USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=16 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= -0.243 X(o=-0.24,f=0) USER MOD Single : A 835 ASN : amide:sc= -4.6! C(o=-4.6!,f=-10!) USER MOD Single : A 841 SER OG : rot 80:sc= 1.14 USER MOD Single : A 853 THR OG1 : rot 125:sc= -1.99! USER MOD Single : A 854 THR OG1 : rot 180:sc= 0 USER MOD Single : A 856 TYR OH : rot 166:sc= -2.03 USER MOD Single : A 857 MET CE :methyl -176:sc= -12.1! (180deg=-12.5!) USER MOD Single : A 858 THR OG1 : rot -69:sc= -0.645 USER MOD Single : A 859 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 860 TYR OH : rot 180:sc= 0 USER MOD Single : A 868 THR OG1 : rot -29:sc= -2.59! USER MOD Single : A 872 GLN : amide:sc= -5.14 K(o=-5.1,f=-7.1!) USER MOD Single : A 875 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 876 CYS SG : rot 180:sc= 0 USER MOD Single : A 880 MET CE :methyl -147:sc= -0.182 (180deg=-0.604) USER MOD Single : A 887 THR OG1 : rot -5:sc= 0.814 USER MOD Single : A 894 MET CE :methyl -112:sc= -4.5! (180deg=-8.21!) 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 92:sc= -4.09! USER MOD Single : A 914 SER OG : rot 48:sc= 0.992 USER MOD Single : A 915 TYR OH : rot 180:sc= -1.1 USER MOD Single : A 926 THR OG1 : rot -24:sc= -3.33! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 7.000 -11.092 -1.145 1.00 0.00 N ATOM 439 CA GLN A 833 6.631 -12.281 -1.969 1.00 0.00 C ATOM 440 C GLN A 833 5.474 -11.939 -2.899 1.00 0.00 C ATOM 441 O GLN A 833 4.553 -12.710 -3.086 1.00 0.00 O ATOM 442 CB GLN A 833 6.213 -13.349 -0.960 1.00 0.00 C ATOM 443 CG GLN A 833 5.022 -12.830 -0.154 1.00 0.00 C ATOM 444 CD GLN A 833 4.570 -13.897 0.844 1.00 0.00 C ATOM 445 OE1 GLN A 833 3.393 -14.176 0.961 1.00 0.00 O ATOM 446 NE2 GLN A 833 5.461 -14.512 1.572 1.00 0.00 N ATOM 0 HA GLN A 833 7.454 -12.618 -2.599 1.00 0.00 H new ATOM 0 HB2 GLN A 833 5.946 -14.271 -1.476 1.00 0.00 H new ATOM 0 HB3 GLN A 833 7.044 -13.585 -0.295 1.00 0.00 H new ATOM 0 HG2 GLN A 833 5.298 -11.918 0.375 1.00 0.00 H new ATOM 0 HG3 GLN A 833 4.201 -12.574 -0.824 1.00 0.00 H new ATOM 0 HE21 GLN A 833 6.449 -14.278 1.474 1.00 0.00 H new ATOM 0 HE22 GLN A 833 5.170 -15.227 2.239 1.00 0.00 H new ATOM 455 N GLU A 834 5.527 -10.784 -3.478 1.00 0.00 N ATOM 456 CA GLU A 834 4.456 -10.347 -4.403 1.00 0.00 C ATOM 457 C GLU A 834 4.934 -9.096 -5.128 1.00 0.00 C ATOM 458 O GLU A 834 5.132 -8.061 -4.520 1.00 0.00 O ATOM 459 CB GLU A 834 3.257 -10.035 -3.506 1.00 0.00 C ATOM 460 CG GLU A 834 1.991 -9.909 -4.358 1.00 0.00 C ATOM 461 CD GLU A 834 0.890 -10.799 -3.776 1.00 0.00 C ATOM 462 OE1 GLU A 834 1.184 -11.939 -3.457 1.00 0.00 O ATOM 463 OE2 GLU A 834 -0.229 -10.326 -3.662 1.00 0.00 O ATOM 0 H GLU A 834 6.281 -10.109 -3.348 1.00 0.00 H new ATOM 0 HA GLU A 834 4.197 -11.093 -5.154 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.131 -10.824 -2.765 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.432 -9.109 -2.959 1.00 0.00 H new ATOM 0 HG2 GLU A 834 1.659 -8.871 -4.382 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.202 -10.200 -5.387 1.00 0.00 H new ATOM 470 N ASN A 835 5.111 -9.165 -6.416 1.00 0.00 N ATOM 471 CA ASN A 835 5.563 -7.953 -7.145 1.00 0.00 C ATOM 472 C ASN A 835 4.423 -6.977 -7.118 1.00 0.00 C ATOM 473 O ASN A 835 3.329 -7.294 -7.492 1.00 0.00 O ATOM 474 CB ASN A 835 5.866 -8.327 -8.605 1.00 0.00 C ATOM 475 CG ASN A 835 6.542 -9.696 -8.699 1.00 0.00 C ATOM 476 OD1 ASN A 835 5.975 -10.631 -9.226 1.00 0.00 O ATOM 477 ND2 ASN A 835 7.745 -9.850 -8.218 1.00 0.00 N ATOM 0 H ASN A 835 4.964 -9.997 -6.988 1.00 0.00 H new ATOM 0 HA ASN A 835 6.459 -7.530 -6.690 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.940 -8.336 -9.180 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.511 -7.569 -9.051 1.00 0.00 H new ATOM 0 HD21 ASN A 835 8.209 -10.756 -8.285 1.00 0.00 H new ATOM 0 HD22 ASN A 835 8.222 -9.064 -7.775 1.00 0.00 H new ATOM 484 N VAL A 836 4.648 -5.813 -6.668 1.00 0.00 N ATOM 485 CA VAL A 836 3.525 -4.841 -6.634 1.00 0.00 C ATOM 486 C VAL A 836 3.895 -3.559 -7.358 1.00 0.00 C ATOM 487 O VAL A 836 4.939 -2.974 -7.139 1.00 0.00 O ATOM 488 CB VAL A 836 3.194 -4.578 -5.153 1.00 0.00 C ATOM 489 CG1 VAL A 836 3.879 -5.612 -4.277 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.659 -3.182 -4.735 1.00 0.00 C ATOM 0 H VAL A 836 5.544 -5.473 -6.320 1.00 0.00 H new ATOM 0 HA VAL A 836 2.652 -5.243 -7.148 1.00 0.00 H new ATOM 0 HB VAL A 836 2.113 -4.646 -5.029 1.00 0.00 H new ATOM 0 HG11 VAL A 836 3.640 -5.419 -3.231 1.00 0.00 H new ATOM 0 HG12 VAL A 836 3.532 -6.608 -4.551 1.00 0.00 H new ATOM 0 HG13 VAL A 836 4.958 -5.552 -4.419 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.416 -3.016 -3.685 1.00 0.00 H new ATOM 0 HG22 VAL A 836 4.737 -3.101 -4.875 1.00 0.00 H new ATOM 0 HG23 VAL A 836 3.156 -2.433 -5.347 1.00 0.00 H new ATOM 500 N GLU A 837 3.022 -3.107 -8.192 1.00 0.00 N ATOM 501 CA GLU A 837 3.278 -1.834 -8.909 1.00 0.00 C ATOM 502 C GLU A 837 2.313 -0.809 -8.357 1.00 0.00 C ATOM 503 O GLU A 837 1.559 -1.096 -7.447 1.00 0.00 O ATOM 504 CB GLU A 837 3.005 -2.107 -10.383 1.00 0.00 C ATOM 505 CG GLU A 837 4.310 -2.015 -11.176 1.00 0.00 C ATOM 506 CD GLU A 837 4.029 -1.424 -12.559 1.00 0.00 C ATOM 507 OE1 GLU A 837 3.487 -0.333 -12.615 1.00 0.00 O ATOM 508 OE2 GLU A 837 4.360 -2.073 -13.537 1.00 0.00 O ATOM 0 H GLU A 837 2.136 -3.562 -8.414 1.00 0.00 H new ATOM 0 HA GLU A 837 4.296 -1.464 -8.787 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.564 -3.097 -10.504 1.00 0.00 H new ATOM 0 HB3 GLU A 837 2.283 -1.387 -10.768 1.00 0.00 H new ATOM 0 HG2 GLU A 837 5.028 -1.393 -10.643 1.00 0.00 H new ATOM 0 HG3 GLU A 837 4.757 -3.004 -11.276 1.00 0.00 H new ATOM 515 N ILE A 838 2.315 0.375 -8.873 1.00 0.00 N ATOM 516 CA ILE A 838 1.380 1.375 -8.333 1.00 0.00 C ATOM 517 C ILE A 838 0.796 2.220 -9.456 1.00 0.00 C ATOM 518 O ILE A 838 1.393 2.418 -10.497 1.00 0.00 O ATOM 519 CB ILE A 838 2.219 2.232 -7.372 1.00 0.00 C ATOM 520 CG1 ILE A 838 1.824 1.932 -5.926 1.00 0.00 C ATOM 521 CG2 ILE A 838 1.998 3.725 -7.645 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.653 0.758 -5.383 1.00 0.00 C ATOM 0 H ILE A 838 2.915 0.690 -9.635 1.00 0.00 H new ATOM 0 HA ILE A 838 0.533 0.915 -7.824 1.00 0.00 H new ATOM 0 HB ILE A 838 3.270 1.989 -7.530 1.00 0.00 H new ATOM 0 HG12 ILE A 838 1.982 2.815 -5.307 1.00 0.00 H new ATOM 0 HG13 ILE A 838 0.762 1.692 -5.874 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.601 4.314 -6.954 1.00 0.00 H new ATOM 0 HG22 ILE A 838 2.291 3.955 -8.669 1.00 0.00 H new ATOM 0 HG23 ILE A 838 0.945 3.968 -7.506 1.00 0.00 H new ATOM 0 HD11 ILE A 838 2.363 0.554 -4.352 1.00 0.00 H new ATOM 0 HD12 ILE A 838 2.473 -0.127 -5.993 1.00 0.00 H new ATOM 0 HD13 ILE A 838 3.712 1.014 -5.418 1.00 0.00 H new ATOM 534 N LEU A 839 -0.364 2.723 -9.219 1.00 0.00 N ATOM 535 CA LEU A 839 -1.045 3.585 -10.227 1.00 0.00 C ATOM 536 C LEU A 839 -2.214 4.319 -9.560 1.00 0.00 C ATOM 537 O LEU A 839 -2.737 3.851 -8.570 1.00 0.00 O ATOM 538 CB LEU A 839 -1.553 2.621 -11.303 1.00 0.00 C ATOM 539 CG LEU A 839 -0.915 2.968 -12.654 1.00 0.00 C ATOM 540 CD1 LEU A 839 0.094 1.883 -13.042 1.00 0.00 C ATOM 541 CD2 LEU A 839 -2.005 3.053 -13.726 1.00 0.00 C ATOM 0 H LEU A 839 -0.889 2.578 -8.357 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.384 4.341 -10.651 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.310 1.594 -11.029 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -2.639 2.683 -11.377 1.00 0.00 H new ATOM 0 HG LEU A 839 -0.403 3.927 -12.575 1.00 0.00 H new ATOM 0 HD11 LEU A 839 0.545 2.133 -14.002 1.00 0.00 H new ATOM 0 HD12 LEU A 839 0.872 1.820 -12.281 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.416 0.923 -13.119 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -1.552 3.300 -14.686 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.517 2.093 -13.802 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -2.723 3.827 -13.454 1.00 0.00 H new ATOM 553 N PRO A 840 -2.607 5.439 -10.119 1.00 0.00 N ATOM 554 CA PRO A 840 -3.737 6.204 -9.545 1.00 0.00 C ATOM 555 C PRO A 840 -4.970 5.307 -9.474 1.00 0.00 C ATOM 556 O PRO A 840 -5.238 4.567 -10.398 1.00 0.00 O ATOM 557 CB PRO A 840 -3.928 7.336 -10.552 1.00 0.00 C ATOM 558 CG PRO A 840 -2.882 7.182 -11.674 1.00 0.00 C ATOM 559 CD PRO A 840 -1.969 5.993 -11.336 1.00 0.00 C ATOM 0 HA PRO A 840 -3.566 6.571 -8.533 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -4.935 7.306 -10.968 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -3.815 8.302 -10.060 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -3.376 7.019 -12.632 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -2.294 8.095 -11.770 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -1.935 5.264 -12.145 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -0.943 6.309 -11.149 1.00 0.00 H new ATOM 566 N SER A 841 -5.700 5.339 -8.378 1.00 0.00 N ATOM 567 CA SER A 841 -6.900 4.470 -8.228 1.00 0.00 C ATOM 568 C SER A 841 -7.450 4.077 -9.595 1.00 0.00 C ATOM 569 O SER A 841 -7.474 4.859 -10.526 1.00 0.00 O ATOM 570 CB SER A 841 -7.908 5.322 -7.451 1.00 0.00 C ATOM 571 OG SER A 841 -8.923 5.792 -8.329 1.00 0.00 O ATOM 0 H SER A 841 -5.506 5.940 -7.577 1.00 0.00 H new ATOM 0 HA SER A 841 -6.675 3.538 -7.710 1.00 0.00 H new ATOM 0 HB2 SER A 841 -8.353 4.733 -6.649 1.00 0.00 H new ATOM 0 HB3 SER A 841 -7.400 6.166 -6.983 1.00 0.00 H new ATOM 0 HG SER A 841 -9.579 5.080 -8.481 1.00 0.00 H new ATOM 577 N GLY A 842 -7.863 2.864 -9.715 1.00 0.00 N ATOM 578 CA GLY A 842 -8.381 2.381 -11.028 1.00 0.00 C ATOM 579 C GLY A 842 -9.818 1.872 -10.918 1.00 0.00 C ATOM 580 O GLY A 842 -10.757 2.574 -11.239 1.00 0.00 O ATOM 0 H GLY A 842 -7.869 2.173 -8.964 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -8.337 3.191 -11.756 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -7.740 1.582 -11.400 1.00 0.00 H new ATOM 740 N ILE A 852 -4.540 -14.168 -6.760 1.00 0.00 N ATOM 741 CA ILE A 852 -4.227 -14.541 -5.340 1.00 0.00 C ATOM 742 C ILE A 852 -4.326 -13.325 -4.419 1.00 0.00 C ATOM 743 O ILE A 852 -4.466 -13.458 -3.218 1.00 0.00 O ATOM 744 CB ILE A 852 -2.785 -15.115 -5.332 1.00 0.00 C ATOM 745 CG1 ILE A 852 -1.765 -14.035 -4.921 1.00 0.00 C ATOM 746 CG2 ILE A 852 -2.406 -15.665 -6.712 1.00 0.00 C ATOM 747 CD1 ILE A 852 -1.784 -12.872 -5.921 1.00 0.00 C ATOM 0 HA ILE A 852 -4.942 -15.276 -4.971 1.00 0.00 H new ATOM 0 HB ILE A 852 -2.762 -15.926 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -1.998 -13.667 -3.922 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -0.766 -14.468 -4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -1.391 -16.061 -6.680 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -3.098 -16.461 -6.989 