USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 379 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 MET CE :methyl -156:sc= -0.234 (180deg=-0.937) USER MOD Set 1.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -138:sc= -0.277 (180deg=-1.92!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-0.16) USER MOD Single : A 100 TYR OH : rot 146:sc= 0.0497 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0.0882 USER MOD Single : A 113 ASN : amide:sc= -3.86 K(o=-3.9,f=-7.5!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 150:sc= -0.531 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot -20:sc= -0.347 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 151:sc= -0.463 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=-0.29) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 135 HIS : no HD1:sc= 0 K(o=0,f=-0.8) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 66.718 8.311 -49.829 1.00 0.00 N ATOM 463 CA VAL A 82 66.771 9.039 -51.091 1.00 0.00 C ATOM 464 C VAL A 82 67.073 8.101 -52.254 1.00 0.00 C ATOM 465 O VAL A 82 67.733 7.076 -52.084 1.00 0.00 O ATOM 466 CB VAL A 82 67.836 10.151 -51.053 1.00 0.00 C ATOM 467 CG1 VAL A 82 67.723 11.040 -52.282 1.00 0.00 C ATOM 468 CG2 VAL A 82 67.704 10.971 -49.778 1.00 0.00 C ATOM 0 HA VAL A 82 65.790 9.491 -51.237 1.00 0.00 H new ATOM 0 HB VAL A 82 68.822 9.687 -51.059 1.00 0.00 H new ATOM 0 HG11 VAL A 82 68.483 11.820 -52.238 1.00 0.00 H new ATOM 0 HG12 VAL A 82 67.870 10.440 -53.180 1.00 0.00 H new ATOM 0 HG13 VAL A 82 66.734 11.498 -52.310 1.00 0.00 H new ATOM 0 HG21 VAL A 82 68.464 11.752 -49.767 1.00 0.00 H new ATOM 0 HG22 VAL A 82 66.715 11.427 -49.739 1.00 0.00 H new ATOM 0 HG23 VAL A 82 67.839 10.322 -48.913 1.00 0.00 H new ATOM 478 N VAL A 83 66.586 8.460 -53.438 1.00 0.00 N ATOM 479 CA VAL A 83 66.805 7.651 -54.632 1.00 0.00 C ATOM 480 C VAL A 83 68.266 7.696 -55.065 1.00 0.00 C ATOM 481 O VAL A 83 68.777 8.747 -55.449 1.00 0.00 O ATOM 482 CB VAL A 83 65.919 8.124 -55.800 1.00 0.00 C ATOM 483 CG1 VAL A 83 65.966 7.123 -56.944 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.489 8.342 -55.329 1.00 0.00 C ATOM 0 H VAL A 83 66.037 9.305 -53.596 1.00 0.00 H new ATOM 0 HA VAL A 83 66.537 6.626 -54.375 1.00 0.00 H new ATOM 0 HB VAL A 83 66.306 9.075 -56.165 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.334 7.473 -57.760 1.00 0.00 H new ATOM 0 HG12 VAL A 83 66.992 7.022 -57.297 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.605 6.155 -56.596 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.877 8.676 -56.167 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.089 7.407 -54.937 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.476 9.099 -54.545 1.00 0.00 H new ATOM 494 N GLU A 84 68.932 6.547 -55.002 1.00 0.00 N ATOM 495 CA GLU A 84 70.335 6.456 -55.389 1.00 0.00 C ATOM 496 C GLU A 84 70.470 6.149 -56.877 1.00 0.00 C ATOM 497 O GLU A 84 71.138 6.874 -57.615 1.00 0.00 O ATOM 498 CB GLU A 84 71.044 5.377 -54.568 1.00 0.00 C ATOM 499 CG GLU A 84 72.513 5.671 -54.316 1.00 0.00 C ATOM 500 CD GLU A 84 73.310 5.802 -55.600 1.00 0.00 C ATOM 501 OE1 GLU A 84 73.166 4.929 -56.480 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.078 6.780 -55.723 1.00 0.00 O ATOM 0 H GLU A 84 68.523 5.667 -54.687 1.00 0.00 H new ATOM 0 HA GLU A 84 70.804 7.420 -55.191 1.00 0.00 H new ATOM 0 HB2 GLU A 84 70.535 5.268 -53.611 1.00 0.00 H new ATOM 0 HB3 GLU A 84 70.957 4.422 -55.086 1.00 0.00 H new ATOM 0 HG2 GLU A 84 72.602 6.593 -53.742 1.00 0.00 H new ATOM 0 HG3 GLU A 84 72.940 4.874 -53.707 1.00 0.00 H new ATOM 509 N LYS A 85 69.832 5.067 -57.313 1.00 0.00 N ATOM 510 CA LYS A 85 69.879 4.662 -58.713 1.00 0.00 C ATOM 511 C LYS A 85 68.676 3.796 -59.069 1.00 0.00 C ATOM 512 O LYS A 85 67.861 3.462 -58.208 1.00 0.00 O ATOM 513 CB LYS A 85 71.174 3.899 -59.001 1.00 0.00 C ATOM 514 CG LYS A 85 71.283 2.582 -58.252 1.00 0.00 C ATOM 515 CD LYS A 85 72.297 1.654 -58.900 1.00 0.00 C ATOM 516 CE LYS A 85 73.722 2.078 -58.583 1.00 0.00 C ATOM 517 NZ LYS A 85 74.173 3.201 -59.451 1.00 0.00 N ATOM 0 H LYS A 85 69.276 4.455 -56.716 1.00 0.00 H new ATOM 0 HA LYS A 85 69.851 5.562 -59.327 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.241 3.705 -60.072 1.00 0.00 H new ATOM 0 HB3 LYS A 85 72.023 4.529 -58.737 1.00 0.00 H new ATOM 0 HG2 LYS A 85 71.572 2.773 -57.218 1.00 0.00 H new ATOM 0 HG3 LYS A 85 70.308 2.096 -58.226 1.00 0.00 H new ATOM 0 HD2 LYS A 85 72.134 0.634 -58.551 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.149 1.649 -59.980 1.00 0.00 H new ATOM 0 HE2 LYS A 85 73.787 2.379 -57.537 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.391 1.227 -58.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 75.152 3.030 -59.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 73.554 3.266 -60.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 74.129 4.092 -58.917 1.00 0.00 H new ATOM 531 N VAL A 86 68.570 3.434 -60.344 1.00 0.00 N ATOM 532 CA VAL A 86 67.467 2.604 -60.814 1.00 0.00 C ATOM 533 C VAL A 86 67.770 1.123 -60.614 1.00 0.00 C ATOM 534 O VAL A 86 68.832 0.637 -61.004 1.00 0.00 O ATOM 535 CB VAL A 86 67.167 2.859 -62.303 1.00 0.00 C ATOM 536 CG1 VAL A 86 65.878 2.165 -62.715 1.00 0.00 C ATOM 537 CG2 VAL A 86 67.092 4.352 -62.582 1.00 0.00 C ATOM 0 H VAL A 86 69.235 3.703 -61.070 1.00 0.00 H new ATOM 0 HA VAL A 86 66.592 2.876 -60.223 1.00 0.00 H new ATOM 0 HB VAL A 86 67.980 2.442 -62.897 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.683 2.357 -63.770 1.00 0.00 H new ATOM 0 HG12 VAL A 86 65.975 1.091 -62.553 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.051 2.549 -62.117 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.879 4.514 -63.639 1.00 0.00 H new ATOM 0 HG22 VAL A 86 66.299 4.795 -61.980 1.00 0.00 H new ATOM 0 HG23 VAL A 86 68.044 4.818 -62.328 1.00 0.00 H new ATOM 547 N LEU A 87 66.830 0.410 -60.004 1.00 0.00 N ATOM 548 CA LEU A 87 66.995 -1.018 -59.752 1.00 0.00 C ATOM 549 C LEU A 87 66.669 -1.832 -61.000 1.00 0.00 C ATOM 550 O LEU A 87 67.245 -2.896 -61.228 1.00 0.00 O ATOM 