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 75 SER OG : rot -80:sc= 1.24 USER MOD Set 1.2: A 77 MET CE :methyl -172:sc= -2.08 (180deg=-2.32) USER MOD Set 2.1: A 63 THR OG1 : rot 17:sc= 0.331 USER MOD Set 2.2: A 66 THR OG1 : rot 96:sc= 0.873 USER MOD Set 3.1: A 56 GLN : amide:sc= 0.527 K(o=-0.79,f=-1.3) USER MOD Set 3.2: A 97 SER OG : rot 180:sc= -1.32 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= -0.88 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.00378 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -169:sc= 1.12 (180deg=1.08) USER MOD Single : A 67 MET CE :methyl -147:sc= -0.452 (180deg=-1.6!) USER MOD Single : A 76 ASN : amide:sc= -0.341 K(o=-0.34,f=-1.2) USER MOD Single : A 78 GLN : amide:sc= -0.841 K(o=-0.84,f=-0.13) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot -146:sc= -1.15! USER MOD Single : A 82 ASN : amide:sc= -0.0786 K(o=-0.079,f=-1.1) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 30:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.00909 USER MOD Single : A 94 SER OG : rot 180:sc= 0.0684 USER MOD Single : A 98 THR OG1 : rot 130:sc= 0.0208 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0527 USER MOD Single : A 100 SER OG : rot 180:sc= 0.268 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 103 GLN : amide:sc= -0.0534 K(o=-0.053,f=-2.8!) USER MOD Single : A 106 THR OG1 : rot 77:sc= 1.26 USER MOD Single : A 109 SER OG : rot 87:sc= 1.95 USER MOD Single : A 112 TYR OH : rot -130:sc= -0.134 USER MOD Single : A 115 GLN : amide:sc= -0.161 K(o=-0.16,f=-3.3) USER MOD Single : A 118 SER OG : rot -160:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= -0.0218 USER MOD Single : A 124 ASN : amide:sc=-0.00337 K(o=-0.0034,f=-0.77) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 510 N TYR A 53 0.539 -10.928 -1.262 1.00 10.00 N ATOM 511 CA TYR A 53 0.433 -9.747 -2.100 1.00 10.00 C ATOM 512 C TYR A 53 1.738 -9.478 -2.834 1.00 10.00 C ATOM 513 O TYR A 53 2.814 -9.498 -2.236 1.00 10.00 O ATOM 514 CB TYR A 53 0.052 -8.539 -1.241 1.00 10.00 C ATOM 515 CG TYR A 53 -0.146 -7.252 -2.007 1.00 10.00 C ATOM 516 CD1 TYR A 53 -0.850 -7.224 -3.206 1.00 10.00 C ATOM 517 CD2 TYR A 53 0.363 -6.056 -1.520 1.00 10.00 C ATOM 518 CE1 TYR A 53 -1.036 -6.042 -3.895 1.00 10.00 C ATOM 519 CE2 TYR A 53 0.178 -4.872 -2.202 1.00 10.00 C ATOM 520 CZ TYR A 53 -0.520 -4.870 -3.388 1.00 10.00 C ATOM 521 OH TYR A 53 -0.699 -3.690 -4.072 1.00 10.00 O ATOM 0 HA TYR A 53 -0.343 -9.921 -2.846 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -0.867 -8.770 -0.703 1.00 10.00 H new ATOM 0 HB3 TYR A 53 0.829 -8.384 -0.493 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.258 -8.141 -3.604 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.913 -6.053 -0.591 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -1.583 -6.037 -4.826 1.00 10.00 H new ATOM 0 HE2 TYR A 53 0.579 -3.950 -1.807 1.00 10.00 H new ATOM 0 HH TYR A 53 -0.274 -2.958 -3.578 1.00 10.00 H new ATOM 531 N THR A 54 1.637 -9.243 -4.132 1.00 10.00 N ATOM 532 CA THR A 54 2.803 -8.952 -4.938 1.00 10.00 C ATOM 533 C THR A 54 3.185 -7.491 -4.782 1.00 10.00 C ATOM 534 O THR A 54 2.508 -6.596 -5.296 1.00 10.00 O ATOM 535 CB THR A 54 2.560 -9.248 -6.425 1.00 10.00 C ATOM 536 OG1 THR A 54 1.864 -10.497 -6.570 1.00 10.00 O ATOM 537 CG2 THR A 54 3.880 -9.294 -7.191 1.00 10.00 C ATOM 0 H THR A 54 0.757 -9.249 -4.647 1.00 10.00 H new ATOM 0 HA THR A 54 3.610 -9.596 -4.588 1.00 10.00 H new ATOM 0 HB THR A 54 1.949 -8.446 -6.840 1.00 10.00 H new ATOM 0 HG1 THR A 54 1.711 -10.678 -7.521 1.00 10.00 H new ATOM 0 HG21 THR A 54 3.684 -9.505 -8.242 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.386 -8.333 -7.102 1.00 10.00 H new ATOM 0 HG23 THR A 54 4.514 -10.077 -6.776 1.00 10.00 H new ATOM 545 N TYR A 55 4.255 -7.259 -4.055 1.00 10.00 N ATOM 546 CA TYR A 55 4.741 -5.916 -3.818 1.00 10.00 C ATOM 547 C TYR A 55 5.474 -5.423 -5.055 1.00 10.00 C ATOM 548 O TYR A 55 6.623 -5.790 -5.307 1.00 10.00 O ATOM 549 CB TYR A 55 5.646 -5.891 -2.585 1.00 10.00 C ATOM 550 CG TYR A 55 4.961 -6.426 -1.345 1.00 10.00 C ATOM 551 CD1 TYR A 55 4.000 -5.676 -0.679 1.00 10.00 C ATOM 552 CD2 TYR A 55 5.261 -7.690 -0.851 1.00 10.00 C ATOM 553 CE1 TYR A 55 3.360 -6.170 0.444 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.621 -8.191 0.266 1.00 10.00 C ATOM 555 CZ TYR A 55 3.674 -7.427 0.910 1.00 10.00 C ATOM 556 OH TYR A 55 3.028 -7.926 2.019 1.00 10.00 O ATOM 0 H TYR A 55 4.811 -7.991 -3.613 1.00 10.00 H new ATOM 0 HA TYR A 55 3.902 -5.249 -3.623 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.540 -6.481 -2.784 1.00 10.00 H new ATOM 0 HB3 TYR A 55 5.974 -4.868 -2.401 1.00 10.00 H new ATOM 0 HD1 TYR A 55 3.748 -4.691 -1.044 1.00 10.00 H new ATOM 0 HD2 TYR A 55 6.007 -8.291 -1.349 1.00 10.00 H new ATOM 0 HE1 TYR A 55 2.618 -5.573 0.952 1.00 10.00 H new ATOM 0 HE2 TYR A 55 4.863 -9.178 0.632 1.00 10.00 H new ATOM 0 HH TYR A 55 3.364 -8.825 2.216 1.00 10.00 H new ATOM 566 N GLN A 56 4.773 -4.619 -5.836 1.00 10.00 N ATOM 567 CA GLN A 56 5.301 -4.074 -7.073 1.00 10.00 C ATOM 568 C GLN A 56 4.835 -2.639 -7.256 1.00 10.00 C ATOM 569 O GLN A 56 3.700 -2.301 -6.909 1.00 10.00 O ATOM 570 CB GLN A 56 4.819 -4.917 -8.257 1.00 10.00 C ATOM 571 CG GLN A 56 5.469 -4.555 -9.582 1.00 10.00 C ATOM 572 CD GLN A 56 4.509 -4.661 -10.749 1.00 10.00 C ATOM 573 OE1 GLN A 56 4.291 -5.745 -11.289 1.00 10.00 O ATOM 574 NE2 GLN A 56 3.940 -3.536 -11.152 1.00 10.00 N ATOM 0 H GLN A 56 3.818 -4.325 -5.628 1.00 10.00 H new ATOM 0 HA GLN A 56 6.390 -4.094 -7.027 1.00 10.00 H new ATOM 0 HB2 GLN A 56 5.014 -5.968 -8.044 1.00 10.00 H new ATOM 0 HB3 GLN A 56 3.739 -4.806 -8.352 1.00 10.00 H new ATOM 0 HG2 GLN A 56 5.857 -3.538 -9.526 1.00 10.00 H new ATOM 0 HG3 GLN A 56 6.321 -5.212 -9.756 1.00 10.00 H new ATOM 0 HE21 GLN A 56 4.150 -2.659 -10.675 1.00 10.00 H new ATOM 0 HE22 GLN A 56 3.292 -3.546 -11.940 1.00 10.00 H new ATOM 583 N ALA A 57 5.710 -1.797 -7.784 1.00 10.00 N ATOM 584 CA ALA A 57 5.358 -0.412 -8.036 1.00 10.00 C ATOM 585 C ALA A 57 4.460 -0.341 -9.256 1.00 10.00 C ATOM 586 O ALA A 57 4.825 -0.807 -10.337 1.00 10.00 O ATOM 587 CB ALA A 57 6.598 0.441 -8.233 1.00 10.00 C ATOM 0 H ALA A 57 6.664 -2.048 -8.044 1.00 10.00 H new ATOM 0 HA ALA A 57 4.826 -0.018 -7.170 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.303 1.474 -8.420 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.216 0.397 -7.336 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.166 0.066 -9.084 1.00 10.00 H new ATOM 593 N THR A 58 3.277 0.212 -9.081 1.00 10.00 N ATOM 594 CA THR A 58 2.333 0.320 -10.169 1.00 10.00 C ATOM 595 C THR A 58 2.452 1.675 -10.853 1.00 10.00 C ATOM 596 O THR A 58 2.660 2.698 -10.194 1.00 10.00 O ATOM 597 CB THR A 58 0.891 0.109 -9.668 1.00 10.00 C ATOM 598 OG1 THR A 58 0.646 0.924 -8.516 1.00 10.00 O ATOM 599 CG2 THR A 58 0.649 -1.354 -9.314 1.00 10.00 C ATOM 0 H THR A 58 2.948 0.593 -8.194 1.00 10.00 H new ATOM 0 HA THR A 58 2.568 -0.460 -10.893 1.00 10.00 H new ATOM 0 HB THR A 58 0.209 0.395 -10.469 1.00 10.00 H new ATOM 0 HG1 THR A 58 -0.273 0.784 -8.206 1.00 10.00 H new ATOM 0 HG21 THR A 58 -0.375 -1.479 -8.963 1.00 10.00 H new ATOM 0 HG22 THR A 58 0.808 -1.973 -10.197 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.341 -1.658 -8.529 1.00 10.00 H new ATOM 607 N PRO A 59 2.329 1.706 -12.188 1.00 10.00 N ATOM 608 CA PRO A 59 2.420 2.947 -12.961 1.00 10.00 C ATOM 609 C PRO A 59 1.214 3.853 -12.736 1.00 10.00 C ATOM 610 O PRO A 59 1.115 4.930 -13.319 1.00 10.00 O ATOM 611 CB PRO A 59 2.472 2.463 -14.412 1.00 10.00 C ATOM 612 CG PRO A 59 1.801 1.137 -14.394 1.00 10.00 C ATOM 613 CD PRO A 59 2.106 0.530 -13.051 1.00 10.00 C ATOM 0 HA PRO A 59 3.283 3.547 -12.673 1.00 10.00 H new ATOM 0 HB2 PRO A 59 1.960 3.157 -15.079 1.00 10.00 H new ATOM 0 HB3 PRO A 59 3.500 2.381 -14.765 1.00 10.00 H new ATOM 0 HG2 PRO A 59 0.726 1.243 -14.538 1.00 10.00 H new ATOM 0 HG3 PRO A 59 2.170 0.503 -15.200 1.00 10.00 H new ATOM 0 HD2 PRO A 59 1.280 -0.083 -12.690 1.00 10.00 H new ATOM 0 HD3 PRO A 59 2.986 -0.112 -13.091 1.00 10.00 H new ATOM 621 N MET A 60 0.299 3.403 -11.889 1.00 10.00 N ATOM 622 CA MET A 60 -0.894 4.169 -11.577 1.00 10.00 C ATOM 623 C MET A 60 -0.783 4.801 -10.197 1.00 10.00 C ATOM 624 O MET A 60 -1.646 5.583 -9.799 1.00 10.00 O ATOM 625 CB MET A 60 -2.140 3.281 -11.629 1.00 10.00 C ATOM 626 CG MET A 60 -2.434 2.703 -13.003 1.00 10.00 C ATOM 627 SD MET A 60 -3.920 1.681 -13.015 1.00 10.00 S ATOM 628 CE MET A 60 -4.087 1.349 -14.767 1.00 10.00 C ATOM 0 H MET A 60 0.363 2.507 -11.405 1.00 10.00 H new ATOM 0 HA MET A 60 -0.986 4.956 -12.325 1.00 10.00 H new ATOM 0 HB2 MET A 60 -2.019 2.462 -10.921 1.00 10.00 H new ATOM 0 HB3 MET A 60 -3.001 3.862 -11.300 1.00 10.00 H new ATOM 0 HG2 MET A 60 -2.550 