USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=10 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 133 ASN : amide:sc= 0.909 K(o=0.65,f=-6.1!) USER MOD Set 1.2: A 148 THR OG1 : rot 180:sc= -0.259 USER MOD Set 2.1: A 120 TYR OH : rot 180:sc= -2.53! USER MOD Set 2.2: A 138 GLN : amide:sc= -2.42! C(o=-5!,f=-6.5!) USER MOD Set 3.1: A 98 HIS : no HD1:sc= -0.441 X(o=-0.38,f=0.059) USER MOD Set 3.2: A 119 THR OG1 : rot 37:sc= 0.0564 USER MOD Set 4.1: A 78 SER OG : rot -130:sc= 0.73 USER MOD Set 4.2: A 85 SER OG : rot -116:sc= 0.515 USER MOD Set 5.1: A 65 ASN : amide:sc= -2.05! C(o=-3.6!,f=-12!) USER MOD Set 5.2: A 68 SER OG : rot 52:sc= -1.59! USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HD1:sc= -0.485! C(o=-0.49!,f=-7.3!) USER MOD Single : A 93 THR OG1 : rot 150:sc= -0.807! USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -8.86! C(o=-8.9!,f=-13!) USER MOD Single : A 106 ASN : amide:sc= -0.494 X(o=-0.49,f=0) USER MOD Single : A 109 ASN : amide:sc= -1.46 K(o=-1.5,f=-5.9!) USER MOD Single : A 122 ASN : amide:sc= -0.0572 K(o=-0.057,f=-2.1!) USER MOD Single : A 128 SER OG : rot 44:sc= 0.675 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -13.597 -8.130 -3.723 1.00 0.00 N ATOM 417 CA GLY A 54 -12.955 -6.813 -3.431 1.00 0.00 C ATOM 418 C GLY A 54 -11.573 -7.049 -2.816 1.00 0.00 C ATOM 419 O GLY A 54 -11.400 -6.982 -1.615 1.00 0.00 O ATOM 0 HA2 GLY A 54 -12.863 -6.229 -4.347 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.577 -6.236 -2.746 1.00 0.00 H new ATOM 423 N LEU A 55 -10.591 -7.332 -3.634 1.00 0.00 N ATOM 424 CA LEU A 55 -9.207 -7.589 -3.120 1.00 0.00 C ATOM 425 C LEU A 55 -8.206 -6.707 -3.870 1.00 0.00 C ATOM 426 O LEU A 55 -8.404 -6.352 -5.015 1.00 0.00 O ATOM 427 CB LEU A 55 -8.856 -9.064 -3.345 1.00 0.00 C ATOM 428 CG LEU A 55 -9.692 -9.958 -2.414 1.00 0.00 C ATOM 429 CD1 LEU A 55 -9.601 -11.408 -2.895 1.00 0.00 C ATOM 430 CD2 LEU A 55 -9.164 -9.874 -0.972 1.00 0.00 C ATOM 0 H LEU A 55 -10.688 -7.397 -4.647 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.163 -7.356 -2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.042 -9.335 -4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.794 -9.225 -3.159 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.727 -9.617 -2.434 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.192 -12.047 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.985 -11.479 -3.912 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.561 -11.733 -2.877 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.767 -10.512 -0.326 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.126 -10.206 -0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.224 -8.844 -0.622 1.00 0.00 H new ATOM 442 N ALA A 56 -7.127 -6.358 -3.226 1.00 0.00 N ATOM 443 CA ALA A 56 -6.088 -5.503 -3.873 1.00 0.00 C ATOM 444 C ALA A 56 -4.717 -6.071 -3.506 1.00 0.00 C ATOM 445 O ALA A 56 -4.520 -6.559 -2.410 1.00 0.00 O ATOM 446 CB ALA A 56 -6.218 -4.072 -3.349 1.00 0.00 C ATOM 0 H ALA A 56 -6.917 -6.632 -2.266 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.212 -5.494 -4.956 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.462 -3.443 -3.818 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.209 -3.686 -3.587 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.076 -4.066 -2.268 1.00 0.00 H new ATOM 452 N LEU A 57 -3.774 -6.030 -4.412 1.00 0.00 N ATOM 453 CA LEU A 57 -2.412 -6.592 -4.123 1.00 0.00 C ATOM 454 C LEU A 57 -1.359 -5.495 -4.257 1.00 0.00 C ATOM 455 O LEU A 57 -1.500 -4.563 -5.024 1.00 0.00 O ATOM 456 CB LEU A 57 -2.100 -7.720 -5.123 1.00 0.00 C ATOM 457 CG LEU A 57 -2.679 -9.050 -4.625 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.211 -8.956 -4.481 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.305 -10.149 -5.623 1.00 0.00 C ATOM 0 H LEU A 57 -3.885 -5.631 -5.344 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.396 -6.986 -3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.520 -7.476 -6.099 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.022 -7.811 -5.253 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.266 -9.284 -3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.602 -9.910 -4.127 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.462 -8.173 -3.766 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.654 -8.719 -5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.710 -11.102 -5.283 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.719 -9.908 -6.602 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.220 -10.221 -5.695 1.00 0.00 H new ATOM 471 N LEU A 58 -0.296 -5.624 -3.512 1.00 0.00 N ATOM 472 CA LEU A 58 0.816 -4.628 -3.563 1.00 0.00 C ATOM 473 C LEU A 58 2.068 -5.348 -4.057 1.00 0.00 C ATOM 474 O LEU A 58 2.392 -6.423 -3.594 1.00 0.00 O ATOM 475 CB LEU A 58 1.056 -4.075 -2.151 1.00 0.00 C ATOM 476 CG LEU A 58 -0.006 -3.008 -1.810 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.185 -2.923 -0.291 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.446 -1.634 -2.329 1.00 0.00 C ATOM 0 H LEU A 58 -0.147 -6.392 -2.857 1.00 0.00 H new ATOM 0 HA LEU A 58 0.570 -3.803 -4.231 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.015 -4.885 -1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.053 -3.640 -2.087 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.948 -3.289 -2.281 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.935 -2.169 -0.055 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.510 -3.890 0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.763 -2.649 0.172 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.309 -0.886 -2.085 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.392 -1.361 -1.861 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.576 -1.678 -3.410 1.00 0.00 H new ATOM 490 N VAL A 59 2.765 -4.776 -5.005 1.00 0.00 N ATOM 491 CA VAL A 59 3.996 -5.436 -5.554 1.00 0.00 C ATOM 492 C VAL A 59 5.212 -4.546 -5.316 1.00 0.00 C ATOM 493 O VAL A 59 5.195 -3.361 -5.586 1.00 0.00 O ATOM 494 CB VAL A 59 3.814 -5.672 -7.055 1.00 0.00 C ATOM 495 CG1 VAL A 59 4.851 -6.688 -7.543 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.404 -6.218 -7.314 1.00 0.00 C ATOM 0 H VAL A 59 2.536 -3.876 -5.427 1.00 0.00 H new ATOM 0 HA VAL A 59 4.152 -6.390 -5.050 1.00 0.00 H new ATOM 0 HB VAL A 59 3.948 -4.732 -7.591 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.721 -6.856 -8.612 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.853 -6.303 -7.355 1.00 0.00 H new ATOM 0 HG13 VAL A 59 4.718 -7.629 -7.009 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.270 -6.388 -8.382 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.274 -7.158 -6.778 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.665 -5.497 -6.966 1.00 0.00 H new ATOM 506 N VAL A 60 6.270 -5.115 -4.811 1.00 0.00 N ATOM 507 CA VAL A 60 7.496 -4.314 -4.550 1.00 0.00 C ATOM 508 C VAL A 60 8.113 -3.892 -5.885 1.00 0.00 C ATOM 509 O VAL A 60 8.748 -4.675 -6.563 1.00 0.00 O ATOM 510 CB VAL A 60 8.487 -5.171 -3.765 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.770 -4.380 -3.513 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.856 -5.562 -2.428 1.00 0.00 C ATOM 0 H VAL A 60 6.338 -6.103 -4.567 1.00 0.00 H new ATOM 0 HA VAL A 60 7.249 -3.423 -3.972 1.00 0.00 H new ATOM 0 HB VAL A 60 8.729 -6.067 -4.337 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.473 -4.996 -2.953 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.216 -4.096 -4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.537 -3.482 -2.940 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.557 -6.174 -1.860 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.618 -4.662 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.943 -6.129 -2.609 1.00 0.00 H new ATOM 522 N LYS A 61 7.923 -2.659 -6.270 1.00 0.00 N ATOM 523 CA LYS A 61 8.487 -2.187 -7.567 1.00 0.00 C ATOM 524 C LYS A 61 10.016 -2.248 -7.517 1.00 0.00 C ATOM 525 O LYS A 61 10.659 -2.669 -8.459 1.00 0.00 O ATOM 526 CB LYS A 61 8.032 -0.747 -7.826 1.00 0.00 C ATOM 527 CG LYS A 61 8.470 -0.310 -9.225 1.00 0.00 C ATOM 528 CD LYS A 61 7.922 1.090 -9.512 1.00 0.00 C ATOM 529 CE LYS A 61 8.333 1.516 -10.921 1.00 0.00 C ATOM 530 NZ LYS A 61 7.761 2.859 -11.227 1.00 0.00 N ATOM 0 H LYS A 61 7.402 -1.958 -5.743 1.00 0.00 H new ATOM 0 HA LYS A 61 8.131 -2.828 -8.373 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.948 -0.676 -7.735 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.459 -0.080 -7.076 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.558 -0.309 -9.294 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.104 -1.016 -9.970 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.836 1.093 -9.421 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.305 1.800 -8.779 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.420 1.546 -11.000 1.00 0.00 H new ATOM 0 HE3 LYS A 61 7.981 0.786 -11.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.042 3.146 -12.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.724 2.816 -11.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.118 3.553 -10.539 1.00 0.00 H new ATOM 544 N ARG A 62 10.606 -1.832 -6.427 1.00 0.00 N ATOM 545 CA ARG A 62 12.096 -1.868 -6.320 1.00 0.00 C ATOM 546 C ARG A 62 12.508 -2.064 -4.861 1.00 0.00 C ATOM 547 O ARG A 62 11.970 -1.447 -3.964 1.00 0.00 O ATOM 548 CB ARG A 62 12.677 -0.551 -6.835 1.00 0.00 C ATOM 549 CG ARG A 62 14.206 -0.620 -6.798 1.00 0.00 C ATOM 550 CD ARG A 62 14.796 0.665 -7.381 1.00 0.00 C ATOM 551 NE ARG A 62 14.446 1.815 -6.502 1.00 0.00 N ATOM 552 CZ ARG A 62 14.779 3.027 -6.852 1.00 0.00 C ATOM 553 NH1 ARG A 62 15.430 3.229 -7.965 1.00 0.00 N ATOM 554 NH2 ARG A 62 14.466 4.037 -6.086 1.00 0.00 N ATOM 0 H ARG A 62 10.121 -1.469 -5.606 1.00 0.00 H new ATOM 0 HA ARG A 62 12.476 -2.697 -6.917 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.335 -0.363 -7.853 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.325 0.279 -6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.548 -0.756 -5.772 1.00 0.00 H new ATOM 0 HG3 ARG A 62 14.554 -1.482 -7.367 1.00 0.00 H new ATOM 0 HD2 ARG A 62 15.879 0.575 -7.466 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.410 0.831 -8.387 1.00 0.00 H new ATOM 0 HE ARG A 62 13.946 1.655 -5.627 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.678 2.439 -8.561 1.00 0.00 H new ATOM 0 HH12 ARG A 62 15.690 4.176 -8.239 1.00 0.00 H new ATOM 0 HH21 ARG A 62 13.961 3.878 -5.214 1.00 0.00 H new ATOM 0 HH22 ARG A 62 14.726 4.984 -6.360 1.00 0.00 H new ATOM 568 N GLY A 63 13.472 -2.907 -4.619 1.00 0.00 N ATOM 569 CA GLY A 63 13.930 -3.129 -3.219 1.00 0.00 C ATOM 570 C GLY A 63 14.695 -4.455 -3.129 1.00 0.00 C ATOM 571 O GLY A 63 14.748 -5.209 -4.080 1.00 0.00 O ATOM 0 H GLY A 63 13.962 -3.451 -5.329 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.571 -2.306 -2.901 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.074 -3.146 -2.544 