USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 546 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 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 72 MET CE :methyl 161:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 43:sc= 1.24 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 164:sc= 0.183 (180deg=0.103) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.414 X(o=-0.41,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 162:sc= -0.0661 (180deg=-0.393) USER MOD Single : A 67 THR OG1 : rot 26:sc= 0.477 USER MOD Single : A 69 SER OG : rot -77:sc= 1.24 USER MOD Single : B 43 SER OG : rot 52:sc= 1.27 USER MOD Single : B 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 162:sc= 0.14 (180deg=0.0636) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 ASN : amide:sc= -0.534 K(o=-0.53,f=0) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 LYS NZ :NH3+ 162:sc= -0.0528 (180deg=-0.397) USER MOD Single : B 67 THR OG1 : rot 38:sc= 0.338 USER MOD Single : B 69 SER OG : rot -70:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 581 N SER A 43 13.025 -6.260 8.337 1.00 0.00 N ATOM 582 CA SER A 43 12.111 -7.110 7.579 1.00 0.00 C ATOM 583 C SER A 43 10.931 -7.533 8.449 1.00 0.00 C ATOM 584 O SER A 43 11.078 -7.722 9.656 1.00 0.00 O ATOM 585 CB SER A 43 12.846 -8.346 7.056 1.00 0.00 C ATOM 586 OG SER A 43 11.971 -9.190 6.329 1.00 0.00 O ATOM 0 HA SER A 43 11.733 -6.539 6.731 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.673 -8.038 6.417 1.00 0.00 H new ATOM 0 HB3 SER A 43 13.277 -8.897 7.892 1.00 0.00 H new ATOM 0 HG SER A 43 11.397 -8.646 5.750 1.00 0.00 H new ATOM 592 N MET A 44 9.758 -7.683 7.833 1.00 0.00 N ATOM 593 CA MET A 44 8.563 -8.070 8.571 1.00 0.00 C ATOM 594 C MET A 44 7.584 -8.830 7.682 1.00 0.00 C ATOM 595 O MET A 44 7.127 -8.315 6.660 1.00 0.00 O ATOM 596 CB MET A 44 7.884 -6.832 9.158 1.00 0.00 C ATOM 597 CG MET A 44 6.625 -7.149 9.945 1.00 0.00 C ATOM 598 SD MET A 44 6.929 -8.298 11.300 1.00 0.00 S ATOM 599 CE MET A 44 5.254 -8.747 11.736 1.00 0.00 C ATOM 0 H MET A 44 9.614 -7.543 6.833 1.00 0.00 H new ATOM 0 HA MET A 44 8.868 -8.732 9.381 1.00 0.00 H new ATOM 0 HB2 MET A 44 8.589 -6.314 9.808 1.00 0.00 H new ATOM 0 HB3 MET A 44 7.634 -6.146 8.349 1.00 0.00 H new ATOM 0 HG2 MET A 44 6.207 -6.225 10.344 1.00 0.00 H new ATOM 0 HG3 MET A 44 5.878 -7.573 9.274 1.00 0.00 H new ATOM 0 HE1 MET A 44 5.271 -9.456 12.564 1.00 0.00 H new ATOM 0 HE2 MET A 44 4.704 -7.854 12.034 1.00 0.00 H new ATOM 0 HE3 MET A 44 4.764 -9.204 10.876 1.00 0.00 H new ATOM 609 N GLU A 45 7.268 -10.059 8.081 1.00 0.00 N ATOM 610 CA GLU A 45 6.339 -10.895 7.331 1.00 0.00 C ATOM 611 C GLU A 45 4.938 -10.290 7.341 1.00 0.00 C ATOM 612 O GLU A 45 4.539 -9.644 8.312 1.00 0.00 O ATOM 613 CB GLU A 45 6.298 -12.304 7.928 1.00 0.00 C ATOM 614 CG GLU A 45 7.674 -12.894 8.190 1.00 0.00 C ATOM 615 CD GLU A 45 7.610 -14.295 8.764 1.00 0.00 C ATOM 616 OE1 GLU A 45 7.562 -15.259 7.972 1.00 0.00 O ATOM 617 OE2 GLU A 45 7.608 -14.428 10.007 1.00 0.00 O ATOM 0 H GLU A 45 7.643 -10.498 8.922 1.00 0.00 H new ATOM 0 HA GLU A 45 6.687 -10.951 6.300 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.739 -12.277 8.864 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.753 -12.961 7.250 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.240 -12.913 7.259 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.217 -12.248 8.880 1.00 0.00 H new ATOM 624 N VAL A 46 4.197 -10.498 6.257 1.00 0.00 N ATOM 625 CA VAL A 46 2.841 -9.972 6.147 1.00 0.00 C ATOM 626 C VAL A 46 1.830 -11.097 5.921 1.00 0.00 C ATOM 627 O VAL A 46 2.083 -12.018 5.143 1.00 0.00 O ATOM 628 CB VAL A 46 2.728 -8.947 5.001 1.00 0.00 C ATOM 629 CG1 VAL A 46 3.657 -7.767 5.246 1.00 0.00 C ATOM 630 CG2 VAL A 46 3.033 -9.601 3.660 1.00 0.00 C ATOM 0 H VAL A 46 4.512 -11.026 5.443 1.00 0.00 H new ATOM 0 HA VAL A 46 2.615 -9.473 7.090 1.00 0.00 H new ATOM 0 HB VAL A 46 1.703 -8.577 4.973 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.563 -7.054 4.427 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.387 -7.280 6.183 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.687 -8.120 5.304 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.947 -8.859 2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.046 -10.003 3.673 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.324 -10.409 3.480 1.00 0.00 H new ATOM 640 N PRO A 47 0.668 -11.045 6.604 1.00 0.00 N ATOM 641 CA PRO A 47 -0.375 -12.049 6.476 1.00 0.00 C ATOM 642 C PRO A 47 -1.525 -11.586 5.586 1.00 0.00 C ATOM 643 O PRO A 47 -1.597 -10.416 5.207 1.00 0.00 O ATOM 644 CB PRO A 47 -0.845 -12.169 7.921 1.00 0.00 C ATOM 645 CG PRO A 47 -0.704 -10.783 8.483 1.00 0.00 C ATOM 646 CD PRO A 47 0.288 -10.041 7.607 1.00 0.00 C ATOM 0 HA PRO A 47 -0.027 -12.975 6.018 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.877 -12.515 7.974 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -0.240 -12.885 8.476 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.667 -10.272 8.492 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.353 -10.820 9.514 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.161 -9.161 7.146 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.150 -9.696 8.178 1.00 0.00 H new ATOM 654 N ALA A 48 -2.420 -12.511 5.254 1.00 0.00 N ATOM 655 CA ALA A 48 -3.567 -12.192 4.412 1.00 0.00 C ATOM 656 C ALA A 48 -4.644 -11.456 5.210 1.00 0.00 C ATOM 657 O ALA A 48 -4.863 -11.755 6.383 1.00 0.00 O ATOM 658 CB ALA A 48 -4.138 -13.458 3.792 1.00 0.00 C ATOM 0 H ALA A 48 -2.373 -13.485 5.554 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.228 -11.533 3.612 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.993 -13.203 3.166 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.374 -13.941 3.183 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -4.456 -14.138 4.582 1.00 0.00 H new ATOM 664 N PRO A 49 -5.330 -10.481 4.584 1.00 0.00 N ATOM 665 CA PRO A 49 -6.381 -9.707 5.252 1.00 0.00 C ATOM 666 C PRO A 49 -7.636 -10.534 5.515 1.00 0.00 C ATOM 667 O PRO A 49 -8.233 -10.446 6.590 1.00 0.00 O ATOM 668 CB PRO A 49 -6.680 -8.581 4.260 1.00 0.00 C ATOM 669 CG PRO A 49 -6.300 -9.138 2.932 1.00 0.00 C ATOM 670 CD PRO A 49 -5.137 -10.055 3.183 1.00 0.00 C ATOM 0 HA PRO A 49 -6.064 -9.355 6.234 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.733 -8.300 4.285 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.105 -7.685 4.493 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.133 -9.679 2.483 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -6.027 -8.342 2.239 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.142 -10.905 2.501 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.185 -9.542 3.047 1.00 0.00 H new ATOM 678 N PHE A 50 -8.033 -11.336 4.532 1.00 0.00 N ATOM 679 CA PHE A 50 -9.219 -12.176 4.662 1.00 0.00 C ATOM 680 C PHE A 50 -9.050 -13.488 3.903 1.00 0.00 C ATOM 681 O PHE A 50 -8.318 -13.556 2.915 1.00 0.00 O ATOM 682 CB PHE A 50 -10.454 -11.434 4.143 1.00 0.00 C ATOM 683 CG PHE A 50 -10.391 -11.112 2.675 1.00 0.00 C ATOM 684 CD1 PHE A 50 -9.677 -10.013 2.225 1.00 0.00 C ATOM 685 CD2 PHE A 50 -11.042 -11.909 1.746 1.00 0.00 C ATOM 686 CE1 PHE A 50 -9.612 -9.715 0.877 1.00 0.00 C ATOM 687 CE2 PHE A 50 -10.981 -11.615 0.397 1.00 0.00 C ATOM 688 CZ PHE A 50 -10.265 -10.517 -0.038 1.00 0.00 C ATOM 0 H PHE A 50 -7.551 -11.422 3.637 1.00 0.00 H new ATOM 0 HA PHE A 50 -9.353 -12.404 5.719 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.339 -12.040 4.336 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.574 -10.508 4.705 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.165 -9.382 2.936 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -11.603 -12.769 2.080 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.051 -8.856 0.540 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -11.493 -12.244 -0.317 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.216 -10.286 -1.092 1.00 0.00 H new ATOM 698 N ALA A 51 -9.732 -14.530 4.373 1.00 0.00 N ATOM 699 CA ALA A 51 -9.666 -15.836 3.730 1.00 0.00 C ATOM 700 C ALA A 51 -10.176 -15.749 2.297 1.00 0.00 C ATOM 701 O ALA A 51 -11.084 -14.972 2.001 1.00 0.00 O ATOM 702 CB ALA A 51 -10.472 -16.856 4.519 1.00 0.00 C ATOM 0 H ALA A 51 -10.335 -14.494 5.195 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.625 -16.159 3.708 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.413 -17.826 4.026 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -10.069 -16.937 5.528 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.513 -16.537 4.569 1.00 0.00 H new ATOM 708 N GLY A 52 -9.595 -16.549 1.409 1.00 0.00 N ATOM 709 CA GLY A 52 -10.010 -16.521 0.019 1.00 0.00 C ATOM 710 C GLY A 52 -9.375 -17.616 -0.809 1.00 0.00 C ATOM 711 O GLY A 52 -8.769 -18.541 -0.270 1.00 0.00 O ATOM 0 H GLY A 52 -8.850 -17.211 1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.095 -16.616 -0.033 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.754 -15.553 -0.411 1.00 0.00 H new ATOM 715 N VAL A 53 -9.520 -17.510 -2.124 1.00 0.00 N ATOM 716 CA VAL A 53 -8.957 -18.491 -3.041 1.00 0.00 C ATOM 717 C VAL A 53 -8.036 -17.820 -4.054 1.00 0.00 C ATOM 718 O VAL A 53 -8.440 -16.886 -4.747 1.00 0.00 O ATOM 719 CB VAL A 53 -10.066 -19.253 -3.794 1.00 0.00 C ATOM 720 CG1 VAL A 53 -9.471 -20.359 -4.653 1.00 0.00 C ATOM 721 CG2 VAL A 53 -11.084 -19.818 -2.815 1.00 0.00 C ATOM 0 H VAL A 53 -10.025 -16.750 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.383 -19.199 -2.443 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.578 -18.552 -4.453 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -10.271 -20.884 -5.176 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.785 -19.925 -5.381 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.930 -21.061 -4.019 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -11.859 -20.352 -3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -10.587 -20.504 -2.129 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -11.536 -19.003 -2.250 1.00 0.00 H new ATOM 731 N VAL A 54 -6.799 -18.297 -4.134 1.00 0.00 N ATOM 732 CA VAL A 54 -5.827 -17.734 -5.062 1.00 0.00 C ATOM 733 C VAL A 54 -6.167 -18.101 -6.502 1.00 0.00 C ATOM 734 O VAL A 54 -6.025 -19.252 -6.912 1.00 0.00 O ATOM 735 CB VAL A 54 -4.396 -18.211 -4.741 1.00 0.00 C ATOM 736 CG1 VAL A 54 -3.412 -17.711 -5.789 1.00 0.00 C ATOM 737 CG2 VAL A 54 -3.985 -17.749 -3.354 1.00 0.00 C ATOM 0 H VAL A 54 -6.447 -19.070 -3.569 1.00 0.00 H new ATOM 0 HA VAL A 54 -5.871 -16.651 -4.947 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.384 -19.301 -4.760 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.409 -18.060 -5.542 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.698 -18.094 -6.769 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.423 -16.621 -5.808 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.973 -18.093 -3.141 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.015 -16.660 -3.309 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.671 -18.162 -2.615 1.00 0.00 H new ATOM 747 N LYS A 55 -6.619 -17.108 -7.260 1.00 0.00 N ATOM 748 CA LYS A 55 -6.981 -17.315 -8.656 1.00 0.00 C ATOM 749 C LYS A 55 -5.752 -17.224 -9.553 1.00 0.00 C ATOM 750 O LYS A 55 -5.331 -18.216 -10.148 1.00 0.00 O ATOM 751 CB LYS A 55 -8.021 -16.280 -9.092 1.00 0.00 C ATOM 752 CG LYS A 55 -8.480 -16.447 -10.533 1.00 0.00 C ATOM 753 CD LYS A 55 -9.389 -15.307 -10.967 1.00 0.00 C ATOM 754 CE LYS A 55 -10.717 -15.335 -10.227 1.00 0.00 C ATOM 755 NZ LYS A 55 -11.607 -14.216 -10.643 1.00 0.00 N ATOM 0 H LYS A 55 -6.743 -16.151 -6.930 1.00 0.00 H new ATOM 0 HA LYS A 55 -7.408 -18.313 -8.752 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -8.887 -16.348 -8.434 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -7.602 -15.281 -8.966 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -7.611 -16.490 -11.190 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -9.008 -17.395 -10.640 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.891 -14.355 -10.785 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.569 -15.373 -12.040 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.217 -16.285 -10.414 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -10.536 -15.276 -9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -12.580 -14.414 -10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -11.279 -13.331 -10.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -11.585 -14.121 -11.678 1.00 0.00 H new ATOM 769 N GLU A 56 -5.179 -16.027 -9.643 1.00 0.00 N ATOM 770 CA GLU A 56 -3.998 -15.798 -10.469 1.00 0.00 C ATOM 771 C GLU A 56 -3.133 -14.688 -9.881 1.00 0.00 C ATOM 772 O GLU A 56 -3.620 -13.591 -9.603 1.00 0.00 O ATOM 773 CB GLU A 56 -4.406 -15.431 -11.899 1.00 0.00 C ATOM 774 CG GLU A 56 -5.040 -16.577 -12.671 1.00 0.00 C ATOM 775 CD GLU A 56 -5.423 -16.182 -14.084 1.00 0.00 C ATOM 776 OE1 GLU A 56 -4.565 -16.297 -14.986 1.00 0.00 O ATOM 777 OE2 GLU A 56 -6.578 -15.755 -14.290 1.00 0.00 O ATOM 0 H GLU A 56 -5.515 -15.198 -9.152 1.00 0.00 H new ATOM 0 HA GLU A 56 -3.419 -16.721 -10.489 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.107 -14.597 -11.864 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -3.526 -15.084 -12.440 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.344 -17.415 -12.707 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -5.927 -16.922 -12.140 1.00 0.00 H new ATOM 784 N LEU A 57 -1.849 -14.977 -9.694 1.00 0.00 N ATOM 785 CA LEU A 57 -0.917 -13.999 -9.143 1.00 0.00 C ATOM 786 C LEU A 57 -0.862 -12.749 -10.018 1.00 0.00 C ATOM 787 O LEU A 57 -1.109 -12.812 -11.222 1.00 0.00 O ATOM 788 CB LEU A 57 0.485 -14.609 -9.005 1.00 0.00 C ATOM 789 CG LEU A 57 1.327 -14.639 -10.286 1.00 0.00 C ATOM 790 CD1 LEU A 57 2.733 -15.131 -9.983 1.00 0.00 C ATOM 791 CD2 LEU A 57 0.675 -15.517 -11.344 1.00 0.00 C ATOM 0 H LEU A 57 -1.430 -15.880 -9.916 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.274 -13.713 -8.154 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.032 -14.049 -8.246 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.382 -15.629 -8.636 1.00 0.00 H new ATOM 0 HG LEU A 57 1.388 -13.623 -10.677 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.319 -15.147 -10.902 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.205 -14.462 -9.263 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.685 -16.137 -9.566 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.291 -15.522 -12.243 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.579 -16.534 -10.964 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.313 -15.125 -11.584 1.00 0.00 H new ATOM 803 N LYS A 58 -0.541 -11.613 -9.404 1.00 0.00 N ATOM 804 CA LYS A 58 -0.455 -10.349 -10.126 1.00 0.00 C ATOM 805 C LYS A 58 0.985 -9.849 -10.172 1.00 0.00 C ATOM 806 O LYS A 58 1.349 -9.045 -11.032 1.00 0.00 O ATOM 807 CB LYS A 58 -1.354 -9.301 -9.464 1.00 0.00 C ATOM 808 CG LYS A 58 -1.418 -7.984 -10.220 1.00 0.00 C ATOM 809 CD LYS A 58 -2.095 -8.147 -11.571 1.00 0.00 C ATOM 810 CE LYS A 58 -2.238 -6.814 -12.289 1.00 0.00 C ATOM 811 NZ LYS A 58 -2.872 -6.970 -13.627 1.00 0.00 N ATOM 0 H LYS A 58 -0.336 -11.543 -8.407 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.795 -10.515 -11.148 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.362 -9.706 -9.372 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.993 -9.112 -8.453 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.962 -7.249 -9.626 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -0.409 -7.596 -10.362 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.516 -8.833 -12.189 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.079 -8.595 -11.434 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.836 -6.136 -11.680 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.256 -6.356 -12.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -2.952 -6.039 -14.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.288 -7.597 -14.