USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 699 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 TYR OH : rot 180:sc= -1.47 USER MOD Set 1.2: A 138 GLN : amide:sc= -1.35 K(o=-2.8,f=-4.5!) USER MOD Set 2.1: A 78 SER OG : rot -160:sc= -0.539 USER MOD Set 2.2: A 82 HIS : no HE2:sc= -3.19! C(o=-3.7!,f=-5.3!) USER MOD Set 2.3: A 85 SER OG : rot -129:sc= 0.0297 USER MOD Single : A 61 LYS NZ :NH3+ 158:sc= -0.0801 (180deg=-0.649) USER MOD Single : A 65 ASN : amide:sc= -0.0735 K(o=-0.074,f=-1) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 77 THR OG1 : rot -169:sc= 0 USER MOD Single : A 93 THR OG1 : rot 167:sc= 0.703 USER MOD Single : A 95 SER OG : rot 180:sc= 0.439 USER MOD Single : A 98 HIS : no HE2:sc= -6.43! C(o=-6.4!,f=-9.8!) USER MOD Single : A 105 ASN : amide:sc= -1.27 K(o=-1.3,f=-0.0079) USER MOD Single : A 106 ASN : amide:sc= -2.76! K(o=-2.8!,f=-0.82) USER MOD Single : A 109 ASN : amide:sc= -3.56 K(o=-3.6,f=-6.5!) USER MOD Single : A 119 THR OG1 : rot 108:sc= 1.26 USER MOD Single : A 122 ASN : amide:sc=-0.00745 K(o=-0.0075,f=-1.1) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.594 K(o=-0.59,f=-7.3!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -12.879 -5.337 -4.942 1.00 0.00 N ATOM 417 CA GLY A 54 -12.864 -5.545 -3.457 1.00 0.00 C ATOM 418 C GLY A 54 -11.499 -6.072 -3.009 1.00 0.00 C ATOM 419 O GLY A 54 -11.167 -6.025 -1.841 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.084 -4.606 -2.949 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.645 -6.251 -3.174 1.00 0.00 H new ATOM 423 N LEU A 55 -10.706 -6.574 -3.925 1.00 0.00 N ATOM 424 CA LEU A 55 -9.352 -7.112 -3.563 1.00 0.00 C ATOM 425 C LEU A 55 -8.266 -6.343 -4.318 1.00 0.00 C ATOM 426 O LEU A 55 -8.451 -5.923 -5.443 1.00 0.00 O ATOM 427 CB LEU A 55 -9.282 -8.602 -3.935 1.00 0.00 C ATOM 428 CG LEU A 55 -9.982 -9.457 -2.857 1.00 0.00 C ATOM 429 CD1 LEU A 55 -10.463 -10.776 -3.472 1.00 0.00 C ATOM 430 CD2 LEU A 55 -8.998 -9.783 -1.721 1.00 0.00 C ATOM 0 H LEU A 55 -10.939 -6.635 -4.916 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.191 -6.993 -2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.757 -8.765 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.241 -8.910 -4.034 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.829 -8.894 -2.465 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.956 -11.376 -2.707 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.166 -10.567 -4.278 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.609 -11.325 -3.869 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.501 -10.386 -0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.150 -10.338 -2.122 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.644 -8.856 -1.269 1.00 0.00 H new ATOM 442 N ALA A 56 -7.130 -6.165 -3.700 1.00 0.00 N ATOM 443 CA ALA A 56 -6.014 -5.435 -4.363 1.00 0.00 C ATOM 444 C ALA A 56 -4.691 -5.934 -3.792 1.00 0.00 C ATOM 445 O ALA A 56 -4.642 -6.466 -2.700 1.00 0.00 O ATOM 446 CB ALA A 56 -6.146 -3.939 -4.098 1.00 0.00 C ATOM 0 H ALA A 56 -6.927 -6.497 -2.757 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.048 -5.612 -5.438 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.327 -3.410 -4.585 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.096 -3.582 -4.495 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.109 -3.755 -3.024 1.00 0.00 H new ATOM 452 N LEU A 57 -3.616 -5.779 -4.519 1.00 0.00 N ATOM 453 CA LEU A 57 -2.295 -6.259 -4.015 1.00 0.00 C ATOM 454 C LEU A 57 -1.207 -5.266 -4.402 1.00 0.00 C ATOM 455 O LEU A 57 -1.355 -4.499 -5.333 1.00 0.00 O ATOM 456 CB LEU A 57 -1.989 -7.633 -4.628 1.00 0.00 C ATOM 457 CG LEU A 57 -2.024 -7.557 -6.180 1.00 0.00 C ATOM 458 CD1 LEU A 57 -0.597 -7.462 -6.741 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.699 -8.815 -6.747 1.00 0.00 C ATOM 0 H LEU A 57 -3.595 -5.341 -5.440 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.327 -6.345 -2.929 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.009 -7.975 -4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.717 -8.364 -4.277 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.587 -6.670 -6.471 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.637 -7.409 -7.829 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.112 -6.567 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.029 -8.342 -6.441 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.721 -8.757 -7.835 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.137 -9.698 -6.442 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.718 -8.884 -6.367 1.00 0.00 H new ATOM 471 N LEU A 58 -0.110 -5.280 -3.688 1.00 0.00 N ATOM 472 CA LEU A 58 1.015 -4.345 -3.993 1.00 0.00 C ATOM 473 C LEU A 58 2.234 -5.158 -4.415 1.00 0.00 C ATOM 474 O LEU A 58 2.398 -6.295 -4.015 1.00 0.00 O ATOM 475 CB LEU A 58 1.364 -3.529 -2.745 1.00 0.00 C ATOM 476 CG LEU A 58 0.125 -2.728 -2.260 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.578 -3.480 -1.125 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.561 -1.351 -1.745 1.00 0.00 C ATOM 0 H LEU A 58 0.056 -5.905 -2.899 1.00 0.00 H new ATOM 0 HA LEU A 58 0.719 -3.669 -4.795 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.709 -4.193 -1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.183 -2.845 -2.967 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.560 -2.609 -3.100 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.445 -2.909 -0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.902 -4.457 -1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.113 -3.609 -0.292 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.314 -0.795 -1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.255 -1.476 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.052 -0.801 -2.548 1.00 0.00 H new ATOM 490 N VAL A 59 3.083 -4.584 -5.230 1.00 0.00 N ATOM 491 CA VAL A 59 4.302 -5.311 -5.707 1.00 0.00 C ATOM 492 C VAL A 59 5.545 -4.477 -5.389 1.00 0.00 C ATOM 493 O VAL A 59 5.587 -3.288 -5.631 1.00 0.00 O ATOM 494 CB VAL A 59 4.201 -5.523 -7.219 1.00 0.00 C ATOM 495 CG1 VAL A 59 5.423 -6.305 -7.708 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.920 -6.304 -7.541 1.00 0.00 C ATOM 0 H VAL A 59 2.984 -3.634 -5.589 1.00 0.00 H new ATOM 0 HA VAL A 59 4.375 -6.277 -5.207 1.00 0.00 H new ATOM 0 HB VAL A 59 4.169 -4.557 -7.722 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.351 -6.456 -8.785 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.329 -5.744 -7.480 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.460 -7.273 -7.208 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.847 -6.455 -8.618 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.948 -7.271 -7.040 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.054 -5.741 -7.194 1.00 0.00 H new ATOM 506 N VAL A 60 6.554 -5.095 -4.841 1.00 0.00 N ATOM 507 CA VAL A 60 7.796 -4.342 -4.494 1.00 0.00 C ATOM 508 C VAL A 60 8.505 -3.869 -5.764 1.00 0.00 C ATOM 509 O VAL A 60 8.676 -4.616 -6.708 1.00 0.00 O ATOM 510 CB VAL A 60 8.732 -5.253 -3.693 1.00 0.00 C ATOM 511 CG1 VAL A 60 10.121 -4.601 -3.556 1.00 0.00 C ATOM 512 CG2 VAL A 60 8.128 -5.483 -2.304 1.00 0.00 C ATOM 0 H VAL A 60 6.574 -6.090 -4.617 1.00 0.00 H new ATOM 0 HA VAL A 60 7.528 -3.470 -3.898 1.00 0.00 H new ATOM 0 HB VAL A 60 8.846 -6.205 -4.212 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.777 -5.258 -2.985 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.545 -4.437 -4.547 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.025 -3.646 -3.039 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.786 -6.130 -1.724 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.017 -4.527 -1.793 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.151 -5.956 -2.406 1.00 0.00 H new ATOM 522 N LYS A 61 8.932 -2.628 -5.780 1.00 0.00 N ATOM 523 CA LYS A 61 9.653 -2.074 -6.969 1.00 0.00 C ATOM 524 C LYS A 61 11.112 -1.800 -6.592 1.00 0.00 C ATOM 525 O LYS A 61 11.628 -0.724 -6.821 1.00 0.00 O ATOM 526 CB LYS A 61 8.984 -0.766 -7.410 1.00 0.00 C ATOM 527 CG LYS A 61 9.364 -0.455 -8.862 1.00 0.00 C ATOM 528 CD LYS A 61 8.585 0.766 -9.344 1.00 0.00 C ATOM 529 CE LYS A 61 8.987 1.081 -10.785 1.00 0.00 C ATOM 530 NZ LYS A 61 8.623 -0.070 -11.661 1.00 0.00 N ATOM 0 H LYS A 61 8.810 -1.969 -5.011 1.00 0.00 H new ATOM 0 HA LYS A 61 9.615 -2.793 -7.787 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.901 -0.851 -7.318 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.296 0.051 -6.759 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.435 -0.268 -8.936 1.00 0.00 H new ATOM 0 HG3 LYS A 61 9.145 -1.313 -9.498 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.513 0.575 -9.286 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.791 1.621 -8.701 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.483 1.986 -11.126 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.059 1.272 -10.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.539 0.256 -12.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.361 -0.800 -11.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.715 -0.469 -11.350 1.00 0.00 H new ATOM 544 N ARG A 62 11.773 -2.773 -6.015 1.00 0.00 N ATOM 545 CA ARG A 62 13.207 -2.610 -5.608 1.00 0.00 C ATOM 546 C ARG A 62 14.042 -3.665 -6.343 1.00 0.00 C ATOM 547 O ARG A 62 13.517 -4.516 -7.026 1.00 0.00 O ATOM 548 CB ARG A 62 13.335 -2.804 -4.082 1.00 0.00 C ATOM 549 CG ARG A 62 14.471 -1.924 -3.523 1.00 0.00 C ATOM 550 CD ARG A 62 13.954 -0.503 -3.252 1.00 0.00 C ATOM 551 NE ARG A 62 15.108 0.440 -3.178 1.00 0.00 N ATOM 552 CZ ARG A 62 14.957 1.619 -2.636 1.00 0.00 C ATOM 553 NH1 ARG A 62 13.809 1.960 -2.122 1.00 0.00 N ATOM 554 NH2 ARG A 62 15.959 2.454 -2.602 1.00 0.00 N ATOM 0 H ARG A 62 11.375 -3.688 -5.805 1.00 0.00 H new ATOM 0 HA ARG A 62 13.563 -1.612 -5.865 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.394 -2.547 -3.596 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.534 -3.852 -3.857 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.859 -2.360 -2.602 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.297 -1.889 -4.233 1.00 0.00 H new ATOM 0 HD2 ARG A 62 13.270 -0.196 -4.043 1.00 0.00 H new ATOM 0 HD3 ARG A 62 13.392 -0.481 -2.318 1.00 0.00 H new ATOM 0 HE ARG A 62 16.016 0.164 -3.551 1.00 0.00 H new ATOM 0 HH11 ARG A 62 13.027 1.306 -2.142 1.00 0.00 H new ATOM 0 HH12 ARG A 62 13.693 2.881 -1.699 1.00 0.00 H new ATOM 0 HH21 ARG A 62 16.860 2.186 -2.999 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.842 3.375 -2.179 1.00 0.00 H new ATOM 568 N GLY A 63 15.336 -3.607 -6.225 1.00 0.00 N ATOM 569 CA GLY A 63 16.194 -4.597 -6.934 1.00 0.00 C ATOM 570 C GLY A 63 16.246 -5.943 -6.178 1.00 0.00 C ATOM 571 O GLY A 63 15.934 -6.978 -6.739 1.00 0.00 O ATOM 0 H GLY A 63 15.839 -2.917 -5.668 1.00 0.00 H new ATOM 0 HA2 GLY A 63 15.809 -4.758 -7.941 1.00 0.00 H