USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 986 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 Single : A 45 LYS NZ :NH3+ 176:sc= 0.668 (180deg=0.658) USER MOD Single : A 48 MET CE :methyl -168:sc= -1.63 (180deg=-2.08) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -130:sc= -2.26! (180deg=-4.89!) USER MOD Single : A 74 LYS NZ :NH3+ -105:sc= -0.463! (180deg=-4.14!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 1.09 K(o=1.1,f=-0.33) USER MOD Single : A 86 LYS NZ :NH3+ 130:sc= -0.395 (180deg=-0.723) USER MOD Single : A 91 MET CE :methyl -103:sc= -1.15 (180deg=-2.96!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= -1.89 X(o=-1.9,f=-1.7) USER MOD Single : B 45 LYS NZ :NH3+ 177:sc= 0.562 (180deg=0.557) USER MOD Single : B 48 MET CE :methyl -168:sc= -1.5 (180deg=-2.14) USER MOD Single : B 58 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 154:sc= -2.14! (180deg=-3.82!) USER MOD Single : B 74 LYS NZ :NH3+ -111:sc= -0.485! (180deg=-4.36!) USER MOD Single : B 75 SER OG : rot 180:sc= 0 USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= 1.09 K(o=1.1,f=-0.32) USER MOD Single : B 86 LYS NZ :NH3+ 159:sc= -0.444 (180deg=-0.786) USER MOD Single : B 91 MET CE :methyl 138:sc= -1.5 (180deg=-3.24!) USER MOD Single : B 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 96 ASN : amide:sc= -1.92! X(o=-1.9!,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 357 N PRO A 43 -2.022 -18.570 -6.897 1.00 0.40 N ATOM 358 CA PRO A 43 -1.637 -17.892 -5.643 1.00 0.40 C ATOM 359 C PRO A 43 -2.440 -16.599 -5.466 1.00 0.36 C ATOM 360 O PRO A 43 -2.968 -16.327 -4.404 1.00 0.41 O ATOM 361 CB PRO A 43 -0.158 -17.586 -5.851 1.00 0.45 C ATOM 362 CG PRO A 43 0.040 -17.518 -7.337 1.00 0.46 C ATOM 363 CD PRO A 43 -1.133 -18.202 -8.004 1.00 0.45 C ATOM 0 HA PRO A 43 -1.827 -18.491 -4.752 1.00 0.40 H new ATOM 0 HB2 PRO A 43 0.117 -16.644 -5.376 1.00 0.45 H new ATOM 0 HB3 PRO A 43 0.468 -18.361 -5.408 1.00 0.45 H new ATOM 0 HG2 PRO A 43 0.110 -16.480 -7.664 1.00 0.46 H new ATOM 0 HG3 PRO A 43 0.974 -18.005 -7.618 1.00 0.46 H new ATOM 0 HD2 PRO A 43 -1.632 -17.537 -8.709 1.00 0.45 H new ATOM 0 HD3 PRO A 43 -0.814 -19.080 -8.565 1.00 0.45 H new ATOM 371 N LEU A 44 -2.531 -15.803 -6.504 1.00 0.35 N ATOM 372 CA LEU A 44 -3.291 -14.517 -6.424 1.00 0.35 C ATOM 373 C LEU A 44 -2.771 -13.651 -5.275 1.00 0.33 C ATOM 374 O LEU A 44 -3.469 -12.795 -4.765 1.00 0.38 O ATOM 375 CB LEU A 44 -4.746 -14.912 -6.177 1.00 0.39 C ATOM 376 CG LEU A 44 -5.648 -13.719 -6.507 1.00 0.42 C ATOM 377 CD1 LEU A 44 -6.776 -14.171 -7.437 1.00 0.51 C ATOM 378 CD2 LEU A 44 -6.247 -13.148 -5.217 1.00 0.47 C ATOM 0 H LEU A 44 -2.107 -15.992 -7.412 1.00 0.35 H new ATOM 0 HA LEU A 44 -3.180 -13.931 -7.336 1.00 0.35 H new ATOM 0 HB2 LEU A 44 -5.014 -15.769 -6.795 1.00 0.39 H new ATOM 0 HB3 LEU A 44 -4.884 -15.212 -5.138 1.00 0.39 H new ATOM 0 HG LEU A 44 -5.056 -12.948 -7.001 1.00 0.42 H new ATOM 0 HD11 LEU A 44 -7.417 -13.321 -7.671 1.00 0.51 H new ATOM 0 HD12 LEU A 44 -6.351 -14.569 -8.358 1.00 0.51 H new ATOM 0 HD13 LEU A 44 -7.365 -14.945 -6.945 1.00 0.51 H new ATOM 0 HD21 LEU A 44 -6.888 -12.300 -5.458 1.00 0.47 H new ATOM 0 HD22 LEU A 44 -6.836 -13.917 -4.718 1.00 0.47 H new ATOM 0 HD23 LEU A 44 -5.444 -12.820 -4.557 1.00 0.47 H new ATOM 390 N LYS A 45 -1.548 -13.864 -4.873 1.00 0.32 N ATOM 391 CA LYS A 45 -0.965 -13.054 -3.762 1.00 0.32 C ATOM 392 C LYS A 45 -0.060 -11.956 -4.333 1.00 0.30 C ATOM 393 O LYS A 45 0.301 -11.023 -3.646 1.00 0.32 O ATOM 394 CB LYS A 45 -0.155 -14.048 -2.922 1.00 0.37 C ATOM 395 CG LYS A 45 1.070 -14.527 -3.711 1.00 0.42 C ATOM 396 CD LYS A 45 1.885 -15.504 -2.857 1.00 0.42 C ATOM 397 CE LYS A 45 1.958 -16.863 -3.558 1.00 0.42 C ATOM 398 NZ LYS A 45 3.249 -17.457 -3.111 1.00 0.38 N ATOM 0 H LYS A 45 -0.923 -14.567 -5.267 1.00 0.32 H new ATOM 0 HA LYS A 45 -1.729 -12.556 -3.166 1.00 0.32 H new ATOM 0 HB2 LYS A 45 0.163 -13.576 -1.992 1.00 0.37 H new ATOM 0 HB3 LYS A 45 -0.779 -14.900 -2.650 1.00 0.37 H new ATOM 0 HG2 LYS A 45 0.753 -15.013 -4.634 1.00 0.42 H new ATOM 0 HG3 LYS A 45 1.687 -13.675 -3.995 1.00 0.42 H new ATOM 0 HD2 LYS A 45 2.889 -15.112 -2.697 1.00 0.42 H new ATOM 0 HD3 LYS A 45 1.426 -15.615 -1.875 1.00 0.42 H new ATOM 0 HE2 LYS A 45 1.115 -17.496 -3.281 1.00 0.42 H new ATOM 0 HE3 LYS A 45 1.929 -16.750 -4.642 1.00 0.42 H new ATOM 0 HZ1 LYS A 45 3.340 -18.419 -3.496 1.00 0.38 H new ATOM 0 HZ2 LYS A 45 4.037 -16.871 -3.453 1.00 0.38 H new ATOM 0 HZ3 LYS A 45 3.272 -17.496 -2.072 1.00 0.38 H new ATOM 412 N LEU A 46 0.307 -12.073 -5.586 1.00 0.31 N ATOM 413 CA LEU A 46 1.192 -11.050 -6.226 1.00 0.31 C ATOM 414 C LEU A 46 0.615 -9.640 -6.033 1.00 0.31 C ATOM 415 O LEU A 46 1.346 -8.683 -5.845 1.00 0.33 O ATOM 416 CB LEU A 46 1.215 -11.424 -7.714 1.00 0.35 C ATOM 417 CG LEU A 46 2.665 -11.551 -8.197 1.00 0.41 C ATOM 418 CD1 LEU A 46 2.925 -12.983 -8.671 1.00 0.52 C ATOM 419 CD2 LEU A 46 2.905 -10.584 -9.359 1.00 0.46 C ATOM 0 H LEU A 46 0.029 -12.840 -6.198 1.00 0.31 H new ATOM 0 HA LEU A 46 2.191 -11.040 -5.789 1.00 0.31 H new ATOM 0 HB2 LEU A 46 0.687 -12.365 -7.870 1.00 0.35 H new ATOM 0 HB3 LEU A 46 0.693 -10.665 -8.297 1.00 0.35 H new ATOM 0 HG LEU A 46 3.339 -11.310 -7.375 1.00 0.41 H new ATOM 0 HD11 LEU A 46 3.956 -13.071 -9.014 1.00 0.52 H new ATOM 0 HD12 LEU A 46 2.756 -13.676 -7.846 1.00 0.52 H new ATOM 0 HD13 LEU A 46 2.248 -13.223 -9.491 1.00 0.52 H new ATOM 0 HD21 LEU A 46 3.936 -10.675 -9.701 1.00 0.46 H new ATOM 0 HD22 LEU A 46 2.228 -10.825 -10.179 1.00 0.46 H new ATOM 0 HD23 LEU A 46 2.722 -9.562 -9.026 1.00 0.46 H new ATOM 431 N PHE A 47 -0.690 -9.508 -6.056 1.00 0.31 N ATOM 432 CA PHE A 47 -1.309 -8.165 -5.860 1.00 0.32 C ATOM 433 C PHE A 47 -1.324 -7.847 -4.371 1.00 0.31 C ATOM 434 O PHE A 47 -1.004 -6.751 -3.951 1.00 0.32 O ATOM 435 CB PHE A 47 -2.736 -8.287 -6.409 1.00 0.34 C ATOM 436 CG PHE A 47 -3.569 -7.125 -5.916 1.00 0.31 C ATOM 437 CD1 PHE A 47 -3.113 -5.812 -6.090 1.00 0.37 C ATOM 438 CD2 PHE A 47 -4.790 -7.362 -5.272 1.00 0.35 C ATOM 439 CE1 PHE A 47 -3.878 -4.738 -5.622 1.00 0.42 C ATOM 440 CE2 PHE A 47 -5.554 -6.288 -4.802 1.00 0.42 C ATOM 441 CZ PHE A 47 -5.098 -4.976 -4.978 1.00 0.43 C ATOM 0 H PHE A 47 -1.349 -10.272 -6.202 1.00 0.31 H new ATOM 0 HA PHE A 47 -0.765 -7.367 -6.366 1.00 0.32 H new ATOM 0 HB2 PHE A 47 -2.718 -8.298 -7.499 1.00 0.34 H new ATOM 0 HB3 PHE A 47 -3.181 -9.229 -6.088 1.00 0.34 H new ATOM 0 HD1 PHE A 47 -2.171 -5.629 -6.585 1.00 0.37 H new ATOM 0 HD2 PHE A 47 -5.142 -8.374 -5.138 1.00 0.35 H new ATOM 0 HE1 PHE A 47 -3.527 -3.726 -5.758 1.00 0.42 H new ATOM 0 HE2 PHE A 47 -6.495 -6.471 -4.304 1.00 0.42 H new ATOM 0 HZ PHE A 47 -5.688 -4.147 -4.617 1.00 0.43 H new ATOM 451 N MET A 48 -1.685 -8.815 -3.575 1.00 0.33 N ATOM 452 CA MET A 48 -1.716 -8.610 -2.103 1.00 0.34 C ATOM 453 C MET A 48 -0.327 -8.206 -1.618 1.00 0.32 C ATOM 454 O MET A 48 -0.164 -7.218 -0.932 1.00 0.37 O ATOM 455 CB MET A 48 -2.110 -9.971 -1.532 1.00 0.38 C ATOM 456 CG MET A 48 -2.970 -9.769 -0.288 1.00 0.50 C ATOM 457 SD MET A 48 -4.708 -10.094 -0.681 1.00 0.60 S ATOM 458 CE MET A 48 -4.846 -8.943 -2.070 1.00 0.54 C ATOM 0 H MET A 48 -1.962 -9.746 -3.886 1.00 0.33 H new ATOM 0 HA MET A 48 -2.408 -7.825 -1.796 1.00 0.34 H new ATOM 0 HB2 MET A 48 -2.659 -10.545 -2.278 1.00 0.38 H new ATOM 0 HB3 MET A 48 -1.218 -10.545 -1.281 1.00 0.38 H new ATOM 0 HG2 MET A 48 -2.637 -10.436 0.507 1.00 0.50 H new ATOM 0 HG3 MET A 48 -2.856 -8.750 0.082 1.00 0.50 H new ATOM 0 HE1 MET A 48 -5.896 -8.819 -2.337 1.00 0.54 H new ATOM 0 HE2 MET A 48 -4.428 -7.978 -1.785 1.00 0.54 H new ATOM 0 HE3 MET A 48 -4.298 -9.338 -2.926 1.00 0.54 H new ATOM 468 N ALA A 49 0.672 -8.963 -1.991 1.00 0.31 N ATOM 469 CA ALA A 49 2.069 -8.640 -1.579 1.00 0.33 C ATOM 470 C ALA A 49 2.443 -7.237 -2.059 1.00 0.32 C ATOM 471 O ALA A 49 3.019 -6.456 -1.325 1.00 0.36 O ATOM 472 CB ALA A 49 2.938 -9.691 -2.273 1.00 0.37 C ATOM 0 H ALA A 49 0.578 -9.798 -2.569 1.00 0.31 H new ATOM 0 HA ALA A 49 2.198 -8.655 -0.497 1.00 0.33 H new ATOM 0 HB1 ALA A 49 3.985 -9.522 -2.020 1.00 0.37 H new ATOM 0 HB2 ALA A 49 2.640 -10.686 -1.941 1.00 0.37 H new ATOM 0 HB3 ALA A 49 2.809 -9.615 -3.353 1.00 0.37 H new ATOM 478 N LEU A 50 2.120 -6.913 -3.289 1.00 0.32 N ATOM 479 CA LEU A 50 2.458 -5.558 -3.820 1.00 0.34 C ATOM 480 C LEU A 50 1.825 -4.467 -2.948 1.00 0.31 C ATOM 481 O LEU A 50 2.521 -3.662 -2.351 1.00 0.33 O ATOM 482 CB LEU A 50 1.878 -5.523 -5.234 1.00 0.41 C ATOM 483 CG LEU A 50 2.588 -4.442 -6.052 1.00 0.53 C ATOM 484 CD1 LEU A 50 4.077 -4.778 -6.166 1.00 0.95 C ATOM 485 CD2 LEU A 50 1.972 -4.378 -7.452 1.00 0.98 C ATOM 0 H LEU A 50 1.638 -7.528 -3.945 1.00 0.32 H new ATOM 0 HA LEU A 50 3.533 -5.376 -3.819 1.00 0.34 H new ATOM 0 HB2 LEU A 50 2.000 -6.495 -5.712 1.00 0.41 H new ATOM 0 HB3 LEU A 50 0.808 -5.320 -5.194 1.00 0.41 H new ATOM 0 HG LEU A 50 2.472 -3.478 -5.557 1.00 0.53 H new ATOM 0 HD11 LEU A 50 4.580 -4.007 -6.749 1.00 0.95 H new ATOM 0 HD12 LEU A 50 4.517 -4.825 -5.170 1.00 0.95 H new ATOM 0 HD13 LEU A 50 4.196 -5.742 -6.661 1.00 0.95 H new ATOM 0 HD21 LEU A 50 2.476 -3.609 -8.037 1.00 0.98 H new ATOM 0 HD22 LEU A 50 2.088 -5.343 -7.945 1.00 0.98 H new ATOM 0 HD23 LEU A 50 0.912 -4.137 -7.372 1.00 0.98 H new ATOM 497 N VAL A 51 0.515 -4.431 -2.864 1.00 0.32 N ATOM 498 CA VAL A 51 -0.147 -3.393 -2.031 1.00 0.32 C ATOM 499 C VAL A 51 0.295 -3.536 -0.570 1.00 0.30 C ATOM 500 O VAL A 51 0.455 -2.555 0.127 1.00 0.34 O ATOM 501 CB VAL A 51 -1.650 -3.638 -2.192 1.00 0.33 C ATOM 502 CG1 VAL A 51 -2.415 -2.666 -1.306 1.00 0.39 C ATOM 503 CG2 VAL A 51 -2.046 -3.417 -3.655 1.00 0.39 C ATOM 0 H VAL A 51 -0.117 -5.077 -3.337 1.00 0.32 H new ATOM 0 HA VAL A 51 0.117 -2.381 -2.337 1.00 0.32 H new ATOM 0 HB VAL A 51 -1.889 -4.661 -1.902 1.00 0.33 H new ATOM 0 HG11 VAL A 51 -3.486 -2.837 -1.418 1.00 0.39 H new ATOM 0 HG12 VAL A 51 -2.130 -2.820 -0.265 1.00 0.39 H new ATOM 0 HG13 VAL A 51 -2.179 -1.643 -1.599 1.00 0.39 H new ATOM 0 HG21 VAL A 51 -3.116 -3.591 -3.773 1.00 0.39 H new ATOM 0 HG22 VAL A 51 -1.811 -2.393 -3.945 1.00 0.39 H new ATOM 0 HG23 VAL A 51 -1.494 -4.110 -4.290 1.00 0.39 H new ATOM 513 N ALA A 52 0.513 -4.745 -0.108 1.00 0.29 N ATOM 514 CA ALA A 52 0.967 -4.936 1.306 1.00 0.29 C ATOM 515 C ALA A 52 2.328 -4.268 1.497 1.00 0.29 C ATOM 516 O ALA A 52 2.522 -3.480 2.406 1.00 0.33 O ATOM 517 CB ALA A 52 1.087 -6.448 1.500 1.00 0.33 C ATOM 0 H ALA A 52 0.397 -5.604 -0.646 1.00 0.29 H new ATOM 0 HA ALA A 52 0.276 -4.496 2.025 1.00 0.29 H new ATOM 0 HB1 ALA A 52 1.417 -6.659 2.517 1.00 0.33 H new ATOM 0 HB2 ALA A 52 0.117 -6.915 1.328 1.00 0.33 H new ATOM 0 HB3 ALA A 52 1.813 -6.849 0.793 1.00 0.33 H new ATOM 523 N PHE A 53 3.265 -4.572 0.630 1.00 0.29 N ATOM 524 CA PHE A 53 4.626 -3.957 0.721 1.00 0.32 C ATOM 525 C PHE A 53 4.488 -2.440 0.867 1.00 0.31 C ATOM 526 O PHE A 53 4.922 -1.849 1.846 1.00 0.33 O ATOM 527 CB PHE A 53 5.299 -4.318 -0.607 1.00 0.38 C ATOM 528 CG PHE A 53 6.667 -3.683 -0.687 1.00 0.44 C ATOM 529 CD1 PHE A 53 7.568 -3.822 0.374 1.00 0.59 C ATOM 530 CD2 PHE A 53 7.032 -2.957 -1.826 1.00 0.57 C ATOM 531 CE1 PHE A 53 8.836 -3.233 0.296 1.00 0.77 C ATOM 532 CE2 PHE A 53 8.300 -2.369 -1.905 1.00 0.73 C ATOM 533 CZ PHE A 53 9.202 -2.507 -0.844 1.00 0.80 C ATOM 0 H PHE A 53 3.143 -5.226 -0.143 1.00 0.29 H new ATOM 0 HA PHE A 53 5.202 -4.311 1.576 1.00 0.32 H new ATOM 0 HB2 PHE A 53 5.387 -5.401 -0.696 1.00 0.38 H new ATOM 0 HB3 PHE A 53 4.683 -3.978 -1.440 1.00 0.38 H new ATOM 0 HD1 PHE A 53 7.286 -4.383 1.253 1.00 0.59 H new ATOM 0 HD2 PHE A 53 6.335 -2.850 -2.644 1.00 0.57 H new ATOM 0 HE1 PHE A 53 9.532 -3.339 1.115 1.00 0.77 H new ATOM 0 HE2 PHE A 53 8.582 -1.809 -2.784 1.00 0.73 H new ATOM 0 HZ PHE A 53 10.180 -2.054 -0.904 1.00 0.80 H new ATOM 543 N LEU A 54 3.856 -1.813 -0.089 1.00 0.32 N ATOM 544 CA LEU A 54 3.654 -0.342 -0.006 1.00 0.34 C ATOM 545 C LEU A 54 2.859 -0.018 1.261 1.00 0.32 C ATOM 546 O LEU A 54 3.121 0.957 1.932 1.00 0.34 O ATOM 547 CB LEU A 54 2.861 0.026 -1.264 1.00 0.40 C ATOM 548 CG LEU A 54 3.818 0.242 -2.443 1.00 0.46 C ATOM 549 CD1 LEU A 54 4.774 1.395 -2.130 1.00 0.54 C ATOM 550 CD2 LEU A 54 4.628 -1.034 -2.692 1.00 0.51 C ATOM 0 H LEU A 54 3.472 -2.258 -0.923 1.00 0.32 H new ATOM 0 HA LEU A 54 4.589 0.215 0.045 1.00 0.34 H new ATOM 0 HB2 LEU A 54 2.151 -0.767 -1.501 1.00 0.40 H new ATOM 0 HB3 LEU A 54 2.280 0.931 -1.086 1.00 0.40 H new ATOM 0 HG LEU A 54 3.237 0.484 -3.333 1.00 0.46 H new ATOM 0 HD11 LEU A 54 5.452 1.544 -2.971 1.00 0.54 H new ATOM 0 HD12 LEU A 54 4.201 2.307 -1.959 1.00 0.54 H new ATOM 0 HD13 LEU A 54 5.351 1.157 -1.237 1.00 0.54 H new ATOM 0 HD21 LEU A 54 5.307 -0.876 -3.530 1.00 0.51 H new ATOM 0 HD22 LEU A 54 5.204 -1.279 -1.800 1.00 0.51 H new ATOM 0 HD23 LEU A 54 3.950 -1.856 -2.923 1.00 0.51 H new ATOM 562 N ARG A 55 1.904 -0.852 1.600 1.00 0.31 N ATOM 563 CA ARG A 55 1.093 -0.618 2.835 1.00 0.32 C ATOM 564 C ARG A 55 1.927 -0.906 4.090 1.00 0.31 C ATOM 565 O ARG A 55 1.469 -0.716 5.202 1.00 0.39 O ATOM 566 CB ARG A 55 -0.087 -1.588 2.739 1.00 0.36 C ATOM 567 CG ARG A 55 -1.092 -1.285 3.854 1.00 0.37 C ATOM 568 CD ARG A 55 -0.984 -2.348 