USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 379 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HE2:sc= -0.478 K(o=-0.48,f=-5.6!) USER MOD Single : A 91 MET CE :methyl -146:sc= -0.293 (180deg=-1.14) 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+ -113:sc= -1.2 (180deg=-3.4!) 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= -2.45 K(o=-2.5,f=-3.7!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -80:sc= 0.94 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 180:sc= -0.325 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 90:sc= 0.445 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=-0.45) USER MOD Single : A 131 TYR OH : rot 83:sc= 0.705 USER MOD Single : A 133 ASN : amide:sc= -0.0398 X(o=-0.04,f=-0.04) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.03) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 66.678 8.672 -50.234 1.00 0.00 N ATOM 463 CA VAL A 82 66.648 9.331 -51.534 1.00 0.00 C ATOM 464 C VAL A 82 67.098 8.384 -52.641 1.00 0.00 C ATOM 465 O VAL A 82 68.018 7.587 -52.455 1.00 0.00 O ATOM 466 CB VAL A 82 67.543 10.584 -51.549 1.00 0.00 C ATOM 467 CG1 VAL A 82 68.966 10.229 -51.145 1.00 0.00 C ATOM 468 CG2 VAL A 82 67.518 11.240 -52.922 1.00 0.00 C ATOM 0 HA VAL A 82 65.615 9.630 -51.714 1.00 0.00 H new ATOM 0 HB VAL A 82 67.152 11.297 -50.823 1.00 0.00 H new ATOM 0 HG11 VAL A 82 69.584 11.127 -51.161 1.00 0.00 H new ATOM 0 HG12 VAL A 82 68.964 9.808 -50.140 1.00 0.00 H new ATOM 0 HG13 VAL A 82 69.371 9.497 -51.844 1.00 0.00 H new ATOM 0 HG21 VAL A 82 68.156 12.124 -52.915 1.00 0.00 H new ATOM 0 HG22 VAL A 82 67.883 10.535 -53.669 1.00 0.00 H new ATOM 0 HG23 VAL A 82 66.497 11.532 -53.167 1.00 0.00 H new ATOM 478 N VAL A 83 66.444 8.477 -53.794 1.00 0.00 N ATOM 479 CA VAL A 83 66.778 7.630 -54.933 1.00 0.00 C ATOM 480 C VAL A 83 68.255 7.748 -55.291 1.00 0.00 C ATOM 481 O VAL A 83 68.731 8.823 -55.658 1.00 0.00 O ATOM 482 CB VAL A 83 65.931 7.991 -56.168 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.180 6.999 -57.294 1.00 0.00 C ATOM 484 CG2 VAL A 83 64.455 8.039 -55.806 1.00 0.00 C ATOM 0 H VAL A 83 65.680 9.130 -53.964 1.00 0.00 H new ATOM 0 HA VAL A 83 66.559 6.603 -54.639 1.00 0.00 H new ATOM 0 HB VAL A 83 66.229 8.981 -56.515 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.573 7.270 -58.158 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.234 7.019 -57.570 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.911 5.996 -56.962 1.00 0.00 H new ATOM 0 HG21 VAL A 83 63.872 8.295 -56.690 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.140 7.064 -55.433 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.294 8.792 -55.034 1.00 0.00 H new ATOM 494 N GLU A 84 68.976 6.636 -55.183 1.00 0.00 N ATOM 495 CA GLU A 84 70.400 6.616 -55.495 1.00 0.00 C ATOM 496 C GLU A 84 70.637 6.134 -56.924 1.00 0.00 C ATOM 497 O GLU A 84 71.556 6.593 -57.602 1.00 0.00 O ATOM 498 CB GLU A 84 71.148 5.715 -54.511 1.00 0.00 C ATOM 499 CG GLU A 84 72.656 5.898 -54.544 1.00 0.00 C ATOM 500 CD GLU A 84 73.076 7.333 -54.289 1.00 0.00 C ATOM 501 OE1 GLU A 84 72.304 8.069 -53.639 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.174 7.719 -54.740 1.00 0.00 O ATOM 0 H GLU A 84 68.597 5.738 -54.882 1.00 0.00 H new ATOM 0 HA GLU A 84 70.780 7.634 -55.405 1.00 0.00 H new ATOM 0 HB2 GLU A 84 70.788 5.916 -53.502 1.00 0.00 H new ATOM 0 HB3 GLU A 84 70.912 4.674 -54.733 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.113 5.251 -53.795 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.036 5.579 -55.515 1.00 0.00 H new ATOM 509 N LYS A 85 69.801 5.205 -57.374 1.00 0.00 N ATOM 510 CA LYS A 85 69.916 4.659 -58.721 1.00 0.00 C ATOM 511 C LYS A 85 68.720 3.773 -59.054 1.00 0.00 C ATOM 512 O LYS A 85 67.857 3.535 -58.209 1.00 0.00 O ATOM 513 CB LYS A 85 71.213 3.857 -58.859 1.00 0.00 C ATOM 514 CG LYS A 85 71.250 2.608 -57.996 1.00 0.00 C ATOM 515 CD LYS A 85 72.598 1.913 -58.079 1.00 0.00 C ATOM 516 CE LYS A 85 72.906 1.460 -59.498 1.00 0.00 C ATOM 517 NZ LYS A 85 74.109 0.584 -59.552 1.00 0.00 N ATOM 0 H LYS A 85 69.035 4.814 -56.825 1.00 0.00 H new ATOM 0 HA LYS A 85 69.934 5.492 -59.423 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.344 3.571 -59.903 1.00 0.00 H new ATOM 0 HB3 LYS A 85 72.055 4.496 -58.595 1.00 0.00 H new ATOM 0 HG2 LYS A 85 71.040 2.874 -56.960 1.00 0.00 H new ATOM 0 HG3 LYS A 85 70.465 1.921 -58.314 1.00 0.00 H new ATOM 0 HD2 LYS A 85 73.379 2.590 -57.735 1.00 0.00 H new ATOM 0 HD3 LYS A 85 72.606 1.052 -57.411 1.00 0.00 H new ATOM 0 HE2 LYS A 85 72.048 0.923 -59.902 1.00 0.00 H new ATOM 0 HE3 LYS A 85 73.064 2.333 -60.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 74.285 0.297 -60.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 74.934 1.104 -59.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 73.949 -0.261 -58.968 1.00 0.00 H new ATOM 531 N VAL A 86 68.676 3.286 -60.290 1.00 0.00 N ATOM 532 CA VAL A 86 67.587 2.425 -60.734 1.00 0.00 C ATOM 533 C VAL A 86 67.921 0.955 -60.506 1.00 0.00 C ATOM 534 O VAL A 86 69.072 0.540 -60.647 1.00 0.00 O ATOM 535 CB VAL A 86 67.270 2.642 -62.226 1.00 0.00 C ATOM 536 CG1 VAL A 86 66.162 1.705 -62.679 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.892 4.093 -62.483 1.00 0.00 C ATOM 0 H VAL A 86 69.382 3.473 -61.002 1.00 0.00 H new ATOM 0 HA VAL A 86 66.712 2.693 -60.142 1.00 0.00 H new ATOM 0 HB VAL A 86 68.164 2.414 -62.807 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.952 1.873 -63.735 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.476 0.672 -62.532 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.262 1.897 -62.095 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.671 4.229 -63.542 1.00 0.00 H new ATOM 0 HG22 VAL A 86 66.012 4.350 -61.893 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.721 4.741 -62.199 1.00 0.00 H new ATOM 547 N LEU A 87 66.908 0.171 -60.154 1.00 0.00 N ATOM 548 CA LEU A 87 67.094 -1.255 -59.906 1.00 0.00 C ATOM 549 C LEU A 87 66.699 -2.076 -61.130 1.00 0.00 C ATOM 550 O LEU A 87 67.360 -3.056 -61.473 1.00 0.00 O ATOM 551 CB LEU A 87 66.269 -1.694 -58.695 1.00 0.00 C ATOM 552 CG LEU A 87 66.475 -3.136 -58.230 1.00 0.00 C ATOM 553 CD1 LEU A 87 65.689 -4.097 -59.107 1.00 0.00 C ATOM 554 CD2 LEU A 87 67.955 -3.492 -58.237 1.00 0.00 C ATOM 0 H LEU A 87 65.949 0.498 -60.034 1.00 0.00 H new ATOM 0 HA LEU A 87 68.150 -1.429 -59.700 1.00 0.00 H new ATOM 0 HB2 LEU A 87 66.499 -1.029 -57.863 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.214 -1.556 -58.930 1.00 0.00 H new ATOM 0 HG LEU A 87 66.105 -3.225 -57.208 1.00 0.00 H new ATOM 0 HD11 LEU A 87 65.848 -5.118 -58.761 1.00 0.00 H new ATOM 0 HD12 LEU A 87 64.628 -3.856 -59.051 1.00 0.00 H new ATOM 0 HD13 LEU A 87 66.027 -4.007 -60.139 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.083 -4.522 -57.903 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.350 -3.386 -59.247 1.00 0.00 H new ATOM 0 HD23 LEU A 87 68.493 -2.823 -57.565 1.00 0.00 H new ATOM 566 N LYS A 88 65.618 -1.667 -61.786 1.00 0.00 N ATOM 567 CA LYS A 88 65.136 -2.361 -62.974 1.00 0.00 C ATOM 568 C LYS A 88 64.066 -1.541 -63.687 1.00 0.00 C ATOM 569 O LYS A 88 63.429 -0.676 -63.085 1.00 0.00 O ATOM 570 CB LYS A 88 64.573 -3.733 -62.595 1.00 0.00 C ATOM 571 CG LYS A 88 64.997 -4.846 -63.537 1.00 0.00 C ATOM 572 CD LYS A 88 64.255 -6.139 -63.243 1.00 0.00 C ATOM 573 CE LYS A 88 65.028 -7.018 -62.272 1.00 0.00 C ATOM 574 NZ LYS A 88 66.019 -7.880 -62.972 1.00 0.00 N ATOM 0 H LYS A 88 65.059 -0.858 -61.515 1.00 0.00 H new ATOM 0 HA LYS A 88 65.979 -2.495 -63.652 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.895 -3.982 -61.584 1.00 0.00 H new ATOM 0 HB3 LYS A 88 63.485 -3.678 -62.578 1.00 0.00 H new ATOM 0 HG2 LYS A 88 64.808 -4.544 -64.567 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.070 -5.012 -63.445 1.00 0.00 H new ATOM 0 HD2 LYS A 88 63.274 -5.910 -62.826 1.00 0.00 H new ATOM 0 HD3 LYS A 88 64.087 -6.683 -64.173 1.00 0.00 H new ATOM 0 HE2 LYS A 88 65.543 -6.390 -61.545 1.00 0.00 H new ATOM 0 HE3 LYS A 88 64.331 -7.644 -61.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 66.525 -8.464 -62.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 65.526 -8.497 -63.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 66.700 -7.282 -63.482 1.00 0.00 H new ATOM 588 N HIS A 89 63.874 -1.817 -64.973 1.00 0.00 N ATOM 589 CA HIS A 89 62.880 -1.105 -65.768 1.00 0.00 C ATOM 590 C HIS A 89 61.805 -2.062 -66.277 1.00 0.00 C ATOM 591 O HIS A 89 62.104 -3.180 -66.696 1.00 0.00 O ATOM 592 CB HIS A 89 63.549 -0.398 -66.946 1.00 0.00 C ATOM 593 CG HIS A 89 62.578 0.151 -67.946 1.00 0.00 C ATOM 594 ND1 HIS A 89 61.440 0.843 -67.588 1.00 0.00 N ATOM 595 CD2 HIS A 89 62.581 0.109 -69.299 1.00 0.00 C ATOM 596 CE1 HIS A 89 60.784 1.201 -68.677 1.00 0.00 C ATOM 597 NE2 HIS A 89 61.455 0.768 -69.729 1.00 0.00 N ATOM 0 H HIS A 89 64.394 -2.529 -65.487 1.00 0.00 H new ATOM 0 HA HIS A 89 62.406 -0.360 -65.129 1.00 0.00 H new ATOM 0 HB2 HIS A 89 64.167 0.416 -66.567 1.00 0.00 H new ATOM 0 HB3 HIS A 89 64.217 -1.098 -67.447 1.00 0.00 H new ATOM 0 HD1 HIS A 89 61.150 1.047 -66.631 1.00 0.00 H new ATOM 0 HD2 HIS A 89 63.329 -0.356 -69.924 1.00 0.00 H new ATOM 0 HE1 HIS A 89 59.857 1.754 -68.703 1.00 0.00 H new ATOM 605 N ARG A 90 60.555 -1.614 -66.238 1.00 0.00 N ATOM 606 CA ARG A 90 59.436 -2.431 -66.694 1.00 0.00 C ATOM 607 C ARG A 90 58.387 -1.573 -67.396 1.00 0.00 C ATOM 608 O ARG A 90 58.122 -0.443 -66.988 1.00 0.00 O ATOM 609 CB ARG A 90 58.801 -3.168 -65.513 1.00 0.00 C ATOM 610 CG ARG A 90 59.342 -4.574 -65.311 1.00 0.00 C ATOM 611 CD ARG A 90 58.930 -5.498 -66.447 1.00 0.00 C ATOM 612 NE ARG A 90 57.625 -6.109 -66.210 1.00 0.00 N ATOM 613 CZ ARG A 90 57.098 -7.043 -66.993 1.00 0.00 C ATOM 614 NH1 ARG A 90 57.761 -7.471 -68.058 1.00 0.00 N ATOM 615 NH2 ARG A 90 55.905 -7.552 -66.712 1.00 0.00 N ATOM 0 H ARG A 90 60.291 -0.690 -65.896 1.00 0.00 H new ATOM 0 HA ARG A 90 59.818 -3.162 -67.407 1.00 0.00 H new ATOM 0 HB2 ARG A 90 58.966 -2.590 -64.604 1.00 0.00 H new ATOM 0 HB3 ARG A 90 57.723 -3.221 -65.666 1.00 0.00 H new ATOM 0 HG2 ARG A 90 60.429 -4.540 -65.244 1.00 0.00 H new ATOM 0 HG3 ARG A 90 58.976 -4.973 -64.365 1.00 0.00 H new ATOM 0 HD2 ARG A 90 58.903 -4.935 -67.380 1.00 0.00 H new ATOM 0 HD3 ARG A 90 59.680 -6.280 -66.568 1.00 0.00 H new ATOM 0 HE ARG A 90 57.089 -5.801 -65.399 1.00 0.00 H new ATOM 0 HH11 ARG A 90 58.678 -7.083 -68.278 1.00 0.00 H new ATOM 0 HH12 ARG A 90 57.354 -8.189 -68.658 1.00 0.00 H new ATOM 0 HH21 ARG A 90 55.391 -7.226 -65.893 1.00 0.00 H new ATOM 0 HH22 ARG A 90 55.502 -8.269 -67.315 1.00 0.00 H new ATOM 629 N MET A 91 57.795 -2.120 -68.452 1.00 0.00 N ATOM 630 CA MET A 91 56.775 -1.405 -69.210 1.00 0.00 C ATOM 631 C MET A 91 55.382 -1.930 -68.878 1.00 0.00 C ATOM 632 O MET A 91 55.033 -3.057 -69.229 1.00 0.00 O ATOM 633 CB MET A 91 57.037 -1.538 -70.712 1.00 0.00 C ATOM 634 CG MET A 91 57.289 -2.968 -71.160 1.00 0.00 C ATOM 635 SD MET A 91 59.036 -3.310 -71.446 1.00 0.00 S ATOM 636 CE MET A 91 59.399 -2.143 -72.755 1.00 0.00 C ATOM 0 H MET A 91 58.004 -3.055 -68.802 1.00 0.00 H new ATOM 0 HA MET A 91 56.824 -0.352 -68.931 1.00 0.00 H new ATOM 0 HB2 MET A 91 56.182 -1.140 -71.258 1.00 0.00 H new ATOM 0 HB3 MET A 91 57.898 -0.925 -70.978 1.00 0.00 H new ATOM 0 HG2 MET A 91 56.908 -3.654 -70.403 1.00 0.00 H new ATOM 0 HG3 MET A 91 56.730 -3.161 -72.076 1.00 0.00 H new ATOM 0 HE1 MET A 91 60.138 -2.573 -73.431 1.00 0.00 H new ATOM 0 HE2 MET A 91 58.486 -1.922 -73.309 1.00 0.00 H new ATOM 0 HE3 MET A 91 59.793 -1.223 -72.323 1.00 0.00 H new ATOM 646 N ALA A 92 54.590 -1.106 -68.198 1.00 0.00 N ATOM 647 CA ALA A 92 53.235 -1.488 -67.820 1.00 0.00 C ATOM 648 C ALA A 92 52.374 -1.747 -69.051 1.00 0.00 C ATOM 649 O ALA A 92 52.300 -0.914 -69.955 1.00 0.00 O ATOM 650 CB ALA A 92 52.607 -0.409 -66.950 1.00 0.00 C ATOM 0 H ALA A 92 54.864 -0.170 -67.898 1.00 0.00 H new ATOM 0 HA ALA A 92 53.290 -2.414 -67.248 