1.00 0.00 H new ATOM 575 N PRO A 64 15.288 -4.745 -1.992 1.00 0.00 N ATOM 576 CA PRO A 64 16.057 -6.013 -1.794 1.00 0.00 C ATOM 577 C PRO A 64 15.228 -7.258 -2.133 1.00 0.00 C ATOM 578 O PRO A 64 15.702 -8.182 -2.764 1.00 0.00 O ATOM 579 CB PRO A 64 16.417 -5.999 -0.297 1.00 0.00 C ATOM 580 CG PRO A 64 16.371 -4.560 0.102 1.00 0.00 C ATOM 581 CD PRO A 64 15.298 -3.908 -0.775 1.00 0.00 C ATOM 0 HA PRO A 64 16.926 -6.061 -2.450 1.00 0.00 H new ATOM 0 HB2 PRO A 64 15.710 -6.592 0.284 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.406 -6.424 -0.126 1.00 0.00 H new ATOM 0 HG2 PRO A 64 16.126 -4.457 1.159 1.00 0.00 H new ATOM 0 HG3 PRO A 64 17.340 -4.083 -0.048 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.325 -3.905 -0.283 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.543 -2.871 -1.004 1.00 0.00 H new ATOM 589 N ASN A 65 13.993 -7.283 -1.710 1.00 0.00 N ATOM 590 CA ASN A 65 13.111 -8.457 -1.989 1.00 0.00 C ATOM 591 C ASN A 65 12.154 -8.097 -3.128 1.00 0.00 C ATOM 592 O ASN A 65 10.959 -7.991 -2.943 1.00 0.00 O ATOM 593 CB ASN A 65 12.313 -8.779 -0.724 1.00 0.00 C ATOM 594 CG ASN A 65 11.533 -10.076 -0.918 1.00 0.00 C ATOM 595 OD1 ASN A 65 11.389 -10.554 -2.026 1.00 0.00 O ATOM 596 ND2 ASN A 65 11.019 -10.671 0.123 1.00 0.00 N ATOM 0 H ASN A 65 13.552 -6.533 -1.178 1.00 0.00 H new ATOM 0 HA ASN A 65 13.706 -9.323 -2.277 1.00 0.00 H new ATOM 0 HB2 ASN A 65 12.987 -8.874 0.127 1.00 0.00 H new ATOM 0 HB3 ASN A 65 11.627 -7.962 -0.498 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.495 -11.539 0.008 1.00 0.00 H new ATOM 0 HD22 ASN A 65 11.141 -10.269 1.052 1.00 0.00 H new ATOM 603 N ALA A 66 12.682 -7.892 -4.303 1.00 0.00 N ATOM 604 CA ALA A 66 11.823 -7.516 -5.465 1.00 0.00 C ATOM 605 C ALA A 66 10.980 -8.716 -5.913 1.00 0.00 C ATOM 606 O ALA A 66 11.418 -9.848 -5.865 1.00 0.00 O ATOM 607 CB ALA A 66 12.716 -7.054 -6.619 1.00 0.00 C ATOM 0 H ALA A 66 13.678 -7.969 -4.511 1.00 0.00 H new ATOM 0 HA ALA A 66 11.152 -6.709 -5.170 1.00 0.00 H new ATOM 0 HB1 ALA A 66 12.095 -6.778 -7.471 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.302 -6.191 -6.302 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.387 -7.863 -6.906 1.00 0.00 H new ATOM 613 N GLY A 67 9.772 -8.475 -6.353 1.00 0.00 N ATOM 614 CA GLY A 67 8.894 -9.597 -6.812 1.00 0.00 C ATOM 615 C GLY A 67 7.964 -10.017 -5.677 1.00 0.00 C ATOM 616 O GLY A 67 7.046 -10.790 -5.866 1.00 0.00 O ATOM 0 H GLY A 67 9.353 -7.547 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.310 -9.284 -7.677 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.504 -10.443 -7.128 1.00 0.00 H new ATOM 620 N SER A 68 8.196 -9.514 -4.498 1.00 0.00 N ATOM 621 CA SER A 68 7.328 -9.882 -3.346 1.00 0.00 C ATOM 622 C SER A 68 5.914 -9.339 -3.572 1.00 0.00 C ATOM 623 O SER A 68 5.728 -8.281 -4.143 1.00 0.00 O ATOM 624 CB SER A 68 7.914 -9.286 -2.064 1.00 0.00 C ATOM 625 OG SER A 68 9.017 -10.075 -1.641 1.00 0.00 O ATOM 0 H SER A 68 8.951 -8.863 -4.282 1.00 0.00 H new ATOM 0 HA SER A 68 7.281 -10.967 -3.254 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.233 -8.259 -2.240 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.154 -9.255 -1.283 1.00 0.00 H new ATOM 0 HG SER A 68 9.641 -10.191 -2.387 1.00 0.00 H new ATOM 631 N ARG A 69 4.918 -10.060 -3.123 1.00 0.00 N ATOM 632 CA ARG A 69 3.499 -9.607 -3.293 1.00 0.00 C ATOM 633 C ARG A 69 2.749 -9.772 -1.970 1.00 0.00 C ATOM 634 O ARG A 69 3.009 -10.683 -1.209 1.00 0.00 O ATOM 635 CB ARG A 69 2.814 -10.454 -4.369 1.00 0.00 C ATOM 636 CG ARG A 69 3.360 -10.062 -5.739 1.00 0.00 C ATOM 637 CD ARG A 69 2.718 -10.928 -6.822 1.00 0.00 C ATOM 638 NE ARG A 69 3.227 -10.495 -8.151 1.00 0.00 N ATOM 639 CZ ARG A 69 2.918 -11.171 -9.220 1.00 0.00 C ATOM 640 NH1 ARG A 69 2.156 -12.226 -9.126 1.00 0.00 N ATOM 641 NH2 ARG A 69 3.369 -10.790 -10.383 1.00 0.00 N ATOM 0 H ARG A 69 5.026 -10.952 -2.641 1.00 0.00 H new ATOM 0 HA ARG A 69 3.489 -8.559 -3.593 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.992 -11.513 -4.183 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.735 -10.301 -4.337 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.155 -9.009 -5.934 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.443 -10.185 -5.757 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.953 -11.979 -6.653 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.633 -10.834 -6.785 1.00 0.00 H new ATOM 0 HE ARG A 69 3.819 -9.668 -8.225 1.00 0.00 H new ATOM 0 HH11 ARG A 69 1.803 -12.521 -8.216 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.913 -12.756 -9.963 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.963 -9.964 -10.454 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.128 -11.318 -11.222 1.00 0.00 H new ATOM 655 N PHE A 70 1.813 -8.899 -1.699 1.00 0.00 N ATOM 656 CA PHE A 70 1.016 -8.986 -0.434 1.00 0.00 C ATOM 657 C PHE A 70 -0.467 -9.014 -0.795 1.00 0.00 C ATOM 658 O PHE A 70 -0.927 -8.246 -1.619 1.00 0.00 O ATOM 659 CB PHE A 70 1.302 -7.762 0.437 1.00 0.00 C ATOM 660 CG PHE A 70 2.722 -7.831 0.936 1.00 0.00 C ATOM 661 CD1 PHE A 70 3.032 -8.625 2.045 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.729 -7.106 0.288 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.349 -8.696 2.508 1.00 0.00 C ATOM 664 CE2 PHE A 70 5.047 -7.178 0.751 1.00 0.00 C ATOM 665 CZ PHE A 70 5.358 -7.972 1.862 1.00 0.00 C ATOM 0 H PHE A 70 1.563 -8.119 -2.307 1.00 0.00 H new ATOM 0 HA PHE A 70 1.287 -9.888 0.115 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.150 -6.848 -0.137 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.609 -7.729 1.278 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.254 -9.183 2.544 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.489 -6.492 -0.568 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.588 -9.309 3.364 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.826 -6.621 0.251 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.376 -8.026 2.220 1.00 0.00 H new ATOM 675 N LEU A 71 -1.217 -9.895 -0.190 1.00 0.00 N ATOM 676 CA LEU A 71 -2.678 -9.990 -0.495 1.00 0.00 C ATOM 677 C LEU A 71 -3.475 -9.313 0.617 1.00 0.00 C ATOM 678 O LEU A 71 -3.346 -9.644 1.778 1.00 0.00 O ATOM 679 CB LEU A 71 -3.070 -11.471 -0.594 1.00 0.00 C ATOM 680 CG LEU A 71 -4.604 -11.616 -0.802 1.00 0.00 C ATOM 681 CD1 LEU A 71 -4.894 -12.701 -1.847 1.00 0.00 C ATOM 682 CD2 LEU A 71 -5.279 -12.011 0.521 1.00 0.00 C ATOM 0 H LEU A 71 -0.880 -10.558 0.508 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.895 -9.492 -1.440 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.539 -11.939 -1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.769 -11.994 0.314 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.998 -10.660 -1.146 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.971 -12.795 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.429 -12.427 -2.794 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.488 -13.653 -1.505 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.353 -12.110 0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.873 -12.961 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.090 -11.242 1.270 1.00 0.00 H new ATOM 694 N LEU A 72 -4.299 -8.361 0.270 1.00 0.00 N ATOM 695 CA LEU A 72 -5.110 -7.650 1.304 1.00 0.00 C ATOM 696 C LEU A 72 -6.514 -8.248 1.342 1.00 0.00 C ATOM 697 O LEU A 72 -7.286 -8.109 0.416 1.00 0.00 O ATOM 698 CB LEU A 72 -5.189 -6.166 0.938 1.00 0.00 C ATOM 699 CG LEU A 72 -3.771 -5.588 0.825 1.00 0.00 C ATOM 700 CD1 LEU A 72 -3.852 -4.109 0.434 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.036 -5.727 2.170 1.00 0.00 C ATOM 0 H LEU A 72 -4.447 -8.043 -0.688 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.646 -7.760 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.720 -6.041 -0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.755 -5.624 1.696 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.221 -6.138 0.061 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.846 -3.698 0.354 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.360 -4.014 -0.525 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.408 -3.561 1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.031 -5.314 2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.583 -5.185 2.941 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -2.972 -6.780 2.443 1.00 0.00 H new ATOM 713 N ASP A 73 -6.853 -8.919 2.410 1.00 0.00 N ATOM 714 CA ASP A 73 -8.209 -9.530 2.505 1.00 0.00 C ATOM 715 C ASP A 73 -9.200 -8.499 3.051 1.00 0.00 C ATOM 716 O ASP A 73 -9.886 -8.730 4.029 1.00 0.00 O ATOM 717 CB ASP A 73 -8.158 -10.751 3.423 1.00 0.00 C ATOM 718 CG ASP A 73 -7.690 -10.327 4.816 1.00 0.00 C ATOM 719 OD1 ASP A 73 -7.644 -9.135 5.066 1.00 0.00 O ATOM 720 OD2 ASP A 73 -7.385 -11.203 5.609 1.00 0.00 O ATOM 0 H ASP A 73 -6.250 -9.070 3.219 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.537 -9.846 1.515 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.143 -11.214 3.485 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.480 -11.499 3.013 1.00 0.00 H new ATOM 725 N GLN A 74 -9.287 -7.366 2.404 1.00 0.00 N ATOM 726 CA GLN A 74 -10.239 -6.303 2.845 1.00 0.00 C ATOM 727 C GLN A 74 -10.068 -6.003 4.334 1.00 0.00 C ATOM 728 O GLN A 74 -9.128 -6.440 4.969 1.00 0.00 O ATOM 729 CB GLN A 74 -11.668 -6.778 2.599 1.00 0.00 C ATOM 730 CG GLN A 74 -11.906 -6.912 1.093 1.00 0.00 C ATOM 731 CD GLN A 74 -13.303 -7.479 0.842 1.00 0.00 C ATOM 732 OE1 GLN A 74 -13.626 -8.559 1.298 1.00 0.00 O ATOM 733 NE2 GLN A 74 -14.150 -6.795 0.123 1.00 0.00 N ATOM 0 H GLN A 74 -8.733 -7.129 1.581 1.00 0.00 H new ATOM 0 HA GLN A 74 -10.033 -5.396 2.277 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -11.835 -7.736 3.091 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -12.377 -6.071 3.029 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -11.805 -5.940 0.611 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -11.153 -7.565 0.653 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -13.879 -5.889 -0.260 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -15.083 -7.166 -0.057 1.00 0.00 H new ATOM 742 N ALA A 75 -10.990 -5.253 4.883 1.00 0.00 N ATOM 743 CA ALA A 75 -10.936 -4.892 6.329 1.00 0.00 C ATOM 744 C ALA A 75 -9.764 -3.947 6.597 1.00 0.00 C ATOM 745 O ALA A 75 -9.451 -3.082 5.802 1.00 0.00 O ATOM 746 CB ALA A 75 -10.783 -6.157 7.182 1.00 0.00 C ATOM 0 H ALA A 75 -11.791 -4.870 4.380 1.00 0.00 H new ATOM 0 HA ALA A 75 -11.866 -4.389 6.596 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.745 -5.883 8.236 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -11.633 -6.817 7.010 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -9.862 -6.672 6.907 1.00 0.00 H new ATOM 752 N ILE A 76 -9.124 -4.112 7.725 1.00 0.00 N ATOM 753 CA ILE A 76 -7.964 -3.238 8.095 1.00 0.00 C ATOM 754 C ILE A 76 -6.689 -4.076 8.120 1.00 0.00 C ATOM 755 O ILE A 76 -6.626 -5.104 8.766 1.00 