USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=15 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+ -172:sc= 0.354 (180deg=0.311) USER MOD Single : A 88 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0745) USER MOD Single : A 89 HIS : no HE2:sc= -0.875 K(o=-0.88,f=-5.4!) USER MOD Single : A 91 MET CE :methyl -163:sc= -0.188 (180deg=-0.794) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 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= 0.092 USER MOD Single : A 113 ASN : amide:sc= -3.95 K(o=-4,f=-4.9!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -130:sc= -0.735 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 180:sc= -0.404 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.0187 K(o=-0.019,f=-0.93) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.042 X(o=-0.042,f=-0.042) USER MOD Single : A 135 HIS : no HD1:sc= -0.144 X(o=-0.14,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 67.943 7.177 -49.282 1.00 0.00 N ATOM 463 CA VAL A 82 67.895 8.137 -50.378 1.00 0.00 C ATOM 464 C VAL A 82 68.117 7.449 -51.721 1.00 0.00 C ATOM 465 O VAL A 82 69.118 6.761 -51.920 1.00 0.00 O ATOM 466 CB VAL A 82 68.951 9.245 -50.200 1.00 0.00 C ATOM 467 CG1 VAL A 82 68.863 10.253 -51.336 1.00 0.00 C ATOM 468 CG2 VAL A 82 68.781 9.930 -48.853 1.00 0.00 C ATOM 0 HA VAL A 82 66.902 8.586 -50.363 1.00 0.00 H new ATOM 0 HB VAL A 82 69.941 8.789 -50.227 1.00 0.00 H new ATOM 0 HG11 VAL A 82 69.616 11.028 -51.194 1.00 0.00 H new ATOM 0 HG12 VAL A 82 69.038 9.747 -52.286 1.00 0.00 H new ATOM 0 HG13 VAL A 82 67.872 10.707 -51.344 1.00 0.00 H new ATOM 0 HG21 VAL A 82 69.535 10.710 -48.744 1.00 0.00 H new ATOM 0 HG22 VAL A 82 67.788 10.375 -48.794 1.00 0.00 H new ATOM 0 HG23 VAL A 82 68.899 9.197 -48.055 1.00 0.00 H new ATOM 478 N VAL A 83 67.177 7.641 -52.640 1.00 0.00 N ATOM 479 CA VAL A 83 67.270 7.041 -53.966 1.00 0.00 C ATOM 480 C VAL A 83 68.586 7.406 -54.643 1.00 0.00 C ATOM 481 O VAL A 83 68.849 8.576 -54.919 1.00 0.00 O ATOM 482 CB VAL A 83 66.102 7.485 -54.866 1.00 0.00 C ATOM 483 CG1 VAL A 83 65.989 9.001 -54.886 1.00 0.00 C ATOM 484 CG2 VAL A 83 66.277 6.936 -56.274 1.00 0.00 C ATOM 0 H VAL A 83 66.342 8.207 -52.491 1.00 0.00 H new ATOM 0 HA VAL A 83 67.223 5.961 -53.829 1.00 0.00 H new ATOM 0 HB VAL A 83 65.176 7.082 -54.456 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.158 9.295 -55.527 1.00 0.00 H new ATOM 0 HG12 VAL A 83 65.814 9.366 -53.874 1.00 0.00 H new ATOM 0 HG13 VAL A 83 66.914 9.430 -55.271 1.00 0.00 H new ATOM 0 HG21 VAL A 83 65.443 7.259 -56.897 1.00 0.00 H new ATOM 0 HG22 VAL A 83 67.211 7.308 -56.696 1.00 0.00 H new ATOM 0 HG23 VAL A 83 66.303 5.847 -56.239 1.00 0.00 H new ATOM 494 N GLU A 84 69.409 6.396 -54.908 1.00 0.00 N ATOM 495 CA GLU A 84 70.699 6.611 -55.553 1.00 0.00 C ATOM 496 C GLU A 84 70.590 6.423 -57.064 1.00 0.00 C ATOM 497 O GLU A 84 71.056 7.258 -57.840 1.00 0.00 O ATOM 498 CB GLU A 84 71.746 5.652 -54.983 1.00 0.00 C ATOM 499 CG GLU A 84 73.160 6.207 -55.013 1.00 0.00 C ATOM 500 CD GLU A 84 73.633 6.522 -56.419 1.00 0.00 C ATOM 501 OE1 GLU A 84 73.696 5.590 -57.247 1.00 0.00 O ATOM 502 OE2 GLU A 84 73.941 7.702 -56.690 1.00 0.00 O ATOM 0 H GLU A 84 69.205 5.421 -54.686 1.00 0.00 H new ATOM 0 HA GLU A 84 71.010 7.637 -55.353 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.482 5.409 -53.954 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.718 4.720 -55.548 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.204 7.112 -54.407 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.839 5.486 -54.558 1.00 0.00 H new ATOM 509 N LYS A 85 69.971 5.321 -57.474 1.00 0.00 N ATOM 510 CA LYS A 85 69.799 5.022 -58.890 1.00 0.00 C ATOM 511 C LYS A 85 68.638 4.056 -59.105 1.00 0.00 C ATOM 512 O LYS A 85 68.053 3.550 -58.147 1.00 0.00 O ATOM 513 CB LYS A 85 71.085 4.425 -59.466 1.00 0.00 C ATOM 514 CG LYS A 85 71.633 3.263 -58.656 1.00 0.00 C ATOM 515 CD LYS A 85 71.095 1.933 -59.154 1.00 0.00 C ATOM 516 CE LYS A 85 71.619 1.605 -60.544 1.00 0.00 C ATOM 517 NZ LYS A 85 71.486 0.156 -60.859 1.00 0.00 N ATOM 0 H LYS A 85 69.580 4.620 -56.845 1.00 0.00 H new ATOM 0 HA LYS A 85 69.574 5.954 -59.408 1.00 0.00 H new ATOM 0 HB2 LYS A 85 70.895 4.089 -60.485 1.00 0.00 H new ATOM 0 HB3 LYS A 85 71.843 5.206 -59.525 1.00 0.00 H new ATOM 0 HG2 LYS A 85 72.722 3.260 -58.713 1.00 0.00 H new ATOM 0 HG3 LYS A 85 71.369 3.393 -57.607 1.00 0.00 H new ATOM 0 HD2 LYS A 85 71.380 1.142 -58.461 1.00 0.00 H new ATOM 0 HD3 LYS A 85 70.006 1.964 -59.173 1.00 0.00 H new ATOM 0 HE2 LYS A 85 71.073 2.189 -61.285 1.00 0.00 H new ATOM 0 HE3 LYS A 85 72.667 1.898 -60.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 71.974 -0.051 -61.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 71.911 -0.406 -60.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 70.479 -0.089 -60.949 1.00 0.00 H new ATOM 531 N VAL A 86 68.310 3.804 -60.368 1.00 0.00 N ATOM 532 CA VAL A 86 67.220 2.897 -60.709 1.00 0.00 C ATOM 533 C VAL A 86 67.626 1.444 -60.490 1.00 0.00 C ATOM 534 O VAL A 86 68.742 1.042 -60.822 1.00 0.00 O ATOM 535 CB VAL A 86 66.774 3.079 -62.172 1.00 0.00 C ATOM 536 CG1 VAL A 86 65.673 2.090 -62.521 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.315 4.509 -62.414 1.00 0.00 C ATOM 0 H VAL A 86 68.784 4.215 -61.172 1.00 0.00 H new ATOM 0 HA VAL A 86 66.387 3.142 -60.050 1.00 0.00 H new ATOM 0 HB VAL A 86 67.626 2.881 -62.822 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.371 2.233 -63.558 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.042 1.073 -62.388 1.00 0.00 H new ATOM 0 HG13 VAL A 86 64.816 2.254 -61.867 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.003 4.620 -63.453 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.476 4.738 -61.757 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.136 5.195 -62.206 1.00 0.00 H new ATOM 547 N LEU A 87 66.713 0.658 -59.929 1.00 0.00 N ATOM 548 CA LEU A 87 66.975 -0.753 -59.666 1.00 0.00 C ATOM 549 C LEU A 87 66.702 -1.598 -60.906 1.00 0.00 C ATOM 550 O LEU A 87 67.537 -2.404 -61.318 1.00 0.00 O ATOM 551 CB LEU A 87 66.114 -1.243 -58.501 1.00 0.00 C ATOM 552 CG LEU A 87 66.672 -2.423 -57.704 