new ATOM 0 HA3 GLY A 63 17.203 -4.198 -7.038 1.00 0.00 H new ATOM 575 N PRO A 64 16.670 -5.934 -4.934 1.00 0.00 N ATOM 576 CA PRO A 64 16.817 -7.178 -4.082 1.00 0.00 C ATOM 577 C PRO A 64 15.531 -7.614 -3.373 1.00 0.00 C ATOM 578 O PRO A 64 15.578 -8.396 -2.445 1.00 0.00 O ATOM 579 CB PRO A 64 17.816 -6.714 -3.021 1.00 0.00 C ATOM 580 CG PRO A 64 17.423 -5.299 -2.800 1.00 0.00 C ATOM 581 CD PRO A 64 17.071 -4.732 -4.171 1.00 0.00 C ATOM 0 HA PRO A 64 17.106 -8.036 -4.689 1.00 0.00 H new ATOM 0 HB2 PRO A 64 17.739 -7.303 -2.107 1.00 0.00 H new ATOM 0 HB3 PRO A 64 18.845 -6.799 -3.369 1.00 0.00 H new ATOM 0 HG2 PRO A 64 16.572 -5.233 -2.122 1.00 0.00 H new ATOM 0 HG3 PRO A 64 18.238 -4.736 -2.344 1.00 0.00 H new ATOM 0 HD2 PRO A 64 16.263 -4.003 -4.111 1.00 0.00 H new ATOM 0 HD3 PRO A 64 17.921 -4.228 -4.630 1.00 0.00 H new ATOM 589 N ASN A 65 14.405 -7.084 -3.724 1.00 0.00 N ATOM 590 CA ASN A 65 13.166 -7.448 -2.978 1.00 0.00 C ATOM 591 C ASN A 65 11.990 -7.390 -3.933 1.00 0.00 C ATOM 592 O ASN A 65 10.846 -7.340 -3.538 1.00 0.00 O ATOM 593 CB ASN A 65 13.026 -6.414 -1.863 1.00 0.00 C ATOM 594 CG ASN A 65 11.864 -6.734 -0.930 1.00 0.00 C ATOM 595 OD1 ASN A 65 11.588 -7.879 -0.640 1.00 0.00 O ATOM 596 ND2 ASN A 65 11.181 -5.741 -0.436 1.00 0.00 N ATOM 0 H ASN A 65 14.280 -6.419 -4.487 1.00 0.00 H new ATOM 0 HA ASN A 65 13.204 -8.453 -2.559 1.00 0.00 H new ATOM 0 HB2 ASN A 65 13.951 -6.373 -1.289 1.00 0.00 H new ATOM 0 HB3 ASN A 65 12.878 -5.427 -2.301 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.406 -5.922 0.201 1.00 0.00 H new ATOM 0 HD22 ASN A 65 11.422 -4.782 -0.686 1.00 0.00 H new ATOM 603 N ALA A 66 12.281 -7.396 -5.199 1.00 0.00 N ATOM 604 CA ALA A 66 11.207 -7.336 -6.214 1.00 0.00 C ATOM 605 C ALA A 66 10.551 -8.709 -6.359 1.00 0.00 C ATOM 606 O ALA A 66 11.159 -9.732 -6.104 1.00 0.00 O ATOM 607 CB ALA A 66 11.814 -6.883 -7.548 1.00 0.00 C ATOM 0 H ALA A 66 13.228 -7.440 -5.575 1.00 0.00 H new ATOM 0 HA ALA A 66 10.441 -6.624 -5.906 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.032 -6.835 -8.306 1.00 0.00 H new ATOM 0 HB2 ALA A 66 12.264 -5.897 -7.427 1.00 0.00 H new ATOM 0 HB3 ALA A 66 12.578 -7.595 -7.860 1.00 0.00 H new ATOM 613 N GLY A 67 9.312 -8.738 -6.767 1.00 0.00 N ATOM 614 CA GLY A 67 8.597 -10.038 -6.938 1.00 0.00 C ATOM 615 C GLY A 67 7.696 -10.280 -5.727 1.00 0.00 C ATOM 616 O GLY A 67 6.744 -11.031 -5.791 1.00 0.00 O ATOM 0 H GLY A 67 8.759 -7.911 -6.991 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.002 -10.022 -7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.316 -10.851 -7.040 1.00 0.00 H new ATOM 620 N SER A 68 7.985 -9.645 -4.625 1.00 0.00 N ATOM 621 CA SER A 68 7.140 -9.837 -3.415 1.00 0.00 C ATOM 622 C SER A 68 5.746 -9.268 -3.678 1.00 0.00 C ATOM 623 O SER A 68 5.597 -8.235 -4.306 1.00 0.00 O ATOM 624 CB SER A 68 7.778 -9.117 -2.226 1.00 0.00 C ATOM 625 OG SER A 68 8.873 -9.886 -1.744 1.00 0.00 O ATOM 0 H SER A 68 8.769 -9.002 -4.511 1.00 0.00 H new ATOM 0 HA SER A 68 7.060 -10.900 -3.188 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.119 -8.126 -2.526 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.042 -8.975 -1.435 1.00 0.00 H new ATOM 0 HG SER A 68 9.285 -9.427 -0.983 1.00 0.00 H new ATOM 631 N ARG A 69 4.724 -9.936 -3.198 1.00 0.00 N ATOM 632 CA ARG A 69 3.325 -9.450 -3.411 1.00 0.00 C ATOM 633 C ARG A 69 2.558 -9.521 -2.092 1.00 0.00 C ATOM 634 O ARG A 69 2.782 -10.396 -1.280 1.00 0.00 O ATOM 635 CB ARG A 69 2.628 -10.344 -4.439 1.00 0.00 C ATOM 636 CG ARG A 69 3.355 -10.247 -5.780 1.00 0.00 C ATOM 637 CD ARG A 69 2.613 -11.085 -6.823 1.00 0.00 C ATOM 638 NE ARG A 69 2.703 -12.529 -6.460 1.00 0.00 N ATOM 639 CZ ARG A 69 3.748 -13.230 -6.810 1.00 0.00 C ATOM 640 NH1 ARG A 69 4.722 -12.667 -7.472 1.00 0.00 N ATOM 641 NH2 ARG A 69 3.820 -14.495 -6.496 1.00 0.00 N ATOM 0 H ARG A 69 4.800 -10.802 -2.665 1.00 0.00 H new ATOM 0 HA ARG A 69 3.349 -8.421 -3.771 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.621 -11.377 -4.092 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.588 -10.039 -4.555 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.407 -9.207 -6.103 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.381 -10.601 -5.676 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.569 -10.777 -6.876 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.044 -10.920 -7.810 1.00 0.00 H new ATOM 0 HE ARG A 69 1.946 -12.970 -5.937 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.668 -11.678 -7.717 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.537 -13.216 -7.745 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.060 -14.936 -5.977 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.636 -15.043 -6.769 1.00 0.00 H new ATOM 655 N PHE A 70 1.646 -8.607 -1.876 1.00 0.00 N ATOM 656 CA PHE A 70 0.845 -8.617 -0.613 1.00 0.00 C ATOM 657 C PHE A 70 -0.616 -8.327 -0.952 1.00 0.00 C ATOM 658 O PHE A 70 -0.996 -7.199 -1.194 1.00 0.00 O ATOM 659 CB PHE A 70 1.374 -7.540 0.336 1.00 0.00 C ATOM 660 CG PHE A 70 2.779 -7.896 0.758 1.00 0.00 C ATOM 661 CD1 PHE A 70 2.988 -8.834 1.777 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.874 -7.293 0.128 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.291 -9.168 2.165 1.00 0.00 C ATOM 664 CE2 PHE A 70 5.176 -7.627 0.516 1.00 0.00 C ATOM 665 CZ PHE A 70 5.385 -8.565 1.534 1.00 0.00 C ATOM 0 H PHE A 70 1.421 -7.851 -2.523 1.00 0.00 H new ATOM 0 HA PHE A 70 0.926 -9.591 -0.131 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.365 -6.568 -0.157 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.728 -7.460 1.210 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.144 -9.300 2.264 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.714 -6.570 -0.658 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.452 -9.891 2.951 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.020 -7.161 0.030 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.390 -8.823 1.832 1.00 0.00 H new ATOM 675 N LEU A 71 -1.439 -9.344 -0.976 1.00 0.00 N ATOM 676 CA LEU A 71 -2.878 -9.136 -1.302 1.00 0.00 C ATOM 677 C LEU A 71 -3.635 -8.759 -0.034 1.00 0.00 C ATOM 678 O LEU A 71 -3.415 -9.309 1.027 1.00 0.00 O ATOM 679 CB LEU A 71 -3.458 -10.423 -1.906 1.00 0.00 C ATOM 680 CG LEU A 71 -3.454 -11.560 -0.851 1.00 0.00 C ATOM 681 CD1 LEU A 71 -4.850 -11.719 -0.229 1.00 0.00 C ATOM 682 CD2 LEU A 71 -3.041 -12.888 -1.506 1.00 0.00 C ATOM 0 H LEU A 71 -1.174 -10.310 -0.783 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.979 -8.329 -2.028 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.475 -10.244 -2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.872 -10.722 -2.775 1.00 0.00 H new ATOM 0 HG LEU A 71 -2.739 -11.299 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.830 -12.521 0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -5.141 -10.787 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.571 -11.962 -1.010 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -3.042 -13.679 -0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.747 -13.138 -2.298 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -2.041 -12.790 -1.929 1.00 0.00 H new ATOM 694 N LEU A 72 -4.517 -7.804 -0.137 1.00 0.00 N ATOM 695 CA LEU A 72 -5.292 -7.351 1.052 1.00 0.00 C ATOM 696 C LEU A 72 -6.647 -8.062 1.090 1.00 0.00 C ATOM 697 O LEU A 72 -7.591 -7.663 0.438 1.00 0.00 O ATOM 698 CB LEU A 72 -5.498 -5.840 0.946 1.00 0.00 C ATOM 699 CG LEU A 72 -4.135 -5.157 0.770 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.336 -3.647 0.618 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.240 -5.440 1.991 1.00 0.00 C ATOM 0 H LEU A 72 -4.736 -7.313 -1.004 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.749 -7.590 1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.147 -5.608 0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.994 -5.465 1.841 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.651 -5.552 -0.123 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.368 -3.162 0.493 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.957 -3.449 -0.256 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.827 -3.254 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.275 -4.951 1.856 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.720 -5.055 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.091 -6.515 2.091 1.00 0.00 H new ATOM 713 N ASP A 73 -6.741 -9.117 1.861 1.00 0.00 N ATOM 714 CA ASP A 73 -8.021 -9.883 1.973 1.00 0.00 C ATOM 715 C ASP A 73 -8.621 -9.660 3.364 1.00 0.00 C ATOM 716 O ASP A 73 -9.463 -10.413 3.809 1.00 0.00 O ATOM 717 CB ASP A 73 -7.733 -11.375 1.787 1.00 0.00 C ATOM 718 CG ASP A 73 -9.038 -12.167 1.876 1.00 0.00 C ATOM 719 OD1 ASP A 73 -10.088 -11.548 1.832 1.00 0.00 O ATOM 720 OD2 ASP A 73 -8.964 -13.380 1.985 1.00 0.00 O ATOM 0 H ASP A 73 -5.975 -9.485 2.425 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.720 -9.543 1.209 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.258 -11.546 0.821 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.035 -11.718 2.551 1.00 0.00 H new ATOM 725 N GLN A 74 -8.181 -8.635 4.058 1.00 0.00 N ATOM 726 CA GLN A 74 -8.709 -8.358 5.434 1.00 0.00 C ATOM 727 C GLN A 74 -9.193 -6.909 5.527 1.00 0.00 C ATOM 728 O GLN A 74 -8.734 -6.039 4.814 1.00 0.00 O ATOM 729 CB GLN A 74 -7.594 -8.595 6.454 1.00 0.00 C ATOM 730 CG GLN A 74 -7.276 -10.089 6.509 1.00 0.00 C ATOM 731 CD GLN A 74 -6.132 -10.339 7.492 1.00 0.00 C ATOM 732 OE1 GLN A 74 -5.673 -9.428 8.153 1.00 0.00 O ATOM 733 NE2 GLN A 74 -5.649 -11.545 7.617 1.00 0.00 N ATOM 0 H GLN A 74 -7.476 -7.976 3.729 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.547 -9.023 5.642 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -6.704 -8.031 6.176 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.902 -8.240 7.437 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.160 -10.647 6.816 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -7.001 -10.448 5.517 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.035 -12.309 7.062 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -4.886 -11.724 8.270 1.00 0.00 H new ATOM 742 N ALA A 75 -10.133 -6.656 6.398 1.00 0.00 N ATOM 743 CA ALA A 75 -10.677 -5.277 6.548 1.00 0.00 C ATOM 744 C ALA A 75 -9.562 -4.301 6.934 1.00 0.00 C ATOM 745 O ALA A 75 -9.437 -3.238 6.357 1.00 0.00 O ATOM 746 CB ALA A 75 -11.750 -5.282 7.639 1.00 0.00 C ATOM 0 H ALA A 75 -10.550 -7.352 7.016 1.00 0.00 H new ATOM 0 HA ALA A 75 -11.107 -4.957 5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -12.154 -4.277 7.756 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.552 -5.965 7.358 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.309 -5.608 8.581 1.00 0.00 H new ATOM 752 N ILE A 76 -8.757 -4.645 7.910 1.00 0.00 N ATOM 753 CA ILE A 76 -7.648 -3.736 8.349 1.00 0.00 C ATOM 754 C ILE A 76 -6.315 -4.480 8.275 