 H ILE 482 H ILE 482 10.802 -9.259 8.950 283 HA ILE 482 HA ILE 482 13.272 -9.826 7.514 284 HB ILE 482 HB ILE 482 12.407 -12.080 7.847 285 HG12 ILE 482 2HG1 ILE 482 11.986 -11.165 4.988 286 HG13 ILE 482 1HG1 ILE 482 13.524 -11.618 5.709 287 HG21 ILE 482 1HG2 ILE 482 10.067 -11.592 8.212 288 HG22 ILE 482 2HG2 ILE 482 10.242 -12.811 6.947 289 HG23 ILE 482 3HG2 ILE 482 9.870 -11.142 6.518 290 HD11 ILE 482 3HD1 ILE 482 12.709 -13.904 5.990 291 HD12 ILE 482 1HD1 ILE 482 12.643 -13.394 4.303 292 HD13 ILE 482 2HD1 ILE 482 11.169 -13.446 5.269 293 H GLY 483 H GLY 483 9.886 -8.874 7.344 294 HA2 GLY 483 2HA GLY 483 9.152 -7.048 6.044 295 HA3 GLY 483 1HA GLY 483 10.520 -7.306 4.955 296 H GLY 484 H GLY 484 7.534 -7.232 4.520 297 HA2 GLY 484 2HA GLY 484 6.232 -8.278 2.876 298 HA3 GLY 484 1HA GLY 484 7.438 -9.558 2.768 299 H SER 485 H SER 485 7.540 -11.067 4.573 300 HA SER 485 HA SER 485 4.964 -11.941 5.450 301 HB2 SER 485 2HB SER 485 7.735 -12.781 6.364 302 HB3 SER 485 1HB SER 485 6.235 -13.656 6.684 303 HG SER 485 HG SER 485 6.227 -13.300 4.145 304 H ALA 486 H ALA 486 3.889 -10.987 6.992 305 HA ALA 486 HA ALA 486 3.284 -9.655 8.652 306 HB1 ALA 486 1HB ALA 486 4.613 -9.542 10.720 307 HB2 ALA 486 2HB ALA 486 5.996 -10.236 9.877 308 HB3 ALA 486 3HB ALA 486 4.544 -11.205 10.131 309 HA PRO 487 HA PRO 487 5.417 -6.122 6.783 310 HB2 PRO 487 2HB PRO 487 3.374 -5.280 5.316 311 HB3 PRO 487 1HB PRO 487 4.135 -6.847 4.955 312 HG2 PRO 487 2HG PRO 487 1.613 -6.229 6.418 313 HG3 PRO 487 1HG PRO 487 1.927 -7.486 5.206 314 HD2 PRO 487 2HD PRO 487 1.976 -7.801 7.991 315 HD3 PRO 487 1HD PRO 487 2.626 -8.935 6.793 316 H ILE 488 H ILE 488 3.982 -3.882 6.245 317 HA ILE 488 HA ILE 488 3.336 -2.732 8.829 318 HB ILE 488 HB ILE 488 4.253 -1.479 6.170 319 HG12 ILE 488 2HG1 ILE 488 5.836 -2.364 8.065 320 HG13 ILE 488 1HG1 ILE 488 6.133 -0.812 7.307 321 HG21 ILE 488 1HG2 ILE 488 3.939 0.668 7.080 322 HG22 ILE 488 2HG2 ILE 488 3.104 -0.098 8.454 323 HG23 ILE 488 3HG2 ILE 488 2.415 -0.211 6.836 324 HD11 ILE 488 3HD1 ILE 488 5.169 0.347 9.188 325 HD12 ILE 488 1HD1 ILE 488 6.399 -0.771 9.761 326 HD13 ILE 488 2HD1 ILE 488 4.689 -1.185 9.927 327 H TYR 489 H TYR 489 1.364 -1.968 9.242 328 HA TYR 489 HA TYR 489 -0.648 -1.935 7.084 329 HB2 TYR 489 2HB TYR 489 -1.134 -2.606 10.012 330 HB3 TYR 489 1HB TYR 489 -2.352 -2.476 8.763 331 HD1 TYR 489 2HD TYR 489 0.447 -4.473 9.997 332 HD2 TYR 489 1HD TYR 489 -2.730 -4.213 7.198 333 HE1 TYR 489 2HE TYR 489 0.766 -6.799 9.492 334 HE2 TYR 489 1HE TYR 489 -2.448 -6.585 6.633 335 HH TYR 489 HH TYR 489 -0.536 -8.700 8.529 336 H VAL 490 H VAL 490 -2.169 -0.308 7.279 337 HA VAL 490 HA VAL 490 -1.248 2.152 8.338 338 HB VAL 490 HB VAL 490 -4.075 1.388 7.546 339 HG11 VAL 490 1HG1 VAL 490 -2.821 4.106 7.925 340 HG12 VAL 490 2HG1 VAL 490 -4.048 3.372 8.951 341 HG13 VAL 490 3HG1 VAL 490 -4.436 3.801 7.286 342 HG21 VAL 490 3HG2 VAL 490 -2.474 1.101 5.728 343 HG22 VAL 490 1HG2 VAL 490 -1.911 2.761 5.963 344 HG23 VAL 490 2HG2 VAL 490 -3.568 2.458 5.441 345 H LYS 491 H LYS 491 -1.217 2.771 10.357 346 HA LYS 491 HA LYS 491 -2.362 1.168 12.437 347 HB2 LYS 491 2HB LYS 491 -0.152 2.351 12.618 348 HB3 LYS 491 1HB LYS 491 -1.030 3.853 12.576 349 HG2 LYS 491 2HG LYS 491 -2.111 3.402 14.676 350 HG3 LYS 491 1HG LYS 491 -1.400 1.789 14.739 351 HD2 LYS 491 2HD LYS 491 -0.183 3.359 16.191 352 HD3 LYS 491 1HD LYS 491 0.843 2.779 14.883 353 HE2 LYS 491 2HE LYS 491 0.445 4.834 13.645 354 HE3 LYS 491 1HE LYS 491 -0.621 5.420 14.921 355 HZ1 LYS 491 3HZ LYS 491 1.282 5.442 16.411 356 HZ2 LYS 491 1HZ LYS 491 1.569 6.374 15.042 357 HZ3 LYS 491 2HZ LYS 491 2.292 4.867 15.180 358 H