USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=28 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 -110:sc= 0.406 USER MOD Set 1.2: A 125 LYS NZ :NH3+ -134:sc= 0.602 (180deg=0) USER MOD Set 2.1: A 63 THR OG1 : rot -26:sc= 1.23 USER MOD Set 2.2: A 66 THR OG1 : rot 180:sc= 1.13 USER MOD Set 3.1: A 58 THR OG1 : rot -68:sc= 0.157 USER MOD Set 3.2: A 60 MET CE :methyl 172:sc= 0 (180deg=-0.0445) USER MOD Set 4.1: A 56 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Set 4.2: A 97 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 55 TYR OH : rot 180:sc= 1.06 USER MOD Set 5.2: A 75 SER OG : rot 170:sc= 1.31 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 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -143:sc= -0.705 (180deg=-2.26!) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 77 MET CE :methyl 138:sc= -0.423 (180deg=-2.4!) USER MOD Single : A 78 GLN : amide:sc= -0.225 K(o=-0.22,f=-4.3!) USER MOD Single : A 81 TYR OH : rot 60:sc= -2.09! USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= -0.0607 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 -66:sc= 1.13 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.058 USER MOD Single : A 99 THR OG1 : rot 55:sc= 0.0657 USER MOD Single : A 100 SER OG : rot 180:sc= 0.461 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 106 THR OG1 : rot 83:sc= 1.27 USER MOD Single : A 109 SER OG : rot -96:sc= 1.28 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.094 USER MOD Single : A 115 GLN :FLIP amide:sc= -1.8 F(o=-2.3!,f=-1.8) USER MOD Single : A 118 SER OG : rot -170:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= -0.0336 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.77 K(o=-1.8,f=-3.7!) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 510 N TYR A 53 0.849 -11.561 -1.253 1.00 10.00 N ATOM 511 CA TYR A 53 0.609 -10.399 -2.090 1.00 10.00 C ATOM 512 C TYR A 53 1.903 -9.951 -2.762 1.00 10.00 C ATOM 513 O TYR A 53 2.921 -9.750 -2.097 1.00 10.00 O ATOM 514 CB TYR A 53 0.023 -9.276 -1.227 1.00 10.00 C ATOM 515 CG TYR A 53 -0.097 -7.930 -1.907 1.00 10.00 C ATOM 516 CD1 TYR A 53 -0.766 -7.783 -3.116 1.00 10.00 C ATOM 517 CD2 TYR A 53 0.447 -6.798 -1.317 1.00 10.00 C ATOM 518 CE1 TYR A 53 -0.882 -6.543 -3.718 1.00 10.00 C ATOM 519 CE2 TYR A 53 0.331 -5.559 -1.909 1.00 10.00 C ATOM 520 CZ TYR A 53 -0.332 -5.435 -3.110 1.00 10.00 C ATOM 521 OH TYR A 53 -0.454 -4.195 -3.698 1.00 10.00 O ATOM 0 HA TYR A 53 -0.101 -10.653 -2.877 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -0.966 -9.581 -0.886 1.00 10.00 H new ATOM 0 HB3 TYR A 53 0.645 -9.161 -0.339 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.201 -8.649 -3.592 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.971 -6.890 -0.377 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -1.401 -6.444 -4.660 1.00 10.00 H new ATOM 0 HE2 TYR A 53 0.758 -4.689 -1.433 1.00 10.00 H new ATOM 0 HH TYR A 53 -0.011 -3.523 -3.139 1.00 10.00 H new ATOM 531 N THR A 54 1.865 -9.824 -4.079 1.00 10.00 N ATOM 532 CA THR A 54 3.026 -9.394 -4.836 1.00 10.00 C ATOM 533 C THR A 54 3.220 -7.890 -4.709 1.00 10.00 C ATOM 534 O THR A 54 2.382 -7.105 -5.151 1.00 10.00 O ATOM 535 CB THR A 54 2.893 -9.759 -6.320 1.00 10.00 C ATOM 536 OG1 THR A 54 2.389 -11.094 -6.443 1.00 10.00 O ATOM 537 CG2 THR A 54 4.236 -9.651 -7.026 1.00 10.00 C ATOM 0 H THR A 54 1.039 -10.014 -4.646 1.00 10.00 H new ATOM 0 HA THR A 54 3.892 -9.912 -4.423 1.00 10.00 H new ATOM 0 HB THR A 54 2.200 -9.060 -6.788 1.00 10.00 H new ATOM 0 HG1 THR A 54 2.303 -11.325 -7.391 1.00 10.00 H new ATOM 0 HG21 THR A 54 4.117 -9.915 -8.077 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.607 -8.629 -6.948 1.00 10.00 H new ATOM 0 HG23 THR A 54 4.948 -10.332 -6.560 1.00 10.00 H new ATOM 545 N TYR A 55 4.323 -7.503 -4.102 1.00 10.00 N ATOM 546 CA TYR A 55 4.641 -6.101 -3.908 1.00 10.00 C ATOM 547 C TYR A 55 5.349 -5.556 -5.137 1.00 10.00 C ATOM 548 O TYR A 55 6.440 -6.011 -5.488 1.00 10.00 O ATOM 549 CB TYR A 55 5.516 -5.922 -2.665 1.00 10.00 C ATOM 550 CG TYR A 55 4.869 -6.428 -1.393 1.00 10.00 C ATOM 551 CD1 TYR A 55 3.972 -5.636 -0.689 1.00 10.00 C ATOM 552 CD2 TYR A 55 5.146 -7.697 -0.902 1.00 10.00 C ATOM 553 CE1 TYR A 55 3.370 -6.090 0.470 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.547 -8.161 0.255 1.00 10.00 C ATOM 555 CZ TYR A 55 3.661 -7.355 0.937 1.00 10.00 C ATOM 556 OH TYR A 55 3.066 -7.815 2.090 1.00 10.00 O ATOM 0 H TYR A 55 5.022 -8.147 -3.731 1.00 10.00 H new ATOM 0 HA TYR A 55 3.715 -5.546 -3.760 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.460 -6.446 -2.816 1.00 10.00 H new ATOM 0 HB3 TYR A 55 5.754 -4.865 -2.547 1.00 10.00 H new ATOM 0 HD1 TYR A 55 3.740 -4.646 -1.054 1.00 10.00 H new ATOM 0 HD2 TYR A 55 5.840 -8.332 -1.432 1.00 10.00 H new ATOM 0 HE1 TYR A 55 2.677 -5.459 1.006 1.00 10.00 H new ATOM 0 HE2 TYR A 55 4.773 -9.151 0.623 1.00 10.00 H new ATOM 0 HH TYR A 55 3.378 -8.724 2.279 1.00 10.00 H new ATOM 566 N GLN A 56 4.705 -4.611 -5.804 1.00 10.00 N ATOM 567 CA GLN A 56 5.257 -3.993 -7.003 1.00 10.00 C ATOM 568 C GLN A 56 4.842 -2.530 -7.089 1.00 10.00 C ATOM 569 O GLN A 56 3.876 -2.109 -6.448 1.00 10.00 O ATOM 570 CB GLN A 56 4.778 -4.739 -8.248 1.00 10.00 C ATOM 571 CG GLN A 56 3.270 -4.936 -8.298 1.00 10.00 C ATOM 572 CD GLN A 56 2.810 -5.650 -9.551 1.00 10.00 C ATOM 573 OE1 GLN A 56 3.543 -6.446 -10.133 1.00 10.00 O ATOM 574 NE2 GLN A 56 1.584 -5.381 -9.975 1.00 10.00 N ATOM 0 H GLN A 56 3.790 -4.251 -5.533 1.00 10.00 H new ATOM 0 HA GLN A 56 6.344 -4.048 -6.948 1.00 10.00 H new ATOM 0 HB2 GLN A 56 5.094 -4.189 -9.135 1.00 10.00 H new ATOM 0 HB3 GLN A 56 5.265 -5.713 -8.287 1.00 10.00 H new ATOM 0 HG2 GLN A 56 2.954 -5.506 -7.424 1.00 10.00 H new ATOM 0 HG3 GLN A 56 2.780 -3.964 -8.239 1.00 10.00 H new ATOM 0 HE21 GLN A 56 1.003 -4.714 -9.466 1.00 10.00 H new ATOM 0 HE22 GLN A 56 1.221 -5.841 -10.810 1.00 10.00 H new ATOM 583 N ALA A 57 5.578 -1.761 -7.877 1.00 10.00 N ATOM 584 CA ALA A 57 5.282 -0.348 -8.063 1.00 10.00 C ATOM 585 C ALA A 57 4.384 -0.156 -9.274 1.00 10.00 C ATOM 586 O ALA A 57 4.789 -0.424 -10.407 1.00 10.00 O ATOM 587 CB ALA A 57 6.565 0.447 -8.231 1.00 10.00 C ATOM 0 H ALA A 57 6.388 -2.093 -8.400 1.00 10.00 H new ATOM 0 HA ALA A 57 4.762 0.017 -7.177 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.324 1.501 -8.369 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.185 0.330 -7.342 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.108 0.082 -9.103 1.00 10.00 H new ATOM 593 N THR A 58 3.172 0.309 -9.038 1.00 10.00 N ATOM 594 CA THR A 58 2.224 0.518 -10.117 1.00 10.00 C ATOM 595 C THR A 58 2.226 1.975 -10.566 1.00 10.00 C ATOM 596 O THR A 58 2.564 2.871 -9.795 1.00 10.00 O ATOM 597 CB THR A 58 0.799 0.117 -9.686 1.00 10.00 C ATOM 598 OG1 THR A 58 0.348 0.964 -8.629 1.00 10.00 O ATOM 599 CG2 THR A 58 0.759 -1.328 -9.222 1.00 10.00 C ATOM 0 H THR A 58 2.821 0.549 -8.111 1.00 10.00 H new ATOM 0 HA THR A 58 2.533 -0.113 -10.950 1.00 10.00 H new ATOM 0 HB THR A 58 0.143 0.228 -10.550 1.00 10.00 H new ATOM 0 HG1 THR A 58 0.872 0.785 -7.820 1.00 10.00 H new ATOM 0 HG21 THR A 58 -0.257 -1.586 -8.923 1.00 10.00 H new ATOM 0 HG22 THR A 58 1.075 -1.980 -10.036 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.430 -1.456 -8.373 1.00 10.00 H new ATOM 607 N PRO A 59 1.853 2.233 -11.829 1.00 10.00 N ATOM 608 CA PRO A 59 1.800 3.595 -12.370 1.00 10.00 C ATOM 609 C PRO A 59 0.733 4.436 -11.674 1.00 10.00 C ATOM 610 O PRO A 59 0.737 5.664 -11.749 1.00 10.00 O ATOM 611 CB PRO A 59 1.448 3.384 -13.845 1.00 10.00 C ATOM 612 CG PRO A 59 0.801 2.044 -13.898 1.00 10.00 C ATOM 613 CD PRO A 59 1.473 1.226 -12.834 1.00 10.00 C ATOM 0 HA PRO A 59 2.735 4.135 -12.225 1.00 10.00 H new ATOM 0 HB2 PRO A 59 0.775 4.162 -14.205 1.00 10.00 H new ATOM 0 HB3 PRO A 59 2.339 3.417 -14.472 1.00 10.00 H new ATOM 0 HG2 PRO A 59 -0.271 2.119 -13.715 1.00 10.00 H new ATOM 0 HG3 PRO A 59 0.926 1.588 -14.880 1.00 10.00 H new ATOM 0 HD2 PRO A 59 0.801 0.475 -12.418 1.00 10.00 H new ATOM 0 HD3 PRO A 59 2.343 0.696 -13.222 1.00 10.00 H new ATOM 621 N MET A 60 -0.172 3.757 -10.977 1.00 10.00 N ATOM 622 CA MET A 60 -1.243 4.431 -10.259 1.00 10.00 C ATOM 623 C MET A 60 -0.779 4.848 -8.866 1.00 10.00 C ATOM 624 O MET A 60 -1.503 5.527 -8.143 1.00 10.00 O ATOM 625 CB MET A 60 -2.487 3.539 -10.173 1.00 10.00 C ATOM 626 CG MET A 60 -2.226 2.147 -9.621 1.00 10.00 C ATOM 627 SD MET A 60 -3.732 1.166 -9.464 1.00 10.00 S ATOM 628 CE MET A 60 -3.051 -0.424 -8.989 1.00 10.00 C ATOM 0 H MET A 60 -0.184 2.740 -10.895 1.00 10.00 H new ATOM 0 HA MET A 60 -1.510 5.331 -10.813 1.00 10.00 H new ATOM 0 HB2 MET A 60 -3.230 4.032 -9.545 1.00 10.00 H new ATOM 0 HB3 MET A 60 -2.922 3.446 -11.168 1.00 10.00 H new ATOM 0 HG2 MET A 60 -1.525 1.627 -10.274 