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.460 -14.865 -7.450 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.058 -12.118 -5.616 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -1.528 -13.242 -6.914 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -2.779 -12.429 -5.945 1.00 0.00 H new ATOM 759 N THR A 853 -4.240 -12.144 -4.963 1.00 0.00 N ATOM 760 CA THR A 853 -4.311 -10.934 -4.141 1.00 0.00 C ATOM 761 C THR A 853 -5.547 -10.973 -3.282 1.00 0.00 C ATOM 762 O THR A 853 -6.665 -10.901 -3.748 1.00 0.00 O ATOM 763 CB THR A 853 -4.370 -9.810 -5.147 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.437 -10.046 -6.053 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.066 -9.780 -5.920 1.00 0.00 C ATOM 0 H THR A 853 -4.121 -11.977 -5.962 1.00 0.00 H new ATOM 0 HA THR A 853 -3.468 -10.822 -3.459 1.00 0.00 H new ATOM 0 HB THR A 853 -4.527 -8.861 -4.634 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.036 -9.271 -6.062 1.00 0.00 H new ATOM 0 HG21 THR A 853 -3.095 -8.972 -6.651 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.238 -9.616 -5.230 1.00 0.00 H new ATOM 0 HG23 THR A 853 -2.926 -10.730 -6.435 1.00 0.00 H new ATOM 773 N THR A 854 -5.339 -11.093 -2.028 1.00 0.00 N ATOM 774 CA THR A 854 -6.478 -11.142 -1.093 1.00 0.00 C ATOM 775 C THR A 854 -7.274 -9.847 -1.236 1.00 0.00 C ATOM 776 O THR A 854 -6.689 -8.792 -1.360 1.00 0.00 O ATOM 777 CB THR A 854 -5.846 -11.250 0.301 1.00 0.00 C ATOM 778 OG1 THR A 854 -5.446 -12.593 0.533 1.00 0.00 O ATOM 779 CG2 THR A 854 -6.859 -10.826 1.370 1.00 0.00 C ATOM 0 H THR A 854 -4.418 -11.161 -1.595 1.00 0.00 H new ATOM 0 HA THR A 854 -7.158 -11.974 -1.278 1.00 0.00 H new ATOM 0 HB THR A 854 -4.978 -10.593 0.353 1.00 0.00 H new ATOM 0 HG1 THR A 854 -5.040 -12.665 1.422 1.00 0.00 H new ATOM 0 HG21 THR A 854 -6.402 -10.906 2.356 1.00 0.00 H new ATOM 0 HG22 THR A 854 -7.164 -9.794 1.194 1.00 0.00 H new ATOM 0 HG23 THR A 854 -7.733 -11.476 1.321 1.00 0.00 H new ATOM 787 N PRO A 855 -8.576 -9.957 -1.195 1.00 0.00 N ATOM 788 CA PRO A 855 -9.439 -8.759 -1.289 1.00 0.00 C ATOM 789 C PRO A 855 -9.077 -7.840 -0.125 1.00 0.00 C ATOM 790 O PRO A 855 -9.842 -7.646 0.796 1.00 0.00 O ATOM 791 CB PRO A 855 -10.846 -9.349 -1.138 1.00 0.00 C ATOM 792 CG PRO A 855 -10.723 -10.879 -0.967 1.00 0.00 C ATOM 793 CD PRO A 855 -9.240 -11.266 -1.055 1.00 0.00 C ATOM 0 HA PRO A 855 -9.343 -8.173 -2.203 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.349 -8.911 -0.276 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.451 -9.114 -2.014 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.138 -11.187 -0.007 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.294 -11.393 -1.740 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -8.906 -11.797 -0.164 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -9.040 -11.916 -1.907 1.00 0.00 H new ATOM 800 N TYR A 856 -7.879 -7.315 -0.157 1.00 0.00 N ATOM 801 CA TYR A 856 -7.379 -6.449 0.936 1.00 0.00 C ATOM 802 C TYR A 856 -5.913 -6.193 0.645 1.00 0.00 C ATOM 803 O TYR A 856 -5.078 -7.064 0.800 1.00 0.00 O ATOM 804 CB TYR A 856 -7.539 -7.272 2.216 1.00 0.00 C ATOM 805 CG TYR A 856 -6.912 -6.585 3.414 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.519 -6.503 3.542 1.00 0.00 C ATOM 807 CD2 TYR A 856 -7.731 -6.055 4.418 1.00 0.00 C ATOM 808 CE1 TYR A 856 -4.950 -5.890 4.661 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.162 -5.448 5.542 1.00 0.00 C ATOM 810 CZ TYR A 856 -5.771 -5.362 5.663 1.00 0.00 C ATOM 811 OH TYR A 856 -5.210 -4.764 6.772 1.00 0.00 O ATOM 0 H TYR A 856 -7.215 -7.458 -0.918 1.00 0.00 H new ATOM 0 HA TYR A 856 -7.903 -5.497 1.029 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.598 -7.441 2.408 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -7.080 -8.251 2.078 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -4.883 -6.915 2.773 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -8.805 -6.115 4.324 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -3.876 -5.824 4.752 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -7.797 -5.045 6.317 1.00 0.00 H new ATOM 0 HH TYR A 856 -5.899 -4.263 7.257 1.00 0.00 H new ATOM 821 N MET A 857 -5.594 -5.035 0.180 1.00 0.00 N ATOM 822 CA MET A 857 -4.182 -4.749 -0.164 1.00 0.00 C ATOM 823 C MET A 857 -3.285 -5.002 1.045 1.00 0.00 C ATOM 824 O MET A 857 -3.759 -5.114 2.156 1.00 0.00 O ATOM 825 CB MET A 857 -4.148 -3.276 -0.545 1.00 0.00 C ATOM 826 CG MET A 857 -2.852 -2.972 -1.297 1.00 0.00 C ATOM 827 SD MET A 857 -2.366 -1.261 -0.990 1.00 0.00 S ATOM 828 CE MET A 857 -3.546 -0.510 -2.130 1.00 0.00 C ATOM 0 H MET A 857 -6.247 -4.268 0.021 1.00 0.00 H new ATOM 0 HA MET A 857 -3.823 -5.386 -0.973 1.00 0.00 H new ATOM 0 HB2 MET A 857 -5.008 -3.031 -1.168 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.215 -2.657 0.349 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.063 -3.650 -0.972 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.992 -3.135 -2.366 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.383 0.567 -2.165 1.00 0.00 H new ATOM 0 HE2 MET A 857 -3.408 -0.930 -3.126 1.00 0.00 H new ATOM 0 HE3 MET A 857 -4.561 -0.712 -1.788 1.00 0.00 H new ATOM 838 N THR A 858 -1.997 -5.100 0.851 1.00 0.00 N ATOM 839 CA THR A 858 -1.115 -5.359 2.020 1.00 0.00 C ATOM 840 C THR A 858 0.006 -4.337 2.110 1.00 0.00 C ATOM 841 O THR A 858 0.555 -3.904 1.119 1.00 0.00 O ATOM 842 CB THR A 858 -0.588 -6.769 1.798 1.00 0.00 C ATOM 843 OG1 THR A 858 0.054 -6.846 0.533 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.778 -7.726 1.838 1.00 0.00 C ATOM 0 H THR A 858 -1.526 -5.014 -0.050 1.00 0.00 H new ATOM 0 HA THR A 858 -1.648 -5.272 2.967 1.00 0.00 H new ATOM 0 HB THR A 858 0.135 -7.033 2.569 1.00 0.00 H new ATOM 0 HG1 THR A 858 -0.614 -6.760 -0.179 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.429 -8.747 1.681 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.269 -7.655 2.808 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.486 -7.460 1.053 1.00 0.00 H new ATOM 852 N LYS A 859 0.305 -3.935 3.320 1.00 0.00 N ATOM 853 CA LYS A 859 1.364 -2.910 3.581 1.00 0.00 C ATOM 854 C LYS A 859 2.446 -2.820 2.481 1.00 0.00 C ATOM 855 O LYS A 859 2.951 -1.749 2.236 1.00 0.00 O ATOM 856 CB LYS A 859 1.994 -3.334 4.909 1.00 0.00 C ATOM 857 CG LYS A 859 2.636 -4.715 4.756 1.00 0.00 C ATOM 858 CD LYS A 859 2.886 -5.319 6.139 1.00 0.00 C ATOM 859 CE LYS A 859 4.041 -4.580 6.819 1.00 0.00 C ATOM 860 NZ LYS A 859 3.609 -4.412 8.235 1.00 0.00 N ATOM 0 H LYS A 859 -0.154 -4.284 4.161 1.00 0.00 H new ATOM 0 HA LYS A 859 0.919 -1.915 3.601 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.744 -2.605 5.216 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.235 -3.359 5.691 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.985 -5.368 4.175 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.575 -4.632 4.209 1.00 0.00 H new ATOM 0 HD2 LYS A 859 1.985 -5.245 6.748 1.00 0.00 H new ATOM 0 HD3 LYS A 859 3.123 -6.379 6.047 1.00 0.00 H new ATOM 0 HE2 LYS A 859 4.968 -5.150 6.754 1.00 0.00 H new ATOM 0 HE3 LYS A 859 4.226 -3.616 6.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 4.350 -3.912 8.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 2.728 -3.860 8.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 3.447 -5.346 8.662 1.00 0.00 H new ATOM 874 N TYR A 860 2.829 -3.893 1.815 1.00 0.00 N ATOM 875 CA TYR A 860 3.879 -3.723 0.765 1.00 0.00 C ATOM 876 C TYR A 860 3.320 -2.899 -0.380 1.00 0.00 C ATOM 877 O TYR A 860 3.917 -1.923 -0.785 1.00 0.00 O ATOM 878 CB TYR A 860 4.278 -5.109 0.277 1.00 0.00 C ATOM 879 CG TYR A 860 5.303 -4.978 -0.848 1.00 0.00 C ATOM 880 CD1 TYR A 860 6.005 -3.770 -1.028 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.544 -6.051 -1.721 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.933 -3.635 -2.063 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.479 -5.908 -2.759 1.00 0.00 C ATOM 884 CZ TYR A 860 7.169 -4.704 -2.929 1.00 0.00 C ATOM 885 OH TYR A 860 8.087 -4.572 -3.953 1.00 0.00 O ATOM 0 H TYR A 860 2.474 -4.840 1.949 1.00 0.00 H new ATOM 0 HA TYR A 860 4.750 -3.205 1.166 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.697 -5.689 1.099 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.400 -5.648 -0.078 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.824 -2.941 -0.360 1.00 0.00 H new ATOM 0 HD2 TYR A 860 5.012 -6.983 -1.595 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.467 -2.705 -2.193 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.666 -6.733 -3.430 1.00 0.00 H new ATOM 0 HH TYR A 860 8.132 -5.408 -4.462 1.00 0.00 H new ATOM 895 N GLU A 861 2.171 -3.256 -0.892 1.00 0.00 N ATOM 896 CA GLU A 861 1.585 -2.432 -1.990 1.00 0.00 C ATOM 897 C GLU A 861 1.714 -0.977 -1.558 1.00 0.00 C ATOM 898 O GLU A 861 2.086 -0.109 -2.319 1.00 0.00 O ATOM 899 CB GLU A 861 0.122 -2.860 -2.087 1.00 0.00 C ATOM 900 CG GLU A 861 0.027 -4.191 -2.837 1.00 0.00 C ATOM 901 CD GLU A 861 0.048 -5.347 -1.838 1.00 0.00 C ATOM 902 OE1 GLU A 861 1.130 -5.817 -1.527 1.00 0.00 O ATOM 903 OE2 GLU A 861 -1.019 -5.743 -1.401 1.00 0.00 O ATOM 0 H GLU A 861 1.622 -4.066 -0.605 1.00 0.00 H new ATOM 0 HA GLU A 861 2.071 -2.556 -2.957 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.305 -2.962 -1.089 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.458 -2.096 -2.606 1.00 0.00 H new ATOM 0 HG2 GLU A 861 -0.890 -4.223 -3.426 1.00 0.00 H new ATOM 0 HG3 GLU A 861 0.858 -4.286 -3.536 1.00 0.00 H new ATOM 910 N ARG A 862 1.470 -0.745 -0.300 1.00 0.00 N ATOM 911 CA ARG A 862 1.633 0.621 0.267 1.00 0.00 C ATOM 912 C ARG A 862 3.124 0.945 0.370 1.00 0.00 C ATOM 913 O ARG A 862 3.555 2.045 0.088 1.00 0.00 O ATOM 914 CB ARG A 862 1.041 0.554 1.668 1.00 0.00 C ATOM 915 CG ARG A 862 1.422 1.825 2.438 1.00 0.00 C ATOM 916 CD ARG A 862 2.675 1.558 3.279 1.00 0.00 C ATOM 917 NE ARG A 862 2.666 2.606 4.336 1.00 0.00 N ATOM 918 CZ ARG A 862 3.664 2.698 5.172 1.00 0.00 C ATOM 919 NH1 ARG A 862 4.405 3.772 5.188 1.00 0.00 N ATOM 920 NH2 ARG A 862 3.922 1.715 5.990 1.00 0.00 N ATOM 0 H ARG A 862 1.161 -1.452 0.367 1.00 0.00 H new ATOM 0 HA ARG A 862 1.150 1.381 -0.347 1.00 0.00 H new ATOM 0 HB2 ARG A 862 -0.043 0.459 1.613 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.412 -0.327 2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 862 1.606 2.643 1.742 1.00 0.00 H new ATOM 0 HG3 ARG A 862 0.598 2.134 3.082 1.00 0.00 H new ATOM 0 HD2 ARG A 862 2.651 0.559 3.715 1.00 0.00 H new ATOM 0 HD3 ARG A 862 3.578 1.619 2.671 1.00 0.00 H new ATOM 0 HE ARG A 862 1.880 3.252 4.407 1.00 0.00 H new ATOM 0 HH11 ARG A 862 4.204 4.540 4.547 1.00 0.00 H new ATOM 0 HH12 ARG A 862 5.185 3.844 5.841 1.00 0.00 H new ATOM 0 HH21 ARG A 862 3.344 0.875 5.976 1.00 0.00 H new ATOM 0 HH22 ARG A 862 