4.950 1.00 0.44 C ATOM 569 NE ARG A 55 -1.633 -1.736 6.142 1.00 0.45 N ATOM 570 CZ ARG A 55 -1.010 -1.722 7.288 1.00 0.44 C ATOM 571 NH1 ARG A 55 -0.036 -0.877 7.491 1.00 0.44 N ATOM 572 NH2 ARG A 55 -1.361 -2.552 8.231 1.00 0.50 N ATOM 0 H ARG A 55 1.652 -1.687 1.072 1.00 0.31 H new ATOM 0 HA ARG A 55 0.760 0.417 2.909 1.00 0.32 H new ATOM 0 HB2 ARG A 55 -0.569 -1.495 1.766 1.00 0.36 H new ATOM 0 HB3 ARG A 55 0.266 -2.616 2.823 1.00 0.36 H new ATOM 0 HG2 ARG A 55 -0.899 -0.297 4.272 1.00 0.37 H new ATOM 0 HG3 ARG A 55 -2.104 -1.268 3.450 1.00 0.37 H new ATOM 0 HD2 ARG A 55 -1.486 -3.270 4.657 1.00 0.44 H new ATOM 0 HD3 ARG A 55 0.056 -2.602 5.153 1.00 0.44 H new ATOM 0 HE ARG A 55 -2.564 -1.328 6.063 1.00 0.45 H new ATOM 0 HH11 ARG A 55 0.238 -0.228 6.754 1.00 0.44 H new ATOM 0 HH12 ARG A 55 0.451 -0.866 8.387 1.00 0.44 H new ATOM 0 HH21 ARG A 55 -2.122 -3.212 8.072 1.00 0.50 H new ATOM 0 HH22 ARG A 55 -0.874 -2.541 9.127 1.00 0.50 H new ATOM 586 N PHE A 56 3.143 -1.363 3.923 1.00 0.29 N ATOM 587 CA PHE A 56 4.003 -1.656 5.105 1.00 0.27 C ATOM 588 C PHE A 56 5.079 -0.576 5.268 1.00 0.27 C ATOM 589 O PHE A 56 5.633 -0.410 6.339 1.00 0.29 O ATOM 590 CB PHE A 56 4.653 -3.007 4.801 1.00 0.26 C ATOM 591 CG PHE A 56 4.025 -4.079 5.660 1.00 0.29 C ATOM 592 CD1 PHE A 56 2.703 -4.482 5.430 1.00 0.36 C ATOM 593 CD2 PHE A 56 4.769 -4.672 6.687 1.00 0.75 C ATOM 594 CE1 PHE A 56 2.127 -5.478 6.227 1.00 0.36 C ATOM 595 CE2 PHE A 56 4.192 -5.668 7.484 1.00 0.94 C ATOM 596 CZ PHE A 56 2.871 -6.071 7.253 1.00 0.64 C ATOM 0 H PHE A 56 3.576 -1.545 3.017 1.00 0.29 H new ATOM 0 HA PHE A 56 3.428 -1.675 6.031 1.00 0.27 H new ATOM 0 HB2 PHE A 56 4.528 -3.253 3.746 1.00 0.26 H new ATOM 0 HB3 PHE A 56 5.725 -2.957 4.991 1.00 0.26 H new ATOM 0 HD1 PHE A 56 2.129 -4.024 4.638 1.00 0.36 H new ATOM 0 HD2 PHE A 56 5.788 -4.361 6.864 1.00 0.75 H new ATOM 0 HE1 PHE A 56 1.108 -5.789 6.050 1.00 0.36 H new ATOM 0 HE2 PHE A 56 4.766 -6.125 8.277 1.00 0.94 H new ATOM 0 HZ PHE A 56 2.426 -6.840 7.867 1.00 0.64 H new ATOM 606 N LEU A 57 5.402 0.142 4.214 1.00 0.29 N ATOM 607 CA LEU A 57 6.473 1.188 4.329 1.00 0.33 C ATOM 608 C LEU A 57 5.903 2.616 4.306 1.00 0.36 C ATOM 609 O LEU A 57 6.288 3.446 5.108 1.00 0.41 O ATOM 610 CB LEU A 57 7.386 0.963 3.119 1.00 0.39 C ATOM 611 CG LEU A 57 7.746 -0.524 2.993 1.00 0.38 C ATOM 612 CD1 LEU A 57 8.810 -0.702 1.907 1.00 0.51 C ATOM 613 CD2 LEU A 57 8.295 -1.042 4.327 1.00 0.42 C ATOM 0 H LEU A 57 4.977 0.051 3.291 1.00 0.29 H new ATOM 0 HA LEU A 57 6.999 1.096 5.279 1.00 0.33 H new ATOM 0 HB2 LEU A 57 6.888 1.302 2.211 1.00 0.39 H new ATOM 0 HB3 LEU A 57 8.294 1.556 3.225 1.00 0.39 H new ATOM 0 HG LEU A 57 6.851 -1.086 2.727 1.00 0.38 H new ATOM 0 HD11 LEU A 57 9.066 -1.758 1.818 1.00 0.51 H new ATOM 0 HD12 LEU A 57 8.422 -0.341 0.955 1.00 0.51 H new ATOM 0 HD13 LEU A 57 9.701 -0.134 2.174 1.00 0.51 H new ATOM 0 HD21 LEU A 57 8.548 -2.098 4.231 1.00 0.42 H new ATOM 0 HD22 LEU A 57 9.188 -0.478 4.597 1.00 0.42 H new ATOM 0 HD23 LEU A 57 7.540 -0.920 5.103 1.00 0.42 H new ATOM 625 N THR A 58 5.014 2.920 3.390 1.00 0.38 N ATOM 626 CA THR A 58 4.455 4.310 3.318 1.00 0.44 C ATOM 627 C THR A 58 2.926 4.285 3.221 1.00 0.40 C ATOM 628 O THR A 58 2.267 5.284 3.436 1.00 0.46 O ATOM 629 CB THR A 58 5.061 4.902 2.045 1.00 0.54 C ATOM 630 OG1 THR A 58 6.478 4.889 2.146 1.00 1.28 O ATOM 631 CG2 THR A 58 4.574 6.339 1.867 1.00 1.16 C ATOM 0 H THR A 58 4.652 2.270 2.692 1.00 0.38 H new ATOM 0 HA THR A 58 4.695 4.893 4.207 1.00 0.44 H new ATOM 0 HB THR A 58 4.753 4.307 1.185 1.00 0.54 H new ATOM 0 HG1 THR A 58 6.868 5.267 1.330 1.00 1.28 H new ATOM 0 HG21 THR A 58 5.007 6.760 0.959 1.00 1.16 H new ATOM 0 HG22 THR A 58 3.487 6.348 1.789 1.00 1.16 H new ATOM 0 HG23 THR A 58 4.881 6.936 2.726 1.00 1.16 H new ATOM 639 N ILE A 59 2.366 3.148 2.904 1.00 0.34 N ATOM 640 CA ILE A 59 0.884 3.017 2.792 1.00 0.33 C ATOM 641 C ILE A 59 0.285 4.061 1.836 1.00 0.36 C ATOM 642 O ILE A 59 -0.523 4.877 2.240 1.00 0.42 O ATOM 643 CB ILE A 59 0.362 3.218 4.211 1.00 0.38 C ATOM 644 CG1 ILE A 59 1.023 2.203 5.147 1.00 0.37 C ATOM 645 CG2 ILE A 59 -1.159 3.023 4.225 1.00 0.43 C ATOM 646 CD1 ILE A 59 2.158 2.881 5.918 1.00 0.40 C ATOM 0 H ILE A 59 2.883 2.289 2.715 1.00 0.34 H new ATOM 0 HA ILE A 59 0.602 2.048 2.379 1.00 0.33 H new ATOM 0 HB ILE A 59 0.600 4.226 4.550 1.00 0.38 H new ATOM 0 HG12 ILE A 59 0.286 1.801 5.843 1.00 0.37 H new ATOM 0 HG13 ILE A 59 1.411 1.362 4.572 1.00 0.37 H new ATOM 0 HG21 ILE A 59 -1.535 3.166 5.238 1.00 0.43 H new ATOM 0 HG22 ILE A 59 -1.625 3.749 3.559 1.00 0.43 H new ATOM 0 HG23 ILE A 59 -1.400 2.015 3.888 1.00 0.43 H new ATOM 0 HD11 ILE A 59 2.628 2.158 6.584 1.00 0.40 H new ATOM 0 HD12 ILE A 59 2.899 3.262 5.215 1.00 0.40 H new ATOM 0 HD13 ILE A 59 1.756 3.707 6.505 1.00 0.40 H new ATOM 658 N PRO A 60 0.679 3.984 0.588 1.00 0.35 N ATOM 659 CA PRO A 60 0.162 4.881 -0.457 1.00 0.39 C ATOM 660 C PRO A 60 -0.826 4.117 -1.374 1.00 0.33 C ATOM 661 O PRO A 60 -0.597 4.026 -2.567 1.00 0.37 O ATOM 662 CB PRO A 60 1.444 5.199 -1.230 1.00 0.47 C ATOM 663 CG PRO A 60 2.357 4.015 -0.989 1.00 0.44 C ATOM 664 CD PRO A 60 1.673 3.102 0.008 1.00 0.35 C ATOM 0 HA PRO A 60 -0.375 5.752 -0.081 1.00 0.39 H new ATOM 0 HB2 PRO A 60 1.241 5.330 -2.293 1.00 0.47 H new ATOM 0 HB3 PRO A 60 1.898 6.125 -0.876 1.00 0.47 H new ATOM 0 HG2 PRO A 60 2.551 3.486 -1.922 1.00 0.44 H new ATOM 0 HG3 PRO A 60 3.321 4.347 -0.604 1.00 0.44 H new ATOM 0 HD2 PRO A 60 1.219 2.237 -0.475 1.00 0.35 H new ATOM 0 HD3 PRO A 60 2.368 2.721 0.757 1.00 0.35 H new ATOM 672 N PRO A 61 -1.885 3.568 -0.809 1.00 0.34 N ATOM 673 CA PRO A 61 -2.852 2.803 -1.633 1.00 0.31 C ATOM 674 C PRO A 61 -3.649 3.743 -2.535 1.00 0.32 C ATOM 675 O PRO A 61 -4.456 4.526 -2.071 1.00 0.42 O ATOM 676 CB PRO A 61 -3.761 2.131 -0.612 1.00 0.39 C ATOM 677 CG PRO A 61 -3.668 2.987 0.602 1.00 0.50 C ATOM 678 CD PRO A 61 -2.291 3.601 0.602 1.00 0.46 C ATOM 0 HA PRO A 61 -2.367 2.085 -2.294 1.00 0.31 H new ATOM 0 HB2 PRO A 61 -4.787 2.070 -0.975 1.00 0.39 H new ATOM 0 HB3 PRO A 61 -3.436 1.112 -0.403 1.00 0.39 H new ATOM 0 HG2 PRO A 61 -4.436 3.761 0.588 1.00 0.50 H new ATOM 0 HG3 PRO A 61 -3.827 2.396 1.504 1.00 0.50 H new ATOM 0 HD2 PRO A 61 -2.309 4.620 0.988 1.00 0.46 H new ATOM 0 HD3 PRO A 61 -1.602 3.035 1.229 1.00 0.46 H new ATOM 686 N THR A 62 -3.428 3.666 -3.821 1.00 0.36 N ATOM 687 CA THR A 62 -4.172 4.549 -4.765 1.00 0.47 C ATOM 688 C THR A 62 -5.681 4.286 -4.630 1.00 0.46 C ATOM 689 O THR A 62 -6.090 3.291 -4.063 1.00 0.42 O ATOM 690 CB THR A 62 -3.618 4.184 -6.159 1.00 0.56 C ATOM 691 OG1 THR A 62 -3.195 5.370 -6.815 1.00 0.75 O ATOM 692 CG2 THR A 62 -4.674 3.485 -7.020 1.00 0.54 C ATOM 0 H THR A 62 -2.763 3.028 -4.258 1.00 0.36 H new ATOM 0 HA THR A 62 -4.040 5.613 -4.571 1.00 0.47 H new ATOM 0 HB THR A 62 -2.782 3.498 -6.024 1.00 0.56 H new ATOM 0 HG1 THR A 62 -2.840 5.145 -7.701 1.00 0.75 H new ATOM 0 HG21 THR A 62 -4.248 3.243 -7.994 1.00 0.54 H new ATOM 0 HG22 THR A 62 -4.996 2.568 -6.527 1.00 0.54 H new ATOM 0 HG23 THR A 62 -5.531 4.146 -7.153 1.00 0.54 H new ATOM 700 N ALA A 63 -6.500 5.180 -5.129 1.00 0.57 N ATOM 701 CA ALA A 63 -7.987 5.004 -5.017 1.00 0.62 C ATOM 702 C ALA A 63 -8.419 3.614 -5.501 1.00 0.54 C ATOM 703 O ALA A 63 -9.307 3.002 -4.938 1.00 0.52 O ATOM 704 CB ALA A 63 -8.586 6.090 -5.915 1.00 0.78 C ATOM 0 H ALA A 63 -6.204 6.028 -5.611 1.00 0.57 H new ATOM 0 HA ALA A 63 -8.323 5.088 -3.984 1.00 0.62 H new ATOM 0 HB1 ALA A 63 -9.674 6.027 -5.886 1.00 0.78 H new ATOM 0 HB2 ALA A 63 -8.270 7.071 -5.560 1.00 0.78 H new ATOM 0 HB3 ALA A 63 -8.241 5.947 -6.939 1.00 0.78 H new ATOM 710 N GLY A 64 -7.799 3.122 -6.541 1.00 0.53 N ATOM 711 CA GLY A 64 -8.164 1.777 -7.081 1.00 0.50 C ATOM 712 C GLY A 64 -8.042 0.710 -5.988 1.00 0.40 C ATOM 713 O GLY A 64 -8.898 -0.131 -5.845 1.00 0.40 O ATOM 0 H GLY A 64 -7.050 3.597 -7.044 1.00 0.53 H new ATOM 0 HA2 GLY A 64 -9.184 1.797 -7.466 1.00 0.50 H new ATOM 0 HA3 GLY A 64 -7.513 1.525 -7.918 1.00 0.50 H new ATOM 717 N ILE A 65 -6.984 0.737 -5.223 1.00 0.34 N ATOM 718 CA ILE A 65 -6.802 -0.279 -4.140 1.00 0.28 C ATOM 719 C ILE A 65 -8.016 -0.286 -3.206 1.00 0.29 C ATOM 720 O ILE A 65 -8.461 -1.330 -2.769 1.00 0.31 O ATOM 721 CB ILE A 65 -5.537 0.163 -3.391 1.00 0.26 C ATOM 722 CG1 ILE A 65 -4.344 0.171 -4.353 1.00 0.30 C ATOM 723 CG2 ILE A 65 -5.245 -0.807 -2.242 1.00 0.28 C ATOM 724 CD1 ILE A 65 -4.218 -1.198 -5.026 1.00 0.35 C ATOM 0 H ILE A 65 -6.232 1.422 -5.300 1.00 0.34 H new ATOM 0 HA ILE A 65 -6.707 -1.291 -4.533 1.00 0.28 H new ATOM 0 HB ILE A 65 -5.696 1.165 -2.991 1.00 0.26 H new ATOM 0 HG12 ILE A 65 -4.477 0.947 -5.107 1.00 0.30 H new ATOM 0 HG13 ILE A 65 -3.428 0.407 -3.811 1.00 0.30 H new ATOM 0 HG21 ILE A 65 -4.346 -0.487 -1.715 1.00 0.28 H new ATOM 0 HG22 ILE A 65 -6.087 -0.816 -1.550 1.00 0.28 H new ATOM 0 HG23 ILE A 65 -5.094 -1.810 -2.642 1.00 0.28 H new ATOM 0 HD11 ILE A 65 -3.369 -1.191 -5.710 1.00 0.35 H new ATOM 0 HD12 ILE A 65 -4.065 -1.964 -4.266 1.00 0.35 H new ATOM 0 HD13 ILE A 65 -5.130 -1.415 -5.582 1.00 0.35 H new ATOM 736 N LEU A 66 -8.558 0.867 -2.908 1.00 0.36 N ATOM 737 CA LEU A 66 -9.747 0.926 -2.006 1.00 0.42 C ATOM 738 C LEU A 66 -11.014 0.583 -2.793 1.00 0.42 C ATOM 739 O LEU A 66 -11.817 -0.227 -2.369 1.00 0.47 O ATOM 740 CB LEU A 66 -9.806 2.371 -1.492 1.00 0.52 C ATOM 741 CG LEU A 66 -8.650 2.654 -0.517 1.00 0.56 C ATOM 742 CD1 LEU A 66 -8.522 1.518 0.505 1.00 0.68 C ATOM 743 CD2 LEU A 66 -7.340 2.787 -1.298 1.00 0.55 C ATOM 0 H LEU A 66 -8.229 1.770 -3.250 1.00 0.36 H new ATOM 0 HA LEU A 66 -9.673 0.214 -1.184 1.00 0.42 H new ATOM 0 HB2 LEU A 66 -9.756 3.063 -2.333 1.00 0.52 H new ATOM 0 HB3 LEU A 66 -10.759 2.545 -0.993 1.00 0.52 H new ATOM 0 HG LEU A 66 -8.858 3.584 0.013 1.00 0.56 H new ATOM 0 HD11 LEU A 66 -7.700 1.733 1.187 1.00 0.68 H new ATOM 0 HD12 LEU A 66 -9.450 1.431 1.071 1.00 0.68 H new ATOM 0 HD13 LEU A 66 -8.325 0.581 -0.016 1.00 0.68 H new ATOM 0 HD21 LEU A 66 -6.522 2.987 -0.606 1.00 0.55 H new ATOM 0 HD22 LEU A 66 -7.141 1.860 -1.836 1.00 0.55 H new ATOM 0 HD23 LEU A 66 -7.422 3.609 -2.010 1.00 0.55 H new ATOM 755 N LYS A 67 -11.194 1.188 -3.940 1.00 0.43 N ATOM 756 CA LYS A 67 -12.404 0.894 -4.766 1.00 0.47 C ATOM 757 C LYS A 67 -12.428 -0.591 -5.130 1.00 0.40 C ATOM 758 O LYS A 67 -13.462 -1.233 -5.108 1.00 0.44 O ATOM 759 CB LYS A 67 -12.245 1.748 -6.024 1.00 0.54 C ATOM 760 CG LYS A 67 -12.922 3.102 -5.813 1.00 0.61 C ATOM 761 CD LYS A 67 -14.437 2.944 -5.959 1.00 0.67 C ATOM 762 CE LYS A 67 -14.795 2.775 -7.438 1.00 0.75 C ATOM 763 NZ LYS A 67 -16.232 2.385 -7.441 1.00 0.88 N ATOM 0 H LYS A 67 -10.554 1.874 -4.340 1.00 0.43 H new ATOM 0 HA LYS A 67 -13.333 1.117 -4.241 1.00 0.47 H new ATOM 0 HB2 LYS A 67 -11.188 1.890 -6.248 1.00 0.54 H new ATOM 0 HB3 LYS A 67 -12.687 1.238 -6.880 1.00 0.54 H new ATOM 0 HG2 LYS A 67 -12.680 3.491 -4.824 1.00 0.61 H new ATOM 0 HG3 LYS A 67 -12.549 3.824 -6.540 1.00 0.61 H new ATOM 0 HD2 LYS A 67 -14.779 2.079 -5.390 1.00 0.67 H new ATOM 0 HD3 LYS A 67 -14.945 3.817 -5.549 1.00 0.67 H new ATOM 0 HE2 LYS A 67 -14.635 3.700 -7.992 1.00 0.75 H new ATOM 0 HE3 LYS A 67 -14.177 2.011 -7.909 1.00 0.75 H new ATOM 0 HZ1 LYS A 67 -16.553 2.250 -8.421 1.00 0.88 H new ATOM 0 HZ2 LYS A 67 -16.352 1.498 -6.912 1.00 0.88 H new ATOM 0 HZ3 LYS A 67 -16.796 3.134 -6.992 1.00 0.88 H new ATOM 777 N ARG A 68 -11.286 -1.133 -5.459 1.00 0.35 N ATOM 778 CA ARG A 68 -11.201 -2.574 -5.824 1.00 0.32 C ATOM 779 C ARG A 68 -11.244 -3.433 -4.552 1.00 0.25 C ATOM 780 O ARG A 68 -11.623 -4.589 -4.585 1.00 0.28 O ATOM 781 CB ARG A 68 -9.864 -2.710 -6.577 1.00 0.35 C ATOM 782 CG ARG A 68 -8.725 -3.053 -5.615 1.00 0.33 C ATOM 783 CD ARG A 68 -7.392 -2.940 -6.358 1.00 0.36 C ATOM 784 NE ARG A 68 -7.289 -4.196 -7.153 1.00 0.50 N ATOM 785 CZ ARG A 68 -7.810 -4.257 -8.348 1.00 0.61 C ATOM 786 NH1 ARG A 68 -7.571 -3.311 -9.214 1.00 0.67 N ATOM 787 NH2 ARG A 68 -8.572 -5.264 -8.677 1.00 0.88 N ATOM 0 H ARG A 68 -10.399 -0.631 -5.490 1.00 0.35 H new ATOM 0 HA ARG A 68 -12.031 -2.913 -6.444 1.00 0.32 H new ATOM 0 HB2 ARG A 68 -9.948 -3.486 -7.338 1.00 0.35 H new ATOM 0 HB3 ARG A 68 -9.638 -1.778 -7.096 1.00 0.35 H new ATOM 0 HG2 ARG A 68 -8.738 -2.377 -4.760 1.00 0.33 H new ATOM 0 HG3 ARG A 68 -8.854 -4.062 -5.224 1.00 0.33 H new ATOM 0 HD2 ARG A 68 -7.372 -2.061 -7.003 1.00 0.36 H new ATOM 0 HD3 ARG A 68 -6.559 -2.843 -5.662 1.00 0.36 H new ATOM 0 HE ARG A 68 -6.811 -5.008 -6.763 1.00 0.50 H new ATOM 0 HH11 ARG A 68 -6.977 -2.523 -8.957 1.00 0.67 H new ATOM 0 HH12 ARG A 68 -7.979 -3.360 -10.148 1.00 0.67 H new ATOM 0 HH21 ARG A 68 -8.760 -6.003 -8.000 1.00 0.88 H new ATOM 0 HH22 ARG A 68 -8.979 -5.312 -9.611 1.00 0.88 H new ATOM 801 N TRP A 69 -10.864 -2.858 -3.435 1.00 0.25 N ATOM 802 CA TRP A 69 -10.880 -3.597 -2.131 1.00 0.22 C ATOM 803 C TRP A 69 -12.218 -4.317 -1.920 1.00 0.24 C ATOM 804 O TRP A 69 -12.267 -5.400 -1.372 1.00 0.29 O ATOM 805 CB TRP A 69 -10.727 -2.495 -1.085 1.00 0.27 C ATOM 806 CG TRP A 69 -10.076 -3.018 0.154 1.00 0.26 C ATOM 807 CD1 TRP A 69 -10.587 -2.878 1.397 1.00 0.31 C ATOM 808 CD2 TRP A 69 -8.810 -3.732 0.310 1.00 0.26 C ATOM 