USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 379 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 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -1.56 K(o=-1.6,f=-3.9) USER MOD Single : A 91 MET CE :methyl 154:sc= -0.117 (180deg=-1.08) USER MOD Single : A 98 TYR OH : rot -111:sc= 0.0342 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0.0171 USER MOD Single : A 113 ASN : amide:sc= -2.2 K(o=-2.2,f=-5.2!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 9:sc= -3.87! USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot -154:sc= -1.04 USER MOD Single : A 122 SER OG : rot -41:sc= 0.0111 USER MOD Single : A 124 CYS SG : rot -52:sc= -0.0549 USER MOD Single : A 125 LYS NZ :NH3+ -135:sc= 0.539 (180deg=-0.443) USER MOD Single : A 126 GLN : amide:sc= -0.05 K(o=-0.05,f=-0.94) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc=-0.00221 X(o=-0.0022,f=-0.0022) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 66.544 7.888 -50.365 1.00 0.00 N ATOM 463 CA VAL A 82 66.430 8.635 -51.612 1.00 0.00 C ATOM 464 C VAL A 82 66.931 7.812 -52.794 1.00 0.00 C ATOM 465 O VAL A 82 67.889 7.048 -52.670 1.00 0.00 O ATOM 466 CB VAL A 82 67.220 9.956 -51.549 1.00 0.00 C ATOM 467 CG1 VAL A 82 68.672 9.692 -51.179 1.00 0.00 C ATOM 468 CG2 VAL A 82 67.125 10.698 -52.873 1.00 0.00 C ATOM 0 HA VAL A 82 65.372 8.859 -51.751 1.00 0.00 H new ATOM 0 HB VAL A 82 66.781 10.585 -50.775 1.00 0.00 H new ATOM 0 HG11 VAL A 82 69.215 10.636 -51.139 1.00 0.00 H new ATOM 0 HG12 VAL A 82 68.717 9.206 -50.204 1.00 0.00 H new ATOM 0 HG13 VAL A 82 69.126 9.044 -51.928 1.00 0.00 H new ATOM 0 HG21 VAL A 82 67.689 11.629 -52.810 1.00 0.00 H new ATOM 0 HG22 VAL A 82 67.537 10.077 -53.668 1.00 0.00 H new ATOM 0 HG23 VAL A 82 66.081 10.921 -53.091 1.00 0.00 H new ATOM 478 N VAL A 83 66.278 7.974 -53.940 1.00 0.00 N ATOM 479 CA VAL A 83 66.658 7.247 -55.145 1.00 0.00 C ATOM 480 C VAL A 83 68.015 7.711 -55.662 1.00 0.00 C ATOM 481 O VAL A 83 68.173 8.859 -56.076 1.00 0.00 O ATOM 482 CB VAL A 83 65.609 7.423 -56.260 1.00 0.00 C ATOM 483 CG1 VAL A 83 65.850 6.424 -57.382 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.204 7.276 -55.697 1.00 0.00 C ATOM 0 H VAL A 83 65.483 8.602 -54.059 1.00 0.00 H new ATOM 0 HA VAL A 83 66.717 6.193 -54.874 1.00 0.00 H new ATOM 0 HB VAL A 83 65.707 8.427 -56.673 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.100 6.563 -58.160 1.00 0.00 H new ATOM 0 HG12 VAL A 83 66.843 6.582 -57.803 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.780 5.410 -56.988 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.476 7.403 -56.498 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.090 6.285 -55.257 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.038 8.034 -54.932 1.00 0.00 H new ATOM 494 N GLU A 84 68.992 6.809 -55.634 1.00 0.00 N ATOM 495 CA GLU A 84 70.337 7.127 -56.100 1.00 0.00 C ATOM 496 C GLU A 84 70.665 6.360 -57.378 1.00 0.00 C ATOM 497 O GLU A 84 71.576 6.729 -58.120 1.00 0.00 O ATOM 498 CB GLU A 84 71.366 6.798 -55.016 1.00 0.00 C ATOM 499 CG GLU A 84 72.542 7.760 -54.982 1.00 0.00 C ATOM 500 CD GLU A 84 73.647 7.365 -55.942 1.00 0.00 C ATOM 501 OE1 GLU A 84 74.034 6.178 -55.946 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.124 8.244 -56.690 1.00 0.00 O ATOM 0 H GLU A 84 68.877 5.854 -55.294 1.00 0.00 H new ATOM 0 HA GLU A 84 70.377 8.194 -56.317 1.00 0.00 H new ATOM 0 HB2 GLU A 84 70.873 6.806 -54.044 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.739 5.786 -55.176 1.00 0.00 H new ATOM 0 HG2 GLU A 84 72.193 8.763 -55.228 1.00 0.00 H new ATOM 0 HG3 GLU A 84 72.943 7.802 -53.969 1.00 0.00 H new ATOM 509 N LYS A 85 69.917 5.291 -57.628 1.00 0.00 N ATOM 510 CA LYS A 85 70.126 4.472 -58.816 1.00 0.00 C ATOM 511 C LYS A 85 68.853 3.718 -59.188 1.00 0.00 C ATOM 512 O LYS A 85 67.854 3.776 -58.472 1.00 0.00 O ATOM 513 CB LYS A 85 71.268 3.480 -58.582 1.00 0.00 C ATOM 514 CG LYS A 85 72.303 3.470 -59.694 1.00 0.00 C ATOM 515 CD LYS A 85 72.858 2.075 -59.926 1.00 0.00 C ATOM 516 CE LYS A 85 74.333 1.995 -59.563 1.00 0.00 C ATOM 517 NZ LYS A 85 74.864 0.610 -59.702 1.00 0.00 N ATOM 0 H LYS A 85 69.160 4.971 -57.023 1.00 0.00 H new ATOM 0 HA LYS A 85 70.390 5.134 -59.641 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.761 3.722 -57.640 1.00 0.00 H new ATOM 0 HB3 LYS A 85 70.852 2.478 -58.476 1.00 0.00 H new ATOM 0 HG2 LYS A 85 71.853 3.841 -60.615 1.00 0.00 H new ATOM 0 HG3 LYS A 85 73.117 4.149 -59.441 1.00 0.00 H new ATOM 0 HD2 LYS A 85 72.296 1.355 -59.331 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.724 1.798 -60.972 1.00 0.00 H new ATOM 0 HE2 LYS A 85 74.902 2.668 -60.204 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.474 2.337 -58.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 75.872 0.597 -59.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 74.338 -0.028 -59.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 74.753 0.293 -60.686 1.00 0.00 H new ATOM 531 N VAL A 86 68.898 3.010 -60.312 1.00 0.00 N ATOM 532 CA VAL A 86 67.749 2.243 -60.778 1.00 0.00 C ATOM 533 C VAL A 86 67.961 0.749 -60.563 1.00 0.00 C ATOM 534 O VAL A 86 68.927 0.170 -61.061 1.00 0.00 O ATOM 535 CB VAL A 86 67.470 2.500 -62.271 1.00 0.00 C ATOM 536 CG1 VAL A 86 66.293 1.662 -62.747 1.00 0.00 C ATOM 537 CG2 VAL A 86 67.215 3.980 -62.518 1.00 0.00 C ATOM 0 H VAL A 86 69.717 2.952 -60.917 1.00 0.00 H new ATOM 0 HA VAL A 86 66.891 2.573 -60.193 1.00 0.00 H new ATOM 0 HB VAL A 86 68.350 2.205 -62.843 1.00 0.00 H new ATOM 0 HG11 VAL A 86 66.111 1.857 -63.804 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.519 0.605 -62.607 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.405 1.923 -62.172 1.00 0.00 H new ATOM 0 HG21 VAL A 86 67.020 4.144 -63.578 1.00 0.00 H new ATOM 0 HG22 VAL A 86 66.352 4.303 -61.936 1.00 0.00 H new ATOM 0 HG23 VAL A 86 68.091 4.555 -62.217 1.00 0.00 H new ATOM 547 N LEU A 87 67.053 0.129 -59.817 1.00 0.00 N ATOM 548 CA LEU A 87 67.140 -1.299 -59.535 1.00 0.00 C ATOM 549 C LEU A 87 66.839 -2.121 -60.785 1.00 0.00 C ATOM 550 O LEU A 87 67.371 -3.216 -60.964 1.00 