USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 699 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 TYR OH : rot -6:sc= -1.71! USER MOD Set 1.2: A 138 GLN : amide:sc= -1.76! C(o=-3.5!,f=-8.5!) USER MOD Set 2.1: A 78 SER OG : rot 70:sc= -0.0815 USER MOD Set 2.2: A 82 HIS : no HD1:sc= -4.52! C(o=-4.6!,f=-6.3!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.0159 K(o=-0.016,f=-1.8!) USER MOD Single : A 68 SER OG : rot -133:sc= 0.032 USER MOD Single : A 74 GLN : amide:sc= -0.007 K(o=-0.007,f=-1.6!) USER MOD Single : A 77 THR OG1 : rot -140:sc= 0 USER MOD Single : A 85 SER OG : rot -155:sc= 0.118 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0.154! USER MOD Single : A 98 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.59) USER MOD Single : A 105 ASN : amide:sc= -0.0659 K(o=-0.066,f=-2.2!) USER MOD Single : A 106 ASN : amide:sc= -3.97! C(o=-4!,f=-3.1!) USER MOD Single : A 109 ASN : amide:sc= -3.15! C(o=-3.1!,f=-9.4!) USER MOD Single : A 119 THR OG1 : rot 74:sc= -0.799 USER MOD Single : A 122 ASN : amide:sc= -1.2! K(o=-1.2!,f=-0.026) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -1.69! C(o=-1.7!,f=-5.2!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -13.042 -7.021 -4.583 1.00 0.00 N ATOM 417 CA GLY A 54 -12.956 -7.487 -3.172 1.00 0.00 C ATOM 418 C GLY A 54 -11.597 -7.096 -2.592 1.00 0.00 C ATOM 419 O GLY A 54 -11.443 -6.050 -1.989 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.757 -7.044 -2.581 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.086 -8.568 -3.126 1.00 0.00 H new ATOM 423 N LEU A 55 -10.608 -7.938 -2.769 1.00 0.00 N ATOM 424 CA LEU A 55 -9.246 -7.644 -2.230 1.00 0.00 C ATOM 425 C LEU A 55 -8.329 -7.155 -3.348 1.00 0.00 C ATOM 426 O LEU A 55 -8.637 -7.255 -4.523 1.00 0.00 O ATOM 427 CB LEU A 55 -8.643 -8.917 -1.627 1.00 0.00 C ATOM 428 CG LEU A 55 -9.470 -9.395 -0.419 1.00 0.00 C ATOM 429 CD1 LEU A 55 -9.596 -8.278 0.633 1.00 0.00 C ATOM 430 CD2 LEU A 55 -10.863 -9.847 -0.876 1.00 0.00 C ATOM 0 H LEU A 55 -10.688 -8.824 -3.268 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.336 -6.872 -1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.608 -9.702 -2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.615 -8.727 -1.317 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.954 -10.240 0.036 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.184 -8.638 1.477 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.603 -7.990 0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.090 -7.414 0.189 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.438 -10.183 -0.013 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -11.378 -9.013 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.764 -10.667 -1.587 1.00 0.00 H new ATOM 442 N ALA A 56 -7.192 -6.626 -2.974 1.00 0.00 N ATOM 443 CA ALA A 56 -6.211 -6.118 -3.973 1.00 0.00 C ATOM 444 C ALA A 56 -4.847 -6.720 -3.660 1.00 0.00 C ATOM 445 O ALA A 56 -4.688 -7.454 -2.693 1.00 0.00 O ATOM 446 CB ALA A 56 -6.124 -4.597 -3.879 1.00 0.00 C ATOM 0 H ALA A 56 -6.900 -6.524 -2.002 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.526 -6.397 -4.979 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.406 -4.228 -4.611 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.103 -4.163 -4.081 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.801 -4.312 -2.878 1.00 0.00 H new ATOM 452 N LEU A 57 -3.861 -6.433 -4.477 1.00 0.00 N ATOM 453 CA LEU A 57 -2.503 -7.003 -4.241 1.00 0.00 C ATOM 454 C LEU A 57 -1.442 -5.910 -4.299 1.00 0.00 C ATOM 455 O LEU A 57 -1.540 -4.951 -5.050 1.00 0.00 O ATOM 456 CB LEU A 57 -2.192 -8.052 -5.309 1.00 0.00 C ATOM 457 CG LEU A 57 -3.145 -9.265 -5.168 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.380 -9.076 -6.055 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.418 -10.546 -5.593 1.00 0.00 C ATOM 0 H LEU A 57 -3.941 -5.829 -5.295 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.491 -7.460 -3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.297 -7.612 -6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.157 -8.381 -5.214 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.457 -9.343 -4.126 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.041 -9.936 -5.946 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.909 -8.171 -5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.070 -8.986 -7.096 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.092 -11.397 -5.492 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.099 -10.456 -6.632 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.545 -10.697 -4.958 1.00 0.00 H new ATOM 471 N LEU A 58 -0.417 -6.071 -3.503 1.00 0.00 N ATOM 472 CA LEU A 58 0.702 -5.086 -3.464 1.00 0.00 C ATOM 473 C LEU A 58 1.979 -5.771 -3.927 1.00 0.00 C ATOM 474 O LEU A 58 2.286 -6.875 -3.516 1.00 0.00 O ATOM 475 CB LEU A 58 0.886 -4.583 -2.026 1.00 0.00 C ATOM 476 CG LEU A 58 -0.119 -3.455 -1.728 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.399 -3.394 -0.224 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.471 -2.112 -2.180 1.00 0.00 C ATOM 0 H LEU A 58 -0.308 -6.860 -2.866 1.00 0.00 H new ATOM 0 HA LEU A 58 0.477 -4.243 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.742 -5.404 -1.324 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.904 -4.220 -1.887 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.047 -3.653 -2.265 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.111 -2.594 -0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.816 -4.345 0.107 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.530 -3.199 0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.240 -1.313 -1.969 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.400 -1.923 -1.641 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.673 -2.145 -3.251 1.00 0.00 H new ATOM 490 N VAL A 59 2.723 -5.122 -4.788 1.00 0.00 N ATOM 491 CA VAL A 59 3.987 -5.724 -5.301 1.00 0.00 C ATOM 492 C VAL A 59 5.154 -4.785 -4.989 1.00 0.00 C ATOM 493 O VAL A 59 5.074 -3.583 -5.176 1.00 0.00 O ATOM 494 CB VAL A 59 3.881 -5.927 -6.810 1.00 0.00 C ATOM 495 CG1 VAL A 59 5.220 -6.433 -7.345 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.784 -6.950 -7.109 1.00 0.00 C ATOM 0 H VAL A 59 2.506 -4.197 -5.158 1.00 0.00 H new ATOM 0 HA VAL A 59 4.155 -6.688 -4.821 1.00 0.00 H new ATOM 0 HB VAL A 59 3.632 -4.982 -7.293 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.149 -6.580 -8.423 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.998 -5.701 -7.129 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.469 -7.380 -6.866 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.707 -7.096 -8.186 1.00 0.00 H new ATOM 0 HG22 VAL A 59 3.030 -7.898 -6.631 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.832 -6.586 -6.723 1.00 0.00 H new ATOM 506 N VAL A 60 6.234 -5.336 -4.507 1.00 0.00 N ATOM 507 CA VAL A 60 7.420 -4.507 -4.163 1.00 0.00 C ATOM 508 C VAL A 60 8.064 -3.955 -5.434 1.00 0.00 C ATOM 509 O VAL A 60 8.285 -4.667 -6.399 1.00 0.00 O ATOM 510 CB VAL A 60 8.435 -5.365 -3.406 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.701 -4.548 -3.137 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.827 -5.814 -2.074 1.00 0.00 C ATOM 0 H VAL A 60 6.345 -6.335 -4.336 1.00 0.00 H new ATOM 0 HA VAL A 60 7.103 -3.673 -3.537 1.00 0.00 H new ATOM 0 HB VAL A 60 8.689 -6.239 -4.006 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.422 -5.162 -2.598 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.135 -4.226 -4.084 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.449 -3.673 -2.538 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.549 -6.426 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.573 -4.938 -1.477 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.926 -6.398 -2.264 1.00 0.00 H new ATOM 522 N LYS A 61 8.375 -2.685 -5.434 1.00 0.00 N ATOM 523 CA LYS A 61 9.016 -2.059 -6.624 1.00 0.00 C ATOM 524 C LYS A 61 10.533 -2.051 -6.432 1.00 0.00 C ATOM 525 O LYS A 61 11.295 -2.091 -7.380 1.00 0.00 O ATOM 526 CB LYS A 61 8.510 -0.621 -6.761 1.00 0.00 C ATOM 527 CG LYS A 61 8.996 -0.030 -8.085 1.00 0.00 C ATOM 528 CD LYS A 61 8.407 1.371 -8.273 1.00 0.00 C ATOM 529 CE LYS A 61 8.876 1.944 -9.612 1.00 0.00 C ATOM 530 NZ LYS A 61 8.274 3.292 -9.817 1.00 0.00 N ATOM 0 H LYS A 61 8.210 -2.051 -4.652 1.00 0.00 H new ATOM 0 HA LYS A 61 8.767 -2.624 -7.523 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.421 -0.603 -6.721 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.870 -0.017 -5.928 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.085 0.019 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.699 -0.674 -8.913 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.318 1.326 -8.245 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.720 2.022 -7.457 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.964 2.014 -9.628 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.587 1.278 -10.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.594 3.680 -10.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.237 3.212 -9.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.571 3.925 -9.047 1.00 0.00 H new ATOM 544 N ARG A 62 10.982 -2.001 -5.202 1.00 0.00 N ATOM 545 CA ARG A 62 12.452 -1.991 -4.944 1.00 0.00 C ATOM 546 C ARG A 62 12.759 -2.706 -3.625 1.00 0.00 C ATOM 547 O ARG A 62 12.075 -2.532 -2.632 1.00 0.00 O ATOM 548 CB ARG A 62 12.953 -0.546 -4.866 1.00 0.00 C ATOM 549 CG ARG A 62 14.475 -0.537 -4.682 1.00 0.00 C ATOM 550 CD ARG A 62 14.977 0.906 -4.630 1.00 0.00 C ATOM 551 NE ARG A 62 16.455 0.906 -4.445 1.00 0.00 N ATOM 552 CZ ARG A 62 17.082 1.999 -4.097 1.00 0.00 C ATOM 553 NH1 ARG A 62 16.422 3.109 -3.908 1.00 0.00 N ATOM 554 NH2 ARG A 62 18.377 1.978 -3.937 1.00 0.00 N ATOM 0 H ARG A 62 10.395 -1.967 -4.369 1.00 0.00 H new ATOM 0 HA ARG A 62 12.956 -2.509 -5.759 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.684 -0.008 -5.775 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.473 -0.029 -4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.743 -1.059 -3.764 1.00 0.00 H new ATOM 0 HG3 ARG A 62 14.954 -1.070 -5.503 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.714 1.428 -5.550 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.496 1.441 -3.811 1.00 0.00 H new ATOM 0 HE ARG A 62 16.983 0.045 -4.591 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.410 3.128 -4.032 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.918 3.958 -3.637 1.00 0.00 H new ATOM 0 HH21 ARG A 62 18.895 1.112 -4.083 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.871 2.828 -3.666 1.00 0.00 H new ATOM 568 N GLY A 63 13.799 -3.502 -3.613 1.00 0.00 N ATOM 569 CA GLY A 63 14.188 -4.234 -2.372 1.00 0.00 C ATOM 570 C GLY A 63 14.716 -5.622 -2.743 1.00 0.00 C ATOM 571 O GLY A 63 14.674 -6.024 -3.889 1.00 0.00 O ATOM 0 H GLY A 63 14.400 -3.676 -4.419 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.952 -3.675 -1.832 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.329 -4.326 -1.707 1.00 0.00 H new ATOM 575 N PRO A 64 15.206 -6.351 -1.772 1.00 0.00 N ATOM 576 CA PRO A 64 15.750 -7.725 -1.983 1.00 0.00 C ATOM 577 C PRO A 64 14.623 -8.733 -2.234 1.00 0.00 C ATOM 578 O PRO A 64 14.849 -9.853 -2.658 1.00 0.00 O ATOM 579 CB PRO A 64 16.481 -8.031 -0.668 1.00 0.00 C ATOM 580 CG PRO A 64 15.792 -7.193 0.364 1.00 0.00 C ATOM 581 CD PRO A 64 15.286 -5.940 -0.362 1.00 0.00 C ATOM 0 HA PRO A 64 16.401 -7.791 -2.854 1.00 0.00 H new ATOM 0 HB2 PRO A 64 16.420 -9.091 -0.420 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.539 -7.780 -0.737 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.965 -7.739 0.819 1.00 0.00 H new ATOM 0 HG3 PRO A 64 16.478 -6.926 1.168 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.314 -5.625 0.017 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.968 -5.100 -0.230 1.00 0.00 H new ATOM 589 N ASN A 65 13.407 -8.333 -1.970 1.00 0.00 N ATOM 590 CA ASN A 65 12.241 -9.239 -2.180 1.00 0.00 C ATOM 591 C ASN A 65 11.597 -8.915 -3.531 1.00 0.00 C ATOM 592 O ASN A 65 10.469 -9.287 -3.800 1.00 0.00 O ATOM 593 CB ASN A 65 11.224 -9.009 -1.058 1.00 0.00 C ATOM 594 CG ASN A 65 11.797 -9.518 0.266 1.00 0.00 C ATOM 595 OD1 ASN A 65 12.723 -10.306 0.278 1.00 0.00 O ATOM 596 ND2 ASN A 65 11.283 -9.100 1.392 1.00 0.00 N ATOM 0 H ASN A 65 13.170 -7.407 -1.614 1.00 0.00 H new ATOM 0 HA ASN A 65 12.566 -10.279 -2.170 1.00 0.00 H new ATOM 0 HB2 ASN A 65 10.988 -7.948 -0.980 1.00 0.00 H new ATOM 0 HB3 ASN A 65 10.292 -9.527 -1.286 1.00 0.00 H new ATOM 0 HD21 ASN A 65 11.659 -9.435 2.279 1.00 0.00 H new ATOM 0 HD22 ASN A 65 10.506 -8.439 1.384 1.00 0.00 H new ATOM 603 N ALA A 66 12.312 -8.213 -4.376 1.00 0.00 N ATOM 604 CA ALA A 66 11.770 -7.829 -5.714 1.00 0.00 C ATOM 605 C ALA A 66 10.965 -8.979 -6.329 1.00 0.00 C ATOM 606 O ALA A 66 11.387 -10.122 -6.348 1.00 0.00 O ATOM 607 CB ALA A 66 12.926 -7.468 -6.647 1.00 0.00 C ATOM 0 H ALA A 66 13.260 -7.886 -4.191 1.00 0.00 H new ATOM 0 HA ALA A 66 11.110 -6.971 -5.585 1.00 0.00 H new ATOM 0 HB1 ALA A 66 12.531 -7.188 -7.624 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.484 -6.631 -6.227 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.588 -8.327 -6.756 1.00 0.00 H new ATOM 613 N GLY A 67 9.796 -8.666 -6.834 1.00 0.00 N ATOM 614 CA GLY A 67 8.924 -9.704 -7.455 1.00 0.00 C ATOM 615 C GLY A 67 7.915 -10.212 -6.419 1.00 0.00 C ATOM 616 O GLY A 67 6.946 -10.875 -6.748 1.00 0.00 O ATOM 0 H GLY A 67 9.407 -7.723 -6.841 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.400 -9.287 -8.315 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.531 -10.531 -7.823 1.00 0.00 H new ATOM 620 N SER A 68 8.143 -9.913 -5.168 1.00 0.00 N ATOM 621 CA SER A 68 7.216 -10.381 -4.095 1.00 0.00 C ATOM 622 C SER A 68 5.844 -9.716 -4.228 1.00 0.00 C ATOM 623 O SER A 68 5.723 -8.574 -4.642 1.00 0.00 O ATOM 624 CB SER A 68 7.812 -10.047 -2.731 1.00 0.00 C ATOM 625 OG SER A 68 6.864 -10.356 -1.715 1.00 0.00 O ATOM 0 H SER A 68 8.936 -9.361 -4.841 1.00 0.00 H new ATOM 0 HA SER A 68 7.088 -11.459 -4.194 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.729 -10.614 -2.573 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.079 -8.991 -2.687 1.00 0.00 H new ATOM 0 HG SER A 68 6.804 -9.608 -1.085 1.00 0.00 H new ATOM 631 N ARG A 69 4.807 -10.436 -3.871 1.00 0.00 N ATOM 632 CA ARG A 69 3.422 -9.885 -3.962 1.00 0.00 C ATOM 633 C ARG A 69 2.653 -10.215 -2.681 1.00 0.00 C ATOM 634 O ARG A 69 2.801 -11.281 -2.112 1.00 0.00 O ATOM 635 CB ARG A 69 2.710 -10.506 -5.167 1.00 0.00 C ATOM 636 CG ARG A 69 2.677 -12.034 -5.033 1.00 0.00 C ATOM 637 CD ARG A 69 1.980 -12.635 -6.258 1.00 0.00 C ATOM 638 NE ARG A 69 1.948 -14.122 -6.138 1.00 0.00 N ATOM 639 CZ ARG A 69 1.418 -14.855 -7.083 1.00 0.00 C ATOM 640 NH1 ARG A 69 0.909 -14.298 -8.148 1.00 0.00 N ATOM 641 NH2 ARG A 69 1.400 -16.155 -6.963 1.00 0.00 N ATOM 0 H ARG A 69 4.864 -11.391 -3.517 1.00 0.00 H new ATOM 0 HA ARG A 69 3.466 -8.803 -4.084 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.694 -10.118 -5.238 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.224 -10.225 -6.087 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.691 -12.425 -4.949 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.149 -12.319 -4.123 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.965 -12.245 -6.339 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.507 -12.345 -7.167 1.00 0.00 H new ATOM 0 HE ARG A 69 2.343 -14.571 -5.312 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.922 -13.283 -8.249 1.00 0.00 H new ATOM 0 HH12 ARG A 69 0.498 -14.878 -8.880 1.00 0.00 H new ATOM 0 HH21 ARG A 69 1.798 -16.596 -6.134 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.987 -16.729 -7.698 1.00 0.00 H new ATOM 655 N PHE A 70 1.834 -9.296 -2.221 1.00 0.00 N ATOM 656 CA PHE A 70 1.044 -9.527 -0.970 1.00 0.00 C ATOM 657 C PHE A 70 -0.450 -9.468 -1.279 1.00 0.00 C ATOM 658 O PHE A 70 -0.950 -8.505 -1.829 1.00 0.00 O ATOM 659 CB PHE A 70 1.393 -8.449 0.054 1.00 0.00 C ATOM 660 CG PHE A 70 2.849 -8.578 0.430 1.00 0.00 C ATOM 661 CD1 PHE A 70 3.292 -9.716 1.113 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.757 -7.566 0.092 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.640 -9.843 1.461 1.00 0.00 C ATOM 664 CE2 PHE A 70 5.108 -7.693 0.440 1.00 0.00 C ATOM 665 CZ PHE A 70 5.550 -8.833 1.125 1.00 0.00 C ATOM 0 H PHE A 70 1.679 -8.390 -2.663 1.00 0.00 H new ATOM 0 HA PHE A 70 1.287 -10.511 -0.568 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.198 -7.460 -0.360 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.765 -8.554 0.939 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.592 -10.497 1.372 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.416 -6.688 -0.437 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.980 -10.721 1.990 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.808 -6.913 0.181 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.591 -8.932 1.393 1.00 0.00 H new ATOM 675 N LEU A 71 -1.163 -10.503 -0.919 1.00 0.00 N ATOM 676 CA LEU A 71 -2.634 -10.552 -1.175 1.00 0.00 C ATOM 677 C LEU A 71 -3.401 -10.245 0.113 1.00 0.00 C ATOM 678 O LEU A 71 -3.101 -10.774 1.170 1.00 0.00 O ATOM 679 CB LEU A 71 -3.000 -11.945 -1.685 1.00 0.00 C ATOM 680 CG LEU A 71 -4.542 -12.091 -1.789 1.00 0.00 C ATOM 681 CD1 LEU A 71 -4.917 -12.816 -3.086 1.00 0.00 C ATOM 682 CD2 LEU A 71 -5.075 -12.895 -0.592 1.00 0.00 C ATOM 0 H LEU A 71 -0.784 -11.327 -0.453 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.902 -9.806 -1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.545 -12.114 -2.661 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.600 -12.703 -1.012 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.986 -11.095 -1.788 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.001 -12.913 -3.148 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.554 -12.245 -3.940 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.463 -13.807 -3.093 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.158 -12.993 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.620 -13.886 -0.588 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.825 -12.377 0.334 1.00 0.00 H new ATOM 694 N LEU A 72 -4.384 -9.379 0.034 1.00 0.00 N ATOM 695 CA LEU A 72 -5.167 -9.008 1.246 1.00 0.00 C ATOM 696 C LEU A 72 -6.332 -9.977 1.443 1.00 0.00 C ATOM 697 O LEU A 72 -6.779 -10.626 0.517 1.00 0.00 O ATOM 698 CB LEU A 72 -5.710 -7.586 1.074 1.00 0.00 C ATOM 699 CG LEU A 72 -4.548 -6.615 0.830 1.00 0.00 C ATOM 700 CD1 LEU A 72 -5.106 -5.211 0.577 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.619 -6.588 2.056 1.00 0.00 C ATOM 0 H LEU A 72 -4.676 -8.913 -0.825 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.518 -9.058 2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.407 -7.551 0.237 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.265 -7.288 1.964 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.979 -6.946 -0.039 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -4.283 -4.518 0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.755 -5.230 -0.298 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.678 -4.885 1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.797 -5.896 1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.181 -6.262 2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.220 -7.587 2.232 1.00 0.00 H new ATOM 713 N ASP A 73 -6.821 -10.068 2.653 1.00 0.00 N ATOM 714 CA ASP A 73 -7.963 -10.972 2.957 1.00 0.00 C ATOM 715 C ASP A 73 -8.397 -10.728 4.406 1.00 0.00 C ATOM 716 O ASP A 73 -8.836 -11.626 5.101 1.00 0.00 O ATOM 717 CB ASP A 73 -7.537 -12.434 2.768 1.00 0.00 C ATOM 718 CG ASP A 73 -8.751 -13.349 2.945 1.00 0.00 C ATOM 719 OD1 ASP A 73 -9.798 -12.847 3.316 1.00 0.00 O ATOM 720 OD2 ASP A 73 -8.612 -14.536 2.697 1.00 0.00 O ATOM 0 H ASP A 73 -6.469 -9.544 3.454 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.795 -10.769 2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.106 -12.573 1.776 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -6.764 -12.695 3.491 1.00 0.00 H new ATOM 725 N GLN A 74 -8.275 -9.503 4.865 1.00 0.00 N ATOM 726 CA GLN A 74 -8.682 -9.178 6.263 1.00 0.00 C ATOM 727 C GLN A 74 -9.000 -7.684 6.379 1.00 0.00 C ATOM 728 O GLN A 74 -8.407 -6.853 5.714 1.00 0.00 O ATOM 729 CB GLN A 74 -7.558 -9.522 7.239 1.00 0.00 C ATOM 730 CG GLN A 74 -8.060 -9.301 8.669 1.00 0.00 C ATOM 731 CD GLN A 74 -7.012 -9.788 9.671 1.00 0.00 C ATOM 732 OE1 GLN A 74 -6.124 -10.542 9.324 1.00 0.00 O ATOM 733 NE2 GLN A 74 -7.084 -9.388 10.911 1.00 0.00 N ATOM 0 H GLN A 74 -7.910 -8.716 4.328 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.566 -9.766 6.509 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.246 -10.558 7.105 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.686 -8.898 7.045 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.267 -8.243 8.831 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -8.997 -9.836 8.821 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.830 -8.755 11.200 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.394 -9.708 11.591 1.00 0.00 H new ATOM 742 N ALA A 75 -9.936 -7.349 7.225 1.00 0.00 N ATOM 743 CA ALA A 75 -10.324 -5.924 7.411 1.00 0.00 C ATOM 744 C ALA A 75 -9.233 -5.156 8.167 1.00 0.00 C ATOM 745 O ALA A 75 -8.680 -5.624 9.148 1.00 0.00 O ATOM 746 CB ALA A 75 -11.628 -5.867 8.204 1.00 0.00 C ATOM 0 H ALA A 75 -10.454 -8.012 7.802 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.454 -5.462 6.433 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.922 -4.827 8.346 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.410 -6.394 7.657 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.484 -6.340 9.176 1.00 0.00 H new ATOM 752 N ILE A 76 -8.939 -3.968 7.711 1.00 0.00 N ATOM 753 CA ILE A 76 -7.902 -3.124 