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.595 -0.707 -66.675 1.00 0.00 H new ATOM 0 HB2 ALA A 92 53.204 -0.276 -66.048 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.571 0.529 -67.503 1.00 0.00 H new ATOM 716 N GLY A 97 52.652 3.086 -70.249 1.00 0.00 N ATOM 717 CA GLY A 97 53.777 3.986 -70.079 1.00 0.00 C ATOM 718 C GLY A 97 55.056 3.254 -69.723 1.00 0.00 C ATOM 719 O GLY A 97 55.406 2.257 -70.356 1.00 0.00 O ATOM 0 HA2 GLY A 97 53.929 4.551 -70.999 1.00 0.00 H new ATOM 0 HA3 GLY A 97 53.545 4.708 -69.296 1.00 0.00 H new ATOM 723 N TYR A 98 55.758 3.750 -68.710 1.00 0.00 N ATOM 724 CA TYR A 98 57.008 3.139 -68.274 1.00 0.00 C ATOM 725 C TYR A 98 57.137 3.187 -66.755 1.00 0.00 C ATOM 726 O TYR A 98 56.594 4.079 -66.103 1.00 0.00 O ATOM 727 CB TYR A 98 58.199 3.847 -68.921 1.00 0.00 C ATOM 728 CG TYR A 98 58.395 3.495 -70.378 1.00 0.00 C ATOM 729 CD1 TYR A 98 58.361 2.172 -70.803 1.00 0.00 C ATOM 730 CD2 TYR A 98 58.616 4.483 -71.329 1.00 0.00 C ATOM 731 CE1 TYR A 98 58.540 1.845 -72.133 1.00 0.00 C ATOM 732 CE2 TYR A 98 58.796 4.165 -72.661 1.00 0.00 C ATOM 733 CZ TYR A 98 58.757 2.845 -73.058 1.00 0.00 C ATOM 734 OH TYR A 98 58.936 2.524 -74.384 1.00 0.00 O ATOM 0 H TYR A 98 55.482 4.574 -68.175 1.00 0.00 H new ATOM 0 HA TYR A 98 57.001 2.095 -68.587 1.00 0.00 H new ATOM 0 HB2 TYR A 98 58.062 4.925 -68.832 1.00 0.00 H new ATOM 0 HB3 TYR A 98 59.105 3.594 -68.370 1.00 0.00 H new ATOM 0 HD1 TYR A 98 58.192 1.387 -70.081 1.00 0.00 H new ATOM 0 HD2 TYR A 98 58.648 5.518 -71.022 1.00 0.00 H new ATOM 0 HE1 TYR A 98 58.510 0.812 -72.447 1.00 0.00 H new ATOM 0 HE2 TYR A 98 58.966 4.946 -73.387 1.00 0.00 H new ATOM 0 HH TYR A 98 59.076 3.343 -74.903 1.00 0.00 H new ATOM 744 N GLU A 99 57.859 2.220 -66.198 1.00 0.00 N ATOM 745 CA GLU A 99 58.060 2.151 -64.755 1.00 0.00 C ATOM 746 C GLU A 99 59.504 1.787 -64.423 1.00 0.00 C ATOM 747 O GLU A 99 60.093 0.906 -65.051 1.00 0.00 O ATOM 748 CB GLU A 99 57.108 1.127 -64.134 1.00 0.00 C ATOM 749 CG GLU A 99 55.657 1.317 -64.543 1.00 0.00 C ATOM 750 CD GLU A 99 55.020 2.528 -63.889 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.055 2.616 -62.644 1.00 0.00 O ATOM 752 OE2 GLU A 99 54.487 3.387 -64.622 1.00 0.00 O ATOM 0 H GLU A 99 58.314 1.474 -66.724 1.00 0.00 H new ATOM 0 HA GLU A 99 57.847 3.135 -64.337 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.429 0.125 -64.420 1.00 0.00 H new ATOM 0 HB3 GLU A 99 57.181 1.187 -63.048 1.00 0.00 H new ATOM 0 HG2 GLU A 99 55.600 1.422 -65.626 1.00 0.00 H new ATOM 0 HG3 GLU A 99 55.089 0.425 -64.278 1.00 0.00 H new ATOM 759 N TYR A 100 60.068 2.470 -63.433 1.00 0.00 N ATOM 760 CA TYR A 100 61.444 2.221 -63.019 1.00 0.00 C ATOM 761 C TYR A 100 61.537 2.066 -61.505 1.00 0.00 C ATOM 762 O TYR A 100 60.916 2.818 -60.752 1.00 0.00 O ATOM 763 CB TYR A 100 62.352 3.360 -63.484 1.00 0.00 C ATOM 764 CG TYR A 100 62.086 3.806 -64.904 1.00 0.00 C ATOM 765 CD1 TYR A 100 61.099 4.741 -65.187 1.00 0.00 C ATOM 766 CD2 TYR A 100 62.824 3.292 -65.964 1.00 0.00 C ATOM 767 CE1 TYR A 100 60.852 5.151 -66.483 1.00 0.00 C ATOM 768 CE2 TYR A 100 62.586 3.697 -67.263 1.00 0.00 C ATOM 769 CZ TYR A 100 61.598 4.626 -67.517 1.00 0.00 C ATOM 770 OH TYR A 100 61.357 5.032 -68.810 1.00 0.00 O ATOM 0 H TYR A 100 59.594 3.200 -62.902 1.00 0.00 H new ATOM 0 HA TYR A 100 61.774 1.291 -63.482 1.00 0.00 H new ATOM 0 HB2 TYR A 100 62.225 4.211 -62.815 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.391 3.042 -63.401 1.00 0.00 H new ATOM 0 HD1 TYR A 100 60.514 5.155 -64.379 1.00 0.00 H new ATOM 0 HD2 TYR A 100 63.597 2.563 -65.769 1.00 0.00 H new ATOM 0 HE1 TYR A 100 60.079 5.878 -66.685 1.00 0.00 H new ATOM 0 HE2 TYR A 100 63.170 3.289 -68.075 1.00 0.00 H new ATOM 0 HH TYR A 100 61.969 4.568 -69.418 1.00 0.00 H new ATOM 780 N LEU A 101 62.319 1.087 -61.064 1.00 0.00 N ATOM 781 CA LEU A 101 62.496 0.832 -59.638 1.00 0.00 C ATOM 782 C LEU A 101 63.553 1.759 -59.047 1.00 0.00 C ATOM 783 O LEU A 101 64.608 1.976 -59.643 1.00 0.00 O ATOM 784 CB LEU A 101 62.894 -0.627 -59.407 1.00 0.00 C ATOM 785 CG LEU A 101 61.742 -1.618 -59.239 1.00 0.00 C ATOM 786 CD1 LEU A 101 62.040 -2.913 -59.979 1.00 0.00 C ATOM 787 CD2 LEU A 101 61.483 -1.892 -57.765 1.00 0.00 C ATOM 0 H LEU A 101 62.841 0.457 -61.673 1.00 0.00 H new ATOM 0 HA LEU A 101 61.547 1.027 -59.138 1.00 0.00 H new ATOM 0 HB2 LEU A 101 63.508 -0.953 -60.247 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.521 -0.675 -58.517 1.00 0.00 H new ATOM 0 HG LEU A 101 60.843 -1.176 -59.669 1.00 0.00 H new ATOM 0 HD11 LEU A 101 61.209 -3.606 -59.848 1.00 0.00 H new ATOM 0 HD12 LEU A 101 62.174 -2.703 -61.040 1.00 0.00 H new ATOM 0 HD13 LEU A 101 62.951 -3.359 -59.580 1.00 0.00 H new ATOM 0 HD21 LEU A 101 60.660 -2.599 -57.666 1.00 0.00 H new ATOM 0 HD22 LEU A 101 62.380 -2.313 -57.310 1.00 0.00 H new ATOM 0 HD23 LEU A 101 61.224 -0.961 -57.262 1.00 0.00 H new ATOM 799 N LEU A 102 63.263 2.303 -57.870 1.00 0.00 N ATOM 800 CA LEU A 102 64.189 3.206 -57.196 1.00 0.00 C ATOM 801 C LEU A 102 65.040 2.453 -56.178 1.00 0.00 C ATOM 802 O LEU A 102 64.559 1.542 -55.503 1.00 0.00 O ATOM 803 CB LEU A 102 63.421 4.332 -56.502 1.00 0.00 C ATOM 804 CG LEU A 102 62.251 4.929 -57.286 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.351 5.740 -56.367 1.00 0.00 C ATOM 806 CD2 LEU A 102 62.761 5.789 -58.432 1.00 0.00 C ATOM 0 H LEU A 102 62.394 2.134 -57.363 1.00 0.00 H new ATOM 0 HA LEU A 102 64.850 3.636 -57.948 1.00 0.00 H new ATOM 0 HB2 LEU A 102 63.041 3.954 -55.553 1.00 0.00 H new ATOM 0 HB3 LEU A 102 64.122 5.133 -56.269 1.00 0.00 H new ATOM 0 HG LEU A 102 61.664 4.111 -57.705 1.00 0.00 H new ATOM 0 HD11 LEU A 102 60.524 6.157 -56.942 1.00 0.00 H new ATOM 0 HD12 LEU A 102 60.957 5.095 -55.581 1.00 0.00 H new ATOM 0 HD13 LEU A 102 61.925 6.550 -55.918 1.00 0.00 H new ATOM 0 HD21 LEU A 102 61.915 6.205 -58.979 1.00 0.00 H new ATOM 0 HD22 LEU A 102 63.371 6.600 -58.035 1.00 0.00 H new ATOM 0 HD23 LEU A 102 63.363 5.179 -59.105 