0.00 O ATOM 551 CB LEU A 87 66.169 -1.679 -58.416 1.00 0.00 C ATOM 552 CG LEU A 87 66.715 -2.622 -57.344 1.00 0.00 C ATOM 553 CD1 LEU A 87 67.158 -3.938 -57.966 1.00 0.00 C ATOM 554 CD2 LEU A 87 67.868 -1.969 -56.596 1.00 0.00 C ATOM 0 H LEU A 87 66.248 0.593 -59.397 1.00 0.00 H new ATOM 0 HA LEU A 87 68.158 -1.518 -59.214 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.832 -0.764 -57.929 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.291 -2.143 -58.866 1.00 0.00 H new ATOM 0 HG LEU A 87 65.918 -2.831 -56.631 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.544 -4.597 -57.188 1.00 0.00 H new ATOM 0 HD12 LEU A 87 66.308 -4.414 -58.455 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.940 -3.748 -58.701 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.244 -2.655 -55.837 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.668 -1.730 -57.297 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.519 -1.054 -56.117 1.00 0.00 H new ATOM 566 N LYS A 88 65.985 -1.583 -61.648 1.00 0.00 N ATOM 567 CA LYS A 88 65.615 -2.262 -62.884 1.00 0.00 C ATOM 568 C LYS A 88 64.627 -1.426 -63.690 1.00 0.00 C ATOM 569 O LYS A 88 64.230 -0.339 -63.270 1.00 0.00 O ATOM 570 CB LYS A 88 65.006 -3.632 -62.574 1.00 0.00 C ATOM 571 CG LYS A 88 65.881 -4.797 -63.003 1.00 0.00 C ATOM 572 CD LYS A 88 65.063 -6.060 -63.215 1.00 0.00 C ATOM 573 CE LYS A 88 65.556 -7.198 -62.335 1.00 0.00 C ATOM 574 NZ LYS A 88 64.738 -7.338 -61.099 1.00 0.00 N ATOM 0 H LYS A 88 65.535 -0.677 -61.514 1.00 0.00 H new ATOM 0 HA LYS A 88 66.518 -2.398 -63.479 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.820 -3.704 -61.502 1.00 0.00 H new ATOM 0 HB3 LYS A 88 64.039 -3.712 -63.072 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.403 -4.541 -63.925 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.643 -4.979 -62.246 1.00 0.00 H new ATOM 0 HD2 LYS A 88 64.015 -5.857 -62.996 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.117 -6.358 -64.262 1.00 0.00 H new ATOM 0 HE2 LYS A 88 65.526 -8.131 -62.898 1.00 0.00 H new ATOM 0 HE3 LYS A 88 66.597 -7.022 -62.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 65.106 -8.124 -60.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 64.786 -6.457 -60.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 63.749 -7.531 -61.357 1.00 0.00 H new ATOM 588 N HIS A 89 64.232 -1.940 -64.851 1.00 0.00 N ATOM 589 CA HIS A 89 63.288 -1.241 -65.715 1.00 0.00 C ATOM 590 C HIS A 89 62.257 -2.208 -66.289 1.00 0.00 C ATOM 591 O HIS A 89 62.591 -3.326 -66.681 1.00 0.00 O ATOM 592 CB HIS A 89 64.030 -0.536 -66.851 1.00 0.00 C ATOM 593 CG HIS A 89 63.126 -0.024 -67.930 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.954 0.656 -67.671 1.00 0.00 N ATOM 595 CD2 HIS A 89 63.228 -0.095 -69.278 1.00 0.00 C ATOM 596 CE1 HIS A 89 61.374 0.980 -68.813 1.00 0.00 C ATOM 597 NE2 HIS A 89 62.127 0.536 -69.803 1.00 0.00 N ATOM 0 H HIS A 89 64.551 -2.838 -65.215 1.00 0.00 H new ATOM 0 HA HIS A 89 62.766 -0.496 -65.114 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.600 0.297 -66.440 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.749 -1.228 -67.289 1.00 0.00 H new ATOM 0 HD2 HIS A 89 64.026 -0.561 -69.836 1.00 0.00 H new ATOM 0 HE1 HIS A 89 60.443 1.517 -68.919 1.00 0.00 H new ATOM 0 HE2 HIS A 89 61.924 0.644 -70.797 1.00 0.00 H new ATOM 605 N ARG A 90 61.002 -1.771 -66.333 1.00 0.00 N ATOM 606 CA ARG A 90 59.922 -2.599 -66.856 1.00 0.00 C ATOM 607 C ARG A 90 58.911 -1.753 -67.623 1.00 0.00 C ATOM 608 O ARG A 90 58.972 -0.524 -67.602 1.00 0.00 O ATOM 609 CB ARG A 90 59.223 -3.342 -65.716 1.00 0.00 C ATOM 610 CG ARG A 90 59.815 -4.711 -65.427 1.00 0.00 C ATOM 611 CD ARG A 90 59.567 -5.679 -66.574 1.00 0.00 C ATOM 612 NE ARG A 90 59.826 -7.064 -66.187 1.00 0.00 N ATOM 613 CZ ARG A 90 59.600 -8.103 -66.983 1.00 0.00 C ATOM 614 NH1 ARG A 90 59.115 -7.916 -68.203 1.00 0.00 N ATOM 615 NH2 ARG A 90 59.862 -9.333 -66.560 1.00 0.00 N ATOM 0 H ARG A 90 60.709 -0.848 -66.013 1.00 0.00 H new ATOM 0 HA ARG A 90 60.355 -3.327 -67.543 1.00 0.00 H new ATOM 0 HB2 ARG A 90 59.275 -2.735 -64.812 1.00 0.00 H new ATOM 0 HB3 ARG A 90 58.167 -3.457 -65.962 1.00 0.00 H new ATOM 0 HG2 ARG A 90 60.887 -4.616 -65.255 1.00 0.00 H new ATOM 0 HG3 ARG A 90 59.380 -5.111 -64.511 1.00 0.00 H new ATOM 0 HD2 ARG A 90 58.535 -5.584 -66.912 1.00 0.00 H new ATOM 0 HD3 ARG A 90 60.204 -5.413 -67.417 1.00 0.00 H new ATOM 0 HE ARG A 90 60.201 -7.243 -65.255 1.00 0.00 H new ATOM 0 HH11 ARG A 90 58.914 -6.972 -68.533 1.00 0.00 H new ATOM 0 HH12 ARG A 90 58.943 -8.716 -68.812 1.00 0.00 H new ATOM 0 HH21 ARG A 90 60.237 -9.481 -65.623 1.00 0.00 H new ATOM 0 HH22 ARG A 90 59.688 -10.131 -67.172 1.00 0.00 H new ATOM 629 N MET A 91 57.981 -2.419 -68.299 1.00 0.00 N ATOM 630 CA MET A 91 56.955 -1.728 -69.072 1.00 0.00 C ATOM 631 C MET A 91 55.584 -1.892 -68.425 1.00 0.00 C ATOM 632 O MET A 91 55.257 -2.957 -67.902 1.00 0.00 O ATOM 633 CB MET A 91 56.923 -2.259 -70.506 1.00 0.00 C ATOM 634 CG MET A 91 55.742 -1.748 -71.316 1.00 0.00 C ATOM 635 SD MET A 91 56.187 -1.353 -73.018 1.00 0.00 S ATOM 636 CE MET A 91 57.187 -2.776 -73.446 1.00 0.00 C ATOM 0 H MET A 91 57.916 -3.437 -68.327 1.00 0.00 H new ATOM 0 HA MET A 91 57.203 -0.667 -69.091 1.00 0.00 H new ATOM 0 HB2 MET A 91 57.848 -1.978 -71.010 1.00 0.00 H new ATOM 0 HB3 MET A 91 56.892 -3.348 -70.481 1.00 0.00 H new ATOM 0 HG2 MET A 91 54.953 -2.500 -71.316 1.00 0.00 H new ATOM 0 HG3 MET A 91 55.334 -0.859 -70.835 1.00 0.00 H new ATOM 0 HE1 MET A 91 57.155 -2.932 -74.524 1.00 0.00 H new ATOM 0 HE2 MET A 91 58.217 -2.603 -73.135 1.00 0.00 H new ATOM 0 HE3 MET A 91 56.798 -3.659 -72.940 1.00 0.00 H new ATOM 646 N ALA A 92 54.785 -0.830 -68.464 1.00 0.00 N ATOM 647 CA ALA A 92 53.448 -0.858 -67.883 1.00 0.00 C ATOM 648 C ALA A 92 52.458 -1.546 -68.817 1.00 0.00 C ATOM 649 O ALA A 92 52.209 -1.076 -69.927 1.00 0.00 O ATOM 650 CB ALA A 92 52.982 0.554 -67.563 1.00 0.00 C ATOM 0 H ALA A 92 55.041 0.060 -68.892 1.00 0.00 H new ATOM 0 HA ALA A 92 53.493 -1.432 -66.957 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.982 