USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 379 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HE2:sc= -0.512 K(o=-0.51,f=-6.3!) USER MOD Single : A 91 MET CE :methyl -143:sc= -0.191 (180deg=-1.07) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.317 USER MOD Single : A 103 LYS NZ :NH3+ 134:sc= -1.71 (180deg=-2.53) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -3.44 K(o=-3.4,f=-5.1!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -120:sc= -0.759 USER MOD Single : A 117 SER OG : rot -102:sc= 0.0542 USER MOD Single : A 121 CYS SG : rot 66:sc= -0.698 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 160:sc= -0.218 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=-0.22) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.0664 K(o=-0.066,f=-0.67) USER MOD Single : A 135 HIS : no HD1:sc= -0.0424 X(o=-0.042,f=-0.0041) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 66.459 8.183 -50.384 1.00 0.00 N ATOM 463 CA VAL A 82 66.376 8.926 -51.635 1.00 0.00 C ATOM 464 C VAL A 82 66.836 8.073 -52.812 1.00 0.00 C ATOM 465 O VAL A 82 67.674 7.184 -52.659 1.00 0.00 O ATOM 466 CB VAL A 82 67.224 10.210 -51.583 1.00 0.00 C ATOM 467 CG1 VAL A 82 66.961 11.074 -52.808 1.00 0.00 C ATOM 468 CG2 VAL A 82 66.941 10.984 -50.305 1.00 0.00 C ATOM 0 HA VAL A 82 65.329 9.197 -51.773 1.00 0.00 H new ATOM 0 HB VAL A 82 68.277 9.929 -51.585 1.00 0.00 H new ATOM 0 HG11 VAL A 82 67.569 11.977 -52.754 1.00 0.00 H new ATOM 0 HG12 VAL A 82 67.219 10.517 -53.709 1.00 0.00 H new ATOM 0 HG13 VAL A 82 65.907 11.348 -52.840 1.00 0.00 H new ATOM 0 HG21 VAL A 82 67.549 11.888 -50.285 1.00 0.00 H new ATOM 0 HG22 VAL A 82 65.886 11.255 -50.270 1.00 0.00 H new ATOM 0 HG23 VAL A 82 67.185 10.364 -49.442 1.00 0.00 H new ATOM 478 N VAL A 83 66.283 8.350 -53.989 1.00 0.00 N ATOM 479 CA VAL A 83 66.638 7.610 -55.194 1.00 0.00 C ATOM 480 C VAL A 83 68.046 7.963 -55.661 1.00 0.00 C ATOM 481 O VAL A 83 68.313 9.097 -56.054 1.00 0.00 O ATOM 482 CB VAL A 83 65.644 7.889 -56.337 1.00 0.00 C ATOM 483 CG1 VAL A 83 65.855 6.907 -57.480 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.213 7.825 -55.826 1.00 0.00 C ATOM 0 H VAL A 83 65.587 9.082 -54.133 1.00 0.00 H new ATOM 0 HA VAL A 83 66.598 6.551 -54.939 1.00 0.00 H new ATOM 0 HB VAL A 83 65.826 8.895 -56.716 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.144 7.120 -58.278 1.00 0.00 H new ATOM 0 HG12 VAL A 83 66.871 7.007 -57.863 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.702 5.890 -57.119 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.524 8.025 -56.647 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.016 6.833 -55.420 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.072 8.572 -55.044 1.00 0.00 H new ATOM 494 N GLU A 84 68.942 6.981 -55.616 1.00 0.00 N ATOM 495 CA GLU A 84 70.323 7.189 -56.035 1.00 0.00 C ATOM 496 C GLU A 84 70.632 6.397 -57.302 1.00 0.00 C ATOM 497 O GLU A 84 71.594 6.690 -58.012 1.00 0.00 O ATOM 498 CB GLU A 84 71.285 6.781 -54.917 1.00 0.00 C ATOM 499 CG GLU A 84 72.502 7.684 -54.802 1.00 0.00 C ATOM 500 CD GLU A 84 72.200 8.979 -54.073 1.00 0.00 C ATOM 501 OE1 GLU A 84 71.142 9.057 -53.414 1.00 0.00 O ATOM 502 OE2 GLU A 84 73.022 9.915 -54.163 1.00 0.00 O ATOM 0 H GLU A 84 68.736 6.035 -55.294 1.00 0.00 H new ATOM 0 HA GLU A 84 70.455 8.249 -56.249 1.00 0.00 H new ATOM 0 HB2 GLU A 84 70.749 6.785 -53.968 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.617 5.758 -55.091 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.296 7.153 -54.277 1.00 0.00 H new ATOM 0 HG3 GLU A 84 72.876 7.912 -55.800 1.00 0.00 H new ATOM 509 N LYS A 85 69.809 5.391 -57.579 1.00 0.00 N ATOM 510 CA LYS A 85 69.992 4.555 -58.760 1.00 0.00 C ATOM 511 C LYS A 85 68.715 3.790 -59.088 1.00 0.00 C ATOM 512 O LYS A 85 67.731 3.859 -58.351 1.00 0.00 O ATOM 513 CB LYS A 85 71.146 3.574 -58.541 1.00 0.00 C ATOM 514 CG LYS A 85 72.112 3.500 -59.711 1.00 0.00 C ATOM 515 CD LYS A 85 72.647 2.091 -59.905 1.00 0.00 C ATOM 516 CE LYS A 85 72.628 1.684 -61.370 1.00 0.00 C ATOM 517 NZ LYS A 85 73.551 0.548 -61.643 1.00 0.00 N ATOM 0 H LYS A 85 69.008 5.135 -57.001 1.00 0.00 H new ATOM 0 HA LYS A 85 70.231 5.205 -59.602 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.695 3.866 -57.646 1.00 0.00 H new ATOM 0 HB3 LYS A 85 70.737 2.581 -58.355 1.00 0.00 H new ATOM 0 HG2 LYS A 85 71.609 3.827 -60.621 1.00 0.00 H new ATOM 0 HG3 LYS A 85 72.943 4.185 -59.542 1.00 0.00 H new ATOM 0 HD2 LYS A 85 73.666 2.032 -59.523 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.048 1.390 -59.324 1.00 0.00 H new ATOM 0 HE2 LYS A 85 71.614 1.405 -61.656 1.00 0.00 H new ATOM 0 HE3 LYS A 85 72.910 2.537 -61.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 73.509 0.301 -62.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 74.523 0.823 -61.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 73.267 -0.274 -61.073 1.00 0.00 H new ATOM 531 N VAL A 86 68.737 3.059 -60.198 1.00 0.00 N ATOM 532 CA VAL A 86 67.581 2.278 -60.622 1.00 0.00 C ATOM 533 C VAL A 86 67.841 0.784 -60.469 1.00 0.00 C ATOM 534 O VAL A 86 68.926 0.295 -60.787 1.00 0.00 O ATOM 535 CB VAL A 86 67.209 2.576 -62.087 1.00 0.00 C ATOM 536 CG1 VAL A 86 66.045 1.702 -62.531 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.877 4.050 -62.262 1.00 0.00 C ATOM 0 H VAL A 86 69.543 2.991 -60.820 1.00 0.00 H new ATOM 0 HA VAL A 86 66.750 2.567 -59.978 1.00 0.00 H new ATOM 0 HB VAL A 86 68.068 2.343 -62.717 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.796 1.927 -63.568 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.324 0.652 -62.444 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.179 1.901 -61.899 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.616 4.243 -63.303 1.00 0.00 H new ATOM 0 HG22 VAL A 86 66.034 4.312 -61.622 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.742 4.653 -61.987 1.00 0.00 H new ATOM 547 N LEU A 87 66.839 0.061 -59.981 1.00 0.00 N ATOM 548 CA LEU A 87 66.958 -1.380 -59.786 1.00 0.00 C ATOM 549 C LEU A 87 66.700 -2.129 -61.089 1.00 0.00 C ATOM 550 O LEU A 87 67.517 -2.940 -61.525 1.00 0.00 O ATOM 551 CB LEU A 87 65.979 -1.852 -58.710 