0.00 O ATOM 756 CB ILE A 76 -8.203 -2.649 9.488 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.412 -1.716 9.441 1.00 0.00 C ATOM 758 CG2 ILE A 76 -6.968 -1.866 9.942 1.00 0.00 C ATOM 759 CD1 ILE A 76 -9.825 -1.337 10.865 1.00 0.00 C ATOM 0 H ILE A 76 -9.357 -4.824 8.417 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.862 -2.435 7.365 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.391 -3.458 10.194 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.170 -0.819 8.871 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.241 -2.204 8.929 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.145 -1.450 10.934 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.107 -2.533 9.977 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -6.772 -1.057 9.239 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.687 -0.671 10.829 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.085 -2.238 11.420 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.997 -0.831 11.362 1.00 0.00 H new ATOM 771 N THR A 77 -5.669 -3.640 7.425 1.00 0.00 N ATOM 772 CA THR A 77 -4.378 -4.397 7.398 1.00 0.00 C ATOM 773 C THR A 77 -3.254 -3.490 7.906 1.00 0.00 C ATOM 774 O THR A 77 -2.942 -2.478 7.313 1.00 0.00 O ATOM 775 CB THR A 77 -4.078 -4.829 5.962 1.00 0.00 C ATOM 776 OG1 THR A 77 -5.109 -5.695 5.505 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.736 -5.561 5.918 1.00 0.00 C ATOM 0 H THR A 77 -5.675 -2.784 6.870 1.00 0.00 H new ATOM 0 HA THR A 77 -4.451 -5.279 8.035 1.00 0.00 H new ATOM 0 HB THR A 77 -4.030 -3.950 5.319 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.920 -5.972 4.584 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.523 -5.869 4.894 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.947 -4.896 6.269 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.780 -6.441 6.560 1.00 0.00 H new ATOM 785 N SER A 78 -2.646 -3.849 9.001 1.00 0.00 N ATOM 786 CA SER A 78 -1.539 -3.017 9.558 1.00 0.00 C ATOM 787 C SER A 78 -0.229 -3.365 8.847 1.00 0.00 C ATOM 788 O SER A 78 -0.130 -4.372 8.175 1.00 0.00 O ATOM 789 CB SER A 78 -1.403 -3.306 11.051 1.00 0.00 C ATOM 790 OG SER A 78 -1.366 -4.715 11.251 1.00 0.00 O ATOM 0 H SER A 78 -2.868 -4.687 9.538 1.00 0.00 H new ATOM 0 HA SER A 78 -1.760 -1.960 9.406 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.495 -2.847 11.442 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.240 -2.871 11.596 1.00 0.00 H new ATOM 0 HG SER A 78 -2.010 -4.964 11.946 1.00 0.00 H new ATOM 796 N ALA A 79 0.782 -2.540 8.993 1.00 0.00 N ATOM 797 CA ALA A 79 2.100 -2.819 8.332 1.00 0.00 C ATOM 798 C ALA A 79 3.222 -2.707 9.367 1.00 0.00 C ATOM 799 O ALA A 79 3.207 -1.845 10.224 1.00 0.00 O ATOM 800 CB ALA A 79 2.334 -1.800 7.214 1.00 0.00 C ATOM 0 H ALA A 79 0.751 -1.682 9.544 1.00 0.00 H new ATOM 0 HA ALA A 79 2.092 -3.825 7.912 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.291 -2.001 6.733 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.534 -1.878 6.478 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.344 -0.794 7.634 1.00 0.00 H new ATOM 806 N GLY A 80 4.198 -3.576 9.296 1.00 0.00 N ATOM 807 CA GLY A 80 5.326 -3.528 10.277 1.00 0.00 C ATOM 808 C GLY A 80 5.045 -4.503 11.419 1.00 0.00 C ATOM 809 O GLY A 80 5.948 -5.015 12.052 1.00 0.00 O ATOM 0 H GLY A 80 4.263 -4.319 8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.263 -3.788 9.784 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.441 -2.517 10.667 1.00 0.00 H new ATOM 813 N ARG A 81 3.796 -4.765 11.687 1.00 0.00 N ATOM 814 CA ARG A 81 3.449 -5.707 12.789 1.00 0.00 C ATOM 815 C ARG A 81 3.885 -7.128 12.416 1.00 0.00 C ATOM 816 O ARG A 81 3.811 -7.539 11.274 1.00 0.00 O ATOM 817 CB ARG A 81 1.927 -5.666 13.031 1.00 0.00 C ATOM 818 CG ARG A 81 1.592 -4.601 14.080 1.00 0.00 C ATOM 819 CD ARG A 81 0.083 -4.568 14.323 1.00 0.00 C ATOM 820 NE ARG A 81 -0.212 -3.595 15.412 1.00 0.00 N ATOM 821 CZ ARG A 81 -1.376 -3.607 15.998 1.00 0.00 C ATOM 822 NH1 ARG A 81 -2.290 -4.458 15.619 1.00 0.00 N ATOM 823 NH2 ARG A 81 -1.624 -2.769 16.968 1.00 0.00 N ATOM 0 H ARG A 81 2.999 -4.367 11.190 1.00 0.00 H new ATOM 0 HA ARG A 81 3.968 -5.410 13.701 1.00 0.00 H new ATOM 0 HB2 ARG A 81 1.408 -5.445 12.098 1.00 0.00 H new ATOM 0 HB3 ARG A 81 1.577 -6.642 13.367 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.115 -4.818 15.012 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.936 -3.624 13.742 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -0.439 -4.281 13.410 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -0.276 -5.560 14.597 1.00 0.00 H new ATOM 0 HE ARG A 81 0.497 -2.920 15.699 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -2.094 -5.115 14.864 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -3.201 -4.467 16.078 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -0.907 -2.107 17.266 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -2.534 -2.776 17.428 1.00 0.00 H new ATOM 837 N HIS A 82 4.340 -7.878 13.388 1.00 0.00 N ATOM 838 CA HIS A 82 4.790 -9.280 13.133 1.00 0.00 C ATOM 839 C HIS A 82 3.616 -10.256 13.356 1.00 0.00 C ATOM 840 O HIS A 82 3.447 -11.198 12.608 1.00 0.00 O ATOM 841 CB HIS A 82 5.973 -9.629 14.073 1.00 0.00 C ATOM 842 CG HIS A 82 6.648 -8.362 14.539 1.00 0.00 C ATOM 843 ND1 HIS A 82 5.989 -7.410 15.304 1.00 0.00 N ATOM 844 CD2 HIS A 82 7.919 -7.874 14.351 1.00 0.00 C ATOM 845 CE1 HIS A 82 6.857 -6.410 15.545 1.00 0.00 C ATOM 846 NE2 HIS A 82 8.047 -6.642 14.987 1.00 0.00 N ATOM 0 H HIS A 82 4.420 -7.575 14.359 1.00 0.00 H new ATOM 0 HA HIS A 82 5.125 -9.370 12.100 1.00 0.00 H new ATOM 0 HB2 HIS A 82 5.612 -10.196 14.931 1.00 0.00 H new ATOM 0 HB3 HIS A 82 6.690 -10.263 13.550 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.700 -8.371 13.794 1.00 0.00 H new ATOM 0 HE1 HIS A 82 6.619 -5.527 16.120 1.00 0.00 H new ATOM 0 HE2 HIS A 82 8.873 -6.045 15.019 1.00 0.00 H new ATOM 854 N PRO A 83 2.811 -10.038 14.378 1.00 0.00 N ATOM 855 CA PRO A 83 1.640 -10.922 14.693 1.00 0.00 C ATOM 856 C PRO A 83 0.692 -11.125 13.501 1.00 0.00 C ATOM 857 O PRO A 83 1.112 -11.406 12.396 1.00 0.00 O ATOM 858 CB PRO A 83 0.929 -10.186 15.843 1.00 0.00 C ATOM 859 CG PRO A 83 2.006 -9.388 16.494 1.00 0.00 C ATOM 860 CD PRO A 83 2.918 -8.938 15.357 1.00 0.00 C ATOM 0 HA PRO A 83 1.962 -11.931 14.951 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.130 -9.545 15.471 1.00 0.00 H new ATOM 0 HB3 PRO A 83 0.475 -10.887 16.543 1.00 0.00 H new ATOM 0 HG2 PRO A 83 1.593 -8.533 17.029 1.00 0.00 H new ATOM 0 HG3 PRO A 83 2.553 -9.986 17.223 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.592 -7.989 14.932 1.00 0.00 H new ATOM 0 HD3 PRO A 83 3.945 -8.800 15.696 1.00 0.00 H new ATOM 868 N ASP A 84 -0.588 -10.998 13.728 1.00 0.00 N ATOM 869 CA ASP A 84 -1.570 -11.198 12.628 1.00 0.00 C ATOM 870 C ASP A 84 -1.533 -10.000 11.678 1.00 0.00 C ATOM 871 O ASP A 84 -2.092 -8.957 11.952 1.00 0.00 O ATOM 872 CB ASP A 84 -2.971 -11.329 13.233 1.00 0.00 C ATOM 873 CG ASP A 84 -3.106 -12.684 13.931 1.00 0.00 C ATOM 874 OD1 ASP A 84 -2.266 -13.536 13.696 1.00 0.00 O ATOM 875 OD2 ASP A 84 -4.048 -12.845 14.691 1.00 0.00 O ATOM 0 H ASP A 84 -0.996 -10.763 14.633 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.320 -12.101 12.071 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -3.147 -10.523 13.945 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -3.725 -11.235 12.452 1.00 0.00 H new ATOM 880 N SER A 85 -0.881 -10.145 10.558 1.00 0.00 N ATOM 881 CA SER A 85 -0.805 -9.020 9.582 1.00 0.00 C ATOM 882 C SER A 85 -0.288 -9.549 8.241 1.00 0.00 C ATOM 883 O SER A 85 0.718 -10.228 8.174 1.00 0.00 O ATOM 884 CB SER A 85 0.143 -7.940 10.111 1.00 0.00 C ATOM 885 OG SER A 85 -0.535 -7.158 11.086 1.00 0.00 O ATOM 0 H SER A 85 -0.396 -10.996 10.275 1.00 0.00 H new ATOM 0 HA SER A 85 -1.796 -8.588 9.446 1.00 0.00 H new ATOM 0 HB2 SER A 85 1.029 -8.400 10.549 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.484 -7.306 9.292 1.00 0.00 H new ATOM 0 HG SER A 85 -0.621 -6.236 10.764 1.00 0.00 H new ATOM 891 N ASP A 86 -0.975 -9.249 7.176 1.00 0.00 N ATOM 892 CA ASP A 86 -0.534 -9.739 5.838 1.00 0.00 C ATOM 893 C ASP A 86 0.848 -9.175 5.504 1.00 0.00 C ATOM 894 O ASP A 86 1.694 -9.863 4.968 1.00 0.00 O ATOM 895 CB ASP A 86 -1.531 -9.277 4.777 1.00 0.00 C ATOM 896 CG ASP A 86 -2.834 -10.063 4.920 1.00 0.00 C ATOM 897 OD1 ASP A 86 -2.842 -11.024 5.671 1.00 0.00 O ATOM 898 OD2 ASP A 86 -3.801 -9.691 4.276 1.00 0.00 O ATOM 0 H ASP A 86 -1.825 -8.685 7.172 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.485 -10.828 5.855 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -1.725 -8.210 4.886 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.113 -9.425 3.781 1.00 0.00 H new ATOM 903 N ILE A 87 1.080 -7.927 5.805 1.00 0.00 N ATOM 904 CA ILE A 87 2.402 -7.315 5.492 1.00 0.00 C ATOM 905 C ILE A 87 3.406 -7.662 6.594 1.00 0.00 C ATOM 906 O ILE A 87 3.170 -7.430 7.763 1.00 0.00 O ATOM 907 CB ILE A 87 2.238 -5.799 5.394 1.00 0.00 C ATOM 908 CG1 ILE A 87 1.350 -5.466 4.192 1.00 0.00 C ATOM 909 CG2 ILE A 87 3.608 -5.139 5.228 1.00 0.00 C ATOM 910 CD1 ILE A 87 0.969 -3.986 4.228 1.00 0.00 C ATOM 0 H ILE A 87 0.410 -7.304 6.255 1.00 0.00 H new ATOM 0 HA ILE A 87 2.773 -7.704 4.544 1.00 0.00 H new ATOM 0 HB ILE A 87 1.773 -5.422 6.305 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.876 -5.694 3.265 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.452 -6.083 4.209 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.485 -4.058 5.159 1.00 0.00 H new ATOM 0 HG22 ILE A 87 4.234 -5.379 6.088 1.00 0.00 H new ATOM 0 HG23 ILE A 87 4.083 -5.509 4.319 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.337 -3.752 3.371 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.426 -3.772 5.149 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.872 -3.377 4.190 1.00 0.00 H new ATOM 922 N PHE A 88 4.529 -8.220 6.219 1.00 0.00 N ATOM 923 CA PHE A 88 5.578 -8.603 7.217 1.00 0.00 C ATOM 924 C PHE A 88 6.926 -8.038 6.765 1.00 0.00 C ATOM 925 O PHE A 88 7.689 -8.697 6.086 1.00 0.00 O ATOM 926 CB PHE A 88 5.662 -10.130 7.290 1.00 0.00 C ATOM 927 CG PHE A 88 6.812 -10.536 8.182 1.00 0.00 C ATOM 928 CD1 PHE A 88 6.761 -10.259 9.551 1.00 0.00 C ATOM 929 CD2 PHE A 88 7.926 -11.192 7.641 1.00 0.00 C ATOM 930 CE1 PHE A 88 7.822 -10.635 10.383 1.00 0.00 C ATOM 931 CE2 PHE A 88 8.987 -11.569 8.472 1.00 0.00 C ATOM 932 CZ PHE A 88 8.935 -11.291 9.843 1.00 0.00 C ATOM 0 H PHE A 88 4.768 -8.430 5.250 1.00 0.00 H new ATOM 0 HA PHE A 88 5.325 -8.203 8.199 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.728 -10.537 7.677 1.00 0.00 H new ATOM 0 HB3 PHE A 88 5.800 -10.544 6.291 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.902 -9.754 9.967 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.966 -11.406 6.583 1.00 0.00 H new ATOM 0 HE1 PHE A 88 7.782 -10.419 11.440 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.846 -12.074 8.056 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.754 -11.583 10.484 1.00 0.00 H new ATOM 942 N LEU A 89 7.221 -6.818 7.130 1.00 0.00 N ATOM 943 CA LEU A 89 8.516 -6.191 6.718 1.00 0.00 C ATOM 944 C LEU A 89 9.495 -6.220 7.894 1.00 0.00 C ATOM 945 O LEU A 89 9.479 -5.362 8.754 1.00 0.00 O ATOM 946 CB LEU A 89 8.254 -4.741 6.305 1.00 0.00 C ATOM 947 CG LEU A 89 7.256 -4.709 5.138 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.934 -3.253 4.789 1.00 0.00 C ATOM 949 CD2 LEU A 89 7.855 -5.418 3.908 1.00 0.00 C ATOM 0 H LEU A 89 6.618 -6.224 7.699 1.00 0.00 H new ATOM 0 HA LEU A 89 8.945 -6.742 5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.859 -4.178 7.150 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.188 -4.262 6.011 1.00 0.00 H new ATOM 0 HG LEU A 89 6.343 -5.227 5.432 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.226 -3.225 3.961 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.497 -2.759 5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.850 -2.737 4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.139 -5.389 3.087 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.772 -4.912 3.607 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.078 -6.455 4.159 1.00 0.00 H new ATOM 961 N ASP A 90 10.350 -7.204 7.934 1.00 0.00 N ATOM 962 CA ASP A 90 11.339 -7.305 9.048 1.00 0.00 C ATOM 963 C ASP A 90 12.601 -6.510 8.690 1.00 0.00 C ATOM 964 O ASP A 90 13.470 -6.991 7.991 1.00 0.00 O ATOM 965 CB ASP A 90 11.703 -8.777 9.254 1.00 0.00 C ATOM 966 CG ASP A 90 12.693 -8.905 10.411 1.00 0.00 C ATOM 967 OD1 ASP A 90 13.134 -7.879 10.901 1.00 0.00 O ATOM 968 OD2 ASP A 90 12.994 -10.026 10.786 1.00 0.00 O ATOM 0 H ASP A 90 10.408 -7.948 7.239 1.00 0.00 H new ATOM 0 HA ASP A 90 10.908 -6.898 9.963 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.805 -9.358 9.465 1.00 0.00 H new ATOM 0 HB3 ASP A 90 12.139 -9.185 8.342 1.00 0.00 H new ATOM 973 N ASP A 91 12.709 -5.297 9.163 1.00 0.00 N ATOM 974 CA ASP A 91 13.914 -4.475 8.845 1.00 0.00 C ATOM 975 C ASP A 91 14.053 -3.347 9.870 1.00 0.00 C ATOM 976 O ASP A 91 13.189 -3.136 10.699 1.00 0.00 O ATOM 977 CB ASP A 91 13.768 -3.868 7.450 1.00 0.00 C ATOM 978 CG ASP A 91 13.914 -4.962 6.391 1.00 0.00 C ATOM 979 OD1 ASP A 91 14.839 -5.750 6.503 1.00 0.00 O ATOM 980 OD2 ASP A 91 13.098 -4.992 5.486 1.00 0.00 O ATOM 0 H ASP A 91 12.016 -4.840 9.755 1.00 0.00 H new ATOM 0 HA ASP A 91 14.799 -5.111 8.878 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.796 -3.384 7.354 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.524 -3.098 7.297 1.00 0.00 H new ATOM 985 N VAL A 92 15.131 -2.617 9.816 1.00 0.00 N ATOM 986 CA VAL A 92 15.322 -1.500 10.784 1.00 0.00 C ATOM 987 C VAL A 92 14.233 -0.446 10.568 1.00 0.00 C ATOM 988 O VAL A 92 13.692 0.103 11.508 1.00 0.00 O ATOM 989 CB VAL A 92 16.693 -0.858 10.558 1.00 0.00 C ATOM 990 CG1 VAL A 92 17.788 -1.907 10.748 1.00 0.00 C ATOM 991 CG2 VAL A 92 16.763 -0.301 9.134 1.00 0.00 C ATOM 0 H VAL A 92 15.888 -2.745 9.144 1.00 0.00 H new ATOM 0 HA VAL A 92 15.261 -1.888 11.801 1.00 0.00 H new ATOM 0 HB VAL A 92 16.838 -0.050 11.275 1.00 0.00 H new ATOM 0 HG11 VAL A 92 18.763 -1.448 10.587 1.00 0.00 H new ATOM 0 HG12 VAL A 92 17.738 -2.306 11.761 1.00 0.00 H new ATOM 0 HG13 VAL A 92 17.645 -2.716 10.032 1.00 0.00 H new ATOM 0 HG21 VAL A 92 17.738 0.157 8.970 1.00 0.00 H new ATOM 0 HG22 VAL A 92 16.617 -1.111 8.419 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.983 0.448 8.998 1.00 0.00 H new ATOM 1001 N THR A 93 13.919 -0.151 9.337 1.00 0.00 N ATOM 1002 CA THR A 93 12.877 0.878 9.051 1.00 0.00 C ATOM 1003 C THR A 93 11.480 0.278 9.224 1.00 0.00 C ATOM 1004 O THR A 93 11.324 -0.871 9.590 1.00 0.00 O ATOM 1005 CB THR A 93 13.044 1.382 7.615 1.00 0.00 C ATOM 1006 OG1 THR A 93 11.825 1.963 7.175 1.00 0.00 O ATOM 1007 CG2 THR A 93 13.418 0.213 6.699 1.00 0.00 C ATOM 0 H THR A 93 14.340 -0.579 8.513 1.00 0.00 H new ATOM 0 HA THR A 93 12.993 1.707 9.749 1.00 0.00 H new ATOM 0 HB THR A 93 13.836 2.130 7.582 1.00 0.00 H new ATOM 0 HG1 THR A 93 12.016 2.673 6.527 1.00 0.00 H new ATOM 0 HG21 THR A 93 13.536 0.575 5.678 1.00 0.00 H new ATOM 0 HG22 THR A 93 14.355 -0.230 7.038 1.00 0.00 H new ATOM 0 HG23 THR A 93 12.630 -0.539 6.729 1.00 0.00 H new ATOM 1015 N VAL A 94 10.462 1.061 8.967 1.00 0.00 N ATOM 1016 CA VAL A 94 9.061 0.568 9.111 1.00 0.00 C ATOM 1017 C VAL A 94 8.804 0.169 10.567 1.00 0.00 C ATOM 1018 O VAL A 94 9.070 -0.944 10.980 1.00 0.00 O ATOM 1019 CB VAL A 94 8.831 -0.634 8.188 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.329 -0.897 8.059 1.00 0.00 C ATOM 1021 CG2 VAL A 94 9.408 -0.330 6.802 1.00 0.00 C ATOM 0 H VAL A 94 10.545 2.030 8.661 1.00 0.00 H new ATOM 0 HA VAL A 94 8.370 1.363 8.830 1.00 0.00 H new ATOM 0 HB VAL A 94 9.323 -1.512 8.607 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.164 -1.752 7.403 1.00 0.00 H new ATOM 0 HG12 VAL A 94 6.911 -1.109 9.043 1.00 0.00 H new ATOM 0 HG13 VAL A 94 6.840 -0.018 7.639 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.245 -1.184 6.145 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.913 0.548 6.386 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.477 -0.137 6.887 1.00 0.00 H new ATOM 1031 N SER A 95 8.284 1.081 11.343 1.00 0.00 N ATOM 1032 CA SER A 95 7.993 0.795 12.779 1.00 0.00 C ATOM 1033 C SER A 95 6.945 -0.315 12.887 1.00 0.00 C ATOM 1034 O SER A 95 6.641 -0.990 11.925 1.00 0.00 O ATOM 1035 CB SER A 95 7.453 2.062 13.440 1.00 0.00 C ATOM 1036 OG SER A 95 8.439 3.084 13.372 1.00 0.00 O ATOM 0 H SER A 95 8.045 2.025 11.039 1.00 0.00 H new ATOM 0 HA SER A 95 8.908 0.474 13.277 1.00 0.00 H new ATOM 0 HB2 SER A 95 6.541 2.387 12.939 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.192 1.861 14.479 1.00 0.00 H new ATOM 0 HG SER A 95 8.095 3.899 13.794 1.00 0.00 H new ATOM 1042 N ARG A 96 6.398 -0.508 14.058 1.00 0.00 N ATOM 1043 CA ARG A 96 5.369 -1.573 14.251 1.00 0.00 C ATOM 1044 C ARG A 96 4.133 -1.261 13.403 1.00 0.00 C ATOM 1045 O ARG A 96 3.539 -2.139 12.809 1.00 0.00 O ATOM 1046 CB ARG A 96 4.969 -1.622 15.729 1.00 0.00 C ATOM 1047 CG ARG A 96 6.126 -2.193 16.551 1.00 0.00 C ATOM 1048 CD ARG A 96 5.742 -2.223 18.031 1.00 0.00 C ATOM 1049 NE ARG A 96 6.869 -2.795 18.823 1.00 0.00 N ATOM 1050 CZ ARG A 96 6.665 -3.200 20.047 1.00 0.00 C ATOM 1051 NH1 ARG A 96 5.477 -3.101 20.578 1.00 0.00 N ATOM 1052 NH2 ARG A 96 7.650 -3.706 20.740 1.00 0.00 N ATOM 0 H ARG A 96 6.621 0.030 14.895 1.00 0.00 H new ATOM 0 HA ARG A 96 5.781 -2.535 13.945 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.717 -0.622 16.082 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.079 -2.239 15.856 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.367 -3.199 16.208 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.020 -1.585 16.410 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.513 -1.216 18.379 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.842 -2.822 18.173 1.00 0.00 H new ATOM 0 HE ARG A 96 7.798 -2.870 18.409 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.708 -2.707 20.037 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.318 -3.418 21.534 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.578 -3.785 20.325 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.491 -4.023 21.696 1.00 0.00 H new ATOM 1066 N ARG A 97 3.742 -0.012 13.347 1.00 0.00 N ATOM 1067 CA ARG A 97 2.541 0.384 12.541 1.00 0.00 C ATOM 1068 C ARG A 97 2.889 1.601 11.681 1.00 0.00 C ATOM 1069 O ARG A 97 2.105 2.520 11.535 1.00 0.00 O ATOM 1070 CB ARG A 97 1.388 0.734 13.485 1.00 0.00 C ATOM 1071 CG ARG A 97 0.977 -0.518 14.263 1.00 0.00 C ATOM 1072 CD ARG A 97 -0.140 -0.175 15.251 1.00 0.00 C ATOM 1073 NE ARG A 97 -1.364 0.214 14.496 1.00 0.00 N ATOM 1074 CZ ARG A 97 -2.430 0.608 15.136 1.00 0.00 C ATOM 1075 NH1 ARG A 97 -2.432 0.651 16.441 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -3.497 0.954 14.470 1.00 0.00 N ATOM 0 H ARG A 97 4.206 0.758 13.829 1.00 0.00 H new ATOM 0 HA ARG A 97 2.242 -0.443 11.897 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.693 1.521 14.174 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.541 1.118 12.917 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.639 -1.291 13.573 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.836 -0.922 14.798 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -0.351 -1.032 15.891 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.173 0.640 15.903 1.00 0.00 H new ATOM 0 HE ARG A 97 -1.368 0.172 13.477 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -1.599 0.376 16.962 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -3.267 0.959 16.940 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -3.497 0.916 13.451 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -4.332 1.262 14.969 1.00 0.00 H new ATOM 1090 N HIS A 98 4.065 1.610 11.112 1.00 0.00 N ATOM 1091 CA HIS A 98 4.490 2.759 10.256 1.00 0.00 C ATOM 1092 C HIS A 98 3.347 3.170 9.325 1.00 0.00 C ATOM 1093 O HIS A 98 3.162 4.335 9.032 1.00 0.00 O ATOM 1094 CB HIS A 98 5.698 2.342 9.415 1.00 0.00 C ATOM 1095 CG HIS A 98 6.230 3.534 8.667 1.00 0.00 C ATOM 1096 ND1 HIS A 98 7.312 4.271 9.124 1.00 0.00 N ATOM 1097 CD2 HIS A 98 5.845 4.125 7.490 1.00 0.00 C ATOM 1098 CE1 HIS A 98 7.539 5.253 8.232 1.00 0.00 C ATOM 1099 NE2 HIS A 98 6.673 5.210 7.217 1.00 0.00 N ATOM 0 H HIS A 98 4.756 0.865 11.204 1.00 0.00 H new ATOM 0 HA HIS A 98 4.754 3.602 10.895 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.475 1.927 10.057 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.412 1.558 8.714 1.00 0.00 H new ATOM 0 HD2 HIS A 98 5.024 3.798 6.869 1.00 0.00 H new ATOM 0 HE1 HIS A 98 8.326 5.987 8.326 1.00 0.00 H new ATOM 0 HE2 HIS A 98 6.628 5.837 6.414 1.00 0.00 H new ATOM 1107 N ALA A 99 2.581 2.224 8.853 1.00 0.00 N ATOM 1108 CA ALA A 99 1.452 2.561 7.935 1.00 0.00 C ATOM 1109 C ALA A 99 0.301 1.579 8.165 1.00 0.00 C ATOM 1110 O ALA A 99 0.501 0.452 8.580 1.00 0.00 O ATOM 1111 CB ALA A 99 1.928 2.458 6.485 1.00 0.00 C ATOM 0 H ALA A 99 2.687 1.231 9.063 1.00 0.00 H new ATOM 0 HA ALA A 99 1.110 3.577 8.134 1.00 0.00 H new ATOM 0 HB1 ALA A 99 1.105 2.704 5.814 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.750 3.155 6.322 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.268 1.442 6.285 1.00 0.00 H new ATOM 1117 N GLU A 100 -0.905 2.004 7.899 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.089 1.114 8.096 1.00 0.00 C ATOM 1119 C GLU A 100 -3.066 1.320 6.938 1.00 0.00 C ATOM 1120 O GLU A 100 -3.158 2.394 6.378 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.777 1.477 9.413 1.00 0.00 C ATOM 1122 CG GLU A 100 -3.954 0.531 9.653 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.577 0.833 11.017 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.251 1.865 11.580 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.368 0.026 11.477 1.00 0.00 O ATOM 0 H GLU A 100 -1.124 2.937 7.551 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.770 0.072 8.126 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.067 1.407 10.237 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.127 2.509 9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.698 0.652 8.866 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.616 -0.505 9.616 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.796 0.296 6.576 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.779 0.409 5.450 1.00 0.00 C ATOM 1134 C PHE A 101 -6.190 0.194 5.996 1.00 0.00 C ATOM 1135 O PHE A 101 -6.413 -0.648 6.843 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.472 -0.667 4.407 1.00 0.00 C ATOM 1137 CG PHE A 101 -3.126 -0.388 3.786 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -3.014 0.538 2.743 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.988 -1.054 4.257 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.764 0.799 2.170 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.739 -0.793 3.684 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.627 0.133 2.641 1.00 0.00 C ATOM 0 H PHE A 101 -3.754 -0.624 7.015 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.707 1.396 4.992 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.473 -1.652 4.873 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.245 -0.676 3.639 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.892 1.051 2.380 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -2.075 -1.769 5.062 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.677 1.514 1.365 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.139 -1.306 4.047 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.338 0.334 2.199 1.00 0.00 H new ATOM 1152 N ARG A 102 -7.146 0.946 5.515 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.559 0.796 5.994 1.00 0.00 C ATOM 1154 C ARG A 102 -9.489 0.708 4.785 1.00 0.00 C ATOM 1155 O ARG A 102 -9.345 1.434 3.822 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.942 2.008 6.846 1.00 0.00 C ATOM 1157 CG ARG A 102 -10.359 1.823 7.390 1.00 0.00 C ATOM 1158 CD ARG A 102 -10.721 3.009 8.284 1.00 0.00 C ATOM 1159 NE ARG A 102 -12.031 2.742 8.948 1.00 0.00 N ATOM 1160 CZ ARG A 102 -13.151 3.062 8.356 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -13.137 3.620 7.175 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -14.289 2.817 8.946 1.00 0.00 N ATOM 0 H ARG A 102 -7.010 1.665 4.804 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.649 -0.109 6.595 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.237 2.124 7.669 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -8.887 2.918 6.248 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.069 1.745 6.566 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.424 0.894 7.956 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -9.945 3.165 9.033 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -10.780 3.922 7.691 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.052 2.307 9.870 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -12.249 3.808 6.710 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.014 3.868 6.718 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.302 2.377 9.866 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -15.165 3.065 8.487 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.441 -0.184 4.824 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.385 -0.334 3.676 1.00 0.00 C ATOM 1178 C LEU A 103 -12.658 0.473 3.943 1.00 0.00 C ATOM 1179 O LEU A 103 -13.292 0.329 4.970 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.741 -1.817 3.522 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.808 -2.007 2.436 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -12.344 -1.374 1.119 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -13.037 -3.505 2.230 1.00 0.00 C ATOM 0 H LEU A 103 -10.608 -0.819 5.605 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.917 0.034 2.763 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.848 -2.386 3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.107 -2.209 4.471 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.734 -1.524 2.748 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.110 -1.516 0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -12.174 -0.308 1.268 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -11.417 -1.848 0.794 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.794 -3.655 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -12.105 -3.976 1.919 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.376 -3.953 3.164 1.00 0.00 H new ATOM 1195 N GLU A 104 -13.047 1.314 3.018 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.292 2.124 3.203 1.00 0.00 C ATOM 1197 C GLU A 104 -15.019 2.239 1.863 1.00 0.00 C ATOM 1198 O GLU A 104 -14.404 2.311 0.817 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.938 3.524 3.716 1.00 0.00 C ATOM 1200 CG GLU A 104 -15.224 4.329 3.929 1.00 0.00 C ATOM 1201 CD GLU A 104 -14.878 5.700 4.508 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -14.204 5.739 5.523 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -15.298 6.688 3.928 1.00 0.00 O ATOM 0 H GLU A 104 -12.555 1.476 2.139 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.936 1.633 3.933 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.383 3.451 4.651 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.292 4.033 3.001 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -15.754 4.445 2.983 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.892 3.795 4.605 1.00 0.00 H new ATOM 1210 N ASN A 105 -16.326 2.251 1.889 1.00 0.00 N ATOM 1211 CA ASN A 105 -17.110 2.359 0.622 1.00 0.00 C ATOM 1212 C ASN A 105 -16.528 1.405 -0.424 1.00 0.00 C ATOM 1213 O ASN A 105 -16.411 1.737 -1.588 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.082 3.807 0.106 1.00 0.00 C ATOM 1215 CG ASN A 105 -15.694 4.162 -0.431 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -15.362 3.845 -1.557 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -14.860 4.815 0.334 1.00 0.00 N ATOM 0 H ASN A 105 -16.888 2.190 2.738 1.00 0.00 H new ATOM 0 HA ASN A 105 -18.147 2.082 0.814 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -17.825 3.932 -0.681 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -17.352 4.491 0.911 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.932 5.058 -0.014 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -15.137 5.082 1.279 1.00 0.00 H new ATOM 1224 N ASN A 106 -16.169 0.216 -0.012 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.598 -0.780 -0.966 1.00 0.00 C ATOM 1226 C ASN A 106 -14.364 -0.195 -1.657 1.00 0.00 C ATOM 1227 O ASN A 106 -14.092 -0.483 -2.806 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.645 -1.145 -2.022 1.00 0.00 C ATOM 1229 CG ASN A 106 -17.946 -1.551 -1.330 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -19.024 -1.273 -1.819 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -17.892 -2.204 -0.202 1.00 0.00 N ATOM 0 H ASN A 106 -16.248 -0.109 0.952 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.311 -1.674 -0.413 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.822 -0.297 -2.683 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.281 -1.963 -2.644 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.753 -2.481 0.269 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.988 -2.438 0.209 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.608 0.617 -0.963 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.378 1.218 -1.574 1.00 0.00 C ATOM 1240 C GLU A 107 -11.243 1.199 -0.547 1.00 0.00 C ATOM 1241 O GLU A 107 -11.399 1.616 0.583 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.674 2.660 -2.003 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.644 2.654 -3.191 1.00 0.00 C ATOM 1244 CD GLU A 107 -12.968 2.020 -4.410 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -11.880 2.454 -4.753 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -13.548 1.108 -4.977 1.00 0.00 O ATOM 0 H GLU A 107 -13.788 0.892 0.003 1.00 0.00 H new ATOM 0 HA GLU A 107 -12.080 0.640 -2.449 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -13.105 3.216 -1.171 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -11.748 3.165 -2.279 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -14.545 2.098 -2.933 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -13.954 3.673 -3.424 1.00 0.00 H new ATOM 1253 N PHE A 108 -10.103 0.706 -0.938 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.946 0.632 -0.001 1.00 0.00 C ATOM 1255 C PHE A 108 -8.398 2.036 0.264 1.00 0.00 C ATOM 1256 O PHE A 108 -8.449 2.902 -0.586 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.855 -0.229 -0.636 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.286 -1.674 -0.628 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -7.987 -2.483 0.472 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.978 -2.207 -1.723 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.378 -3.825 0.481 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -9.371 -3.551 -1.714 1.00 0.00 C ATOM 1263 CZ PHE A 108 -9.070 -4.360 -0.612 1.00 0.00 C ATOM 0 H PHE A 108 -9.920 0.347 -1.875 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.267 0.194 0.944 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.666 0.100 -1.658 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.921 -0.114 -0.087 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.453 -2.071 1.316 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.208 -1.582 -2.573 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.146 -4.449 1.331 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.906 -3.963 -2.557 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.372 -5.397 -0.605 1.00 0.00 H new ATOM 1273 N ASN A 109 -7.877 2.268 1.442 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.326 3.620 1.776 1.00 0.00 C ATOM 1275 C ASN A 109 -6.035 3.461 2.580 1.00 0.00 C ATOM 1276 O ASN A 109 -5.727 2.393 3.066 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.342 4.387 2.621 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.637 4.556 1.830 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.617 4.955 0.684 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -10.774 4.266 2.399 1.00 0.00 N ATOM 0 H ASN A 109 -7.809 1.578 2.190 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.123 4.164 0.854 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.538 3.851 3.549 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -7.941 5.363 2.895 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.646 4.375 1.881 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -10.791 3.931 3.362 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.282 4.521 2.726 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.005 4.450 3.505 1.00 0.00 C ATOM 1289 C VAL A 110 -4.054 5.494 4.621 