USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 981 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 TYR OH : rot -136:sc= 0.443 USER MOD Set 1.2: A 90 THR OG1 : rot 61:sc= 0.496 USER MOD Single : A 32 SER OG : rot -35:sc= 0.683 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -54:sc= 1.12 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.822 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl -130:sc= 0 (180deg=-0.0166) USER MOD Single : A 49 GLN : amide:sc=-0.00858 X(o=-0.0086,f=-0.15) USER MOD Single : A 51 SER OG : rot 180:sc=-0.00398 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -99:sc= 1.15 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -164:sc=-0.00376 (180deg=-0.29) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -161:sc= -0.0496 (180deg=-0.55) USER MOD Single : A 89 LYS NZ :NH3+ -161:sc= 0.288 (180deg=0.157) USER MOD Single : A 92 TYR OH : rot 41:sc= 0.496 USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=-0.0014) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 100:sc= 0.753 USER MOD Single : A 136 LYS NZ :NH3+ -177:sc= -1.45 (180deg=-1.46) USER MOD Single : A 139 SER OG : rot 77:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 342 N VAL A 27 134.530 5.574 7.130 1.00 0.00 N ATOM 343 CA VAL A 27 133.153 5.796 6.692 1.00 0.00 C ATOM 344 C VAL A 27 132.716 4.664 5.758 1.00 0.00 C ATOM 345 O VAL A 27 131.597 4.159 5.866 1.00 0.00 O ATOM 346 CB VAL A 27 133.043 7.188 6.012 1.00 0.00 C ATOM 347 CG1 VAL A 27 131.931 7.201 4.943 1.00 0.00 C ATOM 348 CG2 VAL A 27 132.733 8.252 7.088 1.00 0.00 C ATOM 0 HA VAL A 27 132.481 5.790 7.550 1.00 0.00 H new ATOM 0 HB VAL A 27 133.990 7.410 5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 27 131.878 8.189 4.485 1.00 0.00 H new ATOM 0 HG12 VAL A 27 132.153 6.457 4.178 1.00 0.00 H new ATOM 0 HG13 VAL A 27 130.975 6.966 5.410 1.00 0.00 H new ATOM 0 HG21 VAL A 27 132.654 9.232 6.618 1.00 0.00 H new ATOM 0 HG22 VAL A 27 131.791 8.009 7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 27 133.535 8.267 7.826 1.00 0.00 H new ATOM 358 N GLU A 28 133.599 4.275 4.846 1.00 0.00 N ATOM 359 CA GLU A 28 133.286 3.204 3.906 1.00 0.00 C ATOM 360 C GLU A 28 132.859 1.943 4.655 1.00 0.00 C ATOM 361 O GLU A 28 131.824 1.353 4.347 1.00 0.00 O ATOM 362 CB GLU A 28 134.511 2.901 3.047 1.00 0.00 C ATOM 363 CG GLU A 28 134.780 4.095 2.134 1.00 0.00 C ATOM 364 CD GLU A 28 136.065 3.879 1.346 1.00 0.00 C ATOM 365 OE1 GLU A 28 136.643 2.812 1.467 1.00 0.00 O ATOM 366 OE2 GLU A 28 136.454 4.788 0.629 1.00 0.00 O ATOM 0 H GLU A 28 134.529 4.680 4.737 1.00 0.00 H new ATOM 0 HA GLU A 28 132.463 3.527 3.268 1.00 0.00 H new ATOM 0 HB2 GLU A 28 135.377 2.707 3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 28 134.343 2.002 2.453 1.00 0.00 H new ATOM 0 HG2 GLU A 28 133.944 4.233 1.448 1.00 0.00 H new ATOM 0 HG3 GLU A 28 134.858 5.005 2.728 1.00 0.00 H new ATOM 373 N LEU A 29 133.650 1.545 5.647 1.00 0.00 N ATOM 374 CA LEU A 29 133.323 0.362 6.441 1.00 0.00 C ATOM 375 C LEU A 29 132.044 0.591 7.255 1.00 0.00 C ATOM 376 O LEU A 29 131.225 -0.318 7.401 1.00 0.00 O ATOM 377 CB LEU A 29 134.501 -0.004 7.365 1.00 0.00 C ATOM 378 CG LEU A 29 135.530 -0.880 6.615 1.00 0.00 C ATOM 379 CD1 LEU A 29 134.969 -2.301 6.379 1.00 0.00 C ATOM 380 CD2 LEU A 29 135.884 -0.240 5.264 1.00 0.00 C ATOM 0 H LEU A 29 134.512 2.017 5.919 1.00 0.00 H new ATOM 0 HA LEU A 29 133.145 -0.472 5.762 1.00 0.00 H new ATOM 0 HB2 LEU A 29 134.983 0.905 7.725 1.00 0.00 H new ATOM 0 HB3 LEU A 29 134.131 -0.537 8.241 1.00 0.00 H new ATOM 0 HG LEU A 29 136.427 -0.952 7.230 1.00 0.00 H new ATOM 0 HD11 LEU A 29 135.709 -2.901 5.850 1.00 0.00 H new ATOM 0 HD12 LEU A 29 134.743 -2.767 7.338 1.00 0.00 H new ATOM 0 HD13 LEU A 29 134.059 -2.238 5.782 1.00 0.00 H new ATOM 0 HD21 LEU A 29 136.610 -0.865 4.744 1.00 0.00 H new ATOM 0 HD22 LEU A 29 134.983 -0.149 4.657 1.00 0.00 H new ATOM 0 HD23 LEU A 29 136.311 0.749 5.431 1.00 0.00 H new ATOM 392 N GLY A 30 131.878 1.801 7.789 1.00 0.00 N ATOM 393 CA GLY A 30 130.695 2.116 8.591 1.00 0.00 C ATOM 394 C GLY A 30 129.410 1.912 7.788 1.00 0.00 C ATOM 395 O GLY A 30 128.443 1.339 8.291 1.00 0.00 O ATOM 0 H GLY A 30 132.539 2.571 7.683 1.00 0.00 H new ATOM 0 HA2 GLY A 30 130.676 1.484 9.479 1.00 0.00 H new ATOM 0 HA3 GLY A 30 130.751 3.148 8.936 1.00 0.00 H new ATOM 399 N VAL A 31 129.406 2.377 6.540 1.00 0.00 N ATOM 400 CA VAL A 31 128.230 2.230 5.684 1.00 0.00 C ATOM 401 C VAL A 31 127.957 0.754 5.392 1.00 0.00 C ATOM 402 O VAL A 31 126.813 0.302 5.449 1.00 0.00 O ATOM 403 CB VAL A 31 128.434 2.994 4.368 1.00 0.00 C ATOM 404 CG1 VAL A 31 127.303 2.661 3.387 1.00 0.00 C ATOM 405 CG2 VAL A 31 128.428 4.502 4.648 1.00 0.00 C ATOM 0 H VAL A 31 130.194 2.854 6.102 1.00 0.00 H new ATOM 0 HA VAL A 31 127.370 2.646 6.208 1.00 0.00 H new ATOM 0 HB VAL A 31 129.389 2.701 3.931 1.00 0.00 H new ATOM 0 HG11 VAL A 31 127.456 3.207 2.456 1.00 0.00 H new ATOM 0 HG12 VAL A 31 127.302 1.590 3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 31 126.346 2.948 3.823 1.00 0.00 H new ATOM 0 HG21 VAL A 31 128.573 5.046 3.715 1.00 0.00 H new ATOM 0 HG22 VAL A 31 127.473 4.786 5.089 1.00 0.00 H new ATOM 0 HG23 VAL A 31 129.234 4.747 5.339 1.00 0.00 H new ATOM 415 N SER A 32 129.009 0.011 5.069 1.00 0.00 N ATOM 416 CA SER A 32 128.858 -1.407 4.761 1.00 0.00 C ATOM 417 C SER A 32 128.274 -2.158 5.955 1.00 0.00 C ATOM 418 O SER A 32 127.416 -3.026 5.796 1.00 0.00 O ATOM 419 CB SER A 32 130.215 -2.010 4.401 1.00 0.00 C ATOM 420 OG SER A 32 131.081 -1.911 5.524 1.00 0.00 O ATOM 0 H SER A 32 129.965 0.361 5.014 1.00 0.00 H new ATOM 0 HA SER A 32 128.178 -1.502 3.915 1.00 0.00 H new ATOM 0 HB2 SER A 32 130.097 -3.053 4.108 1.00 0.00 H new ATOM 0 HB3 SER A 32 130.645 -1.486 3.547 1.00 0.00 H new ATOM 0 HG SER A 32 130.893 -1.081 6.010 1.00 0.00 H new ATOM 426 N TYR A 33 128.750 -1.825 7.150 1.00 0.00 N ATOM 427 CA TYR A 33 128.268 -2.482 8.361 1.00 0.00 C ATOM 428 C TYR A 33 126.776 -2.214 8.560 1.00 0.00 C ATOM 429 O TYR A 33 126.003 -3.130 8.834 1.00 0.00 O ATOM 430 CB TYR A 33 129.072 -1.980 9.586 1.00 0.00 C ATOM 431 CG TYR A 33 129.529 -3.154 10.438 1.00 0.00 C ATOM 432 CD1 TYR A 33 128.584 -4.031 10.995 1.00 0.00 C ATOM 433 CD2 TYR A 33 130.896 -3.370 10.657 1.00 0.00 C ATOM 434 CE1 TYR A 33 129.011 -5.120 11.766 1.00 0.00 C ATOM 435 CE2 TYR A 33 131.319 -4.455 11.431 1.00 0.00 C ATOM 436 CZ TYR A 33 130.378 -5.331 11.985 1.00 0.00 C ATOM 437 OH TYR A 33 130.798 -6.406 12.740 1.00 0.00 O ATOM 0 H TYR A 33 129.462 -1.112 7.306 1.00 0.00 H new ATOM 0 HA TYR A 33 128.411 -3.558 8.257 1.00 0.00 H new ATOM 0 HB2 TYR A 33 129.937 -1.407 9.251 1.00 0.00 H new ATOM 0 HB3 TYR A 33 128.456 -1.308 10.183 1.00 0.00 H new ATOM 0 HD1 TYR A 33 127.530 -3.866 10.829 1.00 0.00 H new ATOM 0 HD2 TYR A 33 131.624 -2.698 10.227 1.00 0.00 H new ATOM 0 HE1 TYR A 33 128.285 -5.797 12.192 1.00 0.00 H new ATOM 0 HE2 TYR A 33 132.373 -4.617 11.602 1.00 0.00 H new ATOM 0 HH TYR A 33 131.777 -6.406 12.793 1.00 0.00 H new ATOM 447 N ALA A 34 126.383 -0.951 8.429 1.00 0.00 N ATOM 448 CA ALA A 34 124.987 -0.579 8.613 1.00 0.00 C ATOM 449 C ALA A 34 124.099 -1.366 7.655 1.00 0.00 C ATOM 450 O ALA A 34 122.997 -1.780 8.014 1.00 0.00 O ATOM 451 CB ALA A 34 124.816 0.927 8.378 1.00 0.00 C ATOM 0 H ALA A 34 127.005 -0.176 8.199 1.00 0.00 H new ATOM 0 HA ALA A 34 124.689 -0.816 9.634 1.00 0.00 H new ATOM 0 HB1 ALA A 34 123.770 1.200 8.517 1.00 0.00 H new ATOM 0 HB2 ALA A 34 125.432 1.478 9.088 1.00 0.00 H new ATOM 0 HB3 ALA A 34 125.124 1.174 7.362 1.00 0.00 H new ATOM 457 N ALA A 35 124.587 -1.573 6.440 1.00 0.00 N ATOM 458 CA ALA A 35 123.825 -2.319 5.449 1.00 0.00 C ATOM 459 C ALA A 35 123.617 -3.761 5.907 1.00 0.00 C ATOM 460 O ALA A 35 122.552 -4.337 5.692 1.00 0.00 O ATOM 461 CB ALA A 35 124.562 -2.312 4.109 1.00 0.00 C ATOM 0 H ALA A 35 125.496 -1.239 6.119 1.00 0.00 H new ATOM 0 HA ALA A 35 122.852 -1.841 5.332 1.00 0.00 H new ATOM 0 HB1 ALA A 35 123.985 -2.872 3.373 1.00 0.00 H new ATOM 0 HB2 ALA A 35 124.685 -1.284 3.767 1.00 0.00 H new ATOM 0 HB3 ALA A 35 125.542 -2.774 4.230 1.00 0.00 H new ATOM 467 N LEU A 36 124.637 -4.342 6.536 1.00 0.00 N ATOM 468 CA LEU A 36 124.538 -5.720 7.007 1.00 0.00 C ATOM 469 C LEU A 36 123.417 -5.849 8.034 1.00 0.00 C ATOM 470 O LEU A 36 122.614 -6.782 7.976 1.00 0.00 O ATOM 471 CB LEU A 36 125.869 -6.154 7.638 1.00 0.00 C ATOM 472 CG LEU A 36 125.800 -7.622 8.095 1.00 0.00 C ATOM 473 CD1 LEU A 36 125.509 -8.545 6.896 1.00 0.00 C ATOM 474 CD2 LEU A 36 127.141 -8.011 8.730 1.00 0.00 C ATOM 0 H LEU A 36 125.529 -3.887 6.729 1.00 0.00 H new ATOM 0 HA LEU A 36 124.315 -6.364 6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 36 126.677 -6.030 6.917 1.00 0.00 H new ATOM 0 HB3 LEU A 36 126.100 -5.513 8.489 1.00 0.00 H new ATOM 0 HG LEU A 36 124.996 -7.733 8.823 1.00 0.00 H new ATOM 0 HD11 LEU A 36 125.463 -9.580 7.236 1.00 0.00 H new ATOM 0 HD12 LEU A 36 124.555 -8.268 6.447 1.00 0.00 H new ATOM 0 HD13 LEU A 36 126.302 -8.441 6.156 1.00 0.00 H new ATOM 0 HD21 LEU A 36 127.101 -9.050 9.057 1.00 0.00 H new ATOM 0 HD22 LEU A 36 127.939 -7.892 7.997 1.00 0.00 H new ATOM 0 HD23 LEU A 36 127.337 -7.368 9.588 1.00 0.00 H new ATOM 486 N LEU A 37 123.364 -4.902 8.966 1.00 0.00 N ATOM 487 CA LEU A 37 122.329 -4.916 9.997 1.00 0.00 C ATOM 488 C LEU A 37 120.950 -4.733 9.365 1.00 0.00 C ATOM 489 O LEU A 37 119.984 -5.359 9.779 1.00 0.00 O ATOM 490 CB LEU A 37 122.580 -3.803 11.033 1.00 0.00 C ATOM 491 CG LEU A 37 123.604 -4.262 12.084 1.00 0.00 C ATOM 492 CD1 LEU A 37 124.983 -4.393 11.449 1.00 0.00 C ATOM 493 CD2 LEU A 37 123.670 -3.227 13.209 1.00 0.00 C ATOM 0 H LEU A 37 124.018 -4.122 9.030 1.00 0.00 H new ATOM 0 HA LEU A 37 122.364 -5.881 10.503 1.00 0.00 H new ATOM 0 HB2 LEU A 37 122.944 -2.907 10.531 1.00 0.00 H new ATOM 0 HB3 LEU A 37 121.643 -3.536 11.522 1.00 0.00 H new ATOM 0 HG LEU A 37 123.297 -5.229 12.481 1.00 0.00 H new ATOM 0 HD11 LEU A 37 125.701 -4.719 12.202 1.00 0.00 H new ATOM 0 HD12 LEU A 37 124.944 -5.126 10.643 1.00 0.00 H new ATOM 0 HD13 LEU A 37 125.292 -3.428 11.047 1.00 0.00 H new ATOM 0 HD21 LEU A 37 124.395 -3.548 13.957 1.00 0.00 H new ATOM 0 HD22 LEU A 37 123.974 -2.264 12.800 1.00 0.00 H new ATOM 0 HD23 LEU A 37 122.688 -3.131 13.673 1.00 0.00 H new ATOM 505 N SER A 38 120.855 -3.859 8.376 1.00 0.00 N ATOM 506 CA SER A 38 119.573 -3.619 7.733 1.00 0.00 C ATOM 507 C SER A 38 119.045 -4.900 7.081 1.00 0.00 C ATOM 508 O SER A 38 117.839 -5.127 7.055 1.00 0.00 O ATOM 509 CB SER A 38 119.705 -2.509 6.691 1.00 0.00 C ATOM 510 OG SER A 38 120.353 -3.014 5.532 1.00 0.00 O ATOM 0 H SER A 38 121.634 -3.313 8.006 1.00 0.00 H new ATOM 0 HA SER A 38 118.860 -3.304 8.495 1.00 0.00 H new ATOM 0 HB2 SER A 38 118.720 -2.124 6.429 1.00 0.00 H new ATOM 0 HB3 SER A 38 120.274 -1.676 7.103 1.00 0.00 H new ATOM 0 HG SER A 38 121.203 -3.430 5.787 1.00 0.00 H new ATOM 516 N VAL A 39 119.957 -5.723 6.551 1.00 0.00 N ATOM 517 CA VAL A 39 119.580 -6.984 5.891 1.00 0.00 C ATOM 518 C VAL A 39 119.042 -8.017 6.887 1.00 0.00 C ATOM 519 O VAL A 39 118.015 -8.648 6.654 1.00 0.00 O ATOM 520 CB VAL A 39 120.808 -7.562 5.168 1.00 0.00 C ATOM 521 CG1 VAL A 39 120.489 -8.953 4.604 1.00 0.00 C ATOM 522 CG2 VAL A 39 121.217 -6.628 4.024 1.00 0.00 C ATOM 0 H VAL A 39 120.961 -5.541 6.565 1.00 0.00 H new ATOM 0 HA VAL A 39 118.783 -6.765 5.180 1.00 0.00 H new ATOM 0 HB VAL A 39 121.627 -7.649 5.881 1.00 0.00 H new ATOM 0 HG11 VAL A 39 121.368 -9.349 4.095 1.00 0.00 H new ATOM 0 HG12 VAL A 39 120.210 -9.621 5.419 1.00 0.00 H new ATOM 0 HG13 VAL A 39 119.663 -8.878 3.897 1.00 0.00 H new ATOM 0 HG21 VAL A 39 122.087 -7.039 3.512 1.00 0.00 H new ATOM 0 HG22 VAL A 39 120.392 -6.534 3.318 1.00 0.00 H new ATOM 0 HG23 VAL A 39 121.463 -5.645 4.427 1.00 0.00 H new ATOM 532 N ILE A 40 119.748 -8.212 7.989 1.00 0.00 N ATOM 533 CA ILE A 40 119.308 -9.189 8.978 1.00 0.00 C ATOM 534 C ILE A 40 118.108 -8.646 9.761 1.00 0.00 C ATOM 535 O ILE A 40 117.193 -9.394 10.106 1.00 0.00 O ATOM 536 CB ILE A 40 120.472 -9.568 9.916 1.00 0.00 C ATOM 537 CG1 ILE A 40 120.929 -8.342 10.745 1.00 0.00 C ATOM 538 CG2 ILE A 40 121.645 -10.092 9.069 1.00 0.00 C ATOM 539 CD1 ILE A 40 120.277 -8.371 12.129 1.00 0.00 C ATOM 0 H ILE A 40 120.611 -7.720 8.221 1.00 0.00 H new ATOM 0 HA ILE A 40 118.990 -10.096 8.464 1.00 0.00 H new ATOM 0 HB ILE A 40 120.136 -10.341 10.608 1.00 0.00 H new ATOM 0 HG12 ILE A 40 122.014 -8.345 10.846 1.00 0.00 H new ATOM 0 HG13 ILE A 40 120.660 -7.422 10.227 1.00 0.00 H new ATOM 0 HG21 ILE A 40 122.474 -10.363 9.723 1.00 0.00 H new ATOM 0 HG22 ILE A 40 121.325 -10.969 8.507 1.00 0.00 H new ATOM 0 HG23 ILE A 40 121.969 -9.315 8.376 1.00 0.00 H new ATOM 0 HD11 ILE A 40 120.605 -7.505 12.704 1.00 0.00 H new ATOM 0 HD12 ILE A 40 119.193 -8.346 12.021 1.00 0.00 H new ATOM 0 HD13 ILE A 40 120.568 -9.283 12.649 1.00 0.00 H new ATOM 551 N VAL A 41 118.121 -7.336 10.040 1.00 0.00 N ATOM 552 CA VAL A 41 117.032 -6.696 10.788 1.00 0.00 C ATOM 553 C VAL A 41 115.704 -6.802 10.042 1.00 0.00 C ATOM 554 O VAL A 41 114.687 -7.171 10.632 1.00 0.00 O ATOM 555 CB VAL A 41 117.367 -5.210 11.031 1.00 0.00 C ATOM 556 CG1 VAL A 41 116.108 -4.440 11.455 1.00 0.00 C ATOM 557 CG2 VAL A 41 118.413 -5.102 12.145 1.00 0.00 C ATOM 0 H VAL A 41 118.869 -6.702 9.761 1.00 0.00 H new ATOM 0 HA VAL A 41 116.931 -7.215 11.741 1.00 0.00 H new ATOM 0 HB VAL A 41 117.754 -4.782 10.106 1.00 0.00 H new ATOM 0 HG11 VAL A 41 116.361 -3.393 11.623 1.00 0.00 H new ATOM 0 HG12 VAL A 41 115.356 -4.510 10.669 1.00 0.00 H new ATOM 0 HG13 VAL A 41 115.712 -4.869 12.375 1.00 0.00 H new ATOM 0 HG21 VAL A 41 118.652 -4.053 12.319 1.00 