USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 700 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 833 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 835 ASN : amide:sc= -3.7! C(o=-3.7!,f=-6.5!) USER MOD Single : A 841 SER OG : rot -100:sc= 0.936 USER MOD Single : A 853 THR OG1 : rot 116:sc= -5.55! USER MOD Single : A 854 THR OG1 : rot 180:sc= -1.51! USER MOD Single : A 856 TYR OH : rot 180:sc= 0 USER MOD Single : A 857 MET CE :methyl 173:sc= -13.9! (180deg=-14.7!) USER MOD Single : A 858 THR OG1 : rot -69:sc= -2.69! USER MOD Single : A 859 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 860 TYR OH : rot 180:sc= 0 USER MOD Single : A 868 THR OG1 : rot 180:sc= 0 USER MOD Single : A 872 GLN : amide:sc= -3.69 K(o=-3.7,f=-14!) USER MOD Single : A 875 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 876 CYS SG : rot 180:sc= -0.0114 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 887 THR OG1 : rot -12:sc= 0.775 USER MOD Single : A 894 MET CE :methyl -116:sc= -4.44! (180deg=-8.21!) USER MOD Single : A 895 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 898 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 901 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 909 TYR OH : rot 180:sc= -4.56! USER MOD Single : A 914 SER OG : rot 180:sc= -0.498 USER MOD Single : A 915 TYR OH : rot 180:sc= -0.272 USER MOD Single : A 926 THR OG1 : rot 180:sc= -4.96! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 6.630 -11.084 -0.369 1.00 0.00 N ATOM 439 CA GLN A 833 6.813 -11.859 -1.630 1.00 0.00 C ATOM 440 C GLN A 833 5.629 -11.620 -2.566 1.00 0.00 C ATOM 441 O GLN A 833 4.679 -12.377 -2.596 1.00 0.00 O ATOM 442 CB GLN A 833 6.870 -13.329 -1.216 1.00 0.00 C ATOM 443 CG GLN A 833 7.047 -14.182 -2.471 1.00 0.00 C ATOM 444 CD GLN A 833 7.109 -15.661 -2.086 1.00 0.00 C ATOM 445 OE1 GLN A 833 6.089 -16.293 -1.889 1.00 0.00 O ATOM 446 NE2 GLN A 833 8.270 -16.244 -1.968 1.00 0.00 N ATOM 0 HA GLN A 833 7.717 -11.559 -2.160 1.00 0.00 H new ATOM 0 HB2 GLN A 833 7.697 -13.496 -0.525 1.00 0.00 H new ATOM 0 HB3 GLN A 833 5.956 -13.610 -0.693 1.00 0.00 H new ATOM 0 HG2 GLN A 833 6.219 -14.010 -3.159 1.00 0.00 H new ATOM 0 HG3 GLN A 833 7.960 -13.894 -2.992 1.00 0.00 H new ATOM 0 HE21 GLN A 833 9.126 -15.714 -2.133 1.00 0.00 H new ATOM 0 HE22 GLN A 833 8.322 -17.230 -1.711 1.00 0.00 H new ATOM 455 N GLU A 834 5.687 -10.569 -3.327 1.00 0.00 N ATOM 456 CA GLU A 834 4.587 -10.247 -4.271 1.00 0.00 C ATOM 457 C GLU A 834 5.011 -9.041 -5.101 1.00 0.00 C ATOM 458 O GLU A 834 5.189 -7.958 -4.578 1.00 0.00 O ATOM 459 CB GLU A 834 3.385 -9.904 -3.385 1.00 0.00 C ATOM 460 CG GLU A 834 2.175 -9.559 -4.261 1.00 0.00 C ATOM 461 CD GLU A 834 0.947 -10.339 -3.781 1.00 0.00 C ATOM 462 OE1 GLU A 834 0.939 -10.755 -2.634 1.00 0.00 O ATOM 463 OE2 GLU A 834 0.031 -10.505 -4.570 1.00 0.00 O ATOM 0 H GLU A 834 6.464 -9.908 -3.335 1.00 0.00 H new ATOM 0 HA GLU A 834 4.348 -11.062 -4.954 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.147 -10.747 -2.737 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.628 -9.062 -2.737 1.00 0.00 H new ATOM 0 HG2 GLU A 834 1.977 -8.488 -4.218 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.387 -9.802 -5.302 1.00 0.00 H new ATOM 470 N ASN A 835 5.172 -9.203 -6.386 1.00 0.00 N ATOM 471 CA ASN A 835 5.577 -8.036 -7.210 1.00 0.00 C ATOM 472 C ASN A 835 4.421 -7.078 -7.225 1.00 0.00 C ATOM 473 O ASN A 835 3.327 -7.434 -7.557 1.00 0.00 O ATOM 474 CB ASN A 835 5.852 -8.511 -8.647 1.00 0.00 C ATOM 475 CG ASN A 835 6.575 -9.860 -8.657 1.00 0.00 C ATOM 476 OD1 ASN A 835 6.042 -10.844 -9.132 1.00 0.00 O ATOM 477 ND2 ASN A 835 7.780 -9.943 -8.164 1.00 0.00 N ATOM 0 H ASN A 835 5.042 -10.079 -6.892 1.00 0.00 H new ATOM 0 HA ASN A 835 6.472 -7.563 -6.807 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.911 -8.596 -9.191 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.456 -7.768 -9.169 1.00 0.00 H new ATOM 0 HD21 ASN A 835 8.276 -10.834 -8.177 1.00 0.00 H new ATOM 0 HD22 ASN A 835 8.226 -9.117 -7.766 1.00 0.00 H new ATOM 484 N VAL A 836 4.637 -5.880 -6.860 1.00 0.00 N ATOM 485 CA VAL A 836 3.499 -4.924 -6.872 1.00 0.00 C ATOM 486 C VAL A 836 3.834 -3.694 -7.696 1.00 0.00 C ATOM 487 O VAL A 836 4.877 -3.088 -7.555 1.00 0.00 O ATOM 488 CB VAL A 836 3.195 -4.550 -5.410 1.00 0.00 C ATOM 489 CG1 VAL A 836 3.901 -5.510 -4.470 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.664 -3.124 -5.111 1.00 0.00 C ATOM 0 H VAL A 836 5.534 -5.504 -6.553 1.00 0.00 H new ATOM 0 HA VAL A 836 2.623 -5.380 -7.333 1.00 0.00 H new ATOM 0 HB VAL A 836 2.117 -4.612 -5.260 1.00 0.00 H new ATOM 0 HG11 VAL A 836 3.680 -5.237 -3.438 1.00 0.00 H new ATOM 0 HG12 VAL A 836 3.554 -6.526 -4.659 1.00 0.00 H new ATOM 0 HG13 VAL A 836 4.977 -5.457 -4.637 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.441 -2.878 -4.073 1.00 0.00 H new ATOM 0 HG22 VAL A 836 4.739 -3.052 -5.278 1.00 0.00 H new ATOM 0 HG23 VAL A 836 3.147 -2.425 -5.769 1.00 0.00 H new ATOM 500 N GLU A 837 2.925 -3.308 -8.525 1.00 0.00 N ATOM 501 CA GLU A 837 3.133 -2.086 -9.340 1.00 0.00 C ATOM 502 C GLU A 837 2.202 -1.028 -8.794 1.00 0.00 C ATOM 503 O GLU A 837 1.544 -1.240 -7.794 1.00 0.00 O ATOM 504 CB GLU A 837 2.762 -2.457 -10.771 1.00 0.00 C ATOM 505 CG GLU A 837 3.970 -2.251 -11.687 1.00 0.00 C ATOM 506 CD GLU A 837 3.493 -1.799 -13.068 1.00 0.00 C ATOM 507 OE1 GLU A 837 2.532 -1.051 -13.126 1.00 0.00 O ATOM 508 OE2 GLU A 837 4.100 -2.206 -14.046 1.00 0.00 O ATOM 0 H GLU A 837 2.037 -3.786 -8.679 1.00 0.00 H new ATOM 0 HA GLU A 837 4.156 -1.710 -9.311 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.434 -3.495 -10.814 1.00 0.00 H new ATOM 0 HB3 GLU A 837 1.927 -1.844 -11.111 1.00 0.00 H new ATOM 0 HG2 GLU A 837 4.640 -1.505 -11.260 1.00 0.00 H new ATOM 0 HG3 GLU A 837 4.537 -3.178 -11.772 1.00 0.00 H new ATOM 515 N ILE A 838 2.126 0.100 -9.413 1.00 0.00 N ATOM 516 CA ILE A 838 1.218 1.125 -8.874 1.00 0.00 C ATOM 517 C ILE A 838 0.625 1.957 -10.003 1.00 0.00 C ATOM 518 O ILE A 838 1.204 2.118 -11.059 1.00 0.00 O ATOM 519 CB ILE A 838 2.093 1.957 -7.921 1.00 0.00 C ATOM 520 CG1 ILE A 838 1.346 2.210 -6.612 1.00 0.00 C ATOM 521 CG2 ILE A 838 2.489 3.299 -8.541 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.023 1.423 -5.488 1.00 0.00 C ATOM 0 H ILE A 838 2.643 0.355 -10.254 1.00 0.00 H new ATOM 0 HA ILE A 838 0.361 0.704 -8.348 1.00 0.00 H new ATOM 0 HB ILE A 838 3.002 1.386 -7.730 1.00 0.00 H new ATOM 0 HG12 ILE A 838 1.347 3.275 -6.379 1.00 0.00 H new ATOM 0 HG13 ILE A 838 0.304 1.906 -6.709 1.00 0.00 H new ATOM 0 HG21 ILE A 838 3.106 3.857 -7.837 1.00 0.00 H new ATOM 0 HG22 ILE A 838 3.052 3.124 -9.458 1.00 0.00 H new ATOM 0 HG23 ILE A 838 1.591 3.873 -8.770 1.00 0.00 H new ATOM 0 HD11 ILE A 838 1.495 1.599 -4.551 1.00 0.00 H new ATOM 0 HD12 ILE A 838 1.999 0.359 -5.723 1.00 0.00 H new ATOM 0 HD13 ILE A 838 3.058 1.749 -5.388 1.00 0.00 H new ATOM 534 N LEU A 839 -0.528 2.479 -9.765 1.00 0.00 N ATOM 535 CA LEU A 839 -1.217 3.319 -10.793 1.00 0.00 C ATOM 536 C LEU A 839 -2.377 4.079 -10.140 1.00 0.00 C ATOM 537 O LEU A 839 -2.782 3.742 -9.048 1.00 0.00 O ATOM 538 CB LEU A 839 -1.741 2.321 -11.833 1.00 0.00 C ATOM 539 CG LEU A 839 -1.122 2.622 -13.203 1.00 0.00 C ATOM 540 CD1 LEU A 839 0.062 1.683 -13.454 1.00 0.00 C ATOM 541 CD2 LEU A 839 -2.176 2.413 -14.294 1.00 0.00 C ATOM 0 H LEU A 839 -1.042 2.365 -8.891 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.557 4.060 -11.243 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.496 1.303 -11.529 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -2.828 2.382 -11.894 1.00 0.00 H new ATOM 0 HG LEU A 839 -0.774 3.655 -13.222 1.00 0.00 H new ATOM 0 HD11 LEU A 839 0.499 1.901 -14.429 1.00 0.00 H new ATOM 0 HD12 LEU A 839 0.814 1.830 -12.679 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.283 0.649 -13.434 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -1.738 2.627 -15.269 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.524 1.380 -14.271 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -3.018 3.083 -14.120 1.00 0.00 H new ATOM 553 N PRO A 840 -2.891 5.077 -10.823 1.00 0.00 N ATOM 554 CA PRO A 840 -4.021 5.858 -10.270 1.00 0.00 C ATOM 555 C PRO A 840 -5.200 4.931 -9.978 1.00 0.00 C ATOM 556 O PRO A 840 -5.566 4.103 -10.789 1.00 0.00 O ATOM 557 CB PRO A 840 -4.345 6.836 -11.395 1.00 0.00 C ATOM 558 CG PRO A 840 -3.373 6.584 -12.565 1.00 0.00 C ATOM 559 CD PRO A 840 -2.392 5.472 -12.161 1.00 0.00 C ATOM 0 HA PRO A 840 -3.795 6.362 -9.330 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -5.375 6.704 -11.725 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -4.252 7.863 -11.041 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -3.925 6.294 -13.459 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -2.830 7.497 -12.808 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -2.411 4.639 -12.864 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -1.364 5.832 -12.121 1.00 0.00 H new ATOM 566 N SER A 841 -5.779 5.051 -8.815 1.00 0.00 N ATOM 567 CA SER A 841 -6.908 4.173 -8.440 1.00 0.00 C ATOM 568 C SER A 841 -7.945 4.129 -9.547 1.00 0.00 C ATOM 569 O SER A 841 -8.248 5.114 -10.192 1.00 0.00 O ATOM 570 CB SER A 841 -7.502 4.799 -7.178 1.00 0.00 C ATOM 571 OG SER A 841 -7.628 6.203 -7.363 1.00 0.00 O ATOM 0 H SER A 841 -5.510 5.731 -8.104 1.00 0.00 H new ATOM 0 HA SER A 841 -6.583 3.146 -8.274 1.00 0.00 H new ATOM 0 HB2 SER A 841 -8.477 4.360 -6.965 1.00 0.00 H new ATOM 0 HB3 SER A 841 -6.864 4.590 -6.320 1.00 0.00 H new ATOM 0 HG SER A 841 -6.885 6.660 -6.917 1.00 0.00 H new ATOM 577 N GLY A 842 -8.485 2.980 -9.747 1.00 0.00 N ATOM 578 CA GLY A 842 -9.526 2.806 -10.802 1.00 0.00 C ATOM 579 C GLY A 842 -8.885 2.313 -12.096 1.00 0.00 C ATOM 580 O GLY A 842 -8.642 3.077 -13.011 1.00 0.00 O ATOM 0 H GLY A 842 -8.256 2.134 -9.225 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -10.280 2.094 -10.466 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -10.038 3.752 -10.978 1.00 0.00 H new ATOM 740 N ILE A 852 -5.007 -14.022 -6.970 1.00 0.00 N ATOM 741 CA ILE A 852 -4.872 -14.494 -5.551 1.00 0.00 C ATOM 742 C ILE A 852 -5.020 -13.347 -4.554 1.00 0.00 C ATOM 743 O ILE A 852 -5.318 -13.564 -3.395 1.00 0.00 O ATOM 744 CB ILE A 852 -3.468 -15.152 -5.437 1.00 0.00 C ATOM 745 CG1 ILE A 852 -2.493 -14.255 -4.646 1.00 0.00 C ATOM 746 CG2 ILE A 852 -2.877 -15.429 -6.826 1.00 0.00 C ATOM 747 CD1 ILE A 852 -2.263 -12.928 -5.382 1.00 0.00 C ATOM 0 HA ILE A 852 -5.663 -15.204 -5.309 1.00 0.00 H new ATOM 0 HB ILE A 852 -3.598 -16.094 -4.905 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -2.894 -14.061 -3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -1.543 -14.772 -4.511 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -1.895 -15.889 -6.718 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -3.536 -16.103 -7.374 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.780 -14.492 -7.374 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.573 -12.309 -4.809 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -1.840 -13.127 -6.367 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -3.213 -12.405 -5.494 1.00 0.00 H new ATOM 759 N THR A 853 -4.800 -12.139 -4.977 1.00 0.00 N ATOM 760 CA THR A 853 -4.907 -11.005 -4.069 1.00 0.00 C ATOM 761 C THR A 853 -6.256 -11.028 -3.388 1.00 0.00 C ATOM 762 O THR A 853 -7.277 -11.319 -3.979 1.00 0.00 O ATOM 763 CB THR A 853 -4.756 -9.799 -4.979 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.683 -9.897 -6.054 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.341 -9.780 -5.552 1.00 0.00 C ATOM 0 H THR A 853 -4.546 -11.900 -5.936 1.00 0.00 H new ATOM 0 HA THR A 853 -4.164 -11.006 -3.272 1.00 0.00 H new ATOM 0 HB THR A 853 -4.944 -8.888 -4.410 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.324 -9.158 -6.001 1.00 0.00 H new ATOM 0 HG21 THR A 853 -3.225 -8.916 -6.207 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.619 -9.717 -4.737 1.00 0.00 H new ATOM 0 HG23 THR A 853 -3.167 -10.693 -6.121 1.00 0.00 H new ATOM 773 N THR A 854 -6.246 -10.734 -2.149 1.00 0.00 N ATOM 774 CA THR A 854 -7.495 -10.725 -1.370 1.00 0.00 C ATOM 775 C THR A 854 -8.035 -9.299 -1.329 1.00 0.00 C ATOM 776 O THR A 854 -7.268 -8.361 -1.356 1.00 0.00 O ATOM 777 CB THR A 854 -7.090 -11.194 0.032 1.00 0.00 C ATOM 778 OG1 THR A 854 -8.241 -11.269 0.860 1.00 0.00 O ATOM 779 CG2 THR A 854 -6.089 -10.206 0.640 1.00 0.00 C ATOM 0 H THR A 854 -5.408 -10.492 -1.620 1.00 0.00 H new ATOM 0 HA THR A 854 -8.272 -11.363 -1.792 1.00 0.00 H new ATOM 0 HB THR A 854 -6.628 -12.179 -0.040 1.00 0.00 H new ATOM 0 HG1 THR A 854 -7.981 -11.571 1.755 1.00 0.00 H new ATOM 0 HG21 THR A 854 -5.804 -10.544 1.636 1.00 0.00 H new ATOM 0 HG22 THR A 854 -5.202 -10.151 0.008 1.00 0.00 H new ATOM 0 HG23 THR A 854 -6.547 -9.219 0.708 1.00 0.00 H new ATOM 787 N PRO A 855 -9.330 -9.177 -1.240 1.00 0.00 N ATOM 788 CA PRO A 855 -9.957 -7.844 -1.156 1.00 0.00 C ATOM 789 C PRO A 855 -9.381 -7.147 0.073 1.00 0.00 C ATOM 790 O PRO A 855 -10.011 -7.064 1.107 1.00 0.00 O ATOM 791 CB PRO A 855 -11.441 -8.182 -0.986 1.00 0.00 C ATOM 792 CG PRO A 855 -11.598 -9.718 -0.990 1.00 0.00 C ATOM 793 CD PRO A 855 -10.218 -10.352 -1.218 1.00 0.00 C ATOM 0 HA PRO A 855 -9.792 -7.183 -2.007 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.820 -7.765 -0.053 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -12.025 -7.740 -1.793 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -12.018 -10.058 -0.043 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -12.290 -10.025 -1.774 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -9.953 -11.046 -0.421 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -10.177 -10.910 -2.153 1.00 0.00 H new ATOM 800 N TYR A 856 -8.161 -6.679 -0.040 1.00 0.00 N ATOM 801 CA TYR A 856 -7.467 -6.027 1.057 1.00 0.00 C ATOM 802 C TYR A 856 -6.021 -5.882 0.638 1.00 0.00 C ATOM 803 O TYR A 856 -5.204 -6.755 0.861 1.00 0.00 O ATOM 804 CB TYR A 856 -7.563 -6.966 2.249 1.00 0.00 C ATOM 805 CG TYR A 856 -8.152 -6.227 3.413 1.00 0.00 C ATOM 806 CD1 TYR A 856 -9.304 -5.457 3.238 1.00 0.00 C ATOM 807 CD2 TYR A 856 -7.540 -6.301 4.664 1.00 0.00 C ATOM 808 CE1 TYR A 856 -9.852 -4.764 4.309 1.00 0.00 C ATOM 809 CE2 TYR A 856 -8.082 -5.606 5.743 1.00 0.00 C ATOM 810 CZ TYR A 856 -9.245 -4.836 5.571 1.00 0.00 C ATOM 811 OH TYR A 856 -9.786 -4.151 6.640 1.00 0.00 O ATOM 0 H TYR A 856 -7.614 -6.738 -0.899 1.00 0.00 H new ATOM 0 HA TYR A 856 -7.884 -5.051 1.307 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.182 -7.828 1.999 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -6.575 -7.347 2.507 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -9.770 -5.400 2.266 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -6.648 -6.896 4.796 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -10.744 -4.171 4.170 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -7.608 -5.659 6.712 1.00 0.00 H new ATOM 0 HH TYR A 856 -9.242 -4.310 7.440 1.00 0.00 H new ATOM 821 N MET A 857 -5.710 -4.789 0.030 1.00 0.00 N ATOM 822 CA MET A 857 -4.298 -4.564 -0.417 1.00 0.00 C ATOM 823 C MET A 857 -3.342 -4.870 0.749 1.00 0.00 C ATOM 824 O MET A 857 -3.778 -5.072 1.866 1.00 0.00 O ATOM 825 CB MET A 857 -4.196 -3.085 -0.811 1.00 0.00 C ATOM 826 CG MET A 857 -2.814 -2.804 -1.408 1.00 0.00 C ATOM 827 SD MET A 857 -2.991 -1.949 -2.992 1.00 0.00 S ATOM 828 CE MET A 857 -4.034 -0.592 -2.417 1.00 0.00 C ATOM 0 H MET A 857 -6.361 -4.033 -0.184 1.00 0.00 H new ATOM 0 HA MET A 857 -4.031 -5.208 -1.255 1.00 0.00 H new ATOM 0 HB2 MET A 857 -4.973 -2.837 -1.535 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.361 -2.454 0.062 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.228 -2.195 -0.720 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.272 -3.739 -1.548 1.00 0.00 H new ATOM 0 HE1 MET A 857 -4.164 0.133 -3.221 1.00 0.00 H new ATOM 0 HE2 MET A 857 -5.007 -0.982 -2.120 1.00 0.00 H new ATOM 0 HE3 MET A 857 -3.561 -0.106 -1.563 1.00 0.00 H new ATOM 838 N THR A 858 -2.055 -4.924 0.518 1.00 0.00 N ATOM 839 CA THR A 858 -1.136 -5.243 1.650 1.00 0.00 C ATOM 840 C THR A 858 -0.013 -4.224 1.776 1.00 0.00 C ATOM 841 O THR A 858 0.548 -3.766 0.802 1.00 0.00 O ATOM 842 CB THR A 858 -0.606 -6.640 1.344 1.00 0.00 C ATOM 843 OG1 THR A 858 0.082 -6.632 0.102 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.792 -7.603 1.279 1.00 0.00 C ATOM 0 H THR A 858 -1.609 -4.765 -0.385 1.00 0.00 H new ATOM 0 HA THR A 858 -1.651 -5.207 2.610 1.00 0.00 H new ATOM 0 HB THR A 858 0.088 -6.957 2.123 1.00 0.00 H new ATOM 0 HG1 THR A 858 -0.559 -6.495 -0.626 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.433 -8.609 1.061 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.313 -7.604 2.236 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.477 -7.284 0.493 1.00 0.00 H new ATOM 852 N LYS A 859 0.277 -3.865 3.001 1.00 0.00 N ATOM 853 CA LYS A 859 1.341 -2.856 3.314 1.00 0.00 C ATOM 854 C LYS A 859 2.398 -2.689 2.206 1.00 0.00 C ATOM 855 O LYS A 859 2.825 -1.583 1.948 1.00 0.00 O ATOM 856 CB LYS A 859 1.997 -3.374 4.596 1.00 0.00 C ATOM 857 CG LYS A 859 2.623 -4.746 4.335 1.00 0.00 C ATOM 858 CD LYS A 859 2.666 -5.544 5.641 1.00 0.00 C ATOM 859 CE LYS A 859 1.240 -5.902 6.067 1.00 0.00 C ATOM 860 NZ LYS A 859 1.402 -6.988 7.074 1.00 0.00 N ATOM 0 H LYS A 859 -0.194 -4.241 3.824 1.00 0.00 H new ATOM 0 HA LYS A 859 0.897 -1.866 3.413 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.760 -2.673 4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.256 -3.447 5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 859 2.044 -5.285 3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.630 -4.628 3.935 1.00 0.00 H new ATOM 0 HD2 LYS A 859 3.255 -6.451 5.506 1.00 0.00 H new ATOM 0 HD3 LYS A 859 3.154 -4.960 6.421 1.00 0.00 H new ATOM 0 HE2 LYS A 859 0.727 -5.040 6.494 1.00 0.00 H new ATOM 0 HE3 LYS A 859 0.646 -6.237 5.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 0.466 -7.288 7.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 1.887 -7.797 6.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 1.966 -6.638 7.875 1.00 0.00 H new ATOM 874 N TYR A 860 2.846 -3.739 1.551 1.00 0.00 N ATOM 875 CA TYR A 860 3.879 -3.520 0.494 1.00 0.00 C ATOM 876 C TYR A 860 3.302 -2.666 -0.619 1.00 0.00 C ATOM 877 O TYR A 860 3.894 -1.683 -1.008 1.00 0.00 O ATOM 878 CB TYR A 860 4.288 -4.885 -0.035 1.00 0.00 C ATOM 879 CG TYR A 860 5.320 -4.714 -1.147 1.00 0.00 C ATOM 880 CD1 TYR A 860 5.986 -3.485 -1.317 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.599 -5.774 -2.021 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.913 -3.317 -2.347 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.534 -5.603 -3.051 1.00 0.00 C ATOM 884 CZ TYR A 860 7.188 -4.377 -3.215 1.00 0.00 C ATOM 885 OH TYR A 860 8.104 -4.214 -4.235 1.00 0.00 O ATOM 0 H TYR A 860 2.551 -4.704 1.698 1.00 0.00 H new ATOM 0 HA TYR A 860 4.747 -2.999 0.899 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.704 -5.489 0.771 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.415 -5.416 -0.414 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.778 -2.666 -0.645 1.00 0.00 H new ATOM 0 HD2 TYR A 860 5.094 -6.721 -1.901 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.417 -2.370 -2.473 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.751 -6.422 -3.721 1.00 0.00 H new ATOM 0 HH TYR A 860 8.178 -5.048 -4.745 1.00 0.00 H new ATOM 895 N GLU A 861 2.147 -3.002 -1.122 1.00 0.00 N ATOM 896 CA GLU A 861 1.553 -2.145 -2.186 1.00 0.00 C ATOM 897 C GLU A 861 1.663 -0.704 -1.700 1.00 0.00 C ATOM 898 O GLU A 861 2.055 0.191 -2.422 1.00 0.00 O ATOM 899 CB GLU A 861 0.093 -2.575 -2.298 1.00 0.00 C ATOM 900 CG GLU A 861 0.004 -3.875 -3.099 1.00 0.00 C ATOM 901 CD GLU A 861 0.043 -5.066 -2.145 1.00 0.00 C ATOM 902 OE1 GLU A 861 1.133 -5.529 -1.849 1.00 0.00 O ATOM 903 OE2 GLU A 861 -1.017 -5.496 -1.726 1.00 0.00 O ATOM 0 H GLU A 861 1.597 -3.817 -0.849 1.00 0.00 H new ATOM 0 HA GLU A 861 2.044 -2.234 -3.155 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.332 -2.718 -1.305 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.491 -1.794 -2.786 1.00 0.00 H new ATOM 0 HG2 GLU A 861 -0.917 -3.893 -3.682 1.00 0.00 H new ATOM 0 HG3 GLU A 861 0.831 -3.936 -3.807 1.00 0.00 H new ATOM 910 N ARG A 862 1.367 -0.506 -0.443 1.00 0.00 N ATOM 911 CA ARG A 862 1.492 0.847 0.166 1.00 0.00 C ATOM 912 C ARG A 862 2.978 1.201 0.320 1.00 0.00 C ATOM 913 O ARG A 862 3.365 2.349 0.211 1.00 0.00 O ATOM 914 CB ARG A 862 0.829 0.733 1.533 1.00 0.00 C ATOM 915 CG ARG A 862 -0.475 1.536 1.535 1.00 0.00 C ATOM 916 CD ARG A 862 -1.492 0.867 0.607 1.00 0.00 C ATOM 917 NE ARG A 862 -1.568 1.755 -0.586 1.00 0.00 N ATOM 918 CZ ARG A 862 -2.594 2.545 -0.750 1.00 0.00 C ATOM 919 NH1 ARG A 862 -3.160 3.106 0.284 1.00 0.00 N ATOM 920 NH2 ARG A 862 -3.056 2.775 -1.949 1.00 0.00 N ATOM 0 H ARG A 862 1.040 -1.233 0.193 1.00 0.00 H new ATOM 0 HA ARG A 862 1.029 1.624 -0.442 1.00 0.00 H new ATOM 0 HB2 ARG A 862 0.625 -0.312 1.764 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.500 1.106 2.307 1.00 0.00 H new ATOM 0 HG2 ARG A 862 -0.875 1.596 2.547 1.00 0.00 H new ATOM 0 HG3 ARG A 862 -0.285 2.558 1.207 1.00 0.00 H new ATOM 0 HD2 ARG A 862 -1.173 -0.138 0.331 1.00 0.00 H new ATOM 0 HD3 ARG A 862 -2.464 0.771 1.090 1.00 0.00 H new ATOM 0 HE ARG A 862 -0.817 1.746 -1.276 1.00 0.00 H new ATOM 0 HH11 ARG A 862 -2.801 2.927 1.222 1.00 0.00 H new ATOM 0 HH12 ARG A 862 -3.962 3.723 0.154 1.00 0.00 H new ATOM 0 HH21 ARG