USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=16 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+ -155:sc= -0.0663 (180deg=-0.409) USER MOD Single : A 88 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.436) USER MOD Single : A 89 HIS : no HE2:sc= 0.0903 K(o=0.09,f=-6!) USER MOD Single : A 91 MET CE :methyl -160:sc= -0.0296 (180deg=-0.317) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.029 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= 0.119 USER MOD Single : A 113 ASN : amide:sc= -1.82 K(o=-1.8,f=-4.5!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -52:sc= 1.26 USER MOD Single : A 117 SER OG : rot -38:sc= 0.641 USER MOD Single : A 121 CYS SG : rot -155:sc= -1.12 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 117:sc= 0.491 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 131 TYR OH : rot 61:sc= 0.669 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 135 HIS : no HE2:sc= -0.0199 K(o=-0.02,f=-0.59) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 67.494 8.579 -49.828 1.00 0.00 N ATOM 463 CA VAL A 82 67.326 9.236 -51.118 1.00 0.00 C ATOM 464 C VAL A 82 67.552 8.259 -52.266 1.00 0.00 C ATOM 465 O VAL A 82 68.324 7.307 -52.143 1.00 0.00 O ATOM 466 CB VAL A 82 68.292 10.425 -51.273 1.00 0.00 C ATOM 467 CG1 VAL A 82 67.969 11.216 -52.531 1.00 0.00 C ATOM 468 CG2 VAL A 82 68.238 11.319 -50.043 1.00 0.00 C ATOM 0 HA VAL A 82 66.301 9.604 -51.154 1.00 0.00 H new ATOM 0 HB VAL A 82 69.306 10.036 -51.368 1.00 0.00 H new ATOM 0 HG11 VAL A 82 68.662 12.052 -52.623 1.00 0.00 H new ATOM 0 HG12 VAL A 82 68.064 10.568 -53.402 1.00 0.00 H new ATOM 0 HG13 VAL A 82 66.949 11.596 -52.470 1.00 0.00 H new ATOM 0 HG21 VAL A 82 68.927 12.154 -50.170 1.00 0.00 H new ATOM 0 HG22 VAL A 82 67.225 11.700 -49.915 1.00 0.00 H new ATOM 0 HG23 VAL A 82 68.523 10.744 -49.162 1.00 0.00 H new ATOM 478 N VAL A 83 66.874 8.499 -53.384 1.00 0.00 N ATOM 479 CA VAL A 83 67.002 7.641 -54.556 1.00 0.00 C ATOM 480 C VAL A 83 68.429 7.653 -55.092 1.00 0.00 C ATOM 481 O VAL A 83 68.925 8.685 -55.542 1.00 0.00 O ATOM 482 CB VAL A 83 66.040 8.076 -55.677 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.019 7.043 -56.793 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.642 8.302 -55.122 1.00 0.00 C ATOM 0 H VAL A 83 66.230 9.281 -53.503 1.00 0.00 H new ATOM 0 HA VAL A 83 66.745 6.630 -54.239 1.00 0.00 H new ATOM 0 HB VAL A 83 66.397 9.018 -56.093 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.334 7.367 -57.576 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.021 6.936 -57.209 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.687 6.084 -56.395 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.976 8.609 -55.928 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.273 7.377 -54.678 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.674 9.082 -54.361 1.00 0.00 H new ATOM 494 N GLU A 84 69.084 6.497 -55.041 1.00 0.00 N ATOM 495 CA GLU A 84 70.455 6.375 -55.522 1.00 0.00 C ATOM 496 C GLU A 84 70.485 6.166 -57.033 1.00 0.00 C ATOM 497 O GLU A 84 71.178 6.882 -57.757 1.00 0.00 O ATOM 498 CB GLU A 84 71.163 5.213 -54.822 1.00 0.00 C ATOM 499 CG GLU A 84 72.641 5.109 -55.158 1.00 0.00 C ATOM 500 CD GLU A 84 73.471 6.179 -54.475 1.00 0.00 C ATOM 501 OE1 GLU A 84 73.216 7.376 -54.726 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.375 5.821 -53.692 1.00 0.00 O ATOM 0 H GLU A 84 68.688 5.633 -54.672 1.00 0.00 H new ATOM 0 HA GLU A 84 70.978 7.303 -55.290 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.051 5.327 -53.744 1.00 0.00 H new ATOM 0 HB3 GLU A 84 70.670 4.280 -55.096 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.009 4.126 -54.863 1.00 0.00 H new ATOM 0 HG3 GLU A 84 72.771 5.187 -56.237 1.00 0.00 H new ATOM 509 N LYS A 85 69.729 5.180 -57.504 1.00 0.00 N ATOM 510 CA LYS A 85 69.667 4.875 -58.928 1.00 0.00 C ATOM 511 C LYS A 85 68.563 3.863 -59.220 1.00 0.00 C ATOM 512 O LYS A 85 67.923 3.346 -58.305 1.00 0.00 O ATOM 513 CB LYS A 85 71.013 4.332 -59.414 1.00 0.00 C ATOM 514 CG LYS A 85 71.290 2.907 -58.968 1.00 0.00 C ATOM 515 CD LYS A 85 72.760 2.702 -58.639 1.00 0.00 C ATOM 516 CE LYS A 85 73.528 2.160 -59.835 1.00 0.00 C ATOM 517 NZ LYS A 85 73.108 0.774 -60.182 1.00 0.00 N ATOM 0 H LYS A 85 69.150 4.578 -56.919 1.00 0.00 H new ATOM 0 HA LYS A 85 69.441 5.798 -59.462 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.041 4.375 -60.503 1.00 0.00 H new ATOM 0 HB3 LYS A 85 71.810 4.980 -59.049 1.00 0.00 H new ATOM 0 HG2 LYS A 85 70.684 2.675 -58.092 1.00 0.00 H new ATOM 0 HG3 LYS A 85 70.992 2.214 -59.755 1.00 0.00 H new ATOM 0 HD2 LYS A 85 73.198 3.648 -58.322 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.854 2.011 -57.801 1.00 0.00 H new ATOM 0 HE2 LYS A 85 73.371 2.813 -60.694 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.596 2.172 -59.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 73.884 0.290 -60.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 72.875 0.254 -59.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 72.271 0.809 -60.799 1.00 0.00 H new ATOM 531 N VAL A 86 68.347 3.584 -60.502 1.00 0.00 N ATOM 532 CA VAL A 86 67.322 2.632 -60.915 1.00 0.00 C ATOM 533 C VAL A 86 67.721 1.205 -60.555 1.00 0.00 C ATOM 534 O VAL A 86 68.895 0.840 -60.630 1.00 0.00 O ATOM 535 CB VAL A 86 67.058 2.714 -62.430 1.00 0.00 C ATOM 536 CG1 VAL A 86 66.013 1.690 -62.846 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.626 4.119 -62.820 1.00 0.00 C ATOM 0 H VAL A 86 68.868 4.004 -61.272 1.00 0.00 H new ATOM 0 HA VAL A 86 66.410 2.897 -60.381 1.00 0.00 H new ATOM 0 HB VAL A 86 67.985 2.485 -62.956 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.839 1.763 -63.920 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.368 0.689 -62.603 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.082 1.884 -62.314 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.444 4.159 -63.894 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.712 4.380 -62.287 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.413 4.827 -62.559 1.00 0.00 H new ATOM 547 N LEU A 87 66.738 0.403 -60.165 1.00 0.00 N ATOM 548 CA LEU A 87 66.985 -0.986 -59.794 1.00 