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= -0.134 (180deg=-0.266) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HE2:sc= -0.124 K(o=-0.12,f=-5.8!) USER MOD Single : A 91 MET CE :methyl 151:sc= -0.0123 (180deg=-0.213) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.257 USER MOD Single : A 103 LYS NZ :NH3+ -156:sc=-0.00102 (180deg=-0.744) 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= -3.52 K(o=-3.5,f=-5.2!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -70:sc= -0.641 USER MOD Single : A 117 SER OG : rot 180:sc= 0.0162 USER MOD Single : A 121 CYS SG : rot -23:sc= -0.353 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 101:sc= 0.165 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=-0.19) USER MOD Single : A 131 TYR OH : rot 37:sc= -0.635 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 67.519 8.790 -49.914 1.00 0.00 N ATOM 463 CA VAL A 82 67.508 9.418 -51.230 1.00 0.00 C ATOM 464 C VAL A 82 67.704 8.385 -52.334 1.00 0.00 C ATOM 465 O VAL A 82 68.356 7.360 -52.131 1.00 0.00 O ATOM 466 CB VAL A 82 68.605 10.493 -51.347 1.00 0.00 C ATOM 467 CG1 VAL A 82 68.448 11.277 -52.642 1.00 0.00 C ATOM 468 CG2 VAL A 82 68.570 11.423 -50.144 1.00 0.00 C ATOM 0 HA VAL A 82 66.533 9.890 -51.348 1.00 0.00 H new ATOM 0 HB VAL A 82 69.575 9.997 -51.366 1.00 0.00 H new ATOM 0 HG11 VAL A 82 69.231 12.032 -52.708 1.00 0.00 H new ATOM 0 HG12 VAL A 82 68.527 10.597 -53.491 1.00 0.00 H new ATOM 0 HG13 VAL A 82 67.473 11.764 -52.657 1.00 0.00 H new ATOM 0 HG21 VAL A 82 69.352 12.176 -50.243 1.00 0.00 H new ATOM 0 HG22 VAL A 82 67.598 11.914 -50.092 1.00 0.00 H new ATOM 0 HG23 VAL A 82 68.735 10.847 -49.234 1.00 0.00 H new ATOM 478 N VAL A 83 67.137 8.662 -53.503 1.00 0.00 N ATOM 479 CA VAL A 83 67.250 7.757 -54.641 1.00 0.00 C ATOM 480 C VAL A 83 68.674 7.733 -55.184 1.00 0.00 C ATOM 481 O VAL A 83 69.169 8.734 -55.702 1.00 0.00 O ATOM 482 CB VAL A 83 66.287 8.158 -55.775 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.250 7.082 -56.849 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.894 8.420 -55.222 1.00 0.00 C ATOM 0 H VAL A 83 66.595 9.506 -53.687 1.00 0.00 H new ATOM 0 HA VAL A 83 66.984 6.763 -54.283 1.00 0.00 H new ATOM 0 HB VAL A 83 66.651 9.079 -56.230 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.565 7.382 -57.642 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.249 6.948 -57.264 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.910 6.143 -56.412 1.00 0.00 H new ATOM 0 HG21 VAL A 83 64.226 8.702 -56.036 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.518 7.517 -54.741 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.938 9.229 -54.492 1.00 0.00 H new ATOM 494 N GLU A 84 69.329 6.582 -55.062 1.00 0.00 N ATOM 495 CA GLU A 84 70.697 6.428 -55.541 1.00 0.00 C ATOM 496 C GLU A 84 70.720 6.137 -57.039 1.00 0.00 C ATOM 497 O GLU A 84 71.403 6.817 -57.805 1.00 0.00 O ATOM 498 CB GLU A 84 71.403 5.303 -54.781 1.00 0.00 C ATOM 499 CG GLU A 84 72.919 5.370 -54.864 1.00 0.00 C ATOM 500 CD GLU A 84 73.572 4.007 -54.734 1.00 0.00 C ATOM 501 OE1 GLU A 84 72.900 3.072 -54.250 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.753 3.876 -55.116 1.00 0.00 O ATOM 0 H GLU A 84 68.934 5.744 -54.636 1.00 0.00 H new ATOM 0 HA GLU A 84 71.225 7.365 -55.363 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.103 5.339 -53.734 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.068 4.344 -55.175 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.208 5.818 -55.815 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.294 6.025 -54.077 1.00 0.00 H new ATOM 509 N LYS A 85 69.969 5.121 -57.450 1.00 0.00 N ATOM 510 CA LYS A 85 69.901 4.739 -58.855 1.00 0.00 C ATOM 511 C LYS A 85 68.737 3.784 -59.104 1.00 0.00 C ATOM 512 O LYS A 85 68.059 3.359 -58.168 1.00 0.00 O ATOM 513 CB LYS A 85 71.214 4.084 -59.291 1.00 0.00 C ATOM 514 CG LYS A 85 71.708 3.015 -58.332 1.00 0.00 C ATOM 515 CD LYS A 85 72.393 1.877 -59.069 1.00 0.00 C ATOM 516 CE LYS A 85 73.798 1.635 -58.540 1.00 0.00 C ATOM 517 NZ LYS A 85 73.783 1.105 -57.149 1.00 0.00 N ATOM 0 H LYS A 85 69.398 4.547 -56.829 1.00 0.00 H new ATOM 0 HA LYS A 85 69.739 5.642 -59.444 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.079 3.641 -60.278 1.00 0.00 H new ATOM 0 HB3 LYS A 85 71.979 4.854 -59.389 1.00 0.00 H new ATOM 0 HG2 LYS A 85 72.403 3.458 -57.619 1.00 0.00 H new ATOM 0 HG3 LYS A 85 70.868 2.624 -57.758 1.00 0.00 H new ATOM 0 HD2 LYS A 85 71.802 0.967 -58.965 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.439 2.107 -60.133 1.00 0.00 H new ATOM 0 HE2 LYS A 85 74.315 0.930 -59.192 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.362 2.567 -58.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 74.754 1.081 -56.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 73.197 1.720 -56.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 73.388 0.143 -57.148 1.00 0.00 H new ATOM 531 N VAL A 86 68.513 3.449 -60.370 1.00 0.00 N ATOM 532 CA VAL A 86 67.433 2.542 -60.741 1.00 0.00 C ATOM 533 C VAL A 86 67.807 1.093 -60.450 1.00 0.00 C ATOM 534 O VAL A 86 68.951 0.684 -60.652 1.00 0.00 O ATOM 535 CB VAL A 86 67.073 2.678 -62.232 1.00 0.00 C ATOM 536 CG1 VAL A 86 65.968 1.702 -62.607 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.663 4.108 -62.553 1.00 0.00 C ATOM 0 H VAL A 86 69.065 3.792 -61.156 1.00 0.00 H new ATOM 0 HA VAL A 86 66.567 2.818 -60.139 1.00 0.00 H new ATOM 0 HB VAL A 86 67.956 2.435 -62.824 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.728 1.813 -63.664 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.303 0.682 -62.416 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.081 1.910 -62.009 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.412 4.186 -63.611 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.795 4.381 -61.953 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.488 4.783 -62.325 1.00 0.00 H new ATOM 547 N LEU A 87 66.837 0.321 -59.975 1.00 0.00 N ATOM 548 CA LEU A 87 67.064 -1.084 -59.656 1.00 0.00 C ATOM 549 C LEU A 87 66.735 -1.974 -60.850 1.00 0.00 C ATOM 550 O LEU A 87 67.527 -2.834 -61.235 1.00 0.00 O ATOM 551 CB LEU A 87 66.218 -1.497 -58.450 