USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 586 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 80 SER OG : rot -178:sc= -0.617 USER MOD Set 1.2: A 125 LYS NZ :NH3+ -121:sc= 0.0658 (180deg=0) USER MOD Set 2.1: A 63 THR OG1 : rot 148:sc= 1.02 USER MOD Set 2.2: A 66 THR OG1 : rot 92:sc= 1.08 USER MOD Set 3.1: A 55 TYR OH : rot 40:sc= 1.7 USER MOD Set 3.2: A 75 SER OG : rot -95:sc= 0.507 USER MOD Set 3.3: A 77 MET CE :methyl -164:sc= -0.206 (180deg=-1.15) USER MOD Single : A 53 TYR OH : rot 30:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 1.23 K(o=1.2,f=-0.8) USER MOD Single : A 58 THR OG1 : rot -72:sc= 1.45 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -122:sc= -0.597 (180deg=-1.34) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 78 GLN : amide:sc= -0.794 X(o=-0.79,f=-0.36) USER MOD Single : A 81 TYR OH : rot 79:sc= -0.811! USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0.00566 USER MOD Single : A 97 SER OG : rot 180:sc= -0.575 USER MOD Single : A 98 THR OG1 : rot 100:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0413 USER MOD Single : A 100 SER OG : rot 180:sc= 0.0947 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN : amide:sc= -0.579 K(o=-0.58,f=-4.5!) USER MOD Single : A 106 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 109 SER OG : rot 83:sc= 2.24 USER MOD Single : A 112 TYR OH : rot -15:sc= -0.238 USER MOD Single : A 115 GLN : amide:sc= -0.135 K(o=-0.14,f=-1.2) USER MOD Single : A 118 SER OG : rot 10:sc= 0.0134 USER MOD Single : A 120 SER OG : rot -2:sc= 0.209 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 510 N TYR A 53 0.427 -11.637 -2.599 1.00 10.00 N ATOM 511 CA TYR A 53 0.273 -10.483 -3.471 1.00 10.00 C ATOM 512 C TYR A 53 1.637 -9.946 -3.883 1.00 10.00 C ATOM 513 O TYR A 53 2.490 -9.666 -3.037 1.00 10.00 O ATOM 514 CB TYR A 53 -0.537 -9.394 -2.765 1.00 10.00 C ATOM 515 CG TYR A 53 -0.673 -8.108 -3.552 1.00 10.00 C ATOM 516 CD1 TYR A 53 -1.145 -8.108 -4.858 1.00 10.00 C ATOM 517 CD2 TYR A 53 -0.330 -6.890 -2.977 1.00 10.00 C ATOM 518 CE1 TYR A 53 -1.269 -6.932 -5.570 1.00 10.00 C ATOM 519 CE2 TYR A 53 -0.455 -5.710 -3.678 1.00 10.00 C ATOM 520 CZ TYR A 53 -0.923 -5.735 -4.977 1.00 10.00 C ATOM 521 OH TYR A 53 -1.053 -4.561 -5.685 1.00 10.00 O ATOM 0 HA TYR A 53 -0.263 -10.791 -4.369 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -1.533 -9.781 -2.549 1.00 10.00 H new ATOM 0 HB3 TYR A 53 -0.067 -9.172 -1.807 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.419 -9.043 -5.324 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.041 -6.868 -1.963 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -1.635 -6.949 -6.586 1.00 10.00 H new ATOM 0 HE2 TYR A 53 -0.189 -4.772 -3.214 1.00 10.00 H new ATOM 0 HH TYR A 53 -1.789 -4.646 -6.327 1.00 10.00 H new ATOM 531 N THR A 54 1.839 -9.819 -5.183 1.00 10.00 N ATOM 532 CA THR A 54 3.090 -9.320 -5.718 1.00 10.00 C ATOM 533 C THR A 54 3.194 -7.814 -5.535 1.00 10.00 C ATOM 534 O THR A 54 2.344 -7.052 -6.007 1.00 10.00 O ATOM 535 CB THR A 54 3.233 -9.666 -7.209 1.00 10.00 C ATOM 536 OG1 THR A 54 3.034 -11.073 -7.406 1.00 10.00 O ATOM 537 CG2 THR A 54 4.604 -9.264 -7.736 1.00 10.00 C ATOM 0 H THR A 54 1.145 -10.057 -5.891 1.00 10.00 H new ATOM 0 HA THR A 54 3.896 -9.804 -5.166 1.00 10.00 H new ATOM 0 HB THR A 54 2.475 -9.109 -7.760 1.00 10.00 H new ATOM 0 HG1 THR A 54 3.125 -11.286 -8.358 1.00 10.00 H new ATOM 0 HG21 THR A 54 4.677 -9.521 -8.793 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.740 -8.190 -7.613 1.00 10.00 H new ATOM 0 HG23 THR A 54 5.377 -9.794 -7.180 1.00 10.00 H new ATOM 545 N TYR A 55 4.230 -7.400 -4.835 1.00 10.00 N ATOM 546 CA TYR A 55 4.476 -5.996 -4.585 1.00 10.00 C ATOM 547 C TYR A 55 5.268 -5.416 -5.745 1.00 10.00 C ATOM 548 O TYR A 55 6.394 -5.843 -6.010 1.00 10.00 O ATOM 549 CB TYR A 55 5.232 -5.815 -3.268 1.00 10.00 C ATOM 550 CG TYR A 55 4.461 -6.306 -2.065 1.00 10.00 C ATOM 551 CD1 TYR A 55 3.236 -5.747 -1.730 1.00 10.00 C ATOM 552 CD2 TYR A 55 4.954 -7.327 -1.266 1.00 10.00 C ATOM 553 CE1 TYR A 55 2.526 -6.189 -0.632 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.249 -7.776 -0.168 1.00 10.00 C ATOM 555 CZ TYR A 55 3.036 -7.204 0.147 1.00 10.00 C ATOM 556 OH TYR A 55 2.331 -7.650 1.245 1.00 10.00 O ATOM 0 H TYR A 55 4.923 -8.026 -4.425 1.00 10.00 H new ATOM 0 HA TYR A 55 3.526 -5.468 -4.501 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.181 -6.348 -3.325 1.00 10.00 H new ATOM 0 HB3 TYR A 55 5.467 -4.759 -3.134 1.00 10.00 H new ATOM 0 HD1 TYR A 55 2.831 -4.952 -2.339 1.00 10.00 H new ATOM 0 HD2 TYR A 55 5.905 -7.778 -1.507 1.00 10.00 H new ATOM 0 HE1 TYR A 55 1.575 -5.741 -0.385 1.00 10.00 H new ATOM 0 HE2 TYR A 55 4.647 -8.573 0.442 1.00 10.00 H new ATOM 0 HH TYR A 55 1.376 -7.685 1.028 1.00 10.00 H new ATOM 566 N GLN A 56 4.665 -4.473 -6.447 1.00 10.00 N ATOM 567 CA GLN A 56 5.299 -3.847 -7.595 1.00 10.00 C ATOM 568 C GLN A 56 4.889 -2.387 -7.689 1.00 10.00 C ATOM 569 O GLN A 56 3.776 -2.029 -7.303 1.00 10.00 O ATOM 570 CB GLN A 56 4.877 -4.584 -8.868 1.00 10.00 C ATOM 571 CG GLN A 56 5.709 -4.245 -10.094 1.00 10.00 C ATOM 572 CD GLN A 56 4.909 -4.336 -11.379 1.00 10.00 C ATOM 573 OE1 GLN A 56 3.872 -4.998 -11.441 1.00 10.00 O ATOM 574 NE2 GLN A 56 5.397 -3.689 -12.421 1.00 10.00 N ATOM 0 H GLN A 56 3.730 -4.121 -6.240 1.00 10.00 H new ATOM 0 HA GLN A 56 6.382 -3.901 -7.481 1.00 10.00 H new ATOM 0 HB2 GLN A 56 4.937 -5.657 -8.689 1.00 10.00 H new ATOM 0 HB3 GLN A 56 3.832 -4.354 -9.078 1.00 10.00 H new ATOM 0 HG2 GLN A 56 6.110 -3.237 -9.990 1.00 10.00 H new ATOM 0 HG3 GLN A 56 6.561 -4.923 -10.151 1.00 10.00 H new ATOM 0 HE21 GLN A 56 6.259 -3.151 -12.330 1.00 10.00 H new ATOM 0 HE22 GLN A 56 4.912 -3.727 -13.318 1.00 10.00 H new ATOM 583 N ALA A 57 5.790 -1.551 -8.186 1.00 10.00 N ATOM 584 CA ALA A 57 5.504 -0.133 -8.348 1.00 10.00 C ATOM 585 C ALA A 57 4.579 0.072 -9.540 1.00 10.00 C ATOM 586 O ALA A 57 4.960 -0.166 -10.691 1.00 10.00 O ATOM 587 CB ALA A 57 6.793 0.661 -8.521 1.00 10.00 C ATOM 0 H ALA A 57 6.725 -1.830 -8.484 1.00 10.00 H new ATOM 0 HA ALA A 57 5.006 0.232 -7.449 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.556 1.718 -8.640 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.423 0.528 -7.642 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.323 0.306 -9.405 1.00 10.00 H new ATOM 593 N THR A 58 3.356 0.491 -9.265 1.00 10.00 N ATOM 594 CA THR A 58 2.373 0.707 -10.311 1.00 10.00 C ATOM 595 C THR A 58 2.133 2.193 -10.528 1.00 10.00 C ATOM 596 O THR A 58 2.388 3.007 -9.637 1.00 10.00 O ATOM 597 CB THR A 58 1.029 0.024 -9.964 1.00 10.00 C ATOM 598 OG1 THR A 58 0.383 0.735 -8.901 1.00 10.00 O ATOM 599 CG2 THR A 58 1.240 -1.420 -9.541 1.00 10.00 C ATOM 0 H THR A 58 3.020 0.689 -8.323 1.00 10.00 H new ATOM 0 HA THR A 58 2.771 0.266 -11.225 1.00 10.00 H new ATOM 0 HB THR A 58 0.404 0.038 -10.857 1.00 10.00 H new ATOM 0 HG1 THR A 58 0.861 0.573 -8.061 1.00 10.00 H new ATOM 0 HG21 THR A 58 0.278 -1.874 -9.303 1.00 10.00 H new ATOM 0 HG22 THR A 58 1.711 -1.972 -10.354 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.883 -1.451 -8.661 1.00 10.00 H new ATOM 607 N PRO A 59 1.641 2.576 -11.719 1.00 10.00 N ATOM 608 CA PRO A 59 1.341 3.977 -12.030 1.00 10.00 C ATOM 609 C PRO A 59 0.193 4.502 -11.169 1.00 10.00 C ATOM 610 O PRO A 59 -0.076 5.700 -11.130 1.00 10.00 O ATOM 611 CB PRO A 59 0.943 3.946 -13.508 1.00 10.00 C ATOM 612 CG PRO A 59 0.502 2.546 -13.753 1.00 10.00 C ATOM 613 CD PRO A 59 1.363 1.692 -12.869 1.00 10.00 C ATOM 0 HA PRO A 59 2.185 4.638 -11.832 1.00 10.00 H new ATOM 0 HB2 PRO A 59 0.142 4.655 -13.717 1.00 10.00 H new ATOM 0 HB3 PRO A 59 1.782 4.214 -14.150 1.00 10.00 H new ATOM 0 HG2 PRO A 59 -0.554 2.420 -13.513 1.00 10.00 H new ATOM 0 HG3 PRO A 59 0.625 2.274 -14.801 1.00 10.00 H new ATOM 0 HD2 PRO A 59 0.848 0.781 -12.563 1.00 10.00 H new ATOM 0 HD3 PRO A 59 2.280 1.386 -13.373 1.00 10.00 H new ATOM 621 N MET A 60 -0.478 3.582 -10.481 1.00 10.00 N ATOM 622 CA MET A 60 -1.584 3.925 -9.600 1.00 10.00 C ATOM 623 C MET A 60 -1.048 4.486 -8.290 1.00 10.00 C ATOM 624 O MET A 60 -1.696 5.302 -7.637 1.00 10.00 O ATOM 625 CB MET A 60 -2.446 2.691 -9.319 1.00 10.00 C ATOM 626 CG MET A 60 -3.188 2.173 -10.539 1.00 10.00 C ATOM 627 SD MET A 60 -4.012 0.595 -10.232 1.00 10.00 S ATOM 628 CE MET A 60 -5.042 0.471 -11.693 1.00 10.00 C ATOM 0 H MET A 60 -0.270 2.584 -10.520 1.00 10.00 H new ATOM 0 HA MET A 60 -2.199 4.679 -10.091 1.00 10.00 H new ATOM 0 HB2 MET A 60 -1.811 1.897 -8.927 1.00 10.00 H new ATOM 0 HB3 MET A 60 -3.170 2.934 -8.541 1.00 10.00 H new ATOM 0 HG2 MET A 60 -3.928 2.911 -10.850 1.00 10.00 H new ATOM 0 HG3 MET A 60 -2.486 2.058 -11.365 1.00 10.00 H new ATOM 0 HE1 MET A 60 -5.617 -0.454 -11.655 1.00 