8.372 1.00 0.00 C ATOM 754 C ILE A 76 -6.584 -3.895 8.462 1.00 0.00 C ATOM 755 O ILE A 76 -6.392 -4.730 9.328 1.00 0.00 O ATOM 756 CB ILE A 76 -8.368 -2.728 9.777 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.676 -1.939 9.669 1.00 0.00 C ATOM 758 CG2 ILE A 76 -7.301 -1.845 10.427 1.00 0.00 C ATOM 759 CD1 ILE A 76 -10.279 -1.748 11.060 1.00 0.00 C ATOM 0 H ILE A 76 -9.380 -3.541 6.897 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.749 -2.222 7.780 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.526 -3.622 10.380 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.490 -0.970 9.207 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.380 -2.469 9.027 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.625 -1.559 11.427 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.363 -2.397 10.494 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.153 -0.949 9.824 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.210 -1.186 10.979 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.481 -2.722 11.506 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.577 -1.199 11.688 1.00 0.00 H new ATOM 771 N THR A 77 -5.670 -3.610 7.568 1.00 0.00 N ATOM 772 CA THR A 77 -4.351 -4.311 7.574 1.00 0.00 C ATOM 773 C THR A 77 -3.280 -3.383 8.151 1.00 0.00 C ATOM 774 O THR A 77 -3.095 -2.265 7.703 1.00 0.00 O ATOM 775 CB THR A 77 -3.976 -4.703 6.145 1.00 0.00 C ATOM 776 OG1 THR A 77 -4.912 -5.657 5.661 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.574 -5.313 6.133 1.00 0.00 C ATOM 0 H THR A 77 -5.783 -2.916 6.829 1.00 0.00 H new ATOM 0 HA THR A 77 -4.419 -5.208 8.189 1.00 0.00 H new ATOM 0 HB THR A 77 -3.990 -3.819 5.508 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.442 -6.342 5.141 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.307 -5.592 5.114 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.857 -4.583 6.509 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.557 -6.199 6.768 1.00 0.00 H new ATOM 785 N SER A 78 -2.576 -3.849 9.149 1.00 0.00 N ATOM 786 CA SER A 78 -1.513 -3.019 9.783 1.00 0.00 C ATOM 787 C SER A 78 -0.165 -3.310 9.127 1.00 0.00 C ATOM 788 O SER A 78 0.131 -4.430 8.751 1.00 0.00 O ATOM 789 CB SER A 78 -1.437 -3.350 11.270 1.00 0.00 C ATOM 790 OG SER A 78 -0.331 -2.667 11.845 1.00 0.00 O ATOM 0 H SER A 78 -2.694 -4.777 9.554 1.00 0.00 H new ATOM 0 HA SER A 78 -1.753 -1.964 9.652 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.361 -3.055 11.768 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.328 -4.425 11.410 1.00 0.00 H new ATOM 0 HG SER A 78 -0.518 -1.705 11.872 1.00 0.00 H new ATOM 796 N ALA A 79 0.652 -2.300 8.983 1.00 0.00 N ATOM 797 CA ALA A 79 1.987 -2.485 8.345 1.00 0.00 C ATOM 798 C ALA A 79 3.081 -2.537 9.411 1.00 0.00 C ATOM 799 O ALA A 79 2.856 -2.254 10.576 1.00 0.00 O ATOM 800 CB ALA A 79 2.262 -1.306 7.411 1.00 0.00 C ATOM 0 H ALA A 79 0.449 -1.347 9.283 1.00 0.00 H new ATOM 0 HA ALA A 79 1.987 -3.421 7.786 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.237 -1.434 6.941 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.491 -1.263 6.642 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.255 -0.379 7.984 1.00 0.00 H new ATOM 806 N GLY A 80 4.271 -2.895 9.008 1.00 0.00 N ATOM 807 CA GLY A 80 5.411 -2.970 9.963 1.00 0.00 C ATOM 808 C GLY A 80 5.520 -4.382 10.533 1.00 0.00 C ATOM 809 O GLY A 80 5.537 -5.359 9.805 1.00 0.00 O ATOM 0 H GLY A 80 4.503 -3.141 8.046 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.338 -2.700 9.458 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.268 -2.252 10.771 1.00 0.00 H new ATOM 813 N ARG A 81 5.597 -4.495 11.836 1.00 0.00 N ATOM 814 CA ARG A 81 5.713 -5.836 12.479 1.00 0.00 C ATOM 815 C ARG A 81 4.366 -6.233 13.085 1.00 0.00 C ATOM 816 O ARG A 81 3.907 -5.664 14.058 1.00 0.00 O ATOM 817 CB ARG A 81 6.793 -5.791 13.570 1.00 0.00 C ATOM 818 CG ARG A 81 6.741 -4.453 14.309 1.00 0.00 C ATOM 819 CD ARG A 81 7.788 -4.455 15.427 1.00 0.00 C ATOM 820 NE ARG A 81 9.160 -4.484 14.837 1.00 0.00 N ATOM 821 CZ ARG A 81 10.216 -4.601 15.606 1.00 0.00 C ATOM 822 NH1 ARG A 81 10.089 -4.688 16.903 1.00 0.00 N ATOM 823 NH2 ARG A 81 11.405 -4.627 15.069 1.00 0.00 N ATOM 0 H ARG A 81 5.584 -3.708 12.485 1.00 0.00 H new ATOM 0 HA ARG A 81 5.996 -6.577 11.731 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.644 -6.610 14.274 1.00 0.00 H new ATOM 0 HB3 ARG A 81 7.778 -5.930 13.123 1.00 0.00 H new ATOM 0 HG2 ARG A 81 6.933 -3.634 13.616 1.00 0.00 H new ATOM 0 HG3 ARG A 81 5.747 -4.292 14.726 1.00 0.00 H new ATOM 0 HD2 ARG A 81 7.669 -3.569 16.050 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.642 -5.321 16.073 1.00 0.00 H new ATOM 0 HE ARG A 81 9.277 -4.412 13.826 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.162 -4.665 17.327 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.917 -4.779 17.492 1.00 0.00 H new ATOM 0 HH21 ARG A 81 11.509 -4.557 14.057 1.00 0.00 H new ATOM 0 HH22 ARG A 81 12.230 -4.718 15.661 1.00 0.00 H new ATOM 837 N HIS A 82 3.736 -7.219 12.504 1.00 0.00 N ATOM 838 CA HIS A 82 2.422 -7.688 13.015 1.00 0.00 C ATOM 839 C HIS A 82 2.156 -9.091 12.454 1.00 0.00 C ATOM 840 O HIS A 82 1.588 -9.237 11.391 1.00 0.00 O ATOM 841 CB HIS A 82 1.312 -6.737 12.552 1.00 0.00 C ATOM 842 CG HIS A 82 1.362 -5.477 13.372 1.00 0.00 C ATOM 843 ND1 HIS A 82 0.805 -5.397 14.639 1.00 0.00 N ATOM 844 CD2 HIS A 82 1.904 -4.242 13.122 1.00 0.00 C ATOM 845 CE1 HIS A 82 1.022 -4.152 15.099 1.00 0.00 C ATOM 846 NE2 HIS A 82 1.688 -3.406 14.213 1.00 0.00 N ATOM 0 H HIS A 82 4.083 -7.723 11.688 1.00 0.00 H new ATOM 0 HA HIS A 82 2.436 -7.711 14.105 1.00 0.00 H new ATOM 0 HB2 HIS A 82 1.437 -6.502 11.495 1.00 0.00 H new ATOM 0 HB3 HIS A 82 0.339 -7.216 12.659 1.00 0.00 H new ATOM 0 HD2 HIS A 82 2.420 -3.961 12.216 1.00 0.00 H new ATOM 0 HE1 HIS A 82 0.698 -3.798 16.067 1.00 0.00 H new ATOM 0 HE2 HIS A 82 1.976 -2.433 14.315 1.00 0.00 H new ATOM 854 N PRO A 83 2.568 -10.115 13.162 1.00 0.00 N ATOM 855 CA PRO A 83 2.373 -11.528 12.724 1.00 0.00 C ATOM 856 C PRO A 83 0.920 -11.833 12.362 1.00 0.00 C ATOM 857 O PRO A 83 -0.003 -11.299 12.948 1.00 0.00 O ATOM 858 CB PRO A 83 2.818 -12.350 13.944 1.00 0.00 C ATOM 859 CG PRO A 83 3.778 -11.466 14.666 1.00 0.00 C ATOM 860 CD PRO A 83 3.275 -10.040 14.450 1.00 0.00 C ATOM 0 HA PRO A 83 2.937 -11.754 11.819 1.00 0.00 H new ATOM 0 HB2 PRO A 83 1.969 -12.612 14.576 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.291 -13.284 13.641 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.813 -11.712 15.727 1.00 0.00 H new ATOM 0 HG3 PRO A 83 4.789 -11.587 14.277 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.611 -9.723 15.254 1.00 0.00 H new ATOM 0 HD3 PRO A 83 4.097 -9.326 14.415 1.00 0.00 H new ATOM 868 N ASP A 84 0.730 -12.686 11.385 1.00 0.00 N ATOM 869 CA ASP A 84 -0.646 -13.058 10.934 1.00 0.00 C ATOM 870 C ASP A 84 -1.174 -11.974 9.985 1.00 0.00 C ATOM 871 O ASP A 84 -2.062 -12.207 9.187 1.00 0.00 O ATOM 872 CB ASP A 84 -1.587 -13.199 12.151 1.00 0.00 C ATOM 873 CG ASP A 84 -2.712 -14.189 11.836 1.00 0.00 C ATOM 874 OD1 ASP A 84 -2.417 -15.229 11.269 1.00 0.00 O ATOM 875 OD2 ASP A 84 -3.846 -13.894 12.172 1.00 0.00 O ATOM 0 H ASP A 84 1.483 -13.147 10.874 1.00 0.00 H new ATOM 0 HA ASP A 84 -0.610 -14.015 10.413 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.023 -13.542 13.018 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -2.009 -12.227 12.409 1.00 0.00 H new ATOM 880 N SER A 85 -0.630 -10.788 10.074 1.00 0.00 N ATOM 881 CA SER A 85 -1.092 -9.674 9.194 1.00 0.00 C ATOM 882 C SER A 85 -0.631 -9.892 7.749 1.00 0.00 C ATOM 883 O SER A 85 0.427 -10.438 7.488 1.00 0.00 O ATOM 884 CB SER A 85 -0.534 -8.347 9.715 1.00 0.00 C ATOM 885 OG SER A 85 -1.218 -7.272 9.083 1.00 0.00 O ATOM 0 H SER A 85 0.118 -10.542 10.722 1.00 0.00 H new ATOM 0 HA SER A 85 -2.182 -9.650 9.209 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.657 -8.286 10.796 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.535 -8.283 9.512 1.00 0.00 H new ATOM 0 HG SER A 85 -0.650 -6.474 9.090 1.00 0.00 H new ATOM 891 N ASP A 86 -1.431 -9.458 6.807 1.00 0.00 N ATOM 892 CA ASP A 86 -1.072 -9.615 5.368 1.00 0.00 C ATOM 893 C ASP A 86 0.204 -8.834 5.064 1.00 0.00 C ATOM 894 O ASP A 86 1.080 -9.303 4.362 1.00 0.00 O ATOM 895 CB ASP A 86 -2.210 -9.068 4.504 1.00 0.00 C ATOM 896 CG ASP A 86 -3.416 -10.003 4.583 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.212 -11.184 4.803 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.527 -9.522 4.419 1.00 0.00 O ATOM 0 H ASP A 86 -2.325 -8.998 6.977 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.911 -10.671 5.150 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.489 -8.070 4.843 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.880 -8.972 3.470 1.00 0.00 H new ATOM 903 N ILE A 87 0.313 -7.633 5.581 1.00 0.00 N ATOM 904 CA ILE A 87 1.531 -6.805 5.321 1.00 0.00 C ATOM 905 C ILE A 87 2.399 -6.767 6.573 1.00 0.00 C ATOM 906 O ILE A 87 2.023 -6.224 7.597 1.00 0.00 O ATOM 907 CB ILE A 87 1.109 -5.383 4.934 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.196 -5.433 3.688 1.00 0.00 C ATOM 909 CG2 ILE A 87 2.356 -4.535 4.638 1.00 0.00 C ATOM 910 CD1 ILE A 87 1.038 -5.516 2.404 1.00 0.00 C ATOM 0 H ILE A 87 -0.391 -7.191 6.172 1.00 0.00 H new ATOM 0 HA ILE A 87 2.103 -7.244 4.504 1.00 0.00 H new ATOM 0 HB ILE A 87 0.560 -4.931 5.760 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.467 -6.296 3.751 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.437 -4.546 3.658 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.052 -3.525 4.363 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.988 -4.495 5.525 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.914 -4.983 3.815 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.378 -5.550 1.537 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.683 -4.640 2.334 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.651 -6.417 2.429 1.00 0.00 H new ATOM 922 N PHE A 88 3.568 -7.349 6.487 1.00 0.00 N ATOM 923 CA PHE A 88 4.500 -7.377 7.650 1.00 0.00 C ATOM 924 C PHE A 88 5.881 -6.903 7.205 1.00 0.00 C ATOM 925 O PHE A 88 6.669 -7.656 6.658 1.00 0.00 O ATOM 926 CB PHE A 88 4.584 -8.803 8.202 1.00 0.00 C ATOM 927 CG PHE A 88 5.011 -9.760 7.111 1.00 0.00 C ATOM 928 CD1 PHE A 88 4.089 -10.174 6.141 1.00 0.00 C ATOM 929 CD2 PHE A 88 6.327 -10.241 7.073 1.00 0.00 C ATOM 930 CE1 PHE A 88 4.482 -11.065 5.134 1.00 0.00 C ATOM 931 CE2 PHE A 88 6.718 -11.134 6.067 1.00 0.00 C ATOM 932 CZ PHE A 88 5.795 -11.547 5.098 1.00 0.00 C ATOM 0 H PHE A 88 3.919 -7.811 5.648 1.00 0.00 H new ATOM 0 HA PHE A 88 4.132 -6.714 8.433 1.00 0.00 H new ATOM 0 HB2 PHE A 88 5.295 -8.840 9.027 1.00 0.00 H new ATOM 0 HB3 PHE A 88 3.616 -9.104 8.602 1.00 0.00 H new ATOM 0 HD1 PHE A 88 3.074 -9.806 6.170 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.040 -9.923 7.820 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.771 -11.380 4.385 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.732 -11.504 6.039 1.00 0.00 H new ATOM 0 HZ PHE A 88 6.096 -12.237 4.324 1.00 0.00 H new ATOM 942 N LEU A 89 6.180 -5.649 7.441 1.00 0.00 N ATOM 943 CA LEU A 89 7.508 -5.093 7.047 1.00 0.00 C ATOM 944 C LEU A 89 8.393 -5.003 8.287 1.00 0.00 C ATOM 945 O LEU A 89 8.328 -4.059 9.054 1.00 0.00 O ATOM 946 CB LEU A 89 7.319 -3.700 6.439 1.00 0.00 C ATOM 947 CG LEU A 89 6.470 -3.811 5.164 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.168 -2.406 4.631 1.00 0.00 C ATOM 949 CD2 LEU A 89 7.225 -4.622 4.090 1.00 0.00 C ATOM 0 H LEU A 89 5.554 -4.983 7.894 1.00 0.00 H new ATOM 0 HA LEU A 89 7.979 -5.741 6.308 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.832 -3.041 7.157 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.288 -3.258 6.207 1.00 0.00 H new ATOM 0 HG LEU A 89 5.537 -4.323 5.400 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.565 -2.482 3.726 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.620 -1.841 5.385 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.103 -1.895 4.402 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.613 -4.694 3.191 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.164 -4.123 3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.432 -5.623 4.469 1.00 0.00 H new ATOM 961 N ASP A 90 9.223 -5.992 8.483 1.00 0.00 N ATOM 962 CA ASP A 90 10.124 -6.000 9.666 1.00 0.00 C ATOM 963 C ASP A 90 11.396 -5.209 9.353 1.00 0.00 C ATOM 964 O ASP A 90 12.372 -5.743 8.857 1.00 0.00 O ATOM 965 CB ASP A 90 10.477 -7.449 10.022 1.00 0.00 C ATOM 966 CG ASP A 90 11.005 -8.181 8.784 1.00 0.00 C ATOM 967 OD1 ASP A 90 11.224 -7.527 7.778 1.00 0.00 O ATOM 968 OD2 ASP A 90 11.180 -9.388 8.864 1.00 0.00 O ATOM 0 H ASP A 90 9.314 -6.800 7.868 1.00 0.00 H new ATOM 0 HA ASP A 90 9.621 -5.534 10.513 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.228 -7.465 10.812 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.596 -7.962 10.409 1.00 0.00 H new ATOM 973 N ASP A 91 11.386 -3.929 9.637 1.00 0.00 N ATOM 974 CA ASP A 91 12.585 -3.081 9.368 1.00 0.00 C ATOM 975 C ASP A 91 12.695 -1.997 10.443 1.00 0.00 C ATOM 976 O ASP A 91 11.707 -1.544 10.992 1.00 0.00 O ATOM 977 CB ASP A 91 12.466 -2.418 7.991 1.00 0.00 C ATOM 978 CG ASP A 91 12.600 -3.478 6.895 1.00 0.00 C ATOM 979 OD1 ASP A 91 13.572 -4.212 6.925 1.00 0.00 O ATOM 980 OD2 ASP A 91 11.730 -3.531 6.041 1.00 0.00 O ATOM 0 H ASP A 91 10.593 -3.434 10.046 1.00 0.00 H new ATOM 0 HA ASP A 91 13.474 -3.711 9.385 1.00 0.00 H new ATOM 0 HB2 ASP A 91 11.506 -1.910 7.903 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.240 -1.660 7.874 1.00 0.00 H new ATOM 985 N VAL A 92 13.898 -1.582 10.737 1.00 0.00 N ATOM 986 CA VAL A 92 14.113 -0.524 11.768 1.00 0.00 C ATOM 987 C VAL A 92 13.498 0.797 11.296 1.00 0.00 C ATOM 988 O VAL A 92 13.025 1.598 12.084 1.00 0.00 O ATOM 989 CB VAL A 92 15.618 -0.342 11.987 1.00 0.00 C ATOM 990 CG1 VAL A 92 16.276 0.133 10.686 1.00 0.00 C ATOM 991 CG2 VAL A 92 15.850 0.699 13.081 1.00 0.00 C ATOM 0 H VAL A 92 14.751 -1.935 10.302 1.00 0.00 H new ATOM 0 HA VAL A 92 13.636 -0.821 12.702 1.00 0.00 H new ATOM 0 HB VAL A 92 16.056 -1.294 12.287 1.00 0.00 H new ATOM 0 HG11 VAL A 92 17.347 0.261 10.846 1.00 0.00 H new ATOM 0 HG12 VAL A 92 16.112 -0.608 9.904 1.00 0.00 H new ATOM 0 HG13 VAL A 92 15.838 1.084 10.383 1.00 0.00 H new ATOM 0 HG21 VAL A 92 16.921 0.829 13.238 1.00 0.00 H new ATOM 0 HG22 VAL A 92 15.409 1.649 12.779 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.386 0.362 14.008 1.00 0.00 H new ATOM 1001 N THR A 93 13.505 1.028 10.012 1.00 0.00 N ATOM 1002 CA THR A 93 12.926 2.289 9.469 1.00 0.00 C ATOM 1003 C THR A 93 11.413 2.307 9.702 1.00 0.00 C ATOM 1004 O THR A 93 10.811 3.349 9.892 1.00 0.00 O ATOM 1005 CB THR A 93 13.203 2.362 7.966 1.00 0.00 C ATOM 1006 OG1 THR A 93 12.699 1.190 7.339 1.00 0.00 O ATOM 1007 CG2 THR A 93 14.709 2.463 7.724 1.00 0.00 C ATOM 0 H THR A 93 13.889 0.394 9.312 1.00 0.00 H new ATOM 0 HA THR A 93 13.380 3.142 9.974 1.00 0.00 H new ATOM 0 HB THR A 93 12.713 3.241 7.548 1.00 0.00 H new ATOM 0 HG1 THR A 93 12.873 1.234 6.376 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.903 2.515 6.653 1.00 0.00 H new ATOM 0 HG22 THR A 93 15.096 3.361 8.206 1.00 0.00 H new ATOM 0 HG23 THR A 93 15.204 1.586 8.140 1.00 0.00 H new ATOM 1015 N VAL A 94 10.789 1.156 9.674 1.00 0.00 N ATOM 1016 CA VAL A 94 9.311 1.096 9.881 1.00 0.00 C ATOM 1017 C VAL A 94 9.001 0.847 11.360 1.00 0.00 C ATOM 1018 O VAL A 94 9.519 -0.064 11.979 1.00 0.00 O ATOM 1019 CB VAL A 94 8.723 -0.030 9.026 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.196 0.042 9.065 1.00 0.00 C ATOM 1021 CG2 VAL A 94 9.199 0.130 7.578 1.00 0.00 C ATOM 0 H VAL A 94 11.240 0.255 9.517 1.00 0.00 H new ATOM 0 HA VAL A 94 8.865 2.045 9.584 1.00 0.00 H new ATOM 0 HB VAL A 94 9.053 -0.992 9.418 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.778 -0.760 8.456 1.00 0.00 H new ATOM 0 HG12 VAL A 94 6.853 -0.067 10.094 1.00 0.00 H new ATOM 0 HG13 VAL A 94 6.867 1.004 8.673 1.00 0.00 H new ATOM 0 HG21 VAL A 94 8.782 -0.671 6.967 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.867 1.093 7.190 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.287 0.081 7.545 1.00 0.00 H new ATOM 1031 N SER A 95 8.154 1.668 11.925 1.00 0.00 N ATOM 1032 CA SER A 95 7.791 1.530 13.364 1.00 0.00 C ATOM 1033 C SER A 95 6.777 0.397 13.558 1.00 0.00 C ATOM 1034 O SER A 95 6.485 -0.361 12.652 1.00 0.00 O ATOM 1035 CB SER A 95 7.177 2.844 13.849 1.00 0.00 C ATOM 1036 OG SER A 95 6.626 2.658 15.147 1.00 0.00 O ATOM 0 H SER A 95 7.693 2.439 11.442 1.00 0.00 H new ATOM 0 HA SER A 95 8.689 1.297 13.936 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.936 3.626 13.873 1.00 0.00 H new ATOM 0 HB3 SER A 95 6.402 3.173 13.157 1.00 0.00 H new ATOM 0 HG SER A 95 6.234 3.500 15.460 1.00 0.00 H new ATOM 1042 N ARG A 96 6.235 0.286 14.745 1.00 0.00 N ATOM 1043 CA ARG A 96 5.234 -0.784 15.016 1.00 0.00 C ATOM 1044 C ARG A 96 4.022 -0.576 14.105 1.00 0.00 C ATOM 1045 O ARG A 96 3.474 -1.512 13.552 1.00 0.00 O ATOM 1046 CB ARG A 96 4.788 -0.703 16.482 1.00 0.00 C ATOM 1047 CG ARG A 96 5.929 -1.161 17.397 1.00 0.00 C ATOM 1048 CD ARG A 96 5.489 -1.063 18.863 1.00 0.00 C ATOM 1049 NE ARG A 96 6.603 -1.513 19.748 1.00 0.00 N ATOM 1050 CZ ARG A 96 6.381 -1.801 21.006 1.00 0.00 C ATOM 1051 NH1 ARG A 96 5.179 -1.708 21.506 1.00 0.00 N ATOM 1052 NH2 ARG A 96 7.370 -2.189 21.766 1.00 0.00 N ATOM 0 H ARG A 96 6.445 0.893 15.538 1.00 0.00 H new ATOM 0 HA ARG A 96 5.677 -1.761 14.824 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.500 0.319 16.728 1.00 0.00 H new ATOM 0 HB3 ARG A 96 3.909 -1.329 16.640 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.209 -2.187 17.159 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.812 -0.543 17.230 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.212 -0.036 19.103 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.606 -1.679 19.031 1.00 0.00 H new ATOM 0 HE ARG A 96 7.546 -1.597 19.369 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.403 -1.409 20.916 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.016 -1.934 22.487 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.311 -2.267 21.379 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.202 -2.414 22.746 1.00 0.00 H new ATOM 1066 N ARG A 97 3.603 0.650 13.945 1.00 0.00 N ATOM 1067 CA ARG A 97 2.432 0.947 13.070 1.00 0.00 C ATOM 1068 C ARG A 97 2.695 2.257 12.320 1.00 0.00 C ATOM 1069 O ARG A 97 1.981 3.231 12.473 1.00 0.00 O ATOM 1070 CB ARG A 97 1.163 1.077 13.923 1.00 0.00 C ATOM 1071 CG ARG A 97 0.759 -0.305 14.451 1.00 0.00 C ATOM 1072 CD ARG A 97 -0.461 -0.174 15.371 1.00 0.00 C ATOM 1073 NE ARG A 97 -1.620 0.347 14.589 1.00 0.00 N ATOM 1074 CZ ARG A 97 -2.749 0.635 15.183 1.00 0.00 C ATOM 1075 NH1 ARG A 97 -2.891 0.443 16.467 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -3.745 1.112 14.487 1.00 0.00 N ATOM 0 H ARG A 97 4.026 1.466 14.387 1.00 0.00 H new ATOM 0 HA ARG A 97 2.290 0.136 12.355 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.339 1.759 14.755 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.354 1.502 13.329 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.528 -0.969 13.618 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.590 -0.753 14.996 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -0.708 -1.143 15.806 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.235 0.498 16.199 1.00 0.00 H new ATOM 0 HE ARG A 97 -1.531 0.480 13.582 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -2.118 0.066 17.015 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -3.775 0.670 16.922 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -3.641 1.259 13.483 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -4.627 1.338 14.947 1.00 0.00 H new ATOM 1090 N HIS A 98 3.718 2.280 11.503 1.00 0.00 N ATOM 1091 CA HIS A 98 4.039 3.515 10.732 1.00 0.00 C ATOM 1092 C HIS A 98 2.872 3.841 9.803 1.00 0.00 C ATOM 1093 O HIS A 98 2.496 4.987 9.633 1.00 0.00 O ATOM 1094 CB HIS A 98 5.301 3.283 9.896 1.00 0.00 C ATOM 1095 CG HIS A 98 5.699 4.569 9.223 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.171 4.964 8.004 1.00 0.00 N ATOM 1097 CD2 HIS A 98 6.576 5.560 9.590 1.00 0.00 C ATOM 1098 CE1 HIS A 98 5.729 6.146 7.684 1.00 0.00 C ATOM 1099 NE2 HIS A 98 6.593 6.555 8.617 1.00 0.00 N ATOM 0 H HIS A 98 4.345 1.493 11.338 1.00 0.00 H new ATOM 0 HA HIS A 98 4.207 4.343 11.421 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.111 2.927 10.532 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.119 2.510 9.149 1.00 0.00 H new ATOM 0 HD2 HIS A 98 7.163 5.566 10.496 1.00 0.00 H new ATOM 0 HE1 HIS A 98 5.505 6.697 6.782 1.00 0.00 H new ATOM 0 HE2 HIS A 98 7.146 7.412 8.616 1.00 0.00 H new ATOM 1107 N ALA A 99 2.299 2.838 9.190 1.00 0.00 N ATOM 1108 CA ALA A 99 1.156 3.079 8.258 1.00 0.00 C ATOM 1109 C ALA A 99 0.105 1.986 8.436 1.00 0.00 C ATOM 1110 O ALA A 99 0.407 0.862 8.803 1.00 0.00 O ATOM 1111 CB ALA A 99 1.659 3.066 6.815 1.00 0.00 C ATOM 0 H ALA A 99 2.573 1.861 9.294 1.00 0.00 H new ATOM 0 HA ALA A 99 0.712 4.049 8.481 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.824 3.242 6.137 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.405 3.850 6.683 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.107 2.097 6.595 1.00 0.00 H new ATOM 1117 N GLU A 100 -1.136 2.313 8.180 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.227 1.311 8.329 1.00 0.00 C ATOM 1119 C GLU A 100 -3.236 1.480 7.196 1.00 0.00 C ATOM 1120 O GLU A 100 -3.627 2.581 6.846 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.929 1.521 9.671 1.00 0.00 C ATOM 1122 CG GLU A 100 -4.011 0.453 9.851 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.653 0.594 11.231 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.427 1.610 11.868 