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+ -140:sc= -0.241 (180deg=-2.37!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HE2:sc= -0.824 K(o=-0.82,f=-3.8) USER MOD Single : A 91 MET CE :methyl 162:sc= 0 (180deg=-0.462) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -161:sc= 1.22 (180deg=0.949) 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= -2.83 K(o=-2.8,f=-4.6!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -32:sc= 1.15 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 180:sc= -0.347 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot -40:sc= 1.09 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc=-0.00272 X(o=-0.0027,f=-0.0027) USER MOD Single : A 135 HIS : no HD1:sc= -0.0825 X(o=-0.083,f=-0.24) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 67.750 8.933 -50.019 1.00 0.00 N ATOM 463 CA VAL A 82 67.632 9.472 -51.368 1.00 0.00 C ATOM 464 C VAL A 82 67.861 8.388 -52.415 1.00 0.00 C ATOM 465 O VAL A 82 68.661 7.475 -52.214 1.00 0.00 O ATOM 466 CB VAL A 82 68.634 10.618 -51.604 1.00 0.00 C ATOM 467 CG1 VAL A 82 70.060 10.134 -51.390 1.00 0.00 C ATOM 468 CG2 VAL A 82 68.463 11.197 -53.000 1.00 0.00 C ATOM 0 HA VAL A 82 66.618 9.860 -51.466 1.00 0.00 H new ATOM 0 HB VAL A 82 68.432 11.408 -50.881 1.00 0.00 H new ATOM 0 HG11 VAL A 82 70.753 10.957 -51.561 1.00 0.00 H new ATOM 0 HG12 VAL A 82 70.172 9.772 -50.368 1.00 0.00 H new ATOM 0 HG13 VAL A 82 70.278 9.325 -52.087 1.00 0.00 H new ATOM 0 HG21 VAL A 82 69.179 12.005 -53.149 1.00 0.00 H new ATOM 0 HG22 VAL A 82 68.637 10.417 -53.741 1.00 0.00 H new ATOM 0 HG23 VAL A 82 67.450 11.584 -53.112 1.00 0.00 H new ATOM 478 N VAL A 83 67.154 8.497 -53.536 1.00 0.00 N ATOM 479 CA VAL A 83 67.280 7.526 -54.617 1.00 0.00 C ATOM 480 C VAL A 83 68.702 7.500 -55.167 1.00 0.00 C ATOM 481 O VAL A 83 69.185 8.491 -55.713 1.00 0.00 O ATOM 482 CB VAL A 83 66.302 7.835 -55.765 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.288 6.698 -56.775 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.905 8.093 -55.221 1.00 0.00 C ATOM 0 H VAL A 83 66.488 9.248 -53.719 1.00 0.00 H new ATOM 0 HA VAL A 83 67.038 6.550 -54.197 1.00 0.00 H new ATOM 0 HB VAL A 83 66.641 8.737 -56.274 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.591 6.934 -57.579 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.288 6.566 -57.188 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.975 5.777 -56.282 1.00 0.00 H new ATOM 0 HG21 VAL A 83 64.227 8.310 -56.047 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.554 7.211 -54.686 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.931 8.944 -54.540 1.00 0.00 H new ATOM 494 N GLU A 84 69.366 6.358 -55.020 1.00 0.00 N ATOM 495 CA GLU A 84 70.733 6.203 -55.503 1.00 0.00 C ATOM 496 C GLU A 84 70.754 5.958 -57.009 1.00 0.00 C ATOM 497 O GLU A 84 71.471 6.632 -57.750 1.00 0.00 O ATOM 498 CB GLU A 84 71.426 5.047 -54.779 1.00 0.00 C ATOM 499 CG GLU A 84 72.923 4.981 -55.028 1.00 0.00 C ATOM 500 CD GLU A 84 73.529 3.658 -54.602 1.00 0.00 C ATOM 501 OE1 GLU A 84 72.761 2.747 -54.228 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.771 3.534 -54.644 1.00 0.00 O ATOM 0 H GLU A 84 68.980 5.528 -54.571 1.00 0.00 H new ATOM 0 HA GLU A 84 71.271 7.128 -55.295 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.249 5.142 -53.708 1.00 0.00 H new ATOM 0 HB3 GLU A 84 70.972 4.108 -55.095 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.118 5.141 -56.088 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.413 5.791 -54.488 1.00 0.00 H new ATOM 509 N LYS A 85 69.962 4.989 -57.456 1.00 0.00 N ATOM 510 CA LYS A 85 69.887 4.654 -58.873 1.00 0.00 C ATOM 511 C LYS A 85 68.706 3.731 -59.153 1.00 0.00 C ATOM 512 O LYS A 85 68.015 3.294 -58.232 1.00 0.00 O ATOM 513 CB LYS A 85 71.187 3.989 -59.331 1.00 0.00 C ATOM 514 CG LYS A 85 71.409 2.611 -58.732 1.00 0.00 C ATOM 515 CD LYS A 85 72.601 2.597 -57.790 1.00 0.00 C ATOM 516 CE LYS A 85 73.366 1.286 -57.878 1.00 0.00 C ATOM 517 NZ LYS A 85 72.468 0.108 -57.720 1.00 0.00 N ATOM 0 H LYS A 85 69.363 4.422 -56.857 1.00 0.00 H new ATOM 0 HA LYS A 85 69.743 5.579 -59.431 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.180 3.907 -60.418 1.00 0.00 H new ATOM 0 HB3 LYS A 85 72.027 4.631 -59.065 1.00 0.00 H new ATOM 0 HG2 LYS A 85 70.514 2.299 -58.193 1.00 0.00 H new ATOM 0 HG3 LYS A 85 71.568 1.887 -59.531 1.00 0.00 H new ATOM 0 HD2 LYS A 85 73.267 3.425 -58.032 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.259 2.752 -56.767 1.00 0.00 H new ATOM 0 HE2 LYS A 85 73.876 1.227 -58.839 1.00 0.00 H new ATOM 0 HE3 LYS A 85 74.136 1.262 -57.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 72.941 -0.613 -57.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 71.586 0.404 -57.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 72.250 -0.290 -58.656 1.00 0.00 H new ATOM 531 N VAL A 86 68.479 3.436 -60.429 1.00 0.00 N ATOM 532 CA VAL A 86 67.383 2.563 -60.829 1.00 0.00 C ATOM 533 C VAL A 86 67.710 1.102 -60.540 1.00 0.00 C ATOM 534 O VAL A 86 68.859 0.675 -60.666 1.00 0.00 O ATOM 535 CB VAL A 86 67.059 2.718 -62.326 1.00 0.00 C ATOM 536 CG1 VAL A 86 65.933 1.778 -62.730 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.699 4.161 -62.646 1.00 0.00 C ATOM 0 H VAL A 86 69.040 3.789 -61.204 1.00 0.00 H new ATOM 0 HA VAL A 86 66.513 2.860 -60.244 1.00 0.00 H new ATOM 0 HB VAL A 86 67.946 2.452 -62.901 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.718 1.902 -63.791 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.233 0.748 -62.539 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.040 2.010 -62.150 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.473 4.253 -63.708 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.827 4.456 -62.063 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.539 4.809 -62.397 1.00 0.00 H new ATOM 547 N LEU A 87 66.695 0.339 -60.152 1.00 0.00 N ATOM 548 CA LEU A 87 66.874 -1.076 -59.845 1.00 0.00 C ATOM 549 C LEU A 87 66.493 -1.944 -61.039 1.00 0.00 C ATOM 550 O LEU A 87 67.173 -2.921 -61.353 1.00 0.00 O ATOM 551 CB LEU A 87 66.032 -1.465 -58.628 1.00 0.00 C ATOM 552 CG LEU A 87 66.640 -2.517 -57.700 1.00 0.00 C ATOM 553 CD1 LEU A 87 66.814 -3.838 -58.433 1.00 0.00 C ATOM 554 CD2 LEU A 87 67.972 -2.033 -57.145 1.00 0.00 C ATOM 0 H LEU A 87 65.739 0.676 -60.042 1.00 0.00 H new ATOM 0 HA LEU A 87 67.927 -1.243 -59.619 1.00 0.00 H new ATOM 0 HB2 LEU A 87 65.835 -0.565 -58.045 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.069 -1.834 -58.981 1.00 0.00 H new ATOM 0 HG LEU A 87 65.958 -2.675 -56.865 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.248 -4.575 -57.757 1.00 0.00 H new ATOM 0 HD12 LEU A 87 65.843 -4.192 -58.781 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.476 -3.696 -59.287 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.390 -2.794 -56.487 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.662 -1.846 -57.967 1.00 0.00 H new ATOM 0 HD23 LEU A 87 67.819 -1.112 -56.583 1.00 0.00 H new ATOM 566 N LYS A 88 65.402 -1.581 -61.705 1.00 0.00 N ATOM 567 CA LYS A 88 64.931 -2.324 -62.868 1.00 0.00 C ATOM 568 C LYS A 88 63.940 -1.495 -63.679 1.00 0.00 C ATOM 569 O LYS A 88 63.357 -0.536 -63.172 1.00 0.00 O ATOM 570 CB LYS A 88 64.275 -3.636 -62.429 1.00 0.00 C ATOM 571 CG LYS A 88 65.226 -4.820 -62.430 1.00 0.00 C ATOM 572 CD LYS A 88 64.474 -6.138 -62.512 1.00 0.00 C ATOM 573 CE LYS A 88 65.404 -7.289 -62.865 1.00 0.00 C ATOM 574 NZ LYS A 88 65.524 -7.473 -64.338 1.00 0.00 N ATOM 0 H LYS A 88 64.827 -0.776 -61.459 1.00 0.00 H new ATOM 0 HA LYS A 88 65.792 -2.548 -63.498 1.00 0.00 H new ATOM 0 HB2 LYS A 88 63.865 -3.510 -61.427 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.437 -3.853 -63.091 1.00 0.00 H new ATOM 0 HG2 LYS A 88 65.911 -4.737 -63.274 1.00 0.00 H new ATOM 0 HG3 LYS A 88 65.833 -4.802 -61.525 1.00 0.00 H new ATOM 0 HD2 LYS A 88 63.988 -6.341 -61.558 1.00 0.00 H new ATOM 0 HD3 LYS A 88 63.686 -6.063 -63.261 1.00 0.00 H new ATOM 0 HE2 LYS A 88 66.390 -7.102 -62.441 1.00 0.00 H new ATOM 0 HE3 LYS A 88 65.032 -8.208 -62.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 66.166 -8.266 -64.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 64.587 -7.677 -64.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 65.903 -6.605 -64.767 1.00 0.00 H new ATOM 588 N HIS A 89 63.754 -1.870 -64.940 1.00 0.00 N ATOM 589 CA HIS A 89 62.832 -1.162 -65.821 1.00 0.00 C ATOM 590 C HIS A 89 61.699 -2.078 -66.272 1.00 0.00 C ATOM 591 O HIS A 89 61.921 -3.249 -66.583 1.00 0.00 O ATOM 592 CB HIS A 89 63.576 -0.614 -67.039 1.00 0.00 C ATOM 593 CG HIS A 89 62.671 -0.043 -68.087 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.602 0.776 -67.792 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.682 -0.176 -69.434 1.00 0.00 C ATOM 596 CE1 HIS A 89 60.993 1.121 -68.913 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.629 0.557 -69.924 1.00 0.00 N ATOM 0 H HIS A 89 64.230 -2.660 -65.375 1.00 0.00 H new ATOM 0 HA HIS A 89 62.402 -0.330 -65.263 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.272 0.158 -66.712 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.171 -1.413 -67.481 1.00 0.00 H new ATOM 0 HD1 HIS A 89 61.325 1.070 -66.855 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.387 -0.751 -70.015 1.00 0.00 H new ATOM 0 HE1 HIS A 89 60.123 1.756 -68.989 1.00 0.00 H new ATOM 605 N ARG A 90 60.485 -1.539 -66.304 1.00 0.00 N ATOM 606 CA ARG A 90 59.317 -2.309 -66.715 1.00 0.00 C ATOM 607 C ARG A 90 58.266 -1.405 -67.351 1.00 0.00 C ATOM 608 O ARG A 90 58.140 -0.235 -66.991 1.00 0.00 O ATOM 609 CB ARG A 90 58.715 -3.042 -65.515 1.00 0.00 C ATOM 610 CG ARG A 90 59.327 -4.412 -65.269 1.00 0.00 C ATOM 611 CD ARG A 90 58.983 -5.384 -66.386 1.00 0.00 C ATOM 612 NE ARG A 90 59.411 -6.746 -66.078 1.00 0.00 N ATOM 613 CZ ARG A 90 60.656 -7.179 -66.240 1.00 0.00 C ATOM 614 NH1 ARG A 90 61.591 -6.362 -66.705 1.00 0.00 N ATOM 615 NH2 ARG A 90 60.969 -8.433 -65.937 1.00 0.00 N ATOM 0 H ARG A 90 60.284 -0.572 -66.050 1.00 0.00 H new ATOM 0 HA ARG A 90 59.638 -3.041 -67.456 1.00 0.00 H new ATOM 0 HB2 ARG A 90 58.846 -2.429 -64.623 1.00 0.00 H new ATOM 0 HB3 ARG A 90 57.642 -3.155 -65.670 1.00 0.00 H new ATOM 0 HG2 ARG A 90 60.410 -4.319 -65.187 1.00 0.00 H new ATOM 0 HG3 ARG A 90 58.968 -4.807 -64.318 1.00 0.00 H new ATOM 0 HD2 ARG A 90 57.907 -5.372 -66.558 1.00 0.00 H new ATOM 0 HD3 ARG A 90 59.457 -5.056 -67.311 1.00 0.00 H new ATOM 0 HE ARG A 90 58.716 -7.400 -65.719 1.00 0.00 H new ATOM 0 HH11 ARG A 90 61.355 -5.398 -66.939 1.00 0.00 H new ATOM 0 HH12 ARG A 90 62.546 -6.698 -66.828 1.00 0.00 H new ATOM 0 HH21 ARG A 90 60.253 -9.065 -65.579 1.00 0.00 H new ATOM 0 HH22 ARG A 90 61.926 -8.764 -66.062 1.00 0.00 H new ATOM 629 N MET A 91 57.515 -1.955 -68.299 1.00 0.00 N ATOM 630 CA MET A 91 56.474 -1.198 -68.985 1.00 0.00 C ATOM 631 C MET A 91 55.092 -1.578 -68.464 1.00 0.00 C ATOM 632 O MET A 91 54.832 -2.742 -68.158 1.00 0.00 O ATOM 633 CB MET A 91 56.547 -1.441 -70.494 1.00 0.00 C ATOM 634 CG MET A 91 56.607 -2.912 -70.870 1.00 0.00 C ATOM 635 SD MET A 91 55.898 -3.243 -72.495 1.00 0.00 S ATOM 636 CE MET A 91 56.655 -1.942 -73.466 1.00 0.00 C ATOM 0 H MET A 91 57.608 -2.922 -68.610 1.00 0.00 H new ATOM 0 HA MET A 91 56.639 -0.139 -68.786 1.00 0.00 H new ATOM 0 HB2 MET A 91 55.677 -0.988 -70.969 1.00 0.00 H new ATOM 0 HB3 MET A 91 57.427 -0.936 -70.893 1.00 0.00 H new ATOM 0 HG2 MET A 91 57.645 -3.245 -70.856 1.00 0.00 H new ATOM 0 HG3 MET A 91 56.075 -3.497 -70.120 1.00 0.00 H new ATOM 0 HE1 MET A 91 56.582 -2.189 -74.525 1.00 0.00 H new ATOM 0 HE2 MET A 91 56.140 -1.000 -73.277 1.00 0.00 H new ATOM 0 HE3 MET A 91 57.704 -1.844 -73.188 1.00 0.00 H new ATOM 646 N ALA A 92 54.209 -0.590 -68.364 1.00 0.00 N ATOM 647 CA ALA A 92 52.854 -0.822 -67.882 1.00 0.00 C ATOM 648 C ALA A 92 52.160 -1.909 -68.695 1.00 0.00 C ATOM 649 O ALA A 92 52.195 -1.895 -69.925 1.00 0.00 O ATOM 650 CB ALA A 92 52.049 0.469 -67.927 1.00 0.00 C ATOM 0 H ALA A 92 54.408 0.379 -68.611 1.00 0.00 H new ATOM 0 HA ALA A 92 52.916 -1.163 -66.848 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.039 0.281 -67.564 1.00 0.00 H new ATOM 0 HB2 ALA A 92 52.527 1.218 -67.296 