USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 996 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 Set 1.1: A 834 LYS NZ :NH3+ -139:sc= 1.11 (180deg=-0.0296) USER MOD Set 1.2: A 879 TYR OH : rot -169:sc= 1.8 USER MOD Set 2.1: A 830 MET CE :methyl -135:sc= 0 (180deg=-0.0128) USER MOD Set 2.2: A 860 CYS SG : rot 18:sc= 0.991 USER MOD Set 3.1: A 808 THR OG1 : rot 110:sc= -0.337 USER MOD Set 3.2: A 810 GLN : amide:sc= -0.355 K(o=-0.69,f=1.4) USER MOD Set 4.1: A 754 SER OG : rot -104:sc= 1.2 USER MOD Set 4.2: A 774 CYS SG : rot 180:sc= 0.979 USER MOD Set 5.1: A 763 SER OG : rot -102:sc= 1.2 USER MOD Set 5.2: A 765 THR OG1 : rot 37:sc= 0.755 USER MOD Single : A 742 SER OG : rot 180:sc= 0 USER MOD Single : A 744 SER OG : rot 180:sc= 0.0751 USER MOD Single : A 745 GLN : amide:sc= -0.427 X(o=-0.43,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0392 K(o=-0.039,f=-2.6) USER MOD Single : A 748 MET CE :methyl -105:sc= -2.41! (180deg=-4.46!) USER MOD Single : A 749 ASN : amide:sc= 0.00455 X(o=0.0045,f=0) USER MOD Single : A 756 ASN : amide:sc= 0.0856 K(o=0.086,f=-1.5) USER MOD Single : A 757 HIS : no HD1:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A 762 HIS : no HE2:sc= 0.133 K(o=0.13,f=-1.3) USER MOD Single : A 772 LYS NZ :NH3+ -159:sc= 0.0617 (180deg=0.00356) USER MOD Single : A 777 SER OG : rot -28:sc= 0.319 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.0801 USER MOD Single : A 784 ASN : amide:sc= 0.722 K(o=0.72,f=0) USER MOD Single : A 787 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.013) USER MOD Single : A 796 MET CE :methyl -159:sc= -0.0308 (180deg=-0.278) USER MOD Single : A 797 SER OG : rot 180:sc= 0 USER MOD Single : A 802 ASN : amide:sc= -1.29 K(o=-1.3,f=0) USER MOD Single : A 816 MET CE :methyl -159:sc= -0.988 (180deg=-2.13!) USER MOD Single : A 817 SER OG : rot 180:sc=-0.00929 USER MOD Single : A 820 THR OG1 : rot -82:sc= 0.867 USER MOD Single : A 823 THR OG1 : rot 180:sc= -0.0259 USER MOD Single : A 825 THR OG1 : rot 139:sc= 1.49 USER MOD Single : A 828 GLN : amide:sc= -0.704 K(o=-0.7,f=-0.029) USER MOD Single : A 832 SER OG : rot 106:sc= 0.418 USER MOD Single : A 840 LYS NZ :NH3+ 175:sc= 0.15 (180deg=0.112) USER MOD Single : A 841 ASN : amide:sc= 0.0816 K(o=0.082,f=-2.3!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot 180:sc= 0.255 USER MOD Single : A 845 MET CE :methyl 157:sc= -0.0785 (180deg=-0.74) USER MOD Single : A 856 GLN : amide:sc= -1.95! X(o=-2!,f=-1.6) USER MOD Single : A 859 TYR OH : rot -96:sc= 1.39 USER MOD Single : A 864 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 867 TYR OH : rot 75:sc= 0.473 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 881 SER OG : rot -46:sc= 0.48 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -0.740 -10.109 -7.509 1.00 25.00 N ATOM 22 CA SER A 742 -1.677 -9.215 -6.795 1.00 25.00 C ATOM 23 C SER A 742 -1.835 -9.439 -5.272 1.00 25.00 C ATOM 24 O SER A 742 -0.957 -10.004 -4.611 1.00 25.00 O ATOM 25 CB SER A 742 -3.046 -9.200 -7.502 1.00 25.00 C ATOM 26 OG SER A 742 -3.811 -10.359 -7.217 1.00 25.00 O ATOM 0 HA SER A 742 -1.204 -8.235 -6.851 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.602 -8.315 -7.193 1.00 25.00 H new ATOM 0 HB3 SER A 742 -2.896 -9.122 -8.579 1.00 25.00 H new ATOM 0 HG SER A 742 -4.671 -10.306 -7.684 1.00 25.00 H new ATOM 32 N ILE A 743 -2.941 -8.950 -4.722 1.00 25.00 N ATOM 33 CA ILE A 743 -3.189 -8.974 -3.280 1.00 25.00 C ATOM 34 C ILE A 743 -3.331 -10.408 -2.703 1.00 25.00 C ATOM 35 O ILE A 743 -3.776 -11.333 -3.382 1.00 25.00 O ATOM 36 CB ILE A 743 -4.455 -8.139 -2.945 1.00 25.00 C ATOM 37 CG1 ILE A 743 -4.146 -7.301 -1.703 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.727 -9.029 -2.770 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.331 -6.818 -0.946 1.00 25.00 C ATOM 0 H ILE A 743 -3.694 -8.524 -5.262 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.312 -8.534 -2.806 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.694 -7.480 -3.779 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.525 -7.894 -1.032 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.554 -6.438 -2.007 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.584 -8.397 -2.537 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.919 -9.575 -3.694 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.567 -9.737 -1.957 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -5.001 -6.235 -0.086 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.946 -6.193 -1.593 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.916 -7.671 -0.603 1.00 25.00 H new ATOM 51 N SER A 744 -2.961 -10.575 -1.439 1.00 25.00 N ATOM 52 CA SER A 744 -3.095 -11.853 -0.733 1.00 25.00 C ATOM 53 C SER A 744 -4.365 -11.873 0.107 1.00 25.00 C ATOM 54 O SER A 744 -4.897 -10.824 0.482 1.00 25.00 O ATOM 55 CB SER A 744 -1.879 -12.079 0.186 1.00 25.00 C ATOM 56 OG SER A 744 -2.041 -13.223 1.010 1.00 25.00 O ATOM 0 H SER A 744 -2.559 -9.830 -0.870 1.00 25.00 H new ATOM 0 HA SER A 744 -3.147 -12.648 -1.477 1.00 25.00 H new ATOM 0 HB2 SER A 744 -0.982 -12.194 -0.422 1.00 25.00 H new ATOM 0 HB3 SER A 744 -1.729 -11.199 0.812 1.00 25.00 H new ATOM 0 HG SER A 744 -1.249 -13.333 1.576 1.00 25.00 H new ATOM 62 N GLN A 745 -4.829 -13.073 0.432 1.00 25.00 N ATOM 63 CA GLN A 745 -5.990 -13.244 1.300 1.00 25.00 C ATOM 64 C GLN A 745 -5.679 -12.710 2.696 1.00 25.00 C ATOM 65 O GLN A 745 -6.569 -12.279 3.413 1.00 25.00 O ATOM 66 CB GLN A 745 -6.374 -14.723 1.388 1.00 25.00 C ATOM 67 CG GLN A 745 -7.416 -15.146 0.346 1.00 25.00 C ATOM 68 CD GLN A 745 -8.854 -15.077 0.862 1.00 25.00 C ATOM 69 OE1 GLN A 745 -9.671 -15.913 0.522 1.00 25.00 O ATOM 70 NE2 GLN A 745 -9.161 -14.093 1.670 1.00 25.00 N ATOM 0 H GLN A 745 -4.417 -13.947 0.106 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.826 -12.686 0.878 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.478 -15.331 1.262 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -6.763 -14.931 2.385 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -7.322 -14.506 -0.532 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -7.202 -16.165 0.022 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.451 -13.410 1.934 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -10.110 -14.010 2.035 1.00 25.00 H new ATOM 79 N GLU A 746 -4.413 -12.729 3.076 1.00 25.00 N ATOM 80 CA GLU A 746 -4.004 -12.196 4.373 1.00 25.00 C ATOM 81 C GLU A 746 -3.894 -10.683 4.317 1.00 25.00 C ATOM 82 O GLU A 746 -4.275 -10.004 5.262 1.00 25.00 O ATOM 83 CB GLU A 746 -2.686 -12.821 4.795 1.00 25.00 C ATOM 84 CG GLU A 746 -2.856 -14.290 5.122 1.00 25.00 C ATOM 85 CD GLU A 746 -1.546 -14.957 5.483 1.00 25.00 C ATOM 86 OE1 GLU A 746 -0.636 -14.965 4.628 1.00 25.00 O ATOM 87 OE2 GLU A 746 -1.430 -15.482 6.611 1.00 25.00 O ATOM 0 H GLU A 746 -3.651 -13.105 2.512 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.761 -12.449 5.115 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -1.954 -12.706 3.996 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.293 -12.295 5.665 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -3.555 -14.396 5.952 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -3.297 -14.801 4.266 1.00 25.00 H new ATOM 94 N GLN A 747 -3.411 -10.155 3.199 1.00 25.00 N ATOM 95 CA GLN A 747 -3.296 -8.706 3.032 1.00 25.00 C ATOM 96 C GLN A 747 -4.665 -8.047 3.124 1.00 25.00 C ATOM 97 O GLN A 747 -4.822 -6.995 3.727 1.00 25.00 O ATOM 98 CB GLN A 747 -2.671 -8.354 1.682 1.00 25.00 C ATOM 99 CG GLN A 747 -2.436 -6.855 1.487 1.00 25.00 C ATOM 100 CD GLN A 747 -1.391 -6.309 2.420 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.210 -6.500 2.206 1.00 25.00 O ATOM 102 NE2 GLN A 747 -1.822 -5.643 3.455 1.00 25.00 N ATOM 0 H GLN A 747 -3.094 -10.701 2.398 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.654 -8.337 3.832 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.720 -8.878 1.584 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.319 -8.718 0.885 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -2.131 -6.669 0.457 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.373 -6.320 1.643 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -2.823 -5.508 3.594 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.158 -5.257 4.126 1.00 25.00 H new ATOM 111 N MET A 748 -5.677 -8.669 2.538 1.00 25.00 N ATOM 112 CA MET A 748 -7.012 -8.103 2.576 1.00 25.00 C ATOM 113 C MET A 748 -7.573 -8.249 3.976 1.00 25.00 C ATOM 114 O MET A 748 -8.492 -7.546 4.359 1.00 25.00 O ATOM 115 CB MET A 748 -7.942 -8.775 1.564 1.00 25.00 C ATOM 116 CG MET A 748 -8.177 -10.233 1.778 1.00 25.00 C ATOM 117 SD MET A 748 -9.717 -10.812 1.031 1.00 25.00 S ATOM 118 CE MET A 748 -9.588 -10.166 -0.623 1.00 25.00 C ATOM 0 H MET A 748 -5.599 -9.554 2.037 1.00 25.00 H new ATOM 0 HA MET A 748 -6.946 -7.049 2.307 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.904 -8.263 1.585 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.527 -8.634 0.566 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.342 -10.796 1.361 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.198 -10.440 2.848 1.00 25.00 H new ATOM 0 HE1 MET A 748 -10.251 -9.308 -0.731 1.00 25.00 H new ATOM 0 HE2 MET A 748 -8.560 -9.857 -0.814 1.00 25.00 H new ATOM 0 HE3 MET A 748 -9.873 -10.938 -1.338 1.00 25.00 H new ATOM 128 N ASN A 749 -7.021 -9.177 4.739 1.00 25.00 N ATOM 129 CA ASN A 749 -7.531 -9.455 6.065 1.00 25.00 C ATOM 130 C ASN A 749 -6.981 -8.461 7.078 1.00 25.00 C ATOM 131 O ASN A 749 -7.697 -8.012 7.956 1.00 25.00 O ATOM 132 CB ASN A 749 -7.220 -10.899 6.469 1.00 25.00 C ATOM 133 CG ASN A 749 -6.790 -11.022 7.907 1.00 25.00 C ATOM 134 OD1 ASN A 749 -7.613 -11.112 8.808 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.502 -11.038 8.126 1.00 25.00 N ATOM 0 H ASN A 749 -6.222 -9.748 4.462 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.615 -9.339 6.049 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.103 -11.516 6.304 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -6.433 -11.291 5.824 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -5.148 -11.128 9.078 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -4.851 -10.960 7.345 1.00 25.00 H new ATOM 142 N GLU A 750 -5.719 -8.096 6.955 1.00 25.00 N ATOM 143 CA GLU A 750 -5.169 -7.075 7.842 1.00 25.00 C ATOM 144 C GLU A 750 -5.683 -5.702 7.397 1.00 25.00 C ATOM 145 O GLU A 750 -6.020 -4.858 8.221 1.00 25.00 O ATOM 146 CB GLU A 750 -3.637 -7.134 7.862 1.00 25.00 C ATOM 147 CG GLU A 750 -2.979 -6.960 6.510 1.00 25.00 C ATOM 148 CD GLU A 750 -1.548 -7.418 6.520 1.00 25.00 C ATOM 149 OE1 GLU A 750 -0.731 -6.782 7.207 1.00 25.00 O ATOM 150 OE2 GLU A 750 -1.248 -8.428 5.843 1.00 25.00 O ATOM 0 H GLU A 750 -5.066 -8.476 6.270 1.00 25.00 H new ATOM 0 HA GLU A 750 -5.500 -7.258 8.864 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.266 -6.360 8.534 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.329 -8.093 8.280 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -3.535 -7.523 5.760 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.022 -5.911 6.218 1.00 25.00 H new ATOM 157 N PHE A 751 -5.771 -5.480 6.092 1.00 25.00 N ATOM 158 CA PHE A 751 -6.230 -4.197 5.576 1.00 25.00 C ATOM 159 C PHE A 751 -7.706 -3.926 5.836 1.00 25.00 C ATOM 160 O PHE A 751 -8.112 -2.776 5.981 1.00 25.00 O ATOM 