0.00 H new ATOM 0 HG22 VAL A 41 118.016 -5.541 13.061 1.00 0.00 H new ATOM 0 HG23 VAL A 41 119.316 -5.636 11.849 1.00 0.00 H new ATOM 567 N VAL A 42 115.709 -6.472 8.757 1.00 0.00 N ATOM 568 CA VAL A 42 114.486 -6.534 7.974 1.00 0.00 C ATOM 569 C VAL A 42 113.997 -7.978 7.922 1.00 0.00 C ATOM 570 O VAL A 42 112.796 -8.239 7.975 1.00 0.00 O ATOM 571 CB VAL A 42 114.736 -5.981 6.568 1.00 0.00 C ATOM 572 CG1 VAL A 42 115.771 -6.835 5.862 1.00 0.00 C ATOM 573 CG2 VAL A 42 113.447 -5.987 5.756 1.00 0.00 C ATOM 0 H VAL A 42 116.534 -6.163 8.243 1.00 0.00 H new ATOM 0 HA VAL A 42 113.714 -5.922 8.440 1.00 0.00 H new ATOM 0 HB VAL A 42 115.097 -4.956 6.657 1.00 0.00 H new ATOM 0 HG11 VAL A 42 115.948 -6.440 4.862 1.00 0.00 H new ATOM 0 HG12 VAL A 42 116.703 -6.820 6.428 1.00 0.00 H new ATOM 0 HG13 VAL A 42 115.408 -7.860 5.788 1.00 0.00 H new ATOM 0 HG21 VAL A 42 113.643 -5.591 4.760 1.00 0.00 H new ATOM 0 HG22 VAL A 42 113.074 -7.008 5.674 1.00 0.00 H new ATOM 0 HG23 VAL A 42 112.701 -5.367 6.253 1.00 0.00 H new ATOM 583 N VAL A 43 114.933 -8.920 7.838 1.00 0.00 N ATOM 584 CA VAL A 43 114.558 -10.329 7.806 1.00 0.00 C ATOM 585 C VAL A 43 113.930 -10.765 9.135 1.00 0.00 C ATOM 586 O VAL A 43 112.915 -11.456 9.140 1.00 0.00 O ATOM 587 CB VAL A 43 115.787 -11.194 7.508 1.00 0.00 C ATOM 588 CG1 VAL A 43 115.436 -12.676 7.704 1.00 0.00 C ATOM 589 CG2 VAL A 43 116.210 -10.975 6.052 1.00 0.00 C ATOM 0 H VAL A 43 115.936 -8.739 7.792 1.00 0.00 H new ATOM 0 HA VAL A 43 113.819 -10.462 7.016 1.00 0.00 H new ATOM 0 HB VAL A 43 116.597 -10.917 8.183 1.00 0.00 H new ATOM 0 HG11 VAL A 43 116.312 -13.289 7.491 1.00 0.00 H new ATOM 0 HG12 VAL A 43 115.119 -12.842 8.734 1.00 0.00 H new ATOM 0 HG13 VAL A 43 114.628 -12.951 7.026 1.00 0.00 H new ATOM 0 HG21 VAL A 43 117.084 -11.587 5.831 1.00 0.00 H new ATOM 0 HG22 VAL A 43 115.392 -11.258 5.389 1.00 0.00 H new ATOM 0 HG23 VAL A 43 116.455 -9.924 5.898 1.00 0.00 H new ATOM 599 N VAL A 44 114.552 -10.383 10.251 1.00 0.00 N ATOM 600 CA VAL A 44 114.058 -10.770 11.578 1.00 0.00 C ATOM 601 C VAL A 44 112.653 -10.227 11.841 1.00 0.00 C ATOM 602 O VAL A 44 111.769 -10.961 12.277 1.00 0.00 O ATOM 603 CB VAL A 44 115.018 -10.232 12.652 1.00 0.00 C ATOM 604 CG1 VAL A 44 114.417 -10.430 14.052 1.00 0.00 C ATOM 605 CG2 VAL A 44 116.363 -10.972 12.564 1.00 0.00 C ATOM 0 H VAL A 44 115.395 -9.809 10.266 1.00 0.00 H new ATOM 0 HA VAL A 44 114.011 -11.858 11.616 1.00 0.00 H new ATOM 0 HB VAL A 44 115.174 -9.167 12.479 1.00 0.00 H new ATOM 0 HG11 VAL A 44 115.107 -10.045 14.802 1.00 0.00 H new ATOM 0 HG12 VAL A 44 113.470 -9.894 14.121 1.00 0.00 H new ATOM 0 HG13 VAL A 44 114.246 -11.492 14.228 1.00 0.00 H new ATOM 0 HG21 VAL A 44 117.040 -10.588 13.327 1.00 0.00 H new ATOM 0 HG22 VAL A 44 116.203 -12.038 12.725 1.00 0.00 H new ATOM 0 HG23 VAL A 44 116.801 -10.815 11.578 1.00 0.00 H new ATOM 615 N GLU A 45 112.459 -8.940 11.587 1.00 0.00 N ATOM 616 CA GLU A 45 111.159 -8.321 11.817 1.00 0.00 C ATOM 617 C GLU A 45 110.143 -8.849 10.813 1.00 0.00 C ATOM 618 O GLU A 45 108.958 -8.975 11.122 1.00 0.00 O ATOM 619 CB GLU A 45 111.276 -6.794 11.740 1.00 0.00 C ATOM 620 CG GLU A 45 111.777 -6.362 10.353 1.00 0.00 C ATOM 621 CD GLU A 45 110.602 -6.174 9.393 1.00 0.00 C ATOM 622 OE1 GLU A 45 109.881 -5.204 9.556 1.00 0.00 O ATOM 623 OE2 GLU A 45 110.441 -7.003 8.513 1.00 0.00 O ATOM 0 H GLU A 45 113.175 -8.310 11.226 1.00 0.00 H new ATOM 0 HA GLU A 45 110.812 -8.580 12.817 1.00 0.00 H new ATOM 0 HB2 GLU A 45 110.306 -6.338 11.941 1.00 0.00 H new ATOM 0 HB3 GLU A 45 111.962 -6.437 12.508 1.00 0.00 H new ATOM 0 HG2 GLU A 45 112.338 -5.431 10.436 1.00 0.00 H new ATOM 0 HG3 GLU A 45 112.461 -7.113 9.957 1.00 0.00 H new ATOM 630 N TYR A 46 110.619 -9.179 9.618 1.00 0.00 N ATOM 631 CA TYR A 46 109.750 -9.723 8.584 1.00 0.00 C ATOM 632 C TYR A 46 109.108 -11.030 9.061 1.00 0.00 C ATOM 633 O TYR A 46 107.898 -11.213 8.945 1.00 0.00 O ATOM 634 CB TYR A 46 110.572 -9.976 7.307 1.00 0.00 C ATOM 635 CG TYR A 46 109.805 -10.877 6.364 1.00 0.00 C ATOM 636 CD1 TYR A 46 108.788 -10.357 5.556 1.00 0.00 C ATOM 637 CD2 TYR A 46 110.110 -12.243 6.316 1.00 0.00 C ATOM 638 CE1 TYR A 46 108.077 -11.206 4.699 1.00 0.00 C ATOM 639 CE2 TYR A 46 109.402 -13.090 5.460 1.00 0.00 C ATOM 640 CZ TYR A 46 108.384 -12.574 4.650 1.00 0.00 C ATOM 641 OH TYR A 46 107.680 -13.410 3.808 1.00 0.00 O ATOM 0 H TYR A 46 111.596 -9.080 9.343 1.00 0.00 H new ATOM 0 HA TYR A 46 108.957 -9.006 8.370 1.00 0.00 H new ATOM 0 HB2 TYR A 46 110.796 -9.029 6.816 1.00 0.00 H new ATOM 0 HB3 TYR A 46 111.527 -10.435 7.565 1.00 0.00 H new ATOM 0 HD1 TYR A 46 108.552 -9.304 5.593 1.00 0.00 H new ATOM 0 HD2 TYR A 46 110.894 -12.642 6.942 1.00 0.00 H new ATOM 0 HE1 TYR A 46 107.291 -10.807 4.075 1.00 0.00 H new ATOM 0 HE2 TYR A 46 109.640 -14.143 5.423 1.00 0.00 H new ATOM 0 HH TYR A 46 108.020 -14.325 3.896 1.00 0.00 H new ATOM 651 N THR A 47 109.930 -11.942 9.583 1.00 0.00 N ATOM 652 CA THR A 47 109.429 -13.238 10.059 1.00 0.00 C ATOM 653 C THR A 47 109.040 -13.174 11.534 1.00 0.00 C ATOM 654 O THR A 47 107.871 -13.332 11.887 1.00 0.00 O ATOM 655 CB THR A 47 110.497 -14.331 9.849 1.00 0.00 C ATOM 656 OG1 THR A 47 110.152 -15.474 10.617 1.00 0.00 O ATOM 657 CG2 THR A 47 111.905 -13.849 10.277 1.00 0.00 C ATOM 0 H THR A 47 110.936 -11.812 9.688 1.00 0.00 H new ATOM 0 HA THR A 47 108.539 -13.485 9.481 1.00 0.00 H new ATOM 0 HB THR A 47 110.526 -14.570 8.786 1.00 0.00 H new ATOM 0 HG1 THR A 47 110.827 -16.172 10.486 1.00 0.00 H new ATOM 0 HG21 THR A 47 112.628 -14.648 10.113 1.00 0.00 H new ATOM 0 HG22 THR A 47 112.187 -12.978 9.686 1.00 0.00 H new ATOM 0 HG23 THR A 47 111.892 -13.582 11.334 1.00 0.00 H new ATOM 665 N MET A 48 110.029 -12.943 12.385 1.00 0.00 N ATOM 666 CA MET A 48 109.807 -12.857 13.819 1.00 0.00 C ATOM 667 C MET A 48 109.218 -11.498 14.183 1.00 0.00 C ATOM 668 O MET A 48 109.533 -10.486 13.558 1.00 0.00 O ATOM 669 CB MET A 48 111.140 -13.061 14.548 1.00 0.00 C ATOM 670 CG MET A 48 111.511 -14.552 14.564 1.00 0.00 C ATOM 671 SD MET A 48 113.306 -14.728 14.746 1.00 0.00 S ATOM 672 CE MET A 48 113.434 -14.383 16.521 1.00 0.00 C ATOM 0 H MET A 48 111.000 -12.811 12.103 1.00 0.00 H new ATOM 0 HA MET A 48 109.102 -13.632 14.121 1.00 0.00 H new ATOM 0 HB2 MET A 48 111.925 -12.488 14.054 1.00 0.00 H new ATOM 0 HB3 MET A 48 111.066 -12.686 15.569 1.00 0.00 H new ATOM 0 HG2 MET A 48 111.001 -15.056 15.385 1.00 0.00 H new ATOM 0 HG3 MET A 48 111.180 -15.030 13.642 1.00 0.00 H new ATOM 0 HE1 MET A 48 114.205 -13.631 16.691 1.00 0.00 H new ATOM 0 HE2 MET A 48 112.478 -14.012 16.889 1.00 0.00 H new ATOM 0 HE3 MET A 48 113.697 -15.298 17.052 1.00 0.00 H new ATOM 682 N GLN A 49 108.354 -11.488 15.192 1.00 0.00 N ATOM 683 CA GLN A 49 107.706 -10.255 15.641 1.00 0.00 C ATOM 684 C GLN A 49 108.227 -9.841 17.005 1.00 0.00 C ATOM 685 O GLN A 49 107.732 -8.893 17.610 1.00 0.00 O ATOM 686 CB GLN A 49 106.194 -10.480 15.708 1.00 0.00 C ATOM 687 CG GLN A 49 105.874 -11.471 16.835 1.00 0.00 C ATOM 688 CD GLN A 49 104.489 -12.075 16.625 1.00 0.00 C ATOM 689 OE1 GLN A 49 104.210 -12.627 15.562 1.00 0.00 O ATOM 690 NE2 GLN A 49 103.600 -11.996 17.576 1.00 0.00 N ATOM 0 H GLN A 49 108.084 -12.320 15.717 1.00 0.00 H new ATOM 0 HA GLN A 49 107.931 -9.457 14.933 1.00 0.00 H new ATOM 0 HB2 GLN A 49 105.682 -9.534 15.885 1.00 0.00 H new ATOM 0 HB3 GLN A 49 105.830 -10.866 14.756 1.00 0.00 H new ATOM 0 HG2 GLN A 49 106.624 -12.261 16.858 1.00 0.00 H new ATOM 0 HG3 GLN A 49 105.916 -10.963 17.799 1.00 0.00 H new ATOM 0 HE21 GLN A 49 103.834 -11.538 18.456 1.00 0.00 H new ATOM 0 HE22 GLN A 49 102.670 -12.393 17.439 1.00 0.00 H new ATOM 699 N LEU A 50 109.232 -10.566 17.474 1.00 0.00 N ATOM 700 CA LEU A 50 109.841 -10.288 18.779 1.00 0.00 C ATOM 701 C LEU A 50 108.783 -9.842 19.791 1.00 0.00 C ATOM 702 O LEU A 50 107.705 -10.432 19.871 1.00 0.00 O ATOM 703 CB LEU A 50 110.918 -9.206 18.626 1.00 0.00 C ATOM 704 CG LEU A 50 111.927 -9.619 17.544 1.00 0.00 C ATOM 705 CD1 LEU A 50 112.917 -8.474 17.311 1.00 0.00 C ATOM 706 CD2 LEU A 50 112.700 -10.869 17.998 1.00 0.00 C ATOM 0 H LEU A 50 109.647 -11.353 16.975 1.00 0.00 H new ATOM 0 HA LEU A 50 110.300 -11.204 19.151 1.00 0.00 H new ATOM 0 HB2 LEU A 50 110.455 -8.256 18.360 1.00 0.00 H new ATOM 0 HB3 LEU A 50 111.432 -9.056 19.576 1.00 0.00 H new ATOM 0 HG LEU A 50 111.391 -9.841 16.621 1.00 0.00 H new ATOM 0 HD11 LEU A 50 113.635 -8.764 16.544 1.00 0.00 H new ATOM 0 HD12 LEU A 50 112.376 -7.586 16.985 1.00 0.00 H new ATOM 0 HD13 LEU A 50 113.446 -8.256 18.239 1.00 0.00 H new ATOM 0 HD21 LEU A 50 113.414 -11.156 17.226 1.00 0.00 H new ATOM 0 HD22 LEU A 50 113.234 -10.651 18.923 1.00 0.00 H new ATOM 0 HD23 LEU A 50 112.001 -11.688 18.168 1.00 0.00 H new ATOM 718 N SER A 51 109.087 -8.788 20.550 1.00 0.00 N ATOM 719 CA SER A 51 108.155 -8.256 21.546 1.00 0.00 C ATOM 720 C SER A 51 107.931 -6.773 21.292 1.00 0.00 C ATOM 721 O SER A 51 108.782 -6.110 20.714 1.00 0.00 O ATOM 722 CB SER A 51 108.711 -8.456 22.957 1.00 0.00 C ATOM 723 OG SER A 51 107.792 -7.925 23.902 1.00 0.00 O ATOM 0 H SER A 51 109.973 -8.285 20.494 1.00 0.00 H new ATOM 0 HA SER A 51 107.208 -8.790 21.463 1.00 0.00 H new ATOM 0 HB2 SER A 51 108.876 -9.516 23.149 1.00 0.00 H new ATOM 0 HB3 SER A 51 109.677 -7.961 23.054 1.00 0.00 H new ATOM 0 HG SER A 51 108.144 -8.053 24.808 1.00 0.00 H new ATOM 729 N GLY A 52 106.780 -6.261 21.709 1.00 0.00 N ATOM 730 CA GLY A 52 106.465 -4.853 21.490 1.00 0.00 C ATOM 731 C GLY A 52 107.646 -3.959 21.858 1.00 0.00 C ATOM 732 O GLY A 52 107.977 -3.029 21.121 1.00 0.00 O ATOM 0 H GLY A 52 106.056 -6.791 22.195 1.00 0.00 H new ATOM 0 HA2 GLY A 52 106.198 -4.696 20.445 1.00 0.00 H new ATOM 0 HA3 GLY A 52 105.596 -4.575 22.086 1.00 0.00 H new ATOM 736 N GLU A 53 108.280 -4.245 22.992 1.00 0.00 N ATOM 737 CA GLU A 53 109.425 -3.455 23.435 1.00 0.00 C ATOM 738 C GLU A 53 110.560 -3.547 22.420 1.00 0.00 C ATOM 739 O GLU A 53 111.111 -2.532 21.993 1.00 0.00 O ATOM 740 CB GLU A 53 109.914 -3.968 24.793 1.00 0.00 C ATOM 741 CG GLU A 53 111.057 -3.085 25.301 1.00 0.00 C ATOM 742 CD GLU A 53 111.526 -3.577 26.666 1.00 0.00 C ATOM 743 OE1 GLU A 53 111.154 -4.679 27.035 1.00 0.00 O ATOM 744 OE2 GLU A 53 112.250 -2.845 27.321 1.00 0.00 O ATOM 0 H GLU A 53 108.024 -5.010 23.616 1.00 0.00 H new ATOM 0 HA GLU A 53 109.115 -2.414 23.526 1.00 0.00 H new ATOM 0 HB2 GLU A 53 109.093 -3.964 25.510 1.00 0.00 H new ATOM 0 HB3 GLU A 53 110.253 -5.000 24.702 1.00 0.00 H new ATOM 0 HG2 GLU A 53 111.886 -3.105 24.593 1.00 0.00 H new ATOM 0 HG3 GLU A 53 110.724 -2.050 25.373 1.00 0.00 H new ATOM 751 N TYR A 54 110.899 -4.772 22.038 1.00 0.00 N ATOM 752 CA TYR A 54 111.965 -4.996 21.068 1.00 0.00 C ATOM 753 C TYR A 54 111.550 -4.487 19.694 1.00 0.00 C ATOM 754 O TYR A 54 112.390 -4.057 18.903 1.00 0.00 O ATOM 755 CB TYR A 54 112.305 -6.494 20.993 1.00 0.00 C ATOM 756 CG TYR A 54 113.165 -6.876 22.176 1.00 0.00 C ATOM 757 CD1 TYR A 54 112.615 -6.897 23.463 1.00 0.00 C ATOM 758 CD2 TYR A 54 114.514 -7.205 21.987 1.00 0.00 C ATOM 759 CE1 TYR A 54 113.411 -7.246 24.558 1.00 0.00 C ATOM 760 CE2 TYR A 54 115.310 -7.554 23.082 1.00 0.00 C ATOM 761 CZ TYR A 54 114.759 -7.575 24.369 1.00 0.00 C ATOM 762 OH TYR A 54 115.543 -7.915 25.451 1.00 0.00 O ATOM 0 H TYR A 54 110.454 -5.623 22.383 1.00 0.00 H new ATOM 0 HA TYR A 54 112.849 -4.446 21.391 1.00 0.00 H new ATOM 0 HB2 TYR A 54 111.390 -7.086 20.989 1.00 0.00 H new ATOM 0 HB3 TYR A 54 112.830 -6.713 20.063 1.00 0.00 H new ATOM 0 HD1 TYR A 54 111.576 -6.644 23.610 1.00 0.00 H new ATOM 0 HD2 TYR A 54 114.939 -7.189 20.994 1.00 0.00 H new ATOM 0 HE1 TYR A 54 112.986 -7.262 25.551 1.00 0.00 H new ATOM 0 HE2 TYR A 54 116.350 -7.807 22.935 1.00 0.00 H new ATOM 0 HH TYR A 54 116.452 -8.116 25.146 1.00 0.00 H new ATOM 772 N LEU A 55 110.254 -4.550 19.414 1.00 0.00 N ATOM 773 CA LEU A 55 109.737 -4.104 18.127 1.00 0.00 C ATOM 774 C LEU A 55 110.045 -2.621 17.911 1.00 0.00 C ATOM 775 O LEU A 55 110.572 -2.233 16.869 1.00 0.00 O ATOM 776 CB LEU A 55 108.209 -4.352 18.076 1.00 0.00 C ATOM 777 CG LEU A 55 107.787 -4.898 16.699 1.00 0.00 C ATOM 778 CD1 LEU A 55 108.255 -3.938 15.590 1.00 0.00 C ATOM 779 CD2 LEU A 55 108.391 -6.308 16.469 1.00 0.00 C ATOM 0 H LEU A 55 109.546 -4.904 20.057 1.00 0.00 H new ATOM 0 HA LEU A 55 110.221 -4.669 17.330 1.00 0.00 H new ATOM 0 HB2 LEU A 55 107.925 -5.060 18.855 1.00 0.00 H new ATOM 0 HB3 LEU A 55 107.678 -3.422 18.281 1.00 0.00 H new ATOM 0 HG LEU A 55 106.700 -4.975 16.670 1.00 0.00 H new ATOM 0 HD11 LEU A 55 107.954 -4.330 14.619 1.00 0.00 H new ATOM 0 HD12 LEU A 55 107.803 -2.958 15.742 1.00 0.00 H new ATOM 0 HD13 LEU A 55 109.341 -3.846 15.623 1.00 0.00 H new ATOM 0 HD21 LEU A 55 108.084 -6.680 15.492 1.00 0.00 H new ATOM 0 HD22 LEU A 55 109.479 -6.249 16.509 1.00 0.00 H new ATOM 0 HD23 LEU A 55 108.036 -6.987 17.244 1.00 0.00 H new ATOM 791 N VAL A 56 109.727 -1.803 18.905 1.00 0.00 N ATOM 792 CA VAL A 56 109.982 -0.371 18.811 1.00 0.00 C ATOM 793 C VAL A 56 111.478 -0.100 18.749 1.00 0.00 C ATOM 794 O VAL A 56 111.944 0.700 17.939 1.00 0.00 O ATOM 795 CB VAL A 56 109.372 0.347 20.018 1.00 0.00 C ATOM 796 CG1 VAL A 56 109.793 1.821 20.017 1.00 0.00 C ATOM 797 CG2 VAL A 56 107.847 0.255 19.939 1.00 0.00 C ATOM 0 H VAL A 56 109.295 -2.102 19.779 1.00 0.00 H new ATOM 0 HA VAL A 56 109.521 0.006 17.898 1.00 0.00 H new ATOM 0 HB VAL A 56 109.725 -0.125 20.935 1.00 0.00 H new ATOM 0 HG11 VAL A 56 109.355 2.325 20.879 1.00 0.00 H new ATOM 0 HG12 VAL A 56 110.880 1.889 20.070 1.00 0.00 H new ATOM 0 HG13 VAL A 56 109.444 2.298 19.101 1.00 0.00 H new ATOM 0 HG21 VAL A 56 107.407 0.765 20.796 1.00 0.00 H new