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.004 0.834 -68.953 1.00 0.00 H new ATOM 716 N GLY A 97 52.563 3.863 -69.885 1.00 0.00 N ATOM 717 CA GLY A 97 53.864 4.501 -69.963 1.00 0.00 C ATOM 718 C GLY A 97 54.991 3.572 -69.557 1.00 0.00 C ATOM 719 O GLY A 97 55.024 2.410 -69.962 1.00 0.00 O ATOM 0 HA2 GLY A 97 54.034 4.849 -70.982 1.00 0.00 H new ATOM 0 HA3 GLY A 97 53.873 5.381 -69.320 1.00 0.00 H new ATOM 723 N TYR A 98 55.919 4.085 -68.756 1.00 0.00 N ATOM 724 CA TYR A 98 57.055 3.294 -68.298 1.00 0.00 C ATOM 725 C TYR A 98 57.166 3.329 -66.777 1.00 0.00 C ATOM 726 O TYR A 98 56.569 4.181 -66.120 1.00 0.00 O ATOM 727 CB TYR A 98 58.350 3.812 -68.927 1.00 0.00 C ATOM 728 CG TYR A 98 58.516 3.423 -70.379 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.292 2.117 -70.798 1.00 0.00 C ATOM 730 CD2 TYR A 98 58.897 4.360 -71.331 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.444 1.756 -72.123 1.00 0.00 C ATOM 732 CE2 TYR A 98 59.049 4.008 -72.658 1.00 0.00 C ATOM 733 CZ TYR A 98 58.821 2.705 -73.049 1.00 0.00 C ATOM 734 OH TYR A 98 58.973 2.351 -74.370 1.00 0.00 O ATOM 0 H TYR A 98 55.907 5.045 -68.411 1.00 0.00 H new ATOM 0 HA TYR A 98 56.895 2.261 -68.609 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.374 4.899 -68.846 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.198 3.431 -68.358 1.00 0.00 H new ATOM 0 HD1 TYR A 98 57.994 1.372 -70.076 1.00 0.00 H new ATOM 0 HD2 TYR A 98 59.077 5.381 -71.029 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.268 0.736 -72.431 1.00 0.00 H new ATOM 0 HE2 TYR A 98 59.345 4.749 -73.386 1.00 0.00 H new ATOM 0 HH TYR A 98 59.241 3.137 -74.891 1.00 0.00 H new ATOM 744 N GLU A 99 57.936 2.397 -66.225 1.00 0.00 N ATOM 745 CA GLU A 99 58.126 2.320 -64.781 1.00 0.00 C ATOM 746 C GLU A 99 59.558 1.919 -64.441 1.00 0.00 C ATOM 747 O GLU A 99 60.170 1.110 -65.138 1.00 0.00 O ATOM 748 CB GLU A 99 57.145 1.319 -64.168 1.00 0.00 C ATOM 749 CG GLU A 99 55.692 1.602 -64.510 1.00 0.00 C ATOM 750 CD GLU A 99 54.725 0.903 -63.575 1.00 0.00 C ATOM 751 OE1 GLU A 99 54.885 1.043 -62.344 1.00 0.00 O ATOM 752 OE2 GLU A 99 53.809 0.215 -64.073 1.00 0.00 O ATOM 0 H GLU A 99 58.438 1.685 -66.755 1.00 0.00 H new ATOM 0 HA GLU A 99 57.935 3.308 -64.362 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.401 0.316 -64.510 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.262 1.326 -63.084 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.516 2.677 -64.471 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.495 1.284 -65.534 1.00 0.00 H new ATOM 759 N TYR A 100 60.087 2.492 -63.365 1.00 0.00 N ATOM 760 CA TYR A 100 61.448 2.197 -62.933 1.00 0.00 C ATOM 761 C TYR A 100 61.519 2.053 -61.416 1.00 0.00 C ATOM 762 O TYR A 100 60.906 2.826 -60.678 1.00 0.00 O ATOM 763 CB TYR A 100 62.402 3.298 -63.398 1.00 0.00 C ATOM 764 CG TYR A 100 62.155 3.754 -64.818 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.205 4.728 -65.101 1.00 0.00 C ATOM 766 CD2 TYR A 100 62.873 3.212 -65.877 1.00 0.00 C ATOM 767 CE1 TYR A 100 60.976 5.147 -66.397 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.651 3.626 -67.176 1.00 0.00 C ATOM 769 CZ TYR A 100 61.701 4.593 -67.431 1.00 0.00 C ATOM 770 OH TYR A 100 61.477 5.009 -68.724 1.00 0.00 O ATOM 0 H TYR A 100 59.594 3.163 -62.776 1.00 0.00 H new ATOM 0 HA TYR A 100 61.749 1.251 -63.383 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.309 4.154 -62.729 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.427 2.938 -63.314 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.636 5.165 -64.294 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.617 2.454 -65.681 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.233 5.904 -66.600 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.218 3.195 -67.988 1.00 0.00 H new ATOM 0 HH TYR A 100 62.070 4.521 -69.332 1.00 0.00 H new ATOM 780 N LEU A 101 62.272 1.060 -60.957 1.00 0.00 N ATOM 781 CA LEU A 101 62.425 0.813 -59.528 1.00 0.00 C ATOM 782 C LEU A 101 63.475 1.741 -58.925 1.00 0.00 C ATOM 783 O LEU A 101 64.494 2.034 -59.552 1.00 0.00 O ATOM 784 CB LEU A 101 62.815 -0.645 -59.281 1.00 0.00 C ATOM 785 CG LEU A 101 61.668 -1.599 -58.943 1.00 0.00 C ATOM 786 CD1 LEU A 101 61.907 -2.964 -59.569 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.504 -1.723 -57.435 1.00 0.00 C ATOM 0 H LEU A 101 62.786 0.412 -61.554 1.00 0.00 H new ATOM 0 HA LEU A 101 61.469 1.013 -59.045 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.323 -1.020 -60.170 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.537 -0.674 -58.465 1.00 0.00 H new ATOM 0 HG LEU A 101 60.746 -1.189 -59.356 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.081 -3.629 -59.318 1.00 0.00 H new ATOM 0 HD12 LEU A 101 61.973 -2.861 -60.652 1.00 0.00 H new ATOM 0 HD13 LEU A 101 62.838 -3.382 -59.187 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.684 -2.405 -57.213 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.425 -2.109 -56.999 1.00 0.00 H new ATOM 0 HD23 LEU A 101 61.285 -0.743 -57.011 1.00 0.00 H new ATOM 799 N LEU A 102 63.221 2.199 -57.704 1.00 0.00 N ATOM 800 CA LEU A 102 64.146 3.092 -57.014 1.00 0.00 C ATOM 801 C LEU A 102 65.053 2.312 -56.067 1.00 0.00 C ATOM 802 O LEU A 102 64.612 1.377 -55.398 1.00 0.00 O ATOM 803 CB LEU A 102 63.371 4.157 -56.235 1.00 0.00 C ATOM 804 CG LEU A 102 62.187 4.793 -56.964 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.277 5.509 -55.979 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.675 5.754 -58.038 1.00 0.00 C ATOM 0 H LEU A 102 62.383 1.967 -57.171 1.00 0.00 H new ATOM 0 HA LEU A 102 64.769 3.580 -57.764 1.00 0.00 H new ATOM 0 HB2 LEU A 102 63.005 3.708 -55.312 1.00 0.00 H new ATOM 0 HB3 LEU A 102 64.065 4.948 -55.952 1.00 0.00 H new ATOM 0 HG LEU A 102 61.614 4.001 -57.447 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.440 5.956 -56.516 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.899 4.795 -55.247 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.838 6.291 -55.467 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.819 6.197 -58.546 