161 CB PHE A 751 -5.966 -4.105 4.083 1.00 25.00 C ATOM 162 CG PHE A 751 -6.442 -2.826 3.479 1.00 25.00 C ATOM 163 CD1 PHE A 751 -6.020 -1.586 3.990 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.328 -2.843 2.402 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.489 -0.388 3.423 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.764 -1.650 1.815 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.352 -0.420 2.328 1.00 25.00 C ATOM 0 H PHE A 751 -5.533 -6.166 5.376 1.00 25.00 H new ATOM 0 HA PHE A 751 -5.663 -3.439 6.117 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -4.896 -4.208 3.903 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.456 -4.940 3.582 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -5.332 -1.554 4.822 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.682 -3.788 2.017 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -6.180 0.560 3.837 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.423 -1.682 0.960 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.699 0.500 1.881 1.00 25.00 H new ATOM 177 N ARG A 752 -8.529 -4.963 5.928 1.00 25.00 N ATOM 178 CA ARG A 752 -9.946 -4.766 6.223 1.00 25.00 C ATOM 179 C ARG A 752 -10.101 -4.094 7.575 1.00 25.00 C ATOM 180 O ARG A 752 -11.127 -3.531 7.826 1.00 25.00 O ATOM 181 CB ARG A 752 -10.742 -6.082 6.188 1.00 25.00 C ATOM 182 CG ARG A 752 -10.500 -6.996 7.358 1.00 25.00 C ATOM 183 CD ARG A 752 -11.646 -7.010 8.353 1.00 25.00 C ATOM 184 NE ARG A 752 -11.292 -7.860 9.503 1.00 25.00 N ATOM 185 CZ ARG A 752 -11.418 -9.182 9.554 1.00 25.00 C ATOM 186 NH1 ARG A 752 -11.911 -9.883 8.561 1.00 25.00 N ATOM 187 NH2 ARG A 752 -11.034 -9.813 10.627 1.00 25.00 N ATOM 0 H ARG A 752 -8.248 -5.936 5.805 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.356 -4.125 5.443 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -11.805 -5.846 6.143 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.495 -6.616 5.270 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.334 -8.009 6.991 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -9.588 -6.688 7.869 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -11.861 -5.996 8.690 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -12.551 -7.385 7.875 1.00 25.00 H new ATOM 0 HE ARG A 752 -10.919 -7.394 10.330 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -12.215 -9.414 7.708 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -11.990 -10.897 8.642 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -10.643 -9.293 11.412 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -11.124 -10.828 10.682 1.00 25.00 H new ATOM 201 N ALA A 753 -9.091 -4.141 8.440 1.00 25.00 N ATOM 202 CA ALA A 753 -9.162 -3.479 9.744 1.00 25.00 C ATOM 203 C ALA A 753 -9.186 -1.960 9.568 1.00 25.00 C ATOM 204 O ALA A 753 -9.663 -1.239 10.437 1.00 25.00 O ATOM 205 CB ALA A 753 -7.977 -3.892 10.602 1.00 25.00 C ATOM 0 H ALA A 753 -8.213 -4.630 8.264 1.00 25.00 H new ATOM 0 HA ALA A 753 -10.082 -3.784 10.244 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -8.038 -3.395 11.570 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -7.992 -4.972 10.747 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -7.050 -3.606 10.105 1.00 25.00 H new ATOM 211 N SER A 754 -8.701 -1.466 8.438 1.00 25.00 N ATOM 212 CA SER A 754 -8.740 -0.037 8.170 1.00 25.00 C ATOM 213 C SER A 754 -10.192 0.452 8.073 1.00 25.00 C ATOM 214 O SER A 754 -10.462 1.651 8.169 1.00 25.00 O ATOM 215 CB SER A 754 -7.933 0.328 6.923 1.00 25.00 C ATOM 216 OG SER A 754 -7.464 1.665 7.007 1.00 25.00 O ATOM 0 H SER A 754 -8.280 -2.028 7.698 1.00 25.00 H new ATOM 0 HA SER A 754 -8.268 0.476 9.008 1.00 25.00 H new ATOM 0 HB2 SER A 754 -7.089 -0.353 6.817 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.553 0.209 6.034 1.00 25.00 H new ATOM 0 HG SER A 754 -8.003 2.238 6.423 1.00 25.00 H new ATOM 222 N PHE A 755 -11.128 -0.488 7.935 1.00 25.00 N ATOM 223 CA PHE A 755 -12.568 -0.172 7.969 1.00 25.00 C ATOM 224 C PHE A 755 -12.993 0.529 9.258 1.00 25.00 C ATOM 225 O PHE A 755 -14.011 1.198 9.280 1.00 25.00 O ATOM 226 CB PHE A 755 -13.427 -1.432 7.761 1.00 25.00 C ATOM 227 CG PHE A 755 -13.799 -2.183 9.049 1.00 25.00 C ATOM 228 CD1 PHE A 755 -12.827 -2.648 9.961 1.00 25.00 C ATOM 229 CD2 PHE A 755 -15.144 -2.437 9.335 1.00 25.00 C ATOM 230 CE1 PHE A 755 -13.199 -3.374 11.122 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.531 -3.149 10.499 1.00 25.00 C ATOM 232 CZ PHE A 755 -14.554 -3.621 11.388 1.00 25.00 C ATOM 0 H PHE A 755 -10.921 -1.477 7.798 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.737 0.519 7.143 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.345 -1.147 7.246 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -12.891 -2.115 7.102 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -11.783 -2.448 9.772 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -15.905 -2.083 8.655 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -12.440 -3.736 11.800 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.577 -3.328 10.701 1.00 25.00 H new ATOM 0 HZ PHE A 755 -14.843 -4.171 12.271 1.00 25.00 H new ATOM 242 N ASN A 756 -12.217 0.354 10.323 1.00 25.00 N ATOM 243 CA ASN A 756 -12.492 1.019 11.601 1.00 25.00 C ATOM 244 C ASN A 756 -11.428 2.070 11.940 1.00 25.00 C ATOM 245 O ASN A 756 -11.647 2.922 12.785 1.00 25.00 O ATOM 246 CB ASN A 756 -12.615 -0.019 12.734 1.00 25.00 C ATOM 247 CG ASN A 756 -11.274 -0.502 13.262 1.00 25.00 C ATOM 248 OD1 ASN A 756 -10.540 0.215 13.908 1.00 25.00 O ATOM 249 ND2 ASN A 756 -10.967 -1.735 12.993 1.00 25.00 N ATOM 0 H ASN A 756 -11.390 -0.243 10.331 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.443 1.543 11.501 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -13.184 0.417 13.555 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -13.184 -0.875 12.371 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -10.086 -2.126 13.328 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -11.606 -2.312 12.447 1.00 25.00 H new ATOM 256 N HIS A 757 -10.281 1.989 11.277 1.00 25.00 N ATOM 257 CA HIS A 757 -9.130 2.848 11.586 1.00 25.00 C ATOM 258 C HIS A 757 -9.406 4.328 11.360 1.00 25.00 C ATOM 259 O HIS A 757 -9.196 5.153 12.241 1.00 25.00 O ATOM 260 CB HIS A 757 -7.940 2.433 10.708 1.00 25.00 C ATOM 261 CG HIS A 757 -6.665 3.150 11.028 1.00 25.00 C ATOM 262 ND1 HIS A 757 -5.577 3.197 10.191 1.00 25.00 N ATOM 263 CD2 HIS A 757 -6.294 3.865 12.128 1.00 25.00 C ATOM 264 CE1 HIS A 757 -4.626 3.912 10.785 1.00 25.00 C ATOM 265 NE2 HIS A 757 -5.008 4.340 11.971 1.00 25.00 N ATOM 0 H HIS A 757 -10.116 1.333 10.514 1.00 25.00 H new ATOM 0 HA HIS A 757 -8.914 2.714 12.646 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -7.778 1.361 10.817 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -8.193 2.613 9.663 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -6.915 4.035 12.995 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -3.659 4.117 10.349 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -4.469 4.901 12.631 1.00 25.00 H new ATOM 273 N PHE A 758 -9.864 4.660 10.163 1.00 25.00 N ATOM 274 CA PHE A 758 -10.123 6.052 9.804 1.00 25.00 C ATOM 275 C PHE A 758 -11.605 6.352 9.816 1.00 25.00 C ATOM 276 O PHE A 758 -12.021 7.457 9.472 1.00 25.00 O ATOM 277 CB PHE A 758 -9.545 6.342 8.426 1.00 25.00 C ATOM 278 CG PHE A 758 -8.173 6.940 8.468 1.00 25.00 C ATOM 279 CD1 PHE A 758 -7.039 6.118 8.572 1.00 25.00 C ATOM 280 CD2 PHE A 758 -8.005 8.335 8.393 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.743 6.676 8.597 1.00 25.00 C ATOM 282 CE2 PHE A 758 -6.710 8.909 8.412 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.577 8.074 8.510 1.00 25.00 C ATOM 0 H PHE A 758 -10.065 3.988 9.422 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.643 6.692 10.544 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.512 5.416 7.852 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.213 7.021 7.896 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -7.160 5.047 8.634 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -8.872 8.975 8.320 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -4.879 6.033 8.683 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.591 9.981 8.352 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.586 8.504 8.518 1.00 25.00 H new ATOM 293 N ASP A 759 -12.399 5.361 10.198 1.00 25.00 N ATOM 294 CA ASP A 759 -13.849 5.515 10.268 1.00 25.00 C ATOM 295 C ASP A 759 -14.261 6.654 11.164 1.00 25.00 C ATOM 296 O ASP A 759 -14.212 6.586 12.386 1.00 25.00 O ATOM 297 CB ASP A 759 -14.535 4.229 10.667 1.00 25.00 C ATOM 298 CG ASP A 759 -16.004 4.217 10.270 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.643 5.297 10.174 1.00 50.00 O ATOM 300 OD2 ASP A 759 -16.543 3.135 10.056 1.00 50.00 O ATOM 0 H ASP A 759 -12.063 4.436 10.466 1.00 25.00 H new ATOM 0 HA ASP A 759 -14.180 5.764 9.260 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -14.026 3.387 10.198 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.450 4.093 11.745 1.00 25.00 H new ATOM 305 N ARG A 760 -14.658 7.716 10.490 1.00 25.00 N ATOM 306 CA ARG A 760 -15.006 8.989 11.112 1.00 25.00 C ATOM 307 C ARG A 760 -16.081 8.865 12.180 1.00 25.00 C ATOM 308 O ARG A 760 -16.115 9.644 13.126 1.00 25.00 O ATOM 309 CB ARG A 760 -15.467 9.905 9.986 1.00 25.00 C ATOM 310 CG ARG A 760 -15.534 11.347 10.267 1.00 25.00 C ATOM 311 CD ARG A 760 -15.388 11.957 8.907 1.00 25.00 C ATOM 312 NE ARG A 760 -15.533 13.420 8.896 1.00 25.00 N ATOM 313 CZ ARG A 760 -15.208 14.211 7.876 1.00 25.00 C ATOM 314 NH1 ARG A 760 -14.687 13.747 6.766 1.00 25.00 N ATOM 315 NH2 ARG A 760 -15.406 15.495 7.978 1.00 25.00 N ATOM 0 H ARG A 760 -14.751 7.723 9.474 1.00 25.00 H new ATOM 0 HA ARG A 760 -14.136 9.387 11.635 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -14.798 9.758 9.138 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -16.458 9.578 9.671 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -16.478 11.624 10.735 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -14.738 11.665 10.941 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -14.410 11.695 8.504 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -16.134 11.522 8.242 1.00 25.00 H new ATOM 0 HE ARG A 760 -15.911 13.862 9.734 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -14.517 12.747 6.662 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -14.452 14.386 6.007 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -15.806 15.883 8.832 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -15.161 16.112 7.203 1.00 25.00 H new ATOM 329 N ASP A 761 -16.960 7.893 12.010 1.00 25.00 N ATOM 330 CA ASP A 761 -18.047 7.652 12.955 1.00 25.00 C ATOM 331 C ASP A 761 -18.054 6.205 13.461 1.00 25.00 C ATOM 332 O ASP A 761 -18.948 5.815 14.203 1.00 25.00 O ATOM 333 CB ASP A 761 -19.376 8.029 12.304 1.00 25.00 C ATOM 334 CG ASP A 761 -19.450 7.581 10.876 1.00 25.00 C ATOM 335 OD1 ASP A 761 -19.788 6.418 10.642 1.00 50.00 O ATOM 336 OD2 ASP A 761 -19.139 8.359 9.958 1.00 50.00 O ATOM 0 H ASP A 761 -16.945 7.249 11.219 1.00 25.00 H new ATOM 0 HA ASP A 761 -17.893 8.280 13.832 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -20.195 7.581 12.867 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.509 9.110 12.352 1.00 25.00 H new ATOM 341 N HIS A 762 -17.062 5.417 13.046 