0.518 -67.130 1.00 0.00 H new ATOM 0 HB2 ALA A 92 53.669 1.012 -66.852 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.960 1.146 -68.478 1.00 0.00 H new ATOM 716 N GLY A 97 52.218 3.454 -69.692 1.00 0.00 N ATOM 717 CA GLY A 97 53.475 3.766 -70.346 1.00 0.00 C ATOM 718 C GLY A 97 54.598 2.843 -69.916 1.00 0.00 C ATOM 719 O GLY A 97 54.636 1.676 -70.307 1.00 0.00 O ATOM 0 HA2 GLY A 97 53.346 3.697 -71.426 1.00 0.00 H new ATOM 0 HA3 GLY A 97 53.751 4.797 -70.123 1.00 0.00 H new ATOM 723 N TYR A 98 55.516 3.366 -69.111 1.00 0.00 N ATOM 724 CA TYR A 98 56.647 2.582 -68.631 1.00 0.00 C ATOM 725 C TYR A 98 56.839 2.766 -67.128 1.00 0.00 C ATOM 726 O TYR A 98 56.368 3.743 -66.547 1.00 0.00 O ATOM 727 CB TYR A 98 57.924 2.982 -69.372 1.00 0.00 C ATOM 728 CG TYR A 98 58.002 2.439 -70.781 1.00 0.00 C ATOM 729 CD1 TYR A 98 57.391 3.104 -71.837 1.00 0.00 C ATOM 730 CD2 TYR A 98 58.684 1.261 -71.056 1.00 0.00 C ATOM 731 CE1 TYR A 98 57.459 2.612 -73.126 1.00 0.00 C ATOM 732 CE2 TYR A 98 58.758 0.761 -72.342 1.00 0.00 C ATOM 733 CZ TYR A 98 58.144 1.440 -73.373 1.00 0.00 C ATOM 734 OH TYR A 98 58.214 0.945 -74.655 1.00 0.00 O ATOM 0 H TYR A 98 55.499 4.330 -68.777 1.00 0.00 H new ATOM 0 HA TYR A 98 56.436 1.531 -68.826 1.00 0.00 H new ATOM 0 HB2 TYR A 98 57.988 4.070 -69.407 1.00 0.00 H new ATOM 0 HB3 TYR A 98 58.787 2.629 -68.807 1.00 0.00 H new ATOM 0 HD1 TYR A 98 56.854 4.021 -71.647 1.00 0.00 H new ATOM 0 HD2 TYR A 98 59.165 0.726 -70.250 1.00 0.00 H new ATOM 0 HE1 TYR A 98 56.979 3.142 -73.936 1.00 0.00 H new ATOM 0 HE2 TYR A 98 59.294 -0.156 -72.538 1.00 0.00 H new ATOM 0 HH TYR A 98 57.688 0.120 -74.716 1.00 0.00 H new ATOM 744 N GLU A 99 57.536 1.819 -66.507 1.00 0.00 N ATOM 745 CA GLU A 99 57.790 1.876 -65.072 1.00 0.00 C ATOM 746 C GLU A 99 59.197 1.381 -64.749 1.00 0.00 C ATOM 747 O GLU A 99 59.630 0.341 -65.246 1.00 0.00 O ATOM 748 CB GLU A 99 56.757 1.040 -64.315 1.00 0.00 C ATOM 749 CG GLU A 99 56.657 -0.395 -64.806 1.00 0.00 C ATOM 750 CD GLU A 99 55.503 -1.149 -64.173 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.633 -1.554 -62.999 1.00 0.00 O ATOM 752 OE2 GLU A 99 54.472 -1.334 -64.851 1.00 0.00 O ATOM 0 H GLU A 99 57.934 1.005 -66.974 1.00 0.00 H new ATOM 0 HA GLU A 99 57.707 2.916 -64.755 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.012 1.036 -63.255 1.00 0.00 H new ATOM 0 HB3 GLU A 99 55.780 1.515 -64.406 1.00 0.00 H new ATOM 0 HG2 GLU A 99 56.537 -0.397 -65.889 1.00 0.00 H new ATOM 0 HG3 GLU A 99 57.590 -0.916 -64.588 1.00 0.00 H new ATOM 759 N TYR A 100 59.906 2.134 -63.915 1.00 0.00 N ATOM 760 CA TYR A 100 61.264 1.775 -63.528 1.00 0.00 C ATOM 761 C TYR A 100 61.320 1.355 -62.062 1.00 0.00 C ATOM 762 O TYR A 100 60.308 1.372 -61.360 1.00 0.00 O ATOM 763 CB TYR A 100 62.214 2.949 -63.770 1.00 0.00 C ATOM 764 CG TYR A 100 62.261 3.402 -65.212 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.284 4.245 -65.728 1.00 0.00 C ATOM 766 CD2 TYR A 100 63.282 2.988 -66.058 1.00 0.00 C ATOM 767 CE1 TYR A 100 61.322 4.661 -67.044 1.00 0.00 C ATOM 768 CE2 TYR A 100 63.329 3.400 -67.375 1.00 0.00 C ATOM 769 CZ TYR A 100 62.347 4.236 -67.864 1.00 0.00 C ATOM 770 OH TYR A 100 62.390 4.648 -69.176 1.00 0.00 O ATOM 0 H TYR A 100 59.562 2.997 -63.494 1.00 0.00 H new ATOM 0 HA TYR A 100 61.578 0.930 -64.142 1.00 0.00 H new ATOM 0 HB2 TYR A 100 61.909 3.788 -63.144 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.218 2.664 -63.454 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.481 4.581 -65.088 1.00 0.00 H new ATOM 0 HD2 TYR A 100 64.052 2.333 -65.679 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.554 5.315 -67.429 1.00 0.00 H new ATOM 0 HE2 TYR A 100 64.131 3.069 -68.019 1.00 0.00 H new ATOM 0 HH TYR A 100 63.176 4.260 -69.615 1.00 0.00 H new ATOM 780 N LEU A 101 62.510 0.979 -61.606 1.00 0.00 N ATOM 781 CA LEU A 101 62.700 0.555 -60.223 1.00 0.00 C ATOM 782 C LEU A 101 63.653 1.495 -59.492 1.00 0.00 C ATOM 783 O LEU A 101 64.727 1.825 -59.998 1.00 0.00 O ATOM 784 CB LEU A 101 63.241 -0.875 -60.177 1.00 0.00 C ATOM 785 CG LEU A 101 62.576 -1.812 -59.168 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.858 -3.264 -59.522 1.00 0.00 C ATOM 787 CD2 LEU A 101 63.054 -1.502 -57.757 1.00 0.00 C ATOM 0 H LEU A 101 63.357 0.959 -62.173 1.00 0.00 H new ATOM 0 HA LEU A 101 61.732 0.587 -59.723 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.140 -1.312 -61.170 1.00 0.00 H new ATOM 0 HB3 LEU A 101 64.307 -0.832 -59.955 1.00 0.00 H new ATOM 0 HG LEU A 101 61.498 -1.653 -59.208 1.00 0.00 H new ATOM 0 HD11 LEU A 101 62.377 -3.916 -58.793 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.466 -3.479 -60.516 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.934 -3.439 -59.511 1.00 0.00 H new ATOM 0 HD21 LEU A 101 62.570 -2.178 -57.052 1.00 0.00 H new ATOM 0 HD22 LEU A 101 64.135 -1.633 -57.702 1.00 0.00 H new ATOM 0 HD23 LEU A 101 62.800 -0.473 -57.505 1.00 0.00 H new ATOM 799 N LEU A 102 63.256 1.921 -58.298 1.00 0.00 N ATOM 800 CA LEU A 102 64.076 2.821 -57.495 1.00 0.00 C ATOM 801 C LEU A 102 65.088 2.040 -56.663 1.00 0.00 C ATOM 802 O LEU A 102 64.797 0.946 -56.178 1.00 0.00 O ATOM 803 CB LEU A 102 63.191 3.668 -56.579 1.00 0.00 C ATOM 804 CG LEU A 102 62.020 4.386 -57.252 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.247 5.214 -56.238 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.517 5.263 -58.392 1.00 0.00 C ATOM 0 H LEU A 102 62.371 1.658 -57.865 1.00 0.00 H new ATOM 0 HA LEU A 102 64.621 3.478 -58.173 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.794 3.024 -55.794 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.817 4.415 -56.092 1.00 0.00 H new ATOM 0 HG LEU A 102 61.347 3.635 -57.665 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.418 5.717 -56.735 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.859 4.562 -55.456 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.909 5.958 -55.795 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.671 5.766 -58.860 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.212 6.007 -58.002 