A 862 -2.615 2.337 -2.758 1.00 0.00 H new ATOM 0 HH22 ARG A 862 -3.858 3.392 -2.077 1.00 0.00 H new ATOM 934 N ALA A 863 3.819 0.227 0.561 1.00 0.00 N ATOM 935 CA ALA A 863 5.275 0.528 0.698 1.00 0.00 C ATOM 936 C ALA A 863 5.895 0.738 -0.690 1.00 0.00 C ATOM 937 O ALA A 863 6.935 1.358 -0.842 1.00 0.00 O ATOM 938 CB ALA A 863 5.879 -0.700 1.381 1.00 0.00 C ATOM 0 H ALA A 863 3.563 -0.755 0.668 1.00 0.00 H new ATOM 0 HA ALA A 863 5.459 1.436 1.273 1.00 0.00 H new ATOM 0 HB1 ALA A 863 6.950 -0.551 1.516 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.408 -0.844 2.353 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.710 -1.581 0.762 1.00 0.00 H new ATOM 944 N ARG A 864 5.218 0.302 -1.714 1.00 0.00 N ATOM 945 CA ARG A 864 5.725 0.536 -3.093 1.00 0.00 C ATOM 946 C ARG A 864 5.175 1.896 -3.457 1.00 0.00 C ATOM 947 O ARG A 864 5.812 2.743 -4.050 1.00 0.00 O ATOM 948 CB ARG A 864 5.134 -0.581 -3.956 1.00 0.00 C ATOM 949 CG ARG A 864 6.268 -1.315 -4.680 1.00 0.00 C ATOM 950 CD ARG A 864 6.205 -1.015 -6.180 1.00 0.00 C ATOM 951 NE ARG A 864 7.105 -2.018 -6.811 1.00 0.00 N ATOM 952 CZ ARG A 864 7.818 -1.690 -7.855 1.00 0.00 C ATOM 953 NH1 ARG A 864 9.039 -1.259 -7.700 1.00 0.00 N ATOM 954 NH2 ARG A 864 7.310 -1.794 -9.052 1.00 0.00 N ATOM 0 H ARG A 864 4.336 -0.206 -1.656 1.00 0.00 H new ATOM 0 HA ARG A 864 6.808 0.524 -3.214 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.573 -1.278 -3.334 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.434 -0.165 -4.680 1.00 0.00 H new ATOM 0 HG2 ARG A 864 7.231 -1.002 -4.277 1.00 0.00 H new ATOM 0 HG3 ARG A 864 6.185 -2.389 -4.511 1.00 0.00 H new ATOM 0 HD2 ARG A 864 5.187 -1.105 -6.558 1.00 0.00 H new ATOM 0 HD3 ARG A 864 6.535 0.002 -6.394 1.00 0.00 H new ATOM 0 HE ARG A 864 7.165 -2.962 -6.428 1.00 0.00 H new ATOM 0 HH11 ARG A 864 9.436 -1.178 -6.764 1.00 0.00 H new ATOM 0 HH12 ARG A 864 9.597 -1.003 -8.515 1.00 0.00 H new ATOM 0 HH21 ARG A 864 6.355 -2.132 -9.173 1.00 0.00 H new ATOM 0 HH22 ARG A 864 7.868 -1.538 -9.867 1.00 0.00 H new ATOM 968 N VAL A 865 3.984 2.094 -2.983 1.00 0.00 N ATOM 969 CA VAL A 865 3.261 3.370 -3.114 1.00 0.00 C ATOM 970 C VAL A 865 4.166 4.482 -2.606 1.00 0.00 C ATOM 971 O VAL A 865 4.537 5.382 -3.308 1.00 0.00 O ATOM 972 CB VAL A 865 2.095 3.118 -2.153 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.815 4.310 -1.254 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.865 2.768 -2.938 1.00 0.00 C ATOM 0 H VAL A 865 3.459 1.377 -2.483 1.00 0.00 H new ATOM 0 HA VAL A 865 2.950 3.657 -4.119 1.00 0.00 H new ATOM 0 HB VAL A 865 2.377 2.288 -1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.980 4.079 -0.593 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.700 4.531 -0.657 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.564 5.176 -1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 865 0.036 2.589 -2.254 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.613 3.592 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL A 865 1.052 1.869 -3.525 1.00 0.00 H new ATOM 984 N LEU A 866 4.529 4.363 -1.374 1.00 0.00 N ATOM 985 CA LEU A 866 5.430 5.328 -0.712 1.00 0.00 C ATOM 986 C LEU A 866 6.645 5.498 -1.599 1.00 0.00 C ATOM 987 O LEU A 866 7.147 6.583 -1.789 1.00 0.00 O ATOM 988 CB LEU A 866 5.768 4.662 0.647 1.00 0.00 C ATOM 989 CG LEU A 866 7.273 4.733 0.969 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.460 4.992 2.466 1.00 0.00 C ATOM 991 CD2 LEU A 866 7.940 3.402 0.611 1.00 0.00 C ATOM 0 H LEU A 866 4.224 3.600 -0.770 1.00 0.00 H new ATOM 0 HA LEU A 866 5.010 6.321 -0.551 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.204 5.153 1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.451 3.619 0.628 1.00 0.00 H new ATOM 0 HG LEU A 866 7.726 5.539 0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.524 5.043 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 866 6.985 5.936 2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 866 7.004 4.182 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 866 9.004 3.455 0.840 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.484 2.599 1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 866 7.807 3.203 -0.452 1.00 0.00 H new ATOM 1003 N GLY A 867 7.105 4.428 -2.170 1.00 0.00 N ATOM 1004 CA GLY A 867 8.263 4.550 -3.069 1.00 0.00 C ATOM 1005 C GLY A 867 7.851 5.338 -4.299 1.00 0.00 C ATOM 1006 O GLY A 867 8.510 6.281 -4.691 1.00 0.00 O ATOM 0 H GLY A 867 6.731 3.486 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY A 867 9.085 5.051 -2.558 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.622 3.562 -3.357 1.00 0.00 H new ATOM 1010 N THR A 868 6.758 4.978 -4.909 1.00 0.00 N ATOM 1011 CA THR A 868 6.343 5.742 -6.128 1.00 0.00 C ATOM 1012 C THR A 868 5.741 7.090 -5.738 1.00 0.00 C ATOM 1013 O THR A 868 5.670 8.004 -6.537 1.00 0.00 O ATOM 1014 CB THR A 868 5.354 4.868 -6.909 1.00 0.00 C ATOM 1015 OG1 THR A 868 5.689 4.925 -8.288 1.00 0.00 O ATOM 1016 CG2 THR A 868 3.922 5.380 -6.723 1.00 0.00 C ATOM 0 H THR A 868 6.146 4.211 -4.631 1.00 0.00 H new ATOM 0 HA THR A 868 7.203 5.965 -6.760 1.00 0.00 H new ATOM 0 HB THR A 868 5.412 3.844 -6.540 1.00 0.00 H new ATOM 0 HG1 THR A 868 5.065 4.369 -8.799 1.00 0.00 H new ATOM 0 HG21 THR A 868 3.234 4.748 -7.284 1.00 0.00 H new ATOM 0 HG22 THR A 868 3.660 5.352 -5.665 1.00 0.00 H new ATOM 0 HG23 THR A 868 3.852 6.405 -7.087 1.00 0.00 H new ATOM 1024 N ARG A 869 5.362 7.240 -4.504 1.00 0.00 N ATOM 1025 CA ARG A 869 4.831 8.539 -4.052 1.00 0.00 C ATOM 1026 C ARG A 869 6.051 9.362 -3.726 1.00 0.00 C ATOM 1027 O ARG A 869 6.194 10.491 -4.140 1.00 0.00 O ATOM 1028 CB ARG A 869 4.002 8.240 -2.801 1.00 0.00 C ATOM 1029 CG ARG A 869 2.703 7.537 -3.205 1.00 0.00 C ATOM 1030 CD ARG A 869 1.777 8.527 -3.918 1.00 0.00 C ATOM 1031 NE ARG A 869 1.561 7.949 -5.275 1.00 0.00 N ATOM 1032 CZ ARG A 869 1.049 8.685 -6.225 1.00 0.00 C ATOM 1033 NH1 ARG A 869 0.078 9.515 -5.956 1.00 0.00 N ATOM 1034 NH2 ARG A 869 1.508 8.588 -7.443 1.00 0.00 N ATOM 0 H ARG A 869 5.399 6.513 -3.790 1.00 0.00 H new ATOM 0 HA ARG A 869 4.207 9.066 -4.774 1.00 0.00 H new ATOM 0 HB2 ARG A 869 4.571 7.611 -2.117 1.00 0.00 H new ATOM 0 HB3 ARG A 869 3.777 9.166 -2.271 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.923 6.694 -3.860 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.208 7.133 -2.322 1.00 0.00 H new ATOM 0 HD2 ARG A 869 0.834 8.640 -3.383 1.00 0.00 H new ATOM 0 HD3 ARG A 869 2.230 9.517 -3.979 1.00 0.00 H new ATOM 0 HE ARG A 869 1.813 6.978 -5.462 1.00 0.00 H new ATOM 0 HH11 ARG A 869 -0.281 9.589 -5.004 1.00 0.00 H new ATOM 0 HH12 ARG A 869 -0.322 10.090 -6.698 1.00 0.00 H new ATOM 0 HH21 ARG A 869 2.266 7.938 -7.652 1.00 0.00 H new ATOM 0 HH22 ARG A 869 1.109 9.162 -8.186 1.00 0.00 H new ATOM 1048 N ALA A 870 6.959 8.759 -3.008 1.00 0.00 N ATOM 1049 CA ALA A 870 8.229 9.456 -2.666 1.00 0.00 C ATOM 1050 C ALA A 870 8.887 10.065 -3.913 1.00 0.00 C ATOM 1051 O ALA A 870 9.549 11.073 -3.826 1.00 0.00 O ATOM 1052 CB ALA A 870 9.123 8.364 -2.087 1.00 0.00 C ATOM 0 H ALA A 870 6.874 7.810 -2.643 1.00 0.00 H new ATOM 0 HA ALA A 870 8.060 10.280 -1.973 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.085 8.792 -1.807 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.647 7.933 -1.206 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.276 7.585 -2.834 1.00 0.00 H new ATOM 1058 N LEU A 871 8.704 9.488 -5.072 1.00 0.00 N ATOM 1059 CA LEU A 871 9.339 10.117 -6.295 1.00 0.00 C ATOM 1060 C LEU A 871 8.387 11.139 -6.870 1.00 0.00 C ATOM 1061 O LEU A 871 8.795 12.184 -7.344 1.00 0.00 O ATOM 1062 CB LEU A 871 9.676 9.035 -7.346 1.00 0.00 C ATOM 1063 CG LEU A 871 9.245 7.639 -6.907 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.873 6.826 -8.143 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.408 6.964 -6.173 1.00 0.00 C ATOM 0 H LEU A 871 8.164 8.638 -5.235 1.00 0.00 H new ATOM 0 HA LEU A 871 10.270 10.608 -6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 871 9.187 9.283 -8.288 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.750 9.038 -7.534 1.00 0.00 H new ATOM 0 HG LEU A 871 8.385 7.702 -6.240 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.563 5.826 -7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 871 8.053 7.317 -8.668 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.736 6.754 -8.805 1.00 0.00 H new ATOM 0 HD21 LEU A 871 10.108 5.965 -5.856 1.00 0.00 H new ATOM 0 HD22 LEU A 871 11.266 6.890 -6.841 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.679 7.556 -5.299 1.00 0.00 H new ATOM 1077 N GLN A 872 7.119 10.865 -6.795 1.00 0.00 N ATOM 1078 CA GLN A 872 6.126 11.846 -7.298 1.00 0.00 C ATOM 1079 C GLN A 872 6.524 13.210 -6.731 1.00 0.00 C ATOM 1080 O GLN A 872 6.920 14.116 -7.441 1.00 0.00 O ATOM 1081 CB GLN A 872 4.798 11.341 -6.721 1.00 0.00 C ATOM 1082 CG GLN A 872 3.879 10.826 -7.843 1.00 0.00 C ATOM 1083 CD GLN A 872 4.606 9.775 -8.692 1.00 0.00 C ATOM 1084 OE1 GLN A 872 5.759 9.474 -8.463 1.00 0.00 O ATOM 1085 NE2 GLN A 872 3.969 9.202 -9.678 1.00 0.00 N ATOM 0 H GLN A 872 6.728 10.006 -6.408 1.00 0.00 H new ATOM 0 HA GLN A 872 6.063 11.945 -8.382 1.00 0.00 H new ATOM 0 HB2 GLN A 872 4.988 10.542 -6.004 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.302 12.146 -6.178 1.00 0.00 H new ATOM 0 HG2 GLN A 872 2.976 10.393 -7.412 1.00 0.00 H new ATOM 0 HG3 GLN A 872 3.564 11.657 -8.474 1.00 0.00 H new ATOM 0 HE21 GLN A 872 3.000 9.453 -9.873 1.00 0.00 H new ATOM 0 HE22 GLN A 872 4.441 8.504 -10.253 1.00 0.00 H new ATOM 1094 N ILE A 873 6.470 13.319 -5.442 1.00 0.00 N ATOM 1095 CA ILE A 873 6.888 14.566 -4.742 1.00 0.00 C ATOM 1096 C ILE A 873 8.351 14.837 -4.957 1.00 0.00 C ATOM 1097 O ILE A 873 8.769 15.974 -5.045 1.00 0.00 O ATOM 1098 CB ILE A 873 6.696 14.277 -3.268 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.018 12.794 -2.972 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.266 14.612 -2.921 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.270 12.698 -2.113 1.00 0.00 C ATOM 0 H ILE A 873 6.145 12.577 -4.822 1.00 0.00 H new ATOM 0 HA ILE A 873 6.317 15.421 -5.106 1.00 0.00 H new ATOM 0 HB ILE A 873 7.371 14.879 -2.660 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.178 12.326 -2.459 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.164 12.251 -3.906 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.093 14.415 -1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.078 15.665 -3.129 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.593 13.998 -3.520 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.491 11.651 -1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.109 13.150 -2.642 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.108 13.225 -1.173 1.00 0.00 H new ATOM 1113 N ALA A 874 9.148 