ATOM 0 HG22 VAL A 56 107.501 0.727 19.019 1.00 0.00 H new ATOM 0 HG23 VAL A 56 107.545 -0.792 19.945 1.00 0.00 H new ATOM 807 N ARG A 57 112.224 -0.765 19.616 1.00 0.00 N ATOM 808 CA ARG A 57 113.665 -0.578 19.655 1.00 0.00 C ATOM 809 C ARG A 57 114.293 -1.015 18.330 1.00 0.00 C ATOM 810 O ARG A 57 115.216 -0.373 17.829 1.00 0.00 O ATOM 811 CB ARG A 57 114.270 -1.381 20.811 1.00 0.00 C ATOM 812 CG ARG A 57 115.760 -1.054 20.926 1.00 0.00 C ATOM 813 CD ARG A 57 116.372 -1.833 22.091 1.00 0.00 C ATOM 814 NE ARG A 57 116.428 -3.255 21.772 1.00 0.00 N ATOM 815 CZ ARG A 57 117.430 -3.752 21.054 1.00 0.00 C ATOM 816 NH1 ARG A 57 118.364 -2.956 20.609 1.00 0.00 N ATOM 817 NH2 ARG A 57 117.480 -5.028 20.790 1.00 0.00 N ATOM 0 H ARG A 57 111.860 -1.433 20.296 1.00 0.00 H new ATOM 0 HA ARG A 57 113.875 0.480 19.811 1.00 0.00 H new ATOM 0 HB2 ARG A 57 113.760 -1.140 21.743 1.00 0.00 H new ATOM 0 HB3 ARG A 57 114.132 -2.449 20.639 1.00 0.00 H new ATOM 0 HG2 ARG A 57 116.271 -1.309 19.997 1.00 0.00 H new ATOM 0 HG3 ARG A 57 115.896 0.016 21.081 1.00 0.00 H new ATOM 0 HD2 ARG A 57 117.375 -1.460 22.301 1.00 0.00 H new ATOM 0 HD3 ARG A 57 115.779 -1.678 22.993 1.00 0.00 H new ATOM 0 HE ARG A 57 115.690 -3.875 22.104 1.00 0.00 H new ATOM 0 HH11 ARG A 57 118.323 -1.957 20.813 1.00 0.00 H new ATOM 0 HH12 ARG A 57 119.135 -3.333 20.058 1.00 0.00 H new ATOM 0 HH21 ARG A 57 116.748 -5.649 21.135 1.00 0.00 H new ATOM 0 HH22 ARG A 57 118.251 -5.405 20.239 1.00 0.00 H new ATOM 831 N LEU A 58 113.795 -2.119 17.773 1.00 0.00 N ATOM 832 CA LEU A 58 114.325 -2.641 16.514 1.00 0.00 C ATOM 833 C LEU A 58 114.152 -1.637 15.380 1.00 0.00 C ATOM 834 O LEU A 58 115.088 -1.384 14.619 1.00 0.00 O ATOM 835 CB LEU A 58 113.602 -3.948 16.161 1.00 0.00 C ATOM 836 CG LEU A 58 114.167 -4.540 14.853 1.00 0.00 C ATOM 837 CD1 LEU A 58 113.818 -6.033 14.791 1.00 0.00 C ATOM 838 CD2 LEU A 58 113.581 -3.815 13.608 1.00 0.00 C ATOM 0 H LEU A 58 113.031 -2.666 18.170 1.00 0.00 H new ATOM 0 HA LEU A 58 115.392 -2.826 16.641 1.00 0.00 H new ATOM 0 HB2 LEU A 58 113.719 -4.666 16.973 1.00 0.00 H new ATOM 0 HB3 LEU A 58 112.534 -3.762 16.051 1.00 0.00 H new ATOM 0 HG LEU A 58 115.248 -4.403 14.845 1.00 0.00 H new ATOM 0 HD11 LEU A 58 114.213 -6.461 13.870 1.00 0.00 H new ATOM 0 HD12 LEU A 58 114.258 -6.545 15.647 1.00 0.00 H new ATOM 0 HD13 LEU A 58 112.735 -6.155 14.812 1.00 0.00 H new ATOM 0 HD21 LEU A 58 113.998 -4.254 12.702 1.00 0.00 H new ATOM 0 HD22 LEU A 58 112.497 -3.926 13.599 1.00 0.00 H new ATOM 0 HD23 LEU A 58 113.837 -2.756 13.649 1.00 0.00 H new ATOM 850 N TYR A 59 112.968 -1.053 15.272 1.00 0.00 N ATOM 851 CA TYR A 59 112.721 -0.070 14.224 1.00 0.00 C ATOM 852 C TYR A 59 113.526 1.195 14.487 1.00 0.00 C ATOM 853 O TYR A 59 113.962 1.871 13.553 1.00 0.00 O ATOM 854 CB TYR A 59 111.216 0.261 14.140 1.00 0.00 C ATOM 855 CG TYR A 59 110.527 -0.673 13.170 1.00 0.00 C ATOM 856 CD1 TYR A 59 110.172 -1.966 13.565 1.00 0.00 C ATOM 857 CD2 TYR A 59 110.249 -0.241 11.868 1.00 0.00 C ATOM 858 CE1 TYR A 59 109.536 -2.826 12.661 1.00 0.00 C ATOM 859 CE2 TYR A 59 109.616 -1.098 10.966 1.00 0.00 C ATOM 860 CZ TYR A 59 109.258 -2.392 11.360 1.00 0.00 C ATOM 861 OH TYR A 59 108.634 -3.239 10.468 1.00 0.00 O ATOM 0 H TYR A 59 112.174 -1.237 15.885 1.00 0.00 H new ATOM 0 HA TYR A 59 113.037 -0.493 13.270 1.00 0.00 H new ATOM 0 HB2 TYR A 59 110.761 0.172 15.127 1.00 0.00 H new ATOM 0 HB3 TYR A 59 111.081 1.294 13.819 1.00 0.00 H new ATOM 0 HD1 TYR A 59 110.388 -2.302 14.568 1.00 0.00 H new ATOM 0 HD2 TYR A 59 110.525 0.757 11.561 1.00 0.00 H new ATOM 0 HE1 TYR A 59 109.260 -3.824 12.968 1.00 0.00 H new ATOM 0 HE2 TYR A 59 109.402 -0.762 9.962 1.00 0.00 H new ATOM 0 HH TYR A 59 109.305 -3.650 9.883 1.00 0.00 H new ATOM 871 N LEU A 60 113.707 1.520 15.757 1.00 0.00 N ATOM 872 CA LEU A 60 114.438 2.719 16.118 1.00 0.00 C ATOM 873 C LEU A 60 115.866 2.629 15.602 1.00 0.00 C ATOM 874 O LEU A 60 116.392 3.590 15.051 1.00 0.00 O ATOM 875 CB LEU A 60 114.435 2.897 17.642 1.00 0.00 C ATOM 876 CG LEU A 60 114.948 4.302 18.015 1.00 0.00 C ATOM 877 CD1 LEU A 60 113.819 5.335 17.877 1.00 0.00 C ATOM 878 CD2 LEU A 60 115.446 4.299 19.463 1.00 0.00 C ATOM 0 H LEU A 60 113.361 0.975 16.547 1.00 0.00 H new ATOM 0 HA LEU A 60 113.953 3.583 15.664 1.00 0.00 H new ATOM 0 HB2 LEU A 60 113.426 2.755 18.030 1.00 0.00 H new ATOM 0 HB3 LEU A 60 115.064 2.137 18.105 1.00 0.00 H new ATOM 0 HG LEU A 60 115.763 4.567 17.341 1.00 0.00 H new ATOM 0 HD11 LEU A 60 114.195 6.323 18.143 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.462 5.348 16.847 1.00 0.00 H new ATOM 0 HD13 LEU A 60 112.998 5.068 18.542 1.00 0.00 H new ATOM 0 HD21 LEU A 60 115.808 5.293 19.725 1.00 0.00 H new ATOM 0 HD22 LEU A 60 114.628 4.024 20.129 1.00 0.00 H new ATOM 0 HD23 LEU A 60 116.257 3.578 19.567 1.00 0.00 H new ATOM 890 N VAL A 61 116.478 1.462 15.767 1.00 0.00 N ATOM 891 CA VAL A 61 117.844 1.245 15.299 1.00 0.00 C ATOM 892 C VAL A 61 117.910 1.317 13.768 1.00 0.00 C ATOM 893 O VAL A 61 118.841 1.895 13.195 1.00 0.00 O ATOM 894 CB VAL A 61 118.337 -0.120 15.786 1.00 0.00 C ATOM 895 CG1 VAL A 61 119.668 -0.468 15.108 1.00 0.00 C ATOM 896 CG2 VAL A 61 118.543 -0.064 17.302 1.00 0.00 C ATOM 0 H VAL A 61 116.053 0.653 16.220 1.00 0.00 H new ATOM 0 HA VAL A 61 118.486 2.028 15.703 1.00 0.00 H new ATOM 0 HB VAL A 61 117.598 -0.882 15.536 1.00 0.00 H new ATOM 0 HG11 VAL A 61 120.012 -1.441 15.460 1.00 0.00 H new ATOM 0 HG12 VAL A 61 119.528 -0.502 14.028 1.00 0.00 H new ATOM 0 HG13 VAL A 61 120.411 0.291 15.354 1.00 0.00 H new ATOM 0 HG21 VAL A 61 118.894 -1.033 17.657 1.00 0.00 H new ATOM 0 HG22 VAL A 61 119.283 0.700 17.541 1.00 0.00 H new ATOM 0 HG23 VAL A 61 117.599 0.180 17.789 1.00 0.00 H new ATOM 906 N ASP A 62 116.923 0.712 13.114 1.00 0.00 N ATOM 907 CA ASP A 62 116.877 0.694 11.655 1.00 0.00 C ATOM 908 C ASP A 62 116.903 2.113 11.097 1.00 0.00 C ATOM 909 O ASP A 62 117.459 2.356 10.027 1.00 0.00 O ATOM 910 CB ASP A 62 115.608 -0.015 11.179 1.00 0.00 C ATOM 911 CG ASP A 62 115.729 -0.371 9.700 1.00 0.00 C ATOM 912 OD1 ASP A 62 116.840 -0.614 9.257 1.00 0.00 O ATOM 913 OD2 ASP A 62 114.709 -0.399 9.034 1.00 0.00 O ATOM 0 H ASP A 62 116.147 0.230 13.568 1.00 0.00 H new ATOM 0 HA ASP A 62 117.753 0.156 11.293 1.00 0.00 H new ATOM 0 HB2 ASP A 62 115.445 -0.919 11.766 1.00 0.00 H new ATOM 0 HB3 ASP A 62 114.742 0.628 11.337 1.00 0.00 H new ATOM 918 N LEU A 63 116.301 3.048 11.824 1.00 0.00 N ATOM 919 CA LEU A 63 116.275 4.436 11.375 1.00 0.00 C ATOM 920 C LEU A 63 117.694 4.984 11.257 1.00 0.00 C ATOM 921 O LEU A 63 118.009 5.699 10.310 1.00 0.00 O ATOM 922 CB LEU A 63 115.478 5.303 12.354 1.00 0.00 C ATOM 923 CG LEU A 63 113.986 4.961 12.270 1.00 0.00 C ATOM 924 CD1 LEU A 63 113.248 5.691 13.396 1.00 0.00 C ATOM 925 CD2 LEU A 63 113.410 5.388 10.902 1.00 0.00 C ATOM 0 H LEU A 63 115.831 2.875 12.713 1.00 0.00 H new ATOM 0 HA LEU A 63 115.794 4.465 10.397 1.00 0.00 H new ATOM 0 HB2 LEU A 63 115.839 5.143 13.370 1.00 0.00 H new ATOM 0 HB3 LEU A 63 115.630 6.358 12.124 1.00 0.00 H new ATOM 0 HG LEU A 63 113.855 3.884 12.376 1.00 0.00 H new ATOM 0 HD11 LEU A 63 112.185 5.456 13.347 1.00 0.00 H new ATOM 0 HD12 LEU A 63 113.646 5.371 14.359 1.00 0.00 H new ATOM 0 HD13 LEU A 63 113.387 6.766 13.285 1.00 0.00 H new ATOM 0 HD21 LEU A 63 112.350 5.138 10.859 1.00 0.00 H new ATOM 0 HD22 LEU A 63 113.534 6.463 10.774 1.00 0.00 H new ATOM 0 HD23 LEU A 63 113.939 4.865 10.105 1.00 0.00 H new ATOM 937 N ILE A 64 118.549 4.640 12.214 1.00 0.00 N ATOM 938 CA ILE A 64 119.931 5.112 12.188 1.00 0.00 C ATOM 939 C ILE A 64 120.632 4.575 10.944 1.00 0.00 C ATOM 940 O ILE A 64 121.359 5.303 10.265 1.00 0.00 O ATOM 941 CB ILE A 64 120.667 4.654 13.467 1.00 0.00 C ATOM 942 CG1 ILE A 64 120.295 5.576 14.637 1.00 0.00 C ATOM 943 CG2 ILE A 64 122.190 4.702 13.261 1.00 0.00 C ATOM 944 CD1 ILE A 64 118.815 5.408 14.975 1.00 0.00 C ATOM 0 H ILE A 64 118.315 4.044 13.008 1.00 0.00 H new ATOM 0 HA ILE A 64 119.943 6.201 12.154 1.00 0.00 H new ATOM 0 HB ILE A 64 120.367 3.630 13.687 1.00 0.00 H new ATOM 0 HG12 ILE A 64 120.906 5.339 15.508 1.00 0.00 H new ATOM 0 HG13 ILE A 64 120.503 6.614 14.375 1.00 0.00 H new ATOM 0 HG21 ILE A 64 122.691 4.376 14.173 1.00 0.00 H new ATOM 0 HG22 ILE A 64 122.467 4.042 12.439 1.00 0.00 H new ATOM 0 HG23 ILE A 64 122.493 5.722 13.025 1.00 0.00 H new ATOM 0 HD11 ILE A 64 118.555 6.064 15.806 1.00 0.00 H new ATOM 0 HD12 ILE A 64 118.211 5.667 14.105 1.00 0.00 H new ATOM 0 HD13 ILE A 64 118.621 4.373 15.256 1.00 0.00 H new ATOM 956 N LEU A 65 120.423 3.296 10.662 1.00 0.00 N ATOM 957 CA LEU A 65 121.055 2.671 9.505 1.00 0.00 C ATOM 958 C LEU A 65 120.601 3.341 8.209 1.00 0.00 C ATOM 959 O LEU A 65 121.408 3.608 7.320 1.00 0.00 O ATOM 960 CB LEU A 65 120.681 1.190 9.450 1.00 0.00 C ATOM 961 CG LEU A 65 120.916 0.549 10.816 1.00 0.00 C ATOM 962 CD1 LEU A 65 120.575 -0.940 10.733 1.00 0.00 C ATOM 963 CD2 LEU A 65 122.381 0.730 11.234 1.00 0.00 C ATOM 0 H LEU A 65 119.828 2.676 11.211 1.00 0.00 H new ATOM 0 HA LEU A 65 122.134 2.784 9.606 1.00 0.00 H new ATOM 0 HB2 LEU A 65 119.636 1.079 9.161 1.00 0.00 H new ATOM 0 HB3 LEU A 65 121.277 0.682 8.692 1.00 0.00 H new ATOM 0 HG LEU A 65 120.280 1.028 11.560 1.00 0.00 H new ATOM 0 HD11 LEU A 65 120.740 -1.406 11.705 1.00 0.00 H new ATOM 0 HD12 LEU A 65 119.530 -1.059 10.447 1.00 0.00 H new ATOM 0 HD13 LEU A 65 121.212 -1.418 9.989 1.00 0.00 H new ATOM 0 HD21 LEU A 65 122.541 0.270 12.209 1.00 0.00 H new ATOM 0 HD22 LEU A 65 123.031 0.255 10.498 1.00 0.00 H new ATOM 0 HD23 LEU A 65 122.614 1.793 11.292 1.00 0.00 H new ATOM 975 N VAL A 66 119.307 3.614 8.108 1.00 0.00 N ATOM 976 CA VAL A 66 118.765 4.253 6.912 1.00 0.00 C ATOM 977 C VAL A 66 119.291 5.675 6.772 1.00 0.00 C ATOM 978 O VAL A 66 119.616 6.126 5.667 1.00 0.00 O ATOM 979 CB VAL A 66 117.236 4.278 6.967 1.00 0.00 C ATOM 980 CG1 VAL A 66 116.690 5.017 5.741 1.00 0.00 C ATOM 981 CG2 VAL A 66 116.704 2.840 6.980 1.00 0.00 C ATOM 0 H VAL A 66 118.618 3.406 8.831 1.00 0.00 H new ATOM 0 HA VAL A 66 119.085 3.672 6.047 1.00 0.00 H new ATOM 0 HB VAL A 66 116.913 4.794 7.871 1.00 0.00 H new ATOM 0 HG11 VAL A 66 115.601 5.034 5.782 1.00 0.00 H new ATOM 0 HG12 VAL A 66 117.069 6.039 5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 66 117.011 4.504 4.834 1.00 0.00 H new ATOM 0 HG21 VAL A 66 115.615 2.855 7.019 1.00 0.00 H new ATOM 0 HG22 VAL A 66 117.027 2.324 6.076 1.00 0.00 H new ATOM 0 HG23 VAL A 66 117.091 2.317 7.854 1.00 0.00 H new ATOM 991 N ILE A 67 119.353 6.388 7.893 1.00 0.00 N ATOM 992 CA ILE A 67 119.814 7.769 7.877 1.00 0.00 C ATOM 993 C ILE A 67 121.225 7.868 7.306 1.00 0.00 C ATOM 994 O ILE A 67 121.496 8.701 6.440 1.00 0.00 O ATOM 995 CB ILE A 67 119.781 8.346 9.305 1.00 0.00 C ATOM 996 CG1 ILE A 67 118.329 8.643 9.706 1.00 0.00 C ATOM 997 CG2 ILE A 67 120.592 9.648 9.372 1.00 0.00 C ATOM 998 CD1 ILE A 67 118.242 8.854 11.222 1.00 0.00 C ATOM 0 H ILE A 67 119.092 6.035 8.814 1.00 0.00 H new ATOM 0 HA ILE A 67 119.147 8.347 7.237 1.00 0.00 H new ATOM 0 HB ILE A 67 120.215 7.615 9.987 1.00 0.00 H new ATOM 0 HG12 ILE A 67 117.973 9.532 9.185 1.00 0.00 H new ATOM 0 HG13 ILE A 67 117.683 7.817 9.407 1.00 0.00 H new ATOM 0 HG21 ILE A 67 120.560 10.045 10.387 1.00 0.00 H new ATOM 0 HG22 ILE A 67 121.626 9.447 9.093 1.00 0.00 H new ATOM 0 HG23 ILE A 67 120.166 10.378 8.684 1.00 0.00 H new ATOM 0 HD11 ILE A 67 117.210 9.064 11.501 1.00 0.00 H new ATOM 0 HD12 ILE A 67 118.580 7.954 11.735 1.00 0.00 H new ATOM 0 HD13 ILE A 67 118.874 9.694 11.509 1.00 0.00 H new ATOM 1010 N ILE A 68 122.118 7.021 7.785 1.00 0.00 N ATOM 1011 CA ILE A 68 123.495 7.044 7.314 1.00 0.00 C ATOM 1012 C ILE A 68 123.593 6.600 5.852 1.00 0.00 C ATOM 1013 O ILE A 68 124.496 7.020 5.118 1.00 0.00 O ATOM 1014 CB ILE A 68 124.347 6.136 8.199 1.00 0.00 C ATOM 1015 CG1 ILE A 68 124.383 6.717 9.616 1.00 0.00 C ATOM 1016 CG2 ILE A 68 125.767 6.060 7.637 1.00 0.00 C ATOM 1017 CD1 ILE A 68 125.027 5.712 10.574 1.00 0.00 C ATOM 0 H ILE A 68 121.920 6.314 8.493 1.00 0.00 H new ATOM 0 HA ILE A 68 123.864 8.068 7.373 1.00 0.00 H new ATOM 0 HB ILE A 68 123.919 5.134 8.223 1.00 0.00 H new ATOM 0 HG12 ILE A 68 124.946 7.650 9.622 1.00 0.00 H new ATOM 0 HG13 ILE A 68 123.372 6.953 9.948 1.00 0.00 H new ATOM 0 HG21 ILE A 68 126.374 5.412 8.269 1.00 0.00 H new ATOM 0 HG22 ILE A 68 125.737 5.655 6.625 1.00 0.00 H new ATOM 0 HG23 ILE A 68 126.204 7.058 7.615 1.00 0.00 H new ATOM 0 HD11 ILE A 68 125.050 6.131 11.580 1.00 0.00 H new ATOM 0 HD12 ILE A 68 124.446 4.790 10.578 1.00 0.00 H new ATOM 0 HD13 ILE A 68 126.045 5.498 10.247 1.00 0.00 H new ATOM 1029 N LEU A 69 122.675 5.736 5.438 1.00 0.00 N ATOM 1030 CA LEU A 69 122.682 5.224 4.071 1.00 0.00 C ATOM 1031 C LEU A 69 122.484 6.341 3.040 1.00 0.00 C ATOM 1032 O LEU A 69 123.401 6.672 2.272 1.00 0.00 O ATOM 1033 CB LEU A 69 121.538 4.188 3.919 1.00 0.00 C ATOM 1034 CG LEU A 69 122.084 2.755 3.854 1.00 0.00 C ATOM 1035 CD1 LEU A 69 120.953 1.772 4.164 1.00 0.00 C ATOM 1036 CD2 LEU A 69 122.623 2.472 2.446 1.00 0.00 C ATOM 0 H LEU A 69 121.921 5.376 6.023 1.00 0.00 H new ATOM 0 HA LEU A 69 123.653 4.765 3.886 1.00 0.00 H new ATOM 0 HB2 LEU A 69 120.849 4.279 4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 69 120.968 4.403 3.015 1.00 0.00 H new ATOM 0 HG LEU A 69 122.888 2.640 4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 69 121.335 0.752 4.119 1.00 0.00 H new ATOM 0 HD12 LEU A 69 120.562 1.970 5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 69 120.155 1.893 3.432 1.00 0.00 H new ATOM 0 HD21 LEU A 69 123.010 1.454 2.402 1.00 0.00 H new ATOM 0 HD22 LEU A 69 121.819 2.586 1.719 1.00 0.00 H new ATOM 0 HD23 LEU A 69 123.423 3.175 2.215 1.00 0.00 H new ATOM 1048 N TRP A 70 121.282 6.910 3.005 1.00 0.00 N ATOM 1049 CA TRP A 70 121.012 7.946 2.028 1.00 0.00 C ATOM 1050 C TRP A 70 121.897 9.152 2.280 1.00 0.00 C ATOM 1051 O TRP A 70 122.171 9.924 1.365 1.00 0.00 O ATOM 1052 CB TRP A 70 119.541 8.358 2.019 1.00 0.00 C ATOM 1053 CG TRP A 70 119.181 8.980 3.317 1.00 0.00 C ATOM 1054 CD1 TRP A 70 118.505 8.362 4.305 1.00 0.00 C ATOM 1055 CD2 TRP A 70 119.467 10.326 3.787 1.00 0.00 C ATOM 1056 NE1 TRP A 70 118.350 9.244 5.352 1.00 0.00 N ATOM 1057 CE2 TRP A 70 118.940 10.467 5.087 1.00 0.00 C ATOM 1058 CE3 TRP A 70 120.134 11.427 3.218 1.00 0.00 C ATOM 1059 CZ2 TRP A 70 119.065 11.659 5.801 1.00 0.00 C ATOM 1060 CZ3 TRP A 70 120.264 12.627 3.933 1.00 0.00 C ATOM 1061 CH2 TRP A 70 119.736 12.742 5.223 1.00 0.00 C ATOM 0 H TRP A 70 120.505 6.677 3.623 1.00 0.00 H new ATOM 0 HA TRP A 70 121.240 7.534 1.045 1.00 0.00 H new ATOM 0 HB2 TRP A 70 119.356 9.060 1.206 1.00 0.00 H new ATOM 0 HB3 TRP A 70 118.912 7.487 1.837 1.00 0.00 H new ATOM 0 HD1 TRP A 70 118.144 7.344 4.280 1.00 0.00 H new ATOM 0 HE1 TRP A 70 117.859 9.022 6.218 1.00 0.00 H new ATOM 0 HE3 TRP A 70 120.549 11.348 2.224 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 118.647 11.745 6.