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.025 4.645 -59.132 1.00 0.00 H new ATOM 818 N LYS A 103 66.277 2.610 -56.499 1.00 0.00 N ATOM 819 CA LYS A 103 67.332 1.969 -55.723 1.00 0.00 C ATOM 820 C LYS A 103 67.811 2.883 -54.599 1.00 0.00 C ATOM 821 O LYS A 103 68.122 4.052 -54.827 1.00 0.00 O ATOM 822 CB LYS A 103 68.508 1.599 -56.630 1.00 0.00 C ATOM 823 CG LYS A 103 69.548 0.725 -55.951 1.00 0.00 C ATOM 824 CD LYS A 103 70.419 0.003 -56.965 1.00 0.00 C ATOM 825 CE LYS A 103 71.121 -1.195 -56.345 1.00 0.00 C ATOM 826 NZ LYS A 103 71.468 -2.223 -57.365 1.00 0.00 N ATOM 0 H LYS A 103 66.534 3.515 -56.893 1.00 0.00 H new ATOM 0 HA LYS A 103 66.923 1.061 -55.281 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.128 1.080 -57.510 1.00 0.00 H new ATOM 0 HB3 LYS A 103 68.987 2.513 -56.981 1.00 0.00 H new ATOM 0 HG2 LYS A 103 70.174 1.339 -55.304 1.00 0.00 H new ATOM 0 HG3 LYS A 103 69.050 -0.005 -55.313 1.00 0.00 H new ATOM 0 HD2 LYS A 103 69.806 -0.327 -57.803 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.161 0.693 -57.366 1.00 0.00 H new ATOM 0 HE2 LYS A 103 72.028 -0.863 -55.840 1.00 0.00 H new ATOM 0 HE3 LYS A 103 70.478 -1.640 -55.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 71.945 -3.023 -56.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 70.600 -2.558 -57.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 72.102 -1.806 -58.076 1.00 0.00 H new ATOM 840 N TRP A 104 67.871 2.342 -53.388 1.00 0.00 N ATOM 841 CA TRP A 104 68.314 3.108 -52.229 1.00 0.00 C ATOM 842 C TRP A 104 69.831 3.051 -52.087 1.00 0.00 C ATOM 843 O TRP A 104 70.446 2.011 -52.320 1.00 0.00 O ATOM 844 CB TRP A 104 67.650 2.580 -50.957 1.00 0.00 C ATOM 845 CG TRP A 104 66.159 2.472 -51.066 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.420 1.324 -51.094 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.227 3.554 -51.165 1.00 0.00 C ATOM 848 NE1 TRP A 104 64.084 1.627 -51.204 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.939 2.989 -51.248 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.354 4.946 -51.188 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.790 3.768 -51.354 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.212 5.717 -51.294 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.944 5.127 -51.375 1.00 0.00 C ATOM 0 H TRP A 104 67.618 1.375 -53.183 1.00 0.00 H new ATOM 0 HA TRP A 104 68.020 4.147 -52.378 1.00 0.00 H new ATOM 0 HB2 TRP A 104 68.062 1.599 -50.721 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.900 3.239 -50.125 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.826 0.325 -51.038 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.324 0.948 -51.246 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.327 5.410 -51.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.812 3.315 -51.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.299 6.793 -51.315 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.071 5.758 -51.456 1.00 0.00 H new ATOM 864 N GLU A 105 70.428 4.175 -51.702 1.00 0.00 N ATOM 865 CA GLU A 105 71.874 4.250 -51.529 1.00 0.00 C ATOM 866 C GLU A 105 72.288 3.712 -50.163 1.00 0.00 C ATOM 867 O GLU A 105 71.780 4.150 -49.131 1.00 0.00 O ATOM 868 CB GLU A 105 72.355 5.694 -51.687 1.00 0.00 C ATOM 869 CG GLU A 105 71.719 6.659 -50.700 1.00 0.00 C ATOM 870 CD GLU A 105 72.601 6.926 -49.496 1.00 0.00 C ATOM 871 OE1 GLU A 105 73.571 6.167 -49.290 1.00 0.00 O ATOM 872 OE2 GLU A 105 72.322 7.895 -48.759 1.00 0.00 O ATOM 0 H GLU A 105 69.933 5.045 -51.504 1.00 0.00 H new ATOM 0 HA GLU A 105 72.338 3.633 -52.299 1.00 0.00 H new ATOM 0 HB2 GLU A 105 73.438 5.723 -51.564 1.00 0.00 H new ATOM 0 HB3 GLU A 105 72.140 6.031 -52.701 1.00 0.00 H new ATOM 0 HG2 GLU A 105 71.505 7.601 -51.205 1.00 0.00 H new ATOM 0 HG3 GLU A 105 70.765 6.253 -50.364 1.00 0.00 H new ATOM 879 N GLY A 106 73.214 2.757 -50.165 1.00 0.00 N ATOM 880 CA GLY A 106 73.680 2.174 -48.920 1.00 0.00 C ATOM 881 C GLY A 106 72.889 0.943 -48.525 1.00 0.00 C ATOM 882 O GLY A 106 73.433 0.011 -47.932 1.00 0.00 O ATOM 0 H GLY A 106 73.649 2.377 -51.006 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.733 1.910 -49.018 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.610 2.917 -48.126 1.00 0.00 H new ATOM 886 N TYR A 107 71.602 0.939 -48.852 1.00 0.00 N ATOM 887 CA TYR A 107 70.733 -0.185 -48.524 1.00 0.00 C ATOM 888 C TYR A 107 70.458 -1.040 -49.758 1.00 0.00 C ATOM 889 O TYR A 107 69.990 -0.540 -50.781 1.00 0.00 O ATOM 890 CB TYR A 107 69.414 0.317 -47.934 1.00 0.00 C ATOM 891 CG TYR A 107 69.591 1.388 -46.881 1.00 0.00 C ATOM 892 CD1 TYR A 107 70.066 1.072 -45.614 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.282 2.715 -47.153 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.229 2.047 -44.649 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.443 3.697 -46.194 1.00 0.00 C ATOM 896 CZ TYR A 107 69.916 3.357 -44.944 1.00 0.00 C ATOM 897 OH TYR A 107 70.076 4.332 -43.985 1.00 0.00 O ATOM 0 H TYR A 107 71.137 1.702 -49.344 1.00 0.00 H new ATOM 0 HA TYR A 107 71.243 -0.801 -47.784 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.792 0.709 -48.738 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.877 -0.525 -47.497 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.312 0.047 -45.380 1.00 0.00 H new ATOM 0 HD2 TYR A 107 68.910 2.984 -48.131 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.600 1.785 -43.669 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.200 4.724 -46.422 1.00 0.00 H new ATOM 0 HH TYR A 107 69.812 5.200 -44.354 1.00 0.00 H new ATOM 907 N ASP A 108 70.753 -2.331 -49.652 1.00 0.00 N ATOM 908 CA ASP A 108 70.536 -3.257 -50.758 1.00 0.00 C ATOM 909 C ASP A 108 69.248 -4.050 -50.558 1.00 0.00 C ATOM 910 O ASP A 108 69.237 -5.073 -49.874 1.00 0.00 O ATOM 911 CB ASP A 108 71.723 -4.213 -50.890 1.00 0.00 C ATOM 912 CG ASP A 108 72.856 -3.621 -51.705 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.753 -2.438 -52.091 1.00 0.00 O ATOM 914 OD2 ASP A 108 73.844 -4.341 -51.958 1.00 0.00 O ATOM 0 H ASP A 108 71.143 -2.760 -48.813 1.00 0.00 H new ATOM 0 HA ASP A 