1.00 0.00 C ATOM 755 O ILE A 76 -6.159 -5.542 8.846 1.00 0.00 O ATOM 756 CB ILE A 76 -7.904 -3.297 9.792 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.205 -2.493 9.852 1.00 0.00 C ATOM 758 CG2 ILE A 76 -6.743 -2.427 10.280 1.00 0.00 C ATOM 759 CD1 ILE A 76 -9.600 -2.265 11.312 1.00 0.00 C ATOM 0 H ILE A 76 -8.820 -5.523 8.426 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.610 -2.863 7.697 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.987 -4.177 10.430 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.077 -1.536 9.346 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.999 -3.027 9.329 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.928 -2.116 11.308 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -5.816 -2.999 10.235 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -6.657 -1.546 9.644 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.527 -1.692 11.353 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.746 -3.227 11.804 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.810 -1.713 11.821 1.00 0.00 H new ATOM 771 N THR A 77 -5.350 -3.923 7.584 1.00 0.00 N ATOM 772 CA THR A 77 -4.007 -4.581 7.468 1.00 0.00 C ATOM 773 C THR A 77 -2.934 -3.628 8.000 1.00 0.00 C ATOM 774 O THR A 77 -2.771 -2.528 7.512 1.00 0.00 O ATOM 775 CB THR A 77 -3.725 -4.901 5.997 1.00 0.00 C ATOM 776 OG1 THR A 77 -4.734 -5.770 5.503 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.360 -5.578 5.870 1.00 0.00 C ATOM 0 H THR A 77 -5.434 -3.034 7.091 1.00 0.00 H new ATOM 0 HA THR A 77 -3.996 -5.504 8.048 1.00 0.00 H new ATOM 0 HB THR A 77 -3.723 -3.977 5.419 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.468 -6.114 4.625 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.162 -5.804 4.822 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.586 -4.911 6.249 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.357 -6.502 6.448 1.00 0.00 H new ATOM 785 N SER A 78 -2.203 -4.044 8.998 1.00 0.00 N ATOM 786 CA SER A 78 -1.136 -3.168 9.567 1.00 0.00 C ATOM 787 C SER A 78 0.154 -3.332 8.763 1.00 0.00 C ATOM 788 O SER A 78 0.316 -4.283 8.023 1.00 0.00 O ATOM 789 CB SER A 78 -0.889 -3.561 11.024 1.00 0.00 C ATOM 790 OG SER A 78 -0.716 -4.969 11.108 1.00 0.00 O ATOM 0 H SER A 78 -2.298 -4.955 9.446 1.00 0.00 H new ATOM 0 HA SER A 78 -1.454 -2.127 9.517 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.004 -3.051 11.405 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.729 -3.249 11.644 1.00 0.00 H new ATOM 0 HG SER A 78 -0.874 -5.264 12.029 1.00 0.00 H new ATOM 796 N ALA A 79 1.076 -2.407 8.903 1.00 0.00 N ATOM 797 CA ALA A 79 2.372 -2.491 8.150 1.00 0.00 C ATOM 798 C ALA A 79 3.524 -2.711 9.135 1.00 0.00 C ATOM 799 O ALA A 79 3.333 -2.746 10.334 1.00 0.00 O ATOM 800 CB ALA A 79 2.603 -1.180 7.397 1.00 0.00 C ATOM 0 H ALA A 79 0.986 -1.592 9.510 1.00 0.00 H new ATOM 0 HA ALA A 79 2.329 -3.322 7.446 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.543 -1.236 6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.784 -1.013 6.697 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.646 -0.355 8.108 1.00 0.00 H new ATOM 806 N GLY A 80 4.721 -2.850 8.633 1.00 0.00 N ATOM 807 CA GLY A 80 5.895 -3.055 9.529 1.00 0.00 C ATOM 808 C GLY A 80 5.927 -4.484 10.066 1.00 0.00 C ATOM 809 O GLY A 80 5.851 -5.441 9.320 1.00 0.00 O ATOM 0 H GLY A 80 4.937 -2.830 7.636 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.815 -2.847 8.983 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.851 -2.351 10.360 1.00 0.00 H new ATOM 813 N ARG A 81 6.066 -4.635 11.357 1.00 0.00 N ATOM 814 CA ARG A 81 6.136 -6.001 11.956 1.00 0.00 C ATOM 815 C ARG A 81 4.759 -6.424 12.471 1.00 0.00 C ATOM 816 O ARG A 81 4.229 -5.851 13.401 1.00 0.00 O ATOM 817 CB ARG A 81 7.124 -5.977 13.123 1.00 0.00 C ATOM 818 CG ARG A 81 8.540 -5.770 12.581 1.00 0.00 C ATOM 819 CD ARG A 81 9.527 -5.686 13.747 1.00 0.00 C ATOM 820 NE ARG A 81 10.913 -5.531 13.213 1.00 0.00 N ATOM 821 CZ ARG A 81 11.392 -4.345 12.942 1.00 0.00 C ATOM 822 NH1 ARG A 81 10.656 -3.282 13.120 1.00 0.00 N ATOM 823 NH2 ARG A 81 12.609 -4.224 12.486 1.00 0.00 N ATOM 0 H ARG A 81 6.134 -3.868 12.025 1.00 0.00 H new ATOM 0 HA ARG A 81 6.463 -6.712 11.197 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.867 -5.176 13.816 1.00 0.00 H new ATOM 0 HB3 ARG A 81 7.069 -6.912 13.681 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.811 -6.593 11.920 1.00 0.00 H new ATOM 0 HG3 ARG A 81 8.584 -4.857 11.988 1.00 0.00 H new ATOM 0 HD2 ARG A 81 9.277 -4.842 14.390 1.00 0.00 H new ATOM 0 HD3 ARG A 81 9.460 -6.585 14.360 1.00 0.00 H new ATOM 0 HE ARG A 81 11.491 -6.357 13.058 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.703 -3.375 13.472 1.00 0.00 H new ATOM 0 HH12 ARG A 81 11.034 -2.359 12.907 1.00 0.00 H new ATOM 0 HH21 ARG A 81 13.184 -5.054 12.342 1.00 0.00 H new ATOM 0 HH22 ARG A 81 12.985 -3.300 12.274 1.00 0.00 H new ATOM 837 N HIS A 82 4.191 -7.438 11.875 1.00 0.00 N ATOM 838 CA HIS A 82 2.855 -7.931 12.315 1.00 0.00 C ATOM 839 C HIS A 82 2.566 -9.255 11.596 1.00 0.00 C ATOM 840 O HIS A 82 1.853 -9.289 10.613 1.00 0.00 O ATOM 841 CB HIS A 82 1.770 -6.899 11.951 1.00 0.00 C ATOM 842 CG HIS A 82 1.667 -5.855 13.032 1.00 0.00 C ATOM 843 ND1 HIS A 82 1.310 -6.175 14.334 1.00 0.00 N ATOM 844 CD2 HIS A 82 1.879 -4.500 13.024 1.00 0.00 C ATOM 845 CE1 HIS A 82 1.320 -5.035 15.048 1.00 0.00 C ATOM 846 NE2 HIS A 82 1.659 -3.983 14.298 1.00 0.00 N ATOM 0 H HIS A 82 4.601 -7.951 11.094 1.00 0.00 H new ATOM 0 HA HIS A 82 2.851 -8.079 13.395 1.00 0.00 H new ATOM 0 HB2 HIS A 82 2.011 -6.426 10.999 1.00 0.00 H new ATOM 0 HB3 HIS A 82 0.810 -7.399 11.824 1.00 0.00 H new ATOM 0 HD1 HIS A 82 1.082 -7.105 14.686 1.00 0.00 H new ATOM 0 HD2 HIS A 82 2.172 -3.922 12.160 1.00 0.00 H new ATOM 0 HE1 HIS A 82 1.083 -4.977 16.100 1.00 0.00 H new ATOM 854 N PRO A 83 3.118 -10.339 12.079 1.00 0.00 N ATOM 855 CA PRO A 83 2.910 -11.681 11.463 1.00 0.00 C ATOM 856 C PRO A 83 1.420 -11.981 11.275 1.00 0.00 C ATOM 857 O PRO A 83 1.006 -12.551 10.285 1.00 0.00 O ATOM 858 CB PRO A 83 3.549 -12.652 12.471 1.00 0.00 C ATOM 859 CG PRO A 83 4.552 -11.830 13.221 1.00 0.00 C ATOM 860 CD PRO A 83 3.994 -10.405 13.259 1.00 0.00 C ATOM 0 HA PRO A 83 3.350 -11.758 10.469 1.00 0.00 H new ATOM 0 HB2 PRO A 83 2.801 -13.071 13.144 1.00 0.00 H new ATOM 0 HB3 PRO A 83 4.026 -13.490 11.963 1.00 0.00 H new ATOM 0 HG2 PRO A 83 4.697 -12.218 14.229 1.00 0.00 H new ATOM 0 HG3 PRO A 83 5.523 -11.855 12.727 1.00 0.00 H new ATOM 0 HD2 PRO A 83 3.441 -10.217 14.179 1.00 0.00 H new ATOM 0 HD3 PRO A 83 4.790 -9.662 13.208 1.00 0.00 H new ATOM 868 N ASP A 84 0.613 -11.585 12.219 1.00 0.00 N ATOM 869 CA ASP A 84 -0.850 -11.826 12.105 1.00 0.00 C ATOM 870 C ASP A 84 -1.397 -11.056 10.899 1.00 0.00 C ATOM 871 O ASP A 84 -2.245 -11.535 10.173 1.00 0.00 O ATOM 872 CB ASP A 84 -1.541 -11.329 13.376 1.00 0.00 C ATOM 873 CG ASP A 84 -1.215 -12.271 14.536 1.00 0.00 C ATOM 874 OD1 ASP A 84 -0.738 -13.362 14.272 1.00 0.00 O ATOM 875 OD2 ASP A 84 -1.448 -11.884 15.670 1.00 0.00 O ATOM 0 H ASP A 84 0.906 -11.102 13.068 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.038 -12.892 11.975 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.210 -10.318 13.611 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -2.619 -11.284 13.222 1.00 0.00 H new ATOM 880 N SER A 85 -0.922 -9.857 10.693 1.00 0.00 N ATOM 881 CA SER A 85 -1.413 -9.036 9.549 1.00 0.00 C ATOM 882 C SER A 85 -0.882 -9.594 8.227 1.00 0.00 C ATOM 883 O SER A 85 0.112 -10.292 8.184 1.00 0.00 O ATOM 884 CB SER A 85 -0.937 -7.596 9.717 1.00 0.00 C ATOM 885 OG SER A 85 -1.542 -6.786 8.719 1.00 0.00 O ATOM 0 H SER A 85 -0.211 -9.409 11.271 1.00 0.00 H new ATOM 0 HA SER A 85 -2.502 -9.067 9.534 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.198 -7.227 10.709 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.149 -7.547 9.634 1.00 0.00 H new ATOM 0 HG SER A 85 -0.852 -6.264 8.259 1.00 0.00 H new ATOM 891 N ASP A 86 -1.544 -9.281 7.145 1.00 0.00 N ATOM 892 CA ASP A 86 -1.097 -9.779 5.813 1.00 0.00 C ATOM 893 C ASP A 86 0.294 -9.231 5.493 1.00 0.00 C ATOM 894 O ASP A 86 1.136 -9.923 4.957 1.00 0.00 O ATOM 895 CB ASP A 86 -2.081 -9.305 4.741 1.00 0.00 C ATOM 896 CG ASP A 86 -3.391 -10.081 4.868 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.423 -11.030 5.634 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.342 -9.715 4.197 1.00 0.00 O ATOM 0 H ASP A 86 -2.381 -8.698 7.128 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.061 -10.868 5.831 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.267 -8.237 4.851 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.653 -9.453 3.749 1.00 0.00 H new ATOM 903 N ILE A 87 0.543 -7.986 5.806 1.00 0.00 N ATOM 904 CA ILE A 87 1.879 -7.388 5.507 1.00 0.00 C ATOM 905 C ILE A 87 2.781 -7.503 6.736 1.00 0.00 C ATOM 906 O ILE A 87 2.505 -6.940 7.776 1.00 0.00 O ATOM 907 CB ILE A 87 1.695 -5.914 5.141 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.831 -5.820 3.881 1.00 0.00 C ATOM 909 CG2 ILE A 87 3.061 -5.271 4.879 1.00 0.00 C ATOM 910 CD1 ILE A 87 0.409 -4.367 3.652 1.00 0.00 C ATOM 0 H ILE A 87 -0.122 -7.357 6.256 1.00 0.00 H new ATOM 0 HA ILE A 87 2.341 -7.919 4.675 1.00 0.00 H new ATOM 0 HB ILE A 87 1.208 -5.389 5.963 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.387 -6.187 3.019 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.050 -6.453 3.985 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.925 -4.221 4.619 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.676 -5.346 5.776 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.555 -5.788 4.056 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.206 -4.304 2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.164 -4.015 4.510 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.296 -3.746 3.529 1.00 0.00 H new ATOM 922 N PHE A 88 3.862 -8.231 6.612 1.00 0.00 N ATOM 923 CA PHE A 88 4.813 -8.402 7.755 1.00 0.00 C ATOM 924 C PHE A 88 6.233 -8.114 7.271 1.00 0.00 C ATOM 925 O PHE A 88 6.950 -8.999 6.849 1.00 0.00 O ATOM 926 CB PHE A 88 4.723 -9.837 8.284 1.00 0.00 C ATOM 927 CG PHE A 88 4.892 -10.821 7.150 1.00 0.00 C ATOM 928 CD1 PHE A 88 3.821 -11.082 6.287 1.00 0.00 C ATOM 929 CD2 PHE A 88 6.116 -11.478 6.963 1.00 0.00 C ATOM 930 CE1 PHE A 88 3.971 -11.997 5.239 1.00 0.00 C ATOM 931 CE2 PHE A 88 6.266 -12.395 5.914 1.00 0.00 C ATOM 932 CZ PHE A 88 5.193 -12.653 5.052 1.00 0.00 C ATOM 0 H PHE A 88 4.130 -8.720 5.758 1.00 0.00 H new ATOM 0 HA PHE A 88 4.556 -7.710 8.557 1.00 0.00 H new ATOM 0 HB2 PHE A 88 5.492 -10.004 9.038 1.00 0.00 H new ATOM 0 HB3 PHE A 88 3.760 -9.993 8.771 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.878 -10.576 6.430 1.00 0.00 H new ATOM 0 HD2 PHE A 88 6.944 -11.277 7.627 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.144 -12.197 4.574 