1.00 10.00 H new ATOM 0 HG3 MET A 60 -1.749 2.231 -8.645 1.00 10.00 H new ATOM 0 HE1 MET A 60 -3.861 -1.100 -8.716 1.00 10.00 H new ATOM 0 HE2 MET A 60 -2.493 -0.845 -9.825 1.00 10.00 H new ATOM 0 HE3 MET A 60 -2.384 -0.294 -8.136 1.00 10.00 H new ATOM 638 N ASP A 61 0.427 4.429 -8.489 1.00 10.00 N ATOM 639 CA ASP A 61 0.986 4.793 -7.191 1.00 10.00 C ATOM 640 C ASP A 61 1.539 6.207 -7.264 1.00 10.00 C ATOM 641 O ASP A 61 1.152 7.081 -6.492 1.00 10.00 O ATOM 642 CB ASP A 61 2.087 3.815 -6.765 1.00 10.00 C ATOM 643 CG ASP A 61 1.536 2.473 -6.326 1.00 10.00 C ATOM 644 OD1 ASP A 61 0.540 2.449 -5.573 1.00 10.00 O ATOM 645 OD2 ASP A 61 2.088 1.432 -6.746 1.00 10.00 O ATOM 0 H ASP A 61 1.032 3.840 -9.061 1.00 10.00 H new ATOM 0 HA ASP A 61 0.194 4.744 -6.444 1.00 10.00 H new ATOM 0 HB2 ASP A 61 2.777 3.666 -7.596 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.661 4.253 -5.948 1.00 10.00 H new ATOM 650 N GLY A 62 2.456 6.421 -8.195 1.00 10.00 N ATOM 651 CA GLY A 62 3.027 7.738 -8.386 1.00 10.00 C ATOM 652 C GLY A 62 4.299 7.955 -7.602 1.00 10.00 C ATOM 653 O GLY A 62 5.384 8.041 -8.178 1.00 10.00 O ATOM 0 H GLY A 62 2.816 5.703 -8.824 1.00 10.00 H new ATOM 0 HA2 GLY A 62 3.231 7.888 -9.446 1.00 10.00 H new ATOM 0 HA3 GLY A 62 2.295 8.490 -8.093 1.00 10.00 H new ATOM 657 N THR A 63 4.181 8.028 -6.288 1.00 10.00 N ATOM 658 CA THR A 63 5.344 8.269 -5.453 1.00 10.00 C ATOM 659 C THR A 63 5.597 7.125 -4.486 1.00 10.00 C ATOM 660 O THR A 63 4.739 6.264 -4.277 1.00 10.00 O ATOM 661 CB THR A 63 5.219 9.591 -4.662 1.00 10.00 C ATOM 662 OG1 THR A 63 4.189 9.492 -3.667 1.00 10.00 O ATOM 663 CG2 THR A 63 4.916 10.753 -5.595 1.00 10.00 C ATOM 0 H THR A 63 3.302 7.925 -5.781 1.00 10.00 H new ATOM 0 HA THR A 63 6.193 8.345 -6.133 1.00 10.00 H new ATOM 0 HB THR A 63 6.174 9.774 -4.168 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.525 8.829 -3.949 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.832 11.673 -5.016 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.721 10.855 -6.323 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.977 10.566 -6.116 1.00 10.00 H new ATOM 671 N LEU A 64 6.789 7.142 -3.901 1.00 10.00 N ATOM 672 CA LEU A 64 7.215 6.135 -2.944 1.00 10.00 C ATOM 673 C LEU A 64 6.242 6.046 -1.772 1.00 10.00 C ATOM 674 O LEU A 64 5.915 4.955 -1.307 1.00 10.00 O ATOM 675 CB LEU A 64 8.620 6.475 -2.434 1.00 10.00 C ATOM 676 CG LEU A 64 9.193 5.511 -1.398 1.00 10.00 C ATOM 677 CD1 LEU A 64 9.396 4.133 -2.006 1.00 10.00 C ATOM 678 CD2 LEU A 64 10.498 6.052 -0.839 1.00 10.00 C ATOM 0 H LEU A 64 7.490 7.861 -4.080 1.00 10.00 H new ATOM 0 HA LEU A 64 7.231 5.167 -3.444 1.00 10.00 H new ATOM 0 HB2 LEU A 64 9.298 6.511 -3.286 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.599 7.475 -2.002 1.00 10.00 H new ATOM 0 HG LEU A 64 8.481 5.418 -0.578 1.00 10.00 H new ATOM 0 HD11 LEU A 64 9.805 3.460 -1.253 1.00 10.00 H new ATOM 0 HD12 LEU A 64 8.440 3.746 -2.358 1.00 10.00 H new ATOM 0 HD13 LEU A 64 10.089 4.204 -2.844 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.895 5.354 -0.102 1.00 10.00 H new ATOM 0 HD22 LEU A 64 11.218 6.173 -1.648 1.00 10.00 H new ATOM 0 HD23 LEU A 64 10.319 7.017 -0.365 1.00 10.00 H new ATOM 690 N LYS A 65 5.775 7.202 -1.312 1.00 10.00 N ATOM 691 CA LYS A 65 4.840 7.258 -0.197 1.00 10.00 C ATOM 692 C LYS A 65 3.542 6.530 -0.543 1.00 10.00 C ATOM 693 O LYS A 65 3.103 5.651 0.196 1.00 10.00 O ATOM 694 CB LYS A 65 4.543 8.713 0.182 1.00 10.00 C ATOM 695 CG LYS A 65 3.709 8.854 1.448 1.00 10.00 C ATOM 696 CD LYS A 65 3.264 10.293 1.678 1.00 10.00 C ATOM 697 CE LYS A 65 4.426 11.185 2.091 1.00 10.00 C ATOM 698 NZ LYS A 65 3.968 12.533 2.520 1.00 10.00 N ATOM 0 H LYS A 65 6.030 8.112 -1.695 1.00 10.00 H new ATOM 0 HA LYS A 65 5.300 6.760 0.657 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.485 9.244 0.316 1.00 10.00 H new ATOM 0 HB3 LYS A 65 4.020 9.195 -0.644 1.00 10.00 H new ATOM 0 HG2 LYS A 65 2.833 8.210 1.379 1.00 10.00 H new ATOM 0 HG3 LYS A 65 4.289 8.512 2.305 1.00 10.00 H new ATOM 0 HD2 LYS A 65 2.812 10.684 0.766 1.00 10.00 H new ATOM 0 HD3 LYS A 65 2.495 10.317 2.450 1.00 10.00 H new ATOM 0 HE2 LYS A 65 4.974 10.712 2.906 1.00 10.00 H new ATOM 0 HE3 LYS A 65 5.120 11.286 1.256 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 4.790 13.108 2.793 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 3.467 12.996 1.735 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 3.326 12.439 3.333 1.00 10.00 H new ATOM 712 N THR A 66 2.952 6.885 -1.679 1.00 10.00 N ATOM 713 CA THR A 66 1.708 6.272 -2.126 1.00 10.00 C ATOM 714 C THR A 66 1.882 4.772 -2.365 1.00 10.00 C ATOM 715 O THR A 66 1.015 3.967 -2.012 1.00 10.00 O ATOM 716 CB THR A 66 1.214 6.941 -3.421 1.00 10.00 C ATOM 717 OG1 THR A 66 1.889 8.195 -3.607 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.287 7.179 -3.370 1.00 10.00 C ATOM 0 H THR A 66 3.318 7.598 -2.310 1.00 10.00 H new ATOM 0 HA THR A 66 0.970 6.416 -1.337 1.00 10.00 H new ATOM 0 HB THR A 66 1.434 6.275 -4.255 1.00 10.00 H new ATOM 0 HG1 THR A 66 1.573 8.617 -4.433 1.00 10.00 H new ATOM 0 HG21 THR A 66 -0.612 7.653 -4.296 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.803 6.226 -3.249 1.00 10.00 H new ATOM 0 HG23 THR A 66 -0.524 7.829 -2.528 1.00 10.00 H new ATOM 726 N MET A 67 3.018 4.407 -2.945 1.00 10.00 N ATOM 727 CA MET A 67 3.326 3.012 -3.240 1.00 10.00 C ATOM 728 C MET A 67 3.398 2.182 -1.961 1.00 10.00 C ATOM 729 O MET A 67 2.711 1.166 -1.828 1.00 10.00 O ATOM 730 CB MET A 67 4.654 2.923 -3.990 1.00 10.00 C ATOM 731 CG MET A 67 4.996 1.522 -4.472 1.00 10.00 C ATOM 732 SD MET A 67 6.680 1.406 -5.107 1.00 10.00 S ATOM 733 CE MET A 67 7.626 1.469 -3.591 1.00 10.00 C ATOM 0 H MET A 67 3.748 5.063 -3.223 1.00 10.00 H new ATOM 0 HA MET A 67 2.527 2.610 -3.863 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.621 3.594 -4.848 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.453 3.278 -3.338 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.871 0.817 -3.650 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.295 1.228 -5.253 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.540 2.039 -3.756 1.00 10.00 H new ATOM 0 HE2 MET A 67 7.034 1.950 -2.813 1.00 10.00 H new ATOM 0 HE3 MET A 67 7.881 0.456 -3.279 1.00 10.00 H new ATOM 743 N LEU A 68 4.217 2.630 -1.015 1.00 10.00 N ATOM 744 CA LEU A 68 4.380 1.924 0.252 1.00 10.00 C ATOM 745 C LEU A 68 3.076 1.907 1.040 1.00 10.00 C ATOM 746 O LEU A 68 2.784 0.942 1.750 1.00 10.00 O ATOM 747 CB LEU A 68 5.489 2.569 1.087 1.00 10.00 C ATOM 748 CG LEU A 68 6.887 2.506 0.472 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.870 3.299 1.312 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.348 1.062 0.333 1.00 10.00 C ATOM 0 H LEU A 68 4.778 3.478 -1.101 1.00 10.00 H new ATOM 0 HA LEU A 68 4.660 0.895 0.028 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.232 3.614 1.258 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.516 2.083 2.063 1.00 10.00 H new ATOM 0 HG LEU A 68 6.845 2.949 -0.523 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.861 3.244 0.861 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.550 4.340 1.361 1.00 10.00 H new ATOM 0 HD13 LEU A 68 7.906 2.883 2.319 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.345 1.039 -0.107 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.374 0.592 1.316 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.655 0.519 -0.310 1.00 10.00 H new ATOM 762 N GLU A 69 2.298 2.979 0.911 1.00 10.00 N ATOM 763 CA GLU A 69 1.017 3.084 1.595 1.00 10.00 C ATOM 764 C GLU A 69 0.101 1.942 1.180 1.00 10.00 C ATOM 765 O GLU A 69 -0.564 1.329 2.017 1.00 10.00 O ATOM 766 CB GLU A 69 0.351 4.424 1.282 1.00 10.00 C ATOM 767 CG GLU A 69 0.357 5.397 2.450 1.00 10.00 C ATOM 768 CD GLU A 69 -0.531 4.939 3.588 1.00 10.00 C ATOM 769 OE1 GLU A 69 -1.754 5.183 3.529 1.00 10.00 O ATOM 770 OE2 GLU A 69 -0.015 4.326 4.543 1.00 10.00 O ATOM 0 H GLU A 69 2.535 3.788 0.337 1.00 10.00 H new ATOM 0 HA GLU A 69 1.196 3.023 2.668 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.860 4.884 0.435 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.679 4.245 0.975 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.377 5.516 2.814 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.025 6.376 2.105 1.00 10.00 H new ATOM 777 N ARG A 70 0.083 1.653 -0.117 1.00 10.00 N ATOM 778 CA ARG A 70 -0.741 0.579 -0.651 1.00 10.00 C ATOM 779 C ARG A 70 -0.230 -0.772 -0.173 1.00 10.00 C ATOM 780 O ARG A 70 -1.010 -1.626 0.239 1.00 10.00 O ATOM 781 CB ARG A 70 -0.748 0.608 -2.180 1.00 10.00 C ATOM 782 CG ARG A 70 -1.659 -0.442 -2.799 1.00 10.00 C ATOM 783 CD ARG A 70 -1.325 -0.688 -4.262 1.00 10.00 C ATOM 784 NE ARG A 70 -1.310 0.548 -5.041 1.00 10.00 N ATOM 785 CZ ARG A 70 -2.381 1.079 -5.626 1.00 10.00 C ATOM 786 NH1 ARG A 70 -3.570 0.498 -5.511 1.00 10.00 N ATOM 787 NH2 ARG A 70 -2.254 2.199 -6.321 1.00 10.00 N ATOM 0 H ARG A 70 0.632 2.150 -0.818 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.759 0.727 -0.290 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.063 1.596 -2.516 1.00 10.00 H new ATOM 0 HB3 ARG A 70 0.268 0.457 -2.544 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -1.568 -1.375 -2.243 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -2.697 -0.120 -2.712 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -0.351 -1.172 -4.334 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -2.055 -1.375 -4.689 1.00 10.00 H new ATOM 0 HE ARG A 70 -0.420 1.036 -5.143 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -3.667 -0.362 -4.971 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -4.386 0.912 -5.963 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -1.341 2.647 -6.404 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -3.069 2.614 -6.773 1.00 10.00 H new ATOM 801 N TRP A 71 1.087 -0.947 -0.224 1.00 10.00 N ATOM 802 CA TRP A 71 1.719 -2.191 0.196 1.00 10.00 C ATOM 803 C TRP A 71 1.354 -2.531 1.635 1.00 10.00 C ATOM 804 O TRP A 71 0.882 -3.630 1.928 1.00 10.00 O ATOM 805 CB TRP A 71 3.240 -2.082 0.082 1.00 10.00 C ATOM 806 CG TRP A 71 3.757 -2.090 -1.325 1.00 10.00 C ATOM 807 CD1 TRP A 71 3.035 -1.949 -2.476 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.121 -2.256 -1.726 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.871 -2.012 -3.566 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.156 -2.200 -3.130 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.317 -2.445 -1.028 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.341 -2.326 -3.852 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.491 -2.571 -1.744 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.496 -2.512 -3.144 1.00 10.00 C ATOM 0 H TRP A 71 1.740 -0.237 -0.555 1.00 10.00 H new ATOM 0 HA TRP A 71 1.357 -2.982 -0.460 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.564 -1.163 0.570 1.00 10.00 H new ATOM 0 HB3 TRP A 71 3.693 -2.910 0.628 1.00 10.00 H new ATOM 0 HD1 TRP A 71 1.965 -1.809 -2.523 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.581 -1.932 -4.541 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.323 -2.492 0.051 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.347 -2.279 -4.931 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.422 -2.718 -1.216 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.431 -2.616 -3.675 1.00 10.00 H new ATOM 825 N ALA A 72 1.561 -1.570 2.522 1.00 10.00 N ATOM 826 CA ALA A 72 1.273 -1.761 3.931 1.00 10.00 C ATOM 827 C ALA A 72 -0.217 -1.945 4.177 1.00 10.00 C ATOM 828 O ALA A 72 -0.622 -2.849 4.902 1.00 10.00 O ATOM 829 CB ALA A 72 1.804 -0.593 4.742 1.00 10.00 C ATOM 0 H ALA A 72 1.929 -0.648 2.288 1.00 10.00 H new ATOM 0 HA ALA A 72 1.777 -2.673 4.253 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.580 -0.751 5.797 1.00 10.00 H new ATOM 0 HB2 ALA A 72 2.883 -0.517 4.607 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.331 0.329 4.405 1.00 10.00 H new ATOM 835 N ALA A 73 -1.033 -1.106 3.554 1.00 10.00 N ATOM 836 CA ALA A 73 -2.481 -1.177 3.728 1.00 10.00 C ATOM 837 C ALA A 73 -3.036 -2.519 3.270 1.00 10.00 C ATOM 838 O ALA A 73 -3.905 -3.098 3.925 1.00 10.00 O ATOM 839 CB ALA A 73 -3.159 -0.049 2.970 1.00 10.00 C ATOM 0 H ALA A 73 -0.719 -0.368 2.924 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.690 -1.073 4.793 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -4.238 -0.115 3.109 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.802 0.909 3.348 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.924 -0.131 1.909 1.00 10.00 H new ATOM 845 N ASP A 74 -2.514 -3.019 2.157 1.00 10.00 N ATOM 846 CA ASP A 74 -2.965 -4.289 1.597 1.00 10.00 C ATOM 847 C ASP A 74 -2.741 -5.439 2.573 1.00 10.00 C ATOM 848 O ASP A 74 -3.614 -6.287 2.758 1.00 10.00 O ATOM 849 CB ASP A 74 -2.238 -4.585 0.284 1.00 10.00 C ATOM 850 CG ASP A 74 -2.943 -5.642 -0.547 1.00 10.00 C ATOM 851 OD1 ASP A 74 -2.822 -6.842 -0.228 1.00 10.00 O ATOM 852 OD2 ASP A 74 -3.621 -5.275 -1.533 1.00 10.00 O ATOM 0 H ASP A 74 -1.775 -2.563 1.622 1.00 10.00 H new ATOM 0 HA ASP A 74 -4.035 -4.200 1.407 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -2.156 -3.666 -0.297 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -1.223 -4.916 0.502 1.00 10.00 H new ATOM 857 N SER A 75 -1.591 -5.443 3.232 1.00 10.00 N ATOM 858 CA SER A 75 -1.260 -6.515 4.162 1.00 10.00 C ATOM 859 C SER A 75 -1.530 -6.124 5.615 1.00 10.00 C ATOM 860 O SER A 75 -1.112 -6.829 6.534 1.00 10.00 O ATOM 861 CB SER A 75 0.205 -6.920 3.979 1.00 10.00 C ATOM 862 OG SER A 75 0.471 -7.248 2.625 1.00 10.00 O ATOM 0 H SER A 75 -0.875 -4.722 3.142 1.00 10.00 H new ATOM 0 HA SER A 75 -1.906 -7.364 3.937 1.00 10.00 H new ATOM 0 HB2 SER A 75 0.855 -6.104 4.295 1.00 10.00 H new ATOM 0 HB3 SER A 75 0.433 -7.774 4.617 1.00 10.00 H new ATOM 0 HG SER A 75 1.438 -7.345 2.496 1.00 10.00 H new ATOM 868 N ASN A 76 -2.243 -5.013 5.810 1.00 10.00 N ATOM 869 CA ASN A 76 -2.585 -4.525 7.152 1.00 10.00 C ATOM 870 C ASN A 76 -1.331 -4.283 7.994 1.00 10.00 C ATOM 871 O ASN A 76 -1.289 -4.593 9.187 1.00 10.00 O ATOM 872 CB ASN A 76 -3.523 -5.507 7.871 1.00 10.00 C ATOM 873 CG ASN A 76 -4.957 -5.418 7.381 1.00 10.00 C ATOM 874 OD1 ASN A 76 -5.212 -5.173 6.201 1.00 10.00 O ATOM 875 ND2 ASN A 76 -5.904 -5.611 8.284 1.00 10.00 N ATOM 0 H ASN A 76 -2.598 -4.430 5.052 1.00 10.00 H new ATOM 0 HA ASN A 76 -3.102 -3.573 7.030 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -3.157 -6.524 7.726 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -3.497 -5.308 8.942 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -6.886 -5.559 8.012 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -5.652 -5.812 9.252 1.00 10.00 H new ATOM 882 N MET A 77 -0.317 -3.718 7.360 1.00 10.00 N ATOM 883 CA MET A 77 0.947 -3.418 8.015 1.00 10.00 C ATOM 884 C MET A 77 1.046 -1.926 8.298 1.00 10.00 C ATOM 885 O MET A 77 0.191 -1.149 7.874 1.00 10.00 O ATOM 886 CB MET A 77 2.115 -3.847 7.127 1.00 10.00 C ATOM 887 CG MET A 77 2.135 -5.331 6.811 1.00 10.00 C ATOM 888 SD MET A 77 3.168 -5.728 5.385 1.00 10.00 S ATOM 889 CE MET A 77 4.742 -5.032 5.885 1.00 10.00 C ATOM 0 H MET A 77 -0.346 -3.454 6.375 1.00 10.00 H new ATOM 0 HA MET A 77 0.991 -3.967 8.955 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.073 -3.287 6.193 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.050 -3.578 7.618 1.00 10.00 H new ATOM 0 HG2 MET A 77 2.498 -5.878 7.681 1.00 10.00 H new ATOM 0 HG3 MET A 77 1.117 -5.672 6.623 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.545 -5.720 5.620 1.00 10.00 H new ATOM 0 HE2 MET A 77 4.897 -4.080 5.377 1.00 10.00 H new ATOM 0 HE3 MET A 77 4.743 -4.872 6.963 1.00 10.00 H new ATOM 899 N GLN A 78 2.084 -1.529 9.010 1.00 10.00 N ATOM 900 CA GLN A 78 2.283 -0.128 9.337 1.00 10.00 C ATOM 901 C GLN A 78 3.393 0.473 8.485 1.00 10.00 C ATOM 902 O GLN A 78 4.247 -0.252 7.967 1.00 10.00 O ATOM 903 CB GLN A 78 2.601 0.034 10.820 1.00 10.00 C ATOM 904 CG GLN A 78 1.374 0.345 11.658 1.00 10.00 C ATOM 905 CD GLN A 78 0.937 1.792 11.527 1.00 10.00 C ATOM 906 OE1 GLN A 78 1.052 2.400 10.458 1.00 10.00 O ATOM 907 NE2 GLN A 78 0.452 2.360 12.617 1.00 10.00 N ATOM 0 H GLN A 78 2.802 -2.156 9.373 1.00 10.00 H new ATOM 0 HA GLN A 78 1.359 0.408 9.120 1.00 10.00 H new ATOM 0 HB2 GLN A 78 3.064 -0.881 11.189 1.00 10.00 H new ATOM 0 HB3 GLN A 78 3.332 0.833 10.944 1.00 10.00 H new ATOM 0 HG2 GLN A 78 0.555 -0.308 11.355 1.00 10.00 H new ATOM 0 HG3 GLN A 78 1.587 0.126 12.704 1.00 10.00 H new ATOM 0 HE21 GLN A 78 0.373 1.823 13.480 1.00 10.00 H new ATOM 0 HE22 GLN A 78 0.156 3.336 12.595 1.00 10.00 H new ATOM 916 N LEU A 79 3.380 1.793 8.347 1.00 10.00 N ATOM 917 CA LEU A 79 4.377 2.487 7.544 1.00 10.00 C ATOM 918 C LEU A 79 5.011 3.641 8.312 1.00 10.00 C ATOM 919 O LEU A 79 4.331 4.411 8.989 1.00 10.00 O ATOM 920 CB LEU A 79 3.752 3.009 6.245 1.00 10.00 C ATOM 921 CG LEU A 79 4.666 3.906 5.403 1.00 10.00 C ATOM 922 CD1 LEU A 79 5.708 3.069 4.678 1.00 10.00 C ATOM 923 CD2 LEU A 79 3.853 4.728 4.415 1.00 10.00 C ATOM 0 H LEU A 79 2.689 2.404 8.782 1.00 10.00 H new ATOM 0 HA LEU A 79 5.160 1.768 7.303 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.445 2.157 5.639 1.00 10.00 H new ATOM 0 HB3 LEU A 79 2.848 3.566 6.492 1.00 10.00 H new ATOM 0 HG LEU A 79 5.182 4.595 6.071 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.349 3.721 4.084 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.313 2.530 5.407 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.209 2.355 4.022 1.00 10.00 H new ATOM 0 HD21 LEU A 79 4.522 5.357 3.828 