4.702 1.787 6.643 1.00 0.00 H new ATOM 934 N ALA A 863 3.912 -0.005 0.793 1.00 0.00 N ATOM 935 CA ALA A 863 5.373 0.259 0.926 1.00 0.00 C ATOM 936 C ALA A 863 6.003 0.455 -0.452 1.00 0.00 C ATOM 937 O ALA A 863 7.041 1.080 -0.594 1.00 0.00 O ATOM 938 CB ALA A 863 5.950 -0.977 1.616 1.00 0.00 C ATOM 0 H ALA A 863 3.611 -0.945 1.050 1.00 0.00 H new ATOM 0 HA ALA A 863 5.574 1.166 1.497 1.00 0.00 H new ATOM 0 HB1 ALA A 863 7.025 -0.852 1.747 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.478 -1.103 2.590 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.759 -1.858 1.003 1.00 0.00 H new ATOM 944 N ARG A 864 5.345 0.006 -1.482 1.00 0.00 N ATOM 945 CA ARG A 864 5.886 0.237 -2.845 1.00 0.00 C ATOM 946 C ARG A 864 5.333 1.582 -3.229 1.00 0.00 C ATOM 947 O ARG A 864 5.996 2.453 -3.752 1.00 0.00 O ATOM 948 CB ARG A 864 5.335 -0.887 -3.723 1.00 0.00 C ATOM 949 CG ARG A 864 6.507 -1.607 -4.400 1.00 0.00 C ATOM 950 CD ARG A 864 6.720 -1.028 -5.802 1.00 0.00 C ATOM 951 NE ARG A 864 7.323 -2.138 -6.594 1.00 0.00 N ATOM 952 CZ ARG A 864 7.631 -1.950 -7.850 1.00 0.00 C ATOM 953 NH1 ARG A 864 6.878 -1.194 -8.603 1.00 0.00 N ATOM 954 NH2 ARG A 864 8.693 -2.518 -8.353 1.00 0.00 N ATOM 0 H ARG A 864 4.464 -0.506 -1.439 1.00 0.00 H new ATOM 0 HA ARG A 864 6.972 0.234 -2.933 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.759 -1.589 -3.120 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.657 -0.481 -4.474 1.00 0.00 H new ATOM 0 HG2 ARG A 864 7.413 -1.490 -3.805 1.00 0.00 H new ATOM 0 HG3 ARG A 864 6.304 -2.676 -4.463 1.00 0.00 H new ATOM 0 HD2 ARG A 864 5.778 -0.698 -6.240 1.00 0.00 H new ATOM 0 HD3 ARG A 864 7.379 -0.160 -5.774 1.00 0.00 H new ATOM 0 HE ARG A 864 7.495 -3.043 -6.156 1.00 0.00 H new ATOM 0 HH11 ARG A 864 6.048 -0.749 -8.211 1.00 0.00 H new ATOM 0 HH12 ARG A 864 7.120 -1.048 -9.583 1.00 0.00 H new ATOM 0 HH21 ARG A 864 9.282 -3.108 -7.766 1.00 0.00 H new ATOM 0 HH22 ARG A 864 8.934 -2.372 -9.333 1.00 0.00 H new ATOM 968 N VAL A 865 4.102 1.741 -2.858 1.00 0.00 N ATOM 969 CA VAL A 865 3.371 3.003 -3.043 1.00 0.00 C ATOM 970 C VAL A 865 4.212 4.121 -2.457 1.00 0.00 C ATOM 971 O VAL A 865 4.686 4.974 -3.145 1.00 0.00 O ATOM 972 CB VAL A 865 2.130 2.738 -2.191 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.710 3.957 -1.390 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.998 2.292 -3.067 1.00 0.00 C ATOM 0 H VAL A 865 3.551 1.007 -2.413 1.00 0.00 H new ATOM 0 HA VAL A 865 3.141 3.286 -4.070 1.00 0.00 H new ATOM 0 HB VAL A 865 2.385 1.952 -1.480 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.824 3.718 -0.801 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.520 4.251 -0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.483 4.778 -2.070 1.00 0.00 H new ATOM 0 HG21 VAL A 865 0.116 2.105 -2.455 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.774 3.070 -3.797 1.00 0.00 H new ATOM 0 HG23 VAL A 865 1.280 1.377 -3.587 1.00 0.00 H new ATOM 984 N LEU A 866 4.407 4.070 -1.176 1.00 0.00 N ATOM 985 CA LEU A 866 5.235 5.068 -0.470 1.00 0.00 C ATOM 986 C LEU A 866 6.507 5.243 -1.275 1.00 0.00 C ATOM 987 O LEU A 866 7.010 6.332 -1.439 1.00 0.00 O ATOM 988 CB LEU A 866 5.480 4.463 0.933 1.00 0.00 C ATOM 989 CG LEU A 866 6.922 3.947 1.100 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.882 5.115 1.360 1.00 0.00 C ATOM 991 CD2 LEU A 866 6.971 2.993 2.295 1.00 0.00 C ATOM 0 H LEU A 866 4.011 3.351 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 866 4.782 6.054 -0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.275 5.217 1.693 1.00 0.00 H new ATOM 0 HB3 LEU A 866 4.781 3.644 1.101 1.00 0.00 H new ATOM 0 HG LEU A 866 7.224 3.434 0.187 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.896 4.733 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 866 7.849 5.808 0.519 1.00 0.00 H new ATOM 0 HD13 LEU A 866 7.584 5.635 2.270 1.00 0.00 H new ATOM 0 HD21 LEU A 866 7.988 2.621 2.423 1.00 0.00 H new ATOM 0 HD22 LEU A 866 6.663 3.523 3.196 1.00 0.00 H new ATOM 0 HD23 LEU A 866 6.298 2.154 2.119 1.00 0.00 H new ATOM 1003 N GLY A 867 7.007 4.175 -1.825 1.00 0.00 N ATOM 1004 CA GLY A 867 8.206 4.312 -2.663 1.00 0.00 C ATOM 1005 C GLY A 867 7.825 5.124 -3.889 1.00 0.00 C ATOM 1006 O GLY A 867 8.504 6.047 -4.258 1.00 0.00 O ATOM 0 H GLY A 867 6.637 3.229 -1.728 1.00 0.00 H new ATOM 0 HA2 GLY A 867 9.004 4.807 -2.110 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.582 3.332 -2.956 1.00 0.00 H new ATOM 1010 N THR A 868 6.721 4.793 -4.502 1.00 0.00 N ATOM 1011 CA THR A 868 6.273 5.554 -5.726 1.00 0.00 C ATOM 1012 C THR A 868 5.705 6.891 -5.340 1.00 0.00 C ATOM 1013 O THR A 868 5.710 7.826 -6.108 1.00 0.00 O ATOM 1014 CB THR A 868 5.167 4.723 -6.333 1.00 0.00 C ATOM 1015 OG1 THR A 868 4.001 4.822 -5.526 1.00 0.00 O ATOM 1016 CG2 THR A 868 5.629 3.297 -6.382 1.00 0.00 C ATOM 0 H THR A 868 6.105 4.032 -4.217 1.00 0.00 H new ATOM 0 HA THR A 868 7.106 5.723 -6.408 1.00 0.00 H new ATOM 0 HB THR A 868 4.931 5.078 -7.336 1.00 0.00 H new ATOM 0 HG1 THR A 868 4.261 4.978 -4.594 1.00 0.00 H new ATOM 0 HG21 THR A 868 4.846 2.676 -6.817 1.00 0.00 H new ATOM 0 HG22 THR A 868 6.529 3.227 -6.992 1.00 0.00 H new ATOM 0 HG23 THR A 868 5.848 2.950 -5.372 1.00 0.00 H new ATOM 1024 N ARG A 869 5.289 7.003 -4.129 1.00 0.00 N ATOM 1025 CA ARG A 869 4.797 8.296 -3.648 1.00 0.00 C ATOM 1026 C ARG A 869 6.062 9.070 -3.452 1.00 0.00 C ATOM 1027 O ARG A 869 6.241 10.142 -3.966 1.00 0.00 O ATOM 1028 CB ARG A 869 4.086 8.018 -2.321 1.00 0.00 C ATOM 1029 CG ARG A 869 2.585 8.261 -2.483 1.00 0.00 C ATOM 1030 CD ARG A 869 2.000 7.227 -3.449 1.00 0.00 C ATOM 1031 NE ARG A 869 1.103 8.004 -4.350 1.00 0.00 N ATOM 1032 CZ ARG A 869 1.089 7.757 -5.631 1.00 0.00 C ATOM 1033 NH1 ARG A 869 1.146 6.525 -6.060 1.00 0.00 N ATOM 1034 NH2 ARG A 869 1.020 8.741 -6.485 1.00 0.00 N ATOM 0 H ARG A 869 5.269 6.246 -3.445 1.00 0.00 H new ATOM 0 HA ARG A 869 4.101 8.827 -4.298 1.00 0.00 H new ATOM 0 HB2 ARG A 869 4.267 6.989 -2.009 1.00 0.00 H new ATOM 0 HB3 ARG A 869 4.487 8.664 -1.540 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.088 8.192 -1.515 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.408 9.268 -2.861 1.00 0.00 H new ATOM 0 HD2 ARG A 869 2.786 6.725 -4.013 1.00 0.00 H new ATOM 0 HD3 ARG A 869 1.448 6.455 -2.913 1.00 0.00 H new ATOM 0 HE ARG A 869 0.499 8.730 -3.965 1.00 0.00 H new ATOM 0 HH11 ARG A 869 1.201 5.755 -5.393 1.00 0.00 H new ATOM 0 HH12 ARG A 869 1.135 6.333 -7.062 1.00 0.00 H new ATOM 0 HH21 ARG A 869 0.977 9.704 -6.151 1.00 0.00 H new ATOM 0 HH22 ARG A 869 1.009 8.547 -7.486 1.00 0.00 H new ATOM 1048 N ALA A 870 6.972 8.457 -2.752 1.00 0.00 N ATOM 1049 CA ALA A 870 8.305 9.080 -2.535 1.00 0.00 C ATOM 1050 C ALA A 870 8.973 9.488 -3.861 1.00 0.00 C ATOM 1051 O ALA A 870 9.625 10.505 -3.920 1.00 0.00 O ATOM 1052 CB ALA A 870 9.125 7.996 -1.839 1.00 0.00 C ATOM 0 H ALA A 870 6.848 7.543 -2.317 1.00 0.00 H new ATOM 0 HA ALA A 870 8.226 9.996 -1.950 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.129 8.371 -1.639 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.645 7.725 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.187 7.118 -2.482 1.00 0.00 H new ATOM 1058 N LEU A 871 8.811 8.747 -4.934 1.00 0.00 N ATOM 1059 CA LEU A 871 9.455 9.211 -6.221 1.00 0.00 C ATOM 1060 C LEU A 871 8.490 10.117 -6.929 1.00 0.00 C ATOM 1061 O LEU A 871 8.878 11.124 -7.496 1.00 0.00 O ATOM 1062 CB LEU A 871 9.850 8.018 -7.127 1.00 0.00 C ATOM 1063 CG LEU A 871 9.376 6.679 -6.582 1.00 0.00 C ATOM 1064 CD1 LEU A 871 9.089 5.737 -7.751 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.475 6.079 -5.698 1.00 0.00 C ATOM 0 H LEU A 871 8.284 7.875 -4.984 1.00 0.00 H new ATOM 0 HA LEU A 871 10.376 9.746 -5.989 1.00 0.00 H new ATOM 0 HB2 LEU A 871 9.430 8.169 -8.122 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.934 7.996 -7.238 1.00 0.00 H new ATOM 0 HG LEU A 871 8.469 6.817 -5.993 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.749 4.775 -7.368 1.00 0.00 H new ATOM 0 HD12 LEU A 871 8.315 6.169 -8.385 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.998 5.594 -8.335 1.00 0.00 H new ATOM 0 HD21 LEU A 871 10.141 5.119 -5.304 1.00 0.00 H new ATOM 0 HD22 LEU A 871 11.379 5.934 -6.289 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.687 6.757 -4.871 1.00 0.00 H new ATOM 1077 N GLN A 872 7.222 9.804 -6.875 1.00 0.00 N ATOM 1078 CA GLN A 872 6.239 10.710 -7.521 1.00 0.00 C ATOM 1079 C GLN A 872 6.627 12.143 -7.142 1.00 0.00 C ATOM 1080 O GLN A 872 7.041 12.939 -7.963 1.00 0.00 O ATOM 1081 CB GLN A 872 4.898 10.307 -6.904 1.00 0.00 C ATOM 1082 CG GLN A 872 4.029 9.563 -7.934 1.00 0.00 C ATOM 1083 CD GLN A 872 4.824 8.420 -8.578 1.00 0.00 C ATOM 1084 OE1 GLN A 872 5.726 8.652 -9.357 1.00 0.00 O ATOM 1085 NE2 GLN A 872 4.519 7.185 -8.287 1.00 0.00 N ATOM 0 H GLN A 872 6.834 8.977 -6.421 1.00 0.00 H new ATOM 0 HA GLN A 872 6.200 10.648 -8.609 1.00 0.00 H new ATOM 0 HB2 GLN A 872 5.068 9.670 -6.036 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.373 11.194 -6.551 1.00 0.00 H new ATOM 0 HG2 GLN A 872 3.138 9.166 -7.448 1.00 0.00 H new ATOM 0 HG3 GLN A 872 3.690 10.257 -8.703 1.00 0.00 H new ATOM 0 HE21 GLN A 872 3.762 6.987 -7.633 1.00 0.00 H new ATOM 0 HE22 GLN A 872 5.038 6.417 -8.714 1.00 0.00 H new ATOM 1094 N ILE A 873 6.537 12.438 -5.882 1.00 0.00 N ATOM 1095 CA ILE A 873 6.935 13.778 -5.360 1.00 0.00 C ATOM 1096 C ILE A 873 8.399 14.035 -5.582 1.00 0.00 C ATOM 1097 O ILE A 873 8.804 15.154 -5.815 1.00 0.00 O ATOM 1098 CB ILE A 873 6.720 13.702 -3.863 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.101 12.298 -3.352 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.267 14.011 -3.592 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.322 12.380 -2.449 1.00 0.00 C ATOM 0 H ILE A 873 6.196 11.793 -5.169 1.00 0.00 H new ATOM 0 HA ILE A 873 6.364 14.563 -5.856 1.00 0.00 H new ATOM 0 HB ILE A 873 7.349 14.422 -3.339 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.264 11.863 -2.806 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.308 11.640 -4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.079 13.964 -2.519 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.033 15.011 -3.958 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.638 13.281 -4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.580 11.382 -2.095 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.161 12.795 -3.008 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.101 13.022 -1.596 1.00 0.00 H new ATOM 1113 N ALA A 874 9.210 13.017 -5.512 1.00 0.00 N ATOM 1114 CA ALA A 874 10.658 13.252 -5.724 1.00 0.00 C ATOM 1115 C ALA A 874 10.835 13.970 -7.049 1.00 0.00 C ATOM 1116 O ALA A 874 11.842 14.601 -7.301 1.00 0.00 O ATOM 1117 CB ALA A 874 