1.00 0.00 H new ATOM 818 N LYS A 103 66.306 2.840 -56.070 1.00 0.00 N ATOM 819 CA LYS A 103 67.224 2.205 -55.132 1.00 0.00 C ATOM 820 C LYS A 103 67.598 3.161 -54.004 1.00 0.00 C ATOM 821 O LYS A 103 67.705 4.370 -54.213 1.00 0.00 O ATOM 822 CB LYS A 103 68.487 1.739 -55.860 1.00 0.00 C ATOM 823 CG LYS A 103 68.250 0.576 -56.807 1.00 0.00 C ATOM 824 CD LYS A 103 69.486 -0.299 -56.937 1.00 0.00 C ATOM 825 CE LYS A 103 69.746 -1.089 -55.663 1.00 0.00 C ATOM 826 NZ LYS A 103 68.572 -1.918 -55.275 1.00 0.00 N ATOM 0 H LYS A 103 66.720 3.591 -56.621 1.00 0.00 H new ATOM 0 HA LYS A 103 66.721 1.340 -54.699 1.00 0.00 H new ATOM 0 HB2 LYS A 103 68.901 2.576 -56.422 1.00 0.00 H new ATOM 0 HB3 LYS A 103 69.235 1.449 -55.122 1.00 0.00 H new ATOM 0 HG2 LYS A 103 67.415 -0.024 -56.446 1.00 0.00 H new ATOM 0 HG3 LYS A 103 67.968 0.957 -57.789 1.00 0.00 H new ATOM 0 HD2 LYS A 103 69.360 -0.986 -57.773 1.00 0.00 H new ATOM 0 HD3 LYS A 103 70.352 0.323 -57.164 1.00 0.00 H new ATOM 0 HE2 LYS A 103 70.614 -1.733 -55.806 1.00 0.00 H new ATOM 0 HE3 LYS A 103 69.989 -0.402 -54.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 68.168 -1.554 -54.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 67.854 -1.875 -56.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 68.873 -2.904 -55.140 1.00 0.00 H new ATOM 840 N TRP A 104 67.796 2.613 -52.811 1.00 0.00 N ATOM 841 CA TRP A 104 68.159 3.418 -51.651 1.00 0.00 C ATOM 842 C TRP A 104 69.653 3.320 -51.366 1.00 0.00 C ATOM 843 O TRP A 104 70.177 2.233 -51.123 1.00 0.00 O ATOM 844 CB TRP A 104 67.363 2.970 -50.424 1.00 0.00 C ATOM 845 CG TRP A 104 65.880 2.965 -50.647 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.067 1.871 -50.722 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.037 4.109 -50.826 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.768 2.266 -50.937 1.00 0.00 N ATOM 849 CE2 TRP A 104 63.723 3.633 -51.003 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.263 5.487 -50.851 1.00 0.00 C ATOM 851 CZ2 TRP A 104 62.643 4.489 -51.204 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.191 6.335 -51.050 1.00 0.00 C ATOM 853 CH2 TRP A 104 62.894 5.834 -51.224 1.00 0.00 C ATOM 0 H TRP A 104 67.711 1.614 -52.622 1.00 0.00 H new ATOM 0 HA TRP A 104 67.918 4.458 -51.872 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.684 1.968 -50.138 1.00 0.00 H new ATOM 0 HB3 TRP A 104 67.595 3.630 -49.588 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.396 0.847 -50.627 1.00 0.00 H new ATOM 0 HE1 TRP A 104 62.967 1.642 -51.032 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.259 5.883 -50.717 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 61.643 4.105 -51.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 64.355 7.402 -51.072 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.076 6.523 -51.377 1.00 0.00 H new ATOM 864 N GLU A 105 70.334 4.461 -51.397 1.00 0.00 N ATOM 865 CA GLU A 105 71.769 4.501 -51.143 1.00 0.00 C ATOM 866 C GLU A 105 72.111 3.786 -49.838 1.00 0.00 C ATOM 867 O GLU A 105 71.558 4.097 -48.784 1.00 0.00 O ATOM 868 CB GLU A 105 72.260 5.949 -51.087 1.00 0.00 C ATOM 869 CG GLU A 105 73.745 6.078 -50.791 1.00 0.00 C ATOM 870 CD GLU A 105 74.606 5.335 -51.794 1.00 0.00 C ATOM 871 OE1 GLU A 105 74.709 4.095 -51.685 1.00 0.00 O ATOM 872 OE2 GLU A 105 75.177 5.994 -52.688 1.00 0.00 O ATOM 0 H GLU A 105 69.915 5.370 -51.595 1.00 0.00 H new ATOM 0 HA GLU A 105 72.271 3.986 -51.962 1.00 0.00 H new ATOM 0 HB2 GLU A 105 72.045 6.434 -52.039 1.00 0.00 H new ATOM 0 HB3 GLU A 105 71.698 6.485 -50.322 1.00 0.00 H new ATOM 0 HG2 GLU A 105 74.021 7.132 -50.791 1.00 0.00 H new ATOM 0 HG3 GLU A 105 73.947 5.695 -49.791 1.00 0.00 H new ATOM 879 N GLY A 106 73.026 2.825 -49.919 1.00 0.00 N ATOM 880 CA GLY A 106 73.425 2.080 -48.739 1.00 0.00 C ATOM 881 C GLY A 106 72.615 0.812 -48.553 1.00 0.00 C ATOM 882 O GLY A 106 73.129 -0.195 -48.065 1.00 0.00 O ATOM 0 H GLY A 106 73.498 2.549 -50.780 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.482 1.825 -48.814 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.312 2.712 -47.858 1.00 0.00 H new ATOM 886 N TYR A 107 71.345 0.861 -48.939 1.00 0.00 N ATOM 887 CA TYR A 107 70.461 -0.291 -48.808 1.00 0.00 C ATOM 888 C TYR A 107 70.232 -0.959 -50.161 1.00 0.00 C ATOM 889 O TYR A 107 69.801 -0.316 -51.118 1.00 0.00 O ATOM 890 CB TYR A 107 69.122 0.133 -48.203 1.00 0.00 C ATOM 891 CG TYR A 107 69.260 1.054 -47.012 1.00 0.00 C ATOM 892 CD1 TYR A 107 70.208 0.810 -46.027 1.00 0.00 C ATOM 893 CD2 TYR A 107 68.441 2.168 -46.872 1.00 0.00 C ATOM 894 CE1 TYR A 107 70.337 1.648 -44.936 1.00 0.00 C ATOM 895 CE2 TYR A 107 68.564 3.012 -45.786 1.00 0.00 C ATOM 896 CZ TYR A 107 69.513 2.748 -44.820 1.00 0.00 C ATOM 897 OH TYR A 107 69.639 3.586 -43.736 1.00 0.00 O ATOM 0 H TYR A 107 70.905 1.686 -49.345 1.00 0.00 H new ATOM 0 HA TYR A 107 70.940 -1.011 -48.144 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.528 0.631 -48.969 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.571 -0.758 -47.901 1.00 0.00 H new ATOM 0 HD1 TYR A 107 70.856 -0.050 -46.115 1.00 0.00 H new ATOM 0 HD2 TYR A 107 67.696 2.377 -47.625 1.00 0.00 H new ATOM 0 HE1 TYR A 107 71.079 1.443 -44.178 1.00 0.00 H new ATOM 0 HE2 TYR A 107 67.921 3.874 -45.693 1.00 0.00 H new ATOM 0 HH TYR A 107 68.985 4.313 -43.806 1.00 0.00 H new ATOM 907 N ASP A 108 70.524 -2.253 -50.231 1.00 0.00 N ATOM 908 CA ASP A 108 70.349 -3.011 -51.465 1.00 0.00 C ATOM 909 C ASP A 108 69.156 -3.954 -51.359 1.00 0.00 C ATOM 910 O ASP A 108 69.273 -5.063 -50.837 1.00 0.00 O ATOM 911 CB ASP A 108 71.617 -3.805 -51.784 1.00 0.00 C ATOM 912 CG ASP A 108 72.260 -4.393 -50.544 1.00 0.00 C ATOM 913 OD1 ASP A 108 72.885 -3.627 -49.780 1.00 0.00 O ATOM 914 OD2 ASP A 108 72.138 -5.618 -50.336 1.00 0.00 O ATOM 0 H ASP A 108 70.883 -2.799 -49.448 1.00 0.00 H new ATOM 0 HA ASP A 108 70.159 -2.305 -52.273 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.374 -4.609 -52.479 1.00 0.00 H new