551 CB LEU A 87 66.098 -1.458 -58.593 1.00 0.00 C ATOM 552 CG LEU A 87 66.666 -2.547 -57.682 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.864 -3.841 -58.457 1.00 0.00 C ATOM 554 CD2 LEU A 87 67.976 -2.091 -57.058 1.00 0.00 C ATOM 0 H LEU A 87 65.946 0.797 -59.675 1.00 0.00 H new ATOM 0 HA LEU A 87 68.037 -1.197 -59.486 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.871 -0.584 -57.983 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.153 -1.813 -59.005 1.00 0.00 H new ATOM 0 HG LEU A 87 65.951 -2.733 -56.881 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.269 -4.605 -57.793 1.00 0.00 H new ATOM 0 HD12 LEU A 87 65.906 -4.177 -58.855 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.559 -3.670 -59.279 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.365 -2.879 -56.413 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.699 -1.876 -57.845 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.804 -1.191 -56.468 1.00 0.00 H new ATOM 566 N LYS A 88 65.743 -1.324 -61.807 1.00 0.00 N ATOM 567 CA LYS A 88 65.343 -2.001 -63.034 1.00 0.00 C ATOM 568 C LYS A 88 64.319 -1.172 -63.804 1.00 0.00 C ATOM 569 O LYS A 88 63.722 -0.243 -63.259 1.00 0.00 O ATOM 570 CB LYS A 88 64.761 -3.380 -62.714 1.00 0.00 C ATOM 571 CG LYS A 88 65.691 -4.529 -63.063 1.00 0.00 C ATOM 572 CD LYS A 88 64.917 -5.754 -63.519 1.00 0.00 C ATOM 573 CE LYS A 88 64.081 -6.337 -62.390 1.00 0.00 C ATOM 574 NZ LYS A 88 63.273 -7.503 -62.843 1.00 0.00 N ATOM 0 H LYS A 88 65.256 -0.445 -61.633 1.00 0.00 H new ATOM 0 HA LYS A 88 66.229 -2.123 -63.657 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.523 -3.427 -61.651 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.824 -3.504 -63.257 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.377 -4.217 -63.851 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.298 -4.784 -62.194 1.00 0.00 H new ATOM 0 HD2 LYS A 88 64.268 -5.486 -64.353 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.612 -6.509 -63.886 1.00 0.00 H new ATOM 0 HE2 LYS A 88 64.736 -6.644 -61.574 1.00 0.00 H new ATOM 0 HE3 LYS A 88 63.418 -5.568 -61.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 62.718 -7.872 -62.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 62.630 -7.205 -63.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 63.907 -8.248 -63.197 1.00 0.00 H new ATOM 588 N HIS A 89 64.121 -1.515 -65.073 1.00 0.00 N ATOM 589 CA HIS A 89 63.167 -0.803 -65.916 1.00 0.00 C ATOM 590 C HIS A 89 62.048 -1.732 -66.375 1.00 0.00 C ATOM 591 O HIS A 89 62.290 -2.890 -66.717 1.00 0.00 O ATOM 592 CB HIS A 89 63.877 -0.203 -67.130 1.00 0.00 C ATOM 593 CG HIS A 89 62.940 0.267 -68.200 1.00 0.00 C ATOM 594 ND1 HIS A 89 63.082 -0.075 -69.528 1.00 0.00 N ATOM 595 CD2 HIS A 89 61.843 1.057 -68.131 1.00 0.00 C ATOM 596 CE1 HIS A 89 62.113 0.485 -70.231 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.347 1.177 -69.406 1.00 0.00 N ATOM 0 H HIS A 89 64.608 -2.280 -65.540 1.00 0.00 H new ATOM 0 HA HIS A 89 62.728 0.001 -65.326 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.492 0.635 -66.803 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.552 -0.948 -67.551 1.00 0.00 H new ATOM 0 HD2 HIS A 89 61.434 1.509 -67.239 1.00 0.00 H new ATOM 0 HE1 HIS A 89 61.971 0.393 -71.298 1.00 0.00 H new ATOM 0 HE2 HIS A 89 60.521 1.713 -69.673 1.00 0.00 H new ATOM 605 N ARG A 90 60.822 -1.218 -66.377 1.00 0.00 N ATOM 606 CA ARG A 90 59.665 -2.003 -66.791 1.00 0.00 C ATOM 607 C ARG A 90 58.542 -1.096 -67.287 1.00 0.00 C ATOM 608 O ARG A 90 58.437 0.059 -66.876 1.00 0.00 O ATOM 609 CB ARG A 90 59.165 -2.864 -65.630 1.00 0.00 C ATOM 610 CG ARG A 90 58.796 -2.063 -64.392 1.00 0.00 C ATOM 611 CD ARG A 90 59.037 -2.861 -63.120 1.00 0.00 C ATOM 612 NE ARG A 90 58.002 -3.867 -62.901 1.00 0.00 N ATOM 613 CZ ARG A 90 58.041 -4.759 -61.917 1.00 0.00 C ATOM 614 NH1 ARG A 90 59.057 -4.769 -61.066 1.00 0.00 N ATOM 615 NH2 ARG A 90 57.061 -5.643 -61.783 1.00 0.00 N ATOM 0 H ARG A 90 60.604 -0.262 -66.097 1.00 0.00 H new ATOM 0 HA ARG A 90 59.972 -2.653 -67.610 1.00 0.00 H new ATOM 0 HB2 ARG A 90 58.294 -3.431 -65.958 1.00 0.00 H new ATOM 0 HB3 ARG A 90 59.936 -3.588 -65.367 1.00 0.00 H new ATOM 0 HG2 ARG A 90 59.382 -1.145 -64.363 1.00 0.00 H new ATOM 0 HG3 ARG A 90 57.747 -1.770 -64.446 1.00 0.00 H new ATOM 0 HD2 ARG A 90 60.010 -3.349 -63.177 1.00 0.00 H new ATOM 0 HD3 ARG A 90 59.070 -2.183 -62.267 1.00 0.00 H new ATOM 0 HE ARG A 90 57.206 -3.886 -63.538 1.00 0.00 H new ATOM 0 HH11 ARG A 90 59.812 -4.091 -61.165 1.00 0.00 H new ATOM 0 HH12 ARG A 90 59.084 -5.455 -60.312 1.00 0.00 H new ATOM 0 HH21 ARG A 90 56.277 -5.638 -62.436 1.00 0.00 H new ATOM 0 HH22 ARG A 90 57.091 -6.328 -61.027 1.00 0.00 H new ATOM 629 N MET A 91 57.706 -1.628 -68.172 1.00 0.00 N ATOM 630 CA MET A 91 56.591 -0.867 -68.723 1.00 0.00 C ATOM 631 C MET A 91 55.290 -1.212 -68.006 1.00 0.00 C ATOM 632 O MET A 91 55.167 -2.278 -67.403 1.00 0.00 O ATOM 633 CB MET A 91 56.449 -1.142 -70.222 1.00 0.00 C ATOM 634 CG MET A 91 55.921 -2.532 -70.537 1.00 0.00 C ATOM 635 SD MET A 91 55.667 -2.794 -72.303 1.00 0.00 S ATOM 636 CE MET A 91 54.453 -1.527 -72.662 1.00 0.00 C ATOM 0 H MET A 91 57.779 -2.583 -68.523 1.00 0.00 H new ATOM 0 HA MET A 91 56.798 0.193 -68.573 1.00 0.00 H new ATOM 0 HB2 MET A 91 55.779 -0.400 -70.657 1.00 0.00 H new ATOM 0 HB3 MET A 91 57.420 -1.014 -70.700 1.00 0.00 H new ATOM 0 HG2 MET A 91 56.622 -3.277 -70.160 1.00 0.00 H new ATOM 0 HG3 MET A 91 54.979 -2.686 -70.011 1.00 0.00 H new ATOM 0 HE1 MET A 91 53.887 -1.807 -73.550 1.00 0.00 H new ATOM 0 HE2 MET A 91 53.773 -1.424 -71.816 1.00 0.00 H new ATOM 0 HE3 MET A 91 54.959 -0.578 -72.838 1.00 0.00 H new ATOM 646 N ALA A 92 54.323 -0.303 -68.075 1.00 0.00 N ATOM 647 CA ALA A 92 53.031 -0.513 -67.433 1.00 0.00 C ATOM 648 C ALA A 92 52.366 -1.788 -67.940 1.00 0.00 C ATOM 649 O ALA A 92 52.098 -1.927 -69.134 1.00 0.00 O ATOM 650 CB ALA A 92 52.124 0.686 -67.668 1.00 0.00 C ATOM 0 H ALA A 92 54.410 0.585 -68.569 1.00 0.00 H new ATOM 0 HA ALA A 92 53.200 -0.624 -66.362 