USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=17 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 K(o=0,f=-1.3!) USER MOD Single : A 835 ASN : amide:sc= -3.95 K(o=-4,f=-9.2!) USER MOD Single : A 841 SER OG : rot -105:sc= 0.00181 USER MOD Single : A 853 THR OG1 : rot 109:sc= -4.74! USER MOD Single : A 854 THR OG1 : rot 180:sc= 0 USER MOD Single : A 856 TYR OH : rot -29:sc= -0.584 USER MOD Single : A 857 MET CE :methyl -163:sc= -11.8! (180deg=-13.3!) USER MOD Single : A 858 THR OG1 : rot 140:sc= -0.687 USER MOD Single : A 859 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.122) USER MOD Single : A 860 TYR OH : rot 180:sc= 0 USER MOD Single : A 868 THR OG1 : rot 180:sc= 0 USER MOD Single : A 872 GLN : amide:sc= -2.48 K(o=-2.5,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= -0.0251 USER MOD Single : A 880 MET CE :methyl -159:sc= -0.139 (180deg=-0.319) USER MOD Single : A 887 THR OG1 : rot -2:sc= 0.779 USER MOD Single : A 894 MET CE :methyl -109:sc= -5.58! (180deg=-8.13!) 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= -3.6! USER MOD Single : A 914 SER OG : rot 180:sc= -0.646 USER MOD Single : A 915 TYR OH : rot 180:sc= -1.2 USER MOD Single : A 926 THR OG1 : rot 18:sc= -6.78! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 6.955 -10.658 -0.833 1.00 0.00 N ATOM 439 CA GLN A 833 6.706 -11.939 -1.557 1.00 0.00 C ATOM 440 C GLN A 833 5.537 -11.769 -2.521 1.00 0.00 C ATOM 441 O GLN A 833 4.673 -12.615 -2.637 1.00 0.00 O ATOM 442 CB GLN A 833 6.365 -12.950 -0.467 1.00 0.00 C ATOM 443 CG GLN A 833 5.128 -12.465 0.289 1.00 0.00 C ATOM 444 CD GLN A 833 4.866 -13.373 1.494 1.00 0.00 C ATOM 445 OE1 GLN A 833 5.589 -14.322 1.725 1.00 0.00 O ATOM 446 NE2 GLN A 833 3.853 -13.121 2.276 1.00 0.00 N ATOM 0 HA GLN A 833 7.564 -12.259 -2.148 1.00 0.00 H new ATOM 0 HB2 GLN A 833 6.178 -13.930 -0.907 1.00 0.00 H new ATOM 0 HB3 GLN A 833 7.205 -13.063 0.218 1.00 0.00 H new ATOM 0 HG2 GLN A 833 5.274 -11.437 0.622 1.00 0.00 H new ATOM 0 HG3 GLN A 833 4.262 -12.466 -0.373 1.00 0.00 H new ATOM 0 HE21 GLN A 833 3.246 -12.325 2.083 1.00 0.00 H new ATOM 0 HE22 GLN A 833 3.668 -13.720 3.081 1.00 0.00 H new ATOM 455 N GLU A 834 5.519 -10.673 -3.205 1.00 0.00 N ATOM 456 CA GLU A 834 4.434 -10.392 -4.171 1.00 0.00 C ATOM 457 C GLU A 834 4.877 -9.224 -5.040 1.00 0.00 C ATOM 458 O GLU A 834 5.080 -8.130 -4.555 1.00 0.00 O ATOM 459 CB GLU A 834 3.223 -10.011 -3.314 1.00 0.00 C ATOM 460 CG GLU A 834 2.045 -9.636 -4.220 1.00 0.00 C ATOM 461 CD GLU A 834 0.784 -10.371 -3.758 1.00 0.00 C ATOM 462 OE1 GLU A 834 0.691 -10.664 -2.577 1.00 0.00 O ATOM 463 OE2 GLU A 834 -0.066 -10.629 -4.594 1.00 0.00 O ATOM 0 H GLU A 834 6.226 -9.942 -3.135 1.00 0.00 H new ATOM 0 HA GLU A 834 4.196 -11.232 -4.823 1.00 0.00 H new ATOM 0 HB2 GLU A 834 2.946 -10.844 -2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.475 -9.173 -2.664 1.00 0.00 H new ATOM 0 HG2 GLU A 834 1.881 -8.559 -4.192 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.271 -9.897 -5.254 1.00 0.00 H new ATOM 470 N ASN A 835 5.038 -9.436 -6.314 1.00 0.00 N ATOM 471 CA ASN A 835 5.470 -8.309 -7.179 1.00 0.00 C ATOM 472 C ASN A 835 4.353 -7.304 -7.192 1.00 0.00 C ATOM 473 O ASN A 835 3.233 -7.627 -7.464 1.00 0.00 O ATOM 474 CB ASN A 835 5.691 -8.827 -8.609 1.00 0.00 C ATOM 475 CG ASN A 835 6.328 -10.219 -8.604 1.00 0.00 C ATOM 476 OD1 ASN A 835 5.731 -11.174 -9.063 1.00 0.00 O ATOM 477 ND2 ASN A 835 7.525 -10.373 -8.111 1.00 0.00 N ATOM 0 H ASN A 835 4.892 -10.327 -6.788 1.00 0.00 H new ATOM 0 HA ASN A 835 6.394 -7.866 -6.809 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.738 -8.863 -9.136 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.331 -8.134 -9.154 1.00 0.00 H new ATOM 0 HD21 ASN A 835 7.961 -11.295 -8.110 1.00 0.00 H new ATOM 0 HD22 ASN A 835 8.025 -9.572 -7.726 1.00 0.00 H new ATOM 484 N VAL A 836 4.629 -6.103 -6.889 1.00 0.00 N ATOM 485 CA VAL A 836 3.528 -5.104 -6.904 1.00 0.00 C ATOM 486 C VAL A 836 3.918 -3.881 -7.710 1.00 0.00 C ATOM 487 O VAL A 836 4.941 -3.260 -7.492 1.00 0.00 O ATOM 488 CB VAL A 836 3.199 -4.745 -5.442 1.00 0.00 C ATOM 489 CG1 VAL A 836 3.989 -5.629 -4.497 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.534 -3.282 -5.150 1.00 0.00 C ATOM 0 H VAL A 836 5.551 -5.750 -6.631 1.00 0.00 H new ATOM 0 HA VAL A 836 2.643 -5.519 -7.386 1.00 0.00 H new ATOM 0 HB VAL A 836 2.131 -4.903 -5.291 1.00 0.00 H new ATOM 0 HG11 VAL A 836 3.749 -5.366 -3.467 1.00 0.00 H new ATOM 0 HG12 VAL A 836 3.732 -6.673 -4.675 1.00 0.00 H new ATOM 0 HG13 VAL A 836 5.056 -5.484 -4.669 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.293 -3.054 -4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 836 4.597 -3.111 -5.322 1.00 0.00 H new ATOM 0 HG23 VAL A 836 2.952 -2.637 -5.808 1.00 0.00 H new ATOM 500 N GLU A 837 3.074 -3.519 -8.616 1.00 0.00 N ATOM 501 CA GLU A 837 3.335 -2.308 -9.430 1.00 0.00 C ATOM 502 C GLU A 837 2.489 -1.198 -8.851 1.00 0.00 C ATOM 503 O GLU A 837 1.789 -1.398 -7.876 1.00 0.00 O ATOM 504 CB GLU A 837 2.894 -2.637 -10.852 1.00 0.00 C ATOM 505 CG GLU A 837 4.055 -2.394 -11.820 1.00 0.00 C ATOM 506 CD GLU A 837 5.120 -3.472 -11.621 1.00 0.00 C ATOM 507 OE1 GLU A 837 5.589 -3.615 -10.504 1.00 0.00 O ATOM 508 OE2 GLU A 837 5.451 -4.137 -12.589 1.00 0.00 O ATOM 0 H GLU A 837 2.207 -4.010 -8.833 1.00 0.00 H new ATOM 0 HA GLU A 837 4.382 -2.004 -9.430 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.569 -3.676 -10.911 1.00 0.00 H new ATOM 0 HB3 GLU A 837 2.040 -2.020 -11.131 1.00 0.00 H new ATOM 0 HG2 GLU A 837 3.694 -2.410 -12.848 1.00 0.00 H new ATOM 0 HG3 GLU A 837 4.485 -1.407 -11.648 1.00 0.00 H new ATOM 515 N ILE A 838 2.534 -0.038 -9.412 1.00 0.00 N ATOM 516 CA ILE A 838 1.719 1.049 -8.846 1.00 0.00 C ATOM 517 C ILE A 838 1.112 1.891 -9.968 1.00 0.00 C ATOM 518 O ILE A 838 1.735 2.151 -10.979 1.00 0.00 O ATOM 519 CB ILE A 838 2.705 1.884 -8.020 1.00 0.00 C ATOM 520 CG1 ILE A 838 3.323 1.033 -6.889 1.00 0.00 C ATOM 521 CG2 ILE A 838 1.995 3.107 -7.438 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.513 1.160 -5.592 1.00 0.00 C ATOM 0 H ILE A 838 3.094 0.204 -10.230 1.00 0.00 H new ATOM 0 HA ILE A 838 0.889 0.679 -8.244 1.00 0.00 H new ATOM 0 HB ILE A 838 3.510 2.221 -8.674 1.00 0.00 H new ATOM 0 HG12 ILE A 838 3.361 -0.012 -7.196 1.00 0.00 H new ATOM 0 HG13 ILE A 838 4.351 1.351 -6.712 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.703 3.694 -6.853 1.00 0.00 H new ATOM 0 HG22 ILE A 838 1.599 3.718 -8.249 1.00 0.00 H new ATOM 0 HG23 ILE A 838 1.176 2.781 -6.797 1.00 0.00 H new ATOM 0 HD11 ILE A 838 2.973 0.550 -4.815 1.00 0.00 H new ATOM 0 HD12 ILE A 838 2.497 2.202 -5.273 1.00 0.00 H new ATOM 0 HD13 ILE A 838 1.493 0.818 -5.765 1.00 0.00 H new ATOM 534 N LEU A 839 -0.096 2.319 -9.781 1.00 0.00 N ATOM 535 CA LEU A 839 -0.774 3.158 -10.815 1.00 0.00 C ATOM 536 C LEU A 839 -1.911 3.954 -10.161 1.00 0.00 C ATOM 537 O LEU A 839 -2.316 3.644 -9.061 1.00 0.00 O ATOM 538 CB LEU A 839 -1.328 2.163 -11.838 1.00 0.00 C ATOM 539 CG LEU A 839 -0.620 2.361 -13.183 1.00 0.00 C ATOM 540 CD1 LEU A 839 0.509 1.336 -13.328 1.00 0.00 C ATOM 541 CD2 LEU A 839 -1.630 2.174 -14.319 1.00 0.00 C ATOM 0 H LEU A 839 -0.655 2.126 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.100 3.877 -11.282 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.180 1.142 -11.485 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -2.402 2.307 -11.956 1.00 0.00 H new ATOM 0 HG LEU A 839 -0.200 3.366 -13.228 1.00 0.00 H new ATOM 0 HD11 LEU A 839 1.010 1.480 -14.285 1.00 0.00 H new ATOM 0 HD12 LEU A 839 1.227 1.469 -12.519 1.00 0.00 H new ATOM 0 HD13 LEU A 839 0.094 0.329 -13.283 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -1.130 2.314 -15.277 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.049 1.169 -14.272 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -2.431 2.906 -14.218 1.00 0.00 H new ATOM 553 N PRO A 840 -2.400 4.958 -10.854 1.00 0.00 N ATOM 554 CA PRO A 840 -3.501 5.785 -10.307 1.00 0.00 C ATOM 555 C PRO A 840 -4.712 4.910 -9.996 1.00 0.00 C ATOM 556 O PRO A 840 -5.106 4.079 -10.792 1.00 0.00 O ATOM 557 CB PRO A 840 -3.797 6.757 -11.447 1.00 0.00 C ATOM 558 CG PRO A 840 -2.841 6.451 -12.618 1.00 0.00 C ATOM 559 CD PRO A 840 -1.897 5.313 -12.202 1.00 0.00 C ATOM 0 HA PRO A 840 -3.251 6.291 -9.375 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -4.833 6.657 -11.769 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -3.665 7.785 -11.111 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -3.409 6.166 -13.504 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -2.268 7.340 -12.879 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -1.950 4.469 -12.890 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -0.857 5.638 -12.175 1.00 0.00 H new ATOM 566 N SER A 841 -5.293 5.073 -8.836 1.00 0.00 N ATOM 567 CA SER A 841 -6.457 4.243 -8.455 1.00 0.00 C ATOM 568 C SER A 841 -7.472 4.192 -9.581 1.00 0.00 C ATOM 569 O SER A 841 -7.731 5.162 -10.267 1.00 0.00 O ATOM 570 CB SER A 841 -7.062 4.933 -7.233 1.00 0.00 C ATOM 571 OG SER A 841 -7.416 6.267 -7.573 1.00 0.00 O ATOM 0 H SER A 841 -5.002 5.754 -8.135 1.00 0.00 H new ATOM 0 HA SER A 841 -6.165 3.214 -8.245 1.00 0.00 H new ATOM 0 HB2 SER A 841 -7.941 4.387 -6.891 1.00 0.00 H new ATOM 0 HB3 SER A 841 -6.347 4.933 -6.410 1.00 0.00 H new ATOM 0 HG SER A 841 -6.768 6.888 -7.180 1.00 0.00 H new ATOM 577 N GLY A 842 -8.046 3.056 -9.753 1.00 0.00 N ATOM 578 CA GLY A 842 -9.072 2.878 -10.819 1.00 0.00 C ATOM 579 C GLY A 842 -8.413 2.374 -12.102 1.00 0.00 C ATOM 580 O GLY A 842 -8.158 3.130 -13.020 1.00 0.00 O ATOM 0 H GLY A 842 -7.854 2.222 -9.198 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -9.832 2.170 -10.489 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -9.579 3.824 -11.009 1.00 0.00 H new ATOM 740 N ILE A 852 -4.977 -14.003 -6.467 1.00 0.00 N ATOM 741 CA ILE A 852 -4.776 -14.336 -5.017 1.00 0.00 C ATOM 742 C ILE A 852 -4.784 -13.080 -4.147 1.00 0.00 C ATOM 743 O ILE A 852 -4.946 -13.157 -2.944 1.00 0.00 O ATOM 744 CB ILE A 852 -3.409 -15.061 -4.915 1.00 0.00 C ATOM 745 CG1 ILE A 852 -2.305 -14.089 -4.457 1.00 0.00 C ATOM 746 CG2 ILE A 852 -3.011 -15.674 -6.263 1.00 0.00 C ATOM 747 CD1 ILE A 852 -2.130 -12.962 -5.484 1.00 0.00 C ATOM 0 HA ILE A 852 -5.588 -14.967 -4.655 1.00 0.00 H new ATOM 0 HB ILE A 852 -3.517 -15.857 -4.178 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -2.562 -13.668 -3.485 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -1.365 -14.627 -4.333 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -2.049 -16.176 -6.164 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -3.767 -16.396 -6.572 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.934 -14.886 -7.012 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.347 -12.282 -5.148 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -1.852 -13.388 -6.448 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -3.067 -12.414 -5.586 1.00 0.00 H new ATOM 759 N THR A 853 -4.597 -11.929 -4.729 1.00 0.00 N ATOM 760 CA THR A 853 -4.579 -10.695 -3.941 1.00 0.00 C ATOM 761 C THR A 853 -5.833 -10.604 -3.113 1.00 0.00 C ATOM 762 O THR A 853 -6.931 -10.472 -3.609 1.00 0.00 O ATOM 763 CB THR A 853 -4.513 -9.594 -4.977 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.531 -9.785 -5.955 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.152 -9.659 -5.651 1.00 0.00 C ATOM 0 H THR A 853 -4.455 -11.803 -5.731 1.00 0.00 H new ATOM 0 HA THR A 853 -3.745 -10.638 -3.241 1.00 0.00 H new ATOM 0 HB THR A 853 -4.660 -8.625 -4.500 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.222 -9.098 -5.847 1.00 0.00 H new ATOM 0 HG21 THR A 853 -3.081 -8.873 -6.403 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.370 -9.519 -4.905 1.00 0.00 H new ATOM 0 HG23 THR A 853 -3.029 -10.631 -6.129 1.00 0.00 H new ATOM 773 N THR A 854 -5.665 -10.686 -1.848 1.00 0.00 N ATOM 774 CA THR A 854 -6.829 -10.612 -0.947 1.00 0.00 C ATOM 775 C THR A 854 -7.532 -9.278 -1.184 1.00 0.00 C ATOM 776 O THR A 854 -6.873 -8.271 -1.333 1.00 0.00 O ATOM 777 CB THR A 854 -6.246 -10.679 0.470 1.00 0.00 C ATOM 778 OG1 THR A 854 -5.924 -12.028 0.781 1.00 0.00 O ATOM 779 CG2 THR A 854 -7.267 -10.152 1.483 1.00 0.00 C ATOM 0 H THR A 854 -4.763 -10.803 -1.386 1.00 0.00 H new ATOM 0 HA THR A 854 -7.554 -11.410 -1.108 1.00 0.00 H new ATOM 0 HB THR A 854 -5.347 -10.064 0.518 1.00 0.00 H new ATOM 0 HG1 THR A 854 -5.549 -12.075 1.685 1.00 0.00 H new ATOM 0 HG21 THR A 854 -6.844 -10.204 2.486 1.00 0.00 H new ATOM 0 HG22 THR A 854 -7.514 -9.117 1.246 1.00 0.00 H new ATOM 0 HG23 THR A 854 -8.171 -10.760 1.439 1.00 0.00 H new ATOM 787 N PRO A 855 -8.837 -9.301 -1.192 1.00 0.00 N ATOM 788 CA PRO A 855 -9.610 -8.054 -1.377 1.00 0.00 C ATOM 789 C PRO A 855 -9.222 -7.104 -0.248 1.00 0.00 C ATOM 790 O PRO A 855 -10.003 -6.806 0.633 1.00 0.00 O ATOM 791 CB PRO A 855 -11.059 -8.538 -1.250 1.00 0.00 C ATOM 792 CG PRO A 855 -11.049 -10.061 -0.997 1.00 0.00 C ATOM 793 CD PRO A 855 -9.594 -10.553 -1.017 1.00 0.00 C ATOM 0 HA PRO A 855 -9.444 -7.524 -2.315 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.560 -8.022 -0.431 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.615 -8.309 -2.159 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.512 -10.288 -0.036 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.632 -10.575 -1.761 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -9.326 -11.064 -0.092 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -9.414 -11.254 -1.832 1.00 0.00 H new ATOM 800 N TYR A 856 -7.988 -6.668 -0.259 1.00 0.00 N ATOM 801 CA TYR A 856 -7.470 -5.786 0.808 1.00 0.00 C ATOM 802 C TYR A 856 -5.998 -5.564 0.520 1.00 0.00 C ATOM 803 O TYR A 856 -5.175 -6.427 0.752 1.00 0.00 O ATOM 804 CB TYR A 856 -7.648 -6.573 2.104 1.00 0.00 C ATOM 805 CG TYR A 856 -7.083 -5.824 3.295 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.698 -5.692 3.462 1.00 0.00 C ATOM 807 CD2 TYR A 856 -7.952 -5.284 4.251 1.00 0.00 C ATOM 808 CE1 TYR A 856 -5.187 -5.024 4.579 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.440 -4.611 5.366 1.00 0.00 C ATOM 810 CZ TYR A 856 -6.057 -4.482 5.531 1.00 0.00 C ATOM 811 OH TYR A 856 -5.551 -3.824 6.634 1.00 0.00 O ATOM 0 H TYR A 856 -7.309 -6.897 -0.984 1.00 0.00 H new ATOM 0 HA TYR A 856 -7.973 -4.821 0.871 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.707 -6.771 2.267 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -7.153 -7.540 2.014 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -5.024 -6.107 2.727 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -9.020 -5.387 4.128 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -4.119 -4.926 4.707 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -8.113 -4.191 6.099 1.00 0.00 H new ATOM 0 HH TYR A 856 -4.673 -4.195 6.862 1.00 0.00 H new ATOM 821 N MET A 857 -5.665 -4.443 -0.023 1.00 0.00 N ATOM 822 CA MET A 857 -4.240 -4.188 -0.367 1.00 0.00 C ATOM 823 C MET A 857 -3.356 -4.423 0.857 1.00 0.00 C ATOM 824 O MET A 857 -3.840 -4.464 1.970 1.00 0.00 O ATOM 825 CB MET A 857 -4.176 -2.725 -0.787 1.00 0.00 C ATOM 826 CG MET A 857 -2.771 -2.397 -1.299 1.00 0.00 C ATOM 827 SD MET A 857 -2.525 -0.606 -1.295 1.00 0.00 S ATOM 828 CE MET A 857 -3.649 -0.238 -2.653 1.00 0.00 C ATOM 0 H MET A 857 -6.311 -3.686 -0.247 1.00 0.00 H new ATOM 0 HA MET A 857 -3.888 -4.851 -1.157 1.00 0.00 H new ATOM 0 HB2 MET A 857 -4.913 -2.527 -1.566 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.425 -2.083 0.058 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.022 -2.878 -0.670 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.640 -2.790 -2.307 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.444 0.762 -3.034 1.00 0.00 H new ATOM 0 HE2 MET A 857 -3.506 -0.967 -3.451 1.00 0.00 H new ATOM 0 HE3 MET A 857 -4.678 -0.287 -2.297 1.00 0.00 H new ATOM 838 N THR A 858 -2.071 -4.586 0.679 1.00 0.00 N ATOM 839 CA THR A 858 -1.209 -4.830 1.870 1.00 0.00 C ATOM 840 C THR A 858 -0.053 -3.846 1.952 1.00 0.00 C ATOM 841 O THR A 858 0.509 -3.433 0.959 1.00 0.00 O ATOM 842 CB THR A 858 -0.737 -6.263 1.704 1.00 0.00 C ATOM 843 OG1 THR A 858 -0.150 -6.430 0.421 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.957 -7.168 1.845 1.00 0.00 C ATOM 0 H THR A 858 -1.590 -4.561 -0.220 1.00 0.00 H new ATOM 0 HA THR A 858 -1.749 -4.684 2.806 1.00 0.00 H new ATOM 0 HB THR A 858 0.011 -6.513 2.456 1.00 0.00 H new ATOM 0 HG1 THR A 858 0.645 -6.998 0.496 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.653 -8.209 1.731 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.403 -7.026 2.829 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.687 -6.917 1.076 1.00 0.00 H new ATOM 852 N LYS A 859 0.258 -3.446 3.161 1.00 0.00 N ATOM 853 CA LYS A 859 1.347 -2.449 3.417 1.00 0.00 C ATOM 854 C LYS A 859 2.470 -2.446 2.352 1.00 0.00 C ATOM 855 O LYS A 859 3.043 -1.408 2.099 1.00 0.00 O ATOM 856 CB LYS A 859 1.914 -2.830 4.786 1.00 0.00 C ATOM 857 CG LYS A 859 2.440 -4.267 4.750 1.00 0.00 C ATOM 858 CD LYS A 859 3.478 -4.457 5.859 1.00 0.00 C ATOM 859 CE LYS A 859 4.428 -5.595 5.480 1.00 0.00 C ATOM 860 NZ LYS A 859 3.621 -6.837 5.638 1.00 0.00 N ATOM 0 H LYS A 859 -0.210 -3.778 4.004 1.00 0.00 H new ATOM 0 HA LYS A 859 0.938 -1.439 3.377 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.717 -2.146 5.060 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.141 -2.735 5.549 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.618 -4.970 4.882 1.00 0.00 H new ATOM 0 HG3 LYS A 859 2.887 -4.478 3.778 1.00 0.00 H new ATOM 0 HD2 LYS A 859 4.040 -3.535 6.008 1.00 0.00 H new ATOM 0 HD3 LYS A 859 2.981 -4.683 6.802 1.00 0.00 H new ATOM 0 HE2 LYS A 859 4.788 -5.485 4.457 1.00 0.00 H new ATOM 0 HE3 LYS A 859 5.305 -5.609 6.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 4.164 -7.537 6.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 2.738 -6.616 6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 3.396 -7.226 4.700 1.00 0.00 H new ATOM 874 N TYR A 860 2.816 -3.545 1.708 1.00 0.00 N ATOM 875 CA TYR A 860 3.900 -3.423 0.688 1.00 0.00 C ATOM 876 C TYR A 860 3.377 -2.587 -0.458 1.00 0.00 C ATOM 877 O TYR A 860 4.015 -1.650 -0.890 1.00 0.00 O ATOM 878 CB TYR A 860 4.272 -4.818 0.203 1.00 0.00 C ATOM 879 CG TYR A 860 5.293 -4.697 -0.928 1.00 0.00 C ATOM 880 CD1 TYR A 860 6.023 -3.504 -1.094 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.498 -5.758 -1.821 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.943 -3.373 -2.134 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.424 -5.620 -2.867 1.00 0.00 C ATOM 884 CZ TYR A 860 7.144 -4.430 -3.023 1.00 0.00 C ATOM 885 OH TYR A 860 8.053 -4.302 -4.053 1.00 0.00 O ATOM 0 H TYR A 860 2.414 -4.473 1.839 1.00 0.00 H new ATOM 0 HA TYR A 860 4.786 -2.947 1.109 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.687 -5.403 1.023 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.384 -5.344 -0.147 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.869 -2.683 -0.410 1.00 0.00 H new ATOM 0 HD2 TYR A 860 4.945 -6.679 -1.705 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.499 -2.455 -2.251 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.582 -6.437 -3.555 1.00 0.00 H new ATOM 0 HH TYR A 860 8.071 -5.129 -4.578 1.00 0.00 H new ATOM 895 N GLU A 861 2.194 -2.886 -0.926 1.00 0.00 N ATOM 896 CA GLU A 861 1.611 -2.047 -2.011 1.00 0.00 C ATOM 897 C GLU A 861 1.834 -0.605 -1.572 1.00 0.00 C ATOM 898 O GLU A 861 2.268 0.248 -2.320 1.00 0.00 O ATOM 899 CB GLU A 861 0.115 -2.381 -2.045 1.00 0.00 C ATOM 900 CG GLU A 861 -0.117 -3.903 -2.063 1.00 0.00 C ATOM 901 CD GLU A 861 0.825 -4.583 -3.062 1.00 0.00 C ATOM 902 OE1 GLU A 861 2.021 -4.555 -2.834 1.00 0.00 O ATOM 903 OE2 GLU A 861 0.330 -5.128 -4.033 1.00 0.00 O ATOM 0 H GLU A 861 1.614 -3.663 -0.609 1.00 0.00 H new ATOM 0 HA GLU A 861 2.046 -2.211 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.377 -1.946 -1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.341 -1.931 -2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 861 0.045 -4.312 -1.066 1.00 0.00 H new ATOM 0 HG3 GLU A 861 -1.152 -4.115 -2.330 1.00 0.00 H new ATOM 910 N ARG A 862 1.596 -0.380 -0.310 1.00 0.00 N ATOM 911 CA ARG A 862 1.841 0.959 0.297 1.00 0.00 C ATOM 912 C ARG A 862 3.342 1.259 0.265 1.00 0.00 C ATOM 913 O ARG A 862 3.765 2.340 -0.085 1.00 0.00 O ATOM 914 CB ARG A 862 1.376 0.833 1.747 1.00 0.00 C ATOM 915 CG ARG A 862 2.034 1.922 2.615 1.00 0.00 C ATOM 916 CD ARG A 862 3.024 1.276 3.593 1.00 0.00 C ATOM 917 NE ARG A 862 4.373 1.674 3.102 1.00 0.00 N ATOM 918 CZ ARG A 862 5.442 1.195 3.677 1.00 0.00 C ATOM 919 NH1 ARG A 862 5.518 -0.077 3.959 1.00 0.00 N ATOM 920 NH2 ARG A 862 6.434 1.989 3.973 1.00 0.00 N ATOM 0 H ARG A 862 1.235 -1.080 0.338 1.00 0.00 H new ATOM 0 HA ARG A 862 1.321 1.757 -0.233 1.00 0.00 H new ATOM 0 HB2 ARG A 862 0.291 0.924 1.797 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.631 -0.154 2.134 1.00 0.00 H new ATOM 0 HG2 ARG A 862 2.552 2.642 1.981 1.00 0.00 H new ATOM 0 HG3 ARG A 862 1.271 2.472 3.165 1.00 0.00 H new ATOM 0 HD2 ARG A 862 2.857 1.626 4.612 1.00 0.00 H new ATOM 0 HD3 ARG A 862 2.914 0.192 3.606 1.00 0.00 H new ATOM 0 HE ARG A 862 4.461 2.320 2.318 1.00 0.00 H new ATOM 0 HH11 ARG A 862 4.741 -0.697 3.730 1.00 0.00 H new ATOM 0 HH12 ARG A 862 6.354 -0.451 4.408 1.00 0.00 H new ATOM 0 HH21 ARG A 862 6.374 2.984 3.755 1.00 0.00 H new ATOM 0 HH22 ARG