1.00 0.00 C ATOM 552 CG LEU A 87 66.491 -2.941 -57.767 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.893 -4.180 -58.551 1.00 0.00 C ATOM 554 CD2 LEU A 87 67.662 -2.425 -56.944 1.00 0.00 C ATOM 0 H LEU A 87 65.935 0.449 -59.713 1.00 0.00 H new ATOM 0 HA LEU A 87 67.976 -1.595 -59.461 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.685 -0.990 -58.111 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.079 -2.220 -59.202 1.00 0.00 H new ATOM 0 HG LEU A 87 65.685 -3.214 -57.085 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.255 -4.944 -57.863 1.00 0.00 H new ATOM 0 HD12 LEU A 87 66.030 -4.562 -59.096 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.683 -3.924 -59.257 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.014 -3.213 -56.278 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.471 -2.125 -57.610 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.341 -1.567 -56.353 1.00 0.00 H new ATOM 566 N LYS A 88 65.558 -1.850 -61.709 1.00 0.00 N ATOM 567 CA LYS A 88 65.191 -2.494 -62.965 1.00 0.00 C ATOM 568 C LYS A 88 64.098 -1.708 -63.681 1.00 0.00 C ATOM 569 O LYS A 88 63.538 -0.761 -63.129 1.00 0.00 O ATOM 570 CB LYS A 88 64.719 -3.927 -62.708 1.00 0.00 C ATOM 571 CG LYS A 88 65.835 -4.956 -62.770 1.00 0.00 C ATOM 572 CD LYS A 88 65.307 -6.328 -63.155 1.00 0.00 C ATOM 573 CE LYS A 88 66.240 -7.435 -62.689 1.00 0.00 C ATOM 574 NZ LYS A 88 67.325 -7.698 -63.675 1.00 0.00 N ATOM 0 H LYS A 88 64.870 -1.182 -61.362 1.00 0.00 H new ATOM 0 HA LYS A 88 66.074 -2.518 -63.604 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.247 -3.974 -61.727 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.956 -4.186 -63.442 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.585 -4.637 -63.494 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.331 -5.015 -61.801 1.00 0.00 H new ATOM 0 HD2 LYS A 88 64.319 -6.475 -62.718 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.188 -6.383 -64.237 1.00 0.00 H new ATOM 0 HE2 LYS A 88 66.679 -7.160 -61.730 1.00 0.00 H new ATOM 0 HE3 LYS A 88 65.667 -8.348 -62.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.939 -8.459 -63.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 66.907 -7.985 -64.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 67.888 -6.834 -63.811 1.00 0.00 H new ATOM 588 N HIS A 89 63.798 -2.107 -64.913 1.00 0.00 N ATOM 589 CA HIS A 89 62.770 -1.440 -65.704 1.00 0.00 C ATOM 590 C HIS A 89 61.720 -2.439 -66.182 1.00 0.00 C ATOM 591 O HIS A 89 62.050 -3.552 -66.593 1.00 0.00 O ATOM 592 CB HIS A 89 63.399 -0.730 -66.903 1.00 0.00 C ATOM 593 CG HIS A 89 62.409 -0.345 -67.958 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.234 0.322 -67.680 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.424 -0.534 -69.298 1.00 0.00 C ATOM 596 CE1 HIS A 89 60.569 0.525 -68.803 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.270 0.015 -69.800 1.00 0.00 N ATOM 0 H HIS A 89 64.252 -2.889 -65.385 1.00 0.00 H new ATOM 0 HA HIS A 89 62.281 -0.700 -65.070 1.00 0.00 H new ATOM 0 HB2 HIS A 89 63.914 0.166 -66.555 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.154 -1.380 -67.345 1.00 0.00 H new ATOM 0 HD1 HIS A 89 60.927 0.613 -66.752 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.200 -1.025 -69.867 1.00 0.00 H new ATOM 0 HE1 HIS A 89 59.615 1.023 -68.891 1.00 0.00 H new ATOM 605 N ARG A 90 60.456 -2.034 -66.125 1.00 0.00 N ATOM 606 CA ARG A 90 59.358 -2.893 -66.551 1.00 0.00 C ATOM 607 C ARG A 90 58.374 -2.125 -67.428 1.00 0.00 C ATOM 608 O ARG A 90 58.169 -0.926 -67.243 1.00 0.00 O ATOM 609 CB ARG A 90 58.631 -3.468 -65.333 1.00 0.00 C ATOM 610 CG ARG A 90 57.804 -2.442 -64.577 1.00 0.00 C ATOM 611 CD ARG A 90 56.895 -3.103 -63.554 1.00 0.00 C ATOM 612 NE ARG A 90 55.670 -3.616 -64.161 1.00 0.00 N ATOM 613 CZ ARG A 90 54.655 -2.844 -64.533 1.00 0.00 C ATOM 614 NH1 ARG A 90 54.719 -1.531 -64.361 1.00 0.00 N ATOM 615 NH2 ARG A 90 53.573 -3.385 -65.079 1.00 0.00 N ATOM 0 H ARG A 90 60.167 -1.116 -65.788 1.00 0.00 H new ATOM 0 HA ARG A 90 59.777 -3.711 -67.137 1.00 0.00 H new ATOM 0 HB2 ARG A 90 57.979 -4.279 -65.659 1.00 0.00 H new ATOM 0 HB3 ARG A 90 59.365 -3.902 -64.654 1.00 0.00 H new ATOM 0 HG2 ARG A 90 58.467 -1.738 -64.075 1.00 0.00 H new ATOM 0 HG3 ARG A 90 57.203 -1.867 -65.282 1.00 0.00 H new ATOM 0 HD2 ARG A 90 57.429 -3.920 -63.069 1.00 0.00 H new ATOM 0 HD3 ARG A 90 56.640 -2.383 -62.776 1.00 0.00 H new ATOM 0 HE ARG A 90 55.589 -4.622 -64.307 1.00 0.00 H new ATOM 0 HH11 ARG A 90 55.549 -1.111 -63.942 1.00 0.00 H new ATOM 0 HH12 ARG A 90 53.938 -0.940 -64.648 1.00 0.00 H new ATOM 0 HH21 ARG A 90 53.520 -4.395 -65.213 1.00 0.00 H new ATOM 0 HH22 ARG A 90 52.794 -2.791 -65.364 1.00 0.00 H new ATOM 629 N MET A 91 57.769 -2.824 -68.383 1.00 0.00 N ATOM 630 CA MET A 91 56.806 -2.208 -69.288 1.00 0.00 C ATOM 631 C MET A 91 55.394 -2.293 -68.719 1.00 0.00 C ATOM 632 O MET A 91 54.946 -3.361 -68.303 1.00 0.00 O ATOM 633 CB MET A 91 56.859 -2.883 -70.659 1.00 0.00 C ATOM 634 CG MET A 91 58.235 -2.844 -71.304 1.00 0.00 C ATOM 635 SD MET A 91 58.165 -2.994 -73.100 1.00 0.00 S ATOM 636 CE MET A 91 59.448 -1.841 -73.585 1.00 0.00 C ATOM 0 H MET A 91 57.929 -3.817 -68.550 1.00 0.00 H new ATOM 0 HA MET A 91 57.070 -1.156 -69.399 1.00 0.00 H new ATOM 0 HB2 MET A 91 56.545 -3.922 -70.556 1.00 0.00 H new ATOM 0 HB3 MET A 91 56.142 -2.398 -71.322 1.00 0.00 H new ATOM 0 HG2 MET A 91 58.729 -1.909 -71.040 1.00 0.00 H new ATOM 0 HG3 MET A 91 58.845 -3.652 -70.899 1.00 0.00 H new ATOM 0 HE1 MET A 91 59.146 -1.322 -74.495 1.00 0.00 H new ATOM 0 HE2 MET A 91 59.605 -1.115 -72.788 1.00 0.00 H new ATOM 0 HE3 MET A 91 60.375 -2.384 -73.768 1.00 0.00 H new ATOM 646 N ALA A 92 54.697 -1.162 -68.705 1.00 0.00 N ATOM 647 CA ALA A 92 53.334 -1.110 -68.189 1.00 0.00 C ATOM 648 C ALA A 92 52.427 -2.082 -68.936 1.00 0.00 C ATOM 649 O ALA A 92 52.570 -2.276 -70.143 1.00 0.00 O ATOM 650 CB ALA A 92 52.787 0.306 -68.286 1.00 0.00 C ATOM 0 H ALA A 92 55.053 -0.269 -69.045 1.00 0.00 H new ATOM 0 HA ALA A 92 53.357 -1.408 -67.141 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.769 0.330 -67.897 1.00 0.00 H new ATOM 0 HB2 ALA A 92 