10.00 H new ATOM 0 HE2 MET A 60 -5.723 1.321 -11.731 1.00 10.00 H new ATOM 0 HE3 MET A 60 -4.413 0.471 -12.583 1.00 10.00 H new ATOM 638 N ASP A 61 0.141 4.035 -7.914 1.00 10.00 N ATOM 639 CA ASP A 61 0.779 4.489 -6.687 1.00 10.00 C ATOM 640 C ASP A 61 1.338 5.886 -6.901 1.00 10.00 C ATOM 641 O ASP A 61 1.082 6.804 -6.122 1.00 10.00 O ATOM 642 CB ASP A 61 1.894 3.526 -6.267 1.00 10.00 C ATOM 643 CG ASP A 61 1.414 2.091 -6.138 1.00 10.00 C ATOM 644 OD1 ASP A 61 0.532 1.824 -5.295 1.00 10.00 O ATOM 645 OD2 ASP A 61 1.907 1.227 -6.895 1.00 10.00 O ATOM 0 H ASP A 61 0.684 3.353 -8.443 1.00 10.00 H new ATOM 0 HA ASP A 61 0.038 4.513 -5.888 1.00 10.00 H new ATOM 0 HB2 ASP A 61 2.701 3.570 -6.999 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.310 3.852 -5.314 1.00 10.00 H new ATOM 650 N GLY A 62 2.111 6.033 -7.965 1.00 10.00 N ATOM 651 CA GLY A 62 2.677 7.319 -8.310 1.00 10.00 C ATOM 652 C GLY A 62 3.925 7.665 -7.522 1.00 10.00 C ATOM 653 O GLY A 62 5.006 7.801 -8.091 1.00 10.00 O ATOM 0 H GLY A 62 2.358 5.276 -8.602 1.00 10.00 H new ATOM 0 HA2 GLY A 62 2.915 7.328 -9.374 1.00 10.00 H new ATOM 0 HA3 GLY A 62 1.927 8.093 -8.145 1.00 10.00 H new ATOM 657 N THR A 63 3.787 7.796 -6.216 1.00 10.00 N ATOM 658 CA THR A 63 4.914 8.160 -5.380 1.00 10.00 C ATOM 659 C THR A 63 5.314 7.025 -4.452 1.00 10.00 C ATOM 660 O THR A 63 4.594 6.034 -4.318 1.00 10.00 O ATOM 661 CB THR A 63 4.600 9.417 -4.554 1.00 10.00 C ATOM 662 OG1 THR A 63 3.577 9.139 -3.593 1.00 10.00 O ATOM 663 CG2 THR A 63 4.145 10.551 -5.453 1.00 10.00 C ATOM 0 H THR A 63 2.910 7.657 -5.714 1.00 10.00 H new ATOM 0 HA THR A 63 5.751 8.370 -6.046 1.00 10.00 H new ATOM 0 HB THR A 63 5.513 9.715 -4.038 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.719 9.690 -2.795 1.00 10.00 H new ATOM 0 HG21 THR A 63 3.928 11.431 -4.847 1.00 10.00 H new ATOM 0 HG22 THR A 63 4.933 10.788 -6.167 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.246 10.250 -5.991 1.00 10.00 H new ATOM 671 N LEU A 64 6.467 7.186 -3.810 1.00 10.00 N ATOM 672 CA LEU A 64 6.996 6.185 -2.894 1.00 10.00 C ATOM 673 C LEU A 64 6.077 5.995 -1.694 1.00 10.00 C ATOM 674 O LEU A 64 5.755 4.863 -1.326 1.00 10.00 O ATOM 675 CB LEU A 64 8.397 6.588 -2.425 1.00 10.00 C ATOM 676 CG LEU A 64 9.050 5.633 -1.425 1.00 10.00 C ATOM 677 CD1 LEU A 64 9.242 4.258 -2.039 1.00 10.00 C ATOM 678 CD2 LEU A 64 10.377 6.192 -0.941 1.00 10.00 C ATOM 0 H LEU A 64 7.058 8.011 -3.910 1.00 10.00 H new ATOM 0 HA LEU A 64 7.055 5.237 -3.428 1.00 10.00 H new ATOM 0 HB2 LEU A 64 9.044 6.672 -3.298 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.340 7.578 -1.973 1.00 10.00 H new ATOM 0 HG LEU A 64 8.385 5.532 -0.567 1.00 10.00 H new ATOM 0 HD11 LEU A 64 9.708 3.596 -1.309 1.00 10.00 H new ATOM 0 HD12 LEU A 64 8.274 3.852 -2.332 1.00 10.00 H new ATOM 0 HD13 LEU A 64 9.882 4.338 -2.917 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.826 5.498 -0.230 1.00 10.00 H new ATOM 0 HD22 LEU A 64 11.047 6.326 -1.790 1.00 10.00 H new ATOM 0 HD23 LEU A 64 10.211 7.153 -0.455 1.00 10.00 H new ATOM 690 N LYS A 65 5.654 7.101 -1.094 1.00 10.00 N ATOM 691 CA LYS A 65 4.775 7.055 0.071 1.00 10.00 C ATOM 692 C LYS A 65 3.500 6.269 -0.229 1.00 10.00 C ATOM 693 O LYS A 65 3.190 5.290 0.451 1.00 10.00 O ATOM 694 CB LYS A 65 4.420 8.472 0.526 1.00 10.00 C ATOM 695 CG LYS A 65 3.875 8.533 1.944 1.00 10.00 C ATOM 696 CD LYS A 65 3.274 9.894 2.263 1.00 10.00 C ATOM 697 CE LYS A 65 4.301 11.013 2.136 1.00 10.00 C ATOM 698 NZ LYS A 65 3.767 12.310 2.628 1.00 10.00 N ATOM 0 H LYS A 65 5.905 8.043 -1.395 1.00 10.00 H new ATOM 0 HA LYS A 65 5.310 6.545 0.873 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.308 9.100 0.459 1.00 10.00 H new ATOM 0 HB3 LYS A 65 3.681 8.891 -0.157 1.00 10.00 H new ATOM 0 HG2 LYS A 65 3.116 7.761 2.075 1.00 10.00 H new ATOM 0 HG3 LYS A 65 4.676 8.315 2.650 1.00 10.00 H new ATOM 0 HD2 LYS A 65 2.439 10.089 1.590 1.00 10.00 H new ATOM 0 HD3 LYS A 65 2.871 9.884 3.276 1.00 10.00 H new ATOM 0 HE2 LYS A 65 5.196 10.751 2.700 1.00 10.00 H new ATOM 0 HE3 LYS A 65 4.600 11.115 1.093 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 4.494 13.046 2.525 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 2.928 12.573 2.073 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 3.505 12.220 3.630 1.00 10.00 H new ATOM 712 N THR A 66 2.786 6.690 -1.266 1.00 10.00 N ATOM 713 CA THR A 66 1.543 6.050 -1.668 1.00 10.00 C ATOM 714 C THR A 66 1.758 4.586 -2.065 1.00 10.00 C ATOM 715 O THR A 66 0.879 3.743 -1.856 1.00 10.00 O ATOM 716 CB THR A 66 0.905 6.831 -2.830 1.00 10.00 C ATOM 717 OG1 THR A 66 1.114 8.235 -2.620 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.586 6.555 -2.920 1.00 10.00 C ATOM 0 H THR A 66 3.053 7.483 -1.850 1.00 10.00 H new ATOM 0 HA THR A 66 0.869 6.059 -0.811 1.00 10.00 H new ATOM 0 HB THR A 66 1.371 6.511 -3.762 1.00 10.00 H new ATOM 0 HG1 THR A 66 1.944 8.512 -3.061 1.00 10.00 H new ATOM 0 HG21 THR A 66 -1.011 7.120 -3.750 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.750 5.490 -3.084 1.00 10.00 H new ATOM 0 HG23 THR A 66 -1.069 6.857 -1.991 1.00 10.00 H new ATOM 726 N MET A 67 2.923 4.285 -2.628 1.00 10.00 N ATOM 727 CA MET A 67 3.244 2.919 -3.032 1.00 10.00 C ATOM 728 C MET A 67 3.425 2.031 -1.804 1.00 10.00 C ATOM 729 O MET A 67 2.805 0.972 -1.691 1.00 10.00 O ATOM 730 CB MET A 67 4.519 2.891 -3.880 1.00 10.00 C ATOM 731 CG MET A 67 4.838 1.522 -4.459 1.00 10.00 C ATOM 732 SD MET A 67 6.465 1.460 -5.237 1.00 10.00 S ATOM 733 CE MET A 67 7.536 1.442 -3.803 1.00 10.00 C ATOM 0 H MET A 67 3.659 4.965 -2.815 1.00 10.00 H new ATOM 0 HA MET A 67 2.415 2.539 -3.630 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.418 3.606 -4.696 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.359 3.222 -3.269 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.790 0.776 -3.666 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.078 1.256 -5.193 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.218 2.291 -3.847 1.00 10.00 H new ATOM 0 HE2 MET A 67 6.933 1.508 -2.898 1.00 10.00 H new ATOM 0 HE3 MET A 67 8.111 0.516 -3.790 1.00 10.00 H new ATOM 743 N LEU A 68 4.259 2.488 -0.876 1.00 10.00 N ATOM 744 CA LEU A 68 4.531 1.742 0.346 1.00 10.00 C ATOM 745 C LEU A 68 3.261 1.577 1.170 1.00 10.00 C ATOM 746 O LEU A 68 3.054 0.541 1.800 1.00 10.00 O ATOM 747 CB LEU A 68 5.610 2.445 1.172 1.00 10.00 C ATOM 748 CG LEU A 68 6.982 2.550 0.502 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.905 3.439 1.320 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.597 1.169 0.327 1.00 10.00 C ATOM 0 H LEU A 68 4.759 3.374 -0.948 1.00 10.00 H new ATOM 0 HA LEU A 68 4.893 0.752 0.068 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.263 3.450 1.412 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.725 1.914 2.117 1.00 10.00 H new ATOM 0 HG LEU A 68 6.851 2.998 -0.483 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.877 3.503 0.830 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.472 4.436 1.400 1.00 10.00 H new ATOM 0 HD13 LEU A 68 8.029 3.016 2.317 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.572 1.263 -0.151 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.715 0.697 1.302 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.945 0.557 -0.296 1.00 10.00 H new ATOM 762 N GLU A 69 2.409 2.598 1.151 1.00 10.00 N ATOM 763 CA GLU A 69 1.151 2.557 1.887 1.00 10.00 C ATOM 764 C GLU A 69 0.272 1.423 1.380 1.00 10.00 C ATOM 765 O GLU A 69 -0.364 0.719 2.164 1.00 10.00 O ATOM 766 CB GLU A 69 0.403 3.883 1.766 1.00 10.00 C ATOM 767 CG GLU A 69 0.963 4.983 2.648 1.00 10.00 C ATOM 768 CD GLU A 69 0.156 6.260 2.565 1.00 10.00 C ATOM 769 OE1 GLU A 69 -0.620 6.422 1.599 1.00 10.00 O ATOM 770 OE2 GLU A 69 0.291 7.108 3.470 1.00 10.00 O ATOM 0 H GLU A 69 2.567 3.463 0.634 1.00 10.00 H new ATOM 0 HA GLU A 69 1.385 2.384 2.937 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.432 4.213 0.727 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.645 3.723 2.021 1.00 10.00 H new ATOM 0 HG2 GLU A 69 0.987 4.639 3.682 1.00 10.00 H new ATOM 0 HG3 GLU A 69 1.993 5.189 2.357 1.00 10.00 H new ATOM 777 N ARG A 70 0.249 1.248 0.065 1.00 10.00 N ATOM 778 CA ARG A 70 -0.545 0.196 -0.556 1.00 10.00 C ATOM 779 C ARG A 70 0.035 -1.172 -0.219 1.00 10.00 C ATOM 780 O ARG A 70 -0.706 -2.121 0.050 1.00 10.00 O ATOM 781 CB ARG A 70 -0.592 0.385 -2.075 1.00 10.00 C ATOM 782 CG ARG A 70 -1.459 -0.642 -2.785 1.00 10.00 C ATOM 783 CD ARG A 70 -0.707 -1.324 -3.915 1.00 10.00 C ATOM 784 NE ARG A 70 -0.811 -0.589 -5.175 1.00 10.00 N ATOM 785 CZ ARG A 70 -1.687 -0.882 -6.136 1.00 10.00 C ATOM 786 NH1 ARG A 70 -2.581 -1.849 -5.960 1.00 10.00 N ATOM 787 NH2 ARG A 70 -1.680 -0.204 -7.274 1.00 10.00 N ATOM 0 H ARG A 70 