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= -0.0633 K(o=-0.063,f=-0.78) USER MOD Single : A 835 ASN : amide:sc= -5.9 K(o=-5.9,f=-10!) USER MOD Single : A 841 SER OG : rot 180:sc= 0 USER MOD Single : A 853 THR OG1 : rot 112:sc= -4.28! USER MOD Single : A 854 THR OG1 : rot 180:sc= 0 USER MOD Single : A 856 TYR OH : rot 164:sc= -3.83 USER MOD Single : A 857 MET CE :methyl 172:sc= -14.8! (180deg=-15.3!) USER MOD Single : A 858 THR OG1 : rot 30:sc= -0.467 USER MOD Single : A 859 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 860 TYR OH : rot 165:sc= -0.705 USER MOD Single : A 868 THR OG1 : rot 180:sc= 0 USER MOD Single : A 872 GLN : amide:sc= -2.19 K(o=-2.2,f=-13!) 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 -129:sc= -0.455 (180deg=-2.82!) USER MOD Single : A 887 THR OG1 : rot -36:sc= -0.726! USER MOD Single : A 894 MET CE :methyl -123:sc= -4.47! (180deg=-7.87!) 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= -4.67! USER MOD Single : A 914 SER OG : rot 180:sc= -0.521 USER MOD Single : A 915 TYR OH : rot 180:sc= 0 USER MOD Single : A 926 THR OG1 : rot 86:sc= -6.96! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 6.812 -11.058 -0.668 1.00 0.00 N ATOM 439 CA GLN A 833 7.159 -11.661 -1.986 1.00 0.00 C ATOM 440 C GLN A 833 5.963 -11.567 -2.931 1.00 0.00 C ATOM 441 O GLN A 833 5.163 -12.476 -3.036 1.00 0.00 O ATOM 442 CB GLN A 833 7.493 -13.125 -1.706 1.00 0.00 C ATOM 443 CG GLN A 833 7.876 -13.801 -3.022 1.00 0.00 C ATOM 444 CD GLN A 833 8.281 -15.252 -2.758 1.00 0.00 C ATOM 445 OE1 GLN A 833 8.899 -15.549 -1.755 1.00 0.00 O ATOM 446 NE2 GLN A 833 7.956 -16.176 -3.621 1.00 0.00 N ATOM 0 HA GLN A 833 7.995 -11.145 -2.457 1.00 0.00 H new ATOM 0 HB2 GLN A 833 8.314 -13.195 -0.992 1.00 0.00 H new ATOM 0 HB3 GLN A 833 6.637 -13.629 -1.258 1.00 0.00 H new ATOM 0 HG2 GLN A 833 7.036 -13.768 -3.716 1.00 0.00 H new ATOM 0 HG3 GLN A 833 8.699 -13.263 -3.492 1.00 0.00 H new ATOM 0 HE21 GLN A 833 7.437 -15.927 -4.463 1.00 0.00 H new ATOM 0 HE22 GLN A 833 8.221 -17.147 -3.453 1.00 0.00 H new ATOM 455 N GLU A 834 5.841 -10.471 -3.616 1.00 0.00 N ATOM 456 CA GLU A 834 4.720 -10.283 -4.559 1.00 0.00 C ATOM 457 C GLU A 834 5.114 -9.188 -5.536 1.00 0.00 C ATOM 458 O GLU A 834 5.302 -8.050 -5.150 1.00 0.00 O ATOM 459 CB GLU A 834 3.538 -9.841 -3.693 1.00 0.00 C ATOM 460 CG GLU A 834 2.296 -10.644 -4.076 1.00 0.00 C ATOM 461 CD GLU A 834 1.188 -10.396 -3.051 1.00 0.00 C ATOM 462 OE1 GLU A 834 1.421 -10.660 -1.882 1.00 0.00 O ATOM 463 OE2 GLU A 834 0.127 -9.947 -3.452 1.00 0.00 O ATOM 0 H GLU A 834 6.486 -9.683 -3.558 1.00 0.00 H new ATOM 0 HA GLU A 834 4.470 -11.178 -5.129 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.770 -9.991 -2.639 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.352 -8.776 -3.830 1.00 0.00 H new ATOM 0 HG2 GLU A 834 1.956 -10.355 -5.071 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.536 -11.706 -4.117 1.00 0.00 H new ATOM 470 N ASN A 835 5.237 -9.500 -6.798 1.00 0.00 N ATOM 471 CA ASN A 835 5.613 -8.432 -7.763 1.00 0.00 C ATOM 472 C ASN A 835 4.550 -7.380 -7.636 1.00 0.00 C ATOM 473 O ASN A 835 3.381 -7.665 -7.642 1.00 0.00 O ATOM 474 CB ASN A 835 5.639 -9.007 -9.184 1.00 0.00 C ATOM 475 CG ASN A 835 6.243 -10.414 -9.185 1.00 0.00 C ATOM 476 OD1 ASN A 835 7.130 -10.703 -8.408 1.00 0.00 O ATOM 477 ND2 ASN A 835 5.807 -11.301 -10.038 1.00 0.00 N ATOM 0 H ASN A 835 5.096 -10.429 -7.195 1.00 0.00 H new ATOM 0 HA ASN A 835 6.602 -8.021 -7.560 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.627 -9.040 -9.588 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.221 -8.355 -9.835 1.00 0.00 H new ATOM 0 HD21 ASN A 835 6.212 -12.237 -10.052 1.00 0.00 H new ATOM 0 HD22 ASN A 835 5.062 -11.058 -10.691 1.00 0.00 H new ATOM 484 N VAL A 836 4.933 -6.194 -7.423 1.00 0.00 N ATOM 485 CA VAL A 836 3.908 -5.147 -7.197 1.00 0.00 C ATOM 486 C VAL A 836 4.088 -3.933 -8.108 1.00 0.00 C ATOM 487 O VAL A 836 5.083 -3.237 -8.052 1.00 0.00 O ATOM 488 CB VAL A 836 4.132 -4.779 -5.732 1.00 0.00 C ATOM 489 CG1 VAL A 836 5.580 -4.348 -5.552 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.220 -3.632 -5.299 1.00 0.00 C ATOM 0 H VAL A 836 5.903 -5.881 -7.391 1.00 0.00 H new ATOM 0 HA VAL A 836 2.899 -5.494 -7.420 1.00 0.00 H new ATOM 0 HB VAL A 836 3.903 -5.651 -5.119 1.00 0.00 H new ATOM 0 HG11 VAL A 836 5.754 -4.082 -4.509 1.00 0.00 H new ATOM 0 HG12 VAL A 836 6.241 -5.168 -5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 836 5.784 -3.485 -6.185 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.405 -3.395 -4.251 1.00 0.00 H new ATOM 0 HG22 VAL A 836 3.425 -2.754 -5.911 1.00 0.00 H new ATOM 0 HG23 VAL A 836 2.179 -3.928 -5.425 1.00 0.00 H new ATOM 500 N GLU A 837 3.103 -3.638 -8.912 1.00 0.00 N ATOM 501 CA GLU A 837 3.201 -2.427 -9.767 1.00 0.00 C ATOM 502 C GLU A 837 2.332 -1.360 -9.123 1.00 0.00 C ATOM 503 O GLU A 837 1.567 -1.653 -8.224 1.00 0.00 O ATOM 504 CB GLU A 837 2.663 -2.819 -11.138 1.00 0.00 C ATOM 505 CG GLU A 837 3.812 -2.860 -12.150 1.00 0.00 C ATOM 506 CD GLU A 837 3.325 -2.325 -13.498 1.00 0.00 C ATOM 507 OE1 GLU A 837 2.700 -1.278 -13.506 1.00 0.00 O ATOM 508 OE2 GLU A 837 3.586 -2.973 -14.499 1.00 0.00 O ATOM 0 H GLU A 837 2.244 -4.179 -9.012 1.00 0.00 H new ATOM 0 HA GLU A 837 4.218 -2.047 -9.869 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.178 -3.794 -11.084 1.00 0.00 H new ATOM 0 HB3 GLU A 837 1.906 -2.104 -11.461 1.00 0.00 H new ATOM 0 HG2 GLU A 837 4.649 -2.261 -11.790 1.00 0.00 H new ATOM 0 HG3 GLU A 837 4.176 -3.881 -12.262 1.00 0.00 H new ATOM 515 N ILE A 838 2.437 -0.137 -9.538 1.00 0.00 N ATOM 516 CA ILE A 838 1.611 0.904 -8.894 1.00 0.00 C ATOM 517 C ILE A 838 1.044 1.860 -9.943 1.00 0.00 C ATOM 518 O ILE A 838 1.678 2.182 -10.928 1.00 0.00 O ATOM 519 CB ILE A 838 2.588 1.619 -7.955 1.00 0.00 C ATOM 520 CG1 ILE A 838 2.894 0.711 -6.744 1.00 0.00 C ATOM 521 CG2 ILE A 838 2.016 2.965 -7.498 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.341 1.316 -5.447 1.00 0.00 C ATOM 0 H ILE A 838 3.052 0.183 -10.286 1.00 0.00 H new ATOM 0 HA ILE A 838 0.749 0.500 -8.362 1.00 0.00 H new ATOM 0 HB ILE A 838 3.516 1.820 -8.491 1.00 0.00 H new ATOM 0 HG12 ILE A 838 2.457 -0.274 -6.905 1.00 0.00 H new ATOM 0 HG13 ILE A 838 3.971 0.571 -6.653 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.726 3.455 -6.832 1.00 0.00 H new ATOM 0 HG22 ILE A 838 1.837 3.598 -8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 838 1.077 2.801 -6.969 1.00 0.00 H new ATOM 0 HD11 ILE A 838 2.571 0.656 -4.611 1.00 0.00 H new ATOM 0 HD12 ILE A 838 2.798 2.291 -5.276 1.00 0.00 H new ATOM 0 HD13 ILE A 838 1.260 1.432 -5.531 1.00 0.00 H new ATOM 534 N LEU A 839 -0.148 2.311 -9.715 1.00 0.00 N ATOM 535 CA LEU A 839 -0.812 3.254 -10.666 1.00 0.00 C ATOM 536 C LEU A 839 -1.984 3.959 -9.962 1.00 0.00 C ATOM 537 O LEU A 839 -2.367 3.568 -8.877 1.00 0.00 O ATOM 538 CB LEU A 839 -1.332 2.368 -11.803 1.00 0.00 C ATOM 539 CG LEU A 839 -0.346 2.391 -12.978 1.00 0.00 C ATOM 540 CD1 LEU A 839 0.444 1.080 -13.012 1.00 0.00 C ATOM 541 CD2 LEU A 839 -1.120 2.546 -14.292 1.00 0.00 C ATOM 0 H LEU A 839 -0.707 2.067 -8.898 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.135 4.028 -11.029 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.464 1.346 -11.448 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -2.310 2.720 -12.131 1.00 0.00 H new ATOM 0 HG LEU A 839 0.341 3.228 -12.855 1.00 0.00 H new ATOM 0 HD11 LEU A 839 1.144 1.098 -13.847 1.00 0.00 H new ATOM 0 HD12 LEU A 839 0.996 0.963 -12.079 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.244 0.244 -13.134 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -0.420 2.562 -15.127 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -1.807 1.708 -14.411 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -1.685 3.478 -14.274 1.00 0.00 H new ATOM 553 N PRO A 840 -2.527 4.973 -10.597 1.00 0.00 N ATOM 554 CA PRO A 840 -3.672 5.710 -10.007 1.00 0.00 C ATOM 555 C PRO A 840 -4.840 4.756 -9.742 1.00 0.00 C ATOM 556 O PRO A 840 -5.162 3.917 -10.562 1.00 0.00 O ATOM 557 CB PRO A 840 -4.020 6.724 -11.096 1.00 0.00 C ATOM 558 CG PRO A 840 -3.051 6.533 -12.280 1.00 0.00 C ATOM 559 CD PRO A 840 -2.041 5.435 -11.918 1.00 0.00 C ATOM 0 HA PRO A 840 -3.448 6.177 -9.048 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -5.050 6.586 -11.425 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -3.943 7.739 -10.705 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -3.603 6.257 -13.179 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -2.532 7.467 -12.498 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -2.037 4.630 -12.653 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -1.024 5.822 -11.863 1.00 0.00 H new ATOM 566 N SER A 841 -5.472 4.872 -8.604 1.00 0.00 N ATOM 567 CA SER A 841 -6.601 3.974 -8.279 1.00 0.00 C ATOM 568 C SER A 841 -7.654 4.046 -9.364 1.00 0.00 C ATOM 569 O SER A 841 -7.938 5.088 -9.921 1.00 0.00 O ATOM 570 CB SER A 841 -7.156 4.483 -6.943 1.00 0.00 C ATOM 571 OG SER A 841 -8.548 4.753 -7.070 1.00 0.00 O ATOM 0 H SER A 841 -5.247 5.559 -7.884 1.00 0.00 H new ATOM 0 HA SER A 841 -6.290 2.932 -8.210 1.00 0.00 H new ATOM 0 HB2 SER A 841 -6.990 3.740 -6.163 1.00 0.00 H new ATOM 0 HB3 SER A 841 -6.627 5.387 -6.640 1.00 0.00 H new ATOM 0 HG SER A 841 -8.898 5.076 -6.214 1.00 0.00 H new ATOM 577 N GLY A 842 -8.234 2.935 -9.648 1.00 0.00 N ATOM 578 CA GLY A 842 -9.298 2.897 -10.697 1.00 0.00 C ATOM 579 C GLY A 842 -9.492 1.478 -11.227 1.00 0.00 C ATOM 580 O GLY A 842 -10.606 1.024 -11.406 1.00 0.00 O ATOM 0 H GLY A 842 -8.027 2.040 -9.206 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -10.236 3.266 -10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -9.029 3.562 -11.518 1.00 0.00 H new ATOM 740 N ILE A 852 -4.847 -14.103 -6.331 1.00 0.00 N ATOM 741 CA ILE A 852 -4.589 -14.461 -4.896 1.00 0.00 C ATOM 742 C ILE A 852 -4.554 -13.221 -4.000 1.00 0.00 C ATOM 743 O ILE A 852 -4.655 -13.327 -2.793 1.00 0.00 O ATOM 744 CB ILE A 852 -3.225 -15.200 -4.863 1.00 0.00 C ATOM 745 CG1 ILE A 852 -2.099 -14.254 -4.401 1.00 0.00 C ATOM 746 CG2 ILE A 852 -2.872 -15.762 -6.245 1.00 0.00 C ATOM 747 CD1 ILE A 852 -1.938 -13.095 -5.391 1.00 0.00 C ATOM 0 HA ILE A 852 -5.392 -15.091 -4.512 1.00 0.00 H new ATOM 0 HB ILE A 852 -3.318 -16.023 -4.154 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -2.326 -13.865 -3.409 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -1.162 -14.805 -4.320 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -1.912 -16.275 -6.195 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -3.643 -16.465 -6.560 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.810 -14.946 -6.965 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.139 -12.435 -5.052 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -1.689 -13.490 -6.376 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -2.871 -12.535 -5.450 1.00 0.00 H new ATOM 759 N THR A 853 -4.402 -12.057 -4.563 1.00 0.00 N ATOM 760 CA THR A 853 -4.352 -10.840 -3.745 1.00 0.00 C ATOM 761 C THR A 853 -5.564 -10.783 -2.850 1.00 0.00 C ATOM 762 O THR A 853 -6.689 -10.674 -3.289 1.00 0.00 O ATOM 763 CB THR A 853 -4.345 -9.713 -4.754 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.396 -9.903 -5.697 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.010 -9.737 -5.478 1.00 0.00 C ATOM 0 H THR A 853 -4.310 -11.906 -5.568 1.00 0.00 H new ATOM 0 HA THR A 853 -3.484 -10.791 -3.088 1.00 0.00 H new ATOM 0 HB THR A 853 -4.491 -8.758 -4.250 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.073 -9.204 -5.578 1.00 0.00 H new ATOM 0 HG21 THR A 853 -2.980 -8.932 -6.213 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.203 -9.601 -4.758 1.00 0.00 H new ATOM 0 HG23 THR A 853 -2.888 -10.695 -5.984 1.00 0.00 H new ATOM 773 N THR A 854 -5.329 -10.868 -1.595 1.00 0.00 N ATOM 774 CA THR A 854 -6.448 -10.830 -0.631 1.00 0.00 C ATOM 775 C THR A 854 -7.230 -9.535 -0.847 1.00 0.00 C ATOM 776 O THR A 854 -6.639 -8.477 -0.854 1.00 0.00 O ATOM 777 CB THR A 854 -5.792 -10.850 0.754 1.00 0.00 C ATOM 778 OG1 THR A 854 -6.803 -10.828 1.752 1.00 0.00 O ATOM 779 CG2 THR A 854 -4.884 -9.628 0.919 1.00 0.00 C ATOM 0 H THR A 854 -4.402 -10.964 -1.181 1.00 0.00 H new ATOM 0 HA THR A 854 -7.142 -11.663 -0.744 1.00 0.00 H new ATOM 0 HB THR A 854 -5.193 -11.755 0.856 1.00 0.00 H new ATOM 0 HG1 THR A 854 -6.387 -10.842 2.639 1.00 0.00 H new ATOM 0 HG21 THR A 854 -4.421 -9.649 1.906 1.00 0.00 H new ATOM 0 HG22 THR A 854 -4.108 -9.645 0.154 1.00 0.00 H new ATOM 0 HG23 THR A 854 -5.476 -8.718 0.815 1.00 0.00 H new ATOM 787 N PRO A 855 -8.528 -9.646 -1.012 1.00 0.00 N ATOM 788 CA PRO A 855 -9.369 -8.443 -1.213 1.00 0.00 C ATOM 789 C PRO A 855 -9.082 -7.485 -0.065 1.00 0.00 C ATOM 790 O PRO A 855 -9.868 -7.323 0.846 1.00 0.00 O ATOM 791 CB PRO A 855 -10.789 -9.016 -1.160 1.00 0.00 C ATOM 792 CG PRO A 855 -10.693 -10.543 -0.946 1.00 0.00 C ATOM 793 CD PRO A 855 -9.213 -10.952 -0.995 1.00 0.00 C ATOM 0 HA PRO A 855 -9.199 -7.887 -2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.354 -8.555 -0.350 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.321 -8.796 -2.085 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.130 -10.819 0.014 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.257 -11.069 -1.716 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -8.927 -11.550 -0.130 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -8.983 -11.544 -1.881 1.00 0.00 H new ATOM 800 N TYR A 856 -7.917 -6.893 -0.099 1.00 0.00 N ATOM 801 CA TYR A 856 -7.467 -5.983 0.976 1.00 0.00 C ATOM 802 C TYR A 856 -6.000 -5.704 0.711 1.00 0.00 C ATOM 803 O TYR A 856 -5.145 -6.526 0.975 1.00 0.00 O ATOM 804 CB TYR A 856 -7.633 -6.771 2.273 1.00 0.00 C ATOM 805 CG TYR A 856 -7.106 -6.005 3.470 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.727 -5.825 3.654 1.00 0.00 C ATOM 807 CD2 TYR A 856 -8.004 -5.500 4.417 1.00 0.00 C ATOM 808 CE1 TYR A 856 -5.253 -5.144 4.779 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.529 -4.814 5.539 1.00 0.00 C ATOM 810 CZ TYR A 856 -6.154 -4.637 5.722 1.00 0.00 C ATOM 811 OH TYR A 856 -5.688 -3.968 6.833 1.00 0.00 O ATOM 0 H TYR A 856 -7.243 -7.012 -0.855 1.00 0.00 H new ATOM 0 HA TYR A 856 -8.017 -5.043 1.028 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.687 -7.002 2.425 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -7.107 -7.722 2.190 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -5.031 -6.213 2.925 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -9.066 -5.640 4.281 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -4.191 -5.009 4.920 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -8.225 -4.420 6.265 1.00 0.00 H new ATOM 0 HH TYR A 856 -6.423 -3.470 7.247 1.00 0.00 H new ATOM 821 N MET A 857 -5.706 -4.585 0.146 1.00 0.00 N ATOM 822 CA MET A 857 -4.289 -4.274 -0.184 1.00 0.00 C ATOM 823 C MET A 857 -3.409 -4.468 1.047 1.00 0.00 C ATOM 824 O MET A 857 -3.897 -4.521 2.158 1.00 0.00 O ATOM 825 CB MET A 857 -4.289 -2.814 -0.606 1.00 0.00 C ATOM 826 CG MET A 857 -2.899 -2.410 -1.109 1.00 0.00 C ATOM 827 SD MET A 857 -2.993 -1.970 -2.860 1.00 0.00 S ATOM 828 CE MET A 857 -3.887 -0.417 -2.642 1.00 0.00 C ATOM 0 H MET A 857 -6.381 -3.863 -0.106 1.00 0.00 H new ATOM 0 HA MET A 857 -3.898 -4.924 -0.966 1.00 0.00 H new ATOM 0 HB2 MET A 857 -5.029 -2.654 -1.391 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.577 -2.184 0.236 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.523 -1.566 -0.531 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.197 -3.231 -0.967 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.936 0.111 -3.594 1.00 0.00 H new ATOM 0 HE2 MET A 857 -4.897 -0.625 -2.290 1.00 0.00 H new ATOM 0 HE3 MET A 857 -3.368 0.202 -1.910 1.00 0.00 H new ATOM 838 N THR A 858 -2.123 -4.586 0.872 1.00 0.00 N ATOM 839 CA THR A 858 -1.253 -4.793 2.061 1.00 0.00 C ATOM 840 C THR A 858 -0.113 -3.789 2.107 1.00 0.00 C ATOM 841 O THR A 858 0.407 -3.368 1.095 1.00 0.00 O ATOM 842 CB THR A 858 -0.753 -6.221 1.918 1.00 0.00 C ATOM 843 OG1 THR A 858 -0.047 -6.360 0.692 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.969 -7.144 1.928 1.00 0.00 C ATOM 0 H THR A 858 -1.643 -4.549 -0.027 1.00 0.00 H new ATOM 0 HA THR A 858 -1.790 -4.641 2.998 1.00 0.00 H new ATOM 0 HB THR A 858 -0.078 -6.476 2.735 1.00 0.00 H new ATOM 0 HG1 THR A 858 0.370 -5.505 0.456 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.641 -8.179 1.827 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.509 -7.025 2.867 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.626 -6.889 1.097 1.00 0.00 H new ATOM 852 N LYS A 859 0.234 -3.386 3.302 1.00 0.00 N ATOM 853 CA LYS A 859 1.317 -2.375 3.518 1.00 0.00 C ATOM 854 C LYS A 859 2.391 -2.344 2.404 1.00 0.00 C ATOM 855 O LYS A 859 2.954 -1.300 2.148 1.00 0.00 O ATOM 856 CB LYS A 859 1.952 -2.771 4.852 1.00 0.00 C ATOM 857 CG LYS A 859 2.575 -4.165 4.733 1.00 0.00 C ATOM 858 CD LYS A 859 3.304 -4.515 6.034 1.00 0.00 C ATOM 859 CE LYS A 859 4.691 -5.075 5.710 1.00 0.00 C ATOM 860 NZ LYS A 859 5.150 -5.720 6.973 1.00 0.00 N ATOM 0 H LYS A 859 -0.199 -3.724 4.161 1.00 0.00 H new ATOM 0 HA LYS A 859 0.893 -1.371 3.509 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.714 -2.044 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.199 -2.765 5.640 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.801 -4.904 4.528 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.272 -4.193 3.895 1.00 0.00 H new ATOM 0 HD2 LYS A 859 3.396 -3.628 6.661 1.00 0.00 H new ATOM 0 HD3 LYS A 859 2.728 -5.247 6.600 1.00 0.00 H new ATOM 0 HE2 LYS A 859 4.645 -5.795 4.893 1.00 0.00 H new ATOM 0 HE3 LYS A 859 5.374 -4.284 5.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 6.096 -6.128 6.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 5.190 -5.009 7.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 4.484 -6.473 7.240 1.00 0.00 H new ATOM 874 N TYR A 860 2.710 -3.436 1.729 1.00 0.00 N ATOM 875 CA TYR A 860 3.755 -3.312 0.669 1.00 0.00 C ATOM 876 C TYR A 860 3.224 -2.459 -0.460 1.00 0.00 C ATOM 877 O TYR A 860 3.859 -1.511 -0.867 1.00 0.00 O ATOM 878 CB TYR A 860 4.085 -4.704 0.157 1.00 0.00 C ATOM 879 CG TYR A 860 5.101 -4.587 -0.980 1.00 0.00 C ATOM 880 CD1 TYR A 860 5.889 -3.426 -1.099 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.253 -5.621 -1.918 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.814 -3.297 -2.132 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.186 -5.485 -2.954 1.00 0.00 C ATOM 884 CZ TYR A 860 6.966 -4.326 -3.058 1.00 0.00 C ATOM 885 OH TYR A 860 7.884 -4.202 -4.082 1.00 0.00 O ATOM 0 H TYR A 860 2.308 -4.364 1.863 1.00 0.00 H new ATOM 0 HA TYR A 860 4.653 -2.844 1.072 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.490 -5.316 0.963 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.181 -5.200 -0.195 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.775 -2.627 -0.381 1.00 0.00 H new ATOM 0 HD2 TYR A 860 4.654 -6.516 -1.841 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.412 -2.401 -2.215 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.305 -6.278 -3.677 1.00 0.00 H new ATOM 0 HH TYR A 860 8.038 -5.079 -4.491 1.00 0.00 H new ATOM 895 N GLU A 861 2.055 -2.764 -0.960 1.00 0.00 N ATOM 896 CA GLU A 861 1.497 -1.909 -2.044 1.00 0.00 C ATOM 897 C GLU A 861 1.670 -0.468 -1.578 1.00 0.00 C ATOM 898 O GLU A 861 2.083 0.404 -2.315 1.00 0.00 O ATOM 899 CB GLU A 861 0.025 -2.289 -2.149 1.00 0.00 C ATOM 900 CG GLU A 861 -0.102 -3.652 -2.832 1.00 0.00 C ATOM 901 CD GLU A 861 -0.162 -4.753 -1.776 1.00 0.00 C ATOM 902 OE1 GLU A 861 0.890 -5.162 -1.314 1.00 0.00 O ATOM 903 OE2 GLU A 861 -1.260 -5.170 -1.448 1.00 0.00 O ATOM 0 H GLU A 861 1.474 -3.551 -0.671 1.00 0.00 H new ATOM 0 HA GLU A 861 1.978 -2.032 -3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.424 -2.324 -1.157 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.517 -1.533 -2.718 1.00 0.00 H new ATOM 0 HG2 GLU A 861 -1.000 -3.678 -3.450 1.00 0.00 H new ATOM 0 HG3 GLU A 861 0.747 -3.817 -3.496 1.00 0.00 H new ATOM 910 N ARG A 862 1.419 -0.258 -0.315 1.00 0.00 N ATOM 911 CA ARG A 862 1.627 1.087 0.290 1.00 0.00 C ATOM 912 C ARG A 862 3.124 1.399 0.279 1.00 0.00 C ATOM 913 O ARG A 862 3.543 2.493 -0.044 1.00 0.00 O ATOM 914 CB ARG A 862 1.146 0.964 1.733 1.00 0.00 C ATOM 915 CG ARG A 862 1.737 2.106 2.576 1.00 0.00 C ATOM 916 CD ARG A 862 2.956 1.594 3.349 1.00 0.00 C ATOM 917 NE ARG A 862 3.272 2.668 4.331 1.00 0.00 N ATOM 918 CZ ARG A 862 4.154 2.457 5.269 1.00 0.00 C ATOM 919 NH1 ARG A 862 4.163 1.324 5.915 1.00 0.00 N ATOM 920 NH2 ARG A 862 5.029 3.381 5.560 1.00 0.00 N ATOM 0 H ARG A 862 1.075 -0.969 0.330 1.00 0.00 H new ATOM 0 HA ARG A 862 1.098 1.874 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 862 0.057 1.000 1.768 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.447 0.001 2.146 1.00 0.00 H new ATOM 0 HG2 ARG A 862 2.025 2.937 1.931 1.00 0.00 H new ATOM 0 HG3 ARG A 862 0.987 2.486 3.270 1.00 0.00 H new ATOM 0 HD2 ARG A 862 2.737 0.652 3.852 1.00 0.00 H new ATOM 0 HD3 ARG A 862 3.798 1.410 2.681 1.00 0.00 H new ATOM 0 HE ARG A 862 2.798 3.569 4.270 1.00 0.00 H new ATOM 0 HH11 ARG A 862 3.480 0.602 5.687 1.00 0.00 H new ATOM 0 HH12 ARG A 862 4.853 1.160 6.648 1.00 0.00 H new ATOM 0 HH21 ARG A 862 5.023 4.267 5.054 1.00 0.00 H new ATOM 0 HH22 ARG A 862 5.719 3.217 6.293 1.00 0.00 H new ATOM 934 N ALA A 863 3.933 0.441 0.641 