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.306 4.060 3.749 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.147 5.357 4.958 1.00 10.00 H new ATOM 935 N SER A 80 6.320 3.737 8.194 1.00 10.00 N ATOM 936 CA SER A 80 7.098 4.776 8.833 1.00 10.00 C ATOM 937 C SER A 80 7.912 5.526 7.779 1.00 10.00 C ATOM 938 O SER A 80 9.007 5.100 7.401 1.00 10.00 O ATOM 939 CB SER A 80 8.019 4.147 9.878 1.00 10.00 C ATOM 940 OG SER A 80 7.392 4.075 11.147 1.00 10.00 O ATOM 0 H SER A 80 6.880 3.086 7.644 1.00 10.00 H new ATOM 0 HA SER A 80 6.435 5.485 9.329 1.00 10.00 H new ATOM 0 HB2 SER A 80 8.307 3.146 9.556 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.935 4.732 9.956 1.00 10.00 H new ATOM 0 HG SER A 80 7.820 4.709 11.760 1.00 10.00 H new ATOM 946 N TYR A 81 7.371 6.639 7.306 1.00 10.00 N ATOM 947 CA TYR A 81 8.034 7.448 6.296 1.00 10.00 C ATOM 948 C TYR A 81 8.882 8.514 6.974 1.00 10.00 C ATOM 949 O TYR A 81 8.374 9.561 7.373 1.00 10.00 O ATOM 950 CB TYR A 81 6.990 8.100 5.384 1.00 10.00 C ATOM 951 CG TYR A 81 7.506 8.508 4.021 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.731 7.562 3.030 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.741 9.843 3.718 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.181 7.933 1.779 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.187 10.224 2.468 1.00 10.00 C ATOM 956 CZ TYR A 81 8.405 9.267 1.501 1.00 10.00 C ATOM 957 OH TYR A 81 8.853 9.644 0.255 1.00 10.00 O ATOM 0 H TYR A 81 6.468 7.004 7.609 1.00 10.00 H new ATOM 0 HA TYR A 81 8.680 6.813 5.689 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.160 7.406 5.250 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.590 8.982 5.885 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.551 6.518 3.242 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.572 10.596 4.473 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.357 7.184 1.021 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.364 11.267 2.249 1.00 10.00 H new ATOM 0 HH TYR A 81 8.204 9.366 -0.424 1.00 10.00 H new ATOM 967 N ASN A 82 10.171 8.248 7.103 1.00 10.00 N ATOM 968 CA ASN A 82 11.076 9.182 7.755 1.00 10.00 C ATOM 969 C ASN A 82 11.876 9.972 6.732 1.00 10.00 C ATOM 970 O ASN A 82 13.020 10.350 6.974 1.00 10.00 O ATOM 971 CB ASN A 82 12.019 8.441 8.706 1.00 10.00 C ATOM 972 CG ASN A 82 11.318 7.961 9.963 1.00 10.00 C ATOM 973 OD1 ASN A 82 11.269 8.667 10.969 1.00 10.00 O ATOM 974 ND2 ASN A 82 10.780 6.750 9.920 1.00 10.00 N ATOM 0 H ASN A 82 10.615 7.394 6.765 1.00 10.00 H new ATOM 0 HA ASN A 82 10.474 9.883 8.333 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.454 7.586 8.188 1.00 10.00 H new ATOM 0 HB3 ASN A 82 12.842 9.100 8.982 1.00 10.00 H new ATOM 0 HD21 ASN A 82 10.305 6.374 10.740 1.00 10.00 H new ATOM 0 HD22 ASN A 82 10.841 6.195 9.067 1.00 10.00 H new ATOM 981 N LEU A 83 11.273 10.213 5.581 1.00 10.00 N ATOM 982 CA LEU A 83 11.927 10.974 4.537 1.00 10.00 C ATOM 983 C LEU A 83 11.491 12.427 4.621 1.00 10.00 C ATOM 984 O LEU A 83 10.323 12.712 4.889 1.00 10.00 O ATOM 985 CB LEU A 83 11.600 10.404 3.157 1.00 10.00 C ATOM 986 CG LEU A 83 12.029 8.954 2.937 1.00 10.00 C ATOM 987 CD1 LEU A 83 11.765 8.529 1.504 1.00 10.00 C ATOM 988 CD2 LEU A 83 13.496 8.767 3.287 1.00 10.00 C ATOM 0 H LEU A 83 10.333 9.892 5.348 1.00 10.00 H new ATOM 0 HA LEU A 83 13.006 10.908 4.680 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.524 10.477 2.996 1.00 10.00 H new ATOM 0 HB3 LEU A 83 12.078 11.027 2.401 1.00 10.00 H new ATOM 0 HG LEU A 83 11.437 8.321 3.598 1.00 10.00 H new ATOM 0 HD11 LEU A 83 12.077 7.494 1.368 1.00 10.00 H new ATOM 0 HD12 LEU A 83 10.700 8.618 1.288 1.00 10.00 H new ATOM 0 HD13 LEU A 83 12.328 9.170 0.825 1.00 10.00 H new ATOM 0 HD21 LEU A 83 13.780 7.727 3.123 1.00 10.00 H new ATOM 0 HD22 LEU A 83 14.106 9.413 2.656 1.00 10.00 H new ATOM 0 HD23 LEU A 83 13.656 9.026 4.334 1.00 10.00 H new ATOM 1000 N PRO A 84 12.424 13.363 4.402 1.00 10.00 N ATOM 1001 CA PRO A 84 12.137 14.799 4.463 1.00 10.00 C ATOM 1002 C PRO A 84 11.052 15.211 3.477 1.00 10.00 C ATOM 1003 O PRO A 84 10.298 16.153 3.719 1.00 10.00 O ATOM 1004 CB PRO A 84 13.474 15.457 4.096 1.00 10.00 C ATOM 1005 CG PRO A 84 14.264 14.385 3.431 1.00 10.00 C ATOM 1006 CD PRO A 84 13.834 13.102 4.077 1.00 10.00 C ATOM 0 HA PRO A 84 11.763 15.095 5.443 1.00 10.00 H new ATOM 0 HB2 PRO A 84 13.325 16.308 3.431 1.00 10.00 H new ATOM 0 HB3 PRO A 84 13.986 15.831 4.983 1.00 10.00 H new ATOM 0 HG2 PRO A 84 14.073 14.366 2.358 1.00 10.00 H new ATOM 0 HG3 PRO A 84 15.334 14.549 3.561 1.00 10.00 H new ATOM 0 HD2 PRO A 84 13.944 12.252 3.403 1.00 10.00 H new ATOM 0 HD3 PRO A 84 14.421 12.880 4.968 1.00 10.00 H new ATOM 1014 N SER A 85 10.982 14.503 2.360 1.00 10.00 N ATOM 1015 CA SER A 85 9.991 14.785 1.337 1.00 10.00 C ATOM 1016 C SER A 85 9.621 13.506 0.595 1.00 10.00 C ATOM 1017 O SER A 85 10.258 12.466 0.776 1.00 10.00 O ATOM 1018 CB SER A 85 10.532 15.820 0.350 1.00 10.00 C ATOM 1019 OG SER A 85 11.007 16.974 1.027 1.00 10.00 O ATOM 0 H SER A 85 11.604 13.725 2.140 1.00 10.00 H new ATOM 0 HA SER A 85 9.099 15.186 1.818 1.00 10.00 H new ATOM 0 HB2 SER A 85 11.339 15.381 -0.236 1.00 10.00 H new ATOM 0 HB3 SER A 85 9.747 16.103 -0.351 1.00 10.00 H new ATOM 0 HG SER A 85 11.349 17.619 0.373 1.00 10.00 H new ATOM 1025 N ASP A 86 8.588 13.592 -0.228 1.00 10.00 N ATOM 1026 CA ASP A 86 8.138 12.455 -1.014 1.00 10.00 C ATOM 1027 C ASP A 86 8.910 12.399 -2.323 1.00 10.00 C ATOM 1028 O ASP A 86 9.305 13.434 -2.864 1.00 10.00 O ATOM 1029 CB ASP A 86 6.633 12.547 -1.293 1.00 10.00 C ATOM 1030 CG ASP A 86 6.291 13.565 -2.367 1.00 10.00 C ATOM 1031 OD1 ASP A 86 6.590 14.762 -2.177 1.00 10.00 O ATOM 1032 OD2 ASP A 86 5.718 13.168 -3.403 1.00 10.00 O ATOM 0 H ASP A 86 8.043 14.443 -0.369 1.00 10.00 H new ATOM 0 HA ASP A 86 8.324 11.544 -0.446 1.00 10.00 H new ATOM 0 HB2 ASP A 86 6.265 11.567 -1.598 1.00 10.00 H new ATOM 0 HB3 ASP A 86 6.113 12.810 -0.372 1.00 10.00 H new ATOM 1037 N TYR A 87 9.143 11.193 -2.815 1.00 10.00 N ATOM 1038 CA TYR A 87 9.878 11.017 -4.058 1.00 10.00 C ATOM 1039 C TYR A 87 9.065 10.203 -5.053 1.00 10.00 C ATOM 1040 O TYR A 87 8.375 9.253 -4.677 1.00 10.00 O ATOM 1041 CB TYR A 87 11.229 10.349 -3.789 1.00 10.00 C ATOM 1042 CG TYR A 87 12.051 11.073 -2.744 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.457 12.389 -2.937 1.00 10.00 C ATOM 1044 CD2 TYR A 87 12.411 10.445 -1.560 1.00 10.00 C ATOM 1045 CE1 TYR A 87 13.197 13.056 -1.977 1.00 10.00 C ATOM 1046 CE2 TYR A 87 13.153 11.106 -0.599 1.00 10.00 C ATOM 1047 CZ TYR A 87 13.541 12.409 -0.811 1.00 10.00 C ATOM 1048 OH TYR A 87 14.274 13.066 0.148 1.00 10.00 O ATOM 0 H TYR A 87 8.836 10.325 -2.376 1.00 10.00 H new ATOM 0 HA TYR A 87 10.060 12.000 -4.493 1.00 10.00 H new ATOM 0 HB2 TYR A 87 11.062 9.322 -3.464 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.795 10.301 -4.719 1.00 10.00 H new ATOM 0 HD1 TYR A 87 12.190 12.899 -3.851 1.00 10.00 H new ATOM 0 HD2 TYR A 87 12.107 9.423 -1.387 1.00 10.00 H new ATOM 0 HE1 TYR A 87 13.503 14.079 -2.141 1.00 10.00 H new ATOM 0 HE2 TYR A 87 13.427 10.601 0.315 1.00 10.00 H new ATOM 0 HH TYR A 87 14.430 12.467 0.908 1.00 10.00 H new ATOM 1058 N THR A 88 9.142 10.587 -6.316 1.00 10.00 N ATOM 1059 CA THR A 88 8.411 9.911 -7.373 1.00 10.00 C ATOM 1060 C THR A 88 9.172 8.686 -7.870 1.00 10.00 C ATOM 1061 O THR A 88 10.404 8.640 -7.788 1.00 10.00 O ATOM 1062 CB THR A 88 8.173 10.873 -8.552 1.00 10.00 C ATOM 1063 OG1 THR A 88 8.017 12.211 -8.059 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.939 10.480 -9.347 1.00 10.00 C ATOM 0 H THR A 88 9.710 11.372 -6.636 1.00 10.00 H new ATOM 0 HA THR A 88 7.454 9.587 -6.963 1.00 10.00 H new ATOM 0 HB THR A 88 9.038 10.817 -9.213 1.00 10.00 H new ATOM 0 HG1 THR A 88 7.867 12.821 -8.811 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.800 11.179 -10.172 1.00 10.00 H new ATOM 0 HG22 THR A 88 7.067 9.473 -9.743 1.00 10.00 H new ATOM 0 HG23 THR A 88 6.064 10.506 -8.697 1.00 10.00 H new ATOM 1072 N LEU A 89 8.432 7.688 -8.354 1.00 10.00 N ATOM 1073 CA LEU A 89 9.027 6.471 -8.881 1.00 10.00 C ATOM 1074 C LEU A 89 10.017 6.809 -9.992 1.00 10.00 C ATOM 1075 O LEU A 89 9.649 7.423 -10.995 1.00 10.00 O ATOM 1076 CB LEU A 89 7.929 5.553 -9.426 1.00 10.00 C ATOM 1077 CG LEU A 89 7.238 4.631 -8.411 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.616 4.974 -6.979 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.728 4.681 -8.590 1.00 10.00 C ATOM 0 H LEU A 89 7.413 7.704 -8.390 1.00 10.00 H new ATOM 0 HA LEU A 89 9.558 5.960 -8.078 1.00 10.00 H new ATOM 0 HB2 LEU A 89 7.167 6.175 -9.896 1.00 10.00 H new ATOM 0 HB3 LEU A 89 8.362 4.932 -10.211 1.00 10.00 H new ATOM 0 HG LEU A 89 7.585 3.616 -8.604 1.00 10.00 H new ATOM 0 HD11 LEU A 89 7.104 4.297 -6.295 