USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=11 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 Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.0547 K(o=-0.055,f=-1.8!) USER MOD Single : A 68 SER OG : rot -120:sc= 1.65 USER MOD Single : A 74 GLN : amide:sc= -2.11! K(o=-2.1!,f=-0.18) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HD1:sc= -2.3! C(o=-2.3!,f=-2.6!) USER MOD Single : A 85 SER OG : rot 89:sc= 1.09 USER MOD Single : A 93 THR OG1 : rot 148:sc= 0.0274 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 HIS : no HD1:sc= -0.53 X(o=-0.53,f=-0.47) USER MOD Single : A 105 ASN : amide:sc= -1.03 K(o=-1,f=-5.6!) USER MOD Single : A 106 ASN : amide:sc= -1.5 K(o=-1.5,f=-4.4!) USER MOD Single : A 109 ASN : amide:sc= -3.16 K(o=-3.2,f=-7.4!) USER MOD Single : A 119 THR OG1 : rot 34:sc= 0.132 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -1.05 K(o=-1.1,f=-3.4!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -1.83! C(o=-1.8!,f=-3.2!) USER MOD Single : A 138 GLN : amide:sc=-0.00398 K(o=-0.004,f=-1.5!) USER MOD Single : A 141 LYS NZ :NH3+ 164:sc= -0.012 (180deg=-0.312) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -12.809 -7.209 -5.626 1.00 0.00 N ATOM 417 CA GLY A 54 -12.942 -7.580 -4.187 1.00 0.00 C ATOM 418 C GLY A 54 -11.587 -7.417 -3.498 1.00 0.00 C ATOM 419 O GLY A 54 -11.360 -6.472 -2.769 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.687 -6.948 -3.704 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.289 -8.609 -4.095 1.00 0.00 H new ATOM 423 N LEU A 55 -10.686 -8.339 -3.719 1.00 0.00 N ATOM 424 CA LEU A 55 -9.341 -8.254 -3.072 1.00 0.00 C ATOM 425 C LEU A 55 -8.333 -7.609 -4.026 1.00 0.00 C ATOM 426 O LEU A 55 -8.451 -7.700 -5.233 1.00 0.00 O ATOM 427 CB LEU A 55 -8.869 -9.669 -2.708 1.00 0.00 C ATOM 428 CG LEU A 55 -9.515 -10.112 -1.392 1.00 0.00 C ATOM 429 CD1 LEU A 55 -11.024 -10.258 -1.584 1.00 0.00 C ATOM 430 CD2 LEU A 55 -8.920 -11.455 -0.965 1.00 0.00 C ATOM 0 H LEU A 55 -10.824 -9.150 -4.322 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.414 -7.642 -2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.131 -10.365 -3.504 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.783 -9.687 -2.614 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.322 -9.365 -0.622 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.481 -10.573 -0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.446 -9.301 -1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -11.222 -11.004 -2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.377 -11.774 -0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.114 -12.201 -1.736 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.844 -11.349 -0.826 1.00 0.00 H new ATOM 442 N ALA A 56 -7.336 -6.960 -3.477 1.00 0.00 N ATOM 443 CA ALA A 56 -6.290 -6.297 -4.313 1.00 0.00 C ATOM 444 C ALA A 56 -4.914 -6.776 -3.858 1.00 0.00 C ATOM 445 O ALA A 56 -4.766 -7.329 -2.785 1.00 0.00 O ATOM 446 CB ALA A 56 -6.384 -4.785 -4.133 1.00 0.00 C ATOM 0 H ALA A 56 -7.202 -6.861 -2.471 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.440 -6.548 -5.363 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.622 -4.298 -4.742 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.371 -4.442 -4.444 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.226 -4.533 -3.084 1.00 0.00 H new ATOM 452 N LEU A 57 -3.909 -6.586 -4.677 1.00 0.00 N ATOM 453 CA LEU A 57 -2.534 -7.047 -4.313 1.00 0.00 C ATOM 454 C LEU A 57 -1.535 -5.904 -4.446 1.00 0.00 C ATOM 455 O LEU A 57 -1.720 -4.973 -5.208 1.00 0.00 O ATOM 456 CB LEU A 57 -2.116 -8.187 -5.246 1.00 0.00 C ATOM 457 CG LEU A 57 -3.016 -9.426 -5.013 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.216 -9.401 -5.969 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.209 -10.707 -5.260 1.00 0.00 C ATOM 0 H LEU A 57 -3.983 -6.129 -5.586 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.544 -7.392 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.192 -7.863 -6.284 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.073 -8.448 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.374 -9.405 -3.984 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.839 -10.278 -5.794 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.802 -8.499 -5.794 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.861 -9.409 -6.999 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.846 -11.576 -5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.844 -10.715 -6.287 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.363 -10.742 -4.574 1.00 0.00 H new ATOM 471 N LEU A 58 -0.469 -5.985 -3.693 1.00 0.00 N ATOM 472 CA LEU A 58 0.584 -4.932 -3.729 1.00 0.00 C ATOM 473 C LEU A 58 1.865 -5.541 -4.286 1.00 0.00 C ATOM 474 O LEU A 58 2.198 -6.673 -3.996 1.00 0.00 O ATOM 475 CB LEU A 58 0.841 -4.441 -2.305 1.00 0.00 C ATOM 476 CG LEU A 58 -0.479 -4.004 -1.664 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.214 -3.512 -0.239 1.00 0.00 C ATOM 478 CD2 LEU A 58 -1.114 -2.877 -2.491 1.00 0.00 C ATOM 0 H LEU A 58 -0.283 -6.750 -3.045 1.00 0.00 H new ATOM 0 HA LEU A 58 0.264 -4.099 -4.355 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.299 -5.234 -1.714 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.543 -3.608 -2.319 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.163 -4.852 -1.635 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.153 -3.200 0.219 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.226 -4.318 0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.474 -2.667 -0.268 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.053 -2.571 -2.029 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.434 -2.026 -2.529 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.307 -3.233 -3.503 1.00 0.00 H new ATOM 490 N VAL A 59 2.584 -4.799 -5.092 1.00 0.00 N ATOM 491 CA VAL A 59 3.851 -5.327 -5.683 1.00 0.00 C ATOM 492 C VAL A 59 4.996 -4.358 -5.401 1.00 0.00 C ATOM 493 O VAL A 59 4.879 -3.162 -5.588 1.00 0.00 O ATOM 494 CB VAL A 59 3.675 -5.491 -7.191 1.00 0.00 C ATOM 495 CG1 VAL A 59 4.975 -6.022 -7.798 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.539 -6.487 -7.460 1.00 0.00 C ATOM 0 H VAL A 59 2.346 -3.846 -5.367 1.00 0.00 H new ATOM 0 HA VAL A 59 4.085 -6.293 -5.236 1.00 0.00 H new ATOM 0 HB VAL A 59 3.432 -4.528 -7.641 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.852 -6.140 -8.875 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.783 -5.318 -7.600 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.217 -6.987 -7.352 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.408 -6.608 -8.535 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.786 -7.450 -7.014 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.614 -6.111 -7.022 1.00 0.00 H new ATOM 506 N VAL A 60 6.103 -4.875 -4.947 1.00 0.00 N ATOM 507 CA VAL A 60 7.268 -4.006 -4.641 1.00 0.00 C ATOM 508 C VAL A 60 7.892 -3.505 -5.942 1.00 0.00 C ATOM 509 O VAL A 60 8.127 -4.257 -6.866 1.00 0.00 O ATOM 510 CB VAL A 60 8.296 -4.811 -3.849 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.570 -3.985 -3.656 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.704 -5.163 -2.485 1.00 0.00 C ATOM 0 H VAL A 60 6.250 -5.870 -4.774 1.00 0.00 H new ATOM 0 HA VAL A 60 6.943 -3.149 -4.052 1.00 0.00 H new ATOM 0 HB VAL A 60 8.545 -5.722 -4.394 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.298 -4.566 -3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 60 9.988 -3.728 -4.629 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.332 -3.072 -3.111 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.430 -5.738 -1.911 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.460 -4.247 -1.947 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.799 -5.755 -2.623 1.00 0.00 H new ATOM 522 N LYS A 61 8.157 -2.234 -6.015 1.00 0.00 N ATOM 523 CA LYS A 61 8.760 -1.663 -7.247 1.00 0.00 C ATOM 524 C LYS A 61 10.266 -1.896 -7.222 1.00 0.00 C ATOM 525 O LYS A 61 10.780 -2.763 -7.904 1.00 0.00 O ATOM 526 CB LYS A 61 8.481 -0.162 -7.294 1.00 0.00 C ATOM 527 CG LYS A 61 8.874 0.411 -8.666 1.00 0.00 C ATOM 528 CD LYS A 61 7.710 0.253 -9.646 1.00 0.00 C ATOM 529 CE LYS A 61 8.074 0.894 -10.982 1.00 0.00 C ATOM 530 NZ LYS A 61 6.932 0.737 -11.923 1.00 0.00 N ATOM 0 H LYS A 61 7.981 -1.561 -5.269 1.00 0.00 H new ATOM 0 HA LYS A 61 8.329 -2.143 -8.126 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.424 0.024 -7.104 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.041 0.344 -6.507 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.139 1.464 -8.568 1.00 0.00 H new ATOM 0 HG3 LYS A 61 9.755 -0.105 -9.047 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.482 -0.803 -9.788 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.813 0.720 -9.239 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.304 1.950 -10.842 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.968 0.425 -11.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.173 1.172 -12.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.734 -0.274 -12.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.090 1.204 -11.529 1.00 0.00 H new ATOM 544 N ARG A 62 10.979 -1.113 -6.452 1.00 0.00 N ATOM 545 CA ARG A 62 12.459 -1.273 -6.384 1.00 0.00 C ATOM 546 C ARG A 62 12.915 -1.246 -4.933 1.00 0.00 C ATOM 547 O ARG A 62 12.449 -0.461 -4.129 1.00 0.00 O ATOM 548 CB ARG A 62 13.132 -0.126 -7.141 1.00 0.00 C ATOM 549 CG ARG A 62 14.628 -0.436 -7.332 1.00 0.00 C ATOM 550 CD ARG A 62 14.829 -1.280 -8.598 1.00 0.00 C ATOM 551 NE ARG A 62 16.274 -1.590 -8.770 1.00 0.00 N ATOM 552 CZ ARG A 62 16.821 -2.578 -8.115 1.00 0.00 C ATOM 553 NH1 ARG A 62 16.115 -3.285 -7.275 1.00 0.00 N ATOM 554 NH2 ARG A 62 18.080 -2.852 -8.300 1.00 0.00 N ATOM 0 H ARG A 62 10.597 -0.369 -5.868 1.00 0.00 H new ATOM 0 HA ARG A 62 12.735 -2.226 -6.835 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.653 0.013 -8.110 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.012 0.806 -6.589 1.00 0.00 H new ATOM 0 HG2 ARG A 62 15.194 0.492 -7.410 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.011 -0.971 -6.463 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.255 -2.204 -8.526 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.457 -0.741 -9.469 1.00 0.00 H new ATOM 0 HE ARG A 62 16.841 -1.027 -9.404 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.130 -3.067 -7.127 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.549 -4.056 -6.767 1.00 0.00 H new ATOM 0 HH21 ARG A 62 18.632 -2.296 -8.953 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.514 -3.622 -7.792 1.00 0.00 H new ATOM 568 N GLY A 63 13.838 -2.096 -4.601 1.00 0.00 N ATOM 569 CA GLY A 63 14.358 -2.136 -3.214 1.00 0.00 C ATOM 570 C GLY A 63 15.061 -3.476 -2.986 1.00 0.00 C ATOM 571 O GLY A 63 15.157 -4.290 -3.882 1.00 0.00 O ATOM 0 H GLY A 63 14.259 -2.772 -5.239 1.00 0.00 H new ATOM 0 HA2 GLY A 63 15.053 -1.313 -3.048 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.542 -2.013 -2.502 1.00 0.00 H new ATOM 575 N PRO A 64 15.545 -3.705 -1.794 1.00 0.00 N ATOM 576 CA PRO A 64 16.244 -4.978 -1.435 1.00 0.00 C ATOM 577 C PRO A 64 15.384 -6.211 -1.745 1.00 0.00 C ATOM 578 O PRO A 64 15.870 -7.235 -2.182 1.00 0.00 O ATOM 579 CB PRO A 64 16.470 -4.846 0.082 1.00 0.00 C ATOM 580 CG PRO A 64 16.468 -3.377 0.344 1.00 0.00 C ATOM 581 CD PRO A 64 15.478 -2.780 -0.654 1.00 0.00 C ATOM 0 HA PRO A 64 17.164 -5.117 -2.003 1.00 0.00 H new ATOM 0 HB2 PRO A 64 15.683 -5.349 0.644 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.415 -5.300 0.382 1.00 0.00 H new ATOM 0 HG2 PRO A 64 16.167 -3.163 1.370 1.00 0.00 H new ATOM 0 HG3 PRO A 64 17.463 -2.954 0.209 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.472 -2.726 -0.239 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.759 -1.767 -0.941 1.00 0.00 H new ATOM 589 N ASN A 65 14.106 -6.108 -1.504 1.00 0.00 N ATOM 590 CA ASN A 65 13.193 -7.255 -1.764 1.00 0.00 C ATOM 591 C ASN A 65 12.941 -7.397 -3.269 1.00 0.00 C ATOM 592 O ASN A 65 13.523 -8.236 -3.933 1.00 0.00 O ATOM 593 CB ASN A 65 11.859 -6.994 -1.056 1.00 0.00 C ATOM 594 CG ASN A 65 12.031 -7.174 0.455 1.00 0.00 C ATOM 595 OD1 ASN A 65 12.982 -7.781 0.904 1.00 0.00 O ATOM 596 ND2 ASN A 65 11.140 -6.665 1.264 1.00 0.00 N ATOM 0 H ASN A 65 13.653 -5.272 -1.135 1.00 0.00 H new ATOM 0 HA ASN A 65 13.649 -8.172 -1.390 1.00 0.00 H new ATOM 0 HB2 ASN A 65 11.512 -5.984 -1.274 1.00 0.00 H new ATOM 0 HB3 ASN A 65 11.098 -7.680 -1.429 1.00 0.00 H new ATOM 0 HD21 ASN A 65 11.243 -6.778 2.272 1.00 0.00 H new ATOM 0 HD22 ASN A 65 10.341 -6.155 0.887 1.00 0.00 H new ATOM 603 N ALA A 66 12.080 -6.581 -3.808 1.00 0.00 N ATOM 604 CA ALA A 66 11.770 -6.654 -5.269 1.00 0.00 C ATOM 605 C ALA A 66 11.217 -8.037 -5.629 1.00 0.00 C ATOM 606 O ALA A 66 11.852 -9.053 -5.409 1.00 0.00 O ATOM 607 CB ALA A 66 13.038 -6.381 -6.083 1.00 0.00 C ATOM 0 H ALA A 66 11.572 -5.859 -3.297 1.00 0.00 H new ATOM 0 HA ALA A 66 11.018 -5.901 -5.504 1.00 0.00 H new ATOM 0 HB1 ALA A 66 12.806 -6.435 -7.147 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.417 -5.387 -5.845 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.795 -7.126 -5.838 1.00 0.00 H new ATOM 613 N GLY A 67 10.035 -8.076 -6.188 1.00 0.00 N ATOM 614 CA GLY A 67 9.409 -9.378 -6.578 1.00 0.00 C ATOM 615 C GLY A 67 8.406 -9.803 -5.501 1.00 0.00 C ATOM 616 O GLY A 67 7.535 -10.617 -5.734 1.00 0.00 O ATOM 0 H GLY A 67 9.469 -7.252 -6.394 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.906 -9.279 -7.540 1.00 0.00 H new ATOM 0 HA3 GLY A 67 10.177 -10.142 -6.697 1.00 0.00 H new ATOM 620 N SER A 68 8.528 -9.260 -4.321 1.00 0.00 N ATOM 621 CA SER A 68 7.592 -9.635 -3.219 1.00 0.00 C ATOM 622 C SER A 68 6.177 -9.137 -3.523 1.00 0.00 C ATOM 623 O SER A 68 5.987 -8.079 -4.098 1.00 0.00 O ATOM 624 CB SER A 68 8.078 -9.017 -1.912 1.00 0.00 C ATOM 625 OG SER A 68 7.150 -9.313 -0.878 1.00 0.00 O ATOM 0 H SER A 68 9.237 -8.571 -4.070 1.00 0.00 H new ATOM 0 HA SER A 68 7.569 -10.721 -3.131 1.00 0.00 H new ATOM 0 HB2 SER A 68 9.062 -9.408 -1.656 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.183 -7.938 -2.024 1.00 0.00 H new ATOM 0 HG SER A 68 6.792 -8.478 -0.511 1.00 0.00 H new ATOM 631 N ARG A 69 5.181 -9.896 -3.132 1.00 0.00 N ATOM 632 CA ARG A 69 3.764 -9.491 -3.383 1.00 0.00 C ATOM 633 C ARG A 69 2.934 -9.705 -2.117 1.00 0.00 C ATOM 634 O ARG A 69 3.158 -10.638 -1.370 1.00 0.00 O ATOM 635 CB ARG A 69 3.195 -10.346 -4.512 1.00 0.00 C ATOM 636 CG ARG A 69 4.001 -10.092 -5.785 1.00 0.00 C ATOM 637 CD ARG A 69 3.362 -10.838 -6.958 1.00 0.00 C ATOM 638 NE ARG A 69 3.484 -12.307 -6.744 1.00 0.00 N ATOM 639 CZ ARG A 69 2.959 -13.143 -7.601 1.00 0.00 C ATOM 640 NH1 ARG A 69 2.321 -12.695 -8.647 1.00 0.00 N ATOM 641 NH2 ARG A 69 3.072 -14.428 -7.407 1.00 0.00 N ATOM 0 H ARG A 69 5.292 -10.786 -2.646 1.00 0.00 H new ATOM 0 HA ARG A 69 3.729 -8.438 -3.661 1.00 0.00 H new ATOM 0 HB2 ARG A 69 3.239 -11.401 -4.243 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.145 -10.102 -4.676 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.037 -9.023 -5.997 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.030 -10.424 -5.648 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.312 -10.560 -7.050 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.850 -10.555 -7.891 1.00 0.00 H new ATOM 0 HE ARG A 69 3.979 -12.662 -5.926 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.231 -11.690 -8.798 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.912 -13.349 -9.314 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.569 -14.778 -6.588 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.663 -15.082 -8.074 1.00 0.00 H new ATOM 655 N PHE A 70 1.973 -8.846 -1.873 1.00 0.00 N ATOM 656 CA PHE A 70 1.114 -8.988 -0.656 1.00 0.00 C ATOM 657 C PHE A 70 -0.357 -8.852 -1.048 1.00 0.00 C ATOM 658 O PHE A 70 -0.723 -8.023 -1.859 1.00 0.00 O ATOM 659 CB PHE A 70 1.482 -7.896 0.346 1.00 0.00 C ATOM 660 CG PHE A 70 2.947 -8.015 0.691 1.00 0.00 C ATOM 661 CD1 PHE A 70 3.376 -9.001 1.587 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.877 -7.143 0.112 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.734 -9.115 1.905 1.00 0.00 C ATOM 664 CE2 PHE A 70 5.235 -7.257 0.430 1.00 0.00 C ATOM 665 CZ PHE A 70 5.664 -8.242 1.326 1.00 0.00 C ATOM 0 H PHE A 70 1.746 -8.049 -2.468 1.00 0.00 H new ATOM 0 HA PHE A 70 1.275 -9.967 -0.205 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.274 -6.913 -0.076 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.875 -7.992 1.246 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.659 -9.674 2.033 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.546 -6.383 -0.580 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.065 -9.876 2.597 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.952 -6.584 -0.017 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.712 -8.329 1.571 1.00 0.00 H new ATOM 675 N LEU A 71 -1.202 -9.668 -0.470 1.00 0.00 N ATOM 676 CA LEU A 71 -2.663 -9.619 -0.788 1.00 0.00 C ATOM 677 C LEU A 71 -3.427 -8.990 0.378 1.00 0.00 C ATOM 678 O LEU A 71 -3.079 -9.159 1.530 1.00 0.00 O ATOM 679 CB LEU A 71 -3.164 -11.049 -1.037 1.00 0.00 C ATOM 680 CG LEU A 71 -3.222 -11.856 0.293 1.00 0.00 C ATOM 681 CD1 LEU A 71 -4.657 -11.891 0.842 1.00 0.00 C ATOM 682 CD2 LEU A 71 -2.745 -13.298 0.050 1.00 0.00 C ATOM 0 H LEU A 71 -0.939 -10.375 0.217 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.828 -9.013 -1.679 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.154 -11.018 -1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.504 -11.552 -1.744 1.00 0.00 H new ATOM 0 HG LEU A 71 -2.572 -11.367 1.019 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.677 -12.460 1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.999 -10.874 1.031 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.314 -12.365 0.113 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.788 -13.858 0.984 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.389 -13.775 -0.689 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.719 -13.285 -0.318 1.00 0.00 H new ATOM 694 N LEU A 72 -4.468 -8.256 0.082 1.00 0.00 N ATOM 695 CA LEU A 72 -5.266 -7.602 1.160 1.00 0.00 C ATOM 696 C LEU A 72 -6.518 -8.435 1.451 1.00 0.00 C ATOM 697 O LEU A 72 -7.314 -8.715 0.575 1.00 0.00 O ATOM 698 CB LEU A 72 -5.663 -6.200 0.694 1.00 0.00 C ATOM 699 CG LEU A 72 -4.398 -5.380 0.394 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.801 -4.001 -0.138 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.560 -5.211 1.675 1.00 0.00 C ATOM 0 H LEU A 72 -4.801 -8.081 -0.866 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.675 -7.530 2.073 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.287 -6.265 -0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.256 -5.705 1.463 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.802 -5.904 -0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.905 -3.417 -0.352 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.383 -4.119 -1.052 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.401 -3.484 0.610 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.666 -4.629 1.451 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.151 -4.693 2.431 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.269 -6.192 2.051 1.00 0.00 H new ATOM 713 N ASP A 73 -6.693 -8.831 2.687 1.00 0.00 N ATOM 714 CA ASP A 73 -7.882 -9.650 3.066 1.00 0.00 C ATOM 715 C ASP A 73 -8.993 -8.721 3.570 1.00 0.00 C ATOM 716 O ASP A 73 -9.721 -9.039 4.490 1.00 0.00 O ATOM 717 CB ASP A 73 -7.475 -10.652 4.156 1.00 0.00 C ATOM 718 CG ASP A 73 -6.984 -9.910 5.402 1.00 0.00 C ATOM 719 OD1 ASP A 73 -6.893 -8.695 5.349 1.00 0.00 O ATOM 720 OD2 ASP A 73 -6.707 -10.573 6.388 1.00 0.00 O ATOM 0 H ASP A 73 -6.056 -8.619 3.455 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.253 -10.202 2.203 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.324 -11.286 4.413 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -6.689 -11.308 3.782 1.00 0.00 H new ATOM 725 N GLN A 74 -9.124 -7.577 2.948 1.00 0.00 N ATOM 726 CA GLN A 74 -10.182 -6.596 3.338 1.00 0.00 C ATOM 727 C GLN A 74 -10.074 -6.232 4.821 1.00 0.00 C ATOM 728 O GLN A 74 -9.102 -6.537 5.485 1.00 0.00 O ATOM 729 CB GLN A 74 -11.572 -7.188 3.069 1.00 0.00 C ATOM 730 CG GLN A 74 -11.771 -7.358 1.561 1.00 0.00 C ATOM 731 CD GLN A 74 -13.160 -7.938 1.285 1.00 0.00 C ATOM 732 OE1 GLN A 74 -14.148 -7.451 1.800 1.00 0.00 O ATOM 733 NE2 GLN A 74 -13.282 -8.962 0.485 1.00 0.00 N ATOM 0 H GLN A 74 -8.532 -7.276 2.173 1.00 0.00 H new ATOM 0 HA GLN A 74 -10.039 -5.695 2.741 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -11.672 -8.150 3.571 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -12.343 -6.534 3.477 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -11.662 -6.396 1.060 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -11.004 -8.018 1.156 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -12.455 -9.372 0.052 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -14.205 -9.352 0.293 1.00 0.00 H new ATOM 742 N ALA A 75 -11.081 -5.575 5.335 1.00 0.00 N ATOM 743 CA ALA A 75 -11.087 -5.171 6.772 1.00 0.00 C ATOM 744 C ALA A 75 -9.941 -4.203 7.065 1.00 0.00 C ATOM 745 O ALA A 75 -9.627 -3.333 6.277 1.00 0.00 O ATOM 746 CB ALA A 75 -10.944 -6.407 7.662 1.00 0.00 C ATOM 0 H ALA A 75 -11.911 -5.297 4.812 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.034 -4.674 6.983 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.949 -6.104 8.709 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -11.776 -7.087 7.477 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -10.005 -6.912 7.435 1.00 0.00 H new ATOM 752 N ILE A 76 -9.326 -4.348 8.213 1.00 0.00 N ATOM 753 CA ILE A 76 -8.201 -3.442 8.604 1.00 0.00 C ATOM 754 C ILE A 76 -6.901 -4.236 8.671 1.00 0.00 C ATOM 755 O ILE A 76 -6.818 -5.255 9.329 1.00 0.00 O ATOM 756 CB ILE A 76 -8.495 -2.837 9.977 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.780 -2.007 9.895 1.00 0.00 C ATOM 758 CG2 ILE A 76 -7.329 -1.938 10.393 1.00 0.00 C ATOM 759 CD1 ILE A 76 -10.220 -1.590 11.300 1.00 0.00 C ATOM 0 H ILE A 76 -9.558 -5.063 8.903 1.00 0.00 H new ATOM 0 HA ILE A 76 -8.102 -2.648 7.864 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.620 -3.631 10.713 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.614 -1.123 9.279 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.568 -2.587 9.415 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.535 -1.505 11.372 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.414 -2.528 10.443 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.206 -1.140 9.661 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.134 -1.000 11.235 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.404 -2.479 11.903 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.435 -0.993 11.765 1.00 0.00 H new ATOM 771 N THR A 77 -5.881 -3.767 7.996 1.00 0.00 N ATOM 772 CA THR A 77 -4.564 -4.472 8.005 1.00 0.00 C ATOM 773 C THR A 77 -3.492 -3.530 8.547 1.00 0.00 C ATOM 774 O THR A 77 -3.298 -2.436 8.052 1.00 0.00 O ATOM 775 CB THR A 77 -4.205 -4.890 6.579 1.00 0.00 C ATOM 776 OG1 THR A 77 -5.203 -5.773 6.084 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.850 -5.600 6.581 1.00 0.00 C ATOM 0 H THR A 77 -5.906 -2.917 7.433 1.00 0.00 H new ATOM 0 HA THR A 77 -4.624 -5.357 8.638 1.00 0.00 H new ATOM 0 HB THR A 77 -4.149 -4.007 5.942 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.977 -6.042 5.169 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.594 -5.898 5.564 1.00 0.00 H new ATOM 0 HG22 THR A 77 -2.086 -4.924 6.964 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.904 -6.484 7.216 1.00 0.00 H new ATOM 785 N SER A 78 -2.791 -3.953 9.562 1.00 0.00 N ATOM 786 CA SER A 78 -1.721 -3.102 10.157 1.00 0.00 C ATOM 787 C SER A 78 -0.377 -3.466 9.533 1.00 0.00 C ATOM 788 O SER A 78 -0.223 -4.518 8.943 1.00 0.00 O ATOM 789 CB SER A 78 -1.671 -3.345 11.663 1.00 0.00 C ATOM 790 OG SER A 78 -2.986 -3.253 12.193 1.00 0.00 O ATOM 0 H SER A 78 -2.915 -4.861 10.010 1.00 0.00 H new ATOM 0 HA SER A 78 -1.934 -2.051 9.963 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.250 -4.328 11.871 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.021 -2.612 12.141 1.00 0.00 H new ATOM 0 HG SER A 78 -2.961 -3.410 13.160 1.00 0.00 H new ATOM 796 N ALA A 79 0.597 -2.596 9.652 1.00 0.00 N ATOM 797 CA ALA A 79 1.945 -2.870 9.060 1.00 0.00 C ATOM 798 C ALA A 79 2.978 -3.034 10.175 1.00 0.00 C ATOM 799 O ALA A 79 2.853 -2.473 11.248 1.00 0.00 O ATOM 800 CB ALA A 79 2.349 -1.694 8.175 1.00 0.00 C ATOM 0 H ALA A 79 0.516 -1.702 10.137 1.00 0.00 H new ATOM 0 HA ALA A 79 1.901 -3.786 8.470 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.330 -1.886 7.740 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.616 -1.570 7.377 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.390 -0.785 8.775 1.00 0.00 H new ATOM 806 N GLY A 80 4.005 -3.800 9.920 1.00 0.00 N ATOM 807 CA GLY A 80 5.069 -4.018 10.943 1.00 0.00 C ATOM 808 C GLY A 80 4.786 -5.313 11.706 1.00 0.00 C ATOM 809 O GLY A 80 5.597 -6.216 11.739 1.00 0.00 O ATOM 0 H GLY A 80 4.154 -4.289 9.037 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.045 -4.073 10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.102 -3.176 11.634 1.00 0.00 H new ATOM 813 N ARG A 81 3.641 -5.406 12.325 1.00 0.00 N ATOM 814 CA ARG A 81 3.305 -6.636 13.099 1.00 0.00 C ATOM 815 C ARG A 81 2.881 -7.769 12.158 1.00 0.00 C ATOM 816 O ARG A 81 2.269 -7.551 11.129 1.00 0.00 O ATOM 817 CB ARG A 81 2.171 -6.318 14.073 1.00 0.00 C ATOM 818 CG ARG A 81 2.697 -5.411 15.187 1.00 0.00 C ATOM 819 CD ARG A 81 1.562 -5.096 16.162 1.00 0.00 C ATOM 820 NE ARG A 81 2.052 -4.173 17.228 1.00 0.00 N ATOM 821 CZ ARG A 81 2.636 -4.643 18.301 1.00 0.00 C ATOM 822 NH1 ARG A 81 2.842 -5.925 18.437 1.00 0.00 N ATOM 823 NH2 ARG A 81 3.018 -3.821 19.239 1.00 0.00 N ATOM 0 H ARG A 81 2.922 -4.682 12.328 1.00 0.00 H new ATOM 0 HA ARG A 81 4.187 -6.962 13.650 1.00 0.00 H new ATOM 0 HB2 ARG A 81 1.352 -5.828 13.547 1.00 0.00 H new ATOM 0 HB3 ARG A 81 1.772 -7.239 14.497 1.00 0.00 H new ATOM 0 HG2 ARG A 81 3.518 -5.900 15.712 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.094 -4.489 14.763 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.728 -4.640 15.628 1.00 0.00 H new ATOM 0 HD3 ARG A 81 1.189 -6.017 16.609 1.00 0.00 H new ATOM 0 HE ARG A 81 1.931 -3.166 17.119 1.00 0.00 H new ATOM 0 HH11 ARG A 81 2.547 -6.570 17.704 1.00 0.00 H new ATOM 0 HH12 ARG A 81 3.298 -6.282 19.277 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.861 -2.819 19.134 1.00 0.00 H new ATOM 0 HH22 ARG A 81 3.474 -4.181 20.078 1.00 0.00 H new ATOM 837 N HIS A 82 3.211 -8.987 12.514 1.00 0.00 N ATOM 838 CA HIS A 82 2.848 -10.156 11.663 1.00 0.00 C ATOM 839 C HIS A 82 1.422 -10.634 12.014 1.00 0.00 C ATOM 840 O HIS A 82 0.615 -10.879 11.138 1.00 0.00 O ATOM 841 CB HIS A 82 3.903 -11.284 11.886 1.00 0.00 C ATOM 842 CG HIS A 82 3.238 -12.597 12.227 1.00 0.00 C ATOM 843 ND1 HIS A 82 3.409 -13.230 13.449 1.00 0.00 N ATOM 844 CD2 HIS A 82 2.379 -13.391 11.511 1.00 0.00 C ATOM 845 CE1 HIS A 82 2.667 -14.355 13.428 1.00 0.00 C ATOM 846 NE2 HIS A 82 2.019 -14.501 12.269 1.00 0.00 N ATOM 0 H HIS A 82 3.721 -9.220 13.366 1.00 0.00 H new ATOM 0 HA HIS A 82 2.852 -9.878 10.609 1.00 0.00 H new ATOM 0 HB2 HIS A 82 4.507 -11.403 10.987 1.00 0.00 H new ATOM 0 HB3 HIS A 82 4.581 -10.997 12.690 1.00 0.00 H new ATOM 0 HD2 HIS A 82 2.034 -13.185 10.509 1.00 0.00 H new ATOM 0 HE1 HIS A 82 2.604 -15.054 14.249 1.00 0.00 H new ATOM 0 HE2 HIS A 82 1.395 -15.261 11.998 1.00 0.00 H new ATOM 854 N PRO A 83 1.115 -10.786 13.282 1.00 0.00 N ATOM 855 CA PRO A 83 -0.231 -11.270 13.728 1.00 0.00 C ATOM 856 C PRO A 83 -1.390 -10.476 13.117 1.00 0.00 C ATOM 857 O PRO A 83 -1.382 -9.261 13.086 1.00 0.00 O ATOM 858 CB PRO A 83 -0.186 -11.089 15.251 1.00 0.00 C ATOM 859 CG PRO A 83 1.260 -11.195 15.590 1.00 0.00 C ATOM 860 CD PRO A 83 2.002 -10.533 14.432 1.00 0.00 C ATOM 0 HA PRO A 83 -0.414 -12.297 13.411 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -0.595 -10.124 15.549 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -0.771 -11.854 15.760 1.00 0.00 H new ATOM 0 HG2 PRO A 83 1.479 -10.695 16.533 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.561 -12.236 15.704 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.147 -9.466 14.603 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.990 -10.969 14.284 1.00 0.00 H new ATOM 868 N ASP A 84 -2.385 -11.175 12.630 1.00 0.00 N ATOM 869 CA ASP A 84 -3.564 -10.504 12.007 1.00 0.00 C ATOM 870 C ASP A 84 -3.093 -9.339 11.133 1.00 0.00 C ATOM 871 O ASP A 84 -3.582 -8.228 11.229 1.00 0.00 O ATOM 872 CB ASP A 84 -4.518 -10.010 13.097 1.00 0.00 C ATOM 873 CG ASP A 84 -5.843 -9.584 12.460 1.00 0.00 C ATOM 874 OD1 ASP A 84 -6.096 -9.992 11.339 1.00 0.00 O ATOM 875 OD2 ASP A 84 -6.584 -8.859 13.105 1.00 0.00 O ATOM 0 H ASP A 84 -2.430 -12.194 12.638 1.00 0.00 H new ATOM 0 HA ASP A 84 -4.097 -11.217 11.379 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -4.691 -10.799 13.829 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.073 -9.171 13.632 1.00 0.00 H new ATOM 880 N SER A 85 -2.141 -9.591 10.275 1.00 0.00 N ATOM 881 CA SER A 85 -1.626 -8.517 9.385 1.00 0.00 C ATOM 882 C SER A 85 -0.982 -9.148 8.146 1.00 0.00 C ATOM 883 O SER A 85 0.018 -9.835 8.231 1.00 0.00 O ATOM 884 CB SER A 85 -0.591 -7.680 10.140 1.00 0.00 C ATOM 885 OG SER A 85 0.161 -6.916 9.210 1.00 0.00 O ATOM 0 H SER A 85 -1.697 -10.501 10.154 1.00 0.00 H new ATOM 0 HA SER A 85 -2.449 -7.873 9.074 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.088 -7.021 10.852 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.070 -8.329 10.714 1.00 0.00 H new ATOM 0 HG SER A 85 -0.287 -6.059 9.053 1.00 0.00 H new ATOM 891 N ASP A 86 -1.562 -8.925 6.997 1.00 0.00 N ATOM 892 CA ASP A 86 -1.009 -9.499 5.737 1.00 0.00 C ATOM 893 C ASP A 86 0.373 -8.901 5.454 1.00 0.00 C ATOM 894 O ASP A 86 1.264 -9.569 4.962 1.00 0.00 O ATOM 895 CB ASP A 86 -1.945 -9.151 4.577 1.00 0.00 C ATOM 896 CG ASP A 86 -3.225 -9.982 4.673 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.223 -10.961 5.401 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.189 -9.626 4.015 1.00 0.00 O ATOM 0 H ASP A 86 -2.405 -8.363 6.877 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.922 -10.580 5.842 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.188 -8.089 4.601 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.447 -9.343 3.627 1.00 0.00 H new ATOM 903 N ILE A 87 0.546 -7.640 5.737 1.00 0.00 N ATOM 904 CA ILE A 87 1.857 -6.987 5.462 1.00 0.00 C ATOM 905 C ILE A 87 2.900 -7.456 6.474 1.00 0.00 C ATOM 906 O ILE A 87 2.666 -7.467 7.667 1.00 0.00 O ATOM 907 CB ILE A 87 1.703 -5.469 5.556 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.484 -5.018 4.738 1.00 0.00 C ATOM 909 CG2 ILE A 87 2.963 -4.791 5.015 1.00 0.00 C ATOM 910 CD1 ILE A 87 0.565 -5.577 3.313 1.00 0.00 C ATOM 0 H ILE A 87 -0.164 -7.033 6.147 1.00 0.00 H new ATOM 0 HA ILE A 87 2.185 -7.260 4.459 1.00 0.00 H new ATOM 0 HB ILE A 87 1.559 -5.187 6.599 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.432 -5.360 5.219 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.440 -3.929 4.707 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.851 -3.709 5.083 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.826 -5.104 5.603 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.111 -5.076 3.973 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.305 -5.250 2.744 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.472 -5.213 2.830 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.586 -6.666 3.350 1.00 0.00 H new ATOM 922 N PHE A 88 4.056 -7.847 5.995 1.00 0.00 N ATOM 923 CA PHE A 88 5.143 -8.328 6.902 1.00 0.00 C ATOM 924 C PHE A 88 6.447 -7.600 6.569 1.00 0.00 C ATOM 925 O PHE A 88 7.253 -8.083 5.797 1.00 0.00 O ATOM 926 CB PHE A 88 5.331 -9.830 6.690 1.00 0.00 C ATOM 927 CG PHE A 88 6.493 -10.318 7.520 1.00 0.00 C ATOM 928 CD1 PHE A 88 6.382 -10.363 8.913 1.00 0.00 C ATOM 929 CD2 PHE A 88 7.679 -10.732 6.900 1.00 0.00 C ATOM 930 CE1 PHE A 88 7.454 -10.819 9.688 1.00 0.00 C ATOM 931 CE2 PHE A 88 8.753 -11.187 7.675 1.00 0.00 C ATOM 932 CZ PHE A 88 8.640 -11.231 9.069 1.00 0.00 C ATOM 0 H PHE A 88 4.294 -7.853 5.003 1.00 0.00 H new ATOM 0 HA PHE A 88 4.876 -8.128 7.940 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.422 -10.363 6.969 1.00 0.00 H new ATOM 0 HB3 PHE A 88 5.511 -10.039 5.635 