108 70.444 -2.675 -51.675 1.00 0.00 H new ATOM 0 HB2 ASP A 108 72.090 -4.471 -49.897 1.00 0.00 H new ATOM 0 HB3 ASP A 108 71.389 -5.140 -51.357 1.00 0.00 H new ATOM 919 N ASP A 109 68.165 -3.570 -51.160 1.00 0.00 N ATOM 920 CA ASP A 109 66.871 -4.233 -51.049 1.00 0.00 C ATOM 921 C ASP A 109 66.697 -5.272 -52.152 1.00 0.00 C ATOM 922 O ASP A 109 67.364 -5.234 -53.186 1.00 0.00 O ATOM 923 CB ASP A 109 65.740 -3.206 -51.115 1.00 0.00 C ATOM 924 CG ASP A 109 65.273 -2.769 -49.741 1.00 0.00 C ATOM 925 OD1 ASP A 109 66.035 -2.056 -49.054 1.00 0.00 O ATOM 926 OD2 ASP A 109 64.146 -3.140 -49.352 1.00 0.00 O ATOM 0 H ASP A 109 68.158 -2.724 -51.730 1.00 0.00 H new ATOM 0 HA ASP A 109 66.832 -4.742 -50.086 1.00 0.00 H new ATOM 0 HB2 ASP A 109 66.078 -2.334 -51.675 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.899 -3.631 -51.663 1.00 0.00 H new ATOM 931 N PRO A 110 65.779 -6.225 -51.929 1.00 0.00 N ATOM 932 CA PRO A 110 65.496 -7.293 -52.892 1.00 0.00 C ATOM 933 C PRO A 110 64.796 -6.774 -54.143 1.00 0.00 C ATOM 934 O PRO A 110 64.759 -5.569 -54.391 1.00 0.00 O ATOM 935 CB PRO A 110 64.574 -8.236 -52.115 1.00 0.00 C ATOM 936 CG PRO A 110 63.926 -7.372 -51.089 1.00 0.00 C ATOM 937 CD PRO A 110 64.947 -6.332 -50.719 1.00 0.00 C ATOM 0 HA PRO A 110 66.408 -7.769 -53.253 1.00 0.00 H new ATOM 0 HB2 PRO A 110 63.834 -8.695 -52.770 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.136 -9.047 -51.652 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.022 -6.908 -51.484 1.00 0.00 H new ATOM 0 HG3 PRO A 110 63.630 -7.956 -50.217 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.478 -5.380 -50.468 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.535 -6.636 -49.853 1.00 0.00 H new ATOM 945 N SER A 111 64.241 -7.692 -54.929 1.00 0.00 N ATOM 946 CA SER A 111 63.544 -7.327 -56.156 1.00 0.00 C ATOM 947 C SER A 111 62.144 -6.803 -55.851 1.00 0.00 C ATOM 948 O SER A 111 61.402 -6.418 -56.756 1.00 0.00 O ATOM 949 CB SER A 111 63.457 -8.531 -57.096 1.00 0.00 C ATOM 950 OG SER A 111 64.472 -9.477 -56.807 1.00 0.00 O ATOM 0 H SER A 111 64.261 -8.694 -54.737 1.00 0.00 H new ATOM 0 HA SER A 111 64.111 -6.534 -56.644 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.479 -9.002 -57.000 1.00 0.00 H new ATOM 0 HB3 SER A 111 63.550 -8.197 -58.129 1.00 0.00 H new ATOM 0 HG SER A 111 64.394 -10.238 -57.420 1.00 0.00 H new ATOM 956 N ASP A 112 61.789 -6.793 -54.571 1.00 0.00 N ATOM 957 CA ASP A 112 60.478 -6.316 -54.145 1.00 0.00 C ATOM 958 C ASP A 112 60.519 -4.824 -53.831 1.00 0.00 C ATOM 959 O ASP A 112 59.610 -4.288 -53.198 1.00 0.00 O ATOM 960 CB ASP A 112 60.003 -7.096 -52.918 1.00 0.00 C ATOM 961 CG ASP A 112 59.420 -8.447 -53.280 1.00 0.00 C ATOM 962 OD1 ASP A 112 58.697 -8.529 -54.296 1.00 0.00 O ATOM 963 OD2 ASP A 112 59.688 -9.424 -52.550 1.00 0.00 O ATOM 0 H ASP A 112 62.390 -7.110 -53.810 1.00 0.00 H new ATOM 0 HA ASP A 112 59.776 -6.477 -54.963 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.840 -7.236 -52.234 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.253 -6.510 -52.387 1.00 0.00 H new ATOM 968 N ASN A 113 61.579 -4.159 -54.277 1.00 0.00 N ATOM 969 CA ASN A 113 61.739 -2.729 -54.042 1.00 0.00 C ATOM 970 C ASN A 113 60.544 -1.951 -54.585 1.00 0.00 C ATOM 971 O ASN A 113 59.591 -2.536 -55.101 1.00 0.00 O ATOM 972 CB ASN A 113 63.028 -2.225 -54.694 1.00 0.00 C ATOM 973 CG ASN A 113 64.140 -2.010 -53.685 1.00 0.00 C ATOM 974 OD1 ASN A 113 65.258 -2.495 -53.863 1.00 0.00 O ATOM 975 ND2 ASN A 113 63.838 -1.280 -52.618 1.00 0.00 N ATOM 0 H ASN A 113 62.340 -4.588 -54.803 1.00 0.00 H new ATOM 0 HA ASN A 113 61.797 -2.568 -52.966 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.357 -2.943 -55.446 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.827 -1.288 -55.214 1.00 0.00 H new ATOM 0 HD21 ASN A 113 64.545 -1.102 -51.905 1.00 0.00 H new ATOM 0 HD22 ASN A 113 62.899 -0.897 -52.511 1.00 0.00 H new ATOM 982 N THR A 114 60.602 -0.628 -54.467 1.00 0.00 N ATOM 983 CA THR A 114 59.525 0.230 -54.945 1.00 0.00 C ATOM 984 C THR A 114 59.691 0.547 -56.426 1.00 0.00 C ATOM 985 O THR A 114 60.798 0.819 -56.892 1.00 0.00 O ATOM 986 CB THR A 114 59.465 1.549 -54.152 1.00 0.00 C ATOM 987 OG1 THR A 114 58.199 2.186 -54.357 1.00 0.00 O ATOM 988 CG2 THR A 114 60.584 2.488 -54.578 1.00 0.00 C ATOM 0 H THR A 114 61.384 -0.127 -54.044 1.00 0.00 H new ATOM 0 HA THR A 114 58.594 -0.317 -54.796 1.00 0.00 H new ATOM 0 HB THR A 114 59.589 1.317 -53.094 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.168 3.023 -53.848 1.00 0.00 H new ATOM 0 HG21 THR A 114 60.521 3.413 -54.004 1.00 0.00 H new ATOM 0 HG22 THR A 114 61.548 2.012 -54.395 1.00 0.00 H new ATOM 0 HG23 THR A 114 60.486 2.713 -55.640 1.00 0.00 H new ATOM 996 N TRP A 115 58.586 0.510 -57.162 1.00 0.00 N ATOM 997 CA TRP A 115 58.610 0.794 -58.592 1.00 0.00 C ATOM 998 C TRP A 115 58.043 2.180 -58.881 1.00 0.00 C ATOM 999 O TRP A 115 56.940 2.512 -58.448 1.00 0.00 O ATOM 1000 CB TRP A 115 57.815 -0.265 -59.357 1.00 0.00 C ATOM 1001 CG TRP A 115 58.325 -1.659 -59.145 1.00 0.00 C ATOM 1002 CD1 TRP A 115 58.260 -2.388 -57.992 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.978 -2.488 -60.112 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.835 -3.622 -58.184 1.00 0.00 N ATOM 1005 CE2 TRP A 115 59.282 -3.708 -59.476 1.00 0.00 C ATOM 1006 CE3 TRP A 115 59.334 -2.320 -61.452 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.925 -4.751 -60.137 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.973 -3.356 -62.107 1.00 0.00 C ATOM 1009 CH2 TRP A 115 60.263 -4.559 -61.449 1.00 0.00 C ATOM 0 H TRP A 115 57.662 0.286 -56.792 1.00 0.00 H new ATOM 0 HA TRP A 115 59.648 0.769 -58.925 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.770 -0.217 -59.050 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.845 -0.033 -60.422 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.822 -2.046 -57.066 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.916 -4.355 -57.479 1.00 0.00 H new ATOM 0 HE3 TRP A 115 59.114 -1.397 -61.967 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 60.149 -5.679 -59.