0.00 C ATOM 549 C LEU A 87 66.669 -1.925 -60.954 1.00 0.00 C ATOM 550 O LEU A 87 67.358 -2.923 -61.166 1.00 0.00 O ATOM 551 CB LEU A 87 66.146 -1.366 -58.573 1.00 0.00 C ATOM 552 CG LEU A 87 66.806 -2.318 -57.575 1.00 0.00 C ATOM 553 CD1 LEU A 87 67.202 -3.618 -58.259 1.00 0.00 C ATOM 554 CD2 LEU A 87 68.018 -1.661 -56.931 1.00 0.00 C ATOM 0 H LEU A 87 65.762 0.690 -60.097 1.00 0.00 H new ATOM 0 HA LEU A 87 68.042 -1.087 -59.547 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.873 -0.452 -58.046 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.219 -1.822 -58.922 1.00 0.00 H new ATOM 0 HG LEU A 87 66.084 -2.549 -56.791 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.670 -4.283 -57.533 1.00 0.00 H new ATOM 0 HD12 LEU A 87 66.314 -4.098 -58.671 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.906 -3.406 -59.064 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.474 -2.354 -56.224 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.743 -1.399 -57.702 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.706 -0.759 -56.405 1.00 0.00 H new ATOM 566 N LYS A 88 65.623 -1.597 -61.705 1.00 0.00 N ATOM 567 CA LYS A 88 65.216 -2.407 -62.847 1.00 0.00 C ATOM 568 C LYS A 88 64.189 -1.669 -63.699 1.00 0.00 C ATOM 569 O LYS A 88 63.575 -0.701 -63.250 1.00 0.00 O ATOM 570 CB LYS A 88 64.636 -3.741 -62.371 1.00 0.00 C ATOM 571 CG LYS A 88 65.614 -4.899 -62.470 1.00 0.00 C ATOM 572 CD LYS A 88 64.891 -6.231 -62.586 1.00 0.00 C ATOM 573 CE LYS A 88 64.391 -6.713 -61.234 1.00 0.00 C ATOM 574 NZ LYS A 88 63.003 -6.250 -60.958 1.00 0.00 N ATOM 0 H LYS A 88 65.041 -0.775 -61.543 1.00 0.00 H new ATOM 0 HA LYS A 88 66.098 -2.599 -63.458 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.312 -3.638 -61.336 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.750 -3.973 -62.961 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.260 -4.758 -63.337 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.258 -4.909 -61.591 1.00 0.00 H new ATOM 0 HD2 LYS A 88 64.050 -6.131 -63.272 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.563 -6.975 -63.013 1.00 0.00 H new ATOM 0 HE2 LYS A 88 64.423 -7.802 -61.202 1.00 0.00 H new ATOM 0 HE3 LYS A 88 65.057 -6.351 -60.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 62.956 -5.845 -60.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 62.734 -5.526 -61.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 62.349 -7.055 -61.026 1.00 0.00 H new ATOM 588 N HIS A 89 64.005 -2.134 -64.931 1.00 0.00 N ATOM 589 CA HIS A 89 63.049 -1.519 -65.846 1.00 0.00 C ATOM 590 C HIS A 89 61.948 -2.505 -66.225 1.00 0.00 C ATOM 591 O HIS A 89 62.212 -3.683 -66.463 1.00 0.00 O ATOM 592 CB HIS A 89 63.762 -1.023 -67.104 1.00 0.00 C ATOM 593 CG HIS A 89 62.828 -0.548 -68.174 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.716 0.226 -67.913 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.846 -0.738 -69.514 1.00 0.00 C ATOM 596 CE1 HIS A 89 61.090 0.488 -69.046 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.755 -0.085 -70.032 1.00 0.00 N ATOM 0 H HIS A 89 64.505 -2.934 -65.319 1.00 0.00 H new ATOM 0 HA HIS A 89 62.592 -0.670 -65.338 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.435 -0.209 -66.833 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.379 -1.828 -67.503 1.00 0.00 H new ATOM 0 HD1 HIS A 89 61.423 0.546 -66.990 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.581 -1.299 -70.072 1.00 0.00 H new ATOM 0 HE1 HIS A 89 60.187 1.072 -69.148 1.00 0.00 H new ATOM 605 N ARG A 90 60.714 -2.014 -66.278 1.00 0.00 N ATOM 606 CA ARG A 90 59.573 -2.852 -66.626 1.00 0.00 C ATOM 607 C ARG A 90 58.596 -2.096 -67.522 1.00 0.00 C ATOM 608 O ARG A 90 58.398 -0.892 -67.363 1.00 0.00 O ATOM 609 CB ARG A 90 58.858 -3.329 -65.361 1.00 0.00 C ATOM 610 CG ARG A 90 57.591 -4.120 -65.639 1.00 0.00 C ATOM 611 CD ARG A 90 57.901 -5.457 -66.295 1.00 0.00 C ATOM 612 NE ARG A 90 56.943 -6.490 -65.912 1.00 0.00 N ATOM 613 CZ ARG A 90 55.746 -6.627 -66.474 1.00 0.00 C ATOM 614 NH1 ARG A 90 55.364 -5.800 -67.438 1.00 0.00 N ATOM 615 NH2 ARG A 90 54.930 -7.592 -66.071 1.00 0.00 N ATOM 0 H ARG A 90 60.479 -1.040 -66.084 1.00 0.00 H new ATOM 0 HA ARG A 90 59.944 -3.719 -67.173 1.00 0.00 H new ATOM 0 HB2 ARG A 90 59.542 -3.947 -64.779 1.00 0.00 H new ATOM 0 HB3 ARG A 90 58.609 -2.464 -64.747 1.00 0.00 H new ATOM 0 HG2 ARG A 90 57.053 -4.287 -64.706 1.00 0.00 H new ATOM 0 HG3 ARG A 90 56.933 -3.540 -66.286 1.00 0.00 H new ATOM 0 HD2 ARG A 90 57.893 -5.339 -67.379 1.00 0.00 H new ATOM 0 HD3 ARG A 90 58.906 -5.773 -66.016 1.00 0.00 H new ATOM 0 HE ARG A 90 57.206 -7.142 -65.173 1.00 0.00 H new ATOM 0 HH11 ARG A 90 55.989 -5.057 -67.750 1.00 0.00 H new ATOM 0 HH12 ARG A 90 54.445 -5.907 -67.868 1.00 0.00 H new ATOM 0 HH21 ARG A 90 55.221 -8.229 -65.330 1.00 0.00 H new ATOM 0 HH22 ARG A 90 54.012 -7.697 -66.502 1.00 0.00 H new ATOM 629 N MET A 91 57.989 -2.812 -68.463 1.00 0.00 N ATOM 630 CA MET A 91 57.032 -2.208 -69.383 1.00 0.00 C ATOM 631 C MET A 91 55.618 -2.267 -68.813 1.00 0.00 C ATOM 632 O MET A 91 55.019 -3.338 -68.724 1.00 0.00 O ATOM 633 CB MET A 91 57.079 -2.916 -70.738 1.00 0.00 C ATOM 634 CG MET A 91 56.092 -2.357 -71.750 1.00 0.00 C ATOM 635 SD MET A 91 56.433 -2.911 -73.432 1.00 0.00 S ATOM 636 CE MET A 91 56.887 -1.364 -74.212 1.00 0.00 C ATOM 0 H MET A 91 58.143 -3.810 -68.608 1.00 0.00 H new ATOM 0 HA MET A 91 57.306 -1.162 -69.518 1.00 0.00 H new ATOM 0 HB2 MET A 91 58.087 -2.838 -71.145 1.00 0.00 H new ATOM 0 HB3 MET A 91 56.875 -3.977 -70.592 1.00 0.00 H new ATOM 0 HG2 MET A 91 55.082 -2.657 -71.471 1.00 0.00 H new ATOM 0 HG3 MET A 91 56.122 -1.268 -71.717 1.00 0.00 H new ATOM 0 HE1 MET A 91 56.782 -1.457 -75.293 1.00 0.00 H new ATOM 0 HE2 MET A 91 56.234 -0.569 -73.851 1.00 0.00 H new ATOM 0 HE3 MET A 91 57.922 -1.123 -73.968 1.00 0.00 H new ATOM 646 N ALA A 92 55.091 -1.109 -68.429 1.00 0.00 N ATOM 647 CA ALA A 92 53.747 -1.030 -67.870 1.00 0.00 C ATOM 648 C ALA A 92 52.690 -1.125 -68.965 1.00 0.00 C ATOM 649 O ALA A 92 52.532 -0.207 -69.770 1.00 0.00 O ATOM 650 CB ALA A 92 53.579 0.261 -67.082 1.00 0.00 C ATOM 0 H ALA A 92 55.574 -0.213 -68.495 1.00 0.00 H new ATOM 