ASN 492 H ASN 492 -3.160 4.241 10.879 359 HA ASN 492 HA ASN 492 -5.809 4.266 11.926 360 HB2 ASN 492 2HB ASN 492 -4.538 4.950 13.969 361 HB3 ASN 492 1HB ASN 492 -3.873 6.295 13.053 362 HD21 ASN 492 1HD2 ASN 492 -4.742 7.874 14.323 363 HD22 ASN 492 2HD2 ASN 492 -6.438 8.204 14.407 364 H ILE 493 H ILE 493 -7.023 5.885 10.927 365 HA ILE 493 HA ILE 493 -5.662 7.602 8.962 366 HB ILE 493 HB ILE 493 -8.570 6.668 9.054 367 HG12 ILE 493 2HG1 ILE 493 -7.035 4.873 8.373 368 HG13 ILE 493 1HG1 ILE 493 -8.101 5.376 7.064 369 HG21 ILE 493 1HG2 ILE 493 -7.181 8.328 6.949 370 HG22 ILE 493 2HG2 ILE 493 -8.433 8.903 8.057 371 HG23 ILE 493 3HG2 ILE 493 -8.806 7.702 6.824 372 HD11 ILE 493 3HD1 ILE 493 -5.860 4.969 6.250 373 HD12 ILE 493 1HD1 ILE 493 -5.207 6.134 7.401 374 HD13 ILE 493 2HD1 ILE 493 -6.263 6.680 6.098 375 H LEU 494 H LEU 494 -5.654 9.701 9.537 376 HA LEU 494 HA LEU 494 -7.117 10.459 11.882 377 HB2 LEU 494 2HB LEU 494 -5.098 11.943 10.185 378 HB3 LEU 494 1HB LEU 494 -5.929 12.682 11.534 379 HG LEU 494 HG LEU 494 -4.858 11.035 13.067 380 HD11 LEU 494 1HD1 LEU 494 -3.279 10.183 10.657 381 HD12 LEU 494 2HD1 LEU 494 -4.452 9.201 11.535 382 HD13 LEU 494 3HD1 LEU 494 -2.956 9.710 12.323 383 HD21 LEU 494 3HD2 LEU 494 -3.874 13.217 12.774 384 HD22 LEU 494 1HD2 LEU 494 -2.962 12.645 11.376 385 HD23 LEU 494 2HD2 LEU 494 -2.613 12.000 12.980 386 HA PRO 495 HA PRO 495 -10.653 12.303 10.033 387 HB2 PRO 495 2HB PRO 495 -10.225 14.733 11.652 388 HB3 PRO 495 1HB PRO 495 -11.619 13.647 11.617 389 HG2 PRO 495 2HG PRO 495 -9.952 13.626 13.681 390 HG3 PRO 495 1HG PRO 495 -10.618 12.108 13.044 391 HD2 PRO 495 2HD PRO 495 -7.905 13.310 12.647 392 HD3 PRO 495 1HD PRO 495 -8.360 11.620 12.953 393 H ARG 496 H ARG 496 -7.693 13.976 9.896 394 HA ARG 496 HA ARG 496 -8.600 15.432 7.538 395 HB2 ARG 496 2HB ARG 496 -6.981 16.588 9.801 396 HB3 ARG 496 1HB ARG 496 -7.130 17.350 8.225 397 HG2 ARG 496 2HG ARG 496 -9.517 17.582 8.567 398 HG3 ARG 496 1HG ARG 496 -9.380 16.789 10.142 399 HD2 ARG 496 2HD ARG 496 -7.909 18.545 10.906 400 HD3 ARG 496 1HD ARG 496 -7.995 19.336 9.334 401 HE ARG 496 HE ARG 496 -10.563 19.140 10.094 402 HH11 ARG 496 1HH1 ARG 496 -7.678 20.404 11.695 403 HH12 ARG 496 2HH1 ARG 496 -8.469 21.670 12.502 404 HH21 ARG 496 1HH2 ARG 496 -11.696 20.920 11.243 405 HH22 ARG 496 2HH2 ARG 496 -10.772 21.970 12.238 406 H GLY 497 H GLY 497 -7.138 15.477 5.910 407 HA2 GLY 497 2HA GLY 497 -4.671 15.528 5.524 408 HA3 GLY 497 1HA GLY 497 -4.643 13.995 6.361 409 H ALA 498 H ALA 498 -3.665 13.985 3.927 410 HA ALA 498 HA ALA 498 -5.375 13.838 1.739 411 HB1 ALA 498 1HB ALA 498 -2.756 12.414 2.119 412 HB2 ALA 498 2HB ALA 498 -2.956 14.080 1.580 413 HB3 ALA 498 3HB ALA 498 -3.558 12.754 0.586 414 H ALA 499 H ALA 499 -4.304 11.322 3.940 415 HA ALA 499 HA ALA 499 -5.222 9.096 2.515 416 HB1 ALA 499 1HB ALA 499 -3.712 8.883 4.369 417 HB2 ALA 499 2HB ALA 499 -5.142 7.895 4.655 418 HB3 ALA 499 3HB ALA 499 -4.950 9.439 5.490 419 H ILE 500 H ILE 500 -6.934 11.064 4.902 420 HA ILE 500 HA ILE 500 -9.167 9.299 4.765 421 HB ILE 500 HB ILE 500 -8.647 10.597 6.848 422 HG12 ILE 500 2HG1 ILE 500 -11.374 10.935 5.608 423 HG13 ILE 500 1HG1 ILE 500 -10.792 9.577 6.525 424 HG21 ILE 500 1HG2 ILE 500 -8.049 12.734 5.840 425 HG22 ILE 500 2HG2 ILE 500 -9.355 12.938 7.008 426 HG23 ILE 500 3HG2 ILE 500 -9.706 12.946 5.280 427 HD11 ILE 500 3HD1 ILE 500 -11.170 12.333 7.647 428 HD12 ILE 500 1HD1 ILE 500 -10.651 10.888 8.523 429 HD13 ILE 500 2HD1 ILE 500 -12.278 10.974 7.844 430 H GLN 501 H GLN 501 -8.224 12.248 3.187 431 HA GLN 501 HA GLN 501 -10.819 12.835 2.106 432 HB2 GLN 501 2HB GLN 501 -8.111 13.775 1.253 