1.00 0.00 C ATOM 552 CG LEU A 87 66.786 -2.622 -57.584 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.991 -3.881 -58.413 1.00 0.00 C ATOM 554 CD2 LEU A 87 68.094 -2.188 -56.938 1.00 0.00 C ATOM 0 H LEU A 87 65.885 0.644 -59.802 1.00 0.00 H new ATOM 0 HA LEU A 87 68.119 -1.209 -59.412 1.00 0.00 H new ATOM 0 HB2 LEU A 87 66.069 -0.621 -57.819 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.235 -1.803 -58.809 1.00 0.00 H new ATOM 0 HG LEU A 87 66.069 -2.844 -56.793 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.396 -4.671 -57.781 1.00 0.00 H new ATOM 0 HD12 LEU A 87 66.036 -4.202 -58.829 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.688 -3.673 -59.224 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.484 -3.001 -56.325 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.818 -1.939 -57.714 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.918 -1.314 -56.312 1.00 0.00 H new ATOM 566 N LYS A 88 65.561 -1.759 -61.436 1.00 0.00 N ATOM 567 CA LYS A 88 65.128 -2.538 -62.590 1.00 0.00 C ATOM 568 C LYS A 88 64.124 -1.755 -63.429 1.00 0.00 C ATOM 569 O LYS A 88 63.560 -0.760 -62.972 1.00 0.00 O ATOM 570 CB LYS A 88 64.506 -3.860 -62.134 1.00 0.00 C ATOM 571 CG LYS A 88 65.486 -5.021 -62.122 1.00 0.00 C ATOM 572 CD LYS A 88 65.997 -5.334 -63.518 1.00 0.00 C ATOM 573 CE LYS A 88 66.804 -6.623 -63.540 1.00 0.00 C ATOM 574 NZ LYS A 88 67.113 -7.060 -64.930 1.00 0.00 N ATOM 0 H LYS A 88 64.893 -1.052 -61.130 1.00 0.00 H new ATOM 0 HA LYS A 88 66.003 -2.748 -63.205 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.095 -3.732 -61.133 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.672 -4.106 -62.792 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.327 -4.782 -61.471 1.00 0.00 H new ATOM 0 HG3 LYS A 88 65.001 -5.903 -61.705 1.00 0.00 H new ATOM 0 HD2 LYS A 88 65.155 -5.419 -64.204 1.00 0.00 H new ATOM 0 HD3 LYS A 88 66.616 -4.510 -63.873 1.00 0.00 H new ATOM 0 HE2 LYS A 88 67.734 -6.479 -62.989 1.00 0.00 H new ATOM 0 HE3 LYS A 88 66.248 -7.408 -63.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.664 -7.942 -64.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 66.226 -7.222 -65.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 67.665 -6.322 -65.411 1.00 0.00 H new ATOM 588 N HIS A 89 63.904 -2.210 -64.658 1.00 0.00 N ATOM 589 CA HIS A 89 62.965 -1.552 -65.561 1.00 0.00 C ATOM 590 C HIS A 89 61.815 -2.487 -65.924 1.00 0.00 C ATOM 591 O HIS A 89 62.022 -3.676 -66.164 1.00 0.00 O ATOM 592 CB HIS A 89 63.683 -1.091 -66.829 1.00 0.00 C ATOM 593 CG HIS A 89 62.756 -0.594 -67.895 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.687 0.237 -67.635 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.744 -0.813 -69.231 1.00 0.00 C ATOM 596 CE1 HIS A 89 61.056 0.506 -68.764 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.677 -0.119 -69.747 1.00 0.00 N ATOM 0 H HIS A 89 64.363 -3.031 -65.052 1.00 0.00 H new ATOM 0 HA HIS A 89 62.554 -0.682 -65.049 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.385 -0.298 -66.571 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.269 -1.920 -67.226 1.00 0.00 H new ATOM 0 HD1 HIS A 89 61.424 0.589 -66.714 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.443 -1.420 -69.787 1.00 0.00 H new ATOM 0 HE1 HIS A 89 60.181 1.131 -68.865 1.00 0.00 H new ATOM 605 N ARG A 90 60.604 -1.940 -65.961 1.00 0.00 N ATOM 606 CA ARG A 90 59.422 -2.725 -66.292 1.00 0.00 C ATOM 607 C ARG A 90 58.410 -1.884 -67.065 1.00 0.00 C ATOM 608 O ARG A 90 58.160 -0.728 -66.724 1.00 0.00 O ATOM 609 CB ARG A 90 58.776 -3.277 -65.020 1.00 0.00 C ATOM 610 CG ARG A 90 59.232 -4.683 -64.666 1.00 0.00 C ATOM 611 CD ARG A 90 58.770 -5.696 -65.703 1.00 0.00 C ATOM 612 NE ARG A 90 59.091 -7.066 -65.310 1.00 0.00 N ATOM 613 CZ ARG A 90 58.456 -7.721 -64.344 1.00 0.00 C ATOM 614 NH1 ARG A 90 57.473 -7.134 -63.676 1.00 0.00 N ATOM 615 NH2 ARG A 90 58.805 -8.966 -64.045 1.00 0.00 N ATOM 0 H ARG A 90 60.416 -0.957 -65.766 1.00 0.00 H new ATOM 0 HA ARG A 90 59.735 -3.557 -66.922 1.00 0.00 H new ATOM 0 HB2 ARG A 90 59.004 -2.610 -64.188 1.00 0.00 H new ATOM 0 HB3 ARG A 90 57.693 -3.276 -65.143 1.00 0.00 H new ATOM 0 HG2 ARG A 90 60.319 -4.706 -64.592 1.00 0.00 H new ATOM 0 HG3 ARG A 90 58.840 -4.958 -63.687 1.00 0.00 H new ATOM 0 HD2 ARG A 90 57.694 -5.603 -65.847 1.00 0.00 H new ATOM 0 HD3 ARG A 90 59.240 -5.474 -66.661 1.00 0.00 H new ATOM 0 HE ARG A 90 59.843 -7.546 -65.804 1.00 0.00 H new ATOM 0 HH11 ARG A 90 57.202 -6.177 -63.903 1.00 0.00 H new ATOM 0 HH12 ARG A 90 56.987 -7.639 -62.935 1.00 0.00 H new ATOM 0 HH21 ARG A 90 59.561 -9.421 -64.557 1.00 0.00 H new ATOM 0 HH22 ARG A 90 58.317 -9.468 -63.303 1.00 0.00 H new ATOM 629 N MET A 91 57.830 -2.473 -68.106 1.00 0.00 N ATOM 630 CA MET A 91 56.845 -1.777 -68.926 1.00 0.00 C ATOM 631 C MET A 91 55.454 -1.882 -68.310 1.00 0.00 C ATOM 632 O MET A 91 55.141 -2.853 -67.621 1.00 0.00 O ATOM 633 CB MET A 91 56.833 -2.353 -70.343 1.00 0.00 C ATOM 634 CG MET A 91 58.210 -2.427 -70.981 1.00 0.00 C ATOM 635 SD MET A 91 58.200 -3.305 -72.556 1.00 0.00 S ATOM 636 CE MET A 91 57.241 -2.179 -73.566 1.00 0.00 C ATOM 0 H MET A 91 58.025 -3.430 -68.401 1.00 0.00 H new ATOM 0 HA MET A 91 57.124 -0.724 -68.971 1.00 0.00 H new ATOM 0 HB2 MET A 91 56.400 -3.353 -70.316 1.00 0.00 H new ATOM 0 HB3 MET A 91 56.184 -1.741 -70.969 1.00 0.00 H new ATOM 0 HG2 MET A 91 58.589 -1.417 -71.135 1.00 0.00 H new ATOM 0 HG3 MET A 91 58.897 -2.925 -70.296 1.00 0.00 H new ATOM 0 HE1 MET A 91 57.552 -2.269 -74.607 1.00 0.00 H new ATOM 0 HE2 MET A 91 56.183 -2.425 -73.481 1.00 0.00 H new ATOM 0 HE3 MET A 91 57.404 -1.156 -73.226 1.00 0.00 H new ATOM 646 N ALA A 92 54.623 -0.876 -68.562 1.00 0.00 N ATOM 647 CA ALA A 92 53.264 -0.856 -68.033 1.00 0.00 C ATOM 648 C ALA A 92 52.340 -1.742 -68.861 1.00 0.00 C ATOM 649 O ALA A 92 52.011 -1.417 -70.002 1.00 0.00 O ATOM 650 CB ALA A 92 52.735 0.569 -67.992 1.00 0.00 C ATOM 0 H ALA A 92 54.867 -0.064 -69.129 1.00 0.00 H new ATOM 0 HA ALA A 92 53.290 -1.251 -67.018 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.720 0.569 -67.595 1.00 0.00 H new ATOM 0 HB2 ALA A 92 53.375 1.176 -67.352 