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.209 -12.902 5.770 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.309 -13.359 4.243 1.00 0.00 H new ATOM 942 N LEU A 89 6.643 -6.876 7.327 1.00 0.00 N ATOM 943 CA LEU A 89 8.017 -6.521 6.870 1.00 0.00 C ATOM 944 C LEU A 89 8.987 -6.673 8.042 1.00 0.00 C ATOM 945 O LEU A 89 9.191 -5.760 8.817 1.00 0.00 O ATOM 946 CB LEU A 89 8.019 -5.067 6.388 1.00 0.00 C ATOM 947 CG LEU A 89 7.034 -4.906 5.222 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.932 -3.425 4.847 1.00 0.00 C ATOM 949 CD2 LEU A 89 7.518 -5.714 4.001 1.00 0.00 C ATOM 0 H LEU A 89 6.085 -6.094 7.670 1.00 0.00 H new ATOM 0 HA LEU A 89 8.324 -7.178 6.056 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.741 -4.402 7.206 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.022 -4.780 6.072 1.00 0.00 H new ATOM 0 HG LEU A 89 6.056 -5.278 5.527 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.233 -3.307 4.019 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.577 -2.856 5.706 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.914 -3.057 4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.811 -5.592 3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.499 -5.353 3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.587 -6.769 4.267 1.00 0.00 H new ATOM 961 N ASP A 90 9.589 -7.827 8.174 1.00 0.00 N ATOM 962 CA ASP A 90 10.553 -8.057 9.290 1.00 0.00 C ATOM 963 C ASP A 90 11.977 -7.805 8.794 1.00 0.00 C ATOM 964 O ASP A 90 12.627 -8.689 8.272 1.00 0.00 O ATOM 965 CB ASP A 90 10.426 -9.504 9.770 1.00 0.00 C ATOM 966 CG ASP A 90 11.166 -9.670 11.098 1.00 0.00 C ATOM 967 OD1 ASP A 90 11.983 -8.820 11.410 1.00 0.00 O ATOM 968 OD2 ASP A 90 10.902 -10.645 11.782 1.00 0.00 O ATOM 0 H ASP A 90 9.453 -8.624 7.552 1.00 0.00 H new ATOM 0 HA ASP A 90 10.333 -7.377 10.113 1.00 0.00 H new ATOM 0 HB2 ASP A 90 9.375 -9.766 9.892 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.839 -10.183 9.024 1.00 0.00 H new ATOM 973 N ASP A 91 12.468 -6.608 8.953 1.00 0.00 N ATOM 974 CA ASP A 91 13.852 -6.301 8.491 1.00 0.00 C ATOM 975 C ASP A 91 14.365 -5.051 9.208 1.00 0.00 C ATOM 976 O ASP A 91 13.662 -4.434 9.983 1.00 0.00 O ATOM 977 CB ASP A 91 13.850 -6.072 6.978 1.00 0.00 C ATOM 978 CG ASP A 91 12.735 -5.093 6.607 1.00 0.00 C ATOM 979 OD1 ASP A 91 12.551 -4.133 7.336 1.00 0.00 O ATOM 980 OD2 ASP A 91 12.081 -5.325 5.604 1.00 0.00 O ATOM 0 H ASP A 91 11.971 -5.828 9.383 1.00 0.00 H new ATOM 0 HA ASP A 91 14.507 -7.140 8.723 1.00 0.00 H new ATOM 0 HB2 ASP A 91 14.815 -5.678 6.659 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.704 -7.018 6.457 1.00 0.00 H new ATOM 985 N VAL A 92 15.589 -4.680 8.962 1.00 0.00 N ATOM 986 CA VAL A 92 16.160 -3.478 9.630 1.00 0.00 C ATOM 987 C VAL A 92 15.360 -2.230 9.237 1.00 0.00 C ATOM 988 O VAL A 92 15.045 -1.397 10.063 1.00 0.00 O ATOM 989 CB VAL A 92 17.618 -3.311 9.191 1.00 0.00 C ATOM 990 CG1 VAL A 92 18.171 -1.983 9.714 1.00 0.00 C ATOM 991 CG2 VAL A 92 18.450 -4.466 9.752 1.00 0.00 C ATOM 0 H VAL A 92 16.223 -5.160 8.323 1.00 0.00 H new ATOM 0 HA VAL A 92 16.109 -3.604 10.711 1.00 0.00 H new ATOM 0 HB VAL A 92 17.669 -3.315 8.102 1.00 0.00 H new ATOM 0 HG11 VAL A 92 19.208 -1.871 9.398 1.00 0.00 H new ATOM 0 HG12 VAL A 92 17.579 -1.160 9.314 1.00 0.00 H new ATOM 0 HG13 VAL A 92 18.120 -1.971 10.803 1.00 0.00 H new ATOM 0 HG21 VAL A 92 19.488 -4.351 9.442 1.00 0.00 H new ATOM 0 HG22 VAL A 92 18.394 -4.460 10.841 1.00 0.00 H new ATOM 0 HG23 VAL A 92 18.061 -5.412 9.374 1.00 0.00 H new ATOM 1001 N THR A 93 15.045 -2.090 7.980 1.00 0.00 N ATOM 1002 CA THR A 93 14.282 -0.893 7.521 1.00 0.00 C ATOM 1003 C THR A 93 12.829 -0.964 7.998 1.00 0.00 C ATOM 1004 O THR A 93 12.397 -1.947 8.565 1.00 0.00 O ATOM 1005 CB THR A 93 14.311 -0.829 5.994 1.00 0.00 C ATOM 1006 OG1 THR A 93 13.958 -2.098 5.464 1.00 0.00 O ATOM 1007 CG2 THR A 93 15.714 -0.446 5.524 1.00 0.00 C ATOM 0 H THR A 93 15.284 -2.756 7.246 1.00 0.00 H new ATOM 0 HA THR A 93 14.745 -0.000 7.941 1.00 0.00 H new ATOM 0 HB THR A 93 13.600 -0.080 5.646 1.00 0.00 H new ATOM 0 HG1 THR A 93 13.769 -2.011 4.506 1.00 0.00 H new ATOM 0 HG21 THR A 93 15.733 -0.401 4.435 1.00 0.00 H new ATOM 0 HG22 THR A 93 15.981 0.529 5.932 1.00 0.00 H new ATOM 0 HG23 THR A 93 16.430 -1.192 5.869 1.00 0.00 H new ATOM 1015 N VAL A 94 12.082 0.090 7.772 1.00 0.00 N ATOM 1016 CA VAL A 94 10.649 0.134 8.197 1.00 0.00 C ATOM 1017 C VAL A 94 10.558 0.007 9.721 1.00 0.00 C ATOM 1018 O VAL A 94 10.806 -1.037 10.290 1.00 0.00 O ATOM 1019 CB VAL A 94 9.859 -0.992 7.517 1.00 0.00 C ATOM 1020 CG1 VAL A 94 8.377 -0.859 7.874 1.00 0.00 C ATOM 1021 CG2 VAL A 94 10.025 -0.891 5.994 1.00 0.00 C ATOM 0 H VAL A 94 12.411 0.934 7.304 1.00 0.00 H new ATOM 0 HA VAL A 94 10.216 1.088 7.896 1.00 0.00 H new ATOM 0 HB VAL A 94 10.235 -1.956 7.860 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.814 -1.658 7.392 1.00 0.00 H new ATOM 0 HG12 VAL A 94 8.255 -0.930 8.955 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.005 0.106 7.530 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.463 -1.692 5.513 1.00 0.00 H new ATOM 0 HG22 VAL A 94 9.650 0.073 5.650 1.00 0.00 H new ATOM 0 HG23 VAL A 94 11.080 -0.983 5.736 1.00 0.00 H new ATOM 1031 N SER A 95 10.213 1.083 10.380 1.00 0.00 N ATOM 1032 CA SER A 95 10.111 1.074 11.869 1.00 0.00 C ATOM 1033 C SER A 95 9.054 0.070 12.334 1.00 0.00 C ATOM 1034 O SER A 95 8.807 -0.935 11.696 1.00 0.00 O ATOM 1035 CB SER A 95 9.718 2.470 12.351 1.00 0.00 C ATOM 1036 OG SER A 95 9.925 2.561 13.754 1.00 0.00 O ATOM 0 H SER A 95 9.995 1.979 9.943 1.00 0.00 H new ATOM 0 HA SER A 95 11.076 0.785 12.284 1.00 0.00 H new ATOM 0 HB2 SER A 95 10.311 3.225 11.835 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.673 2.668 12.113 1.00 0.00 H new ATOM 0 HG SER A 95 9.675 3.456 14.064 1.00 0.00 H new ATOM 1042 N ARG A 96 8.435 0.337 13.454 1.00 0.00 N ATOM 1043 CA ARG A 96 7.396 -0.592 13.983 1.00 0.00 C ATOM 1044 C ARG A 96 6.262 -0.715 12.967 1.00 0.00 C ATOM 1045 O ARG A 96 5.809 -1.799 12.663 1.00 0.00 O ATOM 1046 CB ARG A 96 6.847 -0.028 15.297 1.00 0.00 C ATOM 1047 CG ARG A 96 5.845 -1.011 15.908 1.00 0.00 C ATOM 1048 CD ARG A 96 5.318 -0.446 17.230 1.00 0.00 C ATOM 1049 NE ARG A 96 4.320 -1.391 17.812 1.00 0.00 N ATOM 1050 CZ ARG A 96 4.708 -2.376 18.580 1.00 0.00 C ATOM 1051 NH1 ARG A 96 5.974 -2.538 18.855 1.00 0.00 N ATOM 1052 NH2 ARG A 96 3.825 -3.199 19.077 1.00 0.00 N ATOM 0 H ARG A 96 8.606 1.163 14.027 1.00 0.00 H new ATOM 0 HA ARG A 96 7.832 -1.576 14.158 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.664 0.152 15.995 1.00 0.00 H new ATOM 0 HB3 ARG A 96 6.364 0.932 15.117 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.019 -1.181 15.218 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.323 -1.976 16.077 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.142 -0.295 17.928 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.858 0.528 17.064 1.00 0.00 H new ATOM 0 HE ARG A 96 3.328 -1.268 17.609 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.666 -1.895 18.470 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.271 -3.308 19.455 1.00 0.00 H new ATOM 0 HH21 ARG A 96 2.835 -3.073 18.866 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.125 -3.968 19.676 1.00 0.00 H new ATOM 1066 N ARG A 97 5.815 0.392 12.432 1.00 0.00 N ATOM 1067 CA ARG A 97 4.716 0.363 11.422 1.00 0.00 C ATOM 1068 C ARG A 97 4.406 1.792 10.978 1.00 0.00 C ATOM 1069 O ARG A 97 4.415 2.098 9.802 1.00 0.00 O ATOM 1070 CB ARG A 97 3.453 -0.284 12.024 1.00 0.00 C ATOM 1071 CG ARG A 97 3.081 0.397 13.348 1.00 0.00 C ATOM 1072 CD ARG A 97 2.043 -0.448 14.086 1.00 0.00 C ATOM 1073 NE ARG A 97 1.668 0.235 15.361 1.00 0.00 N ATOM 1074 CZ ARG A 97 0.682 1.097 15.389 1.00 0.00 C ATOM 1075 NH1 ARG A 97 0.013 1.371 14.302 1.00 0.00 N ATOM 1076 NH2 ARG A 97 0.368 1.688 16.509 1.00 0.00 N ATOM 0 H ARG A 97 6.168 1.323 12.654 1.00 0.00 H new ATOM 0 HA ARG A 97 5.032 -0.229 10.563 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.624 -0.202 11.321 1.00 0.00 H new ATOM 0 HB3 ARG A 97 3.626 -1.347 12.191 1.00 0.00 H new ATOM 0 HG2 ARG A 97 3.970 0.521 13.967 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.684 1.394 13.157 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.161 -0.588 13.462 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.446 -1.439 14.295 1.00 0.00 H new ATOM 0 HE ARG A 97 2.184 0.028 16.216 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.257 0.913 13.424 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -0.754 2.043 14.331 1.00 0.00 H new ATOM 0 HH21 ARG A 97 0.890 1.478 17.360 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -0.399 2.360 16.534 1.00 0.00 H new ATOM 1090 N HIS A 98 4.131 2.665 11.913 1.00 0.00 N ATOM 1091 CA HIS A 98 3.809 4.081 11.571 1.00 0.00 C ATOM 1092 C HIS A 98 2.862 4.131 10.364 1.00 0.00 C ATOM 1093 O HIS A 98 2.689 5.159 9.742 1.00 0.00 O ATOM 1094 CB HIS A 98 5.101 4.848 11.266 1.00 0.00 C ATOM 1095 CG HIS A 98 5.672 4.408 9.947 1.00 0.00 C ATOM 1096 ND1 HIS A 98 6.498 3.300 9.830 1.00 0.00 N ATOM 1097 CD2 HIS A 98 5.549 4.920 8.680 1.00 0.00 C ATOM 1098 CE1 HIS A 98 6.836 3.183 8.534 1.00 0.00 C ATOM 1099 NE2 HIS A 98 6.285 4.146 7.790 1.00 0.00 N ATOM 0 H HIS A 98 4.116 2.453 12.911 1.00 0.00 H new ATOM 0 HA HIS A 98 3.313 4.549 12.421 1.00 0.00 H new ATOM 0 HB2 HIS A 98 4.899 5.919 11.243 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.829 4.678 12.060 1.00 0.00 H new ATOM 0 HD1 HIS A 98 6.795 2.686 10.589 1.00 0.00 H new ATOM 0 HD2 HIS A 98 4.969 5.791 8.415 1.00 0.00 H new ATOM 0 HE1 HIS A 98 7.475 2.405 8.142 1.00 0.00 H new ATOM 1107 N ALA A 99 2.252 3.023 10.026 1.00 0.00 N ATOM 1108 CA ALA A 99 1.324 3.003 8.862 1.00 0.00 C ATOM 1109 C ALA A 99 0.302 1.876 9.031 1.00 0.00 C ATOM 1110 O ALA A 99 0.612 0.798 9.511 1.00 0.00 O ATOM 1111 CB ALA A 99 2.124 2.766 7.580 1.00 0.00 C ATOM 0 H ALA A 99 2.359 2.131 10.509 1.00 0.00 H new ATOM 0 HA ALA A 99 0.803 3.959 8.803 1.00 0.00 H new ATOM 0 HB1 ALA A 99 1.447 2.751 6.726 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.852 3.567 7.452 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.644 1.811 7.647 1.00 0.00 H new ATOM 1117 N GLU A 100 -0.911 2.116 8.619 1.00 0.00 N ATOM 1118 CA GLU A 100 -1.971 1.073 8.726 1.00 0.00 C ATOM 1119 C GLU A 100 -2.962 1.266 7.581 1.00 0.00 C ATOM 1120 O GLU A 100 -3.197 2.374 7.139 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.698 1.208 10.067 1.00 0.00 C ATOM 1122 CG GLU A 100 -3.768 0.120 10.183 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.421 0.189 11.564 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.215 1.177 12.247 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.117 -0.750 11.917 1.00 0.00 O ATOM 0 H GLU A 100 -1.217 2.998 8.209 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.523 