ATOM 0 HB3 ASP A 108 72.333 -3.154 -52.287 1.00 0.00 H new ATOM 919 N ASP A 109 68.008 -3.506 -51.856 1.00 0.00 N ATOM 920 CA ASP A 109 66.792 -4.311 -51.817 1.00 0.00 C ATOM 921 C ASP A 109 66.683 -5.191 -53.058 1.00 0.00 C ATOM 922 O ASP A 109 67.283 -4.918 -54.098 1.00 0.00 O ATOM 923 CB ASP A 109 65.562 -3.409 -51.707 1.00 0.00 C ATOM 924 CG ASP A 109 65.087 -3.249 -50.276 1.00 0.00 C ATOM 925 OD1 ASP A 109 64.566 -4.233 -49.711 1.00 0.00 O ATOM 926 OD2 ASP A 109 65.237 -2.140 -49.721 1.00 0.00 O ATOM 0 H ASP A 109 67.894 -2.590 -52.290 1.00 0.00 H new ATOM 0 HA ASP A 109 66.840 -4.956 -50.940 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.796 -2.428 -52.121 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.755 -3.825 -52.310 1.00 0.00 H new ATOM 931 N PRO A 110 65.901 -6.275 -52.948 1.00 0.00 N ATOM 932 CA PRO A 110 65.695 -7.218 -54.051 1.00 0.00 C ATOM 933 C PRO A 110 64.869 -6.616 -55.182 1.00 0.00 C ATOM 934 O PRO A 110 64.687 -5.401 -55.252 1.00 0.00 O ATOM 935 CB PRO A 110 64.938 -8.374 -53.393 1.00 0.00 C ATOM 936 CG PRO A 110 64.249 -7.759 -52.224 1.00 0.00 C ATOM 937 CD PRO A 110 65.156 -6.663 -51.738 1.00 0.00 C ATOM 0 HA PRO A 110 66.636 -7.515 -54.514 1.00 0.00 H new ATOM 0 HB2 PRO A 110 64.223 -8.823 -54.083 1.00 0.00 H new ATOM 0 HB3 PRO A 110 65.619 -9.166 -53.080 1.00 0.00 H new ATOM 0 HG2 PRO A 110 63.275 -7.362 -52.510 1.00 0.00 H new ATOM 0 HG3 PRO A 110 64.075 -8.497 -51.441 1.00 0.00 H new ATOM 0 HD2 PRO A 110 64.591 -5.826 -51.328 1.00 0.00 H new ATOM 0 HD3 PRO A 110 65.823 -7.013 -50.950 1.00 0.00 H new ATOM 945 N SER A 111 64.371 -7.474 -56.067 1.00 0.00 N ATOM 946 CA SER A 111 63.567 -7.026 -57.198 1.00 0.00 C ATOM 947 C SER A 111 62.208 -6.515 -56.729 1.00 0.00 C ATOM 948 O SER A 111 61.433 -5.969 -57.514 1.00 0.00 O ATOM 949 CB SER A 111 63.378 -8.166 -58.200 1.00 0.00 C ATOM 950 OG SER A 111 64.538 -8.343 -58.995 1.00 0.00 O ATOM 0 H SER A 111 64.510 -8.483 -56.022 1.00 0.00 H new ATOM 0 HA SER A 111 64.095 -6.207 -57.686 1.00 0.00 H new ATOM 0 HB2 SER A 111 63.154 -9.090 -57.667 1.00 0.00 H new ATOM 0 HB3 SER A 111 62.523 -7.953 -58.841 1.00 0.00 H new ATOM 0 HG SER A 111 64.393 -9.078 -59.626 1.00 0.00 H new ATOM 956 N ASP A 112 61.926 -6.696 -55.443 1.00 0.00 N ATOM 957 CA ASP A 112 60.662 -6.254 -54.868 1.00 0.00 C ATOM 958 C ASP A 112 60.763 -4.813 -54.378 1.00 0.00 C ATOM 959 O ASP A 112 59.928 -4.351 -53.601 1.00 0.00 O ATOM 960 CB ASP A 112 60.253 -7.171 -53.714 1.00 0.00 C ATOM 961 CG ASP A 112 60.244 -8.633 -54.112 1.00 0.00 C ATOM 962 OD1 ASP A 112 59.714 -8.949 -55.198 1.00 0.00 O ATOM 963 OD2 ASP A 112 60.766 -9.463 -53.338 1.00 0.00 O ATOM 0 H ASP A 112 62.557 -7.146 -54.779 1.00 0.00 H new ATOM 0 HA ASP A 112 59.901 -6.302 -55.646 1.00 0.00 H new ATOM 0 HB2 ASP A 112 60.940 -7.029 -52.880 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.261 -6.887 -53.362 1.00 0.00 H new ATOM 968 N ASN A 113 61.792 -4.108 -54.836 1.00 0.00 N ATOM 969 CA ASN A 113 62.003 -2.719 -54.443 1.00 0.00 C ATOM 970 C ASN A 113 60.785 -1.866 -54.782 1.00 0.00 C ATOM 971 O ASN A 113 59.743 -2.384 -55.187 1.00 0.00 O ATOM 972 CB ASN A 113 63.244 -2.154 -55.137 1.00 0.00 C ATOM 973 CG ASN A 113 64.333 -1.772 -54.153 1.00 0.00 C ATOM 974 OD1 ASN A 113 65.504 -2.099 -54.348 1.00 0.00 O ATOM 975 ND2 ASN A 113 63.951 -1.077 -53.088 1.00 0.00 N ATOM 0 H ASN A 113 62.493 -4.475 -55.480 1.00 0.00 H new ATOM 0 HA ASN A 113 62.154 -2.692 -53.364 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.634 -2.893 -55.837 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.963 -1.278 -55.722 1.00 0.00 H new ATOM 0 HD21 ASN A 113 64.639 -0.792 -52.391 1.00 0.00 H new ATOM 0 HD22 ASN A 113 62.969 -0.828 -52.967 1.00 0.00 H new ATOM 982 N THR A 114 60.922 -0.555 -54.614 1.00 0.00 N ATOM 983 CA THR A 114 59.833 0.371 -54.901 1.00 0.00 C ATOM 984 C THR A 114 59.739 0.663 -56.394 1.00 0.00 C ATOM 985 O THR A 114 60.717 1.077 -57.018 1.00 0.00 O ATOM 986 CB THR A 114 60.008 1.698 -54.140 1.00 0.00 C ATOM 987 OG1 THR A 114 58.966 2.611 -54.500 1.00 0.00 O ATOM 988 CG2 THR A 114 61.362 2.321 -54.443 1.00 0.00 C ATOM 0 H THR A 114 61.777 -0.110 -54.280 1.00 0.00 H new ATOM 0 HA THR A 114 58.913 -0.111 -54.569 1.00 0.00 H new ATOM 0 HB THR A 114 59.953 1.488 -53.072 1.00 0.00 H new ATOM 0 HG1 THR A 114 59.084 3.452 -54.010 1.00 0.00 H new ATOM 0 HG21 THR A 114 61.463 3.257 -53.894 1.00 0.00 H new ATOM 0 HG22 THR A 114 62.154 1.636 -54.140 1.00 0.00 H new ATOM 0 HG23 THR A 114 61.441 2.517 -55.512 1.00 0.00 H new ATOM 996 N TRP A 115 58.558 0.446 -56.962 1.00 0.00 N ATOM 997 CA TRP A 115 58.337 0.688 -58.383 1.00 0.00 C ATOM 998 C TRP A 115 57.801 2.095 -58.619 1.00 0.00 C ATOM 999 O TRP A 115 56.688 2.422 -58.206 1.00 0.00 O ATOM 1000 CB TRP A 115 57.363 -0.345 -58.951 1.00 0.00 C ATOM 1001 CG TRP A 115 57.812 -1.760 -58.748 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.874 -2.438 -57.564 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.264 -2.670 -59.757 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.337 -3.714 -57.777 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.582 -3.882 -59.114 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.428 -2.579 -61.142 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 59.056 -4.991 -59.809 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 58.898 -3.681 -61.831 1.00 0.00 C ATOM 1009 CH2 TRP A 115 59.207 -4.874 -61.164 1.00 0.00 C ATOM 0 H TRP A 115 57.739 0.103 -56.460 1.00 0.00 H new ATOM 0 HA TRP A 115 59.294 0.595 -58.896 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.388 -0.210 -58.483 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.232 -0.162 -60.018 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.600 -2.031 -56.602 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.476 -4.422 -57.056 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.192 -1.664 -61.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 59.296 -5.911 -59.