0.773 1.823 -0.594 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.561 0.255 -0.165 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -0.968 1.383 -2.298 1.00 10.00 H new ATOM 0 HB3 ARG A 70 0.422 0.330 -2.472 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -1.798 -1.391 -2.069 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -2.350 -0.155 -3.182 1.00 10.00 H new ATOM 0 HD2 ARG A 70 0.343 -1.424 -3.641 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.098 -2.332 -4.052 1.00 10.00 H new ATOM 0 HE ARG A 70 -0.176 0.194 -5.327 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -2.600 -2.373 -5.085 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -3.248 -2.068 -6.700 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -1.003 0.545 -7.417 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -2.352 -0.431 -8.007 1.00 10.00 H new ATOM 801 N TRP A 71 1.360 -1.260 -0.237 1.00 10.00 N ATOM 802 CA TRP A 71 2.054 -2.505 0.071 1.00 10.00 C ATOM 803 C TRP A 71 1.798 -2.914 1.519 1.00 10.00 C ATOM 804 O TRP A 71 1.420 -4.052 1.794 1.00 10.00 O ATOM 805 CB TRP A 71 3.559 -2.356 -0.174 1.00 10.00 C ATOM 806 CG TRP A 71 3.938 -2.243 -1.624 1.00 10.00 C ATOM 807 CD1 TRP A 71 3.100 -2.111 -2.699 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.265 -2.260 -2.157 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.829 -2.042 -3.862 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.161 -2.130 -3.554 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.534 -2.368 -1.586 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.277 -2.106 -4.387 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.639 -2.345 -2.413 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.506 -2.216 -3.800 1.00 10.00 C ATOM 0 H TRP A 71 1.978 -0.480 -0.463 1.00 10.00 H new ATOM 0 HA TRP A 71 1.668 -3.283 -0.587 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.916 -1.471 0.353 1.00 10.00 H new ATOM 0 HB3 TRP A 71 4.073 -3.214 0.259 1.00 10.00 H new ATOM 0 HD1 TRP A 71 2.022 -2.067 -2.641 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.442 -1.942 -4.800 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.649 -2.468 -0.517 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.175 -2.004 -5.457 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.625 -2.428 -1.981 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.391 -2.203 -4.418 1.00 10.00 H new ATOM 825 N ALA A 72 1.998 -1.972 2.437 1.00 10.00 N ATOM 826 CA ALA A 72 1.779 -2.220 3.857 1.00 10.00 C ATOM 827 C ALA A 72 0.330 -2.608 4.132 1.00 10.00 C ATOM 828 O ALA A 72 0.055 -3.462 4.972 1.00 10.00 O ATOM 829 CB ALA A 72 2.148 -0.987 4.667 1.00 10.00 C ATOM 0 H ALA A 72 2.313 -1.026 2.220 1.00 10.00 H new ATOM 0 HA ALA A 72 2.417 -3.052 4.156 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.980 -1.184 5.726 1.00 10.00 H new ATOM 0 HB2 ALA A 72 3.199 -0.746 4.505 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.530 -0.146 4.352 1.00 10.00 H new ATOM 835 N ALA A 73 -0.590 -1.987 3.410 1.00 10.00 N ATOM 836 CA ALA A 73 -2.012 -2.258 3.580 1.00 10.00 C ATOM 837 C ALA A 73 -2.350 -3.705 3.246 1.00 10.00 C ATOM 838 O ALA A 73 -3.221 -4.312 3.880 1.00 10.00 O ATOM 839 CB ALA A 73 -2.828 -1.323 2.711 1.00 10.00 C ATOM 0 H ALA A 73 -0.378 -1.289 2.697 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.260 -2.089 4.628 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -3.889 -1.534 2.846 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.624 -0.291 2.996 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.559 -1.470 1.665 1.00 10.00 H new ATOM 845 N ASP A 74 -1.649 -4.256 2.265 1.00 10.00 N ATOM 846 CA ASP A 74 -1.880 -5.630 1.836 1.00 10.00 C ATOM 847 C ASP A 74 -1.528 -6.622 2.939 1.00 10.00 C ATOM 848 O ASP A 74 -2.258 -7.585 3.181 1.00 10.00 O ATOM 849 CB ASP A 74 -1.056 -5.956 0.591 1.00 10.00 C ATOM 850 CG ASP A 74 -1.146 -7.425 0.216 1.00 10.00 C ATOM 851 OD1 ASP A 74 -2.176 -7.832 -0.369 1.00 10.00 O ATOM 852 OD2 ASP A 74 -0.190 -8.178 0.511 1.00 10.00 O ATOM 0 H ASP A 74 -0.914 -3.772 1.750 1.00 10.00 H new ATOM 0 HA ASP A 74 -2.941 -5.720 1.604 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -1.404 -5.347 -0.243 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -0.014 -5.690 0.767 1.00 10.00 H new ATOM 857 N SER A 75 -0.425 -6.368 3.628 1.00 10.00 N ATOM 858 CA SER A 75 0.040 -7.266 4.678 1.00 10.00 C ATOM 859 C SER A 75 -0.420 -6.823 6.067 1.00 10.00 C ATOM 860 O SER A 75 -0.006 -7.400 7.077 1.00 10.00 O ATOM 861 CB SER A 75 1.563 -7.363 4.622 1.00 10.00 C ATOM 862 OG SER A 75 2.111 -6.282 3.884 1.00 10.00 O ATOM 0 H SER A 75 0.165 -5.549 3.480 1.00 10.00 H new ATOM 0 HA SER A 75 -0.400 -8.248 4.501 1.00 10.00 H new ATOM 0 HB2 SER A 75 1.969 -7.361 5.633 1.00 10.00 H new ATOM 0 HB3 SER A 75 1.855 -8.307 4.163 1.00 10.00 H new ATOM 0 HG SER A 75 2.257 -6.560 2.956 1.00 10.00 H new ATOM 868 N ASN A 76 -1.285 -5.810 6.104 1.00 10.00 N ATOM 869 CA ASN A 76 -1.813 -5.281 7.363 1.00 10.00 C ATOM 870 C ASN A 76 -0.669 -4.754 8.224 1.00 10.00 C ATOM 871 O ASN A 76 -0.499 -5.144 9.382 1.00 10.00 O ATOM 872 CB ASN A 76 -2.600 -6.363 8.117 1.00 10.00 C ATOM 873 CG ASN A 76 -3.643 -5.793 9.059 1.00 10.00 C ATOM 874 OD1 ASN A 76 -3.470 -4.718 9.635 1.00 10.00 O ATOM 875 ND2 ASN A 76 -4.742 -6.512 9.215 1.00 10.00 N ATOM 0 H ASN A 76 -1.637 -5.336 5.272 1.00 10.00 H new ATOM 0 HA ASN A 76 -2.494 -4.460 7.140 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -3.090 -7.017 7.395 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -1.904 -6.980 8.686 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -5.485 -6.181 9.831 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -4.847 -7.398 8.720 1.00 10.00 H new ATOM 882 N MET A 77 0.130 -3.880 7.633 1.00 10.00 N ATOM 883 CA MET A 77 1.275 -3.294 8.310 1.00 10.00 C ATOM 884 C MET A 77 1.199 -1.774 8.285 1.00 10.00 C ATOM 885 O MET A 77 0.346 -1.197 7.606 1.00 10.00 O ATOM 886 CB MET A 77 2.572 -3.764 7.642 1.00 10.00 C ATOM 887 CG MET A 77 2.758 -5.273 7.681 1.00 10.00 C ATOM 888 SD MET A 77 4.479 -5.773 7.482 1.00 10.00 S ATOM 889 CE MET A 77 4.982 -4.698 6.145 1.00 10.00 C ATOM 0 H MET A 77 0.003 -3.558 6.674 1.00 10.00 H new ATOM 0 HA MET A 77 1.265 -3.621 9.350 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.579 -3.431 6.604 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.419 -3.288 8.135 1.00 10.00 H new ATOM 0 HG2 MET A 77 2.381 -5.656 8.629 1.00 10.00 H new ATOM 0 HG3 MET A 77 2.159 -5.728 6.892 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.912 -5.066 5.713 1.00 10.00 H new ATOM 0 HE2 MET A 77 4.207 -4.683 5.379 1.00 10.00 H new ATOM 0 HE3 MET A 77 5.134 -3.689 6.527 1.00 10.00 H new ATOM 899 N GLN A 78 2.087 -1.127 9.022 1.00 10.00 N ATOM 900 CA GLN A 78 2.118 0.327 9.069 1.00 10.00 C ATOM 901 C GLN A 78 3.305 0.863 8.280 1.00 10.00 C ATOM 902 O GLN A 78 4.171 0.097 7.857 1.00 10.00 O ATOM 903 CB GLN A 78 2.172 0.808 10.515 1.00 10.00 C ATOM 904 CG GLN A 78 0.837 0.702 11.229 1.00 10.00 C ATOM 905 CD GLN A 78 -0.232 1.569 10.598 1.00 10.00 C ATOM 906 OE1 GLN A 78 -0.390 2.734 10.955 1.00 10.00 O ATOM 907 NE2 GLN A 78 -0.974 1.014 9.652 1.00 10.00 N ATOM 0 H GLN A 78 2.796 -1.584 9.596 1.00 10.00 H new ATOM 0 HA GLN A 78 1.205 0.709 8.611 1.00 10.00 H new ATOM 0 HB2 GLN A 78 2.915 0.224 11.058 1.00 10.00 H new ATOM 0 HB3 GLN A 78 2.506 1.845 10.534 1.00 10.00 H new ATOM 0 HG2 GLN A 78 0.507 -0.337 11.223 1.00 10.00 H new ATOM 0 HG3 GLN A 78 0.964 0.990 12.273 1.00 10.00 H new ATOM 0 HE21 GLN A 78 -0.814 0.044 9.382 1.00 10.00 H new ATOM 0 HE22 GLN A 78 -1.706 1.557 9.194 1.00 10.00 H new ATOM 916 N LEU A 79 3.349 2.175 8.089 1.00 10.00 N ATOM 917 CA LEU A 79 4.433 2.799 7.343 1.00 10.00 C ATOM 918 C LEU A 79 4.985 4.023 8.072 1.00 10.00 C ATOM 919 O LEU A 79 4.232 4.875 8.548 1.00 10.00 O ATOM 920 CB LEU A 79 3.952 3.215 5.950 1.00 10.00 C ATOM 921 CG LEU A 79 4.947 4.058 5.152 1.00 10.00 C ATOM 922 CD1 LEU A 79 6.084 3.193 4.630 1.00 10.00 C ATOM 923 CD2 LEU A 79 4.248 4.773 4.007 1.00 10.00 C ATOM 0 H LEU A 79 2.647 2.827 8.440 1.00 10.00 H new ATOM 0 HA LEU A 79 5.231 2.062 7.252 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.719 2.317 5.379 1.00 10.00 H new ATOM 0 HB3 LEU A 79 3.024 3.777 6.055 1.00 10.00 H new ATOM 0 HG LEU A 79 5.368 4.811 5.818 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.781 3.811 4.065 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.605 2.732 5.469 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.681 2.415 3.982 1.00 10.00 H new ATOM 0 HD21 LEU A 79 4.974 5.367 3.452 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.796 4.038 3.341 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.473 5.427 4.406 1.00 10.00 H