11.316 11.884 -5.713 1.00 0.00 C ATOM 0 H ALA A 874 8.938 12.053 -5.321 1.00 0.00 H new ATOM 0 HA ALA A 874 11.112 13.876 -4.955 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.390 11.995 -5.866 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.134 11.400 -4.753 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.897 11.272 -6.512 1.00 0.00 H new ATOM 1123 N MET A 875 9.817 13.949 -7.861 1.00 0.00 N ATOM 1124 CA MET A 875 9.889 14.718 -9.123 1.00 0.00 C ATOM 1125 C MET A 875 9.248 16.068 -8.817 1.00 0.00 C ATOM 1126 O MET A 875 9.888 17.101 -8.809 1.00 0.00 O ATOM 1127 CB MET A 875 9.066 13.925 -10.142 1.00 0.00 C ATOM 1128 CG MET A 875 9.544 14.263 -11.557 1.00 0.00 C ATOM 1129 SD MET A 875 10.768 13.041 -12.093 1.00 0.00 S ATOM 1130 CE MET A 875 10.064 12.719 -13.728 1.00 0.00 C ATOM 0 H MET A 875 8.949 13.437 -7.705 1.00 0.00 H new ATOM 0 HA MET A 875 10.896 14.871 -9.511 1.00 0.00 H new ATOM 0 HB2 MET A 875 9.170 12.856 -9.957 1.00 0.00 H new ATOM 0 HB3 MET A 875 8.008 14.165 -10.037 1.00 0.00 H new ATOM 0 HG2 MET A 875 8.699 14.272 -12.245 1.00 0.00 H new ATOM 0 HG3 MET A 875 9.980 15.262 -11.575 1.00 0.00 H new ATOM 0 HE1 MET A 875 10.673 11.978 -14.247 1.00 0.00 H new ATOM 0 HE2 MET A 875 9.048 12.341 -13.618 1.00 0.00 H new ATOM 0 HE3 MET A 875 10.047 13.643 -14.305 1.00 0.00 H new ATOM 1140 N CYS A 876 7.990 16.028 -8.501 1.00 0.00 N ATOM 1141 CA CYS A 876 7.244 17.256 -8.104 1.00 0.00 C ATOM 1142 C CYS A 876 6.349 16.905 -6.919 1.00 0.00 C ATOM 1143 O CYS A 876 6.686 17.130 -5.774 1.00 0.00 O ATOM 1144 CB CYS A 876 6.424 17.657 -9.332 1.00 0.00 C ATOM 1145 SG CYS A 876 7.360 18.851 -10.319 1.00 0.00 S ATOM 0 H CYS A 876 7.430 15.176 -8.500 1.00 0.00 H new ATOM 0 HA CYS A 876 7.891 18.079 -7.800 1.00 0.00 H new ATOM 0 HB2 CYS A 876 6.192 16.776 -9.931 1.00 0.00 H new ATOM 0 HB3 CYS A 876 5.473 18.091 -9.022 1.00 0.00 H new ATOM 0 HG CYS A 876 6.665 19.190 -11.364 1.00 0.00 H new ATOM 1151 N ALA A 877 5.216 16.314 -7.199 1.00 0.00 N ATOM 1152 CA ALA A 877 4.289 15.900 -6.102 1.00 0.00 C ATOM 1153 C ALA A 877 2.982 15.251 -6.616 1.00 0.00 C ATOM 1154 O ALA A 877 1.918 15.573 -6.125 1.00 0.00 O ATOM 1155 CB ALA A 877 3.981 17.170 -5.325 1.00 0.00 C ATOM 0 H ALA A 877 4.892 16.100 -8.142 1.00 0.00 H new ATOM 0 HA ALA A 877 4.762 15.133 -5.488 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.304 16.938 -4.503 1.00 0.00 H new ATOM 0 HB2 ALA A 877 4.906 17.586 -4.927 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.512 17.897 -5.988 1.00 0.00 H new ATOM 1161 N PRO A 878 3.091 14.311 -7.536 1.00 0.00 N ATOM 1162 CA PRO A 878 1.888 13.580 -8.025 1.00 0.00 C ATOM 1163 C PRO A 878 1.248 12.842 -6.844 1.00 0.00 C ATOM 1164 O PRO A 878 0.135 12.361 -6.905 1.00 0.00 O ATOM 1165 CB PRO A 878 2.483 12.572 -9.001 1.00 0.00 C ATOM 1166 CG PRO A 878 4.008 12.752 -9.023 1.00 0.00 C ATOM 1167 CD PRO A 878 4.383 13.932 -8.132 1.00 0.00 C ATOM 0 HA PRO A 878 1.126 14.218 -8.473 1.00 0.00 H new ATOM 0 HB2 PRO A 878 2.226 11.557 -8.699 1.00 0.00 H new ATOM 0 HB3 PRO A 878 2.070 12.722 -9.998 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.499 11.844 -8.672 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.352 12.926 -10.043 1.00 0.00 H new ATOM 0 HD2 PRO A 878 5.112 13.650 -7.372 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.820 14.750 -8.705 1.00 0.00 H new ATOM 1174 N VAL A 879 1.986 12.758 -5.775 1.00 0.00 N ATOM 1175 CA VAL A 879 1.527 12.067 -4.541 1.00 0.00 C ATOM 1176 C VAL A 879 0.169 12.630 -4.113 1.00 0.00 C ATOM 1177 O VAL A 879 -0.396 13.487 -4.765 1.00 0.00 O ATOM 1178 CB VAL A 879 2.665 12.415 -3.551 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.233 12.370 -2.078 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.834 11.441 -3.772 1.00 0.00 C ATOM 0 H VAL A 879 2.923 13.155 -5.705 1.00 0.00 H new ATOM 0 HA VAL A 879 1.368 10.993 -4.632 1.00 0.00 H new ATOM 0 HB VAL A 879 2.962 13.444 -3.755 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.081 12.624 -1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.428 13.086 -1.913 1.00 0.00 H new ATOM 0 HG13 VAL A 879 1.883 11.367 -1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.641 11.678 -3.079 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.495 10.420 -3.598 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.196 11.534 -4.796 1.00 0.00 H new ATOM 1190 N MET A 880 -0.371 12.125 -3.049 1.00 0.00 N ATOM 1191 CA MET A 880 -1.718 12.591 -2.594 1.00 0.00 C ATOM 1192 C MET A 880 -1.592 13.738 -1.595 1.00 0.00 C ATOM 1193 O MET A 880 -2.516 14.052 -0.873 1.00 0.00 O ATOM 1194 CB MET A 880 -2.352 11.370 -1.930 1.00 0.00 C ATOM 1195 CG MET A 880 -3.760 11.169 -2.484 1.00 0.00 C ATOM 1196 SD MET A 880 -3.657 10.557 -4.184 1.00 0.00 S ATOM 1197 CE MET A 880 -5.055 11.494 -4.848 1.00 0.00 C ATOM 0 H MET A 880 0.057 11.406 -2.466 1.00 0.00 H new ATOM 0 HA MET A 880 -2.317 12.970 -3.422 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.745 10.484 -2.117 1.00 0.00 H new ATOM 0 HB3 MET A 880 -2.390 11.508 -0.849 1.00 0.00 H new ATOM 0 HG2 MET A 880 -4.309 10.460 -1.864 1.00 0.00 H new ATOM 0 HG3 MET A 880 -4.311 12.109 -2.457 1.00 0.00 H new ATOM 0 HE1 MET A 880 -5.547 10.911 -5.627 1.00 0.00 H new ATOM 0 HE2 MET A 880 -5.765 11.704 -4.048 1.00 0.00 H new ATOM 0 HE3 MET A 880 -4.696 12.433 -5.270 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.467 14.386 -1.588 1.00 0.00 N ATOM 1208 CA VAL A 881 -0.249 15.537 -0.696 1.00 0.00 C ATOM 1209 C VAL A 881 0.705 16.473 -1.434 1.00 0.00 C ATOM 1210 O VAL A 881 1.288 16.108 -2.437 1.00 0.00 O ATOM 1211 CB VAL A 881 0.357 14.977 0.603 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.715 14.191 1.386 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.527 14.047 0.277 1.00 0.00 C ATOM 0 H VAL A 881 0.329 14.155 -2.182 1.00 0.00 H new ATOM 0 HA VAL A 881 -1.153 16.090 -0.441 1.00 0.00 H new ATOM 0 HB VAL A 881 0.714 15.809 1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 881 -0.279 13.797 2.304 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.544 14.854 1.633 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -1.080 13.366 0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 881 1.949 13.656 1.202 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.174 13.220 -0.339 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.293 14.602 -0.265 1.00 0.00 H new ATOM 1223 N GLU A 882 0.836 17.672 -0.986 1.00 0.00 N ATOM 1224 CA GLU A 882 1.719 18.642 -1.704 1.00 0.00 C ATOM 1225 C GLU A 882 2.740 19.286 -0.762 1.00 0.00 C ATOM 1226 O GLU A 882 2.609 20.436 -0.389 1.00 0.00 O ATOM 1227 CB GLU A 882 0.761 19.704 -2.246 1.00 0.00 C ATOM 1228 CG GLU A 882 0.264 19.286 -3.632 1.00 0.00 C ATOM 1229 CD GLU A 882 0.108 20.526 -4.515 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -0.273 21.560 -3.988 1.00 0.00 O ATOM 1231 OE2 GLU A 882 0.372 20.422 -5.701 1.00 0.00 O ATOM 0 H GLU A 882 0.375 18.037 -0.153 1.00 0.00 H new ATOM 0 HA GLU A 882 2.299 18.150 -2.485 1.00 0.00 H new ATOM 0 HB2 GLU A 882 -0.083 19.827 -1.568 1.00 0.00 H new ATOM 0 HB3 GLU A 882 1.266 20.668 -2.305 1.00 0.00 H new ATOM 0 HG2 GLU A 882 0.968 18.589 -4.087 1.00 0.00 H new ATOM 0 HG3 GLU A 882 -0.690 18.766 -3.546 1.00 0.00 H new ATOM 1238 N LEU A 883 3.762 18.566 -0.382 1.00 0.00 N ATOM 1239 CA LEU A 883 4.785 19.163 0.525 1.00 0.00 C ATOM 1240 C LEU A 883 5.437 20.388 -0.144 1.00 0.00 C ATOM 1241 O LEU A 883 5.003 21.506 0.054 1.00 0.00 O ATOM 1242 CB LEU A 883 5.809 18.047 0.757 1.00 0.00 C ATOM 1243 CG LEU A 883 6.940 18.565 1.648 1.00 0.00 C ATOM 1244 CD1 LEU A 883 6.426 18.740 3.078 1.00 0.00 C ATOM 1245 CD2 LEU A 883 8.094 17.557 1.643 1.00 0.00 C ATOM 0 H LEU A 883 3.932 17.599 -0.658 1.00 0.00 H new ATOM 0 HA LEU A 883 4.357 19.514 1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 883 5.327 17.189 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 883 6.211 17.705 -0.197 1.00 0.00 H new ATOM 0 HG LEU A 883 7.290 19.525 1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 883 7.232 19.109 3.712 1.00 0.00 H new ATOM 0 HD12 LEU A 883 5.603 19.455 3.084 1.00 0.00 H new ATOM 0 HD13 LEU A 883 6.075 17.781 3.459 1.00 0.00 H new ATOM 0 HD21 LEU A 883 8.901 17.924 2.277 1.00 0.00 H new ATOM 0 HD22 LEU A 883 7.741 16.598 2.023 1.00 0.00 H new ATOM 0 HD23 LEU A 883 8.462 17.430 0.625 1.00 0.00 H new ATOM 1257 N GLU A 884 6.475 20.195 -0.926 1.00 0.00 N ATOM 1258 CA GLU A 884 7.135 21.367 -1.585 1.00 0.00 C ATOM 1259 C GLU A 884 7.642 21.024 -2.997 1.00 0.00 C ATOM 1260 O GLU A 884 8.231 21.855 -3.662 1.00 0.00 O ATOM 1261 CB GLU A 884 8.315 21.706 -0.673 1.00 0.00 C ATOM 1262 CG GLU A 884 8.170 23.139 -0.154 1.00 0.00 C ATOM 1263 CD GLU A 884 9.187 23.384 0.962 1.00 0.00 C ATOM 1264 OE1 GLU A 884 10.334 23.010 0.785 1.00 0.00 O ATOM 1265 OE2 GLU A 884 8.801 23.941 1.977 1.00 0.00 O ATOM 0 H GLU A 884 6.889 19.286 -1.134 1.00 0.00 H new ATOM 0 HA GLU A 884 6.437 22.195 -1.711 1.00 0.00 H new ATOM 0 HB2 GLU A 884 8.353 21.008 0.163 1.00 0.00 H new ATOM 0 HB3 GLU A 884 9.252 21.600 -1.220 1.00 0.00 H new ATOM 0 HG2 GLU A 884 8.328 23.849 -0.966 1.00 0.00 H new ATOM 0 HG3 GLU A 884 7.159 23.301 0.219 1.00 0.00 H new ATOM 1272 N GLY A 885 7.452 19.814 -3.454 1.00 0.00 N ATOM 1273 CA GLY A 885 7.959 19.436 -4.799 1.00 0.00 C ATOM 1274 C GLY A 885 8.928 18.259 -4.638 1.00 0.00 C ATOM 1275 O GLY A 885 9.142 17.495 -5.555 1.00 0.00 O ATOM 0 H GLY A 885 6.966 19.072 -2.950 1.00 0.00 H new ATOM 0 HA2 GLY A 885 7.131 19.159 -5.452 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.464 20.282 -5.265 1.00 0.00 H new ATOM 1279 N GLU A 886 9.502 18.125 -3.457 1.00 0.00 N ATOM 1280 CA GLU A 886 10.470 17.020 -3.140 1.00 0.00 C ATOM 1281 C GLU A 886 11.452 17.524 -2.089 1.00 0.00 C ATOM 1282 O GLU A 886 12.084 18.547 -2.262 1.00 0.00 O ATOM 1283 CB GLU A 886 11.231 16.677 -4.426 1.00 0.00 C ATOM 1284 CG GLU A 886 12.497 15.872 -4.095 1.00 0.00 C ATOM 1285 CD GLU A 886 13.341 15.700 -5.359 1.00 0.00 C ATOM 1286 OE1 GLU A 886 13.420 16.645 -6.127 1.00 0.00 O ATOM 1287 OE2 GLU A 886 13.892 14.627 -5.538 1.00 0.00 O ATOM 0 H GLU A 886 9.331 18.759 -2.676 1.00 0.00 H new ATOM 0 HA GLU A 886 9.951 16.139 -2.763 1.00 0.00 H new ATOM 0 HB2 GLU A 886 10.590 16.102 -5.094 1.00 0.00 H new ATOM 0 HB3 GLU A 886 11.501 17.592 -4.953 1.00 0.00 H new ATOM 0 HG2 GLU A 886 13.075 16.385 -3.326 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.225 14.897 -3.692 1.00 0.00 H new ATOM 1294 N THR A 887 11.598 16.813 -1.014 1.00 0.00 N ATOM 1295 CA THR A 887 12.543 17.242 0.032 1.00 0.00 C ATOM 1296 C THR A 887 12.754 16.049 0.931 1.00 0.00 C ATOM 1297 O THR A 887 13.861 15.660 1.253 1.00 0.00 O ATOM 1298 CB THR A 887 11.821 18.374 0.772 1.00 0.00 C ATOM 