1.00 25.00 N ATOM 342 CA HIS A 762 -16.934 4.007 13.472 1.00 25.00 C ATOM 343 C HIS A 762 -18.184 3.158 13.133 1.00 25.00 C ATOM 344 O HIS A 762 -18.602 2.282 13.890 1.00 25.00 O ATOM 345 CB HIS A 762 -16.563 3.928 14.965 1.00 25.00 C ATOM 346 CG HIS A 762 -15.826 2.676 15.342 1.00 25.00 C ATOM 347 ND1 HIS A 762 -16.414 1.445 15.477 1.00 25.00 N ATOM 348 CD2 HIS A 762 -14.509 2.469 15.628 1.00 25.00 C ATOM 349 CE1 HIS A 762 -15.483 0.570 15.834 1.00 25.00 C ATOM 350 NE2 HIS A 762 -14.300 1.137 15.944 1.00 25.00 N ATOM 0 H HIS A 762 -16.326 5.726 12.411 1.00 25.00 H new ATOM 0 HA HIS A 762 -16.121 3.566 12.896 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -15.949 4.791 15.223 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -17.474 3.995 15.560 1.00 25.00 H new ATOM 0 HD1 HIS A 762 -17.401 1.237 15.328 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -13.743 3.230 15.611 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -15.672 -0.478 16.012 1.00 25.00 H new ATOM 358 N SER A 763 -18.768 3.415 11.970 1.00 25.00 N ATOM 359 CA SER A 763 -19.920 2.665 11.481 1.00 25.00 C ATOM 360 C SER A 763 -19.523 1.311 10.889 1.00 25.00 C ATOM 361 O SER A 763 -20.376 0.497 10.551 1.00 25.00 O ATOM 362 CB SER A 763 -20.621 3.491 10.404 1.00 25.00 C ATOM 363 OG SER A 763 -19.716 3.881 9.362 1.00 25.00 O ATOM 0 H SER A 763 -18.456 4.151 11.337 1.00 25.00 H new ATOM 0 HA SER A 763 -20.580 2.475 12.327 1.00 25.00 H new ATOM 0 HB2 SER A 763 -21.440 2.912 9.977 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.061 4.380 10.856 1.00 25.00 H new ATOM 0 HG SER A 763 -19.463 4.820 9.483 1.00 25.00 H new ATOM 369 N GLY A 764 -18.226 1.086 10.743 1.00 25.00 N ATOM 370 CA GLY A 764 -17.719 -0.156 10.179 1.00 25.00 C ATOM 371 C GLY A 764 -17.702 -0.011 8.674 1.00 25.00 C ATOM 372 O GLY A 764 -17.635 -0.978 7.917 1.00 25.00 O ATOM 0 H GLY A 764 -17.501 1.752 11.009 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -16.717 -0.364 10.553 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -18.350 -0.994 10.474 1.00 25.00 H new ATOM 376 N THR A 765 -17.793 1.238 8.251 1.00 25.00 N ATOM 377 CA THR A 765 -17.850 1.606 6.846 1.00 25.00 C ATOM 378 C THR A 765 -17.374 3.052 6.663 1.00 25.00 C ATOM 379 O THR A 765 -17.766 3.953 7.424 1.00 25.00 O ATOM 380 CB THR A 765 -19.292 1.534 6.329 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.187 1.941 7.370 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.689 0.133 5.881 1.00 25.00 C ATOM 0 H THR A 765 -17.830 2.037 8.883 1.00 25.00 H new ATOM 0 HA THR A 765 -17.213 0.913 6.296 1.00 25.00 H new ATOM 0 HB THR A 765 -19.353 2.195 5.464 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.778 2.665 7.889 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.719 0.143 5.525 1.00 25.00 H new ATOM 0 HG22 THR A 765 -19.030 -0.192 5.076 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.602 -0.556 6.721 1.00 25.00 H new ATOM 390 N LEU A 766 -16.557 3.305 5.657 1.00 25.00 N ATOM 391 CA LEU A 766 -16.063 4.662 5.414 1.00 25.00 C ATOM 392 C LEU A 766 -16.914 5.308 4.319 1.00 25.00 C ATOM 393 O LEU A 766 -17.052 4.761 3.262 1.00 25.00 O ATOM 394 CB LEU A 766 -14.582 4.635 4.990 1.00 25.00 C ATOM 395 CG LEU A 766 -13.460 4.635 6.066 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.535 5.838 6.867 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.489 3.440 6.992 1.00 25.00 C ATOM 0 H LEU A 766 -16.220 2.603 4.998 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.138 5.243 6.333 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.439 3.748 4.374 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.414 5.500 4.348 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.525 4.587 5.507 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.744 5.826 7.617 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.413 6.711 6.225 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.504 5.885 7.363 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.674 3.518 7.712 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.441 3.414 7.523 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.373 2.526 6.410 1.00 25.00 H new ATOM 409 N GLY A 767 -17.494 6.467 4.582 1.00 25.00 N ATOM 410 CA GLY A 767 -18.321 7.155 3.593 1.00 25.00 C ATOM 411 C GLY A 767 -17.431 7.898 2.633 1.00 25.00 C ATOM 412 O GLY A 767 -16.260 7.690 2.686 1.00 25.00 O ATOM 0 H GLY A 767 -17.410 6.956 5.473 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -18.937 6.436 3.054 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -19.000 7.849 4.089 1.00 25.00 H new ATOM 416 N PRO A 768 -17.925 8.774 1.764 1.00 25.00 N ATOM 417 CA PRO A 768 -17.046 9.446 0.793 1.00 25.00 C ATOM 418 C PRO A 768 -15.930 10.276 1.433 1.00 25.00 C ATOM 419 O PRO A 768 -14.748 10.017 1.221 1.00 25.00 O ATOM 420 CB PRO A 768 -18.020 10.338 0.013 1.00 25.00 C ATOM 421 CG PRO A 768 -19.188 10.515 0.951 1.00 25.00 C ATOM 422 CD PRO A 768 -19.320 9.205 1.637 1.00 25.00 C ATOM 0 HA PRO A 768 -16.504 8.727 0.179 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.566 11.295 -0.243 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.327 9.870 -0.922 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -19.005 11.319 1.664 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.097 10.771 0.408 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -19.805 9.302 2.608 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -19.912 8.499 1.054 1.00 25.00 H new ATOM 430 N GLU A 769 -16.311 11.261 2.231 1.00 25.00 N ATOM 431 CA GLU A 769 -15.363 12.161 2.889 1.00 25.00 C ATOM 432 C GLU A 769 -14.528 11.417 3.906 1.00 25.00 C ATOM 433 O GLU A 769 -13.494 11.895 4.360 1.00 25.00 O ATOM 434 CB GLU A 769 -16.129 13.261 3.635 1.00 25.00 C ATOM 435 CG GLU A 769 -17.089 14.050 2.776 1.00 25.00 C ATOM 436 CD GLU A 769 -16.390 14.683 1.601 1.00 25.00 C ATOM 437 OE1 GLU A 769 -15.377 15.382 1.820 1.00 25.00 O ATOM 438 OE2 GLU A 769 -16.846 14.473 0.463 1.00 25.00 O ATOM 0 H GLU A 769 -17.288 11.463 2.444 1.00 25.00 H new ATOM 0 HA GLU A 769 -14.718 12.584 2.119 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -16.685 12.807 4.455 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -15.410 13.949 4.080 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -17.882 13.393 2.418 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -17.564 14.825 3.378 1.00 25.00 H new ATOM 445 N GLU A 770 -14.990 10.239 4.283 1.00 25.00 N ATOM 446 CA GLU A 770 -14.246 9.436 5.239 1.00 25.00 C ATOM 447 C GLU A 770 -13.245 8.516 4.494 1.00 25.00 C ATOM 448 O GLU A 770 -12.090 8.390 4.878 1.00 25.00 O ATOM 449 CB GLU A 770 -15.171 8.569 6.089 1.00 25.00 C ATOM 450 CG GLU A 770 -16.507 9.113 6.552 1.00 25.00 C ATOM 451 CD GLU A 770 -17.253 8.001 7.318 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.663 7.393 8.221 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.408 7.675 6.998 1.00 50.00 O ATOM 0 H GLU A 770 -15.859 9.822 3.950 1.00 25.00 H new ATOM 0 HA GLU A 770 -13.713 10.124 5.896 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.370 7.658 5.525 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.614 8.277 6.979 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -16.360 9.981 7.194 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.097 9.445 5.698 1.00 25.00 H new ATOM 460 N PHE A 771 -13.716 7.869 3.434 1.00 25.00 N ATOM 461 CA PHE A 771 -12.929 6.925 2.622 1.00 25.00 C ATOM 462 C PHE A 771 -11.717 7.597 2.040 1.00 25.00 C ATOM 463 O PHE A 771 -10.634 7.022 1.995 1.00 25.00 O ATOM 464 CB PHE A 771 -13.817 6.375 1.486 1.00 25.00 C ATOM 465 CG PHE A 771 -13.102 5.491 0.481 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.325 4.397 0.898 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.235 5.742 -0.905 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.711 3.532 -0.053 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.618 4.892 -1.866 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.866 3.778 -1.432 1.00 25.00 C ATOM 0 H PHE A 771 -14.674 7.983 3.102 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.591 6.109 3.260 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.636 5.807 1.928 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.263 7.216 0.955 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.192 4.209 1.953 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.813 6.591 -1.239 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -11.127 2.688 0.283 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.724 5.098 -2.921 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.411 3.117 -2.155 1.00 25.00 H new ATOM 480 N LYS A 772 -11.892 8.832 1.612 1.00 25.00 N ATOM 481 CA LYS A 772 -10.820 9.573 1.012 1.00 25.00 C ATOM 482 C LYS A 772 -9.737 9.872 2.043 1.00 25.00 C ATOM 483 O LYS A 772 -8.604 10.110 1.676 1.00 25.00 O ATOM 484 CB LYS A 772 -11.393 10.818 0.336 1.00 25.00 C ATOM 485 CG LYS A 772 -12.022 11.849 1.261 1.00 25.00 C ATOM 486 CD LYS A 772 -11.043 12.900 1.692 1.00 25.00 C ATOM 487 CE LYS A 772 -10.510 13.694 0.469 1.00 25.00 C ATOM 488 NZ LYS A 772 -10.582 15.197 0.505 1.00 25.00 N ATOM 0 H LYS A 772 -12.775 9.339 1.673 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.330 8.985 0.236 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.594 11.302 -0.226 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.145 10.501 -0.387 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -12.862 12.324 0.754 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -12.424 11.347 2.141 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -11.522 13.583 2.394 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -10.211 12.433 2.219 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -9.467 13.415 0.321 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -11.058 13.356 -0.411 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -10.537 15.570 -0.465 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -11.476 15.491 0.948 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -9.783 15.570 1.057 1.00 25.00 H new ATOM 502 N ALA A 773 -10.088 9.872 3.329 1.00 25.00 N ATOM 503 CA ALA A 773 -9.116 10.157 4.379 1.00 25.00 C ATOM 504 C ALA A 773 -8.385 8.860 4.748 1.00 25.00 C ATOM 505 O ALA A 773 -7.206 8.864 5.069 1.00 25.00 O ATOM 506 CB ALA A 773 -9.817 10.752 5.611 1.00 25.00 C ATOM 0 H ALA A 773 -11.032 9.679 3.665 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.393 10.889 4.018 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -9.078 10.959 6.385 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.319 11.678 5.332 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.551 10.041 5.991 1.00 25.00 H new ATOM 512 N CYS A 774 -9.110 7.751 4.681 1.00 25.00 N ATOM 513 CA CYS A 774 -8.548 6.431 4.966 1.00 25.00 C ATOM 514 C CYS A 774 -7.430 6.137 3.983 1.00 25.00 C ATOM 515 O CYS A 774 -6.342 5.710 4.353 1.00 25.00 O ATOM 516 CB CYS A 774 -9.657 5.376 4.834 1.00 25.00 C ATOM 517 SG CYS A 774 -9.135 3.675 5.147 1.00 25.00 S ATOM 0 H CYS A 774 -10.098 7.737 4.429 1.00 25.00 H new ATOM 0 HA CYS A 774 -8.145 6.407 5.979 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.460 5.627 5.527 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -10.074 5.433 3.828 1.00 25.00 H new ATOM 0 HG CYS A 774 -10.152 2.877 5.009 1.00 25.00 H new ATOM 