433 HB3 GLN 501 1HB GLN 501 -9.630 14.475 0.707 434 HG2 GLN 501 2HG GLN 501 -8.546 14.501 3.526 435 HG3 GLN 501 1HG GLN 501 -8.620 15.869 2.424 436 HE21 GLN 501 1HE2 GLN 501 -11.311 15.180 1.459 437 HE22 GLN 501 2HE2 GLN 501 -12.376 15.567 2.752 438 H ASP 502 H ASP 502 -8.159 10.862 1.216 439 HA ASP 502 HA ASP 502 -8.717 10.607 -1.555 440 HB2 ASP 502 2HB ASP 502 -6.534 10.006 -0.707 441 HB3 ASP 502 1HB ASP 502 -7.246 8.807 0.364 442 H GLY 503 H GLY 503 -9.406 8.608 1.219 443 HA2 GLY 503 2HA GLY 503 -11.521 7.594 1.649 444 HA3 GLY 503 1HA GLY 503 -11.943 7.840 -0.029 445 H ARG 504 H ARG 504 -9.189 6.468 -0.737 446 HA ARG 504 HA ARG 504 -10.386 3.821 -0.750 447 HB2 ARG 504 2HB ARG 504 -7.700 4.706 -1.859 448 HB3 ARG 504 1HB ARG 504 -8.351 3.091 -2.011 449 HG2 ARG 504 2HG ARG 504 -8.636 4.172 -4.091 450 HG3 ARG 504 1HG ARG 504 -10.229 4.101 -3.345 451 HD2 ARG 504 2HD ARG 504 -9.991 6.424 -2.633 452 HD3 ARG 504 1HD ARG 504 -8.383 6.480 -3.348 453 HE ARG 504 HE ARG 504 -10.617 5.793 -5.053 454 HH11 ARG 504 1HH1 ARG 504 -8.210 8.257 -4.061 455 HH12 ARG 504 2HH1 ARG 504 -8.503 9.213 -5.435 456 HH21 ARG 504 1HH2 ARG 504 -10.957 7.148 -6.887 457 HH22 ARG 504 2HH2 ARG 504 -10.078 8.599 -7.063 458 H LEU 505 H LEU 505 -7.486 5.366 0.397 459 HA LEU 505 HA LEU 505 -6.508 3.166 1.871 460 HB2 LEU 505 2HB LEU 505 -5.142 5.071 1.120 461 HB3 LEU 505 1HB LEU 505 -6.003 6.117 2.226 462 HG LEU 505 HG LEU 505 -5.069 4.854 4.125 463 HD11 LEU 505 1HD1 LEU 505 -3.554 3.382 1.978 464 HD12 LEU 505 2HD1 LEU 505 -4.731 2.682 3.103 465 HD13 LEU 505 3HD1 LEU 505 -3.196 3.334 3.698 466 HD21 LEU 505 3HD2 LEU 505 -3.027 5.853 2.161 467 HD22 LEU 505 1HD2 LEU 505 -2.787 5.665 3.893 468 HD23 LEU 505 2HD2 LEU 505 -3.948 6.846 3.288 469 H LYS 506 H LYS 506 -6.976 2.453 3.852 470 HA LYS 506 HA LYS 506 -8.626 4.030 5.659 471 HB2 LYS 506 2HB LYS 506 -10.084 2.097 6.041 472 HB3 LYS 506 1HB LYS 506 -10.118 2.541 4.338 473 HG2 LYS 506 2HG LYS 506 -8.437 0.755 3.908 474 HG3 LYS 506 1HG LYS 506 -8.606 0.269 5.591 475 HD2 LYS 506 2HD LYS 506 -10.980 -0.190 5.203 476 HD3 LYS 506 1HD LYS 506 -10.785 0.293 3.512 477 HE2 LYS 506 2HE LYS 506 -9.049 -1.479 3.271 478 HE3 LYS 506 1HE LYS 506 -9.417 -1.994 4.912 479 HZ1 LYS 506 3HZ LYS 506 -11.289 -1.987 2.628 480 HZ2 LYS 506 1HZ LYS 506 -11.696 -2.447 4.192 481 HZ3 LYS 506 2HZ LYS 506 -10.552 -3.331 3.313 482 H ALA 507 H ALA 507 -8.710 2.628 7.826 483 HA ALA 507 HA ALA 507 -5.976 2.161 8.509 484 HB1 ALA 507 1HB ALA 507 -6.808 1.763 10.769 485 HB2 ALA 507 2HB ALA 507 -8.466 1.760 10.172 486 HB3 ALA 507 3HB ALA 507 -7.508 3.238 10.103 487 H GLY 508 H GLY 508 -4.951 0.286 8.661 488 HA2 GLY 508 2HA GLY 508 -4.806 -2.017 9.097 489 HA3 GLY 508 1HA GLY 508 -6.482 -2.223 8.661 490 H ASP 509 H ASP 509 -5.160 -0.263 6.301 491 HA ASP 509 HA ASP 509 -4.924 -2.450 4.497 492 HB2 ASP 509 2HB ASP 509 -4.153 0.452 4.102 493 HB3 ASP 509 1HB ASP 509 -3.964 -0.778 2.862 494 H ARG 510 H ARG 510 -3.237 -3.317 3.551 495 HA ARG 510 HA ARG 510 -0.894 -3.321 5.260 496 HB2 ARG 510 2HB ARG 510 -1.855 -5.423 4.912 497 HB3 ARG 510 1HB ARG 510 -2.021 -5.235 3.200 498 HG2 ARG 510 2HG ARG 510 0.456 -5.375 3.013 499 HG3 ARG 510 1HG ARG 510 0.523 -5.629 4.765 500 HD2 ARG 510 2HD ARG 510 -0.896 -7.616 4.533 501 HD3 ARG 510 1HD ARG 510 -0.987 -7.314 2.801 502 HE ARG 510 HE ARG 510 1.632 -7.588 3.121 503 HH11 ARG 510 1HH1 ARG 510 -1.033 -9.568 4.439 504 HH12 ARG 510 2HH1 ARG 510 -0.158 -11.015 4.371 505 HH21 ARG 510 1HH2 ARG 510 2.813 -9.577 3.062 506 HH22 ARG 510 2HH2 ARG 510 2.073 -11.035 3.559 507 H LEU 511 H LEU 511 0.648 -1.988 4.711 508 HA LEU 511 HA LEU 511 0.694 -0.848 