A 862 7.270 1.615 4.422 1.00 0.00 H new ATOM 934 N ALA A 863 4.153 0.311 0.645 1.00 0.00 N ATOM 935 CA ALA A 863 5.623 0.566 0.636 1.00 0.00 C ATOM 936 C ALA A 863 6.115 0.752 -0.802 1.00 0.00 C ATOM 937 O ALA A 863 7.136 1.375 -1.053 1.00 0.00 O ATOM 938 CB ALA A 863 6.256 -0.671 1.275 1.00 0.00 C ATOM 0 H ALA A 863 3.868 -0.617 0.958 1.00 0.00 H new ATOM 0 HA ALA A 863 5.887 1.473 1.180 1.00 0.00 H new ATOM 0 HB1 ALA A 863 7.339 -0.553 1.302 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.879 -0.789 2.291 1.00 0.00 H new ATOM 0 HB3 ALA A 863 6.002 -1.554 0.689 1.00 0.00 H new ATOM 944 N ARG A 864 5.358 0.295 -1.755 1.00 0.00 N ATOM 945 CA ARG A 864 5.753 0.507 -3.172 1.00 0.00 C ATOM 946 C ARG A 864 5.155 1.847 -3.534 1.00 0.00 C ATOM 947 O ARG A 864 5.734 2.682 -4.200 1.00 0.00 O ATOM 948 CB ARG A 864 5.135 -0.644 -3.966 1.00 0.00 C ATOM 949 CG ARG A 864 6.254 -1.404 -4.684 1.00 0.00 C ATOM 950 CD ARG A 864 6.863 -0.512 -5.771 1.00 0.00 C ATOM 951 NE ARG A 864 8.214 -0.142 -5.259 1.00 0.00 N ATOM 952 CZ ARG A 864 9.005 0.598 -5.985 1.00 0.00 C ATOM 953 NH1 ARG A 864 9.351 0.204 -7.180 1.00 0.00 N ATOM 954 NH2 ARG A 864 9.451 1.731 -5.516 1.00 0.00 N ATOM 0 H ARG A 864 4.485 -0.215 -1.616 1.00 0.00 H new ATOM 0 HA ARG A 864 6.825 0.516 -3.368 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.591 -1.313 -3.299 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.415 -0.260 -4.689 1.00 0.00 H new ATOM 0 HG2 ARG A 864 7.022 -1.701 -3.970 1.00 0.00 H new ATOM 0 HG3 ARG A 864 5.860 -2.318 -5.128 1.00 0.00 H new ATOM 0 HD2 ARG A 864 6.933 -1.041 -6.721 1.00 0.00 H new ATOM 0 HD3 ARG A 864 6.251 0.373 -5.943 1.00 0.00 H new ATOM 0 HE ARG A 864 8.519 -0.468 -4.342 1.00 0.00 H new ATOM 0 HH11 ARG A 864 9.003 -0.682 -7.546 1.00 0.00 H new ATOM 0 HH12 ARG A 864 9.970 0.782 -7.748 1.00 0.00 H new ATOM 0 HH21 ARG A 864 9.181 2.038 -4.581 1.00 0.00 H new ATOM 0 HH22 ARG A 864 10.070 2.310 -6.084 1.00 0.00 H new ATOM 968 N VAL A 865 3.996 2.045 -2.986 1.00 0.00 N ATOM 969 CA VAL A 865 3.251 3.310 -3.115 1.00 0.00 C ATOM 970 C VAL A 865 4.154 4.433 -2.649 1.00 0.00 C ATOM 971 O VAL A 865 4.539 5.299 -3.391 1.00 0.00 O ATOM 972 CB VAL A 865 2.113 3.063 -2.136 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.761 4.306 -1.349 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.916 2.565 -2.895 1.00 0.00 C ATOM 0 H VAL A 865 3.515 1.341 -2.426 1.00 0.00 H new ATOM 0 HA VAL A 865 2.910 3.579 -4.115 1.00 0.00 H new ATOM 0 HB VAL A 865 2.436 2.313 -1.414 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.944 4.083 -0.663 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.631 4.636 -0.782 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.454 5.096 -2.034 1.00 0.00 H new ATOM 0 HG21 VAL A 865 0.095 2.385 -2.202 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.614 3.312 -3.629 1.00 0.00 H new ATOM 0 HG23 VAL A 865 1.170 1.636 -3.406 1.00 0.00 H new ATOM 984 N LEU A 866 4.510 4.362 -1.409 1.00 0.00 N ATOM 985 CA LEU A 866 5.422 5.341 -0.790 1.00 0.00 C ATOM 986 C LEU A 866 6.589 5.517 -1.734 1.00 0.00 C ATOM 987 O LEU A 866 7.091 6.600 -1.929 1.00 0.00 O ATOM 988 CB LEU A 866 5.835 4.686 0.550 1.00 0.00 C ATOM 989 CG LEU A 866 7.345 4.834 0.818 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.577 5.063 2.313 1.00 0.00 C ATOM 991 CD2 LEU A 866 8.069 3.554 0.393 1.00 0.00 C ATOM 0 H LEU A 866 4.191 3.632 -0.772 1.00 0.00 H new ATOM 0 HA LEU A 866 4.995 6.327 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.275 5.143 1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.571 3.629 0.534 1.00 0.00 H new ATOM 0 HG LEU A 866 7.730 5.681 0.249 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.645 5.168 2.504 1.00 0.00 H new ATOM 0 HD12 LEU A 866 7.062 5.971 2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 866 7.190 4.214 2.876 1.00 0.00 H new ATOM 0 HD21 LEU A 866 9.137 3.660 0.583 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.681 2.710 0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 866 7.905 3.379 -0.670 1.00 0.00 H new ATOM 1003 N GLY A 867 7.002 4.450 -2.351 1.00 0.00 N ATOM 1004 CA GLY A 867 8.106 4.571 -3.313 1.00 0.00 C ATOM 1005 C GLY A 867 7.631 5.382 -4.506 1.00 0.00 C ATOM 1006 O GLY A 867 8.276 6.326 -4.913 1.00 0.00 O ATOM 0 H GLY A 867 6.622 3.511 -2.227 1.00 0.00 H new ATOM 0 HA2 GLY A 867 8.963 5.055 -2.845 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.435 3.583 -3.635 1.00 0.00 H new ATOM 1010 N THR A 868 6.502 5.044 -5.066 1.00 0.00 N ATOM 1011 CA THR A 868 6.037 5.846 -6.246 1.00 0.00 C ATOM 1012 C THR A 868 5.481 7.191 -5.791 1.00 0.00 C ATOM 1013 O THR A 868 5.398 8.128 -6.560 1.00 0.00 O ATOM 1014 CB THR A 868 4.995 5.021 -7.010 1.00 0.00 C ATOM 1015 OG1 THR A 868 5.236 5.171 -8.402 1.00 0.00 O ATOM 1016 CG2 THR A 868 3.582 5.518 -6.697 1.00 0.00 C ATOM 0 H THR A 868 5.896 4.277 -4.775 1.00 0.00 H new ATOM 0 HA THR A 868 6.872 6.063 -6.913 1.00 0.00 H new ATOM 0 HB THR A 868 5.075 3.976 -6.711 1.00 0.00 H new ATOM 0 HG1 THR A 868 4.578 4.648 -8.906 1.00 0.00 H new ATOM 0 HG21 THR A 868 2.856 4.921 -7.248 1.00 0.00 H new ATOM 0 HG22 THR A 868 3.392 5.425 -5.628 1.00 0.00 H new ATOM 0 HG23 THR A 868 3.490 6.563 -6.992 1.00 0.00 H new ATOM 1024 N ARG A 869 5.156 7.314 -4.537 1.00 0.00 N ATOM 1025 CA ARG A 869 4.673 8.612 -4.032 1.00 0.00 C ATOM 1026 C ARG A 869 5.921 9.411 -3.768 1.00 0.00 C ATOM 1027 O ARG A 869 6.065 10.538 -4.193 1.00 0.00 O ATOM 1028 CB ARG A 869 3.920 8.307 -2.733 1.00 0.00 C ATOM 1029 CG ARG A 869 2.462 8.752 -2.867 1.00 0.00 C ATOM 1030 CD ARG A 869 1.617 7.592 -3.404 1.00 0.00 C ATOM 1031 NE ARG A 869 1.238 7.999 -4.785 1.00 0.00 N ATOM 1032 CZ ARG A 869 0.292 8.880 -4.970 1.00 0.00 C ATOM 1033 NH1 ARG A 869 -0.875 8.710 -4.409 1.00 0.00 N ATOM 1034 NH2 ARG A 869 0.513 9.929 -5.713 1.00 0.00 N ATOM 0 H ARG A 869 5.206 6.567 -3.844 1.00 0.00 H new ATOM 0 HA ARG A 869 4.013 9.156 -4.707 1.00 0.00 H new ATOM 0 HB2 ARG A 869 3.966 7.240 -2.516 1.00 0.00 H new ATOM 0 HB3 ARG A 869 4.393 8.823 -1.897 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.080 9.076 -1.899 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.393 9.607 -3.539 1.00 0.00 H new ATOM 0 HD2 ARG A 869 2.183 6.660 -3.408 1.00 0.00 H new ATOM 0 HD3 ARG A 869 0.735 7.426 -2.785 1.00 0.00 H new ATOM 0 HE ARG A 869 1.717 7.590 -5.587 1.00 0.00 H new ATOM 0 HH11 ARG A 869 -1.047 7.890 -3.827 1.00 0.00 H new ATOM 0 HH12 ARG A 869 -1.615 9.397 -4.553 1.00 0.00 H new ATOM 0 HH21 ARG A 869 1.425 10.062 -6.150 1.00 0.00 H new ATOM 0 HH22 ARG A 869 -0.226 10.617 -5.857 1.00 0.00 H new ATOM 1048 N ALA A 870 6.849 8.793 -3.093 1.00 0.00 N ATOM 1049 CA ALA A 870 8.147 9.464 -2.808 1.00 0.00 C ATOM 1050 C ALA A 870 8.759 10.079 -4.076 1.00 0.00 C ATOM 1051 O ALA A 870 9.448 11.071 -4.004 1.00 0.00 O ATOM 1052 CB ALA A 870 9.046 8.350 -2.287 1.00 0.00 C ATOM 0 H ALA A 870 6.763 7.846 -2.724 1.00 0.00 H new ATOM 0 HA ALA A 870 8.025 10.284 -2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.029 8.757 -2.050 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.606 7.918 -1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.147 7.577 -3.049 1.00 0.00 H new ATOM 1058 N LEU A 871 8.512 9.525 -5.235 1.00 0.00 N ATOM 1059 CA LEU A 871 9.106 10.160 -6.475 1.00 0.00 C ATOM 1060 C LEU A 871 8.156 11.213 -6.986 1.00 0.00 C ATOM 1061 O LEU A 871 8.566 12.262 -7.453 1.00 0.00 O ATOM 1062 CB LEU A 871 9.368 9.091 -7.562 1.00 0.00 C ATOM 1063 CG LEU A 871 8.925 7.696 -7.129 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.488 6.913 -8.364 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.103 6.986 -6.456 1.00 0.00 C ATOM 0 H LEU A 871 7.947 8.690 -5.387 1.00 0.00 H new ATOM 0 HA LEU A 871 10.062 10.621 -6.225 1.00 0.00 H new ATOM 0 HB2 LEU A 871 8.841 9.369 -8.475 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.431 9.073 -7.801 1.00 0.00 H new ATOM 0 HG LEU A 871 8.094 7.763 -6.427 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.169 5.914 -8.067 1.00 0.00 H new ATOM 0 HD12 LEU A 871 7.659 7.430 -8.848 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.323 6.835 -9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 871 9.796 5.988 -6.143 1.00 0.00 H new ATOM 0 HD22 LEU A 871 10.931 6.907 -7.161 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.422 7.557 -5.584 1.00 0.00 H new ATOM 1077 N GLN A 872 6.886 10.963 -6.868 1.00 0.00 N ATOM 1078 CA GLN A 872 5.897 11.973 -7.308 1.00 0.00 C ATOM 1079 C GLN A 872 6.330 13.315 -6.721 1.00 0.00 C ATOM 1080 O GLN A 872 6.732 14.227 -7.417 1.00 0.00 O ATOM 1081 CB GLN A 872 4.579 11.480 -6.700 1.00 0.00 C ATOM 1082 CG GLN A 872 3.629 11.015 -7.812 1.00 0.00 C ATOM 1083 CD GLN A 872 3.395 9.507 -7.698 1.00 0.00 C ATOM 1084 OE1 GLN A 872 2.803 9.043 -6.744 1.00 0.00 O ATOM 1085 NE2 GLN A 872 3.838 8.718 -8.638 1.00 0.00 N ATOM 0 H GLN A 872 6.492 10.103 -6.486 1.00 0.00 H new ATOM 0 HA GLN A 872 5.805 12.098 -8.387 1.00 0.00 H new ATOM 0 HB2 GLN A 872 4.772 10.660 -6.009 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.114 12.279 -6.123 1.00 0.00 H new ATOM 0 HG2 GLN A 872 2.680 11.546 -7.738 1.00 0.00 H new ATOM 0 HG3 GLN A 872 4.052 11.254 -8.788 1.00 0.00 H new ATOM 0 HE21 GLN A 872 4.335 9.108 -9.439 1.00 0.00 H new ATOM 0 HE22 GLN A 872 3.687 7.711 -8.572 1.00 0.00 H new ATOM 1094 N ILE A 873 6.286 13.400 -5.432 1.00 0.00 N ATOM 1095 CA ILE A 873 6.727 14.626 -4.710 1.00 0.00 C ATOM 1096 C ILE A 873 8.192 14.883 -4.919 1.00 0.00 C ATOM 1097 O ILE A 873 8.623 16.015 -4.983 1.00 0.00 O ATOM 1098 CB ILE A 873 6.536 14.307 -3.246 1.00 0.00 C ATOM 1099 CG1 ILE A 873 6.850 12.814 -2.986 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.109 14.645 -2.890 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.072 12.687 -2.087 1.00 0.00 C ATOM 0 H ILE A 873 5.954 12.651 -4.824 1.00 0.00 H new ATOM 0 HA ILE A 873 6.170 15.496 -5.058 1.00 0.00 H new ATOM 0 HB ILE A 873 7.215 14.890 -2.623 1.00 0.00 H new ATOM 0 HG12 ILE A 873 5.993 12.330 -2.518 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.029 12.302 -3.931 1.00 0.00 H new ATOM 0 HG21 ILE A 873 4.935 14.426 -1.836 1.00 0.00 H new ATOM 0 HG22 ILE A 873 4.929 15.704 -3.075 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.431 14.049 -3.501 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.285 11.633 -1.910 1.00 0.00 H new ATOM 0 HD12 ILE A 873 8.930 13.154 -2.571 1.00 0.00 H new ATOM 0 HD13 ILE A 873 7.877 13.183 -1.136 1.00 0.00 H new ATOM 1113 N ALA A 874 8.975 13.849 -5.020 1.00 0.00 N ATOM 1114 CA ALA A 874 10.423 14.078 -5.217 1.00 0.00 C ATOM 1115 C ALA A 874 10.605 14.968 -6.431 1.00 0.00 C ATOM 1116 O ALA A 874 11.627 15.602 -6.610 1.00 0.00 O