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.271 6.542 -57.578 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.285 5.212 -58.761 1.00 0.00 H new ATOM 818 N LYS A 103 66.321 2.704 -56.015 1.00 0.00 N ATOM 819 CA LYS A 103 67.290 2.045 -55.148 1.00 0.00 C ATOM 820 C LYS A 103 67.758 2.984 -54.041 1.00 0.00 C ATOM 821 O LYS A 103 67.846 4.196 -54.239 1.00 0.00 O ATOM 822 CB LYS A 103 68.492 1.564 -55.964 1.00 0.00 C ATOM 823 CG LYS A 103 69.176 0.341 -55.379 1.00 0.00 C ATOM 824 CD LYS A 103 70.292 0.729 -54.424 1.00 0.00 C ATOM 825 CE LYS A 103 71.363 -0.348 -54.352 1.00 0.00 C ATOM 826 NZ LYS A 103 72.497 0.056 -53.475 1.00 0.00 N ATOM 0 H LYS A 103 66.702 3.475 -56.563 1.00 0.00 H new ATOM 0 HA LYS A 103 66.802 1.185 -54.689 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.164 1.336 -56.978 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.217 2.374 -56.039 1.00 0.00 H new ATOM 0 HG2 LYS A 103 68.443 -0.271 -54.853 1.00 0.00 H new ATOM 0 HG3 LYS A 103 69.582 -0.270 -56.185 1.00 0.00 H new ATOM 0 HD2 LYS A 103 70.740 1.668 -54.749 1.00 0.00 H new ATOM 0 HD3 LYS A 103 69.879 0.900 -53.430 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.924 -1.272 -53.976 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.736 -0.557 -55.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 73.330 -0.528 -53.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.723 1.058 -53.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 72.231 -0.079 -52.479 1.00 0.00 H new ATOM 840 N TRP A 104 68.057 2.418 -52.877 1.00 0.00 N ATOM 841 CA TRP A 104 68.517 3.206 -51.740 1.00 0.00 C ATOM 842 C TRP A 104 70.031 3.114 -51.590 1.00 0.00 C ATOM 843 O TRP A 104 70.595 2.021 -51.561 1.00 0.00 O ATOM 844 CB TRP A 104 67.836 2.731 -50.455 1.00 0.00 C ATOM 845 CG TRP A 104 66.339 2.753 -50.533 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.508 1.676 -50.650 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.497 3.911 -50.501 1.00 0.00 C ATOM 848 NE1 TRP A 104 64.200 2.094 -50.693 1.00 0.00 N ATOM 849 CE2 TRP A 104 64.166 3.460 -50.602 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.737 5.283 -50.395 1.00 0.00 C ATOM 851 CZ2 TRP A 104 63.082 4.334 -50.602 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.660 6.150 -50.394 1.00 0.00 C ATOM 853 CH2 TRP A 104 63.346 5.673 -50.496 1.00 0.00 C ATOM 0 H TRP A 104 67.989 1.416 -52.696 1.00 0.00 H new ATOM 0 HA TRP A 104 68.251 4.247 -51.921 1.00 0.00 H new ATOM 0 HB2 TRP A 104 68.166 1.717 -50.231 1.00 0.00 H new ATOM 0 HB3 TRP A 104 68.159 3.362 -49.627 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.831 0.647 -50.701 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.386 1.485 -50.779 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.746 5.660 -50.315 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 62.069 3.968 -50.683 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.834 7.213 -50.313 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.526 6.376 -50.491 1.00 0.00 H new ATOM 864 N GLU A 105 70.683 4.269 -51.496 1.00 0.00 N ATOM 865 CA GLU A 105 72.134 4.317 -51.351 1.00 0.00 C ATOM 866 C GLU A 105 72.571 3.657 -50.046 1.00 0.00 C ATOM 867 O GLU A 105 72.124 4.038 -48.965 1.00 0.00 O ATOM 868 CB GLU A 105 72.625 5.765 -51.393 1.00 0.00 C ATOM 869 CG GLU A 105 74.109 5.895 -51.691 1.00 0.00 C ATOM 870 CD GLU A 105 74.971 5.715 -50.456 1.00 0.00 C ATOM 871 OE1 GLU A 105 74.440 5.871 -49.336 1.00 0.00 O ATOM 872 OE2 GLU A 105 76.174 5.419 -50.610 1.00 0.00 O ATOM 0 H GLU A 105 70.230 5.183 -51.518 1.00 0.00 H new ATOM 0 HA GLU A 105 72.576 3.768 -52.182 1.00 0.00 H new ATOM 0 HB2 GLU A 105 72.062 6.309 -52.151 1.00 0.00 H new ATOM 0 HB3 GLU A 105 72.412 6.240 -50.435 1.00 0.00 H new ATOM 0 HG2 GLU A 105 74.392 5.153 -52.438 1.00 0.00 H new ATOM 0 HG3 GLU A 105 74.304 6.875 -52.126 1.00 0.00 H new ATOM 879 N GLY A 106 73.449 2.665 -50.157 1.00 0.00 N ATOM 880 CA GLY A 106 73.933 1.967 -48.979 1.00 0.00 C ATOM 881 C GLY A 106 73.113 0.733 -48.659 1.00 0.00 C ATOM 882 O GLY A 106 73.640 -0.256 -48.150 1.00 0.00 O ATOM 0 H GLY A 106 73.834 2.332 -51.041 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.973 1.679 -49.133 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.913 2.644 -48.125 1.00 0.00 H new ATOM 886 N TYR A 107 71.820 0.790 -48.957 1.00 0.00 N ATOM 887 CA TYR A 107 70.925 -0.330 -48.694 1.00 0.00 C ATOM 888 C TYR A 107 70.606 -1.086 -49.980 1.00 0.00 C ATOM 889 O TYR A 107 70.139 -0.502 -50.958 1.00 0.00 O ATOM 890 CB TYR A 107 69.630 0.165 -48.047 1.00 0.00 C ATOM 891 CG TYR A 107 69.854 1.147 -46.919 1.00 0.00 C ATOM 892 CD1 TYR A 107 70.137 0.704 -45.633 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.782 2.517 -47.139 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.341 1.597 -44.599 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.987 3.417 -46.112 1.00 0.00 C ATOM 896 CZ TYR A 107 70.266 2.953 -44.843 1.00 0.00 C ATOM 897 OH TYR A 107 70.469 3.846 -43.817 1.00 0.00 O ATOM 0 H TYR A 107 71.368 1.600 -49.381 1.00 0.00 H new ATOM 0 HA TYR A 107 71.429 -1.011 -48.008 1.00 0.00 H new ATOM 0 HB2 TYR A 107 69.009 0.636 -48.810 1.00 0.00 H new ATOM 0 HB3 TYR A 107 69.073 -0.691 -47.667 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.199 -0.357 -45.438 1.00 0.00 H new ATOM 0 HD2 TYR A 107 69.562 2.884 -48.130 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.558 1.236 -43.605 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.929 4.479 -46.301 1.00 0.00 H new ATOM 0 HH TYR A 107 70.382 4.761 -44.158 1.00 0.00 H new ATOM 907 N ASP A 108 70.863 -2.390 -49.971 1.00 0.00 N ATOM 908 CA ASP A 108 70.603 -3.229 -51.135 1.00 0.00 C ATOM 909 C ASP A 108 69.353 -4.077 -50.925 1.00 0.00 C ATOM 910 O ASP A 108 69.409 -5.142 -50.309 1.00 0.00 O ATOM 911 CB ASP A 108 71.805 -4.131 -51.419 1.00 0.00 C ATOM 912 CG ASP A 108 73.119 -3.375 -51.378 1.00 0.00 C ATOM 913 OD1 ASP A 108 73.476 -2.750 -52.398 1.00 0.00 O ATOM 914 OD2 ASP A 108 73.791 -3.409 -50.325 1.00 0.00 O ATOM 0 H ASP A 108 71.251 -2.889 -49.170 1.00 0.00 H new ATOM 0 HA ASP A 108 70.438 -2.577 -51.993 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.831 -4.938 -50.687 1.00 0.00 H new ATOM 0 HB3 ASP A 108 71.685 -4.593 -52.399 1.00 0.00 H new ATOM 919 N ASP A 109 68.226 -3.598 -51.441 1.00 0.00 N ATOM 920 CA ASP A 109 66.961 -4.313 -51.310 1.00 0.00 C ATOM 921 C ASP A 109 66.775 -5.302 -52.456 1.00 0.00 C ATOM 922 O ASP A 109 67.389 -5.183 -53.517 1.00 0.00 O ATOM 923 CB ASP A 109 65.794 -3.325 -51.276 1.00 0.00 C ATOM 924 CG ASP A 109 65.306 -3.053 -49.867 1.00 0.00 C ATOM 925 OD1 ASP A 109 66.136 -2.671 -49.016 1.00 0.00 O ATOM 926 OD2 ASP A 109 64.095 -3.223 -49.615 1.00 0.00 O ATOM 0 H ASP A 109 68.162 -2.718 -51.953 1.00 0.00 H new ATOM 0 HA ASP A 109 66.982 -4.871 -50.374 1.00 0.00 H new ATOM 0 HB2 ASP A 109 66.102 -2.387 -51.738 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.971 -3.719 -51.873 1.00 0.00 H new ATOM 931 N PRO A 110 65.908 -6.302 -52.240 1.00 0.00 N ATOM 932 CA PRO A 110 65.620 -7.331 -53.244 1.00 0.00 C ATOM 933 C PRO A 110 64.840 -6.780 -54.432 1.00 0.00 C ATOM 934 O PRO A 110 64.749 -5.567 -54.619 1.00 0.00 O ATOM 935 CB PRO A 110 64.776 -8.350 -52.475 1.00 0.00 C ATOM 936 CG PRO A 110 64.145 -7.567 -51.376 1.00 0.00 C ATOM 937 CD PRO A 110 65.141 -6.505 -51.000 1.00 0.00 C ATOM 0 HA PRO A 110 66.531 -7.749 -53.673 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.024 -8.807 -53.118 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.392 -9.158 -52.082 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.205 -7.122 -51.703 1.00 0.00 H new ATOM 0 HG3 PRO A 110 63.915 -8.206 -50.523 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.648 -5.588 -50.678 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.782 -6.828 -50.179 1.00 0.00 H new ATOM 945 N SER A 111 64.277 -7.679 -55.233 1.00 0.00 N ATOM 946 CA SER A 111 63.507 -7.283 -56.406 1.00 0.00 C ATOM 947 C SER A 111 62.138 -6.744 -56.000 1.00 0.00 C ATOM 948 O SER A 111 61.361 -6.295 -56.842 1.00 0.00 O ATOM 949 CB SER A 111 63.338 -8.469 -57.357 1.00 0.00 C ATOM 950 OG SER A 111 64.555 -8.769 -58.018 1.00 0.00 O ATOM 0 H SER A 111 64.340 -8.687 -55.091 1.00 0.00 H new ATOM 0 HA SER A 111 64.054 -6.491 -56.918 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.999 -9.342 -56.799 1.00 0.00 H new ATOM 0 HB3 SER A 111 62.567 -8.242 -58.093 1.00 0.00 H new ATOM 0 HG SER A 111 64.422 -9.532 -58.619 1.00 0.00 H new ATOM 956 N ASP A 112 61.851 -6.792 -54.704 1.00 0.00 N ATOM 957 CA ASP A 112 60.578 -6.308 -54.184 1.00 0.00 C ATOM 958 C ASP A 112 60.665 -4.829 -53.823 1.00 0.00 C ATOM 959 O ASP A 112 59.814 -4.303 -53.107 1.00 0.00 O ATOM 960 CB ASP A 112 60.161 -7.121 -52.957 1.00 0.00 C ATOM 961 CG ASP A 112 58.659 -7.130 -52.751 1.00 0.00 C ATOM 962 OD1 ASP A 112 57.930 -6.743 -53.688 1.00 0.00 O ATOM 963 OD2 ASP A 112 58.213 -7.522 -51.652 1.00 0.00 O ATOM 0 H ASP A 112 62.483 -7.161 -53.994 1.00 0.00 H new ATOM 0 HA ASP A 112 59.826 -6.430 -54.964 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.516 -8.146 -53.066 1.00 0.00 H new ATOM 0 HB3 ASP A 112 60.644 -6.709 -52.071 1.00 0.00 H new ATOM 968 N ASN A 113 61.701 -4.163 -54.323 1.00 0.00 N ATOM 969 CA ASN A 113 61.901 -2.744 -54.052 1.00 0.00 C ATOM 970 C ASN A 113 60.675 -1.934 -54.464 1.00 0.00 C ATOM 971 O ASN A 113 59.671 -2.489 -54.911 1.00 0.00 O ATOM 972 CB ASN A 113 63.138 -2.231 -54.792 1.00 0.00 C ATOM 973 CG ASN A 113 64.342 -2.096 -53.881 1.00 0.00 C ATOM 974 OD1 ASN A 113 64.283 -1.425 -52.851 1.00 0.00 O ATOM 975 ND2 ASN A 113 65.443 -2.736 -54.258 1.00 0.00 N ATOM 0 H ASN A 113 62.415 -4.583 -54.918 1.00 0.00 H new ATOM 0 HA ASN A 113 62.052 -2.622 -52.979 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.378 -2.912 -55.608 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.914 -1.263 -55.240 1.00 0.00 H new ATOM 0 HD21 ASN A 113 66.285 -2.683 -53.685 1.00 0.00 H new ATOM 0 HD22 ASN A 113 65.446 -3.281 -55.120 1.00 0.00 H new ATOM 982 N THR A 114 60.765 -0.616 -54.310 1.00 0.00 N ATOM 983 CA THR A 114 59.664 0.271 -54.665 1.00 0.00 C ATOM 984 C THR A 114 59.683 0.602 -56.153 1.00 0.00 C ATOM 985 O THR A 114 60.722 0.963 -56.706 1.00 0.00 O ATOM 986 CB THR A 114 59.718 1.583 -53.859 1.00 0.00 C ATOM 987 OG1 THR A 114 58.567 2.384 -54.151 1.00 0.00 O ATOM 988 CG2 THR A 114 60.982 2.365 -54.181 1.00 0.00 C ATOM 0 H THR A 114 61.589 -0.140 -53.942 1.00 0.00 H new ATOM 0 HA THR A 114 58.742 -0.258 -54.424 1.00 0.00 H new ATOM 0 HB THR A 114 59.726 1.332 -52.798 1.00 0.00 H new ATOM 0 HG1 THR A 114 58.607 3.215 -53.634 1.00 0.00 H new ATOM 0 HG21 THR A 114 60.997 3.287 -53.600 1.00 0.00 H new ATOM 0 HG22 THR A 114 61.856 1.763 -53.930 1.00 0.00 H new ATOM 0 HG23 THR A 114 61.000 2.606 -55.244 1.00 0.00 H new ATOM 996 N TRP A 115 58.527 0.476 -56.796 1.00 0.00 N ATOM 997 CA TRP A 115 58.411 0.762 -58.222 1.00 0.00 C ATOM 998 C TRP A 115 57.875 2.171 -58.452 1.00 0.00 C ATOM 999 O TRP A 115 56.779 2.508 -58.005 1.00 0.00 O ATOM 1000 CB TRP A 115 57.496 -0.262 -58.896 1.00 0.00 C ATOM 1001 CG TRP A 115 57.969 -1.675 -58.737 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.995 -2.406 -57.584 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.484 -2.527 -59.766 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.496 -3.661 -57.834 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.802 -3.761 -59.165 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.706 -2.369 -61.137 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.331 -4.826 -59.889 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 59.231 -3.427 -61.853 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.538 -4.643 -61.229 1.00 0.00 C ATOM 0 H TRP A 115 57.658 0.178 -56.353 1.00 0.00 H new ATOM 0 HA TRP A 115 59.406 0.695 -58.663 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.493 -0.173 -58.479 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.421 -0.029 -59.958 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.670 -2.050 -56.618 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.620 -4.399 -57.140 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.471 -1.436 -61.