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 120.775 13.467 3.485 1.00 0.00 H new ATOM 0 HH2 TRP A 70 119.846 13.665 5.772 1.00 0.00 H new ATOM 1072 N ALA A 71 122.350 9.310 3.522 1.00 0.00 N ATOM 1073 CA ALA A 71 123.213 10.430 3.857 1.00 0.00 C ATOM 1074 C ALA A 71 124.392 10.484 2.898 1.00 0.00 C ATOM 1075 O ALA A 71 124.678 11.530 2.315 1.00 0.00 O ATOM 1076 CB ALA A 71 123.743 10.276 5.285 1.00 0.00 C ATOM 0 H ALA A 71 122.136 8.685 4.299 1.00 0.00 H new ATOM 0 HA ALA A 71 122.633 11.349 3.778 1.00 0.00 H new ATOM 0 HB1 ALA A 71 124.389 11.120 5.526 1.00 0.00 H new ATOM 0 HB2 ALA A 71 122.906 10.248 5.983 1.00 0.00 H new ATOM 0 HB3 ALA A 71 124.312 9.350 5.364 1.00 0.00 H new ATOM 1082 N ASP A 72 125.078 9.354 2.733 1.00 0.00 N ATOM 1083 CA ASP A 72 126.227 9.318 1.835 1.00 0.00 C ATOM 1084 C ASP A 72 125.792 9.534 0.389 1.00 0.00 C ATOM 1085 O ASP A 72 126.439 10.265 -0.364 1.00 0.00 O ATOM 1086 CB ASP A 72 126.960 7.988 1.972 1.00 0.00 C ATOM 1087 CG ASP A 72 127.572 7.887 3.364 1.00 0.00 C ATOM 1088 OD1 ASP A 72 128.679 8.370 3.540 1.00 0.00 O ATOM 1089 OD2 ASP A 72 126.925 7.330 4.235 1.00 0.00 O ATOM 0 H ASP A 72 124.864 8.472 3.198 1.00 0.00 H new ATOM 0 HA ASP A 72 126.904 10.126 2.112 1.00 0.00 H new ATOM 0 HB2 ASP A 72 126.270 7.161 1.806 1.00 0.00 H new ATOM 0 HB3 ASP A 72 127.739 7.910 1.214 1.00 0.00 H new ATOM 1094 N TYR A 73 124.690 8.897 0.011 1.00 0.00 N ATOM 1095 CA TYR A 73 124.170 9.028 -1.349 1.00 0.00 C ATOM 1096 C TYR A 73 123.804 10.479 -1.654 1.00 0.00 C ATOM 1097 O TYR A 73 124.093 10.985 -2.738 1.00 0.00 O ATOM 1098 CB TYR A 73 122.930 8.151 -1.508 1.00 0.00 C ATOM 1099 CG TYR A 73 122.272 8.407 -2.842 1.00 0.00 C ATOM 1100 CD1 TYR A 73 121.371 9.469 -2.968 1.00 0.00 C ATOM 1101 CD2 TYR A 73 122.550 7.591 -3.943 1.00 0.00 C ATOM 1102 CE1 TYR A 73 120.748 9.720 -4.193 1.00 0.00 C ATOM 1103 CE2 TYR A 73 121.926 7.841 -5.171 1.00 0.00 C ATOM 1104 CZ TYR A 73 121.025 8.907 -5.295 1.00 0.00 C ATOM 1105 OH TYR A 73 120.406 9.156 -6.502 1.00 0.00 O ATOM 0 H TYR A 73 124.142 8.289 0.619 1.00 0.00 H new ATOM 0 HA TYR A 73 124.945 8.709 -2.046 1.00 0.00 H new ATOM 0 HB2 TYR A 73 123.207 7.100 -1.428 1.00 0.00 H new ATOM 0 HB3 TYR A 73 122.225 8.357 -0.702 1.00 0.00 H new ATOM 0 HD1 TYR A 73 121.156 10.097 -2.116 1.00 0.00 H new ATOM 0 HD2 TYR A 73 123.245 6.770 -3.846 1.00 0.00 H new ATOM 0 HE1 TYR A 73 120.053 10.541 -4.288 1.00 0.00 H new ATOM 0 HE2 TYR A 73 122.139 7.212 -6.023 1.00 0.00 H new ATOM 0 HH TYR A 73 120.097 8.311 -6.892 1.00 0.00 H new ATOM 1115 N ALA A 74 123.146 11.133 -0.704 1.00 0.00 N ATOM 1116 CA ALA A 74 122.723 12.513 -0.895 1.00 0.00 C ATOM 1117 C ALA A 74 123.921 13.407 -1.168 1.00 0.00 C ATOM 1118 O ALA A 74 123.866 14.271 -2.037 1.00 0.00 O ATOM 1119 CB ALA A 74 121.978 13.012 0.349 1.00 0.00 C ATOM 0 H ALA A 74 122.896 10.732 0.200 1.00 0.00 H new ATOM 0 HA ALA A 74 122.054 12.551 -1.755 1.00 0.00 H new ATOM 0 HB1 ALA A 74 121.666 14.045 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 74 121.100 12.389 0.522 1.00 0.00 H new ATOM 0 HB3 ALA A 74 122.638 12.957 1.215 1.00 0.00 H new ATOM 1125 N TYR A 75 125.003 13.195 -0.431 1.00 0.00 N ATOM 1126 CA TYR A 75 126.193 14.009 -0.626 1.00 0.00 C ATOM 1127 C TYR A 75 126.674 13.898 -2.068 1.00 0.00 C ATOM 1128 O TYR A 75 126.902 14.907 -2.734 1.00 0.00 O ATOM 1129 CB TYR A 75 127.306 13.544 0.342 1.00 0.00 C ATOM 1130 CG TYR A 75 127.325 14.414 1.580 1.00 0.00 C ATOM 1131 CD1 TYR A 75 127.686 15.759 1.465 1.00 0.00 C ATOM 1132 CD2 TYR A 75 126.989 13.881 2.832 1.00 0.00 C ATOM 1133 CE1 TYR A 75 127.716 16.577 2.596 1.00 0.00 C ATOM 1134 CE2 TYR A 75 127.016 14.701 3.967 1.00 0.00 C ATOM 1135 CZ TYR A 75 127.380 16.050 3.850 1.00 0.00 C ATOM 1136 OH TYR A 75 127.410 16.856 4.968 1.00 0.00 O ATOM 0 H TYR A 75 125.081 12.481 0.293 1.00 0.00 H new ATOM 0 HA TYR A 75 125.950 15.051 -0.418 1.00 0.00 H new ATOM 0 HB2 TYR A 75 127.141 12.504 0.623 1.00 0.00 H new ATOM 0 HB3 TYR A 75 128.274 13.590 -0.157 1.00 0.00 H new ATOM 0 HD1 TYR A 75 127.943 16.167 0.498 1.00 0.00 H new ATOM 0 HD2 TYR A 75 126.710 12.841 2.921 1.00 0.00 H new ATOM 0 HE1 TYR A 75 127.998 17.615 2.504 1.00 0.00 H new ATOM 0 HE2 TYR A 75 126.756 14.294 4.933 1.00 0.00 H new ATOM 0 HH TYR A 75 127.149 16.334 5.755 1.00 0.00 H new ATOM 1146 N ARG A 76 126.826 12.670 -2.546 1.00 0.00 N ATOM 1147 CA ARG A 76 127.289 12.452 -3.909 1.00 0.00 C ATOM 1148 C ARG A 76 126.265 12.958 -4.923 1.00 0.00 C ATOM 1149 O ARG A 76 126.617 13.628 -5.893 1.00 0.00 O ATOM 1150 CB ARG A 76 127.544 10.961 -4.140 1.00 0.00 C ATOM 1151 CG ARG A 76 128.403 10.758 -5.403 1.00 0.00 C ATOM 1152 CD ARG A 76 129.892 10.851 -5.045 1.00 0.00 C ATOM 1153 NE ARG A 76 130.710 10.662 -6.236 1.00 0.00 N ATOM 1154 CZ ARG A 76 131.979 10.276 -6.143 1.00 0.00 C ATOM 1155 NH1 ARG A 76 132.507 10.054 -4.971 1.00 0.00 N ATOM 1156 NH2 ARG A 76 132.695 10.116 -7.222 1.00 0.00 N ATOM 0 H ARG A 76 126.638 11.819 -2.017 1.00 0.00 H new ATOM 0 HA ARG A 76 128.216 13.009 -4.046 1.00 0.00 H new ATOM 0 HB2 ARG A 76 128.050 10.533 -3.275 1.00 0.00 H new ATOM 0 HB3 ARG A 76 126.596 10.435 -4.248 1.00 0.00 H new ATOM 0 HG2 ARG A 76 128.187 9.786 -5.847 1.00 0.00 H new ATOM 0 HG3 ARG A 76 128.152 11.512 -6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 76 130.106 11.822 -4.599 1.00 0.00 H new ATOM 0 HD3 ARG A 76 130.142 10.096 -4.300 1.00 0.00 H new ATOM 0 HE ARG A 76 130.302 10.829 -7.156 1.00 0.00 H new ATOM 0 HH11 ARG A 76 131.947 10.177 -4.128 1.00 0.00 H new ATOM 0 HH12 ARG A 76 133.480 9.758 -4.898 1.00 0.00 H new ATOM 0 HH21 ARG A 76 132.281 10.287 -8.139 1.00 0.00 H new ATOM 0 HH22 ARG A 76 133.668 9.820 -7.149 1.00 0.00 H new ATOM 1170 N ALA A 77 124.999 12.624 -4.697 1.00 0.00 N ATOM 1171 CA ALA A 77 123.936 13.042 -5.604 1.00 0.00 C ATOM 1172 C ALA A 77 123.830 14.558 -5.655 1.00 0.00 C ATOM 1173 O ALA A 77 123.776 15.154 -6.732 1.00 0.00 O ATOM 1174 CB ALA A 77 122.600 12.464 -5.137 1.00 0.00 C ATOM 0 H ALA A 77 124.685 12.070 -3.900 1.00 0.00 H new ATOM 0 HA ALA A 77 124.176 12.671 -6.601 1.00 0.00 H new ATOM 0 HB1 ALA A 77 121.809 12.779 -5.818 1.00 0.00 H new ATOM 0 HB2 ALA A 77 122.658 11.376 -5.127 1.00 0.00 H new ATOM 0 HB3 ALA A 77 122.379 12.825 -4.132 1.00 0.00 H new ATOM 1180 N TYR A 78 123.792 15.176 -4.482 1.00 0.00 N ATOM 1181 CA TYR A 78 123.678 16.623 -4.396 1.00 0.00 C ATOM 1182 C TYR A 78 124.918 17.289 -4.979 1.00 0.00 C ATOM 1183 O TYR A 78 124.886 18.459 -5.360 1.00 0.00 O ATOM 1184 CB TYR A 78 123.496 17.047 -2.935 1.00 0.00 C ATOM 1185 CG TYR A 78 122.851 18.410 -2.878 1.00 0.00 C ATOM 1186 CD1 TYR A 78 123.634 19.567 -2.956 1.00 0.00 C ATOM 1187 CD2 TYR A 78 121.463 18.507 -2.752 1.00 0.00 C ATOM 1188 CE1 TYR A 78 123.022 20.826 -2.907 1.00 0.00 C ATOM 1189 CE2 TYR A 78 120.851 19.764 -2.702 1.00 0.00 C ATOM 1190 CZ TYR A 78 121.630 20.925 -2.778 1.00 0.00 C ATOM 1191 OH TYR A 78 121.027 22.165 -2.730 1.00 0.00 O ATOM 0 H TYR A 78 123.838 14.699 -3.581 1.00 0.00 H new ATOM 0 HA TYR A 78 122.808 16.939 -4.972 1.00 0.00 H new ATOM 0 HB2 TYR A 78 122.878 16.319 -2.409 1.00 0.00 H new ATOM 0 HB3 TYR A 78 124.462 17.069 -2.430 1.00 0.00 H new ATOM 0 HD1 TYR A 78 124.707 19.490 -3.054 1.00 0.00 H new ATOM 0 HD2 TYR A 78 120.862 17.611 -2.693 1.00 0.00 H new ATOM 0 HE1 TYR A 78 123.623 21.721 -2.969 1.00 0.00 H new ATOM 0 HE2 TYR A 78 119.778 19.839 -2.605 1.00 0.00 H new ATOM 0 HH TYR A 78 120.057 22.054 -2.640 1.00 0.00 H new ATOM 1201 N LYS A 79 126.009 16.535 -5.042 1.00 0.00 N ATOM 1202 CA LYS A 79 127.253 17.065 -5.575 1.00 0.00 C ATOM 1203 C LYS A 79 127.047 17.503 -7.025 1.00 0.00 C ATOM 1204 O LYS A 79 127.586 18.521 -7.458 1.00 0.00 O ATOM 1205 CB LYS A 79 128.359 15.996 -5.497 1.00 0.00 C ATOM 1206 CG LYS A 79 129.750 16.665 -5.525 1.00 0.00 C ATOM 1207 CD LYS A 79 130.191 17.029 -4.097 1.00 0.00 C ATOM 1208 CE LYS A 79 131.454 17.891 -4.157 1.00 0.00 C ATOM 1209 NZ LYS A 79 132.550 17.131 -4.824 1.00 0.00 N ATOM 0 H LYS A 79 126.056 15.564 -4.733 1.00 0.00 H new ATOM 0 HA LYS A 79 127.557 17.927 -4.982 1.00 0.00 H new ATOM 0 HB2 LYS A 79 128.247 15.412 -4.584 1.00 0.00 H new ATOM 0 HB3 LYS A 79 128.264 15.302 -6.332 1.00 0.00 H new ATOM 0 HG2 LYS A 79 130.477 15.991 -5.978 1.00 0.00 H new ATOM 0 HG3 LYS A 79 129.718 17.562 -6.144 1.00 0.00 H new ATOM 0 HD2 LYS A 79 129.394 17.568 -3.585 1.00 0.00 H new ATOM 0 HD3 LYS A 79 130.383 16.123 -3.522 1.00 0.00 H new ATOM 0 HE2 LYS A 79 131.252 18.812 -4.704 1.00 0.00 H new ATOM 0 HE3 LYS A 79 131.758 18.178 -3.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 133.461 17.592 -4.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 132.569 16.157 -4.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 132.385 17.113 -5.851 1.00 0.00 H new ATOM 1223 N SER A 80 126.257 16.729 -7.768 1.00 0.00 N ATOM 1224 CA SER A 80 125.981 17.051 -9.163 1.00 0.00 C ATOM 1225 C SER A 80 125.240 18.381 -9.271 1.00 0.00 C ATOM 1226 O SER A 80 125.500 19.177 -10.175 1.00 0.00 O ATOM 1227 CB SER A 80 125.150 15.940 -9.805 1.00 0.00 C ATOM 1228 OG SER A 80 125.220 16.060 -11.221 1.00 0.00 O ATOM 0 H SER A 80 125.801 15.882 -7.429 1.00 0.00 H new ATOM 0 HA SER A 80 126.931 17.137 -9.690 1.00 0.00 H new ATOM 0 HB2 SER A 80 125.522 14.964 -9.492 1.00 0.00 H new ATOM 0 HB3 SER A 80 124.114 16.007 -9.473 1.00 0.00 H new ATOM 0 HG SER A 80 124.690 15.348 -11.636 1.00 0.00 H new ATOM 1234 N GLY A 81 124.308 18.613 -8.347 1.00 0.00 N ATOM 1235 CA GLY A 81 123.520 19.848 -8.340 1.00 0.00 C ATOM 1236 C GLY A 81 122.128 19.603 -8.909 1.00 0.00 C ATOM 1237 O GLY A 81 121.372 20.542 -9.161 1.00 0.00 O ATOM 0 H GLY A 81 124.079 17.964 -7.594 1.00 0.00 H new ATOM 0 HA2 GLY A 81 123.440 20.228 -7.322 1.00 0.00 H new ATOM 0 HA3 GLY A 81 124.029 20.613 -8.927 1.00 0.00 H new ATOM 1241 N ASP A 82 121.795 18.331 -9.101 1.00 0.00 N ATOM 1242 CA ASP A 82 120.490 17.951 -9.635 1.00 0.00 C ATOM 1243 C ASP A 82 120.058 16.599 -9.071 1.00 0.00 C ATOM 1244 O ASP A 82 120.138 15.578 -9.754 1.00 0.00 O ATOM 1245 CB ASP A 82 120.550 17.875 -11.162 1.00 0.00 C ATOM 1246 CG ASP A 82 120.641 19.281 -11.749 1.00 0.00 C ATOM 1247 OD1 ASP A 82 119.699 20.035 -11.574 1.00 0.00 O ATOM 1248 OD2 ASP A 82 121.652 19.580 -12.363 1.00 0.00 O ATOM 0 H ASP A 82 122.411 17.544 -8.895 1.00 0.00 H new ATOM 0 HA ASP A 82 119.762 18.707 -9.340 1.00 0.00 H new ATOM 0 HB2 ASP A 82 121.413 17.286 -11.472 1.00 0.00 H new ATOM 0 HB3 ASP A 82 119.664 17.368 -11.545 1.00 0.00 H new ATOM 1253 N PRO A 83 119.609 16.574 -7.844 1.00 0.00 N ATOM 1254 CA PRO A 83 119.160 15.315 -7.177 1.00 0.00 C ATOM 1255 C PRO A 83 118.124 14.554 -8.008 1.00 0.00 C ATOM 1256 O PRO A 83 118.194 13.334 -8.132 1.00 0.00 O ATOM 1257 CB PRO A 83 118.554 15.802 -5.848 1.00 0.00 C ATOM 1258 CG PRO A 83 119.203 17.124 -5.583 1.00 0.00 C ATOM 1259 CD PRO A 83 119.487 17.740 -6.954 1.00 0.00 C ATOM 0 HA PRO A 83 119.980 14.610 -7.043 1.00 0.00 H new ATOM 0 HB2 PRO A 83 117.471 15.903 -5.922 1.00 0.00 H new ATOM 0 HB3 PRO A 83 118.754 15.096 -5.042 1.00 0.00 H new ATOM 0 HG2 PRO A 83 118.549 17.768 -4.994 1.00 0.00 H new ATOM 0 HG3 PRO A 83 120.124 16.999 -5.014 1.00 0.00 H new ATOM 0 HD2 PRO A 83 118.681 18.402 -7.270 1.00 0.00 H new ATOM 0 HD3 PRO A 83 120.401 18.333 -6.944 1.00 0.00 H new ATOM 1267 N ALA A 84 117.169 15.279 -8.577 1.00 0.00 N ATOM 1268 CA ALA A 84 116.132 14.652 -9.388 1.00 0.00 C ATOM 1269 C ALA A 84 116.744 13.958 -10.597 1.00 0.00 C ATOM 1270 O ALA A 84 116.425 12.806 -10.893 1.00 0.00 O ATOM 1271 CB ALA A 84 115.127 15.707 -9.853 1.00 0.00 C ATOM 0 H ALA A 84 117.090 16.293 -8.494 1.00 0.00 H new ATOM 0 HA ALA A 84 115.620 13.907 -8.780 1.00 0.00 H new ATOM 0 HB1 ALA A 84 114.355 15.232 -10.458 1.00 0.00 H new ATOM 0 HB2 ALA A 84 114.668 16.180 -8.985 1.00 0.00 H new ATOM 0 HB3 ALA A 84 115.641 16.462 -10.448 1.00 0.00 H new ATOM 1277 N GLY A 85 117.630 14.664 -11.284 1.00 0.00 N ATOM 1278 CA GLY A 85 118.294 14.110 -12.455 1.00 0.00 C ATOM 1279 C GLY A 85 119.280 13.017 -12.056 1.00 0.00 C ATOM 1280 O GLY A 85 119.507 12.067 -12.804 1.00 0.00 O ATOM 0 H GLY A 85 117.905 15.618 -11.052 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.551 13.702 -13.140 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.819 14.902 -12.989 1.00 0.00 H new ATOM 1284 N TYR A 86 119.875 13.170 -10.876 1.00 0.00 N ATOM 1285 CA TYR A 86 120.849 12.199 -10.390 1.00 