ATOM 1117 CB ALA A 874 11.045 12.706 -5.402 1.00 0.00 C ATOM 0 H ALA A 874 8.680 12.874 -4.975 1.00 0.00 H new ATOM 0 HA ALA A 874 10.901 14.581 -4.376 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.119 12.811 -5.553 1.00 0.00 H new ATOM 0 HB2 ALA A 874 10.860 12.100 -4.515 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.602 12.220 -6.272 1.00 0.00 H new ATOM 1123 N MET A 875 9.576 15.083 -7.225 1.00 0.00 N ATOM 1124 CA MET A 875 9.654 16.012 -8.375 1.00 0.00 C ATOM 1125 C MET A 875 9.054 17.325 -7.884 1.00 0.00 C ATOM 1126 O MET A 875 9.716 18.337 -7.768 1.00 0.00 O ATOM 1127 CB MET A 875 8.800 15.382 -9.478 1.00 0.00 C ATOM 1128 CG MET A 875 9.009 16.146 -10.787 1.00 0.00 C ATOM 1129 SD MET A 875 7.754 17.442 -10.939 1.00 0.00 S ATOM 1130 CE MET A 875 6.624 16.538 -12.025 1.00 0.00 C ATOM 0 H MET A 875 8.696 14.578 -7.125 1.00 0.00 H new ATOM 0 HA MET A 875 10.660 16.190 -8.754 1.00 0.00 H new ATOM 0 HB2 MET A 875 9.072 14.335 -9.609 1.00 0.00 H new ATOM 0 HB3 MET A 875 7.748 15.405 -9.195 1.00 0.00 H new ATOM 0 HG2 MET A 875 10.006 16.586 -10.808 1.00 0.00 H new ATOM 0 HG3 MET A 875 8.945 15.462 -11.633 1.00 0.00 H new ATOM 0 HE1 MET A 875 5.760 17.163 -12.252 1.00 0.00 H new ATOM 0 HE2 MET A 875 7.138 16.279 -12.951 1.00 0.00 H new ATOM 0 HE3 MET A 875 6.292 15.627 -11.527 1.00 0.00 H new ATOM 1140 N CYS A 876 7.804 17.270 -7.534 1.00 0.00 N ATOM 1141 CA CYS A 876 7.099 18.451 -6.965 1.00 0.00 C ATOM 1142 C CYS A 876 6.245 17.972 -5.791 1.00 0.00 C ATOM 1143 O CYS A 876 6.655 18.013 -4.650 1.00 0.00 O ATOM 1144 CB CYS A 876 6.246 19.012 -8.109 1.00 0.00 C ATOM 1145 SG CYS A 876 5.249 20.398 -7.504 1.00 0.00 S ATOM 0 H CYS A 876 7.225 16.435 -7.620 1.00 0.00 H new ATOM 0 HA CYS A 876 7.769 19.224 -6.589 1.00 0.00 H new ATOM 0 HB2 CYS A 876 6.888 19.342 -8.926 1.00 0.00 H new ATOM 0 HB3 CYS A 876 5.598 18.232 -8.508 1.00 0.00 H new ATOM 0 HG CYS A 876 4.529 20.872 -8.477 1.00 0.00 H new ATOM 1151 N ALA A 877 5.068 17.479 -6.077 1.00 0.00 N ATOM 1152 CA ALA A 877 4.186 16.954 -4.989 1.00 0.00 C ATOM 1153 C ALA A 877 2.806 16.477 -5.492 1.00 0.00 C ATOM 1154 O ALA A 877 1.796 16.841 -4.921 1.00 0.00 O ATOM 1155 CB ALA A 877 4.025 18.097 -4.000 1.00 0.00 C ATOM 0 H ALA A 877 4.678 17.417 -7.017 1.00 0.00 H new ATOM 0 HA ALA A 877 4.642 16.071 -4.541 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.388 17.778 -3.175 1.00 0.00 H new ATOM 0 HB2 ALA A 877 5.003 18.384 -3.613 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.569 18.951 -4.502 1.00 0.00 H new ATOM 1161 N PRO A 878 2.789 15.630 -6.500 1.00 0.00 N ATOM 1162 CA PRO A 878 1.505 15.066 -6.997 1.00 0.00 C ATOM 1163 C PRO A 878 0.881 14.223 -5.881 1.00 0.00 C ATOM 1164 O PRO A 878 -0.273 13.847 -5.919 1.00 0.00 O ATOM 1165 CB PRO A 878 1.956 14.166 -8.140 1.00 0.00 C ATOM 1166 CG PRO A 878 3.487 14.236 -8.247 1.00 0.00 C ATOM 1167 CD PRO A 878 4.018 15.199 -7.188 1.00 0.00 C ATOM 0 HA PRO A 878 0.770 15.811 -7.302 1.00 0.00 H new ATOM 0 HB2 PRO A 878 1.636 13.139 -7.961 1.00 0.00 H new ATOM 0 HB3 PRO A 878 1.497 14.485 -9.076 1.00 0.00 H new ATOM 0 HG2 PRO A 878 3.920 13.246 -8.105 1.00 0.00 H new ATOM 0 HG3 PRO A 878 3.780 14.572 -9.242 1.00 0.00 H new ATOM 0 HD2 PRO A 878 4.713 14.709 -6.507 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.549 16.040 -7.634 1.00 0.00 H new ATOM 1174 N VAL A 879 1.677 13.930 -4.892 1.00 0.00 N ATOM 1175 CA VAL A 879 1.237 13.112 -3.728 1.00 0.00 C ATOM 1176 C VAL A 879 -0.030 13.725 -3.122 1.00 0.00 C ATOM 1177 O VAL A 879 -0.536 14.725 -3.593 1.00 0.00 O ATOM 1178 CB VAL A 879 2.464 13.217 -2.793 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.135 12.982 -1.312 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.527 12.200 -3.242 1.00 0.00 C ATOM 0 H VAL A 879 2.649 14.235 -4.842 1.00 0.00 H new ATOM 0 HA VAL A 879 0.971 12.079 -3.950 1.00 0.00 H new ATOM 0 HB VAL A 879 2.831 14.240 -2.872 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.045 13.072 -0.718 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.409 13.724 -0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 879 1.717 11.983 -1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.396 12.268 -2.587 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.112 11.193 -3.191 1.00 0.00 H new ATOM 0 HG23 VAL A 879 3.828 12.417 -4.267 1.00 0.00 H new ATOM 1190 N MET A 880 -0.559 13.110 -2.111 1.00 0.00 N ATOM 1191 CA MET A 880 -1.822 13.624 -1.494 1.00 0.00 C ATOM 1192 C MET A 880 -1.520 14.570 -0.333 1.00 0.00 C ATOM 1193 O MET A 880 -2.376 14.879 0.473 1.00 0.00 O ATOM 1194 CB MET A 880 -2.563 12.381 -1.008 1.00 0.00 C ATOM 1195 CG MET A 880 -3.501 11.893 -2.113 1.00 0.00 C ATOM 1196 SD MET A 880 -4.868 13.065 -2.305 1.00 0.00 S ATOM 1197 CE MET A 880 -4.498 13.569 -4.003 1.00 0.00 C ATOM 0 H MET A 880 -0.176 12.270 -1.677 1.00 0.00 H new ATOM 0 HA MET A 880 -2.416 14.199 -2.205 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.852 11.598 -0.746 1.00 0.00 H new ATOM 0 HB3 MET A 880 -3.131 12.610 -0.107 1.00 0.00 H new ATOM 0 HG2 MET A 880 -2.956 11.797 -3.052 1.00 0.00 H new ATOM 0 HG3 MET A 880 -3.888 10.904 -1.866 1.00 0.00 H new ATOM 0 HE1 MET A 880 -4.964 14.533 -4.206 1.00 0.00 H new ATOM 0 HE2 MET A 880 -3.419 13.653 -4.131 1.00 0.00 H new ATOM 0 HE3 MET A 880 -4.888 12.824 -4.697 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.324 15.072 -0.287 1.00 0.00 N ATOM 1208 CA VAL A 881 0.068 16.042 0.749 1.00 0.00 C ATOM 1209 C VAL A 881 0.994 17.033 0.053 1.00 0.00 C ATOM 1210 O VAL A 881 1.447 16.793 -1.051 1.00 0.00 O ATOM 1211 CB VAL A 881 0.772 15.251 1.867 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.248 14.368 2.610 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.867 14.361 1.277 1.00 0.00 C ATOM 0 H VAL A 881 0.417 14.839 -0.948 1.00 0.00 H new ATOM 0 HA VAL A 881 -0.762 16.585 1.200 1.00 0.00 H new ATOM 0 HB VAL A 881 1.218 15.961 2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 881 0.259 13.812 3.399 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.022 14.997 3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -0.703 13.669 1.908 1.00 0.00 H new ATOM 0 HG21 VAL A 881 2.357 13.807 2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.424 13.660 0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.602 14.981 0.762 1.00 0.00 H new ATOM 1223 N GLU A 882 1.240 18.148 0.641 1.00 0.00 N ATOM 1224 CA GLU A 882 2.097 19.168 -0.042 1.00 0.00 C ATOM 1225 C GLU A 882 3.176 19.731 0.886 1.00 0.00 C ATOM 1226 O GLU A 882 3.068 20.844 1.365 1.00 0.00 O ATOM 1227 CB GLU A 882 1.122 20.276 -0.448 1.00 0.00 C ATOM 1228 CG GLU A 882 0.739 20.108 -1.920 1.00 0.00 C ATOM 1229 CD GLU A 882 -0.670 20.658 -2.146 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -1.614 20.000 -1.739 1.00 0.00 O ATOM 1231 OE2 GLU A 882 -0.784 21.726 -2.724 1.00 0.00 O ATOM 0 H GLU A 882 0.894 18.413 1.563 1.00 0.00 H new ATOM 0 HA GLU A 882 2.631 18.733 -0.887 1.00 0.00 H new ATOM 0 HB2 GLU A 882 0.230 20.237 0.177 1.00 0.00 H new ATOM 0 HB3 GLU A 882 1.579 21.253 -0.290 1.00 0.00 H new ATOM 0 HG2 GLU A 882 1.452 20.634 -2.555 1.00 0.00 H new ATOM 0 HG3 GLU A 882 0.779 19.055 -2.199 1.00 0.00 H new ATOM 1238 N LEU A 883 4.224 18.992 1.131 1.00 0.00 N ATOM 1239 CA LEU A 883 5.305 19.518 2.010 1.00 0.00 C ATOM 1240 C LEU A 883 5.905 20.798 1.395 1.00 0.00 C ATOM 1241 O LEU A 883 5.492 21.894 1.718 1.00 0.00 O ATOM 1242 CB LEU A 883 6.345 18.395 2.082 1.00 0.00 C ATOM 1243 CG LEU A 883 7.537 18.852 2.926 1.00 0.00 C ATOM 1244 CD1 LEU A 883 7.098 19.016 4.382 1.00 0.00 C ATOM 1245 CD2 LEU A 883 8.648 17.804 2.845 1.00 0.00 C ATOM 0 H LEU A 883 4.377 18.053 0.763 1.00 0.00 H new ATOM 0 HA LEU A 883 4.945 19.788 3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 883 5.900 17.501 2.518 1.00 0.00 H new ATOM 0 HB3 LEU A 883 6.678 18.129 1.079 1.00 0.00 H new ATOM 0 HG LEU A 883 7.906 19.805 2.548 1.00 0.00 H new ATOM 0 HD11 LEU A 883 7.947 19.341 4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 883 6.304 19.761 4.441 1.00 0.00 H new ATOM 0 HD13 LEU A 883 6.729 18.063 4.761 1.00 0.00 H new ATOM 0 HD21 LEU A 883 9.498 18.128 3.446 1.00 0.00 H new ATOM 0 HD22 LEU A 883 8.278 16.851 3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 883 8.961 17.685 1.808 1.00 0.00 H new ATOM 1257 N GLU A 884 6.874 20.673 0.518 1.00 0.00 N ATOM 1258 CA GLU A 884 7.485 21.895 -0.099 1.00 0.00 C ATOM 1259 C GLU A 884 7.870 21.665 -1.572 1.00 0.00 C ATOM 1260 O GLU A 884 8.419 22.540 -2.213 1.00 0.00 O ATOM 1261 CB GLU A 884 8.740 22.158 0.735 1.00 0.00 C ATOM 1262 CG GLU A 884 8.650 23.542 1.384 1.00 0.00 C ATOM 1263 CD GLU A 884 8.207 23.397 2.841 1.00 0.00 C ATOM 1264 OE1 GLU A 884 8.834 22.635 3.557 1.00 0.00 O ATOM 1265 OE2 GLU A 884 7.246 24.050 3.216 1.00 0.00 O ATOM 0 H GLU A 884 7.266 19.785 0.205 1.00 0.00 H new ATOM 0 HA GLU A 884 6.786 22.731 -0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 884 8.844 21.392 1.503 1.00 0.00 H new ATOM 0 HB3 GLU A 884 9.627 22.099 0.104 1.00 0.00 H new ATOM 0 HG2 GLU A 884 9.618 24.041 1.335 1.00 0.00 H new ATOM 0 HG3 GLU A 884 7.942 24.166 0.838 1.00 0.00 H new ATOM 1272 N GLY A 885 7.627 20.498 -2.105 1.00 0.00 N ATOM 1273 CA GLY A 885 8.020 20.215 -3.512 1.00 0.00 C ATOM 1274 C GLY A 885 8.939 18.989 -3.511 1.00 0.00 C ATOM 1275 O GLY A 885 9.090 18.314 -4.507 1.00 0.00 O ATOM 0 H GLY A 885 7.170 19.725 -1.622 1.00 0.00 H new ATOM 0 HA2 GLY A 885 7.137 20.029 -4.124 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.532 21.074 -3.945 1.00 0.00 H new ATOM 1279 N GLU A 886 9.538 18.712 -2.371 1.00 0.00 N ATOM 1280 CA GLU A 886 10.461 17.542 -2.191 1.00 0.00 C ATOM 1281 C GLU A 886 11.493 17.907 -1.133 1.00 0.00 C ATOM 1282 O GLU A 886 12.117 18.947 -1.197 1.00 0.00 O ATOM 1283 CB GLU A 886 11.172 17.278 -3.522 1.00 0.00 C ATOM 1284 CG GLU A 886 12.404 16.389 -3.285 1.00 0.00 C ATOM 1285 CD GLU A 886 13.678 17.193 -3.554 1.00 0.00 C ATOM 1286 OE1 GLU A 886 13.738 18.333 -3.122 1.00 0.00 O ATOM 1287 OE2 GLU A 886 14.569 16.656 -4.190 1.00 0.00 O ATOM 0 H GLU A 886 9.418 19.273 -1.527 1.00 0.00 H new ATOM 0 HA GLU A 886 9.908 16.654 -1.883 1.00 0.00 H new ATOM 0 HB2 GLU A 886 10.490 16.792 -4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 886 11.474 18.221 -3.977 1.00 0.00 H new ATOM 0 HG2 GLU A 886 12.406 16.019 -2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.367 15.518 -3.939 1.00 0.00 H new ATOM 1294 N THR A 887 11.685 17.062 -0.170 1.00 0.00 N ATOM 1295 CA THR A 887 12.676 17.351 0.880 1.00 0.00 C ATOM 1296 C THR A 887 12.906 16.056 1.621 1.00 0.00 C ATOM 1297 O THR A 887 14.018 15.639 1.879 1.00 0.00 O ATOM 1298 CB THR A 887 11.992 18.389 1.780 1.00 0.00 C ATOM 1299 OG1 