0 HA ALA A 92 53.610 -1.875 -67.196 1.00 0.00 H new ATOM 0 HB1 ALA A 92 52.571 0.307 -66.670 1.00 0.00 H new ATOM 0 HB2 ALA A 92 54.305 0.288 -66.269 1.00 0.00 H new ATOM 0 HB3 ALA A 92 53.741 1.114 -67.742 1.00 0.00 H new ATOM 716 N GLY A 97 52.982 3.254 -70.336 1.00 0.00 N ATOM 717 CA GLY A 97 54.257 3.947 -70.363 1.00 0.00 C ATOM 718 C GLY A 97 55.413 3.048 -69.971 1.00 0.00 C ATOM 719 O GLY A 97 55.549 1.939 -70.487 1.00 0.00 O ATOM 0 HA2 GLY A 97 54.431 4.342 -71.364 1.00 0.00 H new ATOM 0 HA3 GLY A 97 54.218 4.800 -69.686 1.00 0.00 H new ATOM 723 N TYR A 98 56.250 3.528 -69.057 1.00 0.00 N ATOM 724 CA TYR A 98 57.403 2.762 -68.599 1.00 0.00 C ATOM 725 C TYR A 98 57.467 2.733 -67.075 1.00 0.00 C ATOM 726 O TYR A 98 56.905 3.597 -66.403 1.00 0.00 O ATOM 727 CB TYR A 98 58.694 3.357 -69.164 1.00 0.00 C ATOM 728 CG TYR A 98 58.894 3.080 -70.637 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.701 1.806 -71.158 1.00 0.00 C ATOM 730 CD2 TYR A 98 59.275 4.093 -71.509 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.883 1.549 -72.502 1.00 0.00 C ATOM 732 CE2 TYR A 98 59.458 3.845 -72.855 1.00 0.00 C ATOM 733 CZ TYR A 98 59.261 2.572 -73.347 1.00 0.00 C ATOM 734 OH TYR A 98 59.443 2.320 -74.688 1.00 0.00 O ATOM 0 H TYR A 98 56.151 4.444 -68.619 1.00 0.00 H new ATOM 0 HA TYR A 98 57.294 1.739 -68.959 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.688 4.435 -69.003 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.542 2.956 -68.609 1.00 0.00 H new ATOM 0 HD1 TYR A 98 58.403 1.003 -70.500 1.00 0.00 H new ATOM 0 HD2 TYR A 98 59.431 5.091 -71.127 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.730 0.553 -72.890 1.00 0.00 H new ATOM 0 HE2 TYR A 98 59.754 4.644 -73.519 1.00 0.00 H new ATOM 0 HH TYR A 98 59.707 3.147 -75.143 1.00 0.00 H new ATOM 744 N GLU A 99 58.158 1.733 -66.537 1.00 0.00 N ATOM 745 CA GLU A 99 58.296 1.591 -65.092 1.00 0.00 C ATOM 746 C GLU A 99 59.756 1.375 -64.704 1.00 0.00 C ATOM 747 O GLU A 99 60.511 0.721 -65.425 1.00 0.00 O ATOM 748 CB GLU A 99 57.445 0.424 -64.588 1.00 0.00 C ATOM 749 CG GLU A 99 55.986 0.785 -64.369 1.00 0.00 C ATOM 750 CD GLU A 99 55.738 1.409 -63.009 1.00 0.00 C ATOM 751 OE1 GLU A 99 56.429 1.021 -62.044 1.00 0.00 O ATOM 752 OE2 GLU A 99 54.852 2.284 -62.910 1.00 0.00 O ATOM 0 H GLU A 99 58.631 1.010 -67.079 1.00 0.00 H new ATOM 0 HA GLU A 99 57.947 2.513 -64.627 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.504 -0.394 -65.306 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.864 0.057 -63.651 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.666 1.479 -65.147 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.374 -0.112 -64.470 1.00 0.00 H new ATOM 759 N TYR A 100 60.147 1.929 -63.562 1.00 0.00 N ATOM 760 CA TYR A 100 61.516 1.800 -63.078 1.00 0.00 C ATOM 761 C TYR A 100 61.552 1.736 -61.554 1.00 0.00 C ATOM 762 O TYR A 100 60.895 2.523 -60.872 1.00 0.00 O ATOM 763 CB TYR A 100 62.366 2.973 -63.571 1.00 0.00 C ATOM 764 CG TYR A 100 62.191 3.270 -65.043 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.146 4.067 -65.492 1.00 0.00 C ATOM 766 CD2 TYR A 100 63.073 2.755 -65.985 1.00 0.00 C ATOM 767 CE1 TYR A 100 60.982 4.341 -66.836 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.919 3.024 -67.331 1.00 0.00 C ATOM 769 CZ TYR A 100 61.871 3.817 -67.752 1.00 0.00 C ATOM 770 OH TYR A 100 61.713 4.089 -69.092 1.00 0.00 O ATOM 0 H TYR A 100 59.534 2.472 -62.954 1.00 0.00 H new ATOM 0 HA TYR A 100 61.927 0.871 -63.472 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.110 3.863 -62.996 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.416 2.758 -63.375 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.449 4.480 -64.778 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.894 2.133 -65.659 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.163 4.962 -67.168 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.615 2.616 -68.050 1.00 0.00 H new ATOM 0 HH TYR A 100 62.423 3.645 -69.602 1.00 0.00 H new ATOM 780 N LEU A 101 62.325 0.793 -61.027 1.00 0.00 N ATOM 781 CA LEU A 101 62.450 0.625 -59.583 1.00 0.00 C ATOM 782 C LEU A 101 63.456 1.615 -59.004 1.00 0.00 C ATOM 783 O LEU A 101 64.482 1.906 -59.621 1.00 0.00 O ATOM 784 CB LEU A 101 62.876 -0.806 -59.251 1.00 0.00 C ATOM 785 CG LEU A 101 61.750 -1.835 -59.146 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.169 -3.151 -59.781 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.353 -2.044 -57.692 1.00 0.00 C ATOM 0 H LEU A 101 62.875 0.133 -61.577 1.00 0.00 H new ATOM 0 HA LEU A 101 61.476 0.821 -59.134 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.577 -1.141 -60.015 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.418 -0.792 -58.305 1.00 0.00 H new ATOM 0 HG LEU A 101 60.884 -1.454 -59.687 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.355 -3.871 -59.697 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.403 -2.989 -60.833 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.050 -3.538 -59.269 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.550 -2.779 -57.636 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.214 -2.403 -57.128 1.00 0.00 H new ATOM 0 HD23 LEU A 101 61.010 -1.100 -57.269 1.00 0.00 H new ATOM 799 N LEU A 102 63.156 2.128 -57.816 1.00 0.00 N ATOM 800 CA LEU A 102 64.036 3.084 -57.152 1.00 0.00 C ATOM 801 C LEU A 102 64.931 2.384 -56.134 1.00 0.00 C ATOM 802 O LEU A 102 64.453 1.648 -55.272 1.00 0.00 O ATOM 803 CB LEU A 102 63.210 4.170 -56.459 1.00 0.00 C ATOM 804 CG LEU A 102 62.062 4.763 -57.276 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.058 5.450 -56.364 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.595 5.738 -58.316 1.00 0.00 C ATOM 0 H LEU A 102 62.311 1.898 -57.293 1.00 0.00 H new ATOM 0 HA LEU A 102 64.670 3.545 -57.910 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.798 3.754 -55.540 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.880 4.980 -56.170 1.00 0.00 H new ATOM 0 HG LEU A 102 61.554 3.951 -57.796 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.248 5.866 -56.963 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.652 4.725 -55.658 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.553 