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.731 0.985 -69.000 1.00 0.00 H new ATOM 716 N GLY A 97 52.963 3.767 -69.419 1.00 0.00 N ATOM 717 CA GLY A 97 54.295 4.207 -69.789 1.00 0.00 C ATOM 718 C GLY A 97 55.374 3.253 -69.318 1.00 0.00 C ATOM 719 O GLY A 97 55.206 2.035 -69.383 1.00 0.00 O ATOM 0 HA2 GLY A 97 54.352 4.309 -70.873 1.00 0.00 H new ATOM 0 HA3 GLY A 97 54.478 5.195 -69.366 1.00 0.00 H new ATOM 723 N TYR A 98 56.485 3.805 -68.844 1.00 0.00 N ATOM 724 CA TYR A 98 57.597 2.994 -68.364 1.00 0.00 C ATOM 725 C TYR A 98 57.691 3.044 -66.842 1.00 0.00 C ATOM 726 O TYR A 98 57.282 4.022 -66.216 1.00 0.00 O ATOM 727 CB TYR A 98 58.911 3.475 -68.983 1.00 0.00 C ATOM 728 CG TYR A 98 59.059 3.117 -70.444 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.735 1.846 -70.904 1.00 0.00 C ATOM 730 CD2 TYR A 98 59.524 4.047 -71.365 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.869 1.514 -72.238 1.00 0.00 C ATOM 732 CE2 TYR A 98 59.660 3.724 -72.701 1.00 0.00 C ATOM 733 CZ TYR A 98 59.332 2.456 -73.133 1.00 0.00 C ATOM 734 OH TYR A 98 59.467 2.130 -74.462 1.00 0.00 O ATOM 0 H TYR A 98 56.639 4.811 -68.782 1.00 0.00 H new ATOM 0 HA TYR A 98 57.417 1.962 -68.665 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.979 4.557 -68.874 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.744 3.045 -68.426 1.00 0.00 H new ATOM 0 HD1 TYR A 98 58.372 1.105 -70.207 1.00 0.00 H new ATOM 0 HD2 TYR A 98 59.784 5.040 -71.030 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.613 0.522 -72.579 1.00 0.00 H new ATOM 0 HE2 TYR A 98 60.021 4.460 -73.404 1.00 0.00 H new ATOM 0 HH TYR A 98 59.803 2.906 -74.957 1.00 0.00 H new ATOM 744 N GLU A 99 58.233 1.983 -66.254 1.00 0.00 N ATOM 745 CA GLU A 99 58.381 1.905 -64.805 1.00 0.00 C ATOM 746 C GLU A 99 59.819 1.570 -64.422 1.00 0.00 C ATOM 747 O GLU A 99 60.508 0.839 -65.134 1.00 0.00 O ATOM 748 CB GLU A 99 57.430 0.854 -64.229 1.00 0.00 C ATOM 749 CG GLU A 99 56.019 0.938 -64.787 1.00 0.00 C ATOM 750 CD GLU A 99 55.032 0.089 -64.009 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.481 -0.755 -63.206 1.00 0.00 O ATOM 752 OE2 GLU A 99 53.812 0.269 -64.204 1.00 0.00 O ATOM 0 H GLU A 99 58.577 1.166 -66.758 1.00 0.00 H new ATOM 0 HA GLU A 99 58.130 2.880 -64.387 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.833 -0.138 -64.431 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.390 0.967 -63.146 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.688 1.977 -64.774 1.00 0.00 H new ATOM 0 HG3 GLU A 99 56.025 0.619 -65.829 1.00 0.00 H new ATOM 759 N TYR A 100 60.265 2.109 -63.293 1.00 0.00 N ATOM 760 CA TYR A 100 61.622 1.871 -62.816 1.00 0.00 C ATOM 761 C TYR A 100 61.663 1.822 -61.291 1.00 0.00 C ATOM 762 O TYR A 100 61.039 2.641 -60.615 1.00 0.00 O ATOM 763 CB TYR A 100 62.564 2.962 -63.327 1.00 0.00 C ATOM 764 CG TYR A 100 62.358 3.306 -64.785 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.393 4.228 -65.172 1.00 0.00 C ATOM 766 CD2 TYR A 100 63.128 2.709 -65.776 1.00 0.00 C ATOM 767 CE1 TYR A 100 61.201 4.545 -66.503 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.943 3.020 -67.109 1.00 0.00 C ATOM 769 CZ TYR A 100 61.978 3.938 -67.467 1.00 0.00 C ATOM 770 OH TYR A 100 61.790 4.252 -68.794 1.00 0.00 O ATOM 0 H TYR A 100 59.706 2.714 -62.691 1.00 0.00 H new ATOM 0 HA TYR A 100 61.951 0.906 -63.202 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.424 3.861 -62.727 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.594 2.638 -63.181 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.783 4.705 -64.419 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.884 1.989 -65.499 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.447 5.264 -66.787 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.550 2.547 -67.866 1.00 0.00 H new ATOM 0 HH TYR A 100 62.418 3.738 -69.344 1.00 0.00 H new ATOM 780 N LEU A 101 62.402 0.856 -60.757 1.00 0.00 N ATOM 781 CA LEU A 101 62.526 0.699 -59.312 1.00 0.00 C ATOM 782 C LEU A 101 63.570 1.657 -58.747 1.00 0.00 C ATOM 783 O LEU A 101 64.603 1.905 -59.371 1.00 0.00 O ATOM 784 CB LEU A 101 62.902 -0.743 -58.967 1.00 0.00 C ATOM 785 CG LEU A 101 61.747 -1.744 -58.916 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.136 -3.044 -59.602 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.329 -2.004 -57.476 1.00 0.00 C ATOM 0 H LEU A 101 62.924 0.170 -61.302 1.00 0.00 H new ATOM 0 HA LEU A 101 61.562 0.935 -58.862 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.628 -1.093 -59.701 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.401 -0.745 -57.998 1.00 0.00 H new ATOM 0 HG LEU A 101 60.898 -1.316 -59.448 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.302 -3.744 -59.556 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.385 -2.845 -60.644 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.001 -3.477 -59.099 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.506 -2.719 -57.459 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.174 -2.410 -56.920 1.00 0.00 H new ATOM 0 HD23 LEU A 101 61.007 -1.070 -57.016 1.00 0.00 H new ATOM 799 N LEU A 102 63.295 2.192 -57.563 1.00 0.00 N ATOM 800 CA LEU A 102 64.212 3.122 -56.912 1.00 0.00 C ATOM 801 C LEU A 102 65.130 2.390 -55.939 1.00 0.00 C ATOM 802 O LEU A 102 64.668 1.683 -55.044 1.00 0.00 O ATOM 803 CB LEU A 102 63.428 4.208 -56.173 1.00 0.00 C ATOM 804 CG LEU A 102 62.309 4.886 -56.965 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.624 5.947 -56.119 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.857 5.494 -58.248 1.00 0.00 C ATOM 0 H LEU A 102 62.445 1.998 -57.034 1.00 0.00 H new ATOM 0 HA LEU A 102 64.827 3.587 -57.682 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.995 3.768 -55.275 1.00 0.00 H new ATOM 0 HB3 LEU A 102 64.130 4.975 -55.845 1.00 0.00 H new ATOM 0 HG LEU A 102 61.569 4.131 -57.232 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.831 6.419 -56.699 1.00 0.00 H new ATOM 0 HD12 LEU A 102 61.197 5.483 -55.230 1.00 0.00 H new ATOM 0 HD13 LEU A 102 62.353 6.701 -55.821 1.00 0.00 H new ATOM 0 HD21 LEU A 102 62.047 5.972 -58.799 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.617 6.236 -58.003 