USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 700 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 Single : A 833 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 835 ASN : amide:sc= -5.53 X(o=-5.5,f=-6!) USER MOD Single : A 841 SER OG : rot 180:sc=-0.000194 USER MOD Single : A 853 THR OG1 : rot 128:sc= -5.4! USER MOD Single : A 854 THR OG1 : rot 180:sc= -0.797 USER MOD Single : A 856 TYR OH : rot -31:sc= -1.76! USER MOD Single : A 857 MET CE :methyl -160:sc= -13.2! (180deg=-14.7!) USER MOD Single : A 858 THR OG1 : rot -64:sc= 0.679 USER MOD Single : A 859 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 860 TYR OH : rot 180:sc= -0.754 USER MOD Single : A 868 THR OG1 : rot -29:sc= -3.28! USER MOD Single : A 872 GLN : amide:sc= -5.98! C(o=-6!,f=-8.6!) USER MOD Single : A 875 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 876 CYS SG : rot 23:sc= 0.0746 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 887 THR OG1 : rot -14:sc= 0.712 USER MOD Single : A 894 MET CE :methyl -111:sc= -6.5! (180deg=-8.48!) USER MOD Single : A 895 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 898 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 901 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 909 TYR OH : rot 180:sc= -4.83! USER MOD Single : A 914 SER OG : rot 19:sc= 0.966 USER MOD Single : A 915 TYR OH : rot 180:sc= -0.458 USER MOD Single : A 926 THR OG1 : rot -160:sc= -4.52! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 7.683 -10.324 -1.623 1.00 0.00 N ATOM 439 CA GLN A 833 7.342 -11.641 -2.240 1.00 0.00 C ATOM 440 C GLN A 833 6.097 -11.502 -3.109 1.00 0.00 C ATOM 441 O GLN A 833 5.208 -12.331 -3.091 1.00 0.00 O ATOM 442 CB GLN A 833 7.075 -12.572 -1.060 1.00 0.00 C ATOM 443 CG GLN A 833 5.901 -12.022 -0.252 1.00 0.00 C ATOM 444 CD GLN A 833 5.613 -12.944 0.934 1.00 0.00 C ATOM 445 OE1 GLN A 833 4.559 -13.543 1.010 1.00 0.00 O ATOM 446 NE2 GLN A 833 6.512 -13.084 1.869 1.00 0.00 N ATOM 0 HA GLN A 833 8.137 -12.019 -2.882 1.00 0.00 H new ATOM 0 HB2 GLN A 833 6.849 -13.577 -1.416 1.00 0.00 H new ATOM 0 HB3 GLN A 833 7.962 -12.648 -0.432 1.00 0.00 H new ATOM 0 HG2 GLN A 833 6.131 -11.018 0.104 1.00 0.00 H new ATOM 0 HG3 GLN A 833 5.017 -11.942 -0.885 1.00 0.00 H new ATOM 0 HE21 GLN A 833 7.397 -12.581 1.805 1.00 0.00 H new ATOM 0 HE22 GLN A 833 6.330 -13.697 2.664 1.00 0.00 H new ATOM 455 N GLU A 834 6.040 -10.454 -3.862 1.00 0.00 N ATOM 456 CA GLU A 834 4.880 -10.209 -4.748 1.00 0.00 C ATOM 457 C GLU A 834 5.229 -9.057 -5.682 1.00 0.00 C ATOM 458 O GLU A 834 5.343 -7.925 -5.260 1.00 0.00 O ATOM 459 CB GLU A 834 3.736 -9.822 -3.806 1.00 0.00 C ATOM 460 CG GLU A 834 2.495 -9.449 -4.619 1.00 0.00 C ATOM 461 CD GLU A 834 1.245 -9.988 -3.922 1.00 0.00 C ATOM 462 OE1 GLU A 834 1.116 -9.771 -2.728 1.00 0.00 O ATOM 463 OE2 GLU A 834 0.438 -10.610 -4.592 1.00 0.00 O ATOM 0 H GLU A 834 6.765 -9.738 -3.903 1.00 0.00 H new ATOM 0 HA GLU A 834 4.609 -11.069 -5.360 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.507 -10.652 -3.137 1.00 0.00 H new ATOM 0 HB3 GLU A 834 4.037 -8.982 -3.180 1.00 0.00 H new ATOM 0 HG2 GLU A 834 2.428 -8.366 -4.723 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.569 -9.862 -5.625 1.00 0.00 H new ATOM 470 N ASN A 835 5.395 -9.327 -6.946 1.00 0.00 N ATOM 471 CA ASN A 835 5.728 -8.238 -7.893 1.00 0.00 C ATOM 472 C ASN A 835 4.644 -7.197 -7.763 1.00 0.00 C ATOM 473 O ASN A 835 3.489 -7.473 -7.927 1.00 0.00 O ATOM 474 CB ASN A 835 5.735 -8.869 -9.284 1.00 0.00 C ATOM 475 CG ASN A 835 6.962 -9.771 -9.429 1.00 0.00 C ATOM 476 OD1 ASN A 835 7.998 -9.503 -8.856 1.00 0.00 O ATOM 477 ND2 ASN A 835 6.888 -10.834 -10.183 1.00 0.00 N ATOM 0 H ASN A 835 5.314 -10.256 -7.360 1.00 0.00 H new ATOM 0 HA ASN A 835 6.693 -7.767 -7.703 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.824 -9.448 -9.437 1.00 0.00 H new ATOM 0 HB3 ASN A 835 5.750 -8.091 -10.048 1.00 0.00 H new ATOM 0 HD21 ASN A 835 7.701 -11.440 -10.291 1.00 0.00 H new ATOM 0 HD22 ASN A 835 6.017 -11.058 -10.664 1.00 0.00 H new ATOM 484 N VAL A 836 4.996 -6.028 -7.390 1.00 0.00 N ATOM 485 CA VAL A 836 3.944 -4.999 -7.165 1.00 0.00 C ATOM 486 C VAL A 836 4.142 -3.761 -8.041 1.00 0.00 C ATOM 487 O VAL A 836 5.208 -3.178 -8.090 1.00 0.00 O ATOM 488 CB VAL A 836 4.093 -4.651 -5.672 1.00 0.00 C ATOM 489 CG1 VAL A 836 4.559 -3.209 -5.487 1.00 0.00 C ATOM 490 CG2 VAL A 836 2.756 -4.821 -4.960 1.00 0.00 C ATOM 0 H VAL A 836 5.956 -5.724 -7.227 1.00 0.00 H new ATOM 0 HA VAL A 836 2.951 -5.365 -7.426 1.00 0.00 H new ATOM 0 HB VAL A 836 4.837 -5.326 -5.248 1.00 0.00 H new ATOM 0 HG11 VAL A 836 4.655 -2.991 -4.423 1.00 0.00 H new ATOM 0 HG12 VAL A 836 5.525 -3.073 -5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 836 3.830 -2.531 -5.931 1.00 0.00 H new ATOM 0 HG21 VAL A 836 2.871 -4.573 -3.905 1.00 0.00 H new ATOM 0 HG22 VAL A 836 2.017 -4.158 -5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 836 2.422 -5.854 -5.055 1.00 0.00 H new ATOM 500 N GLU A 837 3.093 -3.326 -8.692 1.00 0.00 N ATOM 501 CA GLU A 837 3.204 -2.080 -9.508 1.00 0.00 C ATOM 502 C GLU A 837 2.443 -0.995 -8.778 1.00 0.00 C ATOM 503 O GLU A 837 1.774 -1.259 -7.797 1.00 0.00 O ATOM 504 CB GLU A 837 2.555 -2.343 -10.871 1.00 0.00 C ATOM 505 CG GLU A 837 3.394 -1.690 -11.974 1.00 0.00 C ATOM 506 CD GLU A 837 2.669 -0.453 -12.507 1.00 0.00 C ATOM 507 OE1 GLU A 837 2.668 0.552 -11.815 1.00 0.00 O ATOM 508 OE2 GLU A 837 2.128 -0.530 -13.598 1.00 0.00 O ATOM 0 H GLU A 837 2.176 -3.773 -8.694 1.00 0.00 H new ATOM 0 HA GLU A 837 4.242 -1.780 -9.653 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.476 -3.416 -11.047 1.00 0.00 H new ATOM 0 HB3 GLU A 837 1.541 -1.943 -10.886 1.00 0.00 H new ATOM 0 HG2 GLU A 837 4.372 -1.410 -11.583 1.00 0.00 H new ATOM 0 HG3 GLU A 837 3.565 -2.400 -12.783 1.00 0.00 H new ATOM 515 N ILE A 838 2.521 0.214 -9.229 1.00 0.00 N ATOM 516 CA ILE A 838 1.784 1.283 -8.531 1.00 0.00 C ATOM 517 C ILE A 838 1.154 2.215 -9.566 1.00 0.00 C ATOM 518 O ILE A 838 1.738 2.505 -10.592 1.00 0.00 O ATOM 519 CB ILE A 838 2.845 2.022 -7.706 1.00 0.00 C ATOM 520 CG1 ILE A 838 3.591 1.042 -6.776 1.00 0.00 C ATOM 521 CG2 ILE A 838 2.193 3.133 -6.879 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.663 0.519 -5.670 1.00 0.00 C ATOM 0 H ILE A 838 3.059 0.507 -10.045 1.00 0.00 H new ATOM 0 HA ILE A 838 0.980 0.905 -7.899 1.00 0.00 H new ATOM 0 HB ILE A 838 3.565 2.466 -8.393 1.00 0.00 H new ATOM 0 HG12 ILE A 838 3.977 0.205 -7.358 1.00 0.00 H new ATOM 0 HG13 ILE A 838 4.450 1.542 -6.329 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.957 3.650 -6.298 1.00 0.00 H new ATOM 0 HG22 ILE A 838 1.702 3.842 -7.545 1.00 0.00 H new ATOM 0 HG23 ILE A 838 1.455 2.699 -6.204 1.00 0.00 H new ATOM 0 HD11 ILE A 838 3.213 -0.170 -5.029 1.00 0.00 H new ATOM 0 HD12 ILE A 838 2.298 1.356 -5.075 1.00 0.00 H new ATOM 0 HD13 ILE A 838 1.818 -0.002 -6.120 1.00 0.00 H new ATOM 534 N LEU A 839 -0.033 2.672 -9.310 1.00 0.00 N ATOM 535 CA LEU A 839 -0.714 3.575 -10.285 1.00 0.00 C ATOM 536 C LEU A 839 -1.906 4.274 -9.611 1.00 0.00 C ATOM 537 O LEU A 839 -2.560 3.685 -8.773 1.00 0.00 O ATOM 538 CB LEU A 839 -1.189 2.623 -11.393 1.00 0.00 C ATOM 539 CG LEU A 839 -2.062 3.366 -12.412 1.00 0.00 C ATOM 540 CD1 LEU A 839 -1.197 3.829 -13.586 1.00 0.00 C ATOM 541 CD2 LEU A 839 -3.151 2.422 -12.928 1.00 0.00 C ATOM 0 H LEU A 839 -0.568 2.462 -8.467 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.068 4.366 -10.665 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -0.327 2.185 -11.897 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -1.754 1.800 -10.954 1.00 0.00 H new ATOM 0 HG LEU A 839 -2.521 4.232 -11.935 1.00 0.00 H new ATOM 0 HD11 LEU A 839 -1.818 4.357 -14.310 1.00 0.00 H new ATOM 0 HD12 LEU A 839 -0.417 4.497 -13.222 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.739 2.963 -14.064 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -3.774 2.947 -13.653 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.688 1.558 -13.405 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -3.768 2.088 -12.094 1.00 0.00 H new ATOM 553 N PRO A 840 -2.176 5.505 -10.002 1.00 0.00 N ATOM 554 CA PRO A 840 -3.321 6.248 -9.422 1.00 0.00 C ATOM 555 C PRO A 840 -4.583 5.389 -9.500 1.00 0.00 C ATOM 556 O PRO A 840 -4.784 4.681 -10.465 1.00 0.00 O ATOM 557 CB PRO A 840 -3.411 7.483 -10.325 1.00 0.00 C ATOM 558 CG PRO A 840 -2.290 7.400 -11.380 1.00 0.00 C ATOM 559 CD PRO A 840 -1.379 6.217 -11.032 1.00 0.00 C ATOM 0 HA PRO A 840 -3.207 6.510 -8.370 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -4.386 7.527 -10.811 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -3.308 8.393 -9.734 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -2.716 7.270 -12.375 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -1.717 8.327 -11.397 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -1.178 5.588 -11.899 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -0.414 6.545 -10.646 1.00 0.00 H new ATOM 566 N SER A 841 -5.410 5.415 -8.476 1.00 0.00 N ATOM 567 CA SER A 841 -6.640 4.581 -8.454 1.00 0.00 C ATOM 568 C SER A 841 -7.115 4.267 -9.863 1.00 0.00 C ATOM 569 O SER A 841 -7.069 5.089 -10.759 1.00 0.00 O ATOM 570 CB SER A 841 -7.675 5.427 -7.709 1.00 0.00 C ATOM 571 OG SER A 841 -8.327 6.299 -8.626 1.00 0.00 O ATOM 0 H SER A 841 -5.274 5.991 -7.646 1.00 0.00 H new ATOM 0 HA SER A 841 -6.469 3.619 -7.971 1.00 0.00 H new ATOM 0 HB2 SER A 841 -8.406 4.781 -7.223 1.00 0.00 H new ATOM 0 HB3 SER A 841 -7.189 6.006 -6.923 1.00 0.00 H new ATOM 0 HG SER A 841 -8.991 6.839 -8.148 1.00 0.00 H new ATOM 577 N GLY A 842 -7.561 3.076 -10.051 1.00 0.00 N ATOM 578 CA GLY A 842 -8.035 2.660 -11.397 1.00 0.00 C ATOM 579 C GLY A 842 -9.558 2.654 -11.440 1.00 0.00 C ATOM 580 O GLY A 842 -10.183 3.630 -11.802 1.00 0.00 O ATOM 0 H GLY A 842 -7.622 2.358 -9.329 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -7.645 3.340 -12.154 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -7.653 1.667 -11.634 1.00 0.00 H new ATOM 740 N ILE A 852 -4.748 -14.156 -6.811 1.00 0.00 N ATOM 741 CA ILE A 852 -4.078 -14.486 -5.515 1.00 0.00 C ATOM 742 C ILE A 852 -4.288 -13.391 -4.483 1.00 0.00 C ATOM 743 O ILE A 852 -4.468 -13.650 -3.309 1.00 0.00 O ATOM 744 CB ILE A 852 -2.593 -14.600 -5.861 1.00 0.00 C ATOM 745 CG1 ILE A 852 -2.134 -13.326 -6.588 1.00 0.00 C ATOM 746 CG2 ILE A 852 -2.379 -15.816 -6.764 1.00 0.00 C ATOM 747 CD1 ILE A 852 -1.439 -12.388 -5.597 1.00 0.00 C ATOM 0 HA ILE A 852 -4.484 -15.399 -5.079 1.00 0.00 H new ATOM 0 HB ILE A 852 -2.011 -14.719 -4.947 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -1.452 -13.584 -7.399 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -2.990 -12.824 -7.039 