13.810 -5.046 1.00 0.00 N ATOM 1114 CA ALA A 874 10.593 14.052 -5.260 1.00 0.00 C ATOM 1115 C ALA A 874 10.749 14.931 -6.485 1.00 0.00 C ATOM 1116 O ALA A 874 11.758 15.579 -6.683 1.00 0.00 O ATOM 1117 CB ALA A 874 11.230 12.685 -5.442 1.00 0.00 C ATOM 0 H ALA A 874 8.865 12.832 -4.981 1.00 0.00 H new ATOM 0 HA ALA A 874 11.075 14.565 -4.428 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.301 12.802 -5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.062 12.083 -4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.784 12.188 -6.304 1.00 0.00 H new ATOM 1123 N MET A 875 9.710 15.024 -7.267 1.00 0.00 N ATOM 1124 CA MET A 875 9.759 15.943 -8.425 1.00 0.00 C ATOM 1125 C MET A 875 9.173 17.259 -7.924 1.00 0.00 C ATOM 1126 O MET A 875 9.847 18.263 -7.794 1.00 0.00 O ATOM 1127 CB MET A 875 8.868 15.310 -9.496 1.00 0.00 C ATOM 1128 CG MET A 875 9.598 15.318 -10.840 1.00 0.00 C ATOM 1129 SD MET A 875 8.422 14.958 -12.168 1.00 0.00 S ATOM 1130 CE MET A 875 8.310 16.636 -12.833 1.00 0.00 C ATOM 0 H MET A 875 8.839 14.506 -7.152 1.00 0.00 H new ATOM 0 HA MET A 875 10.754 16.114 -8.835 1.00 0.00 H new ATOM 0 HB2 MET A 875 8.614 14.288 -9.215 1.00 0.00 H new ATOM 0 HB3 MET A 875 7.931 15.861 -9.576 1.00 0.00 H new ATOM 0 HG2 MET A 875 10.065 16.289 -11.007 1.00 0.00 H new ATOM 0 HG3 MET A 875 10.397 14.577 -10.836 1.00 0.00 H new ATOM 0 HE1 MET A 875 7.623 16.647 -13.679 1.00 0.00 H new ATOM 0 HE2 MET A 875 7.944 17.310 -12.059 1.00 0.00 H new ATOM 0 HE3 MET A 875 9.296 16.963 -13.163 1.00 0.00 H new ATOM 1140 N CYS A 876 7.921 17.213 -7.582 1.00 0.00 N ATOM 1141 CA CYS A 876 7.223 18.396 -7.005 1.00 0.00 C ATOM 1142 C CYS A 876 6.354 17.911 -5.847 1.00 0.00 C ATOM 1143 O CYS A 876 6.735 17.969 -4.696 1.00 0.00 O ATOM 1144 CB CYS A 876 6.386 18.980 -8.148 1.00 0.00 C ATOM 1145 SG CYS A 876 5.411 20.379 -7.538 1.00 0.00 S ATOM 0 H CYS A 876 7.334 16.384 -7.680 1.00 0.00 H new ATOM 0 HA CYS A 876 7.898 19.158 -6.614 1.00 0.00 H new ATOM 0 HB2 CYS A 876 7.037 19.305 -8.959 1.00 0.00 H new ATOM 0 HB3 CYS A 876 5.726 18.215 -8.556 1.00 0.00 H new ATOM 0 HG CYS A 876 4.704 20.873 -8.511 1.00 0.00 H new ATOM 1151 N ALA A 877 5.194 17.391 -6.156 1.00 0.00 N ATOM 1152 CA ALA A 877 4.298 16.855 -5.086 1.00 0.00 C ATOM 1153 C ALA A 877 2.947 16.325 -5.619 1.00 0.00 C ATOM 1154 O ALA A 877 1.917 16.615 -5.043 1.00 0.00 O ATOM 1155 CB ALA A 877 4.073 18.006 -4.120 1.00 0.00 C ATOM 0 H ALA A 877 4.827 17.314 -7.105 1.00 0.00 H new ATOM 0 HA ALA A 877 4.769 15.993 -4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.422 17.679 -3.309 1.00 0.00 H new ATOM 0 HB2 ALA A 877 5.030 18.329 -3.709 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.605 18.837 -4.647 1.00 0.00 H new ATOM 1161 N PRO A 878 2.982 15.508 -6.654 1.00 0.00 N ATOM 1162 CA PRO A 878 1.734 14.886 -7.181 1.00 0.00 C ATOM 1163 C PRO A 878 1.107 14.029 -6.075 1.00 0.00 C ATOM 1164 O PRO A 878 -0.025 13.594 -6.152 1.00 0.00 O ATOM 1165 CB PRO A 878 2.259 13.988 -8.296 1.00 0.00 C ATOM 1166 CG PRO A 878 3.789 14.120 -8.355 1.00 0.00 C ATOM 1167 CD PRO A 878 4.238 15.171 -7.349 1.00 0.00 C ATOM 0 HA PRO A 878 0.980 15.599 -7.516 1.00 0.00 H new ATOM 0 HB2 PRO A 878 1.976 12.952 -8.112 1.00 0.00 H new ATOM 0 HB3 PRO A 878 1.818 14.274 -9.251 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.258 13.162 -8.132 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.104 14.403 -9.360 1.00 0.00 H new ATOM 0 HD2 PRO A 878 4.989 14.780 -6.662 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.676 16.040 -7.839 1.00 0.00 H new ATOM 1174 N VAL A 879 1.878 13.786 -5.056 1.00 0.00 N ATOM 1175 CA VAL A 879 1.442 12.957 -3.899 1.00 0.00 C ATOM 1176 C VAL A 879 0.122 13.492 -3.334 1.00 0.00 C ATOM 1177 O VAL A 879 -0.445 14.443 -3.836 1.00 0.00 O ATOM 1178 CB VAL A 879 2.637 13.141 -2.932 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.272 12.972 -1.448 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.736 12.132 -3.304 1.00 0.00 C ATOM 0 H VAL A 879 2.830 14.142 -4.974 1.00 0.00 H new ATOM 0 HA VAL A 879 1.234 11.910 -4.120 1.00 0.00 H new ATOM 0 HB VAL A 879 2.979 14.169 -3.047 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.162 13.116 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.519 13.710 -1.172 1.00 0.00 H new ATOM 0 HG13 VAL A 879 1.876 11.970 -1.283 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.584 12.252 -2.629 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.344 11.119 -3.217 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.061 12.309 -4.329 1.00 0.00 H new ATOM 1190 N MET A 880 -0.379 12.856 -2.322 1.00 0.00 N ATOM 1191 CA MET A 880 -1.688 13.274 -1.728 1.00 0.00 C ATOM 1192 C MET A 880 -1.470 14.256 -0.580 1.00 0.00 C ATOM 1193 O MET A 880 -2.311 14.426 0.279 1.00 0.00 O ATOM 1194 CB MET A 880 -2.320 11.979 -1.215 1.00 0.00 C ATOM 1195 CG MET A 880 -3.791 11.926 -1.631 1.00 0.00 C ATOM 1196 SD MET A 880 -4.742 13.109 -0.644 1.00 0.00 S ATOM 1197 CE MET A 880 -5.846 13.669 -1.964 1.00 0.00 C ATOM 0 H MET A 880 0.061 12.054 -1.870 1.00 0.00 H new ATOM 0 HA MET A 880 -2.323 13.781 -2.454 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.787 11.118 -1.617 1.00 0.00 H new ATOM 0 HB3 MET A 880 -2.237 11.927 -0.129 1.00 0.00 H new ATOM 0 HG2 MET A 880 -3.889 12.160 -2.691 1.00 0.00 H new ATOM 0 HG3 MET A 880 -4.184 10.919 -1.489 1.00 0.00 H new ATOM 0 HE1 MET A 880 -6.533 14.418 -1.570 1.00 0.00 H new ATOM 0 HE2 MET A 880 -5.257 14.105 -2.771 1.00 0.00 H new ATOM 0 HE3 MET A 880 -6.414 12.821 -2.347 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.359 14.926 -0.591 1.00 0.00 N ATOM 1208 CA VAL A 881 -0.056 15.931 0.442 1.00 0.00 C ATOM 1209 C VAL A 881 0.893 16.937 -0.203 1.00 0.00 C ATOM 1210 O VAL A 881 1.439 16.693 -1.262 1.00 0.00 O ATOM 1211 CB VAL A 881 0.583 15.178 1.621 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.468 14.277 2.293 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.744 14.311 1.131 1.00 0.00 C ATOM 0 H VAL A 881 0.369 14.812 -1.296 1.00 0.00 H new ATOM 0 HA VAL A 881 -0.927 16.468 0.817 1.00 0.00 H new ATOM 0 HB VAL A 881 0.957 15.909 2.338 1.00 0.00 H new ATOM 0 HG11 VAL A 881 -0.011 13.745 3.128 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.291 14.890 2.660 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -0.847 13.557 1.568 1.00 0.00 H new ATOM 0 HG21 VAL A 881 2.187 13.784 1.976 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.376 13.587 0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.498 14.944 0.663 1.00 0.00 H new ATOM 1223 N GLU A 882 1.057 18.070 0.387 1.00 0.00 N ATOM 1224 CA GLU A 882 1.932 19.112 -0.232 1.00 0.00 C ATOM 1225 C GLU A 882 3.011 19.597 0.740 1.00 0.00 C ATOM 1226 O GLU A 882 2.933 20.689 1.270 1.00 0.00 O ATOM 1227 CB GLU A 882 0.977 20.258 -0.584 1.00 0.00 C ATOM 1228 CG GLU A 882 0.944 20.454 -2.102 1.00 0.00 C ATOM 1229 CD GLU A 882 1.994 21.491 -2.505 1.00 0.00 C ATOM 1230 OE1 GLU A 882 3.170 21.198 -2.370 1.00 0.00 O ATOM 1231 OE2 GLU A 882 1.602 22.560 -2.943 1.00 0.00 O ATOM 0 H GLU A 882 0.628 18.333 1.274 1.00 0.00 H new ATOM 0 HA GLU A 882 2.465 18.723 -1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 882 -0.024 20.036 -0.214 1.00 0.00 H new ATOM 0 HB3 GLU A 882 1.301 21.177 -0.096 1.00 0.00 H new ATOM 0 HG2 GLU A 882 1.140 19.508 -2.606 1.00 0.00 H new ATOM 0 HG3 GLU A 882 -0.047 20.783 -2.416 1.00 0.00 H new ATOM 1238 N LEU A 883 4.025 18.807 0.973 1.00 0.00 N ATOM 1239 CA LEU A 883 5.104 19.249 1.902 1.00 0.00 C ATOM 1240 C LEU A 883 5.768 20.533 1.370 1.00 0.00 C ATOM 1241 O LEU A 883 5.383 21.627 1.737 1.00 0.00 O ATOM 1242 CB LEU A 883 6.099 18.085 1.941 1.00 0.00 C ATOM 1243 CG LEU A 883 7.295 18.454 2.828 1.00 0.00 C ATOM 1244 CD1 LEU A 883 7.265 17.616 4.107 1.00 0.00 C ATOM 1245 CD2 LEU A 883 8.597 18.177 2.072 1.00 0.00 C ATOM 0 H LEU A 883 4.152 17.882 0.563 1.00 0.00 H new ATOM 0 HA LEU A 883 4.727 19.484 2.897 1.00 0.00 H new ATOM 0 HB2 LEU A 883 5.611 17.190 2.327 1.00 0.00 H new ATOM 0 HB3 LEU A 883 6.441 17.852 0.932 1.00 0.00 H new ATOM 0 HG LEU A 883 7.239 19.512 3.085 1.00 0.00 H new ATOM 0 HD11 LEU A 883 8.116 17.880 4.735 1.00 0.00 H new ATOM 0 HD12 LEU A 883 6.339 17.812 4.649 1.00 0.00 H new ATOM 0 HD13 LEU A 883 7.318 16.558 3.850 1.00 0.00 H new ATOM 0 HD21 LEU A 883 9.447 18.439 2.702 1.00 0.00 H new ATOM 0 HD22 LEU A 883 8.650 17.119 1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 883 8.623 18.775 1.161 1.00 0.00 H new ATOM 1257 N GLU A 884 6.761 20.418 0.519 1.00 0.00 N ATOM 1258 CA GLU A 884 7.432 21.648 -0.011 1.00 0.00 C ATOM 1259 C GLU A 884 7.861 21.487 -1.481 1.00 0.00 C ATOM 1260 O GLU A 884 8.450 22.383 -2.056 1.00 0.00 O ATOM 1261 CB GLU A 884 8.663 21.825 0.878 1.00 0.00 C ATOM 1262 CG GLU A 884 8.585 23.169 1.607 1.00 0.00 C ATOM 1263 CD GLU A 884 9.284 24.245 0.775 1.00 0.00 C ATOM 1264 OE1 GLU A 884 8.652 24.776 -0.123 1.00 0.00 O ATOM 1265 OE2 GLU A 884 10.441 24.520 1.050 1.00 0.00 O ATOM 0 H GLU A 884 7.133 19.534 0.171 1.00 0.00 H new ATOM 0 HA GLU A 884 6.759 22.505 0.009 1.00 0.00 H new ATOM 0 HB2 GLU A 884 8.721 21.011 1.601 1.00 0.00 H new ATOM 0 HB3 GLU A 884 9.569 21.780 0.274 1.00 0.00 H new ATOM 0 HG2 GLU A 884 7.543 23.444 1.774 1.00 0.00 H new ATOM 0 HG3 GLU A 884 9.055 23.090 2.587 1.00 0.00 H new ATOM 1272 N GLY A 885 7.609 20.357 -2.087 1.00 0.00 N ATOM 1273 CA GLY A 885 8.042 20.151 -3.496 1.00 0.00 C ATOM 1274 C GLY A 885 9.003 18.958 -3.532 1.00 0.00 C ATOM 1275 O GLY A 885 9.149 18.300 -4.540 1.00 0.00 O ATOM 0 H GLY A 885 7.121 19.567 -1.664 1.00 0.00 H new ATOM 0 HA2 GLY A 885 7.179 19.964 -4.135 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.533 21.046 -3.878 1.00 0.00 H new ATOM 1279 N GLU A 886 9.646 18.688 -2.415 1.00 0.00 N ATOM 1280 CA GLU A 886 10.615 17.547 -2.286 1.00 0.00 C ATOM 1281 C GLU A 886 11.642 17.902 -1.219 1.00 0.00 C ATOM 1282 O GLU A 886 12.282 18.933 -1.285 1.00 0.00 O ATOM 1283 CB GLU A 886 11.319 17.374 -3.637 1.00 0.00 C ATOM 1284 CG GLU A 886 12.579 16.512 -3.472 1.00 0.00 C ATOM 1285 CD GLU A 886 13.387 16.531 -4.769 1.00 0.00 C ATOM 1286 OE1 GLU A 886 13.475 17.588 -5.374 1.00 0.00 O ATOM 1287 OE2 GLU A 886 13.904 15.490 -5.138 1.00 0.00 O ATOM 0 H GLU A 886 9.534 19.231 -1.559 1.00 0.00 H new ATOM 0 HA GLU A 886 10.103 16.626 -2.007 1.00 0.00 H new ATOM 0 HB2 GLU A 886 10.641 16.907 -4.351 1.00 0.00 H new ATOM 0 HB3 GLU A 886 11.587 18.349 -4.043 1.00 0.00 H new ATOM 0 HG2 GLU A 886 13.185 16.890 -2.649 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.301 15.489 -3.220 1.00 0.00 H new ATOM 1294 N THR A 887 11.812 17.063 -0.247 1.00 0.00 N ATOM 1295 CA THR A 887 12.798 17.348 0.811 1.00 0.00 C ATOM 1296 C THR A 887 13.020 16.051 1.549 1.00 0.00 C ATOM 1297 O THR A 887 14.131 