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.300 4.710 -58.862 1.00 0.00 H new ATOM 818 N LYS A 103 66.435 2.566 -56.119 1.00 0.00 N ATOM 819 CA LYS A 103 67.420 1.926 -55.256 1.00 0.00 C ATOM 820 C LYS A 103 67.909 2.890 -54.180 1.00 0.00 C ATOM 821 O LYS A 103 68.471 3.942 -54.486 1.00 0.00 O ATOM 822 CB LYS A 103 68.605 1.425 -56.084 1.00 0.00 C ATOM 823 CG LYS A 103 69.560 0.537 -55.305 1.00 0.00 C ATOM 824 CD LYS A 103 70.505 -0.213 -56.229 1.00 0.00 C ATOM 825 CE LYS A 103 70.963 -1.525 -55.612 1.00 0.00 C ATOM 826 NZ LYS A 103 71.956 -1.310 -54.523 1.00 0.00 N ATOM 0 H LYS A 103 66.835 3.147 -56.856 1.00 0.00 H new ATOM 0 HA LYS A 103 66.941 1.077 -54.768 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.228 0.872 -56.944 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.155 2.283 -56.472 1.00 0.00 H new ATOM 0 HG2 LYS A 103 70.137 1.145 -54.609 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.991 -0.176 -54.709 1.00 0.00 H new ATOM 0 HD2 LYS A 103 70.007 -0.410 -57.178 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.372 0.410 -56.448 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.100 -2.061 -55.216 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.403 -2.156 -56.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 72.535 -2.166 -54.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.571 -0.507 -54.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 71.457 -1.106 -53.634 1.00 0.00 H new ATOM 840 N TRP A 104 67.694 2.524 -52.922 1.00 0.00 N ATOM 841 CA TRP A 104 68.114 3.357 -51.801 1.00 0.00 C ATOM 842 C TRP A 104 69.624 3.282 -51.604 1.00 0.00 C ATOM 843 O TRP A 104 70.205 2.197 -51.604 1.00 0.00 O ATOM 844 CB TRP A 104 67.398 2.925 -50.521 1.00 0.00 C ATOM 845 CG TRP A 104 65.904 2.969 -50.633 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.059 1.902 -50.751 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.079 4.139 -50.639 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.759 2.338 -50.830 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.744 3.706 -50.763 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.337 5.509 -50.550 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.674 4.597 -50.801 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.274 6.391 -50.588 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.956 5.933 -50.712 1.00 0.00 C ATOM 0 H TRP A 104 67.231 1.656 -52.652 1.00 0.00 H new ATOM 0 HA TRP A 104 67.846 4.389 -52.027 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.706 1.911 -50.265 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.713 3.571 -49.701 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.368 0.867 -50.778 1.00 0.00 H new ATOM 0 HE1 TRP A 104 62.938 1.740 -50.923 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.349 5.872 -50.453 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.657 4.246 -50.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.463 7.452 -50.521 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.147 6.648 -50.738 1.00 0.00 H new ATOM 864 N GLU A 105 70.254 4.441 -51.434 1.00 0.00 N ATOM 865 CA GLU A 105 71.697 4.503 -51.236 1.00 0.00 C ATOM 866 C GLU A 105 72.106 3.749 -49.974 1.00 0.00 C ATOM 867 O GLU A 105 71.629 4.044 -48.880 1.00 0.00 O ATOM 868 CB GLU A 105 72.159 5.959 -51.146 1.00 0.00 C ATOM 869 CG GLU A 105 71.532 6.726 -49.994 1.00 0.00 C ATOM 870 CD GLU A 105 71.682 8.228 -50.142 1.00 0.00 C ATOM 871 OE1 GLU A 105 72.051 8.682 -51.246 1.00 0.00 O ATOM 872 OE2 GLU A 105 71.431 8.949 -49.154 1.00 0.00 O ATOM 0 H GLU A 105 69.788 5.348 -51.430 1.00 0.00 H new ATOM 0 HA GLU A 105 72.176 4.029 -52.093 1.00 0.00 H new ATOM 0 HB2 GLU A 105 73.243 5.981 -51.039 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.921 6.466 -52.081 1.00 0.00 H new ATOM 0 HG2 GLU A 105 70.473 6.475 -49.929 1.00 0.00 H new ATOM 0 HG3 GLU A 105 71.993 6.409 -49.058 1.00 0.00 H new ATOM 879 N GLY A 106 72.995 2.773 -50.137 1.00 0.00 N ATOM 880 CA GLY A 106 73.453 1.991 -49.004 1.00 0.00 C ATOM 881 C GLY A 106 72.634 0.732 -48.799 1.00 0.00 C ATOM 882 O GLY A 106 73.157 -0.292 -48.357 1.00 0.00 O ATOM 0 H GLY A 106 73.406 2.511 -51.033 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.498 1.720 -49.152 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.406 2.602 -48.102 1.00 0.00 H new ATOM 886 N TYR A 107 71.347 0.807 -49.118 1.00 0.00 N ATOM 887 CA TYR A 107 70.453 -0.334 -48.963 1.00 0.00 C ATOM 888 C TYR A 107 70.161 -0.985 -50.312 1.00 0.00 C ATOM 889 O TYR A 107 69.703 -0.325 -51.246 1.00 0.00 O ATOM 890 CB TYR A 107 69.146 0.102 -48.300 1.00 0.00 C ATOM 891 CG TYR A 107 69.328 0.645 -46.901 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.787 -0.170 -45.873 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.040 1.972 -46.607 1.00 0.00 C ATOM 894 CE1 TYR A 107 69.954 0.322 -44.593 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.206 2.473 -45.330 1.00 0.00 C ATOM 896 CZ TYR A 107 69.663 1.644 -44.326 1.00 0.00 C ATOM 897 OH TYR A 107 69.828 2.138 -43.053 1.00 0.00 O ATOM 0 H TYR A 107 70.899 1.646 -49.486 1.00 0.00 H new ATOM 0 HA TYR A 107 70.948 -1.067 -48.326 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.672 0.865 -48.918 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.465 -0.748 -48.265 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.017 -1.205 -46.078 1.00 0.00 H new ATOM 0 HD2 TYR A 107 68.680 2.623 -47.390 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.311 -0.325 -43.805 1.00 0.00 H new ATOM 0 HE2 TYR A 107 68.979 3.508 -45.119 1.00 0.00 H new ATOM 0 HH TYR A 107 69.580 3.086 -43.035 1.00 0.00 H new ATOM 907 N ASP A 108 70.427 -2.283 -50.405 1.00 0.00 N ATOM 908 CA ASP A 108 70.191 -3.025 -51.639 1.00 0.00 C ATOM 909 C ASP A 108 69.028 -3.998 -51.473 1.00 0.00 C ATOM 910 O ASP A 108 69.201 -5.108 -50.971 1.00 0.00 O ATOM 911 CB ASP A 108 71.453 -3.784 -52.051 1.00 0.00 C ATOM 912 CG ASP A 108 72.102 -4.506 -50.886 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.958 -3.895 -50.212 1.00 0.00 O ATOM 914 OD2 ASP A 108 71.752 -5.680 -50.647 1.00 0.00 O ATOM 0 H ASP A 108 70.806 -2.843 -49.642 1.00 0.00 H new ATOM 0 HA ASP A 108 