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.570 -5.764 -59.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.408 -3.315 -62.912 1.00 0.00 H new ATOM 0 HH2 TRP A 115 59.946 -5.452 -61.817 1.00 0.00 H new ATOM 1020 N SER A 116 58.654 2.989 -59.153 1.00 0.00 N ATOM 1021 CA SER A 116 58.258 4.362 -59.439 1.00 0.00 C ATOM 1022 C SER A 116 57.725 4.489 -60.863 1.00 0.00 C ATOM 1023 O SER A 116 58.340 4.006 -61.813 1.00 0.00 O ATOM 1024 CB SER A 116 59.443 5.309 -59.240 1.00 0.00 C ATOM 1025 OG SER A 116 60.277 5.330 -60.386 1.00 0.00 O ATOM 0 H SER A 116 59.563 2.724 -59.533 1.00 0.00 H new ATOM 0 HA SER A 116 57.462 4.636 -58.746 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.078 6.315 -59.034 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.021 4.995 -58.371 1.00 0.00 H new ATOM 0 HG SER A 116 60.255 4.453 -60.823 1.00 0.00 H new ATOM 1031 N SER A 117 56.576 5.142 -61.002 1.00 0.00 N ATOM 1032 CA SER A 117 55.956 5.329 -62.309 1.00 0.00 C ATOM 1033 C SER A 117 56.796 6.258 -63.180 1.00 0.00 C ATOM 1034 O SER A 117 57.854 6.728 -62.764 1.00 0.00 O ATOM 1035 CB SER A 117 54.544 5.897 -62.151 1.00 0.00 C ATOM 1036 OG SER A 117 54.553 7.072 -61.358 1.00 0.00 O ATOM 0 H SER A 117 56.055 5.551 -60.226 1.00 0.00 H new ATOM 0 HA SER A 117 55.896 4.357 -62.798 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.126 6.120 -63.133 1.00 0.00 H new ATOM 0 HB3 SER A 117 53.897 5.149 -61.692 1.00 0.00 H new ATOM 0 HG SER A 117 53.639 7.417 -61.273 1.00 0.00 H new ATOM 1042 N GLU A 118 56.315 6.518 -64.392 1.00 0.00 N ATOM 1043 CA GLU A 118 57.022 7.390 -65.323 1.00 0.00 C ATOM 1044 C GLU A 118 57.173 8.794 -64.745 1.00 0.00 C ATOM 1045 O GLU A 118 58.121 9.510 -65.065 1.00 0.00 O ATOM 1046 CB GLU A 118 56.281 7.453 -66.660 1.00 0.00 C ATOM 1047 CG GLU A 118 56.886 8.439 -67.645 1.00 0.00 C ATOM 1048 CD GLU A 118 56.056 8.588 -68.906 1.00 0.00 C ATOM 1049 OE1 GLU A 118 54.840 8.311 -68.852 1.00 0.00 O ATOM 1050 OE2 GLU A 118 56.625 8.981 -69.946 1.00 0.00 O ATOM 0 H GLU A 118 55.440 6.138 -64.752 1.00 0.00 H new ATOM 0 HA GLU A 118 58.016 6.975 -65.487 1.00 0.00 H new ATOM 0 HB2 GLU A 118 56.275 6.460 -67.110 1.00 0.00 H new ATOM 0 HB3 GLU A 118 55.242 7.726 -66.477 1.00 0.00 H new ATOM 0 HG2 GLU A 118 56.987 9.412 -67.164 1.00 0.00 H new ATOM 0 HG3 GLU A 118 57.890 8.110 -67.912 1.00 0.00 H new ATOM 1057 N ALA A 119 56.229 9.181 -63.892 1.00 0.00 N ATOM 1058 CA ALA A 119 56.257 10.498 -63.268 1.00 0.00 C ATOM 1059 C ALA A 119 57.558 10.716 -62.504 1.00 0.00 C ATOM 1060 O ALA A 119 57.981 11.852 -62.290 1.00 0.00 O ATOM 1061 CB ALA A 119 55.063 10.668 -62.341 1.00 0.00 C ATOM 0 H ALA A 119 55.436 8.601 -63.618 1.00 0.00 H new ATOM 0 HA ALA A 119 56.200 11.248 -64.057 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.097 11.656 -61.882 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.141 10.565 -62.913 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.095 9.905 -61.563 1.00 0.00 H new ATOM 1067 N ASP A 120 58.189 9.621 -62.094 1.00 0.00 N ATOM 1068 CA ASP A 120 59.443 9.693 -61.354 1.00 0.00 C ATOM 1069 C ASP A 120 60.617 9.942 -62.295 1.00 0.00 C ATOM 1070 O ASP A 120 61.670 10.423 -61.876 1.00 0.00 O ATOM 1071 CB ASP A 120 59.670 8.401 -60.567 1.00 0.00 C ATOM 1072 CG ASP A 120 60.320 8.650 -59.220 1.00 0.00 C ATOM 1073 OD1 ASP A 120 61.546 8.884 -59.188 1.00 0.00 O ATOM 1074 OD2 ASP A 120 59.603 8.610 -58.198 1.00 0.00 O ATOM 0 H ASP A 120 57.852 8.673 -62.262 1.00 0.00 H new ATOM 0 HA ASP A 120 59.377 10.528 -60.657 1.00 0.00 H new ATOM 0 HB2 ASP A 120 58.715 7.897 -60.419 1.00 0.00 H new ATOM 0 HB3 ASP A 120 60.298 7.729 -61.151 1.00 0.00 H new ATOM 1079 N CYS A 121 60.428 9.611 -63.568 1.00 0.00 N ATOM 1080 CA CYS A 121 61.473 9.797 -64.569 1.00 0.00 C ATOM 1081 C CYS A 121 61.999 11.228 -64.547 1.00 0.00 C ATOM 1082 O CYS A 121 63.199 11.461 -64.687 1.00 0.00 O ATOM 1083 CB CYS A 121 60.939 9.459 -65.962 1.00 0.00 C ATOM 1084 SG CYS A 121 62.124 9.747 -67.297 1.00 0.00 S ATOM 0 H CYS A 121 59.562 9.213 -63.931 1.00 0.00 H new ATOM 0 HA CYS A 121 62.296 9.123 -64.329 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.636 8.412 -65.979 1.00 0.00 H new ATOM 0 HB3 CYS A 121 60.044 10.053 -66.150 1.00 0.00 H new ATOM 0 HG CYS A 121 61.581 9.430 -68.435 1.00 0.00 H new ATOM 1090 N SER A 122 61.092 12.184 -64.370 1.00 0.00 N ATOM 1091 CA SER A 122 61.463 13.593 -64.335 1.00 0.00 C ATOM 1092 C SER A 122 62.272 13.911 -63.081 1.00 0.00 C ATOM 1093 O SER A 122 63.090 14.830 -63.072 1.00 0.00 O ATOM 1094 CB SER A 122 60.213 14.474 -64.385 1.00 0.00 C ATOM 1095 OG SER A 122 60.557 15.839 -64.546 1.00 0.00 O ATOM 0 H SER A 122 60.095 12.008 -64.249 1.00 0.00 H new ATOM 0 HA SER A 122 62.081 13.801 -65.208 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.574 14.157 -65.209 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.638 14.346 -63.468 1.00 0.00 H new ATOM 0 HG SER A 122 59.741 16.381 -64.577 1.00 0.00 H new ATOM 1101 N GLY A 123 62.037 13.142 -62.022 1.00 0.00 N ATOM 1102 CA GLY A 123 62.750 13.356 -60.776 1.00 0.00 C ATOM 1103 C GLY A 123 64.114 12.693 -60.768 1.00 0.00 C ATOM 1104 O GLY A 123 65.092 13.276 -60.298 1.00 0.00 O ATOM 0 H GLY A 123 61.365 12.374 -62.005 1.00 0.00 H new ATOM 0 HA2 GLY A 123 62.869 14.426 -60.608 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.155 12.967 -59.949 1.00 0.00 H new ATOM 1108 N CYS A 124 64.179 11.472 -61.287 1.00 0.00 N ATOM 1109 CA CYS A 124 65.433 10.728 -61.335 1.00 0.00 C ATOM 1110 C CYS A 124 65.876 10.503 -62.777 1.00 0.00 C ATOM 1111 O CYS A 124 66.344 9.421 -63.133 1.00 0.00 O ATOM 1112 CB CYS A 124 65.281 9.385 -60.620 1.00 0.00 C ATOM 1113 SG CYS A 124 63.906 8.378 -61.224 1.00 0.00 S ATOM 0 H CYS A 124 63.379 10.976 -61.680 1.00 0.00 H new ATOM 0 HA CYS A 124 66.196 11.317 -60.827 1.00 0.00 H new ATOM 0 HB2 CYS A 124 66.207 8.820 -60.730 1.00 0.00 H new ATOM 0 HB3 CYS A 124 65.143 9.567 -59.554 1.00 0.00 H new ATOM 0 HG CYS A 124 62.883 9.142 -61.467 1.00 0.00 H new ATOM 1119 N LYS A 125 65.724 11.531 -63.605 1.00 0.00 N ATOM 1120 CA LYS A 125 66.107 