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.163 0.516 -67.183 1.00 0.00 H new ATOM 0 HB2 ALA A 92 52.587 1.580 -67.251 1.00 0.00 H new ATOM 0 HB3 ALA A 92 51.971 0.822 -68.739 1.00 0.00 H new ATOM 716 N GLY A 97 51.436 3.191 -69.919 1.00 0.00 N ATOM 717 CA GLY A 97 52.656 3.958 -70.091 1.00 0.00 C ATOM 718 C GLY A 97 53.896 3.162 -69.736 1.00 0.00 C ATOM 719 O GLY A 97 54.082 2.043 -70.213 1.00 0.00 O ATOM 0 HA2 GLY A 97 52.727 4.294 -71.125 1.00 0.00 H new ATOM 0 HA3 GLY A 97 52.611 4.851 -69.468 1.00 0.00 H new ATOM 723 N TYR A 98 54.748 3.741 -68.897 1.00 0.00 N ATOM 724 CA TYR A 98 55.980 3.081 -68.481 1.00 0.00 C ATOM 725 C TYR A 98 56.320 3.424 -67.034 1.00 0.00 C ATOM 726 O TYR A 98 55.809 4.396 -66.479 1.00 0.00 O ATOM 727 CB TYR A 98 57.135 3.485 -69.398 1.00 0.00 C ATOM 728 CG TYR A 98 57.084 2.830 -70.760 1.00 0.00 C ATOM 729 CD1 TYR A 98 56.340 3.387 -71.793 1.00 0.00 C ATOM 730 CD2 TYR A 98 57.781 1.655 -71.015 1.00 0.00 C ATOM 731 CE1 TYR A 98 56.290 2.792 -73.039 1.00 0.00 C ATOM 732 CE2 TYR A 98 57.738 1.054 -72.258 1.00 0.00 C ATOM 733 CZ TYR A 98 56.991 1.626 -73.266 1.00 0.00 C ATOM 734 OH TYR A 98 56.945 1.030 -74.506 1.00 0.00 O ATOM 0 H TYR A 98 54.608 4.666 -68.492 1.00 0.00 H new ATOM 0 HA TYR A 98 55.827 2.004 -68.554 1.00 0.00 H new ATOM 0 HB2 TYR A 98 57.126 4.568 -69.524 1.00 0.00 H new ATOM 0 HB3 TYR A 98 58.078 3.228 -68.916 1.00 0.00 H new ATOM 0 HD1 TYR A 98 55.791 4.301 -71.619 1.00 0.00 H new ATOM 0 HD2 TYR A 98 58.367 1.204 -70.228 1.00 0.00 H new ATOM 0 HE1 TYR A 98 55.705 3.237 -73.831 1.00 0.00 H new ATOM 0 HE2 TYR A 98 58.286 0.141 -72.439 1.00 0.00 H new ATOM 0 HH TYR A 98 57.494 0.218 -74.499 1.00 0.00 H new ATOM 744 N GLU A 99 57.188 2.619 -66.430 1.00 0.00 N ATOM 745 CA GLU A 99 57.598 2.837 -65.048 1.00 0.00 C ATOM 746 C GLU A 99 59.062 2.457 -64.848 1.00 0.00 C ATOM 747 O GLU A 99 59.734 2.019 -65.781 1.00 0.00 O ATOM 748 CB GLU A 99 56.715 2.026 -64.097 1.00 0.00 C ATOM 749 CG GLU A 99 56.508 0.586 -64.537 1.00 0.00 C ATOM 750 CD GLU A 99 55.868 -0.267 -63.459 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.998 0.085 -62.268 1.00 0.00 O ATOM 752 OE2 GLU A 99 55.238 -1.287 -63.807 1.00 0.00 O ATOM 0 H GLU A 99 57.621 1.810 -66.876 1.00 0.00 H new ATOM 0 HA GLU A 99 57.482 3.898 -64.825 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.164 2.033 -63.104 1.00 0.00 H new ATOM 0 HB3 GLU A 99 55.744 2.514 -64.011 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.881 0.569 -65.429 1.00 0.00 H new ATOM 0 HG3 GLU A 99 57.469 0.153 -64.815 1.00 0.00 H new ATOM 759 N TYR A 100 59.550 2.629 -63.624 1.00 0.00 N ATOM 760 CA TYR A 100 60.935 2.308 -63.301 1.00 0.00 C ATOM 761 C TYR A 100 61.059 1.817 -61.862 1.00 0.00 C ATOM 762 O TYR A 100 60.108 1.894 -61.083 1.00 0.00 O ATOM 763 CB TYR A 100 61.827 3.532 -63.512 1.00 0.00 C ATOM 764 CG TYR A 100 61.801 4.063 -64.928 1.00 0.00 C ATOM 765 CD1 TYR A 100 62.630 3.530 -65.907 1.00 0.00 C ATOM 766 CD2 TYR A 100 60.945 5.098 -65.286 1.00 0.00 C ATOM 767 CE1 TYR A 100 62.610 4.013 -67.201 1.00 0.00 C ATOM 768 CE2 TYR A 100 60.917 5.586 -66.578 1.00 0.00 C ATOM 769 CZ TYR A 100 61.751 5.041 -67.532 1.00 0.00 C ATOM 770 OH TYR A 100 61.727 5.524 -68.820 1.00 0.00 O ATOM 0 H TYR A 100 59.007 2.989 -62.839 1.00 0.00 H new ATOM 0 HA TYR A 100 61.261 1.510 -63.968 1.00 0.00 H new ATOM 0 HB2 TYR A 100 61.512 4.322 -62.831 1.00 0.00 H new ATOM 0 HB3 TYR A 100 62.853 3.274 -63.248 1.00 0.00 H new ATOM 0 HD1 TYR A 100 63.302 2.724 -65.652 1.00 0.00 H new ATOM 0 HD2 TYR A 100 60.291 5.528 -64.542 1.00 0.00 H new ATOM 0 HE1 TYR A 100 63.263 3.589 -67.949 1.00 0.00 H new ATOM 0 HE2 TYR A 100 60.245 6.390 -66.840 1.00 0.00 H new ATOM 0 HH TYR A 100 60.814 5.797 -69.050 1.00 0.00 H new ATOM 780 N LEU A 101 62.238 1.312 -61.515 1.00 0.00 N ATOM 781 CA LEU A 101 62.489 0.808 -60.170 1.00 0.00 C ATOM 782 C LEU A 101 63.451 1.721 -59.417 1.00 0.00 C ATOM 783 O LEU A 101 64.457 2.170 -59.968 1.00 0.00 O ATOM 784 CB LEU A 101 63.058 -0.610 -60.233 1.00 0.00 C ATOM 785 CG LEU A 101 62.448 -1.622 -59.262 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.807 -3.041 -59.674 1.00 0.00 C ATOM 787 CD2 LEU A 101 62.913 -1.344 -57.840 1.00 0.00 C ATOM 0 H LEU A 101 63.035 1.241 -62.147 1.00 0.00 H new ATOM 0 HA LEU A 101 61.540 0.789 -59.633 1.00 0.00 H new ATOM 0 HB2 LEU A 101 62.929 -0.987 -61.248 1.00 0.00 H new ATOM 0 HB3 LEU A 101 64.131 -0.558 -60.046 1.00 0.00 H new ATOM 0 HG LEU A 101 61.363 -1.520 -59.295 1.00 0.00 H new ATOM 0 HD11 LEU A 101 62.364 -3.747 -58.971 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.424 -3.237 -60.675 1.00 0.00 H new ATOM 0 HD13 LEU A 101 63.891 -3.158 -59.671 1.00 0.00 H new ATOM 0 HD21 LEU A 101 62.469 -2.074 -57.163 1.00 0.00 H new ATOM 0 HD22 LEU A 101 63.999 -1.418 -57.791 1.00 0.00 H new ATOM 0 HD23 LEU A 101 62.604 -0.341 -57.546 1.00 0.00 H new ATOM 799 N LEU A 102 63.137 1.991 -58.155 1.00 0.00 N ATOM 800 CA LEU A 102 63.975 2.849 -57.324 1.00 0.00 C ATOM 801 C LEU A 102 64.898 2.018 -56.440 1.00 0.00 C ATOM 802 O LEU A 102 64.518 0.951 -55.957 1.00 0.00 O ATOM 803 CB LEU A 102 63.105 3.761 -56.458 1.00 0.00 C ATOM 804 CG LEU A 102 61.878 4.366 -57.142 1.00 0.00 C ATOM 805 CD1 LEU A 102 60.934 4.965 -56.111 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.299 5.418 -58.158 1.00 0.00 C ATOM 0 H LEU A 102 62.308 1.628 -57.684 1.00 0.00 H new ATOM 0 HA LEU A 102 64.590 3.462 -57.983 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.769 3.193 -55.591 1.00 0.00 H new ATOM 0 HB3 LEU A 102 63.726 4.575 -56.085 1.00 0.00 H new ATOM 0 HG LEU A 102 61.350 3.571 -57.669 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.067 5.391 -56.616 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.607 4.187 -55.422 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.451 5.748 -55.556 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.414 5.838 -58.635 1.00 0.00 H new ATOM 0 HD22 LEU A 102 62.850 6.211 -57.653 1.00 0.00 H new ATOM 0 HD23 LEU A 102 62.936 4.959 -58.914 1.00 0.00 H new ATOM 818 N