USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 699 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 TYR OH : rot -20:sc= -0.442 USER MOD Set 1.2: A 138 GLN : amide:sc= -0.67 K(o=-1.1,f=-7!) USER MOD Set 2.1: A 82 HIS : no HE2:sc= -6.53! C(o=-6!,f=-5.7!) USER MOD Set 2.2: A 85 SER OG : rot 104:sc= 0.498 USER MOD Single : A 61 LYS NZ :NH3+ 164:sc= -0.0254 (180deg=-0.321) USER MOD Single : A 65 ASN : amide:sc= -2.04! C(o=-2!,f=-2.8!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.226 K(o=-0.23,f=-1.6!) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -23:sc= 0.894 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 HIS : no HD1:sc= -0.146 K(o=-0.15,f=-0.83) USER MOD Single : A 105 ASN : amide:sc= -1.47! C(o=-1.5!,f=-6.6!) USER MOD Single : A 106 ASN : amide:sc= -0.293 K(o=-0.29,f=-1.5!) USER MOD Single : A 109 ASN : amide:sc= -0.69 K(o=-0.69,f=-4.6!) USER MOD Single : A 119 THR OG1 : rot 34:sc= -0.183 USER MOD Single : A 122 ASN : amide:sc= -1.44 X(o=-1.4,f=-1.1) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -1.86 K(o=-1.9,f=-6!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 170:sc= -0.555 USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -12.613 -6.192 -6.561 1.00 0.00 N ATOM 417 CA GLY A 54 -12.795 -5.687 -5.169 1.00 0.00 C ATOM 418 C GLY A 54 -11.551 -6.006 -4.340 1.00 0.00 C ATOM 419 O GLY A 54 -11.464 -5.649 -3.182 1.00 0.00 O ATOM 0 HA2 GLY A 54 -12.970 -4.611 -5.182 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.673 -6.147 -4.717 1.00 0.00 H new ATOM 423 N LEU A 55 -10.585 -6.677 -4.926 1.00 0.00 N ATOM 424 CA LEU A 55 -9.330 -7.031 -4.186 1.00 0.00 C ATOM 425 C LEU A 55 -8.132 -6.314 -4.820 1.00 0.00 C ATOM 426 O LEU A 55 -8.117 -6.018 -5.998 1.00 0.00 O ATOM 427 CB LEU A 55 -9.125 -8.567 -4.232 1.00 0.00 C ATOM 428 CG LEU A 55 -9.136 -9.155 -2.806 1.00 0.00 C ATOM 429 CD1 LEU A 55 -7.962 -8.570 -1.988 1.00 0.00 C ATOM 430 CD2 LEU A 55 -10.483 -8.840 -2.110 1.00 0.00 C ATOM 0 H LEU A 55 -10.614 -6.997 -5.894 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.415 -6.713 -3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.913 -9.028 -4.828 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.179 -8.799 -4.721 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.020 -10.237 -2.867 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.975 -8.989 -0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.019 -8.822 -2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.063 -7.486 -1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.480 -9.260 -1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -10.619 -7.760 -2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -11.300 -9.278 -2.683 1.00 0.00 H new ATOM 442 N ALA A 56 -7.129 -6.044 -4.029 1.00 0.00 N ATOM 443 CA ALA A 56 -5.915 -5.353 -4.546 1.00 0.00 C ATOM 444 C ALA A 56 -4.692 -5.878 -3.791 1.00 0.00 C ATOM 445 O ALA A 56 -4.800 -6.379 -2.688 1.00 0.00 O ATOM 446 CB ALA A 56 -6.051 -3.848 -4.320 1.00 0.00 C ATOM 0 H ALA A 56 -7.100 -6.276 -3.036 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.802 -5.545 -5.613 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.163 -3.342 -4.698 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.931 -3.479 -4.847 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.156 -3.648 -3.254 1.00 0.00 H new ATOM 452 N LEU A 57 -3.531 -5.776 -4.382 1.00 0.00 N ATOM 453 CA LEU A 57 -2.293 -6.278 -3.709 1.00 0.00 C ATOM 454 C LEU A 57 -1.160 -5.274 -3.920 1.00 0.00 C ATOM 455 O LEU A 57 -1.281 -4.324 -4.674 1.00 0.00 O ATOM 456 CB LEU A 57 -1.899 -7.643 -4.301 1.00 0.00 C ATOM 457 CG LEU A 57 -2.262 -7.699 -5.789 1.00 0.00 C ATOM 458 CD1 LEU A 57 -1.544 -6.575 -6.549 1.00 0.00 C ATOM 459 CD2 LEU A 57 -1.836 -9.057 -6.354 1.00 0.00 C ATOM 0 H LEU A 57 -3.385 -5.366 -5.304 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.479 -6.394 -2.641 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.829 -7.808 -4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.411 -8.442 -3.764 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.338 -7.570 -5.906 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.808 -6.623 -7.605 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.847 -5.610 -6.143 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.466 -6.692 -6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.090 -9.107 -7.413 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.760 -9.180 -6.233 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.354 -9.853 -5.819 1.00 0.00 H new ATOM 471 N LEU A 58 -0.059 -5.490 -3.252 1.00 0.00 N ATOM 472 CA LEU A 58 1.115 -4.574 -3.381 1.00 0.00 C ATOM 473 C LEU A 58 2.297 -5.371 -3.929 1.00 0.00 C ATOM 474 O LEU A 58 2.573 -6.468 -3.483 1.00 0.00 O ATOM 475 CB LEU A 58 1.466 -4.016 -1.995 1.00 0.00 C ATOM 476 CG LEU A 58 0.472 -2.901 -1.603 1.00 0.00 C ATOM 477 CD1 LEU A 58 0.396 -2.791 -0.076 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.944 -1.553 -2.166 1.00 0.00 C ATOM 0 H LEU A 58 0.080 -6.273 -2.613 1.00 0.00 H new ATOM 0 HA LEU A 58 0.883 -3.750 -4.055 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.437 -4.816 -1.255 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.482 -3.622 -2.000 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.508 -3.149 -2.011 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.306 -2.003 0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.058 -3.740 0.341 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.382 -2.552 0.321 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.236 -0.773 -1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.928 -1.314 -1.761 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.004 -1.613 -3.253 1.00 0.00 H new ATOM 490 N VAL A 59 2.991 -4.828 -4.897 1.00 0.00 N ATOM 491 CA VAL A 59 4.162 -5.544 -5.493 1.00 0.00 C ATOM 492 C VAL A 59 5.429 -4.733 -5.230 1.00 0.00 C ATOM 493 O VAL A 59 5.484 -3.545 -5.476 1.00 0.00 O ATOM 494 CB VAL A 59 3.948 -5.688 -7.001 1.00 0.00 C ATOM 495 CG1 VAL A 59 5.129 -6.445 -7.614 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.647 -6.458 -7.260 1.00 0.00 C ATOM 0 H VAL A 59 2.796 -3.913 -5.303 1.00 0.00 H new ATOM 0 HA VAL A 59 4.262 -6.532 -5.045 1.00 0.00 H new ATOM 0 HB VAL A 59 3.879 -4.700 -7.457 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.977 -6.548 -8.688 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.050 -5.893 -7.429 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.202 -7.434 -7.162 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.493 -6.561 -8.334 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.713 -7.447 -6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.809 -5.914 -6.824 1.00 0.00 H new ATOM 506 N VAL A 60 6.444 -5.371 -4.724 1.00 0.00 N ATOM 507 CA VAL A 60 7.714 -4.653 -4.430 1.00 0.00 C ATOM 508 C VAL A 60 8.408 -4.262 -5.736 1.00 0.00 C ATOM 509 O VAL A 60 8.514 -5.050 -6.655 1.00 0.00 O ATOM 510 CB VAL A 60 8.624 -5.569 -3.606 1.00 0.00 C ATOM 511 CG1 VAL A 60 10.053 -4.999 -3.552 1.00 0.00 C ATOM 512 CG2 VAL A 60 8.056 -5.687 -2.187 1.00 0.00 C ATOM 0 H VAL A 60 6.449 -6.366 -4.500 1.00 0.00 H new ATOM 0 HA VAL A 60 7.500 -3.746 -3.865 1.00 0.00 H new ATOM 0 HB VAL A 60 8.664 -6.553 -4.073 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.687 -5.662 -2.963 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.452 -4.920 -4.563 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.034 -4.011 -3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.697 -6.337 -1.592 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.015 -4.699 -1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.052 -6.108 -2.231 1.00 0.00 H new ATOM 522 N LYS A 61 8.884 -3.044 -5.817 1.00 0.00 N ATOM 523 CA LYS A 61 9.580 -2.576 -7.056 1.00 0.00 C ATOM 524 C LYS A 61 11.094 -2.535 -6.804 1.00 0.00 C ATOM 525 O LYS A 61 11.792 -1.669 -7.292 1.00 0.00 O ATOM 526 CB LYS A 61 9.079 -1.172 -7.423 1.00 0.00 C ATOM 527 CG LYS A 61 9.431 -0.852 -8.889 1.00 0.00 C ATOM 528 CD LYS A 61 8.355 -1.415 -9.828 1.00 0.00 C ATOM 529 CE LYS A 61 8.668 -1.002 -11.265 1.00 0.00 C ATOM 530 NZ LYS A 61 9.930 -1.665 -11.704 1.00 0.00 N ATOM 0 H LYS A 61 8.820 -2.349 -5.073 1.00 0.00 H new ATOM 0 HA LYS A 61 9.368 -3.261 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.000 -1.113 -7.278 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.530 -0.432 -6.762 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.513 0.227 -9.024 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.402 -1.279 -9.139 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.321 -2.502 -9.750 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.372 -1.043 -9.537 1.00 0.00 H new ATOM 0 HE2 LYS A 61 7.847 -1.284 -11.924 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.771 0.081 -11.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.007 -1.614 -12.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.744 -1.183 -11.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.920 -2.662 -11.407 1.00 0.00 H new ATOM 544 N ARG A 62 11.602 -3.475 -6.043 1.00 0.00 N ATOM 545 CA ARG A 62 13.072 -3.524 -5.743 1.00 0.00 C ATOM 546 C ARG A 62 13.629 -4.909 -6.086 1.00 0.00 C ATOM 547 O ARG A 62 12.974 -5.917 -5.920 1.00 0.00 O ATOM 548 CB ARG A 62 13.307 -3.233 -4.259 1.00 0.00 C ATOM 549 CG ARG A 62 13.116 -1.741 -4.000 1.00 0.00 C ATOM 550 CD ARG A 62 13.315 -1.458 -2.515 1.00 0.00 C ATOM 551 NE ARG A 62 14.718 -1.790 -2.130 1.00 0.00 N ATOM 552 CZ ARG A 62 15.672 -0.907 -2.275 1.00 0.00 C ATOM 553 NH1 ARG A 62 15.407 0.277 -2.760 1.00 0.00 N ATOM 554 NH2 ARG A 62 16.895 -1.211 -1.937 1.00 0.00 N ATOM 0 H ARG A 62 11.055 -4.220 -5.611 1.00 0.00 H new ATOM 0 HA ARG A 62 13.582 -2.772 -6.345 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.613 -3.811 -3.649 1.00 0.00 H new ATOM 0 HB3 ARG A 62 14.313 -3.538 -3.972 1.00 0.00 H new ATOM 0 HG2 ARG A 62 13.827 -1.164 -4.591 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.118 -1.431 -4.311 1.00 0.00 H new ATOM 0 HD2 ARG A 62 13.106 -0.409 -2.302 1.00 0.00 H new ATOM 0 HD3 ARG A 62 12.615 -2.048 -1.924 1.00 0.00 H new ATOM 0 HE ARG A 62 14.935 -2.712 -1.751 1.00 0.00 H new ATOM 0 HH11 ARG A 62 14.452 0.517 -3.028 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.155 0.962 -2.871 1.00 0.00 H new ATOM 0 HH21 ARG A 62 17.105 -2.135 -1.561 1.00 0.00 H new ATOM 0 HH22 ARG A 62 17.641 -0.524 -2.049 1.00 0.00 H new ATOM 568 N GLY A 63 14.840 -4.948 -6.572 1.00 0.00 N ATOM 569 CA GLY A 63 15.473 -6.247 -6.954 1.00 0.00 C ATOM 570 C GLY A 63 15.654 -7.149 -5.730 1.00 0.00 C ATOM 571 O GLY A 63 15.170 -8.265 -5.703 1.00 0.00 O ATOM 0 H GLY A 63 15.426 -4.127 -6.723 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.854 -6.753 -7.695 1.00 0.00 H new ATOM 0 HA3 GLY A 63 16.441 -6.061 -7.420 1.00 0.00 H new ATOM 575 N PRO A 64 16.351 -6.680 -4.728 1.00 