53.414 0.979 -67.702 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.785 0.625 -69.328 1.00 0.00 H new ATOM 716 N GLY A 97 53.024 3.319 -69.708 1.00 0.00 N ATOM 717 CA GLY A 97 54.272 3.905 -70.162 1.00 0.00 C ATOM 718 C GLY A 97 55.477 3.070 -69.778 1.00 0.00 C ATOM 719 O GLY A 97 55.688 1.985 -70.320 1.00 0.00 O ATOM 0 HA2 GLY A 97 54.243 4.019 -71.246 1.00 0.00 H new ATOM 0 HA3 GLY A 97 54.376 4.904 -69.739 1.00 0.00 H new ATOM 723 N TYR A 98 56.272 3.577 -68.842 1.00 0.00 N ATOM 724 CA TYR A 98 57.466 2.873 -68.389 1.00 0.00 C ATOM 725 C TYR A 98 57.615 2.971 -66.874 1.00 0.00 C ATOM 726 O TYR A 98 57.416 4.035 -66.288 1.00 0.00 O ATOM 727 CB TYR A 98 58.710 3.443 -69.073 1.00 0.00 C ATOM 728 CG TYR A 98 58.758 3.177 -70.561 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.488 1.912 -71.069 1.00 0.00 C ATOM 730 CD2 TYR A 98 59.074 4.190 -71.458 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.533 1.664 -72.428 1.00 0.00 C ATOM 732 CE2 TYR A 98 59.119 3.951 -72.818 1.00 0.00 C ATOM 733 CZ TYR A 98 58.848 2.687 -73.298 1.00 0.00 C ATOM 734 OH TYR A 98 58.892 2.444 -74.652 1.00 0.00 O ATOM 0 H TYR A 98 56.111 4.473 -68.382 1.00 0.00 H new ATOM 0 HA TYR A 98 57.361 1.822 -68.658 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.747 4.519 -68.903 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.598 3.016 -68.607 1.00 0.00 H new ATOM 0 HD1 TYR A 98 58.239 1.109 -70.391 1.00 0.00 H new ATOM 0 HD2 TYR A 98 59.288 5.181 -71.086 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.323 0.675 -72.807 1.00 0.00 H new ATOM 0 HE2 TYR A 98 59.365 4.750 -73.502 1.00 0.00 H new ATOM 0 HH TYR A 98 59.128 3.269 -75.125 1.00 0.00 H new ATOM 744 N GLU A 99 57.966 1.853 -66.247 1.00 0.00 N ATOM 745 CA GLU A 99 58.142 1.813 -64.800 1.00 0.00 C ATOM 746 C GLU A 99 59.574 1.433 -64.436 1.00 0.00 C ATOM 747 O GLU A 99 60.195 0.601 -65.099 1.00 0.00 O ATOM 748 CB GLU A 99 57.164 0.818 -64.173 1.00 0.00 C ATOM 749 CG GLU A 99 55.858 1.450 -63.721 1.00 0.00 C ATOM 750 CD GLU A 99 55.304 0.809 -62.463 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.805 -0.267 -62.075 1.00 0.00 O ATOM 752 OE2 GLU A 99 54.368 1.383 -61.868 1.00 0.00 O ATOM 0 H GLU A 99 58.134 0.964 -66.718 1.00 0.00 H new ATOM 0 HA GLU A 99 57.938 2.809 -64.407 1.00 0.00 H new ATOM 0 HB2 GLU A 99 56.946 0.031 -64.895 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.642 0.341 -63.317 1.00 0.00 H new ATOM 0 HG2 GLU A 99 56.016 2.514 -63.543 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.122 1.367 -64.521 1.00 0.00 H new ATOM 759 N TYR A 100 60.093 2.048 -63.379 1.00 0.00 N ATOM 760 CA TYR A 100 61.453 1.778 -62.928 1.00 0.00 C ATOM 761 C TYR A 100 61.518 1.708 -61.406 1.00 0.00 C ATOM 762 O TYR A 100 60.862 2.482 -60.708 1.00 0.00 O ATOM 763 CB TYR A 100 62.407 2.857 -63.441 1.00 0.00 C ATOM 764 CG TYR A 100 62.201 3.205 -64.898 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.224 4.114 -65.285 1.00 0.00 C ATOM 766 CD2 TYR A 100 62.984 2.624 -65.889 1.00 0.00 C ATOM 767 CE1 TYR A 100 61.032 4.434 -66.615 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.799 2.939 -67.221 1.00 0.00 C ATOM 769 CZ TYR A 100 61.822 3.844 -67.579 1.00 0.00 C ATOM 770 OH TYR A 100 61.635 4.161 -68.905 1.00 0.00 O ATOM 0 H TYR A 100 59.592 2.737 -62.818 1.00 0.00 H new ATOM 0 HA TYR A 100 61.757 0.812 -63.332 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.281 3.757 -62.840 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.434 2.520 -63.298 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.604 4.579 -64.533 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.750 1.914 -65.613 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.267 5.142 -66.898 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.416 2.479 -67.978 1.00 0.00 H new ATOM 0 HH TYR A 100 62.273 3.660 -69.454 1.00 0.00 H new ATOM 780 N LEU A 101 62.314 0.774 -60.897 1.00 0.00 N ATOM 781 CA LEU A 101 62.467 0.601 -59.456 1.00 0.00 C ATOM 782 C LEU A 101 63.468 1.603 -58.891 1.00 0.00 C ATOM 783 O LEU A 101 64.522 1.845 -59.482 1.00 0.00 O ATOM 784 CB LEU A 101 62.921 -0.825 -59.139 1.00 0.00 C ATOM 785 CG LEU A 101 61.815 -1.875 -59.038 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.254 -3.178 -59.687 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.429 -2.105 -57.584 1.00 0.00 C ATOM 0 H LEU A 101 62.863 0.125 -61.460 1.00 0.00 H new ATOM 0 HA LEU A 101 61.499 0.780 -58.988 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.625 -1.141 -59.909 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.467 -0.810 -58.196 1.00 0.00 H new ATOM 0 HG LEU A 101 60.940 -1.505 -59.572 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.453 -3.913 -59.605 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.479 -3.003 -60.739 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.144 -3.554 -59.183 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.640 -2.856 -57.531 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.299 -2.453 -57.027 1.00 0.00 H new ATOM 0 HD23 LEU A 101 61.071 -1.171 -57.151 1.00 0.00 H new ATOM 799 N LEU A 102 63.133 2.182 -57.743 1.00 0.00 N ATOM 800 CA LEU A 102 64.004 3.158 -57.096 1.00 0.00 C ATOM 801 C LEU A 102 64.999 2.468 -56.167 1.00 0.00 C ATOM 802 O LEU A 102 64.615 1.672 -55.310 1.00 0.00 O ATOM 803 CB LEU A 102 63.171 4.171 -56.308 1.00 0.00 C ATOM 804 CG LEU A 102 61.957 4.751 -57.035 1.00 0.00 C ATOM 805 CD1 LEU A 102 60.994 5.384 -56.043 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.396 5.768 -58.078 1.00 0.00 C ATOM 0 H LEU A 102 62.265 1.993 -57.241 1.00 0.00 H new ATOM 0 HA LEU A 102 64.562 3.681 -57.872 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.826 3.693 -55.391 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.821 4.995 -56.013 1.00 0.00 H new ATOM 0 HG LEU A 102 61.440 3.938 -57.545 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.136 5.791 -56.578 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.654 4.629 -55.334 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.500 6.186 -55.505 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.519 6.170 -58.585 1.00 0.00 H