1.00 0.00 N ATOM 935 CA ALA A 863 5.403 0.694 0.649 1.00 0.00 C ATOM 936 C ALA A 863 5.915 0.859 -0.786 1.00 0.00 C ATOM 937 O ALA A 863 6.958 1.443 -1.030 1.00 0.00 O ATOM 938 CB ALA A 863 6.025 -0.535 1.312 1.00 0.00 C ATOM 0 H ALA A 863 3.646 -0.495 0.928 1.00 0.00 H new ATOM 0 HA ALA A 863 5.661 1.607 1.185 1.00 0.00 H new ATOM 0 HB1 ALA A 863 7.108 -0.418 1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.634 -0.640 2.324 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.778 -1.425 0.733 1.00 0.00 H new ATOM 944 N ARG A 864 5.147 0.424 -1.742 1.00 0.00 N ATOM 945 CA ARG A 864 5.549 0.610 -3.160 1.00 0.00 C ATOM 946 C ARG A 864 5.002 1.971 -3.523 1.00 0.00 C ATOM 947 O ARG A 864 5.634 2.808 -4.133 1.00 0.00 O ATOM 948 CB ARG A 864 4.865 -0.516 -3.938 1.00 0.00 C ATOM 949 CG ARG A 864 5.901 -1.273 -4.772 1.00 0.00 C ATOM 950 CD ARG A 864 6.709 -0.288 -5.628 1.00 0.00 C ATOM 951 NE ARG A 864 6.629 -0.827 -7.014 1.00 0.00 N ATOM 952 CZ ARG A 864 7.723 -1.051 -7.690 1.00 0.00 C ATOM 953 NH1 ARG A 864 7.974 -0.364 -8.770 1.00 0.00 N ATOM 954 NH2 ARG A 864 8.564 -1.965 -7.286 1.00 0.00 N ATOM 0 H ARG A 864 4.256 -0.053 -1.602 1.00 0.00 H new ATOM 0 HA ARG A 864 6.619 0.571 -3.364 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.371 -1.199 -3.248 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.092 -0.105 -4.587 1.00 0.00 H new ATOM 0 HG2 ARG A 864 6.570 -1.831 -4.117 1.00 0.00 H new ATOM 0 HG3 ARG A 864 5.403 -2.000 -5.413 1.00 0.00 H new ATOM 0 HD2 ARG A 864 6.293 0.718 -5.571 1.00 0.00 H new ATOM 0 HD3 ARG A 864 7.743 -0.225 -5.288 1.00 0.00 H new ATOM 0 HE ARG A 864 5.720 -1.021 -7.435 1.00 0.00 H new ATOM 0 HH11 ARG A 864 7.316 0.348 -9.086 1.00 0.00 H new ATOM 0 HH12 ARG A 864 8.829 -0.539 -9.298 1.00 0.00 H new ATOM 0 HH21 ARG A 864 8.366 -2.503 -6.443 1.00 0.00 H new ATOM 0 HH22 ARG A 864 9.419 -2.140 -7.814 1.00 0.00 H new ATOM 968 N VAL A 865 3.821 2.182 -3.029 1.00 0.00 N ATOM 969 CA VAL A 865 3.109 3.467 -3.156 1.00 0.00 C ATOM 970 C VAL A 865 4.034 4.568 -2.680 1.00 0.00 C ATOM 971 O VAL A 865 4.408 5.458 -3.402 1.00 0.00 O ATOM 972 CB VAL A 865 1.968 3.238 -2.169 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.667 4.475 -1.345 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.742 2.793 -2.917 1.00 0.00 C ATOM 0 H VAL A 865 3.297 1.473 -2.515 1.00 0.00 H new ATOM 0 HA VAL A 865 2.779 3.748 -4.156 1.00 0.00 H new ATOM 0 HB VAL A 865 2.277 2.460 -1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.848 4.264 -0.657 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.553 4.759 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.383 5.293 -2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 865 -0.074 2.629 -2.213 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.454 3.562 -3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 865 0.956 1.865 -3.447 1.00 0.00 H new ATOM 984 N LEU A 866 4.416 4.456 -1.455 1.00 0.00 N ATOM 985 CA LEU A 866 5.345 5.412 -0.832 1.00 0.00 C ATOM 986 C LEU A 866 6.533 5.551 -1.757 1.00 0.00 C ATOM 987 O LEU A 866 7.077 6.615 -1.933 1.00 0.00 O ATOM 988 CB LEU A 866 5.710 4.768 0.531 1.00 0.00 C ATOM 989 CG LEU A 866 7.148 4.209 0.541 1.00 0.00 C ATOM 990 CD1 LEU A 866 8.163 5.343 0.723 1.00 0.00 C ATOM 991 CD2 LEU A 866 7.296 3.221 1.704 1.00 0.00 C ATOM 0 H LEU A 866 4.109 3.708 -0.833 1.00 0.00 H new ATOM 0 HA LEU A 866 4.944 6.413 -0.671 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.604 5.510 1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.007 3.964 0.752 1.00 0.00 H new ATOM 0 HG LEU A 866 7.337 3.710 -0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 866 9.172 4.931 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 866 8.065 6.054 -0.097 1.00 0.00 H new ATOM 0 HD13 LEU A 866 7.974 5.852 1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 866 8.310 2.823 1.716 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.096 3.734 2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 866 6.586 2.403 1.579 1.00 0.00 H new ATOM 1003 N GLY A 867 6.919 4.472 -2.372 1.00 0.00 N ATOM 1004 CA GLY A 867 8.047 4.548 -3.311 1.00 0.00 C ATOM 1005 C GLY A 867 7.621 5.333 -4.539 1.00 0.00 C ATOM 1006 O GLY A 867 8.298 6.248 -4.960 1.00 0.00 O ATOM 0 H GLY A 867 6.500 3.549 -2.261 1.00 0.00 H new ATOM 0 HA2 GLY A 867 8.901 5.030 -2.835 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.366 3.546 -3.598 1.00 0.00 H new ATOM 1010 N THR A 868 6.498 5.003 -5.117 1.00 0.00 N ATOM 1011 CA THR A 868 6.083 5.776 -6.332 1.00 0.00 C ATOM 1012 C THR A 868 5.567 7.154 -5.933 1.00 0.00 C ATOM 1013 O THR A 868 5.547 8.075 -6.729 1.00 0.00 O ATOM 1014 CB THR A 868 5.023 4.960 -7.080 1.00 0.00 C ATOM 1015 OG1 THR A 868 5.307 5.017 -8.472 1.00 0.00 O ATOM 1016 CG2 THR A 868 3.630 5.546 -6.834 1.00 0.00 C ATOM 0 H THR A 868 5.867 4.260 -4.818 1.00 0.00 H new ATOM 0 HA THR A 868 6.934 5.939 -6.993 1.00 0.00 H new ATOM 0 HB THR A 868 5.043 3.930 -6.724 1.00 0.00 H new ATOM 0 HG1 THR A 868 4.637 4.497 -8.964 1.00 0.00 H new ATOM 0 HG21 THR A 868 2.887 4.956 -7.371 1.00 0.00 H new ATOM 0 HG22 THR A 868 3.409 5.523 -5.767 1.00 0.00 H new ATOM 0 HG23 THR A 868 3.601 6.576 -7.188 1.00 0.00 H new ATOM 1024 N ARG A 869 5.214 7.325 -4.694 1.00 0.00 N ATOM 1025 CA ARG A 869 4.776 8.655 -4.245 1.00 0.00 C ATOM 1026 C ARG A 869 6.052 9.393 -3.935 1.00 0.00 C ATOM 1027 O ARG A 869 6.281 10.492 -4.392 1.00 0.00 O ATOM 1028 CB ARG A 869 3.933 8.415 -2.994 1.00 0.00 C ATOM 1029 CG ARG A 869 2.605 7.761 -3.393 1.00 0.00 C ATOM 1030 CD ARG A 869 1.831 8.690 -4.334 1.00 0.00 C ATOM 1031 NE ARG A 869 2.125 8.185 -5.706 1.00 0.00 N ATOM 1032 CZ ARG A 869 1.312 7.342 -6.281 1.00 0.00 C ATOM 1033 NH1 ARG A 869 0.860 6.314 -5.618 1.00 0.00 N ATOM 1034 NH2 ARG A 869 0.954 7.526 -7.522 1.00 0.00 N ATOM 0 H ARG A 869 5.212 6.598 -3.979 1.00 0.00 H new ATOM 0 HA ARG A 869 4.185 9.225 -4.962 1.00 0.00 H new ATOM 0 HB2 ARG A 869 4.472 7.774 -2.296 1.00 0.00 H new ATOM 0 HB3 ARG A 869 3.747 9.358 -2.481 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.792 6.806 -3.883 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.011 7.552 -2.504 1.00 0.00 H new ATOM 0 HD2 ARG A 869 0.762 8.662 -4.124 1.00 0.00 H new ATOM 0 HD3 ARG A 869 2.152 9.725 -4.218 1.00 0.00 H new ATOM 0 HE ARG A 869 2.963 8.499 -6.196 1.00 0.00 H new ATOM 0 HH11 ARG A 869 1.142 6.168 -4.649 1.00 0.00 H new ATOM 0 HH12 ARG A 869 0.224 5.656 -6.069 1.00 0.00 H new ATOM 0 HH21 ARG A 869 1.310 8.328 -8.042 1.00 0.00 H new ATOM 0 HH22 ARG A 869 0.318 6.868 -7.972 1.00 0.00 H new ATOM 1048 N ALA A 870 6.910 8.750 -3.190 1.00 0.00 N ATOM 1049 CA ALA A 870 8.230 9.364 -2.868 1.00 0.00 C ATOM 1050 C ALA A 870 8.896 9.966 -4.119 1.00 0.00 C ATOM 1051 O ALA A 870 9.622 10.930 -4.025 1.00 0.00 O ATOM 1052 CB ALA A 870 9.075 8.210 -2.343 1.00 0.00 C ATOM 0 H ALA A 870 6.754 7.825 -2.790 1.00 0.00 H new ATOM 0 HA ALA A 870 8.123 10.179 -2.152 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.068 8.576 -2.081 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.600 7.784 -1.459 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.162 7.443 -3.113 1.00 0.00 H new ATOM 1058 N LEU A 871 8.654 9.432 -5.290 1.00 0.00 N ATOM 1059 CA LEU A 871 9.304 10.055 -6.506 1.00 0.00 C ATOM 1060 C LEU A 871 8.413 11.154 -7.033 1.00 0.00 C ATOM 1061 O LEU A 871 8.880 12.206 -7.439 1.00 0.00 O ATOM 1062 CB LEU A 871 9.556 8.984 -7.595 1.00 0.00 C ATOM 1063 CG LEU A 871 9.063 7.599 -7.177 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.625 6.832 -8.422 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.206 6.851 -6.484 1.00 0.00 C ATOM 0 H LEU A 871 8.059 8.622 -5.465 1.00 0.00 H new ATOM 0 HA LEU A 871 10.269 10.478 -6.226 1.00 0.00 H new ATOM 0 HB2 LEU A 871 9.055 9.282 -8.516 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.623 8.936 -7.813 1.00 0.00 H new ATOM 0 HG LEU A 871 8.221 7.690 -6.491 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.271 5.842 -8.134 1.00 0.00 H new ATOM 0 HD12 LEU A 871 7.821 7.374 -8.919 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.470 6.731 -9.103 1.00 0.00 H new ATOM 0 HD21 LEU A 871 9.863 5.861 -6.182 1.00 0.00 H new ATOM 0 HD22 LEU A 871 11.045 6.750 -7.173 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.525 7.409 -5.603 1.00 0.00 H new ATOM 1077 N GLN A 872 7.129 10.948 -6.990 1.00 0.00 N ATOM 1078 CA GLN A 872 6.210 12.014 -7.447 1.00 0.00 C ATOM 1079 C GLN A 872 6.676 13.317 -6.797 1.00 0.00 C ATOM 1080 O GLN A 872 7.145 14.237 -7.443 1.00 0.00 O ATOM 1081 CB GLN A 872 4.847 11.571 -6.914 1.00 0.00 C ATOM 1082 CG GLN A 872 3.931 11.186 -8.079 1.00 0.00 C ATOM 1083 CD GLN A 872 4.050 9.684 -8.347 1.00 0.00 C ATOM 1084 OE1 GLN A 872 3.203 8.914 -7.940 1.00 0.00 O ATOM 1085 NE2 GLN A 872 5.073 9.233 -9.020 1.00 0.00 N ATOM 0 H GLN A 872 6.682 10.093 -6.660 1.00 0.00 H new ATOM 0 HA GLN A 872 6.176 12.171 -8.525 1.00 0.00 H new ATOM 0 HB2 GLN A 872 4.969 10.723 -6.240 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.394 12.376 -6.335 1.00 0.00 H new ATOM 0 HG2 GLN A 872 2.898 11.444 -7.844 1.00 0.00 H new ATOM 0 HG3 GLN A 872 4.205 11.748 -8.972 1.00 0.00 H new ATOM 0 HE21 GLN A 872 5.784 9.880 -9.362 1.00 0.00 H new ATOM 0 HE22 GLN A 872 5.162 8.234 -9.204 1.00 0.00 H new ATOM 1094 N ILE A 873 6.588 13.355 -5.507 1.00 0.00 N ATOM 1095 CA ILE A 873 7.052 14.531 -4.723 1.00 0.00 C ATOM 1096 C ILE A 873 8.524 14.749 -4.880 1.00 0.00 C ATOM 1097 O ILE A 873 8.995 15.870 -4.848 1.00 0.00 O ATOM 1098 CB ILE A 873 6.814 14.152 -3.283 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.166 12.657 -3.056 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.361 14.422 -2.998 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.361 12.523 -2.114 1.00 0.00 C ATOM 0 H ILE A 873 6.203 12.599 -4.941 1.00 0.00 H new ATOM 0 HA ILE A 873 6.534 15.433 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 873 7.446 14.731 -2.609 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.306 12.135 -2.637 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.393 12.182 -4.011 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.139 14.162 -1.963 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.149 15.479 -3.160 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.742 13.821 -3.664 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.592 11.468 -1.967 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.225 13.027 -2.548 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.120 12.978 -1.153 1.00 0.00 H new ATOM 1113 N ALA A 874 9.273 13.697 -5.042 1.00 0.00 N ATOM 1114 CA ALA A 874 10.725 13.895 -5.194 1.00 0.00 C ATOM 1115 C ALA A 874 10.946 14.904 -6.300 1.00 0.00 C ATOM 1116 O ALA A 874 11.960 