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 60.253 -3.236 -63.143 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.763 -5.350 -61.988 1.00 0.00 H new ATOM 1020 N SER A 116 58.805 2.985 -59.615 1.00 0.00 N ATOM 1021 CA SER A 116 58.380 4.337 -59.958 1.00 0.00 C ATOM 1022 C SER A 116 57.882 4.400 -61.399 1.00 0.00 C ATOM 1023 O SER A 116 58.375 3.684 -62.270 1.00 0.00 O ATOM 1024 CB SER A 116 59.533 5.322 -59.762 1.00 0.00 C ATOM 1025 OG SER A 116 59.517 5.873 -58.456 1.00 0.00 O ATOM 0 H SER A 116 59.720 2.724 -59.983 1.00 0.00 H new ATOM 0 HA SER A 116 57.560 4.613 -59.295 1.00 0.00 H new ATOM 0 HB2 SER A 116 60.482 4.815 -59.934 1.00 0.00 H new ATOM 0 HB3 SER A 116 59.461 6.122 -60.499 1.00 0.00 H new ATOM 0 HG SER A 116 58.855 5.400 -57.910 1.00 0.00 H new ATOM 1031 N SER A 117 56.899 5.262 -61.641 1.00 0.00 N ATOM 1032 CA SER A 117 56.330 5.417 -62.975 1.00 0.00 C ATOM 1033 C SER A 117 57.178 6.362 -63.821 1.00 0.00 C ATOM 1034 O SER A 117 58.207 6.863 -63.368 1.00 0.00 O ATOM 1035 CB SER A 117 54.897 5.944 -62.883 1.00 0.00 C ATOM 1036 OG SER A 117 54.077 5.063 -62.135 1.00 0.00 O ATOM 0 H SER A 117 56.480 5.863 -60.931 1.00 0.00 H new ATOM 0 HA SER A 117 56.320 4.438 -63.455 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.898 6.929 -62.417 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.486 6.066 -63.885 1.00 0.00 H new ATOM 0 HG SER A 117 53.167 5.423 -62.089 1.00 0.00 H new ATOM 1042 N GLU A 118 56.738 6.600 -65.053 1.00 0.00 N ATOM 1043 CA GLU A 118 57.457 7.484 -65.963 1.00 0.00 C ATOM 1044 C GLU A 118 57.480 8.913 -65.428 1.00 0.00 C ATOM 1045 O GLU A 118 58.504 9.592 -65.486 1.00 0.00 O ATOM 1046 CB GLU A 118 56.812 7.457 -67.350 1.00 0.00 C ATOM 1047 CG GLU A 118 57.332 8.538 -68.283 1.00 0.00 C ATOM 1048 CD GLU A 118 56.960 8.287 -69.732 1.00 0.00 C ATOM 1049 OE1 GLU A 118 57.130 7.140 -70.197 1.00 0.00 O ATOM 1050 OE2 GLU A 118 56.499 9.235 -70.400 1.00 0.00 O ATOM 0 H GLU A 118 55.888 6.193 -65.443 1.00 0.00 H new ATOM 0 HA GLU A 118 58.484 7.127 -66.041 1.00 0.00 H new ATOM 0 HB2 GLU A 118 56.987 6.482 -67.804 1.00 0.00 H new ATOM 0 HB3 GLU A 118 55.733 7.570 -67.242 1.00 0.00 H new ATOM 0 HG2 GLU A 118 56.934 9.504 -67.972 1.00 0.00 H new ATOM 0 HG3 GLU A 118 58.417 8.597 -68.195 1.00 0.00 H new ATOM 1057 N ALA A 119 56.342 9.362 -64.907 1.00 0.00 N ATOM 1058 CA ALA A 119 56.232 10.709 -64.361 1.00 0.00 C ATOM 1059 C ALA A 119 57.256 10.939 -63.255 1.00 0.00 C ATOM 1060 O ALA A 119 57.628 12.076 -62.967 1.00 0.00 O ATOM 1061 CB ALA A 119 54.824 10.952 -63.837 1.00 0.00 C ATOM 0 H ALA A 119 55.484 8.813 -64.852 1.00 0.00 H new ATOM 0 HA ALA A 119 56.438 11.417 -65.164 1.00 0.00 H new ATOM 0 HB1 ALA A 119 54.756 11.962 -63.432 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.108 10.838 -64.651 1.00 0.00 H new ATOM 0 HB3 ALA A 119 54.598 10.230 -63.052 1.00 0.00 H new ATOM 1067 N ASP A 120 57.709 9.852 -62.639 1.00 0.00 N ATOM 1068 CA ASP A 120 58.691 9.935 -61.565 1.00 0.00 C ATOM 1069 C ASP A 120 60.090 10.176 -62.125 1.00 0.00 C ATOM 1070 O ASP A 120 60.981 10.643 -61.415 1.00 0.00 O ATOM 1071 CB ASP A 120 58.676 8.653 -60.731 1.00 0.00 C ATOM 1072 CG ASP A 120 58.719 8.931 -59.241 1.00 0.00 C ATOM 1073 OD1 ASP A 120 59.800 9.301 -58.737 1.00 0.00 O ATOM 1074 OD2 ASP A 120 57.671 8.780 -58.580 1.00 0.00 O ATOM 0 H ASP A 120 57.411 8.903 -62.866 1.00 0.00 H new ATOM 0 HA ASP A 120 58.424 10.777 -60.927 1.00 0.00 H new ATOM 0 HB2 ASP A 120 57.778 8.081 -60.965 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.529 8.034 -61.007 1.00 0.00 H new ATOM 1079 N CYS A 121 60.274 9.854 -63.400 1.00 0.00 N ATOM 1080 CA CYS A 121 61.565 10.033 -64.055 1.00 0.00 C ATOM 1081 C CYS A 121 61.965 11.505 -64.075 1.00 0.00 C ATOM 1082 O CYS A 121 63.130 11.839 -64.286 1.00 0.00 O ATOM 1083 CB CYS A 121 61.516 9.486 -65.483 1.00 0.00 C ATOM 1084 SG CYS A 121 61.152 7.718 -65.584 1.00 0.00 S ATOM 0 H CYS A 121 59.546 9.468 -64.001 1.00 0.00 H new ATOM 0 HA CYS A 121 62.313 9.480 -63.487 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.760 10.034 -66.045 1.00 0.00 H new ATOM 0 HB3 CYS A 121 62.474 9.677 -65.967 1.00 0.00 H new ATOM 0 HG CYS A 121 61.643 7.236 -66.687 1.00 0.00 H new ATOM 1090 N SER A 122 60.989 12.381 -63.856 1.00 0.00 N ATOM 1091 CA SER A 122 61.238 13.818 -63.854 1.00 0.00 C ATOM 1092 C SER A 122 62.190 14.202 -62.725 1.00 0.00 C ATOM 1093 O SER A 122 62.759 15.293 -62.723 1.00 0.00 O ATOM 1094 CB SER A 122 59.922 14.584 -63.710 1.00 0.00 C ATOM 1095 OG SER A 122 60.099 15.960 -63.999 1.00 0.00 O ATOM 0 H SER A 122 60.019 12.121 -63.678 1.00 0.00 H new ATOM 0 HA SER A 122 61.702 14.084 -64.804 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.176 14.161 -64.383 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.539 14.468 -62.696 1.00 0.00 H new ATOM 0 HG SER A 122 60.941 16.271 -63.606 1.00 0.00 H new ATOM 1101 N GLY A 123 62.358 13.297 -61.766 1.00 0.00 N ATOM 1102 CA GLY A 123 63.241 13.559 -60.645 1.00 0.00 C ATOM 1103 C GLY A 123 64.503 12.720 -60.692 1.00 0.00 C ATOM 1104 O GLY A 123 65.595 13.215 -60.413 1.00 0.00 O ATOM 0 H GLY A 123 61.898 12.387 -61.745 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.511 14.615 -60.638 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.710 13.359 -59.714 1.00 0.00 H new ATOM 1108 N CYS A 124 64.353 11.449 -61.045 1.00 0.00 N ATOM 1109 CA CYS A 124 65.490 10.538 -61.125 1.00 0.00 C ATOM 1110 C CYS A 124 65.924 10.337 -62.574 1.00 0.00 C ATOM 1111 O CYS A 124 66.462 9.289 -62.932 1.00 0.00 O ATOM 1112 CB CYS A 124 65.137 9.191 -60.494 1.00 0.00 C ATOM 1113 SG CYS A 124 63.741 8.351 -61.278 1.00 0.00 S ATOM 0 H CYS A 124 63.456 11.025 -61.281 1.00 0.00 H new ATOM 0 HA CYS A 124 66.319 10.982 -60.574 1.00 0.00 H new ATOM 0 HB2 CYS A 124 66.011 8.541 -60.540 1.00 0.00 H new ATOM 0 HB3 CYS A 124 64.909 9.345 -59.439 1.00 0.00 H new ATOM 0 HG CYS A 124 62.726 9.161 -61.338 1.00 0.00 H new ATOM 1119 N LYS A 125 65.684 11.346 -63.403 1.00 0.00 N ATOM 1120 CA LYS A 125 66.049 11.282 -64.814 1.00 0.00 