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.694 4.871 -6.853 1.00 10.00 H new ATOM 0 HD13 LEU A 89 7.321 6.001 -6.761 1.00 10.00 H new ATOM 0 HD21 LEU A 89 5.253 4.022 -7.863 1.00 10.00 H new ATOM 0 HD22 LEU A 89 5.377 5.702 -8.438 1.00 10.00 H new ATOM 0 HD23 LEU A 89 5.470 4.355 -9.598 1.00 10.00 H new ATOM 1091 N ILE A 90 11.269 6.417 -9.805 1.00 10.00 N ATOM 1092 CA ILE A 90 12.318 6.693 -10.784 1.00 10.00 C ATOM 1093 C ILE A 90 12.122 5.919 -12.088 1.00 10.00 C ATOM 1094 O ILE A 90 12.529 6.376 -13.155 1.00 10.00 O ATOM 1095 CB ILE A 90 13.718 6.373 -10.226 1.00 10.00 C ATOM 1096 CG1 ILE A 90 13.677 5.123 -9.344 1.00 10.00 C ATOM 1097 CG2 ILE A 90 14.263 7.559 -9.446 1.00 10.00 C ATOM 1098 CD1 ILE A 90 15.040 4.544 -9.040 1.00 10.00 C ATOM 0 H ILE A 90 11.587 5.905 -8.982 1.00 10.00 H new ATOM 0 HA ILE A 90 12.244 7.760 -10.996 1.00 10.00 H new ATOM 0 HB ILE A 90 14.384 6.176 -11.066 1.00 10.00 H new ATOM 0 HG12 ILE A 90 13.180 5.368 -8.406 1.00 10.00 H new ATOM 0 HG13 ILE A 90 13.071 4.362 -9.836 1.00 10.00 H new ATOM 0 HG21 ILE A 90 15.253 7.316 -9.059 1.00 10.00 H new ATOM 0 HG22 ILE A 90 14.333 8.426 -10.103 1.00 10.00 H new ATOM 0 HG23 ILE A 90 13.594 7.787 -8.616 1.00 10.00 H new ATOM 0 HD11 ILE A 90 14.928 3.661 -8.411 1.00 10.00 H new ATOM 0 HD12 ILE A 90 15.533 4.266 -9.971 1.00 10.00 H new ATOM 0 HD13 ILE A 90 15.643 5.287 -8.518 1.00 10.00 H new ATOM 1110 N GLY A 91 11.508 4.749 -11.998 1.00 10.00 N ATOM 1111 CA GLY A 91 11.279 3.942 -13.183 1.00 10.00 C ATOM 1112 C GLY A 91 11.494 2.457 -12.935 1.00 10.00 C ATOM 1113 O GLY A 91 10.547 1.675 -13.004 1.00 10.00 O ATOM 0 H GLY A 91 11.164 4.343 -11.128 1.00 10.00 H new ATOM 0 HA2 GLY A 91 10.260 4.103 -13.535 1.00 10.00 H new ATOM 0 HA3 GLY A 91 11.947 4.274 -13.978 1.00 10.00 H new ATOM 1117 N PRO A 92 12.738 2.034 -12.629 1.00 10.00 N ATOM 1118 CA PRO A 92 13.061 0.620 -12.365 1.00 10.00 C ATOM 1119 C PRO A 92 12.348 0.067 -11.127 1.00 10.00 C ATOM 1120 O PRO A 92 12.501 -1.107 -10.786 1.00 10.00 O ATOM 1121 CB PRO A 92 14.578 0.628 -12.148 1.00 10.00 C ATOM 1122 CG PRO A 92 14.907 2.035 -11.792 1.00 10.00 C ATOM 1123 CD PRO A 92 13.936 2.886 -12.553 1.00 10.00 C ATOM 0 HA PRO A 92 12.736 -0.021 -13.184 1.00 10.00 H new ATOM 0 HB2 PRO A 92 14.867 -0.059 -11.352 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.107 0.314 -13.048 1.00 10.00 H new ATOM 0 HG2 PRO A 92 14.813 2.199 -10.719 1.00 10.00 H new ATOM 0 HG3 PRO A 92 15.935 2.277 -12.063 1.00 10.00 H new ATOM 0 HD2 PRO A 92 13.732 3.825 -12.038 1.00 10.00 H new ATOM 0 HD3 PRO A 92 14.313 3.142 -13.543 1.00 10.00 H new ATOM 1131 N VAL A 93 11.570 0.916 -10.465 1.00 10.00 N ATOM 1132 CA VAL A 93 10.823 0.519 -9.278 1.00 10.00 C ATOM 1133 C VAL A 93 9.738 -0.478 -9.658 1.00 10.00 C ATOM 1134 O VAL A 93 9.473 -1.437 -8.933 1.00 10.00 O ATOM 1135 CB VAL A 93 10.158 1.729 -8.591 1.00 10.00 C ATOM 1136 CG1 VAL A 93 9.907 1.440 -7.121 1.00 10.00 C ATOM 1137 CG2 VAL A 93 11.003 2.981 -8.758 1.00 10.00 C ATOM 0 H VAL A 93 11.440 1.891 -10.733 1.00 10.00 H new ATOM 0 HA VAL A 93 11.532 0.068 -8.584 1.00 10.00 H new ATOM 0 HB VAL A 93 9.197 1.906 -9.073 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.437 2.306 -6.655 1.00 10.00 H new ATOM 0 HG12 VAL A 93 9.249 0.576 -7.027 1.00 10.00 H new ATOM 0 HG13 VAL A 93 10.854 1.230 -6.625 1.00 10.00 H new ATOM 0 HG21 VAL A 93 10.512 3.820 -8.265 1.00 10.00 H new ATOM 0 HG22 VAL A 93 11.984 2.820 -8.310 1.00 10.00 H new ATOM 0 HG23 VAL A 93 11.120 3.202 -9.819 1.00 10.00 H new ATOM 1147 N SER A 94 9.121 -0.251 -10.813 1.00 10.00 N ATOM 1148 CA SER A 94 8.063 -1.123 -11.304 1.00 10.00 C ATOM 1149 C SER A 94 8.606 -2.494 -11.703 1.00 10.00 C ATOM 1150 O SER A 94 7.840 -3.432 -11.928 1.00 10.00 O ATOM 1151 CB SER A 94 7.350 -0.472 -12.487 1.00 10.00 C ATOM 1152 OG SER A 94 6.675 0.708 -12.080 1.00 10.00 O ATOM 0 H SER A 94 9.338 0.533 -11.428 1.00 10.00 H new ATOM 0 HA SER A 94 7.350 -1.271 -10.493 1.00 10.00 H new ATOM 0 HB2 SER A 94 8.073 -0.232 -13.266 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.637 -1.174 -12.919 1.00 10.00 H new ATOM 0 HG SER A 94 5.950 0.474 -11.463 1.00 10.00 H new ATOM 1158 N ALA A 95 9.927 -2.606 -11.779 1.00 10.00 N ATOM 1159 CA ALA A 95 10.568 -3.864 -12.131 1.00 10.00 C ATOM 1160 C ALA A 95 10.716 -4.738 -10.895 1.00 10.00 C ATOM 1161 O ALA A 95 11.116 -5.899 -10.980 1.00 10.00 O ATOM 1162 CB ALA A 95 11.922 -3.615 -12.776 1.00 10.00 C ATOM 0 H ALA A 95 10.575 -1.838 -11.601 1.00 10.00 H new ATOM 0 HA ALA A 95 9.940 -4.384 -12.854 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.384 -4.569 -13.031 1.00 10.00 H new ATOM 0 HB2 ALA A 95 11.790 -3.022 -13.681 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.564 -3.076 -12.079 1.00 10.00 H new ATOM 1168 N ILE A 96 10.384 -4.170 -9.744 1.00 10.00 N ATOM 1169 CA ILE A 96 10.466 -4.883 -8.487 1.00 10.00 C ATOM 1170 C ILE A 96 9.109 -5.487 -8.153 1.00 10.00 C ATOM 1171 O ILE A 96 8.171 -4.776 -7.800 1.00 10.00 O ATOM 1172 CB ILE A 96 10.932 -3.954 -7.347 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.278 -3.315 -7.712 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.039 -4.723 -6.038 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.581 -2.038 -6.957 1.00 10.00 C ATOM 0 H ILE A 96 10.053 -3.209 -9.660 1.00 10.00 H new ATOM 0 HA ILE A 96 11.203 -5.679 -8.590 1.00 10.00 H new ATOM 0 HB ILE A 96 10.193 -3.164 -7.213 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.074 -4.035 -7.521 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.290 -3.104 -8.781 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.369 -4.050 -5.247 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.065 -5.138 -5.779 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.760 -5.533 -6.150 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.549 -1.650 -7.272 1.00 10.00 H new ATOM 0 HD12 ILE A 96 11.808 -1.299 -7.167 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.604 -2.245 -5.887 1.00 10.00 H new ATOM 1187 N SER A 97 8.996 -6.793 -8.323 1.00 10.00 N ATOM 1188 CA SER A 97 7.754 -7.491 -8.052 1.00 10.00 C ATOM 1189 C SER A 97 8.033 -8.824 -7.364 1.00 10.00 C ATOM 1190 O SER A 97 8.337 -9.826 -8.015 1.00 10.00 O ATOM 1191 CB SER A 97 6.983 -7.716 -9.356 1.00 10.00 C ATOM 1192 OG SER A 97 6.966 -6.538 -10.149 1.00 10.00 O ATOM 0 H SER A 97 9.754 -7.393 -8.649 1.00 10.00 H new ATOM 0 HA SER A 97 7.146 -6.879 -7.386 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.442 -8.530 -9.918 1.00 10.00 H new ATOM 0 HB3 SER A 97 5.961 -8.021 -9.130 1.00 10.00 H new ATOM 0 HG SER A 97 6.469 -6.708 -10.977 1.00 10.00 H new ATOM 1198 N THR A 98 7.949 -8.824 -6.048 1.00 10.00 N ATOM 1199 CA THR A 98 8.192 -10.021 -5.263 1.00 10.00 C ATOM 1200 C THR A 98 7.075 -10.233 -4.250 1.00 10.00 C ATOM 1201 O THR A 98 6.380 -9.285 -3.875 1.00 10.00 O ATOM 1202 CB THR A 98 9.545 -9.935 -4.526 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.795 -11.144 -3.801 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.557 -8.759 -3.567 1.00 10.00 C ATOM 0 H THR A 98 7.712 -8.001 -5.495 1.00 10.00 H new ATOM 0 HA THR A 98 8.220 -10.867 -5.950 1.00 10.00 H new ATOM 0 HB THR A 98 10.328 -9.794 -5.271 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.657 -11.077 -3.340 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.519 -8.715 -3.057 1.00 10.00 H new ATOM 0 HG22 THR A 98 9.398 -7.835 -4.123 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.762 -8.881 -2.832 1.00 10.00 H new ATOM 1212 N THR A 99 6.891 -11.473 -3.818 1.00 10.00 N ATOM 1213 CA THR A 99 5.868 -11.786 -2.841 1.00 10.00 C ATOM 1214 C THR A 99 6.382 -11.545 -1.423 1.00 10.00 C ATOM 1215 O THR A 99 5.610 -11.511 -0.464 1.00 10.00 O ATOM 1216 CB THR A 99 5.397 -13.241 -2.976 1.00 10.00 C ATOM 1217 OG1 THR A 99 6.415 -14.031 -3.610 1.00 10.00 O ATOM 1218 CG2 THR A 99 4.111 -13.319 -3.780 1.00 10.00 C ATOM 0 H THR A 99 7.438 -12.275 -4.131 1.00 10.00 H new ATOM 0 HA THR A 99 5.022 -11.126 -3.032 1.00 10.00 H new ATOM 0 HB THR A 99 5.206 -13.633 -1.977 1.00 10.00 H new ATOM 0 HG1 THR A 99 7.255 -13.941 -3.114 1.00 10.00 H new ATOM 0 HG21 THR A 99 3.796 -14.359 -3.863 1.00 10.00 H new ATOM 0 HG22 THR A 99 3.333 -12.743 -3.279 1.00 10.00 H new ATOM 0 HG23 THR A 99 4.280 -12.911 -4.776 1.00 10.00 H new ATOM 1226 N SER A 100 7.692 -11.377 -1.301 1.00 10.00 N ATOM 1227 CA SER A 100 8.311 -11.127 -0.013 1.00 10.00 C ATOM 1228 C SER A 100 8.473 -9.629 0.208 1.00 10.00 C ATOM 1229 O SER A 100 9.220 -8.962 -0.511 1.00 10.00 O ATOM 1230 CB SER A 100 9.672 -11.825 0.070 1.00 10.00 C ATOM 1231 OG SER A 100 10.423 -11.352 1.177 1.00 10.00 O ATOM 0 H SER A 100 8.346 -11.410 -2.083 1.00 10.00 H new ATOM 0 HA SER A 100 7.666 -11.530 0.768 1.00 10.00 H new ATOM 0 HB2 SER A 