3.516 -13.719 1.00 10.00 H new ATOM 0 HG3 MET A 60 -1.583 2.107 -13.333 1.00 10.00 H new ATOM 0 HE1 MET A 60 -4.965 0.725 -14.937 1.00 10.00 H new ATOM 0 HE2 MET A 60 -4.200 2.289 -15.306 1.00 10.00 H new ATOM 0 HE3 MET A 60 -3.198 0.830 -15.125 1.00 10.00 H new ATOM 638 N ASP A 61 0.276 4.462 -9.470 1.00 10.00 N ATOM 639 CA ASP A 61 0.475 5.005 -8.136 1.00 10.00 C ATOM 640 C ASP A 61 0.879 6.467 -8.203 1.00 10.00 C ATOM 641 O ASP A 61 0.103 7.355 -7.839 1.00 10.00 O ATOM 642 CB ASP A 61 1.538 4.228 -7.373 1.00 10.00 C ATOM 643 CG ASP A 61 1.474 4.543 -5.903 1.00 10.00 C ATOM 644 OD1 ASP A 61 2.010 5.592 -5.496 1.00 10.00 O ATOM 645 OD2 ASP A 61 0.839 3.761 -5.160 1.00 10.00 O ATOM 0 H ASP A 61 1.004 3.818 -9.781 1.00 10.00 H new ATOM 0 HA ASP A 61 -0.474 4.915 -7.608 1.00 10.00 H new ATOM 0 HB2 ASP A 61 1.395 3.159 -7.527 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.526 4.477 -7.761 1.00 10.00 H new ATOM 650 N GLY A 62 2.088 6.712 -8.682 1.00 10.00 N ATOM 651 CA GLY A 62 2.573 8.069 -8.789 1.00 10.00 C ATOM 652 C GLY A 62 3.734 8.386 -7.860 1.00 10.00 C ATOM 653 O GLY A 62 4.699 9.017 -8.285 1.00 10.00 O ATOM 0 H GLY A 62 2.741 5.995 -8.998 1.00 10.00 H new ATOM 0 HA2 GLY A 62 2.883 8.253 -9.818 1.00 10.00 H new ATOM 0 HA3 GLY A 62 1.753 8.755 -8.576 1.00 10.00 H new ATOM 657 N THR A 63 3.686 7.934 -6.605 1.00 10.00 N ATOM 658 CA THR A 63 4.758 8.269 -5.670 1.00 10.00 C ATOM 659 C THR A 63 5.226 7.088 -4.827 1.00 10.00 C ATOM 660 O THR A 63 4.604 6.033 -4.798 1.00 10.00 O ATOM 661 CB THR A 63 4.332 9.399 -4.710 1.00 10.00 C ATOM 662 OG1 THR A 63 3.187 8.991 -3.959 1.00 10.00 O ATOM 663 CG2 THR A 63 4.011 10.680 -5.462 1.00 10.00 C ATOM 0 H THR A 63 2.940 7.353 -6.222 1.00 10.00 H new ATOM 0 HA THR A 63 5.587 8.589 -6.301 1.00 10.00 H new ATOM 0 HB THR A 63 5.168 9.598 -4.039 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.093 8.017 -4.009 1.00 10.00 H new ATOM 0 HG21 THR A 63 3.715 11.453 -4.753 1.00 10.00 H new ATOM 0 HG22 THR A 63 4.893 11.010 -6.012 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.195 10.497 -6.161 1.00 10.00 H new ATOM 671 N LEU A 64 6.346 7.294 -4.143 1.00 10.00 N ATOM 672 CA LEU A 64 6.930 6.284 -3.275 1.00 10.00 C ATOM 673 C LEU A 64 6.069 6.061 -2.033 1.00 10.00 C ATOM 674 O LEU A 64 5.760 4.924 -1.674 1.00 10.00 O ATOM 675 CB LEU A 64 8.341 6.714 -2.861 1.00 10.00 C ATOM 676 CG LEU A 64 9.032 5.814 -1.835 1.00 10.00 C ATOM 677 CD1 LEU A 64 9.250 4.422 -2.403 1.00 10.00 C ATOM 678 CD2 LEU A 64 10.352 6.428 -1.390 1.00 10.00 C ATOM 0 H LEU A 64 6.873 8.167 -4.176 1.00 10.00 H new ATOM 0 HA LEU A 64 6.980 5.345 -3.826 1.00 10.00 H new ATOM 0 HB2 LEU A 64 8.964 6.761 -3.754 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.289 7.724 -2.455 1.00 10.00 H new ATOM 0 HG LEU A 64 8.384 5.727 -0.963 1.00 10.00 H new ATOM 0 HD11 LEU A 64 9.743 3.798 -1.657 1.00 10.00 H new ATOM 0 HD12 LEU A 64 8.288 3.982 -2.667 1.00 10.00 H new ATOM 0 HD13 LEU A 64 9.876 4.486 -3.293 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.830 5.774 -0.660 1.00 10.00 H new ATOM 0 HD22 LEU A 64 11.007 6.548 -2.253 1.00 10.00 H new ATOM 0 HD23 LEU A 64 10.166 7.402 -0.938 1.00 10.00 H new ATOM 690 N LYS A 65 5.683 7.162 -1.389 1.00 10.00 N ATOM 691 CA LYS A 65 4.876 7.107 -0.174 1.00 10.00 C ATOM 692 C LYS A 65 3.558 6.379 -0.417 1.00 10.00 C ATOM 693 O LYS A 65 3.214 5.462 0.325 1.00 10.00 O ATOM 694 CB LYS A 65 4.627 8.525 0.351 1.00 10.00 C ATOM 695 CG LYS A 65 3.767 8.595 1.606 1.00 10.00 C ATOM 696 CD LYS A 65 4.309 7.726 2.731 1.00 10.00 C ATOM 697 CE LYS A 65 3.841 8.215 4.095 1.00 10.00 C ATOM 698 NZ LYS A 65 2.360 8.222 4.226 1.00 10.00 N ATOM 0 H LYS A 65 5.919 8.107 -1.692 1.00 10.00 H new ATOM 0 HA LYS A 65 5.426 6.543 0.580 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.588 8.995 0.558 1.00 10.00 H new ATOM 0 HB3 LYS A 65 4.149 9.110 -0.434 1.00 10.00 H new ATOM 0 HG2 LYS A 65 3.708 9.629 1.946 1.00 10.00 H new ATOM 0 HG3 LYS A 65 2.751 8.281 1.365 1.00 10.00 H new ATOM 0 HD2 LYS A 65 3.986 6.696 2.583 1.00 10.00 H new ATOM 0 HD3 LYS A 65 5.399 7.726 2.698 1.00 10.00 H new ATOM 0 HE2 LYS A 65 4.267 7.578 4.870 1.00 10.00 H new ATOM 0 HE3 LYS A 65 4.221 9.222 4.265 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 2.090 8.732 5.091 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 1.941 8.695 3.400 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 2.012 7.244 4.279 1.00 10.00 H new ATOM 712 N THR A 66 2.839 6.768 -1.462 1.00 10.00 N ATOM 713 CA THR A 66 1.572 6.138 -1.790 1.00 10.00 C ATOM 714 C THR A 66 1.762 4.644 -2.077 1.00 10.00 C ATOM 715 O THR A 66 0.958 3.812 -1.646 1.00 10.00 O ATOM 716 CB THR A 66 0.927 6.835 -3.000 1.00 10.00 C ATOM 717 OG1 THR A 66 0.772 8.236 -2.725 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.426 6.235 -3.318 1.00 10.00 C ATOM 0 H THR A 66 3.114 7.518 -2.096 1.00 10.00 H new ATOM 0 HA THR A 66 0.909 6.239 -0.931 1.00 10.00 H new ATOM 0 HB THR A 66 1.580 6.694 -3.861 1.00 10.00 H new ATOM 0 HG1 THR A 66 1.534 8.728 -3.096 1.00 10.00 H new ATOM 0 HG21 THR A 66 -0.858 6.747 -4.178 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.309 5.176 -3.548 1.00 10.00 H new ATOM 0 HG23 THR A 66 -1.086 6.349 -2.458 1.00 10.00 H new ATOM 726 N MET A 67 2.837 4.312 -2.787 1.00 10.00 N ATOM 727 CA MET A 67 3.148 2.925 -3.111 1.00 10.00 C ATOM 728 C MET A 67 3.372 2.124 -1.835 1.00 10.00 C ATOM 729 O MET A 67 2.813 1.040 -1.661 1.00 10.00 O ATOM 730 CB MET A 67 4.395 2.855 -3.993 1.00 10.00 C ATOM 731 CG MET A 67 4.794 1.440 -4.383 1.00 10.00 C ATOM 732 SD MET A 67 6.462 1.348 -5.063 1.00 10.00 S ATOM 733 CE MET A 67 7.447 1.498 -3.577 1.00 10.00 C ATOM 0 H MET A 67 3.509 4.988 -3.150 1.00 10.00 H new ATOM 0 HA MET A 67 2.305 2.498 -3.654 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.221 3.436 -4.899 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.227 3.325 -3.468 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.727 0.794 -3.508 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.085 1.057 -5.117 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.373 2.026 -3.806 1.00 10.00 H new ATOM 0 HE2 MET A 67 6.888 2.055 -2.825 1.00 10.00 H new ATOM 0 HE3 MET A 67 7.681 0.505 -3.194 1.00 10.00 H new ATOM 743 N LEU A 68 4.184 2.675 -0.941 1.00 10.00 N ATOM 744 CA LEU A 68 4.483 2.025 0.328 1.00 10.00 C ATOM 745 C LEU A 68 3.222 1.901 1.174 1.00 10.00 C ATOM 746 O LEU A 68 3.020 0.898 1.858 1.00 10.00 O ATOM 747 CB LEU A 68 5.561 2.800 1.085 1.00 10.00 C ATOM 748 CG LEU A 68 6.958 2.741 0.463 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.868 3.775 1.100 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.552 1.348 0.616 1.00 10.00 C ATOM 0 H LEU A 68 4.648 3.574 -1.073 1.00 10.00 H new ATOM 0 HA LEU A 68 4.859 1.023 0.122 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.255 3.844 1.155 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.617 2.415 2.103 1.00 10.00 H new ATOM 0 HG LEU A 68 6.870 2.965 -0.600 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.857 3.719 0.645 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.453 4.771 0.944 1.00 10.00 H new ATOM 0 HD13 LEU A 68 7.948 3.579 2.169 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.545 1.325 0.168 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.625 1.098 1.674 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.911 0.622 0.115 1.00 10.00 H new ATOM 762 N GLU A 69 2.377 2.924 1.113 1.00 10.00 N ATOM 763 CA GLU A 69 1.117 2.928 1.844 1.00 10.00 C ATOM 764 C GLU A 69 0.241 1.785 1.355 1.00 10.00 C ATOM 765 O GLU A 69 -0.359 1.065 2.148 1.00 10.00 O ATOM 766 CB GLU A 69 0.383 4.254 1.644 1.00 10.00 C ATOM 767 CG GLU A 69 0.920 5.392 2.496 1.00 10.00 C ATOM 768 CD GLU A 69 0.421 5.345 3.926 1.00 10.00 C ATOM 769 OE1 GLU A 69 -0.616 4.698 4.183 1.00 10.00 O ATOM 770 OE2 GLU A 69 1.057 5.973 4.797 1.00 10.00 O ATOM 0 H GLU A 69 2.544 3.765 0.561 1.00 10.00 H new ATOM 0 HA GLU A 69 1.330 2.802 2.906 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.447 4.538 0.594 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.673 4.111 1.871 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.009 5.357 2.495 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.632 6.342 2.047 1.00 10.00 H new ATOM 777 N ARG A 70 0.193 1.623 0.037 1.00 10.00 N ATOM 778 CA ARG A 70 -0.593 0.567 -0.586 1.00 10.00 C ATOM 779 C ARG A 70 -0.088 -0.800 -0.146 1.00 10.00 C ATOM 780 O ARG A 70 -0.871 -1.692 0.179 1.00 10.00 O ATOM 781 CB ARG A 70 -0.509 0.672 -2.109 1.00 10.00 C ATOM 782 CG ARG A 70 -1.842 0.467 -2.807 1.00 10.00 C ATOM 783 CD ARG A 70 -2.598 1.777 -2.944 1.00 10.00 C ATOM 784 NE ARG A 70 -1.904 2.718 -3.820 1.00 10.00 N ATOM 785 CZ ARG A 70 -2.518 3.618 -4.584 1.00 10.00 C