new ATOM 0 HD22 LEU A 102 62.937 6.579 -57.590 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.047 5.284 -58.806 1.00 0.00 H new ATOM 818 N LYS A 103 66.278 2.781 -56.342 1.00 0.00 N ATOM 819 CA LYS A 103 67.329 2.195 -55.519 1.00 0.00 C ATOM 820 C LYS A 103 67.722 3.138 -54.386 1.00 0.00 C ATOM 821 O LYS A 103 67.983 4.319 -54.612 1.00 0.00 O ATOM 822 CB LYS A 103 68.555 1.870 -56.375 1.00 0.00 C ATOM 823 CG LYS A 103 69.319 0.645 -55.903 1.00 0.00 C ATOM 824 CD LYS A 103 70.804 0.765 -56.202 1.00 0.00 C ATOM 825 CE LYS A 103 71.250 -0.261 -57.233 1.00 0.00 C ATOM 826 NZ LYS A 103 70.386 -0.240 -58.446 1.00 0.00 N ATOM 0 H LYS A 103 66.612 3.438 -57.047 1.00 0.00 H new ATOM 0 HA LYS A 103 66.943 1.273 -55.084 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.237 1.715 -57.406 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.226 2.729 -56.374 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.172 0.514 -54.831 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.919 -0.244 -56.390 1.00 0.00 H new ATOM 0 HD2 LYS A 103 71.023 1.768 -56.568 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.373 0.630 -55.282 1.00 0.00 H new ATOM 0 HE2 LYS A 103 72.283 -0.063 -57.519 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.228 -1.256 -56.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 70.983 -0.254 -59.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 69.765 -1.075 -58.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 69.806 0.623 -58.444 1.00 0.00 H new ATOM 840 N TRP A 104 67.764 2.608 -53.169 1.00 0.00 N ATOM 841 CA TRP A 104 68.127 3.403 -52.001 1.00 0.00 C ATOM 842 C TRP A 104 69.640 3.449 -51.824 1.00 0.00 C ATOM 843 O TRP A 104 70.311 2.419 -51.876 1.00 0.00 O ATOM 844 CB TRP A 104 67.470 2.829 -50.744 1.00 0.00 C ATOM 845 CG TRP A 104 65.976 2.756 -50.835 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.207 1.629 -50.789 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.072 3.856 -50.988 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.878 1.961 -50.905 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.769 3.321 -51.028 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.236 5.239 -51.094 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.640 4.123 -51.169 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.114 6.034 -51.235 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.830 5.475 -51.271 1.00 0.00 C ATOM 0 H TRP A 104 67.551 1.631 -52.965 1.00 0.00 H new ATOM 0 HA TRP A 104 67.768 4.420 -52.158 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.865 1.830 -50.560 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.745 3.443 -49.886 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.587 0.624 -50.678 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.100 1.302 -50.900 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.222 5.679 -51.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.649 3.694 -51.197 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.229 7.105 -51.319 1.00 0.00 H new ATOM 0 HH2 TRP A 104 61.973 6.123 -51.381 1.00 0.00 H new ATOM 864 N GLU A 105 70.170 4.650 -51.614 1.00 0.00 N ATOM 865 CA GLU A 105 71.606 4.829 -51.429 1.00 0.00 C ATOM 866 C GLU A 105 72.086 4.113 -50.169 1.00 0.00 C ATOM 867 O GLU A 105 71.617 4.393 -49.067 1.00 0.00 O ATOM 868 CB GLU A 105 71.950 6.317 -51.346 1.00 0.00 C ATOM 869 CG GLU A 105 73.417 6.618 -51.607 1.00 0.00 C ATOM 870 CD GLU A 105 73.711 8.105 -51.633 1.00 0.00 C ATOM 871 OE1 GLU A 105 72.879 8.885 -51.124 1.00 0.00 O ATOM 872 OE2 GLU A 105 74.775 8.490 -52.162 1.00 0.00 O ATOM 0 H GLU A 105 69.628 5.513 -51.568 1.00 0.00 H new ATOM 0 HA GLU A 105 72.114 4.393 -52.289 1.00 0.00 H new ATOM 0 HB2 GLU A 105 71.342 6.863 -52.067 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.682 6.689 -50.357 1.00 0.00 H new ATOM 0 HG2 GLU A 105 74.024 6.145 -50.835 1.00 0.00 H new ATOM 0 HG3 GLU A 105 73.711 6.176 -52.559 1.00 0.00 H new ATOM 879 N GLY A 106 73.024 3.187 -50.343 1.00 0.00 N ATOM 880 CA GLY A 106 73.552 2.445 -49.213 1.00 0.00 C ATOM 881 C GLY A 106 72.804 1.149 -48.970 1.00 0.00 C ATOM 882 O GLY A 106 73.390 0.159 -48.531 1.00 0.00 O ATOM 0 H GLY A 106 73.428 2.937 -51.246 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.606 2.226 -49.386 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.499 3.065 -48.318 1.00 0.00 H new ATOM 886 N TYR A 107 71.506 1.155 -49.255 1.00 0.00 N ATOM 887 CA TYR A 107 70.677 -0.029 -49.062 1.00 0.00 C ATOM 888 C TYR A 107 70.383 -0.712 -50.394 1.00 0.00 C ATOM 889 O TYR A 107 69.868 -0.089 -51.323 1.00 0.00 O ATOM 890 CB TYR A 107 69.366 0.349 -48.370 1.00 0.00 C ATOM 891 CG TYR A 107 69.551 1.274 -47.188 1.00 0.00 C ATOM 892 CD1 TYR A 107 70.191 0.839 -46.034 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.083 2.582 -47.224 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.362 1.680 -44.951 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.251 3.430 -46.146 1.00 0.00 C ATOM 896 CZ TYR A 107 69.890 2.975 -45.012 1.00 0.00 C ATOM 897 OH TYR A 107 70.057 3.816 -43.936 1.00 0.00 O ATOM 0 H TYR A 107 71.006 1.966 -49.620 1.00 0.00 H new ATOM 0 HA TYR A 107 71.226 -0.727 -48.430 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.707 0.826 -49.095 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.866 -0.560 -48.035 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.561 -0.174 -45.983 1.00 0.00 H new ATOM 0 HD2 TYR A 107 68.580 2.942 -48.109 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.862 1.326 -44.062 1.00 0.00 H new ATOM 0 HE2 TYR A 107 68.883 4.445 -46.191 1.00 0.00 H new ATOM 0 HH TYR A 107 69.669 4.692 -44.142 1.00 0.00 H new ATOM 907 N ASP A 108 70.713 -1.995 -50.479 1.00 0.00 N ATOM 908 CA ASP A 108 70.483 -2.766 -51.696 1.00 0.00 C ATOM 909 C ASP A 108 69.324 -3.740 -51.511 1.00 0.00 C ATOM 910 O ASP A 108 69.501 -4.837 -50.980 1.00 0.00 O ATOM 911 CB ASP A 108 71.750 -3.528 -52.089 1.00 0.00 C ATOM 912 CG ASP A 108 72.807 -2.623 -52.689 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.711 -1.391 -52.502 1.00 0.00 O ATOM 914 OD2 ASP A 108 73.733 -3.145 -53.344 1.00 0.00 O ATOM 0 