523 N LEU A 775 -7.726 6.397 2.724 1.00 25.00 N ATOM 524 CA LEU A 775 -6.795 6.170 1.622 1.00 25.00 C ATOM 525 C LEU A 775 -5.478 6.964 1.663 1.00 25.00 C ATOM 526 O LEU A 775 -4.512 6.594 1.005 1.00 25.00 O ATOM 527 CB LEU A 775 -7.521 6.498 0.328 1.00 25.00 C ATOM 528 CG LEU A 775 -8.537 5.480 -0.202 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.202 6.102 -1.425 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.865 4.167 -0.580 1.00 25.00 C ATOM 0 H LEU A 775 -8.626 6.775 2.429 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.490 5.127 1.705 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.039 7.447 0.467 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -6.770 6.655 -0.446 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.270 5.250 0.571 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.935 5.406 -1.834 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.701 7.027 -1.137 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.446 6.318 -2.180 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -8.615 3.468 -0.952 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -7.122 4.349 -1.356 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -7.377 3.742 0.297 1.00 25.00 H new ATOM 542 N ILE A 776 -5.428 8.040 2.433 1.00 25.00 N ATOM 543 CA ILE A 776 -4.217 8.855 2.561 1.00 25.00 C ATOM 544 C ILE A 776 -3.117 7.995 3.168 1.00 25.00 C ATOM 545 O ILE A 776 -1.955 8.078 2.785 1.00 25.00 O ATOM 546 CB ILE A 776 -4.452 10.092 3.488 1.00 25.00 C ATOM 547 CG1 ILE A 776 -5.625 10.927 2.952 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.178 10.968 3.578 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.003 12.140 3.804 1.00 25.00 C ATOM 0 H ILE A 776 -6.217 8.376 2.986 1.00 25.00 H new ATOM 0 HA ILE A 776 -3.939 9.216 1.571 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.689 9.732 4.489 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.376 11.271 1.948 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.498 10.281 2.860 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.369 11.821 4.229 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.358 10.377 3.986 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -2.910 11.323 2.583 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -6.840 12.663 3.342 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -6.289 11.809 4.802 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.150 12.814 3.876 1.00 25.00 H new ATOM 561 N SER A 777 -3.505 7.151 4.114 1.00 25.00 N ATOM 562 CA SER A 777 -2.561 6.292 4.824 1.00 25.00 C ATOM 563 C SER A 777 -2.077 5.145 3.948 1.00 25.00 C ATOM 564 O SER A 777 -1.186 4.402 4.343 1.00 25.00 O ATOM 565 CB SER A 777 -3.234 5.708 6.068 1.00 25.00 C ATOM 566 OG SER A 777 -2.302 5.023 6.886 1.00 25.00 O ATOM 0 H SER A 777 -4.475 7.041 4.411 1.00 25.00 H new ATOM 0 HA SER A 777 -1.702 6.903 5.102 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.703 6.509 6.640 1.00 25.00 H new ATOM 0 HB3 SER A 777 -4.028 5.024 5.767 1.00 25.00 H new ATOM 0 HG SER A 777 -1.575 4.672 6.330 1.00 25.00 H new ATOM 572 N LEU A 778 -2.681 5.001 2.776 1.00 25.00 N ATOM 573 CA LEU A 778 -2.346 3.914 1.860 1.00 25.00 C ATOM 574 C LEU A 778 -1.607 4.455 0.645 1.00 25.00 C ATOM 575 O LEU A 778 -1.140 3.693 -0.178 1.00 25.00 O ATOM 576 CB LEU A 778 -3.606 3.146 1.428 1.00 25.00 C ATOM 577 CG LEU A 778 -4.199 2.112 2.414 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.220 0.991 2.726 1.00 25.00 C ATOM 579 CD2 LEU A 778 -4.661 2.764 3.741 1.00 25.00 C ATOM 0 H LEU A 778 -3.410 5.627 2.434 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.692 3.217 2.385 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.383 3.877 1.204 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.378 2.627 0.497 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.068 1.692 1.908 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.680 0.289 3.422 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -2.958 0.470 1.805 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.319 1.409 3.175 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.070 1.998 4.400 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -3.811 3.244 4.226 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.428 3.510 3.532 1.00 25.00 H new ATOM 591 N GLY A 779 -1.478 5.773 0.527 1.00 25.00 N ATOM 592 CA GLY A 779 -0.670 6.293 -0.570 1.00 25.00 C ATOM 593 C GLY A 779 -1.399 6.193 -1.892 1.00 25.00 C ATOM 594 O GLY A 779 -0.861 5.798 -2.915 1.00 25.00 O ATOM 0 H GLY A 779 -1.898 6.469 1.142 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.414 7.334 -0.373 1.00 25.00 H new ATOM 0 HA3 GLY A 779 0.267 5.739 -0.627 1.00 25.00 H new ATOM 598 N TYR A 780 -2.658 6.584 -1.830 1.00 25.00 N ATOM 599 CA TYR A 780 -3.588 6.553 -2.956 1.00 25.00 C ATOM 600 C TYR A 780 -3.208 7.182 -4.316 1.00 25.00 C ATOM 601 O TYR A 780 -2.305 7.986 -4.438 1.00 25.00 O ATOM 602 CB TYR A 780 -4.915 7.152 -2.485 1.00 25.00 C ATOM 603 CG TYR A 780 -4.855 8.550 -1.869 1.00 25.00 C ATOM 604 CD1 TYR A 780 -3.645 9.274 -1.764 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.029 9.155 -1.384 1.00 25.00 C ATOM 606 CE1 TYR A 780 -3.605 10.536 -1.180 1.00 25.00 C ATOM 607 CE2 TYR A 780 -5.998 10.438 -0.812 1.00 25.00 C ATOM 608 CZ TYR A 780 -4.780 11.124 -0.712 1.00 25.00 C ATOM 609 OH TYR A 780 -4.728 12.382 -0.164 1.00 25.00 O ATOM 0 H TYR A 780 -3.079 6.943 -0.973 1.00 25.00 H new ATOM 0 HA TYR A 780 -3.608 5.494 -3.213 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.596 7.184 -3.336 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.353 6.475 -1.752 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -2.733 8.838 -2.145 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -6.968 8.625 -1.452 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -2.665 11.060 -1.089 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -6.908 10.893 -0.451 1.00 25.00 H new ATOM 0 HH TYR A 780 -5.627 12.655 0.114 1.00 25.00 H new ATOM 619 N ASP A 781 -3.971 6.771 -5.326 1.00 25.00 N ATOM 620 CA ASP A 781 -3.789 7.120 -6.750 1.00 25.00 C ATOM 621 C ASP A 781 -4.467 8.462 -7.070 1.00 25.00 C ATOM 622 O ASP A 781 -4.628 8.857 -8.221 1.00 25.00 O ATOM 623 CB ASP A 781 -4.458 5.996 -7.574 1.00 25.00 C ATOM 624 CG ASP A 781 -3.942 5.892 -9.017 1.00 25.00 C ATOM 625 OD1 ASP A 781 -2.983 6.589 -9.397 1.00 25.00 O ATOM 626 OD2 ASP A 781 -4.528 5.062 -9.776 1.00 25.00 O ATOM 0 H ASP A 781 -4.772 6.157 -5.177 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.729 7.216 -6.987 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -4.295 5.043 -7.070 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -5.535 6.165 -7.595 1.00 25.00 H new ATOM 631 N ILE A 782 -4.891 9.144 -6.020 1.00 25.00 N ATOM 632 CA ILE A 782 -5.594 10.412 -6.121 1.00 25.00 C ATOM 633 C ILE A 782 -5.041 11.360 -5.069 1.00 25.00 C ATOM 634 O ILE A 782 -4.298 10.954 -4.193 1.00 25.00 O ATOM 635 CB ILE A 782 -7.114 10.240 -5.897 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.385 9.469 -4.586 1.00 25.00 C ATOM 637 CG2 ILE A 782 -7.741 9.601 -7.142 1.00 25.00 C ATOM 638 CD1 ILE A 782 -7.816 8.026 -4.734 1.00 25.00 C ATOM 0 H ILE A 782 -4.755 8.828 -5.060 1.00 25.00 H new ATOM 0 HA ILE A 782 -5.444 10.811 -7.124 1.00 25.00 H new ATOM 0 HB ILE A 782 -7.595 11.210 -5.767 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -6.479 9.495 -3.980 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.156 10.001 -4.029 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -8.813 9.478 -6.987 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -7.570 10.243 -8.006 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.286 8.626 -7.319 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -7.976 7.591 -3.747 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -8.743 7.980 -5.306 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.040 7.466 -5.256 1.00 25.00 H new ATOM 650 N GLY A 783 -5.422 12.621 -5.156 1.00 25.00 N ATOM 651 CA GLY A 783 -4.976 13.609 -4.199 1.00 25.00 C ATOM 652 C GLY A 783 -6.004 14.712 -4.155 1.00 25.00 C ATOM 653 O GLY A 783 -7.095 14.549 -4.706 1.00 25.00 O ATOM 0 H GLY A 783 -6.040 12.983 -5.882 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -4.858 13.159 -3.213 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -4.003 14.006 -4.487 1.00 25.00 H new ATOM 657 N ASN A 784 -5.673 15.831 -3.522 1.00 25.00 N ATOM 658 CA ASN A 784 -6.593 16.972 -3.401 1.00 25.00 C ATOM 659 C ASN A 784 -6.496 17.811 -4.690 1.00 25.00 C ATOM 660 O ASN A 784 -6.334 19.033 -4.666 1.00 25.00 O ATOM 661 CB ASN A 784 -6.232 17.795 -2.150 1.00 25.00 C ATOM 662 CG ASN A 784 -7.403 18.592 -1.608 1.00 25.00 C ATOM 663 OD1 ASN A 784 -7.880 18.334 -0.511 1.00 25.00 O ATOM 664 ND2 ASN A 784 -7.862 19.556 -2.355 1.00 25.00 N ATOM 0 H ASN A 784 -4.767 15.980 -3.078 1.00 25.00 H new ATOM 0 HA ASN A 784 -7.622 16.634 -3.282 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -5.866 17.124 -1.373 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -5.417 18.477 -2.393 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -8.644 20.124 -2.030 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -7.439 19.742 -3.264 1.00 25.00 H new ATOM 671 N ASP A 785 -6.576 17.119 -5.810 1.00 25.00 N ATOM 672 CA ASP A 785 -6.406 17.701 -7.133 1.00 25.00 C ATOM 673 C ASP A 785 -7.745 17.721 -7.843 1.00 25.00 C ATOM 674 O ASP A 785 -8.606 16.886 -7.561 1.00 25.00 O ATOM 675 CB ASP A 785 -5.432 16.840 -7.933 1.00 25.00 C ATOM 676 CG ASP A 785 -4.089 16.728 -7.264 1.00 25.00 C ATOM 677 OD1 ASP A 785 -3.276 17.660 -7.410 1.00 25.00 O ATOM 678 OD2 ASP A 785 -3.853 15.712 -6.581 1.00 25.00 O ATOM 0 H ASP A 785 -6.765 16.117 -5.829 1.00 25.00 H new ATOM 0 HA ASP A 785 -6.019 18.716 -7.044 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -5.854 15.844 -8.065 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -5.306 17.267 -8.928 1.00 25.00 H new ATOM 683 N PRO A 786 -7.947 18.650 -8.795 1.00 25.00 N ATOM 684 CA PRO A 786 -9.264 18.660 -9.443 1.00 25.00 C ATOM 685 C PRO A 786 -9.537 17.396 -10.255 1.00 25.00 C ATOM 686 O PRO A 786 -10.686 17.016 -10.452 1.00 25.00 O ATOM 687 CB PRO A 786 -9.200 19.907 -10.331 1.00 25.00 C ATOM 688 CG PRO A 786 -7.747 20.074 -10.629 1.00 25.00 C ATOM 689 CD PRO A 786 -7.069 19.705 -9.335 1.00 25.00 C ATOM 0 HA PRO A 786 -10.082 18.682 -8.723 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -9.781 19.775 -11.244 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -9.604 20.781 -9.820 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -7.429 19.426 -11.446 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -7.514 21.097 -10.925 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -6.054 19.342 -9.499 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -6.997 20.557 -8.659 1.00 25.00 H new ATOM 697 N GLN A 787 -8.483 16.735 -10.716 1.00 25.00 N ATOM 698 CA GLN A 787 -8.646 15.476 -11.430 1.00 25.00 C ATOM 699 C GLN A 787 -8.828 14.321 -10.445 1.00 25.00 C ATOM 700 O GLN A 787 -9.667 13.461 -10.650 1.00 25.00 O ATOM 701 CB GLN A 787 -7.451 15.198 -12.361 1.00 25.00 C ATOM 702 CG GLN A 787 -6.083 15.426 -11.776 1.00 25.00 C ATOM 703 CD GLN A 787 -5.065 15.036 -12.735 1.00 25.00 C ATOM 704 OE1 GLN A 787 -4.305 15.801 -13.297 1.00 25.00 O ATOM 705 NE2 