0.00 N ATOM 576 CA PRO A 64 16.601 -7.473 -3.491 1.00 0.00 C ATOM 577 C PRO A 64 15.321 -8.139 -2.974 1.00 0.00 C ATOM 578 O PRO A 64 15.340 -9.251 -2.486 1.00 0.00 O ATOM 579 CB PRO A 64 17.118 -6.429 -2.488 1.00 0.00 C ATOM 580 CG PRO A 64 17.734 -5.350 -3.328 1.00 0.00 C ATOM 581 CD PRO A 64 16.983 -5.350 -4.669 1.00 0.00 C ATOM 0 HA PRO A 64 17.302 -8.290 -3.659 1.00 0.00 H new ATOM 0 HB2 PRO A 64 16.307 -6.036 -1.875 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.850 -6.865 -1.808 1.00 0.00 H new ATOM 0 HG2 PRO A 64 17.648 -4.381 -2.837 1.00 0.00 H new ATOM 0 HG3 PRO A 64 18.797 -5.537 -3.480 1.00 0.00 H new ATOM 0 HD2 PRO A 64 16.240 -4.554 -4.710 1.00 0.00 H new ATOM 0 HD3 PRO A 64 17.663 -5.194 -5.507 1.00 0.00 H new ATOM 589 N ASN A 65 14.209 -7.461 -3.090 1.00 0.00 N ATOM 590 CA ASN A 65 12.902 -8.027 -2.625 1.00 0.00 C ATOM 591 C ASN A 65 11.940 -8.121 -3.818 1.00 0.00 C ATOM 592 O ASN A 65 10.735 -8.099 -3.660 1.00 0.00 O ATOM 593 CB ASN A 65 12.320 -7.106 -1.545 1.00 0.00 C ATOM 594 CG ASN A 65 12.984 -7.406 -0.198 1.00 0.00 C ATOM 595 OD1 ASN A 65 13.880 -8.221 -0.119 1.00 0.00 O ATOM 596 ND2 ASN A 65 12.570 -6.785 0.874 1.00 0.00 N ATOM 0 H ASN A 65 14.148 -6.526 -3.493 1.00 0.00 H new ATOM 0 HA ASN A 65 13.047 -9.024 -2.208 1.00 0.00 H new ATOM 0 HB2 ASN A 65 12.482 -6.063 -1.817 1.00 0.00 H new ATOM 0 HB3 ASN A 65 11.242 -7.252 -1.471 1.00 0.00 H new ATOM 0 HD21 ASN A 65 13.000 -6.985 1.777 1.00 0.00 H new ATOM 0 HD22 ASN A 65 11.817 -6.100 0.808 1.00 0.00 H new ATOM 603 N ALA A 66 12.468 -8.219 -5.012 1.00 0.00 N ATOM 604 CA ALA A 66 11.591 -8.308 -6.220 1.00 0.00 C ATOM 605 C ALA A 66 10.810 -9.628 -6.199 1.00 0.00 C ATOM 606 O ALA A 66 11.330 -10.668 -5.845 1.00 0.00 O ATOM 607 CB ALA A 66 12.461 -8.235 -7.492 1.00 0.00 C ATOM 0 H ALA A 66 13.470 -8.241 -5.203 1.00 0.00 H new ATOM 0 HA ALA A 66 10.885 -7.478 -6.217 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.823 -8.300 -8.373 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.005 -7.291 -7.507 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.170 -9.063 -7.496 1.00 0.00 H new ATOM 613 N GLY A 67 9.564 -9.587 -6.594 1.00 0.00 N ATOM 614 CA GLY A 67 8.728 -10.831 -6.625 1.00 0.00 C ATOM 615 C GLY A 67 7.809 -10.869 -5.404 1.00 0.00 C ATOM 616 O GLY A 67 6.826 -11.581 -5.379 1.00 0.00 O ATOM 0 H GLY A 67 9.084 -8.740 -6.899 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.135 -10.858 -7.539 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.370 -11.712 -6.635 1.00 0.00 H new ATOM 620 N SER A 68 8.123 -10.111 -4.393 1.00 0.00 N ATOM 621 CA SER A 68 7.269 -10.105 -3.173 1.00 0.00 C ATOM 622 C SER A 68 5.880 -9.562 -3.517 1.00 0.00 C ATOM 623 O SER A 68 5.740 -8.575 -4.215 1.00 0.00 O ATOM 624 CB SER A 68 7.921 -9.219 -2.110 1.00 0.00 C ATOM 625 OG SER A 68 9.000 -9.922 -1.509 1.00 0.00 O ATOM 0 H SER A 68 8.935 -9.494 -4.358 1.00 0.00 H new ATOM 0 HA SER A 68 7.168 -11.121 -2.792 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.281 -8.295 -2.562 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.188 -8.940 -1.353 1.00 0.00 H new ATOM 0 HG SER A 68 9.421 -9.356 -0.829 1.00 0.00 H new ATOM 631 N ARG A 69 4.851 -10.198 -3.016 1.00 0.00 N ATOM 632 CA ARG A 69 3.457 -9.732 -3.289 1.00 0.00 C ATOM 633 C ARG A 69 2.622 -9.880 -2.017 1.00 0.00 C ATOM 634 O ARG A 69 2.827 -10.789 -1.237 1.00 0.00 O ATOM 635 CB ARG A 69 2.843 -10.583 -4.402 1.00 0.00 C ATOM 636 CG ARG A 69 3.613 -10.347 -5.701 1.00 0.00 C ATOM 637 CD ARG A 69 2.965 -11.140 -6.836 1.00 0.00 C ATOM 638 NE ARG A 69 3.099 -12.600 -6.568 1.00 0.00 N ATOM 639 CZ ARG A 69 4.247 -13.196 -6.743 1.00 0.00 C ATOM 640 NH1 ARG A 69 5.285 -12.514 -7.145 1.00 0.00 N ATOM 641 NH2 ARG A 69 4.357 -14.476 -6.516 1.00 0.00 N ATOM 0 H ARG A 69 4.918 -11.027 -2.425 1.00 0.00 H new ATOM 0 HA ARG A 69 3.473 -8.687 -3.600 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.879 -11.638 -4.131 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.793 -10.324 -4.536 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.618 -9.284 -5.944 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.653 -10.651 -5.579 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.912 -10.872 -6.925 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.439 -10.889 -7.785 1.00 0.00 H new ATOM 0 HE ARG A 69 2.292 -13.135 -6.247 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.200 -11.513 -7.323 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.181 -12.982 -7.281 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.546 -15.010 -6.202 1.00 0.00 H new ATOM 0 HH22 ARG A 69 5.254 -14.943 -6.652 1.00 0.00 H new ATOM 655 N PHE A 70 1.679 -8.997 -1.806 1.00 0.00 N ATOM 656 CA PHE A 70 0.812 -9.075 -0.585 1.00 0.00 C ATOM 657 C PHE A 70 -0.656 -9.004 -1.002 1.00 0.00 C ATOM 658 O PHE A 70 -1.034 -8.202 -1.833 1.00 0.00 O ATOM 659 CB PHE A 70 1.131 -7.899 0.336 1.00 0.00 C ATOM 660 CG PHE A 70 2.525 -8.061 0.891 1.00 0.00 C ATOM 661 CD1 PHE A 70 2.759 -8.958 1.940 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.586 -7.322 0.353 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.051 -9.115 2.452 1.00 0.00 C ATOM 664 CE2 PHE A 70 4.879 -7.481 0.864 1.00 0.00 C ATOM 665 CZ PHE A 70 5.112 -8.377 1.914 1.00 0.00 C ATOM 0 H PHE A 70 1.469 -8.218 -2.431 1.00 0.00 H new ATOM 0 HA PHE A 70 1.000 -10.013 -0.062 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.053 -6.961 -0.214 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.407 -7.853 1.149 1.00 0.00 H new ATOM 0 HD1 PHE A 70 1.941 -9.529 2.354 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.406 -6.630 -0.456 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.230 -9.806 3.263 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.697 -6.912 0.448 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.110 -8.499 2.309 1.00 0.00 H new ATOM 675 N LEU A 71 -1.489 -9.833 -0.422 1.00 0.00 N ATOM 676 CA LEU A 71 -2.945 -9.822 -0.769 1.00 0.00 C ATOM 677 C LEU A 71 -3.721 -9.133 0.349 1.00 0.00 C ATOM 678 O LEU A 71 -3.565 -9.449 1.513 1.00 0.00 O ATOM 679 CB LEU A 71 -3.447 -11.261 -0.926 1.00 0.00 C ATOM 680 CG LEU A 71 -4.910 -11.266 -1.398 1.00 0.00 C ATOM 681 CD1 LEU A 71 -5.031 -10.612 -2.788 1.00 0.00 C ATOM 682 CD2 LEU A 71 -5.403 -12.715 -1.459 1.00 0.00 C ATOM 0 H LEU A 71 -1.221 -10.521 0.281 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.093 -9.284 -1.706 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.824 -11.795 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.362 -11.789 0.024 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.518 -10.694 -0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.073 -10.624 -3.106 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.679 -9.582 -2.737 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.426 -11.167 -3.505 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.440 -12.733 -1.793 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.787 -13.280 -2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.333 -13.165 -0.469 1.00 0.00 H new ATOM 694 N LEU A 72 -4.555 -8.188 0.010 1.00 0.00 N ATOM 695 CA LEU A 72 -5.339 -7.470 1.057 1.00 0.00 C ATOM 696 C LEU A 72 -6.704 -8.133 1.210 1.00 0.00 C ATOM 697 O LEU A 72 -7.724 -7.584 0.845 1.00 0.00 O ATOM 698 CB LEU A 72 -5.512 -6.012 0.632 1.00 0.00 C ATOM 699 CG LEU A 72 -4.132 -5.390 0.377 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.305 -3.948 -0.105 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.298 -5.404 1.672 1.00 0.00 C ATOM 0 H LEU A 72 -4.728 -7.881 -0.947 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.815 -7.511 2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.122 -5.954 -0.270 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.037 -5.455 1.408 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.614 -5.972 -0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.326 -3.505 -0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.884 -3.940 -1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.829 -3.370 0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.321 -4.961 1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.812 -4.829 2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.170 -6.432 2.011 1.00 0.00 H new ATOM 713 N ASP A 73 -6.723 -9.316 1.760 1.00 0.00 N ATOM 714 CA ASP A 73 -8.009 -10.043 1.962 1.00 0.00 C ATOM 715 C ASP A 73 -8.508 -9.776 3.384 1.00 0.00 C ATOM 716 O ASP A 73 -9.096 -10.628 4.020 1.00 0.00 O ATOM 717 CB ASP A 73 -7.765 -11.545 1.772 1.00 0.00 C ATOM 718 CG ASP A 73 -9.090 -12.308 1.850 1.00 0.00 C ATOM 719 OD1 ASP A 73 -10.091 -11.691 2.169 1.00 0.00 O ATOM 720 OD2 ASP A 73 -9.079 -13.500 1.587 1.00 0.00 O ATOM 0 H ASP A 73 -5.894 -9.815 2.082 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.755 -9.703 1.244 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.289 -11.725 0.808 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.081 -11.910 2.538 1.00 0.00 H new ATOM 725 N GLN A 74 -8.270 -8.590 3.890 1.00 0.00 N ATOM 726 CA GLN A 74 -8.723 -8.254 5.276 1.00 0.00 C ATOM 727 C GLN A 74 -9.224 -6.808 5.326 1.00 0.00 C ATOM 728 O GLN A 74 -8.783 -5.955 4.580 1.00 0.00 O ATOM 729 CB GLN A 74 -7.558 -8.418 6.250 1.00 0.00 C ATOM 730 CG GLN A 74 -8.034 -8.082 7.664 1.00 0.00 C ATOM 731 CD GLN A 74 -6.950 -8.449 8.679 1.00 0.00 C ATOM 732 OE1 GLN A 74 -6.048 -9.205 8.377 1.00 0.00 O ATOM 733 NE2 GLN A 74 -7.003 -7.942 9.881 1.00 0.00 N ATOM 0 H GLN A 74 -7.781 -7.839 3.402 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.534 -8.926 5.557 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.179 -9.439 6.214 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.735 -7.763 5.965 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.267 -7.020 7.736 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -8.952 -8.626 7.887 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.760 -7.307 10.134 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.287 -8.180 10.567 1.00 0.00 H new ATOM 742 N ALA A 75 -10.147 -6.537 6.207 1.00 0.00 N ATOM 743 CA ALA A 75 -10.700 -5.159 6.328 1.00 0.00 C ATOM 744 C ALA A 75 -9.601 -4.181 6.750 1.00 0.00 C ATOM 745 O ALA A 75 -9.448 -3.121 6.175 1.00 0.00 O ATOM 746 CB ALA A 75 -11.807 -5.157 7.384 1.00 0.00 C ATOM 0 H ALA A 75 -10.545 -7.218 6.854 1.00 0.00 H new ATOM 0 HA ALA A 75 -11.099 -4.848 5.362 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -12.217 -4.152 7.479 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.597 -5.845 7.084 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.396 -5.473 8.343 1.00 0.00 H new ATOM 752 N ILE A 76 -8.836 -4.529 7.757 1.00 0.00 N ATOM 753 CA ILE A 76 -7.739 -3.629 8.240 1.00 0.00 C ATOM 754 C ILE A 76 -6.415 -4.390 8.219 1.00 0.00 C ATOM 755 O ILE A 76 -6.288 -5.448 8.802 1.00 0.00 O ATOM 756 CB ILE A 76 -8.049 -3.181 9.669 