0.081 8.668 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.986 1.121 10.888 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.157 2.193 10.146 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.521 0.252 9.406 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.321 -0.862 10.030 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.539 0.198 7.092 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.516 0.307 5.964 1.00 0.00 C ATOM 1134 C PHE A 101 -5.924 0.011 6.477 1.00 0.00 C ATOM 1135 O PHE A 101 -6.119 -0.831 7.332 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.138 -0.700 4.879 1.00 0.00 C ATOM 1137 CG PHE A 101 -2.814 -0.299 4.276 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.772 0.662 3.260 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.628 -0.885 4.736 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.543 1.038 2.703 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.400 -0.508 4.180 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.358 0.453 3.163 1.00 0.00 C ATOM 0 H PHE A 101 -3.375 -0.751 7.427 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.493 1.315 5.551 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.071 -1.702 5.302 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -4.909 -0.731 4.109 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.687 1.114 2.905 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.661 -1.628 5.520 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.510 1.779 1.918 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.515 -0.958 4.536 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.589 0.743 2.733 1.00 0.00 H new ATOM 1152 N ARG A 102 -6.907 0.708 5.961 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.320 0.496 6.405 1.00 0.00 C ATOM 1154 C ARG A 102 -9.212 0.280 5.183 1.00 0.00 C ATOM 1155 O ARG A 102 -9.094 0.963 4.185 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.799 1.733 7.167 1.00 0.00 C ATOM 1157 CG ARG A 102 -10.215 1.496 7.697 1.00 0.00 C ATOM 1158 CD ARG A 102 -10.670 2.718 8.498 1.00 0.00 C ATOM 1159 NE ARG A 102 -11.980 2.427 9.154 1.00 0.00 N ATOM 1160 CZ ARG A 102 -13.102 2.652 8.523 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -13.090 3.109 7.300 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -14.241 2.415 9.116 1.00 0.00 N ATOM 0 H ARG A 102 -6.789 1.423 5.243 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.372 -0.379 7.052 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.122 1.947 7.994 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -8.787 2.603 6.511 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.900 1.315 6.868 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.235 0.607 8.327 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -9.923 2.971 9.251 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -10.765 3.582 7.840 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.999 2.050 10.102 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -12.202 3.292 6.833 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.969 3.283 6.812 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.254 2.055 10.070 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -15.118 2.590 8.625 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.114 -0.662 5.260 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.032 -0.924 4.113 1.00 0.00 C ATOM 1178 C LEU A 103 -12.301 -0.089 4.297 1.00 0.00 C ATOM 1179 O LEU A 103 -12.934 -0.136 5.332 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.392 -2.415 4.088 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.423 -2.701 2.985 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -11.896 -2.218 1.624 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.681 -4.211 2.930 1.00 0.00 C ATOM 0 H LEU A 103 -10.255 -1.264 6.071 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.549 -0.654 3.174 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.494 -3.009 3.918 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.794 -2.715 5.056 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.349 -2.170 3.208 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.637 -2.427 0.852 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.709 -1.145 1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.968 -2.739 1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.412 -4.427 2.150 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.749 -4.731 2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.066 -4.550 3.892 1.00 0.00 H new ATOM 1195 N GLU A 104 -12.671 0.683 3.302 1.00 0.00 N ATOM 1196 CA GLU A 104 -13.898 1.537 3.408 1.00 0.00 C ATOM 1197 C GLU A 104 -14.896 1.147 2.315 1.00 0.00 C ATOM 1198 O GLU A 104 -14.555 1.063 1.152 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.503 3.007 3.234 1.00 0.00 C ATOM 1200 CG GLU A 104 -14.736 3.895 3.415 1.00 0.00 C ATOM 1201 CD GLU A 104 -14.324 5.366 3.323 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -13.204 5.623 2.911 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -15.133 6.211 3.669 1.00 0.00 O ATOM 0 H GLU A 104 -12.172 0.759 2.415 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.359 1.390 4.385 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.738 3.277 3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.072 3.164 2.245 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -15.478 3.666 2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.202 3.696 4.380 1.00 0.00 H new ATOM 1210 N ASN A 105 -16.128 0.916 2.684 1.00 0.00 N ATOM 1211 CA ASN A 105 -17.164 0.536 1.678 1.00 0.00 C ATOM 1212 C ASN A 105 -16.657 -0.621 0.819 1.00 0.00 C ATOM 1213 O ASN A 105 -16.914 -1.776 1.098 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.468 1.738 0.781 1.00 0.00 C ATOM 1215 CG ASN A 105 -18.116 2.850 1.610 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -18.014 4.012 1.270 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -18.782 2.545 2.690 1.00 0.00 N ATOM 0 H ASN A 105 -16.464 0.975 3.645 1.00 0.00 H new ATOM 0 HA ASN A 105 -18.070 0.226 2.198 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -16.549 2.102 0.321 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -18.134 1.440 -0.029 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -19.216 3.281 3.247 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -18.869 1.570 2.977 1.00 0.00 H new ATOM 1224 N ASN A 106 -15.945 -0.322 -0.232 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.423 -1.396 -1.123 1.00 0.00 C ATOM 1226 C ASN A 106 -14.090 -0.947 -1.723 1.00 0.00 C ATOM 1227 O ASN A 106 -13.681 -1.415 -2.766 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.433 -1.651 -2.244 1.00 0.00 C ATOM 1229 CG ASN A 106 -17.609 -2.475 -1.710 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -18.739 -2.261 -2.100 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -17.391 -3.421 -0.836 1.00 0.00 N ATOM 0 H ASN A 106 -15.701 0.627 -0.514 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.273 -2.313 -0.553 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.794 -0.703 -2.643 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.951 -2.180 -3.066 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.169 -3.978 -0.483 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.443 -3.603 -0.507 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.414 -0.038 -1.068 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.102 0.459 -1.586 1.00 0.00 C ATOM 1240 C GLU A 107 -11.090 0.518 -0.443 1.00 0.00 C ATOM 1241 O GLU A 107 -11.403 0.911 0.663 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.289 1.858 -2.180 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.145 1.772 -3.448 1.00 0.00 C ATOM 1244 CD GLU A 107 -12.392 0.988 -4.526 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -11.179 0.903 -4.428 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -13.041 0.483 -5.426 1.00 0.00 O ATOM 0 H GLU A 107 -13.716 0.385 -0.190 1.00 0.00 H new ATOM 0 HA GLU A 107 -11.734 -0.218 -2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -12.767 2.512 -1.451 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -11.319 2.297 -2.414 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -14.094 1.284 -3.226 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -13.379 2.773 -3.809 1.00 0.00 H new ATOM 1253 N PHE A 108 -9.878 0.122 -0.710 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.829 0.136 0.344 1.00 0.00 C ATOM 1255 C PHE A 108 -8.359 1.571 0.585 1.00 0.00 C ATOM 1256 O PHE A 108 -8.360 2.394 -0.309 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.648 -0.715 -0.117 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.062 -2.165 -0.150 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.013 -2.935 1.018 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.502 -2.740 -1.349 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.402 -4.279 0.987 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -8.891 -4.083 -1.380 1.00 0.00 C ATOM 1263 CZ PHE A 108 -8.841 -4.853 -0.213 1.00 0.00 C ATOM 0 H PHE A 108 -9.567 -0.214 -1.622 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.237 -0.268 1.271 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.319 -0.396 -1.106 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.803 -0.581 0.558 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.675 -2.492 1.943 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.541 -2.146 -2.250 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.364 -4.873 1.888 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.230 -4.526 -2.305 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.141 -5.890 -0.237 1.00 0.00 H new ATOM 1273 N ASN A 109 -7.960 1.875 1.794 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.485 3.255 2.120 1.00 0.00 C ATOM 1275 C ASN A 109 -6.217 3.160 2.967 1.00 0.00 C ATOM 1276 O ASN A 109 -5.893 2.114 3.493 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.569 3.986 2.912 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.763 4.266 2.000 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.625 4.317 0.793 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -10.941 4.443 2.530 1.00 0.00 N ATOM 0 H ASN A 109 -7.943 1.221 2.576 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.273 3.800 1.200 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.882 3.382 3.764 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.175 4.921 3.311 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.747 4.624 1.932 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -11.056 4.400 3.543 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.497 4.249 3.100 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.238 4.242 3.913 1.00 0.00 C ATOM 1289 C VAL A 110 -4.316 5.349 4.970 1.00 0.00 C ATOM 1290 O VAL A 110 -4.662 