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.467 -10.045 9.392 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.765 -10.700 5.824 1.00 0.00 H new ATOM 0 HE1 PHE A 88 7.366 -10.853 10.764 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.668 -11.504 7.197 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.468 -11.583 9.667 1.00 0.00 H new ATOM 942 N LEU A 89 6.662 -6.444 7.150 1.00 0.00 N ATOM 943 CA LEU A 89 7.918 -5.670 6.887 1.00 0.00 C ATOM 944 C LEU A 89 8.628 -5.412 8.214 1.00 0.00 C ATOM 945 O LEU A 89 8.350 -4.453 8.907 1.00 0.00 O ATOM 946 CB LEU A 89 7.561 -4.340 6.213 1.00 0.00 C ATOM 947 CG LEU A 89 6.963 -4.612 4.824 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.379 -3.316 4.254 1.00 0.00 C ATOM 949 CD2 LEU A 89 8.045 -5.155 3.866 1.00 0.00 C ATOM 0 H LEU A 89 6.015 -5.999 7.801 1.00 0.00 H new ATOM 0 HA LEU A 89 8.577 -6.236 6.229 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.847 -3.790 6.826 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.450 -3.716 6.122 1.00 0.00 H new ATOM 0 HG LEU A 89 6.175 -5.359 4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.955 -3.510 3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.598 -2.946 4.918 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.167 -2.568 4.169 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.604 -5.342 2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.846 -4.422 3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.450 -6.085 4.265 1.00 0.00 H new ATOM 961 N ASP A 90 9.546 -6.273 8.576 1.00 0.00 N ATOM 962 CA ASP A 90 10.285 -6.095 9.861 1.00 0.00 C ATOM 963 C ASP A 90 11.598 -5.354 9.596 1.00 0.00 C ATOM 964 O ASP A 90 12.551 -5.920 9.096 1.00 0.00 O ATOM 965 CB ASP A 90 10.583 -7.472 10.465 1.00 0.00 C ATOM 966 CG ASP A 90 9.294 -8.069 11.034 1.00 0.00 C ATOM 967 OD1 ASP A 90 8.338 -7.327 11.193 1.00 0.00 O ATOM 968 OD2 ASP A 90 9.283 -9.260 11.304 1.00 0.00 O ATOM 0 H ASP A 90 9.815 -7.094 8.034 1.00 0.00 H new ATOM 0 HA ASP A 90 9.679 -5.515 10.557 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.997 -8.133 9.704 1.00 0.00 H new ATOM 0 HB3 ASP A 90 11.333 -7.382 11.251 1.00 0.00 H new ATOM 973 N ASP A 91 11.658 -4.091 9.932 1.00 0.00 N ATOM 974 CA ASP A 91 12.911 -3.315 9.703 1.00 0.00 C ATOM 975 C ASP A 91 12.936 -2.073 10.598 1.00 0.00 C ATOM 976 O ASP A 91 11.950 -1.707 11.205 1.00 0.00 O ATOM 977 CB ASP A 91 12.991 -2.876 8.238 1.00 0.00 C ATOM 978 CG ASP A 91 13.291 -4.090 7.361 1.00 0.00 C ATOM 979 OD1 ASP A 91 14.170 -4.855 7.726 1.00 0.00 O ATOM 980 OD2 ASP A 91 12.644 -4.235 6.338 1.00 0.00 O ATOM 0 H ASP A 91 10.893 -3.565 10.355 1.00 0.00 H new ATOM 0 HA ASP A 91 13.762 -3.952 9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.051 -2.416 7.933 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.769 -2.123 8.114 1.00 0.00 H new ATOM 985 N VAL A 92 14.069 -1.426 10.673 1.00 0.00 N ATOM 986 CA VAL A 92 14.200 -0.199 11.515 1.00 0.00 C ATOM 987 C VAL A 92 13.353 0.932 10.921 1.00 0.00 C ATOM 988 O VAL A 92 12.781 1.737 11.630 1.00 0.00 O ATOM 989 CB VAL A 92 15.672 0.229 11.554 1.00 0.00 C ATOM 990 CG1 VAL A 92 16.537 -0.937 12.038 1.00 0.00 C ATOM 991 CG2 VAL A 92 16.128 0.644 10.151 1.00 0.00 C ATOM 0 H VAL A 92 14.920 -1.698 10.181 1.00 0.00 H new ATOM 0 HA VAL A 92 13.851 -0.413 12.525 1.00 0.00 H new ATOM 0 HB VAL A 92 15.778 1.072 12.237 1.00 0.00 H new ATOM 0 HG11 VAL A 92 17.582 -0.628 12.064 1.00 0.00 H new ATOM 0 HG12 VAL A 92 16.221 -1.234 13.038 1.00 0.00 H new ATOM 0 HG13 VAL A 92 16.425 -1.781 11.357 1.00 0.00 H new ATOM 0 HG21 VAL A 92 17.174 0.947 10.183 1.00 0.00 H new ATOM 0 HG22 VAL A 92 16.015 -0.198 9.468 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.519 1.478 9.802 1.00 0.00 H new ATOM 1001 N THR A 93 13.282 1.002 9.621 1.00 0.00 N ATOM 1002 CA THR A 93 12.488 2.080 8.966 1.00 0.00 C ATOM 1003 C THR A 93 11.003 1.900 9.283 1.00 0.00 C ATOM 1004 O THR A 93 10.245 2.851 9.278 1.00 0.00 O ATOM 1005 CB THR A 93 12.694 2.006 7.455 1.00 0.00 C ATOM 1006 OG1 THR A 93 12.338 0.710 6.996 1.00 0.00 O ATOM 1007 CG2 THR A 93 14.161 2.279 7.125 1.00 0.00 C ATOM 0 H THR A 93 13.742 0.355 8.980 1.00 0.00 H new ATOM 0 HA THR A 93 12.819 3.049 9.340 1.00 0.00 H new ATOM 0 HB THR A 93 12.069 2.752 6.965 1.00 0.00 H new ATOM 0 HG1 THR A 93 11.982 0.772 6.085 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.307 2.226 6.046 1.00 0.00 H new ATOM 0 HG22 THR A 93 14.435 3.273 7.480 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.789 1.533 7.613 1.00 0.00 H new ATOM 1015 N VAL A 94 10.579 0.688 9.546 1.00 0.00 N ATOM 1016 CA VAL A 94 9.135 0.439 9.851 1.00 0.00 C ATOM 1017 C VAL A 94 8.982 0.064 11.326 1.00 0.00 C ATOM 1018 O VAL A 94 9.662 -0.807 11.836 1.00 0.00 O ATOM 1019 CB VAL A 94 8.631 -0.706 8.969 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.228 -1.125 9.413 1.00 0.00 C ATOM 1021 CG2 VAL A 94 8.587 -0.241 7.510 1.00 0.00 C ATOM 0 H VAL A 94 11.172 -0.142 9.563 1.00 0.00 H new ATOM 0 HA VAL A 94 8.553 1.338 9.651 1.00 0.00 H new ATOM 0 HB VAL A 94 9.306 -1.557 9.063 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.875 -1.940 8.781 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.259 -1.457 10.451 1.00 0.00 H new ATOM 0 HG13 VAL A 94 6.550 -0.277 9.324 1.00 0.00 H new ATOM 0 HG21 VAL A 94 8.228 -1.055 6.879 1.00 0.00 H new ATOM 0 HG22 VAL A 94 7.914 0.612 7.420 1.00 0.00 H new ATOM 0 HG23 VAL A 94 9.587 0.051 7.191 1.00 0.00 H new ATOM 1031 N SER A 95 8.094 0.732 12.012 1.00 0.00 N ATOM 1032 CA SER A 95 7.879 0.448 13.459 1.00 0.00 C ATOM 1033 C SER A 95 6.824 -0.648 13.627 1.00 0.00 C ATOM 1034 O SER A 95 6.494 -1.361 12.701 1.00 0.00 O ATOM 1035 CB SER A 95 7.394 1.720 14.151 1.00 0.00 C ATOM 1036 OG SER A 95 8.323 2.768 13.908 1.00 0.00 O ATOM 0 H SER A 95 7.503 1.469 11.627 1.00 0.00 H new ATOM 0 HA SER A 95 8.817 0.114 13.903 1.00 0.00 H new ATOM 0 HB2 SER A 95 6.408 1.998 13.778 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.293 1.549 15.223 1.00 0.00 H new ATOM 0 HG SER A 95 8.015 3.587 14.349 1.00 0.00 H new ATOM 1042 N ARG A 96 6.298 -0.783 14.812 1.00 0.00 N ATOM 1043 CA ARG A 96 5.267 -1.827 15.064 1.00 0.00 C ATOM 1044 C ARG A 96 4.032 -1.541 14.210 1.00 0.00 C ATOM 1045 O ARG A 96 3.460 -2.430 13.608 1.00 0.00 O ATOM 1046 CB ARG A 96 4.876 -1.782 16.542 1.00 0.00 C ATOM 1047 CG ARG A 96 6.090 -2.118 17.423 1.00 0.00 C ATOM 1048 CD ARG A 96 6.305 -3.634 17.479 1.00 0.00 C ATOM 1049 NE ARG A 96 7.400 -3.945 18.445 1.00 0.00 N ATOM 1050 CZ ARG A 96 8.145 -5.009 18.285 1.00 0.00 C ATOM 1051 NH1 ARG A 96 7.943 -5.812 17.277 1.00 0.00 N ATOM 1052 NH2 ARG A 96 9.093 -5.269 19.141 1.00 0.00 N ATOM 0 H ARG A 96 6.540 -0.211 15.621 1.00 0.00 H new ATOM 0 HA ARG A 96 5.664 -2.809 14.809 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.497 -0.792 16.795 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.071 -2.491 16.734 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.981 -1.632 17.026 1.00 0.00 H new ATOM 0 HG3 ARG A 96 5.936 -1.729 18.429 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.384 -4.132 17.784 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.560 -4.013 16.489 1.00 0.00 H new ATOM 0 HE ARG A 96 7.569 -3.323 19.236 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.200 -5.613 16.607 1.00 0.00 H new ATOM 0 HH12 ARG A 96 8.528 -6.639 17.159 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.252 -4.644 19.932 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.676 -6.097 19.020 1.00 0.00 H new ATOM 1066 N ARG A 97 3.621 -0.301 14.152 1.00 0.00 N ATOM 1067 CA ARG A 97 2.428 0.071 13.336 1.00 0.00 C ATOM 1068 C ARG A 97 2.892 0.846 12.108 1.00 0.00 C ATOM 1069 O ARG A 97 2.635 0.457 10.987 1.00 0.00 O ATOM 1070 CB ARG A 97 1.501 0.951 14.178 1.00 0.00 C ATOM 1071 CG ARG A 97 0.980 0.147 15.372 1.00 0.00 C ATOM 1072 CD ARG A 97 0.116 1.045 16.264 1.00 0.00 C ATOM 1073 NE ARG A 97 -1.095 1.471 15.507 1.00 0.00 N ATOM 1074 CZ ARG A 97 -1.946 2.315 16.033 1.00 0.00 C ATOM 1075 NH1 ARG A 97 -1.751 2.783 17.234 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -2.994 2.686 15.351 1.00 0.00 N ATOM 0 H ARG A 97 4.065 0.477 14.640 1.00 0.00 H new ATOM 0 HA ARG A 97 1.893 -0.825 13.023 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.037 1.834 14.526 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.667 1.304 13.572 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.396 -0.704 15.022 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.816 -0.254 15.945 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -0.175 0.508 17.167 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.686 1.918 16.582 1.00 0.00 H new ATOM 0 HE ARG A 97 -1.262 1.102 14.571 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -0.932 2.492 17.768 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -2.417 3.441 17.640 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -3.148 2.319 14.412 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -3.660 3.343 15.757 1.00 0.00 H new ATOM 1090 N HIS A 98 3.581 1.937 12.319 1.00 0.00 N ATOM 1091 CA HIS A 98 4.076 2.764 11.177 1.00 0.00 C ATOM 1092 C HIS A 98 2.895 3.202 10.309 1.00 0.00 C ATOM 1093 O HIS A 98 2.502 4.351 10.317 1.00 0.00 O ATOM 1094 CB HIS A 98 5.059 1.954 10.321 1.00 0.00 C ATOM 1095 CG HIS A 98 5.849 2.892 9.445 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.398 3.303 8.198 1.00 0.00 N ATOM 1097 CD2 HIS A 98 7.057 3.516 9.630 1.00 0.00 C ATOM 1098 CE1 HIS A 98 6.324 4.138 7.687 1.00 0.00 C ATOM 1099 NE2 HIS A 98 7.355 4.302 8.519 1.00 0.00 N ATOM 0 H HIS A 98 3.825 2.294 13.243 1.00 0.00 H new ATOM 0 HA HIS A 98 4.586 3.641 11.575 1.00 0.00 H new ATOM 0 HB2 HIS A 98 5.732 1.383 10.961 1.00 0.00 H new ATOM 0 HB3 HIS A 98 4.517 1.235 9.707 1.00 0.00 H new ATOM 0 HD2 HIS A 98 7.682 3.413 10.505 1.00 0.00 H new ATOM 0 HE1 HIS A 98 6.242 4.616 6.722 1.00 0.00 H new ATOM 0 HE2 HIS A 98 8.183 4.879 8.373 1.00 0.00 H new ATOM 1107 N ALA A 99 2.331 2.291 9.557 1.00 0.00 N ATOM 1108 CA ALA A 99 1.177 2.634 8.677 1.00 0.00 C ATOM 1109 C ALA A 99 0.071 1.600 8.864 1.00 0.00 C ATOM 1110 O ALA A 99 0.311 0.470 9.252 1.00 0.00 O ATOM 1111 CB ALA A 99 1.635 2.629 7.221 1.00 0.00 C ATOM 0 H ALA A 99 2.625 1.315 9.516 1.00 0.00 H new ATOM 0 HA ALA A 99 0.799 3.622 8.939 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.794 2.879 6.574 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.428 3.365 7.086 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.011 1.639 6.961 1.00 0.00 H new ATOM 1117 N GLU A 100 -1.143 1.984 8.586 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.290 1.046 8.734 1.00 0.00 C ATOM 1119 C GLU A 100 -3.244 1.236 7.559 1.00 0.00 C ATOM 1120 O GLU A 100 -3.411 2.328 7.054 1.00 0.00 O ATOM 1121 CB GLU A 100 -3.027 1.342 10.040 1.00 0.00 C ATOM 1122 CG GLU A 100 -4.163 