1.00 0.00 C ATOM 1290 O VAL A 110 -4.377 6.643 4.383 1.00 0.00 O ATOM 1291 CB VAL A 110 -2.827 4.747 2.566 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -2.871 6.209 2.108 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.507 4.477 3.293 1.00 0.00 C ATOM 0 H VAL A 110 -5.497 5.439 2.337 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.879 3.457 3.937 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.901 4.099 1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.031 6.407 1.443 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.805 6.396 1.578 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.809 6.864 2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.673 4.689 2.624 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.438 5.117 4.172 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.469 3.432 3.601 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.737 5.105 5.837 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.761 6.077 6.983 1.00 0.00 C ATOM 1305 C VAL A 111 -2.383 6.095 7.653 1.00 0.00 C ATOM 1306 O VAL A 111 -1.719 5.085 7.800 1.00 0.00 O ATOM 1307 CB VAL A 111 -4.879 5.706 7.964 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.762 6.562 9.228 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.222 5.992 7.280 1.00 0.00 C ATOM 0 H VAL A 111 -3.462 4.155 6.086 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.974 7.083 6.622 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.805 4.654 8.241 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.558 6.295 9.923 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.795 6.385 9.699 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.849 7.616 8.963 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.037 5.736 7.957 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.282 7.050 7.023 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.303 5.393 6.373 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.931 7.281 7.963 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.563 7.489 8.530 1.00 0.00 C ATOM 1321 C ASP A 112 -0.595 7.719 10.055 1.00 0.00 C ATOM 1322 O ASP A 112 -1.057 8.739 10.525 1.00 0.00 O ATOM 1323 CB ASP A 112 -0.015 8.734 7.813 1.00 0.00 C ATOM 1324 CG ASP A 112 1.395 9.088 8.282 1.00 0.00 C ATOM 1325 OD1 ASP A 112 1.868 8.468 9.218 1.00 0.00 O ATOM 1326 OD2 ASP A 112 1.977 9.983 7.690 1.00 0.00 O ATOM 0 H ASP A 112 -2.468 8.140 7.844 1.00 0.00 H new ATOM 0 HA ASP A 112 0.060 6.608 8.376 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.006 8.559 6.737 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.680 9.579 7.993 1.00 0.00 H new ATOM 1331 N VAL A 113 -0.063 6.797 10.833 1.00 0.00 N ATOM 1332 CA VAL A 113 -0.024 7.001 12.322 1.00 0.00 C ATOM 1333 C VAL A 113 1.348 7.571 12.692 1.00 0.00 C ATOM 1334 O VAL A 113 1.644 7.807 13.849 1.00 0.00 O ATOM 1335 CB VAL A 113 -0.214 5.672 13.072 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -1.572 5.061 12.728 1.00 0.00 C ATOM 1337 CG2 VAL A 113 0.899 4.696 12.688 1.00 0.00 C ATOM 0 H VAL A 113 0.342 5.921 10.504 1.00 0.00 H new ATOM 0 HA VAL A 113 -0.830 7.679 12.604 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.173 5.865 14.144 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -1.694 4.121 13.265 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.365 5.750 13.018 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.626 4.876 11.655 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.759 3.756 13.222 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.866 4.511 11.614 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.866 5.124 12.953 1.00 0.00 H new ATOM 1405 N THR A 119 4.515 8.033 6.331 1.00 0.00 N ATOM 1406 CA THR A 119 4.011 7.504 5.031 1.00 0.00 C ATOM 1407 C THR A 119 3.414 8.639 4.192 1.00 0.00 C ATOM 1408 O THR A 119 2.706 9.491 4.692 1.00 0.00 O ATOM 1409 CB THR A 119 2.931 6.454 5.300 1.00 0.00 C ATOM 1410 OG1 THR A 119 3.421 5.498 6.229 1.00 0.00 O ATOM 1411 CG2 THR A 119 2.558 5.756 3.992 1.00 0.00 C ATOM 0 HA THR A 119 4.840 7.056 4.483 1.00 0.00 H new ATOM 0 HB THR A 119 2.047 6.940 5.713 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.988 5.946 6.891 1.00 0.00 H new ATOM 0 HG21 THR A 119 1.789 5.008 4.185 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.179 6.491 3.282 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.440 5.270 3.575 1.00 0.00 H new ATOM 1419 N TYR A 120 3.688 8.646 2.912 1.00 0.00 N ATOM 1420 CA TYR A 120 3.137 9.711 2.015 1.00 0.00 C ATOM 1421 C TYR A 120 2.744 9.077 0.677 1.00 0.00 C ATOM 1422 O TYR A 120 3.185 7.994 0.348 1.00 0.00 O ATOM 1423 CB TYR A 120 4.198 10.787 1.774 1.00 0.00 C ATOM 1424 CG TYR A 120 5.456 10.152 1.228 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.552 9.839 -0.134 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.534 9.890 2.083 1.00 0.00 C ATOM 1427 CE1 TYR A 120 6.723 9.262 -0.639 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.704 9.311 1.578 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.799 8.999 0.217 1.00 0.00 C ATOM 1430 OH TYR A 120 8.956 8.435 -0.281 1.00 0.00 O ATOM 0 H TYR A 120 4.274 7.954 2.445 1.00 0.00 H new ATOM 0 HA TYR A 120 2.265 10.168 2.483 1.00 0.00 H new ATOM 0 HB2 TYR A 120 3.821 11.531 1.072 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.418 11.309 2.705 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.722 10.043 -0.795 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.462 10.135 3.132 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.796 9.020 -1.689 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.533 9.105 2.238 1.00 0.00 H new ATOM 0 HH TYR A 120 9.603 8.320 0.446 1.00 0.00 H new ATOM 1440 N VAL A 121 1.916 9.740 -0.095 1.00 0.00 N ATOM 1441 CA VAL A 121 1.481 9.178 -1.418 1.00 0.00 C ATOM 1442 C VAL A 121 1.845 10.166 -2.534 1.00 0.00 C ATOM 1443 O VAL A 121 1.639 11.357 -2.410 1.00 0.00 O ATOM 1444 CB VAL A 121 -0.037 8.938 -1.391 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.786 10.272 -1.462 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.432 8.066 -2.585 1.00 0.00 C ATOM 0 H VAL A 121 1.520 10.651 0.134 1.00 0.00 H new ATOM 0 HA VAL A 121 1.987 8.231 -1.606 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.302 8.434 -0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.860 10.088 -1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.508 10.891 -0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.524 10.788 -2.386 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.508 7.893 -2.569 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.159 8.572 -3.511 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.089 7.111 -2.526 1.00 0.00 H new ATOM 1456 N ASN A 122 2.399 9.674 -3.615 1.00 0.00 N ATOM 1457 CA ASN A 122 2.794 10.570 -4.744 1.00 0.00 C ATOM 1458 C ASN A 122 3.760 11.642 -4.233 1.00 0.00 C ATOM 1459 O ASN A 122 3.736 12.780 -4.666 1.00 0.00 O ATOM 1460 CB ASN A 122 1.551 11.222 -5.361 1.00 0.00 C ATOM 1461 CG ASN A 122 0.761 10.156 -6.125 1.00 0.00 C ATOM 1462 OD1 ASN A 122 1.290 9.113 -6.451 1.00 0.00 O ATOM 1463 ND2 ASN A 122 -0.491 10.371 -6.427 1.00 0.00 N ATOM 0 H ASN A 122 2.595 8.684 -3.764 1.00 0.00 H new ATOM 0 HA ASN A 122 3.292 9.980 -5.514 1.00 0.00 H new ATOM 0 HB2 ASN A 122 0.931 11.665 -4.581 1.00 0.00 H new ATOM 0 HB3 ASN A 122 1.843 12.029 -6.033 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -1.022 9.664 -6.935 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.938 11.246 -6.155 1.00 0.00 H new ATOM 1470 N ARG A 123 4.617 11.276 -3.316 1.00 0.00 N ATOM 1471 CA ARG A 123 5.603 12.247 -2.760 1.00 0.00 C ATOM 1472 C ARG A 123 4.859 13.436 -2.144 1.00 0.00 C ATOM 1473 O ARG A 123 5.204 14.581 -2.358 1.00 0.00 O ATOM 1474 CB ARG A 123 6.527 12.733 -3.880 1.00 0.00 C ATOM 1475 CG ARG A 123 7.763 13.411 -3.277 1.00 0.00 C ATOM 1476 CD ARG A 123 8.733 13.781 -4.396 1.00 0.00 C ATOM 1477 NE ARG A 123 8.131 14.844 -5.247 1.00 0.00 N ATOM 1478 CZ ARG A 123 8.738 15.229 -6.336 1.00 0.00 C ATOM 1479 NH1 ARG A 123 9.870 14.680 -6.683 1.00 0.00 N ATOM 1480 NH2 ARG A 123 8.211 16.164 -7.079 1.00 0.00 N ATOM 0 H ARG A 123 4.676 10.336 -2.925 1.00 0.00 H new ATOM 0 HA ARG A 123 6.200 11.761 -1.988 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.830 11.892 -4.504 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.995 13.433 -4.525 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.469 14.304 -2.725 1.00 0.00 H new ATOM 0 HG3 ARG A 123 8.248 12.742 -2.566 1.00 0.00 H new ATOM 0 HD2 ARG A 123 9.676 14.129 -3.974 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.960 12.902 -5.000 1.00 0.00 H new ATOM 0 HE ARG A 123 7.244 15.271 -4.979 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.281 13.949 -6.103 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.343 14.982 -7.535 1.00 0.00 H new ATOM 0 HH21 ARG A 123 7.326 16.593 -6.808 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.684 16.466 -7.931 1.00 0.00 H new ATOM 1494 N GLU A 124 3.836 13.174 -1.374 1.00 0.00 N ATOM 1495 CA GLU A 124 3.068 14.286 -0.732 1.00 0.00 C ATOM 1496 C GLU A 124 2.604 13.824 0.664 1.00 0.00 C ATOM 1497 O GLU A 124 1.886 12.849 0.771 1.00 0.00 O ATOM 1498 CB GLU A 124 1.851 14.629 -1.602 1.00 0.00 C ATOM 1499 CG GLU A 124 2.325 15.338 -2.875 1.00 0.00 C ATOM 1500 CD GLU A 124 1.118 15.837 -3.672 1.00 0.00 C ATOM 1501 OE1 GLU A 124 0.005 15.592 -3.239 1.00 0.00 O ATOM 1502 OE2 GLU A 124 1.329 16.457 -4.703 1.00 0.00 O ATOM 0 H GLU A 124 3.497 12.236 -1.160 1.00 0.00 H new ATOM 0 HA GLU A 124 3.696 15.172 -0.634 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.305 13.721 -1.859 1.00 0.00 H new ATOM 0 HB3 GLU A 124 1.163 15.269 -1.050 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.972 16.176 -2.616 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.917 14.654 -3.484 1.00 0.00 H new ATOM 1509 N PRO A 125 3.001 14.491 1.735 1.00 0.00 N ATOM 1510 CA PRO A 125 2.593 14.075 3.110 1.00 0.00 C ATOM 1511 C PRO A 125 1.142 14.474 3.419 1.00 0.00 C ATOM 1512 O PRO A 125 0.810 15.641 3.461 1.00 0.00 O ATOM 1513 CB PRO A 125 3.576 14.826 4.021 1.00 0.00 C ATOM 1514 CG PRO A 125 3.968 16.053 3.253 1.00 0.00 C ATOM 1515 CD PRO A 125 3.869 15.691 1.765 1.00 0.00 C ATOM 0 HA PRO A 125 2.626 12.994 3.243 1.00 0.00 H new ATOM 0 HB2 PRO A 125 3.110 15.089 4.971 1.00 0.00 H new ATOM 0 HB3 PRO A 125 4.446 14.212 4.252 1.00 0.00 H new ATOM 0 HG2 PRO A 125 3.309 16.887 3.493 1.00 0.00 H new ATOM 0 HG3 PRO A 125 4.981 16.363 3.509 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.438 16.507 1.185 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.851 15.482 1.341 1.00 0.00 H new ATOM 1523 N VAL A 126 0.276 13.510 3.630 1.00 0.00 N ATOM 1524 CA VAL A 126 -1.159 13.829 3.932 1.00 0.00 C ATOM 1525 C VAL A 126 -1.662 12.944 5.075 1.00 0.00 C ATOM 1526 O VAL A 126 -1.119 11.891 5.350 1.00 0.00 O ATOM 1527 CB VAL A 126 -2.007 