15.571 -6.365 1.00 0.00 O ATOM 1117 CB ALA A 874 11.309 12.529 -5.504 1.00 0.00 C ATOM 0 H ALA A 874 8.946 12.731 -5.074 1.00 0.00 H new ATOM 0 HA ALA A 874 11.212 14.289 -4.302 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.389 12.614 -5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.091 11.845 -4.684 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.868 12.145 -6.424 1.00 0.00 H new ATOM 1123 N MET A 875 9.945 15.089 -7.112 1.00 0.00 N ATOM 1124 CA MET A 875 10.043 16.139 -8.148 1.00 0.00 C ATOM 1125 C MET A 875 9.452 17.407 -7.524 1.00 0.00 C ATOM 1126 O MET A 875 10.136 18.374 -7.256 1.00 0.00 O ATOM 1127 CB MET A 875 9.188 15.647 -9.318 1.00 0.00 C ATOM 1128 CG MET A 875 9.955 15.839 -10.628 1.00 0.00 C ATOM 1129 SD MET A 875 8.786 16.145 -11.976 1.00 0.00 S ATOM 1130 CE MET A 875 9.708 17.479 -12.779 1.00 0.00 C ATOM 0 H MET A 875 9.072 14.561 -7.100 1.00 0.00 H new ATOM 0 HA MET A 875 11.057 16.344 -8.493 1.00 0.00 H new ATOM 0 HB2 MET A 875 8.938 14.595 -9.182 1.00 0.00 H new ATOM 0 HB3 MET A 875 8.247 16.197 -9.351 1.00 0.00 H new ATOM 0 HG2 MET A 875 10.647 16.676 -10.537 1.00 0.00 H new ATOM 0 HG3 MET A 875 10.552 14.953 -10.845 1.00 0.00 H new ATOM 0 HE1 MET A 875 9.158 17.826 -13.654 1.00 0.00 H new ATOM 0 HE2 MET A 875 9.836 18.305 -12.080 1.00 0.00 H new ATOM 0 HE3 MET A 875 10.686 17.110 -13.088 1.00 0.00 H new ATOM 1140 N CYS A 876 8.181 17.361 -7.248 1.00 0.00 N ATOM 1141 CA CYS A 876 7.475 18.501 -6.579 1.00 0.00 C ATOM 1142 C CYS A 876 6.520 17.936 -5.531 1.00 0.00 C ATOM 1143 O CYS A 876 6.797 17.943 -4.348 1.00 0.00 O ATOM 1144 CB CYS A 876 6.722 19.229 -7.696 1.00 0.00 C ATOM 1145 SG CYS A 876 5.789 20.616 -7.000 1.00 0.00 S ATOM 0 H CYS A 876 7.582 16.563 -7.461 1.00 0.00 H new ATOM 0 HA CYS A 876 8.151 19.186 -6.067 1.00 0.00 H new ATOM 0 HB2 CYS A 876 7.425 19.591 -8.446 1.00 0.00 H new ATOM 0 HB3 CYS A 876 6.045 18.540 -8.201 1.00 0.00 H new ATOM 0 HG CYS A 876 5.153 21.232 -7.952 1.00 0.00 H new ATOM 1151 N ALA A 877 5.399 17.422 -5.974 1.00 0.00 N ATOM 1152 CA ALA A 877 4.416 16.821 -5.018 1.00 0.00 C ATOM 1153 C ALA A 877 3.121 16.290 -5.687 1.00 0.00 C ATOM 1154 O ALA A 877 2.054 16.458 -5.129 1.00 0.00 O ATOM 1155 CB ALA A 877 4.080 17.929 -4.031 1.00 0.00 C ATOM 0 H ALA A 877 5.122 17.392 -6.955 1.00 0.00 H new ATOM 0 HA ALA A 877 4.861 15.943 -4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.362 17.559 -3.299 1.00 0.00 H new ATOM 0 HB2 ALA A 877 4.988 18.249 -3.520 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.648 18.775 -4.566 1.00 0.00 H new ATOM 1161 N PRO A 878 3.236 15.604 -6.811 1.00 0.00 N ATOM 1162 CA PRO A 878 2.038 14.990 -7.457 1.00 0.00 C ATOM 1163 C PRO A 878 1.410 13.985 -6.480 1.00 0.00 C ATOM 1164 O PRO A 878 0.326 13.474 -6.676 1.00 0.00 O ATOM 1165 CB PRO A 878 2.647 14.239 -8.636 1.00 0.00 C ATOM 1166 CG PRO A 878 4.170 14.431 -8.607 1.00 0.00 C ATOM 1167 CD PRO A 878 4.526 15.412 -7.493 1.00 0.00 C ATOM 0 HA PRO A 878 1.267 15.705 -7.744 1.00 0.00 H new ATOM 0 HB2 PRO A 878 2.398 13.179 -8.578 1.00 0.00 H new ATOM 0 HB3 PRO A 878 2.237 14.612 -9.574 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.667 13.475 -8.440 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.520 14.809 -9.568 1.00 0.00 H new ATOM 0 HD2 PRO A 878 5.283 15.006 -6.822 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.919 16.349 -7.888 1.00 0.00 H new ATOM 1174 N VAL A 879 2.138 13.707 -5.440 1.00 0.00 N ATOM 1175 CA VAL A 879 1.720 12.740 -4.385 1.00 0.00 C ATOM 1176 C VAL A 879 0.325 13.094 -3.862 1.00 0.00 C ATOM 1177 O VAL A 879 -0.347 13.960 -4.388 1.00 0.00 O ATOM 1178 CB VAL A 879 2.849 12.951 -3.342 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.400 12.886 -1.875 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.958 11.918 -3.584 1.00 0.00 C ATOM 0 H VAL A 879 3.050 14.130 -5.269 1.00 0.00 H new ATOM 0 HA VAL A 879 1.621 11.701 -4.698 1.00 0.00 H new ATOM 0 HB VAL A 879 3.205 13.970 -3.492 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.260 13.045 -1.224 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.655 13.659 -1.688 1.00 0.00 H new ATOM 0 HG13 VAL A 879 1.966 11.907 -1.670 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.754 12.061 -2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.548 10.913 -3.481 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.360 12.045 -4.589 1.00 0.00 H new ATOM 1190 N MET A 880 -0.128 12.405 -2.861 1.00 0.00 N ATOM 1191 CA MET A 880 -1.505 12.667 -2.333 1.00 0.00 C ATOM 1192 C MET A 880 -1.459 13.700 -1.213 1.00 0.00 C ATOM 1193 O MET A 880 -2.326 13.765 -0.365 1.00 0.00 O ATOM 1194 CB MET A 880 -2.005 11.315 -1.815 1.00 0.00 C ATOM 1195 CG MET A 880 -1.888 10.257 -2.921 1.00 0.00 C ATOM 1196 SD MET A 880 -2.823 10.783 -4.383 1.00 0.00 S ATOM 1197 CE MET A 880 -1.441 10.774 -5.550 1.00 0.00 C ATOM 0 H MET A 880 0.389 11.669 -2.379 1.00 0.00 H new ATOM 0 HA MET A 880 -2.167 13.071 -3.099 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.422 11.011 -0.945 1.00 0.00 H new ATOM 0 HB3 MET A 880 -3.042 11.401 -1.490 1.00 0.00 H new ATOM 0 HG2 MET A 880 -0.841 10.107 -3.183 1.00 0.00 H new ATOM 0 HG3 MET A 880 -2.267 9.300 -2.562 1.00 0.00 H new ATOM 0 HE1 MET A 880 -1.407 11.725 -6.081 1.00 0.00 H new ATOM 0 HE2 MET A 880 -0.507 10.628 -5.007 1.00 0.00 H new ATOM 0 HE3 MET A 880 -1.575 9.963 -6.266 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.470 14.537 -1.257 1.00 0.00 N ATOM 1208 CA VAL A 881 -0.317 15.628 -0.278 1.00 0.00 C ATOM 1209 C VAL A 881 0.606 16.646 -0.936 1.00 0.00 C ATOM 1210 O VAL A 881 1.267 16.351 -1.915 1.00 0.00 O ATOM 1211 CB VAL A 881 0.303 15.027 0.995 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.733 14.156 1.723 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.519 14.174 0.638 1.00 0.00 C ATOM 0 H VAL A 881 0.266 14.504 -1.962 1.00 0.00 H new ATOM 0 HA VAL A 881 -1.255 16.108 0.000 1.00 0.00 H new ATOM 0 HB VAL A 881 0.615 15.842 1.647 1.00 0.00 H new ATOM 0 HG11 VAL A 881 -0.286 13.734 2.623 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.593 14.766 1.997 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -1.056 13.349 1.066 1.00 0.00 H new ATOM 0 HG21 VAL A 881 1.949 13.754 1.548 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.214 13.365 -0.026 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.263 14.793 0.137 1.00 0.00 H new ATOM 1223 N GLU A 882 0.636 17.833 -0.450 1.00 0.00 N ATOM 1224 CA GLU A 882 1.492 18.875 -1.089 1.00 0.00 C ATOM 1225 C GLU A 882 2.170 19.749 -0.033 1.00 0.00 C ATOM 1226 O GLU A 882 1.711 20.836 0.263 1.00 0.00 O ATOM 1227 CB GLU A 882 0.521 19.712 -1.921 1.00 0.00 C ATOM 1228 CG GLU A 882 0.402 19.115 -3.325 1.00 0.00 C ATOM 1229 CD GLU A 882 -1.027 19.297 -3.839 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -1.620 20.318 -3.531 1.00 0.00 O ATOM 1231 OE2 GLU A 882 -1.504 18.414 -4.533 1.00 0.00 O ATOM 0 H GLU A 882 0.108 18.143 0.366 1.00 0.00 H new ATOM 0 HA GLU A 882 2.290 18.436 -1.688 1.00 0.00 H new ATOM 0 HB2 GLU A 882 -0.457 19.736 -1.441 1.00 0.00 H new ATOM 0 HB3 GLU A 882 0.872 20.742 -1.981 1.00 0.00 H new ATOM 0 HG2 GLU A 882 1.107 19.602 -3.999 1.00 0.00 H new ATOM 0 HG3 GLU A 882 0.660 18.056 -3.304 1.00 0.00 H new ATOM 1238 N LEU A 883 3.251 19.294 0.545 1.00 0.00 N ATOM 1239 CA LEU A 883 3.925 20.124 1.577 1.00 0.00 C ATOM 1240 C LEU A 883 4.368 21.471 0.979 1.00 0.00 C ATOM 1241 O LEU A 883 3.638 22.441 1.031 1.00 0.00 O ATOM 1242 CB LEU A 883 5.131 19.290 2.027 1.00 0.00 C ATOM 1243 CG LEU A 883 5.941 20.068 3.070 1.00 0.00 C ATOM 1244 CD1 LEU A 883 5.685 19.481 4.459 1.00 0.00 C ATOM 1245 CD2 LEU A 883 7.433 19.960 2.741 1.00 0.00 C ATOM 0 H LEU A 883 3.689 18.394 0.348 1.00 0.00 H new ATOM 0 HA LEU A 883 3.268 20.364 2.413 1.00 0.00 H new ATOM 0 HB2 LEU A 883 4.793 18.343 2.448 1.00 0.00 H new ATOM 0 HB3 LEU A 883 5.760 19.051 1.169 1.00 0.00 H new ATOM 0 HG LEU A 883 5.638 21.115 3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 883 6.261 20.035 5.200 1.00 0.00 H new ATOM 0 HD12 LEU A 883 4.624 19.555 4.695 1.00 0.00 H new ATOM 0 HD13 LEU A 883 5.987 18.434 4.473 1.00 0.00 H new ATOM 0 HD21 LEU A 883 8.010 20.513 3.482 1.00 0.00 H new ATOM 0 HD22 LEU A 883 7.734 18.912 2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 883 7.619 20.378 1.751 1.00 0.00 H new ATOM 1257 N GLU A 884 5.554 21.552 0.420 1.00 0.00 N ATOM 1258 CA GLU A 884 6.007 22.857 -0.159 1.00 0.00 C ATOM 1259 C GLU A 884 6.927 22.649 -1.366 1.00 0.00 C ATOM 1260 O GLU A 884 7.488 23.592 -1.890 1.00 0.00 O ATOM 1261 CB GLU A 884 6.776 23.532 0.975 1.00 0.00 C ATOM 1262 CG GLU A 884 6.116 24.868 1.325 1.00 0.00 C ATOM 1263 CD GLU A 884 6.802 25.471 2.552 1.00 0.00 C ATOM 1264 OE1 GLU A 884 6.635 24.924 3.629 1.00 0.00 O ATOM 1265 OE2 GLU A 884 7.483 26.471 2.393 1.00 0.00 O ATOM 0 H GLU A 884 6.219 20.782 0.340 1.00 0.00 H new ATOM 0 HA GLU A 884 5.166 23.450 -0.517 1.00 0.00 H new ATOM 0 HB2 GLU A 884 6.793 22.884 1.851 1.00 0.00 H new ATOM 0 HB3 GLU A 884 7.812 23.694 0.678 1.00 0.00 H new ATOM 0 HG2 GLU A 884 6.189 25.554 0.481 1.00 0.00 H new ATOM 0 HG3 GLU A 884 5.055 24.720 1.525 1.00 0.00 H new ATOM 1272 N GLY A 885 7.158 21.429 -1.757 1.00 0.00 N ATOM 1273 CA GLY A 885 8.110 21.167 -2.852 1.00 0.00 C ATOM 1274 C GLY A 885 9.294 20.477 -2.189 1.00 0.00 C ATOM 1275 O GLY A 885 10.331 21.068 -1.959 1.00 0.00 O ATOM 0 H GLY A 885 6.721 20.599 -1.357 1.00 0.00 H new ATOM 0 HA2 GLY A 885 7.664 20.535 -3.620 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.415 22.093 -3.339 1.00 0.00 H new ATOM 1279 N GLU A 886 9.114 19.238 -1.831 1.00 0.00 N ATOM 1280 CA GLU A 886 10.190 18.494 -1.117 1.00 0.00 C ATOM 1281 C GLU A 886 10.329 17.094 -1.684 1.00 0.00 C ATOM 1282 O GLU A 886 9.722 16.746 -2.677 1.00 0.00 O ATOM 1283 CB GLU A 886 9.720 18.434 0.338 1.00 0.00 C ATOM 1284 CG GLU A 886 10.894 18.747 1.270 1.00 0.00 C ATOM 1285 CD GLU A 886 10.504 18.419 2.712 1.00 0.00 C ATOM 1286 OE1 GLU A 886 9.886 17.387 2.917 1.00 0.00 O ATOM 1287 OE2 GLU A 886 10.830 19.205 3.587 1.00 0.00 O ATOM 0 H GLU A 886 8.262 18.704 -2.003 1.00 0.00 H new ATOM 0 HA GLU A 886 11.163 18.975 -1.219 1.00 0.00 H new ATOM 0 HB2 GLU A 886 8.913 19.149 0.500 1.00 0.00 H new ATOM 0 HB3 GLU A 886 9.319 17.445 0.561 1.00 0.00 H new ATOM 0 HG2 GLU A 886 11.769 18.166 0.978 1.00 0.00 H new ATOM 0 HG3 GLU A 886 11.168 19.799 1.187 1.00 0.00 H new ATOM 1294 N THR A 887 11.158 16.307 -1.080 1.00 0.00 N ATOM 1295 CA THR A 887 11.395 14.940 -1.589 1.00 0.00 C ATOM 1296 C THR A 887 11.905 14.075 -0.471 1.00 0.00 C ATOM 1297 O THR A 887 12.544 13.065 -0.686 1.00 0.00 O ATOM 1298 CB THR A 887 12.448 15.126 -2.656 1.00 0.00 C ATOM 1299 OG1 THR A 887 