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.820 -7.383 -13.516 1.00 0.00 H new ATOM 825 N VAL A 59 1.800 -10.332 -9.241 1.00 0.00 N ATOM 826 CA VAL A 59 3.202 -9.940 -9.169 1.00 0.00 C ATOM 827 C VAL A 59 4.118 -11.154 -9.288 1.00 0.00 C ATOM 828 O VAL A 59 3.714 -12.278 -8.991 1.00 0.00 O ATOM 829 CB VAL A 59 3.512 -9.204 -7.851 1.00 0.00 C ATOM 830 CG1 VAL A 59 2.723 -7.906 -7.766 1.00 0.00 C ATOM 831 CG2 VAL A 59 3.209 -10.096 -6.656 1.00 0.00 C ATOM 0 H VAL A 59 1.512 -10.998 -8.524 1.00 0.00 H new ATOM 0 HA VAL A 59 3.386 -9.265 -10.005 1.00 0.00 H new ATOM 0 HB VAL A 59 4.574 -8.961 -7.835 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.955 -7.400 -6.829 1.00 0.00 H new ATOM 0 HG12 VAL A 59 2.992 -7.261 -8.603 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.656 -8.125 -7.806 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.434 -9.559 -5.735 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.155 -10.372 -6.666 1.00 0.00 H new ATOM 0 HG23 VAL A 59 3.821 -10.997 -6.710 1.00 0.00 H new ATOM 841 N ASN A 60 5.350 -10.919 -9.725 1.00 0.00 N ATOM 842 CA ASN A 60 6.322 -11.994 -9.882 1.00 0.00 C ATOM 843 C ASN A 60 7.383 -11.923 -8.790 1.00 0.00 C ATOM 844 O ASN A 60 7.691 -10.846 -8.279 1.00 0.00 O ATOM 845 CB ASN A 60 6.986 -11.915 -11.259 1.00 0.00 C ATOM 846 CG ASN A 60 5.984 -11.782 -12.393 1.00 0.00 C ATOM 847 OD1 ASN A 60 6.247 -11.106 -13.388 1.00 0.00 O ATOM 848 ND2 ASN A 60 4.832 -12.430 -12.258 1.00 0.00 N ATOM 0 H ASN A 60 5.699 -9.994 -9.977 1.00 0.00 H new ATOM 0 HA ASN A 60 5.795 -12.944 -9.796 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.666 -11.063 -11.280 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.589 -12.809 -11.417 1.00 0.00 H new ATOM 0 HD21 ASN A 60 4.128 -12.378 -12.994 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.652 -12.980 -11.418 1.00 0.00 H new ATOM 855 N VAL A 61 7.938 -13.077 -8.436 1.00 0.00 N ATOM 856 CA VAL A 61 8.965 -13.146 -7.406 1.00 0.00 C ATOM 857 C VAL A 61 10.246 -12.453 -7.864 1.00 0.00 C ATOM 858 O VAL A 61 10.805 -12.788 -8.908 1.00 0.00 O ATOM 859 CB VAL A 61 9.285 -14.606 -7.030 1.00 0.00 C ATOM 860 CG1 VAL A 61 10.299 -14.661 -5.897 1.00 0.00 C ATOM 861 CG2 VAL A 61 8.012 -15.348 -6.651 1.00 0.00 C ATOM 0 H VAL A 61 7.693 -13.977 -8.848 1.00 0.00 H new ATOM 0 HA VAL A 61 8.572 -12.633 -6.528 1.00 0.00 H new ATOM 0 HB VAL A 61 9.723 -15.097 -7.899 1.00 0.00 H new ATOM 0 HG11 VAL A 61 10.510 -15.701 -5.648 1.00 0.00 H new ATOM 0 HG12 VAL A 61 11.220 -14.168 -6.209 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.894 -14.153 -5.022 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.255 -16.377 -6.388 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.545 -14.856 -5.798 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.323 -15.342 -7.495 1.00 0.00 H new ATOM 871 N GLY A 62 10.702 -11.486 -7.076 1.00 0.00 N ATOM 872 CA GLY A 62 11.908 -10.755 -7.417 1.00 0.00 C ATOM 873 C GLY A 62 11.610 -9.364 -7.936 1.00 0.00 C ATOM 874 O GLY A 62 12.472 -8.716 -8.529 1.00 0.00 O ATOM 0 H GLY A 62 10.257 -11.195 -6.206 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.547 -10.683 -6.537 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.466 -11.310 -8.171 1.00 0.00 H new ATOM 878 N ASP A 63 10.382 -8.904 -7.711 1.00 0.00 N ATOM 879 CA ASP A 63 9.965 -7.582 -8.160 1.00 0.00 C ATOM 880 C ASP A 63 9.619 -6.684 -6.976 1.00 0.00 C ATOM 881 O ASP A 63 8.673 -6.953 -6.235 1.00 0.00 O ATOM 882 CB ASP A 63 8.764 -7.694 -9.098 1.00 0.00 C ATOM 883 CG ASP A 63 9.096 -8.444 -10.373 1.00 0.00 C ATOM 884 OD1 ASP A 63 9.169 -9.691 -10.327 1.00 0.00 O ATOM 885 OD2 ASP A 63 9.282 -7.786 -11.417 1.00 0.00 O ATOM 0 H ASP A 63 9.659 -9.429 -7.220 1.00 0.00 H new ATOM 0 HA ASP A 63 10.799 -7.132 -8.699 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.949 -8.202 -8.582 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.408 -6.695 -9.349 1.00 0.00 H new ATOM 890 N LYS A 64 10.400 -5.622 -6.806 1.00 0.00 N ATOM 891 CA LYS A 64 10.191 -4.668 -5.723 1.00 0.00 C ATOM 892 C LYS A 64 8.733 -4.218 -5.655 1.00 0.00 C ATOM 893 O LYS A 64 8.076 -4.043 -6.681 1.00 0.00 O ATOM 894 CB LYS A 64 11.104 -3.454 -5.912 1.00 0.00 C ATOM 895 CG LYS A 64 11.011 -2.443 -4.782 1.00 0.00 C ATOM 896 CD LYS A 64 11.986 -1.291 -4.972 1.00 0.00 C ATOM 897 CE LYS A 64 11.637 -0.453 -6.193 1.00 0.00 C ATOM 898 NZ LYS A 64 12.542 0.720 -6.337 1.00 0.00 N ATOM 0 H LYS A 64 11.191 -5.399 -7.411 1.00 0.00 H new ATOM 0 HA LYS A 64 10.437 -5.164 -4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 64 12.135 -3.795 -5.999 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.851 -2.962 -6.851 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.995 -2.053 -4.726 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.215 -2.939 -3.833 1.00 0.00 H new ATOM 0 HD2 LYS A 64 11.980 -0.659 -4.084 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.997 -1.684 -5.077 1.00 0.00 H new ATOM 0 HE2 LYS A 64 11.699 -1.072 -7.088 1.00 0.00 H new ATOM 0 HE3 LYS A 64 10.606 -0.109 -6.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.272 1.266 -7.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.464 1.324 -5.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.523 0.391 -6.437 1.00 0.00 H new ATOM 912 N VAL A 65 8.238 -4.033 -4.434 1.00 0.00 N ATOM 913 CA VAL A 65 6.859 -3.608 -4.217 1.00 0.00 C ATOM 914 C VAL A 65 6.804 -2.183 -3.670 1.00 0.00 C ATOM 915 O VAL A 65 7.773 -1.695 -3.087 1.00 0.00 O ATOM 916 CB VAL A 65 6.136 -4.552 -3.234 1.00 0.00 C ATOM 917 CG1 VAL A 65 6.664 -4.363 -1.820 1.00 0.00 C ATOM 918 CG2 VAL A 65 4.632 -4.332 -3.281 1.00 0.00 C ATOM 0 H VAL A 65 8.774 -4.171 -3.577 1.00 0.00 H new ATOM 0 HA VAL A 65 6.356 -3.642 -5.184 1.00 0.00 H new ATOM 0 HB VAL A 65 6.338 -5.579 -3.539 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.141 -5.038 -1.143 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.731 -4.582 -1.798 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.499 -3.333 -1.505 1.00 0.00 H new ATOM 0 HG21 VAL A 65 4.143 -5.008 -2.580 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.406 -3.301 -3.008 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.267 -4.528 -4.289 1.00 0.00 H new ATOM 928 N LYS A 66 5.666 -1.524 -3.860 1.00 0.00 N ATOM 929 CA LYS A 66 5.482 -0.159 -3.379 1.00 0.00 C ATOM 930 C LYS A 66 4.061 0.048 -2.867 1.00 0.00 C ATOM 931 O LYS A 66 3.142 -0.676 -3.250 1.00 0.00 O ATOM 932 CB LYS A 66 5.791 0.847 -4.488 1.00 0.00 C ATOM 933 CG LYS A 66 7.236 0.805 -4.962 1.00 0.00 C ATOM 934 CD LYS A 66 7.506 1.852 -6.033 1.00 0.00 C ATOM 935 CE LYS A 66 7.435 3.262 -5.469 1.00 0.00 C ATOM 936 NZ LYS A 66 8.426 3.474 -4.378 1.00 0.00 N ATOM 0 H LYS A 66 4.857 -1.913 -4.344 1.00 0.00 H new ATOM 0 HA LYS A 66 6.175 0.004 -2.554 1.00 0.00 H new ATOM 0 HB2 LYS A 66 5.133 0.654 -5.336 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.564 1.851 -4.130 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.902 0.970 -4.115 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.461 -0.186 -5.356 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.491 1.683 -6.468 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.780 1.745 -6.838 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.615 3.982 -6.268 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.431 3.451 -5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 8.565 4.494 -4.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.074 3.041 -3.