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 59.029 -3.622 -62.901 1.00 0.00 H new ATOM 0 HH2 TRP A 115 59.572 -5.718 -61.731 1.00 0.00 H new ATOM 1020 N SER A 116 58.598 2.924 -59.285 1.00 0.00 N ATOM 1021 CA SER A 116 58.203 4.298 -59.573 1.00 0.00 C ATOM 1022 C SER A 116 57.687 4.427 -61.003 1.00 0.00 C ATOM 1023 O SER A 116 58.156 3.737 -61.908 1.00 0.00 O ATOM 1024 CB SER A 116 59.385 5.246 -59.358 1.00 0.00 C ATOM 1025 OG SER A 116 60.207 5.307 -60.510 1.00 0.00 O ATOM 0 H SER A 116 59.521 2.668 -59.635 1.00 0.00 H new ATOM 0 HA SER A 116 57.399 4.570 -58.889 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.016 6.243 -59.118 1.00 0.00 H new ATOM 0 HB3 SER A 116 59.974 4.910 -58.505 1.00 0.00 H new ATOM 0 HG SER A 116 60.803 4.529 -60.528 1.00 0.00 H new ATOM 1031 N SER A 117 56.719 5.316 -61.198 1.00 0.00 N ATOM 1032 CA SER A 117 56.135 5.534 -62.516 1.00 0.00 C ATOM 1033 C SER A 117 56.903 6.608 -63.280 1.00 0.00 C ATOM 1034 O SER A 117 57.890 7.151 -62.784 1.00 0.00 O ATOM 1035 CB SER A 117 54.665 5.937 -62.386 1.00 0.00 C ATOM 1036 OG SER A 117 54.519 7.072 -61.550 1.00 0.00 O ATOM 0 H SER A 117 56.322 5.897 -60.460 1.00 0.00 H new ATOM 0 HA SER A 117 56.200 4.600 -63.074 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.255 6.153 -63.373 1.00 0.00 H new ATOM 0 HB3 SER A 117 54.091 5.105 -61.978 1.00 0.00 H new ATOM 0 HG SER A 117 53.571 7.310 -61.485 1.00 0.00 H new ATOM 1042 N GLU A 118 56.442 6.910 -64.490 1.00 0.00 N ATOM 1043 CA GLU A 118 57.086 7.919 -65.322 1.00 0.00 C ATOM 1044 C GLU A 118 57.264 9.226 -64.554 1.00 0.00 C ATOM 1045 O GLU A 118 58.205 9.980 -64.801 1.00 0.00 O ATOM 1046 CB GLU A 118 56.265 8.167 -66.589 1.00 0.00 C ATOM 1047 CG GLU A 118 56.684 7.302 -67.765 1.00 0.00 C ATOM 1048 CD GLU A 118 56.118 7.795 -69.083 1.00 0.00 C ATOM 1049 OE1 GLU A 118 54.884 7.960 -69.174 1.00 0.00 O ATOM 1050 OE2 GLU A 118 56.910 8.016 -70.023 1.00 0.00 O ATOM 0 H GLU A 118 55.626 6.471 -64.915 1.00 0.00 H new ATOM 0 HA GLU A 118 58.071 7.546 -65.603 1.00 0.00 H new ATOM 0 HB2 GLU A 118 55.213 7.984 -66.371 1.00 0.00 H new ATOM 0 HB3 GLU A 118 56.355 9.216 -66.870 1.00 0.00 H new ATOM 0 HG2 GLU A 118 57.772 7.281 -67.826 1.00 0.00 H new ATOM 0 HG3 GLU A 118 56.355 6.277 -67.593 1.00 0.00 H new ATOM 1057 N ALA A 119 56.353 9.486 -63.622 1.00 0.00 N ATOM 1058 CA ALA A 119 56.409 10.700 -62.817 1.00 0.00 C ATOM 1059 C ALA A 119 57.769 10.849 -62.143 1.00 0.00 C ATOM 1060 O ALA A 119 58.263 11.961 -61.959 1.00 0.00 O ATOM 1061 CB ALA A 119 55.300 10.694 -61.776 1.00 0.00 C ATOM 0 H ALA A 119 55.568 8.872 -63.406 1.00 0.00 H new ATOM 0 HA ALA A 119 56.266 11.553 -63.480 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.354 11.606 -61.182 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.332 10.643 -62.275 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.418 9.829 -61.124 1.00 0.00 H new ATOM 1067 N ASP A 120 58.369 9.722 -61.777 1.00 0.00 N ATOM 1068 CA ASP A 120 59.673 9.727 -61.123 1.00 0.00 C ATOM 1069 C ASP A 120 60.793 9.891 -62.146 1.00 0.00 C ATOM 1070 O ASP A 120 61.877 10.377 -61.821 1.00 0.00 O ATOM 1071 CB ASP A 120 59.875 8.435 -60.330 1.00 0.00 C ATOM 1072 CG ASP A 120 60.768 8.631 -59.121 1.00 0.00 C ATOM 1073 OD1 ASP A 120 61.796 9.330 -59.249 1.00 0.00 O ATOM 1074 OD2 ASP A 120 60.439 8.088 -58.046 1.00 0.00 O ATOM 0 H ASP A 120 57.974 8.793 -61.922 1.00 0.00 H new ATOM 0 HA ASP A 120 59.705 10.573 -60.437 1.00 0.00 H new ATOM 0 HB2 ASP A 120 58.906 8.057 -60.005 1.00 0.00 H new ATOM 0 HB3 ASP A 120 60.311 7.677 -60.981 1.00 0.00 H new ATOM 1079 N CYS A 121 60.524 9.482 -63.380 1.00 0.00 N ATOM 1080 CA CYS A 121 61.510 9.581 -64.451 1.00 0.00 C ATOM 1081 C CYS A 121 62.070 10.997 -64.543 1.00 0.00 C ATOM 1082 O CYS A 121 63.272 11.188 -64.729 1.00 0.00 O ATOM 1083 CB CYS A 121 60.885 9.179 -65.787 1.00 0.00 C ATOM 1084 SG CYS A 121 62.065 9.079 -67.154 1.00 0.00 S ATOM 0 H CYS A 121 59.631 9.079 -63.665 1.00 0.00 H new ATOM 0 HA CYS A 121 62.329 8.899 -64.222 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.397 8.211 -65.671 1.00 0.00 H new ATOM 0 HB3 CYS A 121 60.108 9.899 -66.044 1.00 0.00 H new ATOM 0 HG CYS A 121 61.442 8.730 -68.240 1.00 0.00 H new ATOM 1090 N SER A 122 61.191 11.986 -64.415 1.00 0.00 N ATOM 1091 CA SER A 122 61.598 13.384 -64.489 1.00 0.00 C ATOM 1092 C SER A 122 62.394 13.785 -63.251 1.00 0.00 C ATOM 1093 O SER A 122 63.223 14.692 -63.299 1.00 0.00 O ATOM 1094 CB SER A 122 60.371 14.286 -64.635 1.00 0.00 C ATOM 1095 OG SER A 122 60.751 15.627 -64.893 1.00 0.00 O ATOM 0 H SER A 122 60.193 11.845 -64.260 1.00 0.00 H new ATOM 0 HA SER A 122 62.236 13.505 -65.364 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.742 13.921 -65.447 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.774 14.243 -63.724 1.00 0.00 H new ATOM 0 HG SER A 122 59.949 16.183 -64.984 1.00 0.00 H new ATOM 1101 N GLY A 123 62.134 13.101 -62.141 1.00 0.00 N ATOM 1102 CA GLY A 123 62.833 13.400 -60.905 1.00 0.00 C ATOM 1103 C GLY A 123 64.230 12.813 -60.872 1.00 0.00 C ATOM 1104 O GLY A 123 65.174 13.463 -60.423 1.00 0.00 O ATOM 0 H GLY A 123 61.452 12.345 -62.076 1.00 0.00 H new ATOM 0 HA2 GLY A 123 62.893 14.481 -60.778 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.259 13.012 -60.064 1.00 0.00 H new ATOM 1108 N CYS A 124 64.362 11.580 -61.348 1.00 0.00 N ATOM 1109 CA CYS A 124 65.655 10.903 -61.369 1.00 0.00 C ATOM 1110 C CYS A 124 66.055 10.540 -62.796 1.00 0.00 C ATOM 1111 O CYS A 124 66.568 9.451 -63.050 1.00 0.00 O ATOM 1112 CB CYS A 124 65.608 9.643 -60.504 1.00 0.00 C ATOM 1113 SG CYS A 124 64.884 9.898 -58.867 1.00 0.00 S ATOM 0 H CYS A 124 63.591 11.029 -61.724 1.00 0.00 H new ATOM 0 HA CYS A 124 66.402 11.586 -60.964 1.00 0.00 H new ATOM 0 HB2 CYS A 124 65.036 8.877 -61.027 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.621 9.259 -60.386 1.00 0.00 H new ATOM 0 HG CYS A 124 63.602 9.688 -58.922 1.00 0.00 H new ATOM 1119 N LYS A 125 65.815 