USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=14 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= -3.22! K(o=-3.2!,f=1.1) USER MOD Set 1.2: A 148 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 120 TYR OH : rot -29:sc= -0.354! USER MOD Set 2.2: A 138 GLN : amide:sc= 0.702 K(o=0.35,f=-6.5!) USER MOD Set 3.1: A 105 ASN : amide:sc= -0.663 K(o=-3.8,f=-2.5) USER MOD Set 3.2: A 109 ASN : amide:sc= -3.18 K(o=-3.8,f=-6.1!) USER MOD Set 4.1: A 74 GLN : amide:sc= -7.73! C(o=-9.5!,f=-14!) USER MOD Set 4.2: A 77 THR OG1 : rot 69:sc= -1.78! USER MOD Single : A 61 LYS NZ :NH3+ -160:sc= -0.0585 (180deg=-0.549) USER MOD Single : A 65 ASN : amide:sc=-0.00112 K(o=-0.0011,f=-1.1) USER MOD Single : A 68 SER OG : rot 180:sc= -0.0121 USER MOD Single : A 78 SER OG : rot -120:sc= -0.0436 USER MOD Single : A 82 HIS : no HE2:sc= -2.48! C(o=-2.5!,f=-5.4!) USER MOD Single : A 85 SER OG : rot -98:sc= 0.479 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 23:sc= -0.0551 USER MOD Single : A 98 HIS : no HE2:sc= -12! C(o=-12!,f=-21!) USER MOD Single : A 106 ASN : amide:sc= -4.31! C(o=-4.3!,f=-4.6!) USER MOD Single : A 119 THR OG1 : rot 26:sc= 0.273 USER MOD Single : A 122 ASN : amide:sc= -0.0739 K(o=-0.074,f=-1.9!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 163:sc= -0.0345 (180deg=-0.402) USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -13.048 -5.576 -5.170 1.00 0.00 N ATOM 417 CA GLY A 54 -13.170 -5.922 -3.721 1.00 0.00 C ATOM 418 C GLY A 54 -11.876 -6.582 -3.238 1.00 0.00 C ATOM 419 O GLY A 54 -11.640 -6.695 -2.052 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.371 -5.023 -3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.013 -6.596 -3.568 1.00 0.00 H new ATOM 423 N LEU A 55 -11.035 -7.012 -4.150 1.00 0.00 N ATOM 424 CA LEU A 55 -9.743 -7.665 -3.760 1.00 0.00 C ATOM 425 C LEU A 55 -8.580 -6.890 -4.380 1.00 0.00 C ATOM 426 O LEU A 55 -8.674 -6.395 -5.486 1.00 0.00 O ATOM 427 CB LEU A 55 -9.740 -9.112 -4.262 1.00 0.00 C ATOM 428 CG LEU A 55 -10.866 -9.897 -3.566 1.00 0.00 C ATOM 429 CD1 LEU A 55 -11.009 -11.274 -4.223 1.00 0.00 C ATOM 430 CD2 LEU A 55 -10.554 -10.073 -2.066 1.00 0.00 C ATOM 0 H LEU A 55 -11.190 -6.938 -5.155 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.635 -7.662 -2.675 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.881 -9.134 -5.343 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.776 -9.578 -4.057 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.797 -9.340 -3.668 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.806 -11.831 -3.731 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.251 -11.150 -5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.071 -11.822 -4.128 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.361 -10.630 -1.590 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.618 -10.620 -1.951 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.463 -9.094 -1.596 1.00 0.00 H new ATOM 442 N ALA A 56 -7.484 -6.767 -3.673 1.00 0.00 N ATOM 443 CA ALA A 56 -6.326 -6.009 -4.222 1.00 0.00 C ATOM 444 C ALA A 56 -5.014 -6.618 -3.727 1.00 0.00 C ATOM 445 O ALA A 56 -4.966 -7.261 -2.696 1.00 0.00 O ATOM 446 CB ALA A 56 -6.412 -4.559 -3.759 1.00 0.00 C ATOM 0 H ALA A 56 -7.345 -7.159 -2.742 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.352 -6.057 -5.311 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.566 -3.999 -4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.342 -4.117 -4.118 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.390 -4.523 -2.670 1.00 0.00 H new ATOM 452 N LEU A 57 -3.951 -6.419 -4.471 1.00 0.00 N ATOM 453 CA LEU A 57 -2.622 -6.977 -4.087 1.00 0.00 C ATOM 454 C LEU A 57 -1.577 -5.864 -4.084 1.00 0.00 C ATOM 455 O LEU A 57 -1.728 -4.857 -4.748 1.00 0.00 O ATOM 456 CB LEU A 57 -2.211 -8.055 -5.106 1.00 0.00 C ATOM 457 CG LEU A 57 -3.462 -8.798 -5.621 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.074 -8.049 -6.827 1.00 0.00 C ATOM 459 CD2 LEU A 57 -3.073 -10.225 -6.035 1.00 0.00 C ATOM 0 H LEU A 57 -3.952 -5.885 -5.340 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.688 -7.414 -3.091 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.681 -7.595 -5.941 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.523 -8.762 -4.642 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.205 -8.839 -4.825 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.955 -8.585 -7.179 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.359 -7.042 -6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.340 -7.991 -7.630 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.955 -10.752 -6.399 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.324 -10.183 -6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.664 -10.755 -5.175 1.00 0.00 H new ATOM 471 N LEU A 58 -0.509 -6.057 -3.353 1.00 0.00 N ATOM 472 CA LEU A 58 0.582 -5.038 -3.302 1.00 0.00 C ATOM 473 C LEU A 58 1.858 -5.652 -3.867 1.00 0.00 C ATOM 474 O LEU A 58 2.267 -6.719 -3.460 1.00 0.00 O ATOM 475 CB LEU A 58 0.803 -4.625 -1.837 1.00 0.00 C ATOM 476 CG LEU A 58 -0.162 -3.483 -1.459 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.441 -3.510 0.047 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.474 -2.134 -1.824 1.00 0.00 C ATOM 0 H LEU A 58 -0.345 -6.887 -2.783 1.00 0.00 H new ATOM 0 HA LEU A 58 0.313 -4.161 -3.891 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.642 -5.481 -1.181 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.834 -4.303 -1.693 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.097 -3.614 -2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.123 -2.700 0.305 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.893 -4.465 0.316 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.494 -3.384 0.593 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.208 -1.326 -1.557 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.410 -2.014 -1.279 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.671 -2.103 -2.896 1.00 0.00 H new ATOM 490 N VAL A 59 2.489 -4.983 -4.804 1.00 0.00 N ATOM 491 CA VAL A 59 3.744 -5.526 -5.409 1.00 0.00 C ATOM 492 C VAL A 59 4.929 -4.650 -5.001 1.00 0.00 C ATOM 493 O VAL A 59 4.869 -3.437 -5.042 1.00 0.00 O ATOM 494 CB VAL A 59 3.601 -5.532 -6.930 1.00 0.00 C ATOM 495 CG1 VAL A 59 4.955 -5.828 -7.581 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.593 -6.612 -7.326 1.00 0.00 C ATOM 0 H VAL A 59 2.187 -4.082 -5.175 1.00 0.00 H new ATOM 0 HA VAL A 59 3.916 -6.543 -5.055 1.00 0.00 H new ATOM 0 HB VAL A 59 3.254 -4.556 -7.269 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.845 -5.831 -8.665 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.673 -5.061 -7.291 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.312 -6.803 -7.250 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.482 -6.626 -8.410 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.949 -7.584 -6.985 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.629 -6.396 -6.865 1.00 0.00 H new ATOM 506 N VAL A 60 6.003 -5.270 -4.592 1.00 0.00 N ATOM 507 CA VAL A 60 7.199 -4.501 -4.162 1.00 0.00 C ATOM 508 C VAL A 60 7.969 -4.006 -5.389 1.00 0.00 C ATOM 509 O VAL A 60 8.546 -4.779 -6.128 1.00 0.00 O ATOM 510 CB VAL A 60 8.088 -5.417 -3.321 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.336 -4.660 -2.862 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.299 -5.893 -2.098 1.00 0.00 C ATOM 0 H VAL A 60 6.101 -6.284 -4.538 1.00 0.00 H new ATOM 0 HA VAL A 60 6.894 -3.636 -3.573 1.00 0.00 H new ATOM 0 HB VAL A 60 8.396 -6.274 -3.921 1.00 0.00 H new ATOM 0 HG11 VAL A 60 9.963 -5.321 -2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 60 9.896 -4.319 -3.733 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.040 -3.800 -2.262 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.926 -6.547 -1.492 1.00 0.00 H new ATOM 0 HG22 VAL A 60 6.994 -5.032 -1.504 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.415 -6.440 -2.426 1.00 0.00 H new ATOM 522 N LYS A 61 7.973 -2.719 -5.608 1.00 0.00 N ATOM 523 CA LYS A 61 8.695 -2.152 -6.780 1.00 0.00 C ATOM 524 C LYS A 61 10.199 -2.392 -6.641 1.00 0.00 C ATOM 525 O LYS A 61 10.863 -2.757 -7.591 1.00 0.00 O ATOM 526 CB LYS A 61 8.425 -0.648 -6.849 1.00 0.00 C ATOM 527 CG LYS A 61 8.847 -0.106 -8.217 1.00 0.00 C ATOM 528 CD LYS A 61 8.426 1.360 -8.336 1.00 0.00 C ATOM 529 CE LYS A 61 8.788 1.882 -9.728 1.00 0.00 C ATOM 530 NZ LYS A 61 10.263 1.798 -9.923 1.00 0.00 N ATOM 0 H LYS A 61 7.503 -2.031 -5.019 1.00 0.00 H new ATOM 0 HA LYS A 61 8.343 -2.639 -7.690 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.366 -0.452 -6.681 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.974 -0.134 -6.059 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.926 -0.197 -8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.386 -0.694 -9.011 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.354 1.457 -8.167 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.924 1.956 -7.571 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.276 1.297 -10.492 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.454 2.914 -9.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.549 2.440 -10.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.746 2.073 -9.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.525 0.823 -10.172 1.00 0.00 H new ATOM 544 N ARG A 62 10.742 -2.178 -5.466 1.00 0.00 N ATOM 545 CA ARG A 62 12.210 -2.379 -5.258 1.00 0.00 C ATOM 546 C ARG A 62 12.464 -3.096 -3.933 1.00 0.00 C ATOM 547 O ARG A 62 11.699 -2.983 -2.995 1.00 0.00 O ATOM 548 CB ARG A 62 12.909 -1.018 -5.244 1.00 0.00 C ATOM 549 CG ARG A 62 12.897 -0.422 -6.653 1.00 0.00 C ATOM 550 CD ARG A 62 13.502 0.983 -6.621 1.00 0.00 C ATOM 551 NE ARG A 62 14.928 0.902 -6.199 1.00 0.00 N ATOM 552 CZ ARG A 62 15.609 1.995 -5.965 1.00 0.00 C ATOM 553 NH1 ARG A 62 15.047 3.162 -6.113 1.00 0.00 N ATOM 554 NH2 ARG A 62 16.855 1.916 -5.582 1.00 0.00 N ATOM 0 H ARG A 62 10.229 -1.872 -4.639 1.00 0.00 H new ATOM 0 HA ARG A 62 12.604 -2.990 -6.070 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.405 -0.346 -4.549 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.935 -1.128 -4.893 1.00 0.00 H new ATOM 0 HG2 ARG A 62 13.464 -1.058 -7.333 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.876 -0.381 -7.033 1.00 0.00 H new ATOM 0 HD2 ARG A 62 13.429 1.444 -7.606 1.00 0.00 H new ATOM 0 HD3 ARG A 62 12.943 1.615 -5.931 1.00 0.00 H new ATOM 0 HE ARG A 62 15.375 -0.008 -6.092 1.00 0.00 H new ATOM 0 HH11 ARG A 62 14.074 3.225 -6.412 1.00 0.00 H new ATOM 0 HH12 ARG A 62 15.580 4.012 -5.930 1.00 0.00 H new ATOM 0 HH21 ARG A 62 17.296 1.004 -5.466 1.00 0.00 H new ATOM 0 HH22 ARG A 62 17.387 2.767 -5.399 1.00 0.00 H new ATOM 568 N GLY A 63 13.544 -3.831 -3.851 1.00 0.00 N ATOM 569 CA GLY A 63 13.865 -4.558 -2.592 1.00 0.00 C ATOM 570 C GLY A 63 14.750 -5.771 -2.908 1.00 0.00 C ATOM 571 O GLY A 63 14.971 -6.104 -4.057 1.00 0.00 O ATOM 0 H GLY A 63 14.218 -3.957 -4.606 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.377 -3.893 -1.897 1.00 0.00 H new ATOM 0 HA3 GLY A 63 12.946 -4.883 -2.104 1.00 0.00 H new ATOM 575 N PRO A 64 15.249 -6.428 -1.890 1.00 0.00 N ATOM 576 CA PRO A 64 16.126 -7.631 -2.048 1.00 0.00 C ATOM 577 C PRO A 64 15.370 -8.817 -2.660 1.00 0.00 C ATOM 578 O PRO A 64 15.965 -9.733 -3.195 1.00 0.00 O ATOM 579 CB PRO A 64 16.583 -7.950 -0.609 1.00 0.00 C ATOM 580 CG PRO A 64 15.558 -7.312 0.279 1.00 0.00 C ATOM 581 CD PRO A 64 15.029 -6.091 -0.476 1.00 0.00 C ATOM 0 HA PRO A 64 16.958 -7.444 -2.727 1.00 0.00 H new ATOM 0 HB2 PRO A 64 16.634 -9.026 -0.441 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.578 -7.549 -0.414 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.751 -8.009 0.503 1.00 0.00 H new ATOM 0 HG3 PRO A 64 15.999 -7.018 1.232 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.974 -5.918 -0.266 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.563 -5.184 -0.193 1.00 0.00 H new ATOM 589 N ASN A 65 14.066 -8.809 -2.574 1.00 0.00 N ATOM 590 CA ASN A 65 13.265 -9.933 -3.139 1.00 0.00 C ATOM 591 C ASN A 65 12.731 -9.533 -4.518 1.00 0.00 C ATOM 592 O ASN A 65 12.642 -10.347 -5.414 1.00 0.00 O ATOM 593 CB ASN A 65 12.091 -10.219 -2.202 1.00 0.00 C ATOM 594 CG ASN A 65 12.614 -10.776 -0.873 1.00 0.00 C ATOM 595 OD1 ASN A 65 13.598 -11.487 -0.843 1.00 0.00 O ATOM 596 ND2 ASN A 65 11.992 -10.476 0.238 1.00 0.00 N ATOM 0 H ASN A 65 13.519 -8.068 -2.135 1.00 0.00 H new ATOM 0 HA ASN A 65 13.887 -10.822 -3.237 1.00 0.00 H new ATOM 0 HB2 ASN A 65 11.523 -9.306 -2.026 1.00 0.00 H new ATOM 0 HB3 ASN A 65 11.410 -10.934 -2.664 1.00 0.00 H new ATOM 0 HD21 ASN A 65 12.334 -10.839 1.128 1.00 0.00 H new ATOM 0 HD22 ASN A 65 11.165 -9.879 0.214 1.00 0.00 H new ATOM 603 N ALA A 66 12.385 -8.278 -4.681 1.00 0.00 N ATOM 604 CA ALA A 66 11.847 -7.774 -5.987 1.00 0.00 C ATOM 605 C ALA A 66 10.983 -8.843 -6.669 1.00 0.00 C ATOM 606 O ALA A 66 11.477 -9.690 -7.391 1.00 0.00 O ATOM 607 CB ALA A 66 13.007 -7.380 -6.905 1.00 0.00 C ATOM 0 H ALA A 66 12.454 -7.569 -3.951 1.00 0.00 H new ATOM 0 HA ALA A 66 11.224 -6.901 -5.792 1.00 0.00 H new ATOM 0 HB1 ALA A 66 12.613 -7.014 -7.853 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.596 -6.596 -6.430 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.639 -8.249 -7.086 1.00 0.00 H new ATOM 613 N GLY A 67 9.694 -8.806 -6.438 1.00 0.00 N ATOM 614 CA GLY A 67 8.771 -9.808 -7.050 1.00 0.00 C ATOM 615 C GLY A 67 7.762 -10.254 -5.991 1.00 0.00 C ATOM 616 O GLY A 67 6.753 -10.859 -6.292 1.00 0.00 O ATOM 0 H GLY A 67 9.237 -8.114 -5.843 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.254 -9.373 -7.905 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.334 -10.665 -7.420 1.00 0.00 H new ATOM 620 N SER A 68 8.040 -9.966 -4.746 1.00 0.00 N ATOM 621 CA SER A 68 7.118 -10.376 -3.650 1.00 0.00 C ATOM 622 C SER A 68 5.756 -9.696 -3.804 1.00 0.00 C ATOM 623 O SER A 68 5.659 -8.555 -4.220 1.00 0.00 O ATOM 624 CB SER A 68 7.729 -9.980 -2.308 1.00 0.00 C ATOM 625 OG SER A 68 8.947 -10.688 -2.126 1.00 0.00 O ATOM 0 H SER A 68 8.872 -9.461 -4.442 1.00 0.00 H new ATOM 0 HA SER A 68 6.976 -11.456 -3.697 1.00 0.00 H new ATOM 0 HB2 SER A 68 7.911 -8.906 -2.280 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.037 -10.208 -1.498 1.00 0.00 H new ATOM 0 HG SER A 68 9.346 -10.437 -1.267 1.00 0.00 H new ATOM 631 N ARG A 69 4.699 -10.394 -3.456 1.00 0.00 N ATOM 632 CA ARG A 69 3.326 -9.815 -3.560 1.00 0.00 C ATOM 633 C ARG A 69 2.523 -10.187 -2.312 1.00 0.00 C ATOM 634 O ARG A 69 2.811 -11.164 -1.650 1.00 0.00 O ATOM 635 CB ARG A 69 2.632 -10.361 -4.813 1.00 0.00 C ATOM 636 CG ARG A 69 2.499 -11.886 -4.724 1.00 0.00 C ATOM 637 CD ARG A 69 1.843 -12.410 -6.005 1.00 0.00 C ATOM 638 NE ARG A 69 1.663 -13.885 -5.902 1.00 0.00 N ATOM 639 CZ ARG A 69 1.108 -14.552 -6.882 1.00 0.00 C ATOM 640 NH1 ARG A 69 0.702 -13.930 -7.954 1.00 0.00 N ATOM 641 NH2 ARG A 69 0.961 -15.845 -6.783 1.00 0.00 N ATOM 0 H ARG A 69 4.733 -11.350 -3.101 1.00 0.00 H new ATOM 0 HA ARG A 69 3.390 -8.729 -3.635 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.646 -9.908 -4.918 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.203 -10.090 -5.701 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.480 -12.341 -4.591 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.900 -12.161 -3.856 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.879 -11.925 -6.157 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.462 -12.168 -6.869 1.00 0.00 H new ATOM 0 HE ARG A 69 1.973 -14.377 -5.064 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.816 -12.919 -8.031 1.00 0.00 H new ATOM 0 HH12 ARG A 69 0.270 -14.454 -8.715 1.00 0.00 H new ATOM 0 HH21 ARG A 69 1.278 -16.332 -5.944 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.529 -16.369 -7.544 1.00 0.00 H new ATOM 655 N PHE A 70 1.515 -9.410 -1.990 1.00 0.00 N ATOM 656 CA PHE A 70 0.679 -9.702 -0.785 1.00 0.00 C ATOM 657 C PHE A 70 -0.783 -9.764 -1.191 1.00 0.00 C ATOM 658 O PHE A 70 -1.214 -9.061 -2.088 1.00 0.00 O ATOM 659 CB PHE A 70 0.865 -8.590 0.241 1.00 0.00 C ATOM 660 CG PHE A 70 2.297 -8.589 0.708 1.00 0.00 C ATOM 661 CD1 PHE A 70 2.770 -9.643 1.497 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.151 -7.540 0.352 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.099 -9.648 1.933 1.00 0.00 C ATOM 664 CE2 PHE A 70 4.481 -7.544 0.787 1.00 0.00 C ATOM 665 CZ PHE A 70 4.955 -8.598 1.579 1.00 0.00 C ATOM 0 H PHE A 70 1.235 -8.581 -2.515 1.00 0.00 H new ATOM 0 HA PHE A 70 0.983 -10.656 -0.353 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.612 -7.625 -0.199 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.193 -8.741 1.086 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.109 -10.453 1.769 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.784 -6.728 -0.258 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.465 -10.461 2.542 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.142 -6.735 0.512 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.981 -8.601 1.917 1.00 0.00 H new ATOM 675 N LEU A 71 -1.550 -10.603 -0.539 1.00 0.00 N ATOM 676 CA LEU A 71 -2.995 -10.728 -0.882 1.00 0.00 C ATOM 677 C LEU A 71 -3.827 -10.026 0.191 1.00 0.00 C ATOM 678 O LEU A 71 -3.705 -10.302 1.368 1.00 0.00 O ATOM 679 CB LEU A 71 -3.366 -12.222 -0.937 1.00 0.00 C ATOM 680 CG LEU A 71 -4.557 -12.447 -1.889 1.00 0.00 C ATOM 681 CD1 LEU A 71 -5.733 -11.546 -1.493 1.00 0.00 C ATOM 682 CD2 LEU A 71 -4.135 -12.157 -3.352 1.00 0.00 C ATOM 0 H LEU A 71 -1.233 -11.208 0.219 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.194 -10.267 -1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.508 -12.804 -1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.619 -12.577 0.062 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.871 -13.488 -1.812 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.567 -11.716 -2.174 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.043 -11.779 -0.474 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.426 -10.502 -1.549 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.985 -12.320 -4.015 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.802 -11.123 -3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.321 -12.825 -3.635 1.00 0.00 H new ATOM 694 N LEU A 72 -4.682 -9.130 -0.217 1.00 0.00 N ATOM 695 CA LEU A 72 -5.543 -8.404 0.756 1.00 0.00 C ATOM 696 C LEU A 72 -6.941 -9.022 0.767 1.00 0.00 C ATOM 697 O LEU A 72 -7.599 -9.120 -0.250 1.00 0.00 O ATOM 698 CB LEU A 72 -5.630 -6.937 0.337 1.00 0.00 C ATOM 699 CG LEU A 72 -4.216 -6.351 0.248 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.300 -4.892 -0.204 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.521 -6.431 1.619 1.00 0.00 C ATOM 0 H LEU A 72 -4.822 -8.868 -1.193 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.116 -8.478 1.756 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.133 -6.851 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.224 -6.375 1.058 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.635 -6.925 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.296 -4.473 -0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.778 -4.841 -1.182 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.886 -4.321 0.516 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.518 -6.012 1.543 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.096 -5.865 2.352 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.456 -7.473 1.934 1.00 0.00 H new ATOM 713 N ASP A 73 -7.396 -9.429 1.922 1.00 0.00 N ATOM 714 CA ASP A 73 -8.749 -10.030 2.036 1.00 0.00 C ATOM 715 C ASP A 73 -9.253 -9.815 3.467 1.00 0.00 C ATOM 716 O ASP A 73 -9.584 -10.750 4.167 1.00 0.00 O ATOM 717 CB ASP A 73 -8.683 -11.533 1.715 1.00 0.00 C ATOM 718 CG ASP A 73 -7.754 -12.237 2.703 1.00 0.00 C ATOM 719 OD1 ASP A 73 -7.128 -11.550 3.492 1.00 0.00 O ATOM 720 OD2 ASP A 73 -7.684 -13.456 2.655 1.00 0.00 O ATOM 0 H ASP A 73 -6.879 -9.368 2.799 1.00 0.00 H new ATOM 0 HA ASP A 73 -9.431 -9.559 1.328 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.681 -11.969 1.767 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.324 -11.681 0.697 1.00 0.00 H new ATOM 725 N GLN A 74 -9.303 -8.580 3.905 1.00 0.00 N ATOM 726 CA GLN A 74 -9.774 -8.291 5.292 1.00 0.00 C ATOM 727 C GLN A 74 -10.184 -6.817 5.398 1.00 0.00 C ATOM 728 O GLN A 74 -10.029 -6.047 4.469 1.00 0.00 O ATOM 729 CB GLN A 74 -8.643 -8.589 6.304 1.00 0.00 C ATOM 730 CG GLN A 74 -7.278 -8.471 5.616 1.00 0.00 C ATOM 731 CD GLN A 74 -7.192 -7.151 4.846 1.00 0.00 C ATOM 732 OE1 GLN A 74 -7.668 -6.132 5.306 1.00 0.00 O ATOM 733 NE2 GLN A 74 -6.602 -7.127 3.683 1.00 0.00 N ATOM 0 H GLN A 74 -9.037 -7.760 3.360 1.00 0.00 H new ATOM 0 HA GLN A 74 -10.632 -8.924 5.518 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -8.699 -7.892 7.140 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -8.767 -9.591 6.715 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -6.482 -8.521 6.359 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -7.131 -9.309 4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.202 -7.982 3.296 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.540 -6.253 3.160 1.00 0.00 H new ATOM 742 N ALA A 75 -10.706 -6.424 6.532 1.00 0.00 N ATOM 743 CA ALA A 75 -11.129 -5.011 6.722 1.00 0.00 C ATOM 744 C ALA A 75 -9.940 -4.156 7.164 1.00 0.00 C ATOM 745 O ALA A 75 -9.517 -3.260 6.459 1.00 0.00 O ATOM 746 CB ALA A 75 -12.202 -4.953 7.804 1.00 0.00 C ATOM 0 H ALA A 75 -10.857 -7.030 7.339 1.00 0.00 H new ATOM 0 HA ALA A 75 -11.517 -4.628 5.778 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -12.517 -3.920 7.949 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -13.059 -5.554 7.500 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.798 -5.344 8.738 1.00 0.00 H new