GLN A 787 -5.064 13.789 -12.932 1.00 25.00 N ATOM 0 H GLN A 787 -7.517 17.045 -10.610 1.00 25.00 H new ATOM 0 HA GLN A 787 -9.541 15.559 -12.047 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -7.512 14.162 -12.696 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -7.554 15.826 -13.246 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -5.962 16.476 -11.510 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -5.970 14.850 -10.858 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -5.724 13.193 -12.433 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -4.403 13.377 -13.590 1.00 25.00 H new ATOM 714 N GLY A 788 -8.038 14.295 -9.379 1.00 25.00 N ATOM 715 CA GLY A 788 -8.095 13.176 -8.457 1.00 25.00 C ATOM 716 C GLY A 788 -9.355 13.117 -7.633 1.00 25.00 C ATOM 717 O GLY A 788 -9.814 12.043 -7.304 1.00 25.00 O ATOM 0 H GLY A 788 -7.364 15.022 -9.137 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.001 12.249 -9.022 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.238 13.229 -7.786 1.00 25.00 H new ATOM 721 N GLU A 789 -9.941 14.254 -7.311 1.00 25.00 N ATOM 722 CA GLU A 789 -11.192 14.262 -6.547 1.00 25.00 C ATOM 723 C GLU A 789 -12.318 13.626 -7.384 1.00 25.00 C ATOM 724 O GLU A 789 -13.265 13.056 -6.841 1.00 25.00 O ATOM 725 CB GLU A 789 -11.565 15.697 -6.152 1.00 25.00 C ATOM 726 CG GLU A 789 -10.709 16.288 -4.998 1.00 25.00 C ATOM 727 CD GLU A 789 -11.235 15.929 -3.596 1.00 25.00 C ATOM 728 OE1 GLU A 789 -12.444 16.117 -3.355 1.00 25.00 O ATOM 729 OE2 GLU A 789 -10.439 15.477 -2.732 1.00 25.00 O ATOM 0 H GLU A 789 -9.584 15.177 -7.558 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.056 13.679 -5.636 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -11.466 16.339 -7.027 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -12.614 15.719 -5.858 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -9.684 15.929 -5.096 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -10.678 17.373 -5.099 1.00 25.00 H new ATOM 736 N ALA A 790 -12.211 13.702 -8.707 1.00 25.00 N ATOM 737 CA ALA A 790 -13.241 13.142 -9.579 1.00 25.00 C ATOM 738 C ALA A 790 -13.072 11.627 -9.621 1.00 25.00 C ATOM 739 O ALA A 790 -14.038 10.869 -9.591 1.00 25.00 O ATOM 740 CB ALA A 790 -13.119 13.738 -10.989 1.00 25.00 C ATOM 0 H ALA A 790 -11.431 14.141 -9.196 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.230 13.387 -9.193 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -13.891 13.314 -11.631 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -13.242 14.820 -10.939 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -12.137 13.504 -11.399 1.00 25.00 H new ATOM 746 N GLU A 791 -11.824 11.200 -9.680 1.00 25.00 N ATOM 747 CA GLU A 791 -11.490 9.783 -9.722 1.00 25.00 C ATOM 748 C GLU A 791 -11.766 9.131 -8.384 1.00 25.00 C ATOM 749 O GLU A 791 -12.210 7.998 -8.321 1.00 25.00 O ATOM 750 CB GLU A 791 -10.028 9.628 -10.084 1.00 25.00 C ATOM 751 CG GLU A 791 -9.726 10.180 -11.446 1.00 25.00 C ATOM 752 CD GLU A 791 -10.460 9.411 -12.556 1.00 25.00 C ATOM 753 OE1 GLU A 791 -10.388 8.163 -12.577 1.00 25.00 O ATOM 754 OE2 GLU A 791 -11.126 10.048 -13.400 1.00 25.00 O ATOM 0 H GLU A 791 -11.015 11.820 -9.700 1.00 25.00 H new ATOM 0 HA GLU A 791 -12.108 9.292 -10.474 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.414 10.138 -9.342 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.756 8.573 -10.052 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -10.013 11.231 -11.483 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.652 10.136 -11.625 1.00 25.00 H new ATOM 761 N PHE A 792 -11.526 9.862 -7.311 1.00 25.00 N ATOM 762 CA PHE A 792 -11.868 9.384 -5.975 1.00 25.00 C ATOM 763 C PHE A 792 -13.351 9.025 -5.971 1.00 25.00 C ATOM 764 O PHE A 792 -13.732 7.938 -5.541 1.00 25.00 O ATOM 765 CB PHE A 792 -11.575 10.446 -4.905 1.00 25.00 C ATOM 766 CG PHE A 792 -12.632 10.526 -3.835 1.00 25.00 C ATOM 767 CD1 PHE A 792 -12.840 9.452 -2.945 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.445 11.672 -3.723 1.00 25.00 C ATOM 769 CE1 PHE A 792 -13.866 9.513 -1.974 1.00 25.00 C ATOM 770 CE2 PHE A 792 -14.466 11.739 -2.750 1.00 25.00 C ATOM 771 CZ PHE A 792 -14.678 10.661 -1.886 1.00 25.00 C ATOM 0 H PHE A 792 -11.097 10.787 -7.333 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.260 8.512 -5.735 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.614 10.227 -4.440 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.482 11.420 -5.386 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.211 8.576 -3.006 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.285 12.508 -4.388 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.027 8.683 -1.302 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.083 12.622 -2.673 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.466 10.708 -1.149 1.00 25.00 H new ATOM 781 N ALA A 793 -14.188 9.929 -6.464 1.00 25.00 N ATOM 782 CA ALA A 793 -15.626 9.690 -6.485 1.00 25.00 C ATOM 783 C ALA A 793 -15.996 8.549 -7.442 1.00 25.00 C ATOM 784 O ALA A 793 -16.940 7.795 -7.199 1.00 25.00 O ATOM 785 CB ALA A 793 -16.361 10.980 -6.866 1.00 25.00 C ATOM 0 H ALA A 793 -13.900 10.827 -6.852 1.00 25.00 H new ATOM 0 HA ALA A 793 -15.936 9.385 -5.485 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.435 10.796 -6.880 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.136 11.757 -6.135 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.036 11.306 -7.854 1.00 25.00 H new ATOM 791 N ARG A 794 -15.238 8.417 -8.520 1.00 25.00 N ATOM 792 CA ARG A 794 -15.432 7.336 -9.490 1.00 25.00 C ATOM 793 C ARG A 794 -15.214 5.995 -8.797 1.00 25.00 C ATOM 794 O ARG A 794 -15.966 5.053 -9.015 1.00 25.00 O ATOM 795 CB ARG A 794 -14.439 7.523 -10.639 1.00 25.00 C ATOM 796 CG ARG A 794 -14.560 6.571 -11.801 1.00 25.00 C ATOM 797 CD ARG A 794 -13.395 6.857 -12.737 1.00 25.00 C ATOM 798 NE ARG A 794 -13.436 6.067 -13.975 1.00 25.00 N ATOM 799 CZ ARG A 794 -12.514 6.115 -14.933 1.00 25.00 C ATOM 800 NH1 ARG A 794 -11.452 6.874 -14.856 1.00 25.00 N ATOM 801 NH2 ARG A 794 -12.669 5.375 -15.998 1.00 25.00 N ATOM 0 H ARG A 794 -14.473 9.050 -8.752 1.00 25.00 H new ATOM 0 HA ARG A 794 -16.445 7.357 -9.891 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.546 8.539 -11.019 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -13.431 7.439 -10.234 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -14.532 5.537 -11.456 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -15.511 6.710 -12.316 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -13.394 7.917 -12.991 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -12.460 6.653 -12.215 1.00 25.00 H new ATOM 0 HE ARG A 794 -14.227 5.437 -14.110 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -11.304 7.462 -14.036 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.772 6.878 -15.616 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -13.487 4.772 -16.086 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -11.972 5.400 -16.742 1.00 25.00 H new ATOM 815 N ILE A 795 -14.196 5.915 -7.953 1.00 25.00 N ATOM 816 CA ILE A 795 -13.910 4.694 -7.211 1.00 25.00 C ATOM 817 C ILE A 795 -14.970 4.515 -6.149 1.00 25.00 C ATOM 818 O ILE A 795 -15.444 3.421 -5.942 1.00 25.00 O ATOM 819 CB ILE A 795 -12.547 4.721 -6.479 1.00 25.00 C ATOM 820 CG1 ILE A 795 -11.389 4.943 -7.459 1.00 25.00 C ATOM 821 CG2 ILE A 795 -12.324 3.387 -5.718 1.00 25.00 C ATOM 822 CD1 ILE A 795 -10.277 5.753 -6.835 1.00 25.00 C ATOM 0 H ILE A 795 -13.552 6.683 -7.764 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.891 3.886 -7.942 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.568 5.552 -5.774 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.998 3.979 -7.785 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.758 5.455 -8.348 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -11.362 3.416 -5.206 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -13.120 3.248 -4.986 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -12.333 2.558 -6.426 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.475 5.889 -7.560 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.662 6.727 -6.533 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.891 5.228 -5.961 1.00 25.00 H new ATOM 834 N MET A 796 -15.351 5.596 -5.480 1.00 25.00 N ATOM 835 CA MET A 796 -16.359 5.546 -4.415 1.00 25.00 C ATOM 836 C MET A 796 -17.650 4.885 -4.913 1.00 25.00 C ATOM 837 O MET A 796 -18.387 4.277 -4.147 1.00 25.00 O ATOM 838 CB MET A 796 -16.633 6.957 -3.883 1.00 25.00 C ATOM 839 CG MET A 796 -16.911 7.011 -2.389 1.00 25.00 C ATOM 840 SD MET A 796 -18.666 7.169 -2.030 1.00 25.00 S ATOM 841 CE MET A 796 -18.943 5.724 -1.025 1.00 25.00 C ATOM 0 H MET A 796 -14.976 6.528 -5.654 1.00 25.00 H new ATOM 0 HA MET A 796 -15.971 4.938 -3.598 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.775 7.591 -4.106 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.486 7.376 -4.416 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.525 6.108 -1.916 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.375 7.853 -1.952 1.00 25.00 H new ATOM 0 HE1 MET A 796 -20.004 5.473 -1.033 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.369 4.888 -1.424 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.626 5.926 -0.002 1.00 25.00 H new ATOM 851 N SER A 797 -17.891 4.992 -6.212 1.00 25.00 N ATOM 852 CA SER A 797 -19.052 4.380 -6.845 1.00 25.00 C ATOM 853 C SER A 797 -18.861 2.870 -7.055 1.00 25.00 C ATOM 854 O SER A 797 -19.825 2.109 -6.994 1.00 25.00 O ATOM 855 CB SER A 797 -19.301 5.058 -8.196 1.00 25.00 C ATOM 856 OG SER A 797 -20.514 4.623 -8.786 1.00 25.00 O ATOM 0 H SER A 797 -17.289 5.504 -6.856 1.00 25.00 H new ATOM 0 HA SER A 797 -19.909 4.516 -6.185 1.00 25.00 H new ATOM 0 HB2 SER A 797 -19.330 6.139 -8.061 1.00 25.00 H new ATOM 0 HB3 SER A 797 -18.471 4.843 -8.869 1.00 25.00 H new ATOM 0 HG SER A 797 -20.641 5.077 -9.645 1.00 25.00 H new ATOM 862 N ILE A 798 -17.630 2.422 -7.296 1.00 25.00 N ATOM 863 CA ILE A 798 -17.389 0.990 -7.530 1.00 25.00 C ATOM 864 C ILE A 798 -17.201 0.221 -6.222 1.00 25.00 C ATOM 865 O ILE A 798 -17.442 -0.982 -6.161 1.00 25.00 O ATOM 866 CB ILE A 798 -16.227 0.713 -8.554 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.833 0.934 -7.934 1.00 25.00 C ATOM 868 CG2 ILE A 798 -16.429 1.604 -9.811 1.00 25.00 C ATOM 869 CD1 ILE A 798 -13.653 0.540 -8.842 1.00 25.00 C ATOM 0 H ILE A 798 -16.798 3.010 -7.335 1.00 25.00 H new ATOM 0 HA ILE A 798 -18.294 0.608 -8.002 1.00 25.00 H new ATOM 0 HB ILE A 798 -16.269 -0.338 -8.841 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.732 1.986 -7.667 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.768 0.362 -7.008 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -15.626 1.415 -10.524 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -17.387 1.368 -10.274 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -16.416 2.654 -9.519 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.714 0.730 -8.322 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -13.722 -0.519 -9.090 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -13.686 1.130 -9.758 1.00 25.00 H new ATOM 881 N VAL A 799 -16.801 0.920 -5.167 1.00 25.00 N ATOM 882 CA VAL A 799 -16.574 0.293 -3.864 1.00 25.00 C ATOM 883 C VAL A 799 -17.840 0.361 -3.007 1.00 25.00 C ATOM 884 O