2.085 509 HB2 LEU 511 2HB LEU 511 1.277 0.393 4.390 510 HB3 LEU 511 1HB LEU 511 2.758 -0.478 4.245 511 HG LEU 511 HG LEU 511 3.389 0.746 2.162 512 HD11 LEU 511 1HD1 LEU 511 2.087 2.391 1.233 513 HD12 LEU 511 2HD1 LEU 511 0.785 2.147 2.413 514 HD13 LEU 511 3HD1 LEU 511 1.190 0.897 1.230 515 HD21 LEU 511 3HD2 LEU 511 3.913 1.744 4.370 516 HD22 LEU 511 1HD2 LEU 511 2.369 2.593 4.317 517 HD23 LEU 511 2HD2 LEU 511 3.612 2.948 3.115 518 H ILE 512 H ILE 512 1.796 -1.654 0.433 519 HA ILE 512 HA ILE 512 3.506 -3.977 0.879 520 HB ILE 512 HB ILE 512 2.269 -2.843 -1.646 521 HG12 ILE 512 2HG1 ILE 512 0.618 -3.873 -0.188 522 HG13 ILE 512 1HG1 ILE 512 0.874 -4.864 -1.599 523 HG21 ILE 512 1HG2 ILE 512 3.926 -5.344 -1.322 524 HG22 ILE 512 2HG2 ILE 512 4.376 -3.884 -2.206 525 HG23 ILE 512 3HG2 ILE 512 3.040 -4.885 -2.780 526 HD11 ILE 512 3HD1 ILE 512 2.352 -6.353 -0.303 527 HD12 ILE 512 1HD1 ILE 512 0.734 -6.289 0.378 528 HD13 ILE 512 2HD1 ILE 512 2.046 -5.388 1.136 529 H GLU 513 H GLU 513 3.537 -1.012 -1.059 530 HA GLU 513 HA GLU 513 6.293 -0.688 -0.400 531 HB2 GLU 513 2HB GLU 513 7.069 -0.444 -2.693 532 HB3 GLU 513 1HB GLU 513 6.408 -2.045 -2.473 533 HG2 GLU 513 2HG GLU 513 4.375 -1.384 -3.598 534 HG3 GLU 513 1HG GLU 513 5.004 0.269 -3.729 535 H VAL 514 H VAL 514 6.930 1.348 -0.723 536 HA VAL 514 HA VAL 514 4.815 3.231 -1.447 537 HB VAL 514 HB VAL 514 4.914 3.460 0.934 538 HG11 VAL 514 1HG1 VAL 514 6.959 4.001 2.167 539 HG12 VAL 514 2HG1 VAL 514 7.895 3.902 0.670 540 HG13 VAL 514 3HG1 VAL 514 7.129 2.459 1.328 541 HG21 VAL 514 3HG2 VAL 514 5.552 5.831 1.161 542 HG22 VAL 514 1HG2 VAL 514 4.719 5.517 -0.375 543 HG23 VAL 514 2HG2 VAL 514 6.441 5.737 -0.365 544 H ASN 515 H ASN 515 5.314 4.043 -3.286 545 HA ASN 515 HA ASN 515 6.254 5.535 -4.730 546 HB2 ASN 515 2HB ASN 515 6.201 6.821 -2.600 547 HB3 ASN 515 1HB ASN 515 7.836 6.294 -2.276 548 HD21 ASN 515 1HD2 ASN 515 8.506 8.333 -2.119 549 HD22 ASN 515 2HD2 ASN 515 8.678 9.426 -3.418 550 H GLY 516 H GLY 516 7.536 2.847 -4.251 551 HA2 GLY 516 2HA GLY 516 9.213 2.043 -5.839 552 HA3 GLY 516 1HA GLY 516 10.156 3.474 -5.454 553 H VAL 517 H VAL 517 9.091 2.748 -2.558 554 HA VAL 517 HA VAL 517 11.479 1.192 -1.915 555 HB VAL 517 HB VAL 517 9.548 2.666 -0.086 556 HG11 VAL 517 1HG1 VAL 517 12.211 1.388 0.543 557 HG12 VAL 517 2HG1 VAL 517 10.624 0.819 1.079 558 HG13 VAL 517 3HG1 VAL 517 11.251 2.361 1.658 559 HG21 VAL 517 3HG2 VAL 517 10.805 4.213 -1.488 560 HG22 VAL 517 1HG2 VAL 517 12.317 3.446 -1.009 561 HG23 VAL 517 2HG2 VAL 517 11.354 4.314 0.185 562 H ASP 518 H ASP 518 11.254 -0.908 -1.639 563 HA ASP 518 HA ASP 518 8.602 -2.070 -1.311 564 HB2 ASP 518 2HB ASP 518 11.290 -3.364 -1.819 565 HB3 ASP 518 1HB ASP 518 9.802 -4.256 -1.575 566 H LEU 519 H LEU 519 7.859 -2.199 0.625 567 HA LEU 519 HA LEU 519 9.687 -2.771 2.754 568 HB2 LEU 519 2HB LEU 519 7.361 -2.619 4.096 569 HB3 LEU 519 1HB LEU 519 8.430 -1.281 3.757 570 HG LEU 519 HG LEU 519 6.036 -1.879 1.976 571 HD11 LEU 519 1HD1 LEU 519 6.256 -0.005 4.317 572 HD12 LEU 519 2HD1 LEU 519 5.295 -1.507 4.305 573 HD13 LEU 519 3HD1 LEU 519 4.894 -0.178 3.208 574 HD21 LEU 519 3HD2 LEU 519 7.616 0.632 2.509 575 HD22 LEU 519 1HD2 LEU 519 6.277 0.446 1.387 576 HD23 LEU 519 2HD2 LEU 519 7.797 -0.402 1.097 577 H ALA 520 H ALA 520 8.598 -4.551 0.619 578 HA ALA 520 HA ALA 520 7.922 -6.850 2.237 579 HB1 ALA 520 1HB ALA 520 6.967 -6.659 -0.026 580 HB2 ALA 520 2HB ALA 520 8.022 -8.067 0.081 581 HB3 ALA 520 3HB ALA 520 8.591 -6.596 -0.709 582 H GLY 521 H GLY 521 10.530 -5.024 1.601 583 HA2 GLY 521 2HA GLY 521 12.427 -7.176 2.228 584 HA3 GLY 521 1HA GLY 521 12.806 -5.953 1.013 585 H LYS 522 