THR A 887 11.987 19.649 1.126 1.00 0.00 O ATOM 1300 CG2 THR A 887 12.743 18.509 3.110 1.00 0.00 C ATOM 0 H THR A 887 11.191 16.176 -0.067 1.00 0.00 H new ATOM 0 HA THR A 887 13.634 17.725 0.519 1.00 0.00 H new ATOM 0 HB THR A 887 10.968 18.071 1.977 1.00 0.00 H new ATOM 0 HG1 THR A 887 12.451 19.573 0.266 1.00 0.00 H new ATOM 0 HG21 THR A 887 12.249 19.248 3.741 1.00 0.00 H new ATOM 0 HG22 THR A 887 12.745 17.543 3.615 1.00 0.00 H new ATOM 0 HG23 THR A 887 13.770 18.821 2.921 1.00 0.00 H new ATOM 1308 N ASP A 888 11.829 15.419 1.950 1.00 0.00 N ATOM 1309 CA ASP A 888 11.900 14.139 2.660 1.00 0.00 C ATOM 1310 C ASP A 888 11.946 12.969 1.672 1.00 0.00 C ATOM 1311 O ASP A 888 11.319 13.025 0.632 1.00 0.00 O ATOM 1312 CB ASP A 888 10.621 14.109 3.467 1.00 0.00 C ATOM 1313 CG ASP A 888 10.836 13.305 4.749 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.648 12.101 4.710 1.00 0.00 O ATOM 1315 OD2 ASP A 888 11.186 13.908 5.750 1.00 0.00 O ATOM 0 H ASP A 888 10.884 15.745 1.749 1.00 0.00 H new ATOM 0 HA ASP A 888 12.794 14.046 3.277 1.00 0.00 H new ATOM 0 HB2 ASP A 888 10.311 15.125 3.712 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.819 13.664 2.878 1.00 0.00 H new ATOM 1320 N PRO A 889 12.662 11.931 2.025 1.00 0.00 N ATOM 1321 CA PRO A 889 12.743 10.743 1.148 1.00 0.00 C ATOM 1322 C PRO A 889 11.402 9.988 1.121 1.00 0.00 C ATOM 1323 O PRO A 889 11.229 9.067 0.349 1.00 0.00 O ATOM 1324 CB PRO A 889 13.820 9.894 1.836 1.00 0.00 C ATOM 1325 CG PRO A 889 14.300 10.633 3.099 1.00 0.00 C ATOM 1326 CD PRO A 889 13.439 11.888 3.287 1.00 0.00 C ATOM 0 HA PRO A 889 12.970 10.987 0.110 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.418 8.916 2.100 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.656 9.722 1.158 1.00 0.00 H new ATOM 0 HG2 PRO A 889 14.219 9.984 3.971 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.351 10.906 3.002 1.00 0.00 H new ATOM 0 HD2 PRO A 889 12.792 11.810 4.160 1.00 0.00 H new ATOM 0 HD3 PRO A 889 14.048 12.782 3.420 1.00 0.00 H new ATOM 1333 N LEU A 890 10.452 10.358 1.962 1.00 0.00 N ATOM 1334 CA LEU A 890 9.148 9.640 1.976 1.00 0.00 C ATOM 1335 C LEU A 890 8.162 10.231 3.003 1.00 0.00 C ATOM 1336 O LEU A 890 7.118 9.657 3.225 1.00 0.00 O ATOM 1337 CB LEU A 890 9.478 8.167 2.322 1.00 0.00 C ATOM 1338 CG LEU A 890 9.993 7.999 3.773 1.00 0.00 C ATOM 1339 CD1 LEU A 890 11.113 8.993 4.086 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.849 8.202 4.767 1.00 0.00 C ATOM 0 H LEU A 890 10.533 11.123 2.631 1.00 0.00 H new ATOM 0 HA LEU A 890 8.654 9.734 1.009 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.586 7.556 2.184 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.231 7.794 1.627 1.00 0.00 H new ATOM 0 HG LEU A 890 10.389 6.988 3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.452 8.848 5.112 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.946 8.830 3.402 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.740 10.010 3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 890 9.224 8.081 5.783 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.438 9.205 4.649 1.00 0.00 H new ATOM 0 HD23 LEU A 890 8.068 7.465 4.579 1.00 0.00 H new ATOM 1352 N LEU A 891 8.443 11.365 3.626 1.00 0.00 N ATOM 1353 CA LEU A 891 7.448 11.934 4.607 1.00 0.00 C ATOM 1354 C LEU A 891 6.096 11.868 3.965 1.00 0.00 C ATOM 1355 O LEU A 891 5.102 11.549 4.558 1.00 0.00 O ATOM 1356 CB LEU A 891 7.878 13.390 4.838 1.00 0.00 C ATOM 1357 CG LEU A 891 6.679 14.372 4.963 1.00 0.00 C ATOM 1358 CD1 LEU A 891 5.972 14.595 3.610 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.668 13.857 5.998 1.00 0.00 C ATOM 0 H LEU A 891 9.297 11.908 3.501 1.00 0.00 H new ATOM 0 HA LEU A 891 7.410 11.396 5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.480 13.444 5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.515 13.709 4.013 1.00 0.00 H new ATOM 0 HG LEU A 891 7.081 15.330 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 891 5.141 15.287 3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.680 15.012 2.894 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.595 13.643 3.235 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.835 14.557 6.073 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.295 12.881 5.688 1.00 0.00 H new ATOM 0 HD23 LEU A 891 6.155 13.768 6.969 1.00 0.00 H new ATOM 1371 N ILE A 892 6.104 12.187 2.738 1.00 0.00 N ATOM 1372 CA ILE A 892 4.877 12.175 1.924 1.00 0.00 C ATOM 1373 C ILE A 892 4.416 10.753 1.754 1.00 0.00 C ATOM 1374 O ILE A 892 3.250 10.435 1.872 1.00 0.00 O ATOM 1375 CB ILE A 892 5.349 12.708 0.592 1.00 0.00 C ATOM 1376 CG1 ILE A 892 4.975 14.168 0.477 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.731 11.916 -0.551 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.104 14.871 -0.235 1.00 0.00 C ATOM 0 H ILE A 892 6.942 12.470 2.230 1.00 0.00 H new ATOM 0 HA ILE A 892 4.056 12.746 2.357 1.00 0.00 H new ATOM 0 HB ILE A 892 6.432 12.604 0.531 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.043 14.282 -0.076 1.00 0.00 H new ATOM 0 HG13 ILE A 892 4.815 14.602 1.464 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.083 12.315 -1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 892 5.022 10.869 -0.467 1.00 0.00 H new ATOM 0 HG23 ILE A 892 3.645 11.996 -0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 892 5.867 15.930 -0.336 1.00 0.00 H new ATOM 0 HD12 ILE A 892 7.023 14.758 0.340 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.239 14.434 -1.224 1.00 0.00 H new ATOM 1390 N ALA A 893 5.340 9.900 1.450 1.00 0.00 N ATOM 1391 CA ALA A 893 4.952 8.479 1.238 1.00 0.00 C ATOM 1392 C ALA A 893 4.551 7.876 2.581 1.00 0.00 C ATOM 1393 O ALA A 893 3.768 6.953 2.669 1.00 0.00 O ATOM 1394 CB ALA A 893 6.208 7.801 0.708 1.00 0.00 C ATOM 0 H ALA A 893 6.331 10.113 1.339 1.00 0.00 H new ATOM 0 HA ALA A 893 4.114 8.363 0.551 1.00 0.00 H new ATOM 0 HB1 ALA A 893 6.003 6.746 0.526 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.513 8.277 -0.224 1.00 0.00 H new ATOM 0 HB3 ALA A 893 7.009 7.894 1.442 1.00 0.00 H new ATOM 1400 N MET A 894 5.021 8.472 3.623 1.00 0.00 N ATOM 1401 CA MET A 894 4.653 8.031 4.995 1.00 0.00 C ATOM 1402 C MET A 894 3.359 8.729 5.349 1.00 0.00 C ATOM 1403 O MET A 894 2.360 8.113 5.637 1.00 0.00 O ATOM 1404 CB MET A 894 5.809 8.514 5.881 1.00 0.00 C ATOM 1405 CG MET A 894 5.391 8.542 7.357 1.00 0.00 C ATOM 1406 SD MET A 894 5.235 10.259 7.921 1.00 0.00 S ATOM 1407 CE MET A 894 6.955 10.768 7.656 1.00 0.00 C ATOM 0 H MET A 894 5.660 9.266 3.589 1.00 0.00 H new ATOM 0 HA MET A 894 4.508 6.956 5.106 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.669 7.856 5.755 1.00 0.00 H new ATOM 0 HB3 MET A 894 6.121 9.510 5.568 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.443 8.020 7.486 1.00 0.00 H new ATOM 0 HG3 MET A 894 6.129 8.016 7.963 1.00 0.00 H new ATOM 0 HE1 MET A 894 7.448 10.900 8.619 1.00 0.00 H new ATOM 0 HE2 MET A 894 7.477 10.002 7.083 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.975 11.709 7.106 1.00 0.00 H new ATOM 1417 N LYS A 895 3.377 10.022 5.274 1.00 0.00 N ATOM 1418 CA LYS A 895 2.157 10.818 5.540 1.00 0.00 C ATOM 1419 C LYS A 895 1.027 10.219 4.714 1.00 0.00 C ATOM 1420 O LYS A 895 -0.047 9.991 5.198 1.00 0.00 O ATOM 1421 CB LYS A 895 2.502 12.235 5.066 1.00 0.00 C ATOM 1422 CG LYS A 895 1.223 13.048 4.855 1.00 0.00 C ATOM 1423 CD LYS A 895 0.563 13.334 6.207 1.00 0.00 C ATOM 1424 CE LYS A 895 0.532 14.845 6.456 1.00 0.00 C ATOM 1425 NZ LYS A 895 1.754 15.127 7.260 1.00 0.00 N ATOM 0 H LYS A 895 4.202 10.572 5.035 1.00 0.00 H new ATOM 0 HA LYS A 895 1.846 10.825 6.585 1.00 0.00 H new ATOM 0 HB2 LYS A 895 3.138 12.728 5.802 1.00 0.00 H new ATOM 0 HB3 LYS A 895 3.069 12.187 4.136 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.456 13.984 4.348 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.534 12.500 4.212 1.00 0.00 H new ATOM 0 HD2 LYS A 895 -0.450 12.932 6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 895 1.114 12.835 7.004 1.00 0.00 H new ATOM 0 HE2 LYS A 895 0.540 15.400 5.518 1.00 0.00 H new ATOM 0 HE3 LYS A 895 -0.370 15.138 6.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 1.804 16.144 7.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 1.716 14.590 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 2.597 14.844 6.721 1.00 0.00 H new ATOM 1439 N GLU A 896 1.285 9.955 3.465 1.00 0.00 N ATOM 1440 CA GLU A 896 0.231 9.348 2.595 1.00 0.00 C ATOM 1441 C GLU A 896 -0.375 8.089 3.247 1.00 0.00 C ATOM 1442 O GLU A 896 -1.580 7.955 3.333 1.00 0.00 O ATOM 1443 CB GLU A 896 0.950 8.989 1.295 1.00 0.00 C ATOM 1444 CG GLU A 896 0.996 10.213 0.376 1.00 0.00 C ATOM 1445 CD GLU A 896 0.050 10.002 -0.809 1.00 0.00 C ATOM 1446 OE1 GLU A 896 -0.970 9.360 -0.620 1.00 0.00 O ATOM 1447 OE2 GLU A 896 0.362 10.487 -1.884 1.00 0.00 O ATOM 0 H GLU A 896 2.178 10.132 3.005 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.600 10.034 2.431 1.00 0.00 H new ATOM 0 HB2 GLU A 896 1.962 8.646 1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.434 8.168 0.797 1.00 0.00 H new ATOM 0 HG2 GLU A 896 0.708 11.107 0.929 1.00 0.00 H new ATOM 0 HG3 GLU A 896 2.013 10.374 0.018 1.00 0.00 H new ATOM 1454 N LEU A 897 0.439 7.176 3.722 1.00 0.00 N ATOM 1455 CA LEU A 897 -0.139 5.934 4.391 1.00 0.00 C ATOM 1456 C LEU A 897 -0.568 6.343 5.751 1.00 0.00 C ATOM 1457 O LEU A 897 -1.692 6.164 6.164 1.00 0.00 O ATOM 1458 CB LEU A 897 0.984 4.921 4.516 1.00 0.00 C ATOM 1459 CG LEU A 897 2.144 5.401 3.692 1.00 0.00 C ATOM 1460 CD1 LEU A 897 3.295 4.427 3.819 1.00 0.00 C ATOM 1461 CD2 LEU A 897 1.661 5.544 2.241 1.00 0.00 C ATOM 0 H LEU A 897 1.457 7.221 3.684 1.00 0.00 H new ATOM 0 HA LEU A 897 -0.971 5.510 3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.280 4.808 5.559 1.00 0.00 H new ATOM 0 HB3 LEU A 897 0.652 3.942 4.171 1.00 0.00 H new ATOM 0 HG LEU A 897 2.507 6.369 4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 897 4.136 4.777 3.220 1.00 0.00 H new ATOM 0 HD12 LEU A 897 3.598 4.356 4.864 1.00 0.00 H new ATOM 0 HD13 LEU A 897 2.981 3.445 3.465 1.00 0.00 H new ATOM 0 HD21 LEU A 897 2.484 5.892 1.616 1.00 0.00 H new ATOM 0 HD22 LEU A 897 1.312 4.578 1.877 1.00 0.00 H new ATOM 0 HD23 LEU A 897 0.844 6.264 2.199 1.00 0.00 H new ATOM 1473 N LYS A 898 0.336 6.963 6.419 1.00 0.00 N ATOM 1474 CA LYS A 898 0.025 7.518 7.757 1.00 0.00 C ATOM 1475 C LYS A 898 -1.305 8.244 7.657 1.00 0.00 C ATOM 1476 O LYS A 898 -2.050 8.376 8.609 1.00 0.00 O ATOM 1477 CB LYS A 898 1.121 8.532 8.002 1.00 0.00 C ATOM 1478 CG LYS A 898 0.938 9.171 9.379 1.00 0.00 C ATOM 1479 CD LYS A 898 2.293 9.644 9.912 1.00 0.00 C ATOM 1480 CE LYS A 898 2.523 9.073 11.314 1.00 0.00 C ATOM 1481 NZ LYS A 898 3.316 10.112 12.027 1.00 0.00 N ATOM 0 H LYS A 898 1.292 7.116 6.099 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.032 6.765 8.543 1.00 0.00 H new ATOM 0 HB2 LYS A 898 2.096 8.049 7.942 1.00 0.00 H new ATOM 0 HB3 LYS A 898 1.098 9.300 7.229 1.00 0.00 H new ATOM 0 HG2 LYS A 898 0.249 10.013 9.311 1.00 0.00 H new ATOM 0 HG3 LYS A 898 0.496 8.452 10.069 1.00 0.00 H new ATOM 0 HD2 LYS A 898 3.091 9.322 9.242 1.00 0.00 H new ATOM 0 HD3 LYS A 898 2.323 10.733 9.943 1.00 0.00 H new ATOM 0 HE2 LYS A 898 1.578 8.880 11.822 1.00 0.00 H new ATOM 0 HE3 LYS A 898 3.061 8.126 11.