11.460 -63.724 1.00 0.00 N ATOM 1120 CA LYS A 125 66.149 11.239 -65.126 1.00 0.00 C ATOM 1121 C LYS A 125 67.591 10.765 -65.273 1.00 0.00 C ATOM 1122 O LYS A 125 67.873 9.831 -66.023 1.00 0.00 O ATOM 1123 CB LYS A 125 65.939 12.524 -65.931 1.00 0.00 C ATOM 1124 CG LYS A 125 64.748 12.464 -66.871 1.00 0.00 C ATOM 1125 CD LYS A 125 64.965 13.330 -68.101 1.00 0.00 C ATOM 1126 CE LYS A 125 65.485 12.512 -69.274 1.00 0.00 C ATOM 1127 NZ LYS A 125 65.654 13.342 -70.498 1.00 0.00 N ATOM 0 H LYS A 125 65.390 12.367 -63.530 1.00 0.00 H new ATOM 0 HA LYS A 125 65.488 10.463 -65.513 1.00 0.00 H new ATOM 0 HB2 LYS A 125 65.805 13.357 -65.241 1.00 0.00 H new ATOM 0 HB3 LYS A 125 66.839 12.731 -66.510 1.00 0.00 H new ATOM 0 HG2 LYS A 125 64.576 11.432 -67.177 1.00 0.00 H new ATOM 0 HG3 LYS A 125 63.852 12.794 -66.346 1.00 0.00 H new ATOM 0 HD2 LYS A 125 64.027 13.811 -68.379 1.00 0.00 H new ATOM 0 HD3 LYS A 125 65.674 14.125 -67.867 1.00 0.00 H new ATOM 0 HE2 LYS A 125 66.440 12.061 -69.007 1.00 0.00 H new ATOM 0 HE3 LYS A 125 64.794 11.695 -69.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 66.010 12.748 -71.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 64.737 13.752 -70.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 66.333 14.106 -70.308 1.00 0.00 H new ATOM 1141 N GLN A 126 68.499 11.414 -64.551 1.00 0.00 N ATOM 1142 CA GLN A 126 69.912 11.056 -64.602 1.00 0.00 C ATOM 1143 C GLN A 126 70.105 9.563 -64.360 1.00 0.00 C ATOM 1144 O GLN A 126 70.917 8.916 -65.023 1.00 0.00 O ATOM 1145 CB GLN A 126 70.700 11.859 -63.565 1.00 0.00 C ATOM 1146 CG GLN A 126 70.051 11.881 -62.191 1.00 0.00 C ATOM 1147 CD GLN A 126 70.914 12.563 -61.148 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.683 13.473 -61.460 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.792 12.126 -59.900 1.00 0.00 N ATOM 0 H GLN A 126 68.282 12.189 -63.925 1.00 0.00 H new ATOM 0 HA GLN A 126 70.286 11.295 -65.598 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.702 11.439 -63.478 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.813 12.883 -63.920 1.00 0.00 H new ATOM 0 HG2 GLN A 126 69.092 12.394 -62.255 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.845 10.859 -61.874 1.00 0.00 H new ATOM 0 HE21 GLN A 126 70.142 11.369 -59.686 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.348 12.547 -59.156 1.00 0.00 H new ATOM 1158 N LEU A 127 69.355 9.021 -63.407 1.00 0.00 N ATOM 1159 CA LEU A 127 69.444 7.603 -63.077 1.00 0.00 C ATOM 1160 C LEU A 127 68.814 6.749 -64.172 1.00 0.00 C ATOM 1161 O LEU A 127 69.384 5.742 -64.592 1.00 0.00 O ATOM 1162 CB LEU A 127 68.756 7.327 -61.739 1.00 0.00 C ATOM 1163 CG LEU A 127 69.124 8.264 -60.588 1.00 0.00 C ATOM 1164 CD1 LEU A 127 68.596 7.722 -59.269 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.632 8.459 -60.521 1.00 0.00 C ATOM 0 H LEU A 127 68.678 9.542 -62.849 1.00 0.00 H new ATOM 0 HA LEU A 127 70.498 7.339 -62.998 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.678 7.377 -61.891 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.989 6.306 -61.438 1.00 0.00 H new ATOM 0 HG LEU A 127 68.660 9.233 -60.771 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.867 8.402 -58.461 1.00 0.00 H new ATOM 0 HD12 LEU A 127 67.511 7.634 -59.320 1.00 0.00 H new ATOM 0 HD13 LEU A 127 69.031 6.741 -59.079 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.876 9.129 -59.696 1.00 0.00 H new ATOM 0 HD22 LEU A 127 71.117 7.496 -60.362 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.985 8.893 -61.457 1.00 0.00 H new ATOM 1177 N ILE A 128 67.636 7.158 -64.631 1.00 0.00 N ATOM 1178 CA ILE A 128 66.931 6.432 -65.679 1.00 0.00 C ATOM 1179 C ILE A 128 67.836 6.187 -66.882 1.00 0.00 C ATOM 1180 O ILE A 128 67.902 5.074 -67.403 1.00 0.00 O ATOM 1181 CB ILE A 128 65.674 7.193 -66.143 1.00 0.00 C ATOM 1182 CG1 ILE A 128 64.722 7.415 -64.966 1.00 0.00 C ATOM 1183 CG2 ILE A 128 64.976 6.431 -67.260 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.302 6.135 -64.279 1.00 0.00 C ATOM 0 H ILE A 128 67.150 7.989 -64.293 1.00 0.00 H new ATOM 0 HA ILE A 128 66.630 5.475 -65.253 1.00 0.00 H new ATOM 0 HB ILE A 128 65.978 8.166 -66.528 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.204 8.068 -64.238 1.00 0.00 H new ATOM 0 HG13 ILE A 128 63.833 7.936 -65.322 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.090 6.981 -67.577 1.00 0.00 H new ATOM 0 HG22 ILE A 128 65.656 6.320 -68.105 1.00 0.00 H new ATOM 0 HG23 ILE A 128 64.681 5.445 -66.899 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.628 6.369 -63.455 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.791 5.489 -64.993 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.183 5.623 -63.893 1.00 0.00 H new ATOM 1196 N GLU A 129 68.532 7.233 -67.315 1.00 0.00 N ATOM 1197 CA GLU A 129 69.434 7.129 -68.456 1.00 0.00 C ATOM 1198 C GLU A 129 70.727 6.420 -68.065 1.00 0.00 C ATOM 1199 O GLU A 129 71.259 5.612 -68.826 1.00 0.00 O ATOM 1200 CB GLU A 129 69.751 8.519 -69.012 1.00 0.00 C ATOM 1201 CG GLU A 129 70.425 9.438 -68.007 1.00 0.00 C ATOM 1202 CD GLU A 129 70.494 10.875 -68.485 1.00 0.00 C ATOM 1203 OE1 GLU A 129 69.510 11.345 -69.094 1.00 0.00 O ATOM 1204 OE2 GLU A 129 71.532 11.529 -68.251 1.00 0.00 O ATOM 0 H GLU A 129 68.489 8.161 -66.894 1.00 0.00 H new ATOM 0 HA GLU A 129 68.936 6.541 -69.227 1.00 0.00 H new ATOM 0 HB2 GLU A 129 70.396 8.414 -69.884 1.00 0.00 H new ATOM 0 HB3 GLU A 129 68.826 8.984 -69.353 1.00 0.00 H new ATOM 0 HG2 GLU A 129 69.881 9.399 -67.063 1.00 0.00 H new ATOM 0 HG3 GLU A 129 71.434 9.076 -67.809 1.00 0.00 H new ATOM 1211 N ALA A 130 71.227 6.728 -66.873 1.00 0.00 N ATOM 1212 CA ALA A 130 72.456 6.119 -66.379 1.00 0.00 C ATOM 1213 C ALA A 130 72.351 4.598 -66.372 1.00 0.00 C ATOM 1214 O ALA A 130 73.280 3.900 -66.780 1.00 0.00 O ATOM 1215 CB ALA A 130 72.776 6.635 -64.983 1.00 0.00 C ATOM 0 H ALA A 130 70.800 7.396 -66.231 1.00 0.00 H new ATOM 0 HA ALA A 130 73.267 6.397 -67.052 