0.00 C ATOM 1286 C TYR A 86 120.156 10.938 -9.869 1.00 0.00 C ATOM 1287 O TYR A 86 120.755 9.870 -9.830 1.00 0.00 O ATOM 1288 CB TYR A 86 121.707 12.821 -9.281 1.00 0.00 C ATOM 1289 CG TYR A 86 122.861 11.900 -8.960 1.00 0.00 C ATOM 1290 CD1 TYR A 86 122.715 10.905 -7.989 1.00 0.00 C ATOM 1291 CD2 TYR A 86 124.078 12.039 -9.641 1.00 0.00 C ATOM 1292 CE1 TYR A 86 123.782 10.049 -7.695 1.00 0.00 C ATOM 1293 CE2 TYR A 86 125.147 11.183 -9.348 1.00 0.00 C ATOM 1294 CZ TYR A 86 124.999 10.187 -8.374 1.00 0.00 C ATOM 1295 OH TYR A 86 126.052 9.343 -8.085 1.00 0.00 O ATOM 0 H TYR A 86 119.701 13.951 -10.243 1.00 0.00 H new ATOM 0 HA TYR A 86 121.491 11.916 -11.225 1.00 0.00 H new ATOM 0 HB2 TYR A 86 122.082 13.794 -9.599 1.00 0.00 H new ATOM 0 HB3 TYR A 86 121.103 12.988 -8.390 1.00 0.00 H new ATOM 0 HD1 TYR A 86 121.777 10.797 -7.465 1.00 0.00 H new ATOM 0 HD2 TYR A 86 124.192 12.807 -10.392 1.00 0.00 H new ATOM 0 HE1 TYR A 86 123.667 9.281 -6.944 1.00 0.00 H new ATOM 0 HE2 TYR A 86 126.085 11.291 -9.873 1.00 0.00 H new ATOM 0 HH TYR A 86 126.821 9.575 -8.647 1.00 0.00 H new ATOM 1305 N VAL A 87 118.901 11.069 -9.456 1.00 0.00 N ATOM 1306 CA VAL A 87 118.145 9.925 -8.941 1.00 0.00 C ATOM 1307 C VAL A 87 117.613 9.056 -10.079 1.00 0.00 C ATOM 1308 O VAL A 87 117.614 7.831 -9.985 1.00 0.00 O ATOM 1309 CB VAL A 87 116.991 10.422 -8.067 1.00 0.00 C ATOM 1310 CG1 VAL A 87 116.019 9.269 -7.760 1.00 0.00 C ATOM 1311 CG2 VAL A 87 117.548 10.995 -6.744 1.00 0.00 C ATOM 0 H VAL A 87 118.385 11.949 -9.466 1.00 0.00 H new ATOM 0 HA VAL A 87 118.815 9.311 -8.340 1.00 0.00 H new ATOM 0 HB VAL A 87 116.455 11.203 -8.605 1.00 0.00 H new ATOM 0 HG11 VAL A 87 115.203 9.637 -7.138 1.00 0.00 H new ATOM 0 HG12 VAL A 87 115.615 8.876 -8.693 1.00 0.00 H new ATOM 0 HG13 VAL A 87 116.550 8.477 -7.232 1.00 0.00 H new ATOM 0 HG21 VAL A 87 116.723 11.348 -6.125 1.00 0.00 H new ATOM 0 HG22 VAL A 87 118.094 10.216 -6.212 1.00 0.00 H new ATOM 0 HG23 VAL A 87 118.220 11.826 -6.961 1.00 0.00 H new ATOM 1321 N LYS A 88 117.132 9.702 -11.136 1.00 0.00 N ATOM 1322 CA LYS A 88 116.576 8.982 -12.278 1.00 0.00 C ATOM 1323 C LYS A 88 117.501 7.851 -12.713 1.00 0.00 C ATOM 1324 O LYS A 88 117.060 6.879 -13.327 1.00 0.00 O ATOM 1325 CB LYS A 88 116.368 9.950 -13.451 1.00 0.00 C ATOM 1326 CG LYS A 88 115.124 10.803 -13.205 1.00 0.00 C ATOM 1327 CD LYS A 88 114.970 11.823 -14.335 1.00 0.00 C ATOM 1328 CE LYS A 88 113.784 12.737 -14.027 1.00 0.00 C ATOM 1329 NZ LYS A 88 112.543 11.919 -13.931 1.00 0.00 N ATOM 0 H LYS A 88 117.115 10.718 -11.227 1.00 0.00 H new ATOM 0 HA LYS A 88 115.620 8.553 -11.978 1.00 0.00 H new ATOM 0 HB2 LYS A 88 117.242 10.591 -13.565 1.00 0.00 H new ATOM 0 HB3 LYS A 88 116.259 9.391 -14.380 1.00 0.00 H new ATOM 0 HG2 LYS A 88 114.240 10.168 -13.152 1.00 0.00 H new ATOM 0 HG3 LYS A 88 115.206 11.316 -12.247 1.00 0.00 H new ATOM 0 HD2 LYS A 88 115.882 12.412 -14.437 1.00 0.00 H new ATOM 0 HD3 LYS A 88 114.813 11.311 -15.285 1.00 0.00 H new ATOM 0 HE2 LYS A 88 113.955 13.270 -13.092 1.00 0.00 H new ATOM 0 HE3 LYS A 88 113.678 13.489 -14.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 111.712 12.534 -14.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 112.544 11.197 -14.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 112.505 11.454 -13.002 1.00 0.00 H new ATOM 1343 N LYS A 89 118.786 7.986 -12.397 1.00 0.00 N ATOM 1344 CA LYS A 89 119.773 6.964 -12.770 1.00 0.00 C ATOM 1345 C LYS A 89 120.011 5.982 -11.631 1.00 0.00 C ATOM 1346 O LYS A 89 120.661 4.953 -11.811 1.00 0.00 O ATOM 1347 CB LYS A 89 121.100 7.616 -13.160 1.00 0.00 C ATOM 1348 CG LYS A 89 121.477 8.680 -12.136 1.00 0.00 C ATOM 1349 CD LYS A 89 122.831 9.315 -12.492 1.00 0.00 C ATOM 1350 CE LYS A 89 123.984 8.413 -12.033 1.00 0.00 C ATOM 1351 NZ LYS A 89 125.268 9.151 -12.182 1.00 0.00 N ATOM 0 H LYS A 89 119.170 8.783 -11.889 1.00 0.00 H new ATOM 0 HA LYS A 89 119.370 6.419 -13.624 1.00 0.00 H new ATOM 0 HB2 LYS A 89 121.883 6.860 -13.217 1.00 0.00 H new ATOM 0 HB3 LYS A 89 121.017 8.065 -14.150 1.00 0.00 H new ATOM 0 HG2 LYS A 89 120.706 9.449 -12.102 1.00 0.00 H new ATOM 0 HG3 LYS A 89 121.528 8.235 -11.142 1.00 0.00 H new ATOM 0 HD2 LYS A 89 122.893 9.475 -13.568 1.00 0.00 H new ATOM 0 HD3 LYS A 89 122.916 10.293 -12.019 1.00 0.00 H new ATOM 0 HE2 LYS A 89 123.839 8.117 -10.994 1.00 0.00 H new ATOM 0 HE3 LYS A 89 124.005 7.498 -12.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 126.058 8.475 -12.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 125.261 9.684 -13.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 125.383 9.811 -11.387 1.00 0.00 H new ATOM 1365 N THR A 90 119.496 6.314 -10.458 1.00 0.00 N ATOM 1366 CA THR A 90 119.659 5.467 -9.272 1.00 0.00 C ATOM 1367 C THR A 90 118.299 5.064 -8.705 1.00 0.00 C ATOM 1368 O THR A 90 118.105 5.021 -7.491 1.00 0.00 O ATOM 1369 CB THR A 90 120.470 6.211 -8.207 1.00 0.00 C ATOM 1370 OG1 THR A 90 119.680 7.260 -7.672 1.00 0.00 O ATOM 1371 CG2 THR A 90 121.761 6.800 -8.816 1.00 0.00 C ATOM 0 H THR A 90 118.959 7.166 -10.295 1.00 0.00 H new ATOM 0 HA THR A 90 120.193 4.563 -9.564 1.00 0.00 H new ATOM 0 HB THR A 90 120.747 5.509 -7.420 1.00 0.00 H new ATOM 0 HG1 THR A 90 118.880 6.884 -7.249 1.00 0.00 H new ATOM 0 HG21 THR A 90 122.322 7.324 -8.042 1.00 0.00 H new ATOM 0 HG22 THR A 90 122.371 5.994 -9.224 1.00 0.00 H new ATOM 0 HG23 THR A 90 121.502 7.498 -9.612 1.00 0.00 H new ATOM 1379 N LEU A 91 117.366 4.765 -9.599 1.00 0.00 N ATOM 1380 CA LEU A 91 116.023 4.359 -9.202 1.00 0.00 C ATOM 1381 C LEU A 91 116.066 3.035 -8.449 1.00 0.00 C ATOM 1382 O LEU A 91 115.116 2.675 -7.763 1.00 0.00 O ATOM 1383 CB LEU A 91 115.132 4.226 -10.443 1.00 0.00 C ATOM 1384 CG LEU A 91 114.897 5.613 -11.079 1.00 0.00 C ATOM 1385 CD1 LEU A 91 114.601 5.451 -12.572 1.00 0.00 C ATOM 1386 CD2 LEU A 91 113.696 6.310 -10.414 1.00 0.00 C ATOM 0 H LEU A 91 117.515 4.796 -10.608 1.00 0.00 H new ATOM 0 HA LEU A 91 115.609 5.121 -8.541 1.00 0.00 H new ATOM 0 HB2 LEU A 91 115.601 3.560 -11.167 1.00 0.00 H new ATOM 0 HB3 LEU A 91 114.178 3.777 -10.168 1.00 0.00 H new ATOM 0 HG LEU A 91 115.794 6.215 -10.935 1.00 0.00 H new ATOM 0 HD11 LEU A 91 114.435 6.431 -13.019 1.00 0.00 H new ATOM 0 HD12 LEU A 91 115.447 4.968 -13.060 1.00 0.00 H new ATOM 0 HD13 LEU A 91 113.709 4.838 -12.702 1.00 0.00 H new ATOM 0 HD21 LEU A 91 113.542 7.287 -10.873 1.00 0.00 H new ATOM 0 HD22 LEU A 91 112.802 5.701 -10.549 1.00 0.00 H new ATOM 0 HD23 LEU A 91 113.892 6.436 -9.349 1.00 0.00 H new ATOM 1398 N TYR A 92 117.169 2.304 -8.599 1.00 0.00 N ATOM 1399 CA TYR A 92 117.328 1.011 -7.928 1.00 0.00 C ATOM 1400 C TYR A 92 118.004 1.183 -6.567 1.00 0.00 C ATOM 1401 O TYR A 92 118.283 0.203 -5.876 1.00 0.00 O ATOM 1402 CB TYR A 92 118.150 0.066 -8.808 1.00 0.00 C ATOM 1403 CG TYR A 92 119.321 0.817 -9.390 1.00 0.00 C ATOM 1404 CD1 TYR A 92 119.179 1.481 -10.612 1.00 0.00 C ATOM 1405 CD2 TYR A 92 120.543 0.851 -8.710 1.00 0.00 C ATOM 1406 CE1 TYR A 92 120.259 2.181 -11.157 1.00 0.00 C ATOM 1407 CE2 TYR A 92 121.626 1.552 -9.255 1.00 0.00 C ATOM 1408 CZ TYR A 92 121.483 2.217 -10.479 1.00 0.00 C ATOM 1409 OH TYR A 92 122.548 2.910 -11.015 1.00 0.00 O ATOM 0 H TYR A 92 117.963 2.581 -9.176 1.00 0.00 H new ATOM 0 HA TYR A 92 116.339 0.582 -7.766 1.00 0.00 H new ATOM 0 HB2 TYR A 92 118.503 -0.781 -8.220 1.00 0.00 H new ATOM 0 HB3 TYR A 92 117.529 -0.337 -9.608 1.00 0.00 H new ATOM 0 HD1 TYR A 92 118.235 1.453 -11.135 1.00 0.00 H new ATOM 0 HD2 TYR A 92 120.651 0.337 -7.766 1.00 0.00 H new ATOM 0 HE1 TYR A 92 120.149 2.694 -12.101 1.00 0.00 H new ATOM 0 HE2 TYR A 92 122.570 1.580 -8.732 1.00 0.00 H new ATOM 0 HH TYR A 92 122.230 3.754 -11.398 1.00 0.00 H new ATOM 1419 N GLU A 93 118.254 2.439 -6.179 1.00 0.00 N ATOM 1420 CA GLU A 93 118.888 2.737 -4.889 1.00 0.00 C ATOM 1421 C GLU A 93 117.860 3.295 -3.894 1.00 0.00 C ATOM 1422 O GLU A 93 118.049 3.208 -2.681 1.00 0.00 O ATOM 1423 CB GLU A 93 120.020 3.748 -5.098 1.00 0.00 C ATOM 1424 CG GLU A 93 121.095 3.124 -5.999 1.00 0.00 C ATOM 1425 CD GLU A 93 121.764 1.955 -5.287 1.00 0.00 C ATOM 1426 OE1 GLU A 93 121.986 2.065 -4.093 1.00 0.00 O ATOM 1427 OE2 GLU A 93 122.053 0.970 -5.948 1.00 0.00 O ATOM 0 H GLU A 93 118.028 3.262 -6.737 1.00 0.00 H new ATOM 0 HA GLU A 93 119.296 1.814 -4.476 1.00 0.00 H new ATOM 0 HB2 GLU A 93 119.631 4.659 -5.553 1.00 0.00 H new ATOM 0 HB3 GLU A 93 120.452 4.031 -4.138 1.00 0.00 H new ATOM 0 HG2 GLU A 93 120.645 2.782 -6.931 1.00 0.00 H new ATOM 0 HG3 GLU A 93 121.841 3.875 -6.261 1.00 0.00 H new ATOM 1434 N ILE A 94 116.767 3.860 -4.415 1.00 0.00 N ATOM 1435 CA ILE A 94 115.712 4.419 -3.562 1.00 0.00 C ATOM 1436 C ILE A 94 114.892 3.316 -2.866 1.00 0.00 C ATOM 1437 O ILE A 94 114.454 3.487 -1.724 1.00 0.00 O ATOM 1438 CB ILE A 94 114.772 5.312 -4.393 1.00 0.00 C ATOM 1439 CG1 ILE A 94 115.593 6.136 -5.396 1.00 0.00 C ATOM 1440 CG2 ILE A 94 113.988 6.252 -3.472 1.00 0.00 C ATOM 1441 CD1 ILE A 94 116.703 6.904 -4.670 1.00 0.00 C ATOM 0 H ILE A 94 116.589 3.943 -5.416 1.00 0.00 H new ATOM 0 HA ILE A 94 116.200 5.015 -2.791 1.00 0.00 H new ATOM 0 HB ILE A 94 114.069 4.679 -4.935 1.00 0.00 H new ATOM 0 HG12 ILE A 94 116.028 5.478 -6.148 1.00 0.00 H new ATOM 0 HG13 ILE A 94 114.942 6.834 -5.922 1.00 0.00 H new ATOM 0 HG21 ILE A 94 113.326 6.879 -4.070 1.00 0.00 H new ATOM 0 HG22 ILE A 94 113.395 5.664 -2.771 1.00 0.00 H new ATOM 0 HG23 ILE A 94 114.684 6.883 -2.919 1.00 0.00 H new ATOM 0 HD11 ILE A 94 117.277 7.484 -5.393 1.00 0.00 H new ATOM 0 HD12 ILE A 94 116.260 7.576 -3.936 1.00 0.00 H new ATOM 0 HD13 ILE A 94 117.363 6.199 -4.165 1.00 0.00 H new ATOM 1453 N PRO A 95 114.658 2.203 -3.522 1.00 0.00 N ATOM 1454 CA PRO A 95 113.866 1.082 -2.941 1.00 0.00 C ATOM 1455 C PRO A 95 114.458 0.595 -1.619 1.00 0.00 C ATOM 1456 O PRO A 95 113.732 0.231 -0.699 1.00 0.00 O ATOM 1457 CB PRO A 95 113.917 -0.009 -4.026 1.00 0.00 C ATOM 1458 CG PRO A 95 114.216 0.727 -5.287 1.00 0.00 C ATOM 1459 CD PRO A 95 115.120 1.879 -4.873 1.00 0.00 C ATOM 0 HA PRO A 95 112.846 1.377 -2.695 1.00 0.00 H new ATOM 0 HB2 PRO A 95 114.686 -0.749 -3.807 1.00 0.00 H new ATOM 0 HB3 PRO A 95 112.970 -0.544 -4.095 1.00 0.00 H new ATOM 0 HG2 PRO A 95 114.710 0.080 -6.013 1.00 0.00 H new ATOM 0 HG3 PRO A 95 113.302 1.092 -5.756 1.00 0.00 H new ATOM 0 HD2 PRO A 95 116.170 1.588 -4.880 1.00 0.00 H new ATOM 0 HD3 PRO A 95 115.021 2.730 -5.547 1.00 0.00 H new ATOM 1467 N ALA A 96 115.783 0.591 -1.539 1.00 0.00 N ATOM 1468 CA ALA A 96 116.465 0.147 -0.328 1.00 0.00 C ATOM 1469 C ALA A 96 116.173 1.094 0.835 1.00 0.00 C ATOM 1470 O ALA A 96 115.982 0.658 1.970 1.00 0.00 O ATOM 1471 CB ALA A 96 117.976 0.084 -0.576 1.00 0.00 C ATOM 0 H ALA A 96 116.404 0.888 -2.292 1.00 0.00 H new ATOM 0 HA ALA A 96 116.097 -0.846 -0.069 1.00 0.00 H new ATOM 0 HB1 ALA A 96 118.480 -0.248 0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 96 118.183 -0.618 -1.384 1.00 0.00 H new ATOM 0 HB3 ALA A 96 118.341 1.073 -0.852 1.00 0.00 H new ATOM 1477 N LEU A 97 116.148 2.391 0.545 1.00 0.00 N ATOM 1478 CA LEU A 97 115.887 3.390 1.575 1.00 0.00 C ATOM 1479 C LEU A 97 114.479 3.251 2.130 1.00 0.00 C ATOM 1480 O LEU A 97 114.257 3.502 3.313 1.00 0.00 O ATOM 1481 CB LEU A 97 116.062 4.797 1.011 1.00 0.00 C ATOM 1482 CG LEU A 97 117.427 4.923 0.328 1.00 0.00 C ATOM 1483 CD1 LEU A 97 117.589 6.350 -0.219 1.00 0.00 C ATOM 1484 CD2 LEU A 97 118.548 4.616 1.337 1.00 0.00 C ATOM 0 H LEU A 97 116.304 2.773 -0.388 1.00 0.00 H new ATOM 0 HA LEU A 97 116.604 3.225 2.380 1.00 0.00 H new ATOM 0 HB2 LEU A 97 115.268 5.012 0.296 1.00 0.00 H new ATOM 0 HB3 LEU A 97 115.978 5.532 1.812 1.00 0.00 H new ATOM 0 HG LEU A 97 117.490 4.210 -0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 97 118.559 6.445 -0.706 1.00 0.00 H new ATOM 0 HD12 LEU A 97 116.799 6.555 -0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 97 117.524 7.064 0.602 1.00 0.00 H new ATOM 0 HD21 LEU A 97 119.516 4.707 0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 97 118.495 5.322 2.166 1.00 0.00 H new ATOM 0 HD23 LEU A 97 118.428 3.601 1.716 1.00 0.00 H new ATOM 1496 N VAL A 98 113.530 2.867 1.265 1.00 0.00 N ATOM 1497 CA VAL A 98 112.122 2.719 1.670 1.00 0.00 C ATOM 1498 C VAL A 98 112.013 2.292 3.140 1.00 0.00 C ATOM 1499 O VAL A 98 112.081 1.104 3.450 1.00 0.00 O ATOM 1500 CB VAL A 98 111.441 1.664 0.785 1.00 0.00 C ATOM 1501 CG1 VAL A 98 110.048 1.336 1.335 1.00 0.00 C ATOM 1502 CG2 VAL A 98 111.308 2.215 -0.637 1.00 0.00 C ATOM 0 H VAL A 98 113.709 2.654 0.284 1.00 0.00 H new ATOM 0 HA VAL A 98 111.629 3.684 1.551 1.00 0.00 H new ATOM 0 HB VAL A 98 112.043 0.756 0.779 1.00 0.00 H new ATOM 0 HG11 VAL A 98 109.573 0.587 0.701 1.00 0.00 H new ATOM 0 HG12 VAL A 98 110.140 0.947 2.349 1.00 0.00 H new ATOM 0 HG13 VAL A 98 109.439 2.240 1.347 1.00 0.00 H new ATOM 0 HG21 VAL A 98 110.825 1.472 -1.272 1.00 0.00 H new ATOM 0 HG22 VAL A 98 110.706 3.124 -0.620 1.00 0.00 H new ATOM 0 HG23 VAL A 98 112.298 2.443 -1.033 1.00 0.00 H new ATOM 1512 N PRO A 99 111.863 3.233 4.051 1.00 0.00 N ATOM 1513 CA PRO A 99 111.769 2.909 5.505 1.00 0.00 C ATOM 1514 C PRO A 99 110.646 1.914 5.802 1.00 0.00 C ATOM 1515 O PRO A 99 109.484 2.127 5.436 1.00 0.00 O ATOM 1516 CB PRO A 99 111.507 4.272 6.180 1.00 0.00 C ATOM 1517 CG PRO A 99 111.980 5.298 5.196 1.00 0.00 C ATOM 1518 CD PRO A 99 111.764 4.688 3.813 1.00 0.00 C ATOM 0 HA PRO A 99 112.674 2.425 5.874 1.00 0.00 H new ATOM 0 HB2 PRO A 99 110.449 4.402 6.406 1.00 0.00 H new ATOM 0 HB3 PRO A 99 112.047 4.354 7.124 1.00 0.00 H new ATOM 0 HG2 PRO A 99 111.422 6.228 5.304 1.00 0.00 H new ATOM 0 HG3 PRO A 99 113.031 5.537 5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 