new ATOM 935 N SER A 80 6.302 4.094 8.146 1.00 10.00 N ATOM 936 CA SER A 80 6.983 5.204 8.780 1.00 10.00 C ATOM 937 C SER A 80 7.873 5.909 7.756 1.00 10.00 C ATOM 938 O SER A 80 9.003 5.489 7.493 1.00 10.00 O ATOM 939 CB SER A 80 7.810 4.702 9.968 1.00 10.00 C ATOM 940 OG SER A 80 7.233 5.106 11.197 1.00 10.00 O ATOM 0 H SER A 80 6.928 3.383 7.768 1.00 10.00 H new ATOM 0 HA SER A 80 6.249 5.917 9.154 1.00 10.00 H new ATOM 0 HB2 SER A 80 7.878 3.615 9.934 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.827 5.087 9.896 1.00 10.00 H new ATOM 0 HG SER A 80 7.795 4.799 11.939 1.00 10.00 H new ATOM 946 N TYR A 81 7.342 6.972 7.168 1.00 10.00 N ATOM 947 CA TYR A 81 8.062 7.743 6.171 1.00 10.00 C ATOM 948 C TYR A 81 8.867 8.835 6.861 1.00 10.00 C ATOM 949 O TYR A 81 8.336 9.890 7.205 1.00 10.00 O ATOM 950 CB TYR A 81 7.065 8.355 5.187 1.00 10.00 C ATOM 951 CG TYR A 81 7.612 8.627 3.805 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.892 7.586 2.932 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.812 9.927 3.362 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.365 7.832 1.659 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.275 10.180 2.087 1.00 10.00 C ATOM 956 CZ TYR A 81 8.552 9.127 1.240 1.00 10.00 C ATOM 957 OH TYR A 81 8.998 9.376 -0.037 1.00 10.00 O ATOM 0 H TYR A 81 6.405 7.321 7.369 1.00 10.00 H new ATOM 0 HA TYR A 81 8.746 7.095 5.623 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.210 7.685 5.097 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.694 9.291 5.605 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.737 6.567 3.254 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.602 10.753 4.025 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.587 7.010 0.995 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.420 11.197 1.754 1.00 10.00 H new ATOM 0 HH TYR A 81 8.252 9.289 -0.667 1.00 10.00 H new ATOM 967 N ASN A 82 10.147 8.582 7.065 1.00 10.00 N ATOM 968 CA ASN A 82 11.007 9.543 7.735 1.00 10.00 C ATOM 969 C ASN A 82 11.863 10.298 6.730 1.00 10.00 C ATOM 970 O ASN A 82 13.027 10.611 6.988 1.00 10.00 O ATOM 971 CB ASN A 82 11.883 8.840 8.775 1.00 10.00 C ATOM 972 CG ASN A 82 11.088 8.408 9.993 1.00 10.00 C ATOM 973 OD1 ASN A 82 10.793 9.215 10.876 1.00 10.00 O ATOM 974 ND2 ASN A 82 10.741 7.131 10.054 1.00 10.00 N ATOM 0 H ASN A 82 10.614 7.722 6.778 1.00 10.00 H new ATOM 0 HA ASN A 82 10.376 10.268 8.249 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.354 7.968 8.322 1.00 10.00 H new ATOM 0 HB3 ASN A 82 12.685 9.510 9.085 1.00 10.00 H new ATOM 0 HD21 ASN A 82 10.210 6.784 10.853 1.00 10.00 H new ATOM 0 HD22 ASN A 82 11.005 6.494 9.302 1.00 10.00 H new ATOM 981 N LEU A 83 11.276 10.591 5.581 1.00 10.00 N ATOM 982 CA LEU A 83 11.971 11.327 4.540 1.00 10.00 C ATOM 983 C LEU A 83 11.528 12.783 4.554 1.00 10.00 C ATOM 984 O LEU A 83 10.370 13.077 4.856 1.00 10.00 O ATOM 985 CB LEU A 83 11.699 10.722 3.160 1.00 10.00 C ATOM 986 CG LEU A 83 12.158 9.276 2.963 1.00 10.00 C ATOM 987 CD1 LEU A 83 12.060 8.893 1.496 1.00 10.00 C ATOM 988 CD2 LEU A 83 13.578 9.079 3.467 1.00 10.00 C ATOM 0 H LEU A 83 10.318 10.330 5.346 1.00 10.00 H new ATOM 0 HA LEU A 83 13.041 11.265 4.738 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.627 10.772 2.967 1.00 10.00 H new ATOM 0 HB3 LEU A 83 12.187 11.343 2.409 1.00 10.00 H new ATOM 0 HG LEU A 83 11.502 8.628 3.544 1.00 10.00 H new ATOM 0 HD11 LEU A 83 12.389 7.862 1.366 1.00 10.00 H new ATOM 0 HD12 LEU A 83 11.026 8.989 1.163 1.00 10.00 H new ATOM 0 HD13 LEU A 83 12.694 9.553 0.904 1.00 10.00 H new ATOM 0 HD21 LEU A 83 13.878 8.042 3.314 1.00 10.00 H new ATOM 0 HD22 LEU A 83 14.253 9.736 2.919 1.00 10.00 H new ATOM 0 HD23 LEU A 83 13.623 9.317 4.530 1.00 10.00 H new ATOM 1000 N PRO A 84 12.445 13.711 4.244 1.00 10.00 N ATOM 1001 CA PRO A 84 12.138 15.142 4.206 1.00 10.00 C ATOM 1002 C PRO A 84 11.088 15.461 3.148 1.00 10.00 C ATOM 1003 O PRO A 84 10.187 16.268 3.372 1.00 10.00 O ATOM 1004 CB PRO A 84 13.476 15.801 3.845 1.00 10.00 C ATOM 1005 CG PRO A 84 14.298 14.707 3.248 1.00 10.00 C ATOM 1006 CD PRO A 84 13.855 13.442 3.922 1.00 10.00 C ATOM 0 HA PRO A 84 11.727 15.496 5.151 1.00 10.00 H new ATOM 0 HB2 PRO A 84 13.335 16.619 3.138 1.00 10.00 H new ATOM 0 HB3 PRO A 84 13.959 16.221 4.727 1.00 10.00 H new ATOM 0 HG2 PRO A 84 14.146 14.649 2.170 1.00 10.00 H new ATOM 0 HG3 PRO A 84 15.361 14.884 3.411 1.00 10.00 H new ATOM 0 HD2 PRO A 84 13.961 12.578 3.266 1.00 10.00 H new ATOM 0 HD3 PRO A 84 14.441 13.236 4.818 1.00 10.00 H new ATOM 1014 N SER A 85 11.208 14.806 2.003 1.00 10.00 N ATOM 1015 CA SER A 85 10.289 15.006 0.899 1.00 10.00 C ATOM 1016 C SER A 85 9.949 13.671 0.254 1.00 10.00 C ATOM 1017 O SER A 85 10.811 12.800 0.139 1.00 10.00 O ATOM 1018 CB SER A 85 10.916 15.934 -0.139 1.00 10.00 C ATOM 1019 OG SER A 85 11.805 16.854 0.473 1.00 10.00 O ATOM 0 H SER A 85 11.943 14.124 1.816 1.00 10.00 H new ATOM 0 HA SER A 85 9.375 15.460 1.281 1.00 10.00 H new ATOM 0 HB2 SER A 85 11.452 15.344 -0.882 1.00 10.00 H new ATOM 0 HB3 SER A 85 10.132 16.477 -0.667 1.00 10.00 H new ATOM 0 HG SER A 85 12.195 17.437 -0.212 1.00 10.00 H new ATOM 1025 N ASP A 86 8.698 13.509 -0.151 1.00 10.00 N ATOM 1026 CA ASP A 86 8.262 12.278 -0.796 1.00 10.00 C ATOM 1027 C ASP A 86 8.706 12.275 -2.250 1.00 10.00 C ATOM 1028 O ASP A 86 8.504 13.254 -2.972 1.00 10.00 O ATOM 1029 CB ASP A 86 6.742 12.127 -0.699 1.00 10.00 C ATOM 1030 CG ASP A 86 6.212 10.965 -1.518 1.00 10.00 C ATOM 1031 OD1 ASP A 86 6.698 9.825 -1.342 1.00 10.00 O ATOM 1032 OD2 ASP A 86 5.294 11.191 -2.333 1.00 10.00 O ATOM 0 H ASP A 86 7.967 14.213 -0.045 1.00 10.00 H new ATOM 0 HA ASP A 86 8.719 11.431 -0.284 1.00 10.00 H new ATOM 0 HB2 ASP A 86 6.461 11.987 0.345 1.00 10.00 H new ATOM 0 HB3 ASP A 86 6.268 13.049 -1.036 1.00 10.00 H new ATOM 1037 N TYR A 87 9.310 11.179 -2.676 1.00 10.00 N ATOM 1038 CA TYR A 87 9.811 11.062 -4.037 1.00 10.00 C ATOM 1039 C TYR A 87 8.859 10.257 -4.917 1.00 10.00 C ATOM 1040 O TYR A 87 8.169 9.351 -4.446 1.00 10.00 O ATOM 1041 CB TYR A 87 11.202 10.420 -4.031 1.00 10.00 C ATOM 1042 CG TYR A 87 12.194 11.147 -3.147 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.674 12.402 -3.497 1.00 10.00 C ATOM 1044 CD2 TYR A 87 12.645 10.580 -1.962 1.00 10.00 C ATOM 1045 CE1 TYR A 87 13.573 13.072 -2.691 1.00 10.00 C ATOM 1046 CE2 TYR A 87 13.546 11.246 -1.152 1.00 10.00 C ATOM 1047 CZ TYR A 87 14.006 12.491 -1.521 1.00 10.00 C ATOM 1048 OH TYR A 87 14.901 13.160 -0.715 1.00 10.00 O ATOM 0 H TYR A 87 9.466 10.354 -2.097 1.00 10.00 H new ATOM 0 HA TYR A 87 9.881 12.065 -4.457 1.00 10.00 H new ATOM 0 HB2 TYR A 87 11.116 9.387 -3.695 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.586 10.393 -5.051 1.00 10.00 H new ATOM 0 HD1 TYR A 87 12.339 12.862 -4.415 1.00 10.00 H new ATOM 0 HD2 TYR A 87 12.287 9.604 -1.669 1.00 10.00 H new ATOM 0 HE1 TYR A 87 13.935 14.048 -2.978 1.00 10.00 H new ATOM 0 HE2 TYR A 87 13.888 10.792 -0.234 1.00 10.00 H new ATOM 0 HH TYR A 87 15.104 12.613 0.073 1.00 10.00 H new ATOM 1058 N THR A 88 8.825 10.609 -6.197 1.00 10.00 N ATOM 1059 CA THR A 88 7.979 9.940 -7.169 1.00 10.00 C ATOM 1060 C THR A 88 8.644 8.652 -7.662 1.00 10.00 C ATOM 1061 O THR A 88 9.871 8.571 -7.725 1.00 10.00 O ATOM 1062 CB THR A 88 7.707 10.869 -8.368 1.00 10.00 C ATOM 1063 OG1 THR A 88 7.380 12.184 -7.900 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.570 10.344 -9.231 1.00 10.00 C ATOM 0 H THR A 88 9.385 11.367 -6.587 1.00 10.00 H new ATOM 0 HA THR A 88 7.035 9.690 -6.685 1.00 10.00 H new ATOM 0 HB THR A 88 8.611 10.904 -8.976 1.00 10.00 H new ATOM 0 HG1 THR A 88 7.210 12.771 -8.666 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.405 11.023 -10.067 1.00 10.00 H new ATOM 0 HG22 THR A 88 6.828 9.356 -9.611 1.00 10.00 H new ATOM 0 HG23 THR A 88 5.661 10.276 -8.633 1.00 10.00 H new ATOM 1072 N LEU A 89 7.832 7.645 -7.980 1.00 10.00 N ATOM 1073 CA LEU A 89 8.325 6.377 -8.472 1.00 10.00 C ATOM 1074 C LEU A 89 9.226 6.565 -9.687 1.00 10.00 C ATOM 1075 O LEU A 89 8.832 7.175 -10.684 1.00 10.00 O ATOM 1076 CB LEU A 89 7.139 5.486 -8.828 1.00 10.00 C ATOM 1077 CG LEU A 89 6.799 4.408 -7.802 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.299 4.780 -6.416 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.300 4.141 -7.782 1.00 10.00 C ATOM 0 H LEU A 89 6.816 7.693 -7.901 1.00 10.00 H new ATOM 0 HA LEU A 89 8.922 5.906 -7.691 1.00 10.00 H new ATOM 0 HB2 LEU A 89 6.262 6.117 -8.971 1.00 10.00 H new ATOM 0 HB3 LEU A 89 7.343 5.003 -9.784 1.00 10.00 H new ATOM 0 HG LEU A 89 7.310 3.493 -8.101 1.00 10.00 H new ATOM 0 HD11 LEU A 89 7.039 3.990 -5.711 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.382 4.903 -6.441 1.00 10.00 H new ATOM 0 HD13 LEU A 89 