ATOM 752 N ILE A 76 -9.412 -4.411 8.341 1.00 0.00 N ATOM 753 CA ILE A 76 -8.265 -3.597 8.849 1.00 0.00 C ATOM 754 C ILE A 76 -6.982 -4.425 8.832 1.00 0.00 C ATOM 755 O ILE A 76 -6.909 -5.487 9.419 1.00 0.00 O ATOM 756 CB ILE A 76 -8.559 -3.165 10.285 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.952 -2.522 10.352 1.00 0.00 C ATOM 758 CG2 ILE A 76 -7.502 -2.155 10.739 1.00 0.00 C ATOM 759 CD1 ILE A 76 -10.079 -1.407 9.307 1.00 0.00 C ATOM 0 H ILE A 76 -9.729 -5.149 8.970 1.00 0.00 H new ATOM 0 HA ILE A 76 -8.135 -2.724 8.209 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.533 -4.035 10.941 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -10.717 -3.279 10.180 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.124 -2.116 11.349 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.710 -1.846 11.763 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.515 -2.615 10.693 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.527 -1.283 10.085 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.072 -0.962 9.368 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.326 -0.642 9.498 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.929 -1.823 8.311 1.00 0.00 H new ATOM 771 N THR A 77 -5.966 -3.926 8.172 1.00 0.00 N ATOM 772 CA THR A 77 -4.659 -4.646 8.109 1.00 0.00 C ATOM 773 C THR A 77 -3.539 -3.695 8.527 1.00 0.00 C ATOM 774 O THR A 77 -3.405 -2.608 8.002 1.00 0.00 O ATOM 775 CB THR A 77 -4.420 -5.142 6.682 1.00 0.00 C ATOM 776 OG1 THR A 77 -5.365 -6.153 6.380 1.00 0.00 O ATOM 777 CG2 THR A 77 -3.005 -5.710 6.559 1.00 0.00 C ATOM 0 H THR A 77 -5.988 -3.039 7.668 1.00 0.00 H new ATOM 0 HA THR A 77 -4.675 -5.501 8.785 1.00 0.00 H new ATOM 0 HB THR A 77 -4.531 -4.312 5.984 1.00 0.00 H new ATOM 0 HG1 THR A 77 -6.259 -5.756 6.313 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.841 -6.062 5.540 1.00 0.00 H new ATOM 0 HG22 THR A 77 -2.279 -4.932 6.796 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.885 -6.542 7.253 1.00 0.00 H new ATOM 785 N SER A 78 -2.737 -4.100 9.473 1.00 0.00 N ATOM 786 CA SER A 78 -1.624 -3.230 9.938 1.00 0.00 C ATOM 787 C SER A 78 -0.407 -3.412 9.032 1.00 0.00 C ATOM 788 O SER A 78 -0.330 -4.356 8.268 1.00 0.00 O ATOM 789 CB SER A 78 -1.256 -3.617 11.365 1.00 0.00 C ATOM 790 OG SER A 78 -1.069 -5.023 11.430 1.00 0.00 O ATOM 0 H SER A 78 -2.807 -5.001 9.945 1.00 0.00 H new ATOM 0 HA SER A 78 -1.939 -2.187 9.904 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.346 -3.102 11.672 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.044 -3.310 12.053 1.00 0.00 H new ATOM 0 HG SER A 78 -1.703 -5.408 12.071 1.00 0.00 H new ATOM 796 N ALA A 79 0.545 -2.513 9.113 1.00 0.00 N ATOM 797 CA ALA A 79 1.768 -2.617 8.259 1.00 0.00 C ATOM 798 C ALA A 79 2.980 -2.977 9.121 1.00 0.00 C ATOM 799 O ALA A 79 2.955 -2.862 10.331 1.00 0.00 O ATOM 800 CB ALA A 79 2.017 -1.269 7.583 1.00 0.00 C ATOM 0 H ALA A 79 0.526 -1.707 9.738 1.00 0.00 H new ATOM 0 HA ALA A 79 1.619 -3.393 7.509 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.907 -1.335 6.958 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.158 -1.008 6.965 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.164 -0.502 8.344 1.00 0.00 H new ATOM 806 N GLY A 80 4.046 -3.397 8.496 1.00 0.00 N ATOM 807 CA GLY A 80 5.273 -3.753 9.256 1.00 0.00 C ATOM 808 C GLY A 80 5.057 -5.049 10.037 1.00 0.00 C ATOM 809 O GLY A 80 4.670 -6.059 9.482 1.00 0.00 O ATOM 0 H GLY A 80 4.118 -3.509 7.485 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.112 -3.869 8.570 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.531 -2.946 9.942 1.00 0.00 H new ATOM 813 N ARG A 81 5.330 -5.036 11.320 1.00 0.00 N ATOM 814 CA ARG A 81 5.168 -6.273 12.141 1.00 0.00 C ATOM 815 C ARG A 81 3.875 -6.211 12.952 1.00 0.00 C ATOM 816 O ARG A 81 3.549 -5.201 13.544 1.00 0.00 O ATOM 817 CB ARG A 81 6.356 -6.387 13.100 1.00 0.00 C ATOM 818 CG ARG A 81 7.633 -6.656 12.299 1.00 0.00 C ATOM 819 CD ARG A 81 8.833 -6.749 13.247 1.00 0.00 C ATOM 820 NE ARG A 81 10.066 -7.006 12.451 1.00 0.00 N ATOM 821 CZ ARG A 81 11.172 -7.378 13.041 1.00 0.00 C ATOM 822 NH1 ARG A 81 11.210 -7.516 14.337 1.00 0.00 N ATOM 823 NH2 ARG A 81 12.243 -7.609 12.330 1.00 0.00 N ATOM 0 H ARG A 81 5.659 -4.218 11.833 1.00 0.00 H new ATOM 0 HA ARG A 81 5.127 -7.138 11.479 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.462 -5.468 13.676 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.185 -7.193 13.814 1.00 0.00 H new ATOM 0 HG2 ARG A 81 7.531 -7.584 11.736 1.00 0.00 H new ATOM 0 HG3 ARG A 81 7.793 -5.858 11.574 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.937 -5.823 13.813 1.00 0.00 H new ATOM 0 HD3 ARG A 81 8.679 -7.550 13.971 1.00 0.00 H new ATOM 0 HE ARG A 81 10.047 -6.891 11.438 1.00 0.00 H new ATOM 0 HH11 ARG A 81 10.375 -7.334 14.894 1.00 0.00 H new ATOM 0 HH12 ARG A 81 12.075 -7.806 14.794 1.00 0.00 H new ATOM 0 HH21 ARG A 81 12.216 -7.499 11.316 1.00 0.00 H new ATOM 0 HH22 ARG A 81 13.107 -7.899 12.788 1.00 0.00 H new ATOM 837 N HIS A 82 3.151 -7.297 13.001 1.00 0.00 N ATOM 838 CA HIS A 82 1.888 -7.333 13.790 1.00 0.00 C ATOM 839 C HIS A 82 1.182 -8.671 13.515 1.00 0.00 C ATOM 840 O HIS A 82 1.371 -9.273 12.476 1.00 0.00 O ATOM 841 CB HIS A 82 0.977 -6.141 13.393 1.00 0.00 C ATOM 842 CG HIS A 82 0.943 -5.115 14.500 1.00 0.00 C ATOM 843 ND1 HIS A 82 2.003 -4.939 15.372 1.00 0.00 N ATOM 844 CD2 HIS A 82 -0.018 -4.215 14.892 1.00 0.00 C ATOM 845 CE1 HIS A 82 1.661 -3.970 16.239 1.00 0.00 C ATOM 846 NE2 HIS A 82 0.438 -3.493 15.992 1.00 0.00 N ATOM 0 H HIS A 82 3.384 -8.168 12.524 1.00 0.00 H new ATOM 0 HA HIS A 82 2.107 -7.247 14.854 1.00 0.00 H new ATOM 0 HB2 HIS A 82 1.345 -5.683 12.475 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -0.032 -6.498 13.188 1.00 0.00 H new ATOM 0 HD1 HIS A 82 2.885 -5.452 15.359 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -0.980 -4.087 14.419 1.00 0.00 H new ATOM 0 HE1 HIS A 82 2.298 -3.620 17.038 1.00 0.00 H new ATOM 854 N PRO A 83 0.382 -9.138 14.444 1.00 0.00 N ATOM 855 CA PRO A 83 -0.352 -10.435 14.303 1.00 0.00 C ATOM 856 C PRO A 83 -1.474 -10.380 13.258 1.00 0.00 C ATOM 857 O PRO A 83 -2.146 -9.380 13.099 1.00 0.00 O ATOM 858 CB PRO A 83 -0.910 -10.684 15.712 1.00 0.00 C ATOM 859 CG PRO A 83 -1.064 -9.323 16.306 1.00 0.00 C ATOM 860 CD PRO A 83 0.080 -8.485 15.732 1.00 0.00 C ATOM 0 HA PRO A 83 0.299 -11.233 13.947 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -1.864 -11.209 15.673 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -0.232 -11.299 16.303 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -2.032 -8.892 16.049 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -1.011 -9.363 17.394 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -0.216 -7.445 15.594 1.00 0.00 H new ATOM 0 HD3 PRO A 83 0.947 -8.484 16.393 1.00 0.00 H new ATOM 868 N ASP A 84 -1.681 -11.461 12.551 1.00 0.00 N ATOM 869 CA ASP A 84 -2.753 -11.496 11.523 1.00 0.00 C ATOM 870 C ASP A 84 -2.522 -10.373 10.512 1.00 0.00 C ATOM 871 O ASP A 84 -3.448 -9.862 9.910 1.00 0.00 O ATOM 872 CB ASP A 84 -4.121 -11.333 12.198 1.00 0.00 C ATOM 873 CG ASP A 84 -5.233 -11.636 11.193 1.00 0.00 C ATOM 874 OD1 ASP A 84 -4.924 -11.792 10.024 1.00 0.00 O ATOM 875 OD2 ASP A 84 -6.378 -11.710 11.612 1.00 0.00 O ATOM 0 H ASP A 84 -1.147 -12.325 12.646 1.00 0.00 H new ATOM 0 HA ASP A 84 -2.732 -12.453 11.002 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -4.198 -12.005 13.053 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.230 -10.318 12.580 1.00 0.00 H new ATOM 880 N SER A 85 -1.285 -9.986 10.316 1.00 0.00 N ATOM 881 CA SER A 85 -0.975 -8.898 9.343 1.00 0.00 C ATOM 882 C SER A 85 -0.530 -9.511 8.013 1.00 0.00 C ATOM 883 O SER A 85 0.456 -10.219 7.942 1.00 0.00 O ATOM 884 CB SER A 85 0.158 -8.029 9.894 1.00 0.00 C ATOM 885 OG SER A 85 0.616 -7.152 8.873 1.00 0.00 O ATOM 0 H SER A 85 -0.474 -10.381 10.792 1.00 0.00 H new ATOM 0 HA SER A 85 -1.866 -8.290 9.188 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.192 -7.455 10.752 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.977 -8.658 10.244 1.00 0.00 H new ATOM 0 HG SER A 85 1.420 -7.527 8.457 1.00 0.00 H new ATOM 891 N ASP A 86 -1.244 -9.232 6.958 1.00 0.00 N ATOM 892 CA ASP A 86 -0.868 -9.777 5.628 1.00 0.00 C ATOM 893 C ASP A 86 0.480 -9.190 5.203 1.00 0.00 C ATOM 894 O ASP A 86 1.285 -9.846 4.571 1.00 0.00 O ATOM 895 CB ASP A 86 -1.932 -9.381 4.606 1.00 0.00 C ATOM 896 CG ASP A 86 -3.199 -10.208 4.833 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.119 -11.201 5.540 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.229 -9.834 4.297 1.00 0.00 O ATOM 0 H ASP A 86 -2.078 -8.645 6.963 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.794 -10.863 5.683 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.159 -8.319 4.696 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.557 -9.542 3.595 1.00 0.00 H new ATOM 903 N ILE A 87 0.721 -7.947 5.524 1.00 0.00 N ATOM 904 CA ILE A 87 2.005 -7.313 5.117 1.00 0.00 C ATOM 905 C ILE A 87 3.133 -7.762 6.045 1.00 0.00 C ATOM 906 O ILE A 87 3.030 -7.679 7.253 1.00 0.00 O ATOM 907 CB ILE A 87 1.858 -5.791 5.183 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.581 -5.369 4.443 1.00 0.00 C ATOM 909 CG2 ILE A 87 3.073 -5.122 4.534 1.00 0.00 C ATOM 910 CD1 ILE A 87 0.565 -5.957 3.026 1.00 0.00 C ATOM 0 H ILE A 87 0.085 -7.346 6.049 1.00 0.00 H new ATOM 0 HA ILE A 87 2.248 -7.616 4.099 1.00 0.00 H new ATOM 0 HB ILE A 87 1.795 -5.480 6.226 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.296 -5.709 4.995 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.524 -4.282 4.393 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.962 -4.039 4.584 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.978 -5.419 5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.145 -5.431 3.491 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.347 -5.649 2.514 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.432 -5.596 2.472 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.599 -7.045 3.083 1.00 0.00 H new ATOM 922 N PHE A 88 4.216 -8.236 5.473 1.00 0.00 N ATOM 923 CA PHE A 88 5.381 -8.697 6.284 1.00 0.00 C ATOM 924 C PHE A 88 6.641 -7.988 5.790 1.00 0.00 C ATOM 925 O PHE A 88 7.354 -8.494 4.944 1.00 0.00 O ATOM 926 CB PHE A 88 5.542 -10.207 6.110 1.00 0.00 C ATOM 927 CG PHE A 88 4.382 -10.910 6.772 1.00 0.00 C ATOM 928 CD1 PHE A 88 4.410 -11.154 8.149 1.00 0.00 C ATOM 929 CD2 PHE A 88 3.278 -11.313 6.011 1.00 0.00 C ATOM 930 CE1 PHE A 88 3.335 -11.802 8.768 1.00 0.00 C ATOM 931 CE2 PHE A 88 2.202 -11.962 6.629 1.00 0.00 C ATOM 932 CZ PHE A 88 2.231 -12.207 8.008 1.00 0.00 C ATOM 0 H PHE A 88 4.340 -8.323 4.464 1.00 0.00 H new ATOM 0 HA PHE A 88 5.221 -8.466 7.337 1.00 0.00 H new ATOM 0 HB2 PHE A 88 5.580 -10.461 5.051 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.482 -10.538 6.551 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.262 -10.842 8.735 1.00 0.00 H new ATOM 0 HD2 PHE A 88 3.256 -11.123 4.948 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.357 -11.990 9.831 1.00 0.00 H new ATOM 0 HE2 PHE A 88 1.350 -12.274 6.043 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.402 -12.708 8.485 1.00 0.00 H new ATOM 942 N LEU A 89 6.918 -6.816 6.312 1.00 0.00 N ATOM 943 CA LEU A 89 8.129 -6.055 5.880 1.00 0.00 C ATOM 944 C LEU A 89 9.171 -6.072 6.996 1.00 0.00 C ATOM 945 O LEU A 89 9.035 -5.409 8.004 1.00 0.00 O ATOM 946 CB LEU A 89 7.716 -4.614 5.564 1.00 0.00 C ATOM 947 CG LEU A 89 6.871 -4.594 4.278 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.157 -3.244 4.160 1.00 0.00 C ATOM 949 CD2 LEU A 89 7.762 -4.810 3.036 1.00 0.00 C ATOM 0 H LEU A 89 6.352 -6.353 7.023 1.00 0.00 H new ATOM 0 HA LEU A 89 8.563 -6.514 4.992 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.145 -4.198 6.394 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.601 -3.989 5.441 1.00 0.00 H new ATOM 0 HG LEU A 89 6.140 -5.401 4.329 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.558 -3.228 3.250 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.508 -3.099 5.024 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.896 -2.444 4.122 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.145 -4.792 2.138 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.507 -4.016 2.980 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.264 -5.774 3.112 1.00 0.00 H new ATOM 961 N ASP A 90 10.214 -6.836 6.815 1.00 0.00 N ATOM 962 CA ASP A 90 11.278 -6.914 7.849 1.00 0.00 C ATOM 963 C ASP A 90 12.286 -5.787 7.617 1.00 0.00 C ATOM 964 O ASP A 90 13.249 -5.943 6.891 1.00 0.00 O ATOM 965 CB ASP A 90 11.976 -8.273 7.738 1.00 0.00 C ATOM 966 CG ASP A 90 13.018 -8.416 8.848 1.00 0.00 C ATOM 967 OD1 ASP A 90 13.426 -7.401 9.387 1.00 0.00 O ATOM 968 OD2 ASP A 90 13.393 -9.541 9.136 1.00 0.00 O ATOM 0 H ASP A 90 10.373 -7.412 5.989 1.00 0.00 H new ATOM 0 HA ASP A 90 10.847 -6.808 8.844 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.242 -9.075 7.811 1.00 0.00 H new ATOM 0 HB3 ASP A 90 12.455 -8.367 6.763 1.00 0.00 H new ATOM 973 N ASP A 91 12.073 -4.648 8.230 1.00 0.00 N ATOM 974 CA ASP A 91 13.018 -3.510 8.046 1.00 0.00 C ATOM 975 C ASP A 91 13.016 -2.626 9.293 1.00 0.00 C ATOM 976 O ASP A 91 11.978 -2.230 9.786 1.00 0.00 O ATOM 977 CB ASP A 91 12.589 -2.677 6.834 1.00 0.00 C ATOM 978 CG ASP A 91 12.875 -3.456 5.550 1.00 0.00 C ATOM 979 OD1 ASP A 91 13.893 -4.125 5.503 1.00 0.00 O ATOM 980 OD2 ASP A 91 12.074 -3.367 4.633 1.00 0.00 O ATOM 0 H ASP A 91 11.285 -4.460 8.849 1.00 0.00 H new ATOM 0 HA ASP A 91 14.022 -3.903 7.884 1.00 0.00 H new ATOM 0 HB2 ASP A 91 11.527 -2.441 6.899 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.126 -1.728 6.823 1.00 0.00 H new ATOM 985 N VAL A 92 14.178 -2.312 9.798 1.00 0.00 N ATOM 986 CA VAL A 92 14.273 -1.449 11.005 1.00 0.00 C ATOM 987 C VAL A 92 13.836 -0.028 10.635 1.00 0.00 C ATOM 988 O VAL A 92 13.406 0.741 11.472 1.00 0.00 O ATOM 989 CB VAL A 92 15.720 -1.446 11.499 1.00 0.00 C ATOM 990 CG1 VAL A 92 16.618 -0.778 10.457 1.00 0.00 C ATOM 991 CG2 VAL A 92 15.816 -0.683 12.821 1.00 0.00 C ATOM 0 H VAL A 92 15.074 -2.621 9.420 1.00 0.00 H new ATOM 0 HA VAL A 92 13.626 -1.827 11.796 1.00 0.00 H new ATOM 0 HB VAL A 92 16.046 -2.474 11.653 1.00 0.00 H new ATOM 0 HG11 VAL A 92 17.649 -0.777 10.812 1.00 0.00 H new ATOM 0 HG12 VAL A 92 16.558 -1.329 9.518 1.00 0.00 H new ATOM 0 HG13 VAL A 92 16.289 0.249 10.297 1.00 0.00 H new ATOM 0 HG21 VAL A 92 16.849 -0.684 13.168 1.00 0.00 H new ATOM 0 HG22 VAL A 92 15.484 0.345 12.673 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.183 -1.165 13.566 1.00 0.00 H new ATOM 1001 N THR A 93 13.955 0.322 9.382 1.00 0.00 N ATOM 1002 CA THR A 93 13.557 1.685 8.940 1.00 0.00 C ATOM 1003 C THR A 93 12.033 1.770 8.886 1.00 0.00 C ATOM 1004 O THR A 93 11.465 2.840 8.793 1.00 0.00 O ATOM 1005 CB THR A 93 14.133 1.955 7.548 1.00 0.00 C ATOM 1006 OG1 THR A 93 13.574 1.035 6.624 1.00 0.00 O ATOM 1007 CG2 THR A 93 15.656 1.790 7.574 1.00 0.00 C ATOM 0 H THR A 93 14.313 -0.283 8.643 1.00 0.00 H new ATOM 0 HA THR A 93 13.940 2.426 9.641 1.00 0.00 H new ATOM 0 HB THR A 93 13.889 2.974 7.247 1.00 0.00 H new ATOM 0 HG1 THR A 93 13.939 1.206 5.731 1.00 0.00 H new ATOM 0 HG21 THR A 93 16.060 1.983 6.580 1.00 0.00 H new ATOM 0 HG22 THR A 93 16.086 2.496 8.284 1.00 0.00 H new ATOM 0 HG23 THR A 93 15.907 0.773 7.876 1.00 0.00 H new ATOM 1015 N VAL A 94 11.369 0.643 8.942 1.00 0.00 N ATOM 1016 CA VAL A 94 9.878 0.633 8.898 1.00 0.00 C ATOM 1017 C VAL A 94 9.339 0.431 10.314 1.00 0.00 C ATOM 1018 O VAL A 94 8.178 0.665 10.585 1.00 0.00 O ATOM 1019 CB VAL A 94 9.414 -0.516 8.004 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.887 -0.555 7.974 1.00 0.00 C ATOM 1021 CG2 VAL A 94 9.947 -0.304 6.586 1.00 0.00 C ATOM 0 H VAL A 94 11.802 -0.278 9.017 1.00 0.00 H new ATOM 0 HA VAL A 94 9.508 1.578 8.499 1.00 0.00 H new ATOM 0 HB VAL A 94 9.793 -1.459 8.398 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.556 -1.375 7.336 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.507 -0.705 8.984 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.507 0.387 7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.617 -1.123 5.947 1.00 0.00 H new ATOM 0 HG22 VAL A 94 9.568 0.639 6.192 1.00 0.00 H new ATOM 0 HG23 VAL A 94 11.036 -0.277 6.607 1.00 0.00 H new ATOM 1031 N SER A 95 10.184 0.009 11.217 1.00 0.00 N ATOM 1032 CA SER A 95 9.756 -0.205 12.630 1.00 0.00 C ATOM 1033 C SER A 95 8.484 -1.059 12.690 1.00 0.00 C ATOM 1034 O SER A 95 7.897 -1.398 11.682 1.00 0.00 O ATOM 1035 CB SER A 95 9.493 1.147 13.299 1.00 0.00 C ATOM 1036 OG SER A 95 8.471 1.841 12.593 1.00 0.00 O ATOM 0 H SER A 95 11.165 -0.199 11.033 1.00 0.00 H new ATOM 0 HA SER A 95 10.554 -0.729 13.156 1.00 0.00 H new ATOM 0 HB2 SER A 95 9.195 0.998 14.337 1.00 0.00 H new ATOM 0 HB3 SER A 95 10.407 1.741 13.312 1.00 0.00 H new ATOM 0 HG SER A 95 7.924 1.199 12.094 1.00 0.00 H new ATOM 1042 N ARG A 96 8.061 -1.415 13.876 1.00 0.00 N ATOM 1043 CA ARG A 96 6.837 -2.250 14.019 1.00 0.00 C ATOM 1044 C ARG A 96 5.638 -1.524 13.414 1.00 0.00 C ATOM 1045 O ARG A 96 5.063 -1.964 12.437 1.00 0.00 O ATOM 1046 CB ARG A 96 6.564 -2.495 15.503 1.00 0.00 C ATOM 1047 CG ARG A 96 7.609 -3.455 16.074 1.00 0.00 C ATOM 1048 CD ARG A 96 7.338 -3.673 17.565 1.00 0.00 C ATOM 1049 NE ARG A 96 8.369 -4.592 18.127 1.00 0.00 N ATOM 1050 CZ ARG A 96 8.206 -5.889 18.066 1.00 0.00 C ATOM 1051 NH1 ARG A 96 7.135 -6.394 17.517 1.00 0.00 N ATOM 1052 NH2 ARG A 96 9.120 -6.682 18.556 1.00 0.00 N ATOM 0 H ARG A 96 8.515 -1.161 14.753 1.00 0.00 H new ATOM 0 HA ARG A 96 6.990 -3.197 13.502 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.590 -1.551 16.047 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.565 -2.911 15.634 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.573 -4.407 15.544 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.610 -3.048 15.931 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.359 -2.720 18.093 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.343 -4.095 17.707 1.00 0.00 H new ATOM 0 HE ARG A 96 9.207 -4.207 18.562 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.420 -5.777 17.133 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.013 -7.406 17.472 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.958 -6.290 18.985 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.996 -7.693 18.510 1.00 0.00 H new ATOM 1066 N ARG A 97 5.252 -0.417 13.998 1.00 0.00 N ATOM 1067 CA ARG A 97 4.084 0.351 13.478 1.00 0.00 C ATOM 1068 C ARG A 97 4.573 1.561 12.684 1.00 0.00 C ATOM 1069 O ARG A 97 5.458 2.282 13.107 1.00 0.00 O ATOM 1070 CB ARG A 97 3.219 0.808 14.656 1.00 0.00 C ATOM 1071 CG ARG A 97 2.601 -0.424 15.328 1.00 0.00 C ATOM 1072 CD ARG A 97 1.788 0.002 16.554 1.00 0.00 C ATOM 1073 NE ARG A 97 0.640 0.843 16.115 1.00 0.00 N ATOM 1074 CZ ARG A 97 -0.161 1.386 16.994 1.00 0.00 C ATOM 1075 NH1 ARG A 97 0.024 1.180 18.269 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -1.155 2.131 16.593 1.00 0.00 N ATOM 0 H ARG A 97 5.701 -0.011 14.819 1.00 0.00 H new ATOM 0 HA ARG A 97 3.491 -0.283 12.819 1.00 0.00 H new ATOM 0 HB2 ARG A 97 3.823 1.365 15.373 1.00 0.00 H new ATOM 0 HB3 ARG A 97 2.435 1.481 14.309 1.00 0.00 H new ATOM 0 HG2 ARG A 97 1.960 -0.951 14.621 1.00 0.00 H new ATOM 0 HG3 ARG A 97 3.386 -1.119 15.625 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.427 -0.877 17.088 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.418 0.560 17.247 1.00 0.00 H new ATOM 0 HE ARG A 97 0.477 0.997 15.120 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.796 0.593 18.584 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -0.604 1.606 18.951 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -1.305 2.288 15.596 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -1.782 2.556 17.276 1.00 0.00 H new ATOM 1090 N HIS A 98 3.997 1.787 11.534 1.00 0.00 N ATOM 1091 CA HIS A 98 4.409 2.945 10.695 1.00 0.00 C ATOM 1092 C HIS A 98 3.238 3.350 9.804 1.00 0.00 C ATOM 1093 O HIS A 98 3.028 4.515 9.530 1.00 0.00 O ATOM 1094 CB HIS A 98 5.601 2.553 9.818 1.00 0.00 C ATOM 1095 CG HIS A 98 5.299 1.261 9.108 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.214 1.181 7.727 1.00 0.00 N ATOM 1097 CD2 HIS A 98 5.064 -0.009 9.573 1.00 0.00 C ATOM 1098 CE1 HIS A 98 4.943 -0.099 7.411 1.00 0.00 C ATOM 1099 NE2 HIS A 98 4.840 -0.867 8.500 1.00 0.00 N ATOM 0 H HIS A 98 3.253 1.213 11.138 1.00 0.00 H new ATOM 0 HA HIS A 98 4.697 3.778 11.337 1.00 0.00 H new ATOM 0 HB2 HIS A 98 5.806 3.340 9.092 1.00 0.00 H new ATOM 0 HB3 HIS A 98 6.496 2.443 10.430 1.00 0.00 H new ATOM 0 HD1 HIS A 98 5.335 1.952 7.070 1.00 0.00 H new ATOM 0 HD2 HIS A 98 5.054 -0.299 10.613 1.00 0.00 H new ATOM 0 HE1 HIS A 98 4.823 -0.461 6.401 1.00 0.00 H new ATOM 1107 N ALA A 99 2.468 2.394 9.351 1.00 0.00 N ATOM 1108 CA ALA A 99 1.309 2.722 8.475 1.00 0.00 C ATOM 1109 C ALA A 99 0.214 1.668 8.643 1.00 0.00 C ATOM 1110 O ALA A 99 0.465 0.558 9.078 1.00 0.00 O ATOM 1111 CB ALA A 99 1.770 2.753 7.018 1.00 0.00 C ATOM 0 H ALA A 99 2.594 1.402 9.551 1.00 0.00 H new ATOM 0 HA ALA A 99 0.910 3.697 8.755 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.924 2.993 6.374 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.544 3.511 6.897 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.171 1.778 6.742 1.00 0.00 H new ATOM 1117 N GLU A 100 -1.004 2.014 8.301 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.136 1.049 8.435 1.00 0.00 C ATOM 1119 C GLU A 100 -3.027 1.125 7.194 1.00 0.00 C ATOM 1120 O GLU A 100 -3.133 2.156 6.559 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.955 1.416 9.673 1.00 0.00 C ATOM 1122 CG GLU A 100 -4.107 0.423 9.845 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.870 0.747 11.129 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.643 