12.819 13.862 -3.191 1.00 0.00 O ATOM 1300 CG2 THR A 887 13.682 15.820 -2.070 1.00 0.00 C ATOM 0 H THR A 887 11.689 16.555 -0.245 1.00 0.00 H new ATOM 0 HA THR A 887 10.499 14.457 -1.980 1.00 0.00 H new ATOM 0 HB THR A 887 12.037 15.749 -3.450 1.00 0.00 H new ATOM 0 HG1 THR A 887 12.806 13.189 -2.479 1.00 0.00 H new ATOM 0 HG21 THR A 887 14.433 15.947 -2.850 1.00 0.00 H new ATOM 0 HG22 THR A 887 13.398 16.796 -1.677 1.00 0.00 H new ATOM 0 HG23 THR A 887 14.094 15.211 -1.266 1.00 0.00 H new ATOM 1308 N ASP A 888 11.606 14.479 0.725 1.00 0.00 N ATOM 1309 CA ASP A 888 12.028 13.704 1.926 1.00 0.00 C ATOM 1310 C ASP A 888 11.997 12.206 1.588 1.00 0.00 C ATOM 1311 O ASP A 888 11.220 11.795 0.747 1.00 0.00 O ATOM 1312 CB ASP A 888 10.958 14.059 2.957 1.00 0.00 C ATOM 1313 CG ASP A 888 11.073 13.163 4.194 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.935 11.960 4.049 1.00 0.00 O ATOM 1315 OD2 ASP A 888 11.299 13.698 5.267 1.00 0.00 O ATOM 0 H ASP A 888 11.078 15.328 0.929 1.00 0.00 H new ATOM 0 HA ASP A 888 13.035 13.928 2.278 1.00 0.00 H new ATOM 0 HB2 ASP A 888 11.061 15.104 3.249 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.969 13.948 2.513 1.00 0.00 H new ATOM 1320 N PRO A 889 12.834 11.427 2.225 1.00 0.00 N ATOM 1321 CA PRO A 889 12.877 9.978 1.931 1.00 0.00 C ATOM 1322 C PRO A 889 11.459 9.381 1.831 1.00 0.00 C ATOM 1323 O PRO A 889 11.254 8.395 1.152 1.00 0.00 O ATOM 1324 CB PRO A 889 13.696 9.430 3.108 1.00 0.00 C ATOM 1325 CG PRO A 889 14.105 10.616 4.008 1.00 0.00 C ATOM 1326 CD PRO A 889 13.762 11.917 3.271 1.00 0.00 C ATOM 0 HA PRO A 889 13.321 9.726 0.968 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.109 8.708 3.675 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.580 8.907 2.744 1.00 0.00 H new ATOM 0 HG2 PRO A 889 13.579 10.569 4.961 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.171 10.575 4.230 1.00 0.00 H new ATOM 0 HD2 PRO A 889 13.291 12.649 3.928 1.00 0.00 H new ATOM 0 HD3 PRO A 889 14.646 12.393 2.846 1.00 0.00 H new ATOM 1333 N LEU A 890 10.469 9.995 2.453 1.00 0.00 N ATOM 1334 CA LEU A 890 9.075 9.487 2.343 1.00 0.00 C ATOM 1335 C LEU A 890 8.115 10.288 3.233 1.00 0.00 C ATOM 1336 O LEU A 890 7.049 9.808 3.544 1.00 0.00 O ATOM 1337 CB LEU A 890 9.085 7.987 2.754 1.00 0.00 C ATOM 1338 CG LEU A 890 9.603 7.735 4.195 1.00 0.00 C ATOM 1339 CD1 LEU A 890 11.103 7.980 4.282 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.894 8.627 5.215 1.00 0.00 C ATOM 0 H LEU A 890 10.578 10.828 3.031 1.00 0.00 H new ATOM 0 HA LEU A 890 8.720 9.600 1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.074 7.589 2.667 1.00 0.00 H new ATOM 0 HB3 LEU A 890 9.707 7.432 2.052 1.00 0.00 H new ATOM 0 HG LEU A 890 9.387 6.693 4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.443 7.797 5.301 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.622 7.306 3.600 1.00 0.00 H new ATOM 0 HD13 LEU A 890 11.320 9.012 4.007 1.00 0.00 H new ATOM 0 HD21 LEU A 890 9.284 8.421 6.212 1.00 0.00 H new ATOM 0 HD22 LEU A 890 9.068 9.674 4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 890 7.823 8.423 5.195 1.00 0.00 H new ATOM 1352 N LEU A 891 8.446 11.504 3.632 1.00 0.00 N ATOM 1353 CA LEU A 891 7.480 12.280 4.482 1.00 0.00 C ATOM 1354 C LEU A 891 6.125 12.149 3.842 1.00 0.00 C ATOM 1355 O LEU A 891 5.110 11.954 4.467 1.00 0.00 O ATOM 1356 CB LEU A 891 7.981 13.732 4.448 1.00 0.00 C ATOM 1357 CG LEU A 891 6.826 14.767 4.403 1.00 0.00 C ATOM 1358 CD1 LEU A 891 6.148 14.804 3.019 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.786 14.445 5.483 1.00 0.00 C ATOM 0 H LEU A 891 9.321 11.979 3.411 1.00 0.00 H new ATOM 0 HA LEU A 891 7.411 11.933 5.513 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.596 13.920 5.328 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.621 13.870 3.576 1.00 0.00 H new ATOM 0 HG LEU A 891 7.257 15.750 4.593 1.00 0.00 H new ATOM 0 HD11 LEU A 891 5.345 15.541 3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.883 15.077 2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.737 13.821 2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.980 15.178 5.442 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.379 13.448 5.311 1.00 0.00 H new ATOM 0 HD23 LEU A 891 6.258 14.480 6.465 1.00 0.00 H new ATOM 1371 N ILE A 892 6.163 12.260 2.577 1.00 0.00 N ATOM 1372 CA ILE A 892 4.952 12.149 1.745 1.00 0.00 C ATOM 1373 C ILE A 892 4.502 10.714 1.687 1.00 0.00 C ATOM 1374 O ILE A 892 3.334 10.409 1.778 1.00 0.00 O ATOM 1375 CB ILE A 892 5.442 12.555 0.378 1.00 0.00 C ATOM 1376 CG1 ILE A 892 5.154 14.023 0.159 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.768 11.717 -0.698 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.403 14.644 -0.420 1.00 0.00 C ATOM 0 H ILE A 892 7.019 12.431 2.049 1.00 0.00 H new ATOM 0 HA ILE A 892 4.120 12.746 2.118 1.00 0.00 H new ATOM 0 HB ILE A 892 6.517 12.386 0.317 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.311 14.152 -0.519 1.00 0.00 H new ATOM 0 HG13 ILE A 892 4.884 14.506 1.098 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.133 12.023 -1.679 1.00 0.00 H new ATOM 0 HG22 ILE A 892 4.999 10.664 -0.537 1.00 0.00 H new ATOM 0 HG23 ILE A 892 3.689 11.863 -0.650 1.00 0.00 H new ATOM 0 HD11 ILE A 892 6.234 15.707 -0.593 1.00 0.00 H new ATOM 0 HD12 ILE A 892 7.230 14.517 0.278 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.647 14.157 -1.364 1.00 0.00 H new ATOM 1390 N ALA A 893 5.436 9.834 1.505 1.00 0.00 N ATOM 1391 CA ALA A 893 5.051 8.397 1.404 1.00 0.00 C ATOM 1392 C ALA A 893 4.574 7.935 2.780 1.00 0.00 C ATOM 1393 O ALA A 893 3.778 7.021 2.935 1.00 0.00 O ATOM 1394 CB ALA A 893 6.331 7.673 1.004 1.00 0.00 C ATOM 0 H ALA A 893 6.433 10.035 1.422 1.00 0.00 H new ATOM 0 HA ALA A 893 4.252 8.208 0.687 1.00 0.00 H new ATOM 0 HB1 ALA A 893 6.131 6.606 0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.686 8.062 0.050 1.00 0.00 H new ATOM 0 HB3 ALA A 893 7.093 7.832 1.767 1.00 0.00 H new ATOM 1400 N MET A 894 4.990 8.659 3.766 1.00 0.00 N ATOM 1401 CA MET A 894 4.552 8.401 5.155 1.00 0.00 C ATOM 1402 C MET A 894 3.241 9.142 5.323 1.00 0.00 C ATOM 1403 O MET A 894 2.201 8.554 5.520 1.00 0.00 O ATOM 1404 CB MET A 894 5.655 9.010 6.034 1.00 0.00 C ATOM 1405 CG MET A 894 5.091 9.450 7.391 1.00 0.00 C ATOM 1406 SD MET A 894 6.434 10.091 8.426 1.00 0.00 S ATOM 1407 CE MET A 894 6.654 11.681 7.584 1.00 0.00 C ATOM 0 H MET A 894 5.635 9.443 3.665 1.00 0.00 H new ATOM 0 HA MET A 894 4.405 7.351 5.409 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.450 8.280 6.185 1.00 0.00 H new ATOM 0 HB3 MET A 894 6.100 9.865 5.526 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.330 10.217 7.249 1.00 0.00 H new ATOM 0 HG3 MET A 894 4.607 8.608 7.886 1.00 0.00 H new ATOM 0 HE1 MET A 894 7.686 11.773 7.245 1.00 0.00 H new ATOM 0 HE2 MET A 894 5.984 11.734 6.726 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.425 12.493 8.274 1.00 0.00 H new ATOM 1417 N LYS A 895 3.300 10.442 5.193 1.00 0.00 N ATOM 1418 CA LYS A 895 2.080 11.289 5.285 1.00 0.00 C ATOM 1419 C LYS A 895 0.966 10.594 4.524 1.00 0.00 C ATOM 1420 O LYS A 895 -0.125 10.416 5.023 1.00 0.00 O ATOM 1421 CB LYS A 895 2.475 12.611 4.618 1.00 0.00 C ATOM 1422 CG LYS A 895 1.235 13.468 4.356 1.00 0.00 C ATOM 1423 CD LYS A 895 1.206 14.647 5.332 1.00 0.00 C ATOM 1424 CE LYS A 895 2.104 15.768 4.805 1.00 0.00 C ATOM 1425 NZ LYS A 895 1.722 16.969 5.600 1.00 0.00 N ATOM 0 H LYS A 895 4.162 10.960 5.023 1.00 0.00 H new ATOM 0 HA LYS A 895 1.730 11.457 6.303 1.00 0.00 H new ATOM 0 HB2 LYS A 895 3.172 13.154 5.257 1.00 0.00 H new ATOM 0 HB3 LYS A 895 2.992 12.412 3.679 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.244 13.834 3.329 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.334 12.866 4.472 1.00 0.00 H new ATOM 0 HD2 LYS A 895 0.185 15.010 5.450 1.00 0.00 H new ATOM 0 HD3 LYS A 895 1.546 14.326 6.317 1.00 0.00 H new ATOM 0 HE2 LYS A 895 3.158 15.525 4.937 1.00 0.00 H new ATOM 0 HE3 LYS A 895 1.946 15.933 3.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 2.295 17.782 5.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 0.715 17.179 5.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 1.889 16.785 6.610 1.00 0.00 H new ATOM 1439 N GLU A 896 1.255 10.164 3.326 1.00 0.00 N ATOM 1440 CA GLU A 896 0.219 9.435 2.545 1.00 0.00 C ATOM 1441 C GLU A 896 -0.307 8.275 3.384 1.00 0.00 C ATOM 1442 O GLU A 896 -1.501 8.104 3.532 1.00 0.00 O ATOM 1443 CB GLU A 896 0.928 8.914 1.298 1.00 0.00 C ATOM 1444 CG GLU A 896 0.349 9.593 0.056 1.00 0.00 C ATOM 1445 CD GLU A 896 1.404 9.617 -1.051 1.00 0.00 C ATOM 1446 OE1 GLU A 896 2.512 9.174 -0.797 1.00 0.00 O ATOM 1447 OE2 GLU A 896 1.086 10.080 -2.133 1.00 0.00 O ATOM 0 H GLU A 896 2.154 10.285 2.859 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.626 10.069 2.278 1.00 0.00 H new ATOM 0 HB2 GLU A 896 1.998 9.111 1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.807 7.833 1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 896 -0.538 9.058 -0.284 1.00 0.00 H new ATOM 0 HG3 GLU A 896 0.036 10.609 0.297 1.00 0.00 H new ATOM 1454 N LEU A 897 0.565 7.476 3.950 1.00 0.00 N ATOM 1455 CA LEU A 897 0.049 6.356 4.782 1.00 0.00 C ATOM 1456 C LEU A 897 -0.538 6.903 6.076 1.00 0.00 C ATOM 1457 O LEU A 897 -1.646 6.575 6.448 1.00 0.00 O ATOM 1458 CB LEU A 897 1.230 5.441 5.076 1.00 0.00 C ATOM 1459 CG LEU A 897 0.743 4.201 5.846 1.00 0.00 C ATOM 1460 CD1 LEU A 897 0.995 4.403 7.341 1.00 0.00 C ATOM 1461 CD2 LEU A 897 -0.764 3.982 5.614 1.00 0.00 C ATOM 0 H LEU A 897 1.580 7.549 3.874 1.00 0.00 H new ATOM 0 HA LEU A 897 -0.739 5.809 4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.709 5.138 4.145 1.00 0.00 H new ATOM 0 HB3 LEU A 897 1.979 5.974 5.661 1.00 0.00 H new ATOM 0 HG LEU A 897 1.288 3.328 5.488 1.00 0.00 H new ATOM 0 HD11 LEU A 897 0.651 3.526 7.890 1.00 0.00 H new ATOM 0 HD12 LEU A 897 2.062 4.544 7.514 1.00 0.00 H new ATOM 0 HD13 LEU A 897 0.452 5.283 7.686 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -1.093 3.101 6.165 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -1.316 4.855 5.962 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -0.951 3.835 4.550 1.00 0.00 H new ATOM 1473 N LYS A 898 0.168 7.766 6.741 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.390 8.382 7.990 1.00 0.00 C ATOM 1475 C LYS A 898 -1.774 8.864 7.692 1.00 0.00 C ATOM 1476 O LYS A 898 -2.646 8.948 8.534 1.00 0.00 O ATOM 1477 CB LYS A 898 0.409 9.642 8.259 1.00 0.00 C ATOM 1478 CG LYS A 898 1.889 9.408 8.079 1.00 0.00 C ATOM 1479 CD LYS A 898 2.647 10.125 9.192 1.00 0.00 C ATOM 1480 CE LYS A 898 3.372 9.103 10.071 1.00 0.00 C ATOM 1481 NZ LYS A 898 3.237 9.626 11.459 1.00 0.00 N ATOM 0 H LYS A 898 1.105 8.077 6.483 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.365 7.667 8.812 1.00 0.00 H new ATOM 0 HB2 LYS A 898 0.080 10.433 7.585 1.00 0.00 H new ATOM 0 HB3 LYS A 898 0.215 9.987 9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 898 2.107 8.340 8.103 1.00 0.00 H new ATOM 0 HG3 LYS A 898 2.212 9.777 7.106 1.00 0.00 H new ATOM 0 HD2 LYS A 898 3.366 10.823 8.763 1.00 0.00 H new ATOM 0 HD3 LYS A 898 1.955 10.711 9.796 1.00 0.00 H new ATOM 0 HE2 LYS A 898 2.925 8.113 9.977 1.00 0.00 H new ATOM 0 HE3 LYS A 898 4.419 9.008 9.