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.795 -3.654 -58.589 1.00 0.00 C ATOM 554 CD2 LEU A 87 68.019 -2.066 -57.094 1.00 0.00 C ATOM 0 H LEU A 87 65.785 0.974 -59.648 1.00 0.00 H new ATOM 0 HA LEU A 87 68.027 -0.859 -59.402 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.957 -0.410 -57.816 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.136 -1.524 -58.891 1.00 0.00 H new ATOM 0 HG LEU A 87 65.978 -2.650 -56.894 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.194 -4.484 -58.005 1.00 0.00 H new ATOM 0 HD12 LEU A 87 65.813 -3.923 -58.977 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.467 -3.439 -59.420 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.400 -2.918 -56.531 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.722 -1.812 -57.887 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.901 -1.213 -56.426 1.00 0.00 H new ATOM 566 N LYS A 88 65.528 -1.407 -61.499 1.00 0.00 N ATOM 567 CA LYS A 88 65.145 -2.149 -62.694 1.00 0.00 C ATOM 568 C LYS A 88 64.083 -1.392 -63.486 1.00 0.00 C ATOM 569 O LYS A 88 63.456 -0.464 -62.974 1.00 0.00 O ATOM 570 CB LYS A 88 64.621 -3.535 -62.313 1.00 0.00 C ATOM 571 CG LYS A 88 65.714 -4.581 -62.176 1.00 0.00 C ATOM 572 CD LYS A 88 65.133 -5.976 -62.014 1.00 0.00 C ATOM 573 CE LYS A 88 66.227 -7.030 -61.937 1.00 0.00 C ATOM 574 NZ LYS A 88 65.742 -8.289 -61.307 1.00 0.00 N ATOM 0 H LYS A 88 64.825 -0.744 -61.171 1.00 0.00 H new ATOM 0 HA LYS A 88 66.030 -2.262 -63.321 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.078 -3.463 -61.370 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.907 -3.864 -63.068 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.357 -4.554 -63.055 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.340 -4.344 -61.316 1.00 0.00 H new ATOM 0 HD2 LYS A 88 64.524 -6.015 -61.111 1.00 0.00 H new ATOM 0 HD3 LYS A 88 64.473 -6.196 -62.853 1.00 0.00 H new ATOM 0 HE2 LYS A 88 66.596 -7.245 -62.940 1.00 0.00 H new ATOM 0 HE3 LYS A 88 67.068 -6.639 -61.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 66.465 -9.030 -61.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 65.557 -8.123 -60.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 64.864 -8.595 -61.774 1.00 0.00 H new ATOM 588 N HIS A 89 63.884 -1.796 -64.737 1.00 0.00 N ATOM 589 CA HIS A 89 62.895 -1.158 -65.598 1.00 0.00 C ATOM 590 C HIS A 89 61.809 -2.149 -66.006 1.00 0.00 C ATOM 591 O HIS A 89 62.091 -3.315 -66.282 1.00 0.00 O ATOM 592 CB HIS A 89 63.570 -0.581 -66.843 1.00 0.00 C ATOM 593 CG HIS A 89 62.602 -0.127 -67.893 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.491 0.639 -67.611 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.585 -0.334 -69.230 1.00 0.00 C ATOM 596 CE1 HIS A 89 60.831 0.882 -68.729 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.475 0.304 -69.727 1.00 0.00 N ATOM 0 H HIS A 89 64.394 -2.562 -65.177 1.00 0.00 H new ATOM 0 HA HIS A 89 62.429 -0.348 -65.037 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.196 0.261 -66.549 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.230 -1.335 -67.271 1.00 0.00 H new ATOM 0 HD1 HIS A 89 61.221 0.967 -66.684 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.310 -0.896 -69.800 1.00 0.00 H new ATOM 0 HE1 HIS A 89 59.920 1.456 -68.813 1.00 0.00 H new ATOM 605 N ARG A 90 60.567 -1.677 -66.042 1.00 0.00 N ATOM 606 CA ARG A 90 59.439 -2.522 -66.414 1.00 0.00 C ATOM 607 C ARG A 90 58.341 -1.700 -67.083 1.00 0.00 C ATOM 608 O ARG A 90 58.061 -0.573 -66.675 1.00 0.00 O ATOM 609 CB ARG A 90 58.879 -3.233 -65.181 1.00 0.00 C ATOM 610 CG ARG A 90 58.003 -4.430 -65.514 1.00 0.00 C ATOM 611 CD ARG A 90 57.302 -4.969 -64.277 1.00 0.00 C ATOM 612 NE ARG A 90 56.033 -4.291 -64.027 1.00 0.00 N ATOM 613 CZ ARG A 90 54.954 -4.448 -64.786 1.00 0.00 C ATOM 614 NH1 ARG A 90 54.990 -5.256 -65.836 1.00 0.00 N ATOM 615 NH2 ARG A 90 53.836 -3.797 -64.494 1.00 0.00 N ATOM 0 H ARG A 90 60.317 -0.714 -65.818 1.00 0.00 H new ATOM 0 HA ARG A 90 59.795 -3.268 -67.125 1.00 0.00 H new ATOM 0 HB2 ARG A 90 59.708 -3.563 -64.555 1.00 0.00 H new ATOM 0 HB3 ARG A 90 58.299 -2.521 -64.594 1.00 0.00 H new ATOM 0 HG2 ARG A 90 57.260 -4.143 -66.258 1.00 0.00 H new ATOM 0 HG3 ARG A 90 58.613 -5.216 -65.959 1.00 0.00 H new ATOM 0 HD2 ARG A 90 57.124 -6.038 -64.398 1.00 0.00 H new ATOM 0 HD3 ARG A 90 57.953 -4.850 -63.411 1.00 0.00 H new ATOM 0 HE ARG A 90 55.972 -3.663 -63.226 1.00 0.00 H new ATOM 0 HH11 ARG A 90 55.848 -5.759 -66.063 1.00 0.00 H new ATOM 0 HH12 ARG A 90 54.160 -5.375 -66.417 1.00 0.00 H new ATOM 0 HH21 ARG A 90 53.804 -3.175 -63.686 1.00 0.00 H new ATOM 0 HH22 ARG A 90 53.008 -3.918 -65.077 1.00 0.00 H new ATOM 629 N MET A 91 57.725 -2.271 -68.112 1.00 0.00 N ATOM 630 CA MET A 91 56.657 -1.591 -68.836 1.00 0.00 C ATOM 631 C MET A 91 55.292 -2.145 -68.440 1.00 0.00 C ATOM 632 O MET A 91 55.112 -3.357 -68.331 1.00 0.00 O ATOM 633 CB MET A 91 56.862 -1.739 -70.345 1.00 0.00 C ATOM 634 CG MET A 91 56.881 -3.184 -70.818 1.00 0.00 C ATOM 635 SD MET A 91 57.353 -3.342 -72.550 1.00 0.00 S ATOM 636 CE MET A 91 56.324 -2.082 -73.299 1.00 0.00 C ATOM 0 H MET A 91 57.947 -3.203 -68.464 1.00 0.00 H new ATOM 0 HA MET A 91 56.690 -0.534 -68.573 1.00 0.00 H new ATOM 0 HB2 MET A 91 56.066 -1.206 -70.865 1.00 0.00 H new ATOM 0 HB3 MET A 91 57.801 -1.262 -70.624 1.00 0.00 H new ATOM 0 HG2 MET A 91 57.577 -3.754 -70.203 1.00 0.00 H new ATOM 0 HG3 MET A 91 55.894 -3.623 -70.673 1.00 0.00 H new ATOM 0 HE1 MET A 91 56.268 -2.250 -74.375 1.00 0.00 H new ATOM 0 HE2 MET A 91 55.322 -2.129 -72.872 1.00 0.00 H new ATOM 0 HE3 MET A 91 56.755 -1.099 -73.107 1.00 0.00 H new ATOM 646 N ALA A 92 54.335 -1.249 -68.226 1.00 0.00 N ATOM 647 CA ALA A 92 52.986 -1.648 -67.843 1.00 0.00 C ATOM 648 C ALA A 92 52.387 -2.607 -68.867 1.00 0.00 C ATOM 649 O ALA A 92 52.500 -2.392 -70.074 1.00 0.00 O ATOM 650 CB ALA A 92 52.099 -0.423 -67.681 1.00 0.00 C ATOM 0 H ALA A 92 54.468 -0.241 -68.311 1.00 0.00 H new ATOM 0 HA ALA A 92 53.044 -2.168 -66.887 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.095 -0.736 -67.395 1.00 0.00 H new ATOM 0 HB2 ALA A 92 52.511 0.225 -66.907 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.054 