809 NE1 TRP A 69 -9.722 -3.452 2.305 1.00 0.33 N ATOM 810 CE2 TRP A 69 -8.613 -3.989 1.690 1.00 0.29 C ATOM 811 CE3 TRP A 69 -7.821 -4.177 -0.591 1.00 0.27 C ATOM 812 CZ2 TRP A 69 -7.483 -4.656 2.158 1.00 0.32 C ATOM 813 CZ3 TRP A 69 -6.683 -4.850 -0.118 1.00 0.31 C ATOM 814 CH2 TRP A 69 -6.516 -5.084 1.253 1.00 0.32 C ATOM 0 H TRP A 69 -10.539 -1.893 -3.371 1.00 0.25 H new ATOM 0 HA TRP A 69 -10.102 -4.359 -2.083 1.00 0.22 H new ATOM 0 HB2 TRP A 69 -10.132 -1.679 -1.496 1.00 0.27 H new ATOM 0 HB3 TRP A 69 -11.706 -2.083 -0.840 1.00 0.27 H new ATOM 0 HD1 TRP A 69 -11.522 -2.395 1.640 1.00 0.31 H new ATOM 0 HE1 TRP A 69 -9.884 -3.476 3.312 1.00 0.33 H new ATOM 0 HE3 TRP A 69 -7.939 -3.999 -1.650 1.00 0.27 H new ATOM 0 HZ2 TRP A 69 -7.358 -4.840 3.215 1.00 0.32 H new ATOM 0 HZ3 TRP A 69 -5.932 -5.189 -0.816 1.00 0.31 H new ATOM 0 HH2 TRP A 69 -5.635 -5.598 1.609 1.00 0.32 H new ATOM 825 N GLY A 70 -13.304 -3.708 -2.336 1.00 0.27 N ATOM 826 CA GLY A 70 -14.645 -4.339 -2.141 1.00 0.33 C ATOM 827 C GLY A 70 -15.238 -4.773 -3.485 1.00 0.32 C ATOM 828 O GLY A 70 -16.440 -4.750 -3.671 1.00 0.39 O ATOM 0 H GLY A 70 -13.317 -2.801 -2.802 1.00 0.27 H new ATOM 0 HA2 GLY A 70 -14.554 -5.202 -1.482 1.00 0.33 H new ATOM 0 HA3 GLY A 70 -15.317 -3.634 -1.652 1.00 0.33 H new ATOM 832 N THR A 71 -14.412 -5.179 -4.416 1.00 0.30 N ATOM 833 CA THR A 71 -14.940 -5.627 -5.740 1.00 0.34 C ATOM 834 C THR A 71 -14.167 -6.859 -6.232 1.00 0.33 C ATOM 835 O THR A 71 -14.245 -7.228 -7.389 1.00 0.48 O ATOM 836 CB THR A 71 -14.756 -4.423 -6.680 1.00 0.43 C ATOM 837 OG1 THR A 71 -15.831 -4.388 -7.609 1.00 0.56 O ATOM 838 CG2 THR A 71 -13.431 -4.523 -7.444 1.00 0.47 C ATOM 0 H THR A 71 -13.398 -5.220 -4.317 1.00 0.30 H new ATOM 0 HA THR A 71 -15.987 -5.927 -5.691 1.00 0.34 H new ATOM 0 HB THR A 71 -14.743 -3.512 -6.081 1.00 0.43 H new ATOM 0 HG1 THR A 71 -15.720 -3.622 -8.210 1.00 0.56 H new ATOM 0 HG21 THR A 71 -13.324 -3.660 -8.102 1.00 0.47 H new ATOM 0 HG22 THR A 71 -12.603 -4.544 -6.735 1.00 0.47 H new ATOM 0 HG23 THR A 71 -13.422 -5.436 -8.039 1.00 0.47 H new ATOM 846 N ILE A 72 -13.431 -7.500 -5.357 1.00 0.30 N ATOM 847 CA ILE A 72 -12.661 -8.708 -5.769 1.00 0.31 C ATOM 848 C ILE A 72 -13.405 -9.976 -5.324 1.00 0.32 C ATOM 849 O ILE A 72 -14.581 -10.132 -5.596 1.00 0.40 O ATOM 850 CB ILE A 72 -11.295 -8.570 -5.080 1.00 0.31 C ATOM 851 CG1 ILE A 72 -11.480 -8.484 -3.561 1.00 0.29 C ATOM 852 CG2 ILE A 72 -10.592 -7.304 -5.579 1.00 0.36 C ATOM 853 CD1 ILE A 72 -10.228 -9.029 -2.868 1.00 0.29 C ATOM 0 H ILE A 72 -13.332 -7.237 -4.377 1.00 0.30 H new ATOM 0 HA ILE A 72 -12.542 -8.788 -6.850 1.00 0.31 H new ATOM 0 HB ILE A 72 -10.688 -9.443 -5.319 1.00 0.31 H new ATOM 0 HG12 ILE A 72 -11.654 -7.450 -3.262 1.00 0.29 H new ATOM 0 HG13 ILE A 72 -12.356 -9.056 -3.257 1.00 0.29 H new ATOM 0 HG21 ILE A 72 -9.623 -7.208 -5.089 1.00 0.36 H new ATOM 0 HG22 ILE A 72 -10.448 -7.369 -6.657 1.00 0.36 H new ATOM 0 HG23 ILE A 72 -11.204 -6.432 -5.346 1.00 0.36 H new ATOM 0 HD11 ILE A 72 -10.355 -8.970 -1.787 1.00 0.29 H new ATOM 0 HD12 ILE A 72 -10.074 -10.068 -3.159 1.00 0.29 H new ATOM 0 HD13 ILE A 72 -9.362 -8.438 -3.164 1.00 0.29 H new ATOM 865 N LYS A 73 -12.736 -10.884 -4.657 1.00 0.33 N ATOM 866 CA LYS A 73 -13.406 -12.142 -4.212 1.00 0.34 C ATOM 867 C LYS A 73 -13.340 -12.277 -2.694 1.00 0.31 C ATOM 868 O LYS A 73 -14.180 -12.914 -2.090 1.00 0.35 O ATOM 869 CB LYS A 73 -12.597 -13.256 -4.883 1.00 0.38 C ATOM 870 CG LYS A 73 -13.004 -14.622 -4.326 1.00 0.40 C ATOM 871 CD LYS A 73 -14.458 -14.928 -4.692 1.00 0.44 C ATOM 872 CE LYS A 73 -14.572 -15.257 -6.185 1.00 0.50 C ATOM 873 NZ LYS A 73 -14.707 -13.943 -6.882 1.00 0.39 N ATOM 0 H LYS A 73 -11.752 -10.806 -4.401 1.00 0.33 H new ATOM 0 HA LYS A 73 -14.462 -12.170 -4.480 1.00 0.34 H new ATOM 0 HB2 LYS A 73 -12.759 -13.233 -5.961 1.00 0.38 H new ATOM 0 HB3 LYS A 73 -11.532 -13.091 -4.717 1.00 0.38 H new ATOM 0 HG2 LYS A 73 -12.350 -15.396 -4.726 1.00 0.40 H new ATOM 0 HG3 LYS A 73 -12.884 -14.632 -3.243 1.00 0.40 H new ATOM 0 HD2 LYS A 73 -14.821 -15.767 -4.099 1.00 0.44 H new ATOM 0 HD3 LYS A 73 -15.089 -14.072 -4.452 1.00 0.44 H new ATOM 0 HE2 LYS A 73 -13.692 -15.797 -6.535 1.00 0.50 H new ATOM 0 HE3 LYS A 73 -15.435 -15.894 -6.380 1.00 0.50 H new ATOM 0 HZ1 LYS A 73 -15.518 -13.977 -7.532 1.00 0.39 H new ATOM 0 HZ2 LYS A 73 -14.858 -13.191 -6.179 1.00 0.39 H new ATOM 0 HZ3 LYS A 73 -13.840 -13.745 -7.420 1.00 0.39 H new ATOM 887 N LYS A 74 -12.328 -11.707 -2.092 1.00 0.29 N ATOM 888 CA LYS A 74 -12.137 -11.798 -0.610 1.00 0.28 C ATOM 889 C LYS A 74 -11.731 -13.220 -0.222 1.00 0.30 C ATOM 890 O LYS A 74 -10.799 -13.419 0.532 1.00 0.32 O ATOM 891 CB LYS A 74 -13.467 -11.415 0.057 1.00 0.31 C ATOM 892 CG LYS A 74 -14.053 -10.152 -0.578 1.00 0.31 C ATOM 893 CD LYS A 74 -12.972 -9.079 -0.734 1.00 0.32 C ATOM 894 CE LYS A 74 -12.446 -8.678 0.646 1.00 0.32 C ATOM 895 NZ LYS A 74 -12.073 -7.238 0.524 1.00 0.28 N ATOM 0 H LYS A 74 -11.609 -11.170 -2.576 1.00 0.29 H new ATOM 0 HA LYS A 74 -11.346 -11.124 -0.282 1.00 0.28 H new ATOM 0 HB2 LYS A 74 -14.176 -12.237 -0.038 1.00 0.31 H new ATOM 0 HB3 LYS A 74 -13.310 -11.251 1.123 1.00 0.31 H new ATOM 0 HG2 LYS A 74 -14.479 -10.392 -1.552 1.00 0.31 H new ATOM 0 HG3 LYS A 74 -14.866 -9.771 0.040 1.00 0.31 H new ATOM 0 HD2 LYS A 74 -12.156 -9.457 -1.350 1.00 0.32 H new ATOM 0 HD3 LYS A 74 -13.381 -8.208 -1.246 1.00 0.32 H new ATOM 0 HE2 LYS A 74 -13.206 -8.823 1.414 1.00 0.32 H new ATOM 0 HE3 LYS A 74 -11.586 -9.284 0.930 1.00 0.32 H new ATOM 0 HZ1 LYS A 74 -11.038 -7.150 0.477 1.00 0.28 H new ATOM 0 HZ2 LYS A 74 -12.493 -6.843 -0.341 1.00 0.28 H new ATOM 0 HZ3 LYS A 74 -12.428 -6.716 1.351 1.00 0.28 H new ATOM 909 N SER A 75 -12.407 -14.214 -0.746 1.00 0.32 N ATOM 910 CA SER A 75 -12.041 -15.620 -0.417 1.00 0.36 C ATOM 911 C SER A 75 -10.609 -15.869 -0.873 1.00 0.36 C ATOM 912 O SER A 75 -9.843 -16.536 -0.211 1.00 0.39 O ATOM 913 CB SER A 75 -13.020 -16.488 -1.207 1.00 0.39 C ATOM 914 OG SER A 75 -13.021 -17.803 -0.667 1.00 0.48 O ATOM 0 H SER A 75 -13.194 -14.109 -1.386 1.00 0.32 H new ATOM 0 HA SER A 75 -12.096 -15.838 0.649 1.00 0.36 H new ATOM 0 HB2 SER A 75 -14.022 -16.062 -1.159 1.00 0.39 H new ATOM 0 HB3 SER A 75 -12.734 -16.514 -2.259 1.00 0.39 H new ATOM 0 HG SER A 75 -13.649 -18.363 -1.170 1.00 0.48 H new ATOM 920 N LYS A 76 -10.249 -15.308 -1.997 1.00 0.35 N ATOM 921 CA LYS A 76 -8.864 -15.474 -2.519 1.00 0.37 C ATOM 922 C LYS A 76 -7.910 -14.556 -1.750 1.00 0.33 C ATOM 923 O LYS A 76 -6.828 -14.958 -1.365 1.00 0.37 O ATOM 924 CB LYS A 76 -8.951 -15.059 -3.987 1.00 0.42 C ATOM 925 CG LYS A 76 -9.206 -16.294 -4.854 1.00 0.53 C ATOM 926 CD LYS A 76 -7.875 -16.838 -5.375 1.00 0.47 C ATOM 927 CE LYS A 76 -7.223 -17.711 -4.300 1.00 0.58 C ATOM 928 NZ LYS A 76 -6.230 -18.545 -5.032 1.00 0.73 N ATOM 0 H LYS A 76 -10.862 -14.737 -2.579 1.00 0.35 H new ATOM 0 HA LYS A 76 -8.488 -16.491 -2.407 1.00 0.37 H new ATOM 0 HB2 LYS A 76 -9.753 -14.334 -4.124 1.00 0.42 H new ATOM 0 HB3 LYS A 76 -8.025 -14.572 -4.293 1.00 0.42 H new ATOM 0 HG2 LYS A 76 -9.721 -17.059 -4.273 1.00 0.53 H new ATOM 0 HG3 LYS A 76 -9.857 -16.036 -5.689 1.00 0.53 H new ATOM 0 HD2 LYS A 76 -8.038 -17.421 -6.282 1.00 0.47 H new ATOM 0 HD3 LYS A 76 -7.212 -16.014 -5.640 1.00 0.47 H new ATOM 0 HE2 LYS A 76 -6.740 -17.102 -3.536 1.00 0.58 H new ATOM 0 HE3 LYS A 76 -7.962 -18.331 -3.793 1.00 0.58 H new ATOM 0 HZ1 LYS A 76 -5.741 -19.171 -4.361 1.00 0.73 H new ATOM 0 HZ2 LYS A 76 -6.719 -19.119 -5.748 1.00 0.73 H new ATOM 0 HZ3 LYS A 76 -5.535 -17.928 -5.499 1.00 0.73 H new ATOM 942 N ALA A 77 -8.311 -13.329 -1.517 1.00 0.30 N ATOM 943 CA ALA A 77 -7.437 -12.378 -0.762 1.00 0.29 C ATOM 944 C ALA A 77 -7.209 -12.897 0.656 1.00 0.29 C ATOM 945 O ALA A 77 -6.088 -13.015 1.113 1.00 0.33 O ATOM 946 CB ALA A 77 -8.209 -11.058 -0.719 1.00 0.27 C ATOM 0 H ALA A 77 -9.207 -12.945 -1.818 1.00 0.30 H new ATOM 0 HA ALA A 77 -6.460 -12.261 -1.232 1.00 0.29 H new ATOM 0 HB1 ALA A 77 -7.625 -10.313 -0.179 1.00 0.27 H new ATOM 0 HB2 ALA A 77 -8.391 -10.709 -1.736 1.00 0.27 H new ATOM 0 HB3 ALA A 77 -9.162 -11.210 -0.212 1.00 0.27 H new ATOM 952 N ILE A 78 -8.271 -13.207 1.354 1.00 0.29 N ATOM 953 CA ILE A 78 -8.130 -13.721 2.747 1.00 0.31 C ATOM 954 C ILE A 78 -7.317 -15.021 2.742 1.00 0.35 C ATOM 955 O ILE A 78 -6.439 -15.208 3.564 1.00 0.38 O ATOM 956 CB ILE A 78 -9.565 -13.946 3.236 1.00 0.33 C ATOM 957 CG1 ILE A 78 -10.308 -12.603 3.237 1.00 0.33 C ATOM 958 CG2 ILE A 78 -9.544 -14.514 4.657 1.00 0.40 C ATOM 959 CD1 ILE A 78 -11.806 -12.834 3.033 1.00 0.35 C ATOM 0 H ILE A 78 -9.231 -13.126 1.018 1.00 0.29 H new ATOM 0 HA ILE A 78 -7.599 -13.031 3.403 1.00 0.31 H new ATOM 0 HB ILE A 78 -10.070 -14.651 2.575 1.00 0.33 H new ATOM 0 HG12 ILE A 78 -10.137 -12.084 4.180 1.00 0.33 H new ATOM 0 HG13 ILE A 78 -9.919 -11.962 2.445 1.00 0.33 H new ATOM 0 HG21 ILE A 78 -10.566 -14.672 5.001 1.00 0.40 H new ATOM 0 HG22 ILE A 78 -9.008 -15.463 4.661 1.00 0.40 H new ATOM 0 HG23 ILE A 78 -9.042 -13.811 5.322 1.00 0.40 H new ATOM 0 HD11 ILE A 78 -12.326 -11.876 3.035 1.00 0.35 H new ATOM 0 HD12 ILE A 78 -11.970 -13.334 2.078 1.00 0.35 H new ATOM 0 HD13 ILE A 78 -12.191 -13.457 3.840 1.00 0.35 H new ATOM 971 N ASN A 79 -7.575 -15.909 1.808 1.00 0.37 N ATOM 972 CA ASN A 79 -6.778 -17.174 1.751 1.00 0.42 C ATOM 973 C ASN A 79 -5.320 -16.819 1.469 1.00 0.39 C ATOM 974 O ASN A 79 -4.408 -17.392 2.034 1.00 0.43 O ATOM 975 CB ASN A 79 -7.359 -17.988 0.594 1.00 0.50 C ATOM 976 CG ASN A 79 -8.347 -19.020 1.141 1.00 0.65 C ATOM 977 OD1 ASN A 79 -7.983 -19.866 1.933 1.00 1.00 O ATOM 978 ND2 ASN A 79 -9.591 -18.988 0.750 1.00 0.62 N ATOM 0 H ASN A 79 -8.295 -15.813 1.092 1.00 0.37 H new ATOM 0 HA ASN A 79 -6.822 -17.737 2.683 1.00 0.42 H new ATOM 0 HB2 ASN A 79 -7.861 -17.328 -0.113 1.00 0.50 H new ATOM 0 HB3 ASN A 79 -6.558 -18.489 0.049 1.00 0.50 H new ATOM 0 HD21 ASN A 79 -10.256 -19.673 1.109 1.00 0.62 H new ATOM 0 HD22 ASN A 79 -9.898 -18.278 0.085 1.00 0.62 H new ATOM 985 N VAL A 80 -5.106 -15.853 0.609 1.00 0.35 N ATOM 986 CA VAL A 80 -3.716 -15.416 0.288 1.00 0.34 C ATOM 987 C VAL A 80 -3.034 -14.965 1.581 1.00 0.33 C ATOM 988 O VAL A 80 -1.922 -15.359 1.881 1.00 0.33 O ATOM 989 CB VAL A 80 -3.893 -14.251 -0.707 1.00 0.37 C ATOM 990 CG1 VAL A 80 -2.950 -13.088 -0.371 1.00 0.42 C ATOM 991 CG2 VAL A 80 -3.590 -14.747 -2.121 1.00 0.50 C ATOM 0 H VAL A 80 -5.840 -15.347 0.114 1.00 0.35 H new ATOM 0 HA VAL A 80 -3.094 -16.201 -0.142 1.00 0.34 H new ATOM 0 HB VAL A 80 -4.921 -13.894 -0.640 1.00 0.37 H new ATOM 0 HG11 VAL A 80 -3.097 -12.281 -1.089 1.00 0.42 H new ATOM 0 HG12 VAL A 80 -3.165 -12.723 0.633 1.00 0.42 H new ATOM 0 HG13 VAL A 80 -1.917 -13.432 -0.418 1.00 0.42 H new ATOM 0 HG21 VAL A 80 -3.714 -13.927 -2.828 1.00 0.50 H new ATOM 0 HG22 VAL A 80 -2.564 -15.114 -2.166 1.00 0.50 H new ATOM 0 HG23 VAL A 80 -4.276 -15.555 -2.378 1.00 0.50 H new ATOM 1001 N LEU A 81 -3.711 -14.152 2.353 1.00 0.35 N ATOM 1002 CA LEU A 81 -3.130 -13.675 3.641 1.00 0.36 C ATOM 1003 C LEU A 81 -2.813 -14.878 4.531 1.00 0.36 C ATOM 1004 O LEU A 81 -1.857 -14.875 5.285 1.00 0.38 O ATOM 1005 CB LEU A 81 -4.218 -12.804 4.269 1.00 0.41 C ATOM 1006 CG LEU A 81 -3.706 -11.369 4.412 1.00 0.82 C ATOM 1007 CD1 LEU A 81 -4.193 -10.533 3.227 1.00 1.44 C ATOM 1008 CD2 LEU A 81 -4.242 -10.771 5.713 1.00 1.44 C ATOM 0 H LEU A 81 -4.644 -13.798 2.144 1.00 0.35 H new ATOM 0 HA LEU A 81 -2.202 -13.118 3.507 1.00 0.36 H new ATOM 0 HB2 LEU A 81 -5.115 -12.821 3.650 1.00 0.41 H new ATOM 0 HB3 LEU A 81 -4.497 -13.200 5.245 1.00 0.41 H new ATOM 0 HG LEU A 81 -2.616 -11.369 4.431 1.00 0.82 H new ATOM 0 HD11 LEU A 81 -3.828 -9.511 3.329 1.00 1.44 H new ATOM 0 HD12 LEU A 81 -3.815 -10.962 2.299 1.00 1.44 H new ATOM 0 HD13 LEU A 81 -5.283 -10.529 3.208 1.00 1.44 H new ATOM 0 HD21 LEU A 81 -3.880 -9.748 5.820 1.00 1.44 H new ATOM 0 HD22 LEU A 81 -5.332 -10.770 5.691 1.00 1.44 H new ATOM 0 HD23 LEU A 81 -3.897 -11.368 6.557 1.00 1.44 H new ATOM 1020 N ARG A 82 -3.601 -15.918 4.429 1.00 0.38 N ATOM 1021 CA ARG A 82 -3.334 -17.135 5.246 1.00 0.41 C ATOM 1022 C ARG A 82 -2.020 -17.757 4.772 1.00 0.38 C ATOM 1023 O ARG A 82 -1.207 -18.202 5.562 1.00 0.37 O ATOM 1024 CB ARG A 82 -4.513 -18.076 4.977 1.00 0.47 C ATOM 1025 CG ARG A 82 -5.291 -18.308 6.274 1.00 0.64 C ATOM 1026 CD ARG A 82 -5.911 -16.989 6.741 1.00 0.79 C ATOM 1027 NE ARG A 82 -7.080 -17.387 7.574 1.00 1.00 N ATOM 1028 CZ ARG A 82 -8.290 -17.106 7.176 1.00 1.10 C ATOM 1029 NH1 ARG A 82 -8.813 -15.941 7.448 1.00 1.30 N ATOM 1030 NH2 ARG A 82 -8.978 -17.989 6.506 1.00 1.28 N ATOM 0 H ARG A 82 -4.415 -15.975 3.817 1.00 0.38 H new ATOM 0 HA ARG A 82 -3.242 -16.925 6.312 1.00 0.41 H new ATOM 0 HB2 ARG A 82 -5.169 -17.646 4.220 1.00 0.47 H new ATOM 0 HB3 ARG A 82 -4.151 -19.026 4.583 1.00 0.47 H new ATOM 0 HG2 ARG A 82 -6.071 -19.052 6.114 1.00 0.64 H new ATOM 0 HG3 ARG A 82 -4.627 -18.702 7.043 1.00 0.64 H new ATOM 0 HD2 ARG A 82 -5.198 -16.400 7.317 1.00 0.79 H new ATOM 0 HD3 ARG A 82 -6.220 -16.376 5.894 1.00 0.79 H new ATOM 0 HE ARG A 82 -6.934 -17.879 8.455 1.00 1.00 H new ATOM 0 HH11 ARG A 82 -8.275 -15.250 7.972 