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.320 -2.327 9.660 1.00 0.00 C ATOM 758 CG2 ILE A 76 -6.878 -2.362 10.221 1.00 0.00 C ATOM 759 CD1 ILE A 76 -9.790 -2.081 11.096 1.00 0.00 C ATOM 0 H ILE A 76 -8.925 -5.406 8.270 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.666 -2.756 7.592 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.199 -4.055 10.303 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.127 -1.376 9.163 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.103 -2.830 9.093 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.104 -2.045 11.239 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -5.975 -2.973 10.223 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -6.721 -1.484 9.594 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.695 -1.473 11.084 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.001 -3.035 11.578 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.010 -1.559 11.650 1.00 0.00 H new ATOM 771 N THR A 77 -5.427 -3.851 7.552 1.00 0.00 N ATOM 772 CA THR A 77 -4.091 -4.520 7.480 1.00 0.00 C ATOM 773 C THR A 77 -3.023 -3.566 8.016 1.00 0.00 C ATOM 774 O THR A 77 -2.851 -2.468 7.525 1.00 0.00 O ATOM 775 CB THR A 77 -3.784 -4.873 6.023 1.00 0.00 C ATOM 776 OG1 THR A 77 -4.771 -5.773 5.539 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.405 -5.529 5.933 1.00 0.00 C ATOM 0 H THR A 77 -5.489 -2.966 7.048 1.00 0.00 H new ATOM 0 HA THR A 77 -4.097 -5.430 8.079 1.00 0.00 H new ATOM 0 HB THR A 77 -3.791 -3.965 5.420 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.578 -5.999 4.605 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.188 -5.780 4.895 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.648 -4.838 6.305 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.394 -6.437 6.535 1.00 0.00 H new ATOM 785 N SER A 78 -2.305 -3.980 9.022 1.00 0.00 N ATOM 786 CA SER A 78 -1.244 -3.108 9.605 1.00 0.00 C ATOM 787 C SER A 78 0.067 -3.312 8.845 1.00 0.00 C ATOM 788 O SER A 78 0.310 -4.361 8.282 1.00 0.00 O ATOM 789 CB SER A 78 -1.046 -3.474 11.076 1.00 0.00 C ATOM 790 OG SER A 78 -2.315 -3.565 11.709 1.00 0.00 O ATOM 0 H SER A 78 -2.407 -4.891 9.469 1.00 0.00 H new ATOM 0 HA SER A 78 -1.545 -2.064 9.524 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.516 -4.423 11.159 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.432 -2.721 11.571 1.00 0.00 H new ATOM 0 HG SER A 78 -2.970 -3.036 11.207 1.00 0.00 H new ATOM 796 N ALA A 79 0.914 -2.311 8.830 1.00 0.00 N ATOM 797 CA ALA A 79 2.228 -2.426 8.113 1.00 0.00 C ATOM 798 C ALA A 79 3.370 -2.266 9.119 1.00 0.00 C ATOM 799 O ALA A 79 3.471 -1.268 9.803 1.00 0.00 O ATOM 800 CB ALA A 79 2.324 -1.322 7.058 1.00 0.00 C ATOM 0 H ALA A 79 0.752 -1.413 9.286 1.00 0.00 H new ATOM 0 HA ALA A 79 2.300 -3.401 7.632 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.277 -1.401 6.534 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.507 -1.429 6.344 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.256 -0.348 7.543 1.00 0.00 H new ATOM 806 N GLY A 80 4.235 -3.246 9.212 1.00 0.00 N ATOM 807 CA GLY A 80 5.378 -3.163 10.176 1.00 0.00 C ATOM 808 C GLY A 80 5.610 -4.537 10.804 1.00 0.00 C ATOM 809 O GLY A 80 5.808 -5.516 10.114 1.00 0.00 O ATOM 0 H GLY A 80 4.199 -4.103 8.660 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.279 -2.829 9.662 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.162 -2.428 10.951 1.00 0.00 H new ATOM 813 N ARG A 81 5.586 -4.614 12.114 1.00 0.00 N ATOM 814 CA ARG A 81 5.804 -5.924 12.811 1.00 0.00 C ATOM 815 C ARG A 81 4.566 -6.264 13.643 1.00 0.00 C ATOM 816 O ARG A 81 4.162 -5.518 14.514 1.00 0.00 O ATOM 817 CB ARG A 81 7.027 -5.816 13.729 1.00 0.00 C ATOM 818 CG ARG A 81 7.305 -7.170 14.386 1.00 0.00 C ATOM 819 CD ARG A 81 8.513 -7.047 15.318 1.00 0.00 C ATOM 820 NE ARG A 81 9.740 -6.772 14.513 1.00 0.00 N ATOM 821 CZ ARG A 81 10.401 -7.758 13.969 1.00 0.00 C ATOM 822 NH1 ARG A 81 9.980 -8.986 14.112 1.00 0.00 N ATOM 823 NH2 ARG A 81 11.483 -7.518 13.279 1.00 0.00 N ATOM 0 H ARG A 81 5.424 -3.821 12.735 1.00 0.00 H new ATOM 0 HA ARG A 81 5.974 -6.709 12.074 1.00 0.00 H new ATOM 0 HB2 ARG A 81 7.896 -5.495 13.155 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.853 -5.059 14.494 1.00 0.00 H new ATOM 0 HG2 ARG A 81 6.431 -7.500 14.948 1.00 0.00 H new ATOM 0 HG3 ARG A 81 7.497 -7.924 13.623 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.350 -6.244 16.037 1.00 0.00 H new ATOM 0 HD3 ARG A 81 8.639 -7.966 15.890 1.00 0.00 H new ATOM 0 HE ARG A 81 10.062 -5.812 14.388 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.134 -9.176 14.649 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.497 -9.755 13.687 1.00 0.00 H new ATOM 0 HH21 ARG A 81 11.813 -6.560 13.164 1.00 0.00 H new ATOM 0 HH22 ARG A 81 11.999 -8.289 12.854 1.00 0.00 H new ATOM 837 N HIS A 82 3.966 -7.392 13.379 1.00 0.00 N ATOM 838 CA HIS A 82 2.751 -7.802 14.145 1.00 0.00 C ATOM 839 C HIS A 82 2.421 -9.260 13.794 1.00 0.00 C ATOM 840 O HIS A 82 2.867 -9.778 12.789 1.00 0.00 O ATOM 841 CB HIS A 82 1.550 -6.878 13.793 1.00 0.00 C ATOM 842 CG HIS A 82 1.903 -5.987 12.628 1.00 0.00 C ATOM 843 ND1 HIS A 82 1.628 -4.629 12.625 1.00 0.00 N ATOM 844 CD2 HIS A 82 2.518 -6.248 11.429 1.00 0.00 C ATOM 845 CE1 HIS A 82 2.074 -4.128 11.459 1.00 0.00 C ATOM 846 NE2 HIS A 82 2.626 -5.072 10.691 1.00 0.00 N ATOM 0 H HIS A 82 4.266 -8.052 12.662 1.00 0.00 H new ATOM 0 HA HIS A 82 2.943 -7.712 15.214 1.00 0.00 H new ATOM 0 HB2 HIS A 82 0.677 -7.482 13.547 1.00 0.00 H new ATOM 0 HB3 HIS A 82 1.284 -6.270 14.658 1.00 0.00 H new ATOM 0 HD1 HIS A 82 1.171 -4.105 13.371 1.00 0.00 H new ATOM 0 HD2 HIS A 82 2.866 -7.218 11.107 1.00 0.00 H new ATOM 0 HE1 HIS A 82 1.995 -3.088 11.178 1.00 0.00 H new ATOM 854 N PRO A 83 1.640 -9.911 14.614 1.00 0.00 N ATOM 855 CA PRO A 83 1.243 -11.331 14.384 1.00 0.00 C ATOM 856 C PRO A 83 0.302 -11.479 13.182 1.00 0.00 C ATOM 857 O PRO A 83 0.706 -11.872 12.106 1.00 0.00 O ATOM 858 CB PRO A 83 0.533 -11.728 15.690 1.00 0.00 C ATOM 859 CG PRO A 83 0.041 -10.438 16.272 1.00 0.00 C ATOM 860 CD PRO A 83 1.054 -9.370 15.852 1.00 0.00 C ATOM 0 HA PRO A 83 2.100 -11.963 14.152 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -0.292 -12.414 15.498 1.00 0.00 H new ATOM 0 HB3 PRO A 83 1.216 -12.234 16.372 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -0.955 -10.198 15.901 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -0.030 -10.502 17.358 1.00 0.00 H new ATOM 0 HD2 PRO A 83 0.573 -8.407 15.680 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.813 -9.214 16.619 1.00 0.00 H new ATOM 868 N ASP A 84 -0.952 -11.171 13.364 1.00 0.00 N ATOM 869 CA ASP A 84 -1.927 -11.298 12.247 1.00 0.00 C ATOM 870 C ASP A 84 -1.835 -10.071 11.339 1.00 0.00 C ATOM 871 O ASP A 84 -2.418 -9.039 11.604 1.00 0.00 O ATOM 872 CB ASP A 84 -3.338 -11.404 12.828 1.00 0.00 C ATOM 873 CG ASP A 84 -3.522 -12.783 13.467 1.00 0.00 C ATOM 874 OD1 ASP A 84 -2.718 -13.656 13.190 1.00 0.00 O ATOM 875 OD2 ASP A 84 -4.465 -12.941 14.224 1.00 0.00 O ATOM 0 H ASP A 84 -1.345 -10.835 14.243 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.701 -12.190 11.662 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -3.497 -10.622 13.571 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.079 -11.253 12.043 1.00 0.00 H new ATOM 880 N SER A 85 -1.107 -10.185 10.262 1.00 0.00 N ATOM 881 CA SER A 85 -0.969 -9.039 9.320 1.00 0.00 C ATOM 882 C SER A 85 -0.361 -9.540 8.013 1.00 0.00 C ATOM 883 O SER A 85 0.671 -10.183 7.999 1.00 0.00 O ATOM 884 CB SER A 85 -0.068 -7.967 9.928 1.00 0.00 C ATOM 885 OG SER A 85 1.292 -8.332 9.737 1.00 0.00 O ATOM 0 H SER A 85 -0.599 -11.028 9.993 1.00 0.00 H new ATOM 0 HA SER A 85 -1.951 -8.606 9.129 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.266 -7.002 9.462 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.281 -7.857 10.991 1.00 0.00 H new ATOM 0 HG SER A 85 1.675 -7.797 9.011 1.00 0.00 H new ATOM 891 N ASP A 86 -0.999 -9.259 6.914 1.00 0.00 N ATOM 892 CA ASP A 86 -0.470 -9.726 5.601 1.00 0.00 C ATOM 893 C ASP A 86 0.908 -9.115 5.361 1.00 0.00 C ATOM 894 O ASP A 86 1.792 -9.746 4.814 1.00 0.00 O ATOM 895 CB ASP A 86 -1.415 -9.277 4.489 1.00 0.00 C ATOM 896 CG ASP A 86 -2.700 -10.102 4.542 1.00 0.00 C ATOM 897 OD1 ASP A 86 -2.692 -11.132 5.196 1.00 0.00 O ATOM 898 OD2 ASP A 86 -3.670 -9.693 3.926 1.00 0.00 O ATOM 0 H ASP A 86 -1.867 -8.725 6.866 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.393 -10.813 5.606 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -1.646 -8.218 4.601 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.934 -9.397 3.519 1.00 0.00 H new ATOM 903 N ILE A 87 1.092 -7.886 5.753 1.00 0.00 N ATOM 904 CA ILE A 87 2.405 -7.216 5.540 1.00 0.00 C ATOM 905 C ILE A 87 3.327 -7.505 6.723 1.00 0.00 C ATOM 906 O ILE A 87 3.028 -7.181 7.855 1.00 0.00 O ATOM 907 CB ILE A 87 2.172 -5.710 5.426 1.00 0.00 C ATOM 908 CG1 ILE A 87 1.007 -5.445 4.463 1.00 0.00 C ATOM 909 CG2 ILE A 87 3.436 -5.021 4.913 1.00 0.00 C ATOM 910 CD1 ILE A 87 1.239 -6.186 3.142 1.00 0.00 C ATOM 0 H ILE A 87 0.385 -7.313 6.215 1.00 0.00 H new ATOM 0 HA ILE A 87 2.871 -7.591 4.628 1.00 0.00 H new ATOM 0 HB ILE A 87 1.928 -5.309 6.410 1.00 0.00 H new ATOM 0 HG12 ILE A 87 0.070 -5.773 4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.914 -4.375 4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.260 -3.948 4.835 1.00 0.00 H new ATOM 0 HG22 ILE A 87 4.257 -5.204 5.606 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.694 -5.418 3.931 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.407 -5.992 2.465 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.166 -5.837 2.687 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.309 -7.257 3.333 1.00 0.00 H new ATOM 922 N PHE A 88 4.450 -8.118 6.457 1.00 0.00 N ATOM 923 CA PHE A 88 5.423 -8.449 7.541 1.00 0.00 C ATOM 924 C PHE A 88 6.813 -7.972 7.121 1.00 0.00 C ATOM 925 O PHE A 88 7.594 -8.719 6.568 1.00 0.00 O ATOM 926 CB PHE A 88 5.446 -9.965 7.745 1.00 0.00 C ATOM 927 CG PHE A 88 6.406 -10.306 8.859 1.00 0.00 C ATOM 928 CD1 PHE A 88 6.114 -9.913 10.169 1.00 0.00 C ATOM 929 CD2 PHE A 88 7.585 -11.011 8.584 1.00 0.00 C ATOM 930 CE1 PHE A 88 6.998 -10.224 11.207 1.00 0.00 C ATOM 931 CE2 PHE A 88 8.470 -11.322 9.623 1.00 0.00 C ATOM 932 CZ PHE A 88 8.176 -10.929 10.934 1.00 0.00 C ATOM 0 H PHE A 88 4.739 -8.407 5.522 1.00 0.00 H new ATOM 0 HA PHE A 88 5.130 -7.959 8.470 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.447 -10.326 7.988 1.00 0.00 H new ATOM 0 HB3 PHE A 88 5.749 -10.463 6.824 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.205 -9.369 10.379 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.811 -11.314 7.572 1.00 0.00 H new ATOM 0 HE1 PHE A 88 6.772 -9.920 12.219 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.380 -11.865 9.413 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.859 -11.170 