LYS A 103 66.113 2.514 -56.229 1.00 0.00 N ATOM 819 CA LYS A 103 67.090 1.820 -55.400 1.00 0.00 C ATOM 820 C LYS A 103 67.578 2.717 -54.267 1.00 0.00 C ATOM 821 O LYS A 103 68.067 3.822 -54.505 1.00 0.00 O ATOM 822 CB LYS A 103 68.278 1.362 -56.250 1.00 0.00 C ATOM 823 CG LYS A 103 69.226 0.429 -55.518 1.00 0.00 C ATOM 824 CD LYS A 103 70.365 -0.026 -56.415 1.00 0.00 C ATOM 825 CE LYS A 103 70.978 -1.327 -55.922 1.00 0.00 C ATOM 826 NZ LYS A 103 72.442 -1.388 -56.191 1.00 0.00 N ATOM 0 H LYS A 103 66.444 3.395 -56.622 1.00 0.00 H new ATOM 0 HA LYS A 103 66.604 0.947 -54.965 1.00 0.00 H new ATOM 0 HB2 LYS A 103 67.903 0.859 -57.142 1.00 0.00 H new ATOM 0 HB3 LYS A 103 68.832 2.238 -56.587 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.632 0.935 -54.642 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.676 -0.440 -55.158 1.00 0.00 H new ATOM 0 HD2 LYS A 103 69.997 -0.159 -57.432 1.00 0.00 H new ATOM 0 HD3 LYS A 103 71.132 0.748 -56.452 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.801 -1.429 -54.851 1.00 0.00 H new ATOM 0 HE3 LYS A 103 70.484 -2.168 -56.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 72.822 -2.290 -55.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.610 -1.316 -57.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 72.917 -0.600 -55.706 1.00 0.00 H new ATOM 840 N TRP A 104 67.443 2.235 -53.037 1.00 0.00 N ATOM 841 CA TRP A 104 67.872 2.994 -51.868 1.00 0.00 C ATOM 842 C TRP A 104 69.393 3.009 -51.756 1.00 0.00 C ATOM 843 O TRP A 104 70.052 2.003 -52.012 1.00 0.00 O ATOM 844 CB TRP A 104 67.261 2.401 -50.597 1.00 0.00 C ATOM 845 CG TRP A 104 65.763 2.446 -50.581 1.00 0.00 C ATOM 846 CD1 TRP A 104 64.911 1.379 -50.557 1.00 0.00 C ATOM 847 CD2 TRP A 104 64.941 3.619 -50.590 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.609 1.817 -50.551 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.600 3.187 -50.570 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.207 4.990 -50.612 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.531 4.079 -50.572 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.145 5.875 -50.614 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.820 5.417 -50.593 1.00 0.00 C ATOM 0 H TRP A 104 67.040 1.323 -52.823 1.00 0.00 H new ATOM 0 HA TRP A 104 67.525 4.021 -51.985 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.587 1.366 -50.494 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.643 2.943 -49.732 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.216 0.343 -50.545 1.00 0.00 H new ATOM 0 HE1 TRP A 104 62.783 1.219 -50.535 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.224 5.352 -50.627 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.510 3.728 -50.557 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.339 6.937 -50.632 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.012 6.133 -50.593 1.00 0.00 H new ATOM 864 N GLU A 105 69.942 4.157 -51.372 1.00 0.00 N ATOM 865 CA GLU A 105 71.386 4.302 -51.228 1.00 0.00 C ATOM 866 C GLU A 105 71.877 3.616 -49.956 1.00 0.00 C ATOM 867 O GLU A 105 71.347 3.846 -48.870 1.00 0.00 O ATOM 868 CB GLU A 105 71.773 5.782 -51.205 1.00 0.00 C ATOM 869 CG GLU A 105 73.274 6.019 -51.226 1.00 0.00 C ATOM 870 CD GLU A 105 73.635 7.439 -51.616 1.00 0.00 C ATOM 871 OE1 GLU A 105 72.728 8.190 -52.030 1.00 0.00 O ATOM 872 OE2 GLU A 105 74.826 7.799 -51.507 1.00 0.00 O ATOM 0 H GLU A 105 69.409 4.999 -51.155 1.00 0.00 H new ATOM 0 HA GLU A 105 71.861 3.824 -52.085 1.00 0.00 H new ATOM 0 HB2 GLU A 105 71.323 6.280 -52.064 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.353 6.245 -50.312 1.00 0.00 H new ATOM 0 HG2 GLU A 105 73.686 5.801 -50.241 1.00 0.00 H new ATOM 0 HG3 GLU A 105 73.738 5.325 -51.927 1.00 0.00 H new ATOM 879 N GLY A 106 72.894 2.772 -50.100 1.00 0.00 N ATOM 880 CA GLY A 106 73.439 2.065 -48.956 1.00 0.00 C ATOM 881 C GLY A 106 72.782 0.717 -48.740 1.00 0.00 C ATOM 882 O GLY A 106 73.429 -0.235 -48.302 1.00 0.00 O ATOM 0 H GLY A 106 73.350 2.565 -50.989 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.511 1.925 -49.097 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.312 2.675 -48.062 1.00 0.00 H new ATOM 886 N TYR A 107 71.492 0.634 -49.047 1.00 0.00 N ATOM 887 CA TYR A 107 70.745 -0.607 -48.880 1.00 0.00 C ATOM 888 C TYR A 107 70.505 -1.284 -50.226 1.00 0.00 C ATOM 889 O TYR A 107 69.952 -0.681 -51.146 1.00 0.00 O ATOM 890 CB TYR A 107 69.408 -0.334 -48.188 1.00 0.00 C ATOM 891 CG TYR A 107 69.526 0.562 -46.975 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.915 0.048 -45.744 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.248 1.920 -47.060 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.024 0.862 -44.633 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.355 2.742 -45.955 1.00 0.00 C ATOM 896 CZ TYR A 107 69.743 2.208 -44.743 1.00 0.00 C ATOM 897 OH TYR A 107 69.850 3.023 -43.640 1.00 0.00 O ATOM 0 H TYR A 107 70.942 1.411 -49.413 1.00 0.00 H new ATOM 0 HA TYR A 107 71.338 -1.277 -48.257 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.725 0.125 -48.903 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.964 -1.283 -47.887 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.136 -1.005 -45.654 1.00 0.00 H new ATOM 0 HD2 TYR A 107 68.943 2.341 -48.007 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.328 0.447 -43.683 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.136 3.796 -46.039 1.00 0.00 H new ATOM 0 HH TYR A 107 69.618 3.942 -43.889 1.00 0.00 H new ATOM 907 N ASP A 108 70.923 -2.540 -50.332 1.00 0.00 N ATOM 908 CA ASP A 108 70.753 -3.301 -51.564 1.00 0.00 C ATOM 909 C ASP A 108 69.507 -4.179 -51.493 1.00 0.00 C ATOM 910 O ASP A 108 69.553 -5.298 -50.981 1.00 0.00 O ATOM 911 CB ASP A 108 71.987 -4.165 -51.830 1.00 0.00 C ATOM 912 CG ASP A 108 72.351 -5.035 -50.642 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.830 -4.484 -49.629 1.00 0.00 O ATOM 914 OD2 ASP A 108 72.159 -6.266 -50.726 1.00 0.00 O ATOM 0 H ASP A 108 71.382 -3.053 -49.579 1.00 0.00 H new ATOM 0 HA ASP A 108 70.631 -2.594 -52.385 