13.566 2.688 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -1.528 14.465 1.549 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -1.864 12.099 2.275 1.00 0.00 C ATOM 0 H VAL A 126 0.500 12.515 3.606 1.00 0.00 H new ATOM 0 HA VAL A 126 -1.238 14.876 4.224 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.053 13.781 2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.131 14.279 0.660 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.628 15.510 1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -0.483 14.248 1.329 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.468 11.910 1.388 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -0.819 11.883 2.054 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -2.203 11.457 3.088 1.00 0.00 H new ATOM 1539 N ASP A 127 -2.705 13.364 5.736 1.00 0.00 N ATOM 1540 CA ASP A 127 -3.259 12.555 6.857 1.00 0.00 C ATOM 1541 C ASP A 127 -3.760 11.212 6.322 1.00 0.00 C ATOM 1542 O ASP A 127 -3.556 10.177 6.925 1.00 0.00 O ATOM 1543 CB ASP A 127 -4.421 13.314 7.500 1.00 0.00 C ATOM 1544 CG ASP A 127 -3.877 14.501 8.298 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -2.688 14.510 8.573 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -4.658 15.380 8.621 1.00 0.00 O ATOM 0 H ASP A 127 -3.199 14.236 5.547 1.00 0.00 H new ATOM 0 HA ASP A 127 -2.481 12.379 7.599 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -5.110 13.664 6.731 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.985 12.650 8.155 1.00 0.00 H new ATOM 1551 N SER A 128 -4.419 11.222 5.195 1.00 0.00 N ATOM 1552 CA SER A 128 -4.939 9.947 4.619 1.00 0.00 C ATOM 1553 C SER A 128 -5.275 10.165 3.143 1.00 0.00 C ATOM 1554 O SER A 128 -5.499 11.277 2.708 1.00 0.00 O ATOM 1555 CB SER A 128 -6.199 9.527 5.374 1.00 0.00 C ATOM 1556 OG SER A 128 -6.721 8.340 4.793 1.00 0.00 O ATOM 0 H SER A 128 -4.620 12.059 4.647 1.00 0.00 H new ATOM 0 HA SER A 128 -4.185 9.165 4.711 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.968 9.359 6.426 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.943 10.323 5.334 1.00 0.00 H new ATOM 0 HG SER A 128 -5.989 7.711 4.621 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.313 9.118 2.364 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.635 9.282 0.911 1.00 0.00 C ATOM 1564 C ALA A 129 -6.330 8.022 0.391 1.00 0.00 C ATOM 1565 O ALA A 129 -6.186 6.949 0.941 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.344 9.517 0.125 1.00 0.00 C ATOM 0 H ALA A 129 -5.137 8.160 2.666 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.299 10.137 0.783 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.579 9.636 -0.933 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -3.854 10.419 0.492 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.678 8.664 0.255 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.092 8.146 -0.664 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.809 6.960 -1.221 1.00 0.00 C ATOM 1574 C VAL A 130 -6.932 6.281 -2.277 1.00 0.00 C ATOM 1575 O VAL A 130 -6.417 6.917 -3.174 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.121 7.424 -1.853 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.792 6.254 -2.575 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.048 7.948 -0.754 1.00 0.00 C ATOM 0 H VAL A 130 -7.249 9.020 -1.166 1.00 0.00 H new ATOM 0 HA VAL A 130 -8.021 6.246 -0.425 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.918 8.217 -2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.727 6.591 -3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.129 5.880 -3.355 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -9.999 5.456 -1.861 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -10.986 8.281 -1.198 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.248 7.152 -0.037 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.571 8.785 -0.244 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.755 4.992 -2.170 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.905 4.263 -3.157 1.00 0.00 C ATOM 1590 C LEU A 131 -6.704 3.980 -4.432 1.00 0.00 C ATOM 1591 O LEU A 131 -7.915 3.875 -4.411 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.442 2.943 -2.539 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.628 3.221 -1.269 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.244 1.890 -0.621 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.354 4.017 -1.616 1.00 0.00 C ATOM 0 H LEU A 131 -7.164 4.410 -1.439 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.041 4.876 -3.412 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.304 2.320 -2.300 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.837 2.388 -3.256 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.230 3.810 -0.577 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.665 2.079 0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.147 1.336 -0.364 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.646 1.305 -1.319 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.785 4.208 -0.706 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.743 3.441 -2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.632 4.965 -2.076 1.00 0.00 H new ATOM 1607 N ALA A 132 -6.028 3.855 -5.545 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.730 3.578 -6.836 1.00 0.00 C ATOM 1609 C ALA A 132 -5.798 2.776 -7.753 1.00 0.00 C ATOM 1610 O ALA A 132 -4.592 2.805 -7.612 1.00 0.00 O ATOM 1611 CB ALA A 132 -7.112 4.899 -7.506 1.00 0.00 C ATOM 0 H ALA A 132 -5.014 3.933 -5.616 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.636 3.002 -6.647 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.623 4.695 -8.447 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.773 5.463 -6.848 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -6.212 5.482 -7.701 1.00 0.00 H new ATOM 1617 N ASN A 133 -6.355 2.047 -8.679 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.519 1.219 -9.596 1.00 0.00 C ATOM 1619 C ASN A 133 -4.465 2.082 -10.297 1.00 0.00 C ATOM 1620 O ASN A 133 -4.753 3.150 -10.802 1.00 0.00 O ATOM 1621 CB ASN A 133 -6.433 0.577 -10.641 1.00 0.00 C ATOM 1622 CG ASN A 133 -5.697 -0.562 -11.341 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -4.917 -1.265 -10.730 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -5.917 -0.776 -12.608 1.00 0.00 N ATOM 0 H ASN A 133 -7.360 1.988 -8.842 1.00 0.00 H new ATOM 0 HA ASN A 133 -5.003 0.452 -9.018 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -7.337 0.199 -10.164 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.746 1.323 -11.371 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -5.434 -1.535 -13.088 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -6.572 -0.184 -13.119 1.00 0.00 H new ATOM 1631 N GLY A 134 -3.240 1.616 -10.338 1.00 0.00 N ATOM 1632 CA GLY A 134 -2.155 2.395 -11.011 1.00 0.00 C ATOM 1633 C GLY A 134 -1.556 3.403 -10.033 1.00 0.00 C ATOM 1634 O GLY A 134 -0.854 4.315 -10.421 1.00 0.00 O ATOM 0 H GLY A 134 -2.945 0.728 -9.933 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.379 1.719 -11.371 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.555 2.914 -11.882 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.826 3.251 -8.763 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.270 4.209 -7.758 1.00 0.00 C ATOM 1640 C ASP A 135 0.067 3.687 -7.233 1.00 0.00 C ATOM 1641 O ASP A 135 0.312 2.496 -7.208 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.259 4.369 -6.599 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.420 5.271 -7.031 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.357 5.805 -8.126 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -4.352 5.412 -6.260 1.00 0.00 O ATOM 0 H ASP A 135 -2.407 2.506 -8.377 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.113 5.178 -8.231 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.638 3.393 -6.294 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.754 4.799 -5.734 1.00 0.00 H new ATOM 1650 N GLU A 136 0.934 4.576 -6.811 1.00 0.00 N ATOM 1651 CA GLU A 136 2.269 4.157 -6.277 1.00 0.00 C ATOM 1652 C GLU A 136 2.347 4.501 -4.787 1.00 0.00 C ATOM 1653 O GLU A 136 2.041 5.605 -4.381 1.00 0.00 O ATOM 1654 CB GLU A 136 3.378 4.901 -7.023 1.00 0.00 C ATOM 1655 CG GLU A 136 4.743 4.429 -6.516 1.00 0.00 C ATOM 1656 CD GLU A 136 5.846 5.110 -7.326 1.00 0.00 C ATOM 1657 OE1 GLU A 136 5.533 5.658 -8.370 1.00 0.00 O ATOM 1658 OE2 GLU A 136 6.985 5.072 -6.890 1.00 0.00 O ATOM 0 H GLU A 136 0.772 5.583 -6.814 1.00 0.00 H new ATOM 0 HA GLU A 136 2.394 3.083 -6.417 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.294 4.720 -8.095 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.274 5.976 -6.872 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.853 4.667 -5.458 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.824 3.346 -6.609 1.00 0.00 H new ATOM 1665 N VAL A 137 2.760 3.561 -3.973 1.00 0.00 N ATOM 1666 CA VAL A 137 2.873 3.808 -2.497 1.00 0.00 C ATOM 1667 C VAL A 137 4.316 3.539 -2.067 1.00 0.00 C ATOM 1668 O VAL A 137 4.896 2.533 -2.422 1.00 0.00 O ATOM 1669 CB VAL A 137 1.932 2.856 -1.744 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.218 2.916 -0.238 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.482 3.271 -2.005 1.00 0.00 C ATOM 0 H VAL A 137 3.027 2.622 -4.269 1.00 0.00 H new ATOM 0 HA VAL A 137 2.599 4.838 -2.270 1.00 0.00 H new ATOM 0 HB VAL A 137 2.094 1.837 -2.096 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.546 2.238 0.287 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.250 2.620 -0.052 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.061 3.933 0.122 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.190 2.598 -1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.327 4.291 -1.655 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.276 3.219 -3.074 1.00 0.00 H new ATOM 1681 N GLN A 138 4.899 4.432 -1.308 1.00 0.00 N ATOM 1682 CA GLN A 138 6.312 4.239 -0.847 1.00 0.00 C ATOM 1683 C GLN A 138 6.347 4.222 0.681 1.00 0.00 C ATOM 1684 O GLN A 138 5.957 5.173 1.327 1.00 0.00 O ATOM 1685 CB GLN A 138 7.171 5.396 -1.354 1.00 0.00 C ATOM 1686 CG GLN A 138 8.613 5.189 -0.895 1.00 0.00 C ATOM 1687 CD GLN A 138 9.519 6.214 -1.575 1.00 0.00 C ATOM 1688 OE1 GLN A 138 9.147 6.809 -2.567 1.00 0.00 O ATOM 1689 NE2 GLN A 138 10.703 6.447 -1.081 1.00 0.00 N ATOM 0 H GLN A 138 4.456 5.292 -0.985 1.00 0.00 H new ATOM 0 HA GLN A 138 6.697 3.296 -1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.127 5.448 -2.442 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.788 6.343 -0.974 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.679 5.292 0.188 1.00 0.00 H new ATOM 0 HG3 GLN A 138 8.942 4.179 -1.140 1.00 0.00 H new ATOM 0 HE21 GLN A 138 11.015 5.948 -0.248 1.00 0.00 H new ATOM 0 HE22 GLN A 138 11.317 7.129 -1.527 1.00 0.00 H new ATOM 1698 N ILE A 139 6.816 3.144 1.261 1.00 0.00 N ATOM 1699 CA ILE A 139 6.888 3.044 2.756 1.00 0.00 C ATOM 