6.478 4.678 1.00 0.00 O ATOM 1291 CB VAL A 110 -3.036 4.484 2.992 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -3.294 5.707 2.109 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.777 4.717 3.834 1.00 0.00 C ATOM 0 H VAL A 110 -5.729 5.148 2.678 1.00 0.00 H new ATOM 0 HA VAL A 110 -4.121 3.278 4.407 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.892 3.608 2.359 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.436 5.873 1.457 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -4.183 5.536 1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.447 6.584 2.738 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.925 4.888 3.176 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.923 5.588 4.473 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.586 3.841 4.453 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.995 5.022 6.198 1.00 0.00 N ATOM 1304 CA VAL A 111 -4.036 6.032 7.301 1.00 0.00 C ATOM 1305 C VAL A 111 -2.710 5.990 8.064 1.00 0.00 C ATOM 1306 O VAL A 111 -2.222 4.935 8.418 1.00 0.00 O ATOM 1307 CB VAL A 111 -5.194 5.696 8.250 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -5.088 6.535 9.529 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.523 6.002 7.552 1.00 0.00 C ATOM 0 H VAL A 111 -3.703 4.088 6.486 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.187 7.030 6.890 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.146 4.639 8.513 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.915 6.289 10.195 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -4.143 6.320 10.028 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -5.131 7.594 9.274 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.349 5.765 8.222 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.561 7.059 7.289 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.606 5.400 6.647 1.00 0.00 H new ATOM 1319 N ASP A 112 -2.123 7.133 8.317 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.823 7.179 9.057 1.00 0.00 C ATOM 1321 C ASP A 112 -1.075 7.624 10.500 1.00 0.00 C ATOM 1322 O ASP A 112 -1.876 8.501 10.760 1.00 0.00 O ATOM 1323 CB ASP A 112 0.111 8.171 8.364 1.00 0.00 C ATOM 1324 CG ASP A 112 0.481 7.630 6.987 1.00 0.00 C ATOM 1325 OD1 ASP A 112 0.436 6.421 6.818 1.00 0.00 O ATOM 1326 OD2 ASP A 112 0.800 8.432 6.125 1.00 0.00 O ATOM 0 H ASP A 112 -2.491 8.043 8.041 1.00 0.00 H new ATOM 0 HA ASP A 112 -0.364 6.190 9.063 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.376 9.142 8.268 1.00 0.00 H new ATOM 0 HB3 ASP A 112 1.009 8.322 8.962 1.00 0.00 H new ATOM 1331 N VAL A 113 -0.406 7.016 11.443 1.00 0.00 N ATOM 1332 CA VAL A 113 -0.608 7.383 12.879 1.00 0.00 C ATOM 1333 C VAL A 113 0.353 8.509 13.281 1.00 0.00 C ATOM 1334 O VAL A 113 1.539 8.449 13.031 1.00 0.00 O ATOM 1335 CB VAL A 113 -0.343 6.151 13.755 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -1.554 5.215 13.711 1.00 0.00 C ATOM 1337 CG2 VAL A 113 0.889 5.407 13.231 1.00 0.00 C ATOM 0 H VAL A 113 0.277 6.276 11.281 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.633 7.727 13.018 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.169 6.472 14.782 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -1.362 4.342 14.334 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.433 5.740 14.084 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.730 4.896 12.684 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.077 4.532 13.853 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.713 5.090 12.203 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.755 6.069 13.264 1.00 0.00 H new ATOM 1405 N THR A 119 3.175 7.965 6.144 1.00 0.00 N ATOM 1406 CA THR A 119 3.213 7.461 4.739 1.00 0.00 C ATOM 1407 C THR A 119 2.833 8.585 3.770 1.00 0.00 C ATOM 1408 O THR A 119 1.921 9.348 4.019 1.00 0.00 O ATOM 1409 CB THR A 119 2.218 6.306 4.585 1.00 0.00 C ATOM 1410 OG1 THR A 119 2.424 5.362 5.626 1.00 0.00 O ATOM 1411 CG2 THR A 119 2.423 5.630 3.234 1.00 0.00 C ATOM 0 HA THR A 119 4.221 7.114 4.512 1.00 0.00 H new ATOM 0 HB THR A 119 1.201 6.694 4.643 1.00 0.00 H new ATOM 0 HG1 THR A 119 1.685 5.416 6.267 1.00 0.00 H new ATOM 0 HG21 THR A 119 1.714 4.809 3.127 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.262 6.355 2.436 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.440 5.242 3.172 1.00 0.00 H new ATOM 1419 N TYR A 120 3.528 8.682 2.661 1.00 0.00 N ATOM 1420 CA TYR A 120 3.226 9.744 1.647 1.00 0.00 C ATOM 1421 C TYR A 120 2.848 9.084 0.320 1.00 0.00 C ATOM 1422 O TYR A 120 3.298 7.999 0.012 1.00 0.00 O ATOM 1423 CB TYR A 120 4.466 10.619 1.443 1.00 0.00 C ATOM 1424 CG TYR A 120 5.687 9.749 1.269 1.00 0.00 C ATOM 1425 CD1 TYR A 120 6.058 9.309 -0.008 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.457 9.393 2.382 1.00 0.00 C ATOM 1427 CE1 TYR A 120 7.196 8.510 -0.170 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.595 8.595 2.221 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.965 8.153 0.945 1.00 0.00 C ATOM 1430 OH TYR A 120 9.088 7.367 0.785 1.00 0.00 O ATOM 0 H TYR A 120 4.300 8.064 2.412 1.00 0.00 H new ATOM 0 HA TYR A 120 2.398 10.360 1.998 1.00 0.00 H new ATOM 0 HB2 TYR A 120 4.333 11.254 0.567 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.599 11.281 2.299 1.00 0.00 H new ATOM 0 HD1 TYR A 120 5.466 9.586 -0.868 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.173 9.735 3.366 1.00 0.00 H new ATOM 0 HE1 TYR A 120 7.481 8.169 -1.154 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.188 8.320 3.081 1.00 0.00 H new ATOM 0 HH TYR A 120 9.507 7.213 1.658 1.00 0.00 H new ATOM 1440 N VAL A 121 2.014 9.731 -0.463 1.00 0.00 N ATOM 1441 CA VAL A 121 1.585 9.149 -1.778 1.00 0.00 C ATOM 1442 C VAL A 121 1.980 10.090 -2.922 1.00 0.00 C ATOM 1443 O VAL A 121 1.718 11.277 -2.886 1.00 0.00 O ATOM 1444 CB VAL A 121 0.063 8.961 -1.769 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.629 10.325 -1.719 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.367 8.215 -3.036 1.00 0.00 C ATOM 0 H VAL A 121 1.610 10.642 -0.246 1.00 0.00 H new ATOM 0 HA VAL A 121 2.076 8.187 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.222 8.382 -0.890 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.710 10.185 -1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.327 10.854 -0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.344 10.910 -2.594 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.449 8.081 -3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.078 8.792 -3.914 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.119 7.240 -3.067 1.00 0.00 H new ATOM 1456 N ASN A 122 2.605 9.558 -3.938 1.00 0.00 N ATOM 1457 CA ASN A 122 3.023 10.395 -5.103 1.00 0.00 C ATOM 1458 C ASN A 122 3.681 11.695 -4.630 1.00 0.00 C ATOM 1459 O ASN A 122 3.940 11.889 -3.458 1.00 0.00 O ATOM 1460 CB ASN A 122 1.798 10.731 -5.953 1.00 0.00 C ATOM 1461 CG ASN A 122 1.287 9.460 -6.629 1.00 0.00 C ATOM 1462 OD1 ASN A 122 2.065 8.618 -7.034 1.00 0.00 O ATOM 1463 ND2 ASN A 122 0.003 9.281 -6.767 1.00 0.00 N ATOM 0 H ASN A 122 2.847 8.570 -4.012 1.00 0.00 H new ATOM 0 HA ASN A 122 3.746 9.831 -5.693 1.00 0.00 H new ATOM 0 HB2 ASN A 122 1.016 11.164 -5.329 1.00 0.00 H new ATOM 0 HB3 ASN A 122 2.056 11.477 -6.704 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.349 8.435 -7.215 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.650 9.987 -6.427 1.00 0.00 H new ATOM 1470 N ARG A 123 3.957 12.584 -5.549 1.00 0.00 N ATOM 1471 CA ARG A 123 4.605 13.877 -5.190 1.00 0.00 C ATOM 1472 C ARG A 123 3.725 14.649 -4.202 1.00 0.00 C ATOM 1473 O ARG A 123 4.079 15.720 -3.752 1.00 0.00 O ATOM 1474 CB ARG A 123 4.821 14.707 -6.463 1.00 0.00 C ATOM 1475 CG ARG A 123 3.472 15.032 -7.117 1.00 0.00 C ATOM 1476 CD ARG A 123 3.706 15.829 -8.405 1.00 0.00 C ATOM 1477 NE ARG A 123 2.390 16.185 -9.010 1.00 0.00 N ATOM 1478 CZ ARG A 123 2.344 16.905 -10.097 1.00 0.00 C ATOM 1479 NH1 ARG A 123 3.448 17.314 -10.660 1.00 0.00 N ATOM 1480 NH2 ARG A 123 1.190 17.218 -10.622 1.00 0.00 N ATOM 0 H ARG A 123 3.758 12.466 -6.542 1.00 0.00 H new ATOM 0 HA ARG A 123 5.568 13.681 -4.719 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.347 15.630 -6.220 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.450 14.157 -7.163 1.00 0.00 H new ATOM 0 HG2 ARG A 123 2.933 14.111 -7.340 1.00 0.00 H new ATOM 0 HG3 ARG A 123 2.852 15.606 -6.429 1.00 0.00 H new ATOM 0 HD2 ARG A 123 4.276 16.732 -8.189 1.00 0.00 H new ATOM 0 HD3 ARG A 123 4.295 15.241 -9.108 1.00 0.00 H new ATOM 0 HE ARG A 123 1.525 15.865 -8.574 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.350 17.071 -10.250 1.00 0.00 H new ATOM 0 HH12 ARG A 123 3.409 17.877 -11.510 1.00 0.00 H new ATOM 0 HH21 ARG A 123 0.326 16.900 -10.182 1.00 0.00 H new ATOM 0 HH22 ARG A 123 1.152 17.781 -11.472 1.00 0.00 H new ATOM 1494 N GLU A 124 2.577 14.113 -3.867 1.00 0.00 N ATOM 1495 CA GLU A 124 1.656 14.805 -2.908 1.00 0.00 C ATOM 1496 C GLU A 124 1.628 14.032 -1.576 1.00 0.00 C ATOM 1497 O GLU A 124 0.883 13.082 -1.437 1.00 0.00 O ATOM 1498 CB GLU A 124 0.246 14.821 -3.507 1.00 0.00 C ATOM 1499 CG GLU A 124 0.306 15.340 -4.948 1.00 0.00 C ATOM 1500 CD GLU A 124 -1.095 15.751 -5.408 1.00 0.00 C ATOM 1501 OE1 GLU A 124 -2.012 14.968 -5.223 1.00 0.00 O ATOM 1502 OE2 GLU A 124 -1.225 16.842 -5.938 1.00 0.00 O ATOM 0 H GLU A 124 2.235 13.219 -4.219 1.00 0.00 H new ATOM 0 HA GLU A 124 2.002 15.823 -2.731 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.179 13.818 -3.488 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.407 15.455 -2.908 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.984 16.191 -5.010 1.00 0.00 H new ATOM 0 HG3 GLU A 124 0.703 14.568 -5.607 1.00 0.00 H new ATOM 1509 N PRO A 125 2.429 14.416 -0.599 1.00 0.00 N ATOM 1510 CA PRO A 125 2.463 13.709 0.715 1.00 0.00 C ATOM 1511 C PRO A 125 1.278 14.104 1.605 1.00 0.00 C ATOM 1512 O PRO A 125 1.019 15.271 1.822 1.00 0.00 O ATOM 1513 CB PRO A 125 3.797 14.158 1.330 1.00 0.00 C ATOM 1514 CG PRO A 125 4.057 15.516 0.752 1.00 0.00 C ATOM 1515 CD PRO A 125 3.380 15.549 -0.629 1.00 0.00 C ATOM 0 HA PRO A 125 2.386 12.627 0.609 1.00 0.00 H new ATOM 0 HB2 PRO A 125 3.736 14.198 2.418 1.00 0.00 H new ATOM 0 HB3 PRO A 125 4.599 13.464 1.081 1.00 0.00 H new ATOM 0 HG2 PRO A 125 3.654 16.295 1.399 1.00 0.00 H new ATOM 0 HG3 PRO A 125 5.128 15.699 0.662 1.00 0.00 H new ATOM 0 HD2 PRO A 125 2.866 16.495 -0.797 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.109 15.435 -1.432 1.00 0.00 H new ATOM 1523 N VAL A 126 0.550 13.139 2.112 1.00 0.00 N ATOM 1524 CA VAL A 126 -0.632 13.453 2.979 1.00 0.00 C ATOM 1525 C VAL A 126 -0.694 12.489 4.163 1.00 0.00 C ATOM 1526 O VAL A 126 -0.088 11.435 4.158 1.00 0.00 O ATOM 1527 CB VAL A 126 -1.914 13.313 2.158 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -1.902 14.330 1.014 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -2.007 