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.359 -0.318 11.628 1.00 0.00 O ATOM 0 H GLU A 100 -1.439 3.237 7.873 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.805 0.307 8.290 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.206 1.463 10.485 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.374 2.515 9.710 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.769 0.556 9.075 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.576 -0.540 9.742 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.667 0.384 6.627 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.658 0.438 5.517 1.00 0.00 C ATOM 1134 C PHE A 101 -6.048 0.149 6.067 1.00 0.00 C ATOM 1135 O PHE A 101 -6.215 -0.617 7.001 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.306 -0.612 4.465 1.00 0.00 C ATOM 1137 CG PHE A 101 -2.938 -0.314 3.904 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.788 0.668 2.919 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.821 -1.020 4.367 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.522 0.946 2.396 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.553 -0.741 3.843 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.403 0.242 2.857 1.00 0.00 C ATOM 0 H PHE A 101 -3.369 -0.556 6.889 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.640 1.429 5.064 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.321 -1.608 4.909 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.048 -0.607 3.667 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.651 1.211 2.563 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.937 -1.778 5.127 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.407 1.704 1.636 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.310 -1.284 4.199 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.575 0.457 2.452 1.00 0.00 H new ATOM 1152 N ARG A 102 -7.048 0.765 5.494 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.445 0.549 5.962 1.00 0.00 C ATOM 1154 C ARG A 102 -9.337 0.247 4.765 1.00 0.00 C ATOM 1155 O ARG A 102 -9.313 0.940 3.762 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.947 1.808 6.669 1.00 0.00 C ATOM 1157 CG ARG A 102 -10.357 1.556 7.211 1.00 0.00 C ATOM 1158 CD ARG A 102 -10.848 2.784 7.977 1.00 0.00 C ATOM 1159 NE ARG A 102 -9.986 3.007 9.174 1.00 0.00 N ATOM 1160 CZ ARG A 102 -10.210 2.358 10.288 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -11.191 1.501 10.374 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -9.441 2.567 11.321 1.00 0.00 N ATOM 0 H ARG A 102 -6.953 1.415 4.714 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.471 -0.290 6.657 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.274 2.074 7.484 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -8.956 2.649 5.976 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.037 1.334 6.389 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.354 0.685 7.867 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -10.824 3.661 7.331 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.884 2.643 8.284 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.214 3.672 9.124 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.792 1.332 9.568 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -11.356 1.001 11.247 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.671 3.233 11.257 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.610 2.065 12.192 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.131 -0.786 4.871 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.048 -1.160 3.759 1.00 0.00 C ATOM 1178 C LEU A 103 -12.462 -0.706 4.116 1.00 0.00 C ATOM 1179 O LEU A 103 -13.003 -1.056 5.151 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.012 -2.677 3.558 1.00 0.00 C ATOM 1181 CG LEU A 103 -11.878 -3.075 2.353 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -11.299 -2.484 1.056 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -11.918 -4.604 2.246 1.00 0.00 C ATOM 0 H LEU A 103 -10.182 -1.392 5.690 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.736 -0.677 2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.985 -3.006 3.401 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.373 -3.178 4.456 1.00 0.00 H new ATOM 0 HG LEU A 103 -12.886 -2.685 2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.925 -2.776 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.274 -1.397 1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.287 -2.860 0.905 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -12.531 -4.893 1.392 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -10.906 -4.986 2.112 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.345 -5.021 3.158 1.00 0.00 H new ATOM 1195 N GLU A 104 -13.056 0.091 3.268 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.427 0.609 3.543 1.00 0.00 C ATOM 1197 C GLU A 104 -15.470 -0.310 2.895 1.00 0.00 C ATOM 1198 O GLU A 104 -15.424 -1.519 3.033 1.00 0.00 O ATOM 1199 CB GLU A 104 -14.545 2.025 2.962 1.00 0.00 C ATOM 1200 CG GLU A 104 -15.689 2.778 3.649 1.00 0.00 C ATOM 1201 CD GLU A 104 -15.768 4.204 3.104 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -15.117 4.474 2.108 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -16.478 5.001 3.693 1.00 0.00 O ATOM 0 H GLU A 104 -12.646 0.408 2.389 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.604 0.635 4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.608 2.564 3.102 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -14.726 1.973 1.888 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -16.633 2.260 3.478 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.528 2.799 4.727 1.00 0.00 H new ATOM 1210 N ASN A 105 -16.415 0.259 2.190 1.00 0.00 N ATOM 1211 CA ASN A 105 -17.463 -0.571 1.534 1.00 0.00 C ATOM 1212 C ASN A 105 -16.820 -1.465 0.472 1.00 0.00 C ATOM 1213 O ASN A 105 -17.116 -2.640 0.373 1.00 0.00 O ATOM 1214 CB ASN A 105 -18.494 0.352 0.874 1.00 0.00 C ATOM 1215 CG ASN A 105 -19.414 0.944 1.946 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -19.466 0.454 3.057 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -20.148 1.987 1.659 1.00 0.00 N ATOM 0 H ASN A 105 -16.504 1.264 2.042 1.00 0.00 H new ATOM 0 HA ASN A 105 -17.955 -1.197 2.279 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -17.988 1.151 0.333 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -19.081 -0.205 0.144 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -20.763 2.388 2.367 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -20.106 2.400 0.727 1.00 0.00 H new ATOM 1224 N ASN A 106 -15.936 -0.911 -0.314 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.258 -1.706 -1.375 1.00 0.00 C ATOM 1226 C ASN A 106 -14.109 -0.875 -1.956 1.00 0.00 C ATOM 1227 O ASN A 106 -13.687 -1.083 -3.080 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.267 -2.062 -2.486 1.00 0.00 C ATOM 1229 CG ASN A 106 -17.038 -3.331 -2.106 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -18.238 -3.410 -2.298 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -16.395 -4.331 -1.567 1.00 0.00 N ATOM 0 H ASN A 106 -15.653 0.068 -0.265 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.865 -2.630 -0.952 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.962 -1.236 -2.636 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.743 -2.214 -3.430 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.898 -5.179 -1.306 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.390 -4.264 -1.407 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.605 0.067 -1.192 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.482 0.930 -1.676 1.00 0.00 C ATOM 1240 C GLU A 107 -11.338 0.894 -0.664 1.00 0.00 C ATOM 1241 O GLU A 107 -11.533 1.055 0.526 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.969 2.371 -1.850 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.929 2.438 -3.039 1.00 0.00 C ATOM 1244 CD GLU A 107 -14.472 3.861 -3.184 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -14.075 4.708 -2.402 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -15.274 4.079 -4.077 1.00 0.00 O ATOM 0 H GLU A 107 -13.927 0.275 -0.247 1.00 0.00 H new ATOM 0 HA GLU A 107 -12.130 0.554 -2.637 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -13.470 2.710 -0.943 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -12.121 3.037 -2.014 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -13.414 2.140 -3.952 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -14.752 1.738 -2.895 1.00 0.00 H new ATOM 1253 N PHE A 108 -10.145 0.675 -1.143 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.965 0.609 -0.240 1.00 0.00 C ATOM 1255 C PHE A 108 -8.523 2.022 0.140 1.00 0.00 C ATOM 1256 O PHE A 108 -8.632 2.954 -0.638 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.825 -0.106 -0.965 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.307 -1.450 -1.452 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.205 -2.573 -0.626 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.857 -1.570 -2.734 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.650 -3.820 -1.082 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -9.301 -2.816 -3.191 1.00 0.00 C ATOM 1263 CZ PHE A 108 -9.199 -3.940 -2.365 1.00 0.00 C ATOM 0 H PHE A 108 -9.937 0.538 -2.132 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.228 0.064 0.666 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.480 0.496 -1.806 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.975 -0.233 -0.294 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.783 -2.479 0.364 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.939 -0.701 -3.370 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.570 -4.688 -0.445 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.722 -2.910 -4.181 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.544 -4.901 -2.717 1.00 0.00 H new ATOM 1273 N ASN A 109 -8.025 2.191 1.338 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.574 3.542 1.783 1.00 0.00 C ATOM 1275 C ASN A 109 -6.348 3.403 2.679 1.00 0.00 C ATOM 1276 O ASN A 109 -6.089 2.353 3.242 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.692 4.221 2.571 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.860 4.523 1.634 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.664 4.802 0.468 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -11.079 4.477 2.098 1.00 0.00 N ATOM 0 H ASN A 109 -7.911 1.449 2.028 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.324 4.142 0.908 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -9.022 3.576 3.385 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.326 5.143 3.023 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.867 4.675 1.482 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -11.244 4.243 3.077 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.591 4.464 2.813 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.369 4.435 3.668 