C ATOM 1121 C LYS A 125 67.496 10.830 -64.981 1.00 0.00 C ATOM 1122 O LYS A 125 67.789 9.943 -65.782 1.00 0.00 O ATOM 1123 CB LYS A 125 65.849 12.646 -65.476 1.00 0.00 C ATOM 1124 CG LYS A 125 66.484 13.794 -64.710 1.00 0.00 C ATOM 1125 CD LYS A 125 66.132 15.138 -65.325 1.00 0.00 C ATOM 1126 CE LYS A 125 64.976 15.800 -64.592 1.00 0.00 C ATOM 1127 NZ LYS A 125 65.357 16.215 -63.214 1.00 0.00 N ATOM 0 H LYS A 125 65.238 12.219 -63.123 1.00 0.00 H new ATOM 0 HA LYS A 125 65.401 10.552 -65.299 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.267 12.617 -66.482 1.00 0.00 H new ATOM 0 HB3 LYS A 125 64.781 12.837 -65.580 1.00 0.00 H new ATOM 0 HG2 LYS A 125 66.150 13.769 -63.673 1.00 0.00 H new ATOM 0 HG3 LYS A 125 67.567 13.670 -64.699 1.00 0.00 H new ATOM 0 HD2 LYS A 125 67.004 15.792 -65.297 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.869 15.002 -66.374 1.00 0.00 H new ATOM 0 HE2 LYS A 125 64.641 16.672 -65.154 1.00 0.00 H new ATOM 0 HE3 LYS A 125 64.134 15.110 -64.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 64.606 15.941 -62.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 66.246 15.747 -62.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 65.486 17.247 -63.185 1.00 0.00 H new ATOM 1141 N GLN A 126 68.395 11.445 -64.219 1.00 0.00 N ATOM 1142 CA GLN A 126 69.811 11.105 -64.284 1.00 0.00 C ATOM 1143 C GLN A 126 70.017 9.601 -64.131 1.00 0.00 C ATOM 1144 O GLN A 126 70.849 9.005 -64.817 1.00 0.00 O ATOM 1145 CB GLN A 126 70.587 11.851 -63.196 1.00 0.00 C ATOM 1146 CG GLN A 126 70.110 11.540 -61.787 1.00 0.00 C ATOM 1147 CD GLN A 126 70.169 12.746 -60.871 1.00 0.00 C ATOM 1148 OE1 GLN A 126 70.901 13.702 -61.132 1.00 0.00 O ATOM 1149 NE2 GLN A 126 69.397 12.709 -59.791 1.00 0.00 N ATOM 0 H GLN A 126 68.168 12.181 -63.550 1.00 0.00 H new ATOM 0 HA GLN A 126 70.187 11.408 -65.261 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.644 11.598 -63.277 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.502 12.923 -63.371 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.086 11.169 -61.828 1.00 0.00 H new ATOM 0 HG3 GLN A 126 70.722 10.741 -61.369 1.00 0.00 H new ATOM 0 HE21 GLN A 126 68.806 11.897 -59.614 1.00 0.00 H new ATOM 0 HE22 GLN A 126 69.395 13.493 -59.138 1.00 0.00 H new ATOM 1158 N LEU A 127 69.256 8.993 -63.228 1.00 0.00 N ATOM 1159 CA LEU A 127 69.355 7.558 -62.985 1.00 0.00 C ATOM 1160 C LEU A 127 68.810 6.766 -64.169 1.00 0.00 C ATOM 1161 O LEU A 127 69.432 5.806 -64.624 1.00 0.00 O ATOM 1162 CB LEU A 127 68.594 7.183 -61.712 1.00 0.00 C ATOM 1163 CG LEU A 127 68.885 8.039 -60.479 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.268 7.414 -59.237 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.385 8.221 -60.298 1.00 0.00 C ATOM 0 H LEU A 127 68.563 9.471 -62.652 1.00 0.00 H new ATOM 0 HA LEU A 127 70.408 7.308 -62.859 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.526 7.236 -61.922 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.820 6.145 -61.470 1.00 0.00 H new ATOM 0 HG LEU A 127 68.435 9.021 -60.628 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.486 8.037 -58.370 1.00 0.00 H new ATOM 0 HD12 LEU A 127 67.188 7.337 -59.367 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.687 6.420 -59.084 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.573 8.833 -59.416 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.857 7.247 -60.172 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.800 8.714 -61.177 1.00 0.00 H new ATOM 1177 N ILE A 128 67.647 7.176 -64.663 1.00 0.00 N ATOM 1178 CA ILE A 128 67.020 6.507 -65.796 1.00 0.00 C ATOM 1179 C ILE A 128 67.987 6.392 -66.970 1.00 0.00 C ATOM 1180 O ILE A 128 68.138 5.322 -67.559 1.00 0.00 O ATOM 1181 CB ILE A 128 65.754 7.251 -66.260 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.770 7.400 -65.099 1.00 0.00 C ATOM 1183 CG2 ILE A 128 65.104 6.516 -67.422 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.256 6.080 -64.569 1.00 0.00 C ATOM 0 H ILE A 128 67.120 7.968 -64.296 1.00 0.00 H new ATOM 0 HA ILE A 128 66.741 5.509 -65.458 1.00 0.00 H new ATOM 0 HB ILE A 128 66.039 8.247 -66.600 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.256 7.943 -64.289 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.924 8.005 -65.426 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.211 7.054 -67.739 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.806 6.457 -68.254 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.829 5.509 -67.108 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.563 6.263 -63.747 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.741 5.544 -65.366 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.093 5.481 -64.211 1.00 0.00 H new ATOM 1196 N GLU A 129 68.642 7.500 -67.302 1.00 0.00 N ATOM 1197 CA GLU A 129 69.595 7.522 -68.404 1.00 0.00 C ATOM 1198 C GLU A 129 70.875 6.779 -68.032 1.00 0.00 C ATOM 1199 O GLU A 129 71.463 6.081 -68.858 1.00 0.00 O ATOM 1200 CB GLU A 129 69.925 8.965 -68.794 1.00 0.00 C ATOM 1201 CG GLU A 129 70.544 9.773 -67.666 1.00 0.00 C ATOM 1202 CD GLU A 129 70.779 11.222 -68.047 1.00 0.00 C ATOM 1203 OE1 GLU A 129 70.034 11.738 -68.906 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.707 11.840 -67.485 1.00 0.00 O ATOM 0 H GLU A 129 68.530 8.394 -66.823 1.00 0.00 H new ATOM 0 HA GLU A 129 69.138 7.018 -69.256 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.610 8.956 -69.642 1.00 0.00 H new ATOM 0 HB3 GLU A 129 69.013 9.460 -69.127 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.891 9.732 -66.794 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.492 9.319 -67.377 1.00 0.00 H new ATOM 1211 N ALA A 130 71.301 6.935 -66.783 1.00 0.00 N ATOM 1212 CA ALA A 130 72.509 6.278 -66.300 1.00 0.00 C ATOM 1213 C ALA A 130 72.399 4.763 -66.428 1.00 0.00 C ATOM 1214 O ALA A 130 73.287 4.110 -66.978 1.00 0.00 O ATOM 1215 CB ALA A 130 72.780 6.669 -64.855 1.00 0.00 C ATOM 0 H ALA A 130 70.827 7.511 -66.087 1.00 0.00 H new ATOM 0 HA ALA A 130 73.344 6.608 -66.918 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.685 6.171 -64.507 