100 9.527 -12.902 0.159 1.00 10.00 H new ATOM 0 HB3 SER A 100 10.229 -11.653 -0.851 1.00 10.00 H new ATOM 0 HG SER A 100 11.286 -11.814 1.208 1.00 10.00 H new ATOM 1237 N VAL A 101 7.768 -9.097 1.197 1.00 10.00 N ATOM 1238 CA VAL A 101 7.849 -7.678 1.505 1.00 10.00 C ATOM 1239 C VAL A 101 9.253 -7.330 1.989 1.00 10.00 C ATOM 1240 O VAL A 101 9.753 -6.227 1.749 1.00 10.00 O ATOM 1241 CB VAL A 101 6.788 -7.255 2.554 1.00 10.00 C ATOM 1242 CG1 VAL A 101 7.077 -7.855 3.923 1.00 10.00 C ATOM 1243 CG2 VAL A 101 6.689 -5.739 2.635 1.00 10.00 C ATOM 0 H VAL A 101 7.136 -9.626 1.798 1.00 10.00 H new ATOM 0 HA VAL A 101 7.638 -7.123 0.591 1.00 10.00 H new ATOM 0 HB VAL A 101 5.825 -7.647 2.226 1.00 10.00 H new ATOM 0 HG11 VAL A 101 6.311 -7.535 4.630 1.00 10.00 H new ATOM 0 HG12 VAL A 101 7.073 -8.943 3.852 1.00 10.00 H new ATOM 0 HG13 VAL A 101 8.054 -7.518 4.269 1.00 10.00 H new ATOM 0 HG21 VAL A 101 5.939 -5.462 3.376 1.00 10.00 H new ATOM 0 HG22 VAL A 101 7.655 -5.326 2.925 1.00 10.00 H new ATOM 0 HG23 VAL A 101 6.401 -5.341 1.662 1.00 10.00 H new ATOM 1253 N GLN A 102 9.897 -8.293 2.640 1.00 10.00 N ATOM 1254 CA GLN A 102 11.248 -8.105 3.143 1.00 10.00 C ATOM 1255 C GLN A 102 12.219 -7.982 1.978 1.00 10.00 C ATOM 1256 O GLN A 102 13.100 -7.120 1.979 1.00 10.00 O ATOM 1257 CB GLN A 102 11.654 -9.264 4.057 1.00 10.00 C ATOM 1258 CG GLN A 102 10.796 -9.383 5.307 1.00 10.00 C ATOM 1259 CD GLN A 102 11.392 -10.317 6.337 1.00 10.00 C ATOM 1260 OE1 GLN A 102 12.129 -9.889 7.228 1.00 10.00 O ATOM 1261 NE2 GLN A 102 11.089 -11.601 6.220 1.00 10.00 N ATOM 0 H GLN A 102 9.501 -9.214 2.831 1.00 10.00 H new ATOM 0 HA GLN A 102 11.278 -7.187 3.730 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.595 -10.196 3.496 1.00 10.00 H new ATOM 0 HB3 GLN A 102 12.695 -9.135 4.352 1.00 10.00 H new ATOM 0 HG2 GLN A 102 10.667 -8.395 5.750 1.00 10.00 H new ATOM 0 HG3 GLN A 102 9.804 -9.740 5.029 1.00 10.00 H new ATOM 0 HE21 GLN A 102 10.475 -11.914 5.468 1.00 10.00 H new ATOM 0 HE22 GLN A 102 11.470 -12.277 6.882 1.00 10.00 H new ATOM 1270 N GLN A 103 12.041 -8.842 0.978 1.00 10.00 N ATOM 1271 CA GLN A 103 12.887 -8.824 -0.209 1.00 10.00 C ATOM 1272 C GLN A 103 12.657 -7.543 -1.002 1.00 10.00 C ATOM 1273 O GLN A 103 13.601 -6.940 -1.509 1.00 10.00 O ATOM 1274 CB GLN A 103 12.597 -10.037 -1.093 1.00 10.00 C ATOM 1275 CG GLN A 103 13.479 -10.115 -2.328 1.00 10.00 C ATOM 1276 CD GLN A 103 14.871 -10.623 -2.021 1.00 10.00 C ATOM 1277 OE1 GLN A 103 15.777 -9.845 -1.721 1.00 10.00 O ATOM 1278 NE2 GLN A 103 15.052 -11.932 -2.093 1.00 10.00 N ATOM 0 H GLN A 103 11.317 -9.560 0.968 1.00 10.00 H new ATOM 0 HA GLN A 103 13.928 -8.863 0.112 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.729 -10.945 -0.504 1.00 10.00 H new ATOM 0 HB3 GLN A 103 11.553 -10.008 -1.404 1.00 10.00 H new ATOM 0 HG2 GLN A 103 13.011 -10.771 -3.063 1.00 10.00 H new ATOM 0 HG3 GLN A 103 13.549 -9.127 -2.782 1.00 10.00 H new ATOM 0 HE21 GLN A 103 14.274 -12.541 -2.345 1.00 10.00 H new ATOM 0 HE22 GLN A 103 15.970 -12.332 -1.896 1.00 10.00 H new ATOM 1287 N ALA A 104 11.394 -7.136 -1.092 1.00 10.00 N ATOM 1288 CA ALA A 104 11.018 -5.923 -1.811 1.00 10.00 C ATOM 1289 C ALA A 104 11.793 -4.725 -1.288 1.00 10.00 C ATOM 1290 O ALA A 104 12.409 -3.984 -2.056 1.00 10.00 O ATOM 1291 CB ALA A 104 9.523 -5.675 -1.682 1.00 10.00 C ATOM 0 H ALA A 104 10.608 -7.633 -0.672 1.00 10.00 H new ATOM 0 HA ALA A 104 11.264 -6.060 -2.864 1.00 10.00 H new ATOM 0 HB1 ALA A 104 9.257 -4.767 -2.223 1.00 10.00 H new ATOM 0 HB2 ALA A 104 8.977 -6.520 -2.100 1.00 10.00 H new ATOM 0 HB3 ALA A 104 9.263 -5.560 -0.630 1.00 10.00 H new ATOM 1297 N ALA A 105 11.775 -4.552 0.029 1.00 10.00 N ATOM 1298 CA ALA A 105 12.483 -3.448 0.664 1.00 10.00 C ATOM 1299 C ALA A 105 13.988 -3.572 0.451 1.00 10.00 C ATOM 1300 O ALA A 105 14.695 -2.568 0.356 1.00 10.00 O ATOM 1301 CB ALA A 105 12.162 -3.396 2.149 1.00 10.00 C ATOM 0 H ALA A 105 11.278 -5.163 0.677 1.00 10.00 H new ATOM 0 HA ALA A 105 12.149 -2.520 0.201 1.00 10.00 H new ATOM 0 HB1 ALA A 105 12.699 -2.566 2.608 1.00 10.00 H new ATOM 0 HB2 ALA A 105 11.090 -3.254 2.285 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.467 -4.330 2.620 1.00 10.00 H new ATOM 1307 N THR A 106 14.466 -4.807 0.366 1.00 10.00 N ATOM 1308 CA THR A 106 15.882 -5.073 0.157 1.00 10.00 C ATOM 1309 C THR A 106 16.315 -4.596 -1.231 1.00 10.00 C ATOM 1310 O THR A 106 17.344 -3.935 -1.386 1.00 10.00 O ATOM 1311 CB THR A 106 16.186 -6.581 0.314 1.00 10.00 C ATOM 1312 OG1 THR A 106 15.731 -7.042 1.595 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.673 -6.860 0.176 1.00 10.00 C ATOM 0 H THR A 106 13.889 -5.645 0.439 1.00 10.00 H new ATOM 0 HA THR A 106 16.445 -4.524 0.912 1.00 10.00 H new ATOM 0 HB THR A 106 15.660 -7.113 -0.478 1.00 10.00 H new ATOM 0 HG1 THR A 106 14.772 -7.239 1.550 1.00 10.00 H new ATOM 0 HG21 THR A 106 17.855 -7.929 0.291 1.00 10.00 H new ATOM 0 HG22 THR A 106 18.014 -6.538 -0.808 1.00 10.00 H new ATOM 0 HG23 THR A 106 18.219 -6.314 0.946 1.00 10.00 H new ATOM 1321 N GLU A 107 15.507 -4.918 -2.234 1.00 10.00 N ATOM 1322 CA GLU A 107 15.792 -4.523 -3.604 1.00 10.00 C ATOM 1323 C GLU A 107 15.593 -3.023 -3.785 1.00 10.00 C ATOM 1324 O GLU A 107 16.388 -2.357 -4.448 1.00 10.00 O ATOM 1325 CB GLU A 107 14.894 -5.286 -4.572 1.00 10.00 C ATOM 1326 CG GLU A 107 15.114 -6.787 -4.541 1.00 10.00 C ATOM 1327 CD GLU A 107 14.580 -7.474 -5.775 1.00 10.00 C ATOM 1328 OE1 GLU A 107 15.306 -7.526 -6.792 1.00 10.00 O ATOM 1329 OE2 GLU A 107 13.443 -7.977 -5.741 1.00 10.00 O ATOM 0 H GLU A 107 14.646 -5.454 -2.121 1.00 10.00 H new ATOM 0 HA GLU A 107 16.833 -4.764 -3.819 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.852 -5.074 -4.333 1.00 10.00 H new ATOM 0 HB3 GLU A 107 15.070 -4.921 -5.584 1.00 10.00 H new ATOM 0 HG2 GLU A 107 16.180 -6.993 -4.447 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.629 -7.204 -3.658 1.00 10.00 H new ATOM 1336 N LEU A 108 14.528 -2.502 -3.182 1.00 10.00 N ATOM 1337 CA LEU A 108 14.212 -1.080 -3.267 1.00 10.00 C ATOM 1338 C LEU A 108 15.357 -0.224 -2.741 1.00 10.00 C ATOM 1339 O LEU A 108 15.780 0.721 -3.398 1.00 10.00 O ATOM 1340 CB LEU A 108 12.952 -0.768 -2.466 1.00 10.00 C ATOM 1341 CG LEU A 108 11.630 -1.009 -3.185 1.00 10.00 C ATOM 1342 CD1 LEU A 108 10.481 -0.914 -2.200 1.00 10.00 C ATOM 1343 CD2 LEU A 108 11.443 -0.010 -4.315 1.00 10.00 C ATOM 0 H LEU A 108 13.867 -3.046 -2.627 1.00 10.00 H new ATOM 0 HA LEU A 108 14.051 -0.844 -4.319 1.00 10.00 H new ATOM 0 HB2 LEU A 108 12.964 -1.370 -1.557 1.00 10.00 H new ATOM 0 HB3 LEU A 108 12.990 0.277 -2.157 1.00 10.00 H new ATOM 0 HG LEU A 108 11.645 -2.010 -3.616 1.00 10.00 H new ATOM 0 HD11 LEU A 108 9.540 -1.087 -2.721 1.00 10.00 H new ATOM 0 HD12 LEU A 108 10.607 -1.665 -1.420 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.469 0.079 -1.750 1.00 10.00 H new ATOM 0 HD21 LEU A 108 10.493 -0.200 -4.815 1.00 10.00 H new ATOM 0 HD22 LEU A 108 11.444 1.002 -3.910 1.00 10.00 H new ATOM 0 HD23 LEU A 108 12.258 -0.115 -5.032 1.00 10.00 H new ATOM 1355 N SER A 109 15.863 -0.570 -1.561 1.00 10.00 N ATOM 1356 CA SER A 109 16.949 0.180 -0.934 1.00 10.00 C ATOM 1357 C SER A 109 18.225 0.143 -1.767 1.00 10.00 C ATOM 1358 O SER A 109 19.080 1.014 -1.632 1.00 10.00 O ATOM 1359 CB SER A 109 17.225 -0.348 0.473 1.00 10.00 C ATOM 1360 OG SER A 109 17.208 -1.763 0.503 1.00 10.00 O ATOM 0 H SER A 109 15.537 -1.369 -1.017 1.00 10.00 H new ATOM 0 HA SER A 109 16.626 1.219 -0.870 1.00 10.00 H new ATOM 0 HB2 SER A 109 18.194 0.014 0.816 1.00 10.00 H new ATOM 0 HB3 SER A 109 16.477 0.042 1.163 1.00 10.00 H new ATOM 0 HG SER A 109 16.322 -2.074 0.785 1.00 10.00 H new ATOM 1366 N ALA A 110 18.359 -0.861 -2.619 1.00 10.00 N ATOM 1367 CA ALA A 110 19.534 -0.980 -3.474 1.00 10.00 C ATOM 1368 C ALA A 110 19.459 0.016 -4.626 1.00 10.00 C ATOM 1369 O ALA A 110 20.436 0.695 -4.950 1.00 10.00 O ATOM 1370 CB ALA A 110 19.671 -2.401 -4.004 1.00 10.00 C ATOM 0 H ALA A 110 17.671 -1.605 -2.738 1.00 10.00 H new ATOM 0 HA ALA A 110 20.417 -0.751 -2.877 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.554 -2.469 -4.640 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.772 -3.093 -3.168 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.785 -2.660 -4.584 1.00 10.00 H new ATOM 1376 N VAL A 111 18.281 0.115 -5.223 1.00 10.00 N ATOM 1377 CA VAL A 111 18.055 1.019 -6.343 1.00 10.00 C ATOM 1378 C VAL A 111 17.864 2.453 -5.850 1.00 10.00 C ATOM 1379 O VAL A 111 18.246 3.419 -6.512 1.00 10.00 O ATOM 1380 CB VAL A 111 16.804 0.594 -7.144 1.00 10.00 C ATOM 1381 CG1 VAL A 111 16.716 1.356 -8.453 1.00 10.00 C ATOM 1382 CG2 VAL A 111 16.796 -0.906 -7.403 1.00 10.00 C ATOM 0 H VAL A 111 17.460 -0.424 -4.948 1.00 10.00 H new ATOM 0 HA VAL A 111 18.932 