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 3.514 9.793 12.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 4.213 10.270 11.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 2.776 11.000 12.058 1.00 0.00 H new ATOM 1495 N ALA A 899 -1.591 8.706 6.474 1.00 0.00 N ATOM 1496 CA ALA A 899 -2.873 9.430 6.240 1.00 0.00 C ATOM 1497 C ALA A 899 -3.898 8.468 5.633 1.00 0.00 C ATOM 1498 O ALA A 899 -5.076 8.763 5.562 1.00 0.00 O ATOM 1499 CB ALA A 899 -2.529 10.564 5.265 1.00 0.00 C ATOM 0 H ALA A 899 -0.991 8.614 5.654 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.308 9.824 7.158 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -3.428 11.141 5.047 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -1.780 11.216 5.715 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.135 10.142 4.340 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.450 7.321 5.176 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.372 6.329 4.550 1.00 0.00 C ATOM 1507 C ARG A 900 -5.045 7.053 3.431 1.00 0.00 C ATOM 1508 O ARG A 900 -6.194 6.835 3.102 1.00 0.00 O ATOM 1509 CB ARG A 900 -5.377 5.912 5.628 1.00 0.00 C ATOM 1510 CG ARG A 900 -4.745 6.099 7.002 1.00 0.00 C ATOM 1511 CD ARG A 900 -5.400 5.153 8.012 1.00 0.00 C ATOM 1512 NE ARG A 900 -4.344 4.882 9.026 1.00 0.00 N ATOM 1513 CZ ARG A 900 -4.495 5.300 10.253 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -5.511 4.891 10.962 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -3.630 6.126 10.773 1.00 0.00 N ATOM 0 H ARG A 900 -2.473 7.031 5.213 1.00 0.00 H new ATOM 0 HA ARG A 900 -3.875 5.437 4.170 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -6.284 6.511 5.547 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -5.668 4.871 5.487 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -3.674 5.903 6.949 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -4.864 7.132 7.329 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -6.278 5.610 8.469 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -5.733 4.232 7.533 1.00 0.00 H new ATOM 0 HE ARG A 900 -3.503 4.370 8.762 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -6.188 4.244 10.557 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -5.628 5.218 11.921 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -2.834 6.446 10.221 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -3.749 6.452 11.732 1.00 0.00 H new ATOM 1529 N LYS A 901 -4.311 7.956 2.874 1.00 0.00 N ATOM 1530 CA LYS A 901 -4.864 8.768 1.793 1.00 0.00 C ATOM 1531 C LYS A 901 -4.434 8.227 0.436 1.00 0.00 C ATOM 1532 O LYS A 901 -5.042 8.523 -0.566 1.00 0.00 O ATOM 1533 CB LYS A 901 -4.308 10.177 2.027 1.00 0.00 C ATOM 1534 CG LYS A 901 -4.822 11.130 0.944 1.00 0.00 C ATOM 1535 CD LYS A 901 -6.327 10.931 0.746 1.00 0.00 C ATOM 1536 CE LYS A 901 -6.989 12.277 0.444 1.00 0.00 C ATOM 1537 NZ LYS A 901 -8.436 12.067 0.734 1.00 0.00 N ATOM 0 H LYS A 901 -3.345 8.164 3.127 1.00 0.00 H new ATOM 0 HA LYS A 901 -5.954 8.759 1.791 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -4.608 10.536 3.011 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -3.218 10.153 2.015 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -4.617 12.162 1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -4.296 10.947 0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -6.507 10.234 -0.073 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -6.767 10.491 1.641 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -6.573 13.070 1.065 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -6.833 12.570 -0.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -8.958 12.947 0.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -8.806 11.311 0.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -8.554 11.796 1.731 1.00 0.00 H new ATOM 1551 N ILE A 902 -3.384 7.442 0.409 1.00 0.00 N ATOM 1552 CA ILE A 902 -2.872 6.879 -0.896 1.00 0.00 C ATOM 1553 C ILE A 902 -4.008 6.377 -1.810 1.00 0.00 C ATOM 1554 O ILE A 902 -4.419 5.238 -1.702 1.00 0.00 O ATOM 1555 CB ILE A 902 -1.984 5.695 -0.507 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -2.767 4.746 0.427 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -0.714 6.209 0.172 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -2.155 4.729 1.833 1.00 0.00 C ATOM 0 H ILE A 902 -2.853 7.162 1.234 1.00 0.00 H new ATOM 0 HA ILE A 902 -2.345 7.652 -1.455 1.00 0.00 H new ATOM 0 HB ILE A 902 -1.696 5.139 -1.399 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -3.808 5.063 0.484 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -2.763 3.738 0.013 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -0.082 5.365 0.449 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -0.171 6.858 -0.515 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -0.982 6.771 1.067 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -2.725 4.053 2.470 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -1.121 4.388 1.776 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -2.183 5.734 2.254 1.00 0.00 H new ATOM 1570 N PRO A 903 -4.475 7.237 -2.694 1.00 0.00 N ATOM 1571 CA PRO A 903 -5.557 6.867 -3.642 1.00 0.00 C ATOM 1572 C PRO A 903 -4.944 6.212 -4.882 1.00 0.00 C ATOM 1573 O PRO A 903 -4.762 6.868 -5.892 1.00 0.00 O ATOM 1574 CB PRO A 903 -6.110 8.248 -4.029 1.00 0.00 C ATOM 1575 CG PRO A 903 -5.261 9.321 -3.312 1.00 0.00 C ATOM 1576 CD PRO A 903 -3.991 8.629 -2.799 1.00 0.00 C ATOM 0 HA PRO A 903 -6.295 6.176 -3.235 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -6.066 8.387 -5.109 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -7.157 8.334 -3.739 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -5.008 10.131 -3.996 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -5.818 9.763 -2.486 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -3.155 8.727 -3.492 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -3.659 9.027 -1.840 1.00 0.00 H new ATOM 1583 N ILE A 904 -4.597 4.953 -4.849 1.00 0.00 N ATOM 1584 CA ILE A 904 -3.991 4.379 -6.064 1.00 0.00 C ATOM 1585 C ILE A 904 -4.099 2.860 -6.130 1.00 0.00 C ATOM 1586 O ILE A 904 -4.091 2.156 -5.139 1.00 0.00 O ATOM 1587 CB ILE A 904 -2.536 4.872 -6.044 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -2.348 5.892 -7.166 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -1.565 3.716 -6.259 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -1.507 7.066 -6.662 1.00 0.00 C ATOM 0 H ILE A 904 -4.706 4.321 -4.056 1.00 0.00 H new ATOM 0 HA ILE A 904 -4.517 4.703 -6.962 1.00 0.00 H new ATOM 0 HB ILE A 904 -2.331 5.322 -5.073 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -1.859 5.422 -8.019 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -3.318 6.249 -7.512 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -0.542 4.092 -6.240 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -1.695 2.979 -5.466 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -1.763 3.249 -7.224 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -1.376 7.791 -7.465 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.013 7.543 -5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -0.532 6.702 -6.338 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.176 2.378 -7.332 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.261 0.925 -7.592 1.00 0.00 C ATOM 1604 C ILE A 905 -2.845 0.337 -7.598 1.00 0.00 C ATOM 1605 O ILE A 905 -1.888 1.013 -7.921 1.00 0.00 O ATOM 1606 CB ILE A 905 -4.890 0.823 -8.988 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.089 -0.646 -9.358 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -3.977 1.480 -10.029 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.556 -0.881 -9.704 1.00 0.00 C ATOM 0 H ILE A 905 -4.184 2.954 -8.174 1.00 0.00 H new ATOM 0 HA ILE A 905 -4.840 0.384 -6.844 1.00 0.00 H new ATOM 0 HB ILE A 905 -5.852 1.335 -8.975 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.456 -0.909 -10.206 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -4.792 -1.286 -8.528 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.434 1.401 -11.015 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -3.836 2.531 -9.777 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.011 0.976 -10.036 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.704 -1.928 -9.969 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.177 -0.633 -8.843 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -6.836 -0.250 -10.547 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.704 -0.909 -7.259 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.358 -1.541 -7.253 1.00 0.00 C ATOM 1623 C ILE A 906 -1.459 -2.940 -7.856 1.00 0.00 C ATOM 1624 O ILE A 906 -2.392 -3.672 -7.596 1.00 0.00 O ATOM 1625 CB ILE A 906 -0.952 -1.600 -5.771 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.032 -0.424 -5.454 1.00 0.00 C ATOM 1627 CG2 ILE A 906 -0.202 -2.901 -5.468 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -0.851 0.862 -5.377 1.00 0.00 C ATOM 0 H ILE A 906 -3.470 -1.524 -6.983 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.623 -0.990 -7.840 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.855 -1.556 -5.162 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.482 -0.596 -4.509 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.736 -0.333 -6.222 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.077 -2.923 -4.414 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.845 -3.752 -5.692 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.697 -2.954 -6.082 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -0.192 1.700 -5.151 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -1.345 1.037 -6.333 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -1.602 0.769 -4.592 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.517 -3.322 -8.656 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.596 -4.692 -9.261 1.00 0.00 C ATOM 1642 C ARG A 907 0.193 -5.683 -8.442 1.00 0.00 C ATOM 1643 O ARG A 907 1.403 -5.700 -8.478 1.00 0.00 O ATOM 1644 CB ARG A 907 0.011 -4.583 -10.643 1.00 0.00 C ATOM 1645 CG ARG A 907 -1.019 -3.973 -11.591 