1700 C ILE A 139 8.337 2.807 3.192 1.00 0.00 C ATOM 1701 O ILE A 139 9.002 1.908 2.718 1.00 0.00 O ATOM 1702 CB ILE A 139 6.021 1.872 3.230 1.00 0.00 C ATOM 1703 CG1 ILE A 139 4.547 2.185 2.955 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.229 1.645 4.731 1.00 0.00 C ATOM 1705 CD1 ILE A 139 3.703 0.930 3.186 1.00 0.00 C ATOM 0 H ILE A 139 7.155 2.322 0.761 1.00 0.00 H new ATOM 0 HA ILE A 139 6.526 3.973 3.195 1.00 0.00 H new ATOM 0 HB ILE A 139 6.308 0.970 2.690 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.208 2.989 3.608 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.424 2.534 1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.610 0.811 5.062 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.278 1.417 4.923 1.00 0.00 H new ATOM 0 HG23 ILE A 139 5.947 2.545 5.278 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.655 1.155 2.990 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.036 0.139 2.514 1.00 0.00 H new ATOM 0 HD13 ILE A 139 3.816 0.601 4.219 1.00 0.00 H new ATOM 1717 N GLY A 140 8.823 3.599 4.109 1.00 0.00 N ATOM 1718 CA GLY A 140 10.218 3.412 4.596 1.00 0.00 C ATOM 1719 C GLY A 140 11.194 3.402 3.422 1.00 0.00 C ATOM 1720 O GLY A 140 11.199 4.289 2.591 1.00 0.00 O ATOM 0 H GLY A 140 8.313 4.369 4.542 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.479 4.213 5.288 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.295 2.476 5.149 1.00 0.00 H new ATOM 1724 N LYS A 141 12.033 2.403 3.361 1.00 0.00 N ATOM 1725 CA LYS A 141 13.038 2.310 2.259 1.00 0.00 C ATOM 1726 C LYS A 141 12.524 1.348 1.186 1.00 0.00 C ATOM 1727 O LYS A 141 13.159 1.130 0.174 1.00 0.00 O ATOM 1728 CB LYS A 141 14.350 1.768 2.833 1.00 0.00 C ATOM 1729 CG LYS A 141 14.817 2.643 4.006 1.00 0.00 C ATOM 1730 CD LYS A 141 15.141 4.060 3.518 1.00 0.00 C ATOM 1731 CE LYS A 141 15.973 4.790 4.575 1.00 0.00 C ATOM 1732 NZ LYS A 141 16.318 6.151 4.077 1.00 0.00 N ATOM 0 H LYS A 141 12.066 1.638 4.035 1.00 0.00 H new ATOM 0 HA LYS A 141 13.200 3.294 1.820 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.211 0.740 3.169 1.00 0.00 H new ATOM 0 HB3 LYS A 141 15.115 1.749 2.057 1.00 0.00 H new ATOM 0 HG2 LYS A 141 14.041 2.683 4.770 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.699 2.201 4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 141 15.689 4.015 2.577 1.00 0.00 H new ATOM 0 HD3 LYS A 141 14.219 4.608 3.324 1.00 0.00 H new ATOM 0 HE2 LYS A 141 15.414 4.863 5.508 1.00 0.00 H new ATOM 0 HE3 LYS A 141 16.882 4.228 4.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 16.884 6.650 4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 16.867 6.070 3.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 15.445 6.685 3.892 1.00 0.00 H new ATOM 1746 N PHE A 142 11.373 0.773 1.405 1.00 0.00 N ATOM 1747 CA PHE A 142 10.795 -0.180 0.410 1.00 0.00 C ATOM 1748 C PHE A 142 9.791 0.561 -0.474 1.00 0.00 C ATOM 1749 O PHE A 142 9.096 1.450 -0.025 1.00 0.00 O ATOM 1750 CB PHE A 142 10.083 -1.310 1.156 1.00 0.00 C ATOM 1751 CG PHE A 142 11.111 -2.241 1.750 1.00 0.00 C ATOM 1752 CD1 PHE A 142 11.660 -1.971 3.010 1.00 0.00 C ATOM 1753 CD2 PHE A 142 11.519 -3.373 1.036 1.00 0.00 C ATOM 1754 CE1 PHE A 142 12.618 -2.834 3.554 1.00 0.00 C ATOM 1755 CE2 PHE A 142 12.475 -4.237 1.581 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.026 -3.968 2.839 1.00 0.00 C ATOM 0 H PHE A 142 10.802 0.923 2.237 1.00 0.00 H new ATOM 0 HA PHE A 142 11.589 -0.594 -0.211 1.00 0.00 H new ATOM 0 HB2 PHE A 142 9.450 -0.900 1.943 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.431 -1.857 0.475 1.00 0.00 H new ATOM 0 HD1 PHE A 142 11.344 -1.098 3.561 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.096 -3.580 0.064 1.00 0.00 H new ATOM 0 HE1 PHE A 142 13.043 -2.626 4.525 1.00 0.00 H new ATOM 0 HE2 PHE A 142 12.788 -5.112 1.031 1.00 0.00 H new ATOM 0 HZ PHE A 142 13.765 -4.634 3.259 1.00 0.00 H new ATOM 1766 N ARG A 143 9.712 0.195 -1.728 1.00 0.00 N ATOM 1767 CA ARG A 143 8.754 0.862 -2.667 1.00 0.00 C ATOM 1768 C ARG A 143 7.726 -0.165 -3.141 1.00 0.00 C ATOM 1769 O ARG A 143 8.071 -1.220 -3.637 1.00 0.00 O ATOM 1770 CB ARG A 143 9.522 1.404 -3.873 1.00 0.00 C ATOM 1771 CG ARG A 143 8.556 2.132 -4.808 1.00 0.00 C ATOM 1772 CD ARG A 143 9.348 2.803 -5.929 1.00 0.00 C ATOM 1773 NE ARG A 143 10.169 3.905 -5.357 1.00 0.00 N ATOM 1774 CZ ARG A 143 10.958 4.598 -6.130 1.00 0.00 C ATOM 1775 NH1 ARG A 143 11.029 4.325 -7.404 1.00 0.00 N ATOM 1776 NH2 ARG A 143 11.677 5.565 -5.627 1.00 0.00 N ATOM 0 H ARG A 143 10.275 -0.545 -2.147 1.00 0.00 H new ATOM 0 HA ARG A 143 8.249 1.683 -2.159 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.307 2.084 -3.542 1.00 0.00 H new ATOM 0 HB3 ARG A 143 10.011 0.587 -4.403 1.00 0.00 H new ATOM 0 HG2 ARG A 143 7.837 1.428 -5.226 1.00 0.00 H new ATOM 0 HG3 ARG A 143 7.987 2.877 -4.253 1.00 0.00 H new ATOM 0 HD2 ARG A 143 9.990 2.074 -6.423 1.00 0.00 H new ATOM 0 HD3 ARG A 143 8.669 3.195 -6.686 1.00 0.00 H new ATOM 0 HE ARG A 143 10.114 4.118 -4.361 1.00 0.00 H new ATOM 0 HH11 ARG A 143 10.467 3.569 -7.796 1.00 0.00 H new ATOM 0 HH12 ARG A 143 11.646 4.867 -8.008 1.00 0.00 H new ATOM 0 HH21 ARG A 143 11.621 5.777 -4.631 1.00 0.00 H new ATOM 0 HH22 ARG A 143 12.295 6.108 -6.230 1.00 0.00 H new ATOM 1790 N LEU A 144 6.463 0.137 -2.983 1.00 0.00 N ATOM 1791 CA LEU A 144 5.386 -0.811 -3.410 1.00 0.00 C ATOM 1792 C LEU A 144 4.384 -0.076 -4.293 1.00 0.00 C ATOM 1793 O LEU A 144 4.231 1.126 -4.200 1.00 0.00 O ATOM 1794 CB LEU A 144 4.662 -1.358 -2.173 1.00 0.00 C ATOM 1795 CG LEU A 144 5.640 -2.185 -1.302 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.283 -1.295 -0.231 1.00 0.00 C ATOM 1797 CD2 LEU A 144 4.882 -3.321 -0.608 1.00 0.00 C ATOM 0 H LEU A 144 6.127 1.008 -2.572 1.00 0.00 H new ATOM 0 HA LEU A 144 5.831 -1.636 -3.967 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.251 -0.534 -1.589 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.822 -1.981 -2.480 1.00 0.00 H new ATOM 0 HG LEU A 144 6.416 -2.594 -1.949 1.00 0.00 H new ATOM 0 HD11 LEU A 144 6.968 -1.890 0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 144 6.833 -0.486 -0.712 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.506 -0.876 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.574 -3.900 0.003 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.100 -2.903 0.026 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.431 -3.970 -1.359 1.00 0.00 H new ATOM 1809 N VAL A 145 3.697 -0.791 -5.150 1.00 0.00 N ATOM 1810 CA VAL A 145 2.692 -0.146 -6.050 1.00 0.00 C ATOM 1811 C VAL A 145 1.314 -0.748 -5.776 1.00 0.00 C ATOM 1812 O VAL A 145 1.149 -1.953 -5.717 1.00 0.00 O ATOM 1813 CB VAL A 145 3.089 -0.378 -7.511 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.021 -1.870 -7.839 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.136 0.393 -8.426 1.00 0.00 C ATOM 0 H VAL A 145 3.790 -1.800 -5.265 1.00 0.00 H new ATOM 0 HA VAL A 145 2.659 0.927 -5.860 1.00 0.00 H new ATOM 0 HB VAL A 145 4.109 -0.026 -7.666 1.00 0.00 H new ATOM 0 HG11 VAL A 145 3.305 -2.027 -8.880 1.00 0.00 H new ATOM 0 HG12 VAL A 145 3.705 -2.417 -7.190 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.005 -2.231 -7.681 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.418 0.229 -9.466 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.116 0.043 -8.267 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.194 1.457 -8.198 1.00 0.00 H new ATOM 1825 N PHE A 146 0.325 0.091 -5.595 1.00 0.00 N ATOM 1826 CA PHE A 146 -1.051 -0.410 -5.308 1.00 0.00 C ATOM 1827 C PHE A 146 -1.774 -0.674 -6.628 1.00 0.00 C ATOM 1828 O PHE A 146 -1.966 0.221 -7.439 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.819 0.650 -4.516 1.00 0.00 C ATOM 1830 CG PHE A 146 -3.231 0.177 -4.276 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -3.508 -0.690 -3.213 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -4.263 0.609 -5.114 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -4.819 -1.126 -2.990 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -5.574 0.174 -4.892 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.852 -0.693 -3.829 1.00 0.00 C ATOM 0 H PHE A 146 0.414 1.106 -5.634 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.994 -1.331 -4.728 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.321 0.839 -3.565 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.828 1.592 -5.064 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -2.710 -1.022 -2.565 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.048 1.279 -5.933 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.033 -1.796 -2.171 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -6.371 0.507 -5.540 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.864 -1.028 -3.656 1.00 0.00 H new ATOM 1845 N LEU A 147 -2.171 -1.902 -6.849 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.880 -2.265 -8.116 1.00 0.00 C ATOM 1847 C LEU A 147 -4.117 -3.104 -7.786 1.00 0.00 C ATOM 1848 O LEU A 147 -4.153 -3.815 -6.800 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.937 -3.083 -8.999 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.737 -2.224 -9.419 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.269 -3.108 -10.162 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -1.199 -1.074 -10.337 1.00 0.00 C ATOM 0 H LEU A 147 -2.033 -2.677 -6.200 1.00 0.00 H new ATOM 0 HA LEU A 147 -3.185 -1.358 -8.639 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -1.593 -3.965 -8.459 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -2.468 -3.438 -9.882 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.270 -1.794 -8.533 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.127 -2.507 -10.465 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.603 -3.911 -9.505 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.205 -3.536 -11.045 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.338 -0.472 -10.628 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.671 -1.487 -11.229 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.915 -0.449 -9.804 1.00 0.00 H new ATOM 1864 N THR A 148 -5.131 -3.024 -8.611 1.00 0.00 N ATOM 1865 CA THR A 148 -6.385 -3.808 -8.372 1.00 0.00 C ATOM 1866 C THR A 148 -6.738 -4.593 -9.636 1.00 0.00 C ATOM 1867 O THR A 148 -6.286 -4.281 -10.720 1.00 0.00 O ATOM 1868 CB THR A 148 -7.522 -2.843 -8.035 1.00 0.00 C ATOM 1869 OG1 THR A 148 -7.699 -1.929 -9.110 1.00 0.00 O ATOM 1870 CG2 THR A 148 -7.179 -2.078 -6.757 1.00 0.00 C ATOM 0 H THR A 148 -5.145 -2.443 -9.449 1.00 0.00 H new ATOM 0 HA THR A 148 -6.236 -4.501 -7.544 1.00 0.00 H new ATOM 0 HB THR A 148 -8.445 -3.403 -7.882 1.00 0.00 H new ATOM 0 HG1 THR A 148 -8.429 -1.310 -8.897 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.989 -1.390 -6.516 1.00 0.00 H new ATOM 0 HG22 THR A 148 -7.045 -2.782 -5.936 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.257 -1.515 -6.906 1.00 0.00 H new