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.803 -4.798 -52.698 1.00 0.00 H new ATOM 0 HB3 ASP A 108 72.831 -3.521 -52.078 1.00 0.00 H new ATOM 919 N ASP A 109 68.397 -3.664 -52.008 1.00 0.00 N ATOM 920 CA ASP A 109 67.138 -4.401 -52.003 1.00 0.00 C ATOM 921 C ASP A 109 66.997 -5.244 -53.266 1.00 0.00 C ATOM 922 O ASP A 109 67.642 -4.993 -54.285 1.00 0.00 O ATOM 923 CB ASP A 109 65.958 -3.436 -51.884 1.00 0.00 C ATOM 924 CG ASP A 109 65.306 -3.484 -50.517 1.00 0.00 C ATOM 925 OD1 ASP A 109 65.992 -3.172 -49.521 1.00 0.00 O ATOM 926 OD2 ASP A 109 64.109 -3.834 -50.442 1.00 0.00 O ATOM 0 H ASP A 109 68.343 -2.739 -52.434 1.00 0.00 H new ATOM 0 HA ASP A 109 67.139 -5.068 -51.141 1.00 0.00 H new ATOM 0 HB2 ASP A 109 66.301 -2.421 -52.084 1.00 0.00 H new ATOM 0 HB3 ASP A 109 65.217 -3.678 -52.646 1.00 0.00 H new ATOM 931 N PRO A 110 66.134 -6.269 -53.201 1.00 0.00 N ATOM 932 CA PRO A 110 65.889 -7.170 -54.331 1.00 0.00 C ATOM 933 C PRO A 110 65.139 -6.484 -55.467 1.00 0.00 C ATOM 934 O PRO A 110 65.028 -5.259 -55.500 1.00 0.00 O ATOM 935 CB PRO A 110 65.031 -8.281 -53.718 1.00 0.00 C ATOM 936 CG PRO A 110 64.359 -7.642 -52.553 1.00 0.00 C ATOM 937 CD PRO A 110 65.332 -6.627 -52.019 1.00 0.00 C ATOM 0 HA PRO A 110 66.817 -7.526 -54.778 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.303 -8.661 -54.435 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.643 -9.127 -53.407 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.425 -7.167 -52.854 1.00 0.00 H new ATOM 0 HG3 PRO A 110 64.110 -8.382 -51.792 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.820 -5.759 -51.603 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.951 -7.043 -51.224 1.00 0.00 H new ATOM 945 N SER A 111 64.625 -7.282 -56.398 1.00 0.00 N ATOM 946 CA SER A 111 63.888 -6.751 -57.538 1.00 0.00 C ATOM 947 C SER A 111 62.452 -6.414 -57.148 1.00 0.00 C ATOM 948 O SER A 111 61.671 -5.930 -57.968 1.00 0.00 O ATOM 949 CB SER A 111 63.892 -7.758 -58.690 1.00 0.00 C ATOM 950 OG SER A 111 63.943 -9.088 -58.203 1.00 0.00 O ATOM 0 H SER A 111 64.706 -8.299 -56.385 1.00 0.00 H new ATOM 0 HA SER A 111 64.382 -5.836 -57.863 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.997 -7.624 -59.298 1.00 0.00 H new ATOM 0 HB3 SER A 111 64.748 -7.571 -59.338 1.00 0.00 H new ATOM 0 HG SER A 111 63.943 -9.713 -58.958 1.00 0.00 H new ATOM 956 N ASP A 112 62.111 -6.673 -55.891 1.00 0.00 N ATOM 957 CA ASP A 112 60.770 -6.396 -55.389 1.00 0.00 C ATOM 958 C ASP A 112 60.723 -5.048 -54.677 1.00 0.00 C ATOM 959 O ASP A 112 59.783 -4.758 -53.938 1.00 0.00 O ATOM 960 CB ASP A 112 60.319 -7.506 -54.438 1.00 0.00 C ATOM 961 CG ASP A 112 58.811 -7.576 -54.303 1.00 0.00 C ATOM 962 OD1 ASP A 112 58.129 -7.726 -55.339 1.00 0.00 O ATOM 963 OD2 ASP A 112 58.312 -7.482 -53.163 1.00 0.00 O ATOM 0 H ASP A 112 62.745 -7.075 -55.200 1.00 0.00 H new ATOM 0 HA ASP A 112 60.091 -6.360 -56.241 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.693 -8.464 -54.799 1.00 0.00 H new ATOM 0 HB3 ASP A 112 60.761 -7.341 -53.456 1.00 0.00 H new ATOM 968 N ASN A 113 61.744 -4.228 -54.905 1.00 0.00 N ATOM 969 CA ASN A 113 61.820 -2.911 -54.284 1.00 0.00 C ATOM 970 C ASN A 113 60.621 -2.054 -54.679 1.00 0.00 C ATOM 971 O ASN A 113 59.651 -2.549 -55.253 1.00 0.00 O ATOM 972 CB ASN A 113 63.118 -2.208 -54.687 1.00 0.00 C ATOM 973 CG ASN A 113 63.922 -1.747 -53.486 1.00 0.00 C ATOM 974 OD1 ASN A 113 63.509 -1.930 -52.341 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.077 -1.145 -53.744 1.00 0.00 N ATOM 0 H ASN A 113 62.530 -4.453 -55.515 1.00 0.00 H new ATOM 0 HA ASN A 113 61.808 -3.045 -53.202 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.724 -2.886 -55.288 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.883 -1.349 -55.315 1.00 0.00 H new ATOM 0 HD21 ASN A 113 65.662 -0.813 -52.977 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.380 -1.015 -54.709 1.00 0.00 H new ATOM 982 N THR A 114 60.695 -0.763 -54.367 1.00 0.00 N ATOM 983 CA THR A 114 59.617 0.163 -54.688 1.00 0.00 C ATOM 984 C THR A 114 59.681 0.597 -56.148 1.00 0.00 C ATOM 985 O THR A 114 60.750 0.927 -56.661 1.00 0.00 O ATOM 986 CB THR A 114 59.665 1.414 -53.790 1.00 0.00 C ATOM 987 OG1 THR A 114 58.509 2.227 -54.019 1.00 0.00 O ATOM 988 CG2 THR A 114 60.923 2.226 -54.061 1.00 0.00 C ATOM 0 H THR A 114 61.491 -0.336 -53.892 1.00 0.00 H new ATOM 0 HA THR A 114 58.682 -0.367 -54.510 1.00 0.00 H new ATOM 0 HB THR A 114 59.678 1.087 -52.750 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.547 3.019 -53.443 1.00 0.00 H new ATOM 0 HG21 THR A 114 60.935 3.104 -53.416 1.00 0.00 H new ATOM 0 HG22 THR A 114 61.802 1.614 -53.858 1.00 0.00 H new ATOM 0 HG23 THR A 114 60.934 2.542 -55.104 1.00 0.00 H new ATOM 996 N TRP A 115 58.530 0.594 -56.812 1.00 0.00 N ATOM 997 CA TRP A 115 58.456 0.988 -58.214 1.00 0.00 C ATOM 998 C TRP A 115 57.900 2.400 -58.354 1.00 0.00 C ATOM 999 O TRP A 115 56.975 2.787 -57.639 1.00 0.00 O ATOM 1000 CB TRP A 115 57.585 0.004 -58.996 1.00 0.00 C ATOM 1001 CG TRP A 115 57.886 -1.432 -58.686 1.00 0.00 C ATOM 1002 CD1 TRP A 115 59.050 -1.934 -58.179 1.00 0.00 C ATOM 1003 CD2 TRP A 115 57.009 -2.549 -58.866 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.950 -3.297 -58.032 1.00 0.00 N ATOM 1005 CE2 TRP A 115 57.707 -3.698 -58.446 1.00 0.00 C ATOM 1006 CE3 TRP A 115 55.702 -2.691 -59.339 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 57.140 -4.969 -58.486 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 55.141 -3.953 -59.379 1.00 0.00 C ATOM 1009 CH2 TRP A 115 55.859 -5.079 -58.954 1.00 0.00 C ATOM 0 H TRP A 115 57.636 0.323 -56.402 1.00 0.00 H new ATOM 0 HA TRP A 115 59.466 0.973 -58.623 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.536 0.204 -58.776 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.725 0.175 -60.063 1.00 0.00 H new ATOM 0 HD1 TRP A 115 59.921 -1.346 -57.930 1.00 0.00 H new ATOM 0 HE1 TRP A 115 59.682 -3.910 -57.673 1.00 0.00 H new ATOM 0 HE3 TRP A 115 55.140 -1.829 -59.668 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 57.692 -5.838 -58.