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 3.710 8.979 12.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 3.677 10.566 11.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 2.229 9.699 11.706 1.00 0.00 H new ATOM 1495 N ALA A 899 -1.938 9.219 6.470 1.00 0.00 N ATOM 1496 CA ALA A 899 -3.215 9.754 6.016 1.00 0.00 C ATOM 1497 C ALA A 899 -4.123 8.588 5.638 1.00 0.00 C ATOM 1498 O ALA A 899 -5.331 8.684 5.699 1.00 0.00 O ATOM 1499 CB ALA A 899 -2.791 10.617 4.829 1.00 0.00 C ATOM 0 H ALA A 899 -1.218 9.158 5.750 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.785 10.332 6.744 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -3.670 11.086 4.387 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.100 11.389 5.169 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.299 9.993 4.083 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.535 7.485 5.234 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.330 6.295 4.832 1.00 0.00 C ATOM 1507 C ARG A 900 -5.288 6.766 3.769 1.00 0.00 C ATOM 1508 O ARG A 900 -6.365 6.239 3.566 1.00 0.00 O ATOM 1509 CB ARG A 900 -5.024 5.801 6.121 1.00 0.00 C ATOM 1510 CG ARG A 900 -6.520 6.145 6.127 1.00 0.00 C ATOM 1511 CD ARG A 900 -7.054 6.068 7.560 1.00 0.00 C ATOM 1512 NE ARG A 900 -8.531 6.205 7.428 1.00 0.00 N ATOM 1513 CZ ARG A 900 -9.322 5.573 8.251 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -9.769 4.385 7.945 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -9.663 6.126 9.384 1.00 0.00 N ATOM 0 H ARG A 900 -2.524 7.364 5.167 1.00 0.00 H new ATOM 0 HA ARG A 900 -3.756 5.467 4.416 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -4.898 4.722 6.212 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -4.543 6.252 6.989 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.676 7.145 5.722 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -7.066 5.453 5.486 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -6.786 5.122 8.031 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -6.638 6.862 8.180 1.00 0.00 H new ATOM 0 HE ARG A 900 -8.925 6.793 6.694 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -9.500 3.951 7.062 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -10.387 3.891 8.589 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -9.311 7.052 9.626 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -10.281 5.632 10.027 1.00 0.00 H new ATOM 1529 N LYS A 901 -4.872 7.789 3.094 1.00 0.00 N ATOM 1530 CA LYS A 901 -5.709 8.360 2.048 1.00 0.00 C ATOM 1531 C LYS A 901 -5.180 7.960 0.683 1.00 0.00 C ATOM 1532 O LYS A 901 -5.864 8.105 -0.304 1.00 0.00 O ATOM 1533 CB LYS A 901 -5.625 9.875 2.243 1.00 0.00 C ATOM 1534 CG LYS A 901 -6.582 10.575 1.273 1.00 0.00 C ATOM 1535 CD LYS A 901 -5.840 11.693 0.534 1.00 0.00 C ATOM 1536 CE LYS A 901 -6.725 12.941 0.469 1.00 0.00 C ATOM 1537 NZ LYS A 901 -6.457 13.668 1.742 1.00 0.00 N ATOM 0 H LYS A 901 -3.974 8.252 3.233 1.00 0.00 H new ATOM 0 HA LYS A 901 -6.739 8.008 2.105 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -5.880 10.134 3.271 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -4.604 10.217 2.072 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -6.981 9.856 0.558 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -7.431 10.987 1.818 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -4.906 11.924 1.046 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -5.579 11.367 -0.473 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -6.478 13.556 -0.397 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -7.778 12.674 0.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -7.028 14.537 1.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -6.708 13.061 2.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -5.448 13.915 1.795 1.00 0.00 H new ATOM 1551 N ILE A 902 -3.960 7.466 0.624 1.00 0.00 N ATOM 1552 CA ILE A 902 -3.363 7.071 -0.706 1.00 0.00 C ATOM 1553 C ILE A 902 -4.388 6.346 -1.603 1.00 0.00 C ATOM 1554 O ILE A 902 -4.546 5.145 -1.507 1.00 0.00 O ATOM 1555 CB ILE A 902 -2.229 6.102 -0.357 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -1.204 6.804 0.533 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -1.541 5.624 -1.642 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -0.835 5.888 1.701 1.00 0.00 C ATOM 0 H ILE A 902 -3.354 7.319 1.431 1.00 0.00 H new ATOM 0 HA ILE A 902 -3.029 7.950 -1.257 1.00 0.00 H new ATOM 0 HB ILE A 902 -2.645 5.245 0.173 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -0.314 7.052 -0.045 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -1.613 7.743 0.907 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -0.735 4.935 -1.389 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -2.267 5.115 -2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -1.131 6.481 -2.176 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -0.104 6.386 2.337 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -1.729 5.662 2.283 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -0.409 4.961 1.316 1.00 0.00 H new ATOM 1570 N PRO A 903 -5.052 7.101 -2.458 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.059 6.524 -3.384 1.00 0.00 C ATOM 1572 C PRO A 903 -5.357 5.955 -4.616 1.00 0.00 C ATOM 1573 O PRO A 903 -5.167 6.657 -5.591 1.00 0.00 O ATOM 1574 CB PRO A 903 -6.861 7.769 -3.792 1.00 0.00 C ATOM 1575 CG PRO A 903 -6.230 8.996 -3.103 1.00 0.00 C ATOM 1576 CD PRO A 903 -4.865 8.565 -2.549 1.00 0.00 C ATOM 0 HA PRO A 903 -6.656 5.722 -2.949 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -6.847 7.892 -4.875 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -7.905 7.662 -3.497 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -6.114 9.816 -3.812 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -6.873 9.357 -2.300 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -4.045 8.836 -3.214 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -4.652 9.015 -1.580 1.00 0.00 H new ATOM 1583 N ILE A 904 -4.952 4.714 -4.608 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.268 4.204 -5.813 1.00 0.00 C ATOM 1585 C ILE A 904 -4.323 2.681 -5.937 1.00 0.00 C ATOM 1586 O ILE A 904 -4.313 1.944 -4.971 1.00 0.00 O ATOM 1587 CB ILE A 904 -2.837 4.746 -5.710 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -2.627 5.788 -6.809 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -1.823 3.625 -5.892 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -1.953 7.030 -6.221 1.00 0.00 C ATOM 0 H ILE A 904 -5.064 4.053 -3.839 1.00 0.00 H new ATOM 0 HA ILE A 904 -4.761 4.542 -6.725 1.00 0.00 H new ATOM 0 HB ILE A 904 -2.696 5.190 -4.725 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.011 5.371 -7.606 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -3.584 6.059 -7.255 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -0.814 4.031 -5.815 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -1.971 2.872 -5.118 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -1.957 3.169 -6.873 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -1.805 7.770 -7.007 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.585 7.452 -5.440 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -0.988 6.754 -5.797 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.365 2.235 -7.159 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.406 0.786 -7.464 1.00 0.00 C ATOM 1604 C ILE A 905 -2.975 0.235 -7.546 1.00 0.00 C ATOM 1605 O ILE A 905 -2.061 0.928 -7.947 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.079 0.685 -8.838 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.217 -0.788 -9.225 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.232 1.402 -9.895 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.673 -1.085 -9.562 1.00 0.00 C ATOM 0 H ILE A 905 -4.373 2.837 -7.982 1.00 0.00 H new ATOM 0 HA ILE A 905 -4.940 0.219 -6.702 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.062 1.153 -8.787 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.580 -1.012 -10.081 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -4.884 -1.424 -8.405 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.720 1.324 -10.867 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.127 2.453 -9.625 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.246 0.940 -9.946 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.776 -2.134 -9.839 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.297 -0.876 -8.693 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -6.989 -0.458 -10.395 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.780 -1.005 -7.203 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.420 -1.607 -7.288 1.00 0.00 C ATOM 1623 C ILE A 906 -1.543 -3.018 -7.845 1.00 0.00 C ATOM 1624 O ILE A 906 -2.473 -3.737 -7.545 1.00 0.00 O ATOM 1625 CB ILE A 906 -0.877 -1.636 -5.852 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.068 -0.370 -5.586 1.00 0.00 C ATOM 1627 CG2 ILE A 906 0.044 -2.846 -5.659 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.009 0.812 -5.384 1.00 0.00 C ATOM 0 H ILE A 906 -3.509 -1.633 -6.865 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.753 -1.043 -7.940 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.720 -1.700 -5.164 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.556 -0.505 -4.702 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.603 -0.174 -6.422 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.423 -2.856 -4.637 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.515 -3.763 -5.847 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.880 -2.781 -6.355 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -0.426 1.713 -5.194 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -1.614 0.953 -6.280 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -1.661 0.616 -4.533 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.615 -3.427 -8.646 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.703 -4.809 -9.201 1.00 0.00 C ATOM 1642 C ARG A 907 0.145 -5.753 -8.386 1.00 0.00 C ATOM 1643 O ARG A 907 1.355 -5.713 -8.435 1.00 0.00 O ATOM 1644 CB ARG A 907 -0.166 -4.727 -10.613 1.00 0.00 C ATOM 1645 CG ARG A 907 -1.238 -4.152 -11.532 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.644 -2.747 -11.066 1.00 0.00 C ATOM 1647 NE ARG A 907 -2.203 -2.086 -12.281 1.00 0.00 N ATOM 1648 CZ ARG A 907 -1.410 -1.611 -13.211 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -0.128 -1.874 -13.195 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -1.906 -0.869 -14.163 1.00 0.00 N ATOM 0 H ARG A 907 0.193 -2.880 -8.943 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.727 -5.181 -9.179 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.725 -4.100 -10.639 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.131 -5.717 -10.958 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.864 -4.109 -12.555 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -2.110 -4.806 -11.538 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.383 -2.794 -10.266 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.787 -2.197 -10.676 1.00 0.00 H new ATOM 0 HE ARG A 907 -3.214 -2.003 -12.390 1.00 0.00 H new ATOM 0 HH11 ARG A 907 0.264 -2.454 -12.454 1.00 0.00 H new ATOM 0 HH12 ARG A 907 0.479 -1.499 -13.924 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -2.905 -0.662 -14.180 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -1.295 -0.496 -14.890 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.480 -6.632 -7.669 1.00 0.00 N ATOM 1665 CA ARG A 908 0.314 -7.610 -6.882 1.00 0.00 C ATOM 1666 C ARG A 908 0.505 -8.860 -7.740 1.00 0.00 C ATOM 1667 O ARG A 908 -0.310 -9.761 -7.718 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.474 -7.977 -5.592 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.575 -6.952 -5.233 1.00 0.00 C ATOM 1670 CD ARG A 908 -2.146 -7.274 -3.823 1.00 0.00 C ATOM 1671 NE ARG A 908 -0.962 -7.237 -2.918 1.00 0.00 N ATOM 1672 CZ ARG A 908 -0.996 -7.852 -1.766 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.122 -7.963 -1.112 1.00 0.00 N ATOM 1674 NH2 ARG A 908 0.098 -8.357 -1.264 1.00 0.00 N ATOM 0 H ARG A 908 -1.493 -6.719 -7.591 1.00 0.00 H new ATOM 0 HA ARG A 908 1.282 -7.192 -6.605 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -0.930 -8.959 -5.720 1.00 0.00 H new ATOM 0 HB3 ARG A 908 0.224 -8.056 -4.759 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -1.165 -5.942 -5.249 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -2.372 -6.984 -5.976 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -2.897 -6.543 -3.523 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.628 -8.251 -3.805 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.123 -6.730 -3.199 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -2.979 -7.569 -1.501 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.144 -8.444 -0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.979 -8.271 -1.771 1.00 0.00 H new ATOM 0 HH22 ARG A 908 0.072 -8.837 -0.365 1.00 0.00 H new ATOM 1688 N TYR A 909 1.583 -8.942 -8.482 1.00 0.00 N ATOM 1689 CA TYR A 909 1.805 -10.148 -9.296 1.00 0.00 C ATOM 1690 C TYR A 909 2.466 -11.189 -8.417 1.00 0.00 C ATOM 1691 O TYR A 909 2.718 -10.965 -7.247 1.00 0.00 O ATOM 1692 CB TYR A 909 2.759 -9.804 -10.444 1.00 0.00 C ATOM 1693 CG TYR A 909 2.516 -8.434 -11.036 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.173 -7.300 -10.533 1.00 0.00 C ATOM 1695 CD2 TYR A 909 1.679 -8.312 -12.141 1.00 0.00 C ATOM 1696 CE1 TYR A 909 2.987 -6.060 -11.142 1.00 0.00 C ATOM 1697 CE2 TYR A 909 1.483 -7.074 -12.743 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.137 -5.946 -12.252 1.00 0.00 C ATOM 1699 OH TYR A 909 1.950 -4.725 -12.867 1.00 0.00 O ATOM 0 H TYR A 909 2.306 -8.225 -8.550 1.00 0.00 H new ATOM 0 HA TYR A 909 0.861 -10.519 -9.695 1.00 0.00 H new ATOM 0 HB2 TYR A 909 3.786 -9.858 -10.082 1.00 0.00 H new ATOM 0 HB3 TYR A 909 2.657 -10.554 -11.228 1.00 0.00 H new ATOM 0 HD1 TYR A 909 3.822 -7.388 -9.675 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.178 -9.185 -12.534 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.497 -5.188 -10.760 1.00 0.00 H new ATOM 0 HE2 TYR A 909 0.822 -6.987 -13.593 1.00 0.00 H new ATOM 0 HH TYR A 909 1.331 -4.829 -13.619 1.00 0.00 H new ATOM 1709 N LEU A 910 2.760 -12.316 -8.966 1.00 0.00 N ATOM 1710 CA LEU A 910 3.400 -13.372 -8.168 1.00 0.00 C ATOM 1711 C LEU A 910 4.555 -14.019 -8.932 1.00 0.00 C ATOM 1712 O LEU A 910 4.342 -14.690 -9.922 1.00 0.00 O ATOM 1713 CB LEU A 910 2.273 -14.376 -7.922 1.00 0.00 C ATOM 1714 CG LEU A 910 1.109 -13.709 -7.186 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.042 -14.761 -6.876 1.00 0.00 C ATOM 1716 CD2 LEU A 910 1.596 -13.078 -5.879 1.00 0.00 C ATOM 0 H LEU A 910 2.583 -12.554 -9.942 1.00 0.00 H new ATOM 0 HA LEU A 910 3.837 -12.993 -7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 910 1.925 -14.781 -8.872 1.00 0.00 H new ATOM 0 HB3 LEU A 910 2.648 -15.215 -7.336 1.00 0.00 H new ATOM 0 HG LEU A 910 0.689 -12.927 -7.819 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.790 -14.292 -6.351 1.00 0.00 H new ATOM 0 HD12 LEU A 910 -0.317 -15.200 -7.807 1.00 0.00 H new ATOM 0 HD13 LEU A 910 0.472 -15.542 -6.249 1.00 0.00 H new ATOM 0 HD21 LEU A 910 0.756 -12.608 -5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 910 2.024 -13.850 -5.240 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.354 -12.326 -6.098 1.00 0.00 H new ATOM 1728 N PRO A 911 5.752 -13.834 -8.417 1.00 0.00 N ATOM 1729 CA PRO A 911 6.942 -14.450 -9.035 1.00 0.00 C ATOM 1730 C PRO A 911 6.780 -15.969 -8.973 1.00 0.00 C ATOM 1731 O PRO A 911 7.497 -16.715 -9.609 1.00 0.00 O ATOM 1732 CB PRO A 911 8.081 -13.984 -8.121 1.00 0.00 C ATOM 1733 CG PRO A 911 7.486 -13.117 -6.995 1.00 0.00 C ATOM 1734 CD PRO A 911 5.971 -13.009 -7.207 1.00 0.00 C ATOM 0 HA PRO A 911 7.109 -14.181 -10.078 1.00 0.00 H new ATOM 0 HB2 PRO A 911 8.604 -14.843 -7.701 1.00 0.00 H new ATOM 0 HB3 PRO A 911 8.814 -13.413 -8.691 1.00 0.00 H new ATOM 0 HG2 PRO A 911 7.701 -13.560 -6.023 1.00 0.00 H new ATOM 0 HG3 PRO A 911 7.940 -12.126 -7.001 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.414 -13.390 -6.351 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.656 -11.977 -7.358 1.00 0.00 H new ATOM 1741 N ASP A 912 5.816 -16.420 -8.209 1.00 0.00 N ATOM 1742 CA ASP A 912 5.565 -17.878 -8.092 1.00 0.00 C ATOM 1743 C ASP A 912 4.898 -18.366 -9.368 1.00 0.00 C ATOM 1744 O ASP A 912 5.134 -19.467 -9.825 1.00 0.00 O ATOM 1745 CB ASP A 912 4.609 -18.021 -6.909 1.00 0.00 C ATOM 1746 CG ASP A 912 5.403 -18.337 -5.640 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.453 -17.740 -5.459 1.00 0.00 O ATOM 1748 OD2 ASP A 912 4.951 -19.169 -4.873 1.00 0.00 O ATOM 0 H ASP A 912 5.191 -15.831 -7.659 1.00 0.00 H new ATOM 0 HA ASP A 912 6.477 -18.456 -7.946 1.00 0.00 H new ATOM 0 HB2 ASP A 912 4.041 -17.100 -6.775 1.00 0.00 H new ATOM 0 HB3 ASP A 912 3.888 -18.814 -7.106 1.00 0.00 H new ATOM 1753 N GLY A 913 4.066 -17.545 -9.953 1.00 0.00 N ATOM 1754 CA GLY A 913 3.389 -17.972 -11.215 1.00 0.00 C ATOM 1755 C GLY A 913 1.921 -17.589 -11.161 1.00 0.00 C ATOM 1756 O GLY A 913 1.034 -18.387 -11.392 1.00 0.00 O ATOM 0 H GLY A 913 3.828 -16.611 -9.619 1.00 0.00 H new ATOM 0 HA2 GLY A 913 3.867 -17.500 -12.073 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.489 -19.049 -11.347 1.00 0.00 H new ATOM 1760 N SER A 914 1.683 -16.364 -10.859 1.00 0.00 N ATOM 1761 CA SER A 914 0.293 -15.842 -10.772 1.00 0.00 C ATOM 1762 C SER A 914 0.364 -14.333 -10.638 1.00 0.00 C ATOM 1763 O SER A 914 1.432 -13.754 -10.711 1.00 0.00 O ATOM 1764 CB SER A 914 -0.314 -16.483 -9.523 1.00 0.00 C ATOM 1765 OG SER A 914 0.711 -17.103 -8.755 1.00 0.00 O ATOM 0 H SER A 914 2.407 -15.674 -10.661 1.00 0.00 H new ATOM 0 HA SER A 914 -0.312 -16.075 -11.648 1.00 0.00 H new ATOM 0 HB2 SER A 914 -0.823 -15.727 -8.925 1.00 0.00 H new ATOM 0 HB3 SER A 914 -1.064 -17.221 -9.809 1.00 0.00 H new ATOM 0 HG SER A 914 0.319 -17.511 -7.955 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.742 -13.680 -10.445 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.702 -12.210 -10.308 1.00 0.00 C ATOM 1773 C TYR A 915 -2.131 -11.649 -10.200 1.00 0.00 C ATOM 1774 O TYR A 915 -3.073 -12.218 -10.713 1.00 0.00 O ATOM 1775 CB TYR A 915 -0.012 -11.707 -11.598 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.833 -10.628 -12.283 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -1.008 -9.375 -11.676 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -1.406 -10.881 -13.535 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.753 -8.383 -12.321 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -2.154 -9.888 -14.177 1.00 0.00 C ATOM 1781 CZ TYR A 915 -2.326 -8.638 -13.572 1.00 0.00 C ATOM 1782 OH TYR A 915 -3.060 -7.658 -14.209 1.00 0.00 O ATOM 0 H TYR A 915 -1.668 -14.102 -10.377 1.00 0.00 H new ATOM 0 HA TYR A 915 -0.169 -11.890 -9.412 1.00 0.00 H new ATOM 0 HB2 TYR A 915 0.976 -11.315 -11.355 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.136 -12.542 -12.282 1.00 0.00 H new ATOM 0 HD1 TYR A 915 -0.567 -9.177 -10.710 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -1.271 -11.844 -14.006 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.886 -7.419 -11.853 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -2.599 -10.087 -15.141 1.00 0.00 H new ATOM 0 HH TYR A 915 -3.386 -7.999 -15.068 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.280 -10.520 -9.572 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.626 -9.878 -9.453 1.00 0.00 C ATOM 1794 C GLU A 916 -3.471 -8.355 -9.449 1.00 0.00 C ATOM 1795 O GLU A 916 -2.520 -7.823 -8.910 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.196 -10.361 -8.125 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.632 -10.842 -8.331 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.596 -9.665 -8.163 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.232 -8.566 -8.545 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.686 -9.885 -7.660 1.00 0.00 O ATOM 0 H GLU A 916 -1.520 -10.004 -9.129 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.282 -10.138 -10.284 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.584 -11.170 -7.727 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.173 -9.554 -7.392 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.742 -11.276 -9.325 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.870 -11.626 -7.612 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.401 -7.649 -10.033 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.308 -6.164 -10.046 1.00 0.00 C ATOM 1809 C ASP A 917 -5.491 -5.562 -9.323 1.00 0.00 C ATOM 1810 O ASP A 917 -6.567 -6.124 -9.273 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.307 -5.751 -11.505 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.625 -6.148 -12.175 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.333 -6.971 -11.616 