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.361 -2.542 -11.151 1.00 0.00 C ATOM 1647 NE ARG A 907 -1.558 -1.785 -12.419 1.00 0.00 N ATOM 1648 CZ ARG A 907 -2.599 -2.022 -13.171 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -3.774 -2.188 -12.627 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -2.465 -2.096 -14.467 1.00 0.00 N ATOM 0 H ARG A 907 0.296 -2.766 -8.921 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.629 -5.039 -9.296 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.908 -3.964 -10.613 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.315 -5.567 -11.000 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.628 -3.965 -12.608 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -1.922 -4.584 -11.601 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.261 -2.523 -10.536 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.558 -2.110 -10.554 1.00 0.00 H new ATOM 0 HE ARG A 907 -0.878 -1.079 -12.701 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -3.879 -2.133 -11.614 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -4.587 -2.373 -13.215 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -1.547 -1.969 -14.893 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -3.278 -2.281 -15.054 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.479 -6.536 -7.735 1.00 0.00 N ATOM 1665 CA ARG A 908 0.264 -7.551 -6.942 1.00 0.00 C ATOM 1666 C ARG A 908 0.485 -8.789 -7.816 1.00 0.00 C ATOM 1667 O ARG A 908 -0.327 -9.693 -7.834 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.587 -7.936 -5.701 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.674 -6.893 -5.359 1.00 0.00 C ATOM 1670 CD ARG A 908 -2.281 -7.209 -3.965 1.00 0.00 C ATOM 1671 NE ARG A 908 -1.122 -7.194 -3.030 1.00 0.00 N ATOM 1672 CZ ARG A 908 -1.196 -7.827 -1.890 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.298 -7.787 -1.192 1.00 0.00 N ATOM 1674 NH2 ARG A 908 -0.169 -8.500 -1.450 1.00 0.00 N ATOM 0 H ARG A 908 -1.496 -6.579 -7.669 1.00 0.00 H new ATOM 0 HA ARG A 908 1.225 -7.153 -6.617 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -1.062 -8.901 -5.880 1.00 0.00 H new ATOM 0 HB3 ARG A 908 0.072 -8.060 -4.841 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -1.244 -5.891 -5.361 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -2.456 -6.906 -6.118 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -3.027 -6.467 -3.681 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.779 -8.179 -3.961 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.271 -6.690 -3.280 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -3.101 -7.261 -1.537 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.356 -8.281 -0.302 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.692 -8.532 -1.996 1.00 0.00 H new ATOM 0 HH22 ARG A 908 -0.227 -8.994 -0.560 1.00 0.00 H new ATOM 1688 N TYR A 909 1.596 -8.865 -8.508 1.00 0.00 N ATOM 1689 CA TYR A 909 1.865 -10.062 -9.318 1.00 0.00 C ATOM 1690 C TYR A 909 2.438 -11.107 -8.386 1.00 0.00 C ATOM 1691 O TYR A 909 2.610 -10.871 -7.205 1.00 0.00 O ATOM 1692 CB TYR A 909 2.914 -9.723 -10.386 1.00 0.00 C ATOM 1693 CG TYR A 909 2.756 -8.330 -10.962 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.356 -7.226 -10.343 1.00 0.00 C ATOM 1695 CD2 TYR A 909 2.057 -8.154 -12.158 1.00 0.00 C ATOM 1696 CE1 TYR A 909 3.247 -5.961 -10.910 1.00 0.00 C ATOM 1697 CE2 TYR A 909 1.955 -6.891 -12.731 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.547 -5.790 -12.113 1.00 0.00 C ATOM 1699 OH TYR A 909 2.446 -4.544 -12.694 1.00 0.00 O ATOM 0 H TYR A 909 2.318 -8.145 -8.538 1.00 0.00 H new ATOM 0 HA TYR A 909 0.957 -10.418 -9.805 1.00 0.00 H new ATOM 0 HB2 TYR A 909 3.909 -9.818 -9.951 1.00 0.00 H new ATOM 0 HB3 TYR A 909 2.849 -10.452 -11.194 1.00 0.00 H new ATOM 0 HD1 TYR A 909 3.905 -7.358 -9.422 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.594 -9.002 -12.640 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.701 -5.110 -10.424 1.00 0.00 H new ATOM 0 HE2 TYR A 909 1.415 -6.762 -13.658 1.00 0.00 H new ATOM 0 HH TYR A 909 1.927 -4.611 -13.523 1.00 0.00 H new ATOM 1709 N LEU A 910 2.741 -12.246 -8.894 1.00 0.00 N ATOM 1710 CA LEU A 910 3.296 -13.298 -8.032 1.00 0.00 C ATOM 1711 C LEU A 910 4.492 -13.981 -8.694 1.00 0.00 C ATOM 1712 O LEU A 910 4.344 -14.651 -9.696 1.00 0.00 O ATOM 1713 CB LEU A 910 2.137 -14.274 -7.854 1.00 0.00 C ATOM 1714 CG LEU A 910 0.958 -13.583 -7.164 1.00 0.00 C ATOM 1715 CD1 LEU A 910 -0.146 -14.612 -6.919 1.00 0.00 C ATOM 1716 CD2 LEU A 910 1.400 -12.980 -5.828 1.00 0.00 C ATOM 0 H LEU A 910 2.628 -12.498 -9.876 1.00 0.00 H new ATOM 0 HA LEU A 910 3.668 -12.909 -7.084 1.00 0.00 H new ATOM 0 HB2 LEU A 910 1.824 -14.658 -8.825 1.00 0.00 H new ATOM 0 HB3 LEU A 910 2.462 -15.130 -7.263 1.00 0.00 H new ATOM 0 HG LEU A 910 0.588 -12.781 -7.803 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.991 -14.129 -6.428 1.00 0.00 H new ATOM 0 HD12 LEU A 910 -0.471 -15.031 -7.871 1.00 0.00 H new ATOM 0 HD13 LEU A 910 0.236 -15.411 -6.283 1.00 0.00 H new ATOM 0 HD21 LEU A 910 0.550 -12.492 -5.350 1.00 0.00 H new ATOM 0 HD22 LEU A 910 1.777 -13.770 -5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.188 -12.247 -6.002 1.00 0.00 H new ATOM 1728 N PRO A 911 5.645 -13.821 -8.082 1.00 0.00 N ATOM 1729 CA PRO A 911 6.869 -14.470 -8.594 1.00 0.00 C ATOM 1730 C PRO A 911 6.662 -15.984 -8.551 1.00 0.00 C ATOM 1731 O PRO A 911 7.412 -16.749 -9.128 1.00 0.00 O ATOM 1732 CB PRO A 911 7.935 -14.032 -7.584 1.00 0.00 C ATOM 1733 CG PRO A 911 7.267 -13.147 -6.514 1.00 0.00 C ATOM 1734 CD PRO A 911 5.780 -12.997 -6.862 1.00 0.00 C ATOM 0 HA PRO A 911 7.135 -14.207 -9.618 1.00 0.00 H new ATOM 0 HB2 PRO A 911 8.396 -14.904 -7.119 1.00 0.00 H new ATOM 0 HB3 PRO A 911 8.729 -13.481 -8.088 1.00 0.00 H new ATOM 0 HG2 PRO A 911 7.381 -13.595 -5.527 1.00 0.00 H new ATOM 0 HG3 PRO A 911 7.748 -12.169 -6.478 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.138 -13.357 -6.058 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.510 -11.957 -7.044 1.00 0.00 H new ATOM 1741 N ASP A 912 5.625 -16.412 -7.873 1.00 0.00 N ATOM 1742 CA ASP A 912 5.328 -17.863 -7.787 1.00 0.00 C ATOM 1743 C ASP A 912 4.737 -18.322 -9.111 1.00 0.00 C ATOM 1744 O ASP A 912 4.971 -19.428 -9.559 1.00 0.00 O ATOM 1745 CB ASP A 912 4.291 -17.990 -6.671 1.00 0.00 C ATOM 1746 CG ASP A 912 4.991 -18.335 -5.356 1.00 0.00 C ATOM 1747 OD1 ASP A 912 5.676 -19.343 -5.320 1.00 0.00 O ATOM 1748 OD2 ASP A 912 4.829 -17.587 -4.407 1.00 0.00 O ATOM 0 H ASP A 912 4.971 -15.809 -7.374 1.00 0.00 H new ATOM 0 HA ASP A 912 6.212 -18.468 -7.585 1.00 0.00 H new ATOM 0 HB2 ASP A 912 3.739 -17.056 -6.566 1.00 0.00 H new ATOM 0 HB3 ASP A 912 3.565 -18.763 -6.922 1.00 0.00 H new ATOM 1753 N GLY A 913 3.974 -17.472 -9.747 1.00 0.00 N ATOM 1754 CA GLY A 913 3.375 -17.870 -11.057 1.00 0.00 C ATOM 1755 C GLY A 913 1.914 -17.459 -11.102 1.00 0.00 C ATOM 1756 O GLY A 913 1.032 -18.235 -11.408 1.00 0.00 O ATOM 0 H GLY A 913 3.742 -16.533 -9.423 1.00 0.00 H new ATOM 0 HA2 GLY A 913 3.920 -17.398 -11.875 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.463 -18.948 -11.195 1.00 0.00 H new ATOM 1760 N SER A 914 1.678 -16.234 -10.797 1.00 0.00 N ATOM 1761 CA SER A 914 0.293 -15.686 -10.802 1.00 0.00 C ATOM 1762 C SER A 914 0.382 -14.176 -10.665 1.00 0.00 C ATOM 1763 O SER A 914 1.461 -13.614 -10.684 1.00 0.00 O ATOM 1764 CB SER A 914 -0.409 -16.313 -9.594 1.00 0.00 C ATOM 1765 OG SER A 914 0.528 -17.050 -8.817 1.00 0.00 O ATOM 0 H SER A 914 2.399 -15.561 -10.535 1.00 0.00 H new ATOM 0 HA SER A 914 -0.256 -15.911 -11.716 1.00 0.00 H new ATOM 0 HB2 SER A 914 -0.867 -15.534 -8.984 1.00 0.00 H new ATOM 0 HB3 SER A 914 -1.212 -16.969 -9.929 1.00 0.00 H new ATOM 0 HG SER A 914 0.073 -17.447 -8.045 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.723 -13.504 -10.526 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.667 -12.035 -10.390 1.00 0.00 C ATOM 1773 C TYR A 915 -2.097 -11.461 -10.353 1.00 0.00 C ATOM 1774 O TYR A 915 -3.013 -12.008 -10.936 1.00 0.00 O ATOM 1775 CB TYR A 915 0.088 -11.558 -11.648 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.437 -10.225 -12.160 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.505 -9.108 -11.313 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -0.825 -10.105 -13.500 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -0.964 -7.882 -11.807 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -1.278 -8.875 -13.993 1.00 0.00 C ATOM 1781 CZ TYR A 915 -1.348 -7.765 -13.146 1.00 0.00 C ATOM 1782 OH TYR A 915 -1.792 -6.550 -13.632 1.00 0.00 O ATOM 0 H TYR A 915 -1.658 -13.911 -10.501 1.00 0.00 H new ATOM 0 HA TYR A 915 -0.173 -11.710 -9.474 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.150 -11.465 -11.420 1.00 0.00 H new ATOM 0 HB3 TYR A 915 -0.005 -12.309 -12.432 1.00 0.00 H new ATOM 0 HD1 TYR A 915 -0.203 -9.195 -10.280 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -0.775 -10.963 -14.155 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.022 -7.025 -11.153 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -1.573 -8.784 -15.028 1.00 0.00 H new ATOM 0 HH TYR A 915 -2.018 -6.640 -14.581 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.278 -10.353 -9.698 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.624 -9.704 -9.637 1.00 0.00 C ATOM 1794 C GLU A 916 -3.451 -8.183 -9.599 1.00 0.00 C ATOM 1795 O GLU A 916 -2.518 -7.672 -9.010 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.262 -10.203 -8.347 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.693 -10.662 -8.629 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.654 -9.486 -8.450 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.279 -8.380 -8.806 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.750 -9.710 -7.963 1.00 0.00 O ATOM 0 H GLU A 916 -1.543 -9.858 -9.193 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.242 -9.945 -10.502 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.679 -11.027 -7.936 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.264 -9.410 -7.599 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.767 -11.054 -9.644 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.965 -11.473 -7.954 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.341 -7.456 -10.217 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.224 -5.972 -10.208 1.00 0.00 C ATOM 1809 C ASP A 917 -5.415 -5.351 -9.502 1.00 0.00 C ATOM 1810 O ASP A 917 -6.506 -5.883 -9.487 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.176 -5.551 -11.666 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.379 -6.113 -12.432 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.226 -6.730 -11.805 