1.00 0.00 C ATOM 1289 C VAL A 110 -4.425 5.587 4.670 1.00 0.00 C ATOM 1290 O VAL A 110 -4.699 6.723 4.320 1.00 0.00 O ATOM 1291 CB VAL A 110 -3.123 4.569 2.785 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -3.273 5.766 1.840 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.888 4.765 3.667 1.00 0.00 C ATOM 0 H VAL A 110 -5.772 5.359 2.359 1.00 0.00 H new ATOM 0 HA VAL A 110 -4.322 3.490 4.209 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.009 3.661 2.193 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.382 5.852 1.217 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -4.147 5.621 1.205 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.396 6.678 2.424 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.003 4.860 3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -2.007 5.669 4.264 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.773 3.906 4.328 1.00 0.00 H new ATOM 1303 N VAL A 111 -4.166 5.291 5.925 1.00 0.00 N ATOM 1304 CA VAL A 111 -4.197 6.343 6.985 1.00 0.00 C ATOM 1305 C VAL A 111 -2.878 6.320 7.764 1.00 0.00 C ATOM 1306 O VAL A 111 -2.393 5.278 8.169 1.00 0.00 O ATOM 1307 CB VAL A 111 -5.360 6.069 7.944 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -5.246 6.980 9.170 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.681 6.348 7.224 1.00 0.00 C ATOM 0 H VAL A 111 -3.933 4.356 6.259 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.331 7.321 6.522 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.328 5.028 8.266 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -6.075 6.782 9.849 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -4.303 6.785 9.682 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -5.278 8.022 8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.513 6.155 7.902 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.708 7.390 6.904 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.765 5.699 6.353 1.00 0.00 H new ATOM 1319 N ASP A 112 -2.303 7.475 7.978 1.00 0.00 N ATOM 1320 CA ASP A 112 -1.020 7.563 8.733 1.00 0.00 C ATOM 1321 C ASP A 112 -1.319 7.893 10.198 1.00 0.00 C ATOM 1322 O ASP A 112 -1.815 8.958 10.524 1.00 0.00 O ATOM 1323 CB ASP A 112 -0.150 8.657 8.113 1.00 0.00 C ATOM 1324 CG ASP A 112 1.276 8.551 8.653 1.00 0.00 C ATOM 1325 OD1 ASP A 112 1.878 7.508 8.478 1.00 0.00 O ATOM 1326 OD2 ASP A 112 1.743 9.520 9.229 1.00 0.00 O ATOM 0 H ASP A 112 -2.673 8.370 7.658 1.00 0.00 H new ATOM 0 HA ASP A 112 -0.489 6.612 8.684 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.146 8.560 7.027 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.564 9.638 8.344 1.00 0.00 H new ATOM 1331 N VAL A 113 -1.027 6.974 11.080 1.00 0.00 N ATOM 1332 CA VAL A 113 -1.298 7.200 12.526 1.00 0.00 C ATOM 1333 C VAL A 113 -0.228 8.111 13.133 1.00 0.00 C ATOM 1334 O VAL A 113 0.960 7.894 12.976 1.00 0.00 O ATOM 1335 CB VAL A 113 -1.303 5.854 13.262 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -2.432 4.980 12.716 1.00 0.00 C ATOM 1337 CG2 VAL A 113 0.035 5.135 13.050 1.00 0.00 C ATOM 0 H VAL A 113 -0.609 6.071 10.857 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.270 7.681 12.631 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.453 6.032 14.327 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.437 4.023 13.238 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.387 5.482 12.870 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.278 4.811 11.650 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.022 4.180 13.576 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.190 4.961 11.985 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.845 5.752 13.438 1.00 0.00 H new ATOM 1405 N THR A 119 3.658 8.329 6.212 1.00 0.00 N ATOM 1406 CA THR A 119 3.272 7.885 4.840 1.00 0.00 C ATOM 1407 C THR A 119 2.911 9.090 3.971 1.00 0.00 C ATOM 1408 O THR A 119 2.241 10.011 4.402 1.00 0.00 O ATOM 1409 CB THR A 119 2.070 6.945 4.931 1.00 0.00 C ATOM 1410 OG1 THR A 119 2.349 5.923 5.880 1.00 0.00 O ATOM 1411 CG2 THR A 119 1.808 6.314 3.562 1.00 0.00 C ATOM 0 HA THR A 119 4.116 7.365 4.387 1.00 0.00 H new ATOM 0 HB THR A 119 1.189 7.506 5.243 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.304 6.296 6.785 1.00 0.00 H new ATOM 0 HG21 THR A 119 0.951 5.644 3.628 1.00 0.00 H new ATOM 0 HG22 THR A 119 1.600 7.098 2.834 1.00 0.00 H new ATOM 0 HG23 THR A 119 2.686 5.750 3.247 1.00 0.00 H new ATOM 1419 N TYR A 120 3.361 9.085 2.741 1.00 0.00 N ATOM 1420 CA TYR A 120 3.066 10.219 1.820 1.00 0.00 C ATOM 1421 C TYR A 120 2.705 9.672 0.441 1.00 0.00 C ATOM 1422 O TYR A 120 3.054 8.557 0.091 1.00 0.00 O ATOM 1423 CB TYR A 120 4.297 11.118 1.705 1.00 0.00 C ATOM 1424 CG TYR A 120 5.478 10.325 1.190 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.692 10.196 -0.189 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.366 9.728 2.094 1.00 0.00 C ATOM 1427 CE1 TYR A 120 6.794 9.473 -0.662 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.467 9.003 1.621 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.680 8.875 0.243 1.00 0.00 C ATOM 1430 OH TYR A 120 8.767 8.164 -0.223 1.00 0.00 O ATOM 0 H TYR A 120 3.924 8.337 2.335 1.00 0.00 H new ATOM 0 HA TYR A 120 2.230 10.798 2.213 1.00 0.00 H new ATOM 0 HB2 TYR A 120 4.087 11.950 1.032 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.535 11.547 2.678 1.00 0.00 H new ATOM 0 HD1 TYR A 120 5.007 10.654 -0.887 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.201 9.827 3.157 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.961 9.377 -1.725 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.151 8.543 2.319 1.00 0.00 H new ATOM 0 HH TYR A 120 8.718 8.094 -1.199 1.00 0.00 H new ATOM 1440 N VAL A 121 2.000 10.455 -0.342 1.00 0.00 N ATOM 1441 CA VAL A 121 1.590 10.007 -1.708 1.00 0.00 C ATOM 1442 C VAL A 121 2.209 10.923 -2.766 1.00 0.00 C ATOM 1443 O VAL A 121 2.125 12.137 -2.692 1.00 0.00 O ATOM 1444 CB VAL A 121 0.061 10.037 -1.812 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.455 11.478 -1.742 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.364 9.408 -3.136 1.00 0.00 C ATOM 0 H VAL A 121 1.690 11.393 -0.089 1.00 0.00 H new ATOM 0 HA VAL A 121 1.943 8.990 -1.879 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.361 9.475 -0.979 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.542 11.479 -1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.157 11.926 -0.794 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.034 12.056 -2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.451 9.427 -3.215 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.070 9.971 -3.962 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.015 8.376 -3.177 1.00 0.00 H new ATOM 1456 N ASN A 122 2.842 10.331 -3.748 1.00 0.00 N ATOM 1457 CA ASN A 122 3.489 11.125 -4.832 1.00 0.00 C ATOM 1458 C ASN A 122 4.422 12.177 -4.217 1.00 0.00 C ATOM 1459 O ASN A 122 4.383 13.345 -4.559 1.00 0.00 O ATOM 1460 CB ASN A 122 2.421 11.800 -5.695 1.00 0.00 C ATOM 1461 CG ASN A 122 1.612 10.734 -6.445 1.00 0.00 C ATOM 1462 OD1 ASN A 122 0.466 10.956 -6.787 1.00 0.00 O ATOM 1463 ND2 ASN A 122 2.157 9.575 -6.721 1.00 0.00 N ATOM 0 H ASN A 122 2.938 9.320 -3.844 1.00 0.00 H new ATOM 0 HA ASN A 122 4.076 10.459 -5.464 1.00 0.00 H new ATOM 0 HB2 ASN A 122 1.759 12.399 -5.069 1.00 0.00 H new ATOM 0 HB3 ASN A 122 2.890 12.481 -6.405 1.00 0.00 H new ATOM 0 HD21 ASN A 122 1.621 8.865 -7.220 1.00 0.00 H new ATOM 0 HD22 ASN A 122 3.118 9.383 -6.437 1.00 0.00 H new ATOM 1470 N ARG A 123 5.269 11.757 -3.311 1.00 0.00 N ATOM 1471 CA ARG A 123 6.216 12.704 -2.659 1.00 0.00 C ATOM 1472 C ARG A 123 5.451 13.903 -2.096 1.00 0.00 C ATOM 1473 O ARG A 123 5.995 14.983 -1.943 1.00 0.00 O ATOM 1474 CB ARG A 123 7.257 13.188 -3.679 1.00 0.00 C ATOM 1475 CG ARG A 123 8.228 12.046 -4.002 1.00 0.00 C ATOM 1476 CD ARG A 123 9.270 12.531 -5.015 1.00 0.00 C ATOM 1477 NE ARG A 123 10.231 11.427 -5.310 1.00 0.00 N ATOM 1478 CZ ARG A 123 11.364 11.676 -5.914 1.00 0.00 C ATOM 1479 NH1 ARG A 123 11.677 12.895 -6.265 1.00 0.00 N ATOM 1480 NH2 ARG A 123 12.190 10.698 -6.168 1.00 0.00 N ATOM 0 H ARG A 123 5.343 10.790 -2.995 1.00 0.00 H new ATOM 0 HA ARG A 123 6.725 12.189 -1.844 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.760 13.525 -4.589 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.804 14.042 -3.279 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.721 11.706 -3.092 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.682 11.194 -4.406 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.778 12.854 -5.932 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.803 13.395 -4.619 1.00 0.00 H new ATOM 0 HE ARG A 123 10.002 10.471 -5.038 1.00 0.00 H new ATOM 0 HH11 ARG A 123 11.035 13.663 -6.068 1.00 0.00 H new ATOM 0 HH12 ARG A 123 12.563 13.079 -6.736 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.951 9.745 -5.896 1.00 0.00 H new ATOM 0 HH22 ARG A 123 13.075 10.887 -6.639 1.00 0.00 H new ATOM 1494 N GLU A 124 4.192 13.718 -1.775 1.00 0.00 N ATOM 1495 CA GLU A 124 3.374 14.823 -1.209 1.00 0.00 C ATOM 1496 C GLU A 124 2.789 14.370 0.144 1.00 0.00 C ATOM 1497 O GLU A 124 1.823 13.633 0.182 1.00 0.00 O ATOM 1498 CB GLU A 124 2.230 15.143 -2.169 1.00 0.00 C ATOM 1499 CG GLU A 124 1.568 16.440 -1.716 1.00 0.00 C ATOM 1500 CD GLU A 124 0.436 16.807 -2.674 1.00 0.00 C ATOM 1501 OE1 GLU A 124 -0.575 16.124 -2.650 1.00 0.00 O ATOM 1502 OE2 GLU A 124 0.598 17.762 -3.415 1.00 0.00 O ATOM 0 H GLU A 124 3.696 12.834 -1.885 1.00 0.00 H new ATOM 0 HA GLU A 124 3.993 15.709 -1.068 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.607 15.245 -3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 124 1.504 14.330 -2.178 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.178 16.326 -0.705 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.304 17.243 -1.685 1.00 0.00 H new ATOM 1509 N PRO A 125 3.367 14.792 1.246 1.00 0.00 N ATOM 1510 CA PRO A 125 2.883 14.398 2.603 1.00 0.00 C ATOM 1511 C PRO A 125 1.366 14.559 2.748 1.00 0.00 C ATOM 1512 O PRO A 125 0.803 15.607 2.478 1.00 0.00 O ATOM 1513 CB PRO A 125 3.629 15.357 3.543 1.00 0.00 C ATOM 1514 CG PRO A 125 4.888 15.711 2.815 1.00 0.00 C ATOM 1515 CD PRO A 125 4.545 15.673 1.324 1.00 0.00 C ATOM 0 HA PRO A 125 3.074 13.346 2.817 1.00 0.00 H new ATOM 0 HB2 PRO A 125 3.033 16.245 3.756 1.00 0.00 H new ATOM 0 HB3 PRO A 125 3.846 14.882 4.500 1.00 0.00 H new ATOM 0 HG2 PRO A 125 5.242 16.699 3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 125 5.685 15.005 3.049 1.00 0.00 H new ATOM 0 HD2 PRO A 125 4.323 16.669 0.941 1.00 0.00 H new ATOM 0 HD3 PRO A 125 5.374 15.282 0.734 1.00 0.00 H new ATOM 1523 N VAL A 126 0.699 13.513 3.170 1.00 0.00 N ATOM 1524 CA VAL A 126 -0.781 13.571 3.334 1.00 0.00 C ATOM 1525 C VAL A 126 -1.206 12.735 4.547 1.00 0.00 C ATOM 1526 O VAL A 126 -0.716 11.643 4.775 1.00 0.00 O ATOM 1527 CB VAL A 126 -1.452 13.035 2.061 