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -1.322 -15.902 -7.014 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -2.703 -16.717 -6.244 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.959 -15.696 -7.679 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.115 -11.486 -6.116 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -2.134 -12.119 -4.802 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -0.572 -12.890 -5.167 1.00 0.00 H new ATOM 759 N THR A 853 -4.256 -12.169 -4.911 1.00 0.00 N ATOM 760 CA THR A 853 -4.434 -11.051 -3.998 1.00 0.00 C ATOM 761 C THR A 853 -5.746 -11.184 -3.268 1.00 0.00 C ATOM 762 O THR A 853 -6.777 -11.486 -3.837 1.00 0.00 O ATOM 763 CB THR A 853 -4.453 -9.845 -4.917 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.469 -10.011 -5.900 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.112 -9.730 -5.622 1.00 0.00 C ATOM 0 H THR A 853 -4.109 -11.905 -5.885 1.00 0.00 H new ATOM 0 HA THR A 853 -3.659 -10.988 -3.234 1.00 0.00 H new ATOM 0 HB THR A 853 -4.647 -8.948 -4.329 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.051 -9.222 -5.906 1.00 0.00 H new ATOM 0 HG21 THR A 853 -3.122 -8.864 -6.284 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.321 -9.612 -4.882 1.00 0.00 H new ATOM 0 HG23 THR A 853 -2.930 -10.632 -6.207 1.00 0.00 H new ATOM 773 N THR A 854 -5.702 -10.941 -2.018 1.00 0.00 N ATOM 774 CA THR A 854 -6.927 -11.008 -1.210 1.00 0.00 C ATOM 775 C THR A 854 -7.570 -9.625 -1.242 1.00 0.00 C ATOM 776 O THR A 854 -6.870 -8.637 -1.283 1.00 0.00 O ATOM 777 CB THR A 854 -6.471 -11.376 0.206 1.00 0.00 C ATOM 778 OG1 THR A 854 -7.603 -11.449 1.061 1.00 0.00 O ATOM 779 CG2 THR A 854 -5.498 -10.319 0.739 1.00 0.00 C ATOM 0 H THR A 854 -4.857 -10.693 -1.504 1.00 0.00 H new ATOM 0 HA THR A 854 -7.653 -11.736 -1.571 1.00 0.00 H new ATOM 0 HB THR A 854 -5.966 -12.342 0.178 1.00 0.00 H new ATOM 0 HG1 THR A 854 -7.314 -11.686 1.967 1.00 0.00 H new ATOM 0 HG21 THR A 854 -5.181 -10.591 1.746 1.00 0.00 H new ATOM 0 HG22 THR A 854 -4.627 -10.264 0.086 1.00 0.00 H new ATOM 0 HG23 THR A 854 -5.993 -9.348 0.765 1.00 0.00 H new ATOM 787 N PRO A 855 -8.872 -9.592 -1.226 1.00 0.00 N ATOM 788 CA PRO A 855 -9.596 -8.303 -1.247 1.00 0.00 C ATOM 789 C PRO A 855 -9.122 -7.472 -0.057 1.00 0.00 C ATOM 790 O PRO A 855 -9.836 -7.287 0.908 1.00 0.00 O ATOM 791 CB PRO A 855 -11.057 -8.742 -1.099 1.00 0.00 C ATOM 792 CG PRO A 855 -11.102 -10.283 -1.009 1.00 0.00 C ATOM 793 CD PRO A 855 -9.675 -10.824 -1.177 1.00 0.00 C ATOM 0 HA PRO A 855 -9.443 -7.690 -2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.497 -8.298 -0.206 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.644 -8.395 -1.949 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.514 -10.594 -0.049 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.754 -10.689 -1.783 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -9.384 -11.466 -0.345 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -9.569 -11.414 -2.087 1.00 0.00 H new ATOM 800 N TYR A 856 -7.901 -6.997 -0.119 1.00 0.00 N ATOM 801 CA TYR A 856 -7.326 -6.211 0.997 1.00 0.00 C ATOM 802 C TYR A 856 -5.858 -5.992 0.697 1.00 0.00 C ATOM 803 O TYR A 856 -5.037 -6.870 0.881 1.00 0.00 O ATOM 804 CB TYR A 856 -7.477 -7.075 2.246 1.00 0.00 C ATOM 805 CG TYR A 856 -6.919 -6.376 3.472 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.535 -6.224 3.640 1.00 0.00 C ATOM 807 CD2 TYR A 856 -7.792 -5.898 4.457 1.00 0.00 C ATOM 808 CE1 TYR A 856 -5.031 -5.602 4.786 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.287 -5.272 5.600 1.00 0.00 C ATOM 810 CZ TYR A 856 -5.908 -5.125 5.766 1.00 0.00 C ATOM 811 OH TYR A 856 -5.411 -4.511 6.897 1.00 0.00 O ATOM 0 H TYR A 856 -7.275 -7.128 -0.913 1.00 0.00 H new ATOM 0 HA TYR A 856 -7.815 -5.246 1.132 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.530 -7.307 2.405 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -6.960 -8.023 2.099 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -4.857 -6.588 2.882 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -8.859 -6.013 4.333 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -3.965 -5.490 4.915 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -7.964 -4.902 6.356 1.00 0.00 H new ATOM 0 HH TYR A 856 -4.538 -4.895 7.121 1.00 0.00 H new ATOM 821 N MET A 857 -5.523 -4.852 0.203 1.00 0.00 N ATOM 822 CA MET A 857 -4.103 -4.589 -0.145 1.00 0.00 C ATOM 823 C MET A 857 -3.208 -4.851 1.067 1.00 0.00 C ATOM 824 O MET A 857 -3.682 -4.949 2.179 1.00 0.00 O ATOM 825 CB MET A 857 -4.041 -3.113 -0.516 1.00 0.00 C ATOM 826 CG MET A 857 -2.616 -2.753 -0.953 1.00 0.00 C ATOM 827 SD MET A 857 -2.403 -0.959 -0.967 1.00 0.00 S ATOM 828 CE MET A 857 -3.605 -0.615 -2.263 1.00 0.00 C ATOM 0 H MET A 857 -6.167 -4.082 0.021 1.00 0.00 H new ATOM 0 HA MET A 857 -3.761 -5.232 -0.956 1.00 0.00 H new ATOM 0 HB2 MET A 857 -4.744 -2.900 -1.321 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.337 -2.501 0.336 1.00 0.00 H new ATOM 0 HG2 MET A 857 -1.894 -3.207 -0.274 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.419 -3.158 -1.946 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.405 0.366 -2.693 1.00 0.00 H new ATOM 0 HE2 MET A 857 -3.529 -1.375 -3.041 1.00 0.00 H new ATOM 0 HE3 MET A 857 -4.610 -0.628 -1.840 1.00 0.00 H new ATOM 838 N THR A 858 -1.920 -4.961 0.875 1.00 0.00 N ATOM 839 CA THR A 858 -1.036 -5.214 2.046 1.00 0.00 C ATOM 840 C THR A 858 0.123 -4.235 2.093 1.00 0.00 C ATOM 841 O THR A 858 0.695 -3.874 1.086 1.00 0.00 O ATOM 842 CB THR A 858 -0.573 -6.652 1.875 1.00 0.00 C ATOM 843 OG1 THR A 858 0.076 -6.804 0.621 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.809 -7.545 1.939 1.00 0.00 C ATOM 0 H THR A 858 -1.449 -4.888 -0.027 1.00 0.00 H new ATOM 0 HA THR A 858 -1.554 -5.071 2.994 1.00 0.00 H new ATOM 0 HB THR A 858 0.134 -6.925 2.659 1.00 0.00 H new ATOM 0 HG1 THR A 858 -0.565 -6.639 -0.101 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.512 -8.587 1.819 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.301 -7.416 2.903 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.498 -7.270 1.140 1.00 0.00 H new ATOM 852 N LYS A 859 0.428 -3.787 3.287 1.00 0.00 N ATOM 853 CA LYS A 859 1.524 -2.793 3.519 1.00 0.00 C ATOM 854 C LYS A 859 2.556 -2.705 2.382 1.00 0.00 C ATOM 855 O LYS A 859 3.016 -1.627 2.083 1.00 0.00 O ATOM 856 CB LYS A 859 2.200 -3.254 4.812 1.00 0.00 C ATOM 857 CG LYS A 859 2.726 -4.682 4.640 1.00 0.00 C ATOM 858 CD LYS A 859 3.447 -5.119 5.916 1.00 0.00 C ATOM 859 CE LYS A 859 4.914 -4.687 5.849 1.00 0.00 C ATOM 860 NZ LYS A 859 5.650 -5.702 6.652 1.00 0.00 N ATOM 0 H LYS A 859 -0.053 -4.079 4.137 1.00 0.00 H new ATOM 0 HA LYS A 859 1.103 -1.789 3.573 1.00 0.00 H new ATOM 0 HB2 LYS A 859 3.020 -2.582 5.064 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.490 -3.215 5.638 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.901 -5.361 4.425 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.407 -4.730 3.790 1.00 0.00 H new ATOM 0 HD2 LYS A 859 2.966 -4.676 6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 859 3.381 -6.201 6.031 1.00 0.00 H new ATOM 0 HE2 LYS A 859 5.272 -4.662 4.820 1.00 0.00 H new ATOM 0 HE3 LYS A 859 5.050 -3.686 6.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 6.665 -5.474 6.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 5.292 -5.698 7.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 5.508 -6.644 6.235 1.00 0.00 H new ATOM 874 N TYR A 860 2.942 -3.788 1.741 1.00 0.00 N ATOM 875 CA TYR A 860 3.953 -3.631 0.650 1.00 0.00 C ATOM 876 C TYR A 860 3.367 -2.815 -0.485 1.00 0.00 C ATOM 877 O TYR A 860 3.959 -1.848 -0.921 1.00 0.00 O ATOM 878 CB TYR A 860 4.325 -5.020 0.153 1.00 0.00 C ATOM 879 CG TYR A 860 5.211 -4.877 -1.079 1.00 0.00 C ATOM 880 CD1 TYR A 860 6.057 -3.761 -1.205 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.167 -5.830 -2.105 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.852 -3.601 -2.341 1.00 0.00 C ATOM 883 CE2 TYR A 860 5.969 -5.666 -3.240 1.00 0.00 C ATOM 884 CZ TYR A 860 6.808 -4.554 -3.360 1.00 0.00 C ATOM 885 OH TYR A 860 7.594 -4.403 -4.483 1.00 0.00 O ATOM 0 H TYR A 860 2.614 -4.737 1.919 1.00 0.00 H new ATOM 0 HA TYR A 860 4.836 -3.113 1.024 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.849 -5.573 0.933 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.427 -5.587 -0.091 1.00 0.00 H new ATOM 0 HD1 TYR A 860 6.092 -3.023 -0.418 1.00 0.00 H new ATOM 0 HD2 TYR A 860 4.517 -6.688 -2.020 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.500 -2.742 -2.431 1.00 0.00 H new ATOM 0 HE2 TYR A 860 5.940 -6.403 -4.029 1.00 0.00 H new ATOM 0 HH TYR A 860 7.442 -5.156 -5.092 1.00 0.00 H new ATOM 895 N GLU A 861 2.208 -3.177 -0.964 1.00 0.00 N ATOM 896 CA GLU A 861 1.599 -2.374 -2.061 1.00 0.00 C ATOM 897 C GLU A 861 1.712 -0.909 -1.664 1.00 0.00 C ATOM 898 O GLU A 861 2.021 -0.049 -2.461 1.00 0.00 O ATOM 899 CB GLU A 861 0.139 -2.814 -2.125 1.00 0.00 C ATOM 900 CG GLU A 861 0.025 -4.107 -2.931 1.00 0.00 C ATOM 901 CD GLU A 861 0.161 -5.305 -1.991 1.00 0.00 C ATOM 902 OE1 GLU A 861 -0.817 -5.632 -1.340 1.00 0.00 O ATOM 903 OE2 GLU A 861 1.238 -5.873 -1.938 1.00 0.00 O ATOM 0 H GLU A 861 1.664 -3.981 -0.649 1.00 0.00 H new ATOM 0 HA GLU A 861 2.079 -2.511 -3.030 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.249 -2.967 -1.118 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.466 -2.033 -2.585 1.00 0.00 H new ATOM 0 HG2 GLU A 861 -0.934 -4.143 -3.448 1.00 0.00 H new ATOM 0 HG3 GLU A 861 0.801 -4.141 -3.696 1.00 0.00 H new ATOM 910 N ARG A 862 1.506 -0.647 -0.405 1.00 0.00 N ATOM 911 CA ARG A 862 1.642 0.741 0.108 1.00 0.00 C ATOM 912 C ARG A 862 3.127 1.076 0.287 1.00 0.00 C ATOM 913 O ARG A 862 3.539 2.210 0.138 1.00 0.00 O ATOM 914 CB ARG A 862 0.937 0.738 1.454 1.00 0.00 C ATOM 915 CG ARG A 862 -0.051 1.913 1.519 1.00 0.00 C ATOM 916 CD ARG A 862 0.487 3.010 2.447 1.00 0.00 C ATOM 917 NE ARG A 862 1.919 3.186 2.074 1.00 0.00 N ATOM 918 CZ ARG A 862 2.819 3.367 3.004 1.00 0.00 C ATOM 919 NH1 ARG A 862 3.406 4.524 3.125 1.00 0.00 N ATOM 920 NH2 ARG A 862 3.132 2.391 3.812 1.00 0.00 N ATOM 0 H ARG A 862 1.247 -1.342 0.296 1.00 0.00 H new ATOM 0 HA ARG A 862 1.216 1.481 -0.570 1.00 0.00 H new ATOM 0 HB2 ARG A 862 0.408 -0.204 1.597 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.667 0.819 2.259 1.00 0.00 H new ATOM 0 HG2 ARG A 862 -0.211 2.318 0.520 1.00 0.00 H new ATOM 0 HG3 ARG A 862 -1.019 1.564 1.880 1.00 0.00 H new ATOM 0 HD2 ARG A 862 -0.068 3.939 2.318 1.00 0.00 H new ATOM 0 HD3 ARG A 862 0.387 2.721 3.493 1.00 0.00 H new ATOM 0 HE ARG A 862 2.197 3.165 1.093 1.00 0.00 H new ATOM 0 HH11 ARG A 862 3.163 5.288 2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 862 4.109 