H LYS 522 11.826 -3.670 2.154 586 HA LYS 522 HA LYS 522 13.770 -2.998 4.067 587 HB2 LYS 522 2HB LYS 522 11.388 -1.561 2.960 588 HB3 LYS 522 1HB LYS 522 12.285 -0.886 4.310 589 HG2 LYS 522 2HG LYS 522 13.521 -1.637 1.671 590 HG3 LYS 522 1HG LYS 522 12.968 -0.008 2.088 591 HD2 LYS 522 2HD LYS 522 14.450 0.008 4.005 592 HD3 LYS 522 1HD LYS 522 15.055 -1.595 3.606 593 HE2 LYS 522 2HE LYS 522 15.941 -0.698 1.507 594 HE3 LYS 522 1HE LYS 522 15.294 0.896 1.924 595 HZ1 LYS 522 3HZ LYS 522 17.644 0.725 2.463 596 HZ2 LYS 522 1HZ LYS 522 17.350 -0.598 3.454 597 HZ3 LYS 522 2HZ LYS 522 16.720 0.905 3.879 598 H SER 523 H SER 523 13.453 -2.130 6.186 599 HA SER 523 HA SER 523 11.788 -3.909 7.702 600 HB2 SER 523 2HB SER 523 13.220 -3.073 9.568 601 HB3 SER 523 1HB SER 523 14.132 -3.749 8.205 602 HG SER 523 HG SER 523 14.941 -1.754 9.021 603 H GLN 524 H GLN 524 10.878 -2.903 9.753 604 HA GLN 524 HA GLN 524 8.863 -1.112 9.103 605 HB2 GLN 524 2HB GLN 524 8.437 -0.975 11.567 606 HB3 GLN 524 1HB GLN 524 8.497 -2.601 10.909 607 HG2 GLN 524 2HG GLN 524 10.758 -2.880 11.779 608 HG3 GLN 524 1HG GLN 524 10.737 -1.236 12.385 609 HE21 GLN 524 1HE2 GLN 524 9.626 -0.774 14.208 610 HE22 GLN 524 2HE2 GLN 524 8.912 -1.961 15.254 611 H GLU 525 H GLU 525 11.921 -0.449 10.705 612 HA GLU 525 HA GLU 525 11.244 2.217 11.380 613 HB2 GLU 525 2HB GLU 525 13.795 0.718 11.350 614 HB3 GLU 525 1HB GLU 525 13.865 2.476 11.482 615 HG2 GLU 525 2HG GLU 525 13.981 1.377 13.654 616 HG3 GLU 525 1HG GLU 525 12.540 2.371 13.510 617 H GLU 526 H GLU 526 12.698 0.830 8.559 618 HA GLU 526 HA GLU 526 13.696 3.153 7.358 619 HB2 GLU 526 2HB GLU 526 12.421 0.728 6.107 620 HB3 GLU 526 1HB GLU 526 13.385 1.916 5.247 621 HG2 GLU 526 2HG GLU 526 14.386 0.282 7.534 622 HG3 GLU 526 1HG GLU 526 14.562 -0.223 5.866 623 H VAL 527 H VAL 527 10.557 1.571 7.120 624 HA VAL 527 HA VAL 527 9.550 3.661 5.473 625 HB VAL 527 HB VAL 527 7.466 2.408 5.346 626 HG11 VAL 527 1HG1 VAL 527 8.378 0.459 4.302 627 HG12 VAL 527 2HG1 VAL 527 9.921 0.715 5.131 628 HG13 VAL 527 3HG1 VAL 527 9.368 1.870 3.898 629 HG21 VAL 527 3HG2 VAL 527 8.795 0.456 7.218 630 HG22 VAL 527 1HG2 VAL 527 7.262 0.245 6.371 631 HG23 VAL 527 2HG2 VAL 527 7.406 1.482 7.634 632 H VAL 528 H VAL 528 9.148 2.797 8.863 633 HA VAL 528 HA VAL 528 7.086 4.664 9.340 634 HB VAL 528 HB VAL 528 9.102 3.486 11.305 635 HG11 VAL 528 1HG1 VAL 528 8.234 5.624 12.166 636 HG12 VAL 528 2HG1 VAL 528 7.594 4.265 13.091 637 HG13 VAL 528 3HG1 VAL 528 6.585 5.067 11.885 638 HG21 VAL 528 3HG2 VAL 528 6.200 2.842 10.769 639 HG22 VAL 528 1HG2 VAL 528 7.192 2.095 12.014 640 HG23 VAL 528 2HG2 VAL 528 7.577 1.846 10.313 641 H SER 529 H SER 529 10.557 5.038 9.202 642 HA SER 529 HA SER 529 10.569 7.656 10.250 643 HB2 SER 529 2HB SER 529 12.478 6.394 8.281 644 HB3 SER 529 1HB SER 529 12.785 7.872 9.196 645 HG SER 529 HG SER 529 12.613 5.214 10.051 646 H LEU 530 H LEU 530 9.891 6.404 7.083 647 HA LEU 530 HA LEU 530 9.909 8.859 5.663 648 HB2 LEU 530 2HB LEU 530 8.473 6.291 5.265 649 HB3 LEU 530 1HB LEU 530 8.464 7.565 4.044 650 HG LEU 530 HG LEU 530 10.842 5.941 4.999 651 HD11 LEU 530 1HD1 LEU 530 9.409 5.987 2.346 652 HD12 LEU 530 2HD1 LEU 530 9.324 4.699 3.548 653 HD13 LEU 530 3HD1 LEU 530 10.848 5.044 2.729 654 HD21 LEU 530 3HD2 LEU 530 12.094 7.092 3.228 655 HD22 LEU 530 1HD2 LEU 530 11.525 8.218 4.459 656 HD23 LEU 530 2HD2 LEU 530 10.694 8.112 2.908 657 H LEU 531 H LEU 531 7.242 6.906 7.084 658 HA LEU 531 HA LEU 531 5.296 8.813 6.595 659 HB2 LEU 531 2HB LEU 531 5.414 6.341 8.316 660 HB3 LEU 531 1HB LEU 531 4.042 7.436 8.409 661 HG LEU 531 HG LEU 531 3.684 5.505 7.010 662 HD11 LEU 531 