11.735 1.00 0.00 H new ATOM 942 N LEU A 89 7.124 -6.727 7.377 1.00 0.00 N ATOM 943 CA LEU A 89 8.464 -6.183 6.989 1.00 0.00 C ATOM 944 C LEU A 89 9.346 -6.067 8.230 1.00 0.00 C ATOM 945 O LEU A 89 9.148 -5.215 9.073 1.00 0.00 O ATOM 946 CB LEU A 89 8.278 -4.798 6.363 1.00 0.00 C ATOM 947 CG LEU A 89 7.424 -4.917 5.092 1.00 0.00 C ATOM 948 CD1 LEU A 89 7.108 -3.513 4.565 1.00 0.00 C ATOM 949 CD2 LEU A 89 8.182 -5.713 4.013 1.00 0.00 C ATOM 0 H LEU A 89 6.506 -6.060 7.840 1.00 0.00 H new ATOM 0 HA LEU A 89 8.939 -6.851 6.271 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.797 -4.128 7.075 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.248 -4.364 6.122 1.00 0.00 H new ATOM 0 HG LEU A 89 6.498 -5.441 5.330 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.502 -3.591 3.662 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.559 -2.955 5.323 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.038 -2.993 4.334 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.566 -5.790 3.117 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.113 -5.201 3.770 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.405 -6.712 4.387 1.00 0.00 H new ATOM 961 N ASP A 90 10.324 -6.923 8.346 1.00 0.00 N ATOM 962 CA ASP A 90 11.234 -6.876 9.526 1.00 0.00 C ATOM 963 C ASP A 90 12.421 -5.965 9.212 1.00 0.00 C ATOM 964 O ASP A 90 13.454 -6.410 8.752 1.00 0.00 O ATOM 965 CB ASP A 90 11.733 -8.288 9.836 1.00 0.00 C ATOM 966 CG ASP A 90 10.599 -9.105 10.461 1.00 0.00 C ATOM 967 OD1 ASP A 90 9.607 -8.508 10.846 1.00 0.00 O ATOM 968 OD2 ASP A 90 10.741 -10.313 10.543 1.00 0.00 O ATOM 0 H ASP A 90 10.533 -7.658 7.670 1.00 0.00 H new ATOM 0 HA ASP A 90 10.698 -6.485 10.391 1.00 0.00 H new ATOM 0 HB2 ASP A 90 12.082 -8.770 8.923 1.00 0.00 H new ATOM 0 HB3 ASP A 90 12.582 -8.243 10.518 1.00 0.00 H new ATOM 973 N ASP A 91 12.279 -4.690 9.456 1.00 0.00 N ATOM 974 CA ASP A 91 13.396 -3.743 9.170 1.00 0.00 C ATOM 975 C ASP A 91 13.311 -2.548 10.117 1.00 0.00 C ATOM 976 O ASP A 91 12.246 -2.152 10.550 1.00 0.00 O ATOM 977 CB ASP A 91 13.287 -3.254 7.725 1.00 0.00 C ATOM 978 CG ASP A 91 13.594 -4.408 6.769 1.00 0.00 C ATOM 979 OD1 ASP A 91 14.653 -4.998 6.904 1.00 0.00 O ATOM 980 OD2 ASP A 91 12.765 -4.680 5.917 1.00 0.00 O ATOM 0 H ASP A 91 11.437 -4.263 9.841 1.00 0.00 H new ATOM 0 HA ASP A 91 14.349 -4.252 9.315 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.285 -2.868 7.536 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.983 -2.432 7.555 1.00 0.00 H new ATOM 985 N VAL A 92 14.429 -1.967 10.438 1.00 0.00 N ATOM 986 CA VAL A 92 14.427 -0.792 11.349 1.00 0.00 C ATOM 987 C VAL A 92 13.820 0.403 10.619 1.00 0.00 C ATOM 988 O VAL A 92 13.304 1.322 11.224 1.00 0.00 O ATOM 989 CB VAL A 92 15.865 -0.473 11.758 1.00 0.00 C ATOM 990 CG1 VAL A 92 16.493 -1.711 12.402 1.00 0.00 C ATOM 991 CG2 VAL A 92 16.668 -0.081 10.514 1.00 0.00 C ATOM 0 H VAL A 92 15.349 -2.256 10.107 1.00 0.00 H new ATOM 0 HA VAL A 92 13.838 -1.010 12.240 1.00 0.00 H new ATOM 0 HB VAL A 92 15.872 0.351 12.471 1.00 0.00 H new ATOM 0 HG11 VAL A 92 17.519 -1.488 12.695 1.00 0.00 H new ATOM 0 HG12 VAL A 92 15.917 -1.994 13.283 1.00 0.00 H new ATOM 0 HG13 VAL A 92 16.491 -2.534 11.687 1.00 0.00 H new ATOM 0 HG21 VAL A 92 17.695 0.148 10.801 1.00 0.00 H new ATOM 0 HG22 VAL A 92 16.665 -0.908 9.804 1.00 0.00 H new ATOM 0 HG23 VAL A 92 16.217 0.797 10.051 1.00 0.00 H new ATOM 1001 N THR A 93 13.888 0.398 9.316 1.00 0.00 N ATOM 1002 CA THR A 93 13.327 1.531 8.531 1.00 0.00 C ATOM 1003 C THR A 93 11.809 1.581 8.713 1.00 0.00 C ATOM 1004 O THR A 93 11.212 2.638 8.725 1.00 0.00 O ATOM 1005 CB THR A 93 13.653 1.327 7.051 1.00 0.00 C ATOM 1006 OG1 THR A 93 13.119 0.081 6.624 1.00 0.00 O ATOM 1007 CG2 THR A 93 15.169 1.331 6.855 1.00 0.00 C ATOM 0 H THR A 93 14.310 -0.346 8.760 1.00 0.00 H new ATOM 0 HA THR A 93 13.764 2.467 8.880 1.00 0.00 H new ATOM 0 HB THR A 93 13.214 2.134 6.464 1.00 0.00 H new ATOM 0 HG1 THR A 93 13.323 -0.055 5.675 1.00 0.00 H new ATOM 0 HG21 THR A 93 15.400 1.185 5.800 1.00 0.00 H new ATOM 0 HG22 THR A 93 15.576 2.286 7.187 1.00 0.00 H new ATOM 0 HG23 THR A 93 15.613 0.524 7.438 1.00 0.00 H new ATOM 1015 N VAL A 94 11.178 0.441 8.854 1.00 0.00 N ATOM 1016 CA VAL A 94 9.693 0.412 9.035 1.00 0.00 C ATOM 1017 C VAL A 94 9.362 0.190 10.514 1.00 0.00 C ATOM 1018 O VAL A 94 9.702 -0.820 11.096 1.00 0.00 O ATOM 1019 CB VAL A 94 9.105 -0.727 8.201 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.581 -0.652 8.251 1.00 0.00 C ATOM 1021 CG2 VAL A 94 9.574 -0.584 6.750 1.00 0.00 C ATOM 0 H VAL A 94 11.629 -0.474 8.852 1.00 0.00 H new ATOM 0 HA VAL A 94 9.266 1.360 8.709 1.00 0.00 H new ATOM 0 HB VAL A 94 9.437 -1.685 8.600 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.157 -1.462 7.658 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.246 -0.745 9.284 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.250 0.305 7.847 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.157 -1.394 6.151 1.00 0.00 H new ATOM 0 HG22 VAL A 94 9.237 0.373 6.351 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.662 -0.629 6.713 1.00 0.00 H new ATOM 1031 N SER A 95 8.700 1.136 11.119 1.00 0.00 N ATOM 1032 CA SER A 95 8.339 1.010 12.561 1.00 0.00 C ATOM 1033 C SER A 95 7.253 -0.054 12.747 1.00 0.00 C ATOM 1034 O SER A 95 6.734 -0.603 11.795 1.00 0.00 O ATOM 1035 CB SER A 95 7.826 2.355 13.069 1.00 0.00 C ATOM 1036 OG SER A 95 8.891 3.298 13.049 1.00 0.00 O ATOM 0 H SER A 95 8.390 1.999 10.673 1.00 0.00 H new ATOM 0 HA SER A 95 9.223 0.712 13.125 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.003 2.704 12.445 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.436 2.250 14.081 1.00 0.00 H new ATOM 0 HG SER A 95 8.567 4.164 13.373 1.00 0.00 H new ATOM 1042 N ARG A 96 6.913 -0.348 13.977 1.00 0.00 N ATOM 1043 CA ARG A 96 5.865 -1.378 14.245 1.00 0.00 C ATOM 1044 C ARG A 96 4.545 -0.936 13.609 1.00 0.00 C ATOM 1045 O ARG A 96 3.853 -1.722 12.992 1.00 0.00 O ATOM 1046 CB ARG A 96 5.679 -1.522 15.762 1.00 0.00 C ATOM 1047 CG ARG A 96 4.688 -2.651 16.058 1.00 0.00 C ATOM 1048 CD ARG A 96 4.487 -2.766 17.571 1.00 0.00 C ATOM 1049 NE ARG A 96 3.805 -1.540 18.073 1.00 0.00 N ATOM 1050 CZ ARG A 96 3.597 -1.384 19.352 1.00 0.00 C ATOM 1051 NH1 ARG A 96 3.984 -2.301 20.197 1.00 0.00 N ATOM 1052 NH2 ARG A 96 3.000 -0.308 19.788 1.00 0.00 N ATOM 0 H ARG A 96 7.318 0.082 14.809 1.00 0.00 H new ATOM 0 HA ARG A 96 6.170 -2.334 13.820 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.637 -1.733 16.237 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.314 -0.585 16.183 1.00 0.00 H new ATOM 0 HG2 ARG A 96 3.735 -2.452 15.567 1.00 0.00 H new ATOM 0 HG3 ARG A 96 5.062 -3.593 15.657 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.891 -3.648 17.804 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.449 -2.890 18.069 1.00 0.00 H new ATOM 0 HE ARG A 96 3.500 -0.822 17.416 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.450 -3.142 19.858 1.00 0.00 H new ATOM 0 HH12 ARG A 96 3.820 -2.176 21.196 1.00 0.00 H new ATOM 0 HH21 ARG A 96 2.697 0.409 19.129 1.00 0.00 H new ATOM 0 HH22 ARG A 96 2.837 -0.185 20.787 1.00 0.00 H new ATOM 1066 N ARG A 97 4.195 0.318 13.755 1.00 0.00 N ATOM 1067 CA ARG A 97 2.918 0.840 13.159 1.00 0.00 C ATOM 1068 C ARG A 97 3.229 2.075 12.311 1.00 0.00 C ATOM 1069 O ARG A 97 2.671 3.137 12.508 1.00 0.00 O ATOM 1070 CB ARG A 97 1.942 1.212 14.281 1.00 0.00 C ATOM 1071 CG ARG A 97 1.435 -0.067 14.955 1.00 0.00 C ATOM 1072 CD ARG A 97 0.448 0.289 16.070 1.00 0.00 C ATOM 1073 NE ARG A 97 -0.012 -0.962 16.746 1.00 0.00 N ATOM 1074 CZ ARG A 97 -1.019 -1.645 16.261 1.00 0.00 C ATOM 1075 NH1 ARG A 97 -1.619 -1.245 15.174 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -1.420 -2.732 16.863 1.00 0.00 N ATOM 0 H ARG A 97 4.742 1.011 14.266 1.00 0.00 H new ATOM 0 HA ARG A 97 2.463 0.073 12.532 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.437 1.851 15.013 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.104 1.780 13.877 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.950 -0.709 14.219 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.274 -0.629 15.365 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.923 0.952 16.793 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.405 0.827 15.657 1.00 0.00 H new ATOM 0 HE ARG A 97 0.461 -1.286 17.590 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -1.304 -0.399 14.700 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -2.403 -1.779 14.798 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -0.949 -3.049 17.711 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -2.204 -3.264 16.486 1.00 0.00 H new ATOM 1090 N HIS A 98 4.122 1.938 11.368 1.00 0.00 N ATOM 1091 CA HIS A 98 4.491 3.092 10.496 1.00 0.00 C ATOM 1092 C HIS A 98 3.258 3.578 9.732 1.00 0.00 C ATOM 1093 O HIS A 98 3.030 4.763 9.591 1.00 0.00 O ATOM 1094 CB HIS A 98 5.563 2.649 9.497 1.00 0.00 C ATOM 1095 CG HIS A 98 6.022 3.833 8.692 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.356 4.255 7.552 1.00 0.00 N ATOM 1097 CD2 HIS A 98 7.080 4.693 8.849 1.00 0.00 C ATOM 1098 CE1 HIS A 98 6.015 5.324 7.070 1.00 0.00 C ATOM 1099 NE2 HIS A 98 7.074 5.635 7.824 1.00 0.00 N ATOM 0 H HIS A 98 4.616 1.069 11.162 1.00 0.00 H new ATOM 0 HA HIS A 98 4.875 3.903 11.114 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.407 2.207 10.026 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.163 1.880 8.836 1.00 0.00 H new ATOM 0 HD2 HIS A 98 7.807 4.646 9.647 1.00 0.00 H new ATOM 0 HE1 HIS A 98 5.724 5.865 6.182 1.00 0.00 H new ATOM 0 HE2 HIS A 98 7.735 6.398 7.679 1.00 0.00 H new ATOM 1107 N ALA A 99 2.462 2.669 9.236 1.00 0.00 N ATOM 1108 CA ALA A 99 1.242 3.070 8.475 1.00 0.00 C ATOM 1109 C ALA A 99 0.161 2.006 8.667 1.00 0.00 C ATOM 1110 O ALA A 99 0.444 0.874 9.012 1.00 0.00 O ATOM 1111 CB ALA A 99 1.587 3.189 6.990 1.00 0.00 C ATOM 0 H ALA A 99 2.604 1.663 9.325 1.00 0.00 H new ATOM 0 HA ALA A 99 0.878 4.031 8.839 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.698 3.482 6.432 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.364 3.942 6.856 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.946 2.228 6.622 1.00 0.00 H new ATOM 1117 N GLU A 100 -1.079 2.366 8.452 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.198 1.388 8.626 1.00 0.00 C ATOM 1119 C GLU A 100 -3.131 1.471 7.419 1.00 0.00 C ATOM 1120 O GLU A 100 -3.301 2.516 6.823 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.985 1.741 9.893 1.00 0.00 C ATOM 1122 CG GLU A 100 -3.867 0.555 10.299 1.00 0.00 C ATOM 1123 CD GLU A 100 -3.009 -0.524 10.964 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -1.835 -0.271 11.183 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -3.541 -1.585 11.239 1.00 0.00 O ATOM 0 H GLU A 100 -1.367 3.301 8.162 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.794 0.379 8.712 