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.912 7.749 -64.789 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.938 6.367 -64.232 1.00 0.00 H new ATOM 1221 N TYR A 131 71.305 4.208 -65.918 1.00 0.00 N ATOM 1222 CA TYR A 131 71.080 2.769 -65.973 1.00 0.00 C ATOM 1223 C TYR A 131 71.150 2.261 -67.410 1.00 0.00 C ATOM 1224 O TYR A 131 71.674 1.178 -67.672 1.00 0.00 O ATOM 1225 CB TYR A 131 69.722 2.419 -65.362 1.00 0.00 C ATOM 1226 CG TYR A 131 69.483 0.933 -65.227 1.00 0.00 C ATOM 1227 CD1 TYR A 131 68.971 0.192 -66.285 1.00 0.00 C ATOM 1228 CD2 TYR A 131 69.771 0.268 -64.041 1.00 0.00 C ATOM 1229 CE1 TYR A 131 68.751 -1.167 -66.165 1.00 0.00 C ATOM 1230 CE2 TYR A 131 69.556 -1.090 -63.912 1.00 0.00 C ATOM 1231 CZ TYR A 131 69.045 -1.803 -64.977 1.00 0.00 C ATOM 1232 OH TYR A 131 68.828 -3.156 -64.854 1.00 0.00 O ATOM 0 H TYR A 131 70.560 4.734 -65.461 1.00 0.00 H new ATOM 0 HA TYR A 131 71.866 2.282 -65.396 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.646 2.881 -64.378 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.934 2.851 -65.979 1.00 0.00 H new ATOM 0 HD1 TYR A 131 68.741 0.687 -67.217 1.00 0.00 H new ATOM 0 HD2 TYR A 131 70.170 0.823 -63.205 1.00 0.00 H new ATOM 0 HE1 TYR A 131 68.351 -1.728 -66.997 1.00 0.00 H new ATOM 0 HE2 TYR A 131 69.786 -1.591 -62.983 1.00 0.00 H new ATOM 0 HH TYR A 131 69.088 -3.449 -63.956 1.00 0.00 H new ATOM 1242 N TRP A 132 70.619 3.051 -68.336 1.00 0.00 N ATOM 1243 CA TRP A 132 70.621 2.683 -69.747 1.00 0.00 C ATOM 1244 C TRP A 132 72.033 2.736 -70.321 1.00 0.00 C ATOM 1245 O TRP A 132 72.423 1.878 -71.113 1.00 0.00 O ATOM 1246 CB TRP A 132 69.700 3.612 -70.539 1.00 0.00 C ATOM 1247 CG TRP A 132 68.282 3.131 -70.601 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.180 3.761 -70.096 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.814 1.918 -71.200 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.055 3.012 -70.346 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.417 1.877 -71.022 1.00 0.00 C ATOM 1252 CE3 TRP A 132 68.438 0.864 -71.872 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.638 0.823 -71.491 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 67.664 -0.182 -72.336 1.00 0.00 C ATOM 1255 CH2 TRP A 132 66.276 -0.196 -72.144 1.00 0.00 C ATOM 0 H TRP A 132 70.182 3.950 -68.135 1.00 0.00 H new ATOM 0 HA TRP A 132 70.253 1.661 -69.831 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.720 4.604 -70.087 1.00 0.00 H new ATOM 0 HB3 TRP A 132 70.086 3.716 -71.553 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.191 4.708 -69.577 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.104 3.261 -70.072 1.00 0.00 H new ATOM 0 HE3 TRP A 132 69.507 0.867 -72.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.568 0.810 -71.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 68.137 -1.003 -72.855 1.00 0.00 H new ATOM 0 HH2 TRP A 132 65.698 -1.028 -72.519 1.00 0.00 H new ATOM 1266 N ASN A 133 72.794 3.747 -69.917 1.00 0.00 N ATOM 1267 CA ASN A 133 74.163 3.911 -70.393 1.00 0.00 C ATOM 1268 C ASN A 133 75.050 2.772 -69.901 1.00 0.00 C ATOM 1269 O ASN A 133 76.032 2.413 -70.549 1.00 0.00 O ATOM 1270 CB ASN A 133 74.731 5.253 -69.925 1.00 0.00 C ATOM 1271 CG ASN A 133 76.231 5.346 -70.122 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.724 5.307 -71.250 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.966 5.470 -69.023 1.00 0.00 N ATOM 0 H ASN A 133 72.487 4.465 -69.261 1.00 0.00 H new ATOM 0 HA ASN A 133 74.147 3.891 -71.483 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.245 6.061 -70.472 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.496 5.396 -68.870 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.981 5.537 -69.093 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.515 5.498 -68.108 1.00 0.00 H new ATOM 1280 N GLU A 134 74.695 2.207 -68.751 1.00 0.00 N ATOM 1281 CA GLU A 134 75.460 1.108 -68.172 1.00 0.00 C ATOM 1282 C GLU A 134 75.474 -0.097 -69.108 1.00 0.00 C ATOM 1283 O GLU A 134 76.395 -0.913 -69.074 1.00 0.00 O ATOM 1284 CB GLU A 134 74.873 0.708 -66.817 1.00 0.00 C ATOM 1285 CG GLU A 134 75.322 1.600 -65.672 1.00 0.00 C ATOM 1286 CD GLU A 134 75.293 0.890 -64.332 1.00 0.00 C ATOM 1287 OE1 GLU A 134 76.007 -0.123 -64.183 1.00 0.00 O ATOM 1288 OE2 GLU A 134 74.555 1.347 -63.434 1.00 0.00 O ATOM 0 H GLU A 134 73.884 2.492 -68.202 1.00 0.00 H new ATOM 0 HA GLU A 134 76.486 1.448 -68.030 1.00 0.00 H new ATOM 0 HB2 GLU A 134 73.785 0.732 -66.880 1.00 0.00 H new ATOM 0 HB3 GLU A 134 75.156 -0.321 -66.597 1.00 0.00 H new ATOM 0 HG2 GLU A 134 76.334 1.955 -65.869 1.00 0.00 H new ATOM 0 HG3 GLU A 134 74.678 2.479 -65.627 1.00 0.00 H new ATOM 1295 N HIS A 135 74.446 -0.201 -69.944 1.00 0.00 N ATOM 1296 CA HIS A 135 74.339 -1.306 -70.890 1.00 0.00 C ATOM 1297 C HIS A 135 75.031 -0.963 -72.206 1.00 0.00 C ATOM 1298 O HIS A 135 75.500 -1.848 -72.922 1.00 0.00 O ATOM 1299 CB HIS A 135 72.871 -1.646 -71.147 1.00 0.00 C ATOM 1300 CG HIS A 135 72.663 -3.019 -71.709 1.00 0.00 C ATOM 1301 ND1 HIS A 135 72.204 -3.246 -72.989 1.00 0.00 N ATOM 1302 CD2 HIS A 135 72.855 -4.240 -71.157 1.00 0.00 C ATOM 1303 CE1 HIS A 135 72.122 -4.548 -73.200 1.00 0.00 C ATOM 1304 NE2 HIS A 135 72.512 -5.173 -72.104 1.00 0.00 N ATOM 0 H HIS A 135 73.676 0.466 -69.986 1.00 0.00 H new ATOM 0 HA HIS A 135 74.834 -2.174 -70.454 1.00 0.00 H new ATOM 0 HB2 HIS A 135 72.317 -1.557 -70.212 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.452 -0.913 -71.836 1.00 0.00 H new ATOM 0 HD2 HIS A 135 73.212 -4.442 -70.158 1.00 0.00 H new ATOM 0 HE1 HIS A 135 71.792 -5.021 -74.113 1.00 0.00 H new ATOM 0 HE2 HIS A 135 72.552 -6.185 -71.981 1.00 0.00 H new ATOM 1312 N GLY A 136 75.092 0.327 -72.519 1.00 0.00 N ATOM 1313 CA GLY A 136 75.728 0.764 -73.748 1.00 0.00 C ATOM 1314 C GLY A 136 74.724 1.196 -74.799 1.00 0.00 C ATOM 1315 O GLY A 136 74.903 0.929 -75.986 1.00 0.00 O ATOM 0 H GLY A 136 74.712 1.078 -71.943 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.401 1.593 -73.530 1.00 0.00 H new ATOM 0 HA3 GLY A 136 76.339 -0.046 -74.145 1.00 0.00 H new