1HD1 LEU 531 2.431 7.544 6.550 663 HD12 LEU 531 2HD1 LEU 531 2.761 6.692 5.043 664 HD13 LEU 531 3HD1 LEU 531 3.703 8.115 5.476 665 HD21 LEU 531 3HD2 LEU 531 5.810 6.640 5.194 666 HD22 LEU 531 1HD2 LEU 531 4.729 5.311 4.774 667 HD23 LEU 531 2HD2 LEU 531 5.894 5.124 6.087 668 H ARG 532 H ARG 532 7.501 8.462 9.226 669 HA ARG 532 HA ARG 532 6.191 10.256 10.997 670 HB2 ARG 532 2HB ARG 532 7.836 8.630 11.800 671 HB3 ARG 532 1HB ARG 532 9.091 9.412 10.860 672 HG2 ARG 532 2HG ARG 532 8.894 11.418 12.230 673 HG3 ARG 532 1HG ARG 532 7.600 10.665 13.162 674 HD2 ARG 532 2HD ARG 532 9.701 10.507 14.365 675 HD3 ARG 532 1HD ARG 532 9.159 8.905 13.880 676 HE ARG 532 HE ARG 532 10.958 10.008 11.964 677 HH11 ARG 532 1HH1 ARG 532 10.877 8.451 15.150 678 HH12 ARG 532 2HH1 ARG 532 12.456 7.852 15.064 679 HH21 ARG 532 1HH2 ARG 532 13.158 9.160 11.826 680 HH22 ARG 532 2HH2 ARG 532 13.779 8.260 13.127 681 H SER 533 H SER 533 8.986 10.687 8.790 682 HA SER 533 HA SER 533 9.204 13.440 9.407 683 HB2 SER 533 2HB SER 533 10.843 13.476 7.542 684 HB3 SER 533 1HB SER 533 11.171 12.261 8.772 685 HG SER 533 HG SER 533 10.582 10.682 7.416 686 H THR 534 H THR 534 7.484 11.692 6.977 687 HA THR 534 HA THR 534 6.140 12.154 5.334 688 HB THR 534 HB THR 534 4.669 14.177 5.344 689 HG1 THR 534 1HG THR 534 6.671 15.145 6.931 690 HG21 THR 534 3HG2 THR 534 4.138 12.271 6.807 691 HG22 THR 534 1HG2 THR 534 3.607 13.802 7.508 692 HG23 THR 534 2HG2 THR 534 5.069 13.013 8.095 693 H LYS 535 H LYS 535 7.259 11.973 3.588 694 HA LYS 535 HA LYS 535 9.269 13.806 2.807 695 HB2 LYS 535 2HB LYS 535 9.296 11.368 2.299 696 HB3 LYS 535 1HB LYS 535 7.963 11.607 1.185 697 HG2 LYS 535 2HG LYS 535 9.325 12.935 -0.252 698 HG3 LYS 535 1HG LYS 535 10.651 12.915 0.915 699 HD2 LYS 535 2HD LYS 535 10.789 10.463 0.666 700 HD3 LYS 535 1HD LYS 535 9.523 10.538 -0.562 701 HE2 LYS 535 2HE LYS 535 10.919 11.899 -1.975 702 HE3 LYS 535 1HE LYS 535 12.165 11.980 -0.735 703 HZ1 LYS 535 3HZ LYS 535 12.457 9.593 -0.956 704 HZ2 LYS 535 1HZ LYS 535 12.702 10.351 -2.435 705 HZ3 LYS 535 2HZ LYS 535 11.271 9.519 -2.143 706 H MET 536 H MET 536 9.266 15.432 1.323 707 HA MET 536 HA MET 536 6.596 16.538 0.795 708 HB2 MET 536 2HB MET 536 7.762 18.670 0.624 709 HB3 MET 536 1HB MET 536 7.838 17.945 2.244 710 HG2 MET 536 2HG MET 536 10.148 17.227 1.688 711 HG3 MET 536 1HG MET 536 10.004 18.042 0.137 712 HE1 MET 536 3HE MET 536 12.459 20.344 2.135 713 HE2 MET 536 1HE MET 536 12.217 19.416 0.656 714 HE3 MET 536 2HE MET 536 12.351 18.587 2.208 715 H GLU 537 H GLU 537 7.839 14.721 -1.155 716 HA GLU 537 HA GLU 537 8.673 16.262 -3.327 717 HB2 GLU 537 2HB GLU 537 7.235 13.602 -3.425 718 HB3 GLU 537 1HB GLU 537 8.032 14.356 -4.789 719 HG2 GLU 537 2HG GLU 537 10.169 14.168 -3.623 720 HG3 GLU 537 1HG GLU 537 9.342 13.382 -2.274 721 H GLY 538 H GLY 538 5.661 15.794 -1.983 722 HA2 GLY 538 2HA GLY 538 3.821 17.334 -2.710 723 HA3 GLY 538 1HA GLY 538 4.142 16.771 -4.346 724 H THR 539 H THR 539 3.962 14.470 -4.749 725 HA THR 539 HA THR 539 1.754 13.367 -3.266 726 HB THR 539 HB THR 539 1.926 11.662 -5.184 727 HG1 THR 539 1HG THR 539 3.577 11.992 -6.420 728 HG21 THR 539 3HG2 THR 539 0.632 13.062 -6.674 729 HG22 THR 539 1HG2 THR 539 1.128 14.517 -5.791 730 HG23 THR 539 2HG2 THR 539 0.124 13.286 -5.006 731 H VAL 540 H VAL 540 1.886 11.251 -2.504 732 HA VAL 540 HA VAL 540 4.426 9.825 -2.707 733 HB VAL 540 HB VAL 540 2.669 10.066 -0.217 734 HG11 VAL 540 1HG1 VAL 540 3.241 7.692 -0.584 735 HG12 VAL 540 2HG1 VAL 540 4.094 8.348 0.814 736 HG13 VAL 540 3HG1 VAL 540 4.944 8.131 -0.716 737 HG21 VAL 540 3HG2 VAL 540 4.747 10.712 0.883 738 HG22 VAL 540 1HG2 VAL 540 