0.121 -68.624 1.00 0.00 H new ATOM 716 N GLY A 97 52.489 2.957 -69.528 1.00 0.00 N ATOM 717 CA GLY A 97 53.689 3.578 -70.058 1.00 0.00 C ATOM 718 C GLY A 97 54.951 2.846 -69.647 1.00 0.00 C ATOM 719 O GLY A 97 55.243 1.763 -70.156 1.00 0.00 O ATOM 0 HA2 GLY A 97 53.628 3.608 -71.146 1.00 0.00 H new ATOM 0 HA3 GLY A 97 53.743 4.610 -69.713 1.00 0.00 H new ATOM 723 N TYR A 98 55.702 3.438 -68.725 1.00 0.00 N ATOM 724 CA TYR A 98 56.943 2.837 -68.249 1.00 0.00 C ATOM 725 C TYR A 98 57.083 3.001 -66.739 1.00 0.00 C ATOM 726 O TYR A 98 56.500 3.908 -66.146 1.00 0.00 O ATOM 727 CB TYR A 98 58.144 3.468 -68.955 1.00 0.00 C ATOM 728 CG TYR A 98 58.306 3.020 -70.390 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.191 1.680 -70.738 1.00 0.00 C ATOM 730 CD2 TYR A 98 58.574 3.938 -71.399 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.340 1.266 -72.047 1.00 0.00 C ATOM 732 CE2 TYR A 98 58.723 3.533 -72.711 1.00 0.00 C ATOM 733 CZ TYR A 98 58.605 2.197 -73.031 1.00 0.00 C ATOM 734 OH TYR A 98 58.753 1.789 -74.337 1.00 0.00 O ATOM 0 H TYR A 98 55.474 4.333 -68.292 1.00 0.00 H new ATOM 0 HA TYR A 98 56.913 1.772 -68.480 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.040 4.553 -68.931 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.050 3.222 -68.402 1.00 0.00 H new ATOM 0 HD1 TYR A 98 57.981 0.949 -69.971 1.00 0.00 H new ATOM 0 HD2 TYR A 98 58.667 4.985 -71.153 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.250 0.220 -72.299 1.00 0.00 H new ATOM 0 HE2 TYR A 98 58.931 4.259 -73.483 1.00 0.00 H new ATOM 0 HH TYR A 98 58.935 2.567 -74.904 1.00 0.00 H new ATOM 744 N GLU A 99 57.861 2.116 -66.124 1.00 0.00 N ATOM 745 CA GLU A 99 58.078 2.162 -64.682 1.00 0.00 C ATOM 746 C GLU A 99 59.536 1.866 -64.342 1.00 0.00 C ATOM 747 O GLU A 99 60.233 1.179 -65.090 1.00 0.00 O ATOM 748 CB GLU A 99 57.165 1.159 -63.974 1.00 0.00 C ATOM 749 CG GLU A 99 55.687 1.386 -64.245 1.00 0.00 C ATOM 750 CD GLU A 99 54.812 0.996 -63.070 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.149 1.376 -61.929 1.00 0.00 O ATOM 752 OE2 GLU A 99 53.791 0.312 -63.290 1.00 0.00 O ATOM 0 H GLU A 99 58.351 1.359 -66.601 1.00 0.00 H new ATOM 0 HA GLU A 99 57.838 3.168 -64.336 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.433 0.151 -64.289 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.342 1.215 -62.900 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.522 2.437 -64.483 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.390 0.810 -65.122 1.00 0.00 H new ATOM 759 N TYR A 100 59.991 2.391 -63.210 1.00 0.00 N ATOM 760 CA TYR A 100 61.366 2.187 -62.771 1.00 0.00 C ATOM 761 C TYR A 100 61.445 2.096 -61.250 1.00 0.00 C ATOM 762 O TYR A 100 60.823 2.884 -60.536 1.00 0.00 O ATOM 763 CB TYR A 100 62.258 3.325 -63.272 1.00 0.00 C ATOM 764 CG TYR A 100 62.012 3.695 -64.717 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.003 4.586 -65.064 1.00 0.00 C ATOM 766 CD2 TYR A 100 62.786 3.153 -65.736 1.00 0.00 C ATOM 767 CE1 TYR A 100 60.774 4.927 -66.383 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.565 3.490 -67.057 1.00 0.00 C ATOM 769 CZ TYR A 100 61.558 4.377 -67.376 1.00 0.00 C ATOM 770 OH TYR A 100 61.334 4.713 -68.691 1.00 0.00 O ATOM 0 H TYR A 100 59.427 2.961 -62.580 1.00 0.00 H new ATOM 0 HA TYR A 100 61.719 1.245 -63.192 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.096 4.204 -62.648 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.302 3.037 -63.152 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.388 5.019 -64.289 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.574 2.456 -65.491 1.00 0.00 H new ATOM 0 HE1 TYR A 100 59.985 5.620 -66.635 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.178 3.061 -67.836 1.00 0.00 H new ATOM 0 HH TYR A 100 61.973 4.239 -69.263 1.00 0.00 H new ATOM 780 N LEU A 101 62.216 1.131 -60.761 1.00 0.00 N ATOM 781 CA LEU A 101 62.379 0.936 -59.324 1.00 0.00 C ATOM 782 C LEU A 101 63.420 1.896 -58.759 1.00 0.00 C ATOM 783 O LEU A 101 64.433 2.180 -59.401 1.00 0.00 O ATOM 784 CB LEU A 101 62.787 -0.508 -59.029 1.00 0.00 C ATOM 785 CG LEU A 101 61.654 -1.535 -59.010 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.065 -2.798 -59.751 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.254 -1.861 -57.578 1.00 0.00 C ATOM 0 H LEU A 101 62.738 0.471 -61.338 1.00 0.00 H new ATOM 0 HA LEU A 101 61.423 1.143 -58.843 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.519 -0.817 -59.775 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.289 -0.532 -58.062 1.00 0.00 H new ATOM 0 HG LEU A 101 60.791 -1.105 -59.519 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.246 -3.517 -59.727 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.301 -2.552 -60.786 1.00 0.00 H new ATOM 0 HD13 LEU A 101 62.943 -3.232 -59.272 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.447 -2.593 -57.583 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.112 -2.271 -57.045 1.00 0.00 H new ATOM 0 HD23 LEU A 101 60.917 -0.953 -57.079 1.00 0.00 H new ATOM 799 N LEU A 102 63.166 2.393 -57.553 1.00 0.00 N ATOM 800 CA LEU A 102 64.083 3.320 -56.899 1.00 0.00 C ATOM 801 C LEU A 102 64.998 2.585 -55.925 1.00 0.00 C ATOM 802 O LEU A 102 64.547 2.066 -54.904 1.00 0.00 O ATOM 803 CB LEU A 102 63.300 4.407 -56.160 1.00 0.00 C ATOM 804 CG LEU A 102 62.107 5.002 -56.910 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.172 5.714 -55.945 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.583 5.955 -57.996 1.00 0.00 C ATOM 0 H LEU A 102 62.333 2.170 -57.009 1.00 0.00 H new ATOM 0 HA LEU A 102 64.700 3.785 -57.668 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.941 3.992 -55.218 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.987 5.216 -55.911 1.00 0.00 H new ATOM 0 HG LEU A 102 61.556 4.189 -57.383 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.329 6.131 -56.496 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.805 5.004 -55.203 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.711 6.518 -55.443 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.721 6.369 -58.520 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.157 