1.00 1.30 H new ATOM 0 HH12 ARG A 82 -9.759 -15.722 7.137 1.00 1.30 H new ATOM 0 HH21 ARG A 82 -8.570 -18.899 6.293 1.00 1.28 H new ATOM 0 HH22 ARG A 82 -9.924 -17.769 6.195 1.00 1.28 H new ATOM 1044 N GLY A 83 -1.805 -17.764 3.480 1.00 0.39 N ATOM 1045 CA GLY A 83 -0.541 -18.325 2.928 1.00 0.39 C ATOM 1046 C GLY A 83 0.616 -17.422 3.350 1.00 0.35 C ATOM 1047 O GLY A 83 1.719 -17.879 3.580 1.00 0.36 O ATOM 0 H GLY A 83 -2.456 -17.403 2.783 1.00 0.39 H new ATOM 0 HA2 GLY A 83 -0.384 -19.339 3.297 1.00 0.39 H new ATOM 0 HA3 GLY A 83 -0.597 -18.386 1.841 1.00 0.39 H new ATOM 1051 N PHE A 84 0.362 -16.140 3.469 1.00 0.35 N ATOM 1052 CA PHE A 84 1.437 -15.195 3.896 1.00 0.34 C ATOM 1053 C PHE A 84 1.949 -15.607 5.276 1.00 0.31 C ATOM 1054 O PHE A 84 3.138 -15.744 5.493 1.00 0.32 O ATOM 1055 CB PHE A 84 0.766 -13.821 3.967 1.00 0.37 C ATOM 1056 CG PHE A 84 1.065 -13.035 2.723 1.00 0.39 C ATOM 1057 CD1 PHE A 84 2.335 -12.484 2.530 1.00 0.56 C ATOM 1058 CD2 PHE A 84 0.062 -12.845 1.767 1.00 0.65 C ATOM 1059 CE1 PHE A 84 2.602 -11.742 1.377 1.00 0.65 C ATOM 1060 CE2 PHE A 84 0.330 -12.107 0.615 1.00 0.79 C ATOM 1061 CZ PHE A 84 1.598 -11.555 0.421 1.00 0.67 C ATOM 0 H PHE A 84 -0.545 -15.709 3.288 1.00 0.35 H new ATOM 0 HA PHE A 84 2.286 -15.190 3.212 1.00 0.34 H new ATOM 0 HB2 PHE A 84 -0.311 -13.940 4.081 1.00 0.37 H new ATOM 0 HB3 PHE A 84 1.122 -13.279 4.843 1.00 0.37 H new ATOM 0 HD1 PHE A 84 3.108 -12.632 3.270 1.00 0.56 H new ATOM 0 HD2 PHE A 84 -0.919 -13.270 1.921 1.00 0.65 H new ATOM 0 HE1 PHE A 84 3.582 -11.314 1.224 1.00 0.65 H new ATOM 0 HE2 PHE A 84 -0.442 -11.962 -0.126 1.00 0.79 H new ATOM 0 HZ PHE A 84 1.804 -10.981 -0.471 1.00 0.67 H new ATOM 1071 N ARG A 85 1.050 -15.814 6.207 1.00 0.32 N ATOM 1072 CA ARG A 85 1.464 -16.228 7.581 1.00 0.32 C ATOM 1073 C ARG A 85 2.222 -17.557 7.519 1.00 0.30 C ATOM 1074 O ARG A 85 3.239 -17.731 8.163 1.00 0.33 O ATOM 1075 CB ARG A 85 0.157 -16.389 8.360 1.00 0.38 C ATOM 1076 CG ARG A 85 0.442 -16.300 9.860 1.00 0.41 C ATOM 1077 CD ARG A 85 0.866 -17.675 10.382 1.00 0.64 C ATOM 1078 NE ARG A 85 0.852 -17.547 11.866 1.00 0.76 N ATOM 1079 CZ ARG A 85 1.268 -18.536 12.609 1.00 0.86 C ATOM 1080 NH1 ARG A 85 2.386 -19.143 12.319 1.00 1.22 N ATOM 1081 NH2 ARG A 85 0.565 -18.919 13.639 1.00 0.76 N ATOM 0 H ARG A 85 0.044 -15.713 6.072 1.00 0.32 H new ATOM 0 HA ARG A 85 2.127 -15.502 8.052 1.00 0.32 H new ATOM 0 HB2 ARG A 85 -0.551 -15.614 8.067 1.00 0.38 H new ATOM 0 HB3 ARG A 85 -0.304 -17.348 8.123 1.00 0.38 H new ATOM 0 HG2 ARG A 85 1.229 -15.569 10.049 1.00 0.41 H new ATOM 0 HG3 ARG A 85 -0.446 -15.956 10.390 1.00 0.41 H new ATOM 0 HD2 ARG A 85 0.180 -18.453 10.047 1.00 0.64 H new ATOM 0 HD3 ARG A 85 1.857 -17.946 10.019 1.00 0.64 H new ATOM 0 HE ARG A 85 0.518 -16.687 12.301 1.00 0.76 H new ATOM 0 HH11 ARG A 85 2.934 -18.844 11.512 1.00 1.22 H new ATOM 0 HH12 ARG A 85 2.712 -19.916 12.899 1.00 1.22 H new ATOM 0 HH21 ARG A 85 -0.310 -18.445 13.864 1.00 0.76 H new ATOM 0 HH22 ARG A 85 0.890 -19.692 14.220 1.00 0.76 H new ATOM 1095 N LYS A 86 1.737 -18.493 6.742 1.00 0.32 N ATOM 1096 CA LYS A 86 2.433 -19.810 6.630 1.00 0.34 C ATOM 1097 C LYS A 86 3.795 -19.619 5.957 1.00 0.33 C ATOM 1098 O LYS A 86 4.787 -20.196 6.364 1.00 0.38 O ATOM 1099 CB LYS A 86 1.518 -20.677 5.761 1.00 0.40 C ATOM 1100 CG LYS A 86 0.786 -21.692 6.641 1.00 0.52 C ATOM 1101 CD LYS A 86 -0.480 -21.052 7.215 1.00 0.55 C ATOM 1102 CE LYS A 86 -0.156 -20.393 8.557 1.00 0.49 C ATOM 1103 NZ LYS A 86 -1.479 -20.026 9.135 1.00 0.66 N ATOM 0 H LYS A 86 0.890 -18.402 6.181 1.00 0.32 H new ATOM 0 HA LYS A 86 2.614 -20.269 7.602 1.00 0.34 H new ATOM 0 HB2 LYS A 86 0.798 -20.050 5.235 1.00 0.40 H new ATOM 0 HB3 LYS A 86 2.104 -21.195 5.002 1.00 0.40 H new ATOM 0 HG2 LYS A 86 0.527 -22.575 6.057 1.00 0.52 H new ATOM 0 HG3 LYS A 86 1.437 -22.024 7.450 1.00 0.52 H new ATOM 0 HD2 LYS A 86 -0.873 -20.311 6.519 1.00 0.55 H new ATOM 0 HD3 LYS A 86 -1.255 -21.808 7.347 1.00 0.55 H new ATOM 0 HE2 LYS A 86 0.385 -21.076 9.212 1.00 0.49 H new ATOM 0 HE3 LYS A 86 0.474 -19.514 8.423 1.00 0.49 H new ATOM 0 HZ1 LYS A 86 -1.538 -20.371 10.115 1.00 0.66 H new ATOM 0 HZ2 LYS A 86 -1.587 -18.992 9.125 1.00 0.66 H new ATOM 0 HZ3 LYS A 86 -2.237 -20.459 8.570 1.00 0.66 H new ATOM 1117 N GLU A 87 3.845 -18.804 4.934 1.00 0.34 N ATOM 1118 CA GLU A 87 5.137 -18.557 4.226 1.00 0.36 C ATOM 1119 C GLU A 87 6.100 -17.805 5.148 1.00 0.34 C ATOM 1120 O GLU A 87 7.271 -18.126 5.229 1.00 0.37 O ATOM 1121 CB GLU A 87 4.769 -17.701 3.013 1.00 0.42 C ATOM 1122 CG GLU A 87 4.457 -18.608 1.817 1.00 0.46 C ATOM 1123 CD GLU A 87 5.489 -18.379 0.710 1.00 0.46 C ATOM 1124 OE1 GLU A 87 5.788 -17.228 0.432 1.00 0.68 O ATOM 1125 OE2 GLU A 87 5.962 -19.358 0.158 1.00 0.74 O ATOM 0 H GLU A 87 3.044 -18.297 4.558 1.00 0.34 H new ATOM 0 HA GLU A 87 5.634 -19.481 3.930 1.00 0.36 H new ATOM 0 HB2 GLU A 87 3.905 -17.078 3.244 1.00 0.42 H new ATOM 0 HB3 GLU A 87 5.591 -17.029 2.767 1.00 0.42 H new ATOM 0 HG2 GLU A 87 4.469 -19.653 2.128 1.00 0.46 H new ATOM 0 HG3 GLU A 87 3.455 -18.399 1.442 1.00 0.46 H new ATOM 1132 N ILE A 88 5.615 -16.811 5.852 1.00 0.32 N ATOM 1133 CA ILE A 88 6.506 -16.052 6.776 1.00 0.33 C ATOM 1134 C ILE A 88 6.981 -16.991 7.892 1.00 0.29 C ATOM 1135 O ILE A 88 8.106 -16.910 8.355 1.00 0.32 O ATOM 1136 CB ILE A 88 5.646 -14.878 7.295 1.00 0.37 C ATOM 1137 CG1 ILE A 88 6.528 -13.633 7.435 1.00 0.42 C ATOM 1138 CG2 ILE A 88 4.997 -15.194 8.653 1.00 0.38 C ATOM 1139 CD1 ILE A 88 6.322 -12.721 6.224 1.00 0.50 C ATOM 0 H ILE A 88 4.645 -16.496 5.825 1.00 0.32 H new ATOM 0 HA ILE A 88 7.408 -15.666 6.302 1.00 0.33 H new ATOM 0 HB ILE A 88 4.846 -14.706 6.575 1.00 0.37 H new ATOM 0 HG12 ILE A 88 6.278 -13.099 8.352 1.00 0.42 H new ATOM 0 HG13 ILE A 88 7.576 -13.924 7.510 1.00 0.42 H new ATOM 0 HG21 ILE A 88 4.402 -14.341 8.979 1.00 0.38 H new ATOM 0 HG22 ILE A 88 4.354 -16.068 8.554 1.00 0.38 H new ATOM 0 HG23 ILE A 88 5.775 -15.397 9.389 1.00 0.38 H new ATOM 0 HD11 ILE A 88 6.950 -11.836 6.324 1.00 0.50 H new ATOM 0 HD12 ILE A 88 6.593 -13.257 5.315 1.00 0.50 H new ATOM 0 HD13 ILE A 88 5.276 -12.420 6.169 1.00 0.50 H new ATOM 1151 N GLY A 89 6.133 -17.905 8.302 1.00 0.29 N ATOM 1152 CA GLY A 89 6.529 -18.876 9.362 1.00 0.31 C ATOM 1153 C GLY A 89 7.707 -19.692 8.837 1.00 0.29 C ATOM 1154 O GLY A 89 8.665 -19.951 9.541 1.00 0.33 O ATOM 0 H GLY A 89 5.184 -18.017 7.946 1.00 0.29 H new ATOM 0 HA2 GLY A 89 6.806 -18.351 10.276 1.00 0.31 H new ATOM 0 HA3 GLY A 89 5.693 -19.530 9.611 1.00 0.31 H new ATOM 1158 N ARG A 90 7.648 -20.075 7.587 1.00 0.28 N ATOM 1159 CA ARG A 90 8.770 -20.850 6.989 1.00 0.29 C ATOM 1160 C ARG A 90 10.019 -19.973 6.964 1.00 0.29 C ATOM 1161 O ARG A 90 11.126 -20.450 7.133 1.00 0.33 O ATOM 1162 CB ARG A 90 8.326 -21.177 5.563 1.00 0.31 C ATOM 1163 CG ARG A 90 7.417 -22.404 5.570 1.00 0.36 C ATOM 1164 CD ARG A 90 6.829 -22.596 4.172 1.00 0.44 C ATOM 1165 NE ARG A 90 5.901 -23.754 4.297 1.00 0.66 N ATOM 1166 CZ ARG A 90 5.006 -23.975 3.373 1.00 0.43 C ATOM 1167 NH1 ARG A 90 3.910 -23.268 3.346 1.00 0.85 N ATOM 1168 NH2 ARG A 90 5.207 -24.902 2.477 1.00 0.85 N ATOM 0 H ARG A 90 6.870 -19.883 6.956 1.00 0.28 H new ATOM 0 HA ARG A 90 9.002 -21.755 7.551 1.00 0.29 H new ATOM 0 HB2 ARG A 90 7.799 -20.326 5.133 1.00 0.31 H new ATOM 0 HB3 ARG A 90 9.197 -21.363 4.935 1.00 0.31 H new ATOM 0 HG2 ARG A 90 7.981 -23.289 5.866 1.00 0.36 H new ATOM 0 HG3 ARG A 90 6.618 -22.276 6.300 1.00 0.36 H new ATOM 0 HD2 ARG A 90 6.301 -21.702 3.840 1.00 0.44 H new ATOM 0 HD3 ARG A 90 7.611 -22.795 3.439 1.00 0.44 H new ATOM 0 HE ARG A 90 5.965 -24.374 5.104 1.00 0.66 H new ATOM 0 HH11 ARG A 90 3.753 -22.543 4.046 1.00 0.85 H new ATOM 0 HH12 ARG A 90 3.210 -23.440 2.624 1.00 0.85 H new ATOM 0 HH21 ARG A 90 6.064 -25.455 2.498 1.00 0.85 H new ATOM 0 HH22 ARG A 90 4.507 -25.074 1.755 1.00 0.85 H new ATOM 1182 N MET A 91 9.837 -18.682 6.780 1.00 0.27 N ATOM 1183 CA MET A 91 11.001 -17.750 6.761 1.00 0.29 C ATOM 1184 C MET A 91 11.740 -17.889 8.081 1.00 0.29 C ATOM 1185 O MET A 91 12.954 -17.961 8.129 1.00 0.33 O ATOM 1186 CB MET A 91 10.397 -16.349 6.611 1.00 0.31 C ATOM 1187 CG MET A 91 11.145 -15.580 5.520 1.00 0.52 C ATOM 1188 SD MET A 91 10.403 -13.940 5.325 1.00 0.56 S ATOM 1189 CE MET A 91 9.143 -14.399 4.109 1.00 0.85 C ATOM 0 H MET A 91 8.928 -18.239 6.643 1.00 0.27 H new ATOM 0 HA MET A 91 11.708 -17.953 5.956 1.00 0.29 H new ATOM 0 HB2 MET A 91 9.340 -16.423 6.357 1.00 0.31 H new ATOM 0 HB3 MET A 91 10.461 -15.812 7.557 1.00 0.31 H new ATOM 0 HG2 MET A 91 12.199 -15.486 5.783 1.00 0.52 H new ATOM 0 HG3 MET A 91 11.099 -16.126 4.578 1.00 0.52 H new ATOM 0 HE1 MET A 91 9.457 -14.070 3.118 1.00 0.85 H new ATOM 0 HE2 MET A 91 9.015 -15.481 4.109 1.00 0.85 H new ATOM 0 HE3 MET A 91 8.198 -13.922 4.367 1.00 0.85 H new ATOM 1199 N LEU A 92 10.998 -17.967 9.152 1.00 0.28 N ATOM 1200 CA LEU A 92 11.623 -18.144 10.490 1.00 0.30 C ATOM 1201 C LEU A 92 12.355 -19.470 10.512 1.00 0.33 C ATOM 1202 O LEU A 92 13.469 -19.565 10.993 1.00 0.37 O ATOM 1203 CB LEU A 92 10.462 -18.126 11.464 1.00 0.31 C ATOM 1204 CG LEU A 92 9.812 -16.757 11.371 1.00 0.30 C ATOM 1205 CD1 LEU A 92 8.307 -16.876 11.633 1.00 0.35 C ATOM 1206 CD2 LEU A 92 10.448 -15.817 12.402 1.00 0.33 C ATOM 0 H LEU A 92 9.979 -17.915 9.156 1.00 0.28 H new ATOM 0 HA LEU A 92 12.351 -17.373 10.741 1.00 0.30 H new ATOM 0 HB2 LEU A 92 9.744 -18.909 11.220 1.00 0.31 H new ATOM 0 HB3 LEU A 92 10.810 -18.318 12.479 1.00 0.31 H new ATOM 0 HG LEU A 92 9.966 -16.352 10.371 1.00 0.30 H new ATOM 0 HD11 LEU A 92 7.847 -15.890 11.565 1.00 0.35 H new ATOM 0 HD12 LEU A 92 7.860 -17.537 10.891 1.00 0.35 H new ATOM 0 HD13 LEU A 92 8.142 -17.285 12.630 1.00 0.35 H new ATOM 0 HD21 LEU A 92 9.981 -14.834 12.335 1.00 0.33 H new ATOM 0 HD22 LEU A 92 10.300 -16.222 13.403 1.00 0.33 H new ATOM 0 HD23 LEU A 92 11.516 -15.726 12.202 1.00 0.33 H new ATOM 1218 N ASN A 93 11.751 -20.487 9.949 1.00 0.34 N ATOM 1219 CA ASN A 93 12.429 -21.811 9.885 1.00 0.38 C ATOM 1220 C ASN A 93 13.779 -21.620 9.190 1.00 0.39 C ATOM 1221 O ASN A 93 14.718 -22.359 9.415 1.00 0.44 O ATOM 1222 CB ASN A 93 11.505 -22.703 9.050 1.00 0.42 C ATOM 1223 CG ASN A 93 11.257 -24.017 9.793 1.00 0.62 C ATOM 1224 OD1 ASN A 93 12.108 -24.884 9.820 1.00 0.87 O ATOM 1225 ND2 ASN A 93 10.118 -24.203 10.403 1.00 0.96 N ATOM 0 H ASN A 93 10.820 -20.455 9.533 1.00 0.34 H new ATOM 0 HA ASN A 93 12.610 -22.253 10.865 1.00 0.38 H new ATOM 0 HB2 ASN A 93 10.559 -22.193 8.865 1.00 0.42 H new ATOM 0 HB3 ASN A 93 11.955 -22.902 8.078 1.00 0.42 H new ATOM 0 HD21 ASN A 93 9.943 -25.075 10.902 1.00 0.96 H new ATOM 0 HD22 ASN A 93 9.403 -23.476 10.381 1.00 0.96 H new ATOM 1232 N ILE A 94 13.876 -20.606 8.357 1.00 0.36 N ATOM 1233 CA ILE A 94 15.162 -20.331 7.654 1.00 0.38 C ATOM 1234 C ILE A 94 16.057 -19.440 8.520 1.00 0.37 C ATOM 1235 O ILE A 94 17.264 -19.601 8.524 1.00 0.44 O ATOM 1236 CB ILE A 94 14.809 -19.599 6.352 1.00 0.36 C ATOM 1237 CG1 ILE A 94 13.526 -20.188 5.742 1.00 0.39 C ATOM 1238 CG2 ILE A 94 15.979 -19.740 5.372 1.00 0.40 C ATOM 1239 CD1 ILE A 94 13.619 -20.239 4.211 1.00 0.50 C ATOM 0 H ILE A 94 13.117 -19.961 8.138 1.00 0.36 H new ATOM 0 HA ILE A 94 15.700 -21.258 7.454 1.00 0.38 H new ATOM 0 HB ILE A 94 14.633 -18.544 6.560 1.00 0.36 H new ATOM 0 HG12 ILE A 94 13.360 -21.192 6.134 1.00 0.39 H new ATOM 0 HG13 ILE A 94 12.668 -19.585 6.038 1.00 0.39 H new ATOM 0 HG21 ILE A 94 15.739 -19.223 4.443 1.00 0.40 H new ATOM 0 HG22 ILE A 94 16.876 -19.301 5.810 1.00 0.40 H new ATOM 0 HG23 ILE A 94 16.155 -20.796 5.165 1.00 0.40 H new ATOM 0 HD11 ILE A 94 12.699 -20.659 3.804 1.00 0.50 H new ATOM 0 HD12 ILE A 94 13.760 -19.231 3.821 1.00 0.50 H new ATOM 0 HD13 ILE A 94 14.463 -20.863 3.918 1.00 0.50 H new ATOM 1251 N LEU A 95 15.496 -18.489 9.243 1.00 0.33 N ATOM 1252 CA LEU A 95 16.374 -17.603 10.075 1.00 0.34 C ATOM 1253 C LEU A 95 16.488 -18.120 11.517 1.00 0.38 C ATOM 1254 O LEU A 95 16.990 -17.433 12.386 1.00 0.44 O ATOM 1255 CB LEU A 95 15.740 -16.210 10.032 1.00 0.32 C ATOM 1256 CG LEU A 95 14.303 -16.268 10.534 1.00 0.32 C ATOM 1257 CD1 LEU A 95 14.223 -15.644 11.926 1.00 0.40 C ATOM 1258 CD2 LEU A 95 13.404 -15.489 9.570 1.00 0.33 C ATOM 0 H LEU A 95 14.496 -18.294 9.291 1.00 0.33 H new ATOM 0 HA LEU A 95 17.391 -17.584 9.684 1.00 0.34 H new ATOM 0 HB2 LEU A 95 16.319 -15.520 10.646 1.00 0.32 H new ATOM 0 HB3 LEU A 95 15.761 -15.825 9.013 1.00 0.32 H new ATOM 0 HG LEU A 95 13.973 -17.306 10.586 1.00 0.32 H new ATOM 0 HD11 LEU A 95 13.195 -15.686 12.285 1.00 0.40 H new ATOM 0 HD12 LEU A 95 14.868 -16.195 12.610 1.00 0.40 H new ATOM 0 HD13 LEU A 95 14.549 -14.605 11.878 1.00 0.40 H new ATOM 0 HD21 LEU A 95 12.373 -15.526 9.923 1.00 0.33 H new ATOM 0 HD22 LEU A 95 13.734 -14.451 9.523 1.00 0.33 H new ATOM 0 HD23 LEU A 95 13.464 -15.934 8.577 1.00 0.33 H new ATOM 1270 N ASN A 96 16.050 -19.331 11.770 1.00 0.38 N ATOM 1271 CA ASN A 96 16.159 -19.901 13.151 1.00 0.43 C ATOM 1272 C ASN A 96 17.004 -21.182 13.134 1.00 0.49 C ATOM 1273 O ASN A 96 17.341 -21.725 14.169 1.00 0.56 O ATOM 1274 CB ASN A 96 14.727 -20.217 13.579 1.00 0.46 C ATOM 1275 CG ASN