4.430 11.757 -0.503 739 HG23 VAL 540 2HG2 VAL 540 5.626 10.476 -0.629 740 H SER 541 H SER 541 4.143 7.930 -3.652 741 HA SER 541 HA SER 541 1.428 7.040 -4.101 742 HB2 SER 541 2HB SER 541 2.986 7.193 -6.032 743 HB3 SER 541 1HB SER 541 4.053 6.050 -5.216 744 HG SER 541 HG SER 541 1.353 5.357 -5.785 745 H LEU 542 H LEU 542 0.564 5.451 -3.034 746 HA LEU 542 HA LEU 542 2.295 3.738 -1.413 747 HB2 LEU 542 2HB LEU 542 -0.573 4.528 -1.049 748 HB3 LEU 542 1HB LEU 542 0.318 3.421 -0.028 749 HG LEU 542 HG LEU 542 0.952 6.347 -0.359 750 HD11 LEU 542 1HD1 LEU 542 -0.350 4.862 1.901 751 HD12 LEU 542 2HD1 LEU 542 -1.190 5.849 0.707 752 HD13 LEU 542 3HD1 LEU 542 -0.030 6.603 1.800 753 HD21 LEU 542 3HD2 LEU 542 2.031 4.266 1.568 754 HD22 LEU 542 1HD2 LEU 542 2.427 5.984 1.555 755 HD23 LEU 542 2HD2 LEU 542 2.883 4.962 0.195 756 H LEU 543 H LEU 543 2.328 1.745 -2.095 757 HA LEU 543 HA LEU 543 0.084 0.790 -3.726 758 HB2 LEU 543 2HB LEU 543 2.705 0.525 -4.278 759 HB3 LEU 543 1HB LEU 543 2.578 -0.680 -3.056 760 HG LEU 543 HG LEU 543 2.505 -1.699 -5.273 761 HD11 LEU 543 1HD1 LEU 543 1.461 -2.916 -3.493 762 HD12 LEU 543 2HD1 LEU 543 0.557 -3.130 -4.991 763 HD13 LEU 543 3HD1 LEU 543 -0.049 -2.041 -3.743 764 HD21 LEU 543 3HD2 LEU 543 1.409 0.071 -6.511 765 HD22 LEU 543 1HD2 LEU 543 -0.088 -0.213 -5.623 766 HD23 LEU 543 2HD2 LEU 543 0.543 -1.452 -6.706 767 H VAL 544 H VAL 544 -1.409 -0.232 -2.524 768 HA VAL 544 HA VAL 544 -0.466 -1.439 -0.017 769 HB VAL 544 HB VAL 544 -2.473 -0.892 1.117 770 HG11 VAL 544 1HG1 VAL 544 -1.473 1.550 -0.303 771 HG12 VAL 544 2HG1 VAL 544 -0.864 0.856 1.202 772 HG13 VAL 544 3HG1 VAL 544 -2.479 1.555 1.146 773 HG21 VAL 544 3HG2 VAL 544 -4.007 -1.226 -0.620 774 HG22 VAL 544 1HG2 VAL 544 -3.491 0.233 -1.475 775 HG23 VAL 544 2HG2 VAL 544 -4.324 0.366 0.101 776 H PHE 545 H PHE 545 -1.747 -3.093 0.768 777 HA PHE 545 HA PHE 545 -3.086 -4.766 -1.252 778 HB2 PHE 545 2HB PHE 545 -0.947 -5.548 -0.358 779 HB3 PHE 545 1HB PHE 545 -1.545 -5.386 1.275 780 HD1 PHE 545 2HD PHE 545 -3.180 -7.014 2.122 781 HD2 PHE 545 1HD PHE 545 -1.468 -7.346 -1.743 782 HE1 PHE 545 2HE PHE 545 -3.862 -9.371 2.033 783 HE2 PHE 545 1HE PHE 545 -2.128 -9.673 -1.856 784 HZ PHE 545 HZ PHE 545 -3.331 -10.720 0.049 785 H ARG 546 H ARG 546 -5.254 -4.622 -0.853 786 HA ARG 546 HA ARG 546 -5.976 -3.950 1.847 787 HB2 ARG 546 2HB ARG 546 -8.263 -3.528 1.062 788 HB3 ARG 546 1HB ARG 546 -7.139 -2.712 0.013 789 HG2 ARG 546 2HG ARG 546 -8.717 -3.518 -1.470 790 HG3 ARG 546 1HG ARG 546 -7.505 -4.794 -1.534 791 HD2 ARG 546 2HD ARG 546 -8.795 -6.132 0.035 792 HD3 ARG 546 1HD ARG 546 -9.967 -4.829 0.206 793 HE ARG 546 HE ARG 546 -9.523 -6.058 -2.409 794 HH11 ARG 546 1HH1 ARG 546 -11.668 -5.417 0.332 795 HH12 ARG 546 2HH1 ARG 546 -13.072 -6.004 -0.404 796 HH21 ARG 546 1HH2 ARG 546 -11.531 -6.912 -3.488 797 HH22 ARG 546 2HH2 ARG 546 -12.975 -6.860 -2.608 798 H GLN 547 H GLN 547 -6.446 -5.347 3.260 799 HA GLN 547 HA GLN 547 -6.299 -8.096 2.319 800 HB2 GLN 547 2HB GLN 547 -4.472 -7.323 3.728 801 HB3 GLN 547 1HB GLN 547 -5.606 -6.925 5.002 802 HG2 GLN 547 2HG GLN 547 -6.139 -9.241 5.334 803 HG3 GLN 547 1HG GLN 547 -5.177 -9.707 3.933 804 HE21 GLN 547 1HE2 GLN 547 -5.078 -8.630 7.246 805 HE22 GLN 547 2HE2 GLN 547 -3.414 -8.972 7.501 806 H GLU 548 H GLU 548 -8.005 -9.219 2.314 807 HA GLU 548 HA GLU 548 -10.193 -8.676 4.113 808 HB2 GLU 548 2HB GLU 548 -9.866 -10.758 1.925 809 HB3 GLU 548 1HB GLU 548 -11.331 -10.474 2.850 810 HG2 GLU 548 2HG GLU 548 -10.017 -8.481 1.020 811 HG3 GLU 548 1HG GLU 548 -11.421 -9.477 0.635 812 H GLU 549 H GLU 549 -8.607 -11.577 2.971 813 HA GLU 549 HA GLU 549 -7.944 -13.487 