6.764 -57.544 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.213 5.415 -58.703 1.00 0.00 H new ATOM 818 N LYS A 103 66.287 2.547 -56.246 1.00 0.00 N ATOM 819 CA LYS A 103 67.268 1.880 -55.399 1.00 0.00 C ATOM 820 C LYS A 103 67.777 2.820 -54.311 1.00 0.00 C ATOM 821 O LYS A 103 68.225 3.930 -54.597 1.00 0.00 O ATOM 822 CB LYS A 103 68.441 1.375 -56.242 1.00 0.00 C ATOM 823 CG LYS A 103 69.342 0.398 -55.507 1.00 0.00 C ATOM 824 CD LYS A 103 70.479 -0.086 -56.392 1.00 0.00 C ATOM 825 CE LYS A 103 71.043 -1.411 -55.900 1.00 0.00 C ATOM 826 NZ LYS A 103 72.504 -1.525 -56.167 1.00 0.00 N ATOM 0 H LYS A 103 66.677 2.971 -57.088 1.00 0.00 H new ATOM 0 HA LYS A 103 66.780 1.031 -54.921 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.052 0.893 -57.139 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.035 2.228 -56.570 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.751 0.877 -54.617 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.755 -0.456 -55.168 1.00 0.00 H new ATOM 0 HD2 LYS A 103 70.122 -0.199 -57.416 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.271 0.663 -56.411 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.861 -1.508 -54.830 1.00 0.00 H new ATOM 0 HE3 LYS A 103 70.519 -2.233 -56.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 72.850 -2.441 -55.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.676 -1.458 -57.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 73.007 -0.756 -55.680 1.00 0.00 H new ATOM 840 N TRP A 104 67.705 2.368 -53.064 1.00 0.00 N ATOM 841 CA TRP A 104 68.160 3.169 -51.934 1.00 0.00 C ATOM 842 C TRP A 104 69.679 3.121 -51.808 1.00 0.00 C ATOM 843 O TRP A 104 70.281 2.049 -51.864 1.00 0.00 O ATOM 844 CB TRP A 104 67.513 2.675 -50.639 1.00 0.00 C ATOM 845 CG TRP A 104 66.016 2.738 -50.661 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.152 1.682 -50.713 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.208 3.920 -50.635 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.855 2.136 -50.720 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.862 3.504 -50.672 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.489 5.287 -50.582 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.804 4.409 -50.659 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.438 6.184 -50.569 1.00 0.00 C ATOM 853 CH2 TRP A 104 63.108 5.742 -50.606 1.00 0.00 C ATOM 0 H TRP A 104 67.336 1.452 -52.810 1.00 0.00 H new ATOM 0 HA TRP A 104 67.862 4.202 -52.110 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.823 1.646 -50.456 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.882 3.273 -49.806 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.445 0.643 -50.744 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.022 1.549 -50.755 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.510 5.637 -50.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.779 4.071 -50.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.645 7.243 -50.530 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.308 6.468 -50.592 1.00 0.00 H new ATOM 864 N GLU A 105 70.292 4.288 -51.639 1.00 0.00 N ATOM 865 CA GLU A 105 71.742 4.377 -51.506 1.00 0.00 C ATOM 866 C GLU A 105 72.223 3.612 -50.277 1.00 0.00 C ATOM 867 O GLU A 105 71.782 3.872 -49.158 1.00 0.00 O ATOM 868 CB GLU A 105 72.179 5.840 -51.414 1.00 0.00 C ATOM 869 CG GLU A 105 73.662 6.049 -51.669 1.00 0.00 C ATOM 870 CD GLU A 105 73.995 7.482 -52.038 1.00 0.00 C ATOM 871 OE1 GLU A 105 73.268 8.393 -51.588 1.00 0.00 O ATOM 872 OE2 GLU A 105 74.980 7.692 -52.776 1.00 0.00 O ATOM 0 H GLU A 105 69.808 5.185 -51.591 1.00 0.00 H new ATOM 0 HA GLU A 105 72.191 3.927 -52.391 1.00 0.00 H new ATOM 0 HB2 GLU A 105 71.609 6.427 -52.134 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.932 6.223 -50.424 1.00 0.00 H new ATOM 0 HG2 GLU A 105 74.223 5.768 -50.778 1.00 0.00 H new ATOM 0 HG3 GLU A 105 73.986 5.387 -52.472 1.00 0.00 H new ATOM 879 N GLY A 106 73.132 2.666 -50.494 1.00 0.00 N ATOM 880 CA GLY A 106 73.658 1.877 -49.396 1.00 0.00 C ATOM 881 C GLY A 106 72.879 0.595 -49.177 1.00 0.00 C ATOM 882 O GLY A 106 73.445 -0.423 -48.779 1.00 0.00 O ATOM 0 H GLY A 106 73.513 2.432 -51.411 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.702 1.635 -49.595 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.637 2.472 -48.483 1.00 0.00 H new ATOM 886 N TYR A 107 71.577 0.645 -49.436 1.00 0.00 N ATOM 887 CA TYR A 107 70.718 -0.520 -49.261 1.00 0.00 C ATOM 888 C TYR A 107 70.378 -1.153 -50.607 1.00 0.00 C ATOM 889 O TYR A 107 69.861 -0.488 -51.505 1.00 0.00 O ATOM 890 CB TYR A 107 69.434 -0.128 -48.529 1.00 0.00 C ATOM 891 CG TYR A 107 69.670 0.746 -47.318 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.897 0.186 -46.067 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.666 2.131 -47.425 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.112 0.981 -44.958 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.882 2.934 -46.322 1.00 0.00 C ATOM 896 CZ TYR A 107 70.104 2.354 -45.090 1.00 0.00 C ATOM 897 OH TYR A 107 70.319 3.149 -43.988 1.00 0.00 O ATOM 0 H TYR A 107 71.094 1.480 -49.768 1.00 0.00 H new ATOM 0 HA TYR A 107 71.259 -1.253 -48.662 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.776 0.396 -49.222 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.913 -1.033 -48.217 1.00 0.00 H new ATOM 0 HD1 TYR A 107 69.906 -0.889 -45.960 1.00 0.00 H new ATOM 0 HD2 TYR A 107 69.491 2.588 -48.388 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.286 0.530 -43.992 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.877 4.009 -46.423 1.00 0.00 H new ATOM 0 HH TYR A 107 70.282 4.092 -44.253 1.00 0.00 H new ATOM 907 N ASP A 108 70.669 -2.442 -50.738 1.00 0.00 N ATOM 908 CA ASP A 108 70.393 -3.167 -51.973 1.00 0.00 C ATOM 909 C ASP A 108 69.185 -4.084 -51.806 1.00 0.00 C ATOM 910 O ASP A 108 69.309 -5.206 -51.314 1.00 0.00 O ATOM 911 CB ASP A 108 71.615 -3.984 -52.394 1.00 0.00 C ATOM 912 CG ASP A 108 72.279 -4.679 -51.222 1.00 0.00 C ATOM 913 OD1 ASP A 108 71.843 -5.795 -50.868 1.00 0.00 O ATOM 914 OD2 ASP A 108 73.236 -4.108 -50.658 1.00 0.00 O ATOM 0 H ASP A 108 71.096 -3.007 -50.004 