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 9.332 3.036 -4.642 1.00 0.00 H new ATOM 950 N THR A 67 3.888 1.039 -2.001 1.00 0.00 N ATOM 951 CA THR A 67 2.580 1.342 -1.434 1.00 0.00 C ATOM 952 C THR A 67 1.588 1.745 -2.521 1.00 0.00 C ATOM 953 O THR A 67 1.812 2.711 -3.251 1.00 0.00 O ATOM 954 CB THR A 67 2.671 2.472 -0.393 1.00 0.00 C ATOM 955 OG1 THR A 67 3.191 3.660 -1.002 1.00 0.00 O ATOM 956 CG2 THR A 67 3.561 2.062 0.770 1.00 0.00 C ATOM 0 H THR A 67 4.639 1.648 -1.676 1.00 0.00 H new ATOM 0 HA THR A 67 2.228 0.434 -0.945 1.00 0.00 H new ATOM 0 HB THR A 67 1.668 2.669 -0.013 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.988 3.652 -1.961 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.611 2.875 1.494 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.148 1.175 1.249 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.563 1.842 0.401 1.00 0.00 H new ATOM 964 N GLY A 68 0.492 0.998 -2.621 1.00 0.00 N ATOM 965 CA GLY A 68 -0.520 1.294 -3.620 1.00 0.00 C ATOM 966 C GLY A 68 -0.552 0.272 -4.740 1.00 0.00 C ATOM 967 O GLY A 68 -1.437 0.305 -5.595 1.00 0.00 O ATOM 0 H GLY A 68 0.287 0.194 -2.028 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.498 1.332 -3.140 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.332 2.282 -4.040 1.00 0.00 H new ATOM 971 N SER A 69 0.417 -0.641 -4.736 1.00 0.00 N ATOM 972 CA SER A 69 0.495 -1.676 -5.761 1.00 0.00 C ATOM 973 C SER A 69 -0.253 -2.931 -5.325 1.00 0.00 C ATOM 974 O SER A 69 -0.218 -3.312 -4.156 1.00 0.00 O ATOM 975 CB SER A 69 1.955 -2.021 -6.061 1.00 0.00 C ATOM 976 OG SER A 69 2.575 -2.632 -4.943 1.00 0.00 O ATOM 0 H SER A 69 1.157 -0.684 -4.035 1.00 0.00 H new ATOM 0 HA SER A 69 0.027 -1.289 -6.666 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.005 -2.691 -6.919 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.498 -1.115 -6.332 1.00 0.00 H new ATOM 0 HG SER A 69 2.793 -1.948 -4.276 1.00 0.00 H new ATOM 982 N LEU A 70 -0.930 -3.569 -6.275 1.00 0.00 N ATOM 983 CA LEU A 70 -1.684 -4.784 -5.991 1.00 0.00 C ATOM 984 C LEU A 70 -0.774 -6.006 -6.030 1.00 0.00 C ATOM 985 O LEU A 70 0.181 -6.055 -6.806 1.00 0.00 O ATOM 986 CB LEU A 70 -2.825 -4.947 -7.000 1.00 0.00 C ATOM 987 CG LEU A 70 -3.795 -3.767 -7.078 1.00 0.00 C ATOM 988 CD1 LEU A 70 -4.779 -3.960 -8.222 1.00 0.00 C ATOM 989 CD2 LEU A 70 -4.537 -3.597 -5.760 1.00 0.00 C ATOM 0 H LEU A 70 -0.972 -3.264 -7.248 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.105 -4.699 -4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.395 -5.110 -7.988 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.389 -5.845 -6.746 1.00 0.00 H new ATOM 0 HG LEU A 70 -3.219 -2.861 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.461 -3.111 -8.262 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.233 -4.032 -9.163 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.348 -4.876 -8.062 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.222 -2.753 -5.835 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.101 -4.504 -5.540 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.820 -3.413 -4.960 1.00 0.00 H new ATOM 1001 N ILE A 71 -1.073 -6.991 -5.189 1.00 0.00 N ATOM 1002 CA ILE A 71 -0.277 -8.210 -5.128 1.00 0.00 C ATOM 1003 C ILE A 71 -1.064 -9.417 -5.633 1.00 0.00 C ATOM 1004 O ILE A 71 -0.599 -10.145 -6.510 1.00 0.00 O ATOM 1005 CB ILE A 71 0.223 -8.489 -3.696 1.00 0.00 C ATOM 1006 CG1 ILE A 71 -0.906 -8.275 -2.683 1.00 0.00 C ATOM 1007 CG2 ILE A 71 1.413 -7.598 -3.371 1.00 0.00 C ATOM 1008 CD1 ILE A 71 -0.532 -8.648 -1.264 1.00 0.00 C ATOM 0 H ILE A 71 -1.860 -6.968 -4.541 1.00 0.00 H new ATOM 0 HA ILE A 71 0.584 -8.052 -5.777 1.00 0.00 H new ATOM 0 HB ILE A 71 0.543 -9.529 -3.634 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.209 -7.228 -2.706 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.771 -8.864 -2.988 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.756 -7.805 -2.357 1.00 0.00 H new ATOM 0 HG22 ILE A 71 2.220 -7.798 -4.075 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.116 -6.552 -3.447 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.382 -8.469 -0.605 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -0.258 -9.702 -1.225 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.313 -8.041 -0.939 1.00 0.00 H new ATOM 1020 N MET A 72 -2.256 -9.624 -5.080 1.00 0.00 N ATOM 1021 CA MET A 72 -3.100 -10.746 -5.480 1.00 0.00 C ATOM 1022 C MET A 72 -4.579 -10.397 -5.355 1.00 0.00 C ATOM 1023 O MET A 72 -4.941 -9.366 -4.786 1.00 0.00 O ATOM 1024 CB MET A 72 -2.790 -11.983 -4.630 1.00 0.00 C ATOM 1025 CG MET A 72 -1.414 -12.575 -4.888 1.00 0.00 C ATOM 1026 SD MET A 72 -1.107 -14.061 -3.915 1.00 0.00 S ATOM 1027 CE MET A 72 0.538 -14.499 -4.475 1.00 0.00 C ATOM 0 H MET A 72 -2.659 -9.031 -4.355 1.00 0.00 H new ATOM 0 HA MET A 72 -2.882 -10.964 -6.525 1.00 0.00 H new ATOM 0 HB2 MET A 72 -2.869 -11.717 -3.576 1.00 0.00 H new ATOM 0 HB3 MET A 72 -3.545 -12.745 -4.824 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.317 -12.812 -5.947 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.653 -11.830 -4.657 1.00 0.00 H new ATOM 0 HE1 MET A 72 0.869 -15.402 -3.962 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.521 -14.678 -5.550 1.00 0.00 H new ATOM 0 HE3 MET A 72 1.227 -13.684 -4.254 1.00 0.00 H new ATOM 1037 N ILE A 73 -5.430 -11.265 -5.895 1.00 0.00 N ATOM 1038 CA ILE A 73 -6.874 -11.061 -5.847 1.00 0.00 C ATOM 1039 C ILE A 73 -7.582 -12.337 -5.402 1.00 0.00 C ATOM 1040 O ILE A 73 -7.333 -13.415 -5.942 1.00 0.00 O ATOM 1041 CB ILE A 73 -7.430 -10.637 -7.220 1.00 0.00 C ATOM 1042 CG1 ILE A 73 -6.604 -9.484 -7.798 1.00 0.00 C ATOM 1043 CG2 ILE A 73 -8.895 -10.243 -7.099 1.00 0.00 C ATOM 1044 CD1 ILE A 73 -6.975 -9.127 -9.223 1.00 0.00 C ATOM 0 H ILE A 73 -5.143 -12.119 -6.372 1.00 0.00 H new ATOM 0 HA ILE A 73 -7.061 -10.264 -5.128 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.358 -11.484 -7.902 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.732 -8.605 -7.167 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.548 -9.751 -7.762 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.274 -9.946 -8.077 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.471 -11.092 -6.729 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -8.991 -9.409 -6.404 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.350 -8.303 -9.566 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.820 -9.993 -9.867 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -8.023 -8.828 -9.262 1.00 0.00 H new ATOM 1056 N PHE A 74 -8.462 -12.211 -4.414 1.00 0.00 N ATOM 1057 CA PHE A 74 -9.200 -13.361 -3.902 1.00 0.00 C ATOM 1058 C PHE A 74 -10.665 -13.324 -4.319 1.00 0.00 C ATOM 1059 O PHE A 74 -11.330 -12.294 -4.204 1.00 0.00 O ATOM 1060 CB PHE A 74 -9.104 -13.409 -2.379 1.00 0.00 C ATOM 1061 CG PHE A 74 -7.701 -13.547 -1.878 1.00 0.00 C ATOM 1062 CD1 PHE A 74 -7.025 -14.747 -2.006 1.00 0.00 C ATOM 1063 CD2 PHE A 74 -7.056 -12.477 -1.283 1.00 0.00 C ATOM 1064 CE1 PHE A 74 -5.732 -14.881 -1.549 1.00 0.00 C ATOM 1065 CE2 PHE A 74 -5.762 -12.603 -0.821 1.00 0.00 C ATOM 1066 CZ PHE A 74 -5.097 -13.808 -0.953 1.00 0.00 C ATOM 0 H PHE A 74 -8.681 -11.328 -3.953 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.749 -14.257 -4.330 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.542 -12.501 -1.966 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.698 -14.246 -2.011 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.517 -15.589 -2.470 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.571 -11.533 -1.179 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -5.215 -15.823 -1.656 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.269 -11.761 -0.357 1.00 0.00 H new ATOM 0 HZ PHE A 74 -4.084 -13.910 -0.591 1.00 0.00 H new ATOM 1076 N GLU A 75 -11.159 -14.461 -4.799 1.00 0.00 N ATOM 1077 CA GLU A 75 -12.551 -14.575 -5.216 1.00 0.00 C ATOM 1078 C GLU A 75 -13.359 -15.288 -4.136 1.00 0.00 C ATOM 1079 O GLU A 75 -13.436 -16.516 -4.112 1.00 0.00 O ATOM 1080 CB GLU A 75 -12.654 -15.335 -6.542 1.00 0.00 C ATOM 1081 CG GLU A 75 -14.081 -15.490 -7.045 1.00 0.00 C ATOM 1082 CD GLU A 75 -14.154 -16.198 -8.385 1.00 0.00 C ATOM 1083 OE1 GLU A 75 -14.152 -17.447 -8.398 1.00 0.00 O ATOM 1084 OE2 GLU A 75 -14.217 -15.503 -9.420 1.00 0.00 O ATOM 0 H GLU A 75 -10.615 -15.317 -4.909 1.00 0.00 H new ATOM 0 HA GLU A 75 -12.956 -13.574 -5.361 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -12.066 -14.813 -7.297 