A 96 14.009 -18.918 13.952 1.00 0.54 C ATOM 1276 OD1 ASN A 96 14.591 -18.038 14.555 1.00 0.65 O ATOM 1277 ND2 ASN A 96 12.759 -18.761 13.619 1.00 0.68 N ATOM 0 H ASN A 96 15.622 -19.949 11.080 1.00 0.38 H new ATOM 0 HA ASN A 96 16.642 -19.206 13.838 1.00 0.43 H new ATOM 0 HB2 ASN A 96 14.196 -20.719 12.770 1.00 0.46 H new ATOM 0 HB3 ASN A 96 14.732 -20.900 14.429 1.00 0.46 H new ATOM 0 HD21 ASN A 96 12.270 -17.900 13.864 1.00 0.68 H new ATOM 0 HD22 ASN A 96 12.270 -19.499 13.113 1.00 0.68 H new ATOM 1738 N PRO B 43 11.394 0.094 12.535 1.00 0.38 N ATOM 1739 CA PRO B 43 10.641 -1.051 11.983 1.00 0.37 C ATOM 1740 C PRO B 43 11.606 -2.116 11.453 1.00 0.33 C ATOM 1741 O PRO B 43 11.451 -3.293 11.718 1.00 0.40 O ATOM 1742 CB PRO B 43 9.837 -0.430 10.847 1.00 0.40 C ATOM 1743 CG PRO B 43 10.602 0.790 10.427 1.00 0.41 C ATOM 1744 CD PRO B 43 11.540 1.172 11.550 1.00 0.40 C ATOM 0 HA PRO B 43 10.013 -1.551 12.720 1.00 0.37 H new ATOM 0 HB2 PRO B 43 9.728 -1.128 10.017 1.00 0.40 H new ATOM 0 HB3 PRO B 43 8.832 -0.167 11.177 1.00 0.40 H new ATOM 0 HG2 PRO B 43 11.164 0.591 9.514 1.00 0.41 H new ATOM 0 HG3 PRO B 43 9.918 1.610 10.208 1.00 0.41 H new ATOM 0 HD2 PRO B 43 12.569 1.251 11.198 1.00 0.40 H new ATOM 0 HD3 PRO B 43 11.274 2.139 11.978 1.00 0.40 H new ATOM 1752 N LEU B 44 12.598 -1.703 10.703 1.00 0.31 N ATOM 1753 CA LEU B 44 13.589 -2.670 10.138 1.00 0.32 C ATOM 1754 C LEU B 44 12.881 -3.767 9.339 1.00 0.32 C ATOM 1755 O LEU B 44 13.406 -4.847 9.149 1.00 0.51 O ATOM 1756 CB LEU B 44 14.312 -3.271 11.342 1.00 0.38 C ATOM 1757 CG LEU B 44 15.609 -3.930 10.867 1.00 0.49 C ATOM 1758 CD1 LEU B 44 16.777 -3.445 11.728 1.00 0.68 C ATOM 1759 CD2 LEU B 44 15.489 -5.454 10.981 1.00 0.56 C ATOM 0 H LEU B 44 12.765 -0.728 10.456 1.00 0.31 H new ATOM 0 HA LEU B 44 14.281 -2.178 9.454 1.00 0.32 H new ATOM 0 HB2 LEU B 44 14.531 -2.495 12.076 1.00 0.38 H new ATOM 0 HB3 LEU B 44 13.675 -4.005 11.835 1.00 0.38 H new ATOM 0 HG LEU B 44 15.787 -3.659 9.826 1.00 0.49 H new ATOM 0 HD11 LEU B 44 17.700 -3.916 11.388 1.00 0.68 H new ATOM 0 HD12 LEU B 44 16.868 -2.362 11.641 1.00 0.68 H new ATOM 0 HD13 LEU B 44 16.596 -3.711 12.769 1.00 0.68 H new ATOM 0 HD21 LEU B 44 16.415 -5.918 10.642 1.00 0.56 H new ATOM 0 HD22 LEU B 44 15.305 -5.728 12.020 1.00 0.56 H new ATOM 0 HD23 LEU B 44 14.661 -5.801 10.363 1.00 0.56 H new ATOM 1771 N LYS B 45 11.697 -3.490 8.865 1.00 0.28 N ATOM 1772 CA LYS B 45 10.947 -4.504 8.067 1.00 0.29 C ATOM 1773 C LYS B 45 11.086 -4.197 6.572 1.00 0.29 C ATOM 1774 O LYS B 45 10.840 -5.039 5.735 1.00 0.35 O ATOM 1775 CB LYS B 45 9.488 -4.376 8.521 1.00 0.33 C ATOM 1776 CG LYS B 45 8.906 -3.036 8.055 1.00 0.36 C ATOM 1777 CD LYS B 45 7.440 -2.933 8.492 1.00 0.40 C ATOM 1778 CE LYS B 45 7.265 -1.733 9.427 1.00 0.50 C ATOM 1779 NZ LYS B 45 5.857 -1.291 9.226 1.00 0.36 N ATOM 0 H LYS B 45 11.214 -2.601 8.996 1.00 0.28 H new ATOM 0 HA LYS B 45 11.323 -5.516 8.219 1.00 0.29 H new ATOM 0 HB2 LYS B 45 8.899 -5.198 8.114 1.00 0.33 H new ATOM 0 HB3 LYS B 45 9.429 -4.449 9.607 1.00 0.33 H new ATOM 0 HG2 LYS B 45 9.481 -2.212 8.477 1.00 0.36 H new ATOM 0 HG3 LYS B 45 8.980 -2.953 6.971 1.00 0.36 H new ATOM 0 HD2 LYS B 45 6.797 -2.823 7.619 1.00 0.40 H new ATOM 0 HD3 LYS B 45 7.136 -3.849 8.999 1.00 0.40 H new ATOM 0 HE2 LYS B 45 7.447 -2.011 10.465 1.00 0.50 H new ATOM 0 HE3 LYS B 45 7.968 -0.936 9.183 1.00 0.50 H new ATOM 0 HZ1 LYS B 45 5.645 -0.503 9.871 1.00 0.36 H new ATOM 0 HZ2 LYS B 45 5.728 -0.978 8.243 1.00 0.36 H new ATOM 0 HZ3 LYS B 45 5.213 -2.083 9.424 1.00 0.36 H new ATOM 1793 N LEU B 46 11.476 -2.989 6.243 1.00 0.27 N ATOM 1794 CA LEU B 46 11.641 -2.597 4.809 1.00 0.29 C ATOM 1795 C LEU B 46 12.501 -3.625 4.058 1.00 0.28 C ATOM 1796 O LEU B 46 12.255 -3.922 2.901 1.00 0.32 O ATOM 1797 CB LEU B 46 12.350 -1.237 4.856 1.00 0.32 C ATOM 1798 CG LEU B 46 11.560 -0.208 4.038 1.00 0.47 C ATOM 1799 CD1 LEU B 46 11.096 0.927 4.953 1.00 0.61 C ATOM 1800 CD2 LEU B 46 12.455 0.363 2.936 1.00 0.66 C ATOM 0 H LEU B 46 11.689 -2.251 6.914 1.00 0.27 H new ATOM 0 HA LEU B 46 10.686 -2.550 4.285 1.00 0.29 H new ATOM 0 HB2 LEU B 46 12.442 -0.900 5.889 1.00 0.32 H new ATOM 0 HB3 LEU B 46 13.361 -1.330 4.460 1.00 0.32 H new ATOM 0 HG LEU B 46 10.692 -0.692 3.590 1.00 0.47 H new ATOM 0 HD11 LEU B 46 10.535 1.658 4.370 1.00 0.61 H new ATOM 0 HD12 LEU B 46 10.459 0.523 5.739 1.00 0.61 H new ATOM 0 HD13 LEU B 46 11.964 1.410 5.402 1.00 0.61 H new ATOM 0 HD21 LEU B 46 11.894 1.094 2.354 1.00 0.66 H new ATOM 0 HD22 LEU B 46 13.323 0.845 3.386 1.00 0.66 H new ATOM 0 HD23 LEU B 46 12.786 -0.444 2.282 1.00 0.66 H new ATOM 1812 N PHE B 47 13.491 -4.187 4.711 1.00 0.28 N ATOM 1813 CA PHE B 47 14.349 -5.203 4.035 1.00 0.29 C ATOM 1814 C PHE B 47 13.608 -6.534 4.023 1.00 0.29 C ATOM 1815 O PHE B 47 13.574 -7.234 3.028 1.00 0.31 O ATOM 1816 CB PHE B 47 15.625 -5.293 4.882 1.00 0.32 C ATOM 1817 CG PHE B 47 16.385 -6.550 4.522 1.00 0.33 C ATOM 1818 CD1 PHE B 47 16.688 -6.826 3.182 1.00 0.43 C ATOM 1819 CD2 PHE B 47 16.775 -7.446 5.526 1.00 0.39 C ATOM 1820 CE1 PHE B 47 17.381 -7.995 2.849 1.00 0.56 C ATOM 1821 CE2 PHE B 47 17.466 -8.616 5.191 1.00 0.51 C ATOM 1822 CZ PHE B 47 17.769 -8.890 3.853 1.00 0.58 C ATOM 0 H PHE B 47 13.739 -3.985 5.680 1.00 0.28 H new ATOM 0 HA PHE B 47 14.587 -4.943 3.003 1.00 0.29 H new ATOM 0 HB2 PHE B 47 16.250 -4.416 4.711 1.00 0.32 H new ATOM 0 HB3 PHE B 47 15.370 -5.301 5.942 1.00 0.32 H new ATOM 0 HD1 PHE B 47 16.387 -6.137 2.407 1.00 0.43 H new ATOM 0 HD2 PHE B 47 16.542 -7.234 6.559 1.00 0.39 H new ATOM 0 HE1 PHE B 47 17.617 -8.207 1.817 1.00 0.56 H new ATOM 0 HE2 PHE B 47 17.765 -9.307 5.965 1.00 0.51 H new ATOM 0 HZ PHE B 47 18.303 -9.793 3.594 1.00 0.58 H new ATOM 1832 N MET B 48 13.002 -6.871 5.128 1.00 0.33 N ATOM 1833 CA MET B 48 12.236 -8.141 5.211 1.00 0.36 C ATOM 1834 C MET B 48 11.138 -8.137 4.150 1.00 0.34 C ATOM 1835 O MET B 48 11.034 -9.041 3.348 1.00 0.38 O ATOM 1836 CB MET B 48 11.632 -8.136 6.614 1.00 0.42 C ATOM 1837 CG MET B 48 11.590 -9.563 7.154 1.00 0.59 C ATOM 1838 SD MET B 48 12.912 -9.800 8.369 1.00 0.54 S ATOM 1839 CE MET B 48 14.287 -9.288 7.310 1.00 0.53 C ATOM 0 H MET B 48 13.006 -6.314 5.983 1.00 0.33 H new ATOM 0 HA MET B 48 12.851 -9.025 5.039 1.00 0.36 H new ATOM 0 HB2 MET B 48 12.225 -7.503 7.275 1.00 0.42 H new ATOM 0 HB3 MET B 48 10.627 -7.716 6.587 1.00 0.42 H new ATOM 0 HG2 MET B 48 10.622 -9.759 7.614 1.00 0.59 H new ATOM 0 HG3 MET B 48 11.704 -10.274 6.336 1.00 0.59 H new ATOM 0 HE1 MET B 48 15.231 -9.555 7.785 1.00 0.53 H new ATOM 0 HE2 MET B 48 14.211 -9.791 6.346 1.00 0.53 H new ATOM 0 HE3 MET B 48 14.249 -8.209 7.160 1.00 0.53 H new ATOM 1849 N ALA B 49 10.331 -7.107 4.138 1.00 0.35 N ATOM 1850 CA ALA B 49 9.237 -7.004 3.129 1.00 0.37 C ATOM 1851 C ALA B 49 9.813 -7.114 1.715 1.00 0.36 C ATOM 1852 O ALA B 49 9.274 -7.802 0.869 1.00 0.43 O ATOM 1853 CB ALA B 49 8.626 -5.619 3.350 1.00 0.41 C ATOM 0 H ALA B 49 10.385 -6.326 4.791 1.00 0.35 H new ATOM 0 HA ALA B 49 8.499 -7.799 3.236 1.00 0.37 H new ATOM 0 HB1 ALA B 49 7.810 -5.464 2.644 1.00 0.41 H new ATOM 0 HB2 ALA B 49 8.243 -5.549 4.368 1.00 0.41 H new ATOM 0 HB3 ALA B 49 9.389 -4.856 3.196 1.00 0.41 H new ATOM 1859 N LEU B 50 10.907 -6.439 1.455 1.00 0.34 N ATOM 1860 CA LEU B 50 11.520 -6.503 0.094 1.00 0.36 C ATOM 1861 C LEU B 50 11.880 -7.949 -0.265 1.00 0.34 C ATOM 1862 O LEU B 50 11.351 -8.507 -1.211 1.00 0.37 O ATOM 1863 CB LEU B 50 12.779 -5.638 0.177 1.00 0.41 C ATOM 1864 CG LEU B 50 13.188 -5.194 -1.230 1.00 0.56 C ATOM 1865 CD1 LEU B 50 12.072 -4.346 -1.847 1.00 0.87 C ATOM 1866 CD2 LEU B 50 14.471 -4.363 -1.147 1.00 0.69 C ATOM 0 H LEU B 50 11.399 -5.849 2.125 1.00 0.34 H new ATOM 0 HA LEU B 50 10.836 -6.149 -0.678 1.00 0.36 H new ATOM 0 HB2 LEU B 50 12.594 -4.767 0.805 1.00 0.41 H new ATOM 0 HB3 LEU B 50 13.589 -6.200 0.642 1.00 0.41 H new ATOM 0 HG LEU B 50 13.360 -6.073 -1.851 1.00 0.56 H new ATOM 0 HD11 LEU B 50 12.366 -4.031 -2.848 1.00 0.87 H new ATOM 0 HD12 LEU B 50 11.157 -4.936 -1.906 1.00 0.87 H new ATOM 0 HD13 LEU B 50 11.898 -3.467 -1.227 1.00 0.87 H new ATOM 0 HD21 LEU B 50 14.764 -4.046 -2.148 1.00 0.69 H new ATOM 0 HD22 LEU B 50 14.296 -3.485 -0.525 1.00 0.69 H new ATOM 0 HD23 LEU B 50 15.267 -4.965 -0.710 1.00 0.69 H new ATOM 1878 N VAL B 51 12.776 -8.562 0.474 1.00 0.34 N ATOM 1879 CA VAL B 51 13.161 -9.965 0.162 1.00 0.35 C ATOM 1880 C VAL B 51 11.938 -10.883 0.257 1.00 0.32 C ATOM 1881 O VAL B 51 11.802 -11.812 -0.510 1.00 0.34 O ATOM 1882 CB VAL B 51 14.224 -10.341 1.199 1.00 0.36 C ATOM 1883 CG1 VAL B 51 14.686 -11.771 0.951 1.00 0.45 C ATOM 1884 CG2 VAL B 51 15.419 -9.391 1.072 1.00 0.50 C ATOM 0 H VAL B 51 13.252 -8.148 1.275 1.00 0.34 H new ATOM 0 HA VAL B 51 13.549 -10.070 -0.851 1.00 0.35 H new ATOM 0 HB VAL B 51 13.801 -10.261 2.201 1.00 0.36 H new ATOM 0 HG11 VAL B 51 15.443 -12.042 1.687 1.00 0.45 H new ATOM 0 HG12 VAL B 51 13.836 -12.448 1.038 1.00 0.45 H new ATOM 0 HG13 VAL B 51 15.110 -11.848 -0.050 1.00 0.45 H new ATOM 0 HG21 VAL B 51 16.176 -9.658 1.810 1.00 0.50 H new ATOM 0 HG22 VAL B 51 15.843 -9.472 0.071 1.00 0.50 H new ATOM 0 HG23 VAL B 51 15.089 -8.367 1.245 1.00 0.50 H new ATOM 1894 N ALA B 52 11.040 -10.622 1.179 1.00 0.31 N ATOM 1895 CA ALA B 52 9.820 -11.482 1.296 1.00 0.29 C ATOM 1896 C ALA B 52 8.995 -11.368 0.013 1.00 0.29 C ATOM 1897 O ALA B 52 8.608 -12.361 -0.577 1.00 0.34 O ATOM 1898 CB ALA B 52 9.036 -10.933 2.489 1.00 0.31 C ATOM 0 H ALA B 52 11.099 -9.856 1.850 1.00 0.31 H new ATOM 0 HA ALA B 52 10.067 -12.534 1.439 1.00 0.29 H new ATOM 0 HB1 ALA B 52 8.128 -11.520 2.629 1.00 0.31 H new ATOM 0 HB2 ALA B 52 9.650 -10.994 3.387 1.00 0.31 H new ATOM 0 HB3 ALA B 52 8.770 -9.893 2.302 1.00 0.31 H new ATOM 1904 N PHE B 53 8.741 -10.157 -0.428 1.00 0.30 N ATOM 1905 CA PHE B 53 7.959 -9.951 -1.688 1.00 0.33 C ATOM 1906 C PHE B 53 8.561 -10.813 -2.800 1.00 0.33 C ATOM 1907 O PHE B 53 7.907 -11.678 -3.365 1.00 0.36 O ATOM 1908 CB PHE B 53 8.121 -8.460 -2.005 1.00 0.38 C ATOM 1909 CG PHE B 53 7.451 -8.133 -3.319 1.00 0.41 C ATOM 1910 CD1 PHE B 53 6.137 -8.549 -3.559 1.00 0.51 C ATOM 1911 CD2 PHE B 53 8.146 -7.412 -4.297 1.00 0.62 C ATOM 1912 CE1 PHE B 53 5.517 -8.244 -4.776 1.00 0.56 C ATOM 1913 CE2 PHE B 53 7.527 -7.107 -5.514 1.00 0.68 C ATOM 1914 CZ PHE B 53 6.212 -7.523 -5.754 1.00 0.54 C ATOM 0 H PHE B 53 9.044 -9.299 0.034 1.00 0.30 H new ATOM 0 HA PHE B 53 6.910 -10.230 -1.594 1.00 0.33 H new ATOM 0 HB2 PHE B 53 7.684 -7.861 -1.206 1.00 0.38 H new ATOM 0 HB3 PHE B 53 9.179 -8.203 -2.054 1.00 0.38 H new ATOM 0 HD1 PHE B 53 5.601 -9.106 -2.805 1.00 0.51 H new ATOM 0 HD2 PHE B 53 9.160 -7.091 -4.112 1.00 0.62 H new ATOM 0 HE1 PHE B 53 4.502 -8.565 -4.961 1.00 0.56 H new ATOM 0 HE2 PHE B 53 8.064 -6.551 -6.268 1.00 0.68 H new ATOM 0 HZ PHE B 53 5.734 -7.288 -6.693 1.00 0.54 H new ATOM 1924 N LEU B 54 9.817 -10.601 -3.093 1.00 0.35 N ATOM 1925 CA LEU B 54 10.485 -11.419 -4.141 1.00 0.38 C ATOM 1926 C LEU B 54 10.428 -12.893 -3.733 1.00 0.35 C ATOM 1927 O LEU B 54 10.227 -13.763 -4.553 1.00 0.36 O ATOM 1928 CB LEU B 54 11.931 -10.916 -4.181 1.00 0.44 C ATOM 1929 CG LEU B 54 12.036 -9.693 -5.100 1.00 0.52 C ATOM 1930 CD1 LEU B 54 11.629 -10.080 -6.523 1.00 0.67 C ATOM 1931 CD2 LEU B 54 11.110 -8.583 -4.592 1.00 0.68 C ATOM 0 H LEU B 54 10.407 -9.896 -2.651 1.00 0.35 H new ATOM 0 HA LEU B 54 10.011 -11.331 -5.119 1.00 0.38 H new ATOM 0 HB2 LEU B 54 12.262 -10.655 -3.176 1.00 0.44 H new ATOM 0 HB3 LEU B 54 12.590 -11.707 -4.538 1.00 0.44 H new ATOM 0 HG LEU B 54 13.066 -9.335 -5.101 1.00 0.52 H new ATOM 0 HD11 LEU B 54 11.705 -9.208 -7.173 1.00 0.67 H new ATOM 0 HD12 LEU B 54 12.290 -10.865 -6.890 1.00 0.67 H new ATOM 0 HD13 LEU B 54 10.601 -10.443 -6.521 1.00 0.67 H new ATOM 0 HD21 LEU B 54 11.188 -7.716 -5.248 1.00 0.68 H new ATOM 0 HD22 LEU B 54 10.081 -8.942 -4.586 1.00 0.68 H new ATOM 0 HD23 LEU B 54 11.402 -8.300 -3.581 1.00 0.68 H new ATOM 1943 N ARG B 55 10.581 -13.169 -2.458 1.00 0.34 N ATOM 1944 CA ARG B 55 10.521 -14.582 -1.971 1.00 0.34 C ATOM 1945 C ARG B 55 9.081 -15.108 -2.018 1.00 0.33 C ATOM 1946 O ARG B 55 8.826 -16.260 -1.721 1.00 0.39 O ATOM 1947 CB ARG B 55 11.030 -14.537 -0.529 1.00 0.37 C ATOM 1948 CG ARG B 55 11.199 -15.964 0.000 1.00 0.44 C ATOM 1949 CD ARG B 55 10.056 -16.298 0.961 1.00 0.64 C ATOM 1950 NE ARG B 55 10.061 -17.784 1.055 1.00 0.79 N ATOM 1951 CZ ARG B 55 8.958 -18.454 0.863 1.00 0.65 C ATOM 1952 NH1 ARG B 55 8.487 -18.603 -0.345 1.00 0.52 N ATOM 1953 NH2 ARG B 55 8.327 -18.974 1.880 1.00 0.80 N ATOM 0 H ARG B 55 10.746 -12.471 -1.732 1.00 0.34 H new ATOM 0 HA ARG B 55 11.120 -15.249 -2.591 1.00 0.34 H new ATOM 0 HB2 ARG B 55 11.981 -14.007 -0.485 1.00 0.37 H new ATOM 0 HB3 ARG B 55 10.329 -13.986 0.098 1.00 0.37 H new ATOM 0 HG2 ARG B 55 11.207 -16.671 -0.830 1.00 0.44 H new ATOM 0 HG3 ARG B 55 12.157 -16.061 0.511 1.00 0.44 H new ATOM 0 HD2 ARG B 55 10.213 -15.839 1.937 1.00 0.64 H new ATOM 0 HD3 ARG B 55 9.102 -15.928 0.585 1.00 0.64 H new ATOM 0 HE ARG B 55 10.927 -18.278 1.270 1.00 0.79 H new ATOM 0 HH11 ARG B 55 8.981 -18.196 -1.139 1.00 0.52 H new ATOM 0 HH12 ARG B 55 7.625 -19.127 -0.495 1.00 0.52 H new ATOM 0 