99 110.792 4.961 3.403 1.00 0.00 H new ATOM 0 HD3 PRO A 99 112.517 5.030 3.103 1.00 0.00 H new ATOM 1526 N ALA A 100 111.004 0.835 6.491 1.00 0.00 N ATOM 1527 CA ALA A 100 110.031 -0.185 6.851 1.00 0.00 C ATOM 1528 C ALA A 100 108.942 0.432 7.710 1.00 0.00 C ATOM 1529 O ALA A 100 107.776 0.051 7.625 1.00 0.00 O ATOM 1530 CB ALA A 100 110.716 -1.321 7.619 1.00 0.00 C ATOM 0 H ALA A 100 111.955 0.647 6.809 1.00 0.00 H new ATOM 0 HA ALA A 100 109.589 -0.592 5.941 1.00 0.00 H new ATOM 0 HB1 ALA A 100 109.978 -2.078 7.883 1.00 0.00 H new ATOM 0 HB2 ALA A 100 111.488 -1.769 6.994 1.00 0.00 H new ATOM 0 HB3 ALA A 100 111.170 -0.924 8.527 1.00 0.00 H new ATOM 1536 N GLY A 101 109.334 1.394 8.533 1.00 0.00 N ATOM 1537 CA GLY A 101 108.385 2.066 9.400 1.00 0.00 C ATOM 1538 C GLY A 101 107.309 2.770 8.577 1.00 0.00 C ATOM 1539 O GLY A 101 106.134 2.749 8.941 1.00 0.00 O ATOM 0 H GLY A 101 110.296 1.723 8.617 1.00 0.00 H new ATOM 0 HA2 GLY A 101 107.922 1.342 10.071 1.00 0.00 H new ATOM 0 HA3 GLY A 101 108.906 2.792 10.024 1.00 0.00 H new ATOM 1543 N LEU A 102 107.709 3.381 7.459 1.00 0.00 N ATOM 1544 CA LEU A 102 106.747 4.076 6.606 1.00 0.00 C ATOM 1545 C LEU A 102 105.714 3.087 6.078 1.00 0.00 C ATOM 1546 O LEU A 102 104.507 3.319 6.167 1.00 0.00 O ATOM 1547 CB LEU A 102 107.481 4.727 5.428 1.00 0.00 C ATOM 1548 CG LEU A 102 106.494 5.485 4.526 1.00 0.00 C ATOM 1549 CD1 LEU A 102 105.798 6.605 5.318 1.00 0.00 C ATOM 1550 CD2 LEU A 102 107.267 6.088 3.350 1.00 0.00 C ATOM 0 H LEU A 102 108.674 3.408 7.129 1.00 0.00 H new ATOM 0 HA LEU A 102 106.242 4.845 7.190 1.00 0.00 H new ATOM 0 HB2 LEU A 102 108.241 5.413 5.801 1.00 0.00 H new ATOM 0 HB3 LEU A 102 107.998 3.963 4.848 1.00 0.00 H new ATOM 0 HG LEU A 102 105.733 4.796 4.160 1.00 0.00 H new ATOM 0 HD11 LEU A 102 105.102 7.133 4.666 1.00 0.00 H new ATOM 0 HD12 LEU A 102 105.253 6.173 6.157 1.00 0.00 H new ATOM 0 HD13 LEU A 102 106.546 7.304 5.693 1.00 0.00 H new ATOM 0 HD21 LEU A 102 106.578 6.629 2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 102 108.026 6.774 3.727 1.00 0.00 H new ATOM 0 HD23 LEU A 102 107.748 5.291 2.784 1.00 0.00 H new ATOM 1562 N LEU A 103 106.196 1.972 5.548 1.00 0.00 N ATOM 1563 CA LEU A 103 105.300 0.944 5.026 1.00 0.00 C ATOM 1564 C LEU A 103 104.462 0.348 6.151 1.00 0.00 C ATOM 1565 O LEU A 103 103.290 0.041 5.960 1.00 0.00 O ATOM 1566 CB LEU A 103 106.104 -0.153 4.313 1.00 0.00 C ATOM 1567 CG LEU A 103 106.377 0.256 2.860 1.00 0.00 C ATOM 1568 CD1 LEU A 103 107.060 1.625 2.810 1.00 0.00 C ATOM 1569 CD2 LEU A 103 107.288 -0.783 2.209 1.00 0.00 C ATOM 0 H LEU A 103 107.189 1.755 5.467 1.00 0.00 H new ATOM 0 HA LEU A 103 104.627 1.404 4.303 1.00 0.00 H new ATOM 0 HB2 LEU A 103 107.046 -0.322 4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 103 105.553 -1.093 4.337 1.00 0.00 H new ATOM 0 HG LEU A 103 105.429 0.314 2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 103 107.247 1.901 1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 103 106.414 2.371 3.273 1.00 0.00 H new ATOM 0 HD13 LEU A 103 108.006 1.579 3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 103 107.485 -0.497 1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 103 108.229 -0.836 2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 103 106.801 -1.758 2.229 1.00 0.00 H new ATOM 1581 N ALA A 104 105.073 0.175 7.315 1.00 0.00 N ATOM 1582 CA ALA A 104 104.366 -0.396 8.454 1.00 0.00 C ATOM 1583 C ALA A 104 103.054 0.348 8.701 1.00 0.00 C ATOM 1584 O ALA A 104 101.997 -0.271 8.827 1.00 0.00 O ATOM 1585 CB ALA A 104 105.252 -0.312 9.698 1.00 0.00 C ATOM 0 H ALA A 104 106.047 0.419 7.495 1.00 0.00 H new ATOM 0 HA ALA A 104 104.136 -1.439 8.238 1.00 0.00 H new ATOM 0 HB1 ALA A 104 104.724 -0.739 10.550 1.00 0.00 H new ATOM 0 HB2 ALA A 104 106.174 -0.868 9.527 1.00 0.00 H new ATOM 0 HB3 ALA A 104 105.491 0.731 9.905 1.00 0.00 H new ATOM 1591 N LEU A 105 103.124 1.677 8.758 1.00 0.00 N ATOM 1592 CA LEU A 105 101.924 2.485 8.978 1.00 0.00 C ATOM 1593 C LEU A 105 100.937 2.312 7.821 1.00 0.00 C ATOM 1594 O LEU A 105 99.731 2.193 8.033 1.00 0.00 O ATOM 1595 CB LEU A 105 102.308 3.972 9.128 1.00 0.00 C ATOM 1596 CG LEU A 105 102.631 4.304 10.593 1.00 0.00 C ATOM 1597 CD1 LEU A 105 103.796 3.445 11.091 1.00 0.00 C ATOM 1598 CD2 LEU A 105 103.016 5.780 10.697 1.00 0.00 C ATOM 0 H LEU A 105 103.986 2.212 8.657 1.00 0.00 H new ATOM 0 HA LEU A 105 101.443 2.146 9.896 1.00 0.00 H new ATOM 0 HB2 LEU A 105 103.171 4.195 8.501 1.00 0.00 H new ATOM 0 HB3 LEU A 105 101.489 4.601 8.779 1.00 0.00 H new ATOM 0 HG LEU A 105 101.753 4.098 11.206 1.00 0.00 H new ATOM 0 HD11 LEU A 105 104.012 3.692 12.130 1.00 0.00 H new ATOM 0 HD12 LEU A 105 103.528 2.391 11.017 1.00 0.00 H new ATOM 0 HD13 LEU A 105 104.678 3.639 10.481 1.00 0.00 H new ATOM 0 HD21 LEU A 105 103.247 6.024 11.734 1.00 0.00 H new ATOM 0 HD22 LEU A 105 103.891 5.973 10.076 1.00 0.00 H new ATOM 0 HD23 LEU A 105 102.185 6.398 10.355 1.00 0.00 H new ATOM 1610 N ILE A 106 101.457 2.299 6.600 1.00 0.00 N ATOM 1611 CA ILE A 106 100.607 2.140 5.422 1.00 0.00 C ATOM 1612 C ILE A 106 99.951 0.763 5.426 1.00 0.00 C ATOM 1613 O ILE A 106 98.764 0.628 5.123 1.00 0.00 O ATOM 1614 CB ILE A 106 101.422 2.329 4.141 1.00 0.00 C ATOM 1615 CG1 ILE A 106 102.020 3.740 4.129 1.00 0.00 C ATOM 1616 CG2 ILE A 106 100.509 2.160 2.923 1.00 0.00 C ATOM 1617 CD1 ILE A 106 103.006 3.883 2.965 1.00 0.00 C ATOM 0 H ILE A 106 102.452 2.395 6.398 1.00 0.00 H new ATOM 0 HA ILE A 106 99.829 2.903 5.454 1.00 0.00 H new ATOM 0 HB ILE A 106 102.220 1.587 4.104 1.00 0.00 H new ATOM 0 HG12 ILE A 106 101.225 4.480 4.036 1.00 0.00 H new ATOM 0 HG13 ILE A 106 102.528 3.936 5.073 1.00 0.00 H new ATOM 0 HG21 ILE A 106 101.090 2.295 2.011 1.00 0.00 H new ATOM 0 HG22 ILE A 106 100.073 1.161 2.931 1.00 0.00 H new ATOM 0 HG23 ILE A 106 99.713 2.904 2.959 1.00 0.00 H new ATOM 0 HD11 ILE A 106 103.426 4.889 2.965 1.00 0.00 H new ATOM 0 HD12 ILE A 106 103.809 3.155 3.077 1.00 0.00 H new ATOM 0 HD13 ILE A 106 102.486 3.707 2.024 1.00 0.00 H new ATOM 1629 N GLU A 107 100.734 -0.255 5.769 1.00 0.00 N ATOM 1630 CA GLU A 107 100.228 -1.621 5.813 1.00 0.00 C ATOM 1631 C GLU A 107 99.016 -1.695 6.732 1.00 0.00 C ATOM 1632 O GLU A 107 98.000 -2.303 6.394 1.00 0.00 O ATOM 1633 CB GLU A 107 101.320 -2.560 6.337 1.00 0.00 C ATOM 1634 CG GLU A 107 100.824 -4.008 6.298 1.00 0.00 C ATOM 1635 CD GLU A 107 101.923 -4.949 6.780 1.00 0.00 C ATOM 1636 OE1 GLU A 107 102.895 -4.461 7.331 1.00 0.00 O ATOM 1637 OE2 GLU A 107 101.775 -6.145 6.590 1.00 0.00 O ATOM 0 H GLU A 107 101.718 -0.160 6.020 1.00 0.00 H new ATOM 0 HA GLU A 107 99.938 -1.924 4.807 1.00 0.00 H new ATOM 0 HB2 GLU A 107 102.221 -2.458 5.732 1.00 0.00 H new ATOM 0 HB3 GLU A 107 101.589 -2.286 7.357 1.00 0.00 H new ATOM 0 HG2 GLU A 107 99.940 -4.115 6.927 1.00 0.00 H new ATOM 0 HG3 GLU A 107 100.527 -4.272 5.283 1.00 0.00 H new ATOM 1644 N GLY A 108 99.133 -1.069 7.896 1.00 0.00 N ATOM 1645 CA GLY A 108 98.044 -1.064 8.863 1.00 0.00 C ATOM 1646 C GLY A 108 96.828 -0.325 8.315 1.00 0.00 C ATOM 1647 O GLY A 108 95.690 -0.754 8.501 1.00 0.00 O ATOM 0 H GLY A 108 99.966 -0.561 8.192 1.00 0.00 H new ATOM 0 HA2 GLY A 108 97.769 -2.089 9.111 1.00 0.00 H new ATOM 0 HA3 GLY A 108 98.376 -0.590 9.787 1.00 0.00 H new ATOM 1651 N HIS A 109 97.079 0.789 7.638 1.00 0.00 N ATOM 1652 CA HIS A 109 96.001 1.588 7.066 1.00 0.00 C ATOM 1653 C HIS A 109 95.163 0.759 6.097 1.00 0.00 C ATOM 1654 O HIS A 109 93.934 0.777 6.152 1.00 0.00 O ATOM 1655 CB HIS A 109 96.596 2.794 6.333 1.00 0.00 C ATOM 1656 CG HIS A 109 95.502 3.561 5.642 1.00 0.00 C ATOM 1657 ND1 HIS A 109 95.448 3.680 4.263 1.00 0.00 N ATOM 1658 CD2 HIS A 109 94.411 4.243 6.120 1.00 0.00 C ATOM 1659 CE1 HIS A 109 94.358 4.406 3.960 1.00 0.00 C ATOM 1660 NE2 HIS A 109 93.689 4.775 5.055 1.00 0.00 N ATOM 0 H HIS A 109 98.015 1.159 7.472 1.00 0.00 H new ATOM 0 HA HIS A 109 95.353 1.928 7.874 1.00 0.00 H new ATOM 0 HB2 HIS A 109 97.115 3.441 7.040 1.00 0.00 H new ATOM 0 HB3 HIS A 109 97.335 2.460 5.604 1.00 0.00 H new ATOM 0 HD2 HIS A 109 94.152 4.351 7.163 1.00 0.00 H new ATOM 0 HE1 HIS A 109 94.060 4.660 2.954 1.00 0.00 H new ATOM 0 HE2 HIS A 109 92.833 5.328 5.101 1.00 0.00 H new ATOM 1668 N LEU A 110 95.839 0.042 5.210 1.00 0.00 N ATOM 1669 CA LEU A 110 95.155 -0.788 4.226 1.00 0.00 C ATOM 1670 C LEU A 110 94.400 -1.922 4.925 1.00 0.00 C ATOM 1671 O LEU A 110 93.271 -2.261 4.557 1.00 0.00 O ATOM 1672 CB LEU A 110 96.184 -1.365 3.248 1.00 0.00 C ATOM 1673 CG LEU A 110 96.885 -0.221 2.484 1.00 0.00 C ATOM 1674 CD1 LEU A 110 98.216 -0.725 1.926 1.00 0.00 C ATOM 1675 CD2 LEU A 110 96.023 0.259 1.310 1.00 0.00 C ATOM 0 H LEU A 110 96.857 0.018 5.151 1.00 0.00 H new ATOM 0 HA LEU A 110 94.436 -0.180 3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 110 96.921 -1.957 3.790 1.00 0.00 H new ATOM 0 HB3 LEU A 110 95.692 -2.036 2.544 1.00 0.00 H new ATOM 0 HG LEU A 110 97.044 0.605 3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 110 98.713 0.081 1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 110 98.852 -1.058 2.746 1.00 0.00 H new ATOM 0 HD13 LEU A 110 98.034 -1.558 1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 110 96.537 1.065 0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 110 95.852 -0.569 0.622 1.00 0.00 H new ATOM 0 HD23 LEU A 110 95.067 0.623 1.686 1.00 0.00 H new ATOM 1687 N ALA A 111 95.030 -2.504 5.941 1.00 0.00 N ATOM 1688 CA ALA A 111 94.413 -3.595 6.687 1.00 0.00 C ATOM 1689 C ALA A 111 93.098 -3.134 7.306 1.00 0.00 C ATOM 1690 O ALA A 111 92.146 -3.908 7.416 1.00 0.00 O ATOM 1691 CB ALA A 111 95.358 -4.081 7.789 1.00 0.00 C ATOM 0 H ALA A 111 95.961 -2.241 6.265 1.00 0.00 H new ATOM 0 HA ALA A 111 94.214 -4.416 5.999 1.00 0.00 H new ATOM 0 HB1 ALA A 111 94.887 -4.895 8.339 1.00 0.00 H new ATOM 0 HB2 ALA A 111 96.287 -4.435 7.342 1.00 0.00 H new ATOM 0 HB3 ALA A 111 95.574 -3.259 8.472 1.00 0.00 H new ATOM 1697 N GLY A 112 93.051 -1.867 7.705 1.00 0.00 N ATOM 1698 CA GLY A 112 91.845 -1.312 8.309 1.00 0.00 C ATOM 1699 C GLY A 112 90.672 -1.388 7.338 1.00 0.00 C ATOM 1700 O GLY A 112 89.540 -1.656 7.740 1.00 0.00 O ATOM 0 H GLY A 112 93.827 -1.210 7.622 1.00 0.00 H new ATOM 0 HA2 GLY A 112 91.605 -1.858 9.221 1.00 0.00 H new ATOM 0 HA3 GLY A 112 92.020 -0.275 8.595 1.00 0.00 H new ATOM 1704 N LEU A 113 90.949 -1.156 6.059 1.00 0.00 N ATOM 1705 CA LEU A 113 89.904 -1.209 5.041 1.00 0.00 C ATOM 1706 C LEU A 113 89.545 -2.660 4.732 1.00 0.00 C ATOM 1707 O LEU A 113 88.444 -2.952 4.267 1.00 0.00 O ATOM 1708 CB LEU A 113 90.383 -0.513 3.764 1.00 0.00 C ATOM 1709 CG LEU A 113 90.623 0.980 4.034 1.00 0.00 C ATOM 1710 CD1 LEU A 113 91.278 1.606 2.799 1.00 0.00 C ATOM 1711 CD2 LEU A 113 89.289 1.695 4.331 1.00 0.00 C ATOM 0 H LEU A 113 91.879 -0.932 5.704 1.00 0.00 H new ATOM 0 HA LEU A 113 89.019 -0.696 5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 113 91.303 -0.979 3.410 1.00 0.00 H new ATOM 0 HB3 LEU A 113 89.641 -0.633 2.975 1.00 0.00 H new ATOM 0 HG LEU A 113 91.275 1.089 4.901 1.00 0.00 H new ATOM 0 HD11 LEU A 113 91.454 2.667 2.978 1.00 0.00 H new ATOM 0 HD12 LEU A 113 92.228 1.110 2.600 1.00 0.00 H new ATOM 0 HD13 LEU A 113 90.619 1.488 1.939 1.00 0.00 H new ATOM 0 HD21 LEU A 113 89.477 2.752 4.520 1.00 0.00 H new ATOM 0 HD22 LEU A 113 88.623 1.592 3.475 1.00 0.00 H new ATOM 0 HD23 LEU A 113 88.823 1.247 5.209 1.00 0.00 H new ATOM 1723 N GLY A 114 90.484 -3.566 4.998 1.00 0.00 N ATOM 1724 CA GLY A 114 90.258 -4.992 4.749 1.00 0.00 C ATOM 1725 C GLY A 114 90.636 -5.366 3.320 1.00 0.00 C ATOM 1726 O GLY A 114 90.428 -6.500 2.890 1.00 0.00 O ATOM 0 H GLY A 114 91.402 -3.343 5.383 1.00 0.00 H new ATOM 0 HA2 GLY A 114 90.845 -5.584 5.451 1.00 0.00 H new ATOM 0 HA3 GLY A 114 89.210 -5.234 4.926 1.00 0.00 H new ATOM 1730 N LEU A 115 91.200 -4.407 2.595 1.00 0.00 N ATOM 1731 CA LEU A 115 91.611 -4.650 1.219 1.00 0.00 C ATOM 1732 C LEU A 115 92.897 -5.470 1.196 1.00 0.00 C ATOM 1733 O LEU A 115 93.996 -4.930 1.040 1.00 0.00 O ATOM 1734 CB LEU A 115 91.833 -3.315 0.500 1.00 0.00 C ATOM 1735 CG LEU A 115 90.480 -2.622 0.230 1.00 0.00 C ATOM 1736 CD1 LEU A 115 90.698 -1.116 0.071 1.00 0.00 C ATOM 1737 CD2 LEU A 115 89.857 -3.159 -1.066 1.00 0.00 C ATOM 0 H LEU A 115 91.382 -3.462 2.934 1.00 0.00 H new ATOM 0 HA LEU A 115 90.826 -5.207 0.707 1.00 0.00 H new ATOM 0 HB2 LEU A 115 92.466 -2.668 1.107 1.00 0.00 H new ATOM 0 HB3 LEU A 115 92.358 -3.483 -0.441 1.00 0.00 H new ATOM 0 HG LEU A 115 89.815 -2.824 1.070 1.00 0.00 H new ATOM 0 HD11 LEU A 115 89.742 -0.628 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 115 91.135 -0.713 0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 115 91.372 -0.932 -0.766 1.00 0.00 H new ATOM 0 HD21 LEU A 115 88.903 -2.662 -1.244 1.00 0.00 H new ATOM 0 HD22 LEU A 115 90.530 -2.964 -1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 115 89.695 -4.233 -0.974 1.00 0.00 H new ATOM 1749 N PHE A 116 92.747 -6.779 1.356 1.00 0.00 N ATOM 1750 CA PHE A 116 93.893 -7.675 1.362 1.00 0.00 C ATOM 1751 C PHE A 116 94.669 -7.554 0.059 1.00 0.00 C ATOM 1752 O PHE A 116 95.883 -7.752 0.029 1.00 0.00 O ATOM 1753 CB PHE A 116 93.435 -9.123 1.545 1.00 0.00 C ATOM 1754 CG PHE A 116 92.719 -9.259 2.869 1.00 0.00 C ATOM 1755 CD1 PHE A 116 93.429 -9.092 4.065 1.00 0.00 C ATOM 1756 CD2 PHE A 116 91.350 -9.551 2.903 1.00 0.00 C ATOM 1757 CE1 PHE A 116 92.769 -9.216 5.293 1.00 0.00 C ATOM 1758 CE2 PHE A 116 90.690 -9.674 4.131 1.00 0.00 C ATOM 1759 CZ PHE A 116 91.399 -9.507 5.326 1.00 0.00 C ATOM 0 H PHE A 116 91.846 -7.241 1.483 1.00 0.00 H new ATOM 0 HA PHE A 116 94.540 -7.393 2.193 1.00 0.00 H new ATOM 0 HB2 PHE A 116 92.772 -9.412 0.729 1.00 0.00 H new ATOM 0 HB3 PHE A 116 94.293 -9.794 1.512 1.00 0.00 H new ATOM 0 HD1 PHE A 116 94.485 -8.868 4.040 1.00 0.00 H new ATOM 0 HD2 PHE A 116 90.803 -9.681 1.981 1.00 0.00 H new ATOM 0 HE1 PHE A 116 93.316 -9.087 6.215 1.00 0.00 H new ATOM 0 HE2 PHE A 116 89.634 -9.898 4.156 1.00 0.00 H new ATOM 0 HZ PHE A 116 90.890 -9.602 6.274 1.00 0.00 H new ATOM 1769 N ARG A 117 93.960 -7.244 -1.020 1.00 0.00 N ATOM 1770 CA ARG A 117 94.602 -7.122 -2.320 1.00 0.00 C ATOM 1771 C ARG A 117 95.763 -6.137 -2.250 1.00 0.00 C ATOM 1772 O ARG A 117 96.882 -6.459 -2.643 1.00 0.00 O ATOM 1773 CB ARG A 117 93.598 -6.621 -3.360 1.00 0.00 C ATOM 1774 CG ARG A 117 92.488 -7.654 -3.565 1.00 0.00 C ATOM 1775 CD ARG A 117 91.640 -7.244 -4.772 1.00 0.00 C ATOM 1776 NE ARG A 117 91.023 -5.939 -4.543 1.00 0.00 N ATOM 1777 CZ ARG A 117 90.649 -5.167 -5.563 1.00 0.00 C ATOM 1778 NH1 ARG A 117 90.834 -5.573 -6.789 1.00 0.00 N ATOM 1779 NH2 ARG A 117 90.102 -4.003 -5.338 1.00 0.00 N ATOM 0 H ARG A 117 92.954 -7.075 -1.021 1.00 0.00 H new ATOM 0 HA ARG A 117 94.973 -8.106 -2.607 1.00 0.00 H new ATOM 0 HB2 ARG A 117 93.168 -5.674 -3.034 1.00 0.00 H new ATOM 0 HB3 ARG A 117 94.107 -6.431 -4.305 1.00 0.00 H new ATOM 0 HG2 ARG A 117 92.919 -8.642 -3.726 1.00 0.00 H new ATOM 0 HG3 ARG A 117 91.865 -7.719 -2.673 1.00 0.00 H new ATOM 0 HD2 ARG A 117 92.263 -7.207 -5.666 1.00 0.00 H new ATOM 0 HD3 ARG A 117 90.868 -7.992 -4.952 1.00 0.00 H new ATOM 0 HE ARG A 117 90.876 -5.614 -3.587 1.00 0.00 H new ATOM 0 HH11 ARG A 117 91.265 -6.481 -6.966 1.00 0.00 H new ATOM 0 HH12 ARG A 117 90.548 -4.983 -7.570 1.00 0.00 H new ATOM 0 HH21 ARG A 117 89.960 -3.683 -4.380 1.00 0.00 H new ATOM 0 HH22 ARG A 117 89.817 -3.414 -6.120 1.00 0.00 H new ATOM 1793 N LEU A 118 95.499 -4.943 -1.733 1.00 0.00 N ATOM 1794 CA LEU A 118 96.542 -3.934 -1.614 1.00 0.00 C ATOM 1795 C LEU A 118 97.626 -4.413 -0.658 1.00 0.00 C ATOM 1796 O LEU A 118 98.814 -4.182 -0.884 1.00 0.00 O ATOM 1797 CB LEU A 118 95.957 -2.613 -1.116 1.00 0.00 C ATOM 1798 CG LEU A 118 94.781 -2.195 -2.006 1.00 0.00 C ATOM 1799 CD1 LEU A 118 94.212 -0.866 -1.498 1.00 0.00 C ATOM 1800 CD2 LEU A 118 95.253 -2.035 -3.461 1.00 0.00 C ATOM 0 H LEU A 118 94.582 -4.653 -1.393 1.00 0.00 H new ATOM 0 HA LEU A 118 96.979 -3.772 -2.599 1.00 0.00 H new ATOM 0 HB2 LEU A 118 95.623 -2.719 -0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 118 96.724 -1.839 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 118 94.008 -2.963 -1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 118 93.375 -0.564 -2.128 1.00 0.00 H new ATOM 0 HD12 LEU A 118 93.868 -0.986 -0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 118 94.987 -0.101 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 118 94.411 -1.738 -4.086 1.00 0.00 H new ATOM 0 HD22 LEU A 118 96.029 -1.271 -3.510 1.00 0.00 H new ATOM 0 HD23 LEU A 118 95.654 -2.983 -3.820 1.00 0.00 H new ATOM 1812 N VAL A 119 97.209 -5.084 0.409 1.00 0.00 N ATOM 1813 CA VAL A 119 98.162 -5.595 1.390 1.00 0.00 C ATOM 1814 C VAL A 119 99.105 -6.602 0.733 1.00 0.00 C ATOM 1815 O VAL A 119 100.309 -6.592 0.983 1.00 0.00 O ATOM 1816 CB VAL A 119 97.425 -6.260 2.553 1.00 0.00 C ATOM 1817 CG1 VAL A 119 98.441 -6.804 3.558 1.00 0.00 C ATOM 1818 CG2 VAL A 119 96.528 -5.229 3.245 1.00 0.00 C ATOM 0 H VAL A 119 96.231 -5.286 0.617 1.00 0.00 H new ATOM 0 HA VAL A 119 98.745 -4.758 1.774 1.00 0.00 H new ATOM 0 HB VAL A 119 96.814 -7.079 2.174 1.00 0.00 H new ATOM 0 HG11 VAL A 119 97.915 -7.278 4.387 1.00 0.00 H new ATOM 0 HG12 VAL A 119 99.081 -7.537 3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 119 99.052 -5.985 3.937 1.00 0.00 H new ATOM 0 HG21 VAL A 119 96.002 -5.702 4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 119 97.140 -4.410 3.623 1.00 0.00 H new ATOM 0 HG23 VAL A 119 95.803 -4.840 2.530 1.00 0.00 H new ATOM 1828 N ARG A 120 98.546 -7.471 -0.106 1.00 0.00 N ATOM 1829 CA ARG A 120 99.344 -8.485 -0.792 1.00 0.00 C ATOM 1830 C ARG A 120 100.453 -7.839 -1.620 1.00 0.00 C ATOM 1831 O ARG A 120 101.608 -8.256 -1.547 1.00 0.00 O ATOM 1832 CB ARG A 120 98.435 -9.312 -1.716 1.00 0.00 C ATOM 1833 CG ARG A 120 97.601 -10.321 -0.904 1.00 0.00 C ATOM 1834 CD ARG A 120 98.401 -11.613 -0.685 1.00 0.00 C ATOM 1835 NE ARG A 120 97.648 -12.541 0.150 1.00 0.00 N ATOM 1836 CZ ARG A 120 98.227 -13.622 0.664 1.00 0.00 C ATOM 1837 NH1 ARG A 120 99.485 -13.862 0.417 1.00 0.00 N ATOM 1838 NH2 ARG A 120 97.539 -14.443 1.411 1.00 0.00 N ATOM 0 H ARG A 120 97.550 -7.494 -0.326 1.00 0.00 H new ATOM 0 HA ARG A 120 99.802 -9.130 -0.042 1.00 0.00 H new ATOM 0 HB2 ARG A 120 97.772 -8.648 -2.270 1.00 0.00 H new ATOM 0 HB3 ARG A 120 99.041 -9.842 -2.450 1.00 0.00 H new ATOM 0 HG2 ARG A 120 97.326 -9.887 0.057 1.00 0.00 H new ATOM 0 HG3 ARG A 120 96.673 -10.544 -1.430 1.00 0.00 H new ATOM 0 HD2 ARG A 120 98.624 -12.077 -1.646 1.00 0.00 H new ATOM 0 HD3 ARG A 120 99.356 -11.382 -0.213 1.00 0.00 H new ATOM 0 HE ARG A 120 96.663 -12.358 0.343 1.00 0.00 H new ATOM 0 HH11 ARG A 120 100.021 -13.222 -0.169 1.00 0.00 H new ATOM 0 HH12 ARG A 120 99.933 -14.690 0.809 1.00 0.00 H new ATOM 0 HH21 ARG A 120 96.555 -14.256 1.602 1.00 0.00 H new ATOM 0 HH22 ARG A 120 97.986 -15.271 1.804 1.00 0.00 H new ATOM 1852 N LEU A 121 100.106 -6.816 -2.396 1.00 0.00 N ATOM 1853 CA LEU A 121 101.109 -6.132 -3.214 1.00 0.00 C ATOM 1854 C LEU A 121 102.158 -5.469 -2.325 1.00 0.00 C ATOM 1855 O LEU A 121 103.354 -5.525 -2.610 1.00 0.00 O ATOM 1856 CB LEU A 121 100.438 -5.077 -4.114 1.00 0.00 C ATOM 1857 CG LEU A 121 99.992 -5.712 -5.436 1.00 0.00 C ATOM 1858 CD1 LEU A 121 99.019 -6.857 -5.162 1.00 0.00 C ATOM 1859 CD2 LEU A 121 99.304 -4.650 -6.293 1.00 0.00 C ATOM 0 H LEU A 121 99.159 -6.446 -2.477 1.00 0.00 H new ATOM 0 HA LEU A 121 101.601 -6.872 -3.846 1.00 0.00 H new ATOM 0 HB2 LEU A 121 99.578 -4.646 -3.601 1.00 0.00 H new ATOM 0 HB3 LEU A 121 101.134 -4.261 -4.311 1.00 0.00 H new ATOM 0 HG LEU A 121 100.862 -6.105 -5.962 1.00 0.00 H new ATOM 0 HD11 LEU A 121 98.707 -7.303 -6.106 1.00 0.00 H new ATOM 0 HD12 LEU A 121 99.510 -7.613 -4.549 1.00 0.00 H new ATOM 0 HD13 LEU A 121 98.145 -6.474 -4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 121 98.984 -5.094 -7.235 1.00 0.00 H new ATOM 0 HD22 LEU A 121 98.436 -4.260 -5.762 1.00 0.00 H new ATOM 0 HD23 LEU A 121 100.001 -3.837 -6.494 1.00 0.00 H new ATOM 1871 N LEU A 122 101.697 -4.836 -1.252 1.00 0.00 N ATOM 1872 CA LEU A 122 102.603 -4.162 -0.333 1.00 0.00 C ATOM 1873 C LEU A 122 103.532 -5.172 0.331 1.00 0.00 C ATOM 1874 O LEU A 122 104.728 -4.922 0.487 1.00 0.00 O ATOM 1875 CB LEU A 122 101.804 -3.405 0.737 1.00 0.00 C ATOM 1876 CG LEU A 122 102.768 -2.595 1.659 1.00 0.00 C ATOM 1877 CD1 LEU A 122 102.318 -1.132 1.742 1.00 0.00 C ATOM 1878 CD2 LEU A 122 102.771 -3.183 3.075 1.00 0.00 C ATOM 0 H LEU A 122 100.711 -4.776 -1.000 1.00 0.00 H new ATOM 0 HA LEU A 122 103.204 -3.450 -0.898 1.00 0.00 H new ATOM 0 HB2 LEU A 122 101.093 -2.730 0.260 1.00 0.00 H new ATOM 0 HB3 LEU A 122 101.224 -4.109 1.334 1.00 0.00 H new ATOM 0 HG LEU A 122 103.770 -2.652 1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 122 102.999 -0.578 2.388 1.00 0.00 H new ATOM 0 HD12 LEU A 122 102.325 -0.692 0.745 1.00 0.00 H new ATOM 0 HD13 LEU A 122 101.309 -1.084 2.152 1.00 0.00 H new ATOM 0 HD21 LEU A 122 103.448 -2.608 3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 122 101.764 -3.140 3.489 1.00 0.00 H new ATOM 0 HD23 LEU A 122 103.104 -4.220 3.038 1.00 0.00 H new ATOM 1890 N ARG A 123 102.974 -6.314 0.722 1.00 0.00 N ATOM 1891 CA ARG A 123 103.766 -7.353 1.368 1.00 0.00 C ATOM 1892 C ARG A 123 104.844 -7.855 0.411 1.00 0.00 C ATOM 1893 O ARG A 123 105.985 -8.098 0.812 1.00 0.00 O ATOM 1894 CB ARG A 123 102.865 -8.516 1.787 1.00 0.00 C ATOM 1895 CG ARG A 123 103.607 -9.403 2.789 1.00 0.00 C ATOM 1896 CD ARG A 123 102.704 -10.565 3.208 1.00 0.00 C ATOM 1897 NE ARG A 123 103.268 -11.251 4.365 1.00 0.00 N ATOM 1898 CZ ARG A 123 104.219 -12.170 4.236 1.00 0.00 C ATOM 1899 NH1 ARG A 123 104.680 -12.481 3.055 1.00 0.00 N ATOM 1900 NH2 ARG A 123 104.694 -12.761 5.298 1.00 0.00 N ATOM 0 H ARG A 123 101.987 -6.541 0.604 1.00 0.00 H new ATOM 0 HA ARG A 123 104.241 -6.934 2.255 1.00 0.00 H new ATOM 0 HB2 ARG A 123 101.946 -8.135 2.233 1.00 0.00 H new ATOM 0 HB3 ARG A 123 102.577 -9.100 0.913 1.00 0.00 H new ATOM 0 HG2 ARG A 123 104.525 -9.785 2.343 1.00 0.00 H new ATOM 0 HG3 ARG A 123 103.896 -8.819 3.663 1.00 0.00 H new ATOM 0 HD2 ARG A 123 101.708 -10.193 3.447 1.00 0.00 H new ATOM 0 HD3 ARG A 123 102.592 -11.265 2.380 1.00 0.00 H new ATOM 0 HE ARG A 123 102.924 -11.019 5.297 1.00 0.00 H new ATOM 0 HH11 ARG A 123 104.310 -12.018 2.225 1.00 0.00 H new ATOM 0 HH12 ARG A 123 105.410 -13.187 2.962 1.00 0.00 H new ATOM 0 HH21 ARG A 123 104.335 -12.517 6.221 1.00 0.00 H new ATOM 0 HH22 ARG A 123 105.424 -13.467 5.205 1.00 0.00 H new ATOM 1914 N PHE A 124 104.469 -8.007 -0.859 1.00 0.00 N ATOM 1915 CA PHE A 124 105.403 -8.478 -1.882 1.00 0.00 C ATOM 1916 C PHE A 124 106.583 -7.514 -2.020 1.00 0.00 C ATOM 1917 O PHE A 124 107.732 -7.940 -2.129 1.00 0.00 O ATOM 1918 CB PHE A 124 104.664 -8.624 -3.239 1.00 0.00 C ATOM 1919 CG PHE A 124 104.940 -9.985 -3.851 1.00 0.00 C ATOM 1920 CD1 PHE A 124 106.235 -10.305 -4.280 1.00 0.00 C ATOM 1921 CD2 PHE A 124 103.908 -10.923 -3.983 1.00 0.00 C ATOM 1922 CE1 PHE A 124 106.499 -11.560 -4.840 1.00 0.00 C ATOM 1923 CE2 PHE A 124 104.172 -12.179 -4.543 1.00 0.00 C ATOM 1924 CZ PHE A 124 105.467 -12.497 -4.972 1.00 0.00 C ATOM 0 H PHE A 124 103.529 -7.812 -1.203 1.00 0.00 H new ATOM 0 HA PHE A 124 105.792 -9.451 -1.581 1.00 0.00 H new ATOM 0 HB2 PHE A 124 103.592 -8.496 -3.091 1.00 0.00 H new ATOM 0 HB3 PHE A 124 104.988 -7.839 -3.922 1.00 0.00 H new ATOM 0 HD1 PHE A 124 107.031 -9.582 -4.178 1.00 0.00 H new ATOM 0 HD2 PHE A 124 102.909 -10.678 -3.653 1.00 0.00 H new ATOM 0 HE1 PHE A 124 107.498 -11.806 -5.170 1.00 0.00 H new ATOM 0 HE2 PHE A 124 103.377 -12.903 -4.644 1.00 0.00 H new ATOM 0 HZ PHE A 124 105.670 -13.466 -5.405 1.00 0.00 H new ATOM 1934 N LEU A 125 106.290 -6.218 -2.023 1.00 0.00 N ATOM 1935 CA LEU A 125 107.341 -5.215 -2.160 1.00 0.00 C ATOM 1936 C LEU A 125 108.342 -5.342 -1.011 1.00 0.00 C ATOM 1937 O LEU A 125 109.549 -5.262 -1.221 1.00 0.00 O ATOM 1938 CB LEU A 125 106.718 -3.794 -2.170 1.00 0.00 C ATOM 1939 CG LEU A 125 106.687 -3.215 -3.593 1.00 0.00 C ATOM 1940 CD1 LEU A 125 105.686 -3.995 -4.444 1.00 0.00 C ATOM 1941 CD2 LEU A 125 106.266 -1.745 -3.533 1.00 0.00 C ATOM 0 H LEU A 125 105.347 -5.840 -1.933 1.00 0.00 H new ATOM 0 HA LEU A 125 107.865 -5.378 -3.102 1.00 0.00 H new ATOM 0 HB2 LEU A 125 105.706 -3.834 -1.768 1.00 0.00 H new ATOM 0 HB3 LEU A 125 107.294 -3.136 -1.519 1.00 0.00 H new ATOM 0 HG LEU A 125 107.679 -3.295 -4.038 1.00 0.00 H new ATOM 0 HD11 LEU A 125 105.666 -3.582 -5.453 1.00 0.00 H new ATOM 0 HD12 LEU A 125 105.983 -5.043 -4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 125 104.693 -3.917 -4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 125 106.243 -1.332 -4.541 1.00 0.00 H new ATOM 0 HD22 LEU A 125 105.274 -1.668 -3.087 1.00 0.00 H new ATOM 0 HD23 LEU A 125 106.980 -1.186 -2.928 1.00 0.00 H new ATOM 1953 N ARG A 126 107.836 -5.537 0.200 1.00 0.00 N ATOM 1954 CA ARG A 126 108.709 -5.662 1.363 1.00 0.00 C ATOM 1955 C ARG A 126 109.726 -6.778 1.154 1.00 0.00 C ATOM 1956 O ARG A 126 110.930 -6.576 1.317 1.00 0.00 O ATOM 1957 CB ARG A 126 107.863 -5.975 2.603 1.00 0.00 C ATOM 1958 CG ARG A 126 108.744 -5.958 3.884 1.00 0.00 C ATOM 1959 CD ARG A 126 108.508 -4.668 4.674 1.00 0.00 C ATOM 1960 NE ARG A 126 107.131 -4.618 5.147 1.00 0.00 N ATOM 1961 CZ ARG A 126 106.672 -3.564 5.811 1.00 0.00 C ATOM 1962 NH1 ARG A 126 107.460 -2.553 6.054 1.00 0.00 N ATOM 1963 NH2 ARG A 126 105.433 -3.542 6.220 1.00 0.00 N ATOM 0 H ARG A 126 106.839 -5.611 0.403 1.00 0.00 H new ATOM 0 HA ARG A 126 109.243 -4.722 1.501 1.00 0.00 H new ATOM 0 HB2 ARG A 126 107.061 -5.243 2.697 1.00 0.00 H new ATOM 0 HB3 ARG A 126 107.392 -6.952 2.492 1.00 0.00 H new ATOM 0 HG2 ARG A 126 108.510 -6.822 4.506 1.00 0.00 H new ATOM 0 HG3 ARG A 126 109.796 -6.038 3.611 1.00 0.00 H new ATOM 0 HD2 ARG A 126 109.194 -4.619 5.520 1.00 0.00 H new ATOM 0 HD3 ARG A 126 108.717 -3.803 4.044 1.00 0.00 H new ATOM 0 HE ARG A 126 106.509 -5.406 4.965 1.00 0.00 H new ATOM 0 HH11 ARG A 126 108.428 -2.573 5.734 1.00 0.00 H new ATOM 0 HH12 ARG A 126 107.108 -1.743 6.564 1.00 0.00 H new ATOM 0 HH21 ARG A 126 104.819 -4.334 6.029 1.00 0.00 H new ATOM 0 HH22 ARG A 126 105.079 -2.733 6.730 1.00 0.00 H new ATOM 1977 N ILE A 127 109.240 -7.953 0.781 1.00 0.00 N ATOM 1978 CA ILE A 127 110.121 -9.089 0.548 1.00 0.00 C ATOM 1979 C ILE A 127 111.033 -8.800 -0.642 1.00 0.00 C ATOM 1980 O ILE A 127 112.234 -9.080 -0.609 1.00 0.00 O ATOM 1981 CB ILE A 127 109.291 -10.342 0.282 1.00 0.00 C ATOM 1982 CG1 ILE A 127 108.531 -10.716 1.557 1.00 0.00 C ATOM 1983 CG2 ILE A 127 110.216 -11.498 -0.108 1.00 0.00 C ATOM 1984 CD1 ILE A 127 107.494 -11.793 1.237 1.00 0.00 C ATOM 0 H ILE A 127 108.249 -8.145 0.634 1.00 0.00 H new ATOM 0 HA ILE A 127 110.736 -9.254 1.433 1.00 0.00 H new ATOM 0 HB ILE A 127 108.589 -10.150 -0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 127 109.226 -11.079 2.314 1.00 0.00 H new ATOM 0 HG13 ILE A 127 108.040 -9.836 1.972 1.00 0.00 H new ATOM 0 HG21 ILE A 127 109.621 -12.392 -0.297 1.00 0.00 H new ATOM 0 HG22 ILE A 127 110.770 -11.233 -1.009 1.00 0.00 H new ATOM 0 HG23 ILE A 127 110.916 -11.694 0.704 1.00 0.00 H new ATOM 0 HD11 ILE A 127 106.953 -12.059 2.145 1.00 0.00 H new ATOM 0 HD12 ILE A 127 106.792 -11.413 0.495 1.00 0.00 H new ATOM 0 HD13 ILE