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.298 1.990 10.702 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.602 2.622 9.716 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.646 0.887 10.985 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -4.368 0.145 9.422 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.742 0.371 7.064 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.685 0.353 5.901 1.00 0.00 C ATOM 1134 C PHE A 101 -6.092 0.074 6.419 1.00 0.00 C ATOM 1135 O PHE A 101 -6.294 -0.795 7.245 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.271 -0.759 4.937 1.00 0.00 C ATOM 1137 CG PHE A 101 -3.015 -0.349 4.212 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -3.101 0.447 3.064 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.766 -0.762 4.689 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.934 0.831 2.392 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.601 -0.377 4.017 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.685 0.419 2.868 1.00 0.00 C ATOM 0 H PHE A 101 -3.628 -0.527 7.534 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.662 1.312 5.383 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.102 -1.686 5.485 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.071 -0.952 4.222 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.066 0.765 2.697 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.702 -1.377 5.574 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.998 1.445 1.506 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.364 -0.694 4.385 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.215 0.715 2.349 1.00 0.00 H new ATOM 1152 N ARG A 102 -7.069 0.803 5.941 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.479 0.589 6.401 1.00 0.00 C ATOM 1154 C ARG A 102 -9.395 0.424 5.190 1.00 0.00 C ATOM 1155 O ARG A 102 -9.246 1.090 4.185 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.937 1.794 7.225 1.00 0.00 C ATOM 1157 CG ARG A 102 -8.211 1.793 8.571 1.00 0.00 C ATOM 1158 CD ARG A 102 -8.665 2.997 9.397 1.00 0.00 C ATOM 1159 NE ARG A 102 -7.941 3.004 10.703 1.00 0.00 N ATOM 1160 CZ ARG A 102 -8.410 2.331 11.721 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -9.502 1.625 11.596 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -7.778 2.357 12.862 1.00 0.00 N ATOM 0 H ARG A 102 -6.952 1.542 5.248 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.525 -0.311 7.015 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.727 2.718 6.686 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.015 1.754 7.381 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.422 0.869 9.109 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.133 1.832 8.415 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.466 3.921 8.853 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -9.741 2.952 9.565 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.077 3.536 10.801 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -9.992 1.597 10.702 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -9.865 1.101 12.393 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -6.921 2.901 12.958 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -8.141 1.833 13.658 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.349 -0.462 5.287 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.299 -0.690 4.158 1.00 0.00 C ATOM 1178 C LEU A 103 -12.590 0.077 4.442 1.00 0.00 C ATOM 1179 O LEU A 103 -13.176 -0.059 5.498 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.595 -2.190 4.054 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.669 -2.454 2.991 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -12.241 -1.859 1.641 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.856 -3.966 2.850 1.00 0.00 C ATOM 0 H LEU A 103 -10.513 -1.044 6.108 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.868 -0.342 3.219 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.683 -2.730 3.800 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.930 -2.568 5.020 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.605 -1.985 3.295 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.013 -2.054 0.896 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -12.101 -0.783 1.746 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -11.305 -2.317 1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.617 -4.170 2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.914 -4.422 2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.170 -4.384 3.806 1.00 0.00 H new ATOM 1195 N GLU A 104 -13.031 0.888 3.512 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.285 1.683 3.724 1.00 0.00 C ATOM 1197 C GLU A 104 -15.283 1.382 2.602 1.00 0.00 C ATOM 1198 O GLU A 104 -14.943 1.389 1.436 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.936 3.176 3.716 1.00 0.00 C ATOM 1200 CG GLU A 104 -15.168 4.003 4.098 1.00 0.00 C ATOM 1201 CD GLU A 104 -15.502 3.774 5.575 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -14.703 3.150 6.254 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -16.547 4.233 6.001 1.00 0.00 O ATOM 0 H GLU A 104 -12.576 1.035 2.611 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.733 1.414 4.680 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.124 3.372 4.417 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.582 3.470 2.728 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.979 5.061 3.917 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -16.016 3.720 3.475 1.00 0.00 H new ATOM 1210 N ASN A 105 -16.516 1.126 2.956 1.00 0.00 N ATOM 1211 CA ASN A 105 -17.556 0.827 1.928 1.00 0.00 C ATOM 1212 C ASN A 105 -17.064 -0.284 0.999 1.00 0.00 C ATOM 1213 O ASN A 105 -17.362 -1.446 1.191 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.844 2.089 1.108 1.00 0.00 C ATOM 1215 CG ASN A 105 -18.877 1.772 0.023 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -19.185 0.623 -0.225 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -19.431 2.751 -0.638 1.00 0.00 N ATOM 0 H ASN A 105 -16.849 1.111 3.920 1.00 0.00 H new ATOM 0 HA ASN A 105 -18.468 0.500 2.427 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -18.216 2.880 1.758 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -16.924 2.457 0.653 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -20.122 2.551 -1.362 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -19.174 3.716 -0.431 1.00 0.00 H new ATOM 1224 N ASN A 106 -16.318 0.066 -0.012 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.805 -0.964 -0.962 1.00 0.00 C ATOM 1226 C ASN A 106 -14.509 -0.459 -1.597 1.00 0.00 C ATOM 1227 O ASN A 106 -14.146 -0.852 -2.690 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.853 -1.208 -2.052 1.00 0.00 C ATOM 1229 CG ASN A 106 -16.545 -2.519 -2.781 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -16.102 -3.475 -2.175 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -16.766 -2.605 -4.064 1.00 0.00 N ATOM 0 H ASN A 106 -16.040 1.024 -0.223 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.610 -1.896 -0.431 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -17.848 -1.252 -1.610 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.855 -0.379 -2.760 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.567 -3.475 -4.559 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.138 -1.803 -4.572 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.809 0.412 -0.917 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.531 0.960 -1.463 1.00 0.00 C ATOM 1240 C GLU A 107 -11.461 0.949 -0.370 1.00 0.00 C ATOM 1241 O GLU A 107 -11.719 1.268 0.774 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.759 2.394 -1.944 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.508 3.190 -0.871 1.00 0.00 C ATOM 1244 CD GLU A 107 -13.671 4.637 -1.340 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -13.082 4.980 -2.351 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -14.381 5.380 -0.679 1.00 0.00 O ATOM 0 H GLU A 107 -14.071 0.770 0.002 1.00 0.00 H new ATOM 0 HA GLU A 107 -12.198 0.345 -2.299 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -11.803 2.870 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -13.331 2.389 -2.872 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -14.485 2.743 -0.685 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -12.959 3.160 0.070 1.00 0.00 H new ATOM 1253 N PHE A 108 -10.260 0.579 -0.719 1.00 0.00 N ATOM 1254 CA PHE A 108 -9.161 0.536 0.285 1.00 0.00 C ATOM 1255 C PHE A 108 -8.661 1.953 0.564 1.00 0.00 C ATOM 1256 O PHE A 108 -8.654 2.802 -0.304 1.00 0.00 O ATOM 1257 CB PHE A 108 -8.012 -0.310 -0.263 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.522 -1.693 -0.581 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.660 -2.636 0.444 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.861 -2.031 -1.896 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -9.135 -3.919 0.153 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -9.338 -3.315 -2.187 1.00 0.00 C ATOM 1263 CZ PHE A 108 -9.475 -4.258 -1.161 1.00 0.00 C ATOM 0 H PHE A 108 -9.991 0.303 -1.663 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.532 0.097 1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.599 0.153 -1.159 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -7.205 -0.366 0.468 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -8.400 -2.373 1.459 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.755 -1.302 -2.686 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.239 -4.648 0.943 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.600 -3.578 -3.201 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.844 -5.248 -1.384 1.00 0.00 H new ATOM 1273 N ASN A 109 -8.240 2.209 1.776 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.728 3.568 2.141 1.00 0.00 C ATOM 1275 C ASN A 109 -6.413 3.418 2.903 1.00 0.00 C ATOM 1276 O ASN A 109 -6.133 2.384 3.478 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.751 4.271 3.033 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.992 4.606 2.209 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.925 4.708 1.001 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -11.133 4.776 2.816 1.00 0.00 N ATOM 0 H ASN A 109 -8.228 1.529 2.537 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.566 4.156 1.238 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -9.020 3.630 3.873 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.321 5.181 3.451 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.970 4.995 2.276 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -11.189 4.690 3.831 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.606 4.445 2.912 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.295 4.387 3.633 1.00 0.00 C ATOM 1289 C VAL A 110 -4.166 5.623 4.526 1.00 0.00 C ATOM 1290 O VAL A 110 -4.479 6.728 4.124 1.00 0.00 O ATOM 1291 CB VAL A 110 -3.153 