15.618 1.788 1.00 0.00 O ATOM 1298 CB THR A 887 12.111 18.384 1.709 1.00 0.00 C ATOM 1299 OG1 THR A 887 12.092 19.642 1.049 1.00 0.00 O ATOM 1300 CG2 THR A 887 12.868 18.515 3.035 1.00 0.00 C ATOM 0 H THR A 887 11.304 16.185 -0.141 1.00 0.00 H new ATOM 0 HA THR A 887 13.759 17.722 0.457 1.00 0.00 H new ATOM 0 HB THR A 887 11.090 18.059 1.912 1.00 0.00 H new ATOM 0 HG1 THR A 887 12.679 19.609 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 887 12.372 19.253 3.666 1.00 0.00 H new ATOM 0 HG22 THR A 887 12.879 17.551 3.544 1.00 0.00 H new ATOM 0 HG23 THR A 887 13.892 18.834 2.840 1.00 0.00 H new ATOM 1308 N ASP A 888 11.940 15.432 1.899 1.00 0.00 N ATOM 1309 CA ASP A 888 12.007 14.153 2.610 1.00 0.00 C ATOM 1310 C ASP A 888 12.043 12.981 1.623 1.00 0.00 C ATOM 1311 O ASP A 888 11.404 13.034 0.591 1.00 0.00 O ATOM 1312 CB ASP A 888 10.730 14.131 3.418 1.00 0.00 C ATOM 1313 CG ASP A 888 10.943 13.333 4.705 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.782 12.126 4.665 1.00 0.00 O ATOM 1315 OD2 ASP A 888 11.267 13.945 5.710 1.00 0.00 O ATOM 0 H ASP A 888 10.996 15.771 1.715 1.00 0.00 H new ATOM 0 HA ASP A 888 12.902 14.056 3.224 1.00 0.00 H new ATOM 0 HB2 ASP A 888 10.423 15.149 3.658 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.926 13.685 2.832 1.00 0.00 H new ATOM 1320 N PRO A 889 12.767 11.945 1.969 1.00 0.00 N ATOM 1321 CA PRO A 889 12.844 10.756 1.093 1.00 0.00 C ATOM 1322 C PRO A 889 11.503 10.002 1.077 1.00 0.00 C ATOM 1323 O PRO A 889 11.320 9.086 0.300 1.00 0.00 O ATOM 1324 CB PRO A 889 13.924 9.908 1.773 1.00 0.00 C ATOM 1325 CG PRO A 889 14.413 10.648 3.033 1.00 0.00 C ATOM 1326 CD PRO A 889 13.558 11.906 3.225 1.00 0.00 C ATOM 0 HA PRO A 889 13.066 10.999 0.054 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.524 8.930 2.041 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.755 9.736 1.089 1.00 0.00 H new ATOM 0 HG2 PRO A 889 14.334 10.000 3.906 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.464 10.917 2.929 1.00 0.00 H new ATOM 0 HD2 PRO A 889 12.920 11.833 4.106 1.00 0.00 H new ATOM 0 HD3 PRO A 889 14.170 12.799 3.348 1.00 0.00 H new ATOM 1333 N LEU A 890 10.565 10.367 1.931 1.00 0.00 N ATOM 1334 CA LEU A 890 9.262 9.650 1.957 1.00 0.00 C ATOM 1335 C LEU A 890 8.283 10.251 2.985 1.00 0.00 C ATOM 1336 O LEU A 890 7.242 9.679 3.222 1.00 0.00 O ATOM 1337 CB LEU A 890 9.592 8.180 2.311 1.00 0.00 C ATOM 1338 CG LEU A 890 10.115 8.021 3.760 1.00 0.00 C ATOM 1339 CD1 LEU A 890 11.242 9.011 4.055 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.979 8.240 4.761 1.00 0.00 C ATOM 0 H LEU A 890 10.655 11.128 2.604 1.00 0.00 H new ATOM 0 HA LEU A 890 8.763 9.736 0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.698 7.569 2.182 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.340 7.801 1.615 1.00 0.00 H new ATOM 0 HG LEU A 890 10.504 7.008 3.860 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.588 8.874 5.080 1.00 0.00 H new ATOM 0 HD12 LEU A 890 12.069 8.836 3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.874 10.029 3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 890 9.361 8.125 5.775 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.574 9.244 4.637 1.00 0.00 H new ATOM 0 HD23 LEU A 890 8.192 7.507 4.584 1.00 0.00 H new ATOM 1352 N LEU A 891 8.569 11.394 3.590 1.00 0.00 N ATOM 1353 CA LEU A 891 7.584 11.976 4.569 1.00 0.00 C ATOM 1354 C LEU A 891 6.226 11.875 3.945 1.00 0.00 C ATOM 1355 O LEU A 891 5.246 11.535 4.551 1.00 0.00 O ATOM 1356 CB LEU A 891 7.990 13.448 4.746 1.00 0.00 C ATOM 1357 CG LEU A 891 6.769 14.388 4.934 1.00 0.00 C ATOM 1358 CD1 LEU A 891 5.998 14.595 3.612 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.826 13.823 6.003 1.00 0.00 C ATOM 0 H LEU A 891 9.422 11.935 3.450 1.00 0.00 H new ATOM 0 HA LEU A 891 7.572 11.466 5.532 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.649 13.538 5.610 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.561 13.770 3.875 1.00 0.00 H new ATOM 0 HG LEU A 891 7.147 15.358 5.257 1.00 0.00 H new ATOM 0 HD11 LEU A 891 5.151 15.259 3.785 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.661 15.039 2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.637 13.633 3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.973 14.491 6.126 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.474 12.839 5.694 1.00 0.00 H new ATOM 0 HD23 LEU A 891 6.359 13.737 6.950 1.00 0.00 H new ATOM 1371 N ILE A 892 6.217 12.189 2.714 1.00 0.00 N ATOM 1372 CA ILE A 892 4.987 12.148 1.910 1.00 0.00 C ATOM 1373 C ILE A 892 4.541 10.718 1.763 1.00 0.00 C ATOM 1374 O ILE A 892 3.384 10.396 1.897 1.00 0.00 O ATOM 1375 CB ILE A 892 5.440 12.671 0.569 1.00 0.00 C ATOM 1376 CG1 ILE A 892 5.073 14.133 0.455 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.793 11.878 -0.556 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.212 14.836 -0.246 1.00 0.00 C ATOM 0 H ILE A 892 7.045 12.488 2.199 1.00 0.00 H new ATOM 0 HA ILE A 892 4.161 12.713 2.342 1.00 0.00 H new ATOM 0 HB ILE A 892 6.521 12.560 0.487 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.146 14.253 -0.106 1.00 0.00 H new ATOM 0 HG13 ILE A 892 4.906 14.564 1.442 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.130 12.268 -1.516 1.00 0.00 H new ATOM 0 HG22 ILE A 892 5.076 10.829 -0.471 1.00 0.00 H new ATOM 0 HG23 ILE A 892 3.709 11.968 -0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 892 5.979 15.896 -0.345 1.00 0.00 H new ATOM 0 HD12 ILE A 892 7.126 14.718 0.336 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.354 14.402 -1.236 1.00 0.00 H new ATOM 1390 N ALA A 893 5.466 9.865 1.463 1.00 0.00 N ATOM 1391 CA ALA A 893 5.084 8.434 1.277 1.00 0.00 C ATOM 1392 C ALA A 893 4.689 7.847 2.631 1.00 0.00 C ATOM 1393 O ALA A 893 3.958 6.876 2.737 1.00 0.00 O ATOM 1394 CB ALA A 893 6.335 7.755 0.751 1.00 0.00 C ATOM 0 H ALA A 893 6.455 10.082 1.338 1.00 0.00 H new ATOM 0 HA ALA A 893 4.242 8.304 0.597 1.00 0.00 H new ATOM 0 HB1 ALA A 893 6.133 6.696 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.631 8.217 -0.191 1.00 0.00 H new ATOM 0 HB3 ALA A 893 7.141 7.864 1.477 1.00 0.00 H new ATOM 1400 N MET A 894 5.121 8.498 3.660 1.00 0.00 N ATOM 1401 CA MET A 894 4.771 8.085 5.045 1.00 0.00 C ATOM 1402 C MET A 894 3.473 8.778 5.403 1.00 0.00 C ATOM 1403 O MET A 894 2.506 8.166 5.772 1.00 0.00 O ATOM 1404 CB MET A 894 5.926 8.607 5.907 1.00 0.00 C ATOM 1405 CG MET A 894 5.507 8.683 7.379 1.00 0.00 C ATOM 1406 SD MET A 894 6.908 9.252 8.380 1.00 0.00 S ATOM 1407 CE MET A 894 7.060 10.914 7.673 1.00 0.00 C ATOM 0 H MET A 894 5.719 9.323 3.604 1.00 0.00 H new ATOM 0 HA MET A 894 4.640 7.011 5.177 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.790 7.951 5.802 1.00 0.00 H new ATOM 0 HB3 MET A 894 6.230 9.594 5.558 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.664 9.365 7.493 1.00 0.00 H new ATOM 0 HG3 MET A 894 5.174 7.704 7.724 1.00 0.00 H new ATOM 0 HE1 MET A 894 8.023 11.009 7.170 1.00 0.00 H new ATOM 0 HE2 MET A 894 6.257 11.078 6.954 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.992 11.656 8.469 1.00 0.00 H new ATOM 1417 N LYS A 895 3.455 10.064 5.242 1.00 0.00 N ATOM 1418 CA LYS A 895 2.223 10.846 5.507 1.00 0.00 C ATOM 1419 C LYS A 895 1.122 10.247 4.642 1.00 0.00 C ATOM 1420 O LYS A 895 0.026 9.999 5.091 1.00 0.00 O ATOM 1421 CB LYS A 895 2.569 12.276 5.077 1.00 0.00 C ATOM 1422 CG LYS A 895 1.292 13.074 4.807 1.00 0.00 C ATOM 1423 CD LYS A 895 0.593 13.388 6.131 1.00 0.00 C ATOM 1424 CE LYS A 895 -0.812 13.925 5.851 1.00 0.00 C ATOM 1425 NZ LYS A 895 -1.608 13.566 7.058 1.00 0.00 N ATOM 0 H LYS A 895 4.254 10.617 4.933 1.00 0.00 H new ATOM 0 HA LYS A 895 1.886 10.834 6.544 1.00 0.00 H new ATOM 0 HB2 LYS A 895 3.154 12.766 5.856 1.00 0.00 H new ATOM 0 HB3 LYS A 895 3.188 12.253 4.180 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.533 13.999 4.283 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.626 12.505 4.159 1.00 0.00 H new ATOM 0 HD2 LYS A 895 0.535 12.490 6.746 1.00 0.00 H new ATOM 0 HD3 LYS A 895 1.169 14.123 6.694 1.00 0.00 H new ATOM 0 HE2 LYS A 895 -0.798 15.003 5.693 1.00 0.00 H new ATOM 0 HE3 LYS A 895 -1.234 13.477 4.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 -2.585 13.902 6.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 -1.609 12.533 7.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 -1.186 14.012 7.897 1.00 0.00 H new ATOM 1439 N GLU A 896 1.434 9.990 3.400 1.00 0.00 N ATOM 1440 CA GLU A 896 0.431 9.368 2.489 1.00 0.00 C ATOM 1441 C GLU A 896 -0.141 8.111 3.139 1.00 0.00 C ATOM 1442 O GLU A 896 -1.341 7.982 3.284 1.00 0.00 O ATOM 1443 CB GLU A 896 1.201 9.001 1.221 1.00 0.00 C ATOM 1444 CG GLU A 896 1.259 10.208 0.283 1.00 0.00 C ATOM 1445 CD GLU A 896 0.349 9.966 -0.922 1.00 0.00 C ATOM 1446 OE1 GLU A 896 -0.724 9.423 -0.729 1.00 0.00 O ATOM 1447 OE2 GLU A 896 0.742 10.332 -2.017 1.00 0.00 O ATOM 0 H GLU A 896 2.341 10.184 2.977 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.401 10.039 2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 896 2.210 8.679 1.478 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.717 8.163 0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 896 0.946 11.108 0.812 1.00 0.00 H new ATOM 0 HG3 GLU A 896 2.284 10.374 -0.050 1.00 0.00 H new ATOM 1454 N LEU A 897 0.693 7.180 3.551 1.00 0.00 N ATOM 1455 CA LEU A 897 0.120 5.967 4.200 1.00 0.00 C ATOM 1456 C LEU A 897 -0.403 6.353 5.569 1.00 0.00 C ATOM 1457 O LEU A 897 -1.505 6.024 5.955 1.00 0.00 O ATOM 1458 CB LEU A 897 1.255 4.956 4.318 1.00 0.00 C ATOM 1459 CG LEU A 897 0.729 3.655 4.945 1.00 0.00 C ATOM 1460 CD1 LEU A 897 1.022 3.663 6.447 1.00 0.00 C ATOM 1461 CD2 LEU A 897 -0.790 3.533 4.728 1.00 0.00 C ATOM 0 H LEU A 897 1.709 7.209 3.468 1.00 0.00 H new ATOM 0 HA LEU A 897 -0.704 5.541 3.627 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.676 4.752 3.334 1.00 0.00 H new ATOM 0 HB3 LEU A 897 2.058 5.367 4.930 1.00 0.00 H new ATOM 0 HG LEU A 897 1.226 2.808 4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 897 0.650 2.742 6.895 1.00 0.00 H new ATOM 0 HD12 LEU A 897 2.098 3.736 6.607 1.00 0.00 H new ATOM 0 HD13 LEU A 897 0.527 4.517 6.910 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -1.148 2.607 5.177 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -1.293 4.381 5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -1.005 3.525 3.660 1.00 0.00 H new ATOM 1473 N LYS A 898 0.370 7.105 6.274 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.059 7.608 7.605 1.00 0.00 C ATOM 1475 C LYS A 898 -1.425 8.235 7.457 1.00 0.00 C ATOM 1476 O LYS A 898 -2.223 8.289 8.373 1.00 0.00 O ATOM 1477 CB LYS A 898 0.950 8.694 7.927 1.00 0.00 C ATOM 1478 CG LYS A 898 0.580 9.398 9.237 1.00 0.00 C ATOM 1479 CD LYS A 898 0.448 8.373 10.364 1.00 0.00 C ATOM 1480 CE LYS A 898 1.801 7.701 10.609 1.00 0.00 C ATOM 1481 NZ LYS A 898 1.562 6.751 11.731 1.00 0.00 N ATOM 0 H LYS A 898 1.302 7.403 5.985 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.107 6.833 8.369 1.00 0.00 H new ATOM 0 HB2 LYS A 898 1.947 8.260 8.009 1.00 0.00 H new ATOM 0 HB3 LYS A 898 0.984 9.420 7.114 1.00 0.00 H new ATOM 0 HG2 LYS A 898 1.343 10.134 9.492 1.00 0.00 H new ATOM 0 HG3 LYS A 898 -0.358 9.940 9.116 1.00 0.00 H new ATOM 0 HD2 LYS A 898 0.103 8.862 11.275 1.00 0.00 H new ATOM 0 HD3 LYS A 898 -0.299 7.624 10.102 1.00 0.00 H new ATOM 0 HE2 LYS A 898 2.150 7.179 9.718 1.00 0.00 H new ATOM 0 HE3 LYS A 898 2.565 8.434 10.