11.890 1.589 1.00 0.00 C ATOM 0 H VAL A 126 0.723 12.145 1.963 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.533 14.473 3.352 1.00 0.00 H new ATOM 0 HB VAL A 126 -2.777 13.501 2.796 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.816 14.230 0.429 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.842 15.338 1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -1.039 14.147 0.373 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.921 11.791 1.004 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -1.145 11.696 0.951 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -2.021 11.171 2.408 1.00 0.00 H new ATOM 1539 N ASP A 127 -1.434 12.846 5.177 1.00 0.00 N ATOM 1540 CA ASP A 127 -1.555 11.961 6.369 1.00 0.00 C ATOM 1541 C ASP A 127 -2.462 10.772 6.035 1.00 0.00 C ATOM 1542 O ASP A 127 -2.403 9.737 6.669 1.00 0.00 O ATOM 1543 CB ASP A 127 -2.164 12.758 7.523 1.00 0.00 C ATOM 1544 CG ASP A 127 -1.158 13.806 8.003 1.00 0.00 C ATOM 1545 OD1 ASP A 127 0.007 13.676 7.667 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -1.569 14.719 8.699 1.00 0.00 O ATOM 0 H ASP A 127 -1.962 13.717 5.231 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.570 11.593 6.655 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.085 13.243 7.199 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -2.428 12.089 8.342 1.00 0.00 H new ATOM 1551 N SER A 128 -3.306 10.912 5.046 1.00 0.00 N ATOM 1552 CA SER A 128 -4.217 9.790 4.679 1.00 0.00 C ATOM 1553 C SER A 128 -4.774 10.019 3.271 1.00 0.00 C ATOM 1554 O SER A 128 -4.771 11.124 2.765 1.00 0.00 O ATOM 1555 CB SER A 128 -5.374 9.731 5.677 1.00 0.00 C ATOM 1556 OG SER A 128 -6.135 10.929 5.581 1.00 0.00 O ATOM 0 H SER A 128 -3.403 11.754 4.478 1.00 0.00 H new ATOM 0 HA SER A 128 -3.663 8.851 4.701 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.005 8.867 5.470 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.991 9.610 6.690 1.00 0.00 H new ATOM 0 HG SER A 128 -6.879 10.896 6.218 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.259 8.985 2.635 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.822 9.153 1.263 1.00 0.00 C ATOM 1564 C ALA A 129 -6.476 7.844 0.810 1.00 0.00 C ATOM 1565 O ALA A 129 -6.284 6.801 1.404 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.702 9.543 0.288 1.00 0.00 C ATOM 0 H ALA A 129 -5.290 8.035 3.005 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.574 9.942 1.276 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.117 9.665 -0.713 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -4.250 10.481 0.610 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.943 8.760 0.274 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.253 7.898 -0.240 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.931 6.668 -0.745 1.00 0.00 C ATOM 1574 C VAL A 130 -7.040 5.983 -1.784 1.00 0.00 C ATOM 1575 O VAL A 130 -6.540 6.607 -2.699 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.266 7.063 -1.383 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.882 5.856 -2.097 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.220 7.548 -0.289 1.00 0.00 C ATOM 0 H VAL A 130 -7.448 8.746 -0.772 1.00 0.00 H new ATOM 0 HA VAL A 130 -8.110 5.977 0.079 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.098 7.859 -2.109 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.831 6.145 -2.548 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.202 5.507 -2.874 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -10.052 5.055 -1.377 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -11.173 7.831 -0.736 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.382 6.748 0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.786 8.411 0.216 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.831 4.703 -1.642 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.967 3.972 -2.612 1.00 0.00 C ATOM 1590 C LEU A 131 -6.744 3.704 -3.903 1.00 0.00 C ATOM 1591 O LEU A 131 -7.946 3.524 -3.896 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.528 2.639 -2.000 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.674 2.890 -0.750 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.361 1.547 -0.082 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.359 3.600 -1.132 1.00 0.00 C ATOM 0 H LEU A 131 -7.222 4.130 -0.894 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.091 4.580 -2.838 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.403 2.044 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.958 2.065 -2.730 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.225 3.529 -0.060 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.754 1.716 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.292 1.056 0.202 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.814 0.913 -0.779 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.764 3.771 -0.235 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.797 2.976 -1.827 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.586 4.556 -1.605 1.00 0.00 H new ATOM 1607 N ALA A 132 -6.057 3.671 -5.016 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.735 3.410 -6.318 1.00 0.00 C ATOM 1609 C ALA A 132 -5.745 2.728 -7.266 1.00 0.00 C ATOM 1610 O ALA A 132 -4.549 2.896 -7.154 1.00 0.00 O ATOM 1611 CB ALA A 132 -7.207 4.732 -6.928 1.00 0.00 C ATOM 0 H ALA A 132 -5.049 3.815 -5.077 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.599 2.764 -6.161 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.702 4.537 -7.879 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.907 5.217 -6.248 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -6.349 5.384 -7.092 1.00 0.00 H new ATOM 1617 N ASN A 133 -6.238 1.953 -8.192 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.334 1.240 -9.141 1.00 0.00 C ATOM 1619 C ASN A 133 -4.356 2.225 -9.791 1.00 0.00 C ATOM 1620 O ASN A 133 -4.732 3.288 -10.243 1.00 0.00 O ATOM 1621 CB ASN A 133 -6.183 0.571 -10.224 1.00 0.00 C ATOM 1622 CG ASN A 133 -5.351 -0.478 -10.962 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -4.518 -1.137 -10.372 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -5.546 -0.662 -12.238 1.00 0.00 N ATOM 0 H ASN A 133 -7.233 1.781 -8.334 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.760 0.490 -8.597 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -7.059 0.103 -9.775 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.547 1.320 -10.927 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -4.999 -1.360 -12.742 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -6.246 -0.108 -12.732 1.00 0.00 H new ATOM 1631 N GLY A 134 -3.098 1.866 -9.846 1.00 0.00 N ATOM 1632 CA GLY A 134 -2.076 2.762 -10.467 1.00 0.00 C ATOM 1633 C GLY A 134 -1.509 3.701 -9.406 1.00 0.00 C ATOM 1634 O GLY A 134 -0.815 4.651 -9.710 1.00 0.00 O ATOM 0 H GLY A 134 -2.733 0.985 -9.485 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.275 2.168 -10.907 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.526 3.339 -11.275 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.797 3.443 -8.157 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.271 4.324 -7.071 1.00 0.00 C ATOM 1640 C ASP A 135 0.096 3.816 -6.611 1.00 0.00 C ATOM 1641 O ASP A 135 0.371 2.633 -6.640 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.251 4.334 -5.889 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.431 5.261 -6.199 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.395 5.920 -7.227 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -4.347 5.308 -5.396 1.00 0.00 O ATOM 0 H ASP A 135 -2.373 2.662 -7.842 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.164 5.340 -7.452 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.612 3.324 -5.696 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.742 4.669 -4.985 1.00 0.00 H new ATOM 1650 N GLU A 136 0.953 4.712 -6.185 1.00 0.00 N ATOM 1651 CA GLU A 136 2.314 4.313 -5.713 1.00 0.00 C ATOM 1652 C GLU A 136 2.418 4.562 -4.209 1.00 0.00 C ATOM 1653 O GLU A 136 2.127 5.639 -3.729 1.00 0.00 O ATOM 1654 CB GLU A 136 3.370 5.156 -6.431 1.00 0.00 C ATOM 1655 CG GLU A 136 3.405 4.777 -7.913 1.00 0.00 C ATOM 1656 CD GLU A 136 4.406 5.673 -8.644 1.00 0.00 C ATOM 1657 OE1 GLU A 136 5.033 6.488 -7.986 1.00 0.00 O ATOM 1658 OE2 GLU A 136 4.530 5.530 -9.849 1.00 0.00 O ATOM 0 H GLU A 136 0.764 5.714 -6.144 1.00 0.00 H new ATOM 0 HA GLU A 136 2.478 3.257 -5.928 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.141 6.216 -6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.349 4.993 -5.980 1.00 0.00 H new ATOM 0 HG2 GLU A 136 3.688 3.730 -8.025 1.00 0.00 H new ATOM 0 HG3 GLU A 136 2.413 4.888 -8.351 1.00 0.00 H new ATOM 1665 N VAL A 137 2.829 3.566 -3.464 1.00 0.00 N ATOM 1666 CA VAL A 137 2.961 3.716 -1.981 1.00 0.00 C ATOM 1667 C VAL A 137 4.383 3.344 -1.560 1.00 0.00 C ATOM 1668 O VAL A 137 4.896 2.308 -1.933 1.00 0.00 O ATOM 1669 CB VAL A 137 1.968 2.780 -1.291 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.138 2.878 0.226 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.542 3.184 -1.669 1.00 0.00 C ATOM 0 H VAL A 137 3.081 2.646 -3.824 1.00 0.00 H new ATOM 0 HA VAL A 137 2.753 4.747 -1.696 1.00 0.00 H new ATOM 0 HB VAL A 137 2.155 1.755 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.429 2.210 0.715 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.154 2.591 0.498 1.00 0.00 H new ATOM 0 HG13 VAL A 137 1.952 3.903 0.547 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.167 2.518 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.358 4.210 -1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.418 3.113 -2.750 1.00 0.00 H new ATOM 1681 N GLN A 138 5.019 4.183 -0.779 1.00 0.00 N ATOM 1682 CA GLN A 138 6.413 3.896 -0.313 1.00 0.00 C ATOM 1683 C GLN A 138 6.461 3.981 1.213 1.00 0.00 C ATOM 1684 O GLN A 138 6.130 4.997 1.793 1.00 0.00 O ATOM 1685 CB GLN A 138 7.373 4.932 -0.905 1.00 0.00 C ATOM 1686 CG GLN A 138 8.796 4.631 -0.433 1.00 0.00 C ATOM 1687 CD GLN A 138 9.782 5.552 -1.153 1.00 0.00 C ATOM 1688 OE1 GLN A 138 9.456 6.139 -2.165 1.00 0.00 O ATOM 1689 NE2 GLN A 138 10.983 5.705 -0.667 1.00 0.00 N ATOM 0 H GLN A 138 4.629 5.063 -0.441 1.00 0.00 H new ATOM 0 HA GLN A 138 6.708 2.898 -0.637 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.326 4.908 -1.994 1.00 0.00 H new ATOM 0 HB3 GLN A 138 7.080 5.935 -0.596 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.870 4.774 0.645 1.00 0.00 H new ATOM 0 HG3 GLN A 138 9.044 3.589 -0.634 1.00 0.00 H new ATOM 0 HE21 GLN A 138 11.256 5.212 0.183 1.00 0.00 H new ATOM 0 HE22 GLN A 138 11.649 6.318 -1.137 1.00 0.00 H new ATOM 1698 N ILE A 139 6.872 2.919 1.865 1.00 0.00 N ATOM 1699 CA ILE A 139 6.954 2.917 3.362 1.00 0.00 C ATOM 1700 C ILE A 139 8.375 2.559 3.806 1.00 0.00 C ATOM 1701 O ILE A 139 8.945 1.578 3.374 1.00 0.00 O ATOM 1702 CB ILE A 139 5.967 1.890 3.928 1.00 0.00 