6.835 5.714 -6.100 1.00 10.00 H new ATOM 0 HD21 LEU A 89 5.078 3.370 -7.045 1.00 10.00 H new ATOM 0 HD22 LEU A 89 4.771 5.057 -7.520 1.00 10.00 H new ATOM 0 HD23 LEU A 89 4.977 3.805 -8.767 1.00 10.00 H new ATOM 1091 N ILE A 90 10.439 6.054 -9.580 1.00 10.00 N ATOM 1092 CA ILE A 90 11.414 6.145 -10.655 1.00 10.00 C ATOM 1093 C ILE A 90 11.160 5.068 -11.708 1.00 10.00 C ATOM 1094 O ILE A 90 10.084 4.469 -11.748 1.00 10.00 O ATOM 1095 CB ILE A 90 12.852 5.998 -10.113 1.00 10.00 C ATOM 1096 CG1 ILE A 90 12.967 4.736 -9.256 1.00 10.00 C ATOM 1097 CG2 ILE A 90 13.251 7.234 -9.315 1.00 10.00 C ATOM 1098 CD1 ILE A 90 14.388 4.362 -8.911 1.00 10.00 C ATOM 0 H ILE A 90 10.776 5.566 -8.750 1.00 10.00 H new ATOM 0 HA ILE A 90 11.306 7.129 -11.112 1.00 10.00 H new ATOM 0 HB ILE A 90 13.536 5.905 -10.956 1.00 10.00 H new ATOM 0 HG12 ILE A 90 12.405 4.882 -8.333 1.00 10.00 H new ATOM 0 HG13 ILE A 90 12.501 3.905 -9.785 1.00 10.00 H new ATOM 0 HG21 ILE A 90 14.267 7.113 -8.941 1.00 10.00 H new ATOM 0 HG22 ILE A 90 13.203 8.113 -9.958 1.00 10.00 H new ATOM 0 HG23 ILE A 90 12.568 7.361 -8.475 1.00 10.00 H new ATOM 0 HD11 ILE A 90 14.389 3.458 -8.302 1.00 10.00 H new ATOM 0 HD12 ILE A 90 14.950 4.183 -9.828 1.00 10.00 H new ATOM 0 HD13 ILE A 90 14.853 5.175 -8.353 1.00 10.00 H new ATOM 1110 N GLY A 91 12.146 4.834 -12.558 1.00 10.00 N ATOM 1111 CA GLY A 91 12.009 3.834 -13.597 1.00 10.00 C ATOM 1112 C GLY A 91 12.168 2.409 -13.086 1.00 10.00 C ATOM 1113 O GLY A 91 11.192 1.657 -13.043 1.00 10.00 O ATOM 0 H GLY A 91 13.043 5.320 -12.548 1.00 10.00 H new ATOM 0 HA2 GLY A 91 11.030 3.938 -14.065 1.00 10.00 H new ATOM 0 HA3 GLY A 91 12.753 4.020 -14.371 1.00 10.00 H new ATOM 1117 N PRO A 92 13.387 2.017 -12.670 1.00 10.00 N ATOM 1118 CA PRO A 92 13.687 0.653 -12.190 1.00 10.00 C ATOM 1119 C PRO A 92 12.834 0.172 -11.010 1.00 10.00 C ATOM 1120 O PRO A 92 12.816 -1.025 -10.718 1.00 10.00 O ATOM 1121 CB PRO A 92 15.164 0.725 -11.776 1.00 10.00 C ATOM 1122 CG PRO A 92 15.478 2.177 -11.672 1.00 10.00 C ATOM 1123 CD PRO A 92 14.589 2.864 -12.663 1.00 10.00 C ATOM 0 HA PRO A 92 13.464 -0.069 -12.975 1.00 10.00 H new ATOM 0 HB2 PRO A 92 15.330 0.219 -10.825 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.802 0.237 -12.513 1.00 10.00 H new ATOM 0 HG2 PRO A 92 15.294 2.545 -10.662 1.00 10.00 H new ATOM 0 HG3 PRO A 92 16.528 2.366 -11.894 1.00 10.00 H new ATOM 0 HD2 PRO A 92 14.361 3.886 -12.360 1.00 10.00 H new ATOM 0 HD3 PRO A 92 15.050 2.919 -13.649 1.00 10.00 H new ATOM 1131 N VAL A 93 12.131 1.074 -10.335 1.00 10.00 N ATOM 1132 CA VAL A 93 11.294 0.675 -9.204 1.00 10.00 C ATOM 1133 C VAL A 93 10.103 -0.142 -9.687 1.00 10.00 C ATOM 1134 O VAL A 93 9.728 -1.146 -9.081 1.00 10.00 O ATOM 1135 CB VAL A 93 10.807 1.890 -8.383 1.00 10.00 C ATOM 1136 CG1 VAL A 93 9.871 2.775 -9.182 1.00 10.00 C ATOM 1137 CG2 VAL A 93 10.145 1.433 -7.092 1.00 10.00 C ATOM 0 H VAL A 93 12.121 2.072 -10.545 1.00 10.00 H new ATOM 0 HA VAL A 93 11.910 0.061 -8.547 1.00 10.00 H new ATOM 0 HB VAL A 93 11.684 2.488 -8.134 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.553 3.617 -8.567 1.00 10.00 H new ATOM 0 HG12 VAL A 93 10.388 3.147 -10.066 1.00 10.00 H new ATOM 0 HG13 VAL A 93 8.998 2.199 -9.488 1.00 10.00 H new ATOM 0 HG21 VAL A 93 9.809 2.303 -6.528 1.00 10.00 H new ATOM 0 HG22 VAL A 93 9.289 0.800 -7.326 1.00 10.00 H new ATOM 0 HG23 VAL A 93 10.862 0.869 -6.496 1.00 10.00 H new ATOM 1147 N SER A 94 9.535 0.283 -10.796 1.00 10.00 N ATOM 1148 CA SER A 94 8.397 -0.397 -11.389 1.00 10.00 C ATOM 1149 C SER A 94 8.789 -1.774 -11.928 1.00 10.00 C ATOM 1150 O SER A 94 7.928 -2.596 -12.242 1.00 10.00 O ATOM 1151 CB SER A 94 7.823 0.464 -12.508 1.00 10.00 C ATOM 1152 OG SER A 94 7.815 1.832 -12.134 1.00 10.00 O ATOM 0 H SER A 94 9.846 1.106 -11.312 1.00 10.00 H new ATOM 0 HA SER A 94 7.642 -0.548 -10.617 1.00 10.00 H new ATOM 0 HB2 SER A 94 8.414 0.333 -13.414 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.809 0.139 -12.740 1.00 10.00 H new ATOM 0 HG SER A 94 7.445 2.369 -12.865 1.00 10.00 H new ATOM 1158 N ALA A 95 10.092 -2.024 -12.015 1.00 10.00 N ATOM 1159 CA ALA A 95 10.602 -3.292 -12.516 1.00 10.00 C ATOM 1160 C ALA A 95 10.808 -4.294 -11.382 1.00 10.00 C ATOM 1161 O ALA A 95 11.272 -5.415 -11.603 1.00 10.00 O ATOM 1162 CB ALA A 95 11.907 -3.066 -13.262 1.00 10.00 C ATOM 0 H ALA A 95 10.816 -1.359 -11.743 1.00 10.00 H new ATOM 0 HA ALA A 95 9.864 -3.710 -13.200 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.283 -4.019 -13.634 1.00 10.00 H new ATOM 0 HB2 ALA A 95 11.735 -2.391 -14.101 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.640 -2.625 -12.587 1.00 10.00 H new ATOM 1168 N ILE A 96 10.467 -3.884 -10.169 1.00 10.00 N ATOM 1169 CA ILE A 96 10.610 -4.741 -9.002 1.00 10.00 C ATOM 1170 C ILE A 96 9.287 -5.425 -8.685 1.00 10.00 C ATOM 1171 O ILE A 96 8.316 -4.778 -8.302 1.00 10.00 O ATOM 1172 CB ILE A 96 11.090 -3.940 -7.772 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.433 -3.275 -8.078 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.200 -4.838 -6.543 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.767 -2.135 -7.147 1.00 10.00 C ATOM 0 H ILE A 96 10.088 -2.959 -9.967 1.00 10.00 H new ATOM 0 HA ILE A 96 11.362 -5.495 -9.234 1.00 10.00 H new ATOM 0 HB ILE A 96 10.354 -3.166 -7.552 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.222 -4.025 -8.019 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.421 -2.905 -9.103 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.540 -4.249 -5.691 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.224 -5.270 -6.319 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.914 -5.638 -6.739 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.733 -1.711 -7.423 1.00 10.00 H new ATOM 0 HD12 ILE A 96 11.998 -1.366 -7.223 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.812 -2.503 -6.122 1.00 10.00 H new ATOM 1187 N SER A 97 9.249 -6.731 -8.883 1.00 10.00 N ATOM 1188 CA SER A 97 8.049 -7.510 -8.623 1.00 10.00 C ATOM 1189 C SER A 97 8.374 -8.731 -7.761 1.00 10.00 C ATOM 1190 O SER A 97 8.888 -9.736 -8.257 1.00 10.00 O ATOM 1191 CB SER A 97 7.419 -7.942 -9.947 1.00 10.00 C ATOM 1192 OG SER A 97 7.503 -6.898 -10.905 1.00 10.00 O ATOM 0 H SER A 97 10.039 -7.278 -9.225 1.00 10.00 H new ATOM 0 HA SER A 97 7.338 -6.891 -8.076 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.926 -8.830 -10.324 1.00 10.00 H new ATOM 0 HB3 SER A 97 6.375 -8.214 -9.788 1.00 10.00 H new ATOM 0 HG SER A 97 7.096 -7.193 -11.747 1.00 10.00 H new ATOM 1198 N THR A 98 8.088 -8.631 -6.470 1.00 10.00 N ATOM 1199 CA THR A 98 8.345 -9.724 -5.545 1.00 10.00 C ATOM 1200 C THR A 98 7.105 -10.027 -4.706 1.00 10.00 C ATOM 1201 O THR A 98 6.246 -9.163 -4.515 1.00 10.00 O ATOM 1202 CB THR A 98 9.539 -9.407 -4.616 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.886 -10.557 -3.835 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.215 -8.258 -3.683 1.00 10.00 C ATOM 0 H THR A 98 7.677 -7.802 -6.040 1.00 10.00 H new ATOM 0 HA THR A 98 8.595 -10.602 -6.141 1.00 10.00 H new ATOM 0 HB THR A 98 10.380 -9.125 -5.249 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.659 -11.005 -4.238 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.073 -8.057 -3.041 1.00 10.00 H new ATOM 0 HG22 THR A 98 8.984 -7.368 -4.268 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.355 -8.521 -3.067 1.00 10.00 H new ATOM 1212 N THR A 99 7.012 -11.248 -4.215 1.00 10.00 N ATOM 1213 CA THR A 99 5.879 -11.663 -3.411 1.00 10.00 C ATOM 1214 C THR A 99 6.160 -11.537 -1.913 1.00 10.00 C ATOM 1215 O THR A 99 5.385 -12.015 -1.084 1.00 10.00 O ATOM 1216 CB THR A 99 5.506 -13.112 -3.742 1.00 10.00 C ATOM 1217 OG1 THR A 99 6.630 -13.779 -4.337 1.00 10.00 O ATOM 1218 CG2 THR A 99 4.329 -13.157 -4.700 1.00 10.00 C ATOM 0 H THR A 99 7.713 -11.974 -4.360 1.00 10.00 H new ATOM 0 HA THR A 99 5.049 -10.999 -3.651 1.00 10.00 H new ATOM 0 HB THR A 99 5.226 -13.616 -2.817 1.00 10.00 H new ATOM 0 HG1 THR A 99 6.388 -14.705 -4.545 1.00 10.00 H new ATOM 0 HG21 THR A 99 4.080 -14.195 -4.922 1.00 10.00 H new ATOM 0 HG22 THR A 99 3.469 -12.667 -4.243 1.00 10.00 H new ATOM 0 HG23 THR A 99 4.592 -12.641 -5.624 1.00 10.00 H new ATOM 1226 N SER A 100 7.266 -10.895 -1.565 1.00 10.00 N ATOM 1227 CA SER A 100 7.631 -10.713 -0.166 1.00 10.00 C ATOM 1228 C SER A 100 7.862 -9.240 0.143 1.00 10.00 C ATOM 1229 O SER A 100 8.634 -8.567 -0.543 1.00 10.00 O ATOM 1230 CB SER A 100 8.888 -11.519 0.162 1.00 10.00 C ATOM 1231 OG SER A 100 9.423 -11.153 1.424 1.00 10.00 O ATOM 0 H SER A 100 7.926 -10.492 -2.230 1.00 10.00 H new ATOM 0 HA SER A 100 6.808 -11.072 0.452 1.00 10.00 H new ATOM 0 HB2 SER A 100 8.651 -12.583 0.160 1.00 10.00 H new ATOM 0 HB3 SER A 100 9.637 -11.359 -0.613 1.00 10.00 H new ATOM 0 HG SER A 100 10.225 -11.686 1.607 1.00 10.00 H new ATOM 1237 N VAL A 101 7.193 -8.736 1.177 1.00 10.00 N ATOM 1238 CA VAL A 101 7.344 -7.341 1.567 1.00 10.00 C ATOM 1239 C VAL A 101 8.759 -7.086 2.080 1.00 10.00 C ATOM 1240 O VAL A 101 9.298 -5.984 1.950 1.00 10.00 O ATOM 1241 CB VAL A 101 6.296 -6.925 2.627 1.00 10.00 C ATOM 1242 CG1 VAL A 101 6.633 -7.484 4.005 1.00 10.00 C ATOM 1243 CG2 VAL A 101 6.161 -5.411 2.673 1.00 10.00 C ATOM 0 H VAL A 101 6.545 -9.271 1.756 1.00 10.00 H new ATOM 0 HA VAL A 101 7.172 -6.728 0.682 1.00 10.00 H new ATOM 0 HB VAL A 101 5.337 -7.352 2.332 1.00 10.00 H new ATOM 0 HG11 VAL A 101 5.874 -7.170 4.721 1.00 10.00 H new ATOM 0 HG12 VAL A 101 6.660 -8.573 3.959 1.00 10.00 H new ATOM 0 HG13 VAL A 101 7.607 -7.110 4.321 1.00 10.00 H new ATOM 0 HG21 VAL A 101 5.420 -5.134 3.423 1.00 10.00 H new ATOM 0 HG22 VAL A 101 7.123 -4.968 2.932 1.00 10.00 H new ATOM 0 HG23 VAL A 101 5.843 -5.044 1.697 1.00 10.00 H new ATOM 1253 N GLN A 102 9.365 -8.130 2.635 1.00 10.00 N ATOM 1254 CA GLN A 102 10.716 -8.044 3.158 1.00 10.00 C ATOM 1255 C GLN A 102 11.701 -7.916 2.006 1.00 10.00 C ATOM 1256 O GLN A 102 12.605 -7.079 2.034 1.00 10.00 O ATOM 1257 CB GLN A 102 11.041 -9.278 4.003 1.00 10.00 C ATOM 1258 CG GLN A 102 10.094 -9.481 5.174 1.00 10.00 C ATOM 1259 CD GLN A 102 10.402 -10.741 5.958 1.00 10.00 C ATOM 1260 OE1 GLN A 102 9.880 -11.816 5.658 1.00 10.00 O ATOM 1261 NE2 GLN A 102 11.245 -10.620 6.971 1.00 10.00 N ATOM 0 H GLN A 102 8.935 -9.050 2.733 1.00 10.00 H new ATOM 0 HA GLN A 102 10.796 -7.163 3.795 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.012 -10.162 3.366 1.00 10.00 H new ATOM 0 HB3 GLN A 102 12.060 -9.191 4.381 1.00 10.00 H new ATOM 0 HG2 GLN A 102 10.154 -8.619 5.839 1.00 10.00 H new ATOM 0 HG3 GLN A 102 9.070 -9.528 4.805 1.00 10.00 H new ATOM 0 HE21 GLN A 102 11.656 -9.712 7.187 1.00 10.00 H new ATOM 0 HE22 GLN A 102 11.484 -11.435 7.536 1.00 10.00 H new ATOM 1270 N GLN A 103 11.501 -8.735 0.978 1.00 10.00 N ATOM 1271 CA GLN A 103 12.359 -8.712 -0.198 1.00 10.00 C ATOM 1272 C GLN A 103 12.184 -7.394 -0.942 1.00 10.00 C ATOM 1273 O GLN A 103 13.148 -6.820 -1.448 1.00 10.00 O ATOM 1274 CB GLN A 103 12.026 -9.885 -1.121 1.00 10.00 C ATOM 1275 CG GLN A 103 12.940 -9.990 -2.329 1.00 10.00 C ATOM 1276 CD GLN A 103 14.318 -10.532 -1.987 1.00 10.00 C ATOM 1277 OE1 GLN A 103 14.826 -10.322 -0.886 1.00 10.00 O ATOM 1278 NE2 GLN A 103 14.932 -11.227 -2.931 1.00 10.00 N ATOM 0 H GLN A 103 10.750 -9.424 0.937 1.00 10.00 H new ATOM 0 HA GLN A 103 13.397 -8.805 0.122 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.084 -10.812 -0.551 1.00 10.00 H new ATOM 0 HB3 GLN A 103 10.996 -9.785 -1.463 1.00 10.00 H new ATOM 0 HG2 GLN A 103 12.476 -10.637 -3.073 1.00 10.00 H new ATOM 0 HG3 GLN A 103 13.046 -9.005 -2.784 1.00 10.00 H new ATOM 0 HE21 GLN A 103 14.476 -11.379 -3.831 1.00 10.00 H new ATOM 0 HE22 GLN A 103 15.861 -11.611 -2.759 1.00 10.00 H new ATOM 1287 N ALA A 104 10.945 -6.921 -0.992 1.00 10.00 N ATOM 1288 CA ALA A 104 10.621 -5.662 -1.650 1.00 10.00 C ATOM 1289 C ALA A 104 11.436 -4.516 -1.061 1.00 10.00 C ATOM 1290 O ALA A 104 12.074 -3.757 -1.791 1.00 10.00 O ATOM 1291 CB ALA A 104 9.135 -5.370 -1.525 1.00 10.00 C ATOM 0 H ALA A 104 10.141 -7.396 -0.580 1.00 10.00 H new ATOM 0 HA ALA A 104 10.875 -5.754 -2.706 1.00 10.00 H new ATOM 0 HB1 ALA A 104 8.907 -4.427 -2.021 1.00 10.00 H new ATOM 0 HB2 ALA A 104 8.566 -6.173 -1.993 1.00 10.00 H new ATOM 0 HB3 ALA A 104 8.865 -5.301 -0.471 1.00 10.00 H new ATOM 1297 N ALA A 105 11.422 -4.408 0.268 1.00 10.00 N ATOM 1298 CA ALA A 105 12.166 -3.363 0.961 1.00 10.00 C ATOM 1299 C ALA A 105 13.665 -3.529 0.729 1.00 10.00 C ATOM 1300 O ALA A 105 14.420 -2.554 0.699 1.00 10.00 O ATOM 1301 CB ALA A 105 11.849 -3.385 2.453 1.00 10.00 C ATOM 0 H ALA A 105 10.902 -5.033 0.884 1.00 10.00 H new ATOM 0 HA ALA A 105 11.862 -2.397 0.558 1.00 10.00 H new ATOM 0 HB1 ALA A 105 12.412 -2.599 2.956 1.00 10.00 H new ATOM 0 HB2 ALA A 105 10.782 -3.218 2.601 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.126 -4.353 2.870 1.00 10.00 H new ATOM 1307 N THR A 106 14.082 -4.771 0.541 1.00 10.00 N ATOM 1308 CA THR A 106 15.482 -5.087 0.308 1.00 10.00 C ATOM 1309 C THR A 106 15.939 -4.574 -1.059 1.00 10.00 C ATOM 1310 O THR A 106 16.942 -3.860 -1.162 1.00 10.00 O ATOM 1311 CB THR A 106 15.716 -6.611 0.394 1.00 10.00 C ATOM 1312 OG1 THR A 106 15.216 -7.114 1.642 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.191 -6.952 0.266 1.00 10.00 C ATOM 0 H THR A 106 13.465 -5.583 0.545 1.00 10.00 H new ATOM 0 HA THR A 106 16.068 -4.591 1.082 1.00 10.00 H new ATOM 0 HB THR A 106 15.182 -7.078 -0.433 1.00 10.00 H new ATOM 0 HG1 THR A 106 14.257 -7.297 1.560 1.00 10.00 H new ATOM 0 HG21 THR A 106 17.322 -8.032 0.331 1.00 10.00 H new ATOM 0 HG22 THR A 106 17.564 -6.598 -0.695 1.00 10.00 H new ATOM 0 HG23 THR A 106 17.747 -6.471 1.071 1.00 10.00 H new ATOM 1321 N GLU A 107 15.178 -4.911 -2.092 1.00 10.00 N ATOM 1322 CA GLU A 107 15.503 -4.505 -3.453 1.00 10.00 C ATOM 1323 C GLU A 107 15.364 -2.997 -3.639 1.00 10.00 C ATOM 1324 O GLU A 107 16.154 -2.379 -4.358 1.00 10.00 O ATOM 1325 CB GLU A 107 14.618 -5.242 -4.457 1.00 10.00 C ATOM 1326 CG GLU A 107 14.897 -6.735 -4.528 1.00 10.00 C ATOM 1327 CD GLU A 107 14.444 -7.360 -5.832 1.00 10.00 C ATOM 1328 OE1 GLU A 107 14.707 -6.776 -6.902 1.00 10.00 O ATOM 1329 OE2 GLU A 107 13.836 -8.452 -5.800 1.00 10.00 O ATOM 0 H GLU A 107 14.327 -5.467 -2.012 1.00 10.00 H new ATOM 0 HA GLU A 107 16.545 -4.770 -3.634 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.573 -5.088 -4.190 1.00 10.00 H new ATOM 0 HB3 GLU A 107 14.762 -4.806 -5.445 1.00 10.00 H new ATOM 0 HG2 GLU A 107 15.966 -6.906 -4.402 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.394 -7.233 -3.699 1.00 10.00 H new ATOM 1336 N LEU A 108 14.363 -2.405 -2.992 1.00 10.00 N ATOM 1337 CA LEU A 108 14.140 -0.967 -3.088 1.00 10.00 C ATOM 1338 C LEU A 108 15.357 -0.197 -2.596 1.00 10.00 C ATOM 1339 O LEU A 108 15.854 0.690 -3.279 1.00 10.00 O ATOM 1340 CB LEU A 108 12.910 -0.547 -2.280 1.00 10.00 C ATOM 1341 CG LEU A 108 11.555 -0.911 -2.887 1.00 10.00 C ATOM 1342 CD1 LEU A 108 10.433 -0.315 -2.052 1.00 10.00 C ATOM 1343 CD2 LEU A 108 11.460 -0.430 -4.325 1.00 10.00 C ATOM 0 H LEU A 108 13.696 -2.898 -2.398 1.00 10.00 H new ATOM 0 HA LEU A 108 13.969 -0.731 -4.138 1.00 10.00 H new ATOM 0 HB2 LEU A 108 12.977 -1.001 -1.291 1.00 10.00 H new ATOM 0 HB3 LEU A 108 12.944 0.533 -2.138 1.00 10.00 H new ATOM 0 HG LEU A 108 11.457 -1.997 -2.887 1.00 10.00 H new ATOM 0 HD11 LEU A 108 9.472 -0.580 -2.492 1.00 10.00 H new ATOM 0 HD12 LEU A 108 10.487 -0.707 -1.037 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.534 0.770 -2.028 1.00 10.00 H new ATOM 0 HD21 LEU A 108 10.487 -0.700 -4.736 1.00 10.00 H new ATOM 0 HD22 LEU A 108 11.578 0.653 -4.355 1.00 10.00 H new ATOM 0 HD23 LEU A 108 12.247 -0.897 -4.918 1.00 10.00 H new ATOM 1355 N SER A 109 15.841 -0.554 -1.417 1.00 10.00 N ATOM 1356 CA SER A 109 17.001 0.105 -0.827 1.00 10.00 C ATOM 1357 C SER A 109 18.246 -0.034 -1.706 1.00 10.00 C ATOM 1358 O SER A 109 19.123 0.830 -1.687 1.00 10.00 O ATOM 1359 CB SER A 109 17.274 -0.474 0.557 1.00 10.00 C ATOM 1360 OG SER A 109 16.091 -0.469 1.330 1.00 10.00 O ATOM 0 H SER A 109 15.447 -1.301 -0.845 1.00 10.00 H new ATOM 0 HA SER A 109 16.774 1.168 -0.745 1.00 10.00 H new ATOM 0 HB2 SER A 109 17.653 -1.492 0.465 1.00 10.00 H new ATOM 0 HB3 SER A 109 18.047 0.110 1.057 1.00 10.00 H new ATOM 0 HG SER A 109 15.557 -1.262 1.115 1.00 10.00 H new ATOM 1366 N ALA A 110 18.307 -1.105 -2.486 1.00 10.00 N ATOM 1367 CA ALA A 110 19.444 -1.341 -3.361 1.00 10.00 C ATOM 1368 C ALA A 110 19.484 -0.324 -4.498 1.00 10.00 C ATOM 1369 O ALA A 110 20.548 0.184 -4.853 1.00 10.00 O ATOM 1370 CB ALA A 110 19.404 -2.756 -3.915 1.00 10.00 C ATOM 0 H ALA A 110 17.583 -1.822 -2.530 1.00 10.00 H new ATOM 0 HA ALA A 110 20.353 -1.222 -2.771 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.262 -2.916 -4.568 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.436 -3.470 -3.092 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.485 -2.899 -4.483 1.00 10.00 H new ATOM 1376 N VAL A 111 18.324 -0.027 -5.066 1.00 10.00 N ATOM 1377 CA VAL A 111 18.244 0.927 -6.167 1.00 10.00 C ATOM 1378 C VAL A 111 18.090 2.366 -5.657 1.00 10.00 C ATOM 1379 O VAL A 111 18.646 3.305 -6.228 1.00 10.00 O ATOM 1380 CB VAL A 111 17.086 0.577 -7.140 1.00 10.00 C ATOM 1381 CG1 VAL A 111 15.759 0.440 -6.407 1.00 10.00 C ATOM 1382 CG2 VAL A 111 16.978 1.606 -8.254 1.00 10.00 C ATOM 0 H VAL A 111 17.429 -0.429 -4.786 1.00 10.00 H new ATOM 0 HA VAL A 111 19.184 0.858 -6.714 1.00 10.00 H new ATOM 0 HB VAL A 111 