0.334 10.219 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.856 0.571 11.560 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.608 1.603 12.159 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.626 -0.286 11.964 1.00 0.00 O ATOM 0 H GLU A 100 -1.392 2.918 8.259 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.925 0.019 8.751 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.337 1.283 10.882 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.425 2.357 10.025 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.881 0.433 9.405 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.771 -0.682 10.176 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.872 0.172 7.126 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.826 0.260 5.981 1.00 0.00 C ATOM 1134 C PHE A 101 -6.237 -0.022 6.482 1.00 0.00 C ATOM 1135 O PHE A 101 -6.454 -0.899 7.294 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.442 -0.783 4.935 1.00 0.00 C ATOM 1137 CG PHE A 101 -3.060 -0.474 4.415 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.887 0.499 3.423 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.950 -1.157 4.927 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.606 0.787 2.942 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.668 -0.867 4.446 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.495 0.105 3.453 1.00 0.00 C ATOM 0 H PHE A 101 -3.763 -0.762 7.521 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.788 1.256 5.540 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.465 -1.781 5.373 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.162 -0.778 4.116 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.743 1.027 3.029 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -2.083 -1.907 5.693 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.473 1.536 2.176 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.188 -1.393 4.841 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.494 0.328 3.082 1.00 0.00 H new ATOM 1152 N ARG A 102 -7.199 0.722 6.000 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.613 0.519 6.433 1.00 0.00 C ATOM 1154 C ARG A 102 -9.501 0.388 5.200 1.00 0.00 C ATOM 1155 O ARG A 102 -9.333 1.088 4.220 1.00 0.00 O ATOM 1156 CB ARG A 102 -9.060 1.724 7.264 1.00 0.00 C ATOM 1157 CG ARG A 102 -8.240 1.778 8.555 1.00 0.00 C ATOM 1158 CD ARG A 102 -8.615 3.028 9.357 1.00 0.00 C ATOM 1159 NE ARG A 102 -10.029 2.916 9.817 1.00 0.00 N ATOM 1160 CZ ARG A 102 -10.601 3.911 10.443 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -9.942 5.013 10.666 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -11.837 3.799 10.848 1.00 0.00 N ATOM 0 H ARG A 102 -7.063 1.469 5.318 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.692 -0.387 7.034 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.925 2.644 6.695 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.122 1.646 7.497 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.424 0.884 9.151 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.176 1.791 8.320 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.950 3.137 10.214 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -8.491 3.919 8.742 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.553 2.058 9.642 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.976 5.102 10.352 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -10.393 5.787 11.155 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.354 2.937 10.676 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.286 4.574 11.337 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.443 -0.514 5.240 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.351 -0.715 4.075 1.00 0.00 C ATOM 1178 C LEU A 103 -12.631 0.097 4.278 1.00 0.00 C ATOM 1179 O LEU A 103 -13.343 -0.073 5.249 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.687 -2.207 3.966 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.702 -2.447 2.840 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -12.170 -1.875 1.516 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.931 -3.954 2.691 1.00 0.00 C ATOM 0 H LEU A 103 -10.624 -1.125 6.036 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.865 -0.381 3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.779 -2.777 3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.093 -2.565 4.912 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.640 -1.949 3.086 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.899 -2.051 0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -12.003 -0.803 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -11.230 -2.364 1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.651 -4.135 1.893 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.988 -4.443 2.447 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.317 -4.358 3.627 1.00 0.00 H new ATOM 1195 N GLU A 104 -12.925 0.986 3.364 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.153 1.829 3.485 1.00 0.00 C ATOM 1197 C GLU A 104 -15.270 1.247 2.607 1.00 0.00 C ATOM 1198 O GLU A 104 -15.637 0.094 2.734 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.822 3.250 3.022 1.00 0.00 C ATOM 1200 CG GLU A 104 -14.906 4.219 3.498 1.00 0.00 C ATOM 1201 CD GLU A 104 -14.783 4.408 5.010 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -13.827 3.901 5.574 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -15.647 5.054 5.579 1.00 0.00 O ATOM 0 H GLU A 104 -12.362 1.165 2.532 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.490 1.845 4.522 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.852 3.554 3.416 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.748 3.279 1.935 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.802 5.178 2.990 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.893 3.831 3.247 1.00 0.00 H new ATOM 1210 N ASN A 105 -15.823 2.042 1.725 1.00 0.00 N ATOM 1211 CA ASN A 105 -16.921 1.547 0.850 1.00 0.00 C ATOM 1212 C ASN A 105 -16.332 0.840 -0.372 1.00 0.00 C ATOM 1213 O ASN A 105 -16.120 1.431 -1.415 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.782 2.732 0.408 1.00 0.00 C ATOM 1215 CG ASN A 105 -18.990 2.221 -0.375 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -18.972 1.123 -0.892 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -20.050 2.976 -0.483 1.00 0.00 N ATOM 0 H ASN A 105 -15.558 3.015 1.576 1.00 0.00 H new ATOM 0 HA ASN A 105 -17.538 0.837 1.401 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -18.113 3.299 1.278 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -17.195 3.411 -0.211 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -20.863 2.643 -1.002 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -20.065 3.899 -0.049 1.00 0.00 H new ATOM 1224 N ASN A 106 -16.081 -0.433 -0.244 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.518 -1.218 -1.377 1.00 0.00 C ATOM 1226 C ASN A 106 -14.260 -0.534 -1.915 1.00 0.00 C ATOM 1227 O ASN A 106 -13.908 -0.685 -3.071 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.563 -1.334 -2.490 1.00 0.00 C ATOM 1229 CG ASN A 106 -16.076 -2.329 -3.545 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -14.978 -2.841 -3.453 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -16.854 -2.631 -4.550 1.00 0.00 N ATOM 0 H ASN A 106 -16.244 -0.969 0.608 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.254 -2.215 -1.025 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -17.516 -1.664 -2.076 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.734 -0.359 -2.946 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.540 -3.296 -5.257 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.776 -2.202 -4.628 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.567 0.212 -1.090 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.320 0.898 -1.560 1.00 0.00 C ATOM 1240 C GLU A 107 -11.263 0.880 -0.453 1.00 0.00 C ATOM 1241 O GLU A 107 -11.530 1.210 0.687 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.642 2.341 -1.954 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.495 2.338 -3.227 1.00 0.00 C ATOM 1244 CD GLU A 107 -13.843 3.774 -3.619 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -13.411 4.679 -2.927 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -14.536 3.943 -4.610 1.00 0.00 O ATOM 0 H GLU A 107 -13.809 0.376 -0.113 1.00 0.00 H new ATOM 0 HA GLU A 107 -11.928 0.370 -2.429 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -13.176 2.841 -1.146 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -11.721 2.899 -2.121 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -12.953 1.851 -4.038 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -14.407 1.764 -3.063 1.00 0.00 H new ATOM 1253 N PHE A 108 -10.064 0.485 -0.789 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.970 0.424 0.224 1.00 0.00 C ATOM 1255 C PHE A 108 -8.440 1.830 0.515 1.00 0.00 C ATOM 1256 O PHE A 108 -8.412 2.686 -0.347 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.826 -0.432 -0.321 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.236 -1.884 -0.332 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.053 -2.671 0.811 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.795 -2.445 -1.486 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.429 -4.017 0.801 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -9.171 -3.794 -1.497 1.00 0.00 C ATOM 1263 CZ PHE A 108 -8.988 -4.580 -0.352 1.00 0.00 C ATOM 0 H PHE A 108 -9.793 0.200 -1.730 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.363 -0.011 1.143 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.567 -0.110 -1.330 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.936 -0.300 0.294 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.621 -2.238 1.701 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.936 -1.838 -2.368 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.288 -4.623 1.684 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.602 -4.228 -2.387 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.278 -5.620 -0.359 1.00 0.00 H new ATOM 1273 N ASN A 109 -8.007 2.068 1.727 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.463 3.411 2.089 1.00 0.00 C ATOM 1275 C ASN A 109 -6.241 3.230 2.984 1.00 0.00 C ATOM 1276 O ASN A 109 -6.062 2.195 3.597 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.520 4.205 2.852 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.689 4.525 1.923 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.523 4.612 0.723 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -10.876 4.699 2.433 1.00 0.00 N ATOM 0 H ASN A 109 -8.007 1.386 2.485 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.188 3.947 1.180 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.871 3.632 3.710 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.087 5.127 3.240 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.667 