69.935 -2.311 -52.421 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.202 -4.506 -52.828 1.00 0.00 H new ATOM 0 HB3 ASP A 108 72.168 -3.085 -52.485 1.00 0.00 H new ATOM 919 N ASP A 109 67.843 -3.573 -51.898 1.00 0.00 N ATOM 920 CA ASP A 109 66.651 -4.406 -51.797 1.00 0.00 C ATOM 921 C ASP A 109 66.494 -5.282 -53.036 1.00 0.00 C ATOM 922 O ASP A 109 67.046 -5.000 -54.100 1.00 0.00 O ATOM 923 CB ASP A 109 65.408 -3.535 -51.612 1.00 0.00 C ATOM 924 CG ASP A 109 64.840 -3.627 -50.209 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.634 -3.768 -49.256 1.00 0.00 O ATOM 926 OD2 ASP A 109 63.601 -3.558 -50.065 1.00 0.00 O ATOM 0 H ASP A 109 67.683 -2.656 -52.316 1.00 0.00 H new ATOM 0 HA ASP A 109 66.763 -5.054 -50.928 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.659 -2.497 -51.832 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.646 -3.838 -52.330 1.00 0.00 H new ATOM 931 N PRO A 110 65.723 -6.371 -52.897 1.00 0.00 N ATOM 932 CA PRO A 110 65.476 -7.311 -53.995 1.00 0.00 C ATOM 933 C PRO A 110 64.598 -6.709 -55.087 1.00 0.00 C ATOM 934 O PRO A 110 64.403 -5.494 -55.141 1.00 0.00 O ATOM 935 CB PRO A 110 64.755 -8.474 -53.310 1.00 0.00 C ATOM 936 CG PRO A 110 64.113 -7.868 -52.110 1.00 0.00 C ATOM 937 CD PRO A 110 65.034 -6.769 -51.659 1.00 0.00 C ATOM 0 HA PRO A 110 66.398 -7.600 -54.499 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.014 -8.924 -53.970 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.453 -9.263 -53.030 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.126 -7.475 -52.352 1.00 0.00 H new ATOM 0 HG3 PRO A 110 63.977 -8.610 -51.324 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.482 -5.937 -51.221 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.737 -7.119 -50.903 1.00 0.00 H new ATOM 945 N SER A 111 64.071 -7.565 -55.956 1.00 0.00 N ATOM 946 CA SER A 111 63.216 -7.117 -57.049 1.00 0.00 C ATOM 947 C SER A 111 61.889 -6.584 -56.517 1.00 0.00 C ATOM 948 O SER A 111 61.098 -6.003 -57.260 1.00 0.00 O ATOM 949 CB SER A 111 62.962 -8.264 -58.029 1.00 0.00 C ATOM 950 OG SER A 111 63.989 -8.340 -59.002 1.00 0.00 O ATOM 0 H SER A 111 64.221 -8.573 -55.925 1.00 0.00 H new ATOM 0 HA SER A 111 63.729 -6.309 -57.571 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.903 -9.206 -57.484 1.00 0.00 H new ATOM 0 HB3 SER A 111 62.000 -8.120 -58.521 1.00 0.00 H new ATOM 0 HG SER A 111 63.804 -9.082 -59.615 1.00 0.00 H new ATOM 956 N ASP A 112 61.652 -6.787 -55.226 1.00 0.00 N ATOM 957 CA ASP A 112 60.422 -6.326 -54.592 1.00 0.00 C ATOM 958 C ASP A 112 60.579 -4.901 -54.072 1.00 0.00 C ATOM 959 O ASP A 112 59.781 -4.435 -53.260 1.00 0.00 O ATOM 960 CB ASP A 112 60.032 -7.261 -53.446 1.00 0.00 C ATOM 961 CG ASP A 112 59.490 -8.588 -53.939 1.00 0.00 C ATOM 962 OD1 ASP A 112 59.790 -8.959 -55.093 1.00 0.00 O ATOM 963 OD2 ASP A 112 58.764 -9.255 -53.172 1.00 0.00 O ATOM 0 H ASP A 112 62.296 -7.268 -54.598 1.00 0.00 H new ATOM 0 HA ASP A 112 59.631 -6.334 -55.342 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.902 -7.440 -52.815 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.281 -6.774 -52.823 1.00 0.00 H new ATOM 968 N ASN A 113 61.613 -4.214 -54.545 1.00 0.00 N ATOM 969 CA ASN A 113 61.876 -2.842 -54.127 1.00 0.00 C ATOM 970 C ASN A 113 60.697 -1.935 -54.466 1.00 0.00 C ATOM 971 O ASN A 113 59.618 -2.407 -54.823 1.00 0.00 O ATOM 972 CB ASN A 113 63.148 -2.317 -54.797 1.00 0.00 C ATOM 973 CG ASN A 113 64.144 -1.766 -53.794 1.00 0.00 C ATOM 974 OD1 ASN A 113 63.777 -1.387 -52.682 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.412 -1.720 -54.185 1.00 0.00 N ATOM 0 H ASN A 113 62.283 -4.585 -55.219 1.00 0.00 H new ATOM 0 HA ASN A 113 62.015 -2.838 -53.046 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.615 -3.122 -55.365 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.884 -1.536 -55.510 1.00 0.00 H new ATOM 0 HD21 ASN A 113 66.128 -1.359 -53.554 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.671 -2.045 -55.117 1.00 0.00 H new ATOM 982 N THR A 114 60.912 -0.628 -54.353 1.00 0.00 N ATOM 983 CA THR A 114 59.868 0.346 -54.647 1.00 0.00 C ATOM 984 C THR A 114 59.815 0.662 -56.137 1.00 0.00 C ATOM 985 O THR A 114 60.798 1.121 -56.719 1.00 0.00 O ATOM 986 CB THR A 114 60.085 1.655 -53.864 1.00 0.00 C ATOM 987 OG1 THR A 114 60.735 1.379 -52.618 1.00 0.00 O ATOM 988 CG2 THR A 114 58.760 2.356 -53.605 1.00 0.00 C ATOM 0 H THR A 114 61.800 -0.220 -54.060 1.00 0.00 H new ATOM 0 HA THR A 114 58.923 -0.101 -54.339 1.00 0.00 H new ATOM 0 HB THR A 114 60.715 2.311 -54.464 1.00 0.00 H new ATOM 0 HG1 THR A 114 60.871 2.216 -52.127 1.00 0.00 H new ATOM 0 HG21 THR A 114 58.938 3.278 -53.051 1.00 0.00 H new ATOM 0 HG22 THR A 114 58.281 2.591 -54.555 1.00 0.00 H new ATOM 0 HG23 THR A 114 58.110 1.702 -53.023 1.00 0.00 H new ATOM 996 N TRP A 115 58.662 0.414 -56.748 1.00 0.00 N ATOM 997 CA TRP A 115 58.481 0.674 -58.172 1.00 0.00 C ATOM 998 C TRP A 115 57.969 2.090 -58.407 1.00 0.00 C ATOM 999 O TRP A 115 56.888 2.454 -57.942 1.00 0.00 O ATOM 1000 CB TRP A 115 57.509 -0.341 -58.777 1.00 0.00 C ATOM 1001 CG TRP A 115 57.882 -1.764 -58.491 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.706 -2.437 -57.316 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.495 -2.688 -59.397 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.173 -3.724 -57.436 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.661 -3.903 -58.704 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.917 -2.608 -60.727 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.233 -5.025 -59.296 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.484 -3.723 -61.313 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.637 -4.919 -60.599 1.00 0.00 C ATOM 0 H TRP A 115 57.839 0.034 -56.280 1.00 0.00 H new ATOM 0 HA TRP A 115 59.450 0.574 -58.660 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.508 -0.150 -58.390 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.466 -0.194 -59.856 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.265 -2.019 -56.423 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.159 -4.431 -56.701 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.802 -1.691 -61.