4.666 3.851 1.00 0.00 H new ATOM 0 HH21 ARG A 862 2.674 1.485 3.718 1.00 0.00 H new ATOM 0 HH22 ARG A 862 3.835 2.535 4.537 1.00 0.00 H new ATOM 934 N ALA A 863 3.938 0.098 0.603 1.00 0.00 N ATOM 935 CA ALA A 863 5.392 0.375 0.777 1.00 0.00 C ATOM 936 C ALA A 863 6.052 0.591 -0.586 1.00 0.00 C ATOM 937 O ALA A 863 7.076 1.245 -0.701 1.00 0.00 O ATOM 938 CB ALA A 863 5.966 -0.864 1.467 1.00 0.00 C ATOM 0 H ALA A 863 3.657 -0.872 0.747 1.00 0.00 H new ATOM 0 HA ALA A 863 5.570 1.276 1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 863 7.036 -0.729 1.627 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.471 -1.008 2.427 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.801 -1.740 0.839 1.00 0.00 H new ATOM 944 N ARG A 864 5.431 0.130 -1.635 1.00 0.00 N ATOM 945 CA ARG A 864 6.006 0.388 -2.981 1.00 0.00 C ATOM 946 C ARG A 864 5.453 1.739 -3.348 1.00 0.00 C ATOM 947 O ARG A 864 6.127 2.634 -3.815 1.00 0.00 O ATOM 948 CB ARG A 864 5.493 -0.717 -3.898 1.00 0.00 C ATOM 949 CG ARG A 864 6.699 -1.447 -4.502 1.00 0.00 C ATOM 950 CD ARG A 864 6.921 -0.971 -5.941 1.00 0.00 C ATOM 951 NE ARG A 864 8.019 0.034 -5.850 1.00 0.00 N ATOM 952 CZ ARG A 864 8.546 0.525 -6.938 1.00 0.00 C ATOM 953 NH1 ARG A 864 9.718 0.114 -7.339 1.00 0.00 N ATOM 954 NH2 ARG A 864 7.901 1.428 -7.626 1.00 0.00 N ATOM 0 H ARG A 864 4.563 -0.406 -1.619 1.00 0.00 H new ATOM 0 HA ARG A 864 7.094 0.389 -3.041 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.869 -1.414 -3.339 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.871 -0.296 -4.688 1.00 0.00 H new ATOM 0 HG2 ARG A 864 7.590 -1.255 -3.904 1.00 0.00 H new ATOM 0 HG3 ARG A 864 6.530 -2.524 -4.487 1.00 0.00 H new ATOM 0 HD2 ARG A 864 7.198 -1.800 -6.593 1.00 0.00 H new ATOM 0 HD3 ARG A 864 6.015 -0.529 -6.355 1.00 0.00 H new ATOM 0 HE ARG A 864 8.358 0.338 -4.937 1.00 0.00 H new ATOM 0 HH11 ARG A 864 10.222 -0.591 -6.802 1.00 0.00 H new ATOM 0 HH12 ARG A 864 10.130 0.498 -8.190 1.00 0.00 H new ATOM 0 HH21 ARG A 864 6.985 1.750 -7.313 1.00 0.00 H new ATOM 0 HH22 ARG A 864 8.313 1.812 -8.476 1.00 0.00 H new ATOM 968 N VAL A 865 4.212 1.881 -3.002 1.00 0.00 N ATOM 969 CA VAL A 865 3.483 3.150 -3.148 1.00 0.00 C ATOM 970 C VAL A 865 4.338 4.243 -2.529 1.00 0.00 C ATOM 971 O VAL A 865 4.796 5.133 -3.183 1.00 0.00 O ATOM 972 CB VAL A 865 2.258 2.859 -2.292 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.827 4.069 -1.490 1.00 0.00 C ATOM 974 CG2 VAL A 865 1.136 2.393 -3.172 1.00 0.00 C ATOM 0 H VAL A 865 3.651 1.127 -2.605 1.00 0.00 H new ATOM 0 HA VAL A 865 3.242 3.468 -4.163 1.00 0.00 H new ATOM 0 HB VAL A 865 2.520 2.077 -1.579 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.950 3.817 -0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.638 4.376 -0.830 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.582 4.886 -2.168 1.00 0.00 H new ATOM 0 HG21 VAL A 865 0.258 2.184 -2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.897 3.170 -3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 865 1.437 1.486 -3.696 1.00 0.00 H new ATOM 984 N LEU A 866 4.577 4.112 -1.256 1.00 0.00 N ATOM 985 CA LEU A 866 5.440 5.058 -0.506 1.00 0.00 C ATOM 986 C LEU A 866 6.648 5.330 -1.372 1.00 0.00 C ATOM 987 O LEU A 866 7.116 6.440 -1.487 1.00 0.00 O ATOM 988 CB LEU A 866 5.806 4.297 0.788 1.00 0.00 C ATOM 989 CG LEU A 866 7.269 4.543 1.199 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.356 4.672 2.723 1.00 0.00 C ATOM 991 CD2 LEU A 866 8.136 3.364 0.751 1.00 0.00 C ATOM 0 H LEU A 866 4.194 3.358 -0.686 1.00 0.00 H new ATOM 0 HA LEU A 866 4.981 6.016 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.144 4.611 1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.644 3.229 0.640 1.00 0.00 H new ATOM 0 HG LEU A 866 7.623 5.460 0.728 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.392 4.846 3.015 1.00 0.00 H new ATOM 0 HD12 LEU A 866 6.740 5.509 3.053 1.00 0.00 H new ATOM 0 HD13 LEU A 866 6.998 3.753 3.187 1.00 0.00 H new ATOM 0 HD21 LEU A 866 9.171 3.542 1.044 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.778 2.449 1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 866 8.078 3.261 -0.333 1.00 0.00 H new ATOM 1003 N GLY A 867 7.128 4.313 -2.026 1.00 0.00 N ATOM 1004 CA GLY A 867 8.268 4.521 -2.933 1.00 0.00 C ATOM 1005 C GLY A 867 7.805 5.424 -4.066 1.00 0.00 C ATOM 1006 O GLY A 867 8.449 6.390 -4.393 1.00 0.00 O ATOM 0 H GLY A 867 6.778 3.357 -1.968 1.00 0.00 H new ATOM 0 HA2 GLY A 867 9.102 4.976 -2.399 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.622 3.568 -3.325 1.00 0.00 H new ATOM 1010 N THR A 868 6.674 5.123 -4.645 1.00 0.00 N ATOM 1011 CA THR A 868 6.148 5.978 -5.775 1.00 0.00 C ATOM 1012 C THR A 868 5.600 7.276 -5.250 1.00 0.00 C ATOM 1013 O THR A 868 5.558 8.269 -5.941 1.00 0.00 O ATOM 1014 CB THR A 868 5.023 5.180 -6.388 1.00 0.00 C ATOM 1015 OG1 THR A 868 3.907 5.168 -5.508 1.00 0.00 O ATOM 1016 CG2 THR A 868 5.527 3.785 -6.598 1.00 0.00 C ATOM 0 H THR A 868 6.086 4.328 -4.394 1.00 0.00 H new ATOM 0 HA THR A 868 6.936 6.217 -6.489 1.00 0.00 H new ATOM 0 HB THR A 868 4.706 5.619 -7.334 1.00 0.00 H new ATOM 0 HG1 THR A 868 4.219 5.250 -4.583 1.00 0.00 H new ATOM 0 HG21 THR A 868 4.739 3.176 -7.041 1.00 0.00 H new ATOM 0 HG22 THR A 868 6.388 3.806 -7.266 1.00 0.00 H new ATOM 0 HG23 THR A 868 5.821 3.356 -5.640 1.00 0.00 H new ATOM 1024 N ARG A 869 5.264 7.294 -4.011 1.00 0.00 N ATOM 1025 CA ARG A 869 4.808 8.552 -3.405 1.00 0.00 C ATOM 1026 C ARG A 869 6.089 9.312 -3.214 1.00 0.00 C ATOM 1027 O ARG A 869 6.223 10.449 -3.585 1.00 0.00 O ATOM 1028 CB ARG A 869 4.159 8.176 -2.071 1.00 0.00 C ATOM 1029 CG ARG A 869 2.655 8.457 -2.139 1.00 0.00 C ATOM 1030 CD ARG A 869 1.994 7.482 -3.118 1.00 0.00 C ATOM 1031 NE ARG A 869 1.094 8.326 -3.955 1.00 0.00 N ATOM 1032 CZ ARG A 869 1.145 8.243 -5.257 1.00 0.00 C ATOM 1033 NH1 ARG A 869 1.297 7.081 -5.833 1.00 0.00 N ATOM 1034 NH2 ARG A 869 1.041 9.322 -5.984 1.00 0.00 N ATOM 0 H ARG A 869 5.285 6.488 -3.386 1.00 0.00 H new ATOM 0 HA ARG A 869 4.086 9.134 -3.978 1.00 0.00 H new ATOM 0 HB2 ARG A 869 4.334 7.122 -1.853 1.00 0.00 H new ATOM 0 HB3 ARG A 869 4.611 8.748 -1.260 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.210 8.352 -1.149 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.481 9.484 -2.460 1.00 0.00 H new ATOM 0 HD2 ARG A 869 2.738 6.972 -3.730 1.00 0.00 H new ATOM 0 HD3 ARG A 869 1.433 6.711 -2.589 1.00 0.00 H new ATOM 0 HE ARG A 869 0.438 8.968 -3.510 1.00 0.00 H new ATOM 0 HH11 ARG A 869 1.376 6.237 -5.266 1.00 0.00 H new ATOM 0 HH12 ARG A 869 1.337 7.017 -6.850 1.00 0.00 H new ATOM 0 HH21 ARG A 869 0.920 10.230 -5.535 1.00 0.00 H new ATOM 0 HH22 ARG A 869 1.081 9.257 -7.001 1.00 0.00 H new ATOM 1048 N ALA A 870 7.055 8.620 -2.677 1.00 0.00 N ATOM 1049 CA ALA A 870 8.406 9.220 -2.478 1.00 0.00 C ATOM 1050 C ALA A 870 9.028 9.713 -3.801 1.00 0.00 C ATOM 1051 O ALA A 870 9.707 10.713 -3.816 1.00 0.00 O ATOM 1052 CB ALA A 870 9.243 8.087 -1.892 1.00 0.00 C ATOM 0 H ALA A 870 6.966 7.653 -2.364 1.00 0.00 H new ATOM 0 HA ALA A 870 8.357 10.097 -1.833 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.258 8.440 -1.712 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.802 7.758 -0.951 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.268 7.253 -2.593 1.00 0.00 H new ATOM 1058 N LEU A 871 8.805 9.060 -4.915 1.00 0.00 N ATOM 1059 CA LEU A 871 9.408 9.605 -6.191 1.00 0.00 C ATOM 1060 C LEU A 871 8.438 10.580 -6.792 1.00 0.00 C ATOM 1061 O LEU A 871 8.828 11.607 -7.319 1.00 0.00 O ATOM 1062 CB LEU A 871 9.739 8.471 -7.194 1.00 0.00 C ATOM 1063 CG LEU A 871 9.225 7.112 -6.738 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.857 6.277 -7.965 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.326 6.400 -5.945 1.00 0.00 C ATOM 0 H LEU A 871 8.255 8.206 -5.007 1.00 0.00 H new ATOM 0 HA LEU A 871 10.348 10.105 -5.960 1.00 0.00 H new ATOM 0 HB2 LEU A 871 9.305 8.712 -8.164 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.819 8.418 -7.333 1.00 0.00 H new ATOM 0 HG LEU A 871 8.345 7.240 -6.107 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.488 5.303 -7.645 1.00 0.00 H new ATOM 0 HD12 LEU A 871 8.081 6.789 -8.534 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.739 6.143 -8.592 1.00 0.00 H new ATOM 0 HD21 LEU A 871 9.965 5.426 -5.615 1.00 0.00 H new ATOM 0 HD22 LEU A 871 11.203 6.266 -6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.595 7.001 -5.076 1.00 0.00 H new ATOM 1077 N GLN A 872 7.170 10.296 -6.688 1.00 0.00 N ATOM 1078 CA GLN A 872 6.178 11.260 -7.227 1.00 0.00 C ATOM 1079 C GLN A 872 6.625 12.666 -6.801 1.00 0.00 C ATOM 1080 O GLN A 872 6.977 13.499 -7.613 1.00 0.00 O ATOM 1081 CB GLN A 872 4.864 10.849 -6.557 1.00 0.00 C ATOM 1082 CG GLN A 872 3.938 10.133 -7.560 1.00 0.00 C ATOM 1083 CD GLN A 872 4.695 9.030 -8.311 1.00 0.00 C ATOM 1084 OE1 GLN A 872 5.616 9.302 -9.054 1.00 0.00 O ATOM 1085 NE2 GLN A 872 4.335 7.787 -8.152 1.00 0.00 N ATOM 0 H GLN A 872 6.785 9.454 -6.261 1.00 0.00 H new ATOM 0 HA GLN A 872 6.076 11.262 -8.312 1.00 0.00 H new ATOM 0 HB2 GLN A 872 5.071 10.191 -5.713 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.363 11.731 -6.158 1.00 0.00 H new ATOM 0 HG2 GLN A 872 3.087 9.702 -7.032 1.00 0.00 H new ATOM 0 HG3 GLN A 872 3.538 10.855 -8.272 1.00 0.00 H new ATOM 0 HE21 GLN A 872 3.562 7.556 -7.528 1.00 0.00 H new ATOM 0 HE22 GLN A 872 4.827 7.046 -8.651 1.00 0.00 H new ATOM 1094 N ILE A 873 6.659 12.896 -5.524 1.00 0.00 N ATOM 1095 CA ILE A 873 7.134 14.208 -4.980 1.00 0.00 C ATOM 1096 C ILE A 873 8.570 14.441 -5.335 1.00 0.00 C ATOM 1097 O ILE A 873 8.980 15.553 -5.597 1.00 0.00 O ATOM 1098 CB ILE A 873 7.116 14.075 -3.470 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.305 12.600 -3.075 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.815 14.636 -2.956 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.531 12.450 -2.182 1.00 0.00 C ATOM 0 H ILE A 873 6.374 12.222 -4.814 1.00 0.00 H new ATOM 0 HA ILE A 873 6.509 15.010 -5.373 1.00 0.00 H new ATOM 0 HB ILE A 873 7.936 14.636 -3.022 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.419 12.239 -2.553 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.420 11.988 -3.969 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.785 14.548 -1.870 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.735 15.686 -3.238 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.983 14.080 -3.388 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.656 11.402 -1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.416 12.793 -2.718 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.399 13.048 -1.280 1.00 0.00 H new ATOM 1113 N ALA A 874 9.354 13.400 -5.319 1.00 0.00 N ATOM 1114 CA ALA A 874 10.789 13.577 -5.634 1.00 0.00 C ATOM 1115 C ALA A 874 10.906 14.366 -6.922 1.00 0.00 C ATOM 1116 O ALA A 874 11.911 14.989 -7.200 1.00 0.00 O ATOM 1117 CB ALA A 874 11.365 12.177 -5.736 1.00 0.00 C ATOM 0 H ALA A 874 9.063 12.446 -5.103 1.00 0.00 H new ATOM 0 HA ALA A 874 11.339 14.137 -4.878 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.428 12.237 -5.968 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.230 11.658 -4.787 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.851 11.629 -6.526 1.00 0.00 H new ATOM 1123 N MET A 875 9.833 14.427 -7.658 1.00 0.00 N ATOM 1124 CA MET A 875 9.838 15.279 -8.864 1.00 0.00 C ATOM 1125 C MET A 875 9.235 16.605 -8.412 1.00 0.00 C ATOM 1126 O MET A 875 9.890 17.625 -8.336 1.00 0.00 O ATOM 1127 CB MET A 875 8.936 14.570 -9.879 1.00 0.00 C ATOM 1128 CG MET A 875 9.554 14.677 -11.275 1.00 0.00 C ATOM 1129 SD MET A 875 8.240 14.824 -12.511 1.00 0.00 S ATOM 1130 CE MET A 875 8.190 13.082 -12.997 1.00 0.00 C ATOM 0 H MET A 875 8.963 13.927 -7.474 1.00 0.00 H new ATOM 0 HA MET A 875 10.818 15.448 -9.311 1.00 0.00 H new ATOM 0 HB2 MET A 875 8.814 13.523 -9.603 1.00 0.00 H new ATOM 0 HB3 MET A 875 7.943 15.019 -9.874 1.00 0.00 H new ATOM 0 HG2 MET A 875 10.214 15.543 -11.326 1.00 0.00 H new ATOM 0 HG3 MET A 875 10.165 13.798 -11.482 1.00 0.00 H new ATOM 0 HE1 MET A 875 7.432 12.941 -13.767 1.00 0.00 H new ATOM 0 HE2 MET A 875 9.163 12.785 -13.387 1.00 0.00 H new ATOM 0 HE3 MET A 875 7.945 12.469 -12.130 1.00 0.00 H new ATOM 1140 N CYS A 876 7.990 16.550 -8.046 1.00 0.00 N ATOM 1141 CA CYS A 876 7.275 17.741 -7.506 1.00 0.00 C ATOM 1142 C CYS A 876 6.404 17.294 -6.338 1.00 0.00 C ATOM 1143 O CYS A 876 6.783 17.376 -5.190 1.00 0.00 O ATOM 1144 CB CYS A 876 6.434 18.281 -8.665 1.00 0.00 C ATOM 1145 SG CYS A 876 7.433 19.418 -9.657 1.00 0.00 S ATOM 0 H CYS A 876 7.419 15.706 -8.099 1.00 0.00 H new ATOM 0 HA CYS A 876 7.947 18.516 -7.136 1.00 0.00 H new ATOM 0 HB2 CYS A 876 6.078 17.458 -9.284 1.00 0.00 H new ATOM 0 HB3 CYS A 876 5.553 18.795 -8.281 1.00 0.00 H new ATOM 0 HG CYS A 876 8.694 19.152 -9.484 1.00 0.00 H new ATOM 1151 N ALA A 877 5.240 16.786 -6.632 1.00 0.00 N ATOM 1152 CA ALA A 877 4.338 16.302 -5.546 1.00 0.00 C ATOM 1153 C ALA A 877 2.993 15.760 -6.074 1.00 0.00 C ATOM 1154 O ALA A 877 1.949 16.140 -5.580 1.00 0.00 O ATOM 1155 CB ALA A 877 4.106 17.506 -4.639 1.00 0.00 C ATOM 0 H ALA A 877 4.872 16.684 -7.578 1.00 0.00 H new ATOM 0 HA ALA A 877 4.799 15.464 -5.024 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.450 17.221 -3.817 1.00 0.00 H new ATOM 0 HB2 ALA A 877 5.060 17.850 -4.239 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.642 18.309 -5.212 1.00 0.00 H new ATOM 1161 N PRO A 878 3.053 14.830 -7.002 1.00 0.00 N ATOM 1162 CA PRO A 878 1.819 14.176 -7.514 1.00 0.00 C ATOM 1163 C PRO A 878 1.164 13.418 -6.356 1.00 0.00 C ATOM 1164 O PRO A 878 0.052 12.935 -6.435 1.00 0.00 O ATOM 1165 CB PRO A 878 2.364 13.190 -8.538 1.00 0.00 C ATOM 1166 CG PRO A 878 3.895 13.309 -8.568 1.00 0.00 C ATOM 1167 CD PRO A 878 4.330 14.392 -7.588 1.00 0.00 C ATOM 0 HA PRO A 878 1.080 14.860 -7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 878 2.069 12.173 -8.278 1.00 0.00 H new ATOM 0 HB3 PRO A 878 1.949 13.400 -9.524 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.352 12.356 -8.302 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.233 13.555 -9.575 1.00 0.00 H new ATOM 0 HD2 PRO A 878 5.011 14.003 -6.831 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.846 15.210 -8.091 1.00 0.00 H new ATOM 1174 N VAL A 879 1.892 13.323 -5.280 1.00 0.00 N ATOM 1175 CA VAL A 879 1.427 12.618 -4.057 1.00 0.00 C ATOM 1176 C VAL A 879 0.049 13.143 -3.656 1.00 0.00 C ATOM 1177 O VAL A 879 -0.487 14.046 -4.268 1.00 0.00 O ATOM 1178 CB VAL A 879 2.507 13.025 -3.028 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.130 12.654 -1.584 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.827 12.343 -3.400 1.00 0.00 C ATOM 0 H VAL A 879 2.827 13.722 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 879 1.318 11.539 -4.162 1.00 0.00 H new ATOM 0 HB VAL A 879 2.600 14.110 -3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 879 2.927 12.965 -0.909 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.204 13.158 -1.309 1.00 0.00 H new ATOM 0 HG13 VAL A 879 1.992 11.575 -1.510 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.597 12.623 -2.681 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.694 11.261 -3.387 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.131 12.659 -4.398 1.00 0.00 H new ATOM 1190 N MET A 880 -0.534 12.565 -2.653 1.00 0.00 N ATOM 1191 CA MET A 880 -1.894 13.005 -2.222 1.00 0.00 C ATOM 1192 C MET A 880 -1.787 14.088 -1.150 1.00 0.00 C ATOM 1193 O MET A 880 -2.694 14.302 -0.370 1.00 0.00 O ATOM 1194 CB MET A 880 -2.564 11.747 -1.664 1.00 0.00 C ATOM 1195 CG MET A 880 -3.739 11.354 -2.565 1.00 0.00 C ATOM 1196 SD MET A 880 -5.285 11.965 -1.848 1.00 0.00 S ATOM 1197 CE MET A 880 -5.577 13.296 -3.040 1.00 0.00 C ATOM 0 H MET A 880 -0.131 11.803 -2.107 1.00 0.00 H new ATOM 0 HA MET A 880 -2.468 13.435 -3.043 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.843 10.931 -1.611 1.00 0.00 H new ATOM 0 HB3 MET A 880 -2.915 11.929 -0.648 1.00 0.00 H new ATOM 0 HG2 MET A 880 -3.600 11.770 -3.563 1.00 0.00 H new ATOM 0 HG3 MET A 880 -3.780 10.270 -2.674 1.00 0.00 H new ATOM 0 HE1 MET A 880 -6.499 13.818 -2.784 1.00 0.00 H new ATOM 0 HE2 MET A 880 -4.743 13.998 -3.013 1.00 0.00 H new ATOM 0 HE3 MET A 880 -5.664 12.875 -4.042 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.694 14.792 -1.144 1.00 0.00 N ATOM 1208 CA VAL A 881 -0.490 15.893 -0.186 1.00 0.00 C ATOM 1209 C VAL A 881 0.472 16.875 -0.847 1.00 0.00 C ATOM 1210 O VAL A 881 1.103 16.564 -1.840 1.00 0.00 O ATOM 1211 CB VAL A 881 0.102 15.265 1.082 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.972 14.425 1.787 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.290 14.371 0.720 1.00 0.00 C ATOM 0 H VAL A 881 0.085 14.640 -1.785 1.00 0.00 H new ATOM 0 HA VAL A 881 -1.403 16.426 0.081 1.00 0.00 H new ATOM 0 HB VAL A 881 0.442 16.059 1.746 1.00 0.00 H new ATOM 0 HG11 VAL A 881 -0.551 13.979 2.688 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.814 15.063 2.057 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -1.315 13.636 1.117 1.00 0.00 H new ATOM 0 HG21 VAL A 881 1.703 13.930 1.627 1.00 0.00 H new ATOM 0 HG22 VAL A 881 0.958 13.578 0.050 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.056 14.967 0.225 1.00 0.00 H new ATOM 1223 N GLU A 882 0.563 18.052 -0.340 1.00 0.00 N ATOM 1224 CA GLU A 882 1.456 19.072 -0.971 1.00 0.00 C ATOM 1225 C GLU A 882 2.516 19.575 0.011 1.00 0.00 C ATOM 1226 O GLU A 882 2.465 20.703 0.464 1.00 0.00 O ATOM 1227 CB GLU A 882 0.520 20.212 -1.372 1.00 0.00 C ATOM 1228 CG GLU A 882 0.958 20.785 -2.721 1.00 0.00 C ATOM 1229 CD GLU A 882 -0.136 21.705 -3.265 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -1.299 21.413 -3.034 1.00 0.00 O ATOM 1231 OE2 GLU A 882 0.206 22.687 -3.904 1.00 0.00 O ATOM 0 H GLU A 882 0.061 18.369 0.489 1.00 0.00 H new ATOM 0 HA GLU A 882 2.002 18.657 -1.818 1.00 0.00 H new ATOM 0 HB2 GLU A 882 -0.506 19.849 -1.436 1.00 0.00 H new ATOM 0 HB3 GLU A 882 0.535 20.993 -0.612 1.00 0.00 H new ATOM 0 HG2 GLU A 882 1.890 21.339 -2.607 1.00 0.00 H new ATOM 0 HG3 GLU A 882 1.151 19.976 -3.426 1.00 0.00 H new ATOM 1238 N LEU A 883 3.480 18.759 0.338 1.00 0.00 N ATOM 1239 CA LEU A 883 4.539 19.214 1.283 1.00 0.00 C ATOM 1240 C LEU A 883 5.282 20.428 0.699 1.00 0.00 C ATOM 1241 O LEU A 883 4.934 21.560 0.975 1.00 0.00 O ATOM 1242 CB LEU A 883 5.477 18.011 1.443 1.00 0.00 C ATOM 1243 CG LEU A 883 6.647 18.388 2.354 1.00 0.00 C ATOM 1244 CD1 LEU A 883 6.135 18.608 3.779 1.00 0.00 C ATOM 1245 CD2 LEU A 883 7.677 17.256 2.354 1.00 0.00 C ATOM 0 H LEU A 883 3.580 17.804 -0.005 1.00 0.00 H new ATOM 0 HA LEU A 883 4.133 19.531 2.244 1.00 0.00 H new ATOM 0 HB2 LEU A 883 4.932 17.166 1.865 1.00 0.00 H new ATOM 0 HB3 LEU A 883 5.849 17.695 0.468 1.00 0.00 H new ATOM 0 HG LEU A 883 7.111 19.304 1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 883 6.969 18.877 4.428 1.00 0.00 H new ATOM 0 HD12 LEU A 883 5.400 19.413 3.781 1.00 0.00 H new ATOM 0 HD13 LEU A 883 5.671 17.692 4.145 1.00 0.00 H new ATOM 0 HD21 LEU A 883 8.511 17.523 3.003 1.00 0.00 H new ATOM 0 HD22 LEU A 883 7.212 16.341 2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 883 8.043 17.097 1.340 1.00 0.00 H new ATOM 1257 N GLU A 884 6.302 20.212 -0.098 1.00 0.00 N ATOM 1258 CA GLU A 884 7.051 21.373 -0.677 1.00 0.00 C ATOM 1259 C GLU A 884 7.538 21.089 -2.110 1.00 0.00 C ATOM 1260 O GLU A 884 8.202 21.911 -2.711 1.00 0.00 O ATOM 1261 CB GLU A 884 8.249 21.557 0.255 1.00 0.00 C ATOM 1262 CG GLU A 884 8.190 22.940 0.906 1.00 0.00 C ATOM 1263 CD GLU A 884 8.655 23.999 -0.096 1.00 0.00 C ATOM 1264 OE1 GLU A 884 9.703 23.803 -0.690 1.00 0.00 O ATOM 1265 OE2 GLU A 884 7.957 24.987 -0.252 1.00 0.00 O ATOM 0 H GLU A 884 6.646 19.291 -0.371 1.00 0.00 H new ATOM 0 HA GLU A 884 6.418 22.258 -0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 884 8.247 20.783 1.023 1.00 0.00 H new ATOM 0 HB3 GLU A 884 9.178 21.448 -0.305 1.00 0.00 H new ATOM 0 HG2 GLU A 884 7.173 23.156 1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 884 8.822 22.962 1.794 1.00 0.00 H new ATOM 1272 N GLY A 885 7.256 19.933 -2.650 1.00 0.00 N ATOM 1273 CA GLY A 885 7.748 19.607 -4.011 1.00 0.00 C ATOM 1274 C GLY A 885 8.794 18.492 -3.888 1.00 0.00 C ATOM 1275 O GLY A 885 9.181 17.887 -4.866 1.00 0.00 O ATOM 0 H GLY A 885 6.704 19.201 -2.202 1.00 0.00 H new ATOM 0 HA2 GLY A 885 6.923 19.286 -4.647 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.186 20.489 -4.478 1.00 0.00 H new ATOM 1279 N GLU A 886 9.240 18.232 -2.671 1.00 0.00 N ATOM 1280 CA GLU A 886 10.265 17.171 -2.380 1.00 0.00 C ATOM 1281 C GLU A 886 11.187 17.699 -1.291 1.00 0.00 C ATOM 1282 O GLU A 886 11.778 18.753 -1.432 1.00 0.00 O ATOM 1283 CB GLU A 886 11.068 16.914 -3.657 1.00 0.00 C ATOM 1284 CG GLU A 886 12.357 16.154 -3.323 1.00 0.00 C ATOM 1285 CD GLU A 886 13.089 15.797 -4.618 1.00 0.00 C ATOM 1286 OE1 GLU A 886 13.277 16.684 -5.433 1.00 0.00 O ATOM 1287 OE2 GLU A 886 13.450 14.641 -4.771 1.00 0.00 O ATOM 0 H GLU A 886 8.921 18.732 -1.841 1.00 0.00 H new ATOM 0 HA GLU A 886 9.794 16.244 -2.053 1.00 0.00 H new ATOM 0 HB2 GLU A 886 10.469 16.338 -4.363 1.00 0.00 H new ATOM 0 HB3 GLU A 886 11.309 17.860 -4.141 1.00 0.00 H new ATOM 0 HG2 GLU A 886 12.998 16.765 -2.687 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.123 15.248 -2.763 1.00 0.00 H new ATOM 1294 N THR A 887 11.332 16.989 -0.220 1.00 0.00 N ATOM 1295 CA THR A 887 12.224 17.459 0.854 1.00 0.00 C ATOM 1296 C THR