4.909 1.824 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -11.014 4.626 3.441 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.405 4.234 3.070 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.188 4.146 3.934 1.00 0.00 C ATOM 1289 C VAL A 110 -4.157 5.336 4.891 1.00 0.00 C ATOM 1290 O VAL A 110 -4.357 6.474 4.497 1.00 0.00 O ATOM 1291 CB VAL A 110 -2.930 4.142 3.058 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -2.714 5.524 2.434 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.718 3.781 3.921 1.00 0.00 C ATOM 0 H VAL A 110 -5.515 5.119 2.574 1.00 0.00 H new ATOM 0 HA VAL A 110 -4.218 3.222 4.512 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.053 3.409 2.261 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.817 5.507 1.814 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.575 5.784 1.819 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.595 6.265 3.224 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.820 3.777 3.303 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.607 4.516 4.718 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.863 2.793 4.357 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.909 5.072 6.152 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.859 6.159 7.176 1.00 0.00 C ATOM 1305 C VAL A 111 -2.527 6.086 7.924 1.00 0.00 C ATOM 1306 O VAL A 111 -2.069 5.026 8.304 1.00 0.00 O ATOM 1307 CB VAL A 111 -5.015 5.978 8.166 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.825 6.917 9.362 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.334 6.308 7.465 1.00 0.00 C ATOM 0 H VAL A 111 -3.737 4.136 6.518 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.949 7.129 6.688 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.032 4.947 8.519 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.649 6.785 10.063 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.884 6.685 9.861 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.807 7.950 9.014 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.160 6.181 8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.311 7.340 7.114 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.472 5.639 6.616 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.903 7.210 8.131 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.601 7.228 8.846 1.00 0.00 C ATOM 1321 C ASP A 112 -0.851 7.269 10.355 1.00 0.00 C ATOM 1322 O ASP A 112 -1.385 8.227 10.879 1.00 0.00 O ATOM 1323 CB ASP A 112 0.174 8.476 8.430 1.00 0.00 C ATOM 1324 CG ASP A 112 0.480 8.400 6.937 1.00 0.00 C ATOM 1325 OD1 ASP A 112 0.211 7.364 6.350 1.00 0.00 O ATOM 1326 OD2 ASP A 112 0.982 9.375 6.402 1.00 0.00 O ATOM 0 H ASP A 112 -2.243 8.124 7.832 1.00 0.00 H new ATOM 0 HA ASP A 112 -0.029 6.334 8.596 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.409 9.371 8.649 1.00 0.00 H new ATOM 0 HB3 ASP A 112 1.100 8.551 9.000 1.00 0.00 H new ATOM 1331 N VAL A 113 -0.459 6.234 11.056 1.00 0.00 N ATOM 1332 CA VAL A 113 -0.654 6.190 12.536 1.00 0.00 C ATOM 1333 C VAL A 113 0.708 6.369 13.215 1.00 0.00 C ATOM 1334 O VAL A 113 0.813 6.409 14.425 1.00 0.00 O ATOM 1335 CB VAL A 113 -1.251 4.829 12.920 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -2.612 4.662 12.240 1.00 0.00 C ATOM 1337 CG2 VAL A 113 -0.319 3.706 12.457 1.00 0.00 C ATOM 0 H VAL A 113 -0.007 5.409 10.660 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.330 6.984 12.855 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.369 4.781 14.003 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -3.038 3.696 12.511 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.281 5.458 12.565 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.487 4.713 11.158 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.747 2.742 12.732 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.200 3.755 11.375 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.654 3.821 12.935 1.00 0.00 H new ATOM 1405 N THR A 119 5.066 7.212 5.666 1.00 0.00 N ATOM 1406 CA THR A 119 4.223 6.986 4.459 1.00 0.00 C ATOM 1407 C THR A 119 4.205 8.241 3.585 1.00 0.00 C ATOM 1408 O THR A 119 4.003 9.342 4.059 1.00 0.00 O ATOM 1409 CB THR A 119 2.800 6.635 4.891 1.00 0.00 C ATOM 1410 OG1 THR A 119 2.834 5.484 5.724 1.00 0.00 O ATOM 1411 CG2 THR A 119 1.942 6.352 3.657 1.00 0.00 C ATOM 0 HA THR A 119 4.641 6.162 3.880 1.00 0.00 H new ATOM 0 HB THR A 119 2.369 7.471 5.441 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.657 5.489 6.255 1.00 0.00 H new ATOM 0 HG21 THR A 119 0.928 6.102 3.969 1.00 0.00 H new ATOM 0 HG22 THR A 119 1.918 7.236 3.020 1.00 0.00 H new ATOM 0 HG23 THR A 119 2.368 5.516 3.102 1.00 0.00 H new ATOM 1419 N TYR A 120 4.416 8.075 2.304 1.00 0.00 N ATOM 1420 CA TYR A 120 4.415 9.241 1.369 1.00 0.00 C ATOM 1421 C TYR A 120 3.612 8.877 0.123 1.00 0.00 C ATOM 1422 O TYR A 120 3.545 7.729 -0.271 1.00 0.00 O ATOM 1423 CB TYR A 120 5.855 9.559 0.971 1.00 0.00 C ATOM 1424 CG TYR A 120 6.692 9.777 2.213 1.00 0.00 C ATOM 1425 CD1 TYR A 120 6.383 10.824 3.089 1.00 0.00 C ATOM 1426 CD2 TYR A 120 7.778 8.935 2.489 1.00 0.00 C ATOM 1427 CE1 TYR A 120 7.156 11.031 4.237 1.00 0.00 C ATOM 1428 CE2 TYR A 120 8.553 9.144 3.636 1.00 0.00 C ATOM 1429 CZ TYR A 120 8.243 10.192 4.509 1.00 0.00 C ATOM 1430 OH TYR A 120 9.008 10.399 5.639 1.00 0.00 O ATOM 0 H TYR A 120 4.591 7.173 1.862 1.00 0.00 H new ATOM 0 HA TYR A 120 3.968 10.109 1.853 1.00 0.00 H new ATOM 0 HB2 TYR A 120 6.268 8.741 0.381 1.00 0.00 H new ATOM 0 HB3 TYR A 120 5.881 10.449 0.343 1.00 0.00 H new ATOM 0 HD1 TYR A 120 5.546 11.474 2.878 1.00 0.00 H new ATOM 0 HD2 TYR A 120 8.017 8.125 1.816 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.914 11.838 4.913 1.00 0.00 H new ATOM 0 HE2 TYR A 120 9.391 8.496 3.847 1.00 0.00 H new ATOM 0 HH TYR A 120 9.721 9.728 5.678 1.00 0.00 H new ATOM 1440 N VAL A 121 2.995 9.851 -0.495 1.00 0.00 N ATOM 1441 CA VAL A 121 2.173 9.593 -1.717 1.00 0.00 C ATOM 1442 C VAL A 121 2.562 10.574 -2.827 1.00 0.00 C ATOM 1443 O VAL A 121 3.104 11.630 -2.572 1.00 0.00 O ATOM 1444 CB VAL A 121 0.688 9.753 -1.380 1.00 0.00 C ATOM 1445 CG1 VAL A 121 0.357 11.230 -1.173 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.154 9.200 -2.533 1.00 0.00 C ATOM 0 H VAL A 121 3.026 10.827 -0.201 1.00 0.00 H new ATOM 0 HA VAL A 121 2.357 8.576 -2.064 1.00 0.00 H new ATOM 0 HB VAL A 121 0.466 9.205 -0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.701 11.336 -0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.956 11.626 -0.353 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.580 11.784 -2.085 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.212 9.312 -2.297 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.074 9.749 -3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.076 8.144 -2.678 1.00 0.00 H new ATOM 1456 N ASN A 122 2.303 10.204 -4.054 1.00 0.00 N ATOM 1457 CA ASN A 122 2.646 11.076 -5.220 1.00 0.00 C ATOM 1458 C ASN A 122 2.339 12.547 -4.917 1.00 0.00 C ATOM 1459 O ASN A 122 1.772 12.889 -3.901 1.00 0.00 O ATOM 1460 CB ASN A 122 1.811 10.643 -6.431 1.00 0.00 C ATOM 1461 CG ASN A 122 2.344 9.321 -6.984 1.00 0.00 C ATOM 1462 OD1 ASN A 122 3.473 8.954 -6.726 1.00 0.00 O ATOM 1463 ND2 ASN A 122 1.574 8.585 -7.739 1.00 0.00 N ATOM 0 H ASN A 122 1.861 9.319 -4.303 1.00 0.00 H new ATOM 0 HA ASN A 122 3.712 10.973 -5.425 1.00 0.00 H new ATOM 0 HB2 ASN A 122 0.766 10.532 -6.142 1.00 0.00 H new ATOM 0 HB3 ASN A 122 1.848 11.412 -7.203 1.00 0.00 H new ATOM 0 HD21 ASN A 122 1.920 7.701 -8.113 1.00 0.00 H new ATOM 0 HD22 ASN A 122 0.626 8.894 -7.955 1.00 0.00 H new ATOM 1470 N ARG A 123 2.715 13.413 -5.823 1.00 0.00 N ATOM 1471 CA ARG A 123 2.473 14.878 -5.650 1.00 0.00 C ATOM 1472 C ARG A 123 3.182 15.378 -4.402 1.00 0.00 C ATOM 1473 O ARG A 123 4.386 15.546 -4.393 1.00 0.00 O ATOM 1474 CB ARG A 123 0.973 15.177 -5.521 1.00 0.00 C ATOM 1475 CG ARG A 123 0.267 14.815 -6.821 1.00 0.00 C ATOM 1476 CD ARG A 123 -1.240 15.020 -6.651 1.00 0.00 C ATOM 1477 NE ARG A 123 -1.520 16.470 -6.444 1.00 0.00 N ATOM 1478 CZ ARG A 123 -2.732 16.882 -6.180 1.00 0.00 C ATOM 1479 NH1 ARG A 123 -3.714 16.027 -6.094 1.00 0.00 N ATOM 1480 NH2 ARG A 123 -2.960 18.154 -6.002 1.00 0.00 N ATOM 0 H ARG A 123 3.188 13.162 -6.691 1.00 0.00 H new ATOM 0 HA ARG A 123 2.863 15.387 -6.531 1.00 0.00 H new ATOM 0 HB2 ARG A 123 0.548 14.608 -4.694 1.00 0.00 H new ATOM 0 HB3 ARG A 123 0.820 16.232 -5.294 1.00 0.00 H new ATOM 0 HG2 ARG A 123 0.640 15.435 -7.636 1.00 0.00 H new ATOM 0 HG3 ARG A 123 0.477 13.779 -7.086 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -1.770 14.658 -7.532 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -1.604 14.443 -5.801 1.00 0.00 H new ATOM 0 HE ARG A 123 -0.759 17.146 -6.509 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -3.538 15.032 -6.233 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -4.658 16.354 -5.888 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -2.194 18.824 -6.069 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -3.905 18.479 -5.796 1.00 0.00 H new ATOM 1494 N GLU A 124 2.441 15.633 -3.350 1.00 0.00 N ATOM 1495 CA GLU A 124 3.059 16.139 -2.088 1.00 0.00 C ATOM 1496 C GLU A 124 2.658 15.226 -0.914 1.00 0.00 C ATOM 1497 O GLU A 124 1.556 14.715 -0.882 1.00 0.00 O ATOM 1498 CB GLU A 124 2.570 17.558 -1.813 1.00 0.00 C ATOM 1499 CG GLU A 124 2.784 18.410 -3.063 1.00 0.00 C ATOM 1500 CD GLU A 124 2.290 19.832 -2.801 1.00 0.00 C ATOM 1501 OE1 GLU A 124 3.061 20.618 -2.273 1.00 0.00 O ATOM 1502 OE2 GLU A 124 1.151 20.113 -3.133 1.00 0.00 O ATOM 0 H GLU A 124 1.429 15.511 -3.313 1.00 0.00 H new ATOM 0 HA GLU A 124 4.144 16.141 -2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.514 17.546 -1.542 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.111 17.986 -0.969 1.00 0.00 H new ATOM 0 HG2 GLU A 124 3.841 18.424 -3.330 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.248 17.977 -3.907 1.00 0.00 H new ATOM 1509 N PRO A 125 3.532 15.027 0.051 1.00 0.00 N ATOM 1510 CA PRO A 125 3.231 14.167 1.241 1.00 0.00 C ATOM 1511 C PRO A 125 1.886 14.506 1.904 1.00 0.00 C ATOM 1512 O PRO A 125 1.527 15.659 2.052 1.00 0.00 O ATOM 1513 CB PRO A 125 4.384 14.479 2.210 1.00 0.00 C ATOM 1514 CG PRO A 125 5.520 14.921 1.346 1.00 0.00 C ATOM 1515 CD PRO A 125 4.901 15.578 0.113 1.00 0.00 C ATOM 0 HA PRO A 125 3.151 13.117 0.960 1.00 0.00 H new ATOM 0 HB2 PRO A 125 4.102 15.259 2.918 1.00 0.00 H new ATOM 0 HB3 PRO A 125 4.654 13.600 2.795 1.00 0.00 H new ATOM 0 HG2 PRO A 125 6.161 15.623 1.878 1.00 0.00 H new ATOM 0 HG3 PRO A 125 6.143 14.073 1.062 1.00 0.00 H new ATOM 0 HD2 PRO A 125 4.888 16.664 0.206 1.00 0.00 H new ATOM 0 HD3 PRO A 125 5.466 15.342 -0.789 1.00 0.00 H new ATOM 1523 N VAL A 126 1.146 13.500 2.309 1.00 0.00 N ATOM 1524 CA VAL A 126 -0.173 13.745 2.971 1.00 0.00 C ATOM 1525 C VAL A 126 -0.341 