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.354 -5.947 -58.746 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.815 -3.672 -62.340 1.00 0.00 H new ATOM 0 HH2 TRP A 115 60.082 -5.774 -61.087 1.00 0.00 H new ATOM 1020 N SER A 116 58.750 2.885 -59.131 1.00 0.00 N ATOM 1021 CA SER A 116 58.376 4.264 -59.424 1.00 0.00 C ATOM 1022 C SER A 116 57.797 4.383 -60.830 1.00 0.00 C ATOM 1023 O SER A 116 58.275 3.742 -61.766 1.00 0.00 O ATOM 1024 CB SER A 116 59.588 5.186 -59.279 1.00 0.00 C ATOM 1025 OG SER A 116 60.096 5.562 -60.547 1.00 0.00 O ATOM 0 H SER A 116 59.646 2.598 -59.526 1.00 0.00 H new ATOM 0 HA SER A 116 57.611 4.566 -58.708 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.306 6.077 -58.718 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.366 4.682 -58.707 1.00 0.00 H new ATOM 0 HG SER A 116 60.513 4.786 -60.976 1.00 0.00 H new ATOM 1031 N SER A 117 56.765 5.207 -60.971 1.00 0.00 N ATOM 1032 CA SER A 117 56.117 5.408 -62.262 1.00 0.00 C ATOM 1033 C SER A 117 56.966 6.301 -63.163 1.00 0.00 C ATOM 1034 O SER A 117 57.940 6.904 -62.715 1.00 0.00 O ATOM 1035 CB SER A 117 54.731 6.027 -62.071 1.00 0.00 C ATOM 1036 OG SER A 117 54.780 7.115 -61.164 1.00 0.00 O ATOM 0 H SER A 117 56.359 5.747 -60.207 1.00 0.00 H new ATOM 0 HA SER A 117 56.009 4.435 -62.741 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.346 6.367 -63.032 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.039 5.271 -61.700 1.00 0.00 H new ATOM 0 HG SER A 117 53.883 7.495 -61.060 1.00 0.00 H new ATOM 1042 N GLU A 118 56.587 6.379 -64.434 1.00 0.00 N ATOM 1043 CA GLU A 118 57.313 7.198 -65.398 1.00 0.00 C ATOM 1044 C GLU A 118 57.421 8.641 -64.914 1.00 0.00 C ATOM 1045 O GLU A 118 58.356 9.358 -65.271 1.00 0.00 O ATOM 1046 CB GLU A 118 56.619 7.156 -66.761 1.00 0.00 C ATOM 1047 CG GLU A 118 57.184 8.150 -67.762 1.00 0.00 C ATOM 1048 CD GLU A 118 56.519 9.510 -67.673 1.00 0.00 C ATOM 1049 OE1 GLU A 118 55.310 9.559 -67.366 1.00 0.00 O ATOM 1050 OE2 GLU A 118 57.208 10.525 -67.910 1.00 0.00 O ATOM 0 H GLU A 118 55.782 5.886 -64.820 1.00 0.00 H new ATOM 0 HA GLU A 118 58.319 6.790 -65.498 1.00 0.00 H new ATOM 0 HB2 GLU A 118 56.705 6.150 -67.172 1.00 0.00 H new ATOM 0 HB3 GLU A 118 55.556 7.355 -66.624 1.00 0.00 H new ATOM 0 HG2 GLU A 118 58.255 8.262 -67.592 1.00 0.00 H new ATOM 0 HG3 GLU A 118 57.060 7.755 -68.770 1.00 0.00 H new ATOM 1057 N ALA A 119 56.458 9.060 -64.100 1.00 0.00 N ATOM 1058 CA ALA A 119 56.446 10.416 -63.565 1.00 0.00 C ATOM 1059 C ALA A 119 57.729 10.715 -62.797 1.00 0.00 C ATOM 1060 O ALA A 119 58.187 11.857 -62.757 1.00 0.00 O ATOM 1061 CB ALA A 119 55.233 10.619 -62.670 1.00 0.00 C ATOM 0 H ALA A 119 55.676 8.480 -63.797 1.00 0.00 H new ATOM 0 HA ALA A 119 56.386 11.110 -64.403 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.237 11.636 -62.277 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.323 10.456 -63.248 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.269 9.910 -61.843 1.00 0.00 H new ATOM 1067 N ASP A 120 58.302 9.683 -62.188 1.00 0.00 N ATOM 1068 CA ASP A 120 59.533 9.836 -61.421 1.00 0.00 C ATOM 1069 C ASP A 120 60.710 10.154 -62.339 1.00 0.00 C ATOM 1070 O ASP A 120 61.730 10.682 -61.896 1.00 0.00 O ATOM 1071 CB ASP A 120 59.822 8.564 -60.622 1.00 0.00 C ATOM 1072 CG ASP A 120 61.222 8.553 -60.039 1.00 0.00 C ATOM 1073 OD1 ASP A 120 61.439 9.217 -59.005 1.00 0.00 O ATOM 1074 OD2 ASP A 120 62.101 7.879 -60.618 1.00 0.00 O ATOM 0 H ASP A 120 57.934 8.732 -62.210 1.00 0.00 H new ATOM 0 HA ASP A 120 59.400 10.668 -60.730 1.00 0.00 H new ATOM 0 HB2 ASP A 120 59.095 8.472 -59.815 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.693 7.695 -61.268 1.00 0.00 H new ATOM 1079 N CYS A 121 60.561 9.827 -63.618 1.00 0.00 N ATOM 1080 CA CYS A 121 61.612 10.076 -64.598 1.00 0.00 C ATOM 1081 C CYS A 121 62.015 11.547 -64.601 1.00 0.00 C ATOM 1082 O CYS A 121 63.174 11.882 -64.844 1.00 0.00 O ATOM 1083 CB CYS A 121 61.145 9.660 -65.994 1.00 0.00 C ATOM 1084 SG CYS A 121 62.398 9.863 -67.282 1.00 0.00 S ATOM 0 H CYS A 121 59.723 9.389 -64.000 1.00 0.00 H new ATOM 0 HA CYS A 121 62.482 9.480 -64.321 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.835 8.616 -65.965 1.00 0.00 H new ATOM 0 HB3 CYS A 121 60.266 10.247 -66.261 1.00 0.00 H new ATOM 0 HG CYS A 121 63.269 10.751 -66.904 1.00 0.00 H new ATOM 1090 N SER A 122 61.051 12.420 -64.330 1.00 0.00 N ATOM 1091 CA SER A 122 61.304 13.856 -64.307 1.00 0.00 C ATOM 1092 C SER A 122 62.157 14.238 -63.101 1.00 0.00 C ATOM 1093 O SER A 122 62.821 15.273 -63.099 1.00 0.00 O ATOM 1094 CB SER A 122 59.983 14.628 -64.276 1.00 0.00 C ATOM 1095 OG SER A 122 60.143 15.934 -64.804 1.00 0.00 O ATOM 0 H SER A 122 60.087 12.158 -64.123 1.00 0.00 H new ATOM 0 HA SER A 122 61.849 14.118 -65.214 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.230 14.090 -64.851 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.618 14.689 -63.251 1.00 0.00 H new ATOM 0 HG SER A 122 59.285 16.406 -64.775 1.00 0.00 H new ATOM 1101 N GLY A 123 62.134 13.392 -62.076 1.00 0.00 N ATOM 1102 CA GLY A 123 62.908 13.657 -60.878 1.00 0.00 C ATOM 1103 C GLY A 123 64.248 12.948 -60.885 1.00 0.00 C ATOM 1104 O GLY A 123 65.265 13.524 -60.494 1.00 0.00 O ATOM 0 H GLY A 123 61.593 12.528 -62.054 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.069 14.731 -60.783 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.338 13.342 -60.004 1.00 0.00 H new ATOM 1108 N CYS A 124 64.251 11.696 -61.329 1.00 0.00 N ATOM 1109 CA CYS A 124 65.477 10.907 -61.383 1.00 0.00 C ATOM 1110 C CYS A 124 65.869 10.610 -62.827 1.00 0.00 C ATOM 1111 O CYS A 124 66.323 9.511 -63.145 1.00 0.00 O ATOM 1112 CB CYS A 124 65.300 9.599 -60.611 1.00 0.00 C ATOM 1113 SG CYS A 124 64.775 9.820 -58.895 1.00 0.00 S ATOM 0 H CYS A 124 63.419 11.205 -61.657 1.00 0.00 H new ATOM 0 HA CYS A 124 66.275 11.488 -60.921 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.566 8.981 -61.128 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.243 9.052 -60.624 1.00 0.00 H new ATOM 0 HG CYS A 124 63.498 9.595 -58.799 1.00 0.00 H new ATOM 1119 N LYS A 125 65.688 11.597 -63.698 1.00 0.00 N ATOM 1120 CA