3.846 814 HB2 GLU 549 2HB GLU 549 -6.025 -12.126 4.471 815 HB3 GLU 549 1HB GLU 549 -6.787 -11.705 5.993 816 HG2 GLU 549 2HG GLU 549 -6.616 -13.933 6.802 817 HG3 GLU 549 1HG GLU 549 -6.118 -14.543 5.234 818 H ALA 550 H ALA 550 -8.635 -15.193 4.834 819 HA ALA 550 HA ALA 550 -10.671 -14.964 6.819 820 HB1 ALA 550 1HB ALA 550 -9.089 -17.363 5.868 821 HB2 ALA 550 2HB ALA 550 -10.651 -16.841 5.235 822 HB3 ALA 550 3HB ALA 550 -10.520 -17.425 6.895 823 H PHE 551 H PHE 551 -10.182 -14.442 8.859 824 HA PHE 551 HA PHE 551 -7.410 -14.565 9.622 825 HB2 PHE 551 2HB PHE 551 -9.777 -13.263 10.914 826 HB3 PHE 551 1HB PHE 551 -8.170 -13.260 11.639 827 HD1 PHE 551 1HD PHE 551 -6.282 -12.365 9.989 828 HD2 PHE 551 2HD PHE 551 -10.421 -11.451 9.691 829 HE1 PHE 551 1HE PHE 551 -5.732 -10.319 8.742 830 HE2 PHE 551 2HE PHE 551 -9.884 -9.406 8.438 831 HZ PHE 551 HZ PHE 551 -7.534 -8.836 7.964 832 H HIS 552 H HIS 552 -6.589 -15.705 11.086 833 HA HIS 552 HA HIS 552 -8.112 -17.946 12.126 834 HB2 HIS 552 2HB HIS 552 -5.146 -17.332 12.311 835 HB3 HIS 552 1HB HIS 552 -5.923 -18.865 12.699 836 HD1 HIS 552 1HD HIS 552 -4.553 -16.903 9.885 837 HD2 HIS 552 2HD HIS 552 -6.886 -20.297 10.412 838 HE1 HIS 552 1HE HIS 552 -4.605 -18.031 7.655 839 HE2 HIS 552 2HE HIS 552 -6.283 -19.871 7.945 840 HA PRO 553 HA PRO 553 -8.745 -15.338 15.709 841 HB2 PRO 553 2HB PRO 553 -9.850 -17.311 17.315 842 HB3 PRO 553 1HB PRO 553 -10.742 -16.304 16.174 843 HG2 PRO 553 2HG PRO 553 -9.721 -19.086 15.847 844 HG3 PRO 553 1HG PRO 553 -11.231 -18.373 15.258 845 HD2 PRO 553 2HD PRO 553 -9.119 -18.816 13.653 846 HD3 PRO 553 1HD PRO 553 -10.202 -17.430 13.412 847 H ARG 554 H ARG 554 -8.129 -18.549 17.114 848 HA ARG 554 HA ARG 554 -5.525 -17.746 18.027 849 HB2 ARG 554 2HB ARG 554 -7.811 -18.193 19.952 850 HB3 ARG 554 1HB ARG 554 -6.140 -18.430 20.422 851 HG2 ARG 554 2HG ARG 554 -7.292 -15.847 19.385 852 HG3 ARG 554 1HG ARG 554 -7.028 -16.235 21.090 853 HD2 ARG 554 2HD ARG 554 -4.639 -16.464 20.691 854 HD3 ARG 554 1HD ARG 554 -4.876 -16.175 18.973 855 HE ARG 554 HE ARG 554 -5.945 -14.039 20.350 856 HH11 ARG 554 1HH1 ARG 554 -2.751 -15.462 19.809 857 HH12 ARG 554 2HH1 ARG 554 -1.923 -13.983 19.892 858 HH21 ARG 554 1HH2 ARG 554 -4.837 -12.052 20.459 859 HH22 ARG 554 2HH2 ARG 554 -3.136 -11.974 20.296 860 H GLU 555 H GLU 555 -4.527 -19.448 19.296 861 HA GLU 555 HA GLU 555 -5.347 -22.118 18.441 862 HB2 GLU 555 2HB GLU 555 -3.333 -21.308 17.270 863 HB3 GLU 555 1HB GLU 555 -2.603 -20.872 18.796 864 HG2 GLU 555 2HG GLU 555 -2.606 -23.286 19.407 865 HG3 GLU 555 1HG GLU 555 -3.198 -23.644 17.787 866 H MET 556 H MET 556 -4.901 -23.690 20.139 867 HA MET 556 HA MET 556 -5.270 -22.584 22.752 868 HB2 MET 556 2HB MET 556 -6.281 -24.770 21.969 869 HB3 MET 556 1HB MET 556 -4.676 -25.471 22.026 870 HG2 MET 556 2HG MET 556 -6.157 -24.333 24.407 871 HG3 MET 556 1HG MET 556 -6.096 -26.034 23.991 872 HE1 MET 556 3HE MET 556 -2.291 -26.838 24.644 873 HE2 MET 556 1HE MET 556 -2.993 -26.327 23.110 874 HE3 MET 556 2HE MET 556 -3.842 -27.491 24.128 875 H ASN 557 H ASN 557 -3.659 -21.743 23.843 876 HA ASN 557 HA ASN 557 -1.062 -23.069 23.743 877 HB2 ASN 557 2HB ASN 557 0.089 -20.913 23.818 878 HB3 ASN 557 1HB ASN 557 -0.951 -20.979 22.403 879 HD21 ASN 557 1HD2 ASN 557 -2.791 -19.611 22.324 880 HD22 ASN 557 2HD2 ASN 557 -2.975 -18.279 23.397 881 H ALA 558 H ALA 558 -0.164 -23.414 25.651 882 HA ALA 558 HA ALA 558 -0.699 -21.847 27.945 883 HB1 ALA 558 1HB ALA 558 -2.742 -23.205 27.989 884 HB2 ALA 558 2HB ALA 558 -1.675 -23.646 29.319 885 HB3 ALA 558 3HB ALA 558 -1.777 -24.675 27.891
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