4.358 2.611 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -3.353 5.469 1.577 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.813 4.565 3.327 1.00 0.00 C ATOM 0 H VAL A 110 -5.799 5.332 2.447 1.00 0.00 H new ATOM 0 HA VAL A 110 -4.245 3.488 4.247 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.151 3.391 2.107 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.538 5.443 0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -4.301 5.319 1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.362 6.436 2.079 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.004 4.544 2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.818 5.529 3.836 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.664 3.770 4.057 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.706 5.436 5.737 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.542 6.581 6.689 1.00 0.00 C ATOM 1305 C VAL A 111 -2.110 6.567 7.231 1.00 0.00 C ATOM 1306 O VAL A 111 -1.596 5.537 7.624 1.00 0.00 O ATOM 1307 CB VAL A 111 -4.535 6.417 7.843 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.217 7.423 8.953 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -5.954 6.662 7.325 1.00 0.00 C ATOM 0 H VAL A 111 -3.433 4.528 6.113 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.732 7.527 6.182 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.457 5.407 8.245 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.928 7.300 9.770 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.206 7.250 9.322 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.290 8.436 8.558 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.665 6.546 8.143 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.025 7.673 6.923 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.184 5.942 6.540 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.458 7.701 7.250 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.053 7.755 7.761 1.00 0.00 C ATOM 1321 C ASP A 112 -0.053 8.178 9.231 1.00 0.00 C ATOM 1322 O ASP A 112 -0.439 9.276 9.576 1.00 0.00 O ATOM 1323 CB ASP A 112 0.753 8.759 6.931 1.00 0.00 C ATOM 1324 CG ASP A 112 0.083 10.134 6.975 1.00 0.00 C ATOM 1325 OD1 ASP A 112 -1.006 10.228 7.515 1.00 0.00 O ATOM 1326 OD2 ASP A 112 0.668 11.071 6.455 1.00 0.00 O ATOM 0 H ASP A 112 -1.837 8.593 6.934 1.00 0.00 H new ATOM 0 HA ASP A 112 0.402 6.768 7.676 1.00 0.00 H new ATOM 0 HB2 ASP A 112 1.770 8.829 7.317 1.00 0.00 H new ATOM 0 HB3 ASP A 112 0.827 8.414 5.900 1.00 0.00 H new ATOM 1331 N VAL A 113 0.385 7.303 10.101 1.00 0.00 N ATOM 1332 CA VAL A 113 0.425 7.627 11.561 1.00 0.00 C ATOM 1333 C VAL A 113 1.884 7.765 11.999 1.00 0.00 C ATOM 1334 O VAL A 113 2.185 7.890 13.171 1.00 0.00 O ATOM 1335 CB VAL A 113 -0.242 6.496 12.348 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -1.669 6.293 11.833 1.00 0.00 C ATOM 1337 CG2 VAL A 113 0.552 5.202 12.160 1.00 0.00 C ATOM 0 H VAL A 113 0.720 6.370 9.861 1.00 0.00 H new ATOM 0 HA VAL A 113 -0.105 8.560 11.750 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.266 6.757 13.406 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.146 5.488 12.392 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.238 7.213 11.965 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.640 6.033 10.775 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.076 4.398 12.721 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.577 4.941 11.102 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.570 5.344 12.523 1.00 0.00 H new ATOM 1405 N THR A 119 3.605 7.832 5.864 1.00 0.00 N ATOM 1406 CA THR A 119 3.482 7.510 4.414 1.00 0.00 C ATOM 1407 C THR A 119 2.950 8.729 3.656 1.00 0.00 C ATOM 1408 O THR A 119 2.329 9.605 4.224 1.00 0.00 O ATOM 1409 CB THR A 119 2.515 6.335 4.238 1.00 0.00 C ATOM 1410 OG1 THR A 119 3.014 5.206 4.939 1.00 0.00 O ATOM 1411 CG2 THR A 119 2.374 6.001 2.753 1.00 0.00 C ATOM 0 HA THR A 119 4.461 7.242 4.018 1.00 0.00 H new ATOM 0 HB THR A 119 1.537 6.606 4.636 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.486 5.504 5.745 1.00 0.00 H new ATOM 0 HG21 THR A 119 1.685 5.165 2.632 1.00 0.00 H new ATOM 0 HG22 THR A 119 1.987 6.870 2.220 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.349 5.730 2.347 1.00 0.00 H new ATOM 1419 N TYR A 120 3.183 8.781 2.371 1.00 0.00 N ATOM 1420 CA TYR A 120 2.690 9.929 1.551 1.00 0.00 C ATOM 1421 C TYR A 120 2.356 9.425 0.146 1.00 0.00 C ATOM 1422 O TYR A 120 2.772 8.354 -0.248 1.00 0.00 O ATOM 1423 CB TYR A 120 3.764 11.015 1.474 1.00 0.00 C ATOM 1424 CG TYR A 120 5.057 10.427 0.961 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.285 10.325 -0.417 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.033 9.995 1.866 1.00 0.00 C ATOM 1427 CE1 TYR A 120 6.491 9.791 -0.889 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.238 9.460 1.394 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.467 9.359 0.018 1.00 0.00 C ATOM 1430 OH TYR A 120 8.656 8.834 -0.446 1.00 0.00 O ATOM 0 H TYR A 120 3.698 8.072 1.849 1.00 0.00 H new ATOM 0 HA TYR A 120 1.798 10.354 2.012 1.00 0.00 H new ATOM 0 HB2 TYR A 120 3.434 11.819 0.816 1.00 0.00 H new ATOM 0 HB3 TYR A 120 3.920 11.454 2.459 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.531 10.658 -1.115 1.00 0.00 H new ATOM 0 HD2 TYR A 120 5.857 10.074 2.929 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.668 9.712 -1.951 1.00 0.00 H new ATOM 0 HE2 TYR A 120 7.991 9.125 2.093 1.00 0.00 H new ATOM 0 HH TYR A 120 8.543 8.539 -1.374 1.00 0.00 H new ATOM 1440 N VAL A 121 1.595 10.183 -0.608 1.00 0.00 N ATOM 1441 CA VAL A 121 1.210 9.748 -1.991 1.00 0.00 C ATOM 1442 C VAL A 121 1.700 10.778 -3.016 1.00 0.00 C ATOM 1443 O VAL A 121 1.440 11.960 -2.903 1.00 0.00 O ATOM 1444 CB VAL A 121 -0.319 9.619 -2.070 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.987 10.911 -1.583 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.735 9.346 -3.517 1.00 0.00 C ATOM 0 H VAL A 121 1.222 11.089 -0.324 1.00 0.00 H new ATOM 0 HA VAL A 121 1.670 8.785 -2.213 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.637 8.793 -1.433 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.070 10.806 -1.644 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.699 11.102 -0.549 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.667 11.744 -2.209 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.820 9.255 -3.573 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.407 10.170 -4.151 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.275 8.419 -3.859 1.00 0.00 H new ATOM 1456 N ASN A 122 2.404 10.325 -4.024 1.00 0.00 N ATOM 1457 CA ASN A 122 2.917 11.252 -5.075 1.00 0.00 C ATOM 1458 C ASN A 122 3.749 12.368 -4.430 1.00 0.00 C ATOM 1459 O ASN A 122 3.709 13.512 -4.843 1.00 0.00 O ATOM 1460 CB ASN A 122 1.740 11.846 -5.856 1.00 0.00 C ATOM 1461 CG ASN A 122 0.857 10.708 -6.377 1.00 0.00 C ATOM 1462 OD1 ASN A 122 -0.345 10.854 -6.483 1.00 0.00 O ATOM 1463 ND2 ASN A 122 1.407 9.571 -6.709 1.00 0.00 N ATOM 0 H ASN A 122 2.646 9.344 -4.163 1.00 0.00 H new ATOM 0 HA ASN A 122 3.555 10.699 -5.764 1.00 0.00 H new ATOM 0 HB2 ASN A 122 1.159 12.509 -5.214 1.00 0.00 H new ATOM 0 HB3 ASN A 122 2.106 12.448 -6.687 1.00 0.00 H new ATOM 0 HD21 ASN A 122 0.828 8.807 -7.057 1.00 0.00 H new ATOM 0 HD22 ASN A 122 2.416 9.447 -6.621 1.00 0.00 H new ATOM 1470 N ARG A 123 4.514 12.032 -3.425 1.00 0.00 N ATOM 1471 CA ARG A 123 5.373 13.044 -2.737 1.00 0.00 C ATOM 1472 C ARG A 123 4.491 14.164 -2.171 1.00 0.00 C ATOM 1473 O ARG A 123 4.833 15.328 -2.216 1.00 0.00 O ATOM 1474 CB ARG A 123 6.381 13.625 -3.736 1.00 0.00 C ATOM 1475 CG ARG A 123 7.516 14.326 -2.978 1.00 0.00 C ATOM 1476 CD ARG A 123 8.577 14.812 -3.968 1.00 0.00 C ATOM 1477 NE ARG A 123 9.664 15.518 -3.224 1.00 0.00 N ATOM 1478 CZ ARG A 123 10.667 14.843 -2.719 1.00 0.00 C ATOM 1479 NH1 ARG A 123 10.723 13.547 -2.856 1.00 0.00 N ATOM 1480 NH2 ARG A 123 11.612 15.470 -2.072 1.00 0.00 N ATOM 0 H ARG A 123 4.582 11.087 -3.046 1.00 0.00 H new ATOM 0 HA ARG A 123 5.915 12.568 -1.920 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.786 12.830 -4.362 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.883 14.332 -4.400 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.121 15.169 -2.411 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.963 13.640 -2.259 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.989 13.967 -4.520 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.127 15.483 -4.700 1.00 0.00 H new ATOM 0 HE ARG A 123 9.625 16.531 -3.109 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.984 13.055 -3.358 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.506 13.026 -2.461 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.568 16.483 -1.961 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.394 14.947 -1.678 1.00 0.00 H new ATOM 1494 N GLU A 124 3.359 13.815 -1.626 1.00 0.00 N ATOM 1495 CA GLU A 124 2.450 14.845 -1.039 1.00 0.00 C ATOM 1496 C GLU A 124 1.768 14.244 0.200 1.00 0.00 C ATOM 1497 O GLU A 124 0.695 13.687 0.105 1.00 0.00 O ATOM 1498 CB GLU A 124 1.385 15.238 -2.075 1.00 0.00 C ATOM 1499 CG GLU A 124 1.978 16.235 -3.079 1.00 0.00 C ATOM 1500 CD GLU A 124 2.224 17.578 -2.385 1.00 0.00 C ATOM 1501 OE1 GLU A 124 1.253 18.252 -2.081 1.00 0.00 O ATOM 1502 OE2 GLU A 124 3.379 17.908 -2.168 1.00 0.00 O ATOM 0 H GLU A 124 3.021 12.855 -1.561 1.00 0.00 H new ATOM 0 HA GLU A 124 3.018 15.732 -0.759 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.028 14.350 -2.598 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.524 15.681 -1.575 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.913 15.847 -3.484 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.297 16.368 -3.920 1.00 0.00 H new ATOM 1509 N PRO A 125 2.392 14.346 1.352 1.00 0.00 N ATOM 1510 CA PRO A 125 1.830 13.790 2.623 1.00 0.00 C ATOM 1511 C PRO A 125 0.417 14.320 2.914 1.00 0.00 C ATOM 1512 O PRO A 125 0.147 15.498 2.789 1.00 0.00 O ATOM 1513 CB PRO A 125 2.823 14.262 3.703 1.00 0.00 C ATOM 1514 CG PRO A 125 4.099 14.540 2.972 1.00 0.00 C ATOM 1515 CD PRO A 125 3.697 14.993 1.569 1.00 0.00 C ATOM 0 HA PRO A 125 1.724 12.706 2.580 1.00 0.00 H new ATOM 0 HB2 PRO A 125 2.458 15.155 4.210 1.00 0.00 H new ATOM 0 HB3 PRO A 125 2.966 13.498 4.467 1.00 0.00 H new ATOM 0 HG2 PRO A 125 4.678 15.312 3.479 1.00 0.00 H new ATOM 0 HG3 PRO A 125 4.725 13.649 2.929 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.621 16.078 1.505 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.428 14.680 0.823 1.00 0.00 H new ATOM 1523 N VAL A 126 -0.484 13.453 3.302 1.00 0.00 N ATOM 1524 CA VAL A 126 -1.884 13.893 3.606 1.00 0.00 C ATOM 1525 C VAL A 126 -2.424 13.124 4.813 1.00 0.00 C ATOM 1526 O VAL A 126 -1.905 12.094 5.196 1.00 0.00 O ATOM 1527 CB VAL A 126 -2.787 13.629 2.398 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -2.383 14.543 1.239 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -2.655 