11.446 -65.009 1.00 0.00 C ATOM 1121 C LYS A 125 67.523 10.898 -65.155 1.00 0.00 C ATOM 1122 O LYS A 125 67.764 9.976 -65.934 1.00 0.00 O ATOM 1123 CB LYS A 125 66.013 12.824 -65.669 1.00 0.00 C ATOM 1124 CG LYS A 125 64.797 12.987 -66.565 1.00 0.00 C ATOM 1125 CD LYS A 125 65.024 14.054 -67.623 1.00 0.00 C ATOM 1126 CE LYS A 125 63.731 14.411 -68.341 1.00 0.00 C ATOM 1127 NZ LYS A 125 63.387 13.414 -69.392 1.00 0.00 N ATOM 0 H LYS A 125 65.338 12.433 -63.327 1.00 0.00 H new ATOM 0 HA LYS A 125 65.418 10.763 -65.506 1.00 0.00 H new ATOM 0 HB2 LYS A 125 65.987 13.589 -64.893 1.00 0.00 H new ATOM 0 HB3 LYS A 125 66.914 12.998 -66.258 1.00 0.00 H new ATOM 0 HG2 LYS A 125 64.570 12.037 -67.048 1.00 0.00 H new ATOM 0 HG3 LYS A 125 63.930 13.252 -65.959 1.00 0.00 H new ATOM 0 HD2 LYS A 125 65.441 14.947 -67.157 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.758 13.700 -68.347 1.00 0.00 H new ATOM 0 HE2 LYS A 125 62.918 14.471 -67.617 1.00 0.00 H new ATOM 0 HE3 LYS A 125 63.828 15.398 -68.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 62.500 13.693 -69.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 64.151 13.375 -70.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 63.270 12.477 -68.956 1.00 0.00 H new ATOM 1141 N GLN A 126 68.455 11.469 -64.398 1.00 0.00 N ATOM 1142 CA GLN A 126 69.846 11.036 -64.443 1.00 0.00 C ATOM 1143 C GLN A 126 69.953 9.526 -64.255 1.00 0.00 C ATOM 1144 O GLN A 126 70.791 8.870 -64.875 1.00 0.00 O ATOM 1145 CB GLN A 126 70.662 11.754 -63.367 1.00 0.00 C ATOM 1146 CG GLN A 126 69.977 11.793 -62.010 1.00 0.00 C ATOM 1147 CD GLN A 126 70.911 12.225 -60.897 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.897 12.924 -61.134 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.606 11.810 -59.673 1.00 0.00 N ATOM 0 H GLN A 126 68.272 12.232 -63.747 1.00 0.00 H new ATOM 0 HA GLN A 126 70.247 11.291 -65.424 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.627 11.259 -63.264 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.861 12.775 -63.694 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.130 12.478 -62.054 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.577 10.805 -61.781 1.00 0.00 H new ATOM 0 HE21 GLN A 126 69.779 11.232 -59.522 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.198 12.069 -58.884 1.00 0.00 H new ATOM 1158 N LEU A 127 69.098 8.980 -63.397 1.00 0.00 N ATOM 1159 CA LEU A 127 69.096 7.547 -63.126 1.00 0.00 C ATOM 1160 C LEU A 127 68.533 6.770 -64.312 1.00 0.00 C ATOM 1161 O LEU A 127 69.121 5.782 -64.755 1.00 0.00 O ATOM 1162 CB LEU A 127 68.277 7.246 -61.870 1.00 0.00 C ATOM 1163 CG LEU A 127 68.680 8.009 -60.608 1.00 0.00 C ATOM 1164 CD1 LEU A 127 67.950 7.455 -59.394 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.186 7.943 -60.403 1.00 0.00 C ATOM 0 H LEU A 127 68.397 9.508 -62.877 1.00 0.00 H new ATOM 0 HA LEU A 127 70.127 7.232 -62.964 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.230 7.462 -62.083 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.346 6.178 -61.663 1.00 0.00 H new ATOM 0 HG LEU A 127 68.396 9.054 -60.732 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.249 8.010 -58.505 1.00 0.00 H new ATOM 0 HD12 LEU A 127 66.874 7.555 -59.539 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.203 6.402 -59.267 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.455 8.491 -59.500 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.494 6.902 -60.301 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.690 8.388 -61.261 1.00 0.00 H new ATOM 1177 N ILE A 128 67.393 7.223 -64.823 1.00 0.00 N ATOM 1178 CA ILE A 128 66.754 6.572 -65.959 1.00 0.00 C ATOM 1179 C ILE A 128 67.727 6.415 -67.122 1.00 0.00 C ATOM 1180 O ILE A 128 67.817 5.348 -67.728 1.00 0.00 O ATOM 1181 CB ILE A 128 65.521 7.362 -66.440 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.545 7.579 -65.282 1.00 0.00 C ATOM 1183 CG2 ILE A 128 64.838 6.631 -67.586 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.093 6.295 -64.623 1.00 0.00 C ATOM 0 H ILE A 128 66.893 8.038 -64.468 1.00 0.00 H new ATOM 0 HA ILE A 128 66.435 5.587 -65.619 1.00 0.00 H new ATOM 0 HB ILE A 128 65.850 8.336 -66.801 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.018 8.215 -64.534 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.671 8.116 -65.650 1.00 0.00 H new ATOM 0 HG21 ILE A 128 63.969 7.201 -67.915 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.536 6.523 -68.416 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.519 5.645 -67.249 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.403 6.526 -63.811 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.591 5.666 -65.358 1.00 0.00 H new ATOM 0 HD13 ILE A 128 64.959 5.766 -64.224 1.00 0.00 H new ATOM 1196 N GLU A 129 68.455 7.485 -67.426 1.00 0.00 N ATOM 1197 CA GLU A 129 69.424 7.464 -68.517 1.00 0.00 C ATOM 1198 C GLU A 129 70.665 6.667 -68.127 1.00 0.00 C ATOM 1199 O GLU A 129 71.214 5.918 -68.934 1.00 0.00 O ATOM 1200 CB GLU A 129 69.821 8.891 -68.903 1.00 0.00 C ATOM 1201 CG GLU A 129 70.443 9.679 -67.762 1.00 0.00 C ATOM 1202 CD GLU A 129 70.590 11.153 -68.085 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.553 11.834 -68.233 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.740 11.627 -68.189 1.00 0.00 O ATOM 0 H GLU A 129 68.393 8.376 -66.933 1.00 0.00 H new ATOM 0 HA GLU A 129 68.957 6.980 -69.375 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.527 8.851 -69.733 1.00 0.00 H new ATOM 0 HB3 GLU A 129 68.938 9.421 -69.260 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.828 9.566 -66.869 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.423 9.262 -67.529 1.00 0.00 H new ATOM 1211 N ALA A 130 71.102 6.834 -66.883 1.00 0.00 N ATOM 1212 CA ALA A 130 72.277 6.130 -66.384 1.00 0.00 C ATOM 1213 C ALA A 130 72.107 4.620 -66.513 1.00 0.00 C ATOM 1214 O ALA A 130 72.984 3.929 -67.031 1.00 0.00 O ATOM 1215 CB ALA A 130 72.546 6.512 -64.936 1.00 0.00 C ATOM 0 H ALA A 130 70.660 7.451 -66.202 1.00 0.00 H new ATOM 0 HA ALA A 130 73.133 6.426 -66.990 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.426 