H ASP A 108 71.141 -2.524 -49.719 1.00 0.00 H new ATOM 0 HA ASP A 108 70.225 -2.071 -52.495 1.00 0.00 H new ATOM 0 HB2 ASP A 108 72.159 -4.026 -51.210 1.00 0.00 H new ATOM 0 HB3 ASP A 108 71.494 -4.308 -52.806 1.00 0.00 H new ATOM 919 N ASP A 109 68.140 -3.333 -51.953 1.00 0.00 N ATOM 920 CA ASP A 109 66.951 -4.170 -51.837 1.00 0.00 C ATOM 921 C ASP A 109 66.813 -5.089 -53.047 1.00 0.00 C ATOM 922 O ASP A 109 67.366 -4.834 -54.117 1.00 0.00 O ATOM 923 CB ASP A 109 65.701 -3.301 -51.695 1.00 0.00 C ATOM 924 CG ASP A 109 65.157 -3.295 -50.280 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.965 -3.190 -49.334 1.00 0.00 O ATOM 926 OD2 ASP A 109 63.923 -3.393 -50.119 1.00 0.00 O ATOM 0 H ASP A 109 67.977 -2.428 -52.395 1.00 0.00 H new ATOM 0 HA ASP A 109 67.057 -4.787 -50.945 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.936 -2.280 -51.995 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.931 -3.664 -52.376 1.00 0.00 H new ATOM 931 N PRO A 110 66.059 -6.184 -52.875 1.00 0.00 N ATOM 932 CA PRO A 110 65.831 -7.163 -53.942 1.00 0.00 C ATOM 933 C PRO A 110 64.949 -6.611 -55.057 1.00 0.00 C ATOM 934 O PRO A 110 64.735 -5.403 -55.151 1.00 0.00 O ATOM 935 CB PRO A 110 65.124 -8.315 -53.223 1.00 0.00 C ATOM 936 CG PRO A 110 64.467 -7.679 -52.046 1.00 0.00 C ATOM 937 CD PRO A 110 65.369 -6.552 -51.627 1.00 0.00 C ATOM 0 HA PRO A 110 66.760 -7.454 -54.432 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.393 -8.798 -53.872 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.833 -9.083 -52.914 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.475 -7.309 -52.306 1.00 0.00 H new ATOM 0 HG3 PRO A 110 64.338 -8.397 -51.236 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.803 -5.715 -51.219 1.00 0.00 H new ATOM 0 HD3 PRO A 110 66.073 -6.866 -50.856 1.00 0.00 H new ATOM 945 N SER A 111 64.440 -7.504 -55.900 1.00 0.00 N ATOM 946 CA SER A 111 63.584 -7.105 -57.011 1.00 0.00 C ATOM 947 C SER A 111 62.214 -6.659 -56.508 1.00 0.00 C ATOM 948 O SER A 111 61.385 -6.176 -57.279 1.00 0.00 O ATOM 949 CB SER A 111 63.425 -8.261 -58.000 1.00 0.00 C ATOM 950 OG SER A 111 64.654 -8.558 -58.641 1.00 0.00 O ATOM 0 H SER A 111 64.606 -8.508 -55.835 1.00 0.00 H new ATOM 0 HA SER A 111 64.057 -6.264 -57.519 1.00 0.00 H new ATOM 0 HB2 SER A 111 63.062 -9.145 -57.475 1.00 0.00 H new ATOM 0 HB3 SER A 111 62.675 -8.003 -58.747 1.00 0.00 H new ATOM 0 HG SER A 111 64.525 -9.301 -59.267 1.00 0.00 H new ATOM 956 N ASP A 112 61.985 -6.824 -55.210 1.00 0.00 N ATOM 957 CA ASP A 112 60.717 -6.437 -54.603 1.00 0.00 C ATOM 958 C ASP A 112 60.763 -4.990 -54.122 1.00 0.00 C ATOM 959 O ASP A 112 59.922 -4.560 -53.335 1.00 0.00 O ATOM 960 CB ASP A 112 60.384 -7.365 -53.433 1.00 0.00 C ATOM 961 CG ASP A 112 60.502 -8.830 -53.805 1.00 0.00 C ATOM 962 OD1 ASP A 112 59.722 -9.289 -54.666 1.00 0.00 O ATOM 963 OD2 ASP A 112 61.375 -9.518 -53.236 1.00 0.00 O ATOM 0 H ASP A 112 62.661 -7.223 -54.558 1.00 0.00 H new ATOM 0 HA ASP A 112 59.938 -6.524 -55.361 1.00 0.00 H new ATOM 0 HB2 ASP A 112 61.053 -7.149 -52.600 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.370 -7.161 -53.088 1.00 0.00 H new ATOM 968 N ASN A 113 61.753 -4.244 -54.602 1.00 0.00 N ATOM 969 CA ASN A 113 61.910 -2.845 -54.220 1.00 0.00 C ATOM 970 C ASN A 113 60.671 -2.038 -54.592 1.00 0.00 C ATOM 971 O ASN A 113 59.639 -2.598 -54.964 1.00 0.00 O ATOM 972 CB ASN A 113 63.145 -2.246 -54.896 1.00 0.00 C ATOM 973 CG ASN A 113 64.161 -1.732 -53.894 1.00 0.00 C ATOM 974 OD1 ASN A 113 63.814 -1.382 -52.766 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.423 -1.684 -54.303 1.00 0.00 N ATOM 0 H ASN A 113 62.458 -4.585 -55.256 1.00 0.00 H new ATOM 0 HA ASN A 113 62.039 -2.801 -53.139 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.612 -3.001 -55.528 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.838 -1.429 -55.549 1.00 0.00 H new ATOM 0 HD21 ASN A 113 66.151 -1.347 -53.673 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.665 -1.984 -55.247 1.00 0.00 H new ATOM 982 N THR A 114 60.779 -0.717 -54.489 1.00 0.00 N ATOM 983 CA THR A 114 59.668 0.169 -54.813 1.00 0.00 C ATOM 984 C THR A 114 59.654 0.513 -56.298 1.00 0.00 C ATOM 985 O THR A 114 60.672 0.917 -56.860 1.00 0.00 O ATOM 986 CB THR A 114 59.732 1.473 -53.996 1.00 0.00 C ATOM 987 OG1 THR A 114 58.650 2.336 -54.365 1.00 0.00 O ATOM 988 CG2 THR A 114 61.056 2.188 -54.221 1.00 0.00 C ATOM 0 H THR A 114 61.626 -0.237 -54.183 1.00 0.00 H new ATOM 0 HA THR A 114 58.753 -0.366 -54.558 1.00 0.00 H new ATOM 0 HB THR A 114 59.649 1.218 -52.939 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.697 3.162 -53.840 1.00 0.00 H new ATOM 0 HG21 THR A 114 61.078 3.106 -53.634 1.00 0.00 H new ATOM 0 HG22 THR A 114 61.876 1.540 -53.912 1.00 0.00 H new ATOM 0 HG23 THR A 114 61.163 2.431 -55.278 1.00 0.00 H new ATOM 996 N TRP A 115 58.496 0.349 -56.927 1.00 0.00 N ATOM 997 CA TRP A 115 58.351 0.643 -58.349 1.00 0.00 C ATOM 998 C TRP A 115 57.807 2.052 -58.560 1.00 0.00 C ATOM 999 O TRP A 115 56.694 2.367 -58.139 1.00 0.00 O ATOM 1000 CB TRP A 115 57.425 -0.379 -59.010 1.00 0.00 C ATOM 1001 CG TRP A 115 57.895 -1.794 -58.855 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.770 -2.582 -57.747 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.567 -2.586 -59.840 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.324 -3.817 -57.984 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.819 -3.845 -59.261 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.979 -2.356 -61.155 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.464 -4.867 -59.953 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.619 -3.370 -61.840 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.856 -4.613 -61.239 1.00 0.00 C ATOM 0 H TRP A 115 57.644 0.014 -56.476 1.00 0.00 H new ATOM 0 HA TRP A 115 59.337 0.581 -58.810 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.427 -0.286 -58.581 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.338 -0.147 -60.071 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.304 -2.279 -56.821 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.361 -4.588 -57.317 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.800 -1.402 -61.