ATOM 786 NH1 ARG A 70 -3.836 3.764 -4.529 1.00 10.00 N ATOM 787 NH2 ARG A 70 -1.806 4.386 -5.390 1.00 10.00 N ATOM 0 H ARG A 70 0.694 2.216 -0.624 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.631 0.684 -0.273 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -0.116 1.653 -2.376 1.00 10.00 H new ATOM 0 HB3 ARG A 70 0.202 -0.068 -2.477 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -1.676 0.035 -3.794 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -2.444 -0.246 -2.244 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -3.595 1.581 -3.339 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -2.728 2.226 -1.959 1.00 10.00 H new ATOM 0 HE ARG A 70 -0.885 2.683 -3.848 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -4.387 3.184 -3.897 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -4.297 4.457 -5.119 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -0.791 4.287 -5.424 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -2.271 5.078 -5.978 1.00 10.00 H new ATOM 801 N TRP A 71 1.230 -0.945 -0.137 1.00 10.00 N ATOM 802 CA TRP A 71 1.866 -2.192 0.256 1.00 10.00 C ATOM 803 C TRP A 71 1.576 -2.519 1.718 1.00 10.00 C ATOM 804 O TRP A 71 1.135 -3.626 2.039 1.00 10.00 O ATOM 805 CB TRP A 71 3.377 -2.110 0.038 1.00 10.00 C ATOM 806 CG TRP A 71 3.798 -2.105 -1.403 1.00 10.00 C ATOM 807 CD1 TRP A 71 2.994 -2.040 -2.510 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.141 -2.172 -1.888 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.762 -2.054 -3.649 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.083 -2.139 -3.293 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.389 -2.260 -1.266 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.226 -2.185 -4.085 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.523 -2.307 -2.055 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.434 -2.271 -3.451 1.00 10.00 C ATOM 0 H TRP A 71 1.883 -0.207 -0.400 1.00 10.00 H new ATOM 0 HA TRP A 71 1.454 -2.987 -0.366 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.752 -1.205 0.516 1.00 10.00 H new ATOM 0 HB3 TRP A 71 3.850 -2.955 0.539 1.00 10.00 H new ATOM 0 HD1 TRP A 71 1.916 -1.986 -2.490 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.407 -2.009 -4.604 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.466 -2.291 -0.189 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.161 -2.154 -5.163 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.494 -2.373 -1.586 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.338 -2.312 -4.040 1.00 10.00 H new ATOM 825 N ALA A 72 1.812 -1.548 2.596 1.00 10.00 N ATOM 826 CA ALA A 72 1.587 -1.732 4.025 1.00 10.00 C ATOM 827 C ALA A 72 0.117 -1.986 4.332 1.00 10.00 C ATOM 828 O ALA A 72 -0.216 -2.922 5.056 1.00 10.00 O ATOM 829 CB ALA A 72 2.085 -0.523 4.800 1.00 10.00 C ATOM 0 H ALA A 72 2.160 -0.624 2.341 1.00 10.00 H new ATOM 0 HA ALA A 72 2.150 -2.611 4.338 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.910 -0.676 5.865 1.00 10.00 H new ATOM 0 HB2 ALA A 72 3.153 -0.392 4.623 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.550 0.367 4.469 1.00 10.00 H new ATOM 835 N ALA A 73 -0.762 -1.165 3.768 1.00 10.00 N ATOM 836 CA ALA A 73 -2.196 -1.305 4.000 1.00 10.00 C ATOM 837 C ALA A 73 -2.700 -2.675 3.561 1.00 10.00 C ATOM 838 O ALA A 73 -3.499 -3.303 4.256 1.00 10.00 O ATOM 839 CB ALA A 73 -2.964 -0.207 3.279 1.00 10.00 C ATOM 0 H ALA A 73 -0.508 -0.396 3.148 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.367 -1.210 5.072 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -4.031 -0.328 3.464 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.640 0.766 3.648 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.772 -0.271 2.208 1.00 10.00 H new ATOM 845 N ASP A 74 -2.212 -3.144 2.418 1.00 10.00 N ATOM 846 CA ASP A 74 -2.625 -4.439 1.885 1.00 10.00 C ATOM 847 C ASP A 74 -2.188 -5.580 2.797 1.00 10.00 C ATOM 848 O ASP A 74 -2.917 -6.550 2.989 1.00 10.00 O ATOM 849 CB ASP A 74 -2.049 -4.653 0.487 1.00 10.00 C ATOM 850 CG ASP A 74 -2.825 -5.685 -0.308 1.00 10.00 C ATOM 851 OD1 ASP A 74 -2.749 -6.889 0.021 1.00 10.00 O ATOM 852 OD2 ASP A 74 -3.516 -5.295 -1.275 1.00 10.00 O ATOM 0 H ASP A 74 -1.531 -2.648 1.843 1.00 10.00 H new ATOM 0 HA ASP A 74 -3.714 -4.437 1.830 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -2.052 -3.706 -0.053 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -1.009 -4.970 0.570 1.00 10.00 H new ATOM 857 N SER A 75 -1.006 -5.451 3.375 1.00 10.00 N ATOM 858 CA SER A 75 -0.476 -6.484 4.251 1.00 10.00 C ATOM 859 C SER A 75 -0.863 -6.240 5.708 1.00 10.00 C ATOM 860 O SER A 75 -0.411 -6.957 6.604 1.00 10.00 O ATOM 861 CB SER A 75 1.042 -6.551 4.109 1.00 10.00 C ATOM 862 OG SER A 75 1.614 -5.252 4.117 1.00 10.00 O ATOM 0 H SER A 75 -0.395 -4.643 3.254 1.00 10.00 H new ATOM 0 HA SER A 75 -0.911 -7.438 3.952 1.00 10.00 H new ATOM 0 HB2 SER A 75 1.461 -7.141 4.924 1.00 10.00 H new ATOM 0 HB3 SER A 75 1.301 -7.060 3.181 1.00 10.00 H new ATOM 0 HG SER A 75 1.521 -4.848 3.229 1.00 10.00 H new ATOM 868 N ASN A 76 -1.697 -5.221 5.930 1.00 10.00 N ATOM 869 CA ASN A 76 -2.161 -4.860 7.271 1.00 10.00 C ATOM 870 C ASN A 76 -0.972 -4.489 8.160 1.00 10.00 C ATOM 871 O ASN A 76 -0.978 -4.709 9.370 1.00 10.00 O ATOM 872 CB ASN A 76 -2.972 -6.012 7.887 1.00 10.00 C ATOM 873 CG ASN A 76 -3.700 -5.620 9.162 1.00 10.00 C ATOM 874 OD1 ASN A 76 -4.027 -4.450 9.378 1.00 10.00 O ATOM 875 ND2 ASN A 76 -3.957 -6.597 10.017 1.00 10.00 N ATOM 0 H ASN A 76 -2.068 -4.626 5.189 1.00 10.00 H new ATOM 0 HA ASN A 76 -2.814 -3.991 7.195 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -3.699 -6.367 7.156 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -2.302 -6.845 8.101 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -4.442 -6.395 10.891 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -3.670 -7.552 9.802 1.00 10.00 H new ATOM 882 N MET A 77 0.044 -3.909 7.544 1.00 10.00 N ATOM 883 CA MET A 77 1.250 -3.509 8.249 1.00 10.00 C ATOM 884 C MET A 77 1.303 -1.993 8.394 1.00 10.00 C ATOM 885 O MET A 77 0.517 -1.276 7.774 1.00 10.00 O ATOM 886 CB MET A 77 2.489 -4.012 7.504 1.00 10.00 C ATOM 887 CG MET A 77 2.557 -5.529 7.392 1.00 10.00 C ATOM 888 SD MET A 77 4.245 -6.150 7.223 1.00 10.00 S ATOM 889 CE MET A 77 4.919 -5.007 6.025 1.00 10.00 C ATOM 0 H MET A 77 0.057 -3.703 6.545 1.00 10.00 H new ATOM 0 HA MET A 77 1.234 -3.953 9.244 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.501 -3.581 6.503 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.382 -3.653 8.016 1.00 10.00 H new ATOM 0 HG2 MET A 77 2.099 -5.974 8.275 1.00 10.00 H new ATOM 0 HG3 MET A 77 1.970 -5.851 6.532 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.907 -5.347 5.714 1.00 10.00 H new ATOM 0 HE2 MET A 77 4.261 -4.960 5.157 1.00 10.00 H new ATOM 0 HE3 MET A 77 5.000 -4.017 6.473 1.00 10.00 H new ATOM 899 N GLN A 78 2.223 -1.510 9.215 1.00 10.00 N ATOM 900 CA GLN A 78 2.371 -0.078 9.436 1.00 10.00 C ATOM 901 C GLN A 78 3.503 0.473 8.577 1.00 10.00 C ATOM 902 O GLN A 78 4.302 -0.287 8.033 1.00 10.00 O ATOM 903 CB GLN A 78 2.631 0.210 10.916 1.00 10.00 C ATOM 904 CG GLN A 78 1.438 -0.098 11.810 1.00 10.00 C ATOM 905 CD GLN A 78 0.223 0.761 11.504 1.00 10.00 C ATOM 906 OE1 GLN A 78 -0.912 0.301 11.590 1.00 10.00 O ATOM 907 NE2 GLN A 78 0.447 2.022 11.170 1.00 10.00 N ATOM 0 H GLN A 78 2.879 -2.088 9.740 1.00 10.00 H new ATOM 0 HA GLN A 78 1.444 0.417 9.148 1.00 10.00 H new ATOM 0 HB2 GLN A 78 3.486 -0.378 11.248 1.00 10.00 H new ATOM 0 HB3 GLN A 78 2.902 1.259 11.032 1.00 10.00 H new ATOM 0 HG2 GLN A 78 1.170 -1.148 11.698 1.00 10.00 H new ATOM 0 HG3 GLN A 78 1.725 0.048 12.851 1.00 10.00 H new ATOM 0 HE21 GLN A 78 1.403 2.371 11.108 1.00 10.00 H new ATOM 0 HE22 GLN A 78 -0.337 2.645 10.975 1.00 10.00 H new ATOM 916 N LEU A 79 3.569 1.791 8.451 1.00 10.00 N ATOM 917 CA LEU A 79 4.603 2.422 7.644 1.00 10.00 C ATOM 918 C LEU A 79 5.242 3.598 8.380 1.00 10.00 C ATOM 919 O LEU A 79 4.551 4.457 8.928 1.00 10.00 O ATOM 920 CB LEU A 79 4.013 2.894 6.313 1.00 10.00 C ATOM 921 CG LEU A 79 4.967 3.695 5.425 1.00 10.00 C ATOM 922 CD1 LEU A 79 5.998 2.782 4.786 1.00 10.00 C ATOM 923 CD2 LEU A 79 4.199 4.456 4.359 1.00 10.00 C ATOM 0 H LEU A 79 2.921 2.442 8.895 1.00 10.00 H new ATOM 0 HA LEU A 79 5.380 1.682 7.453 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.670 2.022 5.756 1.00 10.00 H new ATOM 0 HB3 LEU A 79 3.135 3.506 6.520 1.00 10.00 H new ATOM 0 HG LEU A 79 5.488 4.417 6.053 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.667 3.371 4.159 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.576 2.284 5.565 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.493 2.034 4.175 1.00 10.00 H new ATOM 0 HD21 LEU A 79 4.897 5.018 3.739 