0.971 -6.988 1.00 10.00 H new ATOM 0 HB VAL A 111 15.929 0.838 -6.541 1.00 10.00 H new ATOM 0 HG11 VAL A 111 15.827 1.040 -8.999 1.00 10.00 H new ATOM 0 HG12 VAL A 111 16.655 2.425 -8.248 1.00 10.00 H new ATOM 0 HG13 VAL A 111 17.603 1.152 -9.053 1.00 10.00 H new ATOM 0 HG21 VAL A 111 15.903 -1.173 -7.968 1.00 10.00 H new ATOM 0 HG22 VAL A 111 17.683 -1.181 -7.974 1.00 10.00 H new ATOM 0 HG23 VAL A 111 16.796 -1.439 -6.452 1.00 10.00 H new ATOM 1392 N TYR A 112 17.281 2.571 -4.672 1.00 10.00 N ATOM 1393 CA TYR A 112 16.998 3.860 -4.062 1.00 10.00 C ATOM 1394 C TYR A 112 18.213 4.458 -3.371 1.00 10.00 C ATOM 1395 O TYR A 112 18.252 5.664 -3.121 1.00 10.00 O ATOM 1396 CB TYR A 112 15.830 3.737 -3.093 1.00 10.00 C ATOM 1397 CG TYR A 112 14.492 3.923 -3.778 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.293 3.469 -5.076 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.439 4.563 -3.141 1.00 10.00 C ATOM 1400 CE1 TYR A 112 13.084 3.643 -5.718 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.226 4.744 -3.781 1.00 10.00 C ATOM 1402 CZ TYR A 112 12.052 4.282 -5.069 1.00 10.00 C ATOM 1403 OH TYR A 112 10.846 4.467 -5.710 1.00 10.00 O ATOM 0 H TYR A 112 16.989 1.773 -4.108 1.00 10.00 H new ATOM 0 HA TYR A 112 16.727 4.546 -4.864 1.00 10.00 H new ATOM 0 HB2 TYR A 112 15.858 2.757 -2.616 1.00 10.00 H new ATOM 0 HB3 TYR A 112 15.937 4.480 -2.302 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.100 2.970 -5.592 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.568 4.925 -2.132 1.00 10.00 H new ATOM 0 HE1 TYR A 112 12.948 3.279 -6.726 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.416 5.246 -3.273 1.00 10.00 H new ATOM 0 HH TYR A 112 10.226 4.933 -5.112 1.00 10.00 H new ATOM 1413 N ALA A 113 19.177 3.613 -3.013 1.00 10.00 N ATOM 1414 CA ALA A 113 20.399 4.063 -2.346 1.00 10.00 C ATOM 1415 C ALA A 113 21.087 5.188 -3.121 1.00 10.00 C ATOM 1416 O ALA A 113 21.771 6.026 -2.533 1.00 10.00 O ATOM 1417 CB ALA A 113 21.367 2.904 -2.154 1.00 10.00 C ATOM 0 H ALA A 113 19.136 2.607 -3.174 1.00 10.00 H new ATOM 0 HA ALA A 113 20.107 4.452 -1.371 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.268 3.261 -1.656 1.00 10.00 H new ATOM 0 HB2 ALA A 113 20.896 2.134 -1.543 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.631 2.485 -3.125 1.00 10.00 H new ATOM 1423 N ALA A 114 20.891 5.206 -4.436 1.00 10.00 N ATOM 1424 CA ALA A 114 21.484 6.232 -5.289 1.00 10.00 C ATOM 1425 C ALA A 114 20.793 7.579 -5.091 1.00 10.00 C ATOM 1426 O ALA A 114 21.350 8.630 -5.403 1.00 10.00 O ATOM 1427 CB ALA A 114 21.412 5.810 -6.748 1.00 10.00 C ATOM 0 H ALA A 114 20.325 4.520 -4.935 1.00 10.00 H new ATOM 0 HA ALA A 114 22.530 6.345 -5.005 1.00 10.00 H new ATOM 0 HB1 ALA A 114 21.858 6.584 -7.373 1.00 10.00 H new ATOM 0 HB2 ALA A 114 21.957 4.876 -6.884 1.00 10.00 H new ATOM 0 HB3 ALA A 114 20.370 5.667 -7.035 1.00 10.00 H new ATOM 1433 N GLN A 115 19.569 7.535 -4.579 1.00 10.00 N ATOM 1434 CA GLN A 115 18.794 8.745 -4.331 1.00 10.00 C ATOM 1435 C GLN A 115 18.966 9.176 -2.882 1.00 10.00 C ATOM 1436 O GLN A 115 18.837 10.353 -2.548 1.00 10.00 O ATOM 1437 CB GLN A 115 17.303 8.514 -4.621 1.00 10.00 C ATOM 1438 CG GLN A 115 16.942 8.509 -6.100 1.00 10.00 C ATOM 1439 CD GLN A 115 17.527 7.327 -6.848 1.00 10.00 C ATOM 1440 OE1 GLN A 115 16.839 6.198 -6.806 1.00 10.00 O flip ATOM 1441 NE2 GLN A 115 18.593 7.423 -7.448 1.00 10.00 N flip ATOM 0 H GLN A 115 19.090 6.671 -4.326 1.00 10.00 H new ATOM 0 HA GLN A 115 19.160 9.527 -4.997 1.00 10.00 H new ATOM 0 HB2 GLN A 115 17.004 7.562 -4.184 1.00 10.00 H new ATOM 0 HB3 GLN A 115 16.724 9.290 -4.121 1.00 10.00 H new ATOM 0 HG2 GLN A 115 15.857 8.497 -6.204 1.00 10.00 H new ATOM 0 HG3 GLN A 115 17.295 9.433 -6.558 1.00 10.00 H new ATOM 0 HE21 GLN A 115 19.095 8.311 -7.458 1.00 10.00 H new ATOM 0 HE22 GLN A 115 18.977 6.615 -7.937 1.00 10.00 H new ATOM 1450 N GLY A 116 19.268 8.208 -2.028 1.00 10.00 N ATOM 1451 CA GLY A 116 19.449 8.488 -0.619 1.00 10.00 C ATOM 1452 C GLY A 116 18.298 7.973 0.222 1.00 10.00 C ATOM 1453 O GLY A 116 17.940 8.574 1.237 1.00 10.00 O ATOM 0 H GLY A 116 19.391 7.229 -2.288 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.378 8.033 -0.277 1.00 10.00 H new ATOM 0 HA3 GLY A 116 19.549 9.564 -0.474 1.00 10.00 H new ATOM 1457 N VAL A 117 17.727 6.847 -0.190 1.00 10.00 N ATOM 1458 CA VAL A 117 16.602 6.252 0.523 1.00 10.00 C ATOM 1459 C VAL A 117 16.858 4.774 0.820 1.00 10.00 C ATOM 1460 O VAL A 117 17.208 4.005 -0.075 1.00 10.00 O ATOM 1461 CB VAL A 117 15.296 6.387 -0.294 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.153 5.637 0.373 1.00 10.00 C ATOM 1463 CG2 VAL A 117 14.926 7.847 -0.490 1.00 10.00 C ATOM 0 H VAL A 117 18.025 6.327 -1.015 1.00 10.00 H new ATOM 0 HA VAL A 117 16.494 6.791 1.464 1.00 10.00 H new ATOM 0 HB VAL A 117 15.472 5.942 -1.273 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.247 5.749 -0.223 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.408 4.580 0.451 1.00 10.00 H new ATOM 0 HG13 VAL A 117 13.984 6.044 1.370 1.00 10.00 H new ATOM 0 HG21 VAL A 117 14.004 7.914 -1.068 1.00 10.00 H new ATOM 0 HG22 VAL A 117 14.781 8.319 0.482 1.00 10.00 H new ATOM 0 HG23 VAL A 117 15.727 8.357 -1.025 1.00 10.00 H new ATOM 1473 N SER A 118 16.698 4.389 2.079 1.00 10.00 N ATOM 1474 CA SER A 118 16.886 3.007 2.493 1.00 10.00 C ATOM 1475 C SER A 118 15.622 2.484 3.173 1.00 10.00 C ATOM 1476 O SER A 118 15.318 2.837 4.313 1.00 10.00 O ATOM 1477 CB SER A 118 18.091 2.894 3.433 1.00 10.00 C ATOM 1478 OG SER A 118 19.303 2.766 2.705 1.00 10.00 O ATOM 0 H SER A 118 16.436 5.021 2.836 1.00 10.00 H new ATOM 0 HA SER A 118 17.080 2.398 1.610 1.00 10.00 H new ATOM 0 HB2 SER A 118 18.140 3.775 4.073 1.00 10.00 H new ATOM 0 HB3 SER A 118 17.965 2.032 4.088 1.00 10.00 H new ATOM 0 HG SER A 118 20.031 2.539 3.320 1.00 10.00 H new ATOM 1484 N VAL A 119 14.872 1.665 2.452 1.00 10.00 N ATOM 1485 CA VAL A 119 13.643 1.090 2.980 1.00 10.00 C ATOM 1486 C VAL A 119 13.901 -0.284 3.584 1.00 10.00 C ATOM 1487 O VAL A 119 14.674 -1.075 3.041 1.00 10.00 O ATOM 1488 CB VAL A 119 12.555 0.958 1.895 1.00 10.00 C ATOM 1489 CG1 VAL A 119 11.947 2.308 1.571 1.00 10.00 C ATOM 1490 CG2 VAL A 119 13.115 0.324 0.637 1.00 10.00 C ATOM 0 H VAL A 119 15.093 1.383 1.497 1.00 10.00 H new ATOM 0 HA VAL A 119 13.288 1.773 3.752 1.00 10.00 H new ATOM 0 HB VAL A 119 11.773 0.310 2.290 1.00 10.00 H new ATOM 0 HG11 VAL A 119 11.183 2.188 0.803 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.496 2.729 2.470 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.725 2.979 1.207 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.327 0.243 -0.111 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.924 0.942 0.247 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.498 -0.670 0.870 1.00 10.00 H new ATOM 1500 N SER A 120 13.267 -0.559 4.708 1.00 10.00 N ATOM 1501 CA SER A 120 13.421 -1.837 5.380 1.00 10.00 C ATOM 1502 C SER A 120 12.120 -2.222 6.075 1.00 10.00 C ATOM 1503 O SER A 120 11.331 -1.355 6.446 1.00 10.00 O ATOM 1504 CB SER A 120 14.556 -1.766 6.405 1.00 10.00 C ATOM 1505 OG SER A 120 15.480 -0.733 6.084 1.00 10.00 O ATOM 0 H SER A 120 12.636 0.090 5.178 1.00 10.00 H new ATOM 0 HA SER A 120 13.666 -2.594 4.635 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.142 -1.590 7.398 1.00 10.00 H new ATOM 0 HB3 SER A 120 15.076 -2.723 6.442 1.00 10.00 H new ATOM 0 HG SER A 120 16.192 -0.711 6.757 1.00 10.00 H new ATOM 1511 N VAL A 121 11.892 -3.516 6.236 1.00 10.00 N ATOM 1512 CA VAL A 121 10.695 -4.002 6.901 1.00 10.00 C ATOM 1513 C VAL A 121 11.091 -4.595 8.237 1.00 10.00 C ATOM 1514 O VAL A 121 11.903 -5.523 8.293 1.00 10.00 O ATOM 1515 CB VAL A 121 9.955 -5.075 6.080 1.00 10.00 C ATOM 1516 CG1 VAL A 121 8.519 -5.223 6.560 1.00 10.00 C ATOM 1517 CG2 VAL A 121 10.008 -4.761 4.594 1.00 10.00 C ATOM 0 H VAL A 121 12.523 -4.250 5.914 1.00 10.00 H new ATOM 0 HA VAL A 121 10.017 -3.157 7.023 1.00 10.00 H new ATOM 0 HB VAL A 121 10.462 -6.028 6.233 1.00 10.00 H new ATOM 0 HG11 VAL A 121 8.014 -5.986 5.967 1.00 10.00 H new ATOM 0 HG12 VAL A 121 8.515 -5.517 7.609 1.00 10.00 H new ATOM 0 HG13 VAL A 121 7.998 -4.272 6.448 1.00 10.00 H new ATOM 0 HG21 VAL A 121 9.478 -5.535 4.039 1.00 10.00 H new ATOM 0 HG22 VAL A 121 9.537 -3.795 4.409 1.00 10.00 H new ATOM 0 HG23 VAL A 121 11.047 -4.727 4.266 1.00 10.00 H new ATOM 1527 N SER A 122 10.546 -4.054 9.305 1.00 10.00 N ATOM 1528 CA SER A 122 10.874 -4.530 10.631 1.00 10.00 C ATOM 1529 C SER A 122 9.625 -4.646 11.497 1.00 10.00 C ATOM 1530 O SER A 122 8.954 -3.651 11.769 1.00 10.00 O ATOM 1531 CB SER A 122 11.890 -3.581 11.270 1.00 10.00 C ATOM 1532 OG SER A 122 13.015 -3.384 10.423 1.00 10.00 O ATOM 0 H SER A 122 9.875 -3.286 9.281 1.00 10.00 H new ATOM 0 HA SER