5.979 -64.577 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.720 7.586 -64.869 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.685 6.245 -64.323 1.00 0.00 H new ATOM 1221 N TYR A 131 70.975 4.114 -66.037 1.00 0.00 N ATOM 1222 CA TYR A 131 70.692 2.685 -66.096 1.00 0.00 C ATOM 1223 C TYR A 131 70.817 2.163 -67.524 1.00 0.00 C ATOM 1224 O TYR A 131 71.280 1.045 -67.749 1.00 0.00 O ATOM 1225 CB TYR A 131 69.288 2.399 -65.558 1.00 0.00 C ATOM 1226 CG TYR A 131 68.844 0.968 -65.757 1.00 0.00 C ATOM 1227 CD1 TYR A 131 69.397 -0.063 -65.007 1.00 0.00 C ATOM 1228 CD2 TYR A 131 67.871 0.646 -66.696 1.00 0.00 C ATOM 1229 CE1 TYR A 131 68.994 -1.372 -65.186 1.00 0.00 C ATOM 1230 CE2 TYR A 131 67.461 -0.660 -66.881 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.026 -1.665 -66.124 1.00 0.00 C ATOM 1232 OH TYR A 131 67.621 -2.968 -66.306 1.00 0.00 O ATOM 0 H TYR A 131 70.238 4.672 -65.606 1.00 0.00 H new ATOM 0 HA TYR A 131 71.424 2.170 -65.475 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.261 2.635 -64.494 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.577 3.063 -66.050 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.155 0.163 -64.272 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.428 1.431 -67.291 1.00 0.00 H new ATOM 0 HE1 TYR A 131 69.434 -2.161 -64.595 1.00 0.00 H new ATOM 0 HE2 TYR A 131 66.703 -0.893 -67.614 1.00 0.00 H new ATOM 0 HH TYR A 131 66.932 -3.002 -67.003 1.00 0.00 H new ATOM 1242 N TRP A 132 70.403 2.982 -68.484 1.00 0.00 N ATOM 1243 CA TRP A 132 70.469 2.604 -69.891 1.00 0.00 C ATOM 1244 C TRP A 132 71.904 2.665 -70.404 1.00 0.00 C ATOM 1245 O TRP A 132 72.313 1.849 -71.229 1.00 0.00 O ATOM 1246 CB TRP A 132 69.576 3.520 -70.729 1.00 0.00 C ATOM 1247 CG TRP A 132 68.134 3.111 -70.723 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.074 3.849 -70.281 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.595 1.865 -71.179 1.00 0.00 C ATOM 1250 NE1 TRP A 132 65.908 3.138 -70.435 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.201 1.918 -70.984 1.00 0.00 C ATOM 1252 CE3 TRP A 132 68.154 0.710 -71.734 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.361 0.860 -71.324 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 67.320 -0.338 -72.070 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.936 -0.258 -71.865 1.00 0.00 C ATOM 0 H TRP A 132 70.018 3.911 -68.314 1.00 0.00 H new ATOM 0 HA TRP A 132 70.113 1.578 -69.983 1.00 0.00 H new ATOM 0 HB2 TRP A 132 69.659 4.540 -70.353 1.00 0.00 H new ATOM 0 HB3 TRP A 132 69.939 3.529 -71.757 1.00 0.00 H new ATOM 0 HD1 TRP A 132 67.142 4.846 -69.870 1.00 0.00 H new ATOM 0 HE1 TRP A 132 64.976 3.466 -70.182 1.00 0.00 H new ATOM 0 HE3 TRP A 132 69.219 0.639 -71.897 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.294 0.920 -71.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 67.742 -1.235 -72.498 1.00 0.00 H new ATOM 0 HH2 TRP A 132 65.311 -1.095 -72.139 1.00 0.00 H new ATOM 1266 N ASN A 133 72.663 3.638 -69.911 1.00 0.00 N ATOM 1267 CA ASN A 133 74.053 3.805 -70.320 1.00 0.00 C ATOM 1268 C ASN A 133 74.884 2.584 -69.936 1.00 0.00 C ATOM 1269 O ASN A 133 75.861 2.251 -70.606 1.00 0.00 O ATOM 1270 CB ASN A 133 74.647 5.062 -69.681 1.00 0.00 C ATOM 1271 CG ASN A 133 76.141 5.178 -69.914 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.609 5.137 -71.052 1.00 0.00 O ATOM 1273 ND2 ASN A 133 76.899 5.323 -68.833 1.00 0.00 N ATOM 0 H ASN A 133 72.339 4.323 -69.228 1.00 0.00 H new ATOM 0 HA ASN A 133 74.076 3.911 -71.405 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.149 5.943 -70.087 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.449 5.050 -68.609 1.00 0.00 H new ATOM 0 HD21 ASN A 133 77.911 5.405 -68.927 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.469 5.352 -67.909 1.00 0.00 H new ATOM 1280 N GLU A 134 74.487 1.922 -68.854 1.00 0.00 N ATOM 1281 CA GLU A 134 75.196 0.738 -68.381 1.00 0.00 C ATOM 1282 C GLU A 134 75.212 -0.350 -69.451 1.00 0.00 C ATOM 1283 O GLU A 134 76.111 -1.191 -69.484 1.00 0.00 O ATOM 1284 CB GLU A 134 74.544 0.203 -67.104 1.00 0.00 C ATOM 1285 CG GLU A 134 75.490 0.148 -65.916 1.00 0.00 C ATOM 1286 CD GLU A 134 76.238 1.450 -65.705 1.00 0.00 C ATOM 1287 OE1 GLU A 134 75.702 2.336 -65.007 1.00 0.00 O ATOM 1288 OE2 GLU A 134 77.360 1.582 -66.237 1.00 0.00 O ATOM 0 H GLU A 134 73.679 2.185 -68.289 1.00 0.00 H new ATOM 0 HA GLU A 134 76.225 1.024 -68.163 1.00 0.00 H new ATOM 0 HB2 GLU A 134 73.691 0.833 -66.850 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.156 -0.797 -67.296 1.00 0.00 H new ATOM 0 HG2 GLU A 134 74.923 -0.091 -65.016 1.00 0.00 H new ATOM 0 HG3 GLU A 134 76.208 -0.659 -66.065 1.00 0.00 H new ATOM 1295 N HIS A 135 74.211 -0.327 -70.326 1.00 0.00 N ATOM 1296 CA HIS A 135 74.110 -1.311 -71.398 1.00 0.00 C ATOM 1297 C HIS A 135 74.438 -0.679 -72.747 1.00 0.00 C ATOM 1298 O HIS A 135 73.995 -1.157 -73.791 1.00 0.00 O ATOM 1299 CB HIS A 135 72.706 -1.915 -71.432 1.00 0.00 C ATOM 1300 CG HIS A 135 72.461 -2.924 -70.353 1.00 0.00 C ATOM 1301 ND1 HIS A 135 73.394 -3.869 -69.981 1.00 0.00 N ATOM 1302 CD2 HIS A 135 71.382 -3.131 -69.562 1.00 0.00 C ATOM 1303 CE1 HIS A 135 72.898 -4.615 -69.009 1.00 0.00 C ATOM 1304 NE2 HIS A 135 71.679 -4.187 -68.736 1.00 0.00 N ATOM 0 H HIS A 135 73.459 0.362 -70.314 1.00 0.00 H new ATOM 0 HA HIS A 135 74.833 -2.103 -71.202 1.00 0.00 H new ATOM 0 HB2 HIS A 135 71.973 -1.114 -71.342 1.00 0.00 H new ATOM 0 HB3 HIS A 135 72.546 -2.386 -72.402 1.00 0.00 H new ATOM 0 HD2 HIS A 135 70.459 -2.570 -69.578 1.00 0.00 H new ATOM 0 HE1 HIS A 135 73.404 -5.435 -68.521 1.00 0.00 H new ATOM 0 HE2 HIS A 135 71.059 -4.577 -68.027 1.00 0.00 H new ATOM 1312 N GLY A 136 75.217 0.398 -72.718 1.00 0.00 N ATOM 1313 CA GLY A 136 75.591 1.077 -73.945 1.00 0.00 C ATOM 1314 C GLY A 136 74.524 2.043 -74.420 1.00 0.00 C ATOM 1315 O GLY A 136 74.422 2.328 -75.613 1.00 0.00 O ATOM 0 H GLY A 136 75.596 0.812 -71.866 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.523 1.619 -73.787 1.00 0.00 H new ATOM 0 HA3 GLY A 136 75.780 0.337 -74.723 1.00 0.00 H new