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 54.132 -4.074 -59.744 1.00 0.00 H new ATOM 0 HH2 TRP A 115 55.392 -6.052 -58.997 1.00 0.00 H new ATOM 1020 N SER A 116 58.468 3.167 -59.279 1.00 0.00 N ATOM 1021 CA SER A 116 58.030 4.539 -59.509 1.00 0.00 C ATOM 1022 C SER A 116 57.509 4.711 -60.933 1.00 0.00 C ATOM 1023 O SER A 116 57.991 4.066 -61.864 1.00 0.00 O ATOM 1024 CB SER A 116 59.181 5.514 -59.254 1.00 0.00 C ATOM 1025 OG SER A 116 58.699 6.833 -59.065 1.00 0.00 O ATOM 0 H SER A 116 59.232 2.862 -59.881 1.00 0.00 H new ATOM 0 HA SER A 116 57.219 4.757 -58.815 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.741 5.198 -58.374 1.00 0.00 H new ATOM 0 HB3 SER A 116 59.873 5.493 -60.096 1.00 0.00 H new ATOM 0 HG SER A 116 59.302 7.319 -58.464 1.00 0.00 H new ATOM 1031 N SER A 117 56.521 5.585 -61.093 1.00 0.00 N ATOM 1032 CA SER A 117 55.931 5.840 -62.402 1.00 0.00 C ATOM 1033 C SER A 117 56.879 6.658 -63.275 1.00 0.00 C ATOM 1034 O SER A 117 57.987 6.993 -62.861 1.00 0.00 O ATOM 1035 CB SER A 117 54.598 6.576 -62.250 1.00 0.00 C ATOM 1036 OG SER A 117 53.552 5.674 -61.930 1.00 0.00 O ATOM 0 H SER A 117 56.112 6.128 -60.333 1.00 0.00 H new ATOM 0 HA SER A 117 55.755 4.880 -62.887 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.683 7.331 -61.469 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.360 7.100 -63.176 1.00 0.00 H new ATOM 0 HG SER A 117 52.711 6.168 -61.836 1.00 0.00 H new ATOM 1042 N GLU A 118 56.432 6.974 -64.487 1.00 0.00 N ATOM 1043 CA GLU A 118 57.240 7.751 -65.419 1.00 0.00 C ATOM 1044 C GLU A 118 57.399 9.189 -64.934 1.00 0.00 C ATOM 1045 O GLU A 118 58.369 9.866 -65.272 1.00 0.00 O ATOM 1046 CB GLU A 118 56.606 7.739 -66.812 1.00 0.00 C ATOM 1047 CG GLU A 118 57.151 6.648 -67.719 1.00 0.00 C ATOM 1048 CD GLU A 118 58.282 7.137 -68.603 1.00 0.00 C ATOM 1049 OE1 GLU A 118 58.783 8.255 -68.361 1.00 0.00 O ATOM 1050 OE2 GLU A 118 58.666 6.401 -69.536 1.00 0.00 O ATOM 0 H GLU A 118 55.516 6.704 -64.845 1.00 0.00 H new ATOM 0 HA GLU A 118 58.227 7.292 -65.473 1.00 0.00 H new ATOM 0 HB2 GLU A 118 55.528 7.611 -66.710 1.00 0.00 H new ATOM 0 HB3 GLU A 118 56.769 8.708 -67.284 1.00 0.00 H new ATOM 0 HG2 GLU A 118 57.505 5.816 -67.109 1.00 0.00 H new ATOM 0 HG3 GLU A 118 56.345 6.264 -68.345 1.00 0.00 H new ATOM 1057 N ALA A 119 56.438 9.649 -64.139 1.00 0.00 N ATOM 1058 CA ALA A 119 56.471 11.005 -63.605 1.00 0.00 C ATOM 1059 C ALA A 119 57.754 11.255 -62.820 1.00 0.00 C ATOM 1060 O ALA A 119 58.208 12.393 -62.699 1.00 0.00 O ATOM 1061 CB ALA A 119 55.254 11.256 -62.727 1.00 0.00 C ATOM 0 H ALA A 119 55.627 9.102 -63.851 1.00 0.00 H new ATOM 0 HA ALA A 119 56.449 11.700 -64.444 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.292 12.272 -62.335 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.347 11.128 -63.317 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.251 10.547 -61.899 1.00 0.00 H new ATOM 1067 N ASP A 120 58.333 10.185 -62.286 1.00 0.00 N ATOM 1068 CA ASP A 120 59.564 10.288 -61.512 1.00 0.00 C ATOM 1069 C ASP A 120 60.778 10.381 -62.432 1.00 0.00 C ATOM 1070 O ASP A 120 61.846 10.838 -62.022 1.00 0.00 O ATOM 1071 CB ASP A 120 59.708 9.085 -60.579 1.00 0.00 C ATOM 1072 CG ASP A 120 61.112 8.946 -60.024 1.00 0.00 C ATOM 1073 OD1 ASP A 120 61.995 8.459 -60.760 1.00 0.00 O ATOM 1074 OD2 ASP A 120 61.327 9.326 -58.854 1.00 0.00 O ATOM 0 H ASP A 120 57.969 9.236 -62.375 1.00 0.00 H new ATOM 0 HA ASP A 120 59.512 11.198 -60.914 1.00 0.00 H new ATOM 0 HB2 ASP A 120 59.003 9.183 -59.754 1.00 0.00 H new ATOM 0 HB3 ASP A 120 59.443 8.176 -61.119 1.00 0.00 H new ATOM 1079 N CYS A 121 60.607 9.945 -63.674 1.00 0.00 N ATOM 1080 CA CYS A 121 61.689 9.977 -64.652 1.00 0.00 C ATOM 1081 C CYS A 121 62.281 11.379 -64.762 1.00 0.00 C ATOM 1082 O CYS A 121 63.487 11.541 -64.949 1.00 0.00 O ATOM 1083 CB CYS A 121 61.183 9.515 -66.019 1.00 0.00 C ATOM 1084 SG CYS A 121 62.447 9.517 -67.313 1.00 0.00 S ATOM 0 H CYS A 121 59.729 9.565 -64.029 1.00 0.00 H new ATOM 0 HA CYS A 121 62.471 9.297 -64.314 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.778 8.508 -65.923 1.00 0.00 H new ATOM 0 HB3 CYS A 121 60.361 10.161 -66.328 1.00 0.00 H new ATOM 0 HG CYS A 121 63.428 10.294 -66.960 1.00 0.00 H new ATOM 1090 N SER A 122 61.424 12.388 -64.646 1.00 0.00 N ATOM 1091 CA SER A 122 61.861 13.776 -64.738 1.00 0.00 C ATOM 1092 C SER A 122 62.725 14.154 -63.539 1.00 0.00 C ATOM 1093 O SER A 122 63.573 15.041 -63.626 1.00 0.00 O ATOM 1094 CB SER A 122 60.651 14.709 -64.823 1.00 0.00 C ATOM 1095 OG SER A 122 60.991 15.928 -65.460 1.00 0.00 O ATOM 0 H SER A 122 60.423 12.270 -64.488 1.00 0.00 H new ATOM 0 HA SER A 122 62.459 13.884 -65.643 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.848 14.219 -65.374 1.00 0.00 H new ATOM 0 HB3 SER A 122 60.273 14.912 -63.821 1.00 0.00 H new ATOM 0 HG SER A 122 60.201 16.506 -65.503 1.00 0.00 H new ATOM 1101 N GLY A 123 62.503 13.473 -62.419 1.00 0.00 N ATOM 1102 CA GLY A 123 63.269 13.751 -61.218 1.00 0.00 C ATOM 1103 C GLY A 123 64.542 12.932 -61.139 1.00 0.00 C ATOM 1104 O GLY A 123 65.594 13.443 -60.756 1.00 0.00 O ATOM 0 H GLY A 123 61.807 12.734 -62.322 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.520 14.811 -61.189 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.653 13.545 -60.342 1.00 0.00 H new ATOM 1108 N CYS A 124 64.446 11.657 -61.500 1.00 0.00 N ATOM 1109 CA CYS A 124 65.599 10.764 -61.466 1.00 0.00 C ATOM 1110 C CYS A 124 66.097 10.466 -62.877 1.00 0.00 C ATOM 1111 O CYS A 124 66.589 9.372 -63.155 1.00 0.00 O ATOM 1112 CB CYS A 124 65.239 9.460 -60.753 1.00 0.00 C ATOM 1113 SG CYS A 124 64.405 9.692 -59.166 1.00 0.00 S ATOM 0 H CYS A 124 63.582 11.219 -61.819 1.00 0.00 H new ATOM 0 HA CYS A 124 66.398 11.262 -60.916 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.598 8.867 -61.405 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.150 8.883 -60.592 1.00 0.00 H new ATOM 0 HG CYS A 124 63.622 8.680 -58.935 1.00 0.00 H new ATOM 1119 N LYS A 125 65.966 11.446 -63.764 1.00 0.00 N ATOM 1120 CA