1.00 0.00 H new ATOM 0 HA ASP A 108 70.168 -2.438 -52.751 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.314 -4.729 -53.131 1.00 0.00 H new ATOM 0 HB3 ASP A 108 72.337 -3.328 -52.880 1.00 0.00 H new ATOM 919 N ASP A 109 68.019 -3.599 -52.217 1.00 0.00 N ATOM 920 CA ASP A 109 66.789 -4.375 -52.113 1.00 0.00 C ATOM 921 C ASP A 109 66.579 -5.231 -53.359 1.00 0.00 C ATOM 922 O ASP A 109 67.129 -4.961 -54.427 1.00 0.00 O ATOM 923 CB ASP A 109 65.591 -3.446 -51.910 1.00 0.00 C ATOM 924 CG ASP A 109 64.976 -3.588 -50.532 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.714 -3.443 -49.535 1.00 0.00 O ATOM 926 OD2 ASP A 109 63.756 -3.844 -50.449 1.00 0.00 O ATOM 0 H ASP A 109 67.900 -2.672 -52.625 1.00 0.00 H new ATOM 0 HA ASP A 109 66.877 -5.036 -51.251 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.906 -2.413 -52.059 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.836 -3.661 -52.666 1.00 0.00 H new ATOM 931 N PRO A 110 65.766 -6.288 -53.220 1.00 0.00 N ATOM 932 CA PRO A 110 65.466 -7.206 -54.324 1.00 0.00 C ATOM 933 C PRO A 110 64.600 -6.556 -55.398 1.00 0.00 C ATOM 934 O PRO A 110 64.450 -5.335 -55.433 1.00 0.00 O ATOM 935 CB PRO A 110 64.706 -8.345 -53.641 1.00 0.00 C ATOM 936 CG PRO A 110 64.105 -7.726 -52.426 1.00 0.00 C ATOM 937 CD PRO A 110 65.077 -6.670 -51.976 1.00 0.00 C ATOM 0 HA PRO A 110 66.368 -7.529 -54.843 1.00 0.00 H new ATOM 0 HB2 PRO A 110 63.938 -8.757 -54.296 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.374 -9.165 -53.378 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.132 -7.290 -52.651 1.00 0.00 H new ATOM 0 HG3 PRO A 110 63.948 -8.470 -51.645 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.566 -5.821 -51.523 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.774 -7.056 -51.233 1.00 0.00 H new ATOM 945 N SER A 111 64.031 -7.381 -56.271 1.00 0.00 N ATOM 946 CA SER A 111 63.182 -6.886 -57.349 1.00 0.00 C ATOM 947 C SER A 111 61.839 -6.407 -56.806 1.00 0.00 C ATOM 948 O SER A 111 61.025 -5.847 -57.539 1.00 0.00 O ATOM 949 CB SER A 111 62.960 -7.980 -58.395 1.00 0.00 C ATOM 950 OG SER A 111 63.028 -9.268 -57.808 1.00 0.00 O ATOM 0 H SER A 111 64.142 -8.395 -56.253 1.00 0.00 H new ATOM 0 HA SER A 111 63.687 -6.042 -57.818 1.00 0.00 H new ATOM 0 HB2 SER A 111 61.988 -7.843 -58.868 1.00 0.00 H new ATOM 0 HB3 SER A 111 63.711 -7.895 -59.180 1.00 0.00 H new ATOM 0 HG SER A 111 62.881 -9.950 -58.497 1.00 0.00 H new ATOM 956 N ASP A 112 61.616 -6.631 -55.515 1.00 0.00 N ATOM 957 CA ASP A 112 60.373 -6.221 -54.872 1.00 0.00 C ATOM 958 C ASP A 112 60.497 -4.813 -54.298 1.00 0.00 C ATOM 959 O ASP A 112 59.686 -4.395 -53.474 1.00 0.00 O ATOM 960 CB ASP A 112 60.000 -7.206 -53.763 1.00 0.00 C ATOM 961 CG ASP A 112 59.176 -8.371 -54.276 1.00 0.00 C ATOM 962 OD1 ASP A 112 58.047 -8.134 -54.753 1.00 0.00 O ATOM 963 OD2 ASP A 112 59.661 -9.519 -54.200 1.00 0.00 O ATOM 0 H ASP A 112 62.280 -7.094 -54.894 1.00 0.00 H new ATOM 0 HA ASP A 112 59.586 -6.218 -55.626 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.909 -7.585 -53.297 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.440 -6.682 -52.989 1.00 0.00 H new ATOM 968 N ASN A 113 61.519 -4.087 -54.740 1.00 0.00 N ATOM 969 CA ASN A 113 61.749 -2.726 -54.270 1.00 0.00 C ATOM 970 C ASN A 113 60.551 -1.833 -54.579 1.00 0.00 C ATOM 971 O ASN A 113 59.487 -2.315 -54.967 1.00 0.00 O ATOM 972 CB ASN A 113 63.010 -2.148 -54.915 1.00 0.00 C ATOM 973 CG ASN A 113 64.018 -1.669 -53.888 1.00 0.00 C ATOM 974 OD1 ASN A 113 63.669 -1.399 -52.739 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.276 -1.562 -54.300 1.00 0.00 N ATOM 0 H ASN A 113 62.201 -4.418 -55.423 1.00 0.00 H new ATOM 0 HA ASN A 113 61.884 -2.760 -53.189 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.472 -2.907 -55.547 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.734 -1.317 -55.564 1.00 0.00 H new ATOM 0 HD21 ASN A 113 65.999 -1.245 -53.654 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.519 -1.797 -55.262 1.00 0.00 H new ATOM 982 N THR A 114 60.733 -0.527 -54.405 1.00 0.00 N ATOM 983 CA THR A 114 59.668 0.433 -54.664 1.00 0.00 C ATOM 984 C THR A 114 59.602 0.796 -56.143 1.00 0.00 C ATOM 985 O THR A 114 60.595 1.225 -56.731 1.00 0.00 O ATOM 986 CB THR A 114 59.860 1.720 -53.840 1.00 0.00 C ATOM 987 OG1 THR A 114 58.809 2.649 -54.130 1.00 0.00 O ATOM 988 CG2 THR A 114 61.207 2.360 -54.140 1.00 0.00 C ATOM 0 H THR A 114 61.608 -0.111 -54.086 1.00 0.00 H new ATOM 0 HA THR A 114 58.734 -0.044 -54.368 1.00 0.00 H new ATOM 0 HB THR A 114 59.829 1.456 -52.783 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.937 3.464 -53.601 1.00 0.00 H new ATOM 0 HG21 THR A 114 61.319 3.267 -53.546 1.00 0.00 H new ATOM 0 HG22 THR A 114 62.005 1.661 -53.890 1.00 0.00 H new ATOM 0 HG23 THR A 114 61.263 2.611 -55.199 1.00 0.00 H new ATOM 996 N TRP A 115 58.428 0.621 -56.738 1.00 0.00 N ATOM 997 CA TRP A 115 58.234 0.931 -58.150 1.00 0.00 C ATOM 998 C TRP A 115 57.756 2.367 -58.332 1.00 0.00 C ATOM 999 O TRP A 115 56.668 2.730 -57.884 1.00 0.00 O ATOM 1000 CB TRP A 115 57.226 -0.038 -58.772 1.00 0.00 C ATOM 1001 CG TRP A 115 57.656 -1.471 -58.697 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.503 -2.318 -57.637 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.311 -2.225 -59.723 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.023 -3.553 -57.942 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.524 -3.522 -59.217 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.736 -1.930 -61.022 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.144 -4.519 -59.964 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.352 -2.922 -61.762 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.551 -4.204 -61.232 1.00 0.00 C ATOM 0 H TRP A 115 57.596 0.266 -56.266 1.00 0.00 H new ATOM 0 HA TRP A 115 59.193 0.821 -58.656 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.267 0.073 -58.267 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.069 0.233 -59.816 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.041 -2.056 -56.697 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.034 -4.361 -57.320 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.586 -0.945 -61.