1.814 11.676 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.667 -0.078 11.545 1.00 0.00 O ATOM 0 H GLU A 100 -1.262 2.930 7.933 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.746 0.036 8.534 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.318 1.406 10.558 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.347 2.428 9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.778 0.475 8.987 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.721 -0.595 9.886 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.676 0.036 6.855 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.577 0.017 5.665 1.00 0.00 C ATOM 1134 C PHE A 101 -6.021 -0.124 6.139 1.00 0.00 C ATOM 1135 O PHE A 101 -6.298 -0.825 7.094 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.216 -1.177 4.782 1.00 0.00 C ATOM 1137 CG PHE A 101 -2.841 -0.961 4.199 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.672 -0.077 3.128 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.739 -1.642 4.728 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.398 0.127 2.585 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.466 -1.438 4.185 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.295 -0.554 3.113 1.00 0.00 C ATOM 0 H PHE A 101 -3.617 -0.848 7.360 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.463 0.940 5.097 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.237 -2.097 5.366 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -4.950 -1.290 3.984 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.524 0.448 2.721 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.871 -2.324 5.555 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.266 0.810 1.759 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.385 -1.963 4.593 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.688 -0.398 2.693 1.00 0.00 H new ATOM 1152 N ARG A 102 -6.946 0.539 5.484 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.376 0.449 5.900 1.00 0.00 C ATOM 1154 C ARG A 102 -9.257 0.246 4.676 1.00 0.00 C ATOM 1155 O ARG A 102 -9.032 0.829 3.634 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.775 1.746 6.597 1.00 0.00 C ATOM 1157 CG ARG A 102 -7.932 1.915 7.860 1.00 0.00 C ATOM 1158 CD ARG A 102 -8.292 3.231 8.548 1.00 0.00 C ATOM 1159 NE ARG A 102 -9.702 3.170 9.033 1.00 0.00 N ATOM 1160 CZ ARG A 102 -9.977 2.665 10.209 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -9.023 2.189 10.962 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -11.213 2.632 10.628 1.00 0.00 N ATOM 0 H ARG A 102 -6.768 1.139 4.678 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.504 -0.394 6.579 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.625 2.594 5.928 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.835 1.725 6.852 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.105 1.080 8.539 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.872 1.905 7.605 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.616 3.413 9.384 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -8.171 4.062 7.853 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.456 3.524 8.445 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.057 2.209 10.635 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -9.243 1.797 11.877 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.961 2.999 10.040 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.431 2.239 11.544 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.269 -0.574 4.800 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.190 -0.825 3.654 1.00 0.00 C ATOM 1178 C LEU A 103 -12.483 -0.036 3.862 1.00 0.00 C ATOM 1179 O LEU A 103 -13.121 -0.130 4.893 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.503 -2.323 3.575 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.397 -2.617 2.359 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -11.679 -2.236 1.050 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.738 -4.113 2.342 1.00 0.00 C ATOM 0 H LEU A 103 -10.497 -1.084 5.653 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.719 -0.505 2.725 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.576 -2.892 3.500 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.002 -2.646 4.489 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.309 -2.024 2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.329 -2.452 0.202 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.440 -1.173 1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.759 -2.813 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.372 -4.332 1.483 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.819 -4.695 2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.266 -4.376 3.259 1.00 0.00 H new ATOM 1195 N GLU A 104 -12.872 0.741 2.885 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.123 1.540 3.007 1.00 0.00 C ATOM 1197 C GLU A 104 -14.656 1.859 1.616 1.00 0.00 C ATOM 1198 O GLU A 104 -15.671 1.344 1.191 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.831 2.852 3.741 1.00 0.00 C ATOM 1200 CG GLU A 104 -15.133 3.645 3.908 1.00 0.00 C ATOM 1201 CD GLU A 104 -14.859 4.923 4.699 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -13.807 5.006 5.310 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -15.708 5.799 4.680 1.00 0.00 O ATOM 0 H GLU A 104 -12.372 0.856 2.003 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.861 0.966 3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.391 2.645 4.717 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.104 3.440 3.181 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -15.547 3.892 2.931 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.876 3.038 4.425 1.00 0.00 H new ATOM 1210 N ASN A 105 -13.979 2.717 0.906 1.00 0.00 N ATOM 1211 CA ASN A 105 -14.435 3.090 -0.455 1.00 0.00 C ATOM 1212 C ASN A 105 -14.197 1.920 -1.413 1.00 0.00 C ATOM 1213 O ASN A 105 -13.910 2.116 -2.577 1.00 0.00 O ATOM 1214 CB ASN A 105 -13.647 4.313 -0.928 1.00 0.00 C ATOM 1215 CG ASN A 105 -14.044 5.533 -0.092 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -15.155 6.015 -0.188 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -13.176 6.060 0.731 1.00 0.00 N ATOM 0 H ASN A 105 -13.123 3.178 1.215 1.00 0.00 H new ATOM 0 HA ASN A 105 -15.499 3.325 -0.436 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -12.577 4.128 -0.834 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -13.847 4.501 -1.983 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.432 6.874 1.290 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -12.242 5.658 0.814 1.00 0.00 H new ATOM 1224 N ASN A 106 -14.302 0.704 -0.927 1.00 0.00 N ATOM 1225 CA ASN A 106 -14.078 -0.490 -1.795 1.00 0.00 C ATOM 1226 C ASN A 106 -12.838 -0.266 -2.663 1.00 0.00 C ATOM 1227 O ASN A 106 -12.730 -0.771 -3.765 1.00 0.00 O ATOM 1228 CB ASN A 106 -15.312 -0.751 -2.672 1.00 0.00 C ATOM 1229 CG ASN A 106 -15.514 0.393 -3.665 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -14.785 0.513 -4.628 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -16.484 1.244 -3.473 1.00 0.00 N ATOM 0 H ASN A 106 -14.535 0.490 0.043 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.917 -1.366 -1.167 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.191 -1.691 -3.211 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.197 -0.856 -2.044 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.629 2.009 -4.132 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.097 1.144 -2.664 1.00 0.00 H new ATOM 1238 N GLU A 107 -11.895 0.490 -2.158 1.00 0.00 N ATOM 1239 CA GLU A 107 -10.639 0.763 -2.923 1.00 0.00 C ATOM 1240 C GLU A 107 -9.463 0.840 -1.945 1.00 0.00 C ATOM 1241 O GLU A 107 -8.371 1.228 -2.304 1.00 0.00 O ATOM 1242 CB GLU A 107 -10.778 2.083 -3.689 1.00 0.00 C ATOM 1243 CG GLU A 107 -11.737 1.891 -4.869 1.00 0.00 C ATOM 1244 CD GLU A 107 -11.936 3.223 -5.594 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -11.368 4.206 -5.150 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -12.653 3.236 -6.581 1.00 0.00 O ATOM 0 H GLU A 107 -11.942 0.933 -1.241 1.00 0.00 H new ATOM 0 HA GLU A 107 -10.460 -0.039 -3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -11.152 2.863 -3.026 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -9.803 2.411 -4.049 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -11.337 1.147 -5.558 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -12.695 1.513 -4.513 1.00 0.00 H new ATOM 1253 N PHE A 108 -9.697 0.463 -0.714 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.631 0.486 0.329 1.00 0.00 C ATOM 1255 C PHE A 108 -8.065 1.898 0.485 1.00 0.00 C ATOM 1256 O PHE A 108 -7.941 2.637 -0.472 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.499 -0.479 -0.042 1.00 0.00 C ATOM 1258 CG PHE A 108 -7.996 -1.901 0.042 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -7.938 -2.586 1.260 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.509 -2.534 -1.096 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.393 -3.907 1.340 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -8.965 -3.853 -1.015 1.00 0.00 C ATOM 1263 CZ PHE A 108 -8.908 -4.540 0.203 1.00 0.00 C ATOM 0 H PHE A 108 -10.603 0.133 -0.382 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.074 0.172 1.274 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.143 -0.267 -1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.653 -0.339 0.631 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.543 -2.096 2.138 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.553 -2.004 -2.036 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.347 -4.438 2.279 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.361 -4.342 -1.893 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.261 -5.559 0.265 1.00 0.00 H new ATOM 1273 N ASN A 109 -7.714 2.271 1.693 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.142 3.630 1.940 1.00 0.00 C ATOM 1275 C ASN A 109 -5.911 3.489 2.831 1.00 0.00 C ATOM 1276 O ASN A 109 -5.709 2.466 3.456 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.178 4.505 2.651 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.483 4.509 1.854 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.476 4.351 0.651 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -10.613 4.678 2.481 1.00 0.00 N ATOM 0 H ASN A 109 -7.801 1.686 2.524 1.00 0.00 H new ATOM 0 HA ASN A 109 -6.870 4.092 0.991 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.357 4.128 3.658 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -7.800 5.522 2.754 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.490 4.677 1.960 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -10.620 4.811 3.492 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.089 4.509 2.893 1.00 0.00 N ATOM 1288 CA VAL A 110 -3.860 4.450 3.741 1.00 0.00 C ATOM 1289 C VAL A 110 -3.908 5.562 4.785 1.00 0.00 C ATOM 1290 O VAL