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 2.446 6.251 11.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 1.238 7.277 12.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 0.836 6.061 11.453 1.00 0.00 H new ATOM 1495 N ALA A 899 -1.680 8.703 6.281 1.00 0.00 N ATOM 1496 CA ALA A 899 -2.985 9.337 5.997 1.00 0.00 C ATOM 1497 C ALA A 899 -3.949 8.254 5.520 1.00 0.00 C ATOM 1498 O ALA A 899 -5.147 8.369 5.661 1.00 0.00 O ATOM 1499 CB ALA A 899 -2.688 10.367 4.898 1.00 0.00 C ATOM 0 H ALA A 899 -1.033 8.674 5.493 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.444 9.819 6.860 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -3.608 10.885 4.627 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -1.959 11.090 5.264 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.286 9.858 4.022 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.419 7.205 4.934 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.272 6.105 4.415 1.00 0.00 C ATOM 1507 C ARG A 900 -5.200 6.729 3.403 1.00 0.00 C ATOM 1508 O ARG A 900 -6.303 6.282 3.151 1.00 0.00 O ATOM 1509 CB ARG A 900 -4.998 5.517 5.646 1.00 0.00 C ATOM 1510 CG ARG A 900 -6.479 5.918 5.673 1.00 0.00 C ATOM 1511 CD ARG A 900 -7.032 5.734 7.088 1.00 0.00 C ATOM 1512 NE ARG A 900 -7.116 4.259 7.278 1.00 0.00 N ATOM 1513 CZ ARG A 900 -6.571 3.703 8.325 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -7.317 3.331 9.329 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -5.279 3.521 8.370 1.00 0.00 N ATOM 0 H ARG A 900 -2.418 7.070 4.795 1.00 0.00 H new ATOM 0 HA ARG A 900 -3.737 5.295 3.918 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -4.915 4.430 5.633 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -4.510 5.864 6.557 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.591 6.956 5.359 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -7.045 5.309 4.968 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -6.378 6.191 7.830 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -8.011 6.202 7.194 1.00 0.00 H new ATOM 0 HE ARG A 900 -7.600 3.683 6.589 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -8.326 3.475 9.295 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -6.891 2.896 10.147 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -4.695 3.814 7.586 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -4.853 3.086 9.189 1.00 0.00 H new ATOM 1529 N LYS A 901 -4.730 7.788 2.826 1.00 0.00 N ATOM 1530 CA LYS A 901 -5.530 8.504 1.836 1.00 0.00 C ATOM 1531 C LYS A 901 -5.121 8.088 0.439 1.00 0.00 C ATOM 1532 O LYS A 901 -5.864 8.246 -0.503 1.00 0.00 O ATOM 1533 CB LYS A 901 -5.208 9.976 2.062 1.00 0.00 C ATOM 1534 CG LYS A 901 -6.396 10.649 2.727 1.00 0.00 C ATOM 1535 CD LYS A 901 -6.545 10.116 4.151 1.00 0.00 C ATOM 1536 CE LYS A 901 -7.750 10.775 4.827 1.00 0.00 C ATOM 1537 NZ LYS A 901 -8.784 9.705 4.897 1.00 0.00 N ATOM 0 H LYS A 901 -3.809 8.187 3.008 1.00 0.00 H new ATOM 0 HA LYS A 901 -6.595 8.296 1.936 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -4.321 10.075 2.688 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -4.984 10.462 1.112 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -6.254 11.730 2.744 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -7.305 10.455 2.157 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -6.673 9.034 4.133 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -5.639 10.320 4.722 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -7.493 11.142 5.821 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -8.106 11.631 4.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -9.642 10.080 5.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -9.013 9.380 3.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -8.420 8.906 5.455 1.00 0.00 H new ATOM 1551 N ILE A 902 -3.926 7.579 0.315 1.00 0.00 N ATOM 1552 CA ILE A 902 -3.401 7.167 -1.040 1.00 0.00 C ATOM 1553 C ILE A 902 -4.469 6.449 -1.888 1.00 0.00 C ATOM 1554 O ILE A 902 -4.629 5.249 -1.783 1.00 0.00 O ATOM 1555 CB ILE A 902 -2.261 6.191 -0.748 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -1.181 6.885 0.077 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -1.652 5.702 -2.066 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -0.720 5.948 1.188 1.00 0.00 C ATOM 0 H ILE A 902 -3.281 7.426 1.090 1.00 0.00 H new ATOM 0 HA ILE A 902 -3.090 8.044 -1.607 1.00 0.00 H new ATOM 0 HB ILE A 902 -2.655 5.343 -0.188 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -0.339 7.156 -0.559 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -1.570 7.810 0.503 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -0.840 5.006 -1.855 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -2.418 5.198 -2.656 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -1.265 6.553 -2.626 1.00 0.00 H new ATOM 0 HD11 ILE A 902 0.052 6.439 1.781 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -1.566 5.699 1.828 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -0.316 5.035 0.750 1.00 0.00 H new ATOM 1570 N PRO A 903 -5.159 7.203 -2.722 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.200 6.626 -3.607 1.00 0.00 C ATOM 1572 C PRO A 903 -5.530 6.061 -4.861 1.00 0.00 C ATOM 1573 O PRO A 903 -5.376 6.765 -5.841 1.00 0.00 O ATOM 1574 CB PRO A 903 -7.017 7.871 -3.985 1.00 0.00 C ATOM 1575 CG PRO A 903 -6.356 9.099 -3.322 1.00 0.00 C ATOM 1576 CD PRO A 903 -4.972 8.668 -2.823 1.00 0.00 C ATOM 0 HA PRO A 903 -6.786 5.826 -3.155 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -7.046 7.993 -5.068 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -8.048 7.766 -3.648 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -6.268 9.918 -4.036 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -6.966 9.462 -2.494 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -4.179 8.936 -3.521 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -4.719 9.120 -1.864 1.00 0.00 H new ATOM 1583 N ILE A 904 -5.111 4.823 -4.865 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.454 4.321 -6.090 1.00 0.00 C ATOM 1585 C ILE A 904 -4.488 2.800 -6.206 1.00 0.00 C ATOM 1586 O ILE A 904 -4.424 2.066 -5.240 1.00 0.00 O ATOM 1587 CB ILE A 904 -3.028 4.892 -6.032 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -2.880 5.948 -7.125 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -1.989 3.800 -6.260 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -2.076 7.136 -6.592 1.00 0.00 C ATOM 0 H ILE A 904 -5.195 4.160 -4.094 1.00 0.00 H new ATOM 0 HA ILE A 904 -4.978 4.646 -6.989 1.00 0.00 H new ATOM 0 HB ILE A 904 -2.865 5.325 -5.045 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.380 5.519 -7.993 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -3.863 6.282 -7.457 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -0.990 4.233 -6.213 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -2.089 3.036 -5.489 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -2.144 3.349 -7.240 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -1.973 7.887 -7.376 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.594 7.572 -5.738 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -1.087 6.797 -6.283 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.574 2.351 -7.423 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.600 0.900 -7.723 1.00 0.00 C ATOM 1604 C ILE A 905 -3.168 0.364 -7.801 1.00 0.00 C ATOM 1605 O ILE A 905 -2.261 1.054 -8.226 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.277 0.797 -9.095 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.424 -0.677 -9.476 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.428 1.507 -10.155 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.898 -0.992 -9.712 1.00 0.00 C ATOM 0 H ILE A 905 -4.629 2.950 -8.246 1.00 0.00 H new ATOM 0 HA ILE A 905 -5.124 0.324 -6.961 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.258 1.270 -9.045 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.846 -0.892 -10.375 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -5.027 -1.311 -8.683 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.917 1.428 -11.126 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.318 2.558 -9.889 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.444 1.040 -10.206 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -7.007 -2.042 -9.984 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.463 -0.793 -8.801 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -7.279 -0.367 -10.520 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.959 -0.859 -7.414 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.597 -1.450 -7.471 1.00 0.00 C ATOM 1623 C ILE A 906 -1.683 -2.837 -8.101 1.00 0.00 C ATOM 1624 O ILE A 906 -2.700 -3.494 -8.040 1.00 0.00 O ATOM 1625 CB ILE A 906 -1.137 -1.545 -6.010 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.455 -0.244 -5.607 1.00 0.00 C ATOM 1627 CG2 ILE A 906 -0.139 -2.696 -5.834 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.503 0.851 -5.428 1.00 0.00 C ATOM 0 H ILE A 906 -3.683 -1.483 -7.056 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.902 -0.858 -8.067 1.00 0.00 H new ATOM 0 HB ILE A 906 -2.011 -1.726 -5.384 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.100 -0.385 -4.680 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.267 0.051 -6.369 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.176 -2.748 -4.792 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.614 -3.636 -6.117 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.731 -2.524 -6.468 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -1.012 1.781 -5.140 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -2.038 0.999 -6.366 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -2.208 0.556 -4.650 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.629 -3.288 -8.700 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.678 -4.646 -9.323 1.00 0.00 C ATOM 1642 C ARG A 907 0.122 -5.633 -8.510 1.00 0.00 C ATOM 1643 O ARG A 907 1.333 -5.632 -8.533 1.00 0.00 O ATOM 1644 CB ARG A 907 -0.060 -4.498 -10.695 1.00 0.00 C ATOM 