HH21 ARG B 55 8.696 -18.856 2.824 1.00 0.80 H new ATOM 0 HH22 ARG B 55 7.465 -19.498 1.731 1.00 0.80 H new ATOM 1967 N PHE B 56 8.140 -14.275 -2.385 1.00 0.30 N ATOM 1968 CA PHE B 56 6.722 -14.730 -2.454 1.00 0.30 C ATOM 1969 C PHE B 56 6.289 -14.914 -3.913 1.00 0.33 C ATOM 1970 O PHE B 56 5.332 -15.613 -4.193 1.00 0.35 O ATOM 1971 CB PHE B 56 5.913 -13.608 -1.799 1.00 0.30 C ATOM 1972 CG PHE B 56 5.430 -14.057 -0.440 1.00 0.32 C ATOM 1973 CD1 PHE B 56 6.343 -14.233 0.610 1.00 0.48 C ATOM 1974 CD2 PHE B 56 4.068 -14.295 -0.229 1.00 0.70 C ATOM 1975 CE1 PHE B 56 5.891 -14.646 1.867 1.00 0.47 C ATOM 1976 CE2 PHE B 56 3.617 -14.709 1.029 1.00 0.84 C ATOM 1977 CZ PHE B 56 4.528 -14.884 2.077 1.00 0.56 C ATOM 0 H PHE B 56 8.295 -13.299 -2.640 1.00 0.30 H new ATOM 0 HA PHE B 56 6.576 -15.688 -1.956 1.00 0.30 H new ATOM 0 HB2 PHE B 56 6.527 -12.713 -1.700 1.00 0.30 H new ATOM 0 HB3 PHE B 56 5.064 -13.343 -2.429 1.00 0.30 H new ATOM 0 HD1 PHE B 56 7.395 -14.050 0.448 1.00 0.48 H new ATOM 0 HD2 PHE B 56 3.365 -14.159 -1.037 1.00 0.70 H new ATOM 0 HE1 PHE B 56 6.594 -14.781 2.676 1.00 0.47 H new ATOM 0 HE2 PHE B 56 2.565 -14.894 1.191 1.00 0.84 H new ATOM 0 HZ PHE B 56 4.179 -15.203 3.048 1.00 0.56 H new ATOM 1987 N LEU B 57 6.962 -14.274 -4.844 1.00 0.36 N ATOM 1988 CA LEU B 57 6.550 -14.403 -6.282 1.00 0.41 C ATOM 1989 C LEU B 57 7.521 -15.274 -7.095 1.00 0.46 C ATOM 1990 O LEU B 57 7.098 -16.132 -7.848 1.00 0.52 O ATOM 1991 CB LEU B 57 6.546 -12.970 -6.826 1.00 0.47 C ATOM 1992 CG LEU B 57 5.780 -12.042 -5.872 1.00 0.44 C ATOM 1993 CD1 LEU B 57 5.591 -10.673 -6.530 1.00 0.58 C ATOM 1994 CD2 LEU B 57 4.406 -12.640 -5.547 1.00 0.48 C ATOM 0 H LEU B 57 7.770 -13.675 -4.673 1.00 0.36 H new ATOM 0 HA LEU B 57 5.579 -14.891 -6.361 1.00 0.41 H new ATOM 0 HB2 LEU B 57 7.570 -12.616 -6.945 1.00 0.47 H new ATOM 0 HB3 LEU B 57 6.085 -12.949 -7.813 1.00 0.47 H new ATOM 0 HG LEU B 57 6.352 -11.932 -4.951 1.00 0.44 H new ATOM 0 HD11 LEU B 57 5.047 -10.015 -5.852 1.00 0.58 H new ATOM 0 HD12 LEU B 57 6.566 -10.239 -6.753 1.00 0.58 H new ATOM 0 HD13 LEU B 57 5.025 -10.789 -7.455 1.00 0.58 H new ATOM 0 HD21 LEU B 57 3.871 -11.975 -4.870 1.00 0.48 H new ATOM 0 HD22 LEU B 57 3.834 -12.758 -6.467 1.00 0.48 H new ATOM 0 HD23 LEU B 57 4.536 -13.613 -5.073 1.00 0.48 H new ATOM 2006 N THR B 58 8.807 -15.051 -6.975 1.00 0.47 N ATOM 2007 CA THR B 58 9.789 -15.857 -7.772 1.00 0.54 C ATOM 2008 C THR B 58 10.917 -16.391 -6.881 1.00 0.50 C ATOM 2009 O THR B 58 11.645 -17.288 -7.260 1.00 0.56 O ATOM 2010 CB THR B 58 10.342 -14.871 -8.802 1.00 0.62 C ATOM 2011 OG1 THR B 58 9.275 -14.372 -9.597 1.00 0.96 O ATOM 2012 CG2 THR B 58 11.358 -15.578 -9.696 1.00 0.94 C ATOM 0 H THR B 58 9.220 -14.348 -6.362 1.00 0.47 H new ATOM 0 HA THR B 58 9.326 -16.730 -8.232 1.00 0.54 H new ATOM 0 HB THR B 58 10.831 -14.044 -8.287 1.00 0.62 H new ATOM 0 HG1 THR B 58 9.627 -13.739 -10.257 1.00 0.96 H new ATOM 0 HG21 THR B 58 11.750 -14.873 -10.429 1.00 0.94 H new ATOM 0 HG22 THR B 58 12.176 -15.960 -9.086 1.00 0.94 H new ATOM 0 HG23 THR B 58 10.874 -16.407 -10.213 1.00 0.94 H new ATOM 2020 N ILE B 59 11.055 -15.844 -5.703 1.00 0.44 N ATOM 2021 CA ILE B 59 12.115 -16.296 -4.756 1.00 0.43 C ATOM 2022 C ILE B 59 13.513 -16.259 -5.393 1.00 0.46 C ATOM 2023 O ILE B 59 14.168 -17.279 -5.506 1.00 0.51 O ATOM 2024 CB ILE B 59 11.727 -17.722 -4.379 1.00 0.48 C ATOM 2025 CG1 ILE B 59 10.313 -17.728 -3.793 1.00 0.47 C ATOM 2026 CG2 ILE B 59 12.719 -18.259 -3.339 1.00 0.53 C ATOM 2027 CD1 ILE B 59 9.316 -18.178 -4.862 1.00 0.50 C ATOM 0 H ILE B 59 10.467 -15.089 -5.351 1.00 0.44 H new ATOM 0 HA ILE B 59 12.175 -15.639 -3.889 1.00 0.43 H new ATOM 0 HB ILE B 59 11.752 -18.355 -5.266 1.00 0.48 H new ATOM 0 HG12 ILE B 59 10.267 -18.398 -2.934 1.00 0.47 H new ATOM 0 HG13 ILE B 59 10.053 -16.732 -3.435 1.00 0.47 H new ATOM 0 HG21 ILE B 59 12.445 -19.278 -3.067 1.00 0.53 H new ATOM 0 HG22 ILE B 59 13.725 -18.254 -3.759 1.00 0.53 H new ATOM 0 HG23 ILE B 59 12.693 -17.627 -2.451 1.00 0.53 H new ATOM 0 HD11 ILE B 59 8.310 -18.182 -4.443 1.00 0.50 H new ATOM 0 HD12 ILE B 59 9.354 -17.491 -5.707 1.00 0.50 H new ATOM 0 HD13 ILE B 59 9.572 -19.182 -5.199 1.00 0.50 H new ATOM 2039 N PRO B 60 13.940 -15.076 -5.764 1.00 0.44 N ATOM 2040 CA PRO B 60 15.275 -14.868 -6.347 1.00 0.47 C ATOM 2041 C PRO B 60 16.211 -14.191 -5.313 1.00 0.42 C ATOM 2042 O PRO B 60 16.719 -13.115 -5.573 1.00 0.42 O ATOM 2043 CB PRO B 60 14.952 -13.883 -7.473 1.00 0.51 C ATOM 2044 CG PRO B 60 13.698 -13.163 -7.023 1.00 0.49 C ATOM 2045 CD PRO B 60 13.232 -13.811 -5.735 1.00 0.42 C ATOM 0 HA PRO B 60 15.776 -15.782 -6.666 1.00 0.47 H new ATOM 0 HB2 PRO B 60 15.773 -13.183 -7.631 1.00 0.51 H new ATOM 0 HB3 PRO B 60 14.790 -14.403 -8.417 1.00 0.51 H new ATOM 0 HG2 PRO B 60 13.901 -12.103 -6.867 1.00 0.49 H new ATOM 0 HG3 PRO B 60 12.923 -13.230 -7.787 1.00 0.49 H new ATOM 0 HD2 PRO B 60 13.494 -13.216 -4.860 1.00 0.42 H new ATOM 0 HD3 PRO B 60 12.151 -13.948 -5.715 1.00 0.42 H new ATOM 2053 N PRO B 61 16.406 -14.812 -4.164 1.00 0.41 N ATOM 2054 CA PRO B 61 17.273 -14.197 -3.129 1.00 0.40 C ATOM 2055 C PRO B 61 18.738 -14.240 -3.560 1.00 0.41 C ATOM 2056 O PRO B 61 19.342 -15.294 -3.632 1.00 0.46 O ATOM 2057 CB PRO B 61 17.044 -15.056 -1.893 1.00 0.41 C ATOM 2058 CG PRO B 61 16.596 -16.374 -2.422 1.00 0.44 C ATOM 2059 CD PRO B 61 15.872 -16.105 -3.718 1.00 0.45 C ATOM 0 HA PRO B 61 17.039 -13.147 -2.954 1.00 0.40 H new ATOM 0 HB2 PRO B 61 17.957 -15.155 -1.306 1.00 0.41 H new ATOM 0 HB3 PRO B 61 16.291 -14.616 -1.239 1.00 0.41 H new ATOM 0 HG2 PRO B 61 17.448 -17.034 -2.586 1.00 0.44 H new ATOM 0 HG3 PRO B 61 15.939 -16.873 -1.709 1.00 0.44 H new ATOM 0 HD2 PRO B 61 16.062 -16.889 -4.451 1.00 0.45 H new ATOM 0 HD3 PRO B 61 14.793 -16.061 -3.570 1.00 0.45 H new ATOM 2067 N THR B 62 19.311 -13.099 -3.842 1.00 0.42 N ATOM 2068 CA THR B 62 20.741 -13.060 -4.267 1.00 0.43 C ATOM 2069 C THR B 62 21.621 -13.659 -3.158 1.00 0.42 C ATOM 2070 O THR B 62 21.186 -13.810 -2.032 1.00 0.41 O ATOM 2071 CB THR B 62 21.031 -11.565 -4.524 1.00 0.47 C ATOM 2072 OG1 THR B 62 21.592 -11.417 -5.819 1.00 0.56 O ATOM 2073 CG2 THR B 62 22.004 -10.995 -3.488 1.00 0.50 C ATOM 0 H THR B 62 18.849 -12.191 -3.796 1.00 0.42 H new ATOM 0 HA THR B 62 20.952 -13.648 -5.161 1.00 0.43 H new ATOM 0 HB THR B 62 20.092 -11.017 -4.446 1.00 0.47 H new ATOM 0 HG1 THR B 62 21.777 -10.470 -5.989 1.00 0.56 H new ATOM 0 HG21 THR B 62 22.185 -9.941 -3.700 1.00 0.50 H new ATOM 0 HG22 THR B 62 21.575 -11.096 -2.491 1.00 0.50 H new ATOM 0 HG23 THR B 62 22.946 -11.541 -3.534 1.00 0.50 H new ATOM 2081 N ALA B 63 22.844 -14.014 -3.476 1.00 0.50 N ATOM 2082 CA ALA B 63 23.757 -14.623 -2.452 1.00 0.53 C ATOM 2083 C ALA B 63 23.794 -13.777 -1.173 1.00 0.51 C ATOM 2084 O ALA B 63 23.841 -14.299 -0.075 1.00 0.52 O ATOM 2085 CB ALA B 63 25.135 -14.648 -3.115 1.00 0.61 C ATOM 0 H ALA B 63 23.252 -13.908 -4.405 1.00 0.50 H new ATOM 0 HA ALA B 63 23.422 -15.617 -2.154 1.00 0.53 H new ATOM 0 HB1 ALA B 63 25.862 -15.081 -2.428 1.00 0.61 H new ATOM 0 HB2 ALA B 63 25.091 -15.250 -4.023 1.00 0.61 H new ATOM 0 HB3 ALA B 63 25.436 -13.631 -3.368 1.00 0.61 H new ATOM 2091 N GLY B 64 23.780 -12.478 -1.315 1.00 0.50 N ATOM 2092 CA GLY B 64 23.821 -11.576 -0.124 1.00 0.51 C ATOM 2093 C GLY B 64 22.677 -11.908 0.840 1.00 0.43 C ATOM 2094 O GLY B 64 22.875 -11.990 2.030 1.00 0.42 O ATOM 0 H GLY B 64 23.742 -11.998 -2.214 1.00 0.50 H new ATOM 0 HA2 GLY B 64 24.778 -11.682 0.387 1.00 0.51 H new ATOM 0 HA3 GLY B 64 23.745 -10.537 -0.444 1.00 0.51 H new ATOM 2098 N ILE B 65 21.485 -12.090 0.337 1.00 0.42 N ATOM 2099 CA ILE B 65 20.323 -12.410 1.223 1.00 0.37 C ATOM 2100 C ILE B 65 20.631 -13.636 2.088 1.00 0.36 C ATOM 2101 O ILE B 65 20.279 -13.684 3.250 1.00 0.37 O ATOM 2102 CB ILE B 65 19.158 -12.700 0.267 1.00 0.36 C ATOM 2103 CG1 ILE B 65 18.866 -11.456 -0.581 1.00 0.39 C ATOM 2104 CG2 ILE B 65 17.904 -13.067 1.068 1.00 0.35 C ATOM 2105 CD1 ILE B 65 18.615 -10.258 0.337 1.00 0.41 C ATOM 0 H ILE B 65 21.263 -12.031 -0.657 1.00 0.42 H new ATOM 0 HA ILE B 65 20.093 -11.594 1.908 1.00 0.37 H new ATOM 0 HB ILE B 65 19.431 -13.532 -0.382 1.00 0.36 H new ATOM 0 HG12 ILE B 65 19.706 -11.250 -1.244 1.00 0.39 H new ATOM 0 HG13 ILE B 65 17.996 -11.631 -1.214 1.00 0.39 H new ATOM 0 HG21 ILE B 65 17.081 -13.271 0.383 1.00 0.35 H new ATOM 0 HG22 ILE B 65 18.103 -13.953 1.670 1.00 0.35 H new ATOM 0 HG23 ILE B 65 17.634 -12.238 1.722 1.00 0.35 H new ATOM 0 HD11 ILE B 65 18.408 -9.374 -0.266 1.00 0.41 H new ATOM 0 HD12 ILE B 65 17.761 -10.466 0.981 1.00 0.41 H new ATOM 0 HD13 ILE B 65 19.498 -10.079 0.951 1.00 0.41 H new ATOM 2117 N LEU B 66 21.287 -14.620 1.530 1.00 0.41 N ATOM 2118 CA LEU B 66 21.617 -15.842 2.321 1.00 0.44 C ATOM 2119 C LEU B 66 22.838 -15.578 3.204 1.00 0.46 C ATOM 2120 O LEU B 66 22.833 -15.868 4.386 1.00 0.50 O ATOM 2121 CB LEU B 66 21.923 -16.933 1.285 1.00 0.53 C ATOM 2122 CG LEU B 66 20.642 -17.363 0.547 1.00 0.53 C ATOM 2123 CD1 LEU B 66 19.503 -17.601 1.545 1.00 0.65 C ATOM 2124 CD2 LEU B 66 20.229 -16.272 -0.444 1.00 0.50 C ATOM 0 H LEU B 66 21.608 -14.630 0.562 1.00 0.41 H new ATOM 0 HA LEU B 66 20.801 -16.137 2.981 1.00 0.44 H new ATOM 0 HB2 LEU B 66 22.655 -16.563 0.567 1.00 0.53 H new ATOM 0 HB3 LEU B 66 22.370 -17.795 1.780 1.00 0.53 H new ATOM 0 HG LEU B 66 20.843 -18.291 0.011 1.00 0.53 H new ATOM 0 HD11 LEU B 66 18.605 -17.904 1.007 1.00 0.65 H new ATOM 0 HD12 LEU B 66 19.790 -18.387 2.244 1.00 0.65 H new ATOM 0 HD13 LEU B 66 19.303 -16.681 2.095 1.00 0.65 H new ATOM 0 HD21 LEU B 66 19.322 -16.578 -0.965 1.00 0.50 H new ATOM 0 HD22 LEU B 66 20.042 -15.343 0.095 1.00 0.50 H new ATOM 0 HD23 LEU B 66 21.029 -16.117 -1.168 1.00 0.50 H new ATOM 2136 N LYS B 67 23.880 -15.022 2.641 1.00 0.46 N ATOM 2137 CA LYS B 67 25.104 -14.725 3.446 1.00 0.51 C ATOM 2138 C LYS B 67 24.751 -13.764 4.582 1.00 0.47 C ATOM 2139 O LYS B 67 25.211 -13.906 5.700 1.00 0.51 O ATOM 2140 CB LYS B 67 26.071 -14.057 2.468 1.00 0.59 C ATOM 2141 CG LYS B 67 26.954 -15.120 1.815 1.00 0.71 C ATOM 2142 CD LYS B 67 28.047 -15.548 2.796 1.00 0.85 C ATOM 2143 CE LYS B 67 29.106 -14.447 2.897 1.00 1.03 C ATOM 2144 NZ LYS B 67 29.969 -14.848 4.043 1.00 1.53 N ATOM 0 H LYS B 67 23.936 -14.760 1.657 1.00 0.46 H new ATOM 0 HA LYS B 67 25.535 -15.620 3.895 1.00 0.51 H new ATOM 0 HB2 LYS B 67 25.515 -13.513 1.705 1.00 0.59 H new ATOM 0 HB3 LYS B 67 26.689 -13.328 2.992 1.00 0.59 H new ATOM 0 HG2 LYS B 67 26.352 -15.981 1.527 1.00 0.71 H new ATOM 0 HG3 LYS B 67 27.403 -14.725 0.903 1.00 0.71 H new ATOM 0 HD2 LYS B 67 27.614 -15.741 3.777 1.00 0.85 H new ATOM 0 HD3 LYS B 67 28.506 -16.478 2.462 1.00 0.85 H new ATOM 0 HE2 LYS B 67 29.684 -14.369 1.976 1.00 1.03 H new ATOM 0 HE3 LYS B 67 28.648 -13.473 3.069 1.00 1.03 H new ATOM 0 HZ1 LYS B 67 30.720 -14.141 4.176 1.00 1.53 H new ATOM 0 HZ2 LYS B 67 29.393 -14.908 4.907 1.00 1.53 H new ATOM 0 HZ3 LYS B 67 30.397 -15.776 3.848 1.00 1.53 H new ATOM 2158 N ARG B 68 23.931 -12.790 4.291 1.00 0.43 N ATOM 2159 CA ARG B 68 23.520 -11.803 5.328 1.00 0.42 C ATOM 2160 C ARG B 68 22.463 -12.429 6.247 1.00 0.35 C ATOM 2161 O ARG B 68 22.297 -12.026 7.383 1.00 0.38 O ATOM 2162 CB ARG B 68 22.968 -10.606 4.534 1.00 0.45 C ATOM 2163 CG ARG B 68 21.464 -10.751 4.299 1.00 0.42 C ATOM 2164 CD ARG B 68 21.006 -9.672 3.315 1.00 0.47 C ATOM 2165 NE ARG B 68 20.905 -8.429 4.129 1.00 0.54 N ATOM 2166 CZ ARG B 68 21.952 -7.665 4.288 1.00 0.60 C ATOM 2167 NH1 ARG B 68 22.666 -7.314 3.254 1.00 0.62 N ATOM 2168 NH2 ARG B 68 22.283 -7.253 5.480 1.00 0.81 N ATOM 0 H ARG B 68 23.525 -12.636 3.368 1.00 0.43 H new ATOM 0 HA ARG B 68 24.338 -11.493 5.978 1.00 0.42 H new ATOM 0 HB2 ARG B 68 23.167 -9.682 5.077 1.00 0.45 H new ATOM 0 HB3 ARG B 68 23.484 -10.531 3.577 1.00 0.45 H new ATOM 0 HG2 ARG B 68 21.239 -11.741 3.903 1.00 0.42 H new ATOM 0 HG3 ARG B 68 20.925 -10.654 5.241 1.00 0.42 H new ATOM 0 HD2 ARG B 68 21.719 -9.553 2.499 1.00 0.47 H new ATOM 0 HD3 ARG B 68 20.047 -9.929 2.865 1.00 0.47 H new ATOM 0 HE ARG B 68 20.018 -8.174 4.563 1.00 0.54 H new ATOM 0 HH11 ARG B 68 22.406 -7.636 2.322 1.00 0.62 H new ATOM 0 HH12 ARG B 68 23.484 -6.717 3.378 1.00 0.62 H new ATOM 0 HH21 ARG B 68 21.724 -7.528 6.288 1.00 0.81 H new ATOM 0 HH22 ARG B 68 23.101 -6.656 5.605 1.00 0.81 H new ATOM 2182 N TRP B 69 21.759 -13.420 5.752 1.00 0.33 N ATOM 2183 CA TRP B 69 20.710 -14.114 6.565 1.00 0.29 C ATOM 2184 C TRP B 69 21.250 -14.500 7.947 1.00 0.31 C ATOM 2185 O TRP B 69 20.541 -14.451 8.932 1.00 0.36 O ATOM 2186 CB TRP B 69 20.407 -15.379 5.766 1.00 0.32 C ATOM 2187 CG TRP B 69 19.012 -15.850 6.020 1.00 0.30 C ATOM 2188 CD1 TRP B 69 18.696 -17.097 6.431 1.00 0.35 C ATOM 2189 CD2 TRP B 69 17.746 -15.133 5.873 1.00 0.30 C ATOM 2190 NE1 TRP B 69 17.325 -17.198 6.543 1.00 0.36 N ATOM 2191 CE2 TRP B 69 16.694 -16.020 6.211 1.00 0.33 C ATOM 2192 CE3 TRP B 69 17.402 -13.820 5.486 1.00 0.32 C ATOM 2193 CZ2 TRP B 69 15.359 -15.627 6.162 1.00 0.36 C ATOM 2194 CZ3 TRP B 69 16.056 -13.426 5.438 1.00 0.35 C ATOM 2195 CH2 TRP B 69 15.040 -14.330 5.775 1.00 0.36 C ATOM 0 H TRP B 69 21.869 -13.782 4.805 1.00 0.33 H new ATOM 0 HA