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.299 -5.507 -59.557 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.686 -2.705 -62.766 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.035 -4.958 -61.836 1.00 0.00 H new ATOM 1020 N SER A 116 58.575 3.180 -58.991 1.00 0.00 N ATOM 1021 CA SER A 116 58.237 4.579 -59.228 1.00 0.00 C ATOM 1022 C SER A 116 57.730 4.781 -60.653 1.00 0.00 C ATOM 1023 O SER A 116 58.166 4.100 -61.581 1.00 0.00 O ATOM 1024 CB SER A 116 59.454 5.470 -58.976 1.00 0.00 C ATOM 1025 OG SER A 116 59.549 6.492 -59.953 1.00 0.00 O ATOM 0 H SER A 116 59.478 2.894 -59.371 1.00 0.00 H new ATOM 0 HA SER A 116 57.443 4.858 -58.535 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.383 5.916 -57.984 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.361 4.865 -58.989 1.00 0.00 H new ATOM 0 HG SER A 116 60.457 6.510 -60.320 1.00 0.00 H new ATOM 1031 N SER A 117 56.807 5.723 -60.818 1.00 0.00 N ATOM 1032 CA SER A 117 56.237 6.013 -62.128 1.00 0.00 C ATOM 1033 C SER A 117 57.231 6.779 -62.995 1.00 0.00 C ATOM 1034 O SER A 117 58.204 7.341 -62.493 1.00 0.00 O ATOM 1035 CB SER A 117 54.946 6.820 -61.978 1.00 0.00 C ATOM 1036 OG SER A 117 53.846 5.975 -61.689 1.00 0.00 O ATOM 0 H SER A 117 56.438 6.298 -60.061 1.00 0.00 H new ATOM 0 HA SER A 117 56.010 5.065 -62.617 1.00 0.00 H new ATOM 0 HB2 SER A 117 55.063 7.554 -61.181 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.751 7.374 -62.896 1.00 0.00 H new ATOM 0 HG SER A 117 53.034 6.515 -61.596 1.00 0.00 H new ATOM 1042 N GLU A 118 56.978 6.797 -64.300 1.00 0.00 N ATOM 1043 CA GLU A 118 57.852 7.493 -65.238 1.00 0.00 C ATOM 1044 C GLU A 118 57.914 8.984 -64.918 1.00 0.00 C ATOM 1045 O GLU A 118 58.880 9.663 -65.264 1.00 0.00 O ATOM 1046 CB GLU A 118 57.363 7.288 -66.673 1.00 0.00 C ATOM 1047 CG GLU A 118 55.918 7.705 -66.889 1.00 0.00 C ATOM 1048 CD GLU A 118 55.755 9.209 -66.995 1.00 0.00 C ATOM 1049 OE1 GLU A 118 56.560 9.844 -67.708 1.00 0.00 O ATOM 1050 OE2 GLU A 118 54.822 9.751 -66.366 1.00 0.00 O ATOM 0 H GLU A 118 56.176 6.338 -64.732 1.00 0.00 H new ATOM 0 HA GLU A 118 58.854 7.076 -65.141 1.00 0.00 H new ATOM 0 HB2 GLU A 118 58.001 7.856 -67.350 1.00 0.00 H new ATOM 0 HB3 GLU A 118 57.472 6.237 -66.938 1.00 0.00 H new ATOM 0 HG2 GLU A 118 55.541 7.237 -67.798 1.00 0.00 H new ATOM 0 HG3 GLU A 118 55.310 7.334 -66.064 1.00 0.00 H new ATOM 1057 N ALA A 119 56.877 9.485 -64.257 1.00 0.00 N ATOM 1058 CA ALA A 119 56.814 10.895 -63.889 1.00 0.00 C ATOM 1059 C ALA A 119 58.028 11.301 -63.062 1.00 0.00 C ATOM 1060 O ALA A 119 58.421 12.468 -63.050 1.00 0.00 O ATOM 1061 CB ALA A 119 55.531 11.184 -63.124 1.00 0.00 C ATOM 0 H ALA A 119 56.068 8.936 -63.965 1.00 0.00 H new ATOM 0 HA ALA A 119 56.818 11.485 -64.806 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.497 12.240 -62.856 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.672 10.941 -63.749 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.503 10.578 -62.218 1.00 0.00 H new ATOM 1067 N ASP A 120 58.618 10.332 -62.370 1.00 0.00 N ATOM 1068 CA ASP A 120 59.789 10.589 -61.539 1.00 0.00 C ATOM 1069 C ASP A 120 61.010 10.895 -62.401 1.00 0.00 C ATOM 1070 O ASP A 120 61.984 11.482 -61.929 1.00 0.00 O ATOM 1071 CB ASP A 120 60.074 9.388 -60.637 1.00 0.00 C ATOM 1072 CG ASP A 120 59.687 9.644 -59.193 1.00 0.00 C ATOM 1073 OD1 ASP A 120 58.599 10.211 -58.962 1.00 0.00 O ATOM 1074 OD2 ASP A 120 60.473 9.279 -58.294 1.00 0.00 O ATOM 0 H ASP A 120 58.305 9.361 -62.368 1.00 0.00 H new ATOM 0 HA ASP A 120 59.579 11.459 -60.917 1.00 0.00 H new ATOM 0 HB2 ASP A 120 59.528 8.521 -61.008 1.00 0.00 H new ATOM 0 HB3 ASP A 120 61.135 9.143 -60.688 1.00 0.00 H new ATOM 1079 N CYS A 121 60.951 10.492 -63.665 1.00 0.00 N ATOM 1080 CA CYS A 121 62.053 10.720 -64.593 1.00 0.00 C ATOM 1081 C CYS A 121 62.417 12.200 -64.651 1.00 0.00 C ATOM 1082 O CYS A 121 63.585 12.558 -64.802 1.00 0.00 O ATOM 1083 CB CYS A 121 61.685 10.218 -65.990 1.00 0.00 C ATOM 1084 SG CYS A 121 63.031 10.327 -67.192 1.00 0.00 S ATOM 0 H CYS A 121 60.152 10.006 -64.071 1.00 0.00 H new ATOM 0 HA CYS A 121 62.919 10.165 -64.233 1.00 0.00 H new ATOM 0 HB2 CYS A 121 61.360 9.180 -65.917 1.00 0.00 H new ATOM 0 HB3 CYS A 121 60.835 10.793 -66.359 1.00 0.00 H new ATOM 0 HG CYS A 121 62.623 9.878 -68.342 1.00 0.00 H new ATOM 1090 N SER A 122 61.408 13.057 -64.532 1.00 0.00 N ATOM 1091 CA SER A 122 61.620 14.499 -64.577 1.00 0.00 C ATOM 1092 C SER A 122 62.486 14.957 -63.407 1.00 0.00 C ATOM 1093 O SER A 122 63.038 16.057 -63.422 1.00 0.00 O ATOM 1094 CB SER A 122 60.278 15.235 -64.551 1.00 0.00 C ATOM 1095 OG SER A 122 60.338 16.375 -63.712 1.00 0.00 O ATOM 0 H SER A 122 60.435 12.778 -64.404 1.00 0.00 H new ATOM 0 HA SER A 122 62.138 14.736 -65.506 1.00 0.00 H new ATOM 0 HB2 SER A 122 60.006 15.538 -65.562 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.497 14.561 -64.199 1.00 0.00 H new ATOM 0 HG SER A 122 59.469 16.829 -63.714 1.00 0.00 H new ATOM 1101 N GLY A 123 62.599 14.104 -62.393 1.00 0.00 N ATOM 1102 CA GLY A 123 63.399 14.438 -61.229 1.00 0.00 C ATOM 1103 C GLY A 123 64.673 13.621 -61.147 1.00 0.00 C ATOM 1104 O GLY A 123 65.737 14.149 -60.820 1.00 0.00 O ATOM 0 H GLY A 123 62.151 13.188 -62.357 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.652 15.498 -61.258 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.808 14.276 -60.327 1.00 0.00 H new ATOM 1108 N CYS A 124 64.566 12.331 -61.442 1.00 0.00 N ATOM 1109 CA CYS A 124 65.719 11.438 -61.398 1.00 0.00 C ATOM 1110 C CYS A 124 66.143 11.027 -62.804 1.00 0.00 C ATOM 1111 O CYS A 124 66.548 9.888 -63.034 1.00 0.00 O ATOM 1112 CB CYS A 124 65.397 10.196 -60.565 1.00 0.00 C ATOM 1113 SG CYS A 124 64.959 10.552 -58.847 1.00 0.00 S ATOM 0 H CYS A 124 63.693 11.879 -61.714 1.00 0.00 H new ATOM 0 HA CYS A 124 66.545 11.975 -60.932 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.573 9.660 -61.035 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.259 9.529 -60.578 1.00 0.00 H new ATOM 0 HG CYS A 124 64.702 9.440 -58.225 1.00 0.00 H new ATOM 1119 N LYS A 125 66.045 11.962 -63.743 1.00 0.00 N ATOM 