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.696 6.172 -64.626 1.00 0.00 H new ATOM 0 HB2 ALA A 130 72.903 7.717 -65.015 1.00 0.00 H new ATOM 0 HB3 ALA A 130 71.958 6.386 -64.307 1.00 0.00 H new ATOM 1221 N TYR A 131 71.215 4.090 -65.906 1.00 0.00 N ATOM 1222 CA TYR A 131 70.991 2.651 -65.843 1.00 0.00 C ATOM 1223 C TYR A 131 71.157 2.013 -67.219 1.00 0.00 C ATOM 1224 O TYR A 131 71.593 0.868 -67.335 1.00 0.00 O ATOM 1225 CB TYR A 131 69.593 2.355 -65.297 1.00 0.00 C ATOM 1226 CG TYR A 131 69.371 0.899 -64.957 1.00 0.00 C ATOM 1227 CD1 TYR A 131 70.228 0.228 -64.093 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.304 0.194 -65.500 1.00 0.00 C ATOM 1229 CE1 TYR A 131 70.029 -1.103 -63.781 1.00 0.00 C ATOM 1230 CE2 TYR A 131 68.097 -1.137 -65.192 1.00 0.00 C ATOM 1231 CZ TYR A 131 68.962 -1.781 -64.333 1.00 0.00 C ATOM 1232 OH TYR A 131 68.760 -3.107 -64.024 1.00 0.00 O ATOM 0 H TYR A 131 70.436 4.654 -65.567 1.00 0.00 H new ATOM 0 HA TYR A 131 71.735 2.222 -65.171 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.426 2.957 -64.404 1.00 0.00 H new ATOM 0 HB3 TYR A 131 68.852 2.664 -66.034 1.00 0.00 H new ATOM 0 HD1 TYR A 131 71.064 0.756 -63.658 1.00 0.00 H new ATOM 0 HD2 TYR A 131 67.625 0.695 -66.174 1.00 0.00 H new ATOM 0 HE1 TYR A 131 70.705 -1.610 -63.109 1.00 0.00 H new ATOM 0 HE2 TYR A 131 67.262 -1.670 -65.622 1.00 0.00 H new ATOM 0 HH TYR A 131 68.275 -3.175 -63.175 1.00 0.00 H new ATOM 1242 N TRP A 132 70.807 2.763 -68.257 1.00 0.00 N ATOM 1243 CA TRP A 132 70.918 2.273 -69.626 1.00 0.00 C ATOM 1244 C TRP A 132 72.350 2.398 -70.135 1.00 0.00 C ATOM 1245 O TRP A 132 72.841 1.528 -70.853 1.00 0.00 O ATOM 1246 CB TRP A 132 69.968 3.043 -70.544 1.00 0.00 C ATOM 1247 CG TRP A 132 68.528 2.673 -70.354 1.00 0.00 C ATOM 1248 CD1 TRP A 132 67.837 2.647 -69.176 1.00 0.00 C ATOM 1249 CD2 TRP A 132 67.603 2.274 -71.372 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.539 2.256 -69.400 1.00 0.00 N ATOM 1251 CE2 TRP A 132 66.370 2.022 -70.739 1.00 0.00 C ATOM 1252 CE3 TRP A 132 67.697 2.107 -72.756 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 65.242 1.612 -71.445 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 66.577 1.700 -73.455 1.00 0.00 C ATOM 1255 CH2 TRP A 132 65.362 1.457 -72.799 1.00 0.00 C ATOM 0 H TRP A 132 70.444 3.713 -68.177 1.00 0.00 H new ATOM 0 HA TRP A 132 70.642 1.219 -69.631 1.00 0.00 H new ATOM 0 HB2 TRP A 132 70.088 4.111 -70.365 1.00 0.00 H new ATOM 0 HB3 TRP A 132 70.249 2.860 -71.581 1.00 0.00 H new ATOM 0 HD1 TRP A 132 68.250 2.897 -68.210 1.00 0.00 H new ATOM 0 HE1 TRP A 132 65.818 2.156 -68.685 1.00 0.00 H new ATOM 0 HE3 TRP A 132 68.628 2.293 -73.270 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 64.305 1.423 -70.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 66.638 1.567 -74.525 1.00 0.00 H new ATOM 0 HH2 TRP A 132 64.504 1.141 -73.374 1.00 0.00 H new ATOM 1266 N ASN A 133 73.014 3.486 -69.759 1.00 0.00 N ATOM 1267 CA ASN A 133 74.390 3.724 -70.179 1.00 0.00 C ATOM 1268 C ASN A 133 75.277 2.531 -69.838 1.00 0.00 C ATOM 1269 O ASN A 133 76.265 2.265 -70.522 1.00 0.00 O ATOM 1270 CB ASN A 133 74.937 4.988 -69.511 1.00 0.00 C ATOM 1271 CG ASN A 133 76.451 5.061 -69.567 1.00 0.00 C ATOM 1272 OD1 ASN A 133 77.042 5.111 -70.646 1.00 0.00 O ATOM 1273 ND2 ASN A 133 77.086 5.069 -68.400 1.00 0.00 N ATOM 0 H ASN A 133 72.622 4.216 -69.165 1.00 0.00 H new ATOM 0 HA ASN A 133 74.395 3.860 -71.260 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.515 5.866 -70.000 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.613 5.016 -68.471 1.00 0.00 H new ATOM 0 HD21 ASN A 133 78.104 5.118 -68.374 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.555 5.026 -67.530 1.00 0.00 H new ATOM 1280 N GLU A 134 74.916 1.815 -68.778 1.00 0.00 N ATOM 1281 CA GLU A 134 75.680 0.650 -68.347 1.00 0.00 C ATOM 1282 C GLU A 134 75.741 -0.400 -69.453 1.00 0.00 C ATOM 1283 O GLU A 134 76.694 -1.175 -69.536 1.00 0.00 O ATOM 1284 CB GLU A 134 75.060 0.044 -67.087 1.00 0.00 C ATOM 1285 CG GLU A 134 76.002 0.021 -65.895 1.00 0.00 C ATOM 1286 CD GLU A 134 76.674 1.359 -65.656 1.00 0.00 C ATOM 1287 OE1 GLU A 134 75.991 2.286 -65.171 1.00 0.00 O ATOM 1288 OE2 GLU A 134 77.880 1.480 -65.954 1.00 0.00 O ATOM 0 H GLU A 134 74.100 2.021 -68.202 1.00 0.00 H new ATOM 0 HA GLU A 134 76.696 0.976 -68.123 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.167 0.611 -66.823 1.00 0.00 H new ATOM 0 HB3 GLU A 134 74.738 -0.974 -67.305 1.00 0.00 H new ATOM 0 HG2 GLU A 134 75.446 -0.266 -65.003 1.00 0.00 H new ATOM 0 HG3 GLU A 134 76.765 -0.741 -66.054 1.00 0.00 H new ATOM 1295 N HIS A 135 74.716 -0.419 -70.300 1.00 0.00 N ATOM 1296 CA HIS A 135 74.653 -1.373 -71.401 1.00 0.00 C ATOM 1297 C HIS A 135 75.697 -1.047 -72.464 1.00 0.00 C ATOM 1298 O HIS A 135 76.149 -1.926 -73.196 1.00 0.00 O ATOM 1299 CB HIS A 135 73.256 -1.373 -72.024 1.00 0.00 C ATOM 1300 CG HIS A 135 72.943 -2.619 -72.793 1.00 0.00 C ATOM 1301 ND1 HIS A 135 72.832 -3.860 -72.203 1.00 0.00 N ATOM 1302 CD2 HIS A 135 72.716 -2.810 -74.114 1.00 0.00 C ATOM 1303 CE1 HIS A 135 72.551 -4.761 -73.127 1.00 0.00 C ATOM 1304 NE2 HIS A 135 72.475 -4.150 -74.296 1.00 0.00 N ATOM 0 H HIS A 135 73.919 0.215 -70.245 1.00 0.00 H new ATOM 0 HA HIS A 135 74.865 -2.365 -71.002 1.00 0.00 H new ATOM 0 HB2 HIS A 135 72.515 -1.248 -71.234 1.00 0.00 H new ATOM 0 HB3 HIS A 135 73.163 -0.513 -72.688 1.00 0.00 H new ATOM 0 HD2 HIS A 135 72.723 -2.050 -74.882 1.00 0.00 H new ATOM 0 HE1 HIS A 135 72.408 -5.818 -72.956 1.00 0.00 H new ATOM 0 HE2 HIS A 135 72.271 -4.600 -75.188 1.00 0.00 H new ATOM 1312 N GLY A 136 76.075 0.226 -72.544 1.00 0.00 N ATOM 1313 CA GLY A 136 77.062 0.646 -73.522 1.00 0.00 C ATOM 1314 C GLY A 136 76.442 1.383 -74.692 1.00 0.00 C ATOM 1315 O GLY A 136 76.912 1.271 -75.824 1.00 0.00 O ATOM 0 H GLY A 136 75.716 0.973 -71.950 1.00 0.00 H new ATOM 0 HA2 GLY A 136 77.796 1.290 -73.039 1.00 0.00 H new ATOM 0 HA3 GLY A 136 77.599 -0.228 -73.891 1.00 0.00 H new