TRP B 69 19.837 -13.483 6.733 1.00 0.29 H new ATOM 0 HB2 TRP B 69 20.540 -15.182 4.702 1.00 0.32 H new ATOM 0 HB3 TRP B 69 21.114 -16.163 6.037 1.00 0.32 H new ATOM 0 HD1 TRP B 69 19.402 -17.887 6.638 1.00 0.35 H new ATOM 0 HE1 TRP B 69 16.837 -18.044 6.837 1.00 0.36 H new ATOM 0 HE3 TRP B 69 18.178 -13.115 5.226 1.00 0.32 H new ATOM 0 HZ2 TRP B 69 14.577 -16.325 6.423 1.00 0.36 H new ATOM 0 HZ3 TRP B 69 15.802 -12.420 5.139 1.00 0.35 H new ATOM 0 HH2 TRP B 69 14.007 -14.019 5.734 1.00 0.36 H new ATOM 2206 N GLY B 70 22.497 -14.901 8.018 1.00 0.35 N ATOM 2207 CA GLY B 70 23.084 -15.314 9.329 1.00 0.43 C ATOM 2208 C GLY B 70 24.124 -14.294 9.799 1.00 0.42 C ATOM 2209 O GLY B 70 25.093 -14.646 10.447 1.00 0.56 O ATOM 0 H GLY B 70 23.133 -14.960 7.223 1.00 0.35 H new ATOM 0 HA2 GLY B 70 22.294 -15.406 10.074 1.00 0.43 H new ATOM 0 HA3 GLY B 70 23.547 -16.296 9.233 1.00 0.43 H new ATOM 2213 N THR B 71 23.930 -13.037 9.493 1.00 0.35 N ATOM 2214 CA THR B 71 24.907 -11.998 9.941 1.00 0.39 C ATOM 2215 C THR B 71 24.167 -10.734 10.399 1.00 0.39 C ATOM 2216 O THR B 71 24.760 -9.684 10.562 1.00 0.47 O ATOM 2217 CB THR B 71 25.801 -11.726 8.719 1.00 0.45 C ATOM 2218 OG1 THR B 71 27.121 -11.443 9.160 1.00 0.52 O ATOM 2219 CG2 THR B 71 25.272 -10.536 7.910 1.00 0.49 C ATOM 0 H THR B 71 23.139 -12.685 8.953 1.00 0.35 H new ATOM 0 HA THR B 71 25.502 -12.325 10.794 1.00 0.39 H new ATOM 0 HB THR B 71 25.797 -12.609 8.081 1.00 0.45 H new ATOM 0 HG1 THR B 71 27.695 -11.270 8.385 1.00 0.52 H new ATOM 0 HG21 THR B 71 25.920 -10.363 7.051 1.00 0.49 H new ATOM 0 HG22 THR B 71 24.261 -10.752 7.564 1.00 0.49 H new ATOM 0 HG23 THR B 71 25.258 -9.646 8.539 1.00 0.49 H new ATOM 2227 N ILE B 72 22.879 -10.833 10.620 1.00 0.39 N ATOM 2228 CA ILE B 72 22.104 -9.645 11.078 1.00 0.41 C ATOM 2229 C ILE B 72 21.868 -9.741 12.591 1.00 0.43 C ATOM 2230 O ILE B 72 22.795 -9.966 13.347 1.00 0.53 O ATOM 2231 CB ILE B 72 20.789 -9.690 10.287 1.00 0.38 C ATOM 2232 CG1 ILE B 72 20.054 -11.006 10.565 1.00 0.33 C ATOM 2233 CG2 ILE B 72 21.085 -9.580 8.788 1.00 0.41 C ATOM 2234 CD1 ILE B 72 18.548 -10.785 10.410 1.00 0.34 C ATOM 0 H ILE B 72 22.333 -11.687 10.502 1.00 0.39 H new ATOM 0 HA ILE B 72 22.624 -8.703 10.905 1.00 0.41 H new ATOM 0 HB ILE B 72 20.161 -8.855 10.598 1.00 0.38 H new ATOM 0 HG12 ILE B 72 20.393 -11.778 9.875 1.00 0.33 H new ATOM 0 HG13 ILE B 72 20.280 -11.357 11.572 1.00 0.33 H new ATOM 0 HG21 ILE B 72 20.150 -9.612 8.229 1.00 0.41 H new ATOM 0 HG22 ILE B 72 21.596 -8.639 8.586 1.00 0.41 H new ATOM 0 HG23 ILE B 72 21.720 -10.411 8.481 1.00 0.41 H new ATOM 0 HD11 ILE B 72 18.021 -11.719 10.607 1.00 0.34 H new ATOM 0 HD12 ILE B 72 18.217 -10.025 11.118 1.00 0.34 H new ATOM 0 HD13 ILE B 72 18.332 -10.453 9.394 1.00 0.34 H new ATOM 2246 N LYS B 73 20.651 -9.571 13.042 1.00 0.43 N ATOM 2247 CA LYS B 73 20.375 -9.650 14.507 1.00 0.44 C ATOM 2248 C LYS B 73 19.377 -10.761 14.811 1.00 0.38 C ATOM 2249 O LYS B 73 19.376 -11.318 15.892 1.00 0.41 O ATOM 2250 CB LYS B 73 19.768 -8.293 14.864 1.00 0.50 C ATOM 2251 CG LYS B 73 19.274 -8.316 16.312 1.00 0.51 C ATOM 2252 CD LYS B 73 19.880 -7.148 17.093 1.00 0.66 C ATOM 2253 CE LYS B 73 21.311 -7.484 17.522 1.00 0.72 C ATOM 2254 NZ LYS B 73 22.153 -7.270 16.310 1.00 0.76 N ATOM 0 H LYS B 73 19.837 -9.381 12.458 1.00 0.43 H new ATOM 0 HA LYS B 73 21.277 -9.870 15.078 1.00 0.44 H new ATOM 0 HB2 LYS B 73 20.511 -7.506 14.735 1.00 0.50 H new ATOM 0 HB3 LYS B 73 18.942 -8.065 14.191 1.00 0.50 H new ATOM 0 HG2 LYS B 73 18.186 -8.253 16.334 1.00 0.51 H new ATOM 0 HG3 LYS B 73 19.548 -9.260 16.783 1.00 0.51 H new ATOM 0 HD2 LYS B 73 19.879 -6.249 16.476 1.00 0.66 H new ATOM 0 HD3 LYS B 73 19.271 -6.933 17.971 1.00 0.66 H new ATOM 0 HE2 LYS B 73 21.635 -6.844 18.342 1.00 0.72 H new ATOM 0 HE3 LYS B 73 21.384 -8.513 17.873 1.00 0.72 H new ATOM 0 HZ1 LYS B 73 23.127 -7.047 16.599 1.00 0.76 H new ATOM 0 HZ2 LYS B 73 22.153 -8.134 15.730 1.00 0.76 H new ATOM 0 HZ3 LYS B 73 21.767 -6.480 15.754 1.00 0.76 H new ATOM 2268 N LYS B 74 18.514 -11.057 13.874 1.00 0.34 N ATOM 2269 CA LYS B 74 17.465 -12.107 14.071 1.00 0.31 C ATOM 2270 C LYS B 74 16.392 -11.593 15.033 1.00 0.28 C ATOM 2271 O LYS B 74 15.212 -11.703 14.766 1.00 0.31 O ATOM 2272 CB LYS B 74 18.155 -13.356 14.644 1.00 0.35 C ATOM 2273 CG LYS B 74 19.451 -13.656 13.887 1.00 0.41 C ATOM 2274 CD LYS B 74 19.220 -13.571 12.377 1.00 0.39 C ATOM 2275 CE LYS B 74 18.192 -14.624 11.958 1.00 0.40 C ATOM 2276 NZ LYS B 74 18.561 -15.003 10.564 1.00 0.46 N ATOM 0 H LYS B 74 18.491 -10.606 12.960 1.00 0.34 H new ATOM 0 HA LYS B 74 16.979 -12.351 13.127 1.00 0.31 H new ATOM 0 HB2 LYS B 74 18.373 -13.204 15.701 1.00 0.35 H new ATOM 0 HB3 LYS B 74 17.483 -14.211 14.577 1.00 0.35 H new ATOM 0 HG2 LYS B 74 20.225 -12.948 14.183 1.00 0.41 H new ATOM 0 HG3 LYS B 74 19.811 -14.650 14.151 1.00 0.41 H new ATOM 0 HD2 LYS B 74 18.867 -12.575 12.108 1.00 0.39 H new ATOM 0 HD3 LYS B 74 20.158 -13.731 11.845 1.00 0.39 H new ATOM 0 HE2 LYS B 74 18.222 -15.488 12.621 1.00 0.40 H new ATOM 0 HE3 LYS B 74 17.179 -14.224 12.002 1.00 0.40 H new ATOM 0 HZ1 LYS B 74 17.834 -14.657 9.906 1.00 0.46 H new ATOM 0 HZ2 LYS B 74 19.479 -14.579 10.320 1.00 0.46 H new ATOM 0 HZ3 LYS B 74 18.628 -16.038 10.492 1.00 0.46 H new ATOM 2290 N SER B 75 16.790 -11.009 16.138 1.00 0.29 N ATOM 2291 CA SER B 75 15.786 -10.471 17.100 1.00 0.31 C ATOM 2292 C SER B 75 14.945 -9.413 16.395 1.00 0.28 C ATOM 2293 O SER B 75 13.751 -9.323 16.592 1.00 0.32 O ATOM 2294 CB SER B 75 16.604 -9.846 18.229 1.00 0.38 C ATOM 2295 OG SER B 75 15.772 -9.666 19.368 1.00 1.19 O ATOM 0 H SER B 75 17.765 -10.883 16.412 1.00 0.29 H new ATOM 0 HA SER B 75 15.109 -11.236 17.480 1.00 0.31 H new ATOM 0 HB2 SER B 75 17.449 -10.487 18.479 1.00 0.38 H new ATOM 0 HB3 SER B 75 17.014 -8.888 17.909 1.00 0.38 H new ATOM 0 HG SER B 75 16.294 -9.267 20.095 1.00 1.19 H new ATOM 2301 N LYS B 76 15.571 -8.629 15.557 1.00 0.27 N ATOM 2302 CA LYS B 76 14.832 -7.577 14.805 1.00 0.26 C ATOM 2303 C LYS B 76 14.066 -8.217 13.645 1.00 0.23 C ATOM 2304 O LYS B 76 12.918 -7.899 13.399 1.00 0.26 O ATOM 2305 CB LYS B 76 15.917 -6.636 14.282 1.00 0.33 C ATOM 2306 CG LYS B 76 16.121 -5.489 15.274 1.00 0.45 C ATOM 2307 CD LYS B 76 15.276 -4.287 14.847 1.00 0.58 C ATOM 2308 CE LYS B 76 13.837 -4.478 15.332 1.00 0.56 C ATOM 2309 NZ LYS B 76 13.237 -3.115 15.299 1.00 0.83 N ATOM 0 H LYS B 76 16.571 -8.674 15.361 1.00 0.27 H new ATOM 0 HA LYS B 76 14.102 -7.051 15.421 1.00 0.26 H new ATOM 0 HB2 LYS B 76 16.850 -7.182 14.144 1.00 0.33 H new ATOM 0 HB3 LYS B 76 15.631 -6.241 13.307 1.00 0.33 H new ATOM 0 HG2 LYS B 76 15.838 -5.807 16.277 1.00 0.45 H new ATOM 0 HG3 LYS B 76 17.174 -5.211 15.313 1.00 0.45 H new ATOM 0 HD2 LYS B 76 15.693 -3.370 15.263 1.00 0.58 H new ATOM 0 HD3 LYS B 76 15.295 -4.182 13.762 1.00 0.58 H new ATOM 0 HE2 LYS B 76 13.291 -5.166 14.687 1.00 0.56 H new ATOM 0 HE3 LYS B 76 13.811 -4.897 16.338 1.00 0.56 H new ATOM 0 HZ1 LYS B 76 12.248 -3.163 15.619 1.00 0.83 H new ATOM 0 HZ2 LYS B 76 13.774 -2.484 15.928 1.00 0.83 H new ATOM 0 HZ3 LYS B 76 13.269 -2.745 14.328 1.00 0.83 H new ATOM 2323 N ALA B 77 14.696 -9.127 12.941 1.00 0.26 N ATOM 2324 CA ALA B 77 14.011 -9.806 11.799 1.00 0.27 C ATOM 2325 C ALA B 77 12.809 -10.595 12.313 1.00 0.24 C ATOM 2326 O ALA B 77 11.701 -10.440 11.834 1.00 0.28 O ATOM 2327 CB ALA B 77 15.054 -10.756 11.207 1.00 0.33 C ATOM 0 H ALA B 77 15.656 -9.428 13.109 1.00 0.26 H new ATOM 0 HA ALA B 77 13.645 -9.096 11.058 1.00 0.27 H new ATOM 0 HB1 ALA B 77 14.621 -11.290 10.361 1.00 0.33 H new ATOM 0 HB2 ALA B 77 15.918 -10.183 10.870 1.00 0.33 H new ATOM 0 HB3 ALA B 77 15.367 -11.472 11.967 1.00 0.33 H new ATOM 2333 N ILE B 78 13.023 -11.441 13.290 1.00 0.23 N ATOM 2334 CA ILE B 78 11.898 -12.246 13.848 1.00 0.25 C ATOM 2335 C ILE B 78 10.813 -11.312 14.398 1.00 0.24 C ATOM 2336 O ILE B 78 9.637 -11.515 14.157 1.00 0.30 O ATOM 2337 CB ILE B 78 12.526 -13.098 14.956 1.00 0.28 C ATOM 2338 CG1 ILE B 78 13.588 -14.017 14.341 1.00 0.30 C ATOM 2339 CG2 ILE B 78 11.446 -13.952 15.626 1.00 0.37 C ATOM 2340 CD1 ILE B 78 14.677 -14.323 15.371 1.00 0.34 C ATOM 0 H ILE B 78 13.931 -11.608 13.725 1.00 0.23 H new ATOM 0 HA ILE B 78 11.415 -12.873 13.099 1.00 0.25 H new ATOM 0 HB ILE B 78 12.984 -12.446 15.700 1.00 0.28 H new ATOM 0 HG12 ILE B 78 13.126 -14.944 14.002 1.00 0.30 H new ATOM 0 HG13 ILE B 78 14.028 -13.542 13.465 1.00 0.30 H new ATOM 0 HG21 ILE B 78 11.896 -14.556 16.413 1.00 0.37 H new ATOM 0 HG22 ILE B 78 10.685 -13.303 16.058 1.00 0.37 H new ATOM 0 HG23 ILE B 78 10.987 -14.606 14.884 1.00 0.37 H new ATOM 0 HD11 ILE B 78 15.427 -14.976 14.925 1.00 0.34 H new ATOM 0 HD12 ILE B 78 15.149 -13.393 15.689 1.00 0.34 H new ATOM 0 HD13 ILE B 78 14.232 -14.818 16.235 1.00 0.34 H new ATOM 2352 N ASN B 79 11.194 -10.276 15.110 1.00 0.23 N ATOM 2353 CA ASN B 79 10.170 -9.324 15.640 1.00 0.25 C ATOM 2354 C ASN B 79 9.447 -8.674 14.463 1.00 0.25 C ATOM 2355 O ASN B 79 8.243 -8.497 14.480 1.00 0.31 O ATOM 2356 CB ASN B 79 10.944 -8.273 16.436 1.00 0.28 C ATOM 2357 CG ASN B 79 10.913 -8.633 17.923 1.00 0.37 C ATOM 2358 OD1 ASN B 79 9.856 -8.727 18.515 1.00 0.64 O ATOM 2359 ND2 ASN B 79 12.035 -8.839 18.556 1.00 0.40 N ATOM 0 H ASN B 79 12.161 -10.052 15.344 1.00 0.23 H new ATOM 0 HA ASN B 79 9.427 -9.818 16.266 1.00 0.25 H new ATOM 0 HB2 ASN B 79 11.975 -8.222 16.085 1.00 0.28 H new ATOM 0 HB3 ASN B 79 10.505 -7.288 16.280 1.00 0.28 H new ATOM 0 HD21 ASN B 79 12.025 -9.079 19.547 1.00 0.40 H new ATOM 0 HD22 ASN B 79 12.923 -8.760 18.060 1.00 0.40 H new ATOM 2366 N VAL B 80 10.182 -8.340 13.430 1.00 0.23 N ATOM 2367 CA VAL B 80 9.557 -7.724 12.223 1.00 0.25 C ATOM 2368 C VAL B 80 8.496 -8.681 11.679 1.00 0.27 C ATOM 2369 O VAL B 80 7.372 -8.297 11.415 1.00 0.31 O ATOM 2370 CB VAL B 80 10.720 -7.537 11.230 1.00 0.28 C ATOM 2371 CG1 VAL B 80 10.311 -7.974 9.817 1.00 0.35 C ATOM 2372 CG2 VAL B 80 11.127 -6.063 11.201 1.00 0.38 C ATOM 0 H VAL B 80 11.192 -8.469 13.373 1.00 0.23 H new ATOM 0 HA VAL B 80 9.060 -6.774 12.421 1.00 0.25 H new ATOM 0 HB VAL B 80 11.557 -8.155 11.557 1.00 0.28 H new ATOM 0 HG11 VAL B 80 11.150 -7.832 9.135 1.00 0.35 H new ATOM 0 HG12 VAL B 80 10.028 -9.026 9.829 1.00 0.35 H new ATOM 0 HG13 VAL B 80 9.465 -7.374 9.481 1.00 0.35 H new ATOM 0 HG21 VAL B 80 11.950 -5.926 10.499 1.00 0.38 H new ATOM 0 HG22 VAL B 80 10.277 -5.457 10.886 1.00 0.38 H new ATOM 0 HG23 VAL B 80 11.444 -5.753 12.197 1.00 0.38 H new ATOM 2382 N LEU B 81 8.853 -9.931 11.527 1.00 0.29 N ATOM 2383 CA LEU B 81 7.878 -10.940 11.018 1.00 0.34 C ATOM 2384 C LEU B 81 6.653 -10.973 11.936 1.00 0.34 C ATOM 2385 O LEU B 81 5.538 -11.194 11.498 1.00 0.37 O ATOM 2386 CB LEU B 81 8.629 -12.270 11.061 1.00 0.40 C ATOM 2387 CG LEU B 81 8.746 -12.838 9.646 1.00 0.52 C ATOM 2388 CD1 LEU B 81 10.117 -12.488 9.067 1.00 1.11 C ATOM 2389 CD2 LEU B 81 8.587 -14.357 9.700 1.00 0.78 C ATOM 0 H LEU B 81 9.782 -10.297 11.735 1.00 0.29 H new ATOM 0 HA LEU B 81 7.520 -10.716 10.013 1.00 0.34 H new ATOM 0 HB2 LEU B 81 9.621 -12.126 11.489 1.00 0.40 H new ATOM 0 HB3 LEU B 81 8.104 -12.975 11.705 1.00 0.40 H new ATOM 0 HG LEU B 81 7.968 -12.410 9.014 1.00 0.52 H new ATOM 0 HD11 LEU B 81 10.200 -12.893 8.058 1.00 1.11 H new ATOM 0 HD12 LEU B 81 10.232 -11.405 9.034 1.00 1.11 H new ATOM 0 HD13 LEU B 81 10.898 -12.917 9.696 1.00 1.11 H new ATOM 0 HD21 LEU B 81 8.670 -14.767 8.694 1.00 0.78 H new ATOM 0 HD22 LEU B 81 9.368 -14.782 10.331 1.00 0.78 H new ATOM 0 HD23 LEU B 81 7.610 -14.606 10.114 1.00 0.78 H new ATOM 2401 N ARG B 82 6.855 -10.731 13.206 1.00 0.36 N ATOM 2402 CA ARG B 82 5.704 -10.718 14.152 1.00 0.40 C ATOM 2403 C ARG B 82 4.808 -9.528 13.809 1.00 0.36 C ATOM 2404 O ARG B 82 3.594 -9.624 13.815 1.00 0.38 O ATOM 2405 CB ARG B 82 6.321 -10.556 15.545 1.00 0.46 C ATOM 2406 CG ARG B 82 6.009 -11.792 16.393 1.00 0.76 C ATOM 2407 CD ARG B 82 6.692 -13.017 15.782 1.00 1.03 C ATOM 2408 NE ARG B 82 6.867 -13.965 16.917 1.00 1.54 N ATOM 2409 CZ ARG B 82 8.065 -14.271 17.334 1.00 1.74 C ATOM 2410 NH1 ARG B 82 8.732 -15.231 16.754 1.00 1.78 N ATOM 2411 NH2 ARG B 82 8.597 -13.616 18.329 1.00 2.20 N ATOM 0 H ARG B 82 7.765 -10.543 13.626 1.00 0.36 H new ATOM 0 HA ARG B 82 5.096 -11.621 14.101 1.00 0.40 H new ATOM 0 HB2 ARG B 82 7.400 -10.422 15.463 1.00 0.46 H new ATOM 0 HB3 ARG B 82 5.925 -9.662 16.027 1.00 0.46 H new ATOM 0 HG2 ARG B 82 6.356 -11.641 17.415 1.00 0.76 H new ATOM 0 HG3 ARG B 82 4.932 -11.950 16.442 1.00 0.76 H new ATOM 0 HD2 ARG B 82 6.083 -13.455 14.991 1.00 1.03 H new ATOM 0 HD3 ARG B 82 7.651 -12.753 15.336 1.00 1.03 H new ATOM 0 HE ARG B 82 6.050 -14.375 17.369 1.00 1.54 H new ATOM 0 HH11 ARG B 82 8.317 -15.742 15.975 1.00 1.78 H new ATOM 0 HH12 ARG B 82 9.668 -15.470 17.080 1.00 1.78 H new ATOM 0 HH21 ARG B 82 8.076 -12.864 18.781 1.00 2.20 H new ATOM 0 HH22 ARG B 82 9.533 -13.856 18.655 1.00 2.20 H new ATOM 2425 N GLY B 83 5.412 -8.410 13.486 1.00 0.36 N ATOM 2426 CA GLY B 83 4.620 -7.205 13.111 1.00 0.37 C ATOM 2427 C GLY B 83 3.908 -7.484 11.789 1.00 0.32 C ATOM 2428 O GLY B 83 2.812 -7.015 11.553 1.00 0.35 O ATOM 0 H GLY B 83 6.424 -8.283 13.467 