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.211 -16.323 -6.420 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -14.662 -16.048 -6.311 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -14.540 -14.505 -7.133 1.00 0.00 H new ATOM 1091 N VAL A 76 -13.953 -14.506 -3.241 1.00 0.00 N ATOM 1092 CA VAL A 76 -14.745 -15.057 -2.150 1.00 0.00 C ATOM 1093 C VAL A 76 -16.219 -15.140 -2.527 1.00 0.00 C ATOM 1094 O VAL A 76 -16.707 -14.353 -3.338 1.00 0.00 O ATOM 1095 CB VAL A 76 -14.589 -14.210 -0.869 1.00 0.00 C ATOM 1096 CG1 VAL A 76 -15.099 -12.795 -1.096 1.00 0.00 C ATOM 1097 CG2 VAL A 76 -15.307 -14.864 0.301 1.00 0.00 C ATOM 0 H VAL A 76 -13.900 -13.487 -3.251 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.373 -16.063 -1.958 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.528 -14.153 -0.624 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -14.980 -12.214 -0.181 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -14.529 -12.327 -1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.153 -12.828 -1.370 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -15.184 -14.250 1.193 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -16.368 -14.959 0.070 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.885 -15.853 0.480 1.00 0.00 H new ATOM 1853 N SER B 43 -15.460 -10.653 -4.714 1.00 0.00 N ATOM 1854 CA SER B 43 -14.009 -10.611 -4.862 1.00 0.00 C ATOM 1855 C SER B 43 -13.483 -9.194 -4.661 1.00 0.00 C ATOM 1856 O SER B 43 -14.113 -8.224 -5.086 1.00 0.00 O ATOM 1857 CB SER B 43 -13.602 -11.125 -6.244 1.00 0.00 C ATOM 1858 OG SER B 43 -12.200 -11.025 -6.432 1.00 0.00 O ATOM 0 HA SER B 43 -13.572 -11.254 -4.098 1.00 0.00 H new ATOM 0 HB2 SER B 43 -13.914 -12.163 -6.356 1.00 0.00 H new ATOM 0 HB3 SER B 43 -14.117 -10.552 -7.015 1.00 0.00 H new ATOM 0 HG SER B 43 -11.738 -11.452 -5.681 1.00 0.00 H new ATOM 1864 N MET B 44 -12.330 -9.081 -4.011 1.00 0.00 N ATOM 1865 CA MET B 44 -11.725 -7.781 -3.756 1.00 0.00 C ATOM 1866 C MET B 44 -10.202 -7.868 -3.794 1.00 0.00 C ATOM 1867 O MET B 44 -9.598 -8.672 -3.085 1.00 0.00 O ATOM 1868 CB MET B 44 -12.185 -7.243 -2.400 1.00 0.00 C ATOM 1869 CG MET B 44 -11.576 -5.901 -2.042 1.00 0.00 C ATOM 1870 SD MET B 44 -11.906 -4.637 -3.283 1.00 0.00 S ATOM 1871 CE MET B 44 -10.855 -3.313 -2.696 1.00 0.00 C ATOM 0 H MET B 44 -11.797 -9.873 -3.652 1.00 0.00 H new ATOM 0 HA MET B 44 -12.047 -7.097 -4.541 1.00 0.00 H new ATOM 0 HB2 MET B 44 -13.271 -7.150 -2.405 1.00 0.00 H new ATOM 0 HB3 MET B 44 -11.930 -7.967 -1.626 1.00 0.00 H new ATOM 0 HG2 MET B 44 -11.970 -5.572 -1.080 1.00 0.00 H new ATOM 0 HG3 MET B 44 -10.499 -6.015 -1.923 1.00 0.00 H new ATOM 0 HE1 MET B 44 -10.947 -2.454 -3.360 1.00 0.00 H new ATOM 0 HE2 MET B 44 -11.158 -3.027 -1.689 1.00 0.00 H new ATOM 0 HE3 MET B 44 -9.819 -3.651 -2.681 1.00 0.00 H new ATOM 1881 N GLU B 45 -9.588 -7.033 -4.628 1.00 0.00 N ATOM 1882 CA GLU B 45 -8.135 -7.009 -4.759 1.00 0.00 C ATOM 1883 C GLU B 45 -7.487 -6.474 -3.486 1.00 0.00 C ATOM 1884 O GLU B 45 -8.068 -5.640 -2.789 1.00 0.00 O ATOM 1885 CB GLU B 45 -7.726 -6.145 -5.954 1.00 0.00 C ATOM 1886 CG GLU B 45 -8.467 -6.486 -7.238 1.00 0.00 C ATOM 1887 CD GLU B 45 -8.050 -5.610 -8.403 1.00 0.00 C ATOM 1888 OE1 GLU B 45 -7.098 -5.987 -9.117 1.00 0.00 O ATOM 1889 OE2 GLU B 45 -8.674 -4.546 -8.599 1.00 0.00 O ATOM 0 H GLU B 45 -10.075 -6.364 -5.224 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.790 -8.030 -4.922 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -7.902 -5.097 -5.711 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -6.655 -6.257 -6.122 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.286 -7.531 -7.491 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -9.539 -6.379 -7.074 1.00 0.00 H new ATOM 1896 N VAL B 46 -6.284 -6.954 -3.186 1.00 0.00 N ATOM 1897 CA VAL B 46 -5.565 -6.514 -1.997 1.00 0.00 C ATOM 1898 C VAL B 46 -4.207 -5.914 -2.366 1.00 0.00 C ATOM 1899 O VAL B 46 -3.496 -6.450 -3.216 1.00 0.00 O ATOM 1900 CB VAL B 46 -5.355 -7.671 -0.999 1.00 0.00 C ATOM 1901 CG1 VAL B 46 -6.692 -8.204 -0.510 1.00 0.00 C ATOM 1902 CG2 VAL B 46 -4.530 -8.784 -1.627 1.00 0.00 C ATOM 0 H VAL B 46 -5.788 -7.646 -3.748 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.180 -5.749 -1.522 1.00 0.00 H new ATOM 0 HB VAL B 46 -4.805 -7.285 -0.141 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -6.523 -9.020 0.193 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -7.243 -7.405 -0.014 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.270 -8.570 -1.358 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -4.395 -9.589 -0.904 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -5.047 -9.169 -2.506 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -3.556 -8.393 -1.921 1.00 0.00 H new ATOM 1912 N PRO B 47 -3.826 -4.786 -1.733 1.00 0.00 N ATOM 1913 CA PRO B 47 -2.563 -4.116 -1.990 1.00 0.00 C ATOM 1914 C PRO B 47 -1.519 -4.400 -0.915 1.00 0.00 C ATOM 1915 O PRO B 47 -1.818 -5.020 0.106 1.00 0.00 O ATOM 1916 CB PRO B 47 -2.990 -2.653 -1.932 1.00 0.00 C ATOM 1917 CG PRO B 47 -4.088 -2.612 -0.906 1.00 0.00 C ATOM 1918 CD PRO B 47 -4.610 -4.028 -0.749 1.00 0.00 C ATOM 0 HA PRO B 47 -2.092 -4.432 -2.921 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -2.158 -2.009 -1.646 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -3.343 -2.305 -2.903 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -3.712 -2.233 0.044 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -4.886 -1.941 -1.223 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -4.457 -4.403 0.263 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -5.679 -4.088 -0.953 1.00 0.00 H new ATOM 1926 N ALA B 48 -0.293 -3.942 -1.151 1.00 0.00 N ATOM 1927 CA ALA B 48 0.793 -4.147 -0.199 1.00 0.00 C ATOM 1928 C ALA B 48 0.707 -3.148 0.954 1.00 0.00 C ATOM 1929 O ALA B 48 0.347 -1.988 0.749 1.00 0.00 O ATOM 1930 CB ALA B 48 2.137 -4.030 -0.902 1.00 0.00 C ATOM 0 H ALA B 48 -0.028 -3.428 -1.991 1.00 0.00 H new ATOM 0 HA ALA B 48 0.698 -5.150 0.216 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.940 -4.185 -0.181 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.204 -4.783 -1.687 1.00 0.00 H new ATOM 0 HB3 ALA B 48 2.232 -3.038 -1.343 1.00 0.00 H new ATOM 1936 N PRO B 49 1.035 -3.583 2.186 1.00 0.00 N ATOM 1937 CA PRO B 49 0.986 -2.712 3.365 1.00 0.00 C ATOM 1938 C PRO B 49 2.089 -1.657 3.358 1.00 0.00 C ATOM 1939 O PRO B 49 1.848 -0.493 3.677 1.00 0.00 O ATOM 1940 CB PRO B 49 1.179 -3.680 4.533 1.00 0.00 C ATOM 1941 CG PRO B 49 1.931 -4.829 3.955 1.00 0.00 C ATOM 1942 CD PRO B 49 1.476 -4.950 2.527 1.00 0.00 C ATOM 0 HA PRO B 49 0.055 -2.147 3.412 1.00 0.00 H new ATOM 0 HB2 PRO B 49 1.734 -3.213 5.346 1.00 0.00 H new ATOM 0 HB3 PRO B 49 0.221 -4.000 4.944 1.00 0.00 H new ATOM 0 HG2 PRO B 49 3.006 -4.657 4.008 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.727 -5.746 4.508 1.00 0.00 H new ATOM 0 HD2 PRO B 49 2.284 -5.285 1.876 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.664 -5.670 2.424 1.00 0.00 H new ATOM 1950 N PHE B 50 3.300 -2.072 2.995 1.00 0.00 N ATOM 1951 CA PHE B 50 4.437 -1.158 2.950 1.00 0.00 C ATOM 1952 C PHE B 50 5.399 -1.536 1.829 1.00 0.00 C ATOM 1953 O PHE B 50 5.466 -2.695 1.419 1.00 0.00 O ATOM 1954 CB PHE B 50 5.176 -1.159 4.291 1.00 0.00 C ATOM 1955 CG PHE B 50 5.786 -2.487 4.642 1.00 0.00 C ATOM 1956 CD1 PHE B 50 5.013 -3.493 5.198 1.00 0.00 C ATOM 1957 CD2 PHE B 50 7.130 -2.730 4.410 1.00 0.00 C ATOM 1958 CE1 PHE B 50 5.568 -4.715 5.520 1.00 0.00 C ATOM 1959 CE2 PHE B 50 7.692 -3.952 4.730 1.00 0.00 C ATOM 1960 CZ PHE B 50 6.909 -4.946 5.284 1.00 0.00 C ATOM 0 H PHE B 50 3.518 -3.032 2.729 1.00 0.00 H new ATOM 0 HA PHE B 50 4.054 -0.157 2.754 1.00 0.00 H new ATOM 0 HB2 PHE B 50 5.962 -0.404 4.264 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.481 -0.868 5.079 1.00 0.00 H new ATOM 0 HD1 PHE B 50 3.963 -3.319 5.382 1.00 0.00 H new ATOM 0 HD2 PHE B 50 7.745 -1.957 3.975 1.00 0.00 H new ATOM 0 HE1 PHE B 50 4.954 -5.490 5.956 