A 122 11.310 -5.526 10.552 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.415 -2.622 11.477 1.00 10.00 H new ATOM 0 HB3 SER A 122 12.219 -3.987 12.227 1.00 10.00 H new ATOM 0 HG SER A 122 13.647 -2.772 10.855 1.00 10.00 H new ATOM 1538 N ALA A 123 9.309 -5.880 11.893 1.00 10.00 N ATOM 1539 CA ALA A 123 8.154 -6.173 12.742 1.00 10.00 C ATOM 1540 C ALA A 123 6.844 -5.809 12.050 1.00 10.00 C ATOM 1541 O ALA A 123 5.992 -5.133 12.630 1.00 10.00 O ATOM 1542 CB ALA A 123 8.271 -5.461 14.088 1.00 10.00 C ATOM 0 H ALA A 123 9.848 -6.706 11.633 1.00 10.00 H new ATOM 0 HA ALA A 123 8.145 -7.248 12.923 1.00 10.00 H new ATOM 0 HB1 ALA A 123 7.400 -5.695 14.700 1.00 10.00 H new ATOM 0 HB2 ALA A 123 9.174 -5.795 14.599 1.00 10.00 H new ATOM 0 HB3 ALA A 123 8.322 -4.384 13.927 1.00 10.00 H new ATOM 1548 N ASN A 124 6.703 -6.252 10.801 1.00 10.00 N ATOM 1549 CA ASN A 124 5.498 -6.003 9.999 1.00 10.00 C ATOM 1550 C ASN A 124 5.270 -4.508 9.801 1.00 10.00 C ATOM 1551 O ASN A 124 4.147 -4.059 9.557 1.00 10.00 O ATOM 1552 CB ASN A 124 4.271 -6.638 10.664 1.00 10.00 C ATOM 1553 CG ASN A 124 3.275 -7.179 9.658 1.00 10.00 C ATOM 1554 OD1 ASN A 124 3.649 -7.624 8.573 1.00 10.00 O ATOM 1555 ND2 ASN A 124 1.995 -7.152 10.008 1.00 10.00 N ATOM 0 H ASN A 124 7.418 -6.793 10.314 1.00 10.00 H new ATOM 0 HA ASN A 124 5.647 -6.460 9.020 1.00 10.00 H new ATOM 0 HB2 ASN A 124 4.595 -7.447 11.319 1.00 10.00 H new ATOM 0 HB3 ASN A 124 3.779 -5.896 11.293 1.00 10.00 H new ATOM 0 HD21 ASN A 124 1.284 -7.508 9.369 1.00 10.00 H new ATOM 0 HD22 ASN A 124 1.722 -6.776 10.916 1.00 10.00 H new ATOM 1562 N LYS A 125 6.343 -3.745 9.914 1.00 10.00 N ATOM 1563 CA LYS A 125 6.285 -2.307 9.749 1.00 10.00 C ATOM 1564 C LYS A 125 7.311 -1.874 8.716 1.00 10.00 C ATOM 1565 O LYS A 125 8.471 -2.286 8.779 1.00 10.00 O ATOM 1566 CB LYS A 125 6.564 -1.611 11.085 1.00 10.00 C ATOM 1567 CG LYS A 125 6.206 -0.136 11.110 1.00 10.00 C ATOM 1568 CD LYS A 125 6.754 0.533 12.361 1.00 10.00 C ATOM 1569 CE LYS A 125 6.012 1.819 12.688 1.00 10.00 C ATOM 1570 NZ LYS A 125 6.811 2.716 13.567 1.00 10.00 N ATOM 0 H LYS A 125 7.274 -4.105 10.122 1.00 10.00 H new ATOM 0 HA LYS A 125 5.288 -2.026 9.409 1.00 10.00 H new ATOM 0 HB2 LYS A 125 6.006 -2.121 11.870 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.622 -1.720 11.324 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.608 0.355 10.224 1.00 10.00 H new ATOM 0 HG3 LYS A 125 5.123 -0.020 11.075 1.00 10.00 H new ATOM 0 HD2 LYS A 125 6.677 -0.154 13.203 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.813 0.750 12.222 1.00 10.00 H new ATOM 0 HE2 LYS A 125 5.767 2.342 11.763 1.00 10.00 H new ATOM 0 HE3 LYS A 125 5.068 1.579 13.177 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 6.210 3.074 14.337 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 7.610 2.186 13.970 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 7.172 3.516 13.010 1.00 10.00 H new ATOM 1584 N LEU A 126 6.889 -1.069 7.764 1.00 10.00 N ATOM 1585 CA LEU A 126 7.792 -0.585 6.737 1.00 10.00 C ATOM 1586 C LEU A 126 8.454 0.689 7.228 1.00 10.00 C ATOM 1587 O LEU A 126 7.775 1.660 7.542 1.00 10.00 O ATOM 1588 CB LEU A 126 7.035 -0.310 5.435 1.00 10.00 C ATOM 1589 CG LEU A 126 6.397 -1.534 4.779 1.00 10.00 C ATOM 1590 CD1 LEU A 126 5.535 -1.110 3.600 1.00 10.00 C ATOM 1591 CD2 LEU A 126 7.466 -2.520 4.329 1.00 10.00 C ATOM 0 H LEU A 126 5.929 -0.736 7.678 1.00 10.00 H new ATOM 0 HA LEU A 126 8.547 -1.345 6.536 1.00 10.00 H new ATOM 0 HB2 LEU A 126 6.253 0.423 5.636 1.00 10.00 H new ATOM 0 HB3 LEU A 126 7.723 0.146 4.723 1.00 10.00 H new ATOM 0 HG LEU A 126 5.763 -2.029 5.515 1.00 10.00 H new ATOM 0 HD11 LEU A 126 5.086 -1.991 3.142 1.00 10.00 H new ATOM 0 HD12 LEU A 126 4.748 -0.441 3.947 1.00 10.00 H new ATOM 0 HD13 LEU A 126 6.152 -0.593 2.865 1.00 10.00 H new ATOM 0 HD21 LEU A 126 6.991 -3.384 3.865 1.00 10.00 H new ATOM 0 HD22 LEU A 126 8.126 -2.037 3.608 1.00 10.00 H new ATOM 0 HD23 LEU A 126 8.047 -2.845 5.192 1.00 10.00 H new ATOM 1603 N LEU A 127 9.770 0.689 7.290 1.00 10.00 N ATOM 1604 CA LEU A 127 10.500 1.848 7.765 1.00 10.00 C ATOM 1605 C LEU A 127 11.390 2.411 6.680 1.00 10.00 C ATOM 1606 O LEU A 127 12.278 1.730 6.166 1.00 10.00 O ATOM 1607 CB LEU A 127 11.342 1.490 8.985 1.00 10.00 C ATOM 1608 CG LEU A 127 10.610 1.583 10.319 1.00 10.00 C ATOM 1609 CD1 LEU A 127 10.520 0.221 10.979 1.00 10.00 C ATOM 1610 CD2 LEU A 127 11.296 2.582 11.234 1.00 10.00 C ATOM 0 H LEU A 127 10.356 -0.100 7.018 1.00 10.00 H new ATOM 0 HA LEU A 127 9.770 2.607 8.046 1.00 10.00 H new ATOM 0 HB2 LEU A 127 11.718 0.474 8.863 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.209 2.149 9.016 1.00 10.00 H new ATOM 0 HG LEU A 127 9.595 1.934 10.130 1.00 10.00 H new ATOM 0 HD11 LEU A 127 9.994 0.311 11.929 1.00 10.00 H new ATOM 0 HD12 LEU A 127 9.977 -0.464 10.327 1.00 10.00 H new ATOM 0 HD13 LEU A 127 11.524 -0.165 11.155 1.00 10.00 H new ATOM 0 HD21 LEU A 127 10.760 2.635 12.182 1.00 10.00 H new ATOM 0 HD22 LEU A 127 12.323 2.264 11.415 1.00 10.00 H new ATOM 0 HD23 LEU A 127 11.299 3.565 10.763 1.00 10.00 H new ATOM 1622 N VAL A 128 11.139 3.652 6.325 1.00 10.00 N ATOM 1623 CA VAL A 128 11.929 4.323 5.316 1.00 10.00 C ATOM 1624 C VAL A 128 12.896 5.277 5.995 1.00 10.00 C ATOM 1625 O VAL A 128 12.468 6.194 6.691 1.00 10.00 O ATOM 1626 CB VAL A 128 11.042 5.122 4.347 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.792 5.427 3.065 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.747 4.381 4.057 1.00 10.00 C ATOM 0 H VAL A 128 10.390 4.219 6.722 1.00 10.00 H new ATOM 0 HA VAL A 128 12.467 3.566 4.746 1.00 10.00 H new ATOM 0 HB VAL A 128 10.784 6.068 4.824 1.00 10.00 H new ATOM 0 HG11 VAL A 128 11.148 5.993 2.392 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.681 6.014 3.295 1.00 10.00 H new ATOM 0 HG13 VAL A 128 12.087 4.494 2.585 1.00 10.00 H new ATOM 0 HG21 VAL A 128 9.138 4.968 3.369 1.00 10.00 H new ATOM 0 HG22 VAL A 128 9.974 3.415 3.607 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.199 4.228 4.987 1.00 10.00 H new ATOM 1638 N GLN A 129 14.186 5.070 5.796 1.00 10.00 N ATOM 1639 CA GLN A 129 15.187 5.922 6.417 1.00 10.00 C ATOM 1640 C GLN A 129 16.162 6.458 5.377 1.00 10.00 C ATOM 1641 O GLN A 129 16.639 5.718 4.517 1.00 10.00 O ATOM 1642 CB GLN A 129 15.940 5.152 7.504 1.00 10.00 C ATOM 1643 CG GLN A 129 15.067 4.753 8.685 1.00 10.00 C ATOM 1644 CD GLN A 129 15.862 4.121 9.810 1.00 10.00 C ATOM 1645 OE1 GLN A 129 16.307 4.806 10.733 1.00 10.00 O ATOM 1646 NE2 GLN A 129 16.057 2.816 9.739 1.00 10.00 N ATOM 0 H GLN A 129 14.564 4.324 5.213 1.00 10.00 H new ATOM 0 HA GLN A 129 14.677 6.769 6.876 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.376 4.254 7.066 1.00 10.00 H new ATOM 0 HB3 GLN A 129 16.767 5.764 7.865 1.00 10.00 H new ATOM 0 HG2 GLN A 129 14.548 5.634 9.062 1.00 10.00 H new ATOM 0 HG3 GLN A 129 14.303 4.053 8.347 1.00 10.00 H new ATOM 0 HE21 GLN A 129 15.672 2.285 8.958 1.00 10.00 H new ATOM 0 HE22 GLN A 129 16.593 2.340 10.465 1.00 10.00 H new ATOM 1655 N PRO A 130 16.437 7.765 5.422 1.00 10.00 N ATOM 1656 CA PRO A 130 17.358 8.409 4.492 1.00 10.00 C ATOM 1657 C PRO A 130 18.819 8.151 4.843 1.00 10.00 C ATOM 1658 O PRO A 130 19.234 8.294 5.998 1.00 10.00 O ATOM 1659 CB PRO A 130 17.025 9.890 4.645 1.00 10.00 C ATOM 1660 CG PRO A 130 16.526 10.023 6.042 1.00 10.00 C ATOM 1661 CD PRO A 130 15.851 8.723 6.377 1.00 10.00 C ATOM 0 HA PRO A 130 17.244 8.031 3.476 1.00 10.00 H new ATOM 0 HB2 PRO A 130 17.904 10.513 4.477 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.270 10.203 3.923 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.347 10.223 6.730 1.00 10.00 H new ATOM 0 HG3 PRO A 130 15.828 10.856 6.128 1.00 10.00 H new ATOM 0 HD2 PRO A 130 16.043 8.427 7.408 1.00 10.00 H new ATOM 0 HD3 PRO A 130 14.769 8.792 6.261 1.00 10.00 H new ATOM 1669 N VAL A 131 19.595 7.775 3.843 1.00 10.00 N ATOM 1670 CA VAL A 131 21.011 7.505 4.039 1.00 10.00 C ATOM 1671 C VAL A 131 21.833 8.733 3.669 1.00 10.00 C ATOM 1672 O VAL A 131 21.443 9.505 2.788 1.00 10.00 O ATOM 1673 CB VAL A 131 21.500 6.289 3.219 1.00 10.00 C ATOM 1674 CG1 VAL A 131 21.200 4.997 3.953 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.874 6.268 1.835 1.00 10.00 C ATOM 0 H VAL A 131 19.270 7.649 2.885 1.00 10.00 H new ATOM 0 HA VAL A 131 21.147 7.267 5.094 1.00 10.00 H new ATOM 0 HB VAL A 131 22.579 6.382 3.098 1.00 10.00 H new ATOM 0 HG11 VAL A 131 21.551 4.152 3.361 1.00 10.00 H new ATOM 0 HG12 VAL A 131 21.708 5.000 4.917 1.00 10.00 H new ATOM 0 HG13 VAL A 131 20.125 4.909 4.109 1.00 10.00 H new ATOM 0 HG21 VAL A 131 21.238 5.401 1.284 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.789 6.210 1.927 1.00 10.00 H new ATOM 0 HG23 VAL A 131 21.144 7.178 1.299 1.00 10.00 H new