LYS A 125 66.402 11.290 -65.147 1.00 0.00 C ATOM 1121 C LYS A 125 67.829 10.754 -65.210 1.00 0.00 C ATOM 1122 O LYS A 125 68.107 9.787 -65.919 1.00 0.00 O ATOM 1123 CB LYS A 125 66.316 12.628 -65.885 1.00 0.00 C ATOM 1124 CG LYS A 125 65.246 12.660 -66.962 1.00 0.00 C ATOM 1125 CD LYS A 125 65.626 13.596 -68.098 1.00 0.00 C ATOM 1126 CE LYS A 125 64.438 13.888 -69.001 1.00 0.00 C ATOM 1127 NZ LYS A 125 64.751 14.941 -70.006 1.00 0.00 N ATOM 0 H LYS A 125 65.561 12.357 -63.550 1.00 0.00 H new ATOM 0 HA LYS A 125 65.740 10.572 -65.631 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.117 13.420 -65.163 1.00 0.00 H new ATOM 0 HB3 LYS A 125 67.283 12.846 -66.338 1.00 0.00 H new ATOM 0 HG2 LYS A 125 65.093 11.654 -67.354 1.00 0.00 H new ATOM 0 HG3 LYS A 125 64.300 12.980 -66.526 1.00 0.00 H new ATOM 0 HD2 LYS A 125 66.011 14.530 -67.688 1.00 0.00 H new ATOM 0 HD3 LYS A 125 66.429 13.150 -68.685 1.00 0.00 H new ATOM 0 HE2 LYS A 125 64.138 12.974 -69.514 1.00 0.00 H new ATOM 0 HE3 LYS A 125 63.590 14.206 -68.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 63.916 15.111 -70.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 65.012 15.821 -69.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 65.544 14.628 -70.602 1.00 0.00 H new ATOM 1141 N GLN A 126 68.728 11.388 -64.464 1.00 0.00 N ATOM 1142 CA GLN A 126 70.126 10.973 -64.436 1.00 0.00 C ATOM 1143 C GLN A 126 70.245 9.479 -64.155 1.00 0.00 C ATOM 1144 O GLN A 126 71.121 8.803 -64.696 1.00 0.00 O ATOM 1145 CB GLN A 126 70.893 11.766 -63.376 1.00 0.00 C ATOM 1146 CG GLN A 126 70.248 11.725 -62.000 1.00 0.00 C ATOM 1147 CD GLN A 126 71.086 12.416 -60.943 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.709 13.446 -61.202 1.00 0.00 O ATOM 1149 NE2 GLN A 126 71.106 11.852 -59.741 1.00 0.00 N ATOM 0 H GLN A 126 68.514 12.190 -63.871 1.00 0.00 H new ATOM 0 HA GLN A 126 70.559 11.175 -65.416 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.907 11.374 -63.304 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.975 12.804 -63.699 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.268 12.199 -62.048 1.00 0.00 H new ATOM 0 HG3 GLN A 126 70.087 10.687 -61.709 1.00 0.00 H new ATOM 0 HE21 GLN A 126 70.575 10.998 -59.569 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.652 12.273 -58.989 1.00 0.00 H new ATOM 1158 N LEU A 127 69.358 8.969 -63.307 1.00 0.00 N ATOM 1159 CA LEU A 127 69.364 7.553 -62.954 1.00 0.00 C ATOM 1160 C LEU A 127 68.851 6.702 -64.111 1.00 0.00 C ATOM 1161 O LEU A 127 69.466 5.699 -64.476 1.00 0.00 O ATOM 1162 CB LEU A 127 68.506 7.315 -61.711 1.00 0.00 C ATOM 1163 CG LEU A 127 68.842 8.170 -60.489 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.087 7.673 -59.265 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.342 8.166 -60.231 1.00 0.00 C ATOM 0 H LEU A 127 68.626 9.514 -62.851 1.00 0.00 H new ATOM 0 HA LEU A 127 70.392 7.260 -62.740 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.463 7.489 -61.975 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.593 6.265 -61.430 1.00 0.00 H new ATOM 0 HG LEU A 127 68.531 9.195 -60.690 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.339 8.294 -58.405 1.00 0.00 H new ATOM 0 HD12 LEU A 127 67.015 7.729 -59.451 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.366 6.639 -59.060 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.563 8.780 -59.358 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.678 7.145 -60.051 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.862 8.571 -61.099 1.00 0.00 H new ATOM 1177 N ILE A 128 67.724 7.109 -64.685 1.00 0.00 N ATOM 1178 CA ILE A 128 67.131 6.385 -65.802 1.00 0.00 C ATOM 1179 C ILE A 128 68.145 6.177 -66.922 1.00 0.00 C ATOM 1180 O ILE A 128 68.254 5.085 -67.479 1.00 0.00 O ATOM 1181 CB ILE A 128 65.905 7.126 -66.366 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.885 7.389 -65.256 1.00 0.00 C ATOM 1183 CG2 ILE A 128 65.273 6.324 -67.494 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.428 6.134 -64.546 1.00 0.00 C ATOM 0 H ILE A 128 67.203 7.937 -64.395 1.00 0.00 H new ATOM 0 HA ILE A 128 66.814 5.416 -65.417 1.00 0.00 H new ATOM 0 HB ILE A 128 66.232 8.085 -66.768 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.322 8.071 -64.526 1.00 0.00 H new ATOM 0 HG13 ILE A 128 64.017 7.892 -65.683 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.408 6.861 -67.882 1.00 0.00 H new ATOM 0 HG22 ILE A 128 66.001 6.184 -68.293 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.957 5.352 -67.116 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.706 6.396 -63.772 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.962 5.459 -65.264 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.286 5.641 -64.090 1.00 0.00 H new ATOM 1196 N GLU A 129 68.886 7.232 -67.246 1.00 0.00 N ATOM 1197 CA GLU A 129 69.892 7.164 -68.299 1.00 0.00 C ATOM 1198 C GLU A 129 71.137 6.425 -67.816 1.00 0.00 C ATOM 1199 O GLU A 129 71.740 5.652 -68.559 1.00 0.00 O ATOM 1200 CB GLU A 129 70.270 8.572 -68.765 1.00 0.00 C ATOM 1201 CG GLU A 129 70.845 9.444 -67.662 1.00 0.00 C ATOM 1202 CD GLU A 129 70.956 10.901 -68.069 1.00 0.00 C ATOM 1203 OE1 GLU A 129 71.961 11.262 -68.717 1.00 0.00 O ATOM 1204 OE2 GLU A 129 70.038 11.680 -67.738 1.00 0.00 O ATOM 0 H GLU A 129 68.809 8.143 -66.795 1.00 0.00 H new ATOM 0 HA GLU A 129 69.466 6.613 -69.138 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.998 8.495 -69.573 1.00 0.00 H new ATOM 0 HB3 GLU A 129 69.386 9.059 -69.178 1.00 0.00 H new ATOM 0 HG2 GLU A 129 70.215 9.365 -66.776 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.832 9.071 -67.386 1.00 0.00 H new ATOM 1211 N ALA A 130 71.514 6.669 -66.565 1.00 0.00 N ATOM 1212 CA ALA A 130 72.685 6.027 -65.982 1.00 0.00 C ATOM 1213 C ALA A 130 72.549 4.508 -66.011 1.00 0.00 C ATOM 1214 O ALA A 130 73.464 3.801 -66.435 1.00 0.00 O ATOM 1215 CB ALA A 130 72.898 6.512 -64.556 1.00 0.00 C ATOM 0 H ALA A 130 71.025 7.306 -65.936 1.00 0.00 H new ATOM 0 HA ALA A 130 73.554 6.300 -66.580 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.776 