1.00 0.00 H new ATOM 0 HE2 PHE B 50 8.742 -4.129 4.547 1.00 0.00 H new ATOM 0 HZ PHE B 50 7.345 -5.902 5.532 1.00 0.00 H new ATOM 1970 N ALA B 51 6.141 -0.548 1.337 1.00 0.00 N ATOM 1971 CA ALA B 51 7.103 -0.775 0.265 1.00 0.00 C ATOM 1972 C ALA B 51 8.255 -1.649 0.743 1.00 0.00 C ATOM 1973 O ALA B 51 8.720 -1.515 1.875 1.00 0.00 O ATOM 1974 CB ALA B 51 7.627 0.553 -0.260 1.00 0.00 C ATOM 0 H ALA B 51 6.094 0.417 1.664 1.00 0.00 H new ATOM 0 HA ALA B 51 6.595 -1.298 -0.545 1.00 0.00 H new ATOM 0 HB1 ALA B 51 8.344 0.370 -1.060 1.00 0.00 H new ATOM 0 HB2 ALA B 51 6.797 1.145 -0.645 1.00 0.00 H new ATOM 0 HB3 ALA B 51 8.116 1.097 0.549 1.00 0.00 H new ATOM 1980 N GLY B 52 8.713 -2.547 -0.125 1.00 0.00 N ATOM 1981 CA GLY B 52 9.809 -3.429 0.231 1.00 0.00 C ATOM 1982 C GLY B 52 10.359 -4.184 -0.962 1.00 0.00 C ATOM 1983 O GLY B 52 10.116 -3.808 -2.109 1.00 0.00 O ATOM 0 H GLY B 52 8.345 -2.679 -1.067 1.00 0.00 H new ATOM 0 HA2 GLY B 52 10.608 -2.844 0.686 1.00 0.00 H new ATOM 0 HA3 GLY B 52 9.468 -4.142 0.982 1.00 0.00 H new ATOM 1987 N VAL B 53 11.102 -5.252 -0.691 1.00 0.00 N ATOM 1988 CA VAL B 53 11.693 -6.060 -1.750 1.00 0.00 C ATOM 1989 C VAL B 53 11.278 -7.522 -1.625 1.00 0.00 C ATOM 1990 O VAL B 53 11.388 -8.119 -0.554 1.00 0.00 O ATOM 1991 CB VAL B 53 13.231 -5.970 -1.731 1.00 0.00 C ATOM 1992 CG1 VAL B 53 13.827 -6.710 -2.919 1.00 0.00 C ATOM 1993 CG2 VAL B 53 13.679 -4.516 -1.719 1.00 0.00 C ATOM 0 H VAL B 53 11.309 -5.578 0.253 1.00 0.00 H new ATOM 0 HA VAL B 53 11.324 -5.662 -2.695 1.00 0.00 H new ATOM 0 HB VAL B 53 13.593 -6.447 -0.820 1.00 0.00 H new ATOM 0 HG11 VAL B 53 14.914 -6.634 -2.887 1.00 0.00 H new ATOM 0 HG12 VAL B 53 13.535 -7.759 -2.878 1.00 0.00 H new ATOM 0 HG13 VAL B 53 13.460 -6.267 -3.845 1.00 0.00 H new ATOM 0 HG21 VAL B 53 14.768 -4.471 -1.706 1.00 0.00 H new ATOM 0 HG22 VAL B 53 13.306 -4.013 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL B 53 13.284 -4.021 -0.832 1.00 0.00 H new ATOM 2003 N VAL B 54 10.800 -8.092 -2.727 1.00 0.00 N ATOM 2004 CA VAL B 54 10.367 -9.484 -2.745 1.00 0.00 C ATOM 2005 C VAL B 54 11.561 -10.432 -2.732 1.00 0.00 C ATOM 2006 O VAL B 54 12.288 -10.546 -3.720 1.00 0.00 O ATOM 2007 CB VAL B 54 9.489 -9.778 -3.979 1.00 0.00 C ATOM 2008 CG1 VAL B 54 9.181 -11.265 -4.084 1.00 0.00 C ATOM 2009 CG2 VAL B 54 8.203 -8.971 -3.916 1.00 0.00 C ATOM 0 H VAL B 54 10.703 -7.610 -3.621 1.00 0.00 H new ATOM 0 HA VAL B 54 9.776 -9.649 -1.844 1.00 0.00 H new ATOM 0 HB VAL B 54 10.043 -9.483 -4.871 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.561 -11.447 -4.962 1.00 0.00 H new ATOM 0 HG12 VAL B 54 10.112 -11.824 -4.176 1.00 0.00 H new ATOM 0 HG13 VAL B 54 8.649 -11.590 -3.190 1.00 0.00 H new ATOM 0 HG21 VAL B 54 7.594 -9.189 -4.793 1.00 0.00 H new ATOM 0 HG22 VAL B 54 7.650 -9.237 -3.015 1.00 0.00 H new ATOM 0 HG23 VAL B 54 8.441 -7.908 -3.895 1.00 0.00 H new ATOM 2019 N LYS B 55 11.757 -11.111 -1.605 1.00 0.00 N ATOM 2020 CA LYS B 55 12.862 -12.051 -1.460 1.00 0.00 C ATOM 2021 C LYS B 55 12.479 -13.428 -1.995 1.00 0.00 C ATOM 2022 O LYS B 55 13.009 -13.879 -3.010 1.00 0.00 O ATOM 2023 CB LYS B 55 13.277 -12.158 0.010 1.00 0.00 C ATOM 2024 CG LYS B 55 14.463 -13.082 0.244 1.00 0.00 C ATOM 2025 CD LYS B 55 14.751 -13.262 1.726 1.00 0.00 C ATOM 2026 CE LYS B 55 15.229 -11.969 2.368 1.00 0.00 C ATOM 2027 NZ LYS B 55 15.504 -12.139 3.821 1.00 0.00 N ATOM 0 H LYS B 55 11.164 -11.027 -0.779 1.00 0.00 H new ATOM 0 HA LYS B 55 13.704 -11.677 -2.042 1.00 0.00 H new ATOM 0 HB2 LYS B 55 13.523 -11.164 0.382 1.00 0.00 H new ATOM 0 HB3 LYS B 55 12.428 -12.516 0.593 1.00 0.00 H new ATOM 0 HG2 LYS B 55 14.263 -14.053 -0.208 1.00 0.00 H new ATOM 0 HG3 LYS B 55 15.345 -12.675 -0.251 1.00 0.00 H new ATOM 0 HD2 LYS B 55 13.850 -13.608 2.232 1.00 0.00 H new ATOM 0 HD3 LYS B 55 15.508 -14.035 1.858 1.00 0.00 H new ATOM 0 HE2 LYS B 55 16.133 -11.627 1.865 1.00 0.00 H new ATOM 0 HE3 LYS B 55 14.475 -11.194 2.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 16.101 -11.356 4.155 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 14.607 -12.138 4.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 15.996 -13.042 3.978 1.00 0.00 H new ATOM 2041 N GLU B 56 11.549 -14.086 -1.308 1.00 0.00 N ATOM 2042 CA GLU B 56 11.095 -15.416 -1.707 1.00 0.00 C ATOM 2043 C GLU B 56 9.642 -15.638 -1.306 1.00 0.00 C ATOM 2044 O GLU B 56 9.278 -15.472 -0.141 1.00 0.00 O ATOM 2045 CB GLU B 56 11.972 -16.497 -1.071 1.00 0.00 C ATOM 2046 CG GLU B 56 13.395 -16.530 -1.604 1.00 0.00 C ATOM 2047 CD GLU B 56 14.245 -17.589 -0.930 1.00 0.00 C ATOM 2048 OE1 GLU B 56 14.256 -18.740 -1.415 1.00 0.00 O ATOM 2049 OE2 GLU B 56 14.899 -17.267 0.085 1.00 0.00 O ATOM 0 H GLU B 56 11.094 -13.720 -0.472 1.00 0.00 H new ATOM 0 HA GLU B 56 11.175 -15.483 -2.792 1.00 0.00 H new ATOM 0 HB2 GLU B 56 12.002 -16.338 0.007 1.00 0.00 H new ATOM 0 HB3 GLU B 56 11.510 -17.470 -1.237 1.00 0.00 H new ATOM 0 HG2 GLU B 56 13.373 -16.716 -2.678 1.00 0.00 H new ATOM 0 HG3 GLU B 56 13.856 -15.553 -1.459 1.00 0.00 H new ATOM 2056 N LEU B 57 8.817 -16.014 -2.277 1.00 0.00 N ATOM 2057 CA LEU B 57 7.402 -16.267 -2.024 1.00 0.00 C ATOM 2058 C LEU B 57 7.230 -17.334 -0.945 1.00 0.00 C ATOM 2059 O LEU B 57 8.093 -18.194 -0.765 1.00 0.00 O ATOM 2060 CB LEU B 57 6.698 -16.705 -3.313 1.00 0.00 C ATOM 2061 CG LEU B 57 6.886 -18.176 -3.707 1.00 0.00 C ATOM 2062 CD1 LEU B 57 6.031 -18.513 -4.917 1.00 0.00 C ATOM 2063 CD2 LEU B 57 8.350 -18.480 -3.993 1.00 0.00 C ATOM 0 H LEU B 57 9.103 -16.150 -3.247 1.00 0.00 H new ATOM 0 HA LEU B 57 6.948 -15.341 -1.672 1.00 0.00 H new ATOM 0 HB2 LEU B 57 5.631 -16.510 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU B 57 7.056 -16.080 -4.131 1.00 0.00 H new ATOM 0 HG LEU B 57 6.567 -18.795 -2.868 1.00 0.00 H new ATOM 0 HD11 LEU B 57 6.175 -19.560 -5.184 1.00 0.00 H new ATOM 0 HD12 LEU B 57 4.981 -18.340 -4.680 1.00 0.00 H new ATOM 0 HD13 LEU B 57 6.322 -17.881 -5.756 1.00 0.00 H new ATOM 0 HD21 LEU B 57 8.456 -19.529 -4.270 1.00 0.00 H new ATOM 0 HD22 LEU B 57 8.699 -17.851 -4.812 1.00 0.00 H new ATOM 0 HD23 LEU B 57 8.944 -18.278 -3.102 1.00 0.00 H new ATOM 2075 N LYS B 58 6.112 -17.271 -0.230 1.00 0.00 N ATOM 2076 CA LYS B 58 5.826 -18.230 0.829 1.00 0.00 C ATOM 2077 C LYS B 58 4.640 -19.112 0.452 1.00 0.00 C ATOM 2078 O LYS B 58 4.479 -20.213 0.978 1.00 0.00 O ATOM 2079 CB LYS B 58 5.538 -17.499 2.142 1.00 0.00 C ATOM 2080 CG LYS B 58 5.342 -18.426 3.330 1.00 0.00 C ATOM 2081 CD LYS B 58 6.616 -19.189 3.660 1.00 0.00 C ATOM 2082 CE LYS B 58 6.452 -20.039 4.909 1.00 0.00 C ATOM 2083 NZ LYS B 58 7.696 -20.789 5.237 1.00 0.00 N ATOM 0 H LYS B 58 5.389 -16.565 -0.365 1.00 0.00 H new ATOM 0 HA LYS B 58 6.702 -18.865 0.961 1.00 0.00 H new ATOM 0 HB2 LYS B 58 6.362 -16.818 2.356 1.00 0.00 H new ATOM 0 HB3 LYS B 58 4.644 -16.888 2.018 1.00 0.00 H new ATOM 0 HG2 LYS B 58 5.030 -17.845 4.198 1.00 0.00 H new ATOM 0 HG3 LYS B 58 4.540 -19.132 3.113 1.00 0.00 H new ATOM 0 HD2 LYS B 58 6.887 -19.827 2.818 1.00 0.00 H new ATOM 0 HD3 LYS B 58 7.436 -18.485 3.804 1.00 0.00 H new ATOM 0 HE2 LYS B 58 6.181 -19.401 5.750 1.00 0.00 H new ATOM 0 HE3 LYS B 58 5.632 -20.742 4.765 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 7.543 -21.356 6.095 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 7.941 -21.417 4.445 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 8.473 -20.118 5.400 1.00 0.00 H new ATOM 2097 N VAL B 59 3.816 -18.620 -0.467 1.00 0.00 N ATOM 2098 CA VAL B 59 2.646 -19.358 -0.921 1.00 0.00 C ATOM 2099 C VAL B 59 2.707 -19.616 -2.422 1.00 0.00 C ATOM 2100 O VAL B 59 3.371 -18.888 -3.160 1.00 0.00 O ATOM 2101 CB VAL B 59 1.343 -18.604 -0.593 1.00 0.00 C ATOM 2102 CG1 VAL B 59 1.168 -18.470 0.912 1.00 0.00 C ATOM 2103 CG2 VAL B 59 1.335 -17.237 -1.261 1.00 0.00 C ATOM 0 H VAL B 59 3.939 -17.711 -0.912 1.00 0.00 H new ATOM 0 HA VAL B 59 2.648 -20.311 -0.391 1.00 0.00 H new ATOM 0 HB VAL B 59 0.504 -19.179 -0.984 1.00 0.00 H new ATOM 0 HG11 VAL B 59 0.242 -17.935 1.124 