LYS A 125 66.022 11.443 -65.109 1.00 0.00 C ATOM 1121 C LYS A 125 67.435 10.893 -65.277 1.00 0.00 C ATOM 1122 O LYS A 125 67.657 9.950 -66.036 1.00 0.00 O ATOM 1123 CB LYS A 125 65.896 12.785 -65.834 1.00 0.00 C ATOM 1124 CG LYS A 125 66.634 13.919 -65.145 1.00 0.00 C ATOM 1125 CD LYS A 125 66.307 15.262 -65.776 1.00 0.00 C ATOM 1126 CE LYS A 125 66.745 16.417 -64.889 1.00 0.00 C ATOM 1127 NZ LYS A 125 68.176 16.770 -65.104 1.00 0.00 N ATOM 0 H LYS A 125 65.312 12.512 -63.451 1.00 0.00 H new ATOM 0 HA LYS A 125 65.320 10.733 -65.547 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.278 12.678 -66.849 1.00 0.00 H new ATOM 0 HB3 LYS A 125 64.841 13.046 -65.917 1.00 0.00 H new ATOM 0 HG2 LYS A 125 66.368 13.938 -64.088 1.00 0.00 H new ATOM 0 HG3 LYS A 125 67.708 13.742 -65.200 1.00 0.00 H new ATOM 0 HD2 LYS A 125 66.800 15.339 -66.745 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.234 15.328 -65.958 1.00 0.00 H new ATOM 0 HE2 LYS A 125 66.122 17.288 -65.092 1.00 0.00 H new ATOM 0 HE3 LYS A 125 66.590 16.151 -63.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 68.436 17.561 -64.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 68.773 15.947 -64.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 68.320 17.048 -66.096 1.00 0.00 H new ATOM 1141 N GLN A 126 68.385 11.487 -64.563 1.00 0.00 N ATOM 1142 CA GLN A 126 69.776 11.055 -64.633 1.00 0.00 C ATOM 1143 C GLN A 126 69.892 9.553 -64.398 1.00 0.00 C ATOM 1144 O GLN A 126 70.714 8.878 -65.019 1.00 0.00 O ATOM 1145 CB GLN A 126 70.619 11.811 -63.605 1.00 0.00 C ATOM 1146 CG GLN A 126 69.987 11.869 -62.224 1.00 0.00 C ATOM 1147 CD GLN A 126 70.944 12.378 -61.165 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.756 13.268 -61.421 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.855 11.816 -59.965 1.00 0.00 N ATOM 0 H GLN A 126 68.217 12.269 -63.929 1.00 0.00 H new ATOM 0 HA GLN A 126 70.149 11.277 -65.633 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.596 11.335 -63.528 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.787 12.827 -63.962 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.110 12.516 -62.257 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.639 10.874 -61.946 1.00 0.00 H new ATOM 0 HE21 GLN A 126 70.168 11.082 -59.796 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.474 12.119 -59.213 1.00 0.00 H new ATOM 1158 N LEU A 127 69.064 9.035 -63.497 1.00 0.00 N ATOM 1159 CA LEU A 127 69.074 7.611 -63.178 1.00 0.00 C ATOM 1160 C LEU A 127 68.461 6.795 -64.312 1.00 0.00 C ATOM 1161 O LEU A 127 69.040 5.806 -64.762 1.00 0.00 O ATOM 1162 CB LEU A 127 68.310 7.354 -61.878 1.00 0.00 C ATOM 1163 CG LEU A 127 68.743 8.183 -60.669 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.077 7.670 -59.403 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.258 8.162 -60.523 1.00 0.00 C ATOM 0 H LEU A 127 68.378 9.579 -62.975 1.00 0.00 H new ATOM 0 HA LEU A 127 70.111 7.299 -63.050 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.251 7.539 -62.060 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.410 6.299 -61.624 1.00 0.00 H new ATOM 0 HG LEU A 127 68.427 9.214 -60.828 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.398 8.273 -58.553 1.00 0.00 H new ATOM 0 HD12 LEU A 127 66.994 7.738 -59.508 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.361 6.631 -59.238 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.548 8.757 -59.657 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.596 7.135 -60.387 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.716 8.579 -61.420 1.00 0.00 H new ATOM 1177 N ILE A 128 67.287 7.218 -64.770 1.00 0.00 N ATOM 1178 CA ILE A 128 66.598 6.528 -65.854 1.00 0.00 C ATOM 1179 C ILE A 128 67.519 6.329 -67.053 1.00 0.00 C ATOM 1180 O ILE A 128 67.571 5.245 -67.633 1.00 0.00 O ATOM 1181 CB ILE A 128 65.345 7.301 -66.306 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.426 7.568 -65.112 1.00 0.00 C ATOM 1183 CG2 ILE A 128 64.607 6.527 -67.388 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.002 6.313 -64.383 1.00 0.00 C ATOM 0 H ILE A 128 66.794 8.034 -64.408 1.00 0.00 H new ATOM 0 HA ILE A 128 66.295 5.555 -65.467 1.00 0.00 H new ATOM 0 HB ILE A 128 65.657 8.259 -66.721 1.00 0.00 H new ATOM 0 HG12 ILE A 128 64.936 8.230 -64.412 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.537 8.095 -65.459 1.00 0.00 H new ATOM 0 HG21 ILE A 128 63.724 7.086 -67.697 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.264 6.384 -68.246 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.303 5.556 -66.998 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.352 6.579 -63.549 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.463 5.659 -65.068 1.00 0.00 H new ATOM 0 HD13 ILE A 128 64.884 5.796 -64.005 1.00 0.00 H new ATOM 1196 N GLU A 129 68.245 7.382 -67.416 1.00 0.00 N ATOM 1197 CA GLU A 129 69.165 7.322 -68.546 1.00 0.00 C ATOM 1198 C GLU A 129 70.434 6.560 -68.173 1.00 0.00 C ATOM 1199 O GLU A 129 70.966 5.791 -68.973 1.00 0.00 O ATOM 1200 CB GLU A 129 69.523 8.733 -69.016 1.00 0.00 C ATOM 1201 CG GLU A 129 70.205 9.575 -67.951 1.00 0.00 C ATOM 1202 CD GLU A 129 70.204 11.053 -68.288 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.142 11.694 -68.148 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.268 11.570 -68.691 1.00 0.00 O ATOM 0 H GLU A 129 68.214 8.286 -66.944 1.00 0.00 H new ATOM 0 HA GLU A 129 68.669 6.792 -69.359 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.177 8.662 -69.885 1.00 0.00 H new ATOM 0 HB3 GLU A 129 68.614 9.240 -69.341 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.702 9.423 -66.996 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.233 9.235 -67.827 1.00 0.00 H new ATOM 1211 N ALA A 130 70.913 6.782 -66.954 1.00 0.00 N ATOM 1212 CA ALA A 130 72.119 6.117 -66.475 1.00 0.00 C ATOM 1213 C ALA A 130 71.985 4.601 -66.573 1.00 0.00 C ATOM 1214 O ALA A 130 72.889 3.919 -67.057 1.00 0.00 O ATOM 1215 CB ALA A 130 72.415 6.530 -65.040 1.00 0.00 C ATOM 0 H ALA A 130 70.485 7.417 -66.280 1.00 0.00 H new ATOM 0 HA ALA A 130 72.950 6.425 -67.109 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.318 6.026 -64.695 