12.803 4.168 1.00 0.00 C ATOM 1526 O VAL A 126 0.299 11.774 4.262 1.00 0.00 O ATOM 1527 CB VAL A 126 -1.304 13.509 1.959 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -0.909 14.123 0.615 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -1.562 12.007 1.773 1.00 0.00 C ATOM 0 H VAL A 126 1.401 12.518 2.209 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.212 14.775 3.325 1.00 0.00 H new ATOM 0 HB VAL A 126 -2.215 13.975 2.335 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -1.708 13.959 -0.109 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -0.745 15.194 0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 126 0.007 13.654 0.256 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.367 11.863 1.052 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -0.656 11.525 1.407 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.847 11.566 2.728 1.00 0.00 H new ATOM 1539 N ASP A 127 -1.217 13.146 5.065 1.00 0.00 N ATOM 1540 CA ASP A 127 -1.471 12.280 6.248 1.00 0.00 C ATOM 1541 C ASP A 127 -2.168 10.988 5.798 1.00 0.00 C ATOM 1542 O ASP A 127 -1.911 9.919 6.318 1.00 0.00 O ATOM 1543 CB ASP A 127 -2.373 13.036 7.221 1.00 0.00 C ATOM 1544 CG ASP A 127 -2.654 12.169 8.448 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -2.250 11.018 8.441 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -3.270 12.671 9.373 1.00 0.00 O ATOM 0 H ASP A 127 -1.775 13.999 5.030 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.529 12.026 6.734 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -1.896 13.968 7.524 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -3.309 13.303 6.731 1.00 0.00 H new ATOM 1551 N SER A 128 -3.057 11.077 4.841 1.00 0.00 N ATOM 1552 CA SER A 128 -3.770 9.849 4.371 1.00 0.00 C ATOM 1553 C SER A 128 -4.280 10.041 2.942 1.00 0.00 C ATOM 1554 O SER A 128 -4.401 11.148 2.453 1.00 0.00 O ATOM 1555 CB SER A 128 -4.960 9.564 5.291 1.00 0.00 C ATOM 1556 OG SER A 128 -5.903 10.623 5.184 1.00 0.00 O ATOM 0 H SER A 128 -3.319 11.941 4.367 1.00 0.00 H new ATOM 0 HA SER A 128 -3.072 9.012 4.392 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.427 8.618 5.018 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.621 9.466 6.322 1.00 0.00 H new ATOM 0 HG SER A 128 -6.667 10.442 5.771 1.00 0.00 H new ATOM 1562 N ALA A 129 -4.591 8.961 2.272 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.104 9.063 0.873 1.00 0.00 C ATOM 1564 C ALA A 129 -5.835 7.773 0.500 1.00 0.00 C ATOM 1565 O ALA A 129 -5.720 6.765 1.171 1.00 0.00 O ATOM 1566 CB ALA A 129 -3.940 9.276 -0.101 1.00 0.00 C ATOM 0 H ALA A 129 -4.512 8.011 2.635 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.788 9.909 0.810 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.325 9.349 -1.118 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -3.415 10.196 0.155 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.251 8.434 -0.034 1.00 0.00 H new ATOM 1572 N VAL A 130 -6.588 7.799 -0.567 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.336 6.582 -0.999 1.00 0.00 C ATOM 1574 C VAL A 130 -6.504 5.799 -2.019 1.00 0.00 C ATOM 1575 O VAL A 130 -5.996 6.344 -2.980 1.00 0.00 O ATOM 1576 CB VAL A 130 -8.662 7.009 -1.629 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.352 5.797 -2.265 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -9.566 7.603 -0.545 1.00 0.00 C ATOM 0 H VAL A 130 -6.718 8.617 -1.162 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.530 5.944 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.473 7.755 -2.400 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.296 6.109 -2.712 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.708 5.375 -3.036 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -9.544 5.045 -1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -10.513 7.909 -0.989 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -9.751 6.854 0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.078 8.469 -0.098 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.358 4.521 -1.803 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.555 3.679 -2.734 1.00 0.00 C ATOM 1590 C LEU A 131 -6.354 3.371 -4.000 1.00 0.00 C ATOM 1591 O LEU A 131 -7.562 3.237 -3.975 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.189 2.376 -2.024 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.434 2.699 -0.729 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.137 1.399 0.027 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.116 3.425 -1.054 1.00 0.00 C ATOM 0 H LEU A 131 -6.765 4.019 -1.014 1.00 0.00 H new ATOM 0 HA LEU A 131 -4.651 4.217 -3.021 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.090 1.805 -1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.571 1.756 -2.673 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.050 3.348 -0.107 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.600 1.628 0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.074 0.896 0.268 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.526 0.747 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.587 3.650 -0.128 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.494 2.786 -1.681 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.333 4.353 -1.583 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.675 3.256 -5.112 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.371 2.957 -6.396 1.00 0.00 C ATOM 1609 C ALA A 132 -5.458 2.124 -7.295 1.00 0.00 C ATOM 1610 O ALA A 132 -4.266 2.026 -7.077 1.00 0.00 O ATOM 1611 CB ALA A 132 -6.716 4.263 -7.106 1.00 0.00 C ATOM 0 H ALA A 132 -4.663 3.357 -5.185 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.284 2.400 -6.187 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.225 4.043 -8.045 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.369 4.861 -6.470 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -5.801 4.819 -7.311 1.00 0.00 H new ATOM 1617 N ASN A 133 -6.021 1.517 -8.304 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.212 0.673 -9.229 1.00 0.00 C ATOM 1619 C ASN A 133 -4.178 1.524 -9.975 1.00 0.00 C ATOM 1620 O ASN A 133 -4.498 2.523 -10.591 1.00 0.00 O ATOM 1621 CB ASN A 133 -6.148 -0.012 -10.228 1.00 0.00 C ATOM 1622 CG ASN A 133 -6.888 1.037 -11.064 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -6.297 1.693 -11.899 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -8.167 1.221 -10.876 1.00 0.00 N ATOM 0 H ASN A 133 -7.014 1.570 -8.529 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.677 -0.079 -8.650 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -5.576 -0.671 -10.881 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.866 -0.636 -9.696 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -8.669 1.915 -11.430 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -8.664 0.671 -10.175 1.00 0.00 H new ATOM 1631 N GLY A 134 -2.934 1.120 -9.923 1.00 0.00 N ATOM 1632 CA GLY A 134 -1.857 1.879 -10.622 1.00 0.00 C ATOM 1633 C GLY A 134 -1.394 3.037 -9.738 1.00 0.00 C ATOM 1634 O GLY A 134 -0.749 3.961 -10.194 1.00 0.00 O ATOM 0 H GLY A 134 -2.618 0.290 -9.422 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.018 1.219 -10.845 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.225 2.259 -11.575 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.719 2.999 -8.474 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.300 4.109 -7.562 1.00 0.00 C ATOM 1640 C ASP A 135 0.112 3.846 -7.035 1.00 0.00 C ATOM 1641 O ASP A 135 0.594 2.729 -7.055 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.276 4.210 -6.391 1.00 0.00 C ATOM 1643 CG ASP A 135 -2.031 5.514 -5.626 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -1.425 6.408 -6.193 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -2.454 5.593 -4.485 1.00 0.00 O ATOM 0 H ASP A 135 -2.254 2.252 -8.032 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.305 5.047 -8.117 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -3.302 4.179 -6.757 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -2.149 3.357 -5.725 1.00 0.00 H new ATOM 1650 N GLU A 136 0.778 4.872 -6.561 1.00 0.00 N ATOM 1651 CA GLU A 136 2.165 4.704 -6.027 1.00 0.00 C ATOM 1652 C GLU A 136 2.165 4.938 -4.518 1.00 0.00 C ATOM 1653 O GLU A 136 1.749 5.974 -4.040 1.00 0.00 O ATOM 1654 CB GLU A 136 3.089 5.728 -6.687 1.00 0.00 C ATOM 1655 CG GLU A 136 4.525 5.488 -6.217 1.00 0.00 C ATOM 1656 CD GLU A 136 5.467 6.469 -6.913 1.00 0.00 C ATOM 1657 OE1 GLU A 136 5.046 7.082 -7.880 1.00 0.00 O ATOM 1658 OE2 GLU A 136 6.595 6.592 -6.465 1.00 0.00 O ATOM 0 H GLU A 136 0.417 5.825 -6.521 1.00 0.00 H new ATOM 0 HA GLU A 136 2.514 3.694 -6.242 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.030 5.642 -7.772 1.00 0.00 H new ATOM 0 HB3 GLU A 136 2.774 6.739 -6.429 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.589 5.612 -5.136 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.824 4.463 -6.438 1.00 0.00 H new ATOM 1665 N VAL A 137 2.644 3.978 -3.767 1.00 0.00 N ATOM 1666 CA VAL A 137 2.699 4.121 -2.281 1.00 0.00 C ATOM 1667 C VAL A 137 4.119 3.829 -1.804 1.00 0.00 C ATOM 1668 O VAL A 137 4.723 2.845 -2.187 1.00 0.00 O ATOM 1669 CB VAL A 137 1.731 3.128 -1.634 1.00 0.00 C ATOM 1670 CG1 VAL A 137 1.959 3.095 -0.117 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.294 3.570 -1.923 1.00 0.00 C ATOM 0 H VAL A 137 3.003 3.093 -4.125 1.00 0.00 H new ATOM 0 HA VAL A 137 2.416 5.135 -2.000 1.00 0.00 H new ATOM 0 HB VAL A 137 1.902 2.133 -2.044 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.268 2.387 0.340 1.00 0.00 H new ATOM 0 HG12 VAL A 137 2.984 2.787 0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 137 1.788 4.088 0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.402 2.867 -1.465 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.129 4.565 -1.510 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.130 3.593 -3.000 1.00 0.00 H new ATOM 1681 N GLN A 138 4.649 4.675 -0.960 1.00 0.00 N ATOM 1682 CA GLN A 138 6.026 4.465 -0.424 1.00 0.00 C ATOM 1683 C GLN A 138 5.946 4.389 1.098 1.00 0.00 C ATOM 1684 O GLN A 138 5.612 5.356 1.758 1.00 0.00 O ATOM 1685 CB GLN A 138 6.919 5.640 -0.830 1.00 0.00 C ATOM 1686 CG GLN A 138 8.329 5.422 -0.275 1.00 0.00 C ATOM 1687 CD GLN A 138 9.254 6.536 -0.761 1.00 0.00 C ATOM 1688 OE1 GLN A 138 8.965 7.206 -1.733 1.00 0.00 O ATOM 1689 NE2 GLN A 138 10.364 6.768 -0.115 1.00 0.00 N ATOM 0 H GLN A 138 4.180 5.513 -0.615 1.00 0.00 H new ATOM 0 HA GLN A 138 6.447 3.543 -0.825 1.00 0.00 H new ATOM 0 HB2 GLN A 138 6.953 5.727 -1.916 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.506 6.574 -0.448 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.303 5.408 0.815 1.00 0.00 H new ATOM 0 HG3 GLN A 138 8.711 4.453 -0.597 1.00 0.00 H new ATOM 0 HE21 GLN A 138 10.606 6.206 0.701 1.00 0.00 H new ATOM 0 HE22 GLN A 138 10.989 7.512 -0.426 1.00 0.00 H new ATOM 1698 N ILE A 139 