1645 CG ARG A 907 -1.074 -3.838 -11.619 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.352 -2.399 -11.164 1.00 0.00 C ATOM 1647 NE ARG A 907 -1.404 -1.604 -12.423 1.00 0.00 N ATOM 1648 CZ ARG A 907 -2.435 -1.707 -13.217 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -2.314 -2.317 -14.364 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -3.583 -1.201 -12.864 1.00 0.00 N ATOM 0 H ARG A 907 0.257 -2.791 -8.790 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.702 -5.017 -9.374 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.847 -3.896 -10.638 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.229 -5.473 -11.086 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.697 -3.837 -12.642 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -2.001 -4.411 -11.621 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.291 -2.332 -10.615 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.568 -2.036 -10.499 1.00 0.00 H new ATOM 0 HE ARG A 907 -0.634 -0.980 -12.664 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -1.415 -2.712 -14.639 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -3.119 -2.398 -14.986 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -3.676 -0.724 -11.967 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -4.388 -1.282 -13.485 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.548 -6.497 -7.817 1.00 0.00 N ATOM 1665 CA ARG A 908 0.195 -7.507 -7.023 1.00 0.00 C ATOM 1666 C ARG A 908 0.514 -8.705 -7.918 1.00 0.00 C ATOM 1667 O ARG A 908 -0.254 -9.644 -7.992 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.725 -7.975 -5.869 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.656 -6.859 -5.356 1.00 0.00 C ATOM 1670 CD ARG A 908 -2.335 -7.320 -4.043 1.00 0.00 C ATOM 1671 NE ARG A 908 -1.210 -7.576 -3.100 1.00 0.00 N ATOM 1672 CZ ARG A 908 -1.409 -8.270 -2.008 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.600 -8.337 -1.475 1.00 0.00 N ATOM 1674 NH2 ARG A 908 -0.411 -8.895 -1.446 1.00 0.00 N ATOM 0 H ARG A 908 -1.565 -6.551 -7.763 1.00 0.00 H new ATOM 0 HA ARG A 908 1.120 -7.084 -6.632 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -1.328 -8.817 -6.210 1.00 0.00 H new ATOM 0 HB3 ARG A 908 -0.110 -8.337 -5.045 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -1.086 -5.946 -5.183 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -2.411 -6.626 -6.107 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -3.008 -6.555 -3.657 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.931 -8.219 -4.201 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.281 -7.209 -3.306 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -3.382 -7.847 -1.910 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.748 -8.880 -0.624 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.521 -8.842 -1.858 1.00 0.00 H new ATOM 0 HH22 ARG A 908 -0.563 -9.437 -0.595 1.00 0.00 H new ATOM 1688 N TYR A 909 1.656 -8.718 -8.561 1.00 0.00 N ATOM 1689 CA TYR A 909 2.003 -9.889 -9.378 1.00 0.00 C ATOM 1690 C TYR A 909 2.594 -10.914 -8.437 1.00 0.00 C ATOM 1691 O TYR A 909 2.793 -10.647 -7.268 1.00 0.00 O ATOM 1692 CB TYR A 909 3.063 -9.493 -10.407 1.00 0.00 C ATOM 1693 CG TYR A 909 2.856 -8.102 -10.969 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.467 -6.990 -10.372 1.00 0.00 C ATOM 1695 CD2 TYR A 909 2.104 -7.935 -12.130 1.00 0.00 C ATOM 1696 CE1 TYR A 909 3.322 -5.726 -10.936 1.00 0.00 C ATOM 1697 CE2 TYR A 909 1.948 -6.671 -12.690 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.558 -5.564 -12.099 1.00 0.00 C ATOM 1699 OH TYR A 909 2.413 -4.317 -12.672 1.00 0.00 O ATOM 0 H TYR A 909 2.348 -7.969 -8.547 1.00 0.00 H new ATOM 0 HA TYR A 909 1.129 -10.279 -9.899 1.00 0.00 H new ATOM 0 HB2 TYR A 909 4.048 -9.548 -9.944 1.00 0.00 H new ATOM 0 HB3 TYR A 909 3.054 -10.214 -11.225 1.00 0.00 H new ATOM 0 HD1 TYR A 909 4.051 -7.115 -9.472 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.640 -8.791 -12.597 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.798 -4.871 -10.478 1.00 0.00 H new ATOM 0 HE2 TYR A 909 1.354 -6.546 -13.583 1.00 0.00 H new ATOM 0 HH TYR A 909 1.852 -4.388 -13.473 1.00 0.00 H new ATOM 1709 N LEU A 910 2.882 -12.069 -8.916 1.00 0.00 N ATOM 1710 CA LEU A 910 3.452 -13.095 -8.030 1.00 0.00 C ATOM 1711 C LEU A 910 4.620 -13.820 -8.695 1.00 0.00 C ATOM 1712 O LEU A 910 4.433 -14.550 -9.647 1.00 0.00 O ATOM 1713 CB LEU A 910 2.286 -14.045 -7.773 1.00 0.00 C ATOM 1714 CG LEU A 910 1.138 -13.302 -7.083 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.027 -14.297 -6.749 1.00 0.00 C ATOM 1716 CD2 LEU A 910 1.629 -12.639 -5.793 1.00 0.00 C ATOM 0 H LEU A 910 2.748 -12.352 -9.887 1.00 0.00 H new ATOM 0 HA LEU A 910 3.861 -12.673 -7.112 1.00 0.00 H new ATOM 0 HB2 LEU A 910 1.939 -14.470 -8.715 1.00 0.00 H new ATOM 0 HB3 LEU A 910 2.616 -14.877 -7.151 1.00 0.00 H new ATOM 0 HG LEU A 910 0.761 -12.530 -7.754 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.794 -13.775 -6.257 1.00 0.00 H new ATOM 0 HD12 LEU A 910 -0.335 -14.759 -7.667 1.00 0.00 H new ATOM 0 HD13 LEU A 910 0.417 -15.068 -6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 910 0.801 -12.115 -5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 910 2.015 -13.401 -5.116 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.421 -11.928 -6.028 1.00 0.00 H new ATOM 1728 N PRO A 911 5.795 -13.632 -8.135 1.00 0.00 N ATOM 1729 CA PRO A 911 6.996 -14.318 -8.650 1.00 0.00 C ATOM 1730 C PRO A 911 6.786 -15.824 -8.498 1.00 0.00 C ATOM 1731 O PRO A 911 7.515 -16.630 -9.043 1.00 0.00 O ATOM 1732 CB PRO A 911 8.102 -13.820 -7.713 1.00 0.00 C ATOM 1733 CG PRO A 911 7.478 -12.867 -6.676 1.00 0.00 C ATOM 1734 CD PRO A 911 5.979 -12.733 -6.973 1.00 0.00 C ATOM 0 HA PRO A 911 7.223 -14.124 -9.698 1.00 0.00 H new ATOM 0 HB2 PRO A 911 8.581 -14.662 -7.213 1.00 0.00 H new ATOM 0 HB3 PRO A 911 8.876 -13.305 -8.282 1.00 0.00 H new ATOM 0 HG2 PRO A 911 7.631 -13.253 -5.668 1.00 0.00 H new ATOM 0 HG3 PRO A 911 7.961 -11.891 -6.721 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.369 -13.040 -6.123 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.703 -11.705 -7.209 1.00 0.00 H new ATOM 1741 N ASP A 912 5.770 -16.199 -7.759 1.00 0.00 N ATOM 1742 CA ASP A 912 5.471 -17.639 -7.560 1.00 0.00 C ATOM 1743 C ASP A 912 4.838 -18.189 -8.826 1.00 0.00 C ATOM 1744 O ASP A 912 5.062 -19.323 -9.206 1.00 0.00 O ATOM 1745 CB ASP A 912 4.471 -17.680 -6.405 1.00 0.00 C ATOM 1746 CG ASP A 912 5.213 -17.938 -5.092 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.285 -17.381 -4.921 1.00 0.00 O ATOM 1748 OD2 ASP A 912 4.696 -18.686 -4.279 1.00 0.00 O ATOM 0 H ASP A 912 5.134 -15.559 -7.284 1.00 0.00 H new ATOM 0 HA ASP A 912 6.359 -18.233 -7.343 1.00 0.00 H new ATOM 0 HB2 ASP A 912 3.927 -16.737 -6.348 1.00 0.00 H new ATOM 0 HB3 ASP A 912 3.733 -18.463 -6.577 1.00 0.00 H new ATOM 1753 N GLY A 913 4.048 -17.389 -9.493 1.00 0.00 N ATOM 1754 CA GLY A 913 3.407 -17.879 -10.751 1.00 0.00 C ATOM 1755 C GLY A 913 1.958 -17.432 -10.801 1.00 0.00 C ATOM 1756 O GLY A 913 1.050 -18.203 -11.041 1.00 0.00 O ATOM 0 H GLY A 913 3.821 -16.431 -9.227 1.00 0.00 H new ATOM 0 HA2 GLY A 913 3.945 -17.494 -11.617 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.463 -18.967 -10.798 1.00 0.00 H new ATOM 1760 N SER A 914 1.758 -16.183 -10.579 1.00 0.00 N ATOM 1761 CA SER A 914 0.388 -15.600 -10.605 1.00 0.00 C ATOM 1762 C SER A 914 0.509 -14.088 -10.562 1.00 0.00 C ATOM 1763 O SER A 914 1.594 -13.547 -10.667 1.00 0.00 O ATOM 1764 CB SER A 914 -0.321 -16.135 -9.356 1.00 0.00 C ATOM 1765 OG SER A 914 0.612 -16.825 -8.530 1.00 0.00 O ATOM 0 H SER A 914 2.499 -15.513 -10.374 1.00 0.00 H new ATOM 0 HA SER A 914 -0.172 -15.867 -11.502 1.00 0.00 H new ATOM 0 HB2 SER A 914 -0.772 -15.312 -8.802 1.00 0.00 H new ATOM 0 HB3 SER A 914 -1.130 -16.806 -9.645 1.00 0.00 H new ATOM 0 HG SER A 914 0.155 -17.164 -7.732 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.578 -13.397 -10.408 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.510 -11.920 -10.358 1.00 0.00 C ATOM 1773 C TYR A 915 -1.935 -11.341 -10.346 1.00 0.00 C ATOM 1774 O TYR A 915 -2.814 -11.835 -11.023 1.00 0.00 O ATOM 1775 CB TYR A 915 0.228 -11.509 -11.652 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.347 -10.229 -12.239 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.492 -9.077 -11.448 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -0.721 -10.193 -13.589 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.003 -7.901 -12.008 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -1.237 -9.018 -14.146 1.00 0.00 C ATOM 1781 CZ TYR A 915 -1.376 -7.871 -13.357 1.00 0.00 C ATOM 1782 OH TYR A 915 -1.881 -6.712 -13.908 1.00 0.00 O ATOM 0 H TYR A 915 -1.513 -13.793 -10.314 1.00 0.00 H new ATOM 0 HA TYR A 915 0.000 -11.553 -9.468 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.288 -11.369 -11.439 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.154 -12.312 -12.385 1.00 0.00 H new ATOM 0 HD1 TYR A 915 -0.209 -9.099 -10.406 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -0.610 -11.076 -14.202 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.110 -7.016 -11.399 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -1.528 -8.996 -15.186 1.00 0.00 H new ATOM 0 HH TYR A 915 -2.088 -6.863 -14.854 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.160 -10.287 -9.617 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.519 -9.663 -9.597 1.00 0.00 C ATOM 1794 C GLU A 916 -3.401 -8.138 -9.567 1.00 0.00 C ATOM 1795 O GLU A 916 -2.519 -7.585 -8.943 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.188 -10.174 -8.328 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.594 -10.677 -8.657 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.592 -9.520 -8.555 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.191 -8.393 -8.790 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.743 -9.783 -8.244 1.00 0.00 O ATOM 0 H GLU A 916 -1.463 -9.826 -9.031 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.097 -9.921 -10.485 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.596 -10.978 -7.891 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.240 -9.377 -7.586 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.614 -11.100 -9.661 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.876 -11.475 -7.970 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.296 -7.459 -10.229 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.255 -5.972 -10.235 1.00 0.00 C ATOM 1809 C ASP A 917 -5.460 -5.415 -9.502 1.00 0.00 C ATOM 1810 O ASP A 917 -6.508 -6.024 -9.434 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.268 -5.557 -11.693 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.597 -5.943 -12.355 