1299 OG1 THR A 887 11.822 19.542 -0.037 1.00 0.00 O ATOM 1300 CG2 THR A 887 12.528 18.673 2.095 1.00 0.00 C ATOM 0 H THR A 887 11.097 15.946 -0.817 1.00 0.00 H new ATOM 0 HA THR A 887 13.511 17.584 -0.335 1.00 0.00 H new ATOM 0 HB THR A 887 10.795 18.067 0.978 1.00 0.00 H new ATOM 0 HG1 THR A 887 12.356 19.381 -0.843 1.00 0.00 H new ATOM 0 HG21 THR A 887 12.007 19.479 2.612 1.00 0.00 H new ATOM 0 HG22 THR A 887 12.525 17.779 2.719 1.00 0.00 H new ATOM 0 HG23 THR A 887 13.557 18.974 1.898 1.00 0.00 H new ATOM 1308 N ASP A 888 11.669 15.462 1.321 1.00 0.00 N ATOM 1309 CA ASP A 888 11.725 14.279 2.185 1.00 0.00 C ATOM 1310 C ASP A 888 11.802 12.996 1.348 1.00 0.00 C ATOM 1311 O ASP A 888 11.211 12.925 0.288 1.00 0.00 O ATOM 1312 CB ASP A 888 10.423 14.339 2.949 1.00 0.00 C ATOM 1313 CG ASP A 888 10.598 13.697 4.327 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.410 12.498 4.428 1.00 0.00 O ATOM 1315 OD2 ASP A 888 10.916 14.419 5.257 1.00 0.00 O ATOM 0 H ASP A 888 10.728 15.764 1.068 1.00 0.00 H new ATOM 0 HA ASP A 888 12.601 14.268 2.834 1.00 0.00 H new ATOM 0 HB2 ASP A 888 10.103 15.375 3.059 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.641 13.821 2.394 1.00 0.00 H new ATOM 1320 N PRO A 889 12.505 12.010 1.848 1.00 0.00 N ATOM 1321 CA PRO A 889 12.616 10.725 1.124 1.00 0.00 C ATOM 1322 C PRO A 889 11.276 9.969 1.139 1.00 0.00 C ATOM 1323 O PRO A 889 11.123 8.972 0.462 1.00 0.00 O ATOM 1324 CB PRO A 889 13.667 9.968 1.947 1.00 0.00 C ATOM 1325 CG PRO A 889 14.102 10.855 3.128 1.00 0.00 C ATOM 1326 CD PRO A 889 13.237 12.121 3.134 1.00 0.00 C ATOM 0 HA PRO A 889 12.881 10.843 0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.255 9.027 2.313 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.527 9.719 1.325 1.00 0.00 H new ATOM 0 HG2 PRO A 889 13.989 10.315 4.068 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.156 11.117 3.036 1.00 0.00 H new ATOM 0 HD2 PRO A 889 12.559 12.146 3.987 1.00 0.00 H new ATOM 0 HD3 PRO A 889 13.842 13.027 3.181 1.00 0.00 H new ATOM 1333 N LEU A 890 10.304 10.423 1.910 1.00 0.00 N ATOM 1334 CA LEU A 890 9.000 9.711 1.962 1.00 0.00 C ATOM 1335 C LEU A 890 7.985 10.424 2.879 1.00 0.00 C ATOM 1336 O LEU A 890 6.936 9.880 3.149 1.00 0.00 O ATOM 1337 CB LEU A 890 9.313 8.291 2.492 1.00 0.00 C ATOM 1338 CG LEU A 890 9.782 8.296 3.968 1.00 0.00 C ATOM 1339 CD1 LEU A 890 10.905 9.311 4.191 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.614 8.632 4.897 1.00 0.00 C ATOM 0 H LEU A 890 10.368 11.253 2.499 1.00 0.00 H new ATOM 0 HA LEU A 890 8.539 9.685 0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.423 7.668 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.085 7.837 1.871 1.00 0.00 H new ATOM 0 HG LEU A 890 10.159 7.299 4.195 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.212 9.290 5.237 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.755 9.058 3.558 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.549 10.309 3.937 1.00 0.00 H new ATOM 0 HD21 LEU A 890 8.960 8.632 5.931 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.221 9.617 4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 890 7.828 7.887 4.777 1.00 0.00 H new ATOM 1352 N LEU A 891 8.251 11.633 3.348 1.00 0.00 N ATOM 1353 CA LEU A 891 7.239 12.336 4.214 1.00 0.00 C ATOM 1354 C LEU A 891 5.895 12.140 3.579 1.00 0.00 C ATOM 1355 O LEU A 891 4.893 11.933 4.208 1.00 0.00 O ATOM 1356 CB LEU A 891 7.641 13.819 4.186 1.00 0.00 C ATOM 1357 CG LEU A 891 6.420 14.774 4.167 1.00 0.00 C ATOM 1358 CD1 LEU A 891 5.700 14.756 2.801 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.437 14.395 5.281 1.00 0.00 C ATOM 0 H LEU A 891 9.111 12.153 3.171 1.00 0.00 H new ATOM 0 HA LEU A 891 7.202 11.966 5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.256 14.040 5.059 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.257 14.007 3.306 1.00 0.00 H new ATOM 0 HG LEU A 891 6.790 15.785 4.336 1.00 0.00 H new ATOM 0 HD11 LEU A 891 4.850 15.438 2.829 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.393 15.071 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.348 13.746 2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.583 15.072 5.259 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.093 13.372 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 891 5.935 14.471 6.247 1.00 0.00 H new ATOM 1371 N ILE A 892 5.929 12.232 2.312 1.00 0.00 N ATOM 1372 CA ILE A 892 4.727 12.072 1.476 1.00 0.00 C ATOM 1373 C ILE A 892 4.264 10.638 1.529 1.00 0.00 C ATOM 1374 O ILE A 892 3.092 10.347 1.663 1.00 0.00 O ATOM 1375 CB ILE A 892 5.251 12.390 0.095 1.00 0.00 C ATOM 1376 CG1 ILE A 892 4.864 13.809 -0.260 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.698 11.414 -0.933 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.067 14.469 -0.889 1.00 0.00 C ATOM 0 H ILE A 892 6.781 12.421 1.783 1.00 0.00 H new ATOM 0 HA ILE A 892 3.885 12.693 1.782 1.00 0.00 H new ATOM 0 HB ILE A 892 6.337 12.293 0.091 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.020 13.814 -0.950 1.00 0.00 H new ATOM 0 HG13 ILE A 892 4.551 14.354 0.630 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.090 11.664 -1.919 1.00 0.00 H new ATOM 0 HG22 ILE A 892 4.998 10.400 -0.670 1.00 0.00 H new ATOM 0 HG23 ILE A 892 3.610 11.479 -0.948 1.00 0.00 H new ATOM 0 HD11 ILE A 892 5.820 15.496 -1.157 1.00 0.00 H new ATOM 0 HD12 ILE A 892 6.895 14.468 -0.180 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.356 13.920 -1.785 1.00 0.00 H new ATOM 1390 N ALA A 893 5.187 9.739 1.411 1.00 0.00 N ATOM 1391 CA ALA A 893 4.783 8.301 1.443 1.00 0.00 C ATOM 1392 C ALA A 893 4.330 7.967 2.866 1.00 0.00 C ATOM 1393 O ALA A 893 3.543 7.067 3.117 1.00 0.00 O ATOM 1394 CB ALA A 893 6.038 7.515 1.094 1.00 0.00 C ATOM 0 H ALA A 893 6.184 9.921 1.296 1.00 0.00 H new ATOM 0 HA ALA A 893 3.971 8.070 0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 893 5.813 6.449 1.099 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.387 7.807 0.103 1.00 0.00 H new ATOM 0 HB3 ALA A 893 6.815 7.725 1.829 1.00 0.00 H new ATOM 1400 N MET A 894 4.774 8.770 3.776 1.00 0.00 N ATOM 1401 CA MET A 894 4.379 8.631 5.201 1.00 0.00 C ATOM 1402 C MET A 894 3.088 9.398 5.388 1.00 0.00 C ATOM 1403 O MET A 894 2.150 8.927 5.975 1.00 0.00 O ATOM 1404 CB MET A 894 5.515 9.300 5.976 1.00 0.00 C ATOM 1405 CG MET A 894 5.118 9.495 7.443 1.00 0.00 C ATOM 1406 SD MET A 894 6.528 10.152 8.374 1.00 0.00 S ATOM 1407 CE MET A 894 6.736 11.702 7.456 1.00 0.00 C ATOM 0 H MET A 894 5.414 9.542 3.590 1.00 0.00 H new ATOM 0 HA MET A 894 4.225 7.602 5.527 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.415 8.689 5.914 1.00 0.00 H new ATOM 0 HB3 MET A 894 5.753 10.264 5.526 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.273 10.179 7.513 1.00 0.00 H new ATOM 0 HG3 MET A 894 4.797 8.546 7.872 1.00 0.00 H new ATOM 0 HE1 MET A 894 7.673 11.672 6.899 1.00 0.00 H new ATOM 0 HE2 MET A 894 5.905 11.828 6.762 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.756 12.539 8.154 1.00 0.00 H new ATOM 1417 N LYS A 895 3.047 10.575 4.850 1.00 0.00 N ATOM 1418 CA LYS A 895 1.827 11.410 4.925 1.00 0.00 C ATOM 1419 C LYS A 895 0.710 10.641 4.238 1.00 0.00 C ATOM 1420 O LYS A 895 -0.378 10.511 4.750 1.00 0.00 O ATOM 1421 CB LYS A 895 2.182 12.693 4.167 1.00 0.00 C ATOM 1422 CG LYS A 895 0.911 13.416 3.723 1.00 0.00 C ATOM 1423 CD LYS A 895 0.181 13.971 4.948 1.00 0.00 C ATOM 1424 CE LYS A 895 0.565 15.439 5.152 1.00 0.00 C ATOM 1425 NZ LYS A 895 0.726 15.592 6.625 1.00 0.00 N ATOM 0 H LYS A 895 3.826 11.004 4.350 1.00 0.00 H new ATOM 0 HA LYS A 895 1.501 11.646 5.938 1.00 0.00 H new ATOM 0 HB2 LYS A 895 2.777 13.347 4.804 1.00 0.00 H new ATOM 0 HB3 LYS A 895 2.794 12.452 3.298 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.162 14.226 3.039 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.261 12.730 3.180 1.00 0.00 H new ATOM 0 HD2 LYS A 895 -0.897 13.882 4.813 1.00 0.00 H new ATOM 0 HD3 LYS A 895 0.441 13.390 5.833 1.00 0.00 H new ATOM 0 HE2 LYS A 895 1.488 15.683 4.626 1.00 0.00 H new ATOM 0 HE3 LYS A 895 -0.206 16.106 4.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 0.990 16.574 6.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 -0.171 15.360 7.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 1.471 14.949 6.961 1.00 0.00 H new ATOM 1439 N GLU A 896 0.995 10.103 3.083 1.00 0.00 N ATOM 1440 CA GLU A 896 -0.034 9.297 2.362 1.00 0.00 C ATOM 1441 C GLU A 896 -0.582 8.229 3.303 1.00 0.00 C ATOM 1442 O GLU A 896 -1.782 8.110 3.467 1.00 0.00 O ATOM 1443 CB GLU A 896 0.700 8.657 1.181 1.00 0.00 C ATOM 1444 CG GLU A 896 0.514 9.522 -0.069 1.00 0.00 C ATOM 1445 CD GLU A 896 -0.324 8.762 -1.101 1.00 0.00 C ATOM 1446 OE1 GLU A 896 -1.168 7.982 -0.691 1.00 0.00 O ATOM 1447 OE2 GLU A 896 -0.109 8.974 -2.282 1.00 0.00 O ATOM 0 H GLU A 896 1.894 10.186 2.608 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.876 9.899 2.020 1.00 0.00 H new ATOM 0 HB2 GLU A 896 1.761 8.555 1.411 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.315 7.653 1.001 1.00 0.00 H new ATOM 0 HG2 GLU A 896 0.023 10.459 0.195 1.00 0.00 H new ATOM 0 HG3 GLU A 896 1.485 9.780 -0.493 1.00 0.00 H new ATOM 1454 N LEU A 897 0.264 7.464 3.956 1.00 0.00 N ATOM 1455 CA LEU A 897 -0.300 6.456 4.896 1.00 0.00 C ATOM 1456 C LEU A 897 -0.809 7.180 6.130 1.00 0.00 C ATOM 1457 O LEU A 897 -1.897 6.943 6.612 1.00 0.00 O ATOM 1458 CB LEU A 897 0.838 5.508 5.259 1.00 0.00 C ATOM 1459 CG LEU A 897 0.337 4.432 6.243 1.00 0.00 C ATOM 1460 CD1 LEU A 897 0.690 4.852 7.671 1.00 0.00 C ATOM 1461 CD2 LEU A 897 -1.190 4.263 6.133 1.00 0.00 C ATOM 0 H LEU A 897 1.281 7.494 3.881 1.00 0.00 H new ATOM 0 HA LEU A 897 -1.127 5.899 4.457 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.229 5.035 4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 897 1.659 6.068 5.707 1.00 0.00 H new ATOM 0 HG LEU A 897 0.816 3.484 5.997 1.00 0.00 H new ATOM 0 HD11 LEU A 897 0.338 4.094 8.371 1.00 0.00 H new ATOM 0 HD12 LEU A 897 1.771 4.956 7.763 1.00 0.00 H new ATOM 0 HD13 LEU A 897 0.213 5.805 7.898 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -1.523 3.499 6.836 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -1.679 5.209 6.367 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -1.451 3.961 5.119 1.00 0.00 H new ATOM 1473 N LYS A 898 -0.041 8.103 6.603 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.460 8.923 7.772 1.00 0.00 C ATOM 1475 C LYS A 898 -1.840 9.475 7.497 1.00 0.00 C ATOM 1476 O LYS A 898 -2.636 9.718 8.383 1.00 0.00 O ATOM 1477 CB LYS A 898 0.529 10.072 7.791 1.00 0.00 C ATOM 1478 CG LYS A 898 0.145 11.093 8.870 1.00 0.00 C ATOM 1479 CD LYS A 898 0.014 10.398 10.229 1.00 0.00 C ATOM 1480 CE LYS A 898 1.370 9.822 10.645 1.00 0.00 C ATOM 1481 NZ LYS A 898 1.170 9.337 12.038 1.00 0.00 N ATOM 0 H LYS A 898 0.879 8.334 6.227 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.480 8.363 8.707 1.00 0.00 H new ATOM 0 HB2 LYS A 898 1.533 9.693 7.982 1.00 0.00 H new ATOM 0 HB3 LYS A 898 0.552 10.557 6.815 1.00 0.00 H new ATOM 0 HG2 LYS A 898 0.900 11.877 8.925 1.00 0.00 H new ATOM 0 HG3 LYS A 898 -0.797 11.575 8.607 1.00 0.00 H new ATOM 0 HD2 LYS A 898 -0.337 11.107 10.979 1.00 0.00 H new ATOM 0 HD3 LYS A 898 -0.728 9.602 10.171 1.00 0.00 H new ATOM 0 HE2 LYS A 898 1.674 9.010 9.984 1.00 0.00 H new ATOM 0 HE3 LYS A 898 2.152 10.580 10.