A 110 -4.195 6.707 4.476 1.00 0.00 O ATOM 1291 CB VAL A 110 -2.619 4.624 2.860 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -2.691 5.957 2.111 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.371 4.604 3.743 1.00 0.00 C ATOM 0 H VAL A 110 -5.219 5.386 2.388 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.812 3.484 4.243 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.574 3.811 2.135 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.805 6.072 1.487 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.582 5.974 1.483 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.738 6.776 2.829 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.484 4.727 3.122 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.424 5.418 4.466 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.314 3.652 4.271 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.637 5.223 6.026 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.664 6.233 7.126 1.00 0.00 C ATOM 1305 C VAL A 111 -2.354 6.162 7.920 1.00 0.00 C ATOM 1306 O VAL A 111 -1.894 5.096 8.280 1.00 0.00 O ATOM 1307 CB VAL A 111 -4.840 5.922 8.058 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.756 6.795 9.315 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.153 6.204 7.322 1.00 0.00 C ATOM 0 H VAL A 111 -3.396 4.277 6.323 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.777 7.232 6.705 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.801 4.873 8.353 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.595 6.568 9.972 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.821 6.592 9.837 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.792 7.847 9.031 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.994 5.984 7.980 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.187 7.253 7.028 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.214 5.576 6.433 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.753 7.290 8.197 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.483 7.296 8.969 1.00 0.00 C ATOM 1321 C ASP A 112 -0.796 7.243 10.469 1.00 0.00 C ATOM 1322 O ASP A 112 -1.384 8.151 11.024 1.00 0.00 O ATOM 1323 CB ASP A 112 0.279 8.579 8.648 1.00 0.00 C ATOM 1324 CG ASP A 112 0.801 8.507 7.214 1.00 0.00 C ATOM 1325 OD1 ASP A 112 0.699 7.444 6.620 1.00 0.00 O ATOM 1326 OD2 ASP A 112 1.292 9.514 6.731 1.00 0.00 O ATOM 0 H ASP A 112 -2.092 8.211 7.918 1.00 0.00 H new ATOM 0 HA ASP A 112 0.121 6.430 8.700 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.374 9.444 8.767 1.00 0.00 H new ATOM 0 HB3 ASP A 112 1.108 8.708 9.344 1.00 0.00 H new ATOM 1331 N VAL A 113 -0.419 6.176 11.120 1.00 0.00 N ATOM 1332 CA VAL A 113 -0.702 6.032 12.578 1.00 0.00 C ATOM 1333 C VAL A 113 -0.065 7.175 13.377 1.00 0.00 C ATOM 1334 O VAL A 113 0.535 8.079 12.829 1.00 0.00 O ATOM 1335 CB VAL A 113 -0.129 4.695 13.063 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -1.049 3.555 12.623 1.00 0.00 C ATOM 1337 CG2 VAL A 113 1.260 4.483 12.452 1.00 0.00 C ATOM 0 H VAL A 113 0.078 5.390 10.700 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.781 6.065 12.732 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.055 4.708 14.150 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -0.641 2.605 12.968 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.040 3.702 13.052 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.122 3.545 11.535 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.668 3.533 12.796 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.181 4.471 11.365 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.920 5.294 12.759 1.00 0.00 H new ATOM 1405 N THR A 119 4.980 9.461 5.808 1.00 0.00 N ATOM 1406 CA THR A 119 4.475 8.803 4.577 1.00 0.00 C ATOM 1407 C THR A 119 3.761 9.817 3.686 1.00 0.00 C ATOM 1408 O THR A 119 2.975 10.622 4.148 1.00 0.00 O ATOM 1409 CB THR A 119 3.506 7.684 4.961 1.00 0.00 C ATOM 1410 OG1 THR A 119 4.127 6.846 5.925 1.00 0.00 O ATOM 1411 CG2 THR A 119 3.156 6.864 3.718 1.00 0.00 C ATOM 0 HA THR A 119 5.318 8.387 4.026 1.00 0.00 H new ATOM 0 HB THR A 119 2.594 8.111 5.378 1.00 0.00 H new ATOM 0 HG1 THR A 119 4.798 7.360 6.421 1.00 0.00 H new ATOM 0 HG21 THR A 119 2.465 6.066 3.991 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.688 7.511 2.975 1.00 0.00 H new ATOM 0 HG23 THR A 119 4.065 6.430 3.301 1.00 0.00 H new ATOM 1419 N TYR A 120 4.021 9.773 2.404 1.00 0.00 N ATOM 1420 CA TYR A 120 3.357 10.719 1.465 1.00 0.00 C ATOM 1421 C TYR A 120 3.022 9.986 0.172 1.00 0.00 C ATOM 1422 O TYR A 120 3.612 8.969 -0.139 1.00 0.00 O ATOM 1423 CB TYR A 120 4.293 11.891 1.160 1.00 0.00 C ATOM 1424 CG TYR A 120 5.605 11.374 0.609 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.703 10.996 -0.738 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.727 11.284 1.441 1.00 0.00 C ATOM 1427 CE1 TYR A 120 6.922 10.531 -1.248 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.944 10.818 0.931 1.00 0.00 C ATOM 1429 CZ TYR A 120 8.043 10.441 -0.413 1.00 0.00 C ATOM 1430 OH TYR A 120 9.245 9.987 -0.917 1.00 0.00 O ATOM 0 H TYR A 120 4.669 9.117 1.968 1.00 0.00 H new ATOM 0 HA TYR A 120 2.443 11.101 1.920 1.00 0.00 H new ATOM 0 HB2 TYR A 120 3.826 12.563 0.440 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.472 12.470 2.066 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.839 11.063 -1.382 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.653 11.575 2.479 1.00 0.00 H new ATOM 0 HE1 TYR A 120 6.998 10.242 -2.286 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.808 10.749 1.575 1.00 0.00 H new ATOM 0 HH TYR A 120 9.076 9.366 -1.656 1.00 0.00 H new ATOM 1440 N VAL A 121 2.072 10.493 -0.578 1.00 0.00 N ATOM 1441 CA VAL A 121 1.676 9.831 -1.857 1.00 0.00 C ATOM 1442 C VAL A 121 1.868 10.800 -3.026 1.00 0.00 C ATOM 1443 O VAL A 121 1.401 11.922 -3.003 1.00 0.00 O ATOM 1444 CB VAL A 121 0.210 9.397 -1.763 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.709 10.621 -1.796 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.117 8.480 -2.942 1.00 0.00 C ATOM 0 H VAL A 121 1.552 11.342 -0.356 1.00 0.00 H new ATOM 0 HA VAL A 121 2.302 8.955 -2.027 1.00 0.00 H new ATOM 0 HB VAL A 121 0.053 8.866 -0.824 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.748 10.298 -1.728 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.476 11.273 -0.954 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.558 11.164 -2.729 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.159 8.167 -2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.047 9.016 -3.877 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.528 7.602 -2.910 1.00 0.00 H new ATOM 1456 N ASN A 122 2.553 10.363 -4.050 1.00 0.00 N ATOM 1457 CA ASN A 122 2.786 11.236 -5.233 1.00 0.00 C ATOM 1458 C ASN A 122 3.419 12.554 -4.782 1.00 0.00 C ATOM 1459 O ASN A 122 3.104 13.610 -5.293 1.00 0.00 O ATOM 1460 CB ASN A 122 1.464 11.495 -5.958 1.00 0.00 C ATOM 1461 CG ASN A 122 0.992 10.192 -6.607 1.00 0.00 C ATOM 1462 OD1 ASN A 122 1.776 9.289 -6.821 1.00 0.00 O ATOM 1463 ND2 ASN A 122 -0.265 10.049 -6.929 1.00 0.00 N ATOM 0 H ASN A 122 2.963 9.431 -4.116 1.00 0.00 H new ATOM 0 HA ASN A 122 3.467 10.738 -5.923 1.00 0.00 H new ATOM 0 HB2 ASN A 122 0.714 11.860 -5.256 1.00 0.00 H new ATOM 0 HB3 ASN A 122 1.594 12.268 -6.715 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.586 9.181 -7.359 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.926 10.805 -6.751 1.00 0.00 H new ATOM 1470 N ARG A 123 4.311 12.491 -3.823 1.00 0.00 N ATOM 1471 CA ARG A 123 4.990 13.720 -3.315 1.00 0.00 C ATOM 1472 C ARG A 123 3.960 14.695 -2.745 1.00 0.00 C ATOM 1473 O ARG A 123 4.022 15.889 -2.973 1.00 0.00 O ATOM 1474 CB ARG A 123 5.781 14.394 -4.449 1.00 0.00 C ATOM 1475 CG ARG A 123 6.754 13.389 -5.087 1.00 0.00 C ATOM 1476 CD ARG A 123 7.949 13.141 -4.159 1.00 0.00 C ATOM 1477 NE ARG A 123 8.974 12.329 -4.879 1.00 0.00 N ATOM 1478 CZ ARG A 123 9.784 11.541 -4.219 1.00 0.00 C ATOM 1479 NH1 ARG A 123 9.706 11.452 -2.918 1.00 0.00 N ATOM 1480 NH2 ARG A 123 10.679 10.844 -4.863 1.00 0.00 N ATOM 0 H ARG A 123 4.600 11.626 -3.366 1.00 0.00 H new ATOM 0 HA ARG A 123 5.681 13.435 -2.522 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.094 14.776 -5.204 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.333 15.249 -4.059 1.00 0.00 H new ATOM 0 HG2 ARG A 123 6.238 12.449 -5.286 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.103 13.770 -6.047 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.379 14.090 -3.840 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.623 12.620 -3.259 1.00 0.00 H new ATOM 0 HE ARG A 123 9.044 12.389 -5.895 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.011 11.999 -2.410 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.341 10.836 -2.410 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.746 10.914 -5.878 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.312 10.229 -4.351 1.00 0.00 H new ATOM 1494 N GLU A 124 3.025 14.193 -1.985 1.00 0.00 N ATOM 1495 CA GLU A 124 1.995 15.074 -1.370 1.00 0.00 C ATOM 1496 C GLU A 124 1.583 14.493 -0.011 1.00 0.00 C ATOM 1497 O GLU A 124 0.635 13.738 0.079 1.00 0.00 O ATOM 1498 CB GLU A 124 0.777 15.151 -2.290 1.00 0.00 C ATOM 1499 CG GLU A 124 1.165 15.879 -3.579 1.00 0.00 C ATOM 1500 CD GLU A 124 -0.094 16.260 -4.353 1.00 0.00 C ATOM 1501 OE1 GLU A 124 -1.103 16.515 -3.716 1.00 0.00 O ATOM 1502 OE2 GLU A 124 -0.029 16.295 -5.570 1.00 0.00 O ATOM 0 H GLU A 124 2.931 13.202 -1.763 1.00 0.00 H new ATOM 0 HA GLU A 124 2.401 16.076 -1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 124 0.415 14.149 -2.519 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.037 15.677 -1.792 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.743 16.772 -3.344 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.801 15.240 -4.192 1.00 0.00 H new ATOM 1509 N PRO A 125 2.292 14.836 1.040 1.00 0.00 N ATOM 1510 CA PRO A 125 1.984 14.331 2.413 1.00 0.00 C ATOM 1511 C PRO A 125 0.526 14.585 2.806 1.00 0.00 C ATOM 1512 O PRO A 125 0.019 15.681 2.672 1.00 0.00 O ATOM 1513 CB PRO A 125 2.950 15.119 3.318 1.00 0.00 C ATOM 1514 CG PRO A 125 4.076 15.528 2.421 1.00 0.00 C ATOM 1515 CD PRO A 125 3.462 15.729 1.035 1.00 0.00 C ATOM 0 HA PRO A 125 2.111 13.251 2.492 1.00 0.00 H new ATOM 0 HB2 PRO A 125 2.459 15.988 3.757 1.00 0.00 H new ATOM 0 HB3 PRO A 125 3.307 14.504 4.144 1.00 0.00 H new ATOM 0 HG2 PRO A 125 4.544 16.446 2.777 1.00 0.00 H new ATOM 0 HG3 PRO A 125 4.852 14.763 2.396 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.173 16.767 0.872 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.164 15.465 0.244 1.00 0.00 H new ATOM 1523 N VAL A 126 -0.154 13.577 3.290 1.00 0.00 N ATOM 1524 CA VAL A 126 -1.581 13.757 3.686 1.00 0.00 C ATOM 1525 C VAL A 126 -1.921 12.854 4.873 1.00 0.00 C ATOM 1526 O VAL A 126 -1.316 11.821 5.076 1.00 0.00 O ATOM 1527 CB VAL A 126 -2.489 13.392 