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.562 7.609 -64.995 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.577 6.251 -64.401 1.00 0.00 H new ATOM 1221 N TYR A 131 70.854 4.080 -66.112 1.00 0.00 N ATOM 1222 CA TYR A 131 70.604 2.644 -66.146 1.00 0.00 C ATOM 1223 C TYR A 131 70.749 2.099 -67.563 1.00 0.00 C ATOM 1224 O TYR A 131 71.232 0.984 -67.765 1.00 0.00 O ATOM 1225 CB TYR A 131 69.204 2.336 -65.610 1.00 0.00 C ATOM 1226 CG TYR A 131 68.988 0.875 -65.286 1.00 0.00 C ATOM 1227 CD1 TYR A 131 69.515 0.314 -64.129 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.255 0.056 -66.136 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.321 -1.020 -63.830 1.00 0.00 C ATOM 1230 CE2 TYR A 131 68.054 -1.280 -65.844 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.590 -1.813 -64.690 1.00 0.00 C ATOM 1232 OH TYR A 131 68.392 -3.142 -64.394 1.00 0.00 O ATOM 0 H TYR A 131 70.095 4.631 -65.710 1.00 0.00 H new ATOM 0 HA TYR A 131 71.344 2.157 -65.511 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.029 2.928 -64.712 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.465 2.649 -66.347 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.086 0.932 -63.452 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.835 0.470 -67.041 1.00 0.00 H new ATOM 0 HE1 TYR A 131 69.739 -1.440 -62.927 1.00 0.00 H new ATOM 0 HE2 TYR A 131 67.481 -1.903 -66.515 1.00 0.00 H new ATOM 0 HH TYR A 131 68.271 -3.247 -63.427 1.00 0.00 H new ATOM 1242 N TRP A 132 70.329 2.893 -68.541 1.00 0.00 N ATOM 1243 CA TRP A 132 70.413 2.491 -69.941 1.00 0.00 C ATOM 1244 C TRP A 132 71.846 2.591 -70.451 1.00 0.00 C ATOM 1245 O TRP A 132 72.306 1.737 -71.207 1.00 0.00 O ATOM 1246 CB TRP A 132 69.491 3.360 -70.798 1.00 0.00 C ATOM 1247 CG TRP A 132 68.038 3.039 -70.621 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.362 2.924 -69.440 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.083 2.790 -71.659 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.044 2.619 -69.681 1.00 0.00 N ATOM 1251 CE2 TRP A 132 65.847 2.532 -71.034 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.151 2.762 -73.054 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 64.692 2.248 -71.758 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.004 2.481 -73.771 1.00 0.00 C ATOM 1255 CH2 TRP A 132 64.788 2.228 -73.123 1.00 0.00 C ATOM 0 H TRP A 132 69.927 3.818 -68.391 1.00 0.00 H new ATOM 0 HA TRP A 132 70.093 1.452 -70.015 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.657 4.408 -70.549 1.00 0.00 H new ATOM 0 HB3 TRP A 132 69.758 3.235 -71.847 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.799 3.054 -68.461 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.328 2.480 -68.968 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.084 2.957 -73.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 63.754 2.051 -71.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 66.046 2.456 -74.850 1.00 0.00 H new ATOM 0 HH2 TRP A 132 63.909 2.013 -73.712 1.00 0.00 H new ATOM 1266 N ASN A 133 72.547 3.640 -70.033 1.00 0.00 N ATOM 1267 CA ASN A 133 73.929 3.851 -70.449 1.00 0.00 C ATOM 1268 C ASN A 133 74.816 2.696 -69.996 1.00 0.00 C ATOM 1269 O ASN A 133 75.677 2.233 -70.743 1.00 0.00 O ATOM 1270 CB ASN A 133 74.459 5.169 -69.880 1.00 0.00 C ATOM 1271 CG ASN A 133 75.934 5.370 -70.166 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.360 5.365 -71.321 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.722 5.549 -69.112 1.00 0.00 N ATOM 0 H ASN A 133 72.181 4.357 -69.407 1.00 0.00 H new ATOM 0 HA ASN A 133 73.951 3.897 -71.538 1.00 0.00 H new ATOM 0 HB2 ASN A 133 73.893 5.998 -70.304 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.295 5.189 -68.803 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.724 5.690 -69.242 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.325 5.546 -68.172 1.00 0.00 H new ATOM 1280 N GLU A 134 74.597 2.235 -68.768 1.00 0.00 N ATOM 1281 CA GLU A 134 75.377 1.133 -68.216 1.00 0.00 C ATOM 1282 C GLU A 134 75.159 -0.144 -69.022 1.00 0.00 C ATOM 1283 O GLU A 134 76.027 -1.017 -69.070 1.00 0.00 O ATOM 1284 CB GLU A 134 75.002 0.897 -66.752 1.00 0.00 C ATOM 1285 CG GLU A 134 76.202 0.715 -65.838 1.00 0.00 C ATOM 1286 CD GLU A 134 76.472 1.935 -64.980 1.00 0.00 C ATOM 1287 OE1 GLU A 134 75.503 2.505 -64.436 1.00 0.00 O ATOM 1288 OE2 GLU A 134 77.653 2.321 -64.852 1.00 0.00 O ATOM 0 H GLU A 134 73.887 2.607 -68.137 1.00 0.00 H new ATOM 0 HA GLU A 134 76.432 1.402 -68.274 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.410 1.741 -66.397 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.368 0.013 -66.686 1.00 0.00 H new ATOM 0 HG2 GLU A 134 76.035 -0.148 -65.194 1.00 0.00 H new ATOM 0 HG3 GLU A 134 77.084 0.497 -66.441 1.00 0.00 H new ATOM 1295 N HIS A 135 73.994 -0.248 -69.652 1.00 0.00 N ATOM 1296 CA HIS A 135 73.661 -1.419 -70.455 1.00 0.00 C ATOM 1297 C HIS A 135 74.391 -1.385 -71.795 1.00 0.00 C ATOM 1298 O HIS A 135 74.763 -2.424 -72.337 1.00 0.00 O ATOM 1299 CB HIS A 135 72.151 -1.493 -70.686 1.00 0.00 C ATOM 1300 CG HIS A 135 71.742 -2.582 -71.630 1.00 0.00 C ATOM 1301 ND1 HIS A 135 71.940 -3.920 -71.366 1.00 0.00 N ATOM 1302 CD2 HIS A 135 71.141 -2.524 -72.841 1.00 0.00 C ATOM 1303 CE1 HIS A 135 71.480 -4.639 -72.375 1.00 0.00 C ATOM 1304 NE2 HIS A 135 70.989 -3.815 -73.283 1.00 0.00 N ATOM 0 H HIS A 135 73.264 0.464 -69.622 1.00 0.00 H new ATOM 0 HA HIS A 135 73.982 -2.306 -69.909 1.00 0.00 H new ATOM 0 HB2 HIS A 135 71.652 -1.647 -69.729 1.00 0.00 H new ATOM 0 HB3 HIS A 135 71.804 -0.536 -71.076 1.00 0.00 H new ATOM 0 HD2 HIS A 135 70.837 -1.629 -73.363 1.00 0.00 H new ATOM 0 HE1 HIS A 135 71.502 -5.716 -72.445 1.00 0.00 H new ATOM 0 HE2 HIS A 135 70.566 -4.093 -74.169 1.00 0.00 H new ATOM 1312 N GLY A 136 74.592 -0.181 -72.323 1.00 0.00 N ATOM 1313 CA GLY A 136 75.276 -0.034 -73.594 1.00 0.00 C ATOM 1314 C GLY A 136 74.321 0.246 -74.738 1.00 0.00 C ATOM 1315 O GLY A 136 74.589 -0.117 -75.883 1.00 0.00 O ATOM 0 H GLY A 136 74.293 0.694 -71.893 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.000 0.778 -73.522 1.00 0.00 H new ATOM 0 HA3 GLY A 136 75.838 -0.943 -73.808 1.00 0.00 H new