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -5.906 -5.615 -13.235 1.00 0.00 O ATOM 0 H ASP A 917 -5.220 -8.037 -10.501 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.408 -5.815 -9.540 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.162 -4.674 -11.584 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.472 -6.224 -12.022 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.249 -4.416 -8.771 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.242 -3.630 -7.972 1.00 0.00 C ATOM 1821 C TRP A 918 -5.539 -3.085 -6.747 1.00 0.00 C ATOM 1822 O TRP A 918 -4.379 -3.357 -6.526 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.416 -4.514 -7.540 1.00 0.00 C ATOM 1824 CG TRP A 918 -7.012 -5.811 -6.899 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.773 -6.353 -6.784 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.908 -6.722 -6.254 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.894 -7.607 -6.201 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.202 -7.856 -5.817 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.276 -6.649 -6.031 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.859 -8.905 -5.170 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.941 -7.664 -5.370 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -9.241 -8.805 -4.934 1.00 0.00 C ATOM 0 H TRP A 918 -4.342 -3.955 -8.843 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.637 -2.818 -8.582 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -8.038 -3.955 -6.841 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -8.033 -4.730 -8.412 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.849 -5.887 -7.094 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -5.121 -8.260 -6.072 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.828 -5.788 -6.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.312 -9.782 -4.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -11.002 -7.582 -5.187 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.763 -9.599 -4.421 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.204 -2.316 -5.941 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.503 -1.779 -4.754 1.00 0.00 C ATOM 1845 C GLY A 919 -6.475 -1.104 -3.820 1.00 0.00 C ATOM 1846 O GLY A 919 -6.915 -1.664 -2.841 1.00 0.00 O ATOM 0 H GLY A 919 -7.180 -2.041 -6.048 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -4.991 -2.587 -4.232 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.739 -1.068 -5.068 1.00 0.00 H new ATOM 1850 N VAL A 920 -6.809 0.099 -4.109 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.757 0.811 -3.233 1.00 0.00 C ATOM 1852 C VAL A 920 -9.033 1.054 -4.010 1.00 0.00 C ATOM 1853 O VAL A 920 -10.015 1.538 -3.480 1.00 0.00 O ATOM 1854 CB VAL A 920 -7.063 2.118 -2.874 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -7.975 2.959 -1.978 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -5.768 1.796 -2.128 1.00 0.00 C ATOM 0 H VAL A 920 -6.470 0.627 -4.913 1.00 0.00 H new ATOM 0 HA VAL A 920 -8.021 0.257 -2.332 1.00 0.00 H new ATOM 0 HB VAL A 920 -6.841 2.680 -3.781 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.474 3.893 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -8.903 3.177 -2.506 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.198 2.407 -1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.260 2.723 -1.864 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -6.000 1.239 -1.220 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -5.120 1.196 -2.767 1.00 0.00 H new ATOM 1866 N ASP A 921 -9.033 0.706 -5.268 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.265 0.907 -6.065 1.00 0.00 C ATOM 1868 C ASP A 921 -11.175 -0.297 -5.906 1.00 0.00 C ATOM 1869 O ASP A 921 -12.366 -0.236 -6.143 1.00 0.00 O ATOM 1870 CB ASP A 921 -9.799 1.073 -7.512 1.00 0.00 C ATOM 1871 CG ASP A 921 -11.006 1.356 -8.408 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -11.417 2.504 -8.470 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -11.500 0.422 -9.017 1.00 0.00 O ATOM 0 H ASP A 921 -8.243 0.298 -5.768 1.00 0.00 H new ATOM 0 HA ASP A 921 -10.835 1.778 -5.743 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -9.081 1.890 -7.582 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.288 0.170 -7.847 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.610 -1.390 -5.509 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.401 -2.620 -5.326 1.00 0.00 C ATOM 1880 C GLU A 922 -11.173 -3.179 -3.916 1.00 0.00 C ATOM 1881 O GLU A 922 -11.908 -4.023 -3.444 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.830 -3.541 -6.388 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.865 -4.604 -6.765 1.00 0.00 C ATOM 1884 CD GLU A 922 -13.059 -3.935 -7.447 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -12.916 -3.538 -8.593 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -14.098 -3.830 -6.815 1.00 0.00 O ATOM 0 H GLU A 922 -9.616 -1.483 -5.300 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.478 -2.481 -5.423 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.550 -2.965 -7.270 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.923 -4.019 -6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.418 -5.341 -7.432 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.194 -5.138 -5.874 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.142 -2.719 -3.250 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.844 -3.233 -1.875 1.00 0.00 C ATOM 1895 C LEU A 923 -9.183 -2.173 -0.969 1.00 0.00 C ATOM 1896 O LEU A 923 -9.403 -0.984 -1.088 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.923 -4.447 -2.074 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.862 -4.146 -3.128 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.457 -4.229 -2.551 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.977 -5.178 -4.198 1.00 0.00 C ATOM 0 H LEU A 923 -9.495 -2.011 -3.597 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.768 -3.501 -1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.443 -4.705 -1.130 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.512 -5.312 -2.379 1.00 0.00 H new ATOM 0 HG LEU A 923 -8.024 -3.136 -3.505 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.729 -4.008 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.352 -3.505 -1.743 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.281 -5.233 -2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.229 -4.989 -4.968 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.814 -6.167 -3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.972 -5.134 -4.640 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.423 -2.652 -0.028 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.742 -1.801 1.003 1.00 0.00 C ATOM 1914 C ILE A 924 -6.544 -1.025 0.482 1.00 0.00 C ATOM 1915 O ILE A 924 -6.065 -1.214 -0.606 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.320 -2.786 2.114 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.415 -2.780 3.162 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -5.972 -2.426 2.761 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.546 -3.653 2.643 1.00 0.00 C ATOM 0 H ILE A 924 -8.233 -3.649 0.078 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.422 -1.024 1.350 1.00 0.00 H new ATOM 0 HB ILE A 924 -7.186 -3.773 1.672 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -8.040 -3.162 4.111 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -8.767 -1.764 3.344 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.733 -3.157 3.534 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -5.191 -2.432 2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -6.036 -1.434 3.207 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.355 -3.673 3.373 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -9.917 -3.247 1.702 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -9.179 -4.666 2.481 1.00 0.00 H new ATOM 1931 N ILE A 925 -6.077 -0.153 1.318 1.00 0.00 N ATOM 1932 CA ILE A 925 -4.876 0.676 1.024 1.00 0.00 C ATOM 1933 C ILE A 925 -3.679 0.004 1.707 1.00 0.00 C ATOM 1934 O ILE A 925 -3.393 -1.153 1.482 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.193 2.055 1.631 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.548 1.904 3.117 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -6.377 2.682 0.888 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -4.905 3.039 3.915 1.00 0.00 C ATOM 0 H ILE A 925 -6.493 0.029 2.231 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.639 0.778 -0.035 1.00 0.00 H new ATOM 0 HB ILE A 925 -4.317 2.697 1.534 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.630 1.922 3.247 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -5.199 0.941 3.489 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.601 3.658 1.318 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -6.124 2.799 -0.166 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -7.249 2.035 0.982 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -5.158 2.931 4.970 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -3.822 3.000 3.795 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -5.276 3.996 3.549 1.00 0.00 H new ATOM 1950 N THR A 926 -2.999 0.706 2.543 1.00 0.00 N ATOM 1951 CA THR A 926 -1.837 0.109 3.261 1.00 0.00 C ATOM 1952 C THR A 926 -2.324 -0.986 4.210 1.00 0.00 C ATOM 1953 O THR A 926 -1.697 -2.015 4.369 1.00 0.00 O ATOM 1954 CB THR A 926 -1.252 1.267 4.066 1.00 0.00 C ATOM 1955 OG1 THR A 926 -0.941 2.341 3.191 1.00 0.00 O ATOM 1956 CG2 THR A 926 0.008 0.802 4.799 1.00 0.00 C ATOM 0 H THR A 926 -3.191 1.681 2.771 1.00 0.00 H new ATOM 0 HA THR A 926 -1.111 -0.341 2.584 1.00 0.00 H new ATOM 0 HB THR A 926 -1.982 1.606 4.801 1.00 0.00 H new ATOM 0 HG1 THR A 926 -1.737 2.896 3.059 1.00 0.00 H new ATOM 0 HG21 THR A 926 0.422 1.631 5.372 1.00 0.00 H new ATOM 0 HG22 THR A 926 -0.245 -0.015 5.474 1.00 0.00 H new ATOM 0 HG23 THR A 926 0.745 0.458 4.073 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.444 -0.765 4.834 1.00 0.00 N ATOM 1965 CA ASP A 927 -4.004 -1.780 5.778 1.00 0.00 C ATOM 1966 C ASP A 927 -5.379 -1.327 6.278 1.00 0.00 C ATOM 1967 O ASP A 927 -5.420 -0.563 7.227 1.00 0.00 O ATOM 1968 CB ASP A 927 -3.007 -1.839 6.940 1.00 0.00 C ATOM 1969 CG ASP A 927 -3.434 -2.926 7.928 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -4.374 -2.689 8.668 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -2.813 -3.975 7.928 1.00 0.00 O ATOM 1972 OXT ASP A 927 -6.366 -1.753 5.700 1.00 0.00 O ATOM 0 H ASP A 927 -4.004 0.082 4.733 1.00 0.00 H new ATOM 0 HA ASP A 927 -4.137 -2.754 5.306 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -2.006 -2.049 6.563 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -2.962 -0.873 7.443 1.00 0.00 H new