1.00 0.36 H new ATOM 0 HA2 GLY B 83 3.894 -6.971 13.890 1.00 0.37 H new ATOM 0 HA3 GLY B 83 5.273 -6.338 13.014 1.00 0.37 H new ATOM 2432 N PHE B 84 4.525 -8.263 10.931 1.00 0.31 N ATOM 2433 CA PHE B 84 3.885 -8.598 9.623 1.00 0.32 C ATOM 2434 C PHE B 84 2.551 -9.298 9.881 1.00 0.31 C ATOM 2435 O PHE B 84 1.526 -8.922 9.344 1.00 0.32 O ATOM 2436 CB PHE B 84 4.858 -9.553 8.927 1.00 0.37 C ATOM 2437 CG PHE B 84 5.696 -8.804 7.931 1.00 0.54 C ATOM 2438 CD1 PHE B 84 5.137 -8.386 6.720 1.00 1.16 C ATOM 2439 CD2 PHE B 84 7.039 -8.541 8.216 1.00 0.84 C ATOM 2440 CE1 PHE B 84 5.924 -7.702 5.792 1.00 1.55 C ATOM 2441 CE2 PHE B 84 7.825 -7.855 7.289 1.00 1.11 C ATOM 2442 CZ PHE B 84 7.267 -7.437 6.078 1.00 1.37 C ATOM 0 H PHE B 84 5.444 -8.680 11.082 1.00 0.31 H new ATOM 0 HA PHE B 84 3.688 -7.715 9.016 1.00 0.32 H new ATOM 0 HB2 PHE B 84 5.500 -10.032 9.666 1.00 0.37 H new ATOM 0 HB3 PHE B 84 4.304 -10.346 8.424 1.00 0.37 H new ATOM 0 HD1 PHE B 84 4.099 -8.592 6.503 1.00 1.16 H new ATOM 0 HD2 PHE B 84 7.468 -8.868 9.152 1.00 0.84 H new ATOM 0 HE1 PHE B 84 5.496 -7.378 4.855 1.00 1.55 H new ATOM 0 HE2 PHE B 84 8.862 -7.648 7.507 1.00 1.11 H new ATOM 0 HZ PHE B 84 7.875 -6.907 5.360 1.00 1.37 H new ATOM 2452 N ARG B 85 2.562 -10.311 10.713 1.00 0.33 N ATOM 2453 CA ARG B 85 1.299 -11.043 11.029 1.00 0.34 C ATOM 2454 C ARG B 85 0.275 -10.081 11.636 1.00 0.32 C ATOM 2455 O ARG B 85 -0.891 -10.107 11.294 1.00 0.35 O ATOM 2456 CB ARG B 85 1.699 -12.114 12.045 1.00 0.42 C ATOM 2457 CG ARG B 85 0.650 -13.228 12.053 1.00 0.53 C ATOM 2458 CD ARG B 85 -0.498 -12.842 12.989 1.00 0.81 C ATOM 2459 NE ARG B 85 -1.311 -14.081 13.138 1.00 0.69 N ATOM 2460 CZ ARG B 85 -2.434 -14.047 13.803 1.00 0.66 C ATOM 2461 NH1 ARG B 85 -3.291 -13.087 13.587 1.00 1.09 N ATOM 2462 NH2 ARG B 85 -2.699 -14.973 14.683 1.00 1.04 N ATOM 0 H ARG B 85 3.394 -10.662 11.187 1.00 0.33 H new ATOM 0 HA ARG B 85 0.841 -11.480 10.142 1.00 0.34 H new ATOM 0 HB2 ARG B 85 2.677 -12.523 11.792 1.00 0.42 H new ATOM 0 HB3 ARG B 85 1.785 -11.674 13.038 1.00 0.42 H new ATOM 0 HG2 ARG B 85 0.271 -13.392 11.044 1.00 0.53 H new ATOM 0 HG3 ARG B 85 1.101 -14.165 12.381 1.00 0.53 H new ATOM 0 HD2 ARG B 85 -0.122 -12.499 13.953 1.00 0.81 H new ATOM 0 HD3 ARG B 85 -1.091 -12.029 12.571 1.00 0.81 H new ATOM 0 HE ARG B 85 -0.991 -14.955 12.721 1.00 0.69 H new ATOM 0 HH11 ARG B 85 -3.083 -12.363 12.899 1.00 1.09 H new ATOM 0 HH12 ARG B 85 -4.168 -13.060 14.106 1.00 1.09 H new ATOM 0 HH21 ARG B 85 -2.029 -15.723 14.851 1.00 1.04 H new ATOM 0 HH22 ARG B 85 -3.576 -14.947 15.203 1.00 1.04 H new ATOM 2476 N LYS B 86 0.705 -9.228 12.532 1.00 0.32 N ATOM 2477 CA LYS B 86 -0.244 -8.257 13.157 1.00 0.33 C ATOM 2478 C LYS B 86 -0.739 -7.265 12.100 1.00 0.30 C ATOM 2479 O LYS B 86 -1.908 -6.929 12.049 1.00 0.35 O ATOM 2480 CB LYS B 86 0.570 -7.536 14.235 1.00 0.37 C ATOM 2481 CG LYS B 86 0.176 -8.066 15.615 1.00 0.47 C ATOM 2482 CD LYS B 86 0.983 -9.327 15.928 1.00 0.55 C ATOM 2483 CE LYS B 86 0.221 -10.558 15.432 1.00 0.52 C ATOM 2484 NZ LYS B 86 0.950 -11.720 16.014 1.00 1.01 N ATOM 0 H LYS B 86 1.670 -9.162 12.857 1.00 0.32 H new ATOM 0 HA LYS B 86 -1.123 -8.745 13.578 1.00 0.33 H new ATOM 0 HB2 LYS B 86 1.635 -7.691 14.065 1.00 0.37 H new ATOM 0 HB3 LYS B 86 0.392 -6.462 14.182 1.00 0.37 H new ATOM 0 HG2 LYS B 86 0.360 -7.306 16.374 1.00 0.47 H new ATOM 0 HG3 LYS B 86 -0.891 -8.289 15.640 1.00 0.47 H new ATOM 0 HD2 LYS B 86 1.961 -9.274 15.449 1.00 0.55 H new ATOM 0 HD3 LYS B 86 1.158 -9.403 17.001 1.00 0.55 H new ATOM 0 HE2 LYS B 86 -0.818 -10.539 15.761 1.00 0.52 H new ATOM 0 HE3 LYS B 86 0.210 -10.604 14.343 1.00 0.52 H new ATOM 0 HZ1 LYS B 86 0.323 -12.550 16.032 1.00 1.01 H new ATOM 0 HZ2 LYS B 86 1.787 -11.931 15.434 1.00 1.01 H new ATOM 0 HZ3 LYS B 86 1.250 -11.492 16.983 1.00 1.01 H new ATOM 2498 N GLU B 87 0.146 -6.803 11.254 1.00 0.28 N ATOM 2499 CA GLU B 87 -0.258 -5.838 10.190 1.00 0.29 C ATOM 2500 C GLU B 87 -1.179 -6.528 9.180 1.00 0.26 C ATOM 2501 O GLU B 87 -2.177 -5.973 8.759 1.00 0.30 O ATOM 2502 CB GLU B 87 1.050 -5.408 9.524 1.00 0.32 C ATOM 2503 CG GLU B 87 1.603 -4.164 10.228 1.00 0.39 C ATOM 2504 CD GLU B 87 1.612 -2.981 9.256 1.00 0.47 C ATOM 2505 OE1 GLU B 87 2.038 -3.168 8.128 1.00 0.69 O ATOM 2506 OE2 GLU B 87 1.193 -1.907 9.658 1.00 0.78 O ATOM 0 H GLU B 87 1.135 -7.054 11.255 1.00 0.28 H new ATOM 0 HA GLU B 87 -0.806 -4.985 10.589 1.00 0.29 H new ATOM 0 HB2 GLU B 87 1.777 -6.218 9.572 1.00 0.32 H new ATOM 0 HB3 GLU B 87 0.879 -5.195 8.469 1.00 0.32 H new ATOM 0 HG2 GLU B 87 0.993 -3.926 11.099 1.00 0.39 H new ATOM 0 HG3 GLU B 87 2.613 -4.358 10.589 1.00 0.39 H new ATOM 2513 N ILE B 88 -0.857 -7.738 8.794 1.00 0.27 N ATOM 2514 CA ILE B 88 -1.725 -8.464 7.820 1.00 0.28 C ATOM 2515 C ILE B 88 -3.089 -8.734 8.470 1.00 0.27 C ATOM 2516 O ILE B 88 -4.119 -8.724 7.815 1.00 0.29 O ATOM 2517 CB ILE B 88 -0.952 -9.756 7.477 1.00 0.32 C ATOM 2518 CG1 ILE B 88 -1.171 -10.093 5.998 1.00 0.37 C ATOM 2519 CG2 ILE B 88 -1.414 -10.939 8.340 1.00 0.35 C ATOM 2520 CD1 ILE B 88 0.030 -9.613 5.180 1.00 0.46 C ATOM 0 H ILE B 88 -0.034 -8.251 9.110 1.00 0.27 H new ATOM 0 HA ILE B 88 -1.931 -7.902 6.909 1.00 0.28 H new ATOM 0 HB ILE B 88 0.105 -9.584 7.679 1.00 0.32 H new ATOM 0 HG12 ILE B 88 -1.302 -11.168 5.875 1.00 0.37 H new ATOM 0 HG13 ILE B 88 -2.083 -9.618 5.637 1.00 0.37 H new ATOM 0 HG21 ILE B 88 -0.847 -11.830 8.070 1.00 0.35 H new ATOM 0 HG22 ILE B 88 -1.248 -10.709 9.392 1.00 0.35 H new ATOM 0 HG23 ILE B 88 -2.476 -11.119 8.172 1.00 0.35 H new ATOM 0 HD11 ILE B 88 -0.127 -9.853 4.128 1.00 0.46 H new ATOM 0 HD12 ILE B 88 0.140 -8.535 5.293 1.00 0.46 H new ATOM 0 HD13 ILE B 88 0.933 -10.109 5.535 1.00 0.46 H new ATOM 2532 N GLY B 89 -3.100 -8.942 9.766 1.00 0.28 N ATOM 2533 CA GLY B 89 -4.387 -9.179 10.479 1.00 0.31 C ATOM 2534 C GLY B 89 -5.230 -7.915 10.354 1.00 0.29 C ATOM 2535 O GLY B 89 -6.423 -7.967 10.121 1.00 0.31 O ATOM 0 H GLY B 89 -2.269 -8.957 10.358 1.00 0.28 H new ATOM 0 HA2 GLY B 89 -4.911 -10.032 10.047 1.00 0.31 H new ATOM 0 HA3 GLY B 89 -4.205 -9.414 11.528 1.00 0.31 H new ATOM 2539 N ARG B 90 -4.603 -6.774 10.484 1.00 0.29 N ATOM 2540 CA ARG B 90 -5.349 -5.493 10.345 1.00 0.29 C ATOM 2541 C ARG B 90 -5.867 -5.375 8.913 1.00 0.26 C ATOM 2542 O ARG B 90 -6.935 -4.842 8.674 1.00 0.30 O ATOM 2543 CB ARG B 90 -4.326 -4.394 10.628 1.00 0.32 C ATOM 2544 CG ARG B 90 -4.155 -4.220 12.135 1.00 0.33 C ATOM 2545 CD ARG B 90 -2.997 -3.258 12.398 1.00 0.39 C ATOM 2546 NE ARG B 90 -2.875 -3.193 13.882 1.00 0.50 N ATOM 2547 CZ ARG B 90 -1.785 -2.727 14.428 1.00 0.76 C ATOM 2548 NH1 ARG B 90 -0.718 -3.475 14.497 1.00 1.22 N ATOM 2549 NH2 ARG B 90 -1.762 -1.513 14.906 1.00 0.90 N ATOM 0 H ARG B 90 -3.607 -6.677 10.680 1.00 0.29 H new ATOM 0 HA ARG B 90 -6.202 -5.428 11.021 1.00 0.29 H new ATOM 0 HB2 ARG B 90 -3.370 -4.649 10.172 1.00 0.32 H new ATOM 0 HB3 ARG B 90 -4.653 -3.456 10.179 1.00 0.32 H new ATOM 0 HG2 ARG B 90 -5.074 -3.832 12.576 1.00 0.33 H new ATOM 0 HG3 ARG B 90 -3.958 -5.183 12.605 1.00 0.33 H new ATOM 0 HD2 ARG B 90 -2.075 -3.618 11.942 1.00 0.39 H new ATOM 0 HD3 ARG B 90 -3.199 -2.274 11.976 1.00 0.39 H new ATOM 0 HE ARG B 90 -3.644 -3.513 14.471 1.00 0.50 H new ATOM 0 HH11 ARG B 90 -0.736 -4.424 14.124 1.00 1.22 H new ATOM 0 HH12 ARG B 90 0.134 -3.110 14.924 1.00 1.22 H new ATOM 0 HH21 ARG B 90 -2.596 -0.928 14.853 1.00 0.90 H new ATOM 0 HH22 ARG B 90 -0.910 -1.149 15.333 1.00 0.90 H new ATOM 2563 N MET B 91 -5.121 -5.900 7.963 1.00 0.23 N ATOM 2564 CA MET B 91 -5.562 -5.847 6.539 1.00 0.22 C ATOM 2565 C MET B 91 -6.917 -6.526 6.439 1.00 0.22 C ATOM 2566 O MET B 91 -7.834 -6.033 5.809 1.00 0.26 O ATOM 2567 CB MET B 91 -4.500 -6.622 5.751 1.00 0.23 C ATOM 2568 CG MET B 91 -4.049 -5.795 4.545 1.00 0.50 C ATOM 2569 SD MET B 91 -2.773 -6.703 3.637 1.00 0.54 S ATOM 2570 CE MET B 91 -1.343 -6.058 4.540 1.00 0.99 C ATOM 0 H MET B 91 -4.225 -6.362 8.120 1.00 0.23 H new ATOM 0 HA MET B 91 -5.661 -4.832 6.154 1.00 0.22 H new ATOM 0 HB2 MET B 91 -3.647 -6.843 6.392 1.00 0.23 H new ATOM 0 HB3 MET B 91 -4.905 -7.578 5.418 1.00 0.23 H new ATOM 0 HG2 MET B 91 -4.898 -5.589 3.893 1.00 0.50 H new ATOM 0 HG3 MET B 91 -3.660 -4.832 4.875 1.00 0.50 H new ATOM 0 HE1 MET B 91 -0.640 -6.868 4.735 1.00 0.99 H new ATOM 0 HE2 MET B 91 -0.853 -5.288 3.944 1.00 0.99 H new ATOM 0 HE3 MET B 91 -1.673 -5.629 5.486 1.00 0.99 H new ATOM 2580 N LEU B 92 -7.049 -7.644 7.099 1.00 0.23 N ATOM 2581 CA LEU B 92 -8.347 -8.369 7.099 1.00 0.26 C ATOM 2582 C LEU B 92 -9.400 -7.481 7.734 1.00 0.29 C ATOM 2583 O LEU B 92 -10.506 -7.366 7.240 1.00 0.34 O ATOM 2584 CB LEU B 92 -8.094 -9.617 7.919 1.00 0.30 C ATOM 2585 CG LEU B 92 -7.032 -10.429 7.196 1.00 0.31 C ATOM 2586 CD1 LEU B 92 -6.169 -11.183 8.213 1.00 0.38 C ATOM 2587 CD2 LEU B 92 -7.710 -11.424 6.248 1.00 0.38 C ATOM 0 H LEU B 92 -6.307 -8.087 7.641 1.00 0.23 H new ATOM 0 HA LEU B 92 -8.706 -8.627 6.103 1.00 0.26 H new ATOM 0 HB2 LEU B 92 -7.760 -9.355 8.923 1.00 0.30 H new ATOM 0 HB3 LEU B 92 -9.011 -10.196 8.029 1.00 0.30 H new ATOM 0 HG LEU B 92 -6.394 -9.758 6.621 1.00 0.31 H new ATOM 0 HD11 LEU B 92 -5.410 -11.763 7.687 1.00 0.38 H new ATOM 0 HD12 LEU B 92 -5.684 -10.469 8.879 1.00 0.38 H new ATOM 0 HD13 LEU B 92 -6.798 -11.854 8.797 1.00 0.38 H new ATOM 0 HD21 LEU B 92 -6.950 -12.007 5.728 1.00 0.38 H new ATOM 0 HD22 LEU B 92 -8.352 -12.093 6.821 1.00 0.38 H new ATOM 0 HD23 LEU B 92 -8.311 -10.880 5.519 1.00 0.38 H new ATOM 2599 N ASN B 93 -9.042 -6.810 8.802 1.00 0.31 N ATOM 2600 CA ASN B 93 -10.003 -5.875 9.449 1.00 0.36 C ATOM 2601 C ASN B 93 -10.473 -4.874 8.392 1.00 0.36 C ATOM 2602 O ASN B 93 -11.557 -4.328 8.472 1.00 0.44 O ATOM 2603 CB ASN B 93 -9.211 -5.172 10.556 1.00 0.38 C ATOM 2604 CG ASN B 93 -9.987 -5.255 11.872 1.00 0.43 C ATOM 2605 OD1 ASN B 93 -10.945 -4.535 12.072 1.00 0.58 O ATOM 2606 ND2 ASN B 93 -9.610 -6.108 12.785 1.00 0.64 N ATOM 0 H ASN B 93 -8.128 -6.872 9.250 1.00 0.31 H new ATOM 0 HA ASN B 93 -10.880 -6.373 9.862 1.00 0.36 H new ATOM 0 HB2 ASN B 93 -8.232 -5.638 10.669 1.00 0.38 H new ATOM 0 HB3 ASN B 93 -9.039 -4.129 10.288 1.00 0.38 H new ATOM 0 HD21 ASN B 93 -10.120 -6.170 13.666 1.00 0.64 H new ATOM 0 HD22 ASN B 93 -8.806 -6.713 12.617 1.00 0.64 H new ATOM 2613 N ILE B 94 -9.654 -4.651 7.385 1.00 0.31 N ATOM 2614 CA ILE B 94 -10.039 -3.709 6.295 1.00 0.33 C ATOM 2615 C ILE B 94 -10.835 -4.445 5.213 1.00 0.33 C ATOM 2616 O ILE B 94 -11.760 -3.893 4.648 1.00 0.38 O ATOM 2617 CB ILE B 94 -8.733 -3.167 5.696 1.00 0.32 C ATOM 2618 CG1 ILE B 94 -7.698 -2.927 6.809 1.00 0.35 C ATOM 2619 CG2 ILE B 94 -9.034 -1.861 4.955 1.00 0.38 C ATOM 2620 CD1 ILE B 94 -6.910 -1.633 6.563 1.00 0.51 C ATOM 0 H ILE B 94 -8.737 -5.084 7.277 1.00 0.31 H new ATOM 0 HA ILE B 94 -10.663 -2.904 6.683 1.00 0.33 H new ATOM 0 HB ILE B 94 -8.318 -3.894 4.998 1.00 0.32 H new ATOM 0 HG12 ILE B 94 -8.203 -2.871 7.773 1.00 0.35 H new ATOM 0 HG13 ILE B 94 -7.010 -3.771 6.858 1.00 0.35 H new ATOM 0 HG21 ILE B 94 -8.114 -1.466 4.525 1.00 0.38 H new ATOM 0 HG22 ILE B 94 -9.754 -2.052 4.159 1.00 0.38 H new ATOM 0 HG23 ILE B 94 -9.449 -1.134 5.653 1.00 0.38 H new ATOM 0 HD11 ILE B 94 -6.186 -1.490 7.365 1.00 0.51 H new ATOM 0 HD12 ILE B 94 -6.386 -1.702 5.610 1.00 0.51 H new ATOM 0 HD13 ILE B 94 -7.597 -0.787 6.539 1.00 0.51 H new ATOM 2632 N LEU B 95 -10.487 -5.680 4.898 1.00 0.30 N ATOM 2633 CA LEU B 95 -11.257 -6.394 3.826 1.00 0.32 C ATOM 2634 C LEU B 95 -12.391 -7.239 4.422 1.00 0.35 C ATOM 2635 O LEU B 95 -12.995 -8.042 3.735 1.00 0.39 O ATOM 2636 CB LEU B 95 -10.243 -7.269 3.081 1.00 0.29 C ATOM 2637 CG LEU B 95 -9.549 -8.220 4.048 1.00 0.29 C ATOM 2638 CD1 LEU B 95 -10.058 -9.645 3.821 1.00 0.43 C ATOM 2639 CD2 LEU B 95 -8.038 -8.172 3.801 1.00 0.29 C ATOM 0 H LEU B 95 -9.726 -6.208 5.325 1.00 0.30 H new ATOM 0 HA LEU B 95 -11.735 -5.686 3.150 1.00 0.32 H new ATOM 0 HB2 LEU B 95 -10.748 -7.838 2.301 1.00 0.29 H new ATOM 0 HB3 LEU B 95 -9.503 -6.639 2.587 1.00 0.29 H new ATOM 0 HG LEU B 95 -9.764 -7.920 5.074 1.00 0.29 H new ATOM 0 HD11 LEU B 95 -9.560 -10.324 4.514 1.00 0.43 H new ATOM 0 HD12 LEU B 95 -11.134 -9.678 3.991 1.00 0.43 H new ATOM 0 HD13 LEU B 95 -9.842 -9.950 2.797 1.00 0.43 H new ATOM 0 HD21 LEU B 95 -7.535 -8.851 4.490 1.00 0.29 H new ATOM 0 HD22 LEU B 95 -7.827 -8.474 2.775 1.00 0.29 H new ATOM 0 HD23 LEU B 95 -7.675 -7.157 3.962 1.00 0.29 H new ATOM 2651 N ASN B 96 -12.700 -7.048 5.683 1.00 0.41 N ATOM 2652 CA ASN B 96 -13.817 -7.824 6.314 1.00 0.47 C ATOM 2653 C ASN B 96 -14.899 -6.871 6.839 1.00 0.51 C ATOM 2654 O ASN B 96 -15.964 -7.296 7.244 1.00 0.59 O ATOM 2655 CB ASN B 96 -13.179 -8.593 7.469 1.00 0.49 C ATOM 2656 CG ASN B 96 -12.376 -9.771 6.915 1.00 0.54 C ATOM 2657 OD1 ASN B 96 -12.789 -10.416 5.971 1.00 0.77 O ATOM 2658 ND2 ASN B 96 -11.238 -10.084 7.467 1.00 0.59 N ATOM 0 H ASN B 96 -12.228 -6.389 6.302 1.00 0.41 H new ATOM 0 HA ASN B 96 -14.299 -8.493 5.601 1.00 0.47 H new ATOM 0 HB2 ASN B 96 -12.528 -7.934 8.044 1.00 0.49 H new ATOM 0 HB3 ASN B 96 -13.950 -8.953 8.150 1.00 0.49 H new ATOM 0 HD21 ASN B 96 -10.695 -10.869 7.107 1.00 0.59 H new ATOM 0 HD22 ASN B 96 -10.890 -9.544 8.259 1.00 0.59 H new