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.647 3.752 3.736 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.501 5.144 4.835 1.00 10.00 H new ATOM 935 N SER A 80 6.563 3.615 8.392 1.00 10.00 N ATOM 936 CA SER A 80 7.320 4.672 9.032 1.00 10.00 C ATOM 937 C SER A 80 8.139 5.423 7.980 1.00 10.00 C ATOM 938 O SER A 80 9.225 4.994 7.589 1.00 10.00 O ATOM 939 CB SER A 80 8.222 4.076 10.120 1.00 10.00 C ATOM 940 OG SER A 80 7.748 4.412 11.415 1.00 10.00 O ATOM 0 H SER A 80 7.140 2.895 7.957 1.00 10.00 H new ATOM 0 HA SER A 80 6.641 5.381 9.506 1.00 10.00 H new ATOM 0 HB2 SER A 80 8.259 2.992 10.013 1.00 10.00 H new ATOM 0 HB3 SER A 80 9.240 4.444 9.995 1.00 10.00 H new ATOM 0 HG SER A 80 8.338 4.019 12.092 1.00 10.00 H new ATOM 946 N TYR A 81 7.596 6.543 7.522 1.00 10.00 N ATOM 947 CA TYR A 81 8.234 7.366 6.504 1.00 10.00 C ATOM 948 C TYR A 81 9.098 8.442 7.154 1.00 10.00 C ATOM 949 O TYR A 81 8.596 9.488 7.566 1.00 10.00 O ATOM 950 CB TYR A 81 7.148 8.014 5.641 1.00 10.00 C ATOM 951 CG TYR A 81 7.611 8.531 4.298 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.712 7.678 3.211 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.910 9.874 4.108 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.102 8.144 1.971 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.297 10.350 2.871 1.00 10.00 C ATOM 956 CZ TYR A 81 8.392 9.481 1.804 1.00 10.00 C ATOM 957 OH TYR A 81 8.781 9.949 0.569 1.00 10.00 O ATOM 0 H TYR A 81 6.700 6.907 7.846 1.00 10.00 H new ATOM 0 HA TYR A 81 8.877 6.742 5.883 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.355 7.285 5.477 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.710 8.842 6.199 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.482 6.630 3.336 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.839 10.557 4.941 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.179 7.464 1.136 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.524 11.398 2.740 1.00 10.00 H new ATOM 0 HH TYR A 81 9.430 10.674 0.684 1.00 10.00 H new ATOM 967 N ASN A 82 10.396 8.192 7.245 1.00 10.00 N ATOM 968 CA ASN A 82 11.312 9.151 7.855 1.00 10.00 C ATOM 969 C ASN A 82 12.070 9.937 6.794 1.00 10.00 C ATOM 970 O ASN A 82 13.131 10.500 7.062 1.00 10.00 O ATOM 971 CB ASN A 82 12.303 8.443 8.785 1.00 10.00 C ATOM 972 CG ASN A 82 11.648 7.916 10.050 1.00 10.00 C ATOM 973 OD1 ASN A 82 10.620 8.426 10.496 1.00 10.00 O ATOM 974 ND2 ASN A 82 12.241 6.891 10.640 1.00 10.00 N ATOM 0 H ASN A 82 10.839 7.338 6.907 1.00 10.00 H new ATOM 0 HA ASN A 82 10.714 9.848 8.442 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.769 7.615 8.250 1.00 10.00 H new ATOM 0 HB3 ASN A 82 13.100 9.136 9.055 1.00 10.00 H new ATOM 0 HD21 ASN A 82 11.847 6.497 11.494 1.00 10.00 H new ATOM 0 HD22 ASN A 82 13.092 6.495 10.240 1.00 10.00 H new ATOM 981 N LEU A 83 11.525 9.975 5.589 1.00 10.00 N ATOM 982 CA LEU A 83 12.155 10.705 4.497 1.00 10.00 C ATOM 983 C LEU A 83 11.830 12.187 4.605 1.00 10.00 C ATOM 984 O LEU A 83 10.721 12.552 4.990 1.00 10.00 O ATOM 985 CB LEU A 83 11.685 10.180 3.139 1.00 10.00 C ATOM 986 CG LEU A 83 12.067 8.739 2.821 1.00 10.00 C ATOM 987 CD1 LEU A 83 11.772 8.421 1.366 1.00 10.00 C ATOM 988 CD2 LEU A 83 13.532 8.491 3.135 1.00 10.00 C ATOM 0 H LEU A 83 10.651 9.511 5.341 1.00 10.00 H new ATOM 0 HA LEU A 83 13.232 10.558 4.573 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.600 10.268 3.092 1.00 10.00 H new ATOM 0 HB3 LEU A 83 12.091 10.825 2.360 1.00 10.00 H new ATOM 0 HG LEU A 83 11.467 8.078 3.447 1.00 10.00 H new ATOM 0 HD11 LEU A 83 12.051 7.388 1.156 1.00 10.00 H new ATOM 0 HD12 LEU A 83 10.708 8.556 1.172 1.00 10.00 H new ATOM 0 HD13 LEU A 83 12.346 9.090 0.724 1.00 10.00 H new ATOM 0 HD21 LEU A 83 13.784 7.457 2.901 1.00 10.00 H new ATOM 0 HD22 LEU A 83 14.151 9.160 2.537 1.00 10.00 H new ATOM 0 HD23 LEU A 83 13.714 8.678 4.193 1.00 10.00 H new ATOM 1000 N PRO A 84 12.791 13.058 4.265 1.00 10.00 N ATOM 1001 CA PRO A 84 12.600 14.509 4.324 1.00 10.00 C ATOM 1002 C PRO A 84 11.419 14.977 3.475 1.00 10.00 C ATOM 1003 O PRO A 84 10.597 15.777 3.929 1.00 10.00 O ATOM 1004 CB PRO A 84 13.918 15.080 3.779 1.00 10.00 C ATOM 1005 CG PRO A 84 14.589 13.938 3.087 1.00 10.00 C ATOM 1006 CD PRO A 84 14.139 12.700 3.803 1.00 10.00 C ATOM 0 HA PRO A 84 12.371 14.842 5.336 1.00 10.00 H new ATOM 0 HB2 PRO A 84 13.734 15.904 3.089 1.00 10.00 H new ATOM 0 HB3 PRO A 84 14.540 15.471 4.584 1.00 10.00 H new ATOM 0 HG2 PRO A 84 14.311 13.902 2.034 1.00 10.00 H new ATOM 0 HG3 PRO A 84 15.673 14.040 3.127 1.00 10.00 H new ATOM 0 HD2 PRO A 84 14.122 11.834 3.141 1.00 10.00 H new ATOM 0 HD3 PRO A 84 14.798 12.452 4.635 1.00 10.00 H new ATOM 1014 N SER A 85 11.330 14.463 2.254 1.00 10.00 N ATOM 1015 CA SER A 85 10.254 14.831 1.346 1.00 10.00 C ATOM 1016 C SER A 85 9.686 13.598 0.647 1.00 10.00 C ATOM 1017 O SER A 85 10.252 12.505 0.728 1.00 10.00 O ATOM 1018 CB SER A 85 10.772 15.825 0.302 1.00 10.00 C ATOM 1019 OG SER A 85 11.616 16.802 0.895 1.00 10.00 O ATOM 0 H SER A 85 11.992 13.789 1.871 1.00 10.00 H new ATOM 0 HA SER A 85 9.458 15.295 1.928 1.00 10.00 H new ATOM 0 HB2 SER A 85 11.320 15.289 -0.473 1.00 10.00 H new ATOM 0 HB3 SER A 85 9.930 16.316 -0.185 1.00 10.00 H new ATOM 0 HG SER A 85 11.933 17.422 0.206 1.00 10.00 H new ATOM 1025 N ASP A 86 8.551 13.781 -0.014 1.00 10.00 N ATOM 1026 CA ASP A 86 7.904 12.704 -0.756 1.00 10.00 C ATOM 1027 C ASP A 86 8.606 12.533 -2.094 1.00 10.00 C ATOM 1028 O ASP A 86 8.907 13.518 -2.768 1.00 10.00 O ATOM 1029 CB ASP A 86 6.421 13.021 -0.986 1.00 10.00 C ATOM 1030 CG ASP A 86 5.489 12.261 -0.058 1.00 10.00 C ATOM 1031 OD1 ASP A 86 5.725 12.260 1.169 1.00 10.00 O ATOM 1032 OD2 ASP A 86 4.491 11.688 -0.555 1.00 10.00 O ATOM 0 H ASP A 86 8.055 14.672 -0.052 1.00 10.00 H new ATOM 0 HA ASP A 86 7.972 11.782 -0.179 1.00 10.00 H new ATOM 0 HB2 ASP A 86 6.261 14.091 -0.852 1.00 10.00 H new ATOM 0 HB3 ASP A 86 6.163 12.787 -2.019 1.00 10.00 H new ATOM 1037 N TYR A 87 8.882 11.294 -2.475 1.00 10.00 N ATOM 1038 CA TYR A 87 9.559 11.031 -3.735 1.00 10.00 C ATOM 1039 C TYR A 87 8.661 10.260 -4.690 1.00 10.00 C ATOM 1040 O TYR A 87 7.662 9.667 -4.279 1.00 10.00 O ATOM 1041 CB TYR A 87 10.861 10.265 -3.496 1.00 10.00 C ATOM 1042 CG TYR A 87 11.872 11.042 -2.680 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.588 12.093 -3.240 1.00 10.00 C ATOM 1044 CD2 TYR A 87 12.103 10.729 -1.348 1.00 10.00 C ATOM 1045 CE1 TYR A 87 13.509 12.805 -2.495 1.00 10.00 C ATOM 1046 CE2 TYR A 87 13.023 11.437 -0.596 1.00 10.00 C ATOM 1047 CZ TYR A 87 13.723 12.474 -1.175 1.00 10.00 C ATOM 1048 OH TYR A 87 14.642 13.183 -0.433 1.00 10.00 O ATOM 0 H TYR A 87 8.649 10.461 -1.934 1.00 10.00 H new ATOM 0 HA TYR A 87 9.797 11.991 -4.193 1.00 10.00 H new ATOM 0 HB2 TYR A 87 10.635 9.329 -2.986 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.303 10.005 -4.458 1.00 10.00 H new ATOM 0 HD1 TYR A 87 12.422 12.358 -4.274 1.00 10.00 H new ATOM 0 HD2 TYR A 87 11.555 9.919 -0.891 1.00 10.00 H new ATOM 0 HE1 TYR A 87 14.059 13.618 -2.946 1.00 10.00 H new ATOM 0 HE2 TYR A 87 13.192 11.179 0.439 1.00 10.00 H new ATOM 0 HH TYR A 87 14.692 14.103 -0.766 1.00 10.00 H new ATOM 1058 N THR A 88 9.027 10.273 -5.960 1.00 10.00 N ATOM 1059 CA THR A 88 8.269 9.590 -6.993 1.00 10.00 C ATOM 1060 C THR A 88 9.019 8.357 -7.484 1.00 10.00 C ATOM 1061 O THR A 88 10.165 8.128 -7.093 1.00 10.00 O ATOM 1062 CB THR A 88 8.010 10.536 -8.182 1.00 10.00 C ATOM 1063 OG1 THR A 88 9.137 11.408 -8.357 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.757 11.366 -7.958 1.00 10.00 C ATOM 0 H THR A 88 9.857 10.757 -6.303 1.00 10.00 H new ATOM 0 HA THR A 88 7.317 9.280 -6.563 1.00 10.00 H new ATOM 0 HB THR A 88 7.866 9.930 -9.077 1.00 10.00 H new ATOM 0 HG1 THR A 88 8.972 12.008 -9.114 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.599 12.024 -8.812 1.00 10.00 H new ATOM 0 HG22 THR A 88 5.898 10.705 -7.845 1.00 10.00 H new ATOM 0 HG23 THR A 88 6.874 11.965 -7.055 1.00 10.00 H new ATOM 1072 N LEU A 89 8.377 7.552 -8.321 1.00 10.00 N ATOM 1073 CA LEU A 89 9.025 6.366 -8.856 1.00 10.00 C ATOM 1074 C LEU A 89 10.020 6.777 -9.933 1.00 10.00 C ATOM 1075 O LEU A 89 9.633 7.308 -10.976 1.00 10.00 O ATOM 1076 CB LEU A 89 8.009 5.378 -9.444 1.00 10.00 C ATOM 1077 CG LEU A 89 6.964 4.799 -8.479 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.418 4.863 -7.027 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.633 5.500 -8.663 1.00 10.00 C ATOM 0 H LEU A 89 7.419 7.698 -8.640 1.00 10.00 H new ATOM 0 HA LEU A 89 9.541 5.865 -8.037 1.00 10.00 H new ATOM 0 HB2 LEU A 89 7.481 5.878 -10.256 1.00 10.00 H new ATOM 0 HB3 LEU A 89 8.560 4.548 -9.886 1.00 10.00 H new ATOM 0 HG LEU A 89 6.844 3.743 -8.723 1.00 10.00 H new ATOM 0 HD11 LEU A 89 6.644 4.442 -6.385 