2.507 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -2.376 14.463 1.423 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -2.066 12.039 1.925 1.00 0.00 C ATOM 0 H VAL A 126 0.218 12.637 3.428 1.00 0.00 H new ATOM 0 HA VAL A 126 -1.736 14.798 3.970 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.520 13.331 2.857 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.022 14.202 0.585 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -2.681 15.427 1.830 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -1.344 14.525 1.079 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.715 11.784 1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -1.034 12.098 1.580 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -2.148 11.271 2.694 1.00 0.00 H new ATOM 1539 N ASP A 127 -2.902 13.238 5.642 1.00 0.00 N ATOM 1540 CA ASP A 127 -3.317 12.413 6.806 1.00 0.00 C ATOM 1541 C ASP A 127 -3.870 11.080 6.303 1.00 0.00 C ATOM 1542 O ASP A 127 -3.629 10.036 6.877 1.00 0.00 O ATOM 1543 CB ASP A 127 -4.404 13.157 7.577 1.00 0.00 C ATOM 1544 CG ASP A 127 -3.782 14.340 8.320 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -2.568 14.372 8.435 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -4.531 15.197 8.758 1.00 0.00 O ATOM 0 H ASP A 127 -3.437 14.096 5.511 1.00 0.00 H new ATOM 0 HA ASP A 127 -2.463 12.230 7.458 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -5.175 13.509 6.892 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.889 12.484 8.284 1.00 0.00 H new ATOM 1551 N SER A 128 -4.617 11.107 5.230 1.00 0.00 N ATOM 1552 CA SER A 128 -5.189 9.847 4.687 1.00 0.00 C ATOM 1553 C SER A 128 -5.514 10.029 3.205 1.00 0.00 C ATOM 1554 O SER A 128 -5.702 11.134 2.735 1.00 0.00 O ATOM 1555 CB SER A 128 -6.473 9.506 5.445 1.00 0.00 C ATOM 1556 OG SER A 128 -7.468 10.477 5.146 1.00 0.00 O ATOM 0 H SER A 128 -4.854 11.951 4.708 1.00 0.00 H new ATOM 0 HA SER A 128 -4.465 9.040 4.805 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.822 8.513 5.163 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.281 9.484 6.518 1.00 0.00 H new ATOM 0 HG SER A 128 -8.293 10.260 5.629 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.589 8.954 2.464 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.910 9.079 1.016 1.00 0.00 C ATOM 1564 C ALA A 129 -6.369 7.726 0.468 1.00 0.00 C ATOM 1565 O ALA A 129 -5.964 6.683 0.944 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.670 9.550 0.253 1.00 0.00 C ATOM 0 H ALA A 129 -5.442 8.002 2.799 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.711 9.807 0.888 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.908 9.641 -0.807 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -4.352 10.519 0.638 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.866 8.826 0.384 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.219 7.739 -0.522 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.721 6.464 -1.101 1.00 0.00 C ATOM 1574 C VAL A 130 -6.698 5.882 -2.079 1.00 0.00 C ATOM 1575 O VAL A 130 -6.123 6.586 -2.886 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.037 6.725 -1.830 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.523 5.434 -2.489 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.078 7.209 -0.820 1.00 0.00 C ATOM 0 H VAL A 130 -7.589 8.585 -0.956 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.881 5.747 -0.296 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.888 7.484 -2.598 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.462 5.622 -3.009 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.776 5.087 -3.203 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -9.677 4.671 -1.726 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -11.021 7.398 -1.332 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.226 6.446 -0.056 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.729 8.129 -0.351 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.462 4.599 -2.006 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.475 3.969 -2.923 1.00 0.00 C ATOM 1590 C LEU A 131 -6.085 3.813 -4.313 1.00 0.00 C ATOM 1591 O LEU A 131 -7.279 3.633 -4.456 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.091 2.598 -2.375 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.435 2.757 -0.997 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.144 1.370 -0.415 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.122 3.556 -1.119 1.00 0.00 C ATOM 0 H LEU A 131 -6.912 3.961 -1.349 1.00 0.00 H new ATOM 0 HA LEU A 131 -4.589 4.599 -2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -5.976 1.966 -2.297 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.404 2.101 -3.060 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.113 3.299 -0.338 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.678 1.477 0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.077 0.815 -0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.470 0.830 -1.081 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.667 3.661 -0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.435 3.029 -1.781 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.334 4.544 -1.528 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.269 3.884 -5.340 1.00 0.00 N ATOM 1608 CA ALA A 132 -5.780 3.749 -6.738 1.00 0.00 C ATOM 1609 C ALA A 132 -4.989 2.667 -7.476 1.00 0.00 C ATOM 1610 O ALA A 132 -3.864 2.360 -7.138 1.00 0.00 O ATOM 1611 CB ALA A 132 -5.622 5.084 -7.460 1.00 0.00 C ATOM 0 H ALA A 132 -4.262 4.031 -5.266 1.00 0.00 H new ATOM 0 HA ALA A 132 -6.833 3.467 -6.716 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.993 4.992 -8.481 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -6.191 5.851 -6.935 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.569 5.364 -7.481 1.00 0.00 H new ATOM 1617 N ASN A 133 -5.589 2.075 -8.471 1.00 0.00 N ATOM 1618 CA ASN A 133 -4.909 0.994 -9.232 1.00 0.00 C ATOM 1619 C ASN A 133 -3.568 1.484 -9.791 1.00 0.00 C ATOM 1620 O ASN A 133 -3.511 2.356 -10.638 1.00 0.00 O ATOM 1621 CB ASN A 133 -5.828 0.560 -10.375 1.00 0.00 C ATOM 1622 CG ASN A 133 -5.193 -0.595 -11.147 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -4.751 -0.420 -12.264 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -5.136 -1.780 -10.601 1.00 0.00 N ATOM 0 H ASN A 133 -6.531 2.298 -8.791 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.706 0.152 -8.570 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -6.796 0.254 -9.978 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -6.009 1.400 -11.045 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -4.720 -2.558 -11.113 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -5.507 -1.927 -9.662 1.00 0.00 H new ATOM 1631 N GLY A 134 -2.487 0.908 -9.322 1.00 0.00 N ATOM 1632 CA GLY A 134 -1.137 1.309 -9.813 1.00 0.00 C ATOM 1633 C GLY A 134 -0.650 2.538 -9.042 1.00 0.00 C ATOM 1634 O GLY A 134 0.281 3.205 -9.445 1.00 0.00 O ATOM 0 H GLY A 134 -2.485 0.173 -8.615 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.434 0.486 -9.685 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -1.179 1.530 -10.880 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.273 2.846 -7.935 1.00 0.00 N ATOM 1639 CA ASP A 135 -0.848 4.035 -7.142 1.00 0.00 C ATOM 1640 C ASP A 135 0.576 3.830 -6.612 1.00 0.00 C ATOM 1641 O ASP A 135 0.975 2.729 -6.287 1.00 0.00 O ATOM 1642 CB ASP A 135 -1.812 4.233 -5.969 1.00 0.00 C ATOM 1643 CG ASP A 135 -1.445 5.505 -5.198 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -0.459 6.130 -5.551 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -2.164 5.837 -4.271 1.00 0.00 O ATOM 0 H ASP A 135 -2.059 2.324 -7.546 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.864 4.918 -7.781 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.836 4.303 -6.337 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.771 3.370 -5.304 1.00 0.00 H new ATOM 1650 N GLU A 136 1.346 4.885 -6.522 1.00 0.00 N ATOM 1651 CA GLU A 136 2.743 4.762 -6.019 1.00 0.00 C ATOM 1652 C GLU A 136 2.769 5.030 -4.515 1.00 0.00 C ATOM 1653 O GLU A 136 2.366 6.082 -4.058 1.00 0.00 O ATOM 1654 CB GLU A 136 3.619 5.794 -6.729 1.00 0.00 C ATOM 1655 CG GLU A 136 3.770 5.400 -8.198 1.00 0.00 C ATOM 1656 CD GLU A 136 4.584 6.463 -8.936 1.00 0.00 C ATOM 1657 OE1 GLU A 136 4.946 7.445 -8.310 1.00 0.00 O ATOM 1658 OE2 GLU A 136 4.837 6.274 -10.114 1.00 0.00 O ATOM 0 H GLU A 136 1.063 5.831 -6.778 1.00 0.00 H new ATOM 0 HA GLU A 136 3.117 3.757 -6.215 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.171 6.785 -6.650 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.598 5.848 -6.252 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.264 4.431 -8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 136 2.788 5.295 -8.659 1.00 0.00 H new ATOM 1665 N VAL A 137 3.246 4.079 -3.745 1.00 0.00 N ATOM 1666 CA VAL A 137 3.315 4.249 -2.262 1.00 0.00 C ATOM 1667 C VAL A 137 4.761 4.082 -1.810 1.00 0.00 C ATOM 1668 O VAL A 137 5.435 3.147 -2.198 1.00 0.00 O ATOM 1669 CB VAL A 137 2.440 3.187 -1.587 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.711 3.170 -0.076 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.968 3.520 -1.838 1.00 0.00 C ATOM 0 H VAL A 137 3.594 3.183 -4.088 1.00 0.00 H new ATOM 0 HA VAL A 137 2.956 5.240 -1.986 1.00 0.00 H new ATOM 0 HB VAL A 137 2.674 2.206 -2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 137 2.086 2.413 0.397 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.761 2.937 0.103 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.479 4.148 0.346 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.339 2.769 -1.361 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.741 4.501 -1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.774 3.527 -2.911 1.00 0.00 H new ATOM 1681 N GLN A 138 5.235 4.981 -0.983 1.00 0.00 N ATOM 1682 CA GLN A 138 6.636 4.892 -0.480 1.00 0.00 C ATOM 1683 C GLN A 138 6.620 4.846 1.044 1.00 0.00 C ATOM 1684 O GLN A 138 6.064 5.712 1.692 1.00 0.00 O ATOM 1685 CB GLN A 138 7.427 6.115 -0.941 1.00 0.00 C ATOM 1686 CG GLN A 138 8.869 5.986 -0.449 1.00 0.00 C ATOM 1687 CD GLN A 138 9.720 7.102 -1.047 1.00 0.00 C ATOM 1688 OE1 GLN A 138 9.345 7.710 -2.029 1.00 0.00 O ATOM 1689 NE2 GLN A 138 10.860 7.398 -0.489 1.00 0.00 N ATOM 0 H GLN A 138 4.704 5.779 -0.633 1.00 0.00 H new ATOM 0 HA GLN A 138 7.106 3.990 -0.872 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.405 6.190 -2.028 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.975 7.026 -0.549 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.898 6.038 0.639 1.00 0.00 H new ATOM 0 HG3 GLN A 138 9.274 5.015 -0.733 1.00 0.00 H new ATOM 0 HE21 GLN A 138 11.172 6.886 0.336 1.00 0.00 H new ATOM 0 HE22 GLN A 138 11.440 8.142 -0.877 1.00 0.00 H new ATOM 1698 N ILE A 139 7.231 3.837 1.617 1.00 0.00 N ATOM 1699 CA ILE A 139 7.272 3.707 3.105 1.00 0.00 C ATOM 1700 C ILE A 139 8.723 3.600 3.580 1.00 