17.320 -0.389 -7.587 1.00 10.00 H new ATOM 0 HG11 VAL A 111 14.973 0.195 -7.121 1.00 10.00 H new ATOM 0 HG12 VAL A 111 15.834 -0.353 -5.663 1.00 10.00 H new ATOM 0 HG13 VAL A 111 15.518 1.380 -5.911 1.00 10.00 H new ATOM 0 HG21 VAL A 111 16.159 1.336 -8.921 1.00 10.00 H new ATOM 0 HG22 VAL A 111 16.787 2.589 -7.824 1.00 10.00 H new ATOM 0 HG23 VAL A 111 17.911 1.632 -8.817 1.00 10.00 H new ATOM 1392 N TYR A 112 17.363 2.523 -4.562 1.00 10.00 N ATOM 1393 CA TYR A 112 17.098 3.837 -3.974 1.00 10.00 C ATOM 1394 C TYR A 112 18.319 4.455 -3.314 1.00 10.00 C ATOM 1395 O TYR A 112 18.367 5.669 -3.100 1.00 10.00 O ATOM 1396 CB TYR A 112 15.931 3.760 -2.996 1.00 10.00 C ATOM 1397 CG TYR A 112 14.592 3.885 -3.688 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.447 3.493 -5.013 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.484 4.394 -3.032 1.00 10.00 C ATOM 1400 CE1 TYR A 112 13.241 3.601 -5.667 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.270 4.509 -3.680 1.00 10.00 C ATOM 1402 CZ TYR A 112 12.151 4.111 -4.994 1.00 10.00 C ATOM 1403 OH TYR A 112 10.942 4.233 -5.638 1.00 10.00 O ATOM 0 H TYR A 112 16.938 1.748 -4.053 1.00 10.00 H new ATOM 0 HA TYR A 112 16.830 4.499 -4.798 1.00 10.00 H new ATOM 0 HB2 TYR A 112 15.972 2.813 -2.458 1.00 10.00 H new ATOM 0 HB3 TYR A 112 16.029 4.552 -2.254 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.300 3.094 -5.542 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.570 4.705 -2.001 1.00 10.00 H new ATOM 0 HE1 TYR A 112 13.149 3.289 -6.697 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.414 4.911 -3.157 1.00 10.00 H new ATOM 0 HH TYR A 112 11.076 4.148 -6.605 1.00 10.00 H new ATOM 1413 N ALA A 113 19.282 3.622 -2.943 1.00 10.00 N ATOM 1414 CA ALA A 113 20.512 4.103 -2.313 1.00 10.00 C ATOM 1415 C ALA A 113 21.208 5.154 -3.181 1.00 10.00 C ATOM 1416 O ALA A 113 21.981 5.967 -2.680 1.00 10.00 O ATOM 1417 CB ALA A 113 21.455 2.945 -2.027 1.00 10.00 C ATOM 0 H ALA A 113 19.239 2.610 -3.066 1.00 10.00 H new ATOM 0 HA ALA A 113 20.239 4.574 -1.369 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.364 3.323 -1.559 1.00 10.00 H new ATOM 0 HB2 ALA A 113 20.969 2.237 -1.356 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.710 2.444 -2.961 1.00 10.00 H new ATOM 1423 N ALA A 114 20.919 5.140 -4.483 1.00 10.00 N ATOM 1424 CA ALA A 114 21.501 6.104 -5.410 1.00 10.00 C ATOM 1425 C ALA A 114 21.004 7.517 -5.100 1.00 10.00 C ATOM 1426 O ALA A 114 21.716 8.499 -5.310 1.00 10.00 O ATOM 1427 CB ALA A 114 21.173 5.729 -6.848 1.00 10.00 C ATOM 0 H ALA A 114 20.284 4.470 -4.917 1.00 10.00 H new ATOM 0 HA ALA A 114 22.584 6.085 -5.287 1.00 10.00 H new ATOM 0 HB1 ALA A 114 21.616 6.460 -7.525 1.00 10.00 H new ATOM 0 HB2 ALA A 114 21.576 4.740 -7.067 1.00 10.00 H new ATOM 0 HB3 ALA A 114 20.092 5.718 -6.983 1.00 10.00 H new ATOM 1433 N GLN A 115 19.779 7.605 -4.593 1.00 10.00 N ATOM 1434 CA GLN A 115 19.177 8.886 -4.239 1.00 10.00 C ATOM 1435 C GLN A 115 19.407 9.178 -2.764 1.00 10.00 C ATOM 1436 O GLN A 115 19.405 10.331 -2.332 1.00 10.00 O ATOM 1437 CB GLN A 115 17.674 8.887 -4.542 1.00 10.00 C ATOM 1438 CG GLN A 115 17.343 9.037 -6.020 1.00 10.00 C ATOM 1439 CD GLN A 115 17.562 7.759 -6.801 1.00 10.00 C ATOM 1440 OE1 GLN A 115 17.390 6.658 -6.277 1.00 10.00 O ATOM 1441 NE2 GLN A 115 17.952 7.891 -8.059 1.00 10.00 N ATOM 0 H GLN A 115 19.180 6.799 -4.417 1.00 10.00 H new ATOM 0 HA GLN A 115 19.649 9.663 -4.840 1.00 10.00 H new ATOM 0 HB2 GLN A 115 17.239 7.958 -4.175 1.00 10.00 H new ATOM 0 HB3 GLN A 115 17.203 9.700 -3.990 1.00 10.00 H new ATOM 0 HG2 GLN A 115 16.304 9.349 -6.125 1.00 10.00 H new ATOM 0 HG3 GLN A 115 17.958 9.829 -6.447 1.00 10.00 H new ATOM 0 HE21 GLN A 115 18.084 8.821 -8.457 1.00 10.00 H new ATOM 0 HE22 GLN A 115 18.121 7.063 -8.630 1.00 10.00 H new ATOM 1450 N GLY A 116 19.614 8.120 -1.997 1.00 10.00 N ATOM 1451 CA GLY A 116 19.846 8.268 -0.579 1.00 10.00 C ATOM 1452 C GLY A 116 18.658 7.833 0.250 1.00 10.00 C ATOM 1453 O GLY A 116 18.387 8.403 1.308 1.00 10.00 O ATOM 0 H GLY A 116 19.625 7.157 -2.334 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.719 7.681 -0.294 1.00 10.00 H new ATOM 0 HA3 GLY A 116 20.077 9.310 -0.359 1.00 10.00 H new ATOM 1457 N VAL A 117 17.953 6.817 -0.220 1.00 10.00 N ATOM 1458 CA VAL A 117 16.787 6.308 0.486 1.00 10.00 C ATOM 1459 C VAL A 117 16.943 4.817 0.758 1.00 10.00 C ATOM 1460 O VAL A 117 17.396 4.065 -0.103 1.00 10.00 O ATOM 1461 CB VAL A 117 15.485 6.551 -0.315 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.293 5.865 0.341 1.00 10.00 C ATOM 1463 CG2 VAL A 117 15.213 8.039 -0.468 1.00 10.00 C ATOM 0 H VAL A 117 18.168 6.327 -1.089 1.00 10.00 H new ATOM 0 HA VAL A 117 16.715 6.848 1.430 1.00 10.00 H new ATOM 0 HB VAL A 117 15.625 6.117 -1.305 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.395 6.056 -0.247 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.473 4.791 0.391 1.00 10.00 H new ATOM 0 HG13 VAL A 117 14.157 6.257 1.349 1.00 10.00 H new ATOM 0 HG21 VAL A 117 14.293 8.184 -1.034 1.00 10.00 H new ATOM 0 HG22 VAL A 117 15.108 8.493 0.517 1.00 10.00 H new ATOM 0 HG23 VAL A 117 16.043 8.508 -0.997 1.00 10.00 H new ATOM 1473 N SER A 118 16.604 4.406 1.969 1.00 10.00 N ATOM 1474 CA SER A 118 16.684 3.012 2.358 1.00 10.00 C ATOM 1475 C SER A 118 15.430 2.610 3.132 1.00 10.00 C ATOM 1476 O SER A 118 14.993 3.316 4.043 1.00 10.00 O ATOM 1477 CB SER A 118 17.960 2.774 3.170 1.00 10.00 C ATOM 1478 OG SER A 118 19.082 2.705 2.305 1.00 10.00 O ATOM 0 H SER A 118 16.268 5.027 2.705 1.00 10.00 H new ATOM 0 HA SER A 118 16.733 2.384 1.469 1.00 10.00 H new ATOM 0 HB2 SER A 118 18.096 3.579 3.892 1.00 10.00 H new ATOM 0 HB3 SER A 118 17.871 1.848 3.738 1.00 10.00 H new ATOM 0 HG SER A 118 18.818 2.987 1.404 1.00 10.00 H new ATOM 1484 N VAL A 119 14.843 1.483 2.758 1.00 10.00 N ATOM 1485 CA VAL A 119 13.622 1.011 3.391 1.00 10.00 C ATOM 1486 C VAL A 119 13.804 -0.367 4.020 1.00 10.00 C ATOM 1487 O VAL A 119 14.597 -1.182 3.553 1.00 10.00 O ATOM 1488 CB VAL A 119 12.454 0.945 2.382 1.00 10.00 C ATOM 1489 CG1 VAL A 119 11.954 2.334 2.040 1.00 10.00 C ATOM 1490 CG2 VAL A 119 12.869 0.221 1.117 1.00 10.00 C ATOM 0 H VAL A 119 15.194 0.877 2.017 1.00 10.00 H new ATOM 0 HA VAL A 119 13.387 1.731 4.175 1.00 10.00 H new ATOM 0 HB VAL A 119 11.644 0.388 2.853 1.00 10.00 H new ATOM 0 HG11 VAL A 119 11.132 2.260 1.328 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.605 2.829 2.947 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.765 2.914 1.599 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.028 0.189 0.424 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.702 0.748 0.653 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.175 -0.796 1.363 1.00 10.00 H new ATOM 1500 N SER A 120 13.069 -0.614 5.089 1.00 10.00 N ATOM 1501 CA SER A 120 13.114 -1.888 5.791 1.00 10.00 C ATOM 1502 C SER A 120 11.805 -2.109 6.536 1.00 10.00 C ATOM 1503 O SER A 120 11.114 -1.152 6.875 1.00 10.00 O ATOM 1504 CB SER A 120 14.286 -1.927 6.777 1.00 10.00 C ATOM 1505 OG SER A 120 15.526 -1.770 6.108 1.00 10.00 O ATOM 0 H SER A 120 12.423 0.062 5.497 1.00 10.00 H new ATOM 0 HA SER A 120 13.256 -2.682 5.058 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.167 -1.137 7.518 1.00 10.00 H new ATOM 0 HB3 SER A 120 14.279 -2.874 7.317 1.00 10.00 H new ATOM 0 HG SER A 120 15.370 -1.697 5.143 1.00 10.00 H new ATOM 1511 N VAL A 121 11.462 -3.361 6.777 1.00 10.00 N ATOM 1512 CA VAL A 121 10.241 -3.691 7.481 1.00 10.00 C ATOM 1513 C VAL A 121 10.572 -4.261 8.853 1.00 10.00 C ATOM 1514 O VAL A 121 11.263 -5.277 8.969 1.00 10.00 O ATOM 1515 CB VAL A 121 9.379 -4.682 6.669 1.00 10.00 C ATOM 1516 CG1 VAL A 121 10.227 -5.799 6.091 1.00 10.00 C ATOM 1517 CG2 VAL A 121 8.243 -5.242 7.513 1.00 10.00 C ATOM 0 H VAL A 121 12.017 -4.169 6.493 1.00 10.00 H new ATOM 0 HA VAL A 121 9.659 -2.778 7.609 1.00 10.00 H new ATOM 0 HB VAL A 121 8.938 -4.132 5.838 1.00 10.00 H new ATOM 0 HG11 VAL A 121 9.593 -6.481 5.525 1.00 10.00 H new ATOM 0 HG12 VAL A 121 10.985 -5.376 5.432 1.00 10.00 H new ATOM 0 HG13 VAL A 121 10.713 -6.343 6.901 1.00 10.00 H new ATOM 0 HG21 VAL A 121 7.653 -5.937 6.915 1.00 10.00 H new ATOM 0 HG22 VAL A 121 8.655 -5.765 8.376 1.00 10.00 H new ATOM 0 HG23 VAL A 121 7.606 -4.426 7.854 1.00 10.00 H new ATOM 1527 N SER A 122 10.101 -3.589 9.886 1.00 10.00 N ATOM 1528 CA SER A 122 10.353 -4.008 11.251 1.00 10.00 C ATOM 1529 C SER A 122 9.081 -3.884 12.084 1.00 10.00 C ATOM 1530 O SER A 122 8.426 -2.840 12.071 1.00 10.00 O ATOM 1531 CB SER A 122 11.478 -3.153 11.844 1.00 10.00 C ATOM 1532 OG SER A 122 12.653 -3.244 11.054 1.00 10.00 O ATOM 0 H SER A 122 9.537 -2.743 9.804 1.00 10.00 H new ATOM 0 HA SER A 122 10.661 -5.054 11.260 