12.167 1.960 1.00 0.00 C ATOM 0 H VAL A 126 -0.311 12.455 3.422 1.00 0.00 H new ATOM 0 HA VAL A 126 -1.875 14.960 3.829 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.821 13.832 2.678 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.029 14.351 0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -2.485 15.584 1.544 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -1.347 14.346 0.964 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -3.300 11.985 1.100 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -1.620 11.961 1.687 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -2.951 11.513 2.780 1.00 0.00 H new ATOM 1539 N ASP A 127 -3.474 13.620 5.407 1.00 0.00 N ATOM 1540 CA ASP A 127 -4.069 12.929 6.584 1.00 0.00 C ATOM 1541 C ASP A 127 -4.569 11.545 6.161 1.00 0.00 C ATOM 1542 O ASP A 127 -4.414 10.574 6.875 1.00 0.00 O ATOM 1543 CB ASP A 127 -5.241 13.759 7.113 1.00 0.00 C ATOM 1544 CG ASP A 127 -4.705 15.016 7.802 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -3.518 15.055 8.080 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -5.491 15.919 8.039 1.00 0.00 O ATOM 0 H ASP A 127 -3.947 14.479 5.126 1.00 0.00 H new ATOM 0 HA ASP A 127 -3.318 12.818 7.366 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -5.904 14.035 6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -5.830 13.170 7.815 1.00 0.00 H new ATOM 1551 N SER A 128 -5.166 11.451 5.004 1.00 0.00 N ATOM 1552 CA SER A 128 -5.679 10.136 4.524 1.00 0.00 C ATOM 1553 C SER A 128 -5.805 10.174 3.000 1.00 0.00 C ATOM 1554 O SER A 128 -5.840 11.230 2.401 1.00 0.00 O ATOM 1555 CB SER A 128 -7.052 9.871 5.141 1.00 0.00 C ATOM 1556 OG SER A 128 -7.898 10.987 4.894 1.00 0.00 O ATOM 0 H SER A 128 -5.321 12.233 4.367 1.00 0.00 H new ATOM 0 HA SER A 128 -4.991 9.343 4.817 1.00 0.00 H new ATOM 0 HB2 SER A 128 -7.488 8.968 4.714 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.956 9.703 6.214 1.00 0.00 H new ATOM 0 HG SER A 128 -8.781 10.821 5.286 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.876 9.037 2.363 1.00 0.00 N ATOM 1563 CA ALA A 129 -6.002 9.029 0.875 1.00 0.00 C ATOM 1564 C ALA A 129 -6.617 7.706 0.411 1.00 0.00 C ATOM 1565 O ALA A 129 -6.458 6.676 1.036 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.617 9.208 0.246 1.00 0.00 C ATOM 0 H ALA A 129 -5.853 8.118 2.804 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.650 9.848 0.563 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.707 9.202 -0.840 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -4.190 10.157 0.570 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.966 8.392 0.560 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.321 7.735 -0.689 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.962 6.494 -1.218 1.00 0.00 C ATOM 1574 C VAL A 130 -7.039 5.854 -2.261 1.00 0.00 C ATOM 1575 O VAL A 130 -6.526 6.517 -3.140 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.299 6.863 -1.862 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.981 5.604 -2.402 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.195 7.517 -0.806 1.00 0.00 C ATOM 0 H VAL A 130 -7.481 8.572 -1.249 1.00 0.00 H new ATOM 0 HA VAL A 130 -8.132 5.785 -0.408 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.129 7.556 -2.686 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.933 5.874 -2.859 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.340 5.134 -3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -10.157 4.906 -1.584 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -11.151 7.784 -1.255 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.362 6.818 0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.710 8.415 -0.423 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.817 4.574 -2.159 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.918 3.885 -3.130 1.00 0.00 C ATOM 1590 C LEU A 131 -6.640 3.698 -4.469 1.00 0.00 C ATOM 1591 O LEU A 131 -7.849 3.595 -4.527 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.524 2.521 -2.562 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.871 2.707 -1.187 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.518 1.334 -0.610 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.596 3.561 -1.315 1.00 0.00 C ATOM 0 H LEU A 131 -7.221 3.971 -1.442 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.025 4.489 -3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.404 1.884 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.833 2.019 -3.239 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.568 3.218 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -4.053 1.459 0.368 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.425 0.738 -0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.824 0.826 -1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -3.142 3.686 -0.332 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.890 3.064 -1.981 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.852 4.539 -1.723 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.900 3.661 -5.550 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.527 3.486 -6.897 1.00 0.00 C ATOM 1609 C ALA A 132 -5.579 2.698 -7.808 1.00 0.00 C ATOM 1610 O ALA A 132 -4.392 2.613 -7.566 1.00 0.00 O ATOM 1611 CB ALA A 132 -6.807 4.861 -7.509 1.00 0.00 C ATOM 0 H ALA A 132 -4.883 3.745 -5.557 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.463 2.937 -6.794 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.264 4.736 -8.491 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.485 5.416 -6.861 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -5.872 5.411 -7.612 1.00 0.00 H new ATOM 1617 N ASN A 133 -6.105 2.105 -8.846 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.251 1.301 -9.770 1.00 0.00 C ATOM 1619 C ASN A 133 -4.115 2.157 -10.337 1.00 0.00 C ATOM 1620 O ASN A 133 -4.323 3.261 -10.802 1.00 0.00 O ATOM 1621 CB ASN A 133 -6.119 0.762 -10.912 1.00 0.00 C ATOM 1622 CG ASN A 133 -6.655 1.923 -11.752 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -6.665 3.057 -11.313 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -7.110 1.682 -12.952 1.00 0.00 N ATOM 0 H ASN A 133 -7.093 2.143 -9.095 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.810 0.471 -9.217 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -5.534 0.088 -11.538 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.948 0.181 -10.507 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -7.474 2.445 -13.522 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -7.101 0.730 -13.319 1.00 0.00 H new ATOM 1631 N GLY A 134 -2.910 1.644 -10.305 1.00 0.00 N ATOM 1632 CA GLY A 134 -1.746 2.409 -10.844 1.00 0.00 C ATOM 1633 C GLY A 134 -1.233 3.381 -9.782 1.00 0.00 C ATOM 1634 O GLY A 134 -0.478 4.286 -10.069 1.00 0.00 O ATOM 0 H GLY A 134 -2.683 0.724 -9.927 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.952 1.723 -11.137 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.041 2.956 -11.739 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.637 3.200 -8.554 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.171 4.117 -7.472 1.00 0.00 C ATOM 1640 C ASP A 135 0.202 3.664 -6.972 1.00 0.00 C ATOM 1641 O ASP A 135 0.520 2.490 -6.979 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.179 4.108 -6.316 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.366 5.009 -6.662 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.466 5.409 -7.810 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -4.149 5.294 -5.771 1.00 0.00 O ATOM 0 H ASP A 135 -2.269 2.458 -8.252 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.092 5.130 -7.865 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.524 3.091 -6.129 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.701 4.456 -5.400 1.00 0.00 H new ATOM 1650 N GLU A 136 1.015 4.593 -6.538 1.00 0.00 N ATOM 1651 CA GLU A 136 2.379 4.249 -6.027 1.00 0.00 C ATOM 1652 C GLU A 136 2.442 4.547 -4.529 1.00 0.00 C ATOM 1653 O GLU A 136 2.117 5.632 -4.089 1.00 0.00 O ATOM 1654 CB GLU A 136 3.426 5.101 -6.751 1.00 0.00 C ATOM 1655 CG GLU A 136 4.827 4.710 -6.276 1.00 0.00 C ATOM 1656 CD GLU A 136 5.872 5.520 -7.046 1.00 0.00 C ATOM 1657 OE1 GLU A 136 5.484 6.470 -7.707 1.00 0.00 O ATOM 1658 OE2 GLU A 136 7.038 5.177 -6.961 1.00 0.00 O ATOM 0 H GLU A 136 0.790 5.588 -6.515 1.00 0.00 H new ATOM 0 HA GLU A 136 2.580 3.193 -6.206 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.344 4.958 -7.828 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.247 6.158 -6.555 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.924 4.895 -5.206 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.991 3.644 -6.432 1.00 0.00 H new ATOM 1665 N VAL A 137 2.867 3.587 -3.747 1.00 0.00 N ATOM 1666 CA VAL A 137 2.972 3.786 -2.267 1.00 0.00 C ATOM 1667 C VAL A 137 4.422 3.546 -1.847 1.00 0.00 C ATOM 1668 O VAL A 137 5.032 2.563 -2.225 1.00 0.00 O ATOM 1669 CB VAL A 137 2.054 2.782 -1.556 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.353 2.772 -0.052 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.596 3.187 -1.781 1.00 0.00 C ATOM 0 H VAL A 137 3.149 2.663 -4.074 1.00 0.00 H new ATOM 0 HA VAL A 137 2.671 4.799 -1.998 1.00 0.00 H new ATOM 0 HB VAL A 137 2.229 1.785 -1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.697 2.057 0.445 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.392 2.485 0.111 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.183 3.767 0.359 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.061 2.477 -1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.429 4.185 -1.376 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.379 3.188 -2.849 1.00 0.00 H new ATOM 1681 N GLN A 138 4.979 4.441 -1.072 1.00 0.00 N ATOM 1682 CA GLN A 138 6.397 4.285 -0.618 1.00 0.00 C ATOM 1683 C GLN A 138 6.433 4.225 0.909 1.00 0.00 C ATOM 1684 O GLN A 138 6.047 5.159 1.583 1.00 0.00 O ATOM 1685 CB GLN A 138 7.214 5.487 -1.092 1.00 0.00 C ATOM 1686 CG GLN A 138 8.673 5.296 -0.685 1.00 0.00 C ATOM 1687 CD GLN A 138 9.524 6.414 -1.286 1.00 0.00 C ATOM 1688 OE1 GLN A 138 9.112 7.073 -2.219 1.00 0.00 O ATOM 1689 NE2 GLN A 138 10.703 6.657 -0.785 1.00 0.00 N ATOM 0 H GLN A 138 4.510 5.280 -0.731 1.00 0.00 H new ATOM 0 HA GLN A 138 6.816 3.368 -1.033 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.137 5.590 -2.174 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.820 6.405 -0.655 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.762 5.302 0.401 1.00 0.00 H new ATOM 0 HG3 GLN A 138 9.033 4.326 -1.029 1.00 0.00 H new ATOM 0 HE21 GLN A 138 11.048 6.103 -0.001 1.00 0.00 H new ATOM 0 HE22 GLN A 138 11.280 7.401 -1.177 1.00 0.00 H new ATOM 1698 N ILE A 139 6.899 3.130 1.456 1.00 0.00 N ATOM 1699 CA ILE A 139 6.974 2.986 2.947 1.00 0.00 C ATOM 1700 C ILE A 139 8.414 2.678 3.365 1.00 0.00 C ATOM 1701 O ILE A 139 9.044 1.777 2.849 1.00 0.00 O