6.252 -55.816 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.764 6.150 -58.888 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.128 6.547 -57.817 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.275 5.216 -58.989 1.00 0.00 H new ATOM 818 N LYS A 103 66.235 2.620 -56.240 1.00 0.00 N ATOM 819 CA LYS A 103 67.199 2.016 -55.329 1.00 0.00 C ATOM 820 C LYS A 103 67.593 2.995 -54.227 1.00 0.00 C ATOM 821 O LYS A 103 67.675 4.202 -54.456 1.00 0.00 O ATOM 822 CB LYS A 103 68.444 1.566 -56.095 1.00 0.00 C ATOM 823 CG LYS A 103 69.407 0.740 -55.260 1.00 0.00 C ATOM 824 CD LYS A 103 70.533 0.171 -56.107 1.00 0.00 C ATOM 825 CE LYS A 103 71.021 -1.163 -55.563 1.00 0.00 C ATOM 826 NZ LYS A 103 72.007 -0.986 -54.462 1.00 0.00 N ATOM 0 H LYS A 103 66.648 3.226 -56.949 1.00 0.00 H new ATOM 0 HA LYS A 103 66.730 1.146 -54.868 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.135 0.982 -56.962 1.00 0.00 H new ATOM 0 HB3 LYS A 103 68.966 2.446 -56.472 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.825 1.359 -54.466 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.866 -0.074 -54.778 1.00 0.00 H new ATOM 0 HD2 LYS A 103 70.188 0.042 -57.133 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.362 0.879 -56.135 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.171 -1.740 -55.200 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.476 -1.739 -56.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 72.315 -1.918 -54.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.830 -0.458 -54.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 71.565 -0.458 -53.682 1.00 0.00 H new ATOM 840 N TRP A 104 67.838 2.467 -53.033 1.00 0.00 N ATOM 841 CA TRP A 104 68.225 3.295 -51.897 1.00 0.00 C ATOM 842 C TRP A 104 69.737 3.280 -51.702 1.00 0.00 C ATOM 843 O TRP A 104 70.366 2.223 -51.748 1.00 0.00 O ATOM 844 CB TRP A 104 67.530 2.808 -50.624 1.00 0.00 C ATOM 845 CG TRP A 104 66.034 2.814 -50.725 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.221 1.732 -50.902 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.175 3.957 -50.657 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.908 2.133 -50.948 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.853 3.494 -50.799 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.394 5.327 -50.487 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.757 4.352 -50.778 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.305 6.178 -50.467 1.00 0.00 C ATOM 853 CH2 TRP A 104 63.000 5.688 -50.610 1.00 0.00 C ATOM 0 H TRP A 104 67.776 1.470 -52.827 1.00 0.00 H new ATOM 0 HA TRP A 104 67.914 4.319 -52.104 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.868 1.797 -50.398 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.833 3.439 -49.789 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.560 0.711 -50.993 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.104 1.517 -51.073 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.396 5.714 -50.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.751 3.976 -50.890 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.463 7.239 -50.339 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.170 6.378 -50.587 1.00 0.00 H new ATOM 864 N GLU A 105 70.314 4.458 -51.485 1.00 0.00 N ATOM 865 CA GLU A 105 71.753 4.577 -51.284 1.00 0.00 C ATOM 866 C GLU A 105 72.185 3.866 -50.005 1.00 0.00 C ATOM 867 O GLU A 105 71.711 4.184 -48.915 1.00 0.00 O ATOM 868 CB GLU A 105 72.161 6.051 -51.224 1.00 0.00 C ATOM 869 CG GLU A 105 71.454 6.835 -50.131 1.00 0.00 C ATOM 870 CD GLU A 105 71.639 8.333 -50.275 1.00 0.00 C ATOM 871 OE1 GLU A 105 72.242 8.763 -51.280 1.00 0.00 O ATOM 872 OE2 GLU A 105 71.180 9.075 -49.382 1.00 0.00 O ATOM 0 H GLU A 105 69.807 5.342 -51.444 1.00 0.00 H new ATOM 0 HA GLU A 105 72.253 4.103 -52.129 1.00 0.00 H new ATOM 0 HB2 GLU A 105 73.238 6.115 -51.067 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.951 6.517 -52.187 1.00 0.00 H new ATOM 0 HG2 GLU A 105 70.390 6.601 -50.151 1.00 0.00 H new ATOM 0 HG3 GLU A 105 71.832 6.518 -49.159 1.00 0.00 H new ATOM 879 N GLY A 106 73.088 2.901 -50.147 1.00 0.00 N ATOM 880 CA GLY A 106 73.569 2.159 -48.996 1.00 0.00 C ATOM 881 C GLY A 106 72.773 0.893 -48.749 1.00 0.00 C ATOM 882 O GLY A 106 73.314 -0.108 -48.279 1.00 0.00 O ATOM 0 H GLY A 106 73.495 2.620 -51.039 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.618 1.902 -49.146 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.520 2.794 -48.112 1.00 0.00 H new ATOM 886 N TYR A 107 71.483 0.936 -49.065 1.00 0.00 N ATOM 887 CA TYR A 107 70.610 -0.215 -48.870 1.00 0.00 C ATOM 888 C TYR A 107 70.327 -0.915 -50.196 1.00 0.00 C ATOM 889 O TYR A 107 69.857 -0.295 -51.151 1.00 0.00 O ATOM 890 CB TYR A 107 69.295 0.219 -48.220 1.00 0.00 C ATOM 891 CG TYR A 107 69.483 1.001 -46.939 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.645 2.381 -46.962 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.500 0.360 -45.707 1.00 0.00 C ATOM 894 CE1 TYR A 107 69.817 3.099 -45.795 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.670 1.070 -44.534 1.00 0.00 C ATOM 896 CZ TYR A 107 69.829 2.439 -44.583 1.00 0.00 C ATOM 897 OH TYR A 107 70.000 3.150 -43.418 1.00 0.00 O ATOM 0 H TYR A 107 71.019 1.756 -49.457 1.00 0.00 H new ATOM 0 HA TYR A 107 71.120 -0.917 -48.210 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.733 0.827 -48.928 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.693 -0.665 -48.011 1.00 0.00 H new ATOM 0 HD1 TYR A 107 69.636 2.901 -47.909 1.00 0.00 H new ATOM 0 HD2 TYR A 107 69.378 -0.712 -45.665 1.00 0.00 H new ATOM 0 HE1 TYR A 107 69.941 4.171 -45.831 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.678 0.556 -43.584 1.00 0.00 H new ATOM 0 HH TYR A 107 69.983 2.536 -42.654 1.00 0.00 H new ATOM 907 N ASP A 108 70.616 -2.211 -50.248 1.00 0.00 N ATOM 908 CA ASP A 108 70.392 -2.997 -51.455 1.00 0.00 C ATOM 909 C ASP A 108 69.191 -3.923 -51.285 1.00 0.00 C ATOM 910 O ASP A 108 69.310 -5.013 -50.727 1.00 0.00 O ATOM 911 CB ASP A 108 71.638 -3.815 -51.795 1.00 0.00 C ATOM 912 CG ASP A 108 72.177 -4.574 -50.599 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.716 -3.924 -49.678 1.00 0.00 O ATOM 914 OD2 ASP A 108 72.060 -5.817 -50.583 1.00 0.00 O ATOM 0 H ASP A 108 71.006 -2.739 -49.467 1.00 0.00 H new ATOM 0 HA ASP A 108 70.184 -2.309 -52.274 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.400 -4.520 -52.592 1.00 0.00 H new ATOM 0 HB3 ASP A 108 72.412 -3.150 -52.178 1.00 0.00 H new ATOM 919 N ASP A 109 68.036 -3.480 -51.770 1.00 0.00 N ATOM 920 CA ASP A 109 66.813 -4.269 -51.672 1.00 0.00 C ATOM 921 C ASP A 109 66.674 -5.205 -52.869 1.00 0.00 C ATOM 922 O ASP A 109 67.271 -4.997 -53.925 1.00 0.00 O ATOM 923 CB ASP A 109 65.594 -3.350 -51.584 1.00 0.00 C ATOM 924 CG ASP A 109 65.066 -3.224 -50.168 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.788 -2.670 -49.312 1.00 0.00 O ATOM 926 OD2 ASP A 109 63.931 -3.678 -49.916 1.00 0.00 O ATOM 0 H ASP A 109 67.921 -2.579 -52.235 1.00 0.00 H new ATOM 0 HA ASP A 109 66.870 -4.872 -50.766 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.860 -2.362 -51.959 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.805 -3.735 -52.230 1.00 0.00 H new ATOM 931 N PRO A 110 65.867 -6.264 -52.701 1.00 0.00 N ATOM 932 CA PRO A 110 65.631 -7.254 -53.755 1.00 0.00 C ATOM 933 C PRO A 110 64.810 -6.687 -54.909 1.00 0.00 C ATOM 934 O PRO A 110 64.651 -5.473 -55.032 1.00 0.00 O ATOM 935 CB PRO A 110 64.852 -8.359 -53.037 1.00 0.00 C ATOM 936 CG PRO A 110 64.186 -7.671 -51.895 1.00 0.00 C ATOM 937 CD PRO A 110 65.123 -6.575 -51.469 1.00 0.00 C ATOM 0 HA PRO A 110 66.561 -7.596 -54.209 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.122 -8.824 -53.700 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.516 -9.150 -52.690 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.220 -7.264 -52.194 1.00 0.00 H new ATOM 0 HG3 PRO A 110 64.000 -8.366 -51.076 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.581 -5.706 -51.096 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.788 -6.903 -50.670 1.00 0.00 H new ATOM 945 N SER A 111 64.290 -7.575 -55.751 1.00 0.00 N ATOM 946 CA SER A 111 63.488 -7.162 -56.897 1.00 0.00 C ATOM 947 C SER A 111 62.110 -6.682 -56.451 1.00 0.00 C ATOM 948 O SER A 111 61.315 -6.205 -57.261 1.00 0.00 O ATOM 949 CB SER A 111 63.341 -8.320 -57.887 1.00 0.00 C ATOM 950 OG SER A 111 63.542 -9.568 -57.246 1.00 0.00 O ATOM 0 H SER A 111 64.410 -8.584 -55.661 1.00 0.00 H new ATOM 0 HA SER A 111 64.000 -6.335 -57.389 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.348 -8.294 -58.337 1.00 0.00 H new ATOM 0 HB3 SER A 111 64.061 -8.204 -58.697 1.00 0.00 H new ATOM 0 HG SER A 111 63.441 -10.291 -57.899 1.00 0.00 H new ATOM 956 N ASP A 112 61.836 -6.811 -55.158 1.00 0.00 N ATOM 957 CA ASP A 112 60.556 -6.389 -54.602 1.00 0.00 C ATOM 958 C ASP A 112 60.606 -4.927 -54.169 1.00 0.00 C ATOM 959 O ASP A 112 59.749 -4.462 -53.420 1.00 0.00 O ATOM 960 CB ASP A 112 60.175 -7.273 -53.413 1.00 0.00 C ATOM 961 CG ASP A 112 60.011 -8.729 -53.804 1.00 0.00 C ATOM 962 OD1 ASP A 112 59.440 -8.992 -54.883 1.00 0.00 O ATOM 963 OD2 ASP A 112 60.452 -9.604 -53.030 1.00 0.00 O ATOM 0 H ASP A 112 62.483 -7.205 -54.475 1.00 0.00 H new ATOM 0 HA ASP A 112 59.799 -6.493 -55.379 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.941 -7.191 -52.642 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.244 -6.910 -52.977 1.00 0.00 H new ATOM 968 N ASN A 113 61.618 -4.209 -54.645 1.00 0.00 N ATOM 969 CA ASN A 113 61.782 -2.800 -54.305 1.00 0.00 C ATOM 970 C ASN A 113 60.553 -1.995 -54.718 1.00 0.00 C ATOM 971 O ASN A 113 59.533 -2.557 -55.116 1.00 0.00 O ATOM 972 CB ASN A 113 63.029 -2.232 -54.985 1.00 0.00 C ATOM 973 CG ASN A 113 64.068 -1.760 -53.985 1.00 0.00 C ATOM 974 OD1 ASN A 113 65.258 -2.040 -54.131 1.00 0.00 O ATOM 975 ND2 ASN A 113 63.620 -1.040 -52.963 1.00 0.00 N ATOM 0 H ASN A 113 62.337 -4.579 -55.267 1.00 0.00 H new ATOM 0 HA ASN A 113 61.899 -2.723 -53.224 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.468 -2.994 -55.629 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.742 -1.399 -55.627 1.00 0.00 H new ATOM 0 HD21 ASN A 113 64.271 -0.695 -52.258 1.00 0.00 H new ATOM 0 HD22 ASN A 113 62.625 -0.832 -52.883 1.00 0.00 H new ATOM 982 N THR A 114 60.658 -0.673 -54.620 1.00 0.00 N ATOM 983 CA THR A 114 59.557 0.210 -54.982 1.00 0.00 C ATOM 984 C THR A 114 59.566 0.516 -56.476 1.00 0.00 C ATOM 985 O THR A 114 60.576 0.957 -57.022 1.00 0.00 O ATOM 986 CB THR A 114 59.618 1.534 -54.198 1.00 0.00 C ATOM 987 OG1 THR A 114 58.533 2.385 -54.588 1.00 0.00 O ATOM 988 CG2 THR A 114 60.940 2.247 -54.441 1.00 0.00 C ATOM 0 H THR A 114 61.495 -0.191 -54.293 1.00 0.00 H new ATOM 0 HA THR A 114 58.635 -0.313 -54.727 1.00 0.00 H new ATOM 0 HB THR A 114 59.537 1.305 -53.135 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.578 3.224 -54.084 1.00 0.00 H new ATOM 0 HG21 THR A 114 60.960 3.179 -53.877 1.00 0.00 H new ATOM 0 HG22 THR A 114 61.762 1.609 -54.117 1.00 0.00 H new ATOM 0 HG23 THR A 114 61.046 2.464 -55.504 1.00 0.00 H new ATOM 996 N TRP A 115 58.434 0.280 -57.130 1.00 0.00 N ATOM 997 CA TRP A 115 58.312 0.531 -58.561 1.00 0.00 C ATOM 998 C TRP A 115 57.751 1.925 -58.823 1.00 0.00 C ATOM 999 O TRP A 115 56.620 2.230 -58.445 1.00 0.00 O ATOM 1000 CB TRP A 115 57.414 -0.523 -59.210 1.00 0.00 C ATOM 1001 CG TRP A 115 57.867 -1.929 -58.952 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.738 -2.630 -57.788 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.523 -2.801 -59.879 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.274 -3.887 -57.935 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.761 -4.017 -59.208 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.930 -2.675 -61.210 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.389 -5.096 -59.825 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.553 -3.747 -61.820 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.777 -4.945 -61.128 1.00 0.00 C ATOM 0 H TRP A 115 57.588 -0.085 -56.692 1.00 0.00 H new ATOM 0 HA TRP A 115 59.307 0.471 -59.001 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.397 -0.402 -58.838 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.382 -0.351 -60.286 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.282 -2.253 -56.885 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.304 -4.607 -57.213 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.761 -1.756 -61.752 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.564 -6.020 -59.293 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.873 -3.660 -62.848 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.265 -5.765 -61.633 1.00 0.00 H new ATOM 1020 N SER A 116 58.549 2.767 -59.473 1.00 0.00 N ATOM 1021 CA SER A 116 58.133 4.130 -59.782 1.00 0.00 C ATOM 1022 C SER A 116 57.653 4.237 -61.226 1.00 0.00 C ATOM 1023 O SER A 116 58.206 3.602 -62.124 1.00 0.00 O ATOM 1024 CB SER A 116 59.287 5.105 -59.542 1.00 0.00 C ATOM 1025 OG SER A 116 60.169 5.134 -60.652 1.00 0.00 O ATOM 0 H SER A 116 59.487 2.529 -59.796 1.00 0.00 H new ATOM 0 HA SER A 116 57.305 4.389 -59.122 1.00 0.00 H new ATOM 0 HB2 SER A 116 58.891 6.104 -59.362 1.00 0.00 H new ATOM 0 HB3 SER A 116 59.834 4.812 -58.646 1.00 0.00 H new ATOM 0 HG SER A 116 60.440 4.220 -60.878 1.00 0.00 H new ATOM 1031 N SER A 117 56.620 5.045 -61.442 1.00 0.00 N ATOM 1032 CA SER A 117 56.062 5.233 -62.776 1.00 0.00 C ATOM 1033 C SER A 117 56.916 6.201 -63.590 1.00 0.00 C ATOM 1034 O SER A 117 57.939 6.692 -63.115 1.00 0.00 O ATOM 1035 CB SER A 117 54.628 5.756 -62.682 1.00 0.00 C ATOM 1036 OG SER A 117 53.799 4.848 -61.977 1.00 0.00 O ATOM 0 H SER A 117 56.152 5.580 -60.710 1.00 0.00 H new ATOM 0 HA SER A 117 56.057 4.267 -63.281 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.623 6.723 -62.180 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.229 5.915 -63.684 1.00 0.00 H new ATOM 0 HG SER A 117 54.052 3.929 -62.206 1.00 0.00 H new ATOM 1042 N GLU A 118 56.486 6.468 -64.819 1.00 0.00 N ATOM 1043 CA GLU A 118 57.212 7.377 -65.700 1.00 0.00 C ATOM 1044 C GLU A 118 57.216 8.794 -65.136 1.00 0.00 C ATOM 1045 O GLU A 118 58.112 9.587 -65.426 1.00 0.00 O ATOM 1046 CB GLU A 118 56.588 7.374 -67.097 1.00 0.00 C ATOM 1047 CG GLU A 118 57.142 8.452 -68.013 1.00 0.00 C ATOM 1048 CD GLU A 118 56.384 9.761 -67.898 1.00 0.00 C ATOM 1049 OE1 GLU A 118 55.450 9.834 -67.072 1.00 0.00 O ATOM 1050 OE2 GLU A 118 56.725 10.711 -68.634 1.00 0.00 O ATOM 0 H GLU A 118 55.641 6.069 -65.227 1.00 0.00 H new ATOM 0 HA GLU A 118 58.243 7.030 -65.769 1.00 0.00 H new ATOM 0 HB2 GLU A 118 56.751 6.399 -67.557 1.00 0.00 H new ATOM 0 HB3 GLU A 118 55.510 7.506 -67.005 1.00 0.00 H new ATOM 0 HG2 GLU A 118 58.192 8.622 -67.774 1.00 0.00 H new ATOM 0 HG3 GLU A 118 57.102 8.103 -69.045 1.00 0.00 H new ATOM 1057 N ALA A 119 56.207 9.106 -64.328 1.00 0.00 N ATOM 1058 CA ALA A 119 56.095 10.427 -63.722 1.00 0.00 C ATOM 1059 C ALA A 119 57.248 10.689 -62.759 1.00 0.00 C ATOM 1060 O ALA A 119 57.605 11.839 -62.502 1.00 0.00 O ATOM 1061 CB ALA A 119 54.762 10.565 -63.002 1.00 0.00 C ATOM 0 H ALA A 119 55.456 8.462 -64.078 1.00 0.00 H new ATOM 0 HA ALA A 119 56.145 11.170 -64.518 1.00 0.00 H new ATOM 0 HB1 ALA A 119 54.691 11.556 -62.554 1.00 0.00 H new ATOM 0 HB2 ALA A 119 53.948 10.430 -63.714 1.00 0.00 H new ATOM 0 HB3 ALA A 119 54.690 9.808 -62.221 1.00 0.00 H new ATOM 1067 N ASP A 120 57.826 9.617 -62.230 1.00 0.00 N ATOM 1068 CA ASP A 120 58.940 9.731 -61.296 1.00 0.00 C ATOM 1069 C ASP A 120 60.238 10.043 -62.033 1.00 0.00 C ATOM 1070 O ASP A 120 61.153 10.647 -61.472 1.00 0.00 O ATOM 1071 CB ASP A 120 59.093 8.439 -60.491 1.00 0.00 C ATOM 1072 CG ASP A 120 59.699 8.678 -59.122 1.00 0.00 C ATOM 1073 OD1 ASP A 120 60.943 8.695 -59.020 1.00 0.00 O ATOM 1074 OD2 ASP A 120 58.929 8.848 -58.154 1.00 0.00 O ATOM 0 H ASP A 120 57.542 8.658 -62.432 1.00 0.00 H new ATOM 0 HA ASP A 120 58.726 10.552 -60.612 1.00 0.00 H new ATOM 0 HB2 ASP A 120 58.117 7.968 -60.376 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.720 7.741 -61.046 1.00 0.00 H new ATOM 1079 N CYS A 121 60.312 9.625 -63.292 1.00 0.00 N ATOM 1080 CA CYS A 121 61.500 9.858 -64.107 1.00 0.00 C ATOM 1081 C CYS A 121 61.781 11.351 -64.243 1.00 0.00 C ATOM 1082 O CYS A 121 62.916 11.759 -64.491 1.00 0.00 O ATOM 1083 CB CYS A 121 61.325 9.231 -65.491 1.00 0.00 C ATOM 1084 SG CYS A 121 60.975 7.457 -65.459 1.00 0.00 S ATOM 0 H CYS A 121 59.564 9.123 -63.771 1.00 0.00 H new ATOM 0 HA CYS A 121 62.350 9.391 -63.610 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.513 9.741 -66.009 1.00 0.00 H new ATOM 0 HB3 CYS A 121 62.231 9.401 -66.072 1.00 0.00 H new ATOM 0 HG CYS A 121 61.357 6.919 -66.579 1.00 0.00 H new ATOM 1090 N SER A 122 60.740 12.161 -64.081 1.00 0.00 N ATOM 1091 CA SER A 122 60.874 13.609 -64.192 1.00 0.00 C ATOM 1092 C SER A 122 62.001 14.120 -63.299 1.00 0.00 C ATOM 1093 O SER A 122 62.655 15.113 -63.613 1.00 0.00 O ATOM 1094 CB SER A 122 59.559 14.295 -63.815 1.00 0.00 C ATOM 1095 OG SER A 122 59.676 15.704 -63.902 1.00 0.00 O ATOM 0 H SER A 122 59.795 11.840 -63.873 1.00 0.00 H new ATOM 0 HA SER A 122 61.117 13.848 -65.227 1.00 0.00 H new ATOM 0 HB2 SER A 122 58.763 13.951 -64.476 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.275 14.012 -62.801 1.00 0.00 H new ATOM 0 HG SER A 122 58.822 16.119 -63.658 1.00 0.00 H new ATOM 1101 N GLY A 123 62.222 13.432 -62.183 1.00 0.00 N ATOM 1102 CA GLY A 123 63.269 13.830 -61.261 1.00 0.00 C ATOM 1103 C GLY A 123 64.439 12.866 -61.261 1.00 0.00 C ATOM 1104 O GLY A 123 65.578 13.261 -61.010 1.00 0.00 O ATOM 0 H GLY A 123 61.694 12.606 -61.901 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.623 14.826 -61.526 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.857 13.896 -60.254 1.00 0.00 H new ATOM 1108 N CYS A 124 64.158 11.598 -61.541 1.00 0.00 N ATOM 1109 CA CYS A 124 65.196 10.573 -61.570 1.00 0.00 C ATOM 1110 C CYS A 124 65.699 10.348 -62.992 1.00 0.00 C ATOM 1111 O CYS A 124 66.203 9.275 -63.321 1.00 0.00 O ATOM 1112 CB CYS A 124 64.663 9.262 -60.991 1.00 0.00 C ATOM 1113 SG CYS A 124 64.147 9.374 -59.261 1.00 0.00 S ATOM 0 H CYS A 124 63.221 11.255 -61.751 1.00 0.00 H new ATOM 0 HA CYS A 124 66.030 10.919 -60.960 1.00 0.00 H new ATOM 0 HB2 CYS A 124 63.816 8.930 -61.591 1.00 0.00 H new ATOM 0 HB3 CYS A 124 65.435 8.498 -61.080 1.00 0.00 H new ATOM 0 HG CYS A 124 62.874 9.128 -59.171 1.00 0.00 H new ATOM 1119 N