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -5.433 -5.913 -13.634 1.00 0.00 O ATOM 0 H ASP A 917 -5.143 -7.826 -10.727 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.335 -5.640 -9.672 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.170 -4.463 -11.736 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.251 -5.905 -12.122 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.158 -4.218 -8.919 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.148 -3.417 -8.131 1.00 0.00 C ATOM 1821 C TRP A 918 -5.441 -2.867 -6.906 1.00 0.00 C ATOM 1822 O TRP A 918 -4.291 -3.162 -6.671 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.339 -4.274 -7.700 1.00 0.00 C ATOM 1824 CG TRP A 918 -6.976 -5.596 -7.087 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.758 -6.180 -6.983 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.903 -6.488 -6.466 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.923 -7.443 -6.431 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.239 -7.656 -6.055 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.266 -6.369 -6.243 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.936 -8.695 -5.434 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.971 -7.374 -5.608 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -9.314 -8.549 -5.198 1.00 0.00 C ATOM 0 H TRP A 918 -4.237 -3.782 -8.958 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.532 -2.608 -8.752 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -7.935 -3.709 -6.983 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -7.972 -4.454 -8.569 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.818 -5.738 -7.279 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -5.173 -8.125 -6.317 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.784 -5.479 -6.570 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.423 -9.598 -5.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -11.029 -7.257 -5.426 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.866 -9.335 -4.704 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.089 -2.060 -6.123 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.378 -1.511 -4.943 1.00 0.00 C ATOM 1845 C GLY A 919 -6.345 -0.860 -3.988 1.00 0.00 C ATOM 1846 O GLY A 919 -6.786 -1.448 -3.027 1.00 0.00 O ATOM 0 H GLY A 919 -7.057 -1.762 -6.243 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -4.840 -2.310 -4.433 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.635 -0.783 -5.267 1.00 0.00 H new ATOM 1850 N VAL A 920 -6.673 0.356 -4.238 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.617 1.044 -3.336 1.00 0.00 C ATOM 1852 C VAL A 920 -8.902 1.304 -4.089 1.00 0.00 C ATOM 1853 O VAL A 920 -9.877 1.772 -3.533 1.00 0.00 O ATOM 1854 CB VAL A 920 -6.923 2.343 -2.951 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -7.797 3.123 -1.968 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -5.586 2.001 -2.296 1.00 0.00 C ATOM 0 H VAL A 920 -6.332 0.908 -5.025 1.00 0.00 H new ATOM 0 HA VAL A 920 -7.872 0.465 -2.449 1.00 0.00 H new ATOM 0 HB VAL A 920 -6.758 2.957 -3.837 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.297 4.052 -1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -8.755 3.350 -2.435 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -7.962 2.523 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.074 2.921 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -5.761 1.395 -1.407 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -4.968 1.443 -3.000 1.00 0.00 H new ATOM 1866 N ASP A 921 -8.920 0.989 -5.356 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.167 1.210 -6.125 1.00 0.00 C ATOM 1868 C ASP A 921 -11.073 0.001 -5.992 1.00 0.00 C ATOM 1869 O ASP A 921 -12.265 0.067 -6.222 1.00 0.00 O ATOM 1870 CB ASP A 921 -9.733 1.424 -7.573 1.00 0.00 C ATOM 1871 CG ASP A 921 -10.944 1.851 -8.404 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -11.287 3.019 -8.357 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -11.509 0.999 -9.073 1.00 0.00 O ATOM 0 H ASP A 921 -8.138 0.596 -5.880 1.00 0.00 H new ATOM 0 HA ASP A 921 -10.730 2.069 -5.761 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -8.956 2.186 -7.623 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.306 0.506 -7.976 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.509 -1.102 -5.623 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.303 -2.335 -5.468 1.00 0.00 C ATOM 1880 C GLU A 922 -11.082 -2.921 -4.071 1.00 0.00 C ATOM 1881 O GLU A 922 -11.819 -3.774 -3.616 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.728 -3.234 -6.547 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.759 -4.297 -6.936 1.00 0.00 C ATOM 1884 CD GLU A 922 -11.493 -4.762 -8.369 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -11.551 -3.932 -9.261 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -11.240 -5.942 -8.550 1.00 0.00 O ATOM 0 H GLU A 922 -9.515 -1.202 -5.419 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.379 -2.194 -5.566 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.455 -2.642 -7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.816 -3.712 -6.188 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.702 -5.143 -6.251 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.767 -3.889 -6.855 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.055 -2.472 -3.395 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.758 -3.003 -2.027 1.00 0.00 C ATOM 1895 C LEU A 923 -9.073 -1.962 -1.122 1.00 0.00 C ATOM 1896 O LEU A 923 -9.275 -0.768 -1.234 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.859 -4.231 -2.242 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.801 -3.940 -3.303 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.392 -4.021 -2.732 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.924 -4.979 -4.365 1.00 0.00 C ATOM 0 H LEU A 923 -9.407 -1.759 -3.731 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.682 -3.260 -1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.376 -4.504 -1.304 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.465 -5.084 -2.549 1.00 0.00 H new ATOM 0 HG LEU A 923 -7.961 -2.932 -3.686 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.668 -3.808 -3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.282 -3.291 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.216 -5.022 -2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.179 -4.797 -5.140 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.762 -5.965 -3.930 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.921 -4.935 -4.803 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.314 -2.456 -0.190 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.611 -1.620 0.836 1.00 0.00 C ATOM 1914 C ILE A 924 -6.400 -0.875 0.308 1.00 0.00 C ATOM 1915 O ILE A 924 -5.920 -1.087 -0.777 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.205 -2.610 1.945 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.281 -2.559 3.008 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -5.833 -2.297 2.567 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.453 -3.382 2.500 1.00 0.00 C ATOM 0 H ILE A 924 -8.140 -3.456 -0.088 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.273 -0.828 1.186 1.00 0.00 H new ATOM 0 HB ILE A 924 -7.112 -3.604 1.508 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -7.909 -2.960 3.951 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -8.587 -1.530 3.197 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.608 -3.031 3.340 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -5.065 -2.337 1.794 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -5.852 -1.300 3.008 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.253 -3.371 3.240 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -9.818 -2.957 1.565 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -9.130 -4.409 2.330 1.00 0.00 H new ATOM 1931 N ILE A 925 -5.918 -0.006 1.136 1.00 0.00 N ATOM 1932 CA ILE A 925 -4.703 0.787 0.837 1.00 0.00 C ATOM 1933 C ILE A 925 -3.537 0.122 1.579 1.00 0.00 C ATOM 1934 O ILE A 925 -3.299 -1.062 1.448 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.013 2.201 1.369 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.405 2.135 2.850 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -6.175 2.803 0.574 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -5.173 3.499 3.504 1.00 0.00 C ATOM 0 H ILE A 925 -6.333 0.196 2.046 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.436 0.840 -0.218 1.00 0.00 H new ATOM 0 HB ILE A 925 -4.123 2.821 1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.452 1.847 2.947 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -4.816 1.372 3.359 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.394 3.802 0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -5.902 2.863 -0.480 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -7.057 2.172 0.685 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -5.452 3.450 4.556 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -4.120 3.768 3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -5.781 4.251 3.002 1.00 0.00 H new ATOM 1950 N THR A 926 -2.831 0.855 2.356 1.00 0.00 N ATOM 1951 CA THR A 926 -1.690 0.274 3.122 1.00 0.00 C ATOM 1952 C THR A 926 -2.206 -0.751 4.141 1.00 0.00 C ATOM 1953 O THR A 926 -1.482 -1.624 4.579 1.00 0.00 O ATOM 1954 CB THR A 926 -1.074 1.470 3.856 1.00 0.00 C ATOM 1955 OG1 THR A 926 -0.640 2.447 2.916 1.00 0.00 O ATOM 1956 CG2 THR A 926 0.110 1.001 4.704 1.00 0.00 C ATOM 0 H THR A 926 -2.986 1.852 2.507 1.00 0.00 H new ATOM 0 HA THR A 926 -0.975 -0.239 2.478 1.00 0.00 H new ATOM 0 HB THR A 926 -1.827 1.916 4.507 1.00 0.00 H new ATOM 0 HG1 THR A 926 -1.074 2.285 2.052 1.00 0.00 H new ATOM 0 HG21 THR A 926 0.545 1.854 5.224 1.00 0.00 H new ATOM 0 HG22 THR A 926 -0.233 0.267 5.434 1.00 0.00 H new ATOM 0 HG23 THR A 926 0.862 0.547 4.059 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.453 -0.652 4.514 1.00 0.00 N ATOM 1965 CA ASP A 927 -4.035 -1.616 5.498 1.00 0.00 C ATOM 1966 C ASP A 927 -5.475 -1.213 5.833 1.00 0.00 C ATOM 1967 O ASP A 927 -5.646 -0.354 6.681 1.00 0.00 O ATOM 1968 CB ASP A 927 -3.150 -1.517 6.747 1.00 0.00 C ATOM 1969 CG ASP A 927 -2.401 -2.836 6.951 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -3.040 -3.807 7.321 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -1.200 -2.852 6.735 1.00 0.00 O ATOM 1972 OXT ASP A 927 -6.380 -1.772 5.235 1.00 0.00 O ATOM 0 H ASP A 927 -4.101 0.061 4.178 1.00 0.00 H new ATOM 0 HA ASP A 927 -4.063 -2.633 5.106 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -2.440 -0.697 6.638 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -3.761 -1.295 7.622 1.00 0.00 H new