6.024 -64.133 1.00 0.00 H new ATOM 0 HB2 ALA A 130 73.048 7.592 -64.557 1.00 0.00 H new ATOM 0 HB3 ALA A 130 72.022 6.268 -63.954 1.00 0.00 H new ATOM 1221 N TYR A 131 71.404 4.013 -65.557 1.00 0.00 N ATOM 1222 CA TYR A 131 71.150 2.577 -65.528 1.00 0.00 C ATOM 1223 C TYR A 131 71.364 1.958 -66.906 1.00 0.00 C ATOM 1224 O TYR A 131 71.839 0.828 -67.024 1.00 0.00 O ATOM 1225 CB TYR A 131 69.724 2.300 -65.048 1.00 0.00 C ATOM 1226 CG TYR A 131 69.350 0.835 -65.077 1.00 0.00 C ATOM 1227 CD1 TYR A 131 70.218 -0.134 -64.588 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.129 0.419 -65.593 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.881 -1.473 -64.613 1.00 0.00 C ATOM 1230 CE2 TYR A 131 67.782 -0.918 -65.620 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.662 -1.860 -65.129 1.00 0.00 C ATOM 1232 OH TYR A 131 68.321 -3.193 -65.156 1.00 0.00 O ATOM 0 H TYR A 131 70.636 4.584 -65.204 1.00 0.00 H new ATOM 0 HA TYR A 131 71.855 2.123 -64.832 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.613 2.675 -64.031 1.00 0.00 H new ATOM 0 HB3 TYR A 131 69.025 2.857 -65.671 1.00 0.00 H new ATOM 0 HD1 TYR A 131 71.173 0.165 -64.181 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.439 1.154 -65.980 1.00 0.00 H new ATOM 0 HE1 TYR A 131 70.568 -2.213 -64.231 1.00 0.00 H new ATOM 0 HE2 TYR A 131 66.828 -1.224 -66.023 1.00 0.00 H new ATOM 0 HH TYR A 131 67.429 -3.295 -65.550 1.00 0.00 H new ATOM 1242 N TRP A 132 71.012 2.706 -67.944 1.00 0.00 N ATOM 1243 CA TRP A 132 71.166 2.232 -69.315 1.00 0.00 C ATOM 1244 C TRP A 132 72.622 2.315 -69.759 1.00 0.00 C ATOM 1245 O TRP A 132 73.108 1.451 -70.488 1.00 0.00 O ATOM 1246 CB TRP A 132 70.284 3.050 -70.261 1.00 0.00 C ATOM 1247 CG TRP A 132 68.826 2.723 -70.145 1.00 0.00 C ATOM 1248 CD1 TRP A 132 68.113 2.553 -68.993 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.904 2.525 -71.222 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.804 2.262 -69.289 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.649 2.240 -70.649 1.00 0.00 C ATOM 1252 CE3 TRP A 132 68.015 2.564 -72.615 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.517 1.993 -71.422 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.891 2.318 -73.380 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.655 2.037 -72.783 1.00 0.00 C ATOM 0 H TRP A 132 70.618 3.643 -67.863 1.00 0.00 H new ATOM 0 HA TRP A 132 70.854 1.188 -69.350 1.00 0.00 H new ATOM 0 HB2 TRP A 132 70.429 4.111 -70.055 1.00 0.00 H new ATOM 0 HB3 TRP A 132 70.607 2.878 -71.288 1.00 0.00 H new ATOM 0 HD1 TRP A 132 68.519 2.635 -67.996 1.00 0.00 H new ATOM 0 HE1 TRP A 132 66.066 2.090 -68.606 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.963 2.783 -73.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.564 1.774 -70.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 66.967 2.343 -74.457 1.00 0.00 H new ATOM 0 HH2 TRP A 132 64.795 1.852 -73.409 1.00 0.00 H new ATOM 1266 N ASN A 133 73.314 3.359 -69.315 1.00 0.00 N ATOM 1267 CA ASN A 133 74.715 3.553 -69.667 1.00 0.00 C ATOM 1268 C ASN A 133 75.544 2.327 -69.298 1.00 0.00 C ATOM 1269 O ASN A 133 76.528 2.007 -69.965 1.00 0.00 O ATOM 1270 CB ASN A 133 75.274 4.791 -68.962 1.00 0.00 C ATOM 1271 CG ASN A 133 76.786 4.865 -69.036 1.00 0.00 C ATOM 1272 OD1 ASN A 133 77.374 4.723 -70.108 1.00 0.00 O ATOM 1273 ND2 ASN A 133 77.424 5.089 -67.893 1.00 0.00 N ATOM 0 H ASN A 133 72.927 4.084 -68.711 1.00 0.00 H new ATOM 0 HA ASN A 133 74.775 3.699 -70.745 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.847 5.687 -69.413 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.964 4.782 -67.917 1.00 0.00 H new ATOM 0 HD21 ASN A 133 78.442 5.149 -67.881 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.896 5.201 -67.028 1.00 0.00 H new ATOM 1280 N GLU A 134 75.138 1.643 -68.233 1.00 0.00 N ATOM 1281 CA GLU A 134 75.844 0.452 -67.776 1.00 0.00 C ATOM 1282 C GLU A 134 75.851 -0.625 -68.857 1.00 0.00 C ATOM 1283 O GLU A 134 76.787 -1.419 -68.951 1.00 0.00 O ATOM 1284 CB GLU A 134 75.196 -0.094 -66.501 1.00 0.00 C ATOM 1285 CG GLU A 134 76.079 -1.068 -65.739 1.00 0.00 C ATOM 1286 CD GLU A 134 75.415 -1.594 -64.481 1.00 0.00 C ATOM 1287 OE1 GLU A 134 74.385 -2.290 -64.601 1.00 0.00 O ATOM 1288 OE2 GLU A 134 75.926 -1.310 -63.377 1.00 0.00 O ATOM 0 H GLU A 134 74.324 1.893 -67.671 1.00 0.00 H new ATOM 0 HA GLU A 134 76.875 0.732 -67.560 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.941 0.740 -65.847 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.262 -0.591 -66.762 1.00 0.00 H new ATOM 0 HG2 GLU A 134 76.335 -1.906 -66.388 1.00 0.00 H new ATOM 0 HG3 GLU A 134 77.014 -0.574 -65.473 1.00 0.00 H new ATOM 1295 N HIS A 135 74.801 -0.645 -69.671 1.00 0.00 N ATOM 1296 CA HIS A 135 74.685 -1.624 -70.747 1.00 0.00 C ATOM 1297 C HIS A 135 75.591 -1.253 -71.917 1.00 0.00 C ATOM 1298 O HIS A 135 76.032 -2.119 -72.672 1.00 0.00 O ATOM 1299 CB HIS A 135 73.235 -1.724 -71.220 1.00 0.00 C ATOM 1300 CG HIS A 135 72.325 -2.377 -70.226 1.00 0.00 C ATOM 1301 ND1 HIS A 135 71.396 -1.678 -69.484 1.00 0.00 N ATOM 1302 CD2 HIS A 135 72.203 -3.673 -69.855 1.00 0.00 C ATOM 1303 CE1 HIS A 135 70.743 -2.516 -68.698 1.00 0.00 C ATOM 1304 NE2 HIS A 135 71.214 -3.733 -68.904 1.00 0.00 N ATOM 0 H HIS A 135 74.018 0.005 -69.607 1.00 0.00 H new ATOM 0 HA HIS A 135 74.999 -2.593 -70.360 1.00 0.00 H new ATOM 0 HB2 HIS A 135 72.863 -0.723 -71.438 1.00 0.00 H new ATOM 0 HB3 HIS A 135 73.204 -2.286 -72.153 1.00 0.00 H new ATOM 0 HD2 HIS A 135 72.777 -4.505 -70.236 1.00 0.00 H new ATOM 0 HE1 HIS A 135 69.958 -2.251 -68.005 1.00 0.00 H new ATOM 0 HE2 HIS A 135 70.895 -4.580 -68.433 1.00 0.00 H new ATOM 1312 N GLY A 136 75.863 0.040 -72.063 1.00 0.00 N ATOM 1313 CA GLY A 136 76.713 0.502 -73.144 1.00 0.00 C ATOM 1314 C GLY A 136 75.932 1.205 -74.237 1.00 0.00 C ATOM 1315 O GLY A 136 76.284 1.122 -75.413 1.00 0.00 O ATOM 0 H GLY A 136 75.510 0.776 -71.452 1.00 0.00 H new ATOM 0 HA2 GLY A 136 77.466 1.182 -72.745 1.00 0.00 H new ATOM 0 HA3 GLY A 136 77.246 -0.347 -73.571 1.00 0.00 H new