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.339 4.292 -6.908 1.00 10.00 H new ATOM 0 HD13 LEU A 89 7.596 5.901 -6.747 1.00 10.00 H new ATOM 0 HD21 LEU A 89 4.902 5.079 -7.973 1.00 10.00 H new ATOM 0 HD22 LEU A 89 5.752 6.565 -8.462 1.00 10.00 H new ATOM 0 HD23 LEU A 89 5.287 5.361 -9.687 1.00 10.00 H new ATOM 1091 N ILE A 90 11.299 6.549 -9.671 1.00 10.00 N ATOM 1092 CA ILE A 90 12.357 6.904 -10.613 1.00 10.00 C ATOM 1093 C ILE A 90 12.222 6.138 -11.929 1.00 10.00 C ATOM 1094 O ILE A 90 12.472 6.685 -13.001 1.00 10.00 O ATOM 1095 CB ILE A 90 13.756 6.647 -10.015 1.00 10.00 C ATOM 1096 CG1 ILE A 90 13.781 5.308 -9.277 1.00 10.00 C ATOM 1097 CG2 ILE A 90 14.145 7.786 -9.081 1.00 10.00 C ATOM 1098 CD1 ILE A 90 15.159 4.881 -8.833 1.00 10.00 C ATOM 0 H ILE A 90 11.633 6.117 -8.809 1.00 10.00 H new ATOM 0 HA ILE A 90 12.247 7.970 -10.814 1.00 10.00 H new ATOM 0 HB ILE A 90 14.483 6.603 -10.826 1.00 10.00 H new ATOM 0 HG12 ILE A 90 13.132 5.373 -8.403 1.00 10.00 H new ATOM 0 HG13 ILE A 90 13.364 4.538 -9.927 1.00 10.00 H new ATOM 0 HG21 ILE A 90 15.134 7.594 -8.665 1.00 10.00 H new ATOM 0 HG22 ILE A 90 14.161 8.723 -9.637 1.00 10.00 H new ATOM 0 HG23 ILE A 90 13.418 7.857 -8.272 1.00 10.00 H new ATOM 0 HD11 ILE A 90 15.095 3.923 -8.317 1.00 10.00 H new ATOM 0 HD12 ILE A 90 15.807 4.782 -9.704 1.00 10.00 H new ATOM 0 HD13 ILE A 90 15.572 5.630 -8.157 1.00 10.00 H new ATOM 1110 N GLY A 91 11.814 4.879 -11.843 1.00 10.00 N ATOM 1111 CA GLY A 91 11.658 4.071 -13.038 1.00 10.00 C ATOM 1112 C GLY A 91 11.778 2.583 -12.762 1.00 10.00 C ATOM 1113 O GLY A 91 10.774 1.871 -12.783 1.00 10.00 O ATOM 0 H GLY A 91 11.589 4.403 -10.970 1.00 10.00 H new ATOM 0 HA2 GLY A 91 10.685 4.276 -13.485 1.00 10.00 H new ATOM 0 HA3 GLY A 91 12.412 4.362 -13.769 1.00 10.00 H new ATOM 1117 N PRO A 92 12.999 2.090 -12.468 1.00 10.00 N ATOM 1118 CA PRO A 92 13.261 0.659 -12.189 1.00 10.00 C ATOM 1119 C PRO A 92 12.472 0.103 -10.996 1.00 10.00 C ATOM 1120 O PRO A 92 12.568 -1.082 -10.679 1.00 10.00 O ATOM 1121 CB PRO A 92 14.764 0.617 -11.885 1.00 10.00 C ATOM 1122 CG PRO A 92 15.144 2.023 -11.578 1.00 10.00 C ATOM 1123 CD PRO A 92 14.240 2.881 -12.406 1.00 10.00 C ATOM 0 HA PRO A 92 12.952 0.042 -13.032 1.00 10.00 H new ATOM 0 HB2 PRO A 92 14.976 -0.040 -11.042 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.327 0.235 -12.737 1.00 10.00 H new ATOM 0 HG2 PRO A 92 15.022 2.238 -10.516 1.00 10.00 H new ATOM 0 HG3 PRO A 92 16.190 2.207 -11.823 1.00 10.00 H new ATOM 0 HD2 PRO A 92 14.075 3.855 -11.946 1.00 10.00 H new ATOM 0 HD3 PRO A 92 14.653 3.063 -13.398 1.00 10.00 H new ATOM 1131 N VAL A 93 11.701 0.958 -10.343 1.00 10.00 N ATOM 1132 CA VAL A 93 10.897 0.558 -9.194 1.00 10.00 C ATOM 1133 C VAL A 93 9.810 -0.425 -9.620 1.00 10.00 C ATOM 1134 O VAL A 93 9.579 -1.437 -8.959 1.00 10.00 O ATOM 1135 CB VAL A 93 10.243 1.780 -8.516 1.00 10.00 C ATOM 1136 CG1 VAL A 93 9.873 1.466 -7.075 1.00 10.00 C ATOM 1137 CG2 VAL A 93 11.161 2.989 -8.586 1.00 10.00 C ATOM 0 H VAL A 93 11.613 1.944 -10.591 1.00 10.00 H new ATOM 0 HA VAL A 93 11.564 0.077 -8.478 1.00 10.00 H new ATOM 0 HB VAL A 93 9.326 2.017 -9.056 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.414 2.343 -6.618 1.00 10.00 H new ATOM 0 HG12 VAL A 93 9.169 0.634 -7.053 1.00 10.00 H new ATOM 0 HG13 VAL A 93 10.771 1.196 -6.519 1.00 10.00 H new ATOM 0 HG21 VAL A 93 10.680 3.839 -8.102 1.00 10.00 H new ATOM 0 HG22 VAL A 93 12.098 2.764 -8.077 1.00 10.00 H new ATOM 0 HG23 VAL A 93 11.364 3.232 -9.629 1.00 10.00 H new ATOM 1147 N SER A 94 9.153 -0.121 -10.735 1.00 10.00 N ATOM 1148 CA SER A 94 8.096 -0.977 -11.268 1.00 10.00 C ATOM 1149 C SER A 94 8.632 -2.343 -11.716 1.00 10.00 C ATOM 1150 O SER A 94 7.856 -3.244 -12.037 1.00 10.00 O ATOM 1151 CB SER A 94 7.415 -0.270 -12.438 1.00 10.00 C ATOM 1152 OG SER A 94 7.502 1.139 -12.283 1.00 10.00 O ATOM 0 H SER A 94 9.334 0.715 -11.290 1.00 10.00 H new ATOM 0 HA SER A 94 7.375 -1.159 -10.471 1.00 10.00 H new ATOM 0 HB2 SER A 94 7.885 -0.569 -13.375 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.369 -0.572 -12.495 1.00 10.00 H new ATOM 0 HG SER A 94 7.063 1.579 -13.041 1.00 10.00 H new ATOM 1158 N ALA A 95 9.954 -2.492 -11.738 1.00 10.00 N ATOM 1159 CA ALA A 95 10.574 -3.753 -12.130 1.00 10.00 C ATOM 1160 C ALA A 95 10.677 -4.693 -10.932 1.00 10.00 C ATOM 1161 O ALA A 95 10.971 -5.880 -11.079 1.00 10.00 O ATOM 1162 CB ALA A 95 11.948 -3.504 -12.736 1.00 10.00 C ATOM 0 H ALA A 95 10.615 -1.756 -11.489 1.00 10.00 H new ATOM 0 HA ALA A 95 9.947 -4.227 -12.885 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.397 -4.455 -13.023 1.00 10.00 H new ATOM 0 HB2 ALA A 95 11.848 -2.870 -13.617 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.585 -3.009 -12.003 1.00 10.00 H new ATOM 1168 N ILE A 96 10.419 -4.158 -9.744 1.00 10.00 N ATOM 1169 CA ILE A 96 10.477 -4.936 -8.519 1.00 10.00 C ATOM 1170 C ILE A 96 9.113 -5.544 -8.234 1.00 10.00 C ATOM 1171 O ILE A 96 8.172 -4.836 -7.888 1.00 10.00 O ATOM 1172 CB ILE A 96 10.924 -4.061 -7.328 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.275 -3.418 -7.635 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.005 -4.888 -6.052 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.521 -2.123 -6.895 1.00 10.00 C ATOM 0 H ILE A 96 10.166 -3.180 -9.606 1.00 10.00 H new ATOM 0 HA ILE A 96 11.210 -5.732 -8.650 1.00 10.00 H new ATOM 0 HB ILE A 96 10.184 -3.275 -7.175 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.067 -4.124 -7.385 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.342 -3.231 -8.707 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.322 -4.252 -5.226 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.025 -5.311 -5.830 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.726 -5.694 -6.186 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.500 -1.729 -7.166 1.00 10.00 H new ATOM 0 HD12 ILE A 96 11.752 -1.399 -7.163 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.488 -2.306 -5.821 1.00 10.00 H new ATOM 1187 N SER A 97 8.999 -6.848 -8.423 1.00 10.00 N ATOM 1188 CA SER A 97 7.737 -7.545 -8.203 1.00 10.00 C ATOM 1189 C SER A 97 7.957 -8.856 -7.447 1.00 10.00 C ATOM 1190 O SER A 97 8.229 -9.899 -8.048 1.00 10.00 O ATOM 1191 CB SER A 97 7.059 -7.816 -9.551 1.00 10.00 C ATOM 1192 OG SER A 97 7.490 -6.877 -10.523 1.00 10.00 O ATOM 0 H SER A 97 9.765 -7.449 -8.729 1.00 10.00 H new ATOM 0 HA SER A 97 7.092 -6.912 -7.593 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.292 -8.827 -9.885 1.00 10.00 H new ATOM 0 HB3 SER A 97 5.976 -7.760 -9.438 1.00 10.00 H new ATOM 0 HG SER A 97 7.049 -7.065 -11.378 1.00 10.00 H new ATOM 1198 N THR A 98 7.865 -8.792 -6.129 1.00 10.00 N ATOM 1199 CA THR A 98 8.046 -9.965 -5.288 1.00 10.00 C ATOM 1200 C THR A 98 6.927 -10.064 -4.259 1.00 10.00 C ATOM 1201 O THR A 98 6.305 -9.056 -3.915 1.00 10.00 O ATOM 1202 CB THR A 98 9.410 -9.927 -4.570 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.642 -11.155 -3.871 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.469 -8.763 -3.601 1.00 10.00 C ATOM 0 H THR A 98 7.665 -7.934 -5.615 1.00 10.00 H new ATOM 0 HA THR A 98 8.017 -10.843 -5.933 1.00 10.00 H new ATOM 0 HB THR A 98 10.188 -9.797 -5.323 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.530 -11.500 -4.102 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.439 -8.752 -3.104 1.00 10.00 H new ATOM 0 HG22 THR A 98 9.330 -7.829 -4.145 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.680 -8.869 -2.856 1.00 10.00 H new ATOM 1212 N THR A 99 6.662 -11.269 -3.771 1.00 10.00 N ATOM 1213 CA THR A 99 5.624 -11.458 -2.769 1.00 10.00 C ATOM 1214 C THR A 99 6.207 -11.338 -1.364 1.00 10.00 C ATOM 1215 O THR A 99 5.486 -11.374 -0.368 1.00 10.00 O ATOM 1216 CB THR A 99 4.926 -12.818 -2.926 1.00 10.00 C ATOM 1217 OG1 THR A 99 5.820 -13.758 -3.530 1.00 10.00 O ATOM 1218 CG2 THR A 99 3.668 -12.693 -3.768 1.00 10.00 C ATOM 0 H THR A 99 7.147 -12.122 -4.050 1.00 10.00 H new ATOM 0 HA THR A 99 4.881 -10.675 -2.920 1.00 10.00 H new ATOM 0 HB THR A 99 4.642 -13.170 -1.934 1.00 10.00 H new ATOM 0 HG1 THR A 99 5.369 -14.623 -3.626 1.00 10.00 H new ATOM 0 HG21 THR A 99 3.195 -13.670 -3.862 1.00 10.00 H new ATOM 0 HG22 THR A 99 2.977 -12.000 -3.289 1.00 10.00 H new ATOM 0 HG23 THR A 99 3.929 -12.319 -4.758 1.00 10.00 H new ATOM 1226 N SER A 100 7.522 -11.208 -1.292 1.00 10.00 N ATOM 1227 CA SER A 100 8.203 -11.061 -0.023 1.00 10.00 C ATOM 1228 C SER A 100 8.430 -9.586 0.261 1.00 10.00 C ATOM 1229 O SER A 100 9.154 -8.909 -0.474 1.00 10.00 O ATOM 1230 CB SER A 100 9.537 -11.812 -0.055 1.00 10.00 C ATOM 1231 OG SER A 100 10.360 -11.460 1.045 1.00 10.00 O ATOM 0 H SER A 100 8.139 -11.202 -2.104 1.00 10.00 H new ATOM 0 HA SER A 100 7.588 -11.484 0.771 1.00 10.00 H new ATOM 0 HB2 SER A 100 9.351 -12.886 -0.042 1.00 10.00 H new ATOM 0 HB3 SER A 100 10.058 -11.590 -0.986 1.00 10.00 H new ATOM 0 HG SER A 100 11.203 -11.958 0.996 1.00 10.00 H new ATOM 1237 N VAL A 101 7.804 -9.081 1.314 1.00 10.00 N ATOM 1238 CA VAL A 101 7.946 -7.678 1.672 1.00 10.00 C ATOM 1239 C VAL A 101 9.393 -7.370 2.057 1.00 10.00 C ATOM 1240 O VAL A 101 9.885 -6.260 1.836 1.00 10.00 O ATOM 1241 CB VAL A 101 6.977 -7.273 2.808 1.00 10.00 C ATOM 1242 CG1 VAL A 101 7.298 -8.000 4.106 1.00 10.00 C ATOM 1243 CG2 VAL A 101 6.992 -5.767 3.011 1.00 10.00 C ATOM 0 H VAL A 101 7.196 -9.618 1.932 1.00 10.00 H new ATOM 0 HA VAL A 101 7.683 -7.085 0.796 1.00 10.00 H new ATOM 0 HB VAL A 101 5.972 -7.571 2.509 1.00 10.00 H new ATOM 0 HG11 VAL A 101 6.596 -7.689 4.880 1.00 10.00 H new ATOM 0 HG12 VAL A 101 7.214 -9.076 3.951 1.00 10.00 H new ATOM 0 HG13 VAL A 101 8.314 -7.756 4.418 1.00 10.00 H new ATOM 0 HG21 VAL A 101 6.304 -5.501 3.814 1.00 10.00 H new ATOM 0 HG22 VAL A 101 8.000 -5.445 3.275 1.00 10.00 H new ATOM 0 HG23 VAL A 101 6.683 -5.273 2.090 1.00 10.00 H new ATOM 1253 N GLN A 102 10.078 -8.373 2.600 1.00 10.00 N ATOM 1254 CA GLN A 102 11.470 -8.221 2.986 1.00 10.00 C ATOM 1255 C GLN A 102 12.334 -8.072 1.741 1.00 10.00 C ATOM 1256 O GLN A 102 13.216 -7.215 1.683 1.00 10.00 O ATOM 1257 CB GLN A 102 11.933 -9.412 3.829 1.00 10.00 C ATOM 1258 CG GLN A 102 11.402 -9.382 5.253 1.00 10.00 C ATOM 1259 CD GLN A 102 11.944 -10.513 6.104 1.00 10.00 C ATOM 1260 OE1 GLN A 102 13.042 -11.015 5.868 1.00 10.00 O ATOM 1261 NE2 GLN A 102 11.183 -10.922 7.103 1.00 10.00 N ATOM 0 H GLN A 102 9.688 -9.298 2.781 1.00 10.00 H new ATOM 0 HA GLN A 102 11.571 -7.323 3.596 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.612 -10.336 3.348 1.00 10.00 H new ATOM 0 HB3 GLN A 102 13.023 -9.428 3.855 1.00 10.00 H new ATOM 0 HG2 GLN A 102 11.663 -8.429 5.714 1.00 10.00 H new ATOM 0 HG3 GLN A 102 10.314 -9.438 5.232 1.00 10.00 H new ATOM 0 HE21 GLN A 102 10.278 -10.482 7.268 1.00 10.00 H new ATOM 0 HE22 GLN A 102 11.500 -11.678 7.709 1.00 10.00 H new ATOM 1270 N GLN A 103 12.052 -8.893 0.732 1.00 10.00 N ATOM 1271 CA GLN A 103 12.786 -8.841 -0.526 1.00 10.00 C ATOM 1272 C GLN A 103 12.528 -7.512 -1.225 1.00 10.00 C ATOM 1273 O GLN A 103 13.450 -6.887 -1.746 1.00 10.00 O ATOM 1274 CB GLN A 103 12.380 -10.000 -1.438 1.00 10.00 C ATOM 1275 CG GLN A 103 13.087 -9.992 -2.786 1.00 10.00 C ATOM 1276 CD GLN A 103 14.474 -10.597 -2.733 1.00 10.00 C ATOM 1277 OE1 GLN A 103 15.168 -10.512 -1.720 1.00 10.00 O ATOM 1278 NE2 GLN A 103 14.889 -11.209 -3.829 1.00 10.00 N ATOM 0 H GLN A 103 11.319 -9.602 0.763 1.00 10.00 H new ATOM 0 HA GLN A 103 13.850 -8.930 -0.308 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.593 -10.941 -0.931 1.00 10.00 H new ATOM 0 HB3 GLN A 103 11.303 -9.962 -1.602 1.00 10.00 H new ATOM 0 HG2 GLN A 103 12.485 -10.542 -3.509 1.00 10.00 H new ATOM 0 HG3 GLN A 103 13.158 -8.966 -3.146 1.00 10.00 H new ATOM 0 HE21 GLN A 103 14.282 -11.257 -4.647 1.00 10.00 H new ATOM 0 HE22 GLN A 103 15.816 -11.633 -3.856 1.00 10.00 H new ATOM 1287 N ALA A 104 11.268 -7.082 -1.215 1.00 10.00 N ATOM 1288 CA ALA A 104 10.873 -5.824 -1.843 1.00 10.00 C ATOM 1289 C ALA A 104 11.654 -4.656 -1.255 1.00 10.00 C ATOM 1290 O ALA A 104 12.244 -3.859 -1.987 1.00 10.00 O ATOM 1291 CB ALA A 104 9.377 -5.596 -1.676 1.00 10.00 C ATOM 0 H ALA A 104 10.500 -7.590 -0.776 1.00 10.00 H new ATOM 0 HA ALA A 104 11.102 -5.887 -2.907 1.00 10.00 H new ATOM 0 HB1 ALA A 104 9.097 -4.655 -2.149 1.00 10.00 H new ATOM 0 HB2 ALA A 104 8.830 -6.414 -2.144 1.00 10.00 H new ATOM 0 HB3 ALA A 104 9.131 -5.556 -0.615 1.00 10.00 H new ATOM 1297 N ALA A 105 11.669 -4.572 0.072 1.00 10.00 N ATOM 1298 CA ALA A 105 12.388 -3.511 0.761 1.00 10.00 C ATOM 1299 C ALA A 105 13.881 -3.590 0.447 1.00 10.00 C ATOM 1300 O ALA A 105 14.562 -2.571 0.320 1.00 10.00 O ATOM 1301 CB ALA A 105 12.148 -3.604 2.262 1.00 10.00 C ATOM 0 H ALA A 105 11.190 -5.227 0.690 1.00 10.00 H new ATOM 0 HA ALA A 105 12.016 -2.548 0.410 1.00 10.00 H new ATOM 0 HB1 ALA A 105 12.691 -2.805 2.767 1.00 10.00 H new ATOM 0 HB2 ALA A 105 11.082 -3.504 2.467 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.499 -4.569 2.628 1.00 10.00 H new ATOM 1307 N THR A 106 14.372 -4.811 0.304 1.00 10.00 N ATOM 1308 CA THR A 106 15.771 -5.049 -0.006 1.00 10.00 C ATOM 1309 C THR A 106 16.113 -4.526 -1.402 1.00 10.00 C ATOM 1310 O THR A 106 17.076 -3.773 -1.579 1.00 10.00 O ATOM 1311 CB THR A 106 16.090 -6.556 0.086 1.00 10.00 C ATOM 1312 OG1 THR A 106 15.851 -7.025 1.420 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.529 -6.845 -0.304 1.00 10.00 C ATOM 0 H THR A 106 13.815 -5.660 0.399 1.00 10.00 H new ATOM 0 HA THR A 106 16.378 -4.512 0.723 1.00 10.00 H new ATOM 0 HB THR A 106 15.437 -7.079 -0.613 1.00 10.00 H new ATOM 0 HG1 THR A 106 14.887 -7.126 1.563 1.00 10.00 H new ATOM 0 HG21 THR A 106 17.719 -7.916 -0.228 1.00 10.00 H new ATOM 0 HG22 THR A 106 17.701 -6.518 -1.330 1.00 10.00 H new ATOM 0 HG23 THR A 106 18.202 -6.309 0.365 1.00 10.00 H new ATOM 1321 N GLU A 107 15.295 -4.903 -2.379 1.00 10.00 N ATOM 1322 CA GLU A 107 15.495 -4.492 -3.765 1.00 10.00 C ATOM 1323 C GLU A 107 15.376 -2.979 -3.922 1.00 10.00 C ATOM 1324 O GLU A 107 16.142 -2.363 -4.663 1.00 10.00 O ATOM 1325 CB GLU A 107 14.485 -5.191 -4.672 1.00 10.00 C ATOM 1326 CG GLU A 107 14.661 -6.699 -4.726 1.00 10.00 C ATOM 1327 CD GLU A 107 14.364 -7.263 -6.097 1.00 10.00 C ATOM 1328 OE1 GLU A 107 15.193 -7.066 -7.009 1.00 10.00 O ATOM 1329 OE2 GLU A 107 13.309 -7.907 -6.271 1.00 10.00 O ATOM 0 H GLU A 107 14.479 -5.498 -2.235 1.00 10.00 H new ATOM 0 HA GLU A 107 16.504 -4.782 -4.056 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.477 -4.963 -4.324 1.00 10.00 H new ATOM 0 HB3 GLU A 107 14.573 -4.787 -5.680 1.00 10.00 H new ATOM 0 HG2 GLU A 107 15.683 -6.954 -4.444 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.003 -7.166 -3.993 1.00 10.00 H new ATOM 1336 N LEU A 108 14.411 -2.387 -3.229 1.00 10.00 N ATOM 1337 CA LEU A 108 14.203 -0.944 -3.289 1.00 10.00 C ATOM 1338 C LEU A 108 15.436 -0.204 -2.785 1.00 10.00 C ATOM 1339 O LEU A 108 15.944 0.688 -3.451 1.00 10.00 O ATOM 1340 CB LEU A 108 12.993 -0.533 -2.451 1.00 10.00 C ATOM 1341 CG LEU A 108 11.629 -0.933 -3.005 1.00 10.00 C ATOM 1342 CD1 LEU A 108 10.546 -0.651 -1.976 1.00 10.00 C ATOM 1343 CD2 LEU A 108 11.335 -0.185 -4.294 1.00 10.00 C ATOM 0 H LEU A 108 13.760 -2.882 -2.619 1.00 10.00 H new ATOM 0 HA LEU A 108 14.022 -0.679 -4.331 1.00 10.00 H new ATOM 0 HB2 LEU A 108 13.101 -0.966 -1.457 1.00 10.00 H new ATOM 0 HB3 LEU A 108 13.011 0.550 -2.330 1.00 10.00 H new ATOM 0 HG LEU A 108 11.642 -2.001 -3.222 1.00 10.00 H new ATOM 0 HD11 LEU A 108 9.576 -0.940 -2.380 1.00 10.00 H new ATOM 0 HD12 LEU A 108 10.747 -1.224 -1.070 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.538 0.413 -1.738 1.00 10.00 H new ATOM 0 HD21 LEU A 108 10.358 -0.484 -4.673 1.00 10.00 H new ATOM 0 HD22 LEU A 108 11.336 0.888 -4.101 1.00 10.00 H new ATOM 0 HD23 LEU A 108 12.099 -0.421 -5.034 1.00 10.00 H new ATOM 1355 N SER A 109 15.925 -0.601 -1.618 1.00 10.00 N ATOM 1356 CA SER A 109 17.096 0.027 -1.015 1.00 10.00 C ATOM 1357 C SER A 109 18.327 -0.071 -1.914 1.00 10.00 C ATOM 1358 O SER A 109 19.211 0.779 -1.854 1.00 10.00 O ATOM 1359 CB SER A 109 17.386 -0.612 0.342 1.00 10.00 C ATOM 1360 OG SER A 109 16.238 -0.562 1.167 1.00 10.00 O ATOM 0 H SER A 109 15.527 -1.360 -1.066 1.00 10.00 H new ATOM 0 HA SER A 109 16.872 1.086 -0.883 1.00 10.00 H new ATOM 0 HB2 SER A 109 17.698 -1.647 0.204 1.00 10.00 H new ATOM 0 HB3 SER A 109 18.213 -0.092 0.826 1.00 10.00 H new ATOM 0 HG SER A 109 15.677 -1.347 0.995 1.00 10.00 H new ATOM 1366 N ALA A 110 18.382 -1.100 -2.748 1.00 10.00 N ATOM 1367 CA ALA A 110 19.512 -1.286 -3.646 1.00 10.00 C ATOM 1368 C ALA A 110 19.545 -0.205 -4.725 1.00 10.00 C ATOM 1369 O ALA A 110 20.605 0.334 -5.051 1.00 10.00 O ATOM 1370 CB ALA A 110 19.463 -2.668 -4.280 1.00 10.00 C ATOM 0 H ALA A 110 17.660 -1.816 -2.821 1.00 10.00 H new ATOM 0 HA ALA A 110 20.426 -1.201 -3.058 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.315 -2.792 -4.949 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.501 -3.428 -3.500 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.538 -2.776 -4.847 1.00 10.00 H new ATOM 1376 N VAL A 111 18.383 0.110 -5.277 1.00 10.00 N ATOM 1377 CA VAL A 111 18.286 1.118 -6.328 1.00 10.00 C ATOM 1378 C VAL A 111 18.103 2.529 -5.752 1.00 10.00 C ATOM 1379 O VAL A 111 18.551 3.515 -6.337 1.00 10.00 O ATOM 1380 CB VAL A 111 17.130 0.786 -7.313 1.00 10.00 C ATOM 1381 CG1 VAL A 111 15.793 0.646 -6.600 1.00 10.00 C ATOM 1382 CG2 VAL A 111 17.036 1.822 -8.418 1.00 10.00 C ATOM 0 H VAL A 111 17.494 -0.316 -5.017 1.00 10.00 H new ATOM 0 HA VAL A 111 19.229 1.100 -6.875 1.00 10.00 H new ATOM 0 HB VAL A 111 17.366 -0.179 -7.762 1.00 10.00 H new ATOM 0 HG11 VAL A 111 15.015 0.414 -7.328 1.00 10.00 H new ATOM 0 HG12 VAL A 111 15.854 -0.157 -5.866 1.00 10.00 H new ATOM 0 HG13 VAL A 111 15.550 1.581 -6.095 1.00 10.00 H new ATOM 0 HG21 VAL A 111 16.219 1.563 -9.091 1.00 10.00 H new ATOM 0 HG22 VAL A 111 16.850 2.803 -7.982 1.00 10.00 H new ATOM 0 HG23 VAL A 111 17.972 1.845 -8.976 1.00 10.00 H new ATOM 1392 N TYR A 112 17.476 2.604 -4.591 1.00 10.00 N ATOM 1393 CA TYR A 112 17.182 3.874 -3.935 1.00 10.00 C ATOM 1394 C TYR A 112 18.358 4.460 -3.164 1.00 10.00 C ATOM 1395 O TYR A 112 18.365 5.658 -2.878 1.00 10.00 O ATOM 1396 CB TYR A 112 15.972 3.721 -3.025 1.00 10.00 C ATOM 1397 CG TYR A 112 14.672 3.946 -3.756 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.576 3.693 -5.116 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.549 4.416 -3.098 1.00 10.00 C ATOM 1400 CE1 TYR A 112 13.401 3.898 -5.802 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.366 4.628 -3.776 1.00 10.00 C ATOM 1402 CZ TYR A 112 12.295 4.367 -5.128 1.00 10.00 C ATOM 1403 OH TYR A 112 11.120 4.589 -5.808 1.00 10.00 O ATOM 0 H TYR A 112 17.154 1.787 -4.073 1.00 10.00 H new ATOM 0 HA TYR A 112 16.965 4.587 -4.731 1.00 10.00 H new ATOM 0 HB2 TYR A 112 15.973 2.722 -2.589 1.00 10.00 H new ATOM 0 HB3 TYR A 112 16.049 4.429 -2.200 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.442 3.327 -5.648 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.599 4.620 -2.039 1.00 10.00 H new ATOM 0 HE1 TYR A 112 13.346 3.693 -6.861 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.498 4.997 -3.249 1.00 10.00 H new ATOM 0 HH TYR A 112 10.784 5.485 -5.596 1.00 10.00 H new ATOM 1413 N ALA A 113 19.310 3.621 -2.772 1.00 10.00 N ATOM 1414 CA ALA A 113 20.484 4.082 -2.025 1.00 10.00 C ATOM 1415 C ALA A 113 21.155 5.277 -2.705 1.00 10.00 C ATOM 1416 O ALA A 113 21.748 6.123 -2.038 1.00 10.00 O ATOM 1417 CB ALA A 113 21.485 2.951 -1.844 1.00 10.00 C ATOM 0 H ALA A 113 19.296 2.618 -2.957 1.00 10.00 H new ATOM 0 HA ALA A 113 20.137 4.407 -1.044 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.348 3.315 -1.287 1.00 10.00 H new ATOM 0 HB2 ALA A 113 21.016 2.135 -1.294 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.808 2.592 -2.821 1.00 10.00 H new ATOM 1423 N ALA A 114 21.058 5.343 -4.030 1.00 10.00 N ATOM 1424 CA ALA A 114 21.639 6.445 -4.792 1.00 10.00 C ATOM 1425 C ALA A 114 20.858 7.737 -4.556 1.00 10.00 C ATOM 1426 O ALA A 114 21.439 8.817 -4.427 1.00 10.00 O ATOM 1427 CB ALA A 114 21.668 6.103 -6.272 1.00 10.00 C ATOM 0 H ALA A 114 20.581 4.644 -4.600 1.00 10.00 H new ATOM 0 HA ALA A 114 22.662 6.599 -4.449 1.00 10.00 H new ATOM 0 HB1 ALA A 114 22.103 6.933 -6.829 1.00 10.00 H new ATOM 0 HB2 ALA A 114 22.269 5.207 -6.427 1.00 10.00 H new ATOM 0 HB3 ALA A 114 20.652 5.923 -6.624 1.00 10.00 H new ATOM 1433 N GLN A 115 19.537 7.612 -4.487 1.00 10.00 N ATOM 1434 CA GLN A 115 18.659 8.757 -4.253 1.00 10.00 C ATOM 1435 C GLN A 115 18.732 9.183 -2.793 1.00 10.00 C ATOM 1436 O GLN A 115 18.449 10.331 -2.449 1.00 10.00 O ATOM 1437 CB GLN A 115 17.209 8.413 -4.611 1.00 10.00 C ATOM 1438 CG GLN A 115 16.903 8.495 -6.097 1.00 10.00 C ATOM 1439 CD GLN A 115 17.516 7.354 -6.884 1.00 10.00 C ATOM 1440 OE1 GLN A 115 17.727 6.265 -6.357 1.00 10.00 O ATOM 1441 NE2 GLN A 115 17.799 7.596 -8.153 1.00 10.00 N ATOM 0 H GLN A 115 19.046 6.724 -4.590 1.00 10.00 H new ATOM 0 HA GLN A 115 18.994 9.576 -4.889 1.00 10.00 H new ATOM 0 HB2 GLN A 115 16.988 7.405 -4.260 1.00 10.00 H new ATOM 0 HB3 GLN A 115 16.543 9.090 -4.076 1.00 10.00 H new ATOM 0 HG2 GLN A 115 15.823 8.492 -6.242 1.00 10.00 H new ATOM 0 HG3 GLN A 115 17.274 9.442 -6.489 1.00 10.00 H new ATOM 0 HE21 GLN A 115 17.608 8.515 -8.552 1.00 10.00 H new ATOM 0 HE22 GLN A 115 18.208 6.864 -8.733 1.00 10.00 H new ATOM 1450 N GLY A 116 19.109 8.242 -1.943 1.00 10.00 N ATOM 1451 CA GLY A 116 19.222 8.517 -0.529 1.00 10.00 C ATOM 1452 C GLY A 116 18.068 7.949 0.261 1.00 10.00 C ATOM 1453 O GLY A 116 17.627 8.542 1.246 1.00 10.00 O ATOM 0 H GLY A 116 19.340 7.285 -2.211 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.156 8.099 -0.154 1.00 10.00 H new ATOM 0 HA3 GLY A 116 19.270 9.595 -0.374 1.00 10.00 H new ATOM 1457 N VAL A 117 17.578 6.796 -0.165 1.00 10.00 N ATOM 1458 CA VAL A 117 16.460 6.149 0.503 1.00 10.00 C ATOM 1459 C VAL A 117 16.756 4.675 0.768 1.00 10.00 C ATOM 1460 O VAL A 117 17.191 3.945 -0.121 1.00 10.00 O ATOM 1461 CB VAL A 117 15.166 6.265 -0.335 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.021 5.502 0.314 1.00 10.00 C ATOM 1463 CG2 VAL A 117 14.784 7.724 -0.544 1.00 10.00 C ATOM 0 H VAL A 117 17.938 6.288 -0.973 1.00 10.00 H new ATOM 0 HA VAL A 117 16.316 6.661 1.454 1.00 10.00 H new ATOM 0 HB VAL A 117 15.361 5.818 -1.310 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.124 5.602 -0.298 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.287 4.448 0.398 1.00 10.00 H new ATOM 0 HG13 VAL A 117 13.830 5.908 1.307 1.00 10.00 H new ATOM 0 HG21 VAL A 117 13.871 7.780 -1.136 1.00 10.00 H new ATOM 0 HG22 VAL A 117 14.619 8.199 0.423 1.00 10.00 H new ATOM 0 HG23 VAL A 117 15.589 8.239 -1.069 1.00 10.00 H new ATOM 1473 N SER A 118 16.547 4.259 2.005 1.00 10.00 N ATOM 1474 CA SER A 118 16.756 2.882 2.406 1.00 10.00 C ATOM 1475 C SER A 118 15.520 2.384 3.154 1.00 10.00 C ATOM 1476 O SER A 118 15.146 2.930 4.193 1.00 10.00 O ATOM 1477 CB SER A 118 18.019 2.774 3.265 1.00 10.00 C ATOM 1478 OG SER A 118 19.183 2.829 2.454 1.00 10.00 O ATOM 0 H SER A 118 16.228 4.868 2.759 1.00 10.00 H new ATOM 0 HA SER A 118 16.902 2.253 1.527 1.00 10.00 H new ATOM 0 HB2 SER A 118 18.039 3.584 3.994 1.00 10.00 H new ATOM 0 HB3 SER A 118 18.004 1.840 3.826 1.00 10.00 H new ATOM 0 HG SER A 118 19.942 2.451 2.945 1.00 10.00 H new ATOM 1484 N VAL A 119 14.881 1.357 2.613 1.00 10.00 N ATOM 1485 CA VAL A 119 13.666 0.816 3.203 1.00 10.00 C ATOM 1486 C VAL A 119 13.876 -0.587 3.759 1.00 10.00 C ATOM 1487 O VAL A 119 14.514 -1.431 3.134 1.00 10.00 O ATOM 1488 CB VAL A 119 12.510 0.779 2.181 1.00 10.00 C ATOM 1489 CG1 VAL A 119 11.990 2.175 1.913 1.00 10.00 C ATOM 1490 CG2 VAL A 119 12.948 0.138 0.880 1.00 10.00 C ATOM 0 H VAL A 119 15.185 0.881 1.764 1.00 10.00 H new ATOM 0 HA VAL A 119 13.405 1.485 4.023 1.00 10.00 H new ATOM 0 HB VAL A 119 11.710 0.176 2.611 1.00 10.00 H new ATOM 0 HG11 VAL A 119 11.176 2.127 1.190 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.625 2.612 2.842 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.794 2.792 1.513 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.112 0.127 0.181 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.772 0.710 0.452 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.276 -0.884 1.070 1.00 10.00 H new ATOM 1500 N SER A 120 13.335 -0.824 4.938 1.00 10.00 N ATOM 1501 CA SER A 120 13.433 -2.120 5.587 1.00 10.00 C ATOM 1502 C SER A 120 12.152 -2.406 6.360 1.00 10.00 C ATOM 1503 O SER A 120 11.586 -1.509 6.978 1.00 10.00 O ATOM 1504 CB SER A 120 14.643 -2.165 6.527 1.00 10.00 C ATOM 1505 OG SER A 120 15.862 -2.080 5.802 1.00 10.00 O ATOM 0 H SER A 120 12.816 -0.127 5.473 1.00 10.00 H new ATOM 0 HA SER A 120 13.568 -2.885 4.823 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.583 -1.343 7.240 1.00 10.00 H new ATOM 0 HB3 SER A 120 14.624 -3.090 7.104 1.00 10.00 H new ATOM 0 HG SER A 120 16.617 -2.109 6.426 1.00 10.00 H new ATOM 1511 N VAL A 121 11.692 -3.643 6.315 1.00 10.00 N ATOM 1512 CA VAL A 121 10.475 -4.026 7.011 1.00 10.00 C ATOM 1513 C VAL A 121 10.825 -4.764 8.298 1.00 10.00 C ATOM 1514 O VAL A 121 11.630 -5.695 8.294 1.00 10.00 O ATOM 1515 CB VAL A 121 9.561 -4.898 6.119 1.00 10.00 C ATOM 1516 CG1 VAL A 121 10.349 -6.021 5.472 1.00 10.00 C ATOM 1517 CG2 VAL A 121 8.392 -5.452 6.914 1.00 10.00 C ATOM 0 H VAL A 121 12.143 -4.401 5.803 1.00 10.00 H new ATOM 0 HA VAL A 121 9.924 -3.118 7.256 1.00 10.00 H new ATOM 0 HB VAL A 121 9.161 -4.263 5.328 1.00 10.00 H new ATOM 0 HG11 VAL A 121 9.684 -6.620 4.850 1.00 10.00 H new ATOM 0 HG12 VAL A 121 11.143 -5.600 4.855 1.00 10.00 H new ATOM 0 HG13 VAL A 121 10.787 -6.651 6.246 1.00 10.00 H new ATOM 0 HG21 VAL A 121 7.765 -6.061 6.263 1.00 10.00 H new ATOM 0 HG22 VAL A 121 8.767 -6.065 7.734 1.00 10.00 H new ATOM 0 HG23 VAL A 121 7.803 -4.628 7.317 1.00 10.00 H new ATOM 1527 N SER A 122 10.245 -4.323 9.400 1.00 10.00 N ATOM 1528 CA SER A 122 10.511 -4.926 10.692 1.00 10.00 C ATOM 1529 C SER A 122 9.309 -4.786 11.620 1.00 10.00 C ATOM 1530 O SER A 122 8.749 -3.697 11.755 1.00 10.00 O ATOM 1531 CB SER A 122 11.741 -4.266 11.312 1.00 10.00 C ATOM 1532 OG SER A 122 12.895 -4.502 10.519 1.00 10.00 O ATOM 0 H SER A 122 9.584 -3.546 9.425 1.00 10.00 H new ATOM 0 HA SER A 122 10.699 -5.990 10.552 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.574 -3.193 11.408 1.00 10.00 H new ATOM 0 HB3 SER A 122 11.900 -4.655 12.318 1.00 10.00 H new ATOM 0 HG SER A 122 13.671 -4.069 10.933 1.00 10.00 H new ATOM 1538 N ALA A 123 8.917 -5.901 12.238 1.00 10.00 N ATOM 1539 CA ALA A 123 7.791 -5.941 13.172 1.00 10.00 C ATOM 1540 C ALA A 123 6.488 -5.494 12.511 1.00 10.00 C ATOM 1541 O ALA A 123 5.724 -4.710 13.082 1.00 10.00 O ATOM 1542 CB ALA A 123 8.092 -5.108 14.413 1.00 10.00 C ATOM 0 H ALA A 123 9.372 -6.804 12.105 1.00 10.00 H new ATOM 0 HA ALA A 123 7.655 -6.978 13.479 1.00 10.00 H new ATOM 0 HB1 ALA A 123 7.243 -5.151 15.095 1.00 10.00 H new ATOM 0 HB2 ALA A 123 8.977 -5.504 14.911 1.00 10.00 H new ATOM 0 HB3 ALA A 123 8.272 -4.073 14.122 1.00 10.00 H new ATOM 1548 N ASN A 124 6.240 -6.012 11.307 1.00 10.00 N ATOM 1549 CA ASN A 124 5.034 -5.687 10.543 1.00 10.00 C ATOM 1550 C ASN A 124 4.964 -4.196 10.269 1.00 10.00 C ATOM 1551 O ASN A 124 3.888 -3.602 10.232 1.00 10.00 O ATOM 1552 CB ASN A 124 3.770 -6.132 11.288 1.00 10.00 C ATOM 1553 CG ASN A 124 3.629 -7.637 11.369 1.00 10.00 C ATOM 1554 OD1 ASN A 124 4.014 -8.364 10.451 1.00 10.00 O ATOM 1555 ND2 ASN A 124 3.073 -8.116 12.469 1.00 10.00 N ATOM 0 H ASN A 124 6.866 -6.665 10.836 1.00 10.00 H new ATOM 0 HA ASN A 124 5.088 -6.225 9.597 1.00 10.00 H new ATOM 0 HB2 ASN A 124 3.786 -5.719 12.297 1.00 10.00 H new ATOM 0 HB3 ASN A 124 2.895 -5.717 10.787 1.00 10.00 H new ATOM 0 HD21 ASN A 124 2.949 -9.122 12.581 1.00 10.00 H new ATOM 0 HD22 ASN A 124 2.768 -7.479 13.205 1.00 10.00 H new ATOM 1562 N LYS A 125 6.122 -3.592 10.084 1.00 10.00 N ATOM 1563 CA LYS A 125 6.204 -2.171 9.821 1.00 10.00 C ATOM 1564 C LYS A 125 7.259 -1.892 8.770 1.00 10.00 C ATOM 1565 O LYS A 125 8.374 -2.404 8.852 1.00 10.00 O ATOM 1566 CB LYS A 125 6.565 -1.408 11.097 1.00 10.00 C ATOM 1567 CG LYS A 125 6.531 0.103 10.928 1.00 10.00 C ATOM 1568 CD LYS A 125 7.326 0.810 12.014 1.00 10.00 C ATOM 1569 CE LYS A 125 6.549 0.901 13.318 1.00 10.00 C ATOM 1570 NZ LYS A 125 7.155 0.064 14.385 1.00 10.00 N ATOM 0 H LYS A 125 7.024 -4.068 10.112 1.00 10.00 H new ATOM 0 HA LYS A 125 5.230 -1.838 9.463 1.00 10.00 H new ATOM 0 HB2 LYS A 125 5.873 -1.693 11.890 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.562 -1.708 11.421 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.934 0.369 9.951 1.00 10.00 H new ATOM 0 HG3 LYS A 125 5.497 0.448 10.951 1.00 10.00 H new ATOM 0 HD2 LYS A 125 8.261 0.276 12.185 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.588 1.813 11.677 1.00 10.00 H new ATOM 0 HE2 LYS A 125 6.514 1.939 13.648 1.00 10.00 H new ATOM 0 HE3 LYS A 125 5.520 0.585 13.150 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 6.595 0.154 15.257 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 7.166 -0.931 14.082 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 8.129 0.382 14.564 1.00 10.00 H new ATOM 1584 N LEU A 126 6.899 -1.103 7.781 1.00 10.00 N ATOM 1585 CA LEU A 126 7.837 -0.728 6.745 1.00 10.00 C ATOM 1586 C LEU A 126 8.538 0.537 7.198 1.00 10.00 C ATOM 1587 O LEU A 126 7.892 1.550 7.449 1.00 10.00 O ATOM 1588 CB LEU A 126 7.108 -0.489 5.421 1.00 10.00 C ATOM 1589 CG LEU A 126 6.732 -1.753 4.646 1.00 10.00 C ATOM 1590 CD1 LEU A 126 5.599 -1.463 3.678 1.00 10.00 C ATOM 1591 CD2 LEU A 126 7.943 -2.296 3.902 1.00 10.00 C ATOM 0 H LEU A 126 5.964 -0.709 7.672 1.00 10.00 H new ATOM 0 HA LEU A 126 8.560 -1.527 6.582 1.00 10.00 H new ATOM 0 HB2 LEU A 126 6.199 0.078 5.623 1.00 10.00 H new ATOM 0 HB3 LEU A 126 7.738 0.134 4.785 1.00 10.00 H new ATOM 0 HG LEU A 126 6.394 -2.509 5.355 1.00 10.00 H new ATOM 0 HD11 LEU A 126 5.343 -2.372 3.134 1.00 10.00 H new ATOM 0 HD12 LEU A 126 4.727 -1.114 4.232 1.00 10.00 H new ATOM 0 HD13 LEU A 126 5.912 -0.694 2.972 1.00 10.00 H new ATOM 0 HD21 LEU A 126 7.661 -3.196 3.355 1.00 10.00 H new ATOM 0 HD22 LEU A 126 8.307 -1.544 3.201 1.00 10.00 H new ATOM 0 HD23 LEU A 126 8.730 -2.538 4.616 1.00 10.00 H new ATOM 1603 N LEU A 127 9.849 0.481 7.309 1.00 10.00 N ATOM 1604 CA LEU A 127 10.613 1.629 7.758 1.00 10.00 C ATOM 1605 C LEU A 127 11.410 2.232 6.624 1.00 10.00 C ATOM 1606 O LEU A 127 12.246 1.573 6.010 1.00 10.00 O ATOM 1607 CB LEU A 127 11.544 1.249 8.909 1.00 10.00 C ATOM 1608 CG LEU A 127 10.926 1.392 10.296 1.00 10.00 C ATOM 1609 CD1 LEU A 127 11.074 0.103 11.078 1.00 10.00 C ATOM 1610 CD2 LEU A 127 11.569 2.546 11.048 1.00 10.00 C ATOM 0 H LEU A 127 10.408 -0.345 7.095 1.00 10.00 H new ATOM 0 HA LEU A 127 9.903 2.375 8.115 1.00 10.00 H new ATOM 0 HB2 LEU A 127 11.866 0.217 8.773 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.438 1.871 8.857 1.00 10.00 H new ATOM 0 HG LEU A 127 9.863 1.605 10.180 1.00 10.00 H new ATOM 0 HD11 LEU A 127 10.628 0.223 12.065 1.00 10.00 H new ATOM 0 HD12 LEU A 127 10.570 -0.704 10.547 1.00 10.00 H new ATOM 0 HD13 LEU A 127 12.132 -0.138 11.185 1.00 10.00 H new ATOM 0 HD21 LEU A 127 11.116 2.634 12.036 1.00 10.00 H new ATOM 0 HD22 LEU A 127 12.638 2.361 11.154 1.00 10.00 H new ATOM 0 HD23 LEU A 127 11.415 3.472 10.494 1.00 10.00 H new ATOM 1622 N VAL A 128 11.126 3.487 6.343 1.00 10.00 N ATOM 1623 CA VAL A 128 11.814 4.210 5.299 1.00 10.00 C ATOM 1624 C VAL A 128 12.769 5.203 5.938 1.00 10.00 C ATOM 1625 O VAL A 128 12.338 6.108 6.650 1.00 10.00 O ATOM 1626 CB VAL A 128 10.817 4.975 4.409 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.459 5.372 3.093 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.560 4.153 4.173 1.00 10.00 C ATOM 0 H VAL A 128 10.414 4.031 6.831 1.00 10.00 H new ATOM 0 HA VAL A 128 12.357 3.497 4.679 1.00 10.00 H new ATOM 0 HB VAL A 128 10.530 5.887 4.932 1.00 10.00 H new ATOM 0 HG11 VAL A 128 10.734 5.911 2.483 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.319 6.013 3.286 1.00 10.00 H new ATOM 0 HG13 VAL A 128 11.786 4.477 2.563 1.00 10.00 H new ATOM 0 HG21 VAL A 128 8.871 4.715 3.542 1.00 10.00 H new ATOM 0 HG22 VAL A 128 9.824 3.218 3.679 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.082 3.937 5.128 1.00 10.00 H new ATOM 1638 N GLN A 129 14.054 5.053 5.677 1.00 10.00 N ATOM 1639 CA GLN A 129 15.045 5.943 6.254 1.00 10.00 C ATOM 1640 C GLN A 129 15.997 6.456 5.185 1.00 10.00 C ATOM 1641 O GLN A 129 16.407 5.710 4.297 1.00 10.00 O ATOM 1642 CB GLN A 129 15.835 5.226 7.353 1.00 10.00 C ATOM 1643 CG GLN A 129 14.998 4.831 8.559 1.00 10.00 C ATOM 1644 CD GLN A 129 15.846 4.526 9.777 1.00 10.00 C ATOM 1645 OE1 GLN A 129 16.151 5.415 10.571 1.00 10.00 O ATOM 1646 NE2 GLN A 129 16.239 3.272 9.935 1.00 10.00 N ATOM 0 H GLN A 129 14.436 4.326 5.072 1.00 10.00 H new ATOM 0 HA GLN A 129 14.521 6.793 6.691 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.292 4.331 6.932 1.00 10.00 H new ATOM 0 HB3 GLN A 129 16.647 5.873 7.684 1.00 10.00 H new ATOM 0 HG2 GLN A 129 14.304 5.637 8.796 1.00 10.00 H new ATOM 0 HG3 GLN A 129 14.397 3.956 8.310 1.00 10.00 H new ATOM 0 HE21 GLN A 129 15.966 2.562 9.255 1.00 10.00 H new ATOM 0 HE22 GLN A 129 16.815 3.015 10.737 1.00 10.00 H new ATOM 1655 N PRO A 130 16.338 7.745 5.240 1.00 10.00 N ATOM 1656 CA PRO A 130 17.259 8.345 4.286 1.00 10.00 C ATOM 1657 C PRO A 130 18.709 8.031 4.630 1.00 10.00 C ATOM 1658 O PRO A 130 19.096 8.048 5.801 1.00 10.00 O ATOM 1659 CB PRO A 130 16.981 9.840 4.426 1.00 10.00 C ATOM 1660 CG PRO A 130 16.515 10.014 5.832 1.00 10.00 C ATOM 1661 CD PRO A 130 15.844 8.721 6.227 1.00 10.00 C ATOM 0 HA PRO A 130 17.116 7.970 3.273 1.00 10.00 H new ATOM 0 HB2 PRO A 130 17.878 10.428 4.231 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.223 10.169 3.715 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.353 10.233 6.494 1.00 10.00 H new ATOM 0 HG3 PRO A 130 15.820 10.850 5.909 1.00 10.00 H new ATOM 0 HD2 PRO A 130 16.108 8.429 7.243 1.00 10.00 H new ATOM 0 HD3 PRO A 130 14.758 8.808 6.192 1.00 10.00 H new ATOM 1669 N VAL A 131 19.507 7.732 3.621 1.00 10.00 N ATOM 1670 CA VAL A 131 20.912 7.432 3.842 1.00 10.00 C ATOM 1671 C VAL A 131 21.771 8.634 3.455 1.00 10.00 C ATOM 1672 O VAL A 131 21.366 9.440 2.615 1.00 10.00 O ATOM 1673 CB VAL A 131 21.380 6.173 3.072 1.00 10.00 C ATOM 1674 CG1 VAL A 131 21.143 4.928 3.907 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.679 6.053 1.728 1.00 10.00 C ATOM 0 H VAL A 131 19.210 7.690 2.646 1.00 10.00 H new ATOM 0 HA VAL A 131 21.032 7.220 4.904 1.00 10.00 H new ATOM 0 HB VAL A 131 22.449 6.273 2.882 1.00 10.00 H new ATOM 0 HG11 VAL A 131 21.476 4.050 3.354 1.00 10.00 H new ATOM 0 HG12 VAL A 131 21.702 5.003 4.840 1.00 10.00 H new ATOM 0 HG13 VAL A 131 20.080 4.835 4.128 1.00 10.00 H new ATOM 0 HG21 VAL A 131 21.030 5.159 1.213 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.603 5.983 1.884 1.00 10.00 H new ATOM 0 HG23 VAL A 131 20.901 6.931 1.122 1.00 10.00 H new