1.00 0.00 H new ATOM 0 HG12 VAL B 59 1.126 -19.461 1.363 1.00 0.00 H new ATOM 0 HG13 VAL B 59 2.010 -17.918 1.328 1.00 0.00 H new ATOM 0 HG21 VAL B 59 0.407 -16.719 -1.018 1.00 0.00 H new ATOM 0 HG22 VAL B 59 2.182 -16.652 -0.903 1.00 0.00 H new ATOM 0 HG23 VAL B 59 1.410 -17.360 -2.341 1.00 0.00 H new ATOM 2113 N ASN B 60 2.009 -20.656 -2.867 1.00 0.00 N ATOM 2114 CA ASN B 60 1.984 -21.010 -4.281 1.00 0.00 C ATOM 2115 C ASN B 60 0.636 -20.663 -4.901 1.00 0.00 C ATOM 2116 O ASN B 60 -0.393 -20.673 -4.224 1.00 0.00 O ATOM 2117 CB ASN B 60 2.270 -22.504 -4.460 1.00 0.00 C ATOM 2118 CG ASN B 60 3.510 -22.964 -3.713 1.00 0.00 C ATOM 2119 OD1 ASN B 60 3.566 -24.092 -3.222 1.00 0.00 O ATOM 2120 ND2 ASN B 60 4.517 -22.099 -3.627 1.00 0.00 N ATOM 0 H ASN B 60 1.454 -21.268 -2.269 1.00 0.00 H new ATOM 0 HA ASN B 60 2.759 -20.435 -4.789 1.00 0.00 H new ATOM 0 HB2 ASN B 60 1.410 -23.077 -4.113 1.00 0.00 H new ATOM 0 HB3 ASN B 60 2.391 -22.721 -5.521 1.00 0.00 H new ATOM 0 HD21 ASN B 60 5.374 -22.361 -3.141 1.00 0.00 H new ATOM 0 HD22 ASN B 60 4.432 -21.174 -4.047 1.00 0.00 H new ATOM 2127 N VAL B 61 0.649 -20.350 -6.193 1.00 0.00 N ATOM 2128 CA VAL B 61 -0.572 -19.999 -6.907 1.00 0.00 C ATOM 2129 C VAL B 61 -1.513 -21.196 -6.998 1.00 0.00 C ATOM 2130 O VAL B 61 -1.131 -22.262 -7.482 1.00 0.00 O ATOM 2131 CB VAL B 61 -0.266 -19.491 -8.330 1.00 0.00 C ATOM 2132 CG1 VAL B 61 -1.542 -19.049 -9.028 1.00 0.00 C ATOM 2133 CG2 VAL B 61 0.748 -18.357 -8.286 1.00 0.00 C ATOM 0 H VAL B 61 1.492 -20.333 -6.766 1.00 0.00 H new ATOM 0 HA VAL B 61 -1.053 -19.201 -6.342 1.00 0.00 H new ATOM 0 HB VAL B 61 0.166 -20.312 -8.903 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -1.304 -18.694 -10.031 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -2.231 -19.891 -9.095 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.008 -18.244 -8.459 1.00 0.00 H new ATOM 0 HG21 VAL B 61 0.952 -18.011 -9.300 1.00 0.00 H new ATOM 0 HG22 VAL B 61 0.347 -17.533 -7.695 1.00 0.00 H new ATOM 0 HG23 VAL B 61 1.673 -18.713 -7.832 1.00 0.00 H new ATOM 2143 N GLY B 62 -2.743 -21.013 -6.529 1.00 0.00 N ATOM 2144 CA GLY B 62 -3.718 -22.087 -6.564 1.00 0.00 C ATOM 2145 C GLY B 62 -3.950 -22.705 -5.200 1.00 0.00 C ATOM 2146 O GLY B 62 -4.555 -23.772 -5.089 1.00 0.00 O ATOM 0 H GLY B 62 -3.082 -20.140 -6.125 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -4.662 -21.704 -6.951 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -3.380 -22.858 -7.256 1.00 0.00 H new ATOM 2150 N ASP B 63 -3.467 -22.034 -4.159 1.00 0.00 N ATOM 2151 CA ASP B 63 -3.623 -22.524 -2.793 1.00 0.00 C ATOM 2152 C ASP B 63 -4.506 -21.586 -1.977 1.00 0.00 C ATOM 2153 O ASP B 63 -4.187 -20.409 -1.806 1.00 0.00 O ATOM 2154 CB ASP B 63 -2.257 -22.672 -2.123 1.00 0.00 C ATOM 2155 CG ASP B 63 -1.371 -23.674 -2.837 1.00 0.00 C ATOM 2156 OD1 ASP B 63 -0.803 -23.320 -3.890 1.00 0.00 O ATOM 2157 OD2 ASP B 63 -1.248 -24.814 -2.343 1.00 0.00 O ATOM 0 H ASP B 63 -2.964 -21.150 -4.235 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.105 -23.501 -2.836 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -1.759 -21.702 -2.100 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -2.395 -22.985 -1.088 1.00 0.00 H new ATOM 2162 N LYS B 64 -5.615 -22.119 -1.474 1.00 0.00 N ATOM 2163 CA LYS B 64 -6.552 -21.339 -0.676 1.00 0.00 C ATOM 2164 C LYS B 64 -5.844 -20.658 0.493 1.00 0.00 C ATOM 2165 O LYS B 64 -4.941 -21.229 1.105 1.00 0.00 O ATOM 2166 CB LYS B 64 -7.671 -22.244 -0.159 1.00 0.00 C ATOM 2167 CG LYS B 64 -8.724 -21.506 0.647 1.00 0.00 C ATOM 2168 CD LYS B 64 -9.845 -22.434 1.092 1.00 0.00 C ATOM 2169 CE LYS B 64 -9.352 -23.470 2.090 1.00 0.00 C ATOM 2170 NZ LYS B 64 -10.447 -24.372 2.541 1.00 0.00 N ATOM 0 H LYS B 64 -5.887 -23.093 -1.606 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.980 -20.562 -1.310 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -8.151 -22.735 -1.006 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -7.236 -23.029 0.459 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -8.260 -21.051 1.522 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -9.139 -20.695 0.048 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -10.646 -21.848 1.541 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -10.268 -22.938 0.223 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -8.558 -24.062 1.636 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -8.919 -22.965 2.953 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -10.070 -25.063 3.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -11.194 -23.810 2.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -10.844 -24.874 1.721 1.00 0.00 H new ATOM 2184 N VAL B 65 -6.263 -19.432 0.795 1.00 0.00 N ATOM 2185 CA VAL B 65 -5.674 -18.662 1.885 1.00 0.00 C ATOM 2186 C VAL B 65 -6.647 -18.538 3.055 1.00 0.00 C ATOM 2187 O VAL B 65 -7.858 -18.676 2.884 1.00 0.00 O ATOM 2188 CB VAL B 65 -5.278 -17.248 1.416 1.00 0.00 C ATOM 2189 CG1 VAL B 65 -6.514 -16.377 1.236 1.00 0.00 C ATOM 2190 CG2 VAL B 65 -4.305 -16.605 2.391 1.00 0.00 C ATOM 0 H VAL B 65 -7.011 -18.950 0.297 1.00 0.00 H new ATOM 0 HA VAL B 65 -4.782 -19.198 2.209 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.778 -17.339 0.451 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -6.214 -15.383 0.905 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -7.170 -16.826 0.490 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -7.045 -16.298 2.185 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -4.041 -15.608 2.038 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.771 -16.530 3.374 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -3.404 -17.215 2.462 1.00 0.00 H new ATOM 2200 N LYS B 66 -6.111 -18.273 4.242 1.00 0.00 N ATOM 2201 CA LYS B 66 -6.935 -18.121 5.435 1.00 0.00 C ATOM 2202 C LYS B 66 -6.365 -17.051 6.361 1.00 0.00 C ATOM 2203 O LYS B 66 -5.183 -16.718 6.289 1.00 0.00 O ATOM 2204 CB LYS B 66 -7.051 -19.453 6.178 1.00 0.00 C ATOM 2205 CG LYS B 66 -7.751 -20.535 5.370 1.00 0.00 C ATOM 2206 CD LYS B 66 -7.859 -21.838 6.150 1.00 0.00 C ATOM 2207 CE LYS B 66 -8.803 -21.703 7.336 1.00 0.00 C ATOM 2208 NZ LYS B 66 -10.179 -21.327 6.911 1.00 0.00 N ATOM 0 H LYS B 66 -5.110 -18.159 4.403 1.00 0.00 H new ATOM 0 HA LYS B 66 -7.929 -17.806 5.119 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -6.053 -19.799 6.447 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -7.595 -19.295 7.109 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -8.748 -20.194 5.091 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -7.203 -20.709 4.444 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -8.214 -22.630 5.490 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -6.871 -22.135 6.502 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -8.837 -22.646 7.882 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -8.417 -20.950 8.