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.648 -5.826 -59.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.942 -3.202 -62.857 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.358 -5.386 -61.802 1.00 0.00 H new ATOM 1020 N SER A 116 58.598 2.895 -59.215 1.00 0.00 N ATOM 1021 CA SER A 116 58.196 4.272 -59.479 1.00 0.00 C ATOM 1022 C SER A 116 57.780 4.446 -60.937 1.00 0.00 C ATOM 1023 O SER A 116 58.317 3.791 -61.830 1.00 0.00 O ATOM 1024 CB SER A 116 59.339 5.232 -59.145 1.00 0.00 C ATOM 1025 OG SER A 116 59.475 6.230 -60.141 1.00 0.00 O ATOM 0 H SER A 116 59.521 2.649 -59.573 1.00 0.00 H new ATOM 0 HA SER A 116 57.340 4.503 -58.845 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.153 5.701 -58.179 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.271 4.675 -59.055 1.00 0.00 H new ATOM 0 HG SER A 116 60.370 6.178 -60.536 1.00 0.00 H new ATOM 1031 N SER A 117 56.820 5.335 -61.170 1.00 0.00 N ATOM 1032 CA SER A 117 56.329 5.595 -62.518 1.00 0.00 C ATOM 1033 C SER A 117 57.189 6.642 -63.218 1.00 0.00 C ATOM 1034 O SER A 117 58.166 7.134 -62.655 1.00 0.00 O ATOM 1035 CB SER A 117 54.872 6.062 -62.472 1.00 0.00 C ATOM 1036 OG SER A 117 54.292 6.049 -63.764 1.00 0.00 O ATOM 0 H SER A 117 56.367 5.888 -60.442 1.00 0.00 H new ATOM 0 HA SER A 117 56.387 4.666 -63.084 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.300 5.415 -61.807 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.822 7.069 -62.058 1.00 0.00 H new ATOM 0 HG SER A 117 54.260 6.962 -64.117 1.00 0.00 H new ATOM 1042 N GLU A 118 56.817 6.978 -64.449 1.00 0.00 N ATOM 1043 CA GLU A 118 57.555 7.967 -65.226 1.00 0.00 C ATOM 1044 C GLU A 118 57.406 9.359 -64.618 1.00 0.00 C ATOM 1045 O GLU A 118 58.189 10.262 -64.909 1.00 0.00 O ATOM 1046 CB GLU A 118 57.065 7.978 -66.676 1.00 0.00 C ATOM 1047 CG GLU A 118 57.897 8.859 -67.593 1.00 0.00 C ATOM 1048 CD GLU A 118 59.386 8.720 -67.342 1.00 0.00 C ATOM 1049 OE1 GLU A 118 59.866 7.571 -67.248 1.00 0.00 O ATOM 1050 OE2 GLU A 118 60.070 9.759 -67.240 1.00 0.00 O ATOM 0 H GLU A 118 56.010 6.580 -64.929 1.00 0.00 H new ATOM 0 HA GLU A 118 58.610 7.692 -65.208 1.00 0.00 H new ATOM 0 HB2 GLU A 118 57.072 6.958 -67.061 1.00 0.00 H new ATOM 0 HB3 GLU A 118 56.030 8.320 -66.698 1.00 0.00 H new ATOM 0 HG2 GLU A 118 57.682 8.603 -68.630 1.00 0.00 H new ATOM 0 HG3 GLU A 118 57.605 9.900 -67.454 1.00 0.00 H new ATOM 1057 N ALA A 119 56.395 9.523 -63.771 1.00 0.00 N ATOM 1058 CA ALA A 119 56.144 10.803 -63.120 1.00 0.00 C ATOM 1059 C ALA A 119 57.259 11.147 -62.139 1.00 0.00 C ATOM 1060 O ALA A 119 57.632 12.311 -61.992 1.00 0.00 O ATOM 1061 CB ALA A 119 54.800 10.777 -62.407 1.00 0.00 C ATOM 0 H ALA A 119 55.737 8.786 -63.520 1.00 0.00 H new ATOM 0 HA ALA A 119 56.121 11.576 -63.888 1.00 0.00 H new ATOM 0 HB1 ALA A 119 54.625 11.739 -61.925 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.008 10.584 -63.131 1.00 0.00 H new ATOM 0 HB3 ALA A 119 54.803 9.989 -61.654 1.00 0.00 H new ATOM 1067 N ASP A 120 57.787 10.129 -61.468 1.00 0.00 N ATOM 1068 CA ASP A 120 58.860 10.324 -60.501 1.00 0.00 C ATOM 1069 C ASP A 120 60.209 10.450 -61.203 1.00 0.00 C ATOM 1070 O ASP A 120 61.135 11.072 -60.682 1.00 0.00 O ATOM 1071 CB ASP A 120 58.896 9.164 -59.505 1.00 0.00 C ATOM 1072 CG ASP A 120 59.125 9.630 -58.081 1.00 0.00 C ATOM 1073 OD1 ASP A 120 59.771 10.683 -57.897 1.00 0.00 O ATOM 1074 OD2 ASP A 120 58.657 8.942 -57.149 1.00 0.00 O ATOM 0 H ASP A 120 57.489 9.160 -61.577 1.00 0.00 H new ATOM 0 HA ASP A 120 58.664 11.250 -59.961 1.00 0.00 H new ATOM 0 HB2 ASP A 120 57.956 8.615 -59.558 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.687 8.470 -59.789 1.00 0.00 H new ATOM 1079 N CYS A 121 60.311 9.854 -62.386 1.00 0.00 N ATOM 1080 CA CYS A 121 61.548 9.898 -63.159 1.00 0.00 C ATOM 1081 C CYS A 121 61.907 11.333 -63.529 1.00 0.00 C ATOM 1082 O CYS A 121 63.047 11.625 -63.891 1.00 0.00 O ATOM 1083 CB CYS A 121 61.412 9.050 -64.425 1.00 0.00 C ATOM 1084 SG CYS A 121 61.124 7.294 -64.109 1.00 0.00 S ATOM 0 H CYS A 121 59.554 9.335 -62.831 1.00 0.00 H new ATOM 0 HA CYS A 121 62.349 9.491 -62.542 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.589 9.440 -65.024 1.00 0.00 H new ATOM 0 HB3 CYS A 121 62.319 9.157 -65.020 1.00 0.00 H new ATOM 0 HG CYS A 121 59.961 7.139 -63.549 1.00 0.00 H new ATOM 1090 N SER A 122 60.927 12.226 -63.437 1.00 0.00 N ATOM 1091 CA SER A 122 61.138 13.630 -63.768 1.00 0.00 C ATOM 1092 C SER A 122 62.334 14.193 -63.007 1.00 0.00 C ATOM 1093 O SER A 122 63.000 15.118 -63.470 1.00 0.00 O ATOM 1094 CB SER A 122 59.884 14.446 -63.447 1.00 0.00 C ATOM 1095 OG SER A 122 60.211 15.798 -63.176 1.00 0.00 O ATOM 0 H SER A 122 59.979 12.002 -63.136 1.00 0.00 H new ATOM 0 HA SER A 122 61.344 13.699 -64.836 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.190 14.398 -64.286 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.374 14.012 -62.587 1.00 0.00 H new ATOM 0 HG SER A 122 59.393 16.299 -62.975 1.00 0.00 H new ATOM 1101 N GLY A 123 62.600 13.628 -61.833 1.00 0.00 N ATOM 1102 CA GLY A 123 63.715 14.086 -61.025 1.00 0.00 C ATOM 1103 C GLY A 123 64.877 13.112 -61.034 1.00 0.00 C ATOM 1104 O GLY A 123 66.018 13.494 -60.773 1.00 0.00 O ATOM 0 H GLY A 123 62.063 12.861 -61.427 1.00 0.00 H new ATOM 0 HA2 GLY A 123 64.054 15.054 -61.394 1.00 0.00 H new ATOM 0 HA3 GLY A 123 63.379 14.236 -59.999 1.00 0.00 H new ATOM 1108 N CYS A 124 64.586 11.851 -61.334 1.00 0.00 N ATOM 1109 CA CYS A 124 65.615 10.818 -61.373 1.00 0.00 C ATOM 1110 C CYS A 124 65.989 10.478 -62.812 1.00 0.00 C ATOM 1111 O CYS A 124 66.458 9.376 -63.100 1.00 0.00 O ATOM 1112 CB CYS A 124 65.134 9.561 -60.648 1.00 0.00 C ATOM 1113 SG CYS A 124 64.466 9.871 -58.997 1.00 0.00 S ATOM 0 H CYS A 124 63.647 11.519 -61.554 1.00 0.00 H new ATOM 0 HA CYS A 124 66.501 11.203 -60.867 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.368 9.076 -61.253 1.00 0.00 H new ATOM 0 HB3 CYS A 124 65.966 8.861 -60.566 1.00 0.00 H new ATOM 0 HG CYS A 124 63.715 8.872 -58.638 1.00 0.00 H new ATOM 1119 N LYS A 125 65.777 11.431 -63.714 1.00 0.00 N ATOM 1120 CA LYS