A 887 12.511 16.268 1.729 1.00 0.00 C ATOM 1297 O THR A 887 13.638 15.978 2.082 1.00 0.00 O ATOM 1298 CB THR A 887 11.412 18.516 1.609 1.00 0.00 C ATOM 1299 OG1 THR A 887 11.230 19.655 0.778 1.00 0.00 O ATOM 1300 CG2 THR A 887 12.153 18.929 2.884 1.00 0.00 C ATOM 0 H THR A 887 10.868 16.098 -0.043 1.00 0.00 H new ATOM 0 HA THR A 887 13.169 17.879 0.509 1.00 0.00 H new ATOM 0 HB THR A 887 10.441 18.099 1.877 1.00 0.00 H new ATOM 0 HG1 THR A 887 11.847 19.608 0.018 1.00 0.00 H new ATOM 0 HG21 THR A 887 11.570 19.681 3.416 1.00 0.00 H new ATOM 0 HG22 THR A 887 12.291 18.057 3.523 1.00 0.00 H new ATOM 0 HG23 THR A 887 13.126 19.343 2.621 1.00 0.00 H new ATOM 1308 N ASP A 888 11.476 15.570 2.069 1.00 0.00 N ATOM 1309 CA ASP A 888 11.632 14.378 2.907 1.00 0.00 C ATOM 1310 C ASP A 888 11.865 13.132 2.046 1.00 0.00 C ATOM 1311 O ASP A 888 11.344 13.042 0.951 1.00 0.00 O ATOM 1312 CB ASP A 888 10.317 14.286 3.640 1.00 0.00 C ATOM 1313 CG ASP A 888 10.529 13.631 5.006 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.879 14.343 5.934 1.00 0.00 O ATOM 1315 OD2 ASP A 888 10.339 12.431 5.103 1.00 0.00 O ATOM 0 H ASP A 888 10.517 15.783 1.795 1.00 0.00 H new ATOM 0 HA ASP A 888 12.488 14.441 3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 888 9.890 15.281 3.766 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.604 13.705 3.055 1.00 0.00 H new ATOM 1320 N PRO A 889 12.619 12.193 2.564 1.00 0.00 N ATOM 1321 CA PRO A 889 12.878 10.942 1.818 1.00 0.00 C ATOM 1322 C PRO A 889 11.598 10.099 1.703 1.00 0.00 C ATOM 1323 O PRO A 889 11.562 9.124 0.979 1.00 0.00 O ATOM 1324 CB PRO A 889 13.914 10.234 2.701 1.00 0.00 C ATOM 1325 CG PRO A 889 14.199 11.114 3.932 1.00 0.00 C ATOM 1326 CD PRO A 889 13.261 12.327 3.895 1.00 0.00 C ATOM 0 HA PRO A 889 13.217 11.109 0.795 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.541 9.258 3.012 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.832 10.060 2.140 1.00 0.00 H new ATOM 0 HG2 PRO A 889 14.044 10.544 4.848 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.239 11.440 3.931 1.00 0.00 H new ATOM 0 HD2 PRO A 889 12.530 12.300 4.703 1.00 0.00 H new ATOM 0 HD3 PRO A 889 13.807 13.266 3.990 1.00 0.00 H new ATOM 1333 N LEU A 890 10.542 10.459 2.410 1.00 0.00 N ATOM 1334 CA LEU A 890 9.287 9.670 2.334 1.00 0.00 C ATOM 1335 C LEU A 890 8.166 10.283 3.198 1.00 0.00 C ATOM 1336 O LEU A 890 7.102 9.707 3.292 1.00 0.00 O ATOM 1337 CB LEU A 890 9.644 8.246 2.822 1.00 0.00 C ATOM 1338 CG LEU A 890 9.950 8.206 4.338 1.00 0.00 C ATOM 1339 CD1 LEU A 890 10.930 9.314 4.731 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.656 8.365 5.142 1.00 0.00 C ATOM 0 H LEU A 890 10.508 11.267 3.032 1.00 0.00 H new ATOM 0 HA LEU A 890 8.902 9.661 1.314 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.817 7.571 2.602 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.509 7.881 2.269 1.00 0.00 H new ATOM 0 HG LEU A 890 10.405 7.241 4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.127 9.262 5.802 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.864 9.185 4.183 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.498 10.285 4.488 1.00 0.00 H new ATOM 0 HD21 LEU A 890 8.884 8.335 6.208 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.190 9.320 4.897 1.00 0.00 H new ATOM 0 HD23 LEU A 890 7.972 7.553 4.894 1.00 0.00 H new ATOM 1352 N LEU A 891 8.353 11.449 3.804 1.00 0.00 N ATOM 1353 CA LEU A 891 7.228 12.056 4.600 1.00 0.00 C ATOM 1354 C LEU A 891 6.005 11.947 3.751 1.00 0.00 C ATOM 1355 O LEU A 891 4.912 11.727 4.189 1.00 0.00 O ATOM 1356 CB LEU A 891 7.603 13.529 4.789 1.00 0.00 C ATOM 1357 CG LEU A 891 6.364 14.457 4.834 1.00 0.00 C ATOM 1358 CD1 LEU A 891 5.630 14.513 3.477 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.398 13.992 5.928 1.00 0.00 C ATOM 0 H LEU A 891 9.217 11.991 3.780 1.00 0.00 H new ATOM 0 HA LEU A 891 7.057 11.576 5.563 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.170 13.640 5.713 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.257 13.841 3.975 1.00 0.00 H new ATOM 0 HG LEU A 891 6.719 15.463 5.059 1.00 0.00 H new ATOM 0 HD11 LEU A 891 4.768 15.176 3.557 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.308 14.890 2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.294 13.513 3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.530 14.651 5.951 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.074 12.973 5.718 1.00 0.00 H new ATOM 0 HD23 LEU A 891 5.902 14.021 6.894 1.00 0.00 H new ATOM 1371 N ILE A 892 6.236 12.119 2.514 1.00 0.00 N ATOM 1372 CA ILE A 892 5.163 12.045 1.516 1.00 0.00 C ATOM 1373 C ILE A 892 4.562 10.661 1.542 1.00 0.00 C ATOM 1374 O ILE A 892 3.364 10.476 1.542 1.00 0.00 O ATOM 1375 CB ILE A 892 5.879 12.181 0.190 1.00 0.00 C ATOM 1376 CG1 ILE A 892 6.712 13.465 0.124 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.851 12.150 -0.905 1.00 0.00 C ATOM 1378 CD1 ILE A 892 5.823 14.673 0.321 1.00 0.00 C ATOM 0 H ILE A 892 7.159 12.316 2.128 1.00 0.00 H new ATOM 0 HA ILE A 892 4.388 12.792 1.688 1.00 0.00 H new ATOM 0 HB ILE A 892 6.578 11.353 0.071 1.00 0.00 H new ATOM 0 HG12 ILE A 892 7.486 13.445 0.891 1.00 0.00 H new ATOM 0 HG13 ILE A 892 7.219 13.530 -0.839 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.346 12.247 -1.871 1.00 0.00 H new ATOM 0 HG22 ILE A 892 4.308 11.205 -0.868 1.00 0.00 H new ATOM 0 HG23 ILE A 892 4.152 12.975 -0.771 1.00 0.00 H new ATOM 0 HD11 ILE A 892 6.426 15.580 0.272 1.00 0.00 H new ATOM 0 HD12 ILE A 892 5.065 14.698 -0.462 1.00 0.00 H new ATOM 0 HD13 ILE A 892 5.337 14.612 1.295 1.00 0.00 H new ATOM 1390 N ALA A 893 5.419 9.692 1.549 1.00 0.00 N ATOM 1391 CA ALA A 893 4.934 8.280 1.556 1.00 0.00 C ATOM 1392 C ALA A 893 4.368 7.953 2.933 1.00 0.00 C ATOM 1393 O ALA A 893 3.553 7.061 3.116 1.00 0.00 O ATOM 1394 CB ALA A 893 6.154 7.415 1.280 1.00 0.00 C ATOM 0 H ALA A 893 6.433 9.807 1.550 1.00 0.00 H new ATOM 0 HA ALA A 893 4.153 8.112 0.815 1.00 0.00 H new ATOM 0 HB1 ALA A 893 5.861 6.365 1.273 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.577 7.681 0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 893 6.899 7.578 2.058 1.00 0.00 H new ATOM 1400 N MET A 894 4.762 8.727 3.884 1.00 0.00 N ATOM 1401 CA MET A 894 4.258 8.555 5.269 1.00 0.00 C ATOM 1402 C MET A 894 2.971 9.344 5.404 1.00 0.00 C ATOM 1403 O MET A 894 1.952 8.821 5.745 1.00 0.00 O ATOM 1404 CB MET A 894 5.357 9.147 6.155 1.00 0.00 C ATOM 1405 CG MET A 894 4.841 9.338 7.587 1.00 0.00 C ATOM 1406 SD MET A 894 4.784 11.105 7.991 1.00 0.00 S ATOM 1407 CE MET A 894 6.555 11.447 7.819 1.00 0.00 C ATOM 0 H MET A 894 5.427 9.491 3.764 1.00 0.00 H new ATOM 0 HA MET A 894 4.047 7.520 5.538 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.225 8.488 6.159 1.00 0.00 H new ATOM 0 HB3 MET A 894 5.685 10.104 5.749 1.00 0.00 H new ATOM 0 HG2 MET A 894 3.847 8.901 7.686 1.00 0.00 H new ATOM 0 HG3 MET A 894 5.490 8.816 8.290 1.00 0.00 H new ATOM 0 HE1 MET A 894 6.981 11.660 8.799 1.00 0.00 H new ATOM 0 HE2 MET A 894 7.053 10.579 7.388 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.698 12.308 7.166 1.00 0.00 H new ATOM 1417 N LYS A 895 3.029 10.599 5.107 1.00 0.00 N ATOM 1418 CA LYS A 895 1.824 11.457 5.174 1.00 0.00 C ATOM 1419 C LYS A 895 0.718 10.805 4.352 1.00 0.00 C ATOM 1420 O LYS A 895 -0.417 10.719 4.779 1.00 0.00 O ATOM 1421 CB LYS A 895 2.263 12.795 4.567 1.00 0.00 C ATOM 1422 CG LYS A 895 1.038 13.617 4.156 1.00 0.00 C ATOM 1423 CD LYS A 895 1.152 15.037 4.719 1.00 0.00 C ATOM 1424 CE LYS A 895 0.166 15.209 5.878 1.00 0.00 C ATOM 1425 NZ LYS A 895 0.133 16.675 6.143 1.00 0.00 N ATOM 0 H LYS A 895 3.879 11.081 4.813 1.00 0.00 H new ATOM 0 HA LYS A 895 1.438 11.596 6.184 1.00 0.00 H new ATOM 0 HB2 LYS A 895 2.858 13.353 5.290 1.00 0.00 H new ATOM 0 HB3 LYS A 895 2.899 12.618 3.700 1.00 0.00 H new ATOM 0 HG2 LYS A 895 0.960 13.652 3.069 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.129 13.142 4.525 1.00 0.00 H new ATOM 0 HD2 LYS A 895 2.170 15.222 5.063 1.00 0.00 H new ATOM 0 HD3 LYS A 895 0.942 15.767 3.938 1.00 0.00 H new ATOM 0 HE2 LYS A 895 -0.823 14.833 5.614 1.00 0.00 H new ATOM 0 HE3 LYS A 895 0.492 14.656 6.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 -0.522 16.872 6.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 1.086 17.003 6.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 -0.188 17.175 5.289 1.00 0.00 H new ATOM 1439 N GLU A 896 1.044 10.322 3.181 1.00 0.00 N ATOM 1440 CA GLU A 896 -0.008 9.653 2.358 1.00 0.00 C ATOM 1441 C GLU A 896 -0.590 8.473 3.125 1.00 0.00 C ATOM 1442 O GLU A 896 -1.794 8.371 3.267 1.00 0.00 O ATOM 1443 CB GLU A 896 0.679 9.194 1.073 1.00 0.00 C ATOM 1444 CG GLU A 896 1.876 8.313 1.390 1.00 0.00 C ATOM 1445 CD GLU A 896 1.506 6.834 1.232 1.00 0.00 C ATOM 1446 OE1 GLU A 896 0.338 6.513 1.370 1.00 0.00 O ATOM 1447 OE2 GLU A 896 2.402 6.047 0.975 1.00 0.00 O ATOM 0 H GLU A 896 1.974 10.360 2.765 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.835 10.325 2.129 1.00 0.00 H new ATOM 0 HB2 GLU A 896 -0.029 8.645 0.452 1.00 0.00 H new ATOM 0 HB3 GLU A 896 1.002 10.061 0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 896 2.704 8.560 0.726 1.00 0.00 H new ATOM 0 HG3 GLU A 896 2.216 8.503 2.408 1.00 0.00 H new ATOM 1454 N LEU A 897 0.220 7.588 3.650 1.00 0.00 N ATOM 1455 CA LEU A 897 -0.402 6.470 4.418 1.00 0.00 C ATOM 1456 C LEU A 897 -0.920 7.025 5.732 1.00 0.00 C ATOM 1457 O LEU A 897 -2.023 6.753 6.159 1.00 0.00 O ATOM 1458 CB LEU A 897 0.679 5.428 4.672 1.00 0.00 C ATOM 1459 CG LEU A 897 0.065 4.250 5.452 1.00 0.00 C ATOM 1460 CD1 LEU A 897 0.260 4.479 6.952 1.00 0.00 C ATOM 1461 CD2 LEU A 897 -1.442 4.141 5.143 1.00 0.00 C ATOM 0 H LEU A 897 1.238 7.587 3.586 1.00 0.00 H new ATOM 0 HA LEU A 897 -1.229 6.016 3.872 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.095 5.078 3.727 1.00 0.00 H new ATOM 0 HB3 LEU A 897 1.500 5.867 5.238 1.00 0.00 H new ATOM 0 HG LEU A 897 0.559 3.326 5.152 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -0.174 3.647 7.507 1.00 0.00 H new ATOM 0 HD12 LEU A 897 1.325 4.547 7.174 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -0.232 5.406 7.246 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -1.868 3.306 5.699 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -1.941 5.064 5.437 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -1.583 3.976 4.075 1.00 0.00 H new ATOM 1473 N LYS A 898 -0.135 7.847 6.341 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.547 8.514 7.604 1.00 0.00 C ATOM 1475 C LYS A 898 -1.920 9.096 7.396 1.00 0.00 C ATOM 1476 O LYS A 898 -2.730 9.201 8.297 1.00 0.00 O ATOM 1477 CB LYS A 898 0.450 9.646 7.773 1.00 0.00 C ATOM 1478 CG LYS A 898 0.088 10.492 8.998 1.00 0.00 C ATOM 1479 CD LYS A 898 0.032 9.603 10.245 1.00 0.00 C ATOM 1480 CE LYS A 898 0.785 10.281 11.393 1.00 0.00 C ATOM 1481 NZ LYS A 898 2.221 9.976 11.143 1.00 0.00 N ATOM 0 H LYS A 898 0.799 8.095 6.015 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.569 7.844 8.463 1.00 0.00 H new ATOM 0 HB2 LYS A 898 1.456 9.241 7.886 1.00 0.00 H new ATOM 0 HB3 LYS A 898 0.457 10.271 6.880 1.00 0.00 H new ATOM 0 HG2 LYS A 898 0.826 11.282 9.136 1.00 0.00 H new ATOM 0 HG3 LYS A 898 -0.875 10.979 8.844 1.00 0.00 H new ATOM 0 HD2 LYS A 898 -1.005 9.426 10.531 1.00 0.00 H new ATOM 0 HD3 LYS A 898 0.475 8.630 10.031 1.00 0.00 H new ATOM 0 HE2 LYS A 898 0.605 11.356 11.403 1.00 0.00 H new ATOM 0 HE3 LYS A 898 0.462 9.895 12.