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 2.057 8.927 12.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 0.888 10.133 12.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 0.425 8.612 12.049 1.00 0.00 H new ATOM 1495 N ALA A 899 -2.113 9.645 6.248 1.00 0.00 N ATOM 1496 CA ALA A 899 -3.439 10.156 5.837 1.00 0.00 C ATOM 1497 C ALA A 899 -4.364 8.948 5.735 1.00 0.00 C ATOM 1498 O ALA A 899 -5.556 9.030 5.949 1.00 0.00 O ATOM 1499 CB ALA A 899 -3.197 10.829 4.479 1.00 0.00 C ATOM 0 H ALA A 899 -1.468 9.450 5.482 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.895 10.869 6.524 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -4.135 11.236 4.102 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.473 11.635 4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.811 10.094 3.772 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.786 7.823 5.409 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.540 6.560 5.276 1.00 0.00 C ATOM 1507 C ARG A 900 -5.549 6.742 4.188 1.00 0.00 C ATOM 1508 O ARG A 900 -6.566 6.078 4.118 1.00 0.00 O ATOM 1509 CB ARG A 900 -5.160 6.280 6.663 1.00 0.00 C ATOM 1510 CG ARG A 900 -6.677 6.515 6.655 1.00 0.00 C ATOM 1511 CD ARG A 900 -7.177 6.668 8.094 1.00 0.00 C ATOM 1512 NE ARG A 900 -8.624 6.324 8.035 1.00 0.00 N ATOM 1513 CZ ARG A 900 -8.994 5.078 7.905 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -9.432 4.644 6.755 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -8.925 4.269 8.926 1.00 0.00 N ATOM 0 H ARG A 900 -2.787 7.734 5.225 1.00 0.00 H new ATOM 0 HA ARG A 900 -3.930 5.702 4.995 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -4.951 5.251 6.956 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -4.694 6.924 7.408 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.914 7.410 6.079 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -7.183 5.680 6.170 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -6.640 6.004 8.771 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -7.027 7.684 8.458 1.00 0.00 H new ATOM 0 HE ARG A 900 -9.326 7.061 8.096 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -9.485 5.278 5.958 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -9.721 3.671 6.654 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -8.582 4.610 9.824 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -9.214 3.296 8.826 1.00 0.00 H new ATOM 1529 N LYS A 901 -5.240 7.626 3.304 1.00 0.00 N ATOM 1530 CA LYS A 901 -6.145 7.841 2.191 1.00 0.00 C ATOM 1531 C LYS A 901 -5.706 6.929 1.063 1.00 0.00 C ATOM 1532 O LYS A 901 -6.511 6.310 0.396 1.00 0.00 O ATOM 1533 CB LYS A 901 -6.033 9.326 1.811 1.00 0.00 C ATOM 1534 CG LYS A 901 -4.570 9.718 1.561 1.00 0.00 C ATOM 1535 CD LYS A 901 -4.461 11.242 1.469 1.00 0.00 C ATOM 1536 CE LYS A 901 -5.146 11.733 0.190 1.00 0.00 C ATOM 1537 NZ LYS A 901 -6.275 12.585 0.660 1.00 0.00 N ATOM 0 H LYS A 901 -4.399 8.203 3.312 1.00 0.00 H new ATOM 0 HA LYS A 901 -7.184 7.613 2.427 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -6.624 9.522 0.917 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -6.448 9.942 2.609 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -3.939 9.345 2.368 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -4.212 9.260 0.639 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -4.925 11.703 2.341 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -3.413 11.542 1.470 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -4.456 12.301 -0.434 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -5.505 10.898 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -6.793 12.959 -0.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -6.919 12.016 1.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -5.902 13.376 1.223 1.00 0.00 H new ATOM 1551 N ILE A 902 -4.412 6.832 0.872 1.00 0.00 N ATOM 1552 CA ILE A 902 -3.852 5.933 -0.202 1.00 0.00 C ATOM 1553 C ILE A 902 -4.848 5.709 -1.373 1.00 0.00 C ATOM 1554 O ILE A 902 -5.113 4.574 -1.717 1.00 0.00 O ATOM 1555 CB ILE A 902 -3.533 4.610 0.501 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -2.503 4.862 1.603 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -2.952 3.609 -0.506 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -3.224 5.224 2.900 1.00 0.00 C ATOM 0 H ILE A 902 -3.711 7.337 1.414 1.00 0.00 H new ATOM 0 HA ILE A 902 -2.971 6.384 -0.659 1.00 0.00 H new ATOM 0 HB ILE A 902 -4.449 4.202 0.929 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -1.889 3.974 1.751 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -1.831 5.669 1.310 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -2.728 2.671 0.002 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -3.678 3.428 -1.299 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -2.037 4.016 -0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -2.491 5.404 3.686 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -3.819 6.124 2.746 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -3.877 4.403 3.194 1.00 0.00 H new ATOM 1570 N PRO A 903 -5.395 6.763 -1.951 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.365 6.578 -3.063 1.00 0.00 C ATOM 1572 C PRO A 903 -5.648 6.087 -4.317 1.00 0.00 C ATOM 1573 O PRO A 903 -5.468 6.832 -5.263 1.00 0.00 O ATOM 1574 CB PRO A 903 -6.903 7.993 -3.281 1.00 0.00 C ATOM 1575 CG PRO A 903 -6.207 8.941 -2.288 1.00 0.00 C ATOM 1576 CD PRO A 903 -5.100 8.162 -1.560 1.00 0.00 C ATOM 0 HA PRO A 903 -7.141 5.845 -2.845 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -6.717 8.315 -4.306 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -7.982 8.015 -3.132 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -5.784 9.796 -2.815 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -6.928 9.333 -1.571 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -4.105 8.473 -1.879 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -5.146 8.302 -0.480 1.00 0.00 H new ATOM 1583 N ILE A 904 -5.223 4.855 -4.349 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.522 4.383 -5.556 1.00 0.00 C ATOM 1585 C ILE A 904 -4.562 2.865 -5.702 1.00 0.00 C ATOM 1586 O ILE A 904 -4.626 2.115 -4.749 1.00 0.00 O ATOM 1587 CB ILE A 904 -3.092 4.920 -5.413 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -2.885 6.031 -6.435 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -2.071 3.817 -5.670 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -2.069 7.162 -5.812 1.00 0.00 C ATOM 0 H ILE A 904 -5.332 4.170 -3.601 1.00 0.00 H new ATOM 0 HA ILE A 904 -5.001 4.745 -6.466 1.00 0.00 H new ATOM 0 HB ILE A 904 -2.954 5.294 -4.399 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.370 5.639 -7.312 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -3.849 6.410 -6.774 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -1.064 4.221 -5.563 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -2.217 3.011 -4.951 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -2.201 3.429 -6.680 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -1.924 7.954 -6.547 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.601 7.562 -4.949 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -1.099 6.779 -5.495 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.500 2.439 -6.926 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.503 0.996 -7.252 1.00 0.00 C ATOM 1604 C ILE A 905 -3.060 0.488 -7.313 1.00 0.00 C ATOM 1605 O ILE A 905 -2.148 1.225 -7.636 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.166 0.920 -8.632 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.310 -0.543 -9.053 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.316 1.664 -9.669 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.778 -0.836 -9.347 1.00 0.00 C ATOM 0 H ILE A 905 -4.446 3.053 -7.739 1.00 0.00 H new ATOM 0 HA ILE A 905 -5.027 0.388 -6.515 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.150 1.385 -8.575 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.703 -0.742 -9.936 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -4.947 -1.199 -8.262 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.797 1.603 -10.645 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.219 2.710 -9.377 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.327 1.209 -9.723 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.888 -1.878 -9.648 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.372 -0.652 -8.452 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -7.124 -0.187 -10.152 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.849 -0.758 -7.016 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.479 -1.325 -7.057 1.00 0.00 C ATOM 1623 C ILE A 906 -1.528 -2.653 -7.800 1.00 0.00 C ATOM 1624 O ILE A 906 -2.491 -3.383 -7.718 1.00 0.00 O ATOM 1625 CB ILE A 906 -1.090 -1.543 -5.585 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.352 -0.314 -5.068 1.00 0.00 C ATOM 1627 CG2 ILE A 906 -0.164 -2.758 -5.451 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.320 0.863 -4.952 1.00 0.00 C ATOM 0 H ILE A 906 -3.578 -1.417 -6.743 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.761 -0.680 -7.564 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.999 -1.713 -5.008 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.092 -0.528 -4.096 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.465 -0.059 -5.743 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.102 -2.899 -4.403 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.676 -3.648 -5.818 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.741 -2.592 -6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -0.786 1.738 -4.582 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -1.743 1.084 -5.932 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -2.122 0.608 -4.259 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.506 -2.983 -8.517 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.540 -4.286 -9.241 1.00 0.00 C ATOM 1642 C ARG A 907 0.202 -5.336 -8.462 1.00 0.00 C ATOM 1643 O ARG A 907 1.411 -5.342 -8.394 1.00 0.00 O ATOM 1644 CB ARG A 907 0.124 -4.048 -10.571 1.00 0.00 C ATOM 1645 CG ARG A 907 -0.902 -3.419 -11.499 