ATOM 1702 CB ILE A 139 6.064 1.836 3.391 1.00 0.00 C ATOM 1703 CG1 ILE A 139 4.605 2.200 3.096 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.239 1.590 4.892 1.00 0.00 C ATOM 1705 CD1 ILE A 139 3.721 0.966 3.286 1.00 0.00 C ATOM 0 H ILE A 139 7.234 2.322 0.931 1.00 0.00 H new ATOM 0 HA ILE A 139 6.652 3.916 3.416 1.00 0.00 H new ATOM 0 HB ILE A 139 6.331 0.931 2.846 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.278 3.000 3.760 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.512 2.573 2.076 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.590 0.772 5.205 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.277 1.330 5.100 1.00 0.00 H new ATOM 0 HG23 ILE A 139 5.974 2.493 5.442 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.683 1.226 3.076 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.043 0.179 2.604 1.00 0.00 H new ATOM 0 HD13 ILE A 139 3.806 0.613 4.314 1.00 0.00 H new ATOM 1717 N GLY A 140 8.933 3.413 4.309 1.00 0.00 N ATOM 1718 CA GLY A 140 10.326 3.159 4.777 1.00 0.00 C ATOM 1719 C GLY A 140 11.307 3.323 3.617 1.00 0.00 C ATOM 1720 O GLY A 140 11.279 4.301 2.895 1.00 0.00 O ATOM 0 H GLY A 140 8.452 4.181 4.778 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.580 3.851 5.579 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.402 2.152 5.188 1.00 0.00 H new ATOM 1724 N LYS A 141 12.184 2.369 3.444 1.00 0.00 N ATOM 1725 CA LYS A 141 13.192 2.441 2.340 1.00 0.00 C ATOM 1726 C LYS A 141 12.752 1.524 1.197 1.00 0.00 C ATOM 1727 O LYS A 141 13.233 1.619 0.086 1.00 0.00 O ATOM 1728 CB LYS A 141 14.547 1.966 2.874 1.00 0.00 C ATOM 1729 CG LYS A 141 15.633 2.209 1.824 1.00 0.00 C ATOM 1730 CD LYS A 141 16.995 1.804 2.395 1.00 0.00 C ATOM 1731 CE LYS A 141 18.081 2.065 1.350 1.00 0.00 C ATOM 1732 NZ LYS A 141 19.414 1.708 1.911 1.00 0.00 N ATOM 0 H LYS A 141 12.247 1.534 4.026 1.00 0.00 H new ATOM 0 HA LYS A 141 13.274 3.466 1.977 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.792 2.497 3.794 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.499 0.906 3.122 1.00 0.00 H new ATOM 0 HG2 LYS A 141 15.419 1.633 0.924 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.646 3.260 1.535 1.00 0.00 H new ATOM 0 HD2 LYS A 141 17.204 2.370 3.303 1.00 0.00 H new ATOM 0 HD3 LYS A 141 16.987 0.750 2.672 1.00 0.00 H new ATOM 0 HE2 LYS A 141 17.884 1.478 0.453 1.00 0.00 H new ATOM 0 HE3 LYS A 141 18.069 3.114 1.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 20.150 1.887 1.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 19.602 2.286 2.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 19.422 0.701 2.172 1.00 0.00 H new ATOM 1746 N PHE A 142 11.840 0.632 1.470 1.00 0.00 N ATOM 1747 CA PHE A 142 11.360 -0.305 0.418 1.00 0.00 C ATOM 1748 C PHE A 142 10.327 0.393 -0.469 1.00 0.00 C ATOM 1749 O PHE A 142 9.588 1.250 -0.024 1.00 0.00 O ATOM 1750 CB PHE A 142 10.730 -1.530 1.083 1.00 0.00 C ATOM 1751 CG PHE A 142 11.821 -2.377 1.692 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.477 -3.335 0.913 1.00 0.00 C ATOM 1753 CD2 PHE A 142 12.182 -2.199 3.034 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.495 -4.116 1.473 1.00 0.00 C ATOM 1755 CE2 PHE A 142 13.201 -2.979 3.593 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.857 -3.938 2.812 1.00 0.00 C ATOM 0 H PHE A 142 11.404 0.512 2.384 1.00 0.00 H new ATOM 0 HA PHE A 142 12.201 -0.618 -0.200 1.00 0.00 H new ATOM 0 HB2 PHE A 142 10.023 -1.219 1.851 1.00 0.00 H new ATOM 0 HB3 PHE A 142 10.169 -2.109 0.350 1.00 0.00 H new ATOM 0 HD1 PHE A 142 12.198 -3.473 -0.121 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.674 -1.460 3.637 1.00 0.00 H new ATOM 0 HE1 PHE A 142 14.001 -4.856 0.871 1.00 0.00 H new ATOM 0 HE2 PHE A 142 13.481 -2.841 4.627 1.00 0.00 H new ATOM 0 HZ PHE A 142 14.643 -4.540 3.244 1.00 0.00 H new ATOM 1766 N ARG A 143 10.279 0.035 -1.728 1.00 0.00 N ATOM 1767 CA ARG A 143 9.305 0.670 -2.670 1.00 0.00 C ATOM 1768 C ARG A 143 8.168 -0.310 -2.953 1.00 0.00 C ATOM 1769 O ARG A 143 8.394 -1.486 -3.164 1.00 0.00 O ATOM 1770 CB ARG A 143 10.020 0.989 -3.982 1.00 0.00 C ATOM 1771 CG ARG A 143 11.158 1.965 -3.707 1.00 0.00 C ATOM 1772 CD ARG A 143 11.950 2.207 -4.990 1.00 0.00 C ATOM 1773 NE ARG A 143 13.073 3.142 -4.697 1.00 0.00 N ATOM 1774 CZ ARG A 143 13.934 3.441 -5.628 1.00 0.00 C ATOM 1775 NH1 ARG A 143 13.815 2.925 -6.821 1.00 0.00 N ATOM 1776 NH2 ARG A 143 14.918 4.260 -5.365 1.00 0.00 N ATOM 0 H ARG A 143 10.878 -0.676 -2.147 1.00 0.00 H new ATOM 0 HA ARG A 143 8.906 1.583 -2.228 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.409 0.075 -4.430 1.00 0.00 H new ATOM 0 HB3 ARG A 143 9.319 1.421 -4.697 1.00 0.00 H new ATOM 0 HG2 ARG A 143 10.759 2.907 -3.331 1.00 0.00 H new ATOM 0 HG3 ARG A 143 11.814 1.565 -2.933 1.00 0.00 H new ATOM 0 HD2 ARG A 143 12.336 1.264 -5.378 1.00 0.00 H new ATOM 0 HD3 ARG A 143 11.302 2.626 -5.759 1.00 0.00 H new ATOM 0 HE ARG A 143 13.168 3.548 -3.766 1.00 0.00 H new ATOM 0 HH11 ARG A 143 13.047 2.286 -7.026 1.00 0.00 H new ATOM 0 HH12 ARG A 143 14.490 3.161 -7.548 1.00 0.00 H new ATOM 0 HH21 ARG A 143 15.010 4.663 -4.433 1.00 0.00 H new ATOM 0 HH22 ARG A 143 15.593 4.496 -6.092 1.00 0.00 H new ATOM 1790 N LEU A 144 6.949 0.161 -2.967 1.00 0.00 N ATOM 1791 CA LEU A 144 5.790 -0.743 -3.245 1.00 0.00 C ATOM 1792 C LEU A 144 4.805 -0.029 -4.168 1.00 0.00 C ATOM 1793 O LEU A 144 4.694 1.180 -4.152 1.00 0.00 O ATOM 1794 CB LEU A 144 5.088 -1.105 -1.931 1.00 0.00 C ATOM 1795 CG LEU A 144 6.066 -1.874 -1.005 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.746 -0.902 -0.034 1.00 0.00 C ATOM 1797 CD2 LEU A 144 5.301 -2.931 -0.199 1.00 0.00 C ATOM 0 H LEU A 144 6.704 1.136 -2.797 1.00 0.00 H new ATOM 0 HA LEU A 144 6.148 -1.655 -3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.738 -0.200 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 144 4.209 -1.717 -2.135 1.00 0.00 H new ATOM 0 HG LEU A 144 6.821 -2.359 -1.624 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.431 -1.452 0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 144 7.302 -0.153 -0.598 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.990 -0.408 0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.995 -3.467 0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.539 -2.444 0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.825 -3.635 -0.882 1.00 0.00 H new ATOM 1809 N VAL A 145 4.085 -0.771 -4.972 1.00 0.00 N ATOM 1810 CA VAL A 145 3.094 -0.150 -5.905 1.00 0.00 C ATOM 1811 C VAL A 145 1.722 -0.785 -5.667 1.00 0.00 C ATOM 1812 O VAL A 145 1.591 -1.989 -5.577 1.00 0.00 O ATOM 1813 CB VAL A 145 3.539 -0.390 -7.351 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.438 -1.880 -7.683 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.641 0.416 -8.294 1.00 0.00 C ATOM 0 H VAL A 145 4.142 -1.788 -5.023 1.00 0.00 H new ATOM 0 HA VAL A 145 3.033 0.923 -5.726 1.00 0.00 H new ATOM 0 HB VAL A 145 4.574 -0.071 -7.473 1.00 0.00 H new ATOM 0 HG11 VAL A 145 3.756 -2.046 -8.712 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.080 -2.447 -7.009 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.406 -2.210 -7.564 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.953 0.249 -9.325 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.606 0.097 -8.172 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.724 1.477 -8.057 1.00 0.00 H new ATOM 1825 N PHE A 146 0.701 0.020 -5.553 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.668 -0.524 -5.311 1.00 0.00 C ATOM 1827 C PHE A 146 -1.386 -0.711 -6.646 1.00 0.00 C ATOM 1828 O PHE A 146 -1.633 0.236 -7.374 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.448 0.467 -4.446 1.00 0.00 C ATOM 1830 CG PHE A 146 -2.857 -0.028 -4.246 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -3.152 -0.896 -3.189 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.872 0.382 -5.119 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -4.461 -1.351 -3.002 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -5.181 -0.074 -4.934 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.476 -0.939 -3.875 1.00 0.00 C ATOM 0 H PHE A 146 0.755 1.037 -5.617 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.600 -1.486 -4.803 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -0.955 0.588 -3.481 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.461 1.447 -4.922 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -2.369 -1.215 -2.517 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -3.644 1.051 -5.936 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.689 -2.020 -2.185 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -5.964 0.241 -5.608 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.487 -1.289 -3.730 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.727 -1.937 -6.968 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.434 -2.224 -8.255 1.00 0.00 C ATOM 1847 C LEU A 147 -3.679 -3.066 -7.971 1.00 0.00 C ATOM 1848 O LEU A 147 -3.665 -3.961 -7.146 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.488 -2.991 -9.183 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.259 -2.129 -9.500 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.735 -2.957 -10.319 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -0.677 -0.881 -10.300 1.00 0.00 C ATOM 0 H LEU A 147 -1.544 -2.756 -6.389 1.00 0.00 H new ATOM 0 HA LEU A 147 -2.734 -1.291 -8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -1.178 -3.923 -8.711 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -2.005 -3.257 -10.105 1.00 0.00 H new ATOM 0 HG LEU A 147 0.206 -1.808 -8.568 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.611 -2.351 -10.548 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.039 -3.832 -9.745 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.263 -3.278 -11.248 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.204 -0.277 -10.519 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.148 -1.188 -11.234 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.383 -0.293 -9.714 1.00 0.00 H new ATOM 1864 N THR A 148 -4.762 -2.776 -8.645 1.00 0.00 N ATOM 1865 CA THR A 148 -6.030 -3.539 -8.426 1.00 0.00 C ATOM 1866 C THR A 148 -6.208 -4.585 -9.528 1.00 0.00 C ATOM 1867 O THR A 148 -5.521 -4.572 -10.532 1.00 0.00 O ATOM 1868 CB THR A 148 -7.207 -2.564 -8.449 1.00 0.00 C ATOM 1869 OG1 THR A 148 -7.310 -1.981 -9.741 1.00 0.00 O ATOM 1870 CG2 THR A 148 -6.976 -1.469 -7.405 1.00 0.00 C ATOM 0 H THR A 148 -4.824 -2.036 -9.345 1.00 0.00 H new ATOM 0 HA THR A 148 -5.988 -4.046 -7.462 1.00 0.00 H new ATOM 0 HB THR A 148 -8.131 -3.095 -8.218 1.00 0.00 H new ATOM 0 HG1 THR A 148 -8.151 -1.483 -9.809 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.813 -0.771 -7.418 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.895 -1.920 -6.416 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.055 -0.934 -7.636 1.00 0.00 H new