0.00 C ATOM 1701 O ILE A 139 9.492 2.802 3.084 1.00 0.00 O ATOM 1702 CB ILE A 139 6.498 2.454 3.518 1.00 0.00 C ATOM 1703 CG1 ILE A 139 5.016 2.645 3.183 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.659 2.227 5.022 1.00 0.00 C ATOM 1705 CD1 ILE A 139 4.273 1.319 3.351 1.00 0.00 C ATOM 0 H ILE A 139 7.708 3.091 1.110 1.00 0.00 H new ATOM 0 HA ILE A 139 6.817 4.587 3.561 1.00 0.00 H new ATOM 0 HB ILE A 139 6.886 1.589 2.980 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.581 3.402 3.836 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.908 3.006 2.160 1.00 0.00 H new ATOM 0 HG21 ILE A 139 6.107 1.334 5.316 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.715 2.096 5.259 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.270 3.089 5.564 1.00 0.00 H new ATOM 0 HD11 ILE A 139 3.219 1.460 3.112 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.701 0.574 2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.368 0.976 4.381 1.00 0.00 H new ATOM 1717 N GLY A 140 9.091 4.397 4.549 1.00 0.00 N ATOM 1718 CA GLY A 140 10.481 4.351 5.081 1.00 0.00 C ATOM 1719 C GLY A 140 11.491 4.561 3.951 1.00 0.00 C ATOM 1720 O GLY A 140 11.904 5.669 3.671 1.00 0.00 O ATOM 0 H GLY A 140 8.482 5.082 4.996 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.612 5.120 5.842 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.661 3.391 5.564 1.00 0.00 H new ATOM 1724 N LYS A 141 11.895 3.499 3.305 1.00 0.00 N ATOM 1725 CA LYS A 141 12.880 3.609 2.194 1.00 0.00 C ATOM 1726 C LYS A 141 12.493 2.617 1.099 1.00 0.00 C ATOM 1727 O LYS A 141 13.099 2.567 0.047 1.00 0.00 O ATOM 1728 CB LYS A 141 14.281 3.280 2.726 1.00 0.00 C ATOM 1729 CG LYS A 141 14.764 4.410 3.643 1.00 0.00 C ATOM 1730 CD LYS A 141 16.165 4.082 4.173 1.00 0.00 C ATOM 1731 CE LYS A 141 16.680 5.255 5.013 1.00 0.00 C ATOM 1732 NZ LYS A 141 15.804 5.440 6.205 1.00 0.00 N ATOM 0 H LYS A 141 11.579 2.550 3.504 1.00 0.00 H new ATOM 0 HA LYS A 141 12.882 4.621 1.788 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.261 2.338 3.274 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.975 3.151 1.895 1.00 0.00 H new ATOM 0 HG2 LYS A 141 14.783 5.352 3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 141 14.071 4.538 4.474 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.134 3.175 4.776 1.00 0.00 H new ATOM 0 HD3 LYS A 141 16.844 3.890 3.342 1.00 0.00 H new ATOM 0 HE2 LYS A 141 17.706 5.066 5.329 1.00 0.00 H new ATOM 0 HE3 LYS A 141 16.693 6.166 4.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 16.297 6.024 6.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 14.923 5.913 5.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 15.580 4.512 6.619 1.00 0.00 H new ATOM 1746 N PHE A 142 11.479 1.821 1.344 1.00 0.00 N ATOM 1747 CA PHE A 142 11.037 0.823 0.328 1.00 0.00 C ATOM 1748 C PHE A 142 9.866 1.384 -0.478 1.00 0.00 C ATOM 1749 O PHE A 142 8.988 2.034 0.057 1.00 0.00 O ATOM 1750 CB PHE A 142 10.599 -0.460 1.043 1.00 0.00 C ATOM 1751 CG PHE A 142 11.819 -1.222 1.495 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.408 -2.160 0.640 1.00 0.00 C ATOM 1753 CD2 PHE A 142 12.364 -0.986 2.760 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.542 -2.867 1.052 1.00 0.00 C ATOM 1755 CE2 PHE A 142 13.500 -1.691 3.173 1.00 0.00 C ATOM 1756 CZ PHE A 142 14.089 -2.631 2.319 1.00 0.00 C ATOM 0 H PHE A 142 10.939 1.823 2.209 1.00 0.00 H new ATOM 0 HA PHE A 142 11.862 0.605 -0.350 1.00 0.00 H new ATOM 0 HB2 PHE A 142 9.971 -0.216 1.900 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.999 -1.076 0.373 1.00 0.00 H new ATOM 0 HD1 PHE A 142 11.987 -2.338 -0.338 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.909 -0.260 3.418 1.00 0.00 H new ATOM 0 HE1 PHE A 142 13.995 -3.594 0.394 1.00 0.00 H new ATOM 0 HE2 PHE A 142 13.922 -1.510 4.150 1.00 0.00 H new ATOM 0 HZ PHE A 142 14.966 -3.175 2.638 1.00 0.00 H new ATOM 1766 N ARG A 143 9.849 1.132 -1.766 1.00 0.00 N ATOM 1767 CA ARG A 143 8.741 1.642 -2.627 1.00 0.00 C ATOM 1768 C ARG A 143 7.793 0.501 -2.988 1.00 0.00 C ATOM 1769 O ARG A 143 8.212 -0.539 -3.458 1.00 0.00 O ATOM 1770 CB ARG A 143 9.333 2.230 -3.908 1.00 0.00 C ATOM 1771 CG ARG A 143 10.083 3.521 -3.572 1.00 0.00 C ATOM 1772 CD ARG A 143 10.699 4.103 -4.845 1.00 0.00 C ATOM 1773 NE ARG A 143 11.444 5.348 -4.505 1.00 0.00 N ATOM 1774 CZ ARG A 143 11.827 6.168 -5.448 1.00 0.00 C ATOM 1775 NH1 ARG A 143 11.563 5.902 -6.698 1.00 0.00 N ATOM 1776 NH2 ARG A 143 12.478 7.255 -5.137 1.00 0.00 N ATOM 0 H ARG A 143 10.561 0.592 -2.258 1.00 0.00 H new ATOM 0 HA ARG A 143 8.187 2.409 -2.085 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.010 1.513 -4.372 1.00 0.00 H new ATOM 0 HB3 ARG A 143 8.541 2.433 -4.629 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.401 4.243 -3.123 1.00 0.00 H new ATOM 0 HG3 ARG A 143 10.863 3.320 -2.838 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.371 3.377 -5.303 1.00 0.00 H new ATOM 0 HD3 ARG A 143 9.919 4.320 -5.574 1.00 0.00 H new ATOM 0 HE ARG A 143 11.656 5.562 -3.530 1.00 0.00 H new ATOM 0 HH11 ARG A 143 11.056 5.051 -6.942 1.00 0.00 H new ATOM 0 HH12 ARG A 143 11.864 6.545 -7.431 1.00 0.00 H new ATOM 0 HH21 ARG A 143 12.687 7.463 -4.160 1.00 0.00 H new ATOM 0 HH22 ARG A 143 12.778 7.897 -5.870 1.00 0.00 H new ATOM 1790 N LEU A 144 6.514 0.701 -2.786 1.00 0.00 N ATOM 1791 CA LEU A 144 5.511 -0.349 -3.126 1.00 0.00 C ATOM 1792 C LEU A 144 4.431 0.270 -4.001 1.00 0.00 C ATOM 1793 O LEU A 144 4.134 1.442 -3.890 1.00 0.00 O ATOM 1794 CB LEU A 144 4.872 -0.890 -1.842 1.00 0.00 C ATOM 1795 CG LEU A 144 5.924 -1.655 -1.001 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.579 -0.711 0.011 1.00 0.00 C ATOM 1797 CD2 LEU A 144 5.247 -2.805 -0.245 1.00 0.00 C ATOM 0 H LEU A 144 6.120 1.557 -2.396 1.00 0.00 H new ATOM 0 HA LEU A 144 6.001 -1.166 -3.655 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.458 -0.067 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 144 4.043 -1.553 -2.091 1.00 0.00 H new ATOM 0 HG LEU A 144 6.686 -2.051 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.317 -1.260 0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 144 7.070 0.105 -0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.817 -0.305 0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.991 -3.340 0.345 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.479 -2.403 0.417 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.789 -3.490 -0.959 1.00 0.00 H new ATOM 1809 N VAL A 145 3.843 -0.511 -4.871 1.00 0.00 N ATOM 1810 CA VAL A 145 2.776 0.018 -5.770 1.00 0.00 C ATOM 1811 C VAL A 145 1.481 -0.760 -5.523 1.00 0.00 C ATOM 1812 O VAL A 145 1.459 -1.976 -5.519 1.00 0.00 O ATOM 1813 CB VAL A 145 3.228 -0.130 -7.229 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.731 -1.553 -7.486 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.056 0.175 -8.165 1.00 0.00 C ATOM 0 H VAL A 145 4.059 -1.500 -4.997 1.00 0.00 H new ATOM 0 HA VAL A 145 2.596 1.073 -5.564 1.00 0.00 H new ATOM 0 HB VAL A 145 4.039 0.573 -7.419 1.00 0.00 H new ATOM 0 HG11 VAL A 145 4.049 -1.645 -8.525 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.574 -1.765 -6.829 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.929 -2.264 -7.288 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.380 0.069 -9.200 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.241 -0.521 -7.967 1.00 0.00 H new ATOM 0 HG23 VAL A 145 1.711 1.195 -7.995 1.00 0.00 H new ATOM 1825 N PHE A 146 0.404 -0.051 -5.302 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.904 -0.709 -5.036 1.00 0.00 C ATOM 1827 C PHE A 146 -1.642 -0.931 -6.353 1.00 0.00 C ATOM 1828 O PHE A 146 -1.808 -0.023 -7.145 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.732 0.199 -4.127 1.00 0.00 C ATOM 1830 CG PHE A 146 -3.094 -0.406 -3.903 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -3.290 -1.332 -2.872 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -4.164 -0.039 -4.726 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -4.555 -1.889 -2.664 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -5.430 -0.596 -4.518 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.626 -1.520 -3.486 1.00 0.00 C ATOM 0 H PHE A 146 0.378 0.969 -5.295 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.746 -1.673 -4.552 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.223 0.335 -3.173 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.832 1.186 -4.578 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -2.464 -1.616 -2.237 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.012 0.675 -5.522 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.706 -2.604 -1.869 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -6.256 -0.313 -5.154 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.604 -1.949 -3.324 1.00 0.00 H new ATOM 1845 N LEU A 147 -2.074 -2.142 -6.600 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.788 -2.444 -7.872 1.00 0.00 C ATOM 1847 C LEU A 147 -3.900 -3.458 -7.620 1.00 0.00 C ATOM 1848 O LEU A 147 -4.054 -3.984 -6.535 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.812 -3.020 -8.901 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.985 -4.147 -8.270 1.00 0.00 C ATOM 1851 CD1 LEU A 147 -0.255 -4.914 -9.381 1.00 0.00 C ATOM 1852 CD2 LEU A 147 0.030 -3.564 -7.260 1.00 0.00 C ATOM 0 H LEU A 147 -1.961 -2.936 -5.970 1.00 0.00 H new ATOM 0 HA LEU A 147 -3.217 -1.518 -8.255 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -2.362 -3.400 -9.762 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -1.151 -2.234 -9.266 1.00 0.00 H new ATOM 0 HG LEU A 147 -1.645 -4.828 -7.733 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.336 -5.717 -8.941 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -0.985 -5.337 -10.071 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.403 -4.233 -9.921 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.611 -4.374 -6.819 1.00 0.00 H new ATOM 0 HD22 LEU A 147 0.700 -2.875 -7.774 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.504 -3.031 -6.474 1.00 0.00 H new ATOM 1864 N THR A 148 -4.669 -3.732 -8.635 1.00 0.00 N ATOM 1865 CA THR A 148 -5.790 -4.713 -8.509 1.00 0.00 C ATOM 1866 C THR A 148 -5.949 -5.479 -9.826 1.00 0.00 C ATOM 1867 O THR A 148 -5.007 -5.663 -10.572 1.00 0.00 O ATOM 1868 CB THR A 148 -7.103 -3.977 -8.226 1.00 0.00 C ATOM 1869 OG1 THR A 148 -7.542 -3.336 -9.416 1.00 0.00 O ATOM 1870 CG2 THR A 148 -6.896 -2.931 -7.132 1.00 0.00 C ATOM 0 H THR A 148 -4.570 -3.314 -9.560 1.00 0.00 H new ATOM 0 HA THR A 148 -5.563 -5.398 -7.692 1.00 0.00 H new ATOM 0 HB THR A 148 -7.852 -4.695 -7.891 1.00 0.00 H new ATOM 0 HG1 THR A 148 -8.383 -2.864 -9.242 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.836 -2.415 -6.940 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.558 -3.421 -6.219 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.146 -2.210 -7.456 1.00 0.00 H new