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.156 -2.113 11.906 1.00 10.00 H new ATOM 0 HB3 SER A 122 11.692 -3.481 12.861 1.00 10.00 H new ATOM 0 HG SER A 122 13.357 -2.689 11.450 1.00 10.00 H new ATOM 1538 N ALA A 123 8.729 -4.969 12.773 1.00 10.00 N ATOM 1539 CA ALA A 123 7.545 -5.020 13.628 1.00 10.00 C ATOM 1540 C ALA A 123 6.273 -4.717 12.839 1.00 10.00 C ATOM 1541 O ALA A 123 5.405 -3.972 13.304 1.00 10.00 O ATOM 1542 CB ALA A 123 7.690 -4.067 14.806 1.00 10.00 C ATOM 0 H ALA A 123 9.259 -5.840 12.753 1.00 10.00 H new ATOM 0 HA ALA A 123 7.459 -6.035 14.015 1.00 10.00 H new ATOM 0 HB1 ALA A 123 6.798 -4.121 15.430 1.00 10.00 H new ATOM 0 HB2 ALA A 123 8.562 -4.348 15.396 1.00 10.00 H new ATOM 0 HB3 ALA A 123 7.814 -3.049 14.437 1.00 10.00 H new ATOM 1548 N ASN A 124 6.171 -5.306 11.646 1.00 10.00 N ATOM 1549 CA ASN A 124 5.012 -5.116 10.772 1.00 10.00 C ATOM 1550 C ASN A 124 4.832 -3.637 10.451 1.00 10.00 C ATOM 1551 O ASN A 124 3.719 -3.112 10.404 1.00 10.00 O ATOM 1552 CB ASN A 124 3.740 -5.695 11.406 1.00 10.00 C ATOM 1553 CG ASN A 124 3.592 -7.184 11.157 1.00 10.00 C ATOM 1554 OD1 ASN A 124 4.562 -7.881 10.854 1.00 10.00 O ATOM 1555 ND2 ASN A 124 2.375 -7.686 11.289 1.00 10.00 N ATOM 0 H ASN A 124 6.885 -5.924 11.260 1.00 10.00 H new ATOM 0 HA ASN A 124 5.193 -5.655 9.842 1.00 10.00 H new ATOM 0 HB2 ASN A 124 3.757 -5.510 12.480 1.00 10.00 H new ATOM 0 HB3 ASN A 124 2.870 -5.175 11.006 1.00 10.00 H new ATOM 0 HD21 ASN A 124 2.215 -8.682 11.139 1.00 10.00 H new ATOM 0 HD22 ASN A 124 1.597 -7.077 11.541 1.00 10.00 H new ATOM 1562 N LYS A 125 5.952 -2.974 10.244 1.00 10.00 N ATOM 1563 CA LYS A 125 5.967 -1.566 9.916 1.00 10.00 C ATOM 1564 C LYS A 125 7.110 -1.288 8.960 1.00 10.00 C ATOM 1565 O LYS A 125 8.245 -1.688 9.207 1.00 10.00 O ATOM 1566 CB LYS A 125 6.130 -0.727 11.183 1.00 10.00 C ATOM 1567 CG LYS A 125 5.839 0.754 10.997 1.00 10.00 C ATOM 1568 CD LYS A 125 6.108 1.531 12.278 1.00 10.00 C ATOM 1569 CE LYS A 125 5.414 2.884 12.280 1.00 10.00 C ATOM 1570 NZ LYS A 125 5.786 3.694 13.472 1.00 10.00 N ATOM 0 H LYS A 125 6.878 -3.399 10.299 1.00 10.00 H new ATOM 0 HA LYS A 125 5.022 -1.298 9.444 1.00 10.00 H new ATOM 0 HB2 LYS A 125 5.467 -1.121 11.953 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.150 -0.841 11.551 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.457 1.151 10.191 1.00 10.00 H new ATOM 0 HG3 LYS A 125 4.800 0.889 10.698 1.00 10.00 H new ATOM 0 HD2 LYS A 125 5.768 0.948 13.134 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.182 1.674 12.396 1.00 10.00 H new ATOM 0 HE2 LYS A 125 5.677 3.429 11.374 1.00 10.00 H new ATOM 0 HE3 LYS A 125 4.334 2.739 12.262 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 4.930 3.926 14.015 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 6.439 3.150 14.071 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 6.249 4.573 13.164 1.00 10.00 H new ATOM 1584 N LEU A 126 6.811 -0.625 7.866 1.00 10.00 N ATOM 1585 CA LEU A 126 7.827 -0.291 6.889 1.00 10.00 C ATOM 1586 C LEU A 126 8.445 1.038 7.281 1.00 10.00 C ATOM 1587 O LEU A 126 7.749 2.041 7.392 1.00 10.00 O ATOM 1588 CB LEU A 126 7.208 -0.197 5.496 1.00 10.00 C ATOM 1589 CG LEU A 126 6.907 -1.541 4.830 1.00 10.00 C ATOM 1590 CD1 LEU A 126 5.850 -1.372 3.755 1.00 10.00 C ATOM 1591 CD2 LEU A 126 8.169 -2.141 4.231 1.00 10.00 C ATOM 0 H LEU A 126 5.872 -0.305 7.629 1.00 10.00 H new ATOM 0 HA LEU A 126 8.593 -1.066 6.866 1.00 10.00 H new ATOM 0 HB2 LEU A 126 6.281 0.373 5.564 1.00 10.00 H new ATOM 0 HB3 LEU A 126 7.883 0.367 4.852 1.00 10.00 H new ATOM 0 HG LEU A 126 6.530 -2.222 5.593 1.00 10.00 H new ATOM 0 HD11 LEU A 126 5.646 -2.337 3.290 1.00 10.00 H new ATOM 0 HD12 LEU A 126 4.935 -0.984 4.202 1.00 10.00 H new ATOM 0 HD13 LEU A 126 6.208 -0.673 2.999 1.00 10.00 H new ATOM 0 HD21 LEU A 126 7.931 -3.096 3.763 1.00 10.00 H new ATOM 0 HD22 LEU A 126 8.575 -1.461 3.482 1.00 10.00 H new ATOM 0 HD23 LEU A 126 8.907 -2.297 5.018 1.00 10.00 H new ATOM 1603 N LEU A 127 9.743 1.044 7.489 1.00 10.00 N ATOM 1604 CA LEU A 127 10.428 2.254 7.896 1.00 10.00 C ATOM 1605 C LEU A 127 11.336 2.771 6.800 1.00 10.00 C ATOM 1606 O LEU A 127 12.209 2.056 6.305 1.00 10.00 O ATOM 1607 CB LEU A 127 11.237 2.010 9.170 1.00 10.00 C ATOM 1608 CG LEU A 127 10.426 2.062 10.462 1.00 10.00 C ATOM 1609 CD1 LEU A 127 10.374 0.694 11.121 1.00 10.00 C ATOM 1610 CD2 LEU A 127 11.008 3.098 11.408 1.00 10.00 C ATOM 0 H LEU A 127 10.345 0.228 7.384 1.00 10.00 H new ATOM 0 HA LEU A 127 9.669 3.010 8.094 1.00 10.00 H new ATOM 0 HB2 LEU A 127 11.717 1.034 9.098 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.033 2.753 9.227 1.00 10.00 H new ATOM 0 HG LEU A 127 9.405 2.355 10.218 1.00 10.00 H new ATOM 0 HD11 LEU A 127 9.791 0.755 12.040 1.00 10.00 H new ATOM 0 HD12 LEU A 127 9.907 -0.020 10.442 1.00 10.00 H new ATOM 0 HD13 LEU A 127 11.386 0.364 11.355 1.00 10.00 H new ATOM 0 HD21 LEU A 127 10.420 3.124 12.325 1.00 10.00 H new ATOM 0 HD22 LEU A 127 12.039 2.835 11.645 1.00 10.00 H new ATOM 0 HD23 LEU A 127 10.984 4.079 10.933 1.00 10.00 H new ATOM 1622 N VAL A 128 11.113 4.011 6.421 1.00 10.00 N ATOM 1623 CA VAL A 128 11.914 4.647 5.398 1.00 10.00 C ATOM 1624 C VAL A 128 12.918 5.579 6.056 1.00 10.00 C ATOM 1625 O VAL A 128 12.536 6.512 6.761 1.00 10.00 O ATOM 1626 CB VAL A 128 11.041 5.451 4.417 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.796 5.723 3.127 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.736 4.727 4.134 1.00 10.00 C ATOM 0 H VAL A 128 10.378 4.602 6.809 1.00 10.00 H new ATOM 0 HA VAL A 128 12.429 3.868 4.835 1.00 10.00 H new ATOM 0 HB VAL A 128 10.802 6.408 4.882 1.00 10.00 H new ATOM 0 HG11 VAL A 128 11.162 6.292 2.447 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.697 6.295 3.347 1.00 10.00 H new ATOM 0 HG13 VAL A 128 12.071 4.777 2.660 1.00 10.00 H new ATOM 0 HG21 VAL A 128 9.137 5.315 3.439 1.00 10.00 H new ATOM 0 HG22 VAL A 128 9.949 3.752 3.695 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.185 4.594 5.065 1.00 10.00 H new ATOM 1638 N GLN A 129 14.193 5.329 5.816 1.00 10.00 N ATOM 1639 CA GLN A 129 15.253 6.133 6.399 1.00 10.00 C ATOM 1640 C GLN A 129 16.228 6.574 5.320 1.00 10.00 C ATOM 1641 O GLN A 129 16.634 5.771 4.478 1.00 10.00 O ATOM 1642 CB GLN A 129 15.992 5.335 7.477 1.00 10.00 C ATOM 1643 CG GLN A 129 15.077 4.773 8.553 1.00 10.00 C ATOM 1644 CD GLN A 129 15.810 3.901 9.553 1.00 10.00 C ATOM 1645 OE1 GLN A 129 16.981 4.127 9.859 1.00 10.00 O ATOM 1646 NE2 GLN A 129 15.127 2.888 10.068 1.00 10.00 N ATOM 0 H GLN A 129 14.521 4.571 5.218 1.00 10.00 H new ATOM 0 HA GLN A 129 14.809 7.016 6.858 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.530 4.514 7.004 1.00 10.00 H new ATOM 0 HB3 GLN A 129 16.738 5.977 7.945 1.00 10.00 H new ATOM 0 HG2 GLN A 129 14.596 5.597 9.081 1.00 10.00 H new ATOM 0 HG3 GLN A 129 14.285 4.190 8.082 1.00 10.00 H new ATOM 0 HE21 GLN A 129 14.158 2.733 9.790 1.00 10.00 H new ATOM 0 HE22 GLN A 129 15.571 2.264 10.742 1.00 10.00 H new ATOM 1655 N PRO A 130 16.596 7.856 5.310 1.00 10.00 N ATOM 1656 CA PRO A 130 17.532 8.385 4.328 1.00 10.00 C ATOM 1657 C PRO A 130 18.977 8.056 4.682 1.00 10.00 C ATOM 1658 O PRO A 130 19.412 8.244 5.822 1.00 10.00 O ATOM 1659 CB PRO A 130 17.293 9.889 4.391 1.00 10.00 C ATOM 1660 CG PRO A 130 16.843 10.141 5.791 1.00 10.00 C ATOM 1661 CD PRO A 130 16.124 8.895 6.243 1.00 10.00 C ATOM 0 HA PRO A 130 17.376 7.959 3.337 1.00 10.00 H new ATOM 0 HB2 PRO A 130 18.202 10.445 4.161 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.538 10.201 3.670 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.693 10.354 6.439 1.00 10.00 H new ATOM 0 HG3 PRO A 130 16.183 11.007 5.836 1.00 10.00 H new ATOM 0 HD2 PRO A 130 16.368 8.645 7.276 1.00 10.00 H new ATOM 0 HD3 PRO A 130 15.042 9.017 6.191 1.00 10.00 H new ATOM 1669 N VAL A 131 19.714 7.560 3.709 1.00 10.00 N ATOM 1670 CA VAL A 131 21.107 7.208 3.922 1.00 10.00 C ATOM 1671 C VAL A 131 22.017 8.317 3.397 1.00 10.00 C ATOM 1672 O VAL A 131 21.743 8.901 2.347 1.00 10.00 O ATOM 1673 CB VAL A 131 21.485 5.870 3.252 1.00 10.00 C ATOM 1674 CG1 VAL A 131 20.939 4.700 4.049 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.987 5.815 1.819 1.00 10.00 C ATOM 0 H VAL A 131 19.374 7.391 2.762 1.00 10.00 H new ATOM 0 HA VAL A 131 21.245 7.090 4.997 1.00 10.00 H new ATOM 0 HB VAL A 131 22.573 5.801 3.234 1.00 10.00 H new ATOM 0 HG11 VAL A 131 21.216 3.766 3.560 1.00 10.00 H new ATOM 0 HG12 VAL A 131 21.355 4.720 5.056 1.00 10.00 H new ATOM 0 HG13 VAL A 131 19.853 4.772 4.104 1.00 10.00 H new ATOM 0 HG21 VAL A 131 21.268 4.861 1.373 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.902 5.916 1.807 1.00 10.00 H new ATOM 0 HG23 VAL A 131 21.433 6.629 1.247 1.00 10.00 H new