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -10.849 -21.538 7.678 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -10.210 -20.310 6.694 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -10.441 -21.870 6.063 1.00 0.00 H new ATOM 2222 N THR B 67 -7.217 -16.514 7.229 1.00 0.00 N ATOM 2223 CA THR B 67 -6.803 -15.479 8.169 1.00 0.00 C ATOM 2224 C THR B 67 -5.739 -15.996 9.130 1.00 0.00 C ATOM 2225 O THR B 67 -5.958 -16.973 9.846 1.00 0.00 O ATOM 2226 CB THR B 67 -7.999 -14.951 8.982 1.00 0.00 C ATOM 2227 OG1 THR B 67 -8.610 -16.024 9.708 1.00 0.00 O ATOM 2228 CG2 THR B 67 -9.028 -14.301 8.068 1.00 0.00 C ATOM 0 H THR B 67 -8.199 -16.779 7.301 1.00 0.00 H new ATOM 0 HA THR B 67 -6.385 -14.665 7.577 1.00 0.00 H new ATOM 0 HB THR B 67 -7.632 -14.201 9.683 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.916 -16.628 10.045 1.00 0.00 H new ATOM 0 HG21 THR B 67 -9.864 -13.935 8.664 1.00 0.00 H new ATOM 0 HG22 THR B 67 -8.568 -13.467 7.537 1.00 0.00 H new ATOM 0 HG23 THR B 67 -9.389 -15.035 7.347 1.00 0.00 H new ATOM 2236 N GLY B 68 -4.585 -15.334 9.140 1.00 0.00 N ATOM 2237 CA GLY B 68 -3.504 -15.738 10.020 1.00 0.00 C ATOM 2238 C GLY B 68 -2.348 -16.373 9.273 1.00 0.00 C ATOM 2239 O GLY B 68 -1.277 -16.585 9.843 1.00 0.00 O ATOM 0 H GLY B 68 -4.380 -14.525 8.554 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -3.143 -14.868 10.568 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -3.886 -16.444 10.758 1.00 0.00 H new ATOM 2243 N SER B 69 -2.561 -16.677 7.996 1.00 0.00 N ATOM 2244 CA SER B 69 -1.524 -17.293 7.174 1.00 0.00 C ATOM 2245 C SER B 69 -0.644 -16.234 6.516 1.00 0.00 C ATOM 2246 O SER B 69 -1.125 -15.174 6.115 1.00 0.00 O ATOM 2247 CB SER B 69 -2.155 -18.183 6.102 1.00 0.00 C ATOM 2248 OG SER B 69 -2.920 -17.418 5.187 1.00 0.00 O ATOM 0 H SER B 69 -3.441 -16.507 7.509 1.00 0.00 H new ATOM 0 HA SER B 69 -0.899 -17.904 7.825 1.00 0.00 H new ATOM 0 HB2 SER B 69 -1.373 -18.721 5.566 1.00 0.00 H new ATOM 0 HB3 SER B 69 -2.791 -18.932 6.575 1.00 0.00 H new ATOM 0 HG SER B 69 -3.723 -17.079 5.635 1.00 0.00 H new ATOM 2254 N LEU B 70 0.648 -16.532 6.410 1.00 0.00 N ATOM 2255 CA LEU B 70 1.601 -15.609 5.798 1.00 0.00 C ATOM 2256 C LEU B 70 1.635 -15.793 4.284 1.00 0.00 C ATOM 2257 O LEU B 70 1.462 -16.904 3.781 1.00 0.00 O ATOM 2258 CB LEU B 70 3.000 -15.828 6.380 1.00 0.00 C ATOM 2259 CG LEU B 70 3.100 -15.701 7.901 1.00 0.00 C ATOM 2260 CD1 LEU B 70 4.481 -16.123 8.377 1.00 0.00 C ATOM 2261 CD2 LEU B 70 2.799 -14.275 8.342 1.00 0.00 C ATOM 0 H LEU B 70 1.060 -17.405 6.740 1.00 0.00 H new ATOM 0 HA LEU B 70 1.278 -14.591 6.018 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.345 -16.821 6.091 1.00 0.00 H new ATOM 0 HB3 LEU B 70 3.682 -15.109 5.926 1.00 0.00 H new ATOM 0 HG LEU B 70 2.359 -16.362 8.351 1.00 0.00 H new ATOM 0 HD11 LEU B 70 4.537 -16.027 9.461 1.00 0.00 H new ATOM 0 HD12 LEU B 70 4.662 -17.160 8.094 1.00 0.00 H new ATOM 0 HD13 LEU B 70 5.235 -15.485 7.917 1.00 0.00 H new ATOM 0 HD21 LEU B 70 2.875 -14.206 9.427 1.00 0.00 H new ATOM 0 HD22 LEU B 70 3.516 -13.593 7.884 1.00 0.00 H new ATOM 0 HD23 LEU B 70 1.790 -14.003 8.031 1.00 0.00 H new ATOM 2273 N ILE B 71 1.857 -14.698 3.562 1.00 0.00 N ATOM 2274 CA ILE B 71 1.911 -14.743 2.105 1.00 0.00 C ATOM 2275 C ILE B 71 3.320 -14.458 1.585 1.00 0.00 C ATOM 2276 O ILE B 71 3.865 -15.233 0.800 1.00 0.00 O ATOM 2277 CB ILE B 71 0.923 -13.743 1.472 1.00 0.00 C ATOM 2278 CG1 ILE B 71 1.007 -12.386 2.178 1.00 0.00 C ATOM 2279 CG2 ILE B 71 -0.494 -14.294 1.532 1.00 0.00 C ATOM 2280 CD1 ILE B 71 0.153 -11.312 1.539 1.00 0.00 C ATOM 0 H ILE B 71 2.002 -13.771 3.962 1.00 0.00 H new ATOM 0 HA ILE B 71 1.626 -15.754 1.815 1.00 0.00 H new ATOM 0 HB ILE B 71 1.194 -13.599 0.426 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.703 -12.508 3.218 1.00 0.00 H new ATOM 0 HG13 ILE B 71 2.045 -12.055 2.186 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -1.182 -13.578 1.082 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -0.542 -15.236 0.986 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.775 -14.463 2.572 1.00 0.00 H new ATOM 0 HD11 ILE B 71 0.265 -10.380 2.094 1.00 0.00 H new ATOM 0 HD12 ILE B 71 0.471 -11.160 0.507 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.892 -11.621 1.555 1.00 0.00 H new ATOM 2292 N MET B 72 3.903 -13.345 2.023 1.00 0.00 N ATOM 2293 CA MET B 72 5.247 -12.966 1.591 1.00 0.00 C ATOM 2294 C MET B 72 5.986 -12.200 2.684 1.00 0.00 C ATOM 2295 O MET B 72 5.394 -11.789 3.682 1.00 0.00 O ATOM 2296 CB MET B 72 5.178 -12.110 0.323 1.00 0.00 C ATOM 2297 CG MET B 72 4.677 -12.861 -0.900 1.00 0.00 C ATOM 2298 SD MET B 72 4.693 -11.846 -2.391 1.00 0.00 S ATOM 2299 CE MET B 72 4.127 -13.028 -3.612 1.00 0.00 C ATOM 0 H MET B 72 3.468 -12.691 2.674 1.00 0.00 H new ATOM 0 HA MET B 72 5.796 -13.884 1.380 1.00 0.00 H new ATOM 0 HB2 MET B 72 4.524 -11.258 0.507 1.00 0.00 H new ATOM 0 HB3 MET B 72 6.170 -11.711 0.111 1.00 0.00 H new ATOM 0 HG2 MET B 72 5.297 -13.744 -1.059 1.00 0.00 H new ATOM 0 HG3 MET B 72 3.662 -13.213 -0.715 1.00 0.00 H new ATOM 0 HE1 MET B 72 3.763 -12.497 -4.492 1.00 0.00 H new ATOM 0 HE2 MET B 72 4.953 -13.680 -3.897 1.00 0.00 H new ATOM 0 HE3 MET B 72 3.320 -13.628 -3.191 1.00 0.00 H new ATOM 2309 N ILE B 73 7.289 -12.016 2.483 1.00 0.00 N ATOM 2310 CA ILE B 73 8.123 -11.291 3.436 1.00 0.00 C ATOM 2311 C ILE B 73 8.938 -10.225 2.711 1.00 0.00 C ATOM 2312 O ILE B 73 9.454 -10.469 1.621 1.00 0.00 O ATOM 2313 CB ILE B 73 9.078 -12.239 4.189 1.00 0.00 C ATOM 2314 CG1 ILE B 73 8.309 -13.455 4.715 1.00 0.00 C ATOM 2315 CG2 ILE B 73 9.762 -11.503 5.333 1.00 0.00 C ATOM 2316 CD1 ILE B 73 9.194 -14.515 5.339 1.00 0.00 C ATOM 0 H ILE B 73 7.791 -12.361 1.665 1.00 0.00 H new ATOM 0 HA ILE B 73 7.461 -10.822 4.164 1.00 0.00 H new ATOM 0 HB ILE B 73 9.845 -12.586 3.497 1.00 0.00 H new ATOM 0 HG12 ILE B 73 7.581 -13.121 5.455 1.00 0.00 H new ATOM 0 HG13 ILE B 73 7.747 -13.901 3.894 1.00 0.00 H new ATOM 0 HG21 ILE B 73 10.433 -12.185 5.855 1.00 0.00 H new ATOM 0 HG22 ILE B 73 10.334 -10.665 4.936 1.00 0.00 H new ATOM 0 HG23 ILE B 73 9.009 -11.132 6.028 1.00 0.00 H new ATOM 0 HD11 ILE B 73 8.578 -15.344 5.688 1.00 0.00 H new ATOM 0 HD12 ILE B 73 9.905 -14.878 4.597 1.00 0.00 H new ATOM 0 HD13 ILE B 73 9.736 -14.086 6.182 1.00 0.00 H new ATOM 2328 N PHE B 74 9.052 -9.044 3.313 1.00 0.00 N ATOM 2329 CA PHE B 74 9.796 -7.953 2.691 1.00 0.00 C ATOM 2330 C PHE B 74 10.991 -7.539 3.539 1.00 0.00 C ATOM 2331 O PHE B 74 10.859 -7.292 4.738 1.00 0.00 O ATOM 2332 CB PHE B 74 8.882 -6.748 2.463 1.00 0.00 C ATOM 2333 CG PHE B 74 7.708 -7.039 1.572 1.00 0.00 C ATOM 2334 CD1 PHE B 74 7.886 -7.253 0.215 1.00 0.00 C ATOM 2335 CD2 PHE B 74 6.426 -7.094 2.093 1.00 0.00 C ATOM 2336 CE1 PHE B 74 6.807 -7.519 -0.606 1.00 0.00 C ATOM 2337 CE2 PHE B 74 5.343 -7.359 1.278 1.00 0.00 C ATOM 2338 CZ PHE B 74 5.533 -7.570 -0.074 1.00 0.00 C ATOM 0 H PHE B 74 8.644 -8.819 4.220 1.00 0.00 H new ATOM 0 HA PHE B 74 10.167 -8.312 1.731 1.00 0.00 H new ATOM 0 HB2 PHE B 74 8.516 -6.394 3.427 1.00 0.00 H new ATOM 0 HB3 PHE B 74 9.466 -5.938 2.026 1.00 0.00 H new ATOM 0 HD1 PHE B 74 8.880 -7.211 -0.206 1.00 0.00 H new ATOM 0 HD2 PHE B 74 6.271 -6.928 3.149 1.00 0.00 H new ATOM 0 HE1 PHE B 74 6.959 -7.687 -1.662 1.00 0.00 H new ATOM 0 HE2 PHE B 74 4.349 -7.401 1.697 1.00 0.00 H new ATOM 0 HZ PHE B 74 4.687 -7.774 -0.714 1.00 0.00 H new ATOM 2348 N GLU B 75 12.156 -7.463 2.905 1.00 0.00 N ATOM 2349 CA GLU B 75 13.373 -7.064 3.595 1.00 0.00 C ATOM 2350 C GLU B 75 13.653 -5.584 3.357 1.00 0.00 C ATOM 2351 O GLU B 75 14.288 -5.211 2.370 1.00 0.00 O ATOM 2352 CB GLU B 75 14.557 -7.910 3.122 1.00 0.00 C ATOM 2353 CG GLU B 75 15.865 -7.572 3.817 1.00 0.00 C ATOM 2354 CD GLU B 75 17.004 -8.476 3.388 1.00 0.00 C ATOM 2355 OE1 GLU B 75 17.649 -8.172 2.363 1.00 0.00 O ATOM 2356 OE2 GLU B 75 17.252 -9.487 4.078 1.00 0.00 O ATOM 0 H GLU B 75 12.281 -7.673 1.915 1.00 0.00 H new ATOM 0 HA GLU B 75 13.235 -7.227 4.664 1.00 0.00 H new ATOM 0 HB2 GLU B 75 14.329 -8.963 3.288 1.00 0.00 H new ATOM 0 HB3 GLU B 75 14.682 -7.776 2.047 1.00 0.00 H new ATOM 0 HG2 GLU B 75 16.128 -6.536 3.604 1.00 0.00 H new ATOM 0 HG3 GLU B 75 15.730 -7.651 4.896 1.00 0.00 H new ATOM 2363 N VAL B 76 13.167 -4.747 4.266 1.00 0.00 N ATOM 2364 CA VAL B 76 13.353 -3.306 4.159 1.00 0.00 C ATOM 2365 C VAL B 76 14.589 -2.857 4.930 1.00 0.00 C ATOM 2366 O VAL B 76 14.986 -3.491 5.907 1.00 0.00 O ATOM 2367 CB VAL B 76 12.116 -2.546 4.682 1.00 0.00 C ATOM 2368 CG1 VAL B 76 11.864 -2.872 6.146 1.00 0.00 C ATOM 2369 CG2 VAL B 76 12.274 -1.047 4.484 1.00 0.00 C ATOM 0 H VAL B 76 12.640 -5.043 5.087 1.00 0.00 H new ATOM 0 HA VAL B 76 13.489 -3.074 3.103 1.00 0.00 H new ATOM 0 HB VAL B 76 11.251 -2.872 4.105 1.00 0.00 H new ATOM 0 HG11 VAL B 76 10.988 -2.326 6.495 1.00 0.00 H new ATOM 0 HG12 VAL B 76 11.692 -3.943 6.256 1.00 0.00 H new ATOM 0 HG13 VAL B 76 12.732 -2.581 6.738 1.00 0.00 H new ATOM 0 HG21 VAL B 76 11.389 -0.535 4.861 1.00 0.00 H new ATOM 0 HG22 VAL B 76 13.153 -0.699 5.026 1.00 0.00 H new ATOM 0 HG23 VAL B 76 12.394 -0.831 3.422 1.00 0.00 H new