LYS A 125 65.556 11.368 -63.832 1.00 0.00 N ATOM 1120 CA LYS A 125 65.995 11.283 -65.220 1.00 0.00 C ATOM 1121 C LYS A 125 67.428 10.767 -65.307 1.00 0.00 C ATOM 1122 O LYS A 125 67.712 9.821 -66.041 1.00 0.00 O ATOM 1123 CB LYS A 125 65.893 12.653 -65.893 1.00 0.00 C ATOM 1124 CG LYS A 125 64.583 12.874 -66.629 1.00 0.00 C ATOM 1125 CD LYS A 125 64.757 13.817 -67.807 1.00 0.00 C ATOM 1126 CE LYS A 125 65.315 13.093 -69.023 1.00 0.00 C ATOM 1127 NZ LYS A 125 65.103 13.869 -70.276 1.00 0.00 N ATOM 0 H LYS A 125 65.139 12.263 -63.576 1.00 0.00 H new ATOM 0 HA LYS A 125 65.343 10.581 -65.739 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.011 13.429 -65.137 1.00 0.00 H new ATOM 0 HB3 LYS A 125 66.718 12.765 -66.596 1.00 0.00 H new ATOM 0 HG2 LYS A 125 64.197 11.918 -66.982 1.00 0.00 H new ATOM 0 HG3 LYS A 125 63.843 13.283 -65.941 1.00 0.00 H new ATOM 0 HD2 LYS A 125 63.797 14.267 -68.059 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.427 14.630 -67.527 1.00 0.00 H new ATOM 0 HE2 LYS A 125 66.381 12.915 -68.882 1.00 0.00 H new ATOM 0 HE3 LYS A 125 64.838 12.117 -69.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 65.497 13.342 -71.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 64.084 14.017 -70.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 65.579 14.790 -70.199 1.00 0.00 H new ATOM 1141 N GLN A 126 68.325 11.394 -64.553 1.00 0.00 N ATOM 1142 CA GLN A 126 69.728 10.997 -64.546 1.00 0.00 C ATOM 1143 C GLN A 126 69.868 9.498 -64.299 1.00 0.00 C ATOM 1144 O GLN A 126 70.761 8.849 -64.846 1.00 0.00 O ATOM 1145 CB GLN A 126 70.495 11.775 -63.476 1.00 0.00 C ATOM 1146 CG GLN A 126 69.777 11.838 -62.137 1.00 0.00 C ATOM 1147 CD GLN A 126 70.718 12.122 -60.983 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.777 12.724 -61.164 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.335 11.690 -59.787 1.00 0.00 N ATOM 0 H GLN A 126 68.105 12.179 -63.939 1.00 0.00 H new ATOM 0 HA GLN A 126 70.149 11.227 -65.525 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.472 11.313 -63.333 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.671 12.790 -63.833 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.011 12.613 -62.176 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.265 10.892 -61.959 1.00 0.00 H new ATOM 0 HE21 GLN A 126 69.449 11.195 -59.683 1.00 0.00 H new ATOM 0 HE22 GLN A 126 70.927 11.853 -58.972 1.00 0.00 H new ATOM 1158 N LEU A 127 68.981 8.954 -63.474 1.00 0.00 N ATOM 1159 CA LEU A 127 69.005 7.531 -63.154 1.00 0.00 C ATOM 1160 C LEU A 127 68.536 6.698 -64.342 1.00 0.00 C ATOM 1161 O LEU A 127 69.178 5.716 -64.716 1.00 0.00 O ATOM 1162 CB LEU A 127 68.123 7.246 -61.937 1.00 0.00 C ATOM 1163 CG LEU A 127 68.363 8.131 -60.713 1.00 0.00 C ATOM 1164 CD1 LEU A 127 67.588 7.605 -59.514 1.00 0.00 C ATOM 1165 CD2 LEU A 127 69.849 8.212 -60.396 1.00 0.00 C ATOM 0 H LEU A 127 68.236 9.477 -63.014 1.00 0.00 H new ATOM 0 HA LEU A 127 70.033 7.254 -62.922 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.080 7.350 -62.237 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.268 6.206 -61.643 1.00 0.00 H new ATOM 0 HG LEU A 127 68.005 9.135 -60.939 1.00 0.00 H new ATOM 0 HD11 LEU A 127 67.771 8.247 -58.652 1.00 0.00 H new ATOM 0 HD12 LEU A 127 66.522 7.600 -59.743 1.00 0.00 H new ATOM 0 HD13 LEU A 127 67.915 6.590 -59.286 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.001 8.846 -59.522 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.232 7.213 -60.190 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.380 8.636 -61.248 1.00 0.00 H new ATOM 1177 N ILE A 128 67.414 7.098 -64.932 1.00 0.00 N ATOM 1178 CA ILE A 128 66.862 6.390 -66.080 1.00 0.00 C ATOM 1179 C ILE A 128 67.896 6.255 -67.193 1.00 0.00 C ATOM 1180 O ILE A 128 68.068 5.180 -67.766 1.00 0.00 O ATOM 1181 CB ILE A 128 65.616 7.105 -66.636 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.588 7.325 -65.524 1.00 0.00 C ATOM 1183 CG2 ILE A 128 65.008 6.300 -67.775 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.156 6.047 -64.839 1.00 0.00 C ATOM 0 H ILE A 128 66.870 7.908 -64.634 1.00 0.00 H new ATOM 0 HA ILE A 128 66.576 5.398 -65.731 1.00 0.00 H new ATOM 0 HB ILE A 128 65.917 8.078 -67.024 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.008 8.002 -64.780 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.711 7.817 -65.944 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.128 6.818 -68.158 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.741 6.190 -68.574 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.719 5.315 -67.410 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.427 6.279 -64.062 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.706 5.376 -65.571 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.024 5.564 -64.390 1.00 0.00 H new ATOM 1196 N GLU A 129 68.582 7.354 -67.492 1.00 0.00 N ATOM 1197 CA GLU A 129 69.600 7.357 -68.536 1.00 0.00 C ATOM 1198 C GLU A 129 70.853 6.618 -68.076 1.00 0.00 C ATOM 1199 O GLU A 129 71.473 5.886 -68.847 1.00 0.00 O ATOM 1200 CB GLU A 129 69.956 8.793 -68.928 1.00 0.00 C ATOM 1201 CG GLU A 129 70.498 9.622 -67.775 1.00 0.00 C ATOM 1202 CD GLU A 129 70.670 11.084 -68.138 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.645 11.787 -68.266 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.827 11.525 -68.295 1.00 0.00 O ATOM 0 H GLU A 129 68.451 8.252 -67.027 1.00 0.00 H new ATOM 0 HA GLU A 129 69.194 6.841 -69.406 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.697 8.770 -69.727 1.00 0.00 H new ATOM 0 HB3 GLU A 129 69.069 9.282 -69.330 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.822 9.540 -66.924 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.458 9.214 -67.459 1.00 0.00 H new ATOM 1211 N ALA A 130 71.221 6.817 -66.815 1.00 0.00 N ATOM 1212 CA ALA A 130 72.399 6.170 -66.251 1.00 0.00 C ATOM 1213 C ALA A 130 72.280 4.651 -66.328 1.00 0.00 C ATOM 1214 O ALA A 130 73.185 3.972 -66.814 1.00 0.00 O ATOM 1215 CB ALA A 130 72.606 6.612 -64.810 1.00 0.00 C ATOM 0 H ALA A 130 70.720 7.422 -66.164 1.00 0.00 H new ATOM 0 HA ALA A 130 73.265 6.472 -66.840 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.489 