1120 CA LYS A 125 66.418 11.699 -65.127 1.00 0.00 C ATOM 1121 C LYS A 125 67.805 11.070 -65.207 1.00 0.00 C ATOM 1122 O LYS A 125 68.006 10.076 -65.904 1.00 0.00 O ATOM 1123 CB LYS A 125 66.386 12.995 -65.941 1.00 0.00 C ATOM 1124 CG LYS A 125 67.163 14.133 -65.303 1.00 0.00 C ATOM 1125 CD LYS A 125 66.923 15.447 -66.027 1.00 0.00 C ATOM 1126 CE LYS A 125 67.900 16.521 -65.572 1.00 0.00 C ATOM 1127 NZ LYS A 125 67.530 17.865 -66.095 1.00 0.00 N ATOM 0 H LYS A 125 65.710 12.910 -63.570 1.00 0.00 H new ATOM 0 HA LYS A 125 65.696 10.997 -65.544 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.792 12.801 -66.934 1.00 0.00 H new ATOM 0 HB3 LYS A 125 65.349 13.304 -66.075 1.00 0.00 H new ATOM 0 HG2 LYS A 125 66.870 14.234 -64.258 1.00 0.00 H new ATOM 0 HG3 LYS A 125 68.228 13.899 -65.315 1.00 0.00 H new ATOM 0 HD2 LYS A 125 67.023 15.295 -67.102 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.902 15.782 -65.846 1.00 0.00 H new ATOM 0 HE2 LYS A 125 67.926 16.550 -64.483 1.00 0.00 H new ATOM 0 HE3 LYS A 125 68.904 16.264 -65.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 68.220 18.569 -65.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 67.529 17.845 -67.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 66.582 18.122 -65.753 1.00 0.00 H new ATOM 1141 N GLN A 126 68.758 11.656 -64.489 1.00 0.00 N ATOM 1142 CA GLN A 126 70.126 11.151 -64.479 1.00 0.00 C ATOM 1143 C GLN A 126 70.154 9.662 -64.150 1.00 0.00 C ATOM 1144 O GLN A 126 70.962 8.910 -64.696 1.00 0.00 O ATOM 1145 CB GLN A 126 70.970 11.926 -63.466 1.00 0.00 C ATOM 1146 CG GLN A 126 70.282 12.123 -62.125 1.00 0.00 C ATOM 1147 CD GLN A 126 71.266 12.316 -60.987 1.00 0.00 C ATOM 1148 OE1 GLN A 126 72.440 12.614 -61.210 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.791 12.148 -59.759 1.00 0.00 N ATOM 0 H GLN A 126 68.608 12.480 -63.907 1.00 0.00 H new ATOM 0 HA GLN A 126 70.546 11.292 -65.475 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.910 11.397 -63.308 1.00 0.00 H new ATOM 0 HB3 GLN A 126 71.219 12.901 -63.884 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.624 12.990 -62.182 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.653 11.259 -61.913 1.00 0.00 H new ATOM 0 HE21 GLN A 126 69.811 11.901 -59.621 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.406 12.266 -58.954 1.00 0.00 H new ATOM 1158 N LEU A 127 69.268 9.243 -63.254 1.00 0.00 N ATOM 1159 CA LEU A 127 69.191 7.843 -62.851 1.00 0.00 C ATOM 1160 C LEU A 127 68.577 6.990 -63.957 1.00 0.00 C ATOM 1161 O LEU A 127 69.119 5.947 -64.323 1.00 0.00 O ATOM 1162 CB LEU A 127 68.368 7.705 -61.569 1.00 0.00 C ATOM 1163 CG LEU A 127 68.741 8.651 -60.427 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.040 8.239 -59.142 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.250 8.678 -60.228 1.00 0.00 C ATOM 0 H LEU A 127 68.593 9.852 -62.792 1.00 0.00 H new ATOM 0 HA LEU A 127 70.205 7.489 -62.665 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.318 7.862 -61.816 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.461 6.680 -61.210 1.00 0.00 H new ATOM 0 HG LEU A 127 68.411 9.656 -60.691 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.318 8.924 -58.341 1.00 0.00 H new ATOM 0 HD12 LEU A 127 66.961 8.272 -59.290 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.339 7.226 -58.873 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.497 9.356 -59.411 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.603 7.675 -59.986 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.732 9.022 -61.143 1.00 0.00 H new ATOM 1177 N ILE A 128 67.446 7.443 -64.487 1.00 0.00 N ATOM 1178 CA ILE A 128 66.761 6.724 -65.553 1.00 0.00 C ATOM 1179 C ILE A 128 67.704 6.435 -66.716 1.00 0.00 C ATOM 1180 O ILE A 128 67.741 5.320 -67.235 1.00 0.00 O ATOM 1181 CB ILE A 128 65.547 7.515 -66.076 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.621 7.895 -64.919 1.00 0.00 C ATOM 1183 CG2 ILE A 128 64.794 6.701 -67.119 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.163 6.711 -64.097 1.00 0.00 C ATOM 0 H ILE A 128 66.985 8.305 -64.195 1.00 0.00 H new ATOM 0 HA ILE A 128 66.415 5.783 -65.126 1.00 0.00 H new ATOM 0 HB ILE A 128 65.904 8.431 -66.546 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.137 8.601 -64.268 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.747 8.410 -65.318 1.00 0.00 H new ATOM 0 HG21 ILE A 128 63.939 7.273 -67.479 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.458 6.476 -67.954 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.445 5.770 -66.672 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.510 7.056 -63.295 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.618 6.014 -64.734 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.030 6.209 -63.668 1.00 0.00 H new ATOM 1196 N GLU A 129 68.467 7.447 -67.118 1.00 0.00 N ATOM 1197 CA GLU A 129 69.412 7.300 -68.219 1.00 0.00 C ATOM 1198 C GLU A 129 70.633 6.496 -67.783 1.00 0.00 C ATOM 1199 O GLU A 129 71.148 5.671 -68.538 1.00 0.00 O ATOM 1200 CB GLU A 129 69.848 8.674 -68.732 1.00 0.00 C ATOM 1201 CG GLU A 129 70.548 9.521 -67.683 1.00 0.00 C ATOM 1202 CD GLU A 129 70.561 10.995 -68.037 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.577 11.693 -67.714 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.556 11.451 -68.639 1.00 0.00 O ATOM 0 H GLU A 129 68.449 8.376 -66.698 1.00 0.00 H new ATOM 0 HA GLU A 129 68.913 6.761 -69.024 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.516 8.540 -69.583 1.00 0.00 H new ATOM 0 HB3 GLU A 129 68.972 9.211 -69.096 1.00 0.00 H new ATOM 0 HG2 GLU A 129 70.051 9.386 -66.722 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.573 9.171 -67.564 1.00 0.00 H new ATOM 1211 N ALA A 130 71.092 6.742 -66.561 1.00 0.00 N ATOM 1212 CA ALA A 130 72.252 6.041 -66.024 1.00 0.00 C ATOM 1213 C ALA A 130 72.072 4.530 -66.119 1.00 0.00 C ATOM 1214 O ALA A 130 72.985 3.810 -66.524 1.00 0.00 O ATOM 1215 CB ALA A 130 72.497 6.455 -64.581 1.00 0.00 C ATOM 0 H ALA A 130 70.678 7.422 -65.923 1.00 0.00 H new ATOM 0 HA ALA A 130 73.121 6.316 -66.622 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.366 5.924 -64.193 