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -0.806 11.709 1.653 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -2.946 12.809 2.319 1.00 0.00 C ATOM 0 H VAL A 126 1.122 12.616 3.409 1.00 0.00 H new ATOM 0 HA VAL A 126 -1.090 14.603 3.498 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.325 13.764 1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -1.286 11.333 0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 126 0.256 11.865 1.462 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -0.927 10.983 2.457 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -3.418 12.429 1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -3.071 12.085 3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -3.413 13.752 2.603 1.00 0.00 H new ATOM 1539 N ASP A 127 -2.133 13.246 5.314 1.00 0.00 N ATOM 1540 CA ASP A 127 -2.630 12.504 6.507 1.00 0.00 C ATOM 1541 C ASP A 127 -3.372 11.243 6.051 1.00 0.00 C ATOM 1542 O ASP A 127 -3.254 10.187 6.644 1.00 0.00 O ATOM 1543 CB ASP A 127 -3.587 13.408 7.287 1.00 0.00 C ATOM 1544 CG ASP A 127 -4.116 12.660 8.511 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -3.816 11.485 8.637 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -4.812 13.277 9.302 1.00 0.00 O ATOM 0 H ASP A 127 -2.570 14.155 5.162 1.00 0.00 H new ATOM 0 HA ASP A 127 -1.792 12.217 7.142 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.072 14.317 7.598 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.416 13.714 6.649 1.00 0.00 H new ATOM 1551 N SER A 128 -4.142 11.348 4.998 1.00 0.00 N ATOM 1552 CA SER A 128 -4.893 10.159 4.500 1.00 0.00 C ATOM 1553 C SER A 128 -5.232 10.342 3.020 1.00 0.00 C ATOM 1554 O SER A 128 -5.338 11.449 2.524 1.00 0.00 O ATOM 1555 CB SER A 128 -6.189 9.991 5.296 1.00 0.00 C ATOM 1556 OG SER A 128 -7.047 11.096 5.038 1.00 0.00 O ATOM 0 H SER A 128 -4.282 12.205 4.463 1.00 0.00 H new ATOM 0 HA SER A 128 -4.272 9.272 4.625 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.682 9.060 5.017 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.969 9.928 6.362 1.00 0.00 H new ATOM 0 HG SER A 128 -7.879 10.990 5.545 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.405 9.257 2.312 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.736 9.356 0.862 1.00 0.00 C ATOM 1564 C ALA A 129 -6.361 8.045 0.381 1.00 0.00 C ATOM 1565 O ALA A 129 -6.169 6.994 0.969 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.463 9.635 0.062 1.00 0.00 C ATOM 0 H ALA A 129 -5.331 8.307 2.676 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.446 10.170 0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.708 9.707 -0.998 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -4.021 10.573 0.397 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.751 8.824 0.216 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.110 8.106 -0.691 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.763 6.881 -1.232 1.00 0.00 C ATOM 1574 C VAL A 130 -6.852 6.224 -2.271 1.00 0.00 C ATOM 1575 O VAL A 130 -6.380 6.855 -3.199 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.089 7.272 -1.882 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.714 6.051 -2.560 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.038 7.801 -0.805 1.00 0.00 C ATOM 0 H VAL A 130 -7.297 8.960 -1.217 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.944 6.173 -0.423 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.914 8.044 -2.631 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.659 6.335 -3.022 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.036 5.673 -3.325 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -9.893 5.274 -1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -10.987 8.082 -1.262 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.210 7.025 -0.059 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.594 8.673 -0.325 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.602 4.954 -2.108 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.718 4.226 -3.057 1.00 0.00 C ATOM 1590 C LEU A 131 -6.463 3.925 -4.354 1.00 0.00 C ATOM 1591 O LEU A 131 -7.675 3.798 -4.383 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.266 2.917 -2.410 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.414 3.223 -1.170 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.132 1.923 -0.409 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.083 3.880 -1.586 1.00 0.00 C ATOM 0 H LEU A 131 -6.977 4.385 -1.349 1.00 0.00 H new ATOM 0 HA LEU A 131 -4.852 4.846 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.134 2.320 -2.129 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.690 2.327 -3.123 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.960 3.912 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.527 2.141 0.471 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.074 1.471 -0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.594 1.231 -1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.488 4.092 -0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.532 3.203 -2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.287 4.810 -2.116 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.736 3.819 -5.434 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.371 3.533 -6.748 1.00 0.00 C ATOM 1609 C ALA A 132 -5.403 2.739 -7.625 1.00 0.00 C ATOM 1610 O ALA A 132 -4.197 2.784 -7.446 1.00 0.00 O ATOM 1611 CB ALA A 132 -6.726 4.848 -7.439 1.00 0.00 C ATOM 0 H ALA A 132 -4.721 3.920 -5.460 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.278 2.948 -6.592 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.191 4.639 -8.402 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.420 5.411 -6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -5.820 5.434 -7.594 1.00 0.00 H new ATOM 1617 N ASN A 133 -5.933 2.007 -8.564 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.075 1.184 -9.461 1.00 0.00 C ATOM 1619 C ASN A 133 -3.960 2.028 -10.083 1.00 0.00 C ATOM 1620 O ASN A 133 -4.181 3.116 -10.588 1.00 0.00 O ATOM 1621 CB ASN A 133 -5.941 0.566 -10.564 1.00 0.00 C ATOM 1622 CG ASN A 133 -6.464 1.655 -11.507 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -6.482 2.822 -11.164 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -6.899 1.316 -12.694 1.00 0.00 N ATOM 0 H ASN A 133 -6.934 1.943 -8.750 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.610 0.394 -8.871 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -5.358 -0.162 -11.128 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.778 0.028 -10.119 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -7.253 2.030 -13.331 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -6.884 0.338 -12.982 1.00 0.00 H new ATOM 1631 N GLY A 134 -2.754 1.518 -10.039 1.00 0.00 N ATOM 1632 CA GLY A 134 -1.590 2.252 -10.612 1.00 0.00 C ATOM 1633 C GLY A 134 -1.080 3.281 -9.600 1.00 0.00 C ATOM 1634 O GLY A 134 -0.371 4.209 -9.946 1.00 0.00 O ATOM 0 H GLY A 134 -2.527 0.614 -9.625 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.794 1.551 -10.865 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -1.881 2.750 -11.537 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.436 3.129 -8.351 1.00 0.00 N ATOM 1639 CA ASP A 135 -0.975 4.107 -7.317 1.00 0.00 C ATOM 1640 C ASP A 135 0.428 3.737 -6.833 1.00 0.00 C ATOM 1641 O ASP A 135 0.808 2.580 -6.805 1.00 0.00 O ATOM 1642 CB ASP A 135 -1.953 4.115 -6.133 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.122 5.057 -6.430 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.241 5.483 -7.567 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -3.873 5.343 -5.513 1.00 0.00 O ATOM 0 H ASP A 135 -2.024 2.373 -8.001 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.944 5.102 -7.760 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.324 3.107 -5.950 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.438 4.434 -5.227 1.00 0.00 H new ATOM 1650 N GLU A 136 1.201 4.724 -6.449 1.00 0.00 N ATOM 1651 CA GLU A 136 2.587 4.466 -5.964 1.00 0.00 C ATOM 1652 C GLU A 136 2.651 4.706 -4.458 1.00 0.00 C ATOM 1653 O GLU A 136 2.313 5.769 -3.969 1.00 0.00 O ATOM 1654 CB GLU A 136 3.553 5.423 -6.664 1.00 0.00 C ATOM 1655 CG GLU A 136 3.602 5.106 -8.167 1.00 0.00 C ATOM 1656 CD GLU A 136 2.417 5.763 -8.881 1.00 0.00 C ATOM 1657 OE1 GLU A 136 1.582 6.335 -8.201 1.00 0.00 O ATOM 1658 OE2 GLU A 136 2.369 5.688 -10.099 1.00 0.00 O ATOM 0 H GLU A 136 0.925 5.706 -6.452 1.00 0.00 H new ATOM 0 HA GLU A 136 2.863 3.435 -6.184 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.233 6.454 -6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.549 5.330 -6.231 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.539 5.466 -8.592 1.00 0.00 H new ATOM 0 HG3 GLU A 136 3.577 4.027 -8.320 1.00 0.00 H new ATOM 1665 N VAL A 137 3.082 3.713 -3.721 1.00 0.00 N ATOM 1666 CA VAL A 137 3.180 3.846 -2.238 1.00 0.00 C ATOM 1667 C VAL A 137 4.603 3.511 -1.798 1.00 0.00 C ATOM 1668 O VAL A 137 5.175 2.512 -2.200 1.00 0.00 O ATOM 1669 CB VAL A 137 2.197 2.884 -1.571 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.459 2.846 -0.062 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.770 3.369 -1.831 1.00 0.00 C ATOM 0 H VAL A 137 3.373 2.807 -4.089 1.00 0.00 H new ATOM 0 HA VAL A 137 2.937 4.867 -1.945 1.00 0.00 H new ATOM 0 HB VAL A 137 2.326 1.883 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.757 2.160 0.412 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.478 2.507 0.122 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.328 3.844 0.355 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.062 2.688 -1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.644 4.369 -1.415 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.585 3.396 -2.905 1.00 0.00 H new ATOM 1681 N GLN A 138 5.172 4.347 -0.969 1.00 0.00 N ATOM 1682 CA GLN A 138 6.561 4.113 -0.474 1.00 0.00 C ATOM 1683 C GLN A 138 6.555 4.074 1.052 1.00 0.00 C ATOM 1684 O GLN A 138 6.092 4.993 1.707 1.00 0.00 O ATOM 1685 CB GLN A 138 7.468 5.247 -0.949 1.00 0.00 C ATOM 1686 CG GLN A 138 8.899 4.967 -0.489 1.00 0.00 C ATOM 1687 CD GLN A 138 9.860 5.966 -1.134 1.00 0.00 C ATOM 1688 OE1 GLN A 138 9.528 6.605 -2.114 1.00 0.00 O ATOM 1689 NE2 GLN A 138 11.050 6.127 -0.621 1.00 0.00 N ATOM 0 H GLN A 138 4.728 5.192 -0.610 1.00 0.00 H new ATOM 0 HA GLN A 138 6.931 3.164 -0.862 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.431 5.328 -2.035 1.00 0.00 H new ATOM 0 HB3 GLN A 138 7.123 6.199 -0.546 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.961 5.039 0.597 1.00 0.00 H new ATOM 0 HG3 GLN A 138 9.184 3.950 -0.758 1.00 0.00 H new ATOM 0 HE21 GLN A 138 11.328 5.591 0.201 1.00 0.00 H new ATOM 0 HE22 GLN A 138 11.702 6.789 -1.042 1.00 0.00 H new ATOM 1698 N ILE A 139 7.067 3.011 1.622 1.00 0.00 N ATOM 1699 CA ILE A 139 7.101 2.884 3.109 1.00 0.00 C ATOM 1700 C ILE A 139 8.549 2.965 3.590 1.00 0.00 C ATOM 1701 O ILE A 139 9.421 2.253 3.122 1.00 0.00 O ATOM 