A 125 66.091 11.233 -65.124 1.00 0.00 C ATOM 1121 C LYS A 125 67.514 10.711 -65.297 1.00 0.00 C ATOM 1122 O LYS A 125 67.742 9.730 -66.005 1.00 0.00 O ATOM 1123 CB LYS A 125 65.921 12.545 -65.894 1.00 0.00 C ATOM 1124 CG LYS A 125 64.565 12.686 -66.563 1.00 0.00 C ATOM 1125 CD LYS A 125 64.583 12.140 -67.981 1.00 0.00 C ATOM 1126 CE LYS A 125 63.239 12.329 -68.668 1.00 0.00 C ATOM 1127 NZ LYS A 125 63.096 13.696 -69.242 1.00 0.00 N ATOM 0 H LYS A 125 65.389 12.348 -63.493 1.00 0.00 H new ATOM 0 HA LYS A 125 65.400 10.491 -65.524 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.067 13.380 -65.209 1.00 0.00 H new ATOM 0 HB3 LYS A 125 66.700 12.615 -66.653 1.00 0.00 H new ATOM 0 HG2 LYS A 125 63.813 12.157 -65.978 1.00 0.00 H new ATOM 0 HG3 LYS A 125 64.274 13.736 -66.580 1.00 0.00 H new ATOM 0 HD2 LYS A 125 65.361 12.643 -68.556 1.00 0.00 H new ATOM 0 HD3 LYS A 125 64.837 11.080 -67.961 1.00 0.00 H new ATOM 0 HE2 LYS A 125 63.129 11.589 -69.461 1.00 0.00 H new ATOM 0 HE3 LYS A 125 62.437 12.150 -67.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 62.167 13.784 -69.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 63.175 14.402 -68.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 63.846 13.858 -69.944 1.00 0.00 H new ATOM 1141 N GLN A 126 68.465 11.372 -64.646 1.00 0.00 N ATOM 1142 CA GLN A 126 69.865 10.972 -64.728 1.00 0.00 C ATOM 1143 C GLN A 126 70.026 9.487 -64.422 1.00 0.00 C ATOM 1144 O GLN A 126 70.864 8.807 -65.016 1.00 0.00 O ATOM 1145 CB GLN A 126 70.711 11.799 -63.759 1.00 0.00 C ATOM 1146 CG GLN A 126 70.094 11.936 -62.377 1.00 0.00 C ATOM 1147 CD GLN A 126 71.036 12.578 -61.378 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.796 13.485 -61.718 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.990 12.111 -60.135 1.00 0.00 N ATOM 0 H GLN A 126 68.292 12.186 -64.056 1.00 0.00 H new ATOM 0 HA GLN A 126 70.209 11.154 -65.746 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.695 11.339 -63.665 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.863 12.793 -64.180 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.184 12.532 -62.447 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.803 10.950 -62.014 1.00 0.00 H new ATOM 0 HE21 GLN A 126 70.345 11.358 -59.897 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.600 12.506 -59.419 1.00 0.00 H new ATOM 1158 N LEU A 127 69.219 8.988 -63.492 1.00 0.00 N ATOM 1159 CA LEU A 127 69.272 7.583 -63.107 1.00 0.00 C ATOM 1160 C LEU A 127 68.678 6.696 -64.197 1.00 0.00 C ATOM 1161 O LEU A 127 69.292 5.713 -64.613 1.00 0.00 O ATOM 1162 CB LEU A 127 68.521 7.365 -61.792 1.00 0.00 C ATOM 1163 CG LEU A 127 68.933 8.266 -60.627 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.295 7.789 -59.332 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.448 8.307 -60.494 1.00 0.00 C ATOM 0 H LEU A 127 68.520 9.536 -62.991 1.00 0.00 H new ATOM 0 HA LEU A 127 70.318 7.309 -62.971 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.456 7.508 -61.977 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.655 6.327 -61.488 1.00 0.00 H new ATOM 0 HG LEU A 127 68.579 9.276 -60.832 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.600 8.442 -58.514 1.00 0.00 H new ATOM 0 HD12 LEU A 127 67.210 7.813 -59.431 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.618 6.769 -59.121 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.723 8.953 -59.660 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.825 7.300 -60.313 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.884 8.697 -61.414 1.00 0.00 H new ATOM 1177 N ILE A 128 67.483 7.052 -64.656 1.00 0.00 N ATOM 1178 CA ILE A 128 66.809 6.291 -65.700 1.00 0.00 C ATOM 1179 C ILE A 128 67.722 6.080 -66.904 1.00 0.00 C ATOM 1180 O ILE A 128 67.798 4.981 -67.451 1.00 0.00 O ATOM 1181 CB ILE A 128 65.519 6.992 -66.165 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.614 7.289 -64.967 1.00 0.00 C ATOM 1183 CG2 ILE A 128 64.789 6.135 -67.188 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.282 6.065 -64.143 1.00 0.00 C ATOM 0 H ILE A 128 66.962 7.862 -64.321 1.00 0.00 H new ATOM 0 HA ILE A 128 66.552 5.324 -65.268 1.00 0.00 H new ATOM 0 HB ILE A 128 65.787 7.937 -66.637 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.101 8.026 -64.328 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.688 7.739 -65.324 1.00 0.00 H new ATOM 0 HG21 ILE A 128 63.880 6.644 -67.507 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.434 5.970 -68.051 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.530 5.176 -66.740 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.638 6.350 -63.311 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.767 5.335 -64.767 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.202 5.627 -63.756 1.00 0.00 H new ATOM 1196 N GLU A 129 68.413 7.141 -67.308 1.00 0.00 N ATOM 1197 CA GLU A 129 69.321 7.072 -68.446 1.00 0.00 C ATOM 1198 C GLU A 129 70.617 6.361 -68.066 1.00 0.00 C ATOM 1199 O GLU A 129 71.166 5.587 -68.849 1.00 0.00 O ATOM 1200 CB GLU A 129 69.632 8.477 -68.966 1.00 0.00 C ATOM 1201 CG GLU A 129 70.316 9.368 -67.942 1.00 0.00 C ATOM 1202 CD GLU A 129 70.390 10.816 -68.386 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.549 11.226 -69.213 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.288 11.538 -67.906 1.00 0.00 O ATOM 0 H GLU A 129 68.361 8.058 -66.864 1.00 0.00 H new ATOM 0 HA GLU A 129 68.830 6.501 -69.234 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.268 8.396 -69.847 1.00 0.00 H new ATOM 0 HB3 GLU A 129 68.704 8.951 -69.285 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.777 9.309 -66.997 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.324 8.996 -67.758 1.00 0.00 H new ATOM 1211 N ALA A 130 71.100 6.631 -66.858 1.00 0.00 N ATOM 1212 CA ALA A 130 72.330 6.017 -66.372 1.00 0.00 C ATOM 1213 C ALA A 130 72.215 4.496 -66.357 1.00 0.00 C ATOM 1214 O ALA A 130 73.112 3.792 -66.822 1.00 0.00 O ATOM 1215 CB ALA A 130 72.665 6.536 -64.982 1.00 0.00 C ATOM 0 H ALA A 130 70.658 7.271 -66.198 1.00 0.00 H new ATOM 0 HA ALA A 130 73.136 6.288 -67.053 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.586 