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 2.803 10.408 11.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 2.363 8.946 11.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 2.502 10.361 10.219 1.00 0.00 H new ATOM 1495 N ALA A 899 -2.179 9.442 6.181 1.00 0.00 N ATOM 1496 CA ALA A 899 -3.502 9.989 5.838 1.00 0.00 C ATOM 1497 C ALA A 899 -4.395 8.801 5.528 1.00 0.00 C ATOM 1498 O ALA A 899 -5.574 8.797 5.816 1.00 0.00 O ATOM 1499 CB ALA A 899 -3.261 10.865 4.605 1.00 0.00 C ATOM 0 H ALA A 899 -1.524 9.369 5.402 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.975 10.578 6.623 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -4.203 11.311 4.286 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.551 11.654 4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.857 10.254 3.798 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.820 7.789 4.921 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.587 6.575 4.556 1.00 0.00 C ATOM 1507 C ARG A 900 -5.718 7.037 3.682 1.00 0.00 C ATOM 1508 O ARG A 900 -6.770 6.433 3.588 1.00 0.00 O ATOM 1509 CB ARG A 900 -5.051 5.951 5.891 1.00 0.00 C ATOM 1510 CG ARG A 900 -6.549 6.187 6.134 1.00 0.00 C ATOM 1511 CD ARG A 900 -6.860 6.009 7.622 1.00 0.00 C ATOM 1512 NE ARG A 900 -7.487 4.662 7.725 1.00 0.00 N ATOM 1513 CZ ARG A 900 -8.383 4.428 8.645 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -9.479 5.136 8.684 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -8.183 3.487 9.526 1.00 0.00 N ATOM 0 H ARG A 900 -2.834 7.762 4.663 1.00 0.00 H new ATOM 0 HA ARG A 900 -4.028 5.820 4.004 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -4.847 4.880 5.883 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -4.477 6.379 6.713 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.827 7.190 5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -7.139 5.487 5.542 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -5.954 6.070 8.225 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -7.534 6.787 7.980 1.00 0.00 H new ATOM 0 HE ARG A 900 -7.216 3.922 7.077 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -9.635 5.872 7.996 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -10.179 4.953 9.403 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -7.326 2.934 9.496 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -8.883 3.304 10.245 1.00 0.00 H new ATOM 1529 N LYS A 901 -5.482 8.131 3.030 1.00 0.00 N ATOM 1530 CA LYS A 901 -6.515 8.676 2.151 1.00 0.00 C ATOM 1531 C LYS A 901 -6.105 8.478 0.703 1.00 0.00 C ATOM 1532 O LYS A 901 -6.901 8.609 -0.201 1.00 0.00 O ATOM 1533 CB LYS A 901 -6.602 10.163 2.498 1.00 0.00 C ATOM 1534 CG LYS A 901 -7.833 10.777 1.827 1.00 0.00 C ATOM 1535 CD LYS A 901 -7.404 11.924 0.909 1.00 0.00 C ATOM 1536 CE LYS A 901 -8.467 13.025 0.933 1.00 0.00 C ATOM 1537 NZ LYS A 901 -8.129 13.859 2.119 1.00 0.00 N ATOM 0 H LYS A 901 -4.614 8.666 3.074 1.00 0.00 H new ATOM 0 HA LYS A 901 -7.479 8.185 2.283 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -6.663 10.291 3.579 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -5.700 10.677 2.166 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -8.362 10.017 1.252 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -8.526 11.144 2.584 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -6.444 12.324 1.235 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -7.268 11.558 -0.109 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -8.446 13.615 0.017 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -9.469 12.605 1.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -8.814 14.637 2.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -8.164 13.273 2.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -7.172 14.251 2.006 1.00 0.00 H new ATOM 1551 N ILE A 902 -4.855 8.177 0.490 1.00 0.00 N ATOM 1552 CA ILE A 902 -4.351 7.987 -0.913 1.00 0.00 C ATOM 1553 C ILE A 902 -5.220 6.999 -1.709 1.00 0.00 C ATOM 1554 O ILE A 902 -5.085 5.803 -1.545 1.00 0.00 O ATOM 1555 CB ILE A 902 -2.928 7.420 -0.791 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -2.233 7.914 0.484 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -2.109 7.860 -2.004 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -2.389 9.435 0.626 1.00 0.00 C ATOM 0 H ILE A 902 -4.155 8.053 1.222 1.00 0.00 H new ATOM 0 HA ILE A 902 -4.378 8.938 -1.445 1.00 0.00 H new ATOM 0 HB ILE A 902 -2.998 6.333 -0.745 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -2.660 7.416 1.354 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -1.175 7.652 0.454 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -1.098 7.461 -1.924 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -2.576 7.484 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -2.068 8.949 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -1.890 9.769 1.536 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -1.940 9.929 -0.236 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -3.448 9.689 0.679 1.00 0.00 H new ATOM 1570 N PRO A 903 -6.065 7.517 -2.578 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.917 6.646 -3.424 1.00 0.00 C ATOM 1572 C PRO A 903 -6.053 6.085 -4.551 1.00 0.00 C ATOM 1573 O PRO A 903 -5.711 6.800 -5.473 1.00 0.00 O ATOM 1574 CB PRO A 903 -7.940 7.636 -3.991 1.00 0.00 C ATOM 1575 CG PRO A 903 -7.605 9.043 -3.455 1.00 0.00 C ATOM 1576 CD PRO A 903 -6.236 8.978 -2.765 1.00 0.00 C ATOM 0 HA PRO A 903 -7.376 5.806 -2.902 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -7.911 7.629 -5.081 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -8.949 7.348 -3.697 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -7.586 9.766 -4.270 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -8.370 9.375 -2.753 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -5.446 9.407 -3.381 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -6.229 9.516 -1.817 1.00 0.00 H new ATOM 1583 N ILE A 904 -5.665 4.839 -4.498 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.805 4.330 -5.584 1.00 0.00 C ATOM 1585 C ILE A 904 -4.871 2.812 -5.743 1.00 0.00 C ATOM 1586 O ILE A 904 -5.084 2.062 -4.811 1.00 0.00 O ATOM 1587 CB ILE A 904 -3.394 4.804 -5.210 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -2.948 5.866 -6.205 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -2.410 3.645 -5.265 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -2.005 6.855 -5.517 1.00 0.00 C ATOM 0 H ILE A 904 -5.903 4.171 -3.765 1.00 0.00 H new ATOM 0 HA ILE A 904 -5.130 4.707 -6.554 1.00 0.00 H new ATOM 0 HB ILE A 904 -3.416 5.208 -4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.445 5.397 -7.051 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -3.816 6.393 -6.603 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -1.415 4.000 -4.997 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -2.720 2.871 -4.564 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -2.389 3.233 -6.274 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -1.688 7.614 -6.233 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.523 7.334 -4.686 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -1.131 6.323 -5.141 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.649 2.385 -6.948 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.641 0.943 -7.283 1.00 0.00 C ATOM 1604 C ILE A 905 -3.184 0.463 -7.356 1.00 0.00 C ATOM 1605 O ILE A 905 -2.281 1.242 -7.595 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.311 0.861 -8.659 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.386 -0.600 -9.112 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.511 1.669 -9.686 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.821 -0.930 -9.522 1.00 0.00 C ATOM 0 H ILE A 905 -4.466 2.999 -7.742 1.00 0.00 H new ATOM 0 HA ILE A 905 -5.157 0.323 -6.550 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.317 1.273 -8.584 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.709 -0.768 -9.949 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -5.065 -1.259 -8.306 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.997 1.603 -10.659 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.466 2.712 -9.373 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.500 1.268 -9.757 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.877 -1.970 -9.845 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.486 -0.778 -8.672 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -7.124 -0.279 -10.342 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.945 -0.802 -7.162 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.558 -1.325 -7.224 1.00 0.00 C ATOM 1623 C ILE A 906 -1.588 -2.714 -7.843 1.00 0.00 C ATOM 1624 O ILE A 906 -2.507 -3.476 -7.630 1.00 0.00 O ATOM 1625 CB ILE A 906 -1.087 -1.387 -5.761 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.249 -0.152 -5.453 1.00 0.00 C ATOM 1627 CG2 ILE A 906 -0.227 -2.633 -5.520 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.161 1.022 -5.115 1.00 0.00 C ATOM 0 H ILE A 906 -3.660 -1.501 -6.961 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.892 -0.707 -7.826 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.964 -1.428 -5.116 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.421 -0.355 -4.618 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.376 0.097 -6.310 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.095 -2.657 -4.479 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.811 -3.527 -5.739 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.647 -2.603 -6.170 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -0.556 1.902 -4.896 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -1.813 1.232 -5.963 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -1.767 0.773 -4.244 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.597 -3.066 -8.592 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.619 -4.440 -9.181 1.00 0.00 C ATOM 1642 C ARG A 907 0.123 -5.395 -8.287 1.00 0.00 C ATOM 1643 O ARG A 907 1.284 -5.223 -7.994 1.00 0.00 O ATOM 1644 