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.332 -2.045 -10.963 1.00 0.00 C ATOM 1647 NE ARG A 907 -1.545 -1.209 -12.177 1.00 0.00 N ATOM 1648 CZ ARG A 907 -2.639 -1.342 -12.876 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -3.603 -0.472 -12.751 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -2.767 -2.344 -13.702 1.00 0.00 N ATOM 0 H ARG A 907 0.340 -2.426 -8.638 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.562 -4.642 -9.369 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.987 -3.392 -10.455 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.491 -4.986 -10.988 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.481 -3.312 -12.499 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -1.771 -4.071 -11.587 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.244 -2.120 -10.370 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.566 -1.616 -10.317 1.00 0.00 H new ATOM 0 HE ARG A 907 -0.836 -0.533 -12.462 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -3.502 0.312 -12.107 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -4.458 -0.576 -13.297 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -2.012 -3.023 -13.801 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -3.622 -2.448 -14.249 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.525 -6.234 -7.892 1.00 0.00 N ATOM 1665 CA ARG A 908 0.122 -7.312 -7.117 1.00 0.00 C ATOM 1666 C ARG A 908 0.477 -8.459 -8.071 1.00 0.00 C ATOM 1667 O ARG A 908 -0.312 -9.364 -8.270 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.954 -7.780 -6.119 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.087 -6.826 -4.918 1.00 0.00 C ATOM 1670 CD ARG A 908 -1.982 -7.475 -3.828 1.00 0.00 C ATOM 1671 NE ARG A 908 -1.034 -7.895 -2.756 1.00 0.00 N ATOM 1672 CZ ARG A 908 -1.470 -8.573 -1.729 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.624 -8.279 -1.193 1.00 0.00 N ATOM 1674 NH2 ARG A 908 -0.751 -9.543 -1.237 1.00 0.00 N ATOM 0 H ARG A 908 -1.544 -6.271 -7.927 1.00 0.00 H new ATOM 0 HA ARG A 908 1.033 -6.988 -6.615 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -1.914 -7.854 -6.630 1.00 0.00 H new ATOM 0 HB3 ARG A 908 -0.706 -8.779 -5.761 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -0.102 -6.603 -4.508 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -1.520 -5.879 -5.240 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -2.719 -6.767 -3.449 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.533 -8.328 -4.225 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.046 -7.653 -2.825 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -3.186 -7.519 -1.577 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.964 -8.809 -0.391 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.151 -9.771 -1.654 1.00 0.00 H new ATOM 0 HH22 ARG A 908 -1.091 -10.073 -0.435 1.00 0.00 H new ATOM 1688 N TYR A 909 1.659 -8.460 -8.640 1.00 0.00 N ATOM 1689 CA TYR A 909 2.032 -9.576 -9.528 1.00 0.00 C ATOM 1690 C TYR A 909 2.600 -10.683 -8.665 1.00 0.00 C ATOM 1691 O TYR A 909 2.696 -10.559 -7.460 1.00 0.00 O ATOM 1692 CB TYR A 909 3.126 -9.112 -10.497 1.00 0.00 C ATOM 1693 CG TYR A 909 2.952 -7.683 -10.965 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.543 -6.623 -10.264 1.00 0.00 C ATOM 1695 CD2 TYR A 909 2.257 -7.427 -12.146 1.00 0.00 C ATOM 1696 CE1 TYR A 909 3.437 -5.322 -10.744 1.00 0.00 C ATOM 1697 CE2 TYR A 909 2.139 -6.125 -12.621 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.731 -5.070 -11.928 1.00 0.00 C ATOM 1699 OH TYR A 909 2.624 -3.785 -12.419 1.00 0.00 O ATOM 0 H TYR A 909 2.368 -7.737 -8.522 1.00 0.00 H new ATOM 0 HA TYR A 909 1.163 -9.918 -10.090 1.00 0.00 H new ATOM 0 HB2 TYR A 909 4.097 -9.211 -10.011 1.00 0.00 H new ATOM 0 HB3 TYR A 909 3.135 -9.772 -11.365 1.00 0.00 H new ATOM 0 HD1 TYR A 909 4.082 -6.817 -9.349 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.809 -8.242 -12.694 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.898 -4.507 -10.205 1.00 0.00 H new ATOM 0 HE2 TYR A 909 1.587 -5.931 -13.529 1.00 0.00 H new ATOM 0 HH TYR A 909 3.354 -3.614 -13.050 1.00 0.00 H new ATOM 1709 N LEU A 910 2.988 -11.755 -9.265 1.00 0.00 N ATOM 1710 CA LEU A 910 3.551 -12.866 -8.482 1.00 0.00 C ATOM 1711 C LEU A 910 4.807 -13.433 -9.142 1.00 0.00 C ATOM 1712 O LEU A 910 4.736 -14.022 -10.203 1.00 0.00 O ATOM 1713 CB LEU A 910 2.437 -13.906 -8.466 1.00 0.00 C ATOM 1714 CG LEU A 910 1.212 -13.355 -7.737 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.144 -14.448 -7.659 1.00 0.00 C ATOM 1716 CD2 LEU A 910 1.596 -12.913 -6.321 1.00 0.00 C ATOM 0 H LEU A 910 2.939 -11.911 -10.272 1.00 0.00 H new ATOM 0 HA LEU A 910 3.856 -12.554 -7.483 1.00 0.00 H new ATOM 0 HB2 LEU A 910 2.170 -14.179 -9.487 1.00 0.00 H new ATOM 0 HB3 LEU A 910 2.784 -14.814 -7.974 1.00 0.00 H new ATOM 0 HG LEU A 910 0.824 -12.494 -8.282 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.734 -14.063 -7.140 1.00 0.00 H new ATOM 0 HD12 LEU A 910 -0.136 -14.756 -8.666 1.00 0.00 H new ATOM 0 HD13 LEU A 910 0.540 -15.305 -7.115 1.00 0.00 H new ATOM 0 HD21 LEU A 910 0.716 -12.522 -5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 910 1.988 -13.766 -5.767 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.358 -12.136 -6.377 1.00 0.00 H new ATOM 1728 N PRO A 911 5.923 -13.279 -8.466 1.00 0.00 N ATOM 1729 CA PRO A 911 7.194 -13.832 -8.971 1.00 0.00 C ATOM 1730 C PRO A 911 7.056 -15.354 -9.033 1.00 0.00 C ATOM 1731 O PRO A 911 7.867 -16.049 -9.612 1.00 0.00 O ATOM 1732 CB PRO A 911 8.200 -13.417 -7.891 1.00 0.00 C ATOM 1733 CG PRO A 911 7.448 -12.644 -6.789 1.00 0.00 C ATOM 1734 CD PRO A 911 5.968 -12.553 -7.177 1.00 0.00 C ATOM 0 HA PRO A 911 7.486 -13.487 -9.963 1.00 0.00 H new ATOM 0 HB2 PRO A 911 8.688 -14.296 -7.471 1.00 0.00 H new ATOM 0 HB3 PRO A 911 8.983 -12.794 -8.323 1.00 0.00 H new ATOM 0 HG2 PRO A 911 7.557 -13.151 -5.830 1.00 0.00 H new ATOM 0 HG3 PRO A 911 7.870 -11.646 -6.672 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.324 -13.016 -6.429 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.640 -11.519 -7.283 1.00 0.00 H new ATOM 1741 N ASP A 912 6.005 -15.866 -8.436 1.00 0.00 N ATOM 1742 CA ASP A 912 5.766 -17.330 -8.447 1.00 0.00 C ATOM 1743 C ASP A 912 5.224 -17.738 -9.808 1.00 0.00 C ATOM 1744 O ASP A 912 5.554 -18.785 -10.330 1.00 0.00 O ATOM 1745 CB ASP A 912 4.710 -17.563 -7.367 1.00 0.00 C ATOM 1746 CG ASP A 912 5.393 -17.952 -6.055 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.005 -17.088 -5.450 1.00 0.00 O ATOM 1748 OD2 ASP A 912 5.293 -19.109 -5.680 1.00 0.00 O ATOM 0 H ASP A 912 5.301 -15.320 -7.939 1.00 0.00 H new ATOM 0 HA ASP A 912 6.671 -17.908 -8.262 1.00 0.00 H new ATOM 0 HB2 ASP A 912 4.115 -16.661 -7.225 1.00 0.00 H new ATOM 0 HB3 ASP A 912 4.024 -18.351 -7.679 1.00 0.00 H new ATOM 1753 N GLY A 913 4.397 -16.913 -10.394 1.00 0.00 N ATOM 1754 CA GLY A 913 3.845 -17.267 -11.736 1.00 0.00 C ATOM 1755 C GLY A 913 2.381 -16.874 -11.820 1.00 0.00 C ATOM 1756 O GLY A 913 1.524 -17.646 -12.201 1.00 0.00 O ATOM 0 H GLY A 913 4.083 -16.022 -10.009 1.00 0.00 H new ATOM 0 HA2 GLY A 913 4.411 -16.758 -12.516 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.953 -18.337 -11.911 1.00 0.00 H new ATOM 1760 N SER A 914 2.112 -15.667 -11.471 1.00 0.00 N ATOM 1761 CA SER A 914 0.721 -15.140 -11.514 1.00 0.00 C ATOM 1762 C SER A 914 0.764 -13.644 -11.291 1.00 0.00 C ATOM 1763 O SER A 914 1.813 -13.032 -11.350 1.00 0.00 O ATOM 1764 CB SER A 914 -0.019 -15.836 -10.378 1.00 0.00 C ATOM 1765 OG SER A 914 -0.753 -16.936 -10.899 1.00 0.00 O ATOM 0 H SER A 914 2.809 -14.997 -11.147 1.00 0.00 H new ATOM 0 HA SER A 914 0.227 -15.324 -12.468 1.00 0.00 H new ATOM 0 HB2 SER A 914 0.689 -16.181 -9.625 1.00 0.00 H new ATOM 0 HB3 SER A 914 -0.693 -15.135 -9.885 1.00 0.00 H new ATOM 0 HG SER A 914 -0.173 -17.469 -11.482 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.356 -13.047 -11.030 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.375 -11.590 -10.796 1.00 0.00 C ATOM 1773 C TYR A 915 -1.836 -11.105 -10.692 1.00 0.00 C ATOM 1774 O TYR A 915 -2.750 -11.737 -11.182 1.00 0.00 O ATOM 1775 CB TYR A 915 0.329 -10.982 -12.032 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.380 -9.736 -12.527 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.390 -8.568 -11.753 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -1.014 -9.749 -13.776 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.032 -7.418 -12.226 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -1.653 -8.597 -14.250 1.00 0.00 C ATOM 1781 CZ TYR A 915 -1.662 -7.433 -13.474 1.00 0.00 C ATOM 1782 OH TYR A 915 -2.293 -6.298 -13.942 1.00 0.00 O ATOM 0 H TYR A 915 -1.263 -13.510 -10.969 1.00 0.00 H new ATOM 0 HA TYR A 915 0.123 -11.299 -9.871 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.361 -10.737 -11.779 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.364 -11.722 -12.831 1.00 0.00 H new ATOM 0 HD1 TYR A 915 0.099 -8.555 -10.790 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -1.010 -10.648 -14.374 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.041 -6.519 -11.627 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -2.139 -8.607 -15.214 1.00 0.00 H new ATOM 0 HH TYR A 915 -2.678 -6.478 -14.825 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.040 -9.976 -10.083 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.412 -9.401 -9.956 1.00 0.00 C ATOM 1794 C GLU A 916 -3.313 -7.881 -9.806 1.00 0.00 C ATOM 1795 O GLU A 916 -2.394 -7.367 -9.202 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.026 -10.040 -8.714 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.410 -10.588 -9.068 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.455 -9.486 -8.889 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.335 -8.469 -9.551 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.359 -9.677 -8.093 1.00 0.00 O ATOM 0 H GLU A 916 -1.303 -9.413 -9.658 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.028 -9.601 -10.833 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.386 -10.843 -8.348 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.106 -9.305 -7.913 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.418 -10.948 -10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.650 -11.439 -8.430 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.253 -7.163 -10.353 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.221 -5.679 -10.249 1.00 0.00 C ATOM 1809 C ASP A 917 -5.375 -5.200 -9.399 1.00 0.00 C ATOM 1810 O ASP A 917 -6.420 -5.813 -9.333 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.350 -5.162 -11.670 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.659 -5.645 -12.304 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.306 -6.498 -11.717 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -5.992 -5.153 -13.370 1.00 0.00 O ATOM 0 H ASP A 917 -5.046 -7.543 -10.870 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.304 -5.321 -9.781 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.320 -4.072 -11.670 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.504 -5.504 -12.265 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.147 -4.095 -8.766 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.116 -3.425 -7.843 1.00 0.00 C ATOM 1821 C TRP A 918 -5.376 -2.992 -6.595 1.00 0.00 C ATOM 1822 O TRP A 918 -4.219 -3.304 -6.413 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.269 -4.362 -7.472 1.00 0.00 C ATOM 1824 CG TRP A 918 -6.851 -5.711 -6.961 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.612 -6.261 -6.921 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.736 -6.674 -6.386 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.724 -7.566 -6.454 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.029 -7.845 -6.065 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.099 -6.612 -6.132 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.685 -8.944 -5.501 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.760 -7.677 -5.552 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -9.063 -8.856 -5.232 1.00 0.00 C ATOM 0 H TRP A 918 -4.266 -3.588 -8.853 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.545 -2.559 -8.347 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -7.882 -3.876 -6.713 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -7.900 -4.502 -8.350 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.693 -5.769 -7.204 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -4.951 -8.230 -6.404 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.650 -5.720 -6.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.140 -9.849 -5.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -10.817 -7.604 -5.343 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.583 -9.689 -4.782 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.012 -2.262 -5.734 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.290 -1.807 -4.521 1.00 0.00 C ATOM 1845 C GLY A 919 -6.257 -1.220 -3.527 1.00 0.00 C ATOM 1846 O GLY A 919 -6.660 -1.854 -2.577 1.00 0.00 O ATOM 0 H GLY A 919 -6.984 -1.963 -5.812 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -4.758 -2.645 -4.070 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.541 -1.063 -4.793 1.00 0.00 H new ATOM 1850 N VAL A 920 -6.640 -0.014 -3.746 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.597 0.616 -2.815 1.00 0.00 C ATOM 1852 C VAL A 920 -8.868 0.922 -3.573 1.00 0.00 C ATOM 1853 O VAL A 920 -9.861 1.335 -3.004 1.00 0.00 O ATOM 1854 CB VAL A 920 -6.921 1.894 -2.335 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -7.845 2.636 -1.367 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -5.625 1.522 -1.621 1.00 0.00 C ATOM 0 H VAL A 920 -6.336 0.568 -4.527 1.00 0.00 H new ATOM 0 HA VAL A 920 -7.857 -0.020 -1.969 1.00 0.00 H new ATOM 0 HB VAL A 920 -6.706 2.541 -3.185 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.357 3.549 -1.026 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -8.776 2.889 -1.875 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.061 1.999 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.129 2.428 -1.271 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -5.850 0.880 -0.770 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -4.968 0.992 -2.311 1.00 0.00 H new ATOM 1866 N ASP A 921 -8.856 0.704 -4.860 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.090 0.970 -5.631 1.00 0.00 C ATOM 1868 C ASP A 921 -10.970 -0.269 -5.608 1.00 0.00 C ATOM 1869 O ASP A 921 -12.153 -0.218 -5.885 1.00 0.00 O ATOM 1870 CB ASP A 921 -9.634 1.335 -7.048 1.00 0.00 C ATOM 1871 CG ASP A 921 -10.404 2.570 -7.526 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -11.601 2.622 -7.297 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -9.783 3.441 -8.109 1.00 0.00 O ATOM 0 H ASP A 921 -8.060 0.360 -5.397 1.00 0.00 H new ATOM 0 HA ASP A 921 -10.684 1.783 -5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -8.562 1.534 -7.057 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.809 0.499 -7.725 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.393 -1.377 -5.268 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.157 -2.635 -5.204 1.00 0.00 C ATOM 1880 C GLU A 922 -10.950 -3.296 -3.835 1.00 0.00 C ATOM 1881 O GLU A 922 -11.693 -4.170 -3.434 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.545 -3.458 -6.322 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.567 -4.477 -6.832 1.00 0.00 C ATOM 1884 CD GLU A 922 -11.213 -4.883 -8.264 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -10.837 -4.010 -9.030 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -11.325 -6.058 -8.570 1.00 0.00 O ATOM 0 H GLU A 922 -9.405 -1.463 -5.028 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.234 -2.513 -5.318 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.230 -2.806 -7.136 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.653 -3.972 -5.962 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.575 -5.355 -6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.569 -4.049 -6.801 1.00 0.00 H new ATOM 1893 N LEU A 923 -9.925 -2.888 -3.123 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.643 -3.497 -1.784 1.00 0.00 C ATOM 1895 C LEU A 923 -8.976 -2.508 -0.808 1.00 0.00 C ATOM 1896 O LEU A 923 -9.196 -1.314 -0.843 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.735 -4.704 -2.057 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.668 -4.348 -3.090 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.269 -4.451 -2.511 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.768 -5.330 -4.201 1.00 0.00 C ATOM 0 H LEU A 923 -9.272 -2.160 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.573 -3.788 -1.296 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.259 -5.026 -1.130 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.332 -5.542 -2.416 1.00 0.00 H new ATOM 0 HG LEU A 923 -7.834 -3.323 -3.421 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.538 -4.190 -3.277 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.172 -3.766 -1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.090 -5.471 -2.171 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.017 -5.102 -4.957 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.600 -6.335 -3.814 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.761 -5.274 -4.648 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.217 -3.050 0.100 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.540 -2.263 1.184 1.00 0.00 C ATOM 1914 C ILE A 924 -6.352 -1.434 0.723 1.00 0.00 C ATOM 1915 O ILE A 924 -5.845 -1.551 -0.363 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.108 -3.306 2.233 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.153 -3.299 3.328 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -5.719 -3.023 2.830 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.326 -4.132 2.840 1.00 0.00 C ATOM 0 H ILE A 924 -8.026 -4.051 0.142 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.233 -1.519 1.575 1.00 0.00 H new ATOM 0 HB ILE A 924 -7.032 -4.279 1.748 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -7.746 -3.713 4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -8.471 -2.280 3.549 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.474 -3.793 3.561 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -4.973 -3.027 2.035 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -5.724 -2.048 3.317 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.102 -4.151 3.605 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -9.728 -3.695 1.926 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -8.991 -5.149 2.638 1.00 0.00 H new ATOM 1931 N ILE A 925 -5.925 -0.603 1.614 1.00 0.00 N ATOM 1932 CA ILE A 925 -4.745 0.272 1.393 1.00 0.00 C ATOM 1933 C ILE A 925 -3.539 -0.410 2.046 1.00 0.00 C ATOM 1934 O ILE A 925 -3.231 -1.550 1.767 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.115 1.599 2.082 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.454 1.350 3.557 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -6.335 2.213 1.387 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -4.947 2.521 4.404 1.00 0.00 C ATOM 0 H ILE A 925 -6.362 -0.486 2.528 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.492 0.449 0.348 1.00 0.00 H new ATOM 0 HB ILE A 925 -4.266 2.280 2.016 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.531 1.239 3.679 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -4.997 0.419 3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.597 3.152 1.874 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -6.101 2.401 0.339 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -7.176 1.523 1.452 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -5.188 2.343 5.452 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -3.867 2.611 4.291 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -5.425 3.443 4.073 1.00 0.00 H new ATOM 1950 N THR A 926 -2.877 0.263 2.916 1.00 0.00 N ATOM 1951 CA THR A 926 -1.702 -0.346 3.608 1.00 0.00 C ATOM 1952 C THR A 926 -2.168 -1.513 4.478 1.00 0.00 C ATOM 1953 O THR A 926 -1.511 -2.531 4.581 1.00 0.00 O ATOM 1954 CB THR A 926 -1.156 0.772 4.498 1.00 0.00 C ATOM 1955 OG1 THR A 926 -1.246 2.011 3.811 1.00 0.00 O ATOM 1956 CG2 THR A 926 0.300 0.479 4.862 1.00 0.00 C ATOM 0 H THR A 926 -3.090 1.222 3.191 1.00 0.00 H new ATOM 0 HA THR A 926 -0.956 -0.727 2.910 1.00 0.00 H new ATOM 0 HB THR A 926 -1.744 0.827 5.414 1.00 0.00 H new ATOM 0 HG1 THR A 926 -1.260 1.849 2.845 1.00 0.00 H new ATOM 0 HG21 THR A 926 0.684 1.278 5.496 1.00 0.00 H new ATOM 0 HG22 THR A 926 0.358 -0.469 5.398 1.00 0.00 H new ATOM 0 HG23 THR A 926 0.897 0.418 3.952 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.306 -1.371 5.095 1.00 0.00 N ATOM 1965 CA ASP A 927 -3.849 -2.462 5.962 1.00 0.00 C ATOM 1966 C ASP A 927 -5.220 -2.059 6.512 1.00 0.00 C ATOM 1967 O ASP A 927 -5.948 -1.385 5.800 1.00 0.00 O ATOM 1968 CB ASP A 927 -2.840 -2.621 7.105 1.00 0.00 C ATOM 1969 CG ASP A 927 -2.642 -1.279 7.821 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -3.327 -0.332 7.470 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -1.807 -1.224 8.708 1.00 0.00 O ATOM 1972 OXT ASP A 927 -5.520 -2.431 7.635 1.00 0.00 O ATOM 0 H ASP A 927 -3.892 -0.538 5.038 1.00 0.00 H new ATOM 0 HA ASP A 927 -3.981 -3.394 5.412 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -3.194 -3.371 7.812 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -1.887 -2.977 6.713 1.00 0.00 H new