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.321 -6.734 -11.773 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -5.866 -5.440 -13.433 1.00 0.00 O ATOM 0 H ASP A 917 -5.057 -7.873 -10.768 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.369 -5.589 -9.729 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.116 -4.480 -11.771 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.442 -6.034 -12.220 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.264 -4.256 -8.954 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.276 -3.506 -8.140 1.00 0.00 C ATOM 1821 C TRP A 918 -5.587 -3.001 -6.883 1.00 0.00 C ATOM 1822 O TRP A 918 -4.443 -3.320 -6.637 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.458 -4.407 -7.769 1.00 0.00 C ATOM 1824 CG TRP A 918 -7.072 -5.696 -7.105 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.839 -6.243 -6.973 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.977 -6.590 -6.444 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.969 -7.487 -6.378 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.277 -7.719 -5.987 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.346 -6.510 -6.223 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.935 -8.751 -5.319 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -10.012 -7.515 -5.543 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -9.315 -8.646 -5.086 1.00 0.00 C ATOM 0 H TRP A 918 -4.379 -3.757 -9.041 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.669 -2.672 -8.721 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -8.124 -3.856 -7.105 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -8.024 -4.633 -8.673 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.910 -5.785 -7.280 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -5.202 -8.146 -6.245 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.897 -5.655 -6.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.389 -9.621 -4.985 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -11.073 -7.429 -5.363 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.838 -9.430 -4.559 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.240 -2.211 -6.082 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.537 -1.714 -4.873 1.00 0.00 C ATOM 1845 C GLY A 919 -6.500 -1.095 -3.894 1.00 0.00 C ATOM 1846 O GLY A 919 -6.868 -1.681 -2.900 1.00 0.00 O ATOM 0 H GLY A 919 -7.202 -1.895 -6.206 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -5.007 -2.537 -4.394 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.787 -0.978 -5.163 1.00 0.00 H new ATOM 1850 N VAL A 920 -6.901 0.094 -4.156 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.845 0.754 -3.235 1.00 0.00 C ATOM 1852 C VAL A 920 -9.119 1.046 -3.993 1.00 0.00 C ATOM 1853 O VAL A 920 -10.107 1.481 -3.433 1.00 0.00 O ATOM 1854 CB VAL A 920 -7.138 2.027 -2.788 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -8.075 2.862 -1.912 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -5.895 1.637 -1.986 1.00 0.00 C ATOM 0 H VAL A 920 -6.620 0.644 -4.967 1.00 0.00 H new ATOM 0 HA VAL A 920 -8.116 0.150 -2.369 1.00 0.00 H new ATOM 0 HB VAL A 920 -6.852 2.618 -3.658 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.563 3.771 -1.596 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -8.966 3.127 -2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.364 2.284 -1.034 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.376 2.538 -1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -6.192 1.052 -1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -5.229 1.043 -2.612 1.00 0.00 H new ATOM 1866 N ASP A 921 -9.113 0.785 -5.274 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.348 1.028 -6.054 1.00 0.00 C ATOM 1868 C ASP A 921 -11.232 -0.206 -6.004 1.00 0.00 C ATOM 1869 O ASP A 921 -12.418 -0.153 -6.267 1.00 0.00 O ATOM 1870 CB ASP A 921 -9.892 1.329 -7.478 1.00 0.00 C ATOM 1871 CG ASP A 921 -11.077 1.863 -8.281 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -11.377 3.039 -8.147 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -11.667 1.089 -9.017 1.00 0.00 O ATOM 0 H ASP A 921 -8.319 0.421 -5.801 1.00 0.00 H new ATOM 0 HA ASP A 921 -10.934 1.857 -5.656 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -9.085 2.061 -7.467 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.498 0.427 -7.945 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.653 -1.315 -5.672 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.424 -2.570 -5.600 1.00 0.00 C ATOM 1880 C GLU A 922 -11.232 -3.218 -4.223 1.00 0.00 C ATOM 1881 O GLU A 922 -11.954 -4.117 -3.841 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.804 -3.406 -6.705 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.799 -4.475 -7.166 1.00 0.00 C ATOM 1884 CD GLU A 922 -11.372 -5.015 -8.532 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -11.221 -4.217 -9.442 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -11.204 -6.218 -8.644 1.00 0.00 O ATOM 0 H GLU A 922 -9.663 -1.405 -5.444 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.500 -2.446 -5.723 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.526 -2.768 -7.544 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.889 -3.878 -6.347 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.840 -5.286 -6.439 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.801 -4.051 -7.228 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.259 -2.757 -3.477 1.00 0.00 N ATOM 1894 CA LEU A 923 -10.012 -3.335 -2.119 1.00 0.00 C ATOM 1895 C LEU A 923 -9.491 -2.286 -1.132 1.00 0.00 C ATOM 1896 O LEU A 923 -9.790 -1.111 -1.207 1.00 0.00 O ATOM 1897 CB LEU A 923 -9.010 -4.489 -2.301 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.908 -4.104 -3.276 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.527 -4.248 -2.652 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.980 -5.049 -4.415 1.00 0.00 C ATOM 0 H LEU A 923 -9.625 -2.006 -3.749 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.945 -3.698 -1.688 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.573 -4.751 -1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.531 -5.374 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 923 -8.049 -3.065 -3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.767 -3.964 -3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.453 -3.600 -1.779 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.370 -5.284 -2.350 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.203 -4.806 -5.139 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.833 -6.067 -4.053 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.957 -4.971 -4.891 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.772 -2.761 -0.175 1.00 0.00 N ATOM 1913 CA ILE A 924 -8.230 -1.932 0.934 1.00 0.00 C ATOM 1914 C ILE A 924 -6.873 -1.320 0.630 1.00 0.00 C ATOM 1915 O ILE A 924 -6.215 -1.639 -0.330 1.00 0.00 O ATOM 1916 CB ILE A 924 -8.078 -2.927 2.062 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.351 -2.298 3.404 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -6.634 -3.458 2.105 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -7.466 -3.053 4.374 1.00 0.00 C ATOM 0 H ILE A 924 -8.520 -3.747 -0.107 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.885 -1.086 1.142 1.00 0.00 H new ATOM 0 HB ILE A 924 -8.796 -3.726 1.874 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -8.113 -1.234 3.398 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -9.403 -2.388 3.676 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -6.534 -4.174 2.921 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -6.398 -3.948 1.161 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -5.946 -2.628 2.264 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -7.605 -2.655 5.379 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -7.732 -4.110 4.362 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -6.423 -2.938 4.080 1.00 0.00 H new ATOM 1931 N ILE A 925 -6.459 -0.474 1.514 1.00 0.00 N ATOM 1932 CA ILE A 925 -5.120 0.167 1.426 1.00 0.00 C ATOM 1933 C ILE A 925 -4.130 -0.737 2.166 1.00 0.00 C ATOM 1934 O ILE A 925 -4.119 -1.936 1.979 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.286 1.527 2.121 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.759 1.322 3.566 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -6.321 2.363 1.362 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -4.911 2.176 4.512 1.00 0.00 C ATOM 0 H ILE A 925 -7.008 -0.187 2.324 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.750 0.306 0.410 1.00 0.00 H new ATOM 0 HB ILE A 925 -4.327 2.045 2.128 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.810 1.596 3.657 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -5.679 0.270 3.839 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.440 3.328 1.854 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -5.983 2.517 0.337 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -7.277 1.839 1.354 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -5.249 2.028 5.538 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -3.865 1.881 4.429 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -5.014 3.227 4.244 1.00 0.00 H new ATOM 1950 N THR A 926 -3.319 -0.190 3.006 1.00 0.00 N ATOM 1951 CA THR A 926 -2.347 -1.043 3.760 1.00 0.00 C ATOM 1952 C THR A 926 -3.112 -1.961 4.724 1.00 0.00 C ATOM 1953 O THR A 926 -2.739 -3.098 4.941 1.00 0.00 O ATOM 1954 CB THR A 926 -1.449 -0.052 4.521 1.00 0.00 C ATOM 1955 OG1 THR A 926 -0.190 0.028 3.873 1.00 0.00 O ATOM 1956 CG2 THR A 926 -1.235 -0.508 5.968 1.00 0.00 C ATOM 0 H THR A 926 -3.276 0.808 3.213 1.00 0.00 H new ATOM 0 HA THR A 926 -1.756 -1.689 3.111 1.00 0.00 H new ATOM 0 HB THR A 926 -1.937 0.922 4.529 1.00 0.00 H new ATOM 0 HG1 THR A 926 0.385 0.660 4.353 1.00 0.00 H new ATOM 0 HG21 THR A 926 -0.597 0.209 6.485 1.00 0.00 H new ATOM 0 HG22 THR A 926 -2.197 -0.570 6.476 1.00 0.00 H new ATOM 0 HG23 THR A 926 -0.758 -1.488 5.974 1.00 0.00 H new ATOM 1964 N ASP A 927 -4.181 -1.477 5.288 1.00 0.00 N ATOM 1965 CA ASP A 927 -4.989 -2.313 6.230 1.00 0.00 C ATOM 1966 C ASP A 927 -6.257 -1.559 6.649 1.00 0.00 C ATOM 1967 O ASP A 927 -6.498 -0.496 6.101 1.00 0.00 O ATOM 1968 CB ASP A 927 -4.083 -2.561 7.442 1.00 0.00 C ATOM 1969 CG ASP A 927 -3.773 -1.236 8.150 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -4.078 -0.197 7.588 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -3.236 -1.286 9.244 1.00 0.00 O ATOM 1972 OXT ASP A 927 -6.962 -2.059 7.510 1.00 0.00 O ATOM 0 H ASP A 927 -4.536 -0.532 5.139 1.00 0.00 H new ATOM 0 HA ASP A 927 -5.309 -3.249 5.773 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -4.570 -3.247 8.135 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -3.156 -3.036 7.121 1.00 0.00 H new