A 127 107.996 -12.676 0.842 1.00 0.00 H new ATOM 1996 N LEU A 128 110.448 -8.239 -1.693 1.00 0.00 N ATOM 1997 CA LEU A 128 111.201 -7.910 -2.896 1.00 0.00 C ATOM 1998 C LEU A 128 112.311 -6.922 -2.560 1.00 0.00 C ATOM 1999 O LEU A 128 113.425 -7.022 -3.076 1.00 0.00 O ATOM 2000 CB LEU A 128 110.270 -7.294 -3.946 1.00 0.00 C ATOM 2001 CG LEU A 128 111.021 -7.125 -5.304 1.00 0.00 C ATOM 2002 CD1 LEU A 128 110.433 -8.068 -6.360 1.00 0.00 C ATOM 2003 CD2 LEU A 128 110.888 -5.684 -5.807 1.00 0.00 C ATOM 0 H LEU A 128 109.457 -8.003 -1.737 1.00 0.00 H new ATOM 0 HA LEU A 128 111.640 -8.824 -3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 128 109.395 -7.929 -4.083 1.00 0.00 H new ATOM 0 HB3 LEU A 128 109.910 -6.326 -3.599 1.00 0.00 H new ATOM 0 HG LEU A 128 112.072 -7.365 -5.141 1.00 0.00 H new ATOM 0 HD11 LEU A 128 110.967 -7.938 -7.301 1.00 0.00 H new ATOM 0 HD12 LEU A 128 110.535 -9.100 -6.024 1.00 0.00 H new ATOM 0 HD13 LEU A 128 109.378 -7.837 -6.507 1.00 0.00 H new ATOM 0 HD21 LEU A 128 111.416 -5.579 -6.755 1.00 0.00 H new ATOM 0 HD22 LEU A 128 109.834 -5.444 -5.950 1.00 0.00 H new ATOM 0 HD23 LEU A 128 111.319 -5.002 -5.074 1.00 0.00 H new ATOM 2015 N LEU A 129 111.999 -5.971 -1.687 1.00 0.00 N ATOM 2016 CA LEU A 129 112.978 -4.973 -1.280 1.00 0.00 C ATOM 2017 C LEU A 129 114.164 -5.647 -0.601 1.00 0.00 C ATOM 2018 O LEU A 129 115.308 -5.238 -0.791 1.00 0.00 O ATOM 2019 CB LEU A 129 112.336 -3.956 -0.324 1.00 0.00 C ATOM 2020 CG LEU A 129 111.523 -2.919 -1.115 1.00 0.00 C ATOM 2021 CD1 LEU A 129 110.719 -2.063 -0.132 1.00 0.00 C ATOM 2022 CD2 LEU A 129 112.463 -2.021 -1.949 1.00 0.00 C ATOM 0 H LEU A 129 111.082 -5.871 -1.251 1.00 0.00 H new ATOM 0 HA LEU A 129 113.329 -4.448 -2.168 1.00 0.00 H new ATOM 0 HB2 LEU A 129 111.688 -4.472 0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.110 -3.455 0.257 1.00 0.00 H new ATOM 0 HG LEU A 129 110.846 -3.434 -1.797 1.00 0.00 H new ATOM 0 HD11 LEU A 129 110.138 -1.324 -0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 129 110.045 -2.701 0.439 1.00 0.00 H new ATOM 0 HD13 LEU A 129 111.401 -1.554 0.549 1.00 0.00 H new ATOM 0 HD21 LEU A 129 111.872 -1.292 -2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 129 113.152 -1.500 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 129 113.029 -2.637 -2.648 1.00 0.00 H new ATOM 2034 N ILE A 130 113.893 -6.677 0.192 1.00 0.00 N ATOM 2035 CA ILE A 130 114.968 -7.376 0.885 1.00 0.00 C ATOM 2036 C ILE A 130 115.930 -7.979 -0.131 1.00 0.00 C ATOM 2037 O ILE A 130 117.146 -7.881 0.021 1.00 0.00 O ATOM 2038 CB ILE A 130 114.393 -8.490 1.762 1.00 0.00 C ATOM 2039 CG1 ILE A 130 113.580 -7.858 2.891 1.00 0.00 C ATOM 2040 CG2 ILE A 130 115.531 -9.323 2.365 1.00 0.00 C ATOM 2041 CD1 ILE A 130 112.813 -8.936 3.666 1.00 0.00 C ATOM 0 H ILE A 130 112.957 -7.041 0.369 1.00 0.00 H new ATOM 0 HA ILE A 130 115.501 -6.663 1.514 1.00 0.00 H new ATOM 0 HB ILE A 130 113.759 -9.138 1.157 1.00 0.00 H new ATOM 0 HG12 ILE A 130 114.243 -7.318 3.567 1.00 0.00 H new ATOM 0 HG13 ILE A 130 112.881 -7.129 2.480 1.00 0.00 H new ATOM 0 HG21 ILE A 130 115.113 -10.114 2.988 1.00 0.00 H new ATOM 0 HG22 ILE A 130 116.121 -9.767 1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 130 116.169 -8.681 2.973 1.00 0.00 H new ATOM 0 HD11 ILE A 130 112.239 -8.470 4.467 1.00 0.00 H new ATOM 0 HD12 ILE A 130 112.135 -9.457 2.990 1.00 0.00 H new ATOM 0 HD13 ILE A 130 113.519 -9.649 4.093 1.00 0.00 H new ATOM 2053 N ILE A 131 115.383 -8.600 -1.168 1.00 0.00 N ATOM 2054 CA ILE A 131 116.225 -9.210 -2.191 1.00 0.00 C ATOM 2055 C ILE A 131 117.054 -8.141 -2.905 1.00 0.00 C ATOM 2056 O ILE A 131 118.255 -8.317 -3.116 1.00 0.00 O ATOM 2057 CB ILE A 131 115.354 -9.947 -3.213 1.00 0.00 C ATOM 2058 CG1 ILE A 131 114.401 -10.910 -2.486 1.00 0.00 C ATOM 2059 CG2 ILE A 131 116.245 -10.740 -4.174 1.00 0.00 C ATOM 2060 CD1 ILE A 131 115.178 -11.814 -1.524 1.00 0.00 C ATOM 0 H ILE A 131 114.379 -8.695 -1.323 1.00 0.00 H new ATOM 0 HA ILE A 131 116.898 -9.919 -1.709 1.00 0.00 H new ATOM 0 HB ILE A 131 114.771 -9.218 -3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 131 113.652 -10.342 -1.934 1.00 0.00 H new ATOM 0 HG13 ILE A 131 113.866 -11.520 -3.214 1.00 0.00 H new ATOM 0 HG21 ILE A 131 115.622 -11.263 -4.900 1.00 0.00 H new ATOM 0 HG22 ILE A 131 116.915 -10.057 -4.696 1.00 0.00 H new ATOM 0 HG23 ILE A 131 116.833 -11.465 -3.611 1.00 0.00 H new ATOM 0 HD11 ILE A 131 114.486 -12.488 -1.019 1.00 0.00 H new ATOM 0 HD12 ILE A 131 115.910 -12.397 -2.083 1.00 0.00 H new ATOM 0 HD13 ILE A 131 115.692 -11.201 -0.784 1.00 0.00 H new ATOM 2072 N SER A 132 116.412 -7.035 -3.272 1.00 0.00 N ATOM 2073 CA SER A 132 117.110 -5.949 -3.959 1.00 0.00 C ATOM 2074 C SER A 132 118.126 -5.283 -3.028 1.00 0.00 C ATOM 2075 O SER A 132 119.247 -4.973 -3.433 1.00 0.00 O ATOM 2076 CB SER A 132 116.104 -4.906 -4.456 1.00 0.00 C ATOM 2077 OG SER A 132 116.701 -4.136 -5.492 1.00 0.00 O ATOM 0 H SER A 132 115.419 -6.867 -3.108 1.00 0.00 H new ATOM 0 HA SER A 132 117.642 -6.371 -4.812 1.00 0.00 H new ATOM 0 HB2 SER A 132 115.204 -5.398 -4.825 1.00 0.00 H new ATOM 0 HB3 SER A 132 115.799 -4.258 -3.635 1.00 0.00 H new ATOM 0 HG SER A 132 116.060 -3.468 -5.814 1.00 0.00 H new ATOM 2083 N ARG A 133 117.714 -5.053 -1.783 1.00 0.00 N ATOM 2084 CA ARG A 133 118.581 -4.410 -0.801 1.00 0.00 C ATOM 2085 C ARG A 133 119.784 -5.298 -0.491 1.00 0.00 C ATOM 2086 O ARG A 133 120.908 -4.815 -0.359 1.00 0.00 O ATOM 2087 CB ARG A 133 117.797 -4.120 0.487 1.00 0.00 C ATOM 2088 CG ARG A 133 118.576 -3.119 1.343 1.00 0.00 C ATOM 2089 CD ARG A 133 117.743 -2.735 2.565 1.00 0.00 C ATOM 2090 NE ARG A 133 118.320 -1.569 3.221 1.00 0.00 N ATOM 2091 CZ ARG A 133 117.770 -1.056 4.314 1.00 0.00 C ATOM 2092 NH1 ARG A 133 116.729 -1.633 4.850 1.00 0.00 N ATOM 2093 NH2 ARG A 133 118.279 0.014 4.862 1.00 0.00 N ATOM 0 H ARG A 133 116.789 -5.302 -1.432 1.00 0.00 H new ATOM 0 HA ARG A 133 118.939 -3.469 -1.218 1.00 0.00 H new ATOM 0 HB2 ARG A 133 116.813 -3.719 0.244 1.00 0.00 H new ATOM 0 HB3 ARG A 133 117.636 -5.043 1.044 1.00 0.00 H new ATOM 0 HG2 ARG A 133 119.524 -3.555 1.658 1.00 0.00 H new ATOM 0 HG3 ARG A 133 118.813 -2.231 0.757 1.00 0.00 H new ATOM 0 HD2 ARG A 133 116.718 -2.521 2.263 1.00 0.00 H new ATOM 0 HD3 ARG A 133 117.702 -3.571 3.263 1.00 0.00 H new ATOM 0 HE ARG A 133 119.160 -1.140 2.834 1.00 0.00 H new ATOM 0 HH11 ARG A 133 116.340 -2.477 4.429 1.00 0.00 H new ATOM 0 HH12 ARG A 133 116.305 -1.240 5.690 1.00 0.00 H new ATOM 0 HH21 ARG A 133 119.100 0.457 4.450 1.00 0.00 H new ATOM 0 HH22 ARG A 133 117.855 0.407 5.702 1.00 0.00 H new ATOM 2107 N GLY A 134 119.535 -6.601 -0.380 1.00 0.00 N ATOM 2108 CA GLY A 134 120.597 -7.560 -0.089 1.00 0.00 C ATOM 2109 C GLY A 134 121.708 -7.476 -1.130 1.00 0.00 C ATOM 2110 O GLY A 134 122.852 -7.845 -0.862 1.00 0.00 O ATOM 0 H GLY A 134 118.609 -7.016 -0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 134 121.007 -7.365 0.902 1.00 0.00 H new ATOM 0 HA3 GLY A 134 120.186 -8.569 -0.071 1.00 0.00 H new ATOM 2114 N SER A 135 121.360 -6.992 -2.318 1.00 0.00 N ATOM 2115 CA SER A 135 122.333 -6.863 -3.396 1.00 0.00 C ATOM 2116 C SER A 135 123.549 -6.076 -2.922 1.00 0.00 C ATOM 2117 O SER A 135 124.666 -6.307 -3.382 1.00 0.00 O ATOM 2118 CB SER A 135 121.699 -6.149 -4.591 1.00 0.00 C ATOM 2119 OG SER A 135 120.502 -6.821 -4.960 1.00 0.00 O ATOM 0 H SER A 135 120.417 -6.684 -2.557 1.00 0.00 H new ATOM 0 HA SER A 135 122.650 -7.862 -3.696 1.00 0.00 H new ATOM 0 HB2 SER A 135 121.483 -5.111 -4.336 1.00 0.00 H new ATOM 0 HB3 SER A 135 122.394 -6.133 -5.430 1.00 0.00 H new ATOM 0 HG SER A 135 119.731 -6.341 -4.592 1.00 0.00 H new ATOM 2125 N LYS A 136 123.320 -5.139 -2.007 1.00 0.00 N ATOM 2126 CA LYS A 136 124.402 -4.316 -1.486 1.00 0.00 C ATOM 2127 C LYS A 136 125.453 -5.187 -0.810 1.00 0.00 C ATOM 2128 O LYS A 136 126.649 -5.034 -1.053 1.00 0.00 O ATOM 2129 CB LYS A 136 123.852 -3.317 -0.464 1.00 0.00 C ATOM 2130 CG LYS A 136 122.937 -2.312 -1.165 1.00 0.00 C ATOM 2131 CD LYS A 136 122.407 -1.304 -0.141 1.00 0.00 C ATOM 2132 CE LYS A 136 121.490 -0.299 -0.840 1.00 0.00 C ATOM 2133 NZ LYS A 136 121.014 0.711 0.146 1.00 0.00 N ATOM 0 H LYS A 136 122.401 -4.933 -1.614 1.00 0.00 H new ATOM 0 HA LYS A 136 124.858 -3.780 -2.319 1.00 0.00 H new ATOM 0 HB2 LYS A 136 123.300 -3.845 0.314 1.00 0.00 H new ATOM 0 HB3 LYS A 136 124.673 -2.795 0.027 1.00 0.00 H new ATOM 0 HG2 LYS A 136 123.484 -1.793 -1.952 1.00 0.00 H new ATOM 0 HG3 LYS A 136 122.107 -2.832 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 136 121.861 -1.823 0.647 1.00 0.00 H new ATOM 0 HD3 LYS A 136 123.238 -0.784 0.336 1.00 0.00 H new ATOM 0 HE2 LYS A 136 122.025 0.194 -1.652 1.00 0.00 H new ATOM 0 HE3 LYS A 136 120.640 -0.816 -1.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 120.351 1.364 -0.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 120.533 0.229 0.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 121.826 1.247 0.514 1.00 0.00 H new ATOM 2147 N PHE A 137 124.998 -6.110 0.031 1.00 0.00 N ATOM 2148 CA PHE A 137 125.917 -7.003 0.723 1.00 0.00 C ATOM 2149 C PHE A 137 126.671 -7.866 -0.277 1.00 0.00 C ATOM 2150 O PHE A 137 127.888 -7.997 -0.198 1.00 0.00 O ATOM 2151 CB PHE A 137 125.152 -7.902 1.696 1.00 0.00 C ATOM 2152 CG PHE A 137 126.132 -8.754 2.474 1.00 0.00 C ATOM 2153 CD1 PHE A 137 126.851 -8.197 3.540 1.00 0.00 C ATOM 2154 CD2 PHE A 137 126.319 -10.100 2.133 1.00 0.00 C ATOM 2155 CE1 PHE A 137 127.755 -8.986 4.263 1.00 0.00 C ATOM 2156 CE2 PHE A 137 127.222 -10.889 2.858 1.00 0.00 C ATOM 2157 CZ PHE A 137 127.940 -10.331 3.923 1.00 0.00 C ATOM 0 H PHE A 137 124.012 -6.258 0.247 1.00 0.00 H new ATOM 0 HA PHE A 137 126.630 -6.395 1.280 1.00 0.00 H new ATOM 0 HB2 PHE A 137 124.560 -7.294 2.380 1.00 0.00 H new ATOM 0 HB3 PHE A 137 124.455 -8.538 1.149 1.00 0.00 H new ATOM 0 HD1 PHE A 137 126.708 -7.160 3.804 1.00 0.00 H new ATOM 0 HD2 PHE A 137 125.767 -10.530 1.311 1.00 0.00 H new ATOM 0 HE1 PHE A 137 128.310 -8.556 5.084 1.00 0.00 H new ATOM 0 HE2 PHE A 137 127.364 -11.927 2.596 1.00 0.00 H new ATOM 0 HZ PHE A 137 128.636 -10.938 4.482 1.00 0.00 H new ATOM 2167 N LEU A 138 125.942 -8.450 -1.224 1.00 0.00 N ATOM 2168 CA LEU A 138 126.565 -9.302 -2.232 1.00 0.00 C ATOM 2169 C LEU A 138 127.562 -8.497 -3.061 1.00 0.00 C ATOM 2170 O LEU A 138 128.654 -8.975 -3.364 1.00 0.00 O ATOM 2171 CB LEU A 138 125.493 -9.928 -3.152 1.00 0.00 C ATOM 2172 CG LEU A 138 124.888 -11.195 -2.517 1.00 0.00 C ATOM 2173 CD1 LEU A 138 123.958 -10.824 -1.359 1.00 0.00 C ATOM 2174 CD2 LEU A 138 124.084 -11.952 -3.574 1.00 0.00 C ATOM 0 H LEU A 138 124.931 -8.351 -1.315 1.00 0.00 H new ATOM 0 HA LEU A 138 127.097 -10.105 -1.722 1.00 0.00 H new ATOM 0 HB2 LEU A 138 124.704 -9.201 -3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 138 125.937 -10.177 -4.116 1.00 0.00 H new ATOM 0 HG LEU A 138 125.698 -11.818 -2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 138 123.540 -11.731 -0.923 1.00 0.00 H new ATOM 0 HD12 LEU A 138 124.521 -10.282 -0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 138 123.149 -10.194 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 138 123.654 -12.850 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 138 123.284 -11.313 -3.949 1.00 0.00 H new ATOM 0 HD23 LEU A 138 124.740 -12.233 -4.398 1.00 0.00 H new ATOM 2186 N SER A 139 127.186 -7.274 -3.422 1.00 0.00 N ATOM 2187 CA SER A 139 128.067 -6.422 -4.212 1.00 0.00 C ATOM 2188 C SER A 139 129.375 -6.163 -3.463 1.00 0.00 C ATOM 2189 O SER A 139 130.452 -6.164 -4.062 1.00 0.00 O ATOM 2190 CB SER A 139 127.370 -5.098 -4.524 1.00 0.00 C ATOM 2191 OG SER A 139 126.275 -5.340 -5.397 1.00 0.00 O ATOM 0 H SER A 139 126.287 -6.855 -3.183 1.00 0.00 H new ATOM 0 HA SER A 139 128.299 -6.932 -5.147 1.00 0.00 H new ATOM 0 HB2 SER A 139 127.020 -4.632 -3.603 1.00 0.00 H new ATOM 0 HB3 SER A 139 128.072 -4.404 -4.986 1.00 0.00 H new ATOM 0 HG SER A 139 125.526 -5.713 -4.887 1.00 0.00 H new ATOM 2197 N ALA A 140 129.271 -5.935 -2.155 1.00 0.00 N ATOM 2198 CA ALA A 140 130.452 -5.669 -1.331 1.00 0.00 C ATOM 2199 C ALA A 140 131.451 -6.823 -1.400 1.00 0.00 C ATOM 2200 O ALA A 140 132.633 -6.610 -1.670 1.00 0.00 O ATOM 2201 CB ALA A 140 130.033 -5.455 0.123 1.00 0.00 C ATOM 0 H ALA A 140 128.388 -5.929 -1.644 1.00 0.00 H new ATOM 0 HA ALA A 140 130.933 -4.771 -1.718 1.00 0.00 H new ATOM 0 HB1 ALA A 140 130.916 -5.258 0.731 1.00 0.00 H new ATOM 0 HB2 ALA A 140 129.353 -4.605 0.184 1.00 0.00 H new ATOM 0 HB3 ALA A 140 129.531 -6.349 0.492 1.00 0.00 H new ATOM 2207 N ILE A 141 130.972 -8.044 -1.164 1.00 0.00 N ATOM 2208 CA ILE A 141 131.847 -9.215 -1.219 1.00 0.00 C ATOM 2209 C ILE A 141 132.386 -9.399 -2.633 1.00 0.00 C ATOM 2210 O ILE A 141 133.573 -9.669 -2.820 1.00 0.00 O ATOM 2211 CB ILE A 141 131.087 -10.480 -0.752 1.00 0.00 C ATOM 2212 CG1 ILE A 141 131.066 -10.546 0.784 1.00 0.00 C ATOM 2213 CG2 ILE A 141 131.756 -11.752 -1.296 1.00 0.00 C ATOM 2214 CD1 ILE A 141 130.544 -9.237 1.367 1.00 0.00 C ATOM 0 H ILE A 141 129.999 -8.247 -0.936 1.00 0.00 H new ATOM 0 HA ILE A 141 132.689 -9.058 -0.545 1.00 0.00 H new ATOM 0 HB ILE A 141 130.068 -10.420 -1.135 1.00 0.00 H new ATOM 0 HG12 ILE A 141 130.435 -11.373 1.110 1.00 0.00 H new ATOM 0 HG13 ILE A 141 132.070 -10.743 1.159 1.00 0.00 H new ATOM 0 HG21 ILE A 141 131.204 -12.628 -0.955 1.00 0.00 H new ATOM 0 HG22 ILE A 141 131.756 -11.725 -2.386 1.00 0.00 H new ATOM 0 HG23 ILE A 141 132.783 -11.806 -0.934 1.00 0.00 H new ATOM 0 HD11 ILE A 141 130.536 -9.301 2.455 1.00 0.00 H new ATOM 0 HD12 ILE A 141 131.191 -8.417 1.057 1.00 0.00 H new ATOM 0 HD13 ILE A 141 129.531 -9.056 1.007 1.00 0.00 H new