CB ARG A 907 0.074 -4.375 -10.523 1.00 0.00 C ATOM 1645 CG ARG A 907 -0.921 -3.995 -11.598 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.697 -2.732 -11.192 1.00 0.00 C ATOM 1647 NE ARG A 907 -2.033 -2.059 -12.477 1.00 0.00 N ATOM 1648 CZ ARG A 907 -3.273 -2.009 -12.884 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -3.696 -2.844 -13.792 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -4.087 -1.121 -12.383 1.00 0.00 N ATOM 0 H ARG A 907 0.211 -2.489 -8.824 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.647 -4.788 -9.288 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.883 -3.645 -10.489 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.524 -5.340 -10.757 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.400 -3.822 -12.539 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -1.616 -4.818 -11.766 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.597 -2.984 -10.631 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -1.094 -2.086 -10.554 1.00 0.00 H new ATOM 0 HE ARG A 907 -1.294 -1.637 -13.040 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -3.058 -3.537 -14.185 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -4.665 -2.805 -14.110 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -3.755 -0.467 -11.674 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -5.056 -1.081 -12.700 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.539 -6.419 -7.889 1.00 0.00 N ATOM 1665 CA ARG A 908 0.116 -7.438 -7.047 1.00 0.00 C ATOM 1666 C ARG A 908 0.395 -8.641 -7.950 1.00 0.00 C ATOM 1667 O ARG A 908 -0.457 -9.490 -8.115 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.936 -7.822 -5.991 1.00 0.00 C ATOM 1669 CG ARG A 908 -0.973 -6.838 -4.811 1.00 0.00 C ATOM 1670 CD ARG A 908 -1.911 -7.396 -3.711 1.00 0.00 C ATOM 1671 NE ARG A 908 -1.002 -7.841 -2.619 1.00 0.00 N ATOM 1672 CZ ARG A 908 -1.488 -8.461 -1.579 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.573 -8.019 -1.006 1.00 0.00 N ATOM 1674 NH2 ARG A 908 -0.890 -9.523 -1.113 1.00 0.00 N ATOM 0 H ARG A 908 -1.518 -6.602 -8.110 1.00 0.00 H new ATOM 0 HA ARG A 908 1.042 -7.100 -6.582 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -1.919 -7.859 -6.460 1.00 0.00 H new ATOM 0 HB3 ARG A 908 -0.723 -8.824 -5.618 1.00 0.00 H new ATOM 0 HG2 ARG A 908 0.031 -6.694 -4.411 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -1.326 -5.863 -5.146 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -2.605 -6.633 -3.360 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.511 -8.224 -4.087 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.000 -7.661 -2.684 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -3.041 -7.189 -1.371 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.954 -8.503 -0.193 1.00 0.00 H new ATOM 0 HH21 ARG A 908 -0.042 -9.869 -1.562 1.00 0.00 H new ATOM 0 HH22 ARG A 908 -1.271 -10.007 -0.300 1.00 0.00 H new ATOM 1688 N TYR A 909 1.563 -8.746 -8.536 1.00 0.00 N ATOM 1689 CA TYR A 909 1.821 -9.909 -9.400 1.00 0.00 C ATOM 1690 C TYR A 909 2.711 -10.877 -8.646 1.00 0.00 C ATOM 1691 O TYR A 909 3.207 -10.579 -7.579 1.00 0.00 O ATOM 1692 CB TYR A 909 2.457 -9.475 -10.751 1.00 0.00 C ATOM 1693 CG TYR A 909 2.921 -8.027 -10.833 1.00 0.00 C ATOM 1694 CD1 TYR A 909 2.205 -6.959 -10.269 1.00 0.00 C ATOM 1695 CD2 TYR A 909 4.103 -7.764 -11.532 1.00 0.00 C ATOM 1696 CE1 TYR A 909 2.691 -5.656 -10.400 1.00 0.00 C ATOM 1697 CE2 TYR A 909 4.578 -6.464 -11.658 1.00 0.00 C ATOM 1698 CZ TYR A 909 3.881 -5.411 -11.093 1.00 0.00 C ATOM 1699 OH TYR A 909 4.371 -4.129 -11.218 1.00 0.00 O ATOM 0 H TYR A 909 2.331 -8.080 -8.448 1.00 0.00 H new ATOM 0 HA TYR A 909 0.881 -10.402 -9.647 1.00 0.00 H new ATOM 0 HB2 TYR A 909 3.311 -10.122 -10.953 1.00 0.00 H new ATOM 0 HB3 TYR A 909 1.731 -9.649 -11.545 1.00 0.00 H new ATOM 0 HD1 TYR A 909 1.284 -7.144 -9.737 1.00 0.00 H new ATOM 0 HD2 TYR A 909 4.653 -8.579 -11.979 1.00 0.00 H new ATOM 0 HE1 TYR A 909 2.145 -4.833 -9.964 1.00 0.00 H new ATOM 0 HE2 TYR A 909 5.494 -6.275 -12.198 1.00 0.00 H new ATOM 0 HH TYR A 909 5.207 -4.147 -11.729 1.00 0.00 H new ATOM 1709 N LEU A 910 2.869 -12.046 -9.163 1.00 0.00 N ATOM 1710 CA LEU A 910 3.661 -13.063 -8.457 1.00 0.00 C ATOM 1711 C LEU A 910 4.723 -13.684 -9.357 1.00 0.00 C ATOM 1712 O LEU A 910 4.405 -14.406 -10.280 1.00 0.00 O ATOM 1713 CB LEU A 910 2.613 -14.103 -8.071 1.00 0.00 C ATOM 1714 CG LEU A 910 1.551 -13.483 -7.162 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.634 -14.592 -6.657 1.00 0.00 C ATOM 1716 CD2 LEU A 910 2.203 -12.781 -5.971 1.00 0.00 C ATOM 0 H LEU A 910 2.478 -12.344 -10.057 1.00 0.00 H new ATOM 0 HA LEU A 910 4.209 -12.652 -7.609 1.00 0.00 H new ATOM 0 HB2 LEU A 910 2.142 -14.504 -8.969 1.00 0.00 H new ATOM 0 HB3 LEU A 910 3.092 -14.939 -7.562 1.00 0.00 H new ATOM 0 HG LEU A 910 0.982 -12.745 -7.727 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.129 -14.165 -6.007 1.00 0.00 H new ATOM 0 HD12 LEU A 910 0.156 -15.083 -7.505 1.00 0.00 H new ATOM 0 HD13 LEU A 910 1.220 -15.322 -6.098 1.00 0.00 H new ATOM 0 HD21 LEU A 910 1.430 -12.347 -5.337 1.00 0.00 H new ATOM 0 HD22 LEU A 910 2.781 -13.503 -5.395 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.863 -11.992 -6.331 1.00 0.00 H new ATOM 1728 N PRO A 911 5.968 -13.435 -9.020 1.00 0.00 N ATOM 1729 CA PRO A 911 7.082 -14.040 -9.771 1.00 0.00 C ATOM 1730 C PRO A 911 6.996 -15.558 -9.590 1.00 0.00 C ATOM 1731 O PRO A 911 7.667 -16.323 -10.253 1.00 0.00 O ATOM 1732 CB PRO A 911 8.318 -13.472 -9.066 1.00 0.00 C ATOM 1733 CG PRO A 911 7.852 -12.556 -7.917 1.00 0.00 C ATOM 1734 CD PRO A 911 6.318 -12.547 -7.888 1.00 0.00 C ATOM 0 HA PRO A 911 7.087 -13.833 -10.841 1.00 0.00 H new ATOM 0 HB2 PRO A 911 8.937 -14.281 -8.678 1.00 0.00 H new ATOM 0 HB3 PRO A 911 8.932 -12.912 -9.771 1.00 0.00 H new ATOM 0 HG2 PRO A 911 8.246 -12.913 -6.965 1.00 0.00 H new ATOM 0 HG3 PRO A 911 8.233 -11.545 -8.061 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.928 -12.923 -6.942 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.916 -11.543 -8.021 1.00 0.00 H new ATOM 1741 N ASP A 912 6.146 -15.988 -8.685 1.00 0.00 N ATOM 1742 CA ASP A 912 5.971 -17.439 -8.432 1.00 0.00 C ATOM 1743 C ASP A 912 5.134 -18.048 -9.548 1.00 0.00 C ATOM 1744 O ASP A 912 5.396 -19.145 -10.003 1.00 0.00 O ATOM 1745 CB ASP A 912 5.217 -17.519 -7.106 1.00 0.00 C ATOM 1746 CG ASP A 912 6.213 -17.700 -5.959 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.896 -16.741 -5.636 1.00 0.00 O ATOM 1748 OD2 ASP A 912 6.275 -18.794 -5.421 1.00 0.00 O ATOM 0 H ASP A 912 5.563 -15.381 -8.109 1.00 0.00 H new ATOM 0 HA ASP A 912 6.918 -17.977 -8.396 1.00 0.00 H new ATOM 0 HB2 ASP A 912 4.632 -16.612 -6.953 1.00 0.00 H new ATOM 0 HB3 ASP A 912 4.514 -18.352 -7.125 1.00 0.00 H new ATOM 1753 N GLY A 913 4.131 -17.341 -10.006 1.00 0.00 N ATOM 1754 CA GLY A 913 3.295 -17.907 -11.111 1.00 0.00 C ATOM 1755 C GLY A 913 1.839 -17.512 -10.932 1.00 0.00 C ATOM 1756 O GLY A 913 0.936 -18.321 -11.018 1.00 0.00 O ATOM 0 H GLY A 913 3.858 -16.417 -9.672 1.00 0.00 H new ATOM 0 HA2 GLY A 913 3.660 -17.546 -12.073 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.385 -18.993 -11.123 1.00 0.00 H new ATOM 1760 N SER A 914 1.626 -16.267 -10.705 1.00 0.00 N ATOM 1761 CA SER A 914 0.247 -15.732 -10.527 1.00 0.00 C ATOM 1762 C SER A 914 0.326 -14.222 -10.507 1.00 0.00 C ATOM 1763 O SER A 914 1.372 -13.653 -10.755 1.00 0.00 O ATOM 1764 CB SER A 914 -0.237 -16.262 -9.182 1.00 0.00 C ATOM 1765 OG SER A 914 -0.686 -17.602 -9.334 1.00 0.00 O ATOM 0 H SER A 914 2.364 -15.566 -10.631 1.00 0.00 H new ATOM 0 HA SER A 914 -0.432 -16.032 -11.325 1.00 0.00 H new ATOM 0 HB2 SER A 914 0.570 -16.218 -8.450 1.00 0.00 H new ATOM 0 HB3 SER A 914 -1.046 -15.637 -8.803 1.00 0.00 H new ATOM 0 HG SER A 914 -0.315 -17.980 -10.158 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.750 -13.558 -10.200 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.710 -12.082 -10.151 1.00 0.00 C ATOM 1773 C TYR A 915 -2.143 -11.515 -10.087 1.00 0.00 C ATOM 1774 O TYR A 915 -3.098 -12.172 -10.446 1.00 0.00 O ATOM 1775 CB TYR A 915 -0.013 -11.649 -11.463 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.742 -10.485 -12.115 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.603 -9.185 -11.610 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -1.551 -10.714 -13.235 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.272 -8.119 -12.222 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -2.218 -9.647 -13.848 1.00 0.00 C ATOM 1781 CZ TYR A 915 -2.078 -8.349 -13.341 1.00 0.00 C ATOM 1782 OH TYR A 915 -2.736 -7.298 -13.945 1.00 0.00 O ATOM 0 H TYR A 915 -1.654 -13.978 -9.982 1.00 0.00 H new ATOM 0 HA TYR A 915 -0.181 -11.714 -9.272 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.018 -11.364 -11.253 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.023 -12.491 -12.154 1.00 0.00 H new ATOM 0 HD1 TYR A 915 0.021 -9.006 -10.747 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -1.660 -11.715 -13.626 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.166 -7.118 -11.830 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -2.841 -9.825 -14.712 1.00 0.00 H new ATOM 0 HH TYR A 915 -3.252 -7.631 -14.709 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.280 -10.290 -9.663 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.623 -9.639 -9.600 1.00 0.00 C ATOM 1794 C GLU A 916 -3.467 -8.112 -9.605 1.00 0.00 C ATOM 1795 O GLU A 916 -2.522 -7.575 -9.060 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.252 -10.122 -8.295 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.667 -10.635 -8.568 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.664 -9.481 -8.438 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.454 -8.467 -9.082 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.622 -9.632 -7.699 1.00 0.00 O ATOM 0 H GLU A 916 -1.507 -9.701 -9.352 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.246 -9.896 -10.457 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.645 -10.915 -7.858 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.283 -9.308 -7.571 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.722 -11.066 -9.568 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.919 -11.428 -7.864 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.399 -7.413 -10.193 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.333 -5.925 -10.214 1.00 0.00 C ATOM 1809 C ASP A 917 -5.458 -5.381 -9.361 1.00 0.00 C ATOM 1810 O ASP A 917 -6.491 -5.997 -9.213 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.512 -5.516 -11.664 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.908 -5.900 -12.169 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.541 -6.731 -11.537 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -6.319 -5.356 -13.180 1.00 0.00 O ATOM 0 H ASP A 917 -5.210 -7.813 -10.664 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.392 -5.541 -9.821 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.367 -4.440 -11.764 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.752 -5.998 -12.279 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.228 -4.232 -8.813 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.190 -3.522 -7.903 1.00 0.00 C ATOM 1821 C TRP A 918 -5.436 -3.054 -6.673 1.00 0.00 C ATOM 1822 O TRP A 918 -4.276 -3.356 -6.504 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.341 -4.451 -7.496 1.00 0.00 C ATOM 1824 CG TRP A 918 -6.898 -5.747 -6.868 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.650 -6.275 -6.812 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.752 -6.670 -6.178 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.725 -7.530 -6.225 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.007 -7.794 -5.774 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.107 -6.620 -5.886 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.615 -8.852 -5.092 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.725 -7.648 -5.192 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -8.985 -8.775 -4.790 1.00 0.00 C ATOM 0 H TRP A 918 -4.361 -3.716 -8.962 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.620 -2.667 -8.426 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -7.988 -3.923 -6.795 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -7.941 -4.674 -8.378 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.748 -5.798 -7.166 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -4.939 -8.174 -6.137 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.689 -5.768 -6.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.039 -9.718 -4.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -10.778 -7.584 -4.959 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.468 -9.577 -4.252 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.060 -2.310 -5.812 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.308 -1.832 -4.622 1.00 0.00 C ATOM 1845 C GLY A 919 -6.234 -1.202 -3.616 1.00 0.00 C ATOM 1846 O GLY A 919 -6.543 -1.769 -2.593 1.00 0.00 O ATOM 0 H GLY A 919 -7.035 -2.016 -5.874 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -4.779 -2.667 -4.162 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.554 -1.108 -4.931 1.00 0.00 H new ATOM 1850 N VAL A 920 -6.678 -0.031 -3.895 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.598 0.634 -2.951 1.00 0.00 C ATOM 1852 C VAL A 920 -8.893 0.918 -3.678 1.00 0.00 C ATOM 1853 O VAL A 920 -9.861 1.370 -3.097 1.00 0.00 O ATOM 1854 CB VAL A 920 -6.906 1.927 -2.536 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -7.806 2.709 -1.575 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -5.591 1.586 -1.839 1.00 0.00 C ATOM 0 H VAL A 920 -6.448 0.501 -4.734 1.00 0.00 H new ATOM 0 HA VAL A 920 -7.826 0.028 -2.074 1.00 0.00 H new ATOM 0 HB VAL A 920 -6.710 2.537 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.308 3.633 -1.280 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -8.748 2.946 -2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.004 2.105 -0.689 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.089 2.506 -1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -5.794 0.979 -0.957 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -4.950 1.030 -2.523 1.00 0.00 H new ATOM 1866 N ASP A 921 -8.926 0.636 -4.952 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.181 0.877 -5.700 1.00 0.00 C ATOM 1868 C ASP A 921 -11.080 -0.340 -5.568 1.00 0.00 C ATOM 1869 O ASP A 921 -12.274 -0.281 -5.784 1.00 0.00 O ATOM 1870 CB ASP A 921 -9.765 1.119 -7.153 1.00 0.00 C ATOM 1871 CG ASP A 921 -10.953 1.681 -7.935 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -12.016 1.087 -7.867 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -10.780 2.695 -8.590 1.00 0.00 O ATOM 0 H ASP A 921 -8.151 0.256 -5.495 1.00 0.00 H new ATOM 0 HA ASP A 921 -10.741 1.732 -5.321 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -8.928 1.816 -7.192 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.426 0.187 -7.606 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.502 -1.442 -5.209 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.284 -2.681 -5.049 1.00 0.00 C ATOM 1880 C GLU A 922 -11.027 -3.285 -3.662 1.00 0.00 C ATOM 1881 O GLU A 922 -11.713 -4.190 -3.230 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.731 -3.567 -6.151 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.730 -4.684 -6.466 1.00 0.00 C ATOM 1884 CD GLU A 922 -11.516 -5.170 -7.900 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -10.370 -5.310 -8.293 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -12.503 -5.396 -8.583 1.00 0.00 O ATOM 0 H GLU A 922 -9.505 -1.535 -5.017 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.363 -2.542 -5.120 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.540 -2.974 -7.046 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.777 -3.995 -5.842 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.600 -5.510 -5.767 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.750 -4.320 -6.343 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.020 -2.803 -2.977 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.686 -3.361 -1.629 1.00 0.00 C ATOM 1895 C LEU A 923 -9.008 -2.331 -0.704 1.00 0.00 C ATOM 1896 O LEU A 923 -9.236 -1.139 -0.771 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.745 -4.542 -1.906 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.717 -4.136 -2.953 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.294 -4.407 -2.491 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.969 -4.963 -4.152 1.00 0.00 C ATOM 0 H LEU A 923 -9.414 -2.046 -3.293 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.593 -3.658 -1.103 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.244 -4.845 -0.987 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.316 -5.402 -2.256 1.00 0.00 H new ATOM 0 HG LEU A 923 -7.813 -3.067 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.594 -4.102 -3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.093 -3.842 -1.581 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.173 -5.472 -2.291 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.252 -4.703 -4.930 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.861 -6.017 -3.896 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.980 -4.779 -4.515 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.216 -2.844 0.192 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.500 -2.041 1.232 1.00 0.00 C ATOM 1914 C ILE A 924 -6.287 -1.297 0.711 1.00 0.00 C ATOM 1915 O ILE A 924 -5.813 -1.499 -0.377 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.083 -3.074 2.298 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.178 -3.114 3.341 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -5.732 -2.755 2.956 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.310 -3.952 2.772 1.00 0.00 C ATOM 0 H ILE A 924 -8.024 -3.844 0.251 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.151 -1.255 1.614 1.00 0.00 H new ATOM 0 HB ILE A 924 -6.952 -4.042 1.813 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -7.808 -3.547 4.270 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -8.524 -2.107 3.574 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.498 -3.520 3.696 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -4.952 -2.736 2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -5.786 -1.782 3.445 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.123 -4.006 3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -9.674 -3.495 1.852 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -8.947 -4.957 2.559 1.00 0.00 H new ATOM 1931 N ILE A 925 -5.790 -0.451 1.550 1.00 0.00 N ATOM 1932 CA ILE A 925 -4.563 0.330 1.257 1.00 0.00 C ATOM 1933 C ILE A 925 -3.404 -0.401 1.938 1.00 0.00 C ATOM 1934 O ILE A 925 -3.193 -1.579 1.732 1.00 0.00 O ATOM 1935 CB ILE A 925 -4.823 1.716 1.875 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.158 1.570 3.367 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -5.998 2.384 1.155 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -4.438 2.660 4.164 1.00 0.00 C ATOM 0 H ILE A 925 -6.197 -0.258 2.465 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.321 0.435 0.199 1.00 0.00 H new ATOM 0 HB ILE A 925 -3.928 2.329 1.766 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.235 1.647 3.517 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -4.856 0.585 3.723 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.182 3.365 1.592 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -5.760 2.497 0.097 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -6.889 1.766 1.262 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -4.677 2.555 5.222 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -3.361 2.562 4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -4.762 3.640 3.815 1.00 0.00 H new ATOM 1950 N THR A 926 -2.676 0.265 2.756 1.00 0.00 N ATOM 1951 CA THR A 926 -1.548 -0.407 3.472 1.00 0.00 C ATOM 1952 C THR A 926 -2.119 -1.471 4.409 1.00 0.00 C ATOM 1953 O THR A 926 -1.600 -2.564 4.527 1.00 0.00 O ATOM 1954 CB THR A 926 -0.860 0.718 4.269 1.00 0.00 C ATOM 1955 OG1 THR A 926 0.542 0.647 4.066 1.00 0.00 O ATOM 1956 CG2 THR A 926 -1.149 0.603 5.774 1.00 0.00 C ATOM 0 H THR A 926 -2.800 1.254 2.973 1.00 0.00 H new ATOM 0 HA THR A 926 -0.847 -0.904 2.802 1.00 0.00 H new ATOM 0 HB THR A 926 -1.254 1.670 3.914 1.00 0.00 H new ATOM 0 HG1 THR A 926 1.002 1.126 4.787 1.00 0.00 H new ATOM 0 HG21 THR A 926 -0.648 1.413 6.304 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.224 0.669 5.944 1.00 0.00 H new ATOM 0 HG23 THR A 926 -0.781 -0.354 6.143 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.188 -1.145 5.065 1.00 0.00 N ATOM 1965 CA ASP A 927 -3.832 -2.114 6.006 1.00 0.00 C ATOM 1966 C ASP A 927 -5.146 -1.536 6.537 1.00 0.00 C ATOM 1967 O ASP A 927 -5.087 -0.598 7.315 1.00 0.00 O ATOM 1968 CB ASP A 927 -2.822 -2.288 7.145 1.00 0.00 C ATOM 1969 CG ASP A 927 -3.346 -3.319 8.146 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -4.090 -2.931 9.032 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -2.995 -4.478 8.010 1.00 0.00 O ATOM 1972 OXT ASP A 927 -6.190 -2.042 6.157 1.00 0.00 O ATOM 0 H ASP A 927 -3.655 -0.241 4.995 1.00 0.00 H new ATOM 0 HA ASP A 927 -4.072 -3.063 5.526 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -1.861 -2.611 6.745 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -2.655 -1.334 7.645 1.00 0.00 H new