C ATOM 1703 CG1 ILE A 139 4.534 2.359 3.647 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.179 1.747 5.437 1.00 0.00 C ATOM 1705 CD1 ILE A 139 3.544 1.253 4.018 1.00 0.00 C ATOM 0 H ILE A 139 7.157 2.046 1.421 1.00 0.00 H new ATOM 0 HA ILE A 139 6.702 3.910 3.735 1.00 0.00 H new ATOM 0 HB ILE A 139 6.133 0.923 3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.318 3.260 4.220 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.426 2.618 2.594 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.475 1.016 5.836 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.198 1.413 5.631 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.014 2.710 5.920 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.528 1.592 3.816 1.00 0.00 H new ATOM 0 HD12 ILE A 139 3.754 0.363 3.425 1.00 0.00 H new ATOM 0 HD13 ILE A 139 3.644 1.016 5.077 1.00 0.00 H new ATOM 1717 N GLY A 140 8.943 3.348 4.679 1.00 0.00 N ATOM 1718 CA GLY A 140 10.321 3.055 5.169 1.00 0.00 C ATOM 1719 C GLY A 140 11.337 3.302 4.054 1.00 0.00 C ATOM 1720 O GLY A 140 11.620 4.429 3.699 1.00 0.00 O ATOM 0 H GLY A 140 8.511 4.183 5.074 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.552 3.685 6.028 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.383 2.020 5.506 1.00 0.00 H new ATOM 1724 N LYS A 141 11.896 2.248 3.509 1.00 0.00 N ATOM 1725 CA LYS A 141 12.910 2.390 2.418 1.00 0.00 C ATOM 1726 C LYS A 141 12.477 1.550 1.214 1.00 0.00 C ATOM 1727 O LYS A 141 12.831 1.835 0.087 1.00 0.00 O ATOM 1728 CB LYS A 141 14.263 1.888 2.927 1.00 0.00 C ATOM 1729 CG LYS A 141 15.337 2.142 1.868 1.00 0.00 C ATOM 1730 CD LYS A 141 16.697 1.682 2.398 1.00 0.00 C ATOM 1731 CE LYS A 141 17.773 1.950 1.344 1.00 0.00 C ATOM 1732 NZ LYS A 141 19.100 1.510 1.862 1.00 0.00 N ATOM 0 H LYS A 141 11.690 1.286 3.777 1.00 0.00 H new ATOM 0 HA LYS A 141 12.992 3.436 2.122 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.525 2.397 3.855 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.205 0.823 3.153 1.00 0.00 H new ATOM 0 HG2 LYS A 141 15.092 1.606 0.951 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.372 3.202 1.618 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.937 2.210 3.321 1.00 0.00 H new ATOM 0 HD3 LYS A 141 16.665 0.619 2.638 1.00 0.00 H new ATOM 0 HE2 LYS A 141 17.536 1.417 0.423 1.00 0.00 H new ATOM 0 HE3 LYS A 141 17.801 3.012 1.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 19.831 1.693 1.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 19.327 2.038 2.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 19.070 0.492 2.074 1.00 0.00 H new ATOM 1746 N PHE A 142 11.714 0.517 1.443 1.00 0.00 N ATOM 1747 CA PHE A 142 11.262 -0.339 0.312 1.00 0.00 C ATOM 1748 C PHE A 142 10.175 0.390 -0.481 1.00 0.00 C ATOM 1749 O PHE A 142 9.389 1.141 0.062 1.00 0.00 O ATOM 1750 CB PHE A 142 10.707 -1.658 0.854 1.00 0.00 C ATOM 1751 CG PHE A 142 11.851 -2.545 1.301 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.725 -3.083 0.349 1.00 0.00 C ATOM 1753 CD2 PHE A 142 12.035 -2.832 2.660 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.782 -3.906 0.753 1.00 0.00 C ATOM 1755 CE2 PHE A 142 13.093 -3.656 3.064 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.965 -4.193 2.111 1.00 0.00 C ATOM 0 H PHE A 142 11.384 0.229 2.364 1.00 0.00 H new ATOM 0 HA PHE A 142 12.108 -0.547 -0.343 1.00 0.00 H new ATOM 0 HB2 PHE A 142 10.035 -1.465 1.690 1.00 0.00 H new ATOM 0 HB3 PHE A 142 10.122 -2.162 0.084 1.00 0.00 H new ATOM 0 HD1 PHE A 142 12.583 -2.863 -0.699 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.361 -2.418 3.396 1.00 0.00 H new ATOM 0 HE1 PHE A 142 14.456 -4.320 0.018 1.00 0.00 H new ATOM 0 HE2 PHE A 142 13.236 -3.877 4.112 1.00 0.00 H new ATOM 0 HZ PHE A 142 14.780 -4.829 2.423 1.00 0.00 H new ATOM 1766 N ARG A 143 10.135 0.175 -1.770 1.00 0.00 N ATOM 1767 CA ARG A 143 9.113 0.848 -2.630 1.00 0.00 C ATOM 1768 C ARG A 143 8.018 -0.156 -2.992 1.00 0.00 C ATOM 1769 O ARG A 143 8.293 -1.304 -3.276 1.00 0.00 O ATOM 1770 CB ARG A 143 9.794 1.321 -3.912 1.00 0.00 C ATOM 1771 CG ARG A 143 10.848 2.371 -3.569 1.00 0.00 C ATOM 1772 CD ARG A 143 11.658 2.700 -4.821 1.00 0.00 C ATOM 1773 NE ARG A 143 10.779 3.360 -5.826 1.00 0.00 N ATOM 1774 CZ ARG A 143 11.231 3.596 -7.025 1.00 0.00 C ATOM 1775 NH1 ARG A 143 12.450 3.255 -7.337 1.00 0.00 N ATOM 1776 NH2 ARG A 143 10.466 4.174 -7.910 1.00 0.00 N ATOM 0 H ARG A 143 10.773 -0.444 -2.270 1.00 0.00 H new ATOM 0 HA ARG A 143 8.675 1.693 -2.098 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.258 0.477 -4.423 1.00 0.00 H new ATOM 0 HB3 ARG A 143 9.056 1.741 -4.595 1.00 0.00 H new ATOM 0 HG2 ARG A 143 10.369 3.272 -3.185 1.00 0.00 H new ATOM 0 HG3 ARG A 143 11.506 2.000 -2.783 1.00 0.00 H new ATOM 0 HD2 ARG A 143 12.491 3.355 -4.566 1.00 0.00 H new ATOM 0 HD3 ARG A 143 12.086 1.789 -5.240 1.00 0.00 H new ATOM 0 HE ARG A 143 9.827 3.626 -5.577 1.00 0.00 H new ATOM 0 HH11 ARG A 143 13.047 2.805 -6.643 1.00 0.00 H new ATOM 0 HH12 ARG A 143 12.807 3.438 -8.275 1.00 0.00 H new ATOM 0 HH21 ARG A 143 9.513 4.442 -7.663 1.00 0.00 H new ATOM 0 HH22 ARG A 143 10.821 4.358 -8.848 1.00 0.00 H new ATOM 1790 N LEU A 144 6.779 0.268 -2.989 1.00 0.00 N ATOM 1791 CA LEU A 144 5.660 -0.660 -3.342 1.00 0.00 C ATOM 1792 C LEU A 144 4.676 0.053 -4.267 1.00 0.00 C ATOM 1793 O LEU A 144 4.327 1.197 -4.051 1.00 0.00 O ATOM 1794 CB LEU A 144 4.925 -1.099 -2.068 1.00 0.00 C ATOM 1795 CG LEU A 144 5.878 -1.905 -1.146 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.488 -0.984 -0.086 1.00 0.00 C ATOM 1797 CD2 LEU A 144 5.103 -3.026 -0.438 1.00 0.00 C ATOM 0 H LEU A 144 6.493 1.219 -2.757 1.00 0.00 H new ATOM 0 HA LEU A 144 6.070 -1.536 -3.845 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.549 -0.224 -1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 144 4.061 -1.709 -2.331 1.00 0.00 H new ATOM 0 HG LEU A 144 6.669 -2.335 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.155 -1.560 0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 144 7.051 -0.189 -0.575 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.692 -0.546 0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.781 -3.586 0.207 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.305 -2.592 0.164 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.673 -3.697 -1.182 1.00 0.00 H new ATOM 1809 N VAL A 145 4.210 -0.625 -5.288 1.00 0.00 N ATOM 1810 CA VAL A 145 3.228 -0.007 -6.232 1.00 0.00 C ATOM 1811 C VAL A 145 1.871 -0.676 -6.017 1.00 0.00 C ATOM 1812 O VAL A 145 1.761 -1.885 -5.976 1.00 0.00 O ATOM 1813 CB VAL A 145 3.695 -0.217 -7.678 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.675 -1.706 -8.023 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.763 0.542 -8.628 1.00 0.00 C ATOM 0 H VAL A 145 4.470 -1.586 -5.509 1.00 0.00 H new ATOM 0 HA VAL A 145 3.149 1.064 -6.047 1.00 0.00 H new ATOM 0 HB VAL A 145 4.713 0.159 -7.784 1.00 0.00 H new ATOM 0 HG11 VAL A 145 4.008 -1.846 -9.051 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.342 -2.245 -7.349 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.661 -2.091 -7.914 1.00 0.00 H new ATOM 0 HG21 VAL A 145 3.093 0.394 -9.656 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.746 0.167 -8.516 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.787 1.605 -8.389 1.00 0.00 H new ATOM 1825 N PHE A 146 0.836 0.104 -5.854 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.516 -0.480 -5.613 1.00 0.00 C ATOM 1827 C PHE A 146 -1.229 -0.716 -6.947 1.00 0.00 C ATOM 1828 O PHE A 146 -1.606 0.215 -7.643 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.323 0.501 -4.763 1.00 0.00 C ATOM 1830 CG PHE A 146 -2.740 0.010 -4.606 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -3.710 0.380 -5.542 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.089 -0.799 -3.518 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -5.031 -0.056 -5.394 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -4.410 -1.238 -3.370 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.380 -0.865 -4.308 1.00 0.00 C ATOM 0 H PHE A 146 0.868 1.123 -5.877 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.421 -1.434 -5.095 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -0.858 0.612 -3.783 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.321 1.486 -5.231 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -3.439 1.004 -6.381 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -2.340 -1.084 -2.794 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.780 0.232 -6.117 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.681 -1.864 -2.533 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.399 -1.203 -4.193 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.417 -1.967 -7.296 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.104 -2.321 -8.576 1.00 0.00 C ATOM 1847 C LEU A 147 -3.036 -3.521 -8.352 1.00 0.00 C ATOM 1848 O LEU A 147 -2.904 -4.262 -7.394 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.052 -2.666 -9.640 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.405 -1.376 -10.181 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.910 -1.719 -10.889 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -1.343 -0.683 -11.189 1.00 0.00 C ATOM 0 H LEU A 147 -1.119 -2.768 -6.739 1.00 0.00 H new ATOM 0 HA LEU A 147 -2.697 -1.472 -8.917 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.287 -3.313 -9.210 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -1.516 -3.219 -10.456 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.218 -0.706 -9.342 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.366 -0.806 -11.271 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.590 -2.196 -10.183 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.711 -2.399 -11.717 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.870 0.226 -11.561 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.542 -1.356 -12.023 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.282 -0.428 -10.697 1.00 0.00 H new ATOM 1864 N THR A 148 -3.990 -3.699 -9.228 1.00 0.00 N ATOM 1865 CA THR A 148 -4.959 -4.830 -9.091 1.00 0.00 C ATOM 1866 C THR A 148 -4.513 -6.021 -9.947 1.00 0.00 C ATOM 1867 O THR A 148 -3.627 -5.909 -10.771 1.00 0.00 O ATOM 1868 CB THR A 148 -6.334 -4.357 -9.563 1.00 0.00 C ATOM 1869 OG1 THR A 148 -6.265 -4.010 -10.940 1.00 0.00 O ATOM 1870 CG2 THR A 148 -6.757 -3.137 -8.744 1.00 0.00 C ATOM 0 H THR A 148 -4.142 -3.103 -10.042 1.00 0.00 H new ATOM 0 HA THR A 148 -5.002 -5.144 -8.048 1.00 0.00 H new ATOM 0 HB THR A 148 -7.065 -5.154 -9.428 1.00 0.00 H new ATOM 0 HG1 THR A 148 -7.146 -3.708 -11.246 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.737 -2.797 -9.078 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.806 -3.406 -7.689 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.029 -2.337 -8.881 1.00 0.00 H new