6.245 3.245 1.658 1.00 0.00 N ATOM 1699 CA ILE A 139 6.188 3.083 3.143 1.00 0.00 C ATOM 1700 C ILE A 139 7.475 2.423 3.642 1.00 0.00 C ATOM 1701 O ILE A 139 7.902 1.403 3.137 1.00 0.00 O ATOM 1702 CB ILE A 139 4.984 2.218 3.516 1.00 0.00 C ATOM 1703 CG1 ILE A 139 3.698 2.961 3.139 1.00 0.00 C ATOM 1704 CG2 ILE A 139 5.000 1.952 5.022 1.00 0.00 C ATOM 1705 CD1 ILE A 139 2.497 2.016 3.248 1.00 0.00 C ATOM 0 H ILE A 139 6.528 2.409 1.146 1.00 0.00 H new ATOM 0 HA ILE A 139 6.087 4.063 3.610 1.00 0.00 H new ATOM 0 HB ILE A 139 5.029 1.269 2.981 1.00 0.00 H new ATOM 0 HG12 ILE A 139 3.557 3.819 3.797 1.00 0.00 H new ATOM 0 HG13 ILE A 139 3.776 3.348 2.123 1.00 0.00 H new ATOM 0 HG21 ILE A 139 4.143 1.335 5.292 1.00 0.00 H new ATOM 0 HG22 ILE A 139 5.920 1.432 5.290 1.00 0.00 H new ATOM 0 HG23 ILE A 139 4.949 2.899 5.559 1.00 0.00 H new ATOM 0 HD11 ILE A 139 1.587 2.552 2.978 1.00 0.00 H new ATOM 0 HD12 ILE A 139 2.635 1.172 2.572 1.00 0.00 H new ATOM 0 HD13 ILE A 139 2.413 1.651 4.272 1.00 0.00 H new ATOM 1717 N GLY A 140 8.087 3.002 4.640 1.00 0.00 N ATOM 1718 CA GLY A 140 9.341 2.420 5.198 1.00 0.00 C ATOM 1719 C GLY A 140 10.466 2.522 4.170 1.00 0.00 C ATOM 1720 O GLY A 140 11.297 1.643 4.064 1.00 0.00 O ATOM 0 H GLY A 140 7.770 3.858 5.095 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.622 2.947 6.110 1.00 0.00 H new ATOM 0 HA3 GLY A 140 9.178 1.377 5.469 1.00 0.00 H new ATOM 1724 N LYS A 141 10.492 3.583 3.414 1.00 0.00 N ATOM 1725 CA LYS A 141 11.559 3.757 2.382 1.00 0.00 C ATOM 1726 C LYS A 141 11.321 2.774 1.230 1.00 0.00 C ATOM 1727 O LYS A 141 11.835 2.943 0.140 1.00 0.00 O ATOM 1728 CB LYS A 141 12.949 3.493 3.006 1.00 0.00 C ATOM 1729 CG LYS A 141 14.040 4.231 2.207 1.00 0.00 C ATOM 1730 CD LYS A 141 14.170 5.678 2.698 1.00 0.00 C ATOM 1731 CE LYS A 141 15.348 6.347 1.991 1.00 0.00 C ATOM 1732 NZ LYS A 141 15.052 6.459 0.535 1.00 0.00 N ATOM 0 H LYS A 141 9.816 4.345 3.465 1.00 0.00 H new ATOM 0 HA LYS A 141 11.526 4.779 2.005 1.00 0.00 H new ATOM 0 HB2 LYS A 141 12.959 3.827 4.044 1.00 0.00 H new ATOM 0 HB3 LYS A 141 13.155 2.423 3.014 1.00 0.00 H new ATOM 0 HG2 LYS A 141 14.994 3.715 2.318 1.00 0.00 H new ATOM 0 HG3 LYS A 141 13.793 4.220 1.145 1.00 0.00 H new ATOM 0 HD2 LYS A 141 13.250 6.227 2.496 1.00 0.00 H new ATOM 0 HD3 LYS A 141 14.321 5.696 3.777 1.00 0.00 H new ATOM 0 HE2 LYS A 141 15.527 7.335 2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 141 16.257 5.765 2.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 15.706 7.140 0.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 15.169 5.529 0.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 14.074 6.787 0.404 1.00 0.00 H new ATOM 1746 N PHE A 142 10.554 1.746 1.465 1.00 0.00 N ATOM 1747 CA PHE A 142 10.293 0.750 0.390 1.00 0.00 C ATOM 1748 C PHE A 142 9.330 1.337 -0.643 1.00 0.00 C ATOM 1749 O PHE A 142 8.411 2.062 -0.312 1.00 0.00 O ATOM 1750 CB PHE A 142 9.674 -0.503 1.006 1.00 0.00 C ATOM 1751 CG PHE A 142 10.696 -1.194 1.875 1.00 0.00 C ATOM 1752 CD1 PHE A 142 11.629 -2.067 1.303 1.00 0.00 C ATOM 1753 CD2 PHE A 142 10.710 -0.963 3.256 1.00 0.00 C ATOM 1754 CE1 PHE A 142 12.575 -2.708 2.111 1.00 0.00 C ATOM 1755 CE2 PHE A 142 11.657 -1.604 4.064 1.00 0.00 C ATOM 1756 CZ PHE A 142 12.589 -2.477 3.492 1.00 0.00 C ATOM 0 H PHE A 142 10.097 1.553 2.356 1.00 0.00 H new ATOM 0 HA PHE A 142 11.232 0.496 -0.102 1.00 0.00 H new ATOM 0 HB2 PHE A 142 8.799 -0.236 1.598 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.334 -1.177 0.220 1.00 0.00 H new ATOM 0 HD1 PHE A 142 11.619 -2.246 0.238 1.00 0.00 H new ATOM 0 HD2 PHE A 142 9.990 -0.290 3.698 1.00 0.00 H new ATOM 0 HE1 PHE A 142 13.295 -3.381 1.669 1.00 0.00 H new ATOM 0 HE2 PHE A 142 11.668 -1.425 5.129 1.00 0.00 H new ATOM 0 HZ PHE A 142 13.319 -2.972 4.115 1.00 0.00 H new ATOM 1766 N ARG A 143 9.531 1.021 -1.897 1.00 0.00 N ATOM 1767 CA ARG A 143 8.629 1.546 -2.966 1.00 0.00 C ATOM 1768 C ARG A 143 7.616 0.468 -3.341 1.00 0.00 C ATOM 1769 O ARG A 143 7.973 -0.618 -3.755 1.00 0.00 O ATOM 1770 CB ARG A 143 9.466 1.909 -4.190 1.00 0.00 C ATOM 1771 CG ARG A 143 10.307 3.146 -3.872 1.00 0.00 C ATOM 1772 CD ARG A 143 11.159 3.520 -5.088 1.00 0.00 C ATOM 1773 NE ARG A 143 11.962 4.734 -4.770 1.00 0.00 N ATOM 1774 CZ ARG A 143 12.536 5.419 -5.724 1.00 0.00 C ATOM 1775 NH1 ARG A 143 12.395 5.057 -6.969 1.00 0.00 N ATOM 1776 NH2 ARG A 143 13.248 6.472 -5.428 1.00 0.00 N ATOM 0 H ARG A 143 10.285 0.419 -2.228 1.00 0.00 H new ATOM 0 HA ARG A 143 8.102 2.431 -2.608 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.112 1.075 -4.464 1.00 0.00 H new ATOM 0 HB3 ARG A 143 8.818 2.104 -5.044 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.658 3.979 -3.601 1.00 0.00 H new ATOM 0 HG3 ARG A 143 10.949 2.950 -3.013 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.818 2.693 -5.353 1.00 0.00 H new ATOM 0 HD3 ARG A 143 10.520 3.708 -5.951 1.00 0.00 H new ATOM 0 HE ARG A 143 12.065 5.033 -3.800 1.00 0.00 H new ATOM 0 HH11 ARG A 143 11.835 4.237 -7.201 1.00 0.00 H new ATOM 0 HH12 ARG A 143 12.845 5.594 -7.710 1.00 0.00 H new ATOM 0 HH21 ARG A 143 13.355 6.758 -4.455 1.00 0.00 H new ATOM 0 HH22 ARG A 143 13.697 7.009 -6.170 1.00 0.00 H new ATOM 1790 N LEU A 144 6.349 0.761 -3.187 1.00 0.00 N ATOM 1791 CA LEU A 144 5.286 -0.236 -3.515 1.00 0.00 C ATOM 1792 C LEU A 144 4.242 0.398 -4.424 1.00 0.00 C ATOM 1793 O LEU A 144 4.037 1.596 -4.413 1.00 0.00 O ATOM 1794 CB LEU A 144 4.613 -0.700 -2.223 1.00 0.00 C ATOM 1795 CG LEU A 144 5.639 -1.442 -1.327 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.280 -0.466 -0.332 1.00 0.00 C ATOM 1797 CD2 LEU A 144 4.934 -2.559 -0.549 1.00 0.00 C ATOM 0 H LEU A 144 6.003 1.657 -2.845 1.00 0.00 H new ATOM 0 HA LEU A 144 5.738 -1.087 -4.025 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.204 0.157 -1.688 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.777 -1.359 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 144 6.414 -1.867 -1.964 1.00 0.00 H new ATOM 0 HD11 LEU A 144 6.998 -1.000 0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 144 6.792 0.326 -0.878 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.506 -0.030 0.300 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.658 -3.078 0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.153 -2.129 0.077 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.489 -3.266 -1.250 1.00 0.00 H new ATOM 1809 N VAL A 145 3.580 -0.409 -5.213 1.00 0.00 N ATOM 1810 CA VAL A 145 2.536 0.110 -6.143 1.00 0.00 C ATOM 1811 C VAL A 145 1.232 -0.663 -5.932 1.00 0.00 C ATOM 1812 O VAL A 145 1.227 -1.865 -5.746 1.00 0.00 O ATOM 1813 CB VAL A 145 3.020 -0.047 -7.589 1.00 0.00 C ATOM 1814 CG1 VAL A 145 2.998 -1.523 -8.002 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.103 0.757 -8.511 1.00 0.00 C ATOM 0 H VAL A 145 3.722 -1.418 -5.252 1.00 0.00 H new ATOM 0 HA VAL A 145 2.355 1.166 -5.942 1.00 0.00 H new ATOM 0 HB VAL A 145 4.043 0.321 -7.667 1.00 0.00 H new ATOM 0 HG11 VAL A 145 3.344 -1.618 -9.031 1.00 0.00 H new ATOM 0 HG12 VAL A 145 3.653 -2.095 -7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 145 1.981 -1.907 -7.924 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.440 0.651 -9.542 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.082 0.385 -8.423 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.132 1.809 -8.226 1.00 0.00 H new ATOM 1825 N PHE A 146 0.128 0.032 -5.943 1.00 0.00 N ATOM 1826 CA PHE A 146 -1.189 -0.630 -5.728 1.00 0.00 C ATOM 1827 C PHE A 146 -1.759 -1.075 -7.074 1.00 0.00 C ATOM 1828 O PHE A 146 -1.983 -0.268 -7.963 1.00 0.00 O ATOM 1829 CB PHE A 146 -2.141 0.379 -5.084 1.00 0.00 C ATOM 1830 CG PHE A 146 -3.343 -0.333 -4.517 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -4.377 -0.745 -5.363 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.427 -0.573 -3.142 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -5.495 -1.400 -4.836 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -4.545 -1.228 -2.612 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.579 -1.642 -3.459 1.00 0.00 C ATOM 0 H PHE A 146 0.082 1.040 -6.093 1.00 0.00 H new ATOM 0 HA PHE A 146 -1.070 -1.500 -5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.625 0.924 -4.294 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -2.459 1.114 -5.823 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.312 -0.557 -6.425 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -2.629 -0.253 -2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -6.293 -1.719 -5.490 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.609 -1.414 -1.550 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.442 -2.148 -3.051 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.994 -2.358 -7.228 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.548 -2.890 -8.511 1.00 0.00 C ATOM 1847 C LEU A 147 -3.673 -3.878 -8.220 1.00 0.00 C ATOM 1848 O LEU A 147 -3.708 -4.511 -7.181 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.438 -3.597 -9.287 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.446 -2.561 -9.836 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.828 -3.274 -10.294 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -1.064 -1.800 -11.029 1.00 0.00 C ATOM 0 H LEU A 147 -1.823 -3.064 -6.512 1.00 0.00 H new ATOM 0 HA LEU A 147 -2.942 -2.064 -9.103 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.919 -4.302 -8.637 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -1.866 -4.175 -10.107 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.210 -1.846 -9.048 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.535 -2.542 -10.684 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.277 -3.796 -9.449 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.582 -3.993 -11.075 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.347 -1.070 -11.405 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.313 -2.506 -11.821 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.968 -1.286 -10.704 1.00 0.00 H new ATOM 1864 N THR A 148 -4.593 -4.010 -9.142 1.00 0.00 N ATOM 1865 CA THR A 148 -5.737 -4.951 -8.956 1.00 0.00 C ATOM 1866 C THR A 148 -5.846 -5.873 -10.174 1.00 0.00 C ATOM 1867 O THR A 148 -5.352 -5.575 -11.244 1.00 0.00 O ATOM 1868 CB THR A 148 -7.030 -4.147 -8.801 1.00 0.00 C ATOM 1869 OG1 THR A 148 -7.298 -3.440 -10.004 1.00 0.00 O ATOM 1870 CG2 THR A 148 -6.874 -3.156 -7.646 1.00 0.00 C ATOM 0 H THR A 148 -4.599 -3.500 -10.025 1.00 0.00 H new ATOM 0 HA THR A 148 -5.574 -5.555 -8.063 1.00 0.00 H new ATOM 0 HB THR A 148 -7.858 -4.824 -8.590 1.00 0.00 H new ATOM 0 HG1 THR A 148 -8.127 -2.927 -9.904 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.793 -2.582 -7.533 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.671 -3.701 -6.724 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.047 -2.479 -7.857 1.00 0.00 H new