1702 CB ILE A 139 6.501 1.538 3.527 1.00 0.00 C ATOM 1703 CG1 ILE A 139 5.095 1.387 2.923 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.412 1.474 5.052 1.00 0.00 C ATOM 1705 CD1 ILE A 139 4.224 2.600 3.278 1.00 0.00 C ATOM 0 H ILE A 139 7.466 2.221 1.115 1.00 0.00 H new ATOM 0 HA ILE A 139 6.520 3.691 3.554 1.00 0.00 H new ATOM 0 HB ILE A 139 7.136 0.730 3.164 1.00 0.00 H new ATOM 0 HG12 ILE A 139 5.167 1.288 1.840 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.629 0.475 3.296 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.985 0.517 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.410 1.576 5.479 1.00 0.00 H new ATOM 0 HG23 ILE A 139 5.778 2.283 5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 139 3.233 2.476 2.842 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.137 2.681 4.362 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.683 3.506 2.883 1.00 0.00 H new ATOM 1717 N GLY A 140 8.802 3.840 4.527 1.00 0.00 N ATOM 1718 CA GLY A 140 10.180 4.003 5.065 1.00 0.00 C ATOM 1719 C GLY A 140 11.155 4.283 3.922 1.00 0.00 C ATOM 1720 O GLY A 140 11.370 5.419 3.533 1.00 0.00 O ATOM 0 H GLY A 140 8.103 4.454 4.946 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.204 4.822 5.784 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.481 3.101 5.598 1.00 0.00 H new ATOM 1724 N LYS A 141 11.747 3.249 3.388 1.00 0.00 N ATOM 1725 CA LYS A 141 12.713 3.407 2.263 1.00 0.00 C ATOM 1726 C LYS A 141 12.322 2.437 1.147 1.00 0.00 C ATOM 1727 O LYS A 141 12.727 2.579 0.007 1.00 0.00 O ATOM 1728 CB LYS A 141 14.129 3.082 2.762 1.00 0.00 C ATOM 1729 CG LYS A 141 14.172 1.655 3.323 1.00 0.00 C ATOM 1730 CD LYS A 141 15.582 1.355 3.846 1.00 0.00 C ATOM 1731 CE LYS A 141 15.627 -0.064 4.420 1.00 0.00 C ATOM 1732 NZ LYS A 141 16.998 -0.353 4.931 1.00 0.00 N ATOM 0 H LYS A 141 11.599 2.286 3.689 1.00 0.00 H new ATOM 0 HA LYS A 141 12.693 4.430 1.887 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.843 3.182 1.945 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.424 3.794 3.533 1.00 0.00 H new ATOM 0 HG2 LYS A 141 13.444 1.546 4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 141 13.900 0.939 2.547 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.309 1.455 3.040 1.00 0.00 H new ATOM 0 HD3 LYS A 141 15.857 2.078 4.614 1.00 0.00 H new ATOM 0 HE2 LYS A 141 14.899 -0.165 5.225 1.00 0.00 H new ATOM 0 HE3 LYS A 141 15.354 -0.787 3.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 17.027 -1.317 5.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 17.683 -0.273 4.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 17.241 0.329 5.677 1.00 0.00 H new ATOM 1746 N PHE A 142 11.536 1.443 1.475 1.00 0.00 N ATOM 1747 CA PHE A 142 11.114 0.447 0.451 1.00 0.00 C ATOM 1748 C PHE A 142 10.019 1.039 -0.435 1.00 0.00 C ATOM 1749 O PHE A 142 9.158 1.770 0.019 1.00 0.00 O ATOM 1750 CB PHE A 142 10.584 -0.807 1.146 1.00 0.00 C ATOM 1751 CG PHE A 142 11.730 -1.511 1.829 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.578 -2.343 1.091 1.00 0.00 C ATOM 1753 CD2 PHE A 142 11.946 -1.327 3.201 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.644 -2.995 1.723 1.00 0.00 C ATOM 1755 CE2 PHE A 142 13.011 -1.979 3.833 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.861 -2.812 3.094 1.00 0.00 C ATOM 0 H PHE A 142 11.168 1.280 2.412 1.00 0.00 H new ATOM 0 HA PHE A 142 11.973 0.187 -0.168 1.00 0.00 H new ATOM 0 HB2 PHE A 142 9.819 -0.539 1.875 1.00 0.00 H new ATOM 0 HB3 PHE A 142 10.114 -1.470 0.420 1.00 0.00 H new ATOM 0 HD1 PHE A 142 12.411 -2.483 0.033 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.292 -0.683 3.770 1.00 0.00 H new ATOM 0 HE1 PHE A 142 14.298 -3.638 1.153 1.00 0.00 H new ATOM 0 HE2 PHE A 142 13.178 -1.840 4.891 1.00 0.00 H new ATOM 0 HZ PHE A 142 14.684 -3.313 3.582 1.00 0.00 H new ATOM 1766 N ARG A 143 10.053 0.723 -1.707 1.00 0.00 N ATOM 1767 CA ARG A 143 9.029 1.255 -2.654 1.00 0.00 C ATOM 1768 C ARG A 143 8.037 0.156 -3.027 1.00 0.00 C ATOM 1769 O ARG A 143 8.409 -0.957 -3.359 1.00 0.00 O ATOM 1770 CB ARG A 143 9.727 1.761 -3.913 1.00 0.00 C ATOM 1771 CG ARG A 143 10.509 3.032 -3.577 1.00 0.00 C ATOM 1772 CD ARG A 143 11.229 3.533 -4.829 1.00 0.00 C ATOM 1773 NE ARG A 143 12.009 4.763 -4.499 1.00 0.00 N ATOM 1774 CZ ARG A 143 11.444 5.943 -4.542 1.00 0.00 C ATOM 1775 NH1 ARG A 143 10.186 6.066 -4.873 1.00 0.00 N ATOM 1776 NH2 ARG A 143 12.144 7.004 -4.251 1.00 0.00 N ATOM 0 H ARG A 143 10.753 0.114 -2.131 1.00 0.00 H new ATOM 0 HA ARG A 143 8.487 2.072 -2.177 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.400 0.997 -4.302 1.00 0.00 H new ATOM 0 HB3 ARG A 143 8.993 1.966 -4.693 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.832 3.800 -3.202 1.00 0.00 H new ATOM 0 HG3 ARG A 143 11.231 2.829 -2.786 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.895 2.760 -5.212 1.00 0.00 H new ATOM 0 HD3 ARG A 143 10.506 3.749 -5.615 1.00 0.00 H new ATOM 0 HE ARG A 143 12.992 4.683 -4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 143 9.635 5.238 -5.101 1.00 0.00 H new ATOM 0 HH12 ARG A 143 9.755 6.990 -4.904 1.00 0.00 H new ATOM 0 HH21 ARG A 143 13.126 6.912 -3.992 1.00 0.00 H new ATOM 0 HH22 ARG A 143 11.709 7.926 -4.283 1.00 0.00 H new ATOM 1790 N LEU A 144 6.769 0.470 -2.966 1.00 0.00 N ATOM 1791 CA LEU A 144 5.717 -0.530 -3.304 1.00 0.00 C ATOM 1792 C LEU A 144 4.673 0.113 -4.205 1.00 0.00 C ATOM 1793 O LEU A 144 4.491 1.319 -4.208 1.00 0.00 O ATOM 1794 CB LEU A 144 5.041 -1.017 -2.022 1.00 0.00 C ATOM 1795 CG LEU A 144 6.061 -1.779 -1.143 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.701 -0.826 -0.128 1.00 0.00 C ATOM 1797 CD2 LEU A 144 5.351 -2.912 -0.393 1.00 0.00 C ATOM 0 H LEU A 144 6.415 1.387 -2.693 1.00 0.00 H new ATOM 0 HA LEU A 144 6.177 -1.374 -3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.635 -0.169 -1.470 1.00 0.00 H new ATOM 0 HB3 LEU A 144 4.202 -1.668 -2.268 1.00 0.00 H new ATOM 0 HG LEU A 144 6.838 -2.193 -1.786 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.417 -1.374 0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 144 7.215 -0.023 -0.657 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.927 -0.402 0.511 1.00 0.00 H new ATOM 0 HD21 LEU A 144 6.072 -3.447 0.225 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.569 -2.494 0.241 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.907 -3.601 -1.111 1.00 0.00 H new ATOM 1809 N VAL A 145 3.990 -0.691 -4.976 1.00 0.00 N ATOM 1810 CA VAL A 145 2.947 -0.166 -5.901 1.00 0.00 C ATOM 1811 C VAL A 145 1.624 -0.898 -5.660 1.00 0.00 C ATOM 1812 O VAL A 145 1.578 -2.112 -5.541 1.00 0.00 O ATOM 1813 CB VAL A 145 3.409 -0.374 -7.346 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.367 -1.863 -7.708 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.489 0.405 -8.283 1.00 0.00 C ATOM 0 H VAL A 145 4.114 -1.703 -5.003 1.00 0.00 H new ATOM 0 HA VAL A 145 2.795 0.898 -5.719 1.00 0.00 H new ATOM 0 HB VAL A 145 4.433 -0.016 -7.449 1.00 0.00 H new ATOM 0 HG11 VAL A 145 3.698 -1.997 -8.738 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.026 -2.418 -7.040 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.348 -2.234 -7.603 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.813 0.261 -9.314 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.466 0.046 -8.170 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.530 1.466 -8.035 1.00 0.00 H new ATOM 1825 N PHE A 146 0.548 -0.157 -5.586 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.789 -0.773 -5.354 1.00 0.00 C ATOM 1827 C PHE A 146 -1.474 -1.018 -6.695 1.00 0.00 C ATOM 1828 O PHE A 146 -1.703 -0.096 -7.471 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.643 0.178 -4.518 1.00 0.00 C ATOM 1830 CG PHE A 146 -3.035 -0.387 -4.369 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -4.009 -0.117 -5.339 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.352 -1.185 -3.264 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -5.298 -0.644 -5.202 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -4.640 -1.713 -3.128 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.612 -1.443 -4.096 1.00 0.00 C ATOM 0 H PHE A 146 0.541 0.859 -5.678 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.669 -1.720 -4.827 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.191 0.321 -3.536 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.687 1.157 -4.994 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -3.765 0.498 -6.193 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -2.602 -1.393 -2.516 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -6.050 -0.435 -5.949 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.884 -2.329 -2.275 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.606 -1.851 -3.990 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.797 -2.259 -6.969 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.466 -2.610 -8.257 1.00 0.00 C ATOM 1847 C LEU A 147 -3.658 -3.523 -7.983 1.00 0.00 C ATOM 1848 O LEU A 147 -3.701 -4.249 -7.000 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.467 -3.331 -9.165 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.291 -2.396 -9.476 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.807 -3.180 -10.201 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -0.758 -1.228 -10.363 1.00 0.00 C ATOM 0 H LEU A 147 -1.623 -3.049 -6.348 1.00 0.00 H new ATOM 0 HA LEU A 147 -2.815 -1.701 -8.746 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -1.106 -4.237 -8.679 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -1.956 -3.638 -10.090 1.00 0.00 H new ATOM 0 HG LEU A 147 0.099 -1.996 -8.540 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.643 -2.516 -10.422 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.151 -3.997 -9.566 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.410 -3.586 -11.131 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.086 -0.573 -10.576 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.159 -1.619 -11.298 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.533 -0.664 -9.844 1.00 0.00 H new ATOM 1864 N THR A 148 -4.634 -3.481 -8.851 1.00 0.00 N ATOM 1865 CA THR A 148 -5.846 -4.327 -8.675 1.00 0.00 C ATOM 1866 C THR A 148 -6.326 -4.831 -10.039 1.00 0.00 C ATOM 1867 O THR A 148 -5.927 -4.337 -11.078 1.00 0.00 O ATOM 1868 CB THR A 148 -6.949 -3.509 -7.993 1.00 0.00 C ATOM 1869 OG1 THR A 148 -8.173 -4.226 -8.051 1.00 0.00 O ATOM 1870 CG2 THR A 148 -7.108 -2.156 -8.686 1.00 0.00 C ATOM 0 H THR A 148 -4.641 -2.890 -9.682 1.00 0.00 H new ATOM 0 HA THR A 148 -5.603 -5.185 -8.048 1.00 0.00 H new ATOM 0 HB THR A 148 -6.675 -3.339 -6.952 1.00 0.00 H new ATOM 0 HG1 THR A 148 -8.878 -3.705 -7.614 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.894 -1.585 -8.192 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.169 -1.605 -8.629 1.00 0.00 H new ATOM 0 HG23 THR A 148 -7.374 -2.312 -9.731 1.00 0.00 H new