6.069 -64.631 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.798 7.617 -65.020 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.852 6.294 -64.298 1.00 0.00 H new ATOM 1221 N TYR A 131 71.108 3.996 -65.821 1.00 0.00 N ATOM 1222 CA TYR A 131 70.878 2.558 -65.743 1.00 0.00 C ATOM 1223 C TYR A 131 70.956 1.919 -67.126 1.00 0.00 C ATOM 1224 O TYR A 131 71.453 0.803 -67.279 1.00 0.00 O ATOM 1225 CB TYR A 131 69.515 2.272 -65.111 1.00 0.00 C ATOM 1226 CG TYR A 131 69.165 0.802 -65.066 1.00 0.00 C ATOM 1227 CD1 TYR A 131 68.545 0.182 -66.144 1.00 0.00 C ATOM 1228 CD2 TYR A 131 69.455 0.032 -63.946 1.00 0.00 C ATOM 1229 CE1 TYR A 131 68.223 -1.161 -66.107 1.00 0.00 C ATOM 1230 CE2 TYR A 131 69.138 -1.311 -63.901 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.522 -1.903 -64.984 1.00 0.00 C ATOM 1232 OH TYR A 131 68.203 -3.241 -64.943 1.00 0.00 O ATOM 0 H TYR A 131 70.355 4.565 -65.434 1.00 0.00 H new ATOM 0 HA TYR A 131 71.658 2.123 -65.118 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.503 2.671 -64.097 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.745 2.803 -65.671 1.00 0.00 H new ATOM 0 HD1 TYR A 131 68.311 0.760 -67.026 1.00 0.00 H new ATOM 0 HD2 TYR A 131 69.937 0.492 -63.096 1.00 0.00 H new ATOM 0 HE1 TYR A 131 67.740 -1.627 -66.953 1.00 0.00 H new ATOM 0 HE2 TYR A 131 69.371 -1.895 -63.023 1.00 0.00 H new ATOM 0 HH TYR A 131 68.482 -3.618 -64.082 1.00 0.00 H new ATOM 1242 N TRP A 132 70.460 2.634 -68.129 1.00 0.00 N ATOM 1243 CA TRP A 132 70.473 2.137 -69.500 1.00 0.00 C ATOM 1244 C TRP A 132 71.876 2.211 -70.093 1.00 0.00 C ATOM 1245 O TRP A 132 72.305 1.307 -70.809 1.00 0.00 O ATOM 1246 CB TRP A 132 69.498 2.940 -70.364 1.00 0.00 C ATOM 1247 CG TRP A 132 68.061 2.600 -70.109 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.463 2.424 -68.894 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.042 2.395 -71.094 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.134 2.121 -69.063 1.00 0.00 N ATOM 1251 CE2 TRP A 132 65.850 2.098 -70.403 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.019 2.434 -72.490 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 64.652 1.841 -71.064 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 65.829 2.179 -73.144 1.00 0.00 C ATOM 1255 CH2 TRP A 132 64.658 1.887 -72.432 1.00 0.00 C ATOM 0 H TRP A 132 70.044 3.559 -68.019 1.00 0.00 H new ATOM 0 HA TRP A 132 70.160 1.093 -69.485 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.651 4.003 -70.179 1.00 0.00 H new ATOM 0 HB3 TRP A 132 69.725 2.763 -71.415 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.962 2.510 -67.940 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.467 1.942 -68.313 1.00 0.00 H new ATOM 0 HE3 TRP A 132 67.916 2.659 -73.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 63.749 1.613 -70.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 65.801 2.205 -74.223 1.00 0.00 H new ATOM 0 HH2 TRP A 132 63.743 1.695 -72.973 1.00 0.00 H new ATOM 1266 N ASN A 133 72.586 3.293 -69.790 1.00 0.00 N ATOM 1267 CA ASN A 133 73.941 3.483 -70.293 1.00 0.00 C ATOM 1268 C ASN A 133 74.834 2.306 -69.913 1.00 0.00 C ATOM 1269 O ASN A 133 75.695 1.892 -70.687 1.00 0.00 O ATOM 1270 CB ASN A 133 74.533 4.784 -69.747 1.00 0.00 C ATOM 1271 CG ASN A 133 76.031 4.873 -69.961 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.545 4.473 -71.006 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.740 5.400 -68.969 1.00 0.00 N ATOM 0 H ASN A 133 72.245 4.051 -69.199 1.00 0.00 H new ATOM 0 HA ASN A 133 73.892 3.542 -71.380 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.049 5.632 -70.232 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.316 4.859 -68.681 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.753 5.486 -69.056 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.272 5.718 -68.121 1.00 0.00 H new ATOM 1280 N GLU A 134 74.620 1.772 -68.714 1.00 0.00 N ATOM 1281 CA GLU A 134 75.405 0.642 -68.231 1.00 0.00 C ATOM 1282 C GLU A 134 75.248 -0.564 -69.153 1.00 0.00 C ATOM 1283 O GLU A 134 76.136 -1.412 -69.241 1.00 0.00 O ATOM 1284 CB GLU A 134 74.982 0.269 -66.809 1.00 0.00 C ATOM 1285 CG GLU A 134 76.000 -0.587 -66.075 1.00 0.00 C ATOM 1286 CD GLU A 134 75.786 -2.071 -66.302 1.00 0.00 C ATOM 1287 OE1 GLU A 134 74.635 -2.534 -66.157 1.00 0.00 O ATOM 1288 OE2 GLU A 134 76.770 -2.770 -66.624 1.00 0.00 O ATOM 0 H GLU A 134 73.911 2.103 -68.060 1.00 0.00 H new ATOM 0 HA GLU A 134 76.454 0.938 -68.224 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.810 1.182 -66.239 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.033 -0.265 -66.850 1.00 0.00 H new ATOM 0 HG2 GLU A 134 77.003 -0.314 -66.403 1.00 0.00 H new ATOM 0 HG3 GLU A 134 75.945 -0.375 -65.007 1.00 0.00 H new ATOM 1295 N HIS A 135 74.111 -0.633 -69.838 1.00 0.00 N ATOM 1296 CA HIS A 135 73.836 -1.735 -70.753 1.00 0.00 C ATOM 1297 C HIS A 135 74.639 -1.584 -72.042 1.00 0.00 C ATOM 1298 O HIS A 135 74.956 -2.569 -72.707 1.00 0.00 O ATOM 1299 CB HIS A 135 72.342 -1.799 -71.074 1.00 0.00 C ATOM 1300 CG HIS A 135 71.859 -3.178 -71.401 1.00 0.00 C ATOM 1301 ND1 HIS A 135 71.189 -3.484 -72.567 1.00 0.00 N ATOM 1302 CD2 HIS A 135 71.952 -4.337 -70.708 1.00 0.00 C ATOM 1303 CE1 HIS A 135 70.890 -4.771 -72.576 1.00 0.00 C ATOM 1304 NE2 HIS A 135 71.343 -5.312 -71.459 1.00 0.00 N ATOM 0 H HIS A 135 73.366 0.061 -69.777 1.00 0.00 H new ATOM 0 HA HIS A 135 74.135 -2.663 -70.265 1.00 0.00 H new ATOM 0 HB2 HIS A 135 71.779 -1.418 -70.222 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.131 -1.140 -71.916 1.00 0.00 H new ATOM 0 HD2 HIS A 135 72.419 -4.470 -69.743 1.00 0.00 H new ATOM 0 HE1 HIS A 135 70.365 -5.292 -73.363 1.00 0.00 H new ATOM 0 HE2 HIS A 135 71.255 -6.294 -71.197 1.00 0.00 H new ATOM 1312 N GLY A 136 74.963 -0.342 -72.389 1.00 0.00 N ATOM 1313 CA GLY A 136 75.725 -0.085 -73.597 1.00 0.00 C ATOM 1314 C GLY A 136 74.872 0.491 -74.710 1.00 0.00 C ATOM 1315 O GLY A 136 75.075 0.179 -75.882 1.00 0.00 O ATOM 0 H GLY A 136 74.712 0.490 -71.855 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.536 0.607 -73.371 1.00 0.00 H new ATOM 0 HA3 GLY A 136 76.183 -1.013 -73.938 1.00 0.00 H new