6.121 -64.402 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.744 7.693 -64.777 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.733 6.340 -64.217 1.00 0.00 H new ATOM 1221 N TYR A 131 71.160 4.125 -65.845 1.00 0.00 N ATOM 1222 CA TYR A 131 70.925 2.686 -65.857 1.00 0.00 C ATOM 1223 C TYR A 131 71.091 2.118 -67.263 1.00 0.00 C ATOM 1224 O TYR A 131 71.781 1.118 -67.463 1.00 0.00 O ATOM 1225 CB TYR A 131 69.523 2.373 -65.331 1.00 0.00 C ATOM 1226 CG TYR A 131 69.350 0.938 -64.887 1.00 0.00 C ATOM 1227 CD1 TYR A 131 69.830 0.509 -63.656 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.707 0.012 -65.698 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.674 -0.801 -63.246 1.00 0.00 C ATOM 1230 CE2 TYR A 131 68.545 -1.300 -65.296 1.00 0.00 C ATOM 1231 CZ TYR A 131 69.031 -1.702 -64.069 1.00 0.00 C ATOM 1232 OH TYR A 131 68.873 -3.008 -63.666 1.00 0.00 O ATOM 0 H TYR A 131 70.401 4.673 -65.440 1.00 0.00 H new ATOM 0 HA TYR A 131 71.664 2.218 -65.206 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.303 3.033 -64.492 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.794 2.594 -66.110 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.334 1.211 -63.009 1.00 0.00 H new ATOM 0 HD2 TYR A 131 68.327 0.323 -66.660 1.00 0.00 H new ATOM 0 HE1 TYR A 131 70.054 -1.118 -62.286 1.00 0.00 H new ATOM 0 HE2 TYR A 131 68.041 -2.007 -65.939 1.00 0.00 H new ATOM 0 HH TYR A 131 68.341 -3.034 -62.843 1.00 0.00 H new ATOM 1242 N TRP A 132 70.455 2.764 -68.234 1.00 0.00 N ATOM 1243 CA TRP A 132 70.532 2.324 -69.622 1.00 0.00 C ATOM 1244 C TRP A 132 71.955 2.449 -70.154 1.00 0.00 C ATOM 1245 O TRP A 132 72.409 1.617 -70.939 1.00 0.00 O ATOM 1246 CB TRP A 132 69.576 3.143 -70.491 1.00 0.00 C ATOM 1247 CG TRP A 132 68.152 2.682 -70.405 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.366 2.655 -69.288 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.347 2.181 -71.477 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.121 2.167 -69.602 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.083 1.870 -70.939 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.570 1.967 -72.840 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.049 1.355 -71.716 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.543 1.456 -73.610 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.295 1.155 -73.048 1.00 0.00 C ATOM 0 H TRP A 132 69.881 3.594 -68.086 1.00 0.00 H new ATOM 0 HA TRP A 132 70.240 1.275 -69.662 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.630 4.190 -70.191 1.00 0.00 H new ATOM 0 HB3 TRP A 132 69.905 3.091 -71.529 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.678 2.971 -68.303 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.350 2.045 -68.946 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.528 2.197 -73.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.087 1.122 -71.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 66.705 1.285 -74.664 1.00 0.00 H new ATOM 0 HH2 TRP A 132 64.512 0.758 -73.677 1.00 0.00 H new ATOM 1266 N ASN A 133 72.655 3.493 -69.722 1.00 0.00 N ATOM 1267 CA ASN A 133 74.028 3.726 -70.156 1.00 0.00 C ATOM 1268 C ASN A 133 74.971 2.688 -69.557 1.00 0.00 C ATOM 1269 O ASN A 133 76.014 2.377 -70.132 1.00 0.00 O ATOM 1270 CB ASN A 133 74.479 5.132 -69.758 1.00 0.00 C ATOM 1271 CG ASN A 133 75.836 5.489 -70.334 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.043 5.429 -71.546 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.768 5.862 -69.465 1.00 0.00 N ATOM 0 H ASN A 133 72.294 4.191 -69.072 1.00 0.00 H new ATOM 0 HA ASN A 133 74.060 3.636 -71.242 1.00 0.00 H new ATOM 0 HB2 ASN A 133 73.740 5.858 -70.099 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.518 5.204 -68.671 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.700 6.113 -69.794 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.552 5.897 -68.469 1.00 0.00 H new ATOM 1280 N GLU A 134 74.596 2.154 -68.398 1.00 0.00 N ATOM 1281 CA GLU A 134 75.410 1.151 -67.721 1.00 0.00 C ATOM 1282 C GLU A 134 75.567 -0.096 -68.586 1.00 0.00 C ATOM 1283 O GLU A 134 76.577 -0.797 -68.506 1.00 0.00 O ATOM 1284 CB GLU A 134 74.782 0.777 -66.377 1.00 0.00 C ATOM 1285 CG GLU A 134 75.601 -0.227 -65.581 1.00 0.00 C ATOM 1286 CD GLU A 134 75.038 -0.470 -64.195 1.00 0.00 C ATOM 1287 OE1 GLU A 134 74.705 0.519 -63.508 1.00 0.00 O ATOM 1288 OE2 GLU A 134 74.930 -1.649 -63.796 1.00 0.00 O ATOM 0 H GLU A 134 73.735 2.399 -67.909 1.00 0.00 H new ATOM 0 HA GLU A 134 76.398 1.578 -67.547 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.652 1.681 -65.782 1.00 0.00 H new ATOM 0 HB3 GLU A 134 73.788 0.365 -66.552 1.00 0.00 H new ATOM 0 HG2 GLU A 134 75.639 -1.171 -66.124 1.00 0.00 H new ATOM 0 HG3 GLU A 134 76.626 0.133 -65.495 1.00 0.00 H new ATOM 1295 N HIS A 135 74.562 -0.366 -69.413 1.00 0.00 N ATOM 1296 CA HIS A 135 74.589 -1.529 -70.294 1.00 0.00 C ATOM 1297 C HIS A 135 75.012 -1.132 -71.704 1.00 0.00 C ATOM 1298 O HIS A 135 74.663 -1.797 -72.679 1.00 0.00 O ATOM 1299 CB HIS A 135 73.215 -2.198 -70.331 1.00 0.00 C ATOM 1300 CG HIS A 135 73.274 -3.673 -70.585 1.00 0.00 C ATOM 1301 ND1 HIS A 135 73.327 -4.216 -71.852 1.00 0.00 N ATOM 1302 CD2 HIS A 135 73.289 -4.720 -69.727 1.00 0.00 C ATOM 1303 CE1 HIS A 135 73.371 -5.534 -71.762 1.00 0.00 C ATOM 1304 NE2 HIS A 135 73.349 -5.865 -70.483 1.00 0.00 N ATOM 0 H HIS A 135 73.720 0.204 -69.492 1.00 0.00 H new ATOM 0 HA HIS A 135 75.319 -2.236 -69.900 1.00 0.00 H new ATOM 0 HB2 HIS A 135 72.708 -2.021 -69.382 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.612 -1.728 -71.108 1.00 0.00 H new ATOM 0 HD1 HIS A 135 73.332 -3.684 -72.722 1.00 0.00 H new ATOM 0 HD2 HIS A 135 73.259 -4.665 -68.649 1.00 0.00 H new ATOM 0 HE1 HIS A 135 73.417 -6.223 -72.592 1.00 0.00 H new ATOM 1312 N GLY A 136 75.767 -0.042 -71.806 1.00 0.00 N ATOM 1313 CA GLY A 136 76.225 0.425 -73.102 1.00 0.00 C ATOM 1314 C GLY A 136 75.167 1.221 -73.838 1.00 0.00 C ATOM 1315 O GLY A 136 75.203 1.332 -75.063 1.00 0.00 O ATOM 0 H GLY A 136 76.070 0.526 -71.015 1.00 0.00 H new ATOM 0 HA2 GLY A 136 77.113 1.043 -72.969 1.00 0.00 H new ATOM 0 HA3 GLY A 136 76.520 -0.431 -73.710 1.00 0.00 H new