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.678 7.529 -64.536 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.623 6.209 -63.978 1.00 0.00 H new ATOM 1221 N TYR A 131 70.889 4.055 -65.744 1.00 0.00 N ATOM 1222 CA TYR A 131 70.591 2.628 -65.784 1.00 0.00 C ATOM 1223 C TYR A 131 70.669 2.095 -67.212 1.00 0.00 C ATOM 1224 O TYR A 131 71.082 0.958 -67.440 1.00 0.00 O ATOM 1225 CB TYR A 131 69.202 2.359 -65.203 1.00 0.00 C ATOM 1226 CG TYR A 131 68.803 0.901 -65.236 1.00 0.00 C ATOM 1227 CD1 TYR A 131 69.386 -0.018 -64.372 1.00 0.00 C ATOM 1228 CD2 TYR A 131 67.844 0.443 -66.131 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.026 -1.351 -64.399 1.00 0.00 C ATOM 1230 CE2 TYR A 131 67.477 -0.888 -66.164 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.070 -1.782 -65.296 1.00 0.00 C ATOM 1232 OH TYR A 131 67.708 -3.109 -65.327 1.00 0.00 O ATOM 0 H TYR A 131 70.121 4.637 -65.409 1.00 0.00 H new ATOM 0 HA TYR A 131 71.337 2.110 -65.181 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.174 2.711 -64.172 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.466 2.941 -65.758 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.133 0.316 -63.667 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.378 1.139 -66.812 1.00 0.00 H new ATOM 0 HE1 TYR A 131 69.490 -2.052 -63.722 1.00 0.00 H new ATOM 0 HE2 TYR A 131 66.730 -1.228 -66.866 1.00 0.00 H new ATOM 0 HH TYR A 131 67.023 -3.245 -66.014 1.00 0.00 H new ATOM 1242 N TRP A 132 70.270 2.926 -68.168 1.00 0.00 N ATOM 1243 CA TRP A 132 70.295 2.539 -69.574 1.00 0.00 C ATOM 1244 C TRP A 132 71.726 2.488 -70.100 1.00 0.00 C ATOM 1245 O TRP A 132 72.063 1.640 -70.925 1.00 0.00 O ATOM 1246 CB TRP A 132 69.468 3.519 -70.408 1.00 0.00 C ATOM 1247 CG TRP A 132 67.991 3.280 -70.313 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.049 4.149 -69.843 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.289 2.092 -70.696 1.00 0.00 C ATOM 1250 NE1 TRP A 132 65.803 3.574 -69.911 1.00 0.00 N ATOM 1251 CE2 TRP A 132 65.923 2.312 -70.431 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.681 0.866 -71.239 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 64.950 1.350 -70.690 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.714 -0.088 -71.495 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.362 0.158 -71.221 1.00 0.00 C ATOM 0 H TRP A 132 69.926 3.871 -67.996 1.00 0.00 H new ATOM 0 HA TRP A 132 69.861 1.543 -69.658 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.686 4.536 -70.082 1.00 0.00 H new ATOM 0 HB3 TRP A 132 69.774 3.446 -71.451 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.253 5.143 -69.472 1.00 0.00 H new ATOM 0 HE1 TRP A 132 64.930 4.015 -69.621 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.720 0.667 -71.455 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 63.908 1.538 -70.479 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 67.006 -1.040 -71.914 1.00 0.00 H new ATOM 0 HH2 TRP A 132 64.631 -0.608 -71.433 1.00 0.00 H new ATOM 1266 N ASN A 133 72.562 3.400 -69.616 1.00 0.00 N ATOM 1267 CA ASN A 133 73.957 3.458 -70.038 1.00 0.00 C ATOM 1268 C ASN A 133 74.711 2.206 -69.598 1.00 0.00 C ATOM 1269 O ASN A 133 75.705 1.821 -70.212 1.00 0.00 O ATOM 1270 CB ASN A 133 74.635 4.703 -69.463 1.00 0.00 C ATOM 1271 CG ASN A 133 76.147 4.603 -69.489 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.765 4.639 -70.553 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.752 4.476 -68.313 1.00 0.00 N ATOM 0 H ASN A 133 72.298 4.109 -68.932 1.00 0.00 H new ATOM 0 HA ASN A 133 73.979 3.511 -71.127 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.322 5.579 -70.031 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.301 4.853 -68.436 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.768 4.404 -68.268 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.200 4.451 -67.456 1.00 0.00 H new ATOM 1280 N GLU A 134 74.229 1.577 -68.531 1.00 0.00 N ATOM 1281 CA GLU A 134 74.858 0.369 -68.009 1.00 0.00 C ATOM 1282 C GLU A 134 74.870 -0.736 -69.061 1.00 0.00 C ATOM 1283 O GLU A 134 75.722 -1.625 -69.034 1.00 0.00 O ATOM 1284 CB GLU A 134 74.126 -0.113 -66.755 1.00 0.00 C ATOM 1285 CG GLU A 134 74.956 -1.039 -65.883 1.00 0.00 C ATOM 1286 CD GLU A 134 74.801 -2.498 -66.267 1.00 0.00 C ATOM 1287 OE1 GLU A 134 73.687 -3.039 -66.104 1.00 0.00 O ATOM 1288 OE2 GLU A 134 75.793 -3.098 -66.731 1.00 0.00 O ATOM 0 H GLU A 134 73.406 1.883 -68.012 1.00 0.00 H new ATOM 0 HA GLU A 134 75.889 0.610 -67.749 1.00 0.00 H new ATOM 0 HB2 GLU A 134 73.824 0.753 -66.166 1.00 0.00 H new ATOM 0 HB3 GLU A 134 73.214 -0.630 -67.053 1.00 0.00 H new ATOM 0 HG2 GLU A 134 76.006 -0.757 -65.958 1.00 0.00 H new ATOM 0 HG3 GLU A 134 74.664 -0.909 -64.841 1.00 0.00 H new ATOM 1295 N HIS A 135 73.918 -0.674 -69.987 1.00 0.00 N ATOM 1296 CA HIS A 135 73.819 -1.669 -71.048 1.00 0.00 C ATOM 1297 C HIS A 135 74.729 -1.309 -72.219 1.00 0.00 C ATOM 1298 O HIS A 135 75.169 -2.180 -72.968 1.00 0.00 O ATOM 1299 CB HIS A 135 72.373 -1.789 -71.530 1.00 0.00 C ATOM 1300 CG HIS A 135 71.544 -2.730 -70.711 1.00 0.00 C ATOM 1301 ND1 HIS A 135 72.006 -3.954 -70.274 1.00 0.00 N ATOM 1302 CD2 HIS A 135 70.277 -2.620 -70.248 1.00 0.00 C ATOM 1303 CE1 HIS A 135 71.058 -4.557 -69.579 1.00 0.00 C ATOM 1304 NE2 HIS A 135 69.999 -3.769 -69.548 1.00 0.00 N ATOM 0 H HIS A 135 73.205 0.054 -70.024 1.00 0.00 H new ATOM 0 HA HIS A 135 74.141 -2.628 -70.643 1.00 0.00 H new ATOM 0 HB2 HIS A 135 71.910 -0.802 -71.514 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.371 -2.125 -72.567 1.00 0.00 H new ATOM 0 HD2 HIS A 135 69.609 -1.785 -70.400 1.00 0.00 H new ATOM 0 HE1 HIS A 135 71.136 -5.529 -69.115 1.00 0.00 H new ATOM 0 HE2 HIS A 135 69.117 -3.979 -69.080 1.00 0.00 H new ATOM 1312 N GLY A 136 75.007 -0.017 -72.370 1.00 0.00 N ATOM 1313 CA GLY A 136 75.863 0.436 -73.451 1.00 0.00 C ATOM 1314 C GLY A 136 75.090 1.155 -74.539 1.00 0.00 C ATOM 1315 O GLY A 136 75.329 0.938 -75.726 1.00 0.00 O ATOM 0 H GLY A 136 74.655 0.723 -71.763 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.627 1.103 -73.051 1.00 0.00 H new ATOM 0 HA3 GLY A 136 76.382 -0.420 -73.883 1.00 0.00 H new