VAL A 799 -17.801 0.281 -1.776 1.00 25.00 O ATOM 885 CB VAL A 799 -15.341 0.900 -3.129 1.00 25.00 C ATOM 886 CG1 VAL A 799 -14.083 0.694 -3.967 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.535 2.373 -2.833 1.00 25.00 C ATOM 0 H VAL A 799 -16.626 1.925 -5.185 1.00 25.00 H new ATOM 0 HA VAL A 799 -16.341 -0.758 -4.036 1.00 25.00 H new ATOM 0 HB VAL A 799 -15.232 0.383 -2.176 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -13.225 1.121 -3.447 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -13.920 -0.372 -4.122 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -14.204 1.186 -4.932 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -14.654 2.760 -2.320 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -15.679 2.916 -3.767 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -16.411 2.504 -2.198 1.00 25.00 H new ATOM 897 N ASP A 800 -18.974 0.474 -3.679 1.00 25.00 N ATOM 898 CA ASP A 800 -20.278 0.435 -3.023 1.00 25.00 C ATOM 899 C ASP A 800 -21.160 -0.662 -3.648 1.00 25.00 C ATOM 900 O ASP A 800 -22.224 -0.398 -4.221 1.00 25.00 O ATOM 901 CB ASP A 800 -20.987 1.780 -3.096 1.00 25.00 C ATOM 902 CG ASP A 800 -22.294 1.771 -2.336 1.00 25.00 C ATOM 903 OD1 ASP A 800 -22.517 0.833 -1.529 1.00 25.00 O ATOM 904 OD2 ASP A 800 -23.118 2.678 -2.534 1.00 25.00 O ATOM 0 H ASP A 800 -19.021 0.595 -4.691 1.00 25.00 H new ATOM 0 HA ASP A 800 -20.109 0.204 -1.971 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -20.337 2.555 -2.691 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -21.175 2.035 -4.139 1.00 25.00 H new ATOM 909 N PRO A 801 -20.734 -1.932 -3.537 1.00 25.00 N ATOM 910 CA PRO A 801 -21.559 -3.002 -4.110 1.00 25.00 C ATOM 911 C PRO A 801 -22.878 -3.268 -3.377 1.00 25.00 C ATOM 912 O PRO A 801 -23.630 -4.151 -3.778 1.00 25.00 O ATOM 913 CB PRO A 801 -20.638 -4.223 -3.992 1.00 25.00 C ATOM 914 CG PRO A 801 -19.820 -3.938 -2.775 1.00 25.00 C ATOM 915 CD PRO A 801 -19.512 -2.480 -2.917 1.00 25.00 C ATOM 0 HA PRO A 801 -21.881 -2.745 -5.119 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -21.209 -5.145 -3.883 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -20.012 -4.338 -4.877 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -20.372 -4.148 -1.859 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -18.913 -4.542 -2.746 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -19.308 -2.016 -1.952 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -18.635 -2.313 -3.542 1.00 25.00 H new ATOM 923 N ASN A 802 -23.169 -2.535 -2.304 1.00 25.00 N ATOM 924 CA ASN A 802 -24.376 -2.794 -1.518 1.00 25.00 C ATOM 925 C ASN A 802 -25.328 -1.612 -1.684 1.00 25.00 C ATOM 926 O ASN A 802 -26.440 -1.631 -1.168 1.00 25.00 O ATOM 927 CB ASN A 802 -24.029 -3.000 -0.039 1.00 25.00 C ATOM 928 CG ASN A 802 -23.578 -4.405 0.282 1.00 25.00 C ATOM 929 OD1 ASN A 802 -24.004 -4.983 1.261 1.00 25.00 O ATOM 930 ND2 ASN A 802 -22.715 -4.951 -0.521 1.00 25.00 N ATOM 0 H ASN A 802 -22.594 -1.766 -1.961 1.00 25.00 H new ATOM 0 HA ASN A 802 -24.854 -3.707 -1.874 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -23.242 -2.301 0.242 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.902 -2.759 0.568 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -22.374 -5.895 -0.338 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -22.378 -4.436 -1.335 1.00 25.00 H new ATOM 937 N ARG A 803 -24.872 -0.602 -2.425 1.00 25.00 N ATOM 938 CA ARG A 803 -25.658 0.598 -2.759 1.00 25.00 C ATOM 939 C ARG A 803 -26.135 1.355 -1.523 1.00 25.00 C ATOM 940 O ARG A 803 -27.250 1.869 -1.487 1.00 25.00 O ATOM 941 CB ARG A 803 -26.836 0.236 -3.668 1.00 25.00 C ATOM 942 CG ARG A 803 -26.432 -0.621 -4.869 1.00 25.00 C ATOM 943 CD ARG A 803 -26.862 -2.078 -4.676 1.00 25.00 C ATOM 944 NE ARG A 803 -26.962 -2.792 -5.958 1.00 25.00 N ATOM 945 CZ ARG A 803 -28.061 -2.881 -6.699 1.00 25.00 C ATOM 946 NH1 ARG A 803 -29.196 -2.323 -6.343 1.00 25.00 N ATOM 947 NH2 ARG A 803 -28.018 -3.544 -7.821 1.00 25.00 N ATOM 0 H ARG A 803 -23.931 -0.589 -2.819 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.992 1.272 -3.297 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -27.585 -0.299 -3.084 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -27.305 1.153 -4.026 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -26.888 -0.221 -5.775 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -25.352 -0.573 -5.007 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -26.145 -2.586 -4.032 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -27.825 -2.108 -4.167 1.00 25.00 H new ATOM 0 HE ARG A 803 -26.122 -3.255 -6.305 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -29.255 -1.799 -5.470 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -30.018 -2.414 -6.940 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -27.148 -3.986 -8.119 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -28.854 -3.621 -8.400 1.00 25.00 H new ATOM 961 N LEU A 804 -25.278 1.404 -0.513 1.00 25.00 N ATOM 962 CA LEU A 804 -25.585 2.079 0.752 1.00 25.00 C ATOM 963 C LEU A 804 -24.847 3.407 0.872 1.00 25.00 C ATOM 964 O LEU A 804 -25.087 4.178 1.795 1.00 25.00 O ATOM 965 CB LEU A 804 -25.267 1.175 1.956 1.00 25.00 C ATOM 966 CG LEU A 804 -24.332 -0.027 1.756 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.886 0.359 1.552 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.408 -0.978 2.929 1.00 25.00 C ATOM 0 H LEU A 804 -24.351 0.980 -0.541 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.655 2.289 0.754 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.834 1.803 2.734 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -26.213 0.796 2.342 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.685 -0.511 0.845 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -22.285 -0.540 1.418 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.799 0.989 0.667 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.529 0.907 2.424 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.736 -1.819 2.760 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -24.114 -0.456 3.840 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -25.429 -1.345 3.034 1.00 25.00 H new ATOM 980 N GLY A 805 -23.957 3.675 -0.070 1.00 25.00 N ATOM 981 CA GLY A 805 -23.228 4.937 -0.083 1.00 25.00 C ATOM 982 C GLY A 805 -22.050 4.961 0.868 1.00 25.00 C ATOM 983 O GLY A 805 -21.594 6.028 1.288 1.00 25.00 O ATOM 0 H GLY A 805 -23.721 3.040 -0.833 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.873 5.132 -1.095 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.911 5.746 0.176 1.00 25.00 H new ATOM 987 N VAL A 806 -21.554 3.784 1.223 1.00 25.00 N ATOM 988 CA VAL A 806 -20.433 3.668 2.152 1.00 25.00 C ATOM 989 C VAL A 806 -19.512 2.531 1.701 1.00 25.00 C ATOM 990 O VAL A 806 -19.953 1.587 1.055 1.00 25.00 O ATOM 991 CB VAL A 806 -20.909 3.387 3.611 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.384 4.447 4.566 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.445 3.352 3.746 1.00 25.00 C ATOM 0 H VAL A 806 -21.910 2.891 0.882 1.00 25.00 H new ATOM 0 HA VAL A 806 -19.901 4.620 2.147 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.512 2.404 3.863 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -20.729 4.229 5.577 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.294 4.446 4.547 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -20.752 5.426 4.260 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -22.715 3.153 4.783 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -22.859 4.313 3.442 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -22.848 2.565 3.109 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.236 2.636 2.037 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.221 1.677 1.619 1.00 25.00 C ATOM 1005 C VAL A 807 -17.048 0.625 2.695 1.00 25.00 C ATOM 1006 O VAL A 807 -16.862 0.949 3.868 1.00 25.00 O ATOM 1007 CB VAL A 807 -15.870 2.408 1.397 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.796 1.461 0.891 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -16.064 3.566 0.411 1.00 25.00 C ATOM 0 H VAL A 807 -17.871 3.395 2.612 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.535 1.204 0.689 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.536 2.799 2.358 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.865 2.010 0.748 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.640 0.665 1.620 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -15.111 1.027 -0.058 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.113 4.077 0.258 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.424 3.177 -0.541 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.793 4.269 0.814 1.00 25.00 H new ATOM 1019 N THR A 808 -17.123 -0.634 2.300 1.00 25.00 N ATOM 1020 CA THR A 808 -17.020 -1.753 3.243 1.00 25.00 C ATOM 1021 C THR A 808 -15.725 -2.517 3.085 1.00 25.00 C ATOM 1022 O THR A 808 -15.025 -2.357 2.116 1.00 25.00 O ATOM 1023 CB THR A 808 -18.195 -2.766 3.088 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.710 -3.965 2.485 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.310 -2.228 2.203 1.00 25.00 C ATOM 0 H THR A 808 -17.256 -0.916 1.329 1.00 25.00 H new ATOM 0 HA THR A 808 -17.058 -1.295 4.231 1.00 25.00 H new ATOM 0 HB THR A 808 -18.593 -2.946 4.087 1.00 25.00 H new ATOM 0 HG1 THR A 808 -17.712 -4.688 3.147 1.00 25.00 H new ATOM 0 HG21 THR A 808 -20.104 -2.971 2.127 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.710 -1.312 2.638 1.00 25.00 H new ATOM 0 HG23 THR A 808 -18.915 -2.015 1.209 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.422 -3.365 4.054 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.216 -4.190 4.076 1.00 25.00 C ATOM 1035 C PHE A 809 -13.934 -4.941 2.791 1.00 25.00 C ATOM 1036 O PHE A 809 -12.804 -4.987 2.352 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.328 -5.187 5.228 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.753 -5.523 5.591 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.444 -6.546 4.909 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -16.417 -4.810 6.612 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.792 -6.843 5.224 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.762 -5.101 6.939 1.00 25.00 C ATOM 1043 CZ PHE A 809 -18.453 -6.115 6.239 1.00 25.00 C ATOM 0 H PHE A 809 -16.019 -3.505 4.869 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.379 -3.504 4.204 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.804 -6.104 4.958 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -13.824 -4.778 6.104 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -15.939 -7.109 4.138 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -15.893 -4.034 7.149 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -18.314 -7.624 4.690 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -18.260 -4.549 7.722 1.00 25.00 H new ATOM 0 HZ PHE A 809 -19.483 -6.333 6.479 1.00 25.00 H new ATOM 1053 N GLN A 810 -14.958 -5.516 2.185 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.776 -6.281 0.953 1.00 25.00 C ATOM 1055 C GLN A 810 -14.585 -5.344 -0.236 1.00 25.00 C ATOM 1056 O GLN A 810 -14.156 -5.750 -1.304 1.00 25.00 O ATOM 1057 CB GLN A 810 -15.982 -7.210 0.748 1.00 25.00 C ATOM 1058 CG GLN A 810 -17.292 -6.492 0.389 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.465 -6.899 1.280 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -18.555 -8.025 1.730 1.00 25.00 O ATOM 1061 NE2 GLN A 810 -19.359 -5.971 1.541 1.00 25.00 N ATOM 0 H GLN A 810 -15.921 -5.471 2.519 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.877 -6.892 1.033 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.745 -7.921 -0.043 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -16.138 -7.787 1.659 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -17.142 -5.415 0.467 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -17.543 -6.705 -0.650 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -19.253 -5.036 1.147 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -20.158 -6.186 2.137 1.00 25.00 H new ATOM 1070 N ALA A 811 -14.929 -4.084 -0.023 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.857 -3.058 -1.051 1.00 25.00 C ATOM 1072 C ALA A 811 -13.500 -2.364 -1.052 1.00 25.00 C ATOM 1073 O ALA A 811 -12.973 -2.011 -2.088 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.943 -2.050 -0.817 1.00 25.00 C ATOM 0 H ALA A 811 -15.269 -3.742 0.876 1.00 25.00 H new ATOM 0 HA ALA A 811 -14.989 -3.533 -2.023 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.894 -1.278 -1.585 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.914 -2.544 -0.860 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.811 -1.595 0.164 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.946 -2.164 0.135 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.652 -1.490 0.272 1.00 25.00 C ATOM 1082 C PHE A 812 -10.560 -2.228 -0.509 1.00 25.00 C ATOM 1083 O PHE A 812 -9.614 -1.624 -1.006 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.208 -1.428 1.731 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.970 -0.469 2.569 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.738 0.914 2.522 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.921 -0.958 3.436 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.509 1.781 3.333 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.698 -0.123 4.230 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.511 1.237 4.172 1.00 25.00 C ATOM 0 H PHE A 812 -13.366 -2.456 1.017 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.787 -0.483 -0.122 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.299 -2.423 2.167 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -10.152 -1.160 1.765 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.975 1.315 1.871 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -13.068 -2.026 3.501 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.335 2.847 3.312 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.445 -0.541 4.889 1.00 25.00 H new ATOM 0 HZ PHE A 812 -14.130 1.892 4.768 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.701 -3.542 -0.597 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.704 -4.411 -1.233 1.00 25.00 C ATOM 1102 C ILE A 813 -9.525 -4.066 -2.697 1.00 25.00 C ATOM 1103 O ILE A 813 -8.440 -4.186 -3.256 1.00 25.00 O ATOM 1104 CB ILE A 813 -10.128 -5.893 -1.116 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.488 -6.236 0.344 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -9.020 -6.833 -1.662 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.521 -5.674 1.457 1.00 25.00 C ATOM 0 H ILE A 813 -11.510 -4.044 -0.230 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.758 -4.254 -0.715 1.00 25.00 H new ATOM 0 HB ILE A 813 -11.017 -6.047 -1.728 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.492 -5.863 0.545 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.526 -7.321 0.440 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.343 -7.870 -1.568 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.834 -6.605 -2.711 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -8.104 -6.686 -1.090 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -9.879 -5.982 2.439 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.516 -6.066 1.298 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.498 -4.586 1.404 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.605 -3.616 -3.301 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.584 -3.180 -4.701 1.00 25.00 C ATOM 1121 C ASP A 814 -9.435 -2.179 -4.912 1.00 25.00 C ATOM 1122 O ASP A 814 -8.657 -2.279 -5.861 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.929 -2.535 -5.049 1.00 25.00 C ATOM 1124 CG ASP A 814 -12.311 -2.715 -6.514 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -11.467 -3.164 -7.317 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -13.472 -2.412 -6.858 1.00 25.00 O ATOM 0 H ASP A 814 -11.517 -3.539 -2.851 1.00 25.00 H new ATOM 0 HA ASP A 814 -10.423 -4.037 -5.355 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.707 -2.967 -4.420 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.887 -1.471 -4.818 1.00 25.00 H new ATOM 1131 N PHE A 815 -9.306 -1.228 -3.992 1.00 25.00 N ATOM 1132 CA PHE A 815 -8.213 -0.256 -4.058 1.00 25.00 C ATOM 1133 C PHE A 815 -6.885 -0.905 -3.657 1.00 25.00 C ATOM 1134 O PHE A 815 -5.865 -0.702 -4.282 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.493 0.927 -3.132 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.733 2.165 -3.500 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -6.322 2.227 -3.403 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.430 3.296 -3.958 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.635 3.390 -3.782 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.748 4.451 -4.320 1.00 25.00 C ATOM 1141 CZ PHE A 815 -6.359 4.501 -4.246 1.00 25.00 C ATOM 0 H PHE A 815 -9.936 -1.107 -3.199 1.00 25.00 H new ATOM 0 HA PHE A 815 -8.142 0.097 -5.087 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.560 1.147 -3.149 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -8.241 0.646 -2.109 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.771 1.374 -3.035 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.507 3.267 -4.029 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.558 3.431 -3.718 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -8.299 5.315 -4.661 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.836 5.397 -4.546 1.00 25.00 H new ATOM 1151 N MET A 816 -6.912 -1.701 -2.606 1.00 25.00 N ATOM 1152 CA MET A 816 -5.718 -2.384 -2.113 1.00 25.00 C ATOM 1153 C MET A 816 -5.014 -3.257 -3.161 1.00 25.00 C ATOM 1154 O MET A 816 -3.828 -3.473 -3.094 1.00 25.00 O ATOM 1155 CB MET A 816 -6.147 -3.300 -0.998 1.00 25.00 C ATOM 1156 CG MET A 816 -5.215 -3.390 0.202 1.00 25.00 C ATOM 1157 SD MET A 816 -3.536 -3.857 -0.081 1.00 25.00 S ATOM 1158 CE MET A 816 -2.821 -2.385 0.343 1.00 25.00 C ATOM 0 H MET A 816 -7.756 -1.896 -2.067 1.00 25.00 H new ATOM 0 HA MET A 816 -5.015 -1.609 -1.808 1.00 25.00 H new ATOM 0 HB2 MET A 816 -7.126 -2.974 -0.646 1.00 25.00 H new ATOM 0 HB3 MET A 816 -6.273 -4.302 -1.409 1.00 25.00 H new ATOM 0 HG2 MET A 816 -5.212 -2.418 0.695 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.645 -4.103 0.905 1.00 25.00 H new ATOM 0 HE1 MET A 816 -1.828 -2.321 -0.102 1.00 25.00 H new ATOM 0 HE2 MET A 816 -3.436 -1.563 -0.023 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.737 -2.320 1.428 1.00 25.00 H new ATOM 1168 N SER A 817 -5.732 -3.792 -4.132 1.00 25.00 N ATOM 1169 CA SER A 817 -5.058 -4.587 -5.154 1.00 25.00 C ATOM 1170 C SER A 817 -4.526 -3.696 -6.275 1.00 25.00 C ATOM 1171 O SER A 817 -3.625 -4.086 -7.018 1.00 25.00 O ATOM 1172 CB SER A 817 -5.974 -5.671 -5.679 1.00 25.00 C ATOM 1173 OG SER A 817 -5.283 -6.518 -6.582 1.00 25.00 O ATOM 0 H SER A 817 -6.742 -3.700 -4.238 1.00 25.00 H new ATOM 0 HA SER A 817 -4.198 -5.079 -4.699 1.00 25.00 H new ATOM 0 HB2 SER A 817 -6.364 -6.258 -4.848 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.830 -5.219 -6.179 1.00 25.00 H new ATOM 0 HG SER A 817 -5.891 -7.213 -6.909 1.00 25.00 H new ATOM 1179 N ARG A 818 -5.075 -2.494 -6.379 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.611 -1.494 -7.362 1.00 25.00 C ATOM 1181 C ARG A 818 -3.286 -0.925 -6.894 1.00 25.00 C ATOM 1182 O ARG A 818 -2.460 -0.504 -7.688 1.00 25.00 O ATOM 1183 CB ARG A 818 -5.606 -0.333 -7.473 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.810 -0.614 -8.347 1.00 25.00 C ATOM 1185 CD ARG A 818 -6.425 -0.530 -9.823 1.00 25.00 C ATOM 1186 NE ARG A 818 -5.864 0.802 -10.147 1.00 25.00 N ATOM 1187 CZ ARG A 818 -5.066 1.084 -11.170 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -4.705 0.174 -12.044 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -4.612 2.302 -11.312 1.00 25.00 N ATOM 0 H ARG A 818 -5.848 -2.175 -5.795 1.00 25.00 H new ATOM 0 HA ARG A 818 -4.515 -1.984 -8.331 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.953 -0.072 -6.473 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -5.084 0.539 -7.867 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -7.207 -1.604 -8.124 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -7.601 0.103 -8.129 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -5.694 -1.304 -10.057 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -7.301 -0.721 -10.443 1.00 25.00 H new ATOM 0 HE ARG A 818 -6.114 1.573 -9.528 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -5.039 -0.785 -11.949 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -4.090 0.426 -12.818 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -4.872 3.025 -10.640 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -3.998 2.530 -12.094 1.00 25.00 H new ATOM 1203 N GLU A 819 -3.125 -0.946 -5.585 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.948 -0.463 -4.864 1.00 25.00 C ATOM 1205 C GLU A 819 -0.634 -1.142 -5.294 1.00 25.00 C ATOM 1206 O GLU A 819 0.446 -0.649 -5.029 1.00 25.00 O ATOM 1207 CB GLU A 819 -2.235 -0.756 -3.400 1.00 25.00 C ATOM 1208 CG GLU A 819 -1.217 -0.337 -2.390 1.00 25.00 C ATOM 1209 CD GLU A 819 -1.836 0.261 -1.112 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -3.030 0.663 -1.121 1.00 25.00 O ATOM 1211 OE2 GLU A 819 -1.128 0.297 -0.084 1.00 25.00 O ATOM 0 H GLU A 819 -3.841 -1.316 -4.960 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.794 0.595 -5.073 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -3.179 -0.276 -3.142 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -2.385 -1.831 -3.297 1.00 25.00 H new ATOM 0 HG2 GLU A 819 -0.607 -1.199 -2.121 1.00 25.00 H new ATOM 0 HG3 GLU A 819 -0.550 0.398 -2.840 1.00 25.00 H new ATOM 1218 N THR A 820 -0.736 -2.273 -5.981 1.00 25.00 N ATOM 1219 CA THR A 820 0.449 -2.987 -6.469 1.00 25.00 C ATOM 1220 C THR A 820 1.135 -2.237 -7.625 1.00 25.00 C ATOM 1221 O THR A 820 2.201 -2.644 -8.103 1.00 25.00 O ATOM 1222 CB THR A 820 0.082 -4.412 -6.945 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.940 -4.347 -7.947 1.00 25.00 O ATOM 1224 CG2 THR A 820 -0.447 -5.253 -5.787 1.00 25.00 C ATOM 0 H THR A 820 -1.623 -2.719 -6.215 1.00 25.00 H new ATOM 0 HA THR A 820 1.142 -3.048 -5.630 1.00 25.00 H new ATOM 0 HB THR A 820 0.986 -4.869 -7.349 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.816 -4.260 -7.516 1.00 25.00 H new ATOM 0 HG21 THR A 820 -0.698 -6.251 -6.147 1.00 25.00 H new ATOM 0 HG22 THR A 820 0.317 -5.328 -5.013 1.00 25.00 H new ATOM 0 HG23 THR A 820 -1.338 -4.782 -5.373 1.00 25.00 H new ATOM 1232 N ALA A 821 0.531 -1.139 -8.063 1.00 25.00 N ATOM 1233 CA ALA A 821 1.110 -0.289 -9.093 1.00 25.00 C ATOM 1234 C ALA A 821 1.966 0.779 -8.399 1.00 25.00 C ATOM 1235 O ALA A 821 1.640 1.236 -7.315 1.00 25.00 O ATOM 1236 CB ALA A 821 0.001 0.369 -9.922 1.00 25.00 C ATOM 0 H ALA A 821 -0.371 -0.814 -7.715 1.00 25.00 H new ATOM 0 HA ALA A 821 1.726 -0.881 -9.770 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.447 1.002 -10.689 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.605 -0.403 -10.396 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.628 0.976 -9.271 1.00 25.00 H new ATOM 1242 N ASP A 822 3.051 1.175 -9.041 1.00 25.00 N ATOM 1243 CA ASP A 822 3.942 2.187 -8.473 1.00 25.00 C ATOM 1244 C ASP A 822 3.256 3.548 -8.466 1.00 25.00 C ATOM 1245 O ASP A 822 2.565 3.902 -9.428 1.00 25.00 O ATOM 1246 CB ASP A 822 5.213 2.262 -9.304 1.00 25.00 C ATOM 1247 CG ASP A 822 6.441 2.478 -8.464 1.00 25.00 C ATOM 1248 OD1 ASP A 822 6.360 3.117 -7.409 1.00 25.00 O ATOM 1249 OD2 ASP A 822 7.509 1.972 -8.877 1.00 25.00 O ATOM 0 H ASP A 822 3.340 0.817 -9.951 1.00 25.00 H new ATOM 0 HA ASP A 822 4.188 1.911 -7.448 1.00 25.00 H new ATOM 0 HB2 ASP A 822 5.325 1.340 -9.874 1.00 25.00 H new ATOM 0 HB3 ASP A 822 5.123 3.074 -10.026 1.00 25.00 H new ATOM 1254 N THR A 823 3.434 4.299 -7.388 1.00 25.00 N ATOM 1255 CA THR A 823 2.774 5.602 -7.229 1.00 25.00 C ATOM 1256 C THR A 823 3.667 6.606 -6.491 1.00 25.00 C ATOM 1257 O THR A 823 4.502 6.224 -5.695 1.00 25.00 O ATOM 1258 CB THR A 823 1.431 5.463 -6.448 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.828 4.199 -6.740 1.00 25.00 O ATOM 1260 CG2 THR A 823 0.435 6.538 -6.850 1.00 25.00 C ATOM 0 H THR A 823 4.030 4.033 -6.604 1.00 25.00 H new ATOM 0 HA THR A 823 2.577 5.972 -8.235 1.00 25.00 H new ATOM 0 HB THR A 823 1.667 5.558 -5.388 1.00 25.00 H new ATOM 0 HG1 THR A 823 -0.014 4.116 -6.246 1.00 25.00 H new ATOM 0 HG21 THR A 823 -0.488 6.408 -6.285 1.00 25.00 H new ATOM 0 HG22 THR A 823 0.855 7.521 -6.638 1.00 25.00 H new ATOM 0 HG23 THR A 823 0.222 6.457 -7.916 1.00 25.00 H new ATOM 1268 N ASP A 824 3.474 7.892 -6.752 1.00 25.00 N ATOM 1269 CA ASP A 824 4.233 8.958 -6.076 1.00 25.00 C ATOM 1270 C ASP A 824 3.915 8.975 -4.575 1.00 25.00 C ATOM 1271 O ASP A 824 4.793 9.011 -3.716 1.00 25.00 O ATOM 1272 CB ASP A 824 3.835 10.299 -6.698 1.00 25.00 C ATOM 1273 CG ASP A 824 4.669 11.459 -6.182 1.00 25.00 C ATOM 1274 OD1 ASP A 824 5.870 11.528 -6.517 1.00 25.00 O ATOM 1275 OD2 ASP A 824 4.115 12.313 -5.459 1.00 25.00 O ATOM 0 H ASP A 824 2.794 8.233 -7.432 1.00 25.00 H new ATOM 0 HA ASP A 824 5.301 8.780 -6.199 1.00 25.00 H new ATOM 0 HB2 ASP A 824 3.939 10.237 -7.781 1.00 25.00 H new ATOM 0 HB3 ASP A 824 2.783 10.493 -6.489 1.00 25.00 H new ATOM 1280 N THR A 825 2.628 8.917 -4.280 1.00 25.00 N ATOM 1281 CA THR A 825 2.100 8.880 -2.922 1.00 25.00 C ATOM 1282 C THR A 825 2.486 7.604 -2.179 1.00 25.00 C ATOM 1283 O THR A 825 2.364 7.532 -0.954 1.00 25.00 O ATOM 1284 CB THR A 825 0.587 8.959 -3.005 1.00 25.00 C ATOM 1285 OG1 THR A 825 0.214 8.708 -4.362 1.00 25.00 O ATOM 1286 CG2 THR A 825 0.080 10.330 -2.629 1.00 25.00 C ATOM 0 H THR A 825 1.901 8.894 -4.995 1.00 25.00 H new ATOM 0 HA THR A 825 2.523 9.719 -2.369 1.00 25.00 H new ATOM 0 HB THR A 825 0.159 8.232 -2.315 1.00 25.00 H new ATOM 0 HG1 THR A 825 -0.580 8.133 -4.382 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.008 10.348 -2.700 1.00 25.00 H new ATOM 0 HG22 THR A 825 0.380 10.561 -1.607 1.00 25.00 H new ATOM 0 HG23 THR A 825 0.500 11.072 -3.308 1.00 25.00 H new ATOM 1294 N ALA A 826 2.937 6.594 -2.912 1.00 25.00 N ATOM 1295 CA ALA A 826 3.302 5.313 -2.318 1.00 25.00 C ATOM 1296 C ALA A 826 4.494 5.447 -1.359 1.00 25.00 C ATOM 1297 O ALA A 826 4.680 4.605 -0.496 1.00 25.00 O ATOM 1298 CB ALA A 826 3.605 4.284 -3.415 1.00 25.00 C ATOM 0 H ALA A 826 3.059 6.637 -3.924 1.00 25.00 H new ATOM 0 HA ALA A 826 2.451 4.966 -1.732 1.00 25.00 H new ATOM 0 HB1 ALA A 826 3.876 3.333 -2.957 1.00 25.00 H new ATOM 0 HB2 ALA A 826 2.722 4.147 -4.040 1.00 25.00 H new ATOM 0 HB3 ALA A 826 4.432 4.640 -4.029 1.00 25.00 H new ATOM 1304 N ASP A 827 5.276 6.509 -1.483 1.00 25.00 N ATOM 1305 CA ASP A 827 6.409 6.738 -0.570 1.00 25.00 C ATOM 1306 C ASP A 827 5.914 6.777 0.876 1.00 25.00 C ATOM 1307 O ASP A 827 6.568 6.303 1.804 1.00 25.00 O ATOM 1308 CB ASP A 827 7.077 8.077 -0.892 1.00 25.00 C ATOM 1309 CG ASP A 827 8.231 8.395 0.051 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.314 7.786 -0.090 1.00 25.00 O ATOM 1311 OD2 ASP A 827 8.054 9.271 0.931 1.00 25.00 O ATOM 0 H ASP A 827 5.157 7.227 -2.198 1.00 25.00 H new ATOM 0 HA ASP A 827 7.125 5.926 -0.696 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.445 8.058 -1.918 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.335 8.873 -0.834 1.00 25.00 H new ATOM 1316 N GLN A 828 4.730 7.341 1.054 1.00 25.00 N ATOM 1317 CA GLN A 828 4.144 7.498 2.376 1.00 25.00 C ATOM 1318 C GLN A 828 3.785 6.168 3.005 1.00 25.00 C ATOM 1319 O GLN A 828 3.940 5.983 4.211 1.00 25.00 O ATOM 1320 CB GLN A 828 2.849 8.289 2.279 1.00 25.00 C ATOM 1321 CG GLN A 828 2.945 9.593 1.496 1.00 25.00 C ATOM 1322 CD GLN A 828 1.585 10.219 1.322 1.00 25.00 C ATOM 1323 OE1 GLN A 828 1.360 11.379 1.639 1.00 25.00 O ATOM 1324 NE2 GLN A 828 0.664 9.442 0.825 1.00 25.00 N ATOM 0 H GLN A 828 4.152 7.700 0.294 1.00 25.00 H new ATOM 0 HA GLN A 828 4.892 8.006 2.984 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.091 7.659 1.814 1.00 25.00 H new ATOM 0 HB3 GLN A 828 2.502 8.514 3.288 1.00 25.00 H new ATOM 0 HG2 GLN A 828 3.605 10.287 2.017 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.390 9.403 0.519 1.00 25.00 H new ATOM 0 HE21 GLN A 828 0.890 8.480 0.573 1.00 25.00 H new ATOM 0 HE22 GLN A 828 -0.283 9.796 0.688 1.00 25.00 H new ATOM 1333 N VAL A 829 3.278 5.243 2.199 1.00 25.00 N ATOM 1334 CA VAL A 829 2.839 3.963 2.734 1.00 25.00 C ATOM 1335 C VAL A 829 4.062 3.050 2.901 1.00 25.00 C ATOM 1336 O VAL A 829 4.159 2.285 3.863 1.00 25.00 O ATOM 1337 CB VAL A 829 1.693 3.307 1.874 1.00 25.00 C ATOM 1338 CG1 VAL A 829 2.117 3.021 0.448 1.00 25.00 C ATOM 1339 CG2 VAL A 829 1.198 2.028 2.517 1.00 25.00 C ATOM 0 H VAL A 829 3.162 5.352 1.191 1.00 25.00 H new ATOM 0 HA VAL A 829 2.387 4.123 3.713 1.00 25.00 H new ATOM 0 HB VAL A 829 0.886 4.039 1.840 1.00 25.00 H new ATOM 0 HG11 VAL A 829 1.286 2.570 -0.095 1.00 25.00 H new ATOM 0 HG12 VAL A 829 2.406 3.952 -0.039 1.00 25.00 H new ATOM 0 HG13 VAL A 829 2.964 2.335 0.451 1.00 25.00 H new ATOM 0 HG21 VAL A 829 0.408 1.595 1.904 1.00 25.00 H new ATOM 0 HG22 VAL A 829 2.022 1.320 2.600 1.00 25.00 H new ATOM 0 HG23 VAL A 829 0.807 2.248 3.511 1.00 25.00 H new ATOM 1349 N MET A 830 5.010 3.156 1.976 1.00 25.00 N ATOM 1350 CA MET A 830 6.231 2.351 2.010 1.00 25.00 C ATOM 1351 C MET A 830 7.122 2.738 3.181 1.00 25.00 C ATOM 1352 O MET A 830 8.025 1.996 3.537 1.00 25.00 O ATOM 1353 CB MET A 830 7.024 2.533 0.719 1.00 25.00 C ATOM 1354 CG MET A 830 6.404 1.880 -0.505 1.00 25.00 C ATOM 1355 SD MET A 830 7.378 2.250 -1.986 1.00 25.00 S ATOM 1356 CE MET A 830 8.762 1.111 -1.840 1.00 25.00 C ATOM 0 H MET A 830 4.957 3.798 1.185 1.00 25.00 H new ATOM 0 HA MET A 830 5.926 1.311 2.122 1.00 25.00 H new ATOM 0 HB2 MET A 830 7.138 3.600 0.526 1.00 25.00 H new ATOM 0 HB3 MET A 830 8.025 2.126 0.863 1.00 25.00 H new ATOM 0 HG2 MET A 830 6.349 0.801 -0.360 1.00 25.00 H new ATOM 0 HG3 MET A 830 5.382 2.237 -0.636 1.00 25.00 H new ATOM 0 HE1 MET A 830 9.691 1.637 -2.062 1.00 25.00 H new ATOM 0 HE2 MET A 830 8.802 0.716 -0.825 1.00 25.00 H new ATOM 0 HE3 MET A 830 8.633 0.289 -2.545 1.00 25.00 H new ATOM 1366 N ALA A 831 6.857 3.886 3.795 1.00 25.00 N ATOM 1367 CA ALA A 831 7.612 4.362 4.958 1.00 25.00 C ATOM 1368 C ALA A 831 7.703 3.303 6.075 1.00 25.00 C ATOM 1369 O ALA A 831 8.588 3.372 6.943 1.00 25.00 O ATOM 1370 CB ALA A 831 6.980 5.651 5.489 1.00 25.00 C ATOM 0 H ALA A 831 6.111 4.517 3.503 1.00 25.00 H new ATOM 0 HA ALA A 831 8.633 4.561 4.631 1.00 25.00 H new ATOM 0 HB1 ALA A 831 7.543 6.003 6.354 1.00 25.00 H new ATOM 0 HB2 ALA A 831 6.998 6.413 4.710 1.00 25.00 H new ATOM 0 HB3 ALA A 831 5.948 5.456 5.782 1.00 25.00 H new ATOM 1376 N SER A 832 6.808 2.322 6.039 1.00 25.00 N ATOM 1377 CA SER A 832 6.820 1.197 6.967 1.00 25.00 C ATOM 1378 C SER A 832 8.177 0.488 7.001 1.00 25.00 C ATOM 1379 O SER A 832 8.548 -0.070 8.038 1.00 25.00 O ATOM 1380 CB SER A 832 5.752 0.189 6.548 1.00 25.00 C ATOM 1381 OG SER A 832 6.021 -0.291 5.242 1.00 25.00 O ATOM 0 H SER A 832 6.048 2.285 5.360 1.00 25.00 H new ATOM 0 HA SER A 832 6.620 1.591 7.963 1.00 25.00 H new ATOM 0 HB2 SER A 832 5.730 -0.643 7.252 1.00 25.00 H new ATOM 0 HB3 SER A 832 4.768 0.657 6.576 1.00 25.00 H new ATOM 0 HG SER A 832 6.365 -1.207 5.295 1.00 25.00 H new ATOM 1387 N PHE A 833 8.941 0.519 5.910 1.00 25.00 N ATOM 1388 CA PHE A 833 10.256 -0.125 5.914 1.00 25.00 C ATOM 1389 C PHE A 833 11.196 0.473 6.975 1.00 25.00 C ATOM 1390 O PHE A 833 12.113 -0.197 7.441 1.00 25.00 O ATOM 1391 CB PHE A 833 10.916 -0.174 4.513 1.00 25.00 C ATOM 1392 CG PHE A 833 10.967 1.158 3.753 1.00 25.00 C ATOM 1393 CD1 PHE A 833 11.464 2.351 4.330 1.00 25.00 C ATOM 1394 CD2 PHE A 833 10.538 1.198 2.410 1.00 25.00 C ATOM 1395 CE1 PHE A 833 11.503 3.558 3.589 1.00 25.00 C ATOM 1396 CE2 PHE A 833 10.592 2.404 1.660 1.00 25.00 C ATOM 1397 CZ PHE A 833 11.064 3.581 2.256 1.00 25.00 C ATOM 0 H PHE A 833 8.683 0.970 5.033 1.00 25.00 H new ATOM 0 HA PHE A 833 10.075 -1.162 6.197 1.00 25.00 H new ATOM 0 HB2 PHE A 833 11.934 -0.546 4.625 1.00 25.00 H new ATOM 0 HB3 PHE A 833 10.377 -0.899 3.903 1.00 25.00 H new ATOM 0 HD1 PHE A 833 11.819 2.341 5.350 1.00 25.00 H new ATOM 0 HD2 PHE A 833 10.163 0.299 1.945 1.00 25.00 H new ATOM 0 HE1 PHE A 833 11.871 4.462 4.051 1.00 25.00 H new ATOM 0 HE2 PHE A 833 10.269 2.413 0.630 1.00 25.00 H new ATOM 0 HZ PHE A 833 11.090 4.502 1.692 1.00 25.00 H new ATOM 1407 N LYS A 834 10.972 1.715 7.392 1.00 25.00 N ATOM 1408 CA LYS A 834 11.826 2.322 8.414 1.00 25.00 C ATOM 1409 C LYS A 834 11.425 1.780 9.772 1.00 25.00 C ATOM 1410 O LYS A 834 12.268 1.559 10.635 1.00 25.00 O ATOM 1411 CB LYS A 834 11.711 3.856 8.393 1.00 25.00 C ATOM 1412 CG LYS A 834 12.537 4.577 9.486 1.00 25.00 C ATOM 1413 CD LYS A 834 14.023 4.410 9.336 1.00 25.00 C ATOM 1414 CE LYS A 834 14.576 4.344 10.721 1.00 25.00 C ATOM 1415 NZ LYS A 834 16.022 3.942 10.777 1.00 25.00 N ATOM 0 H LYS A 834 10.222 2.314 7.048 1.00 25.00 H new ATOM 0 HA LYS A 834 12.866 2.069 8.207 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.031 4.218 7.416 1.00 25.00 H new ATOM 0 HB3 LYS A 834 10.662 4.131 8.508 1.00 25.00 H new ATOM 0 HG2 LYS A 834 12.297 5.640 9.467 1.00 25.00 H new ATOM 0 HG3 LYS A 834 12.236 4.200 10.463 1.00 25.00 H new ATOM 0 HD2 LYS A 834 14.259 3.503 8.779 1.00 25.00 H new ATOM 0 HD3 LYS A 834 14.455 5.245 8.784 1.00 25.00 H new ATOM 0 HE2 LYS A 834 14.461 5.319 11.195 1.00 25.00 H new ATOM 0 HE3 LYS A 834 13.988 3.635 11.304 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 16.169 3.282 11.568 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.288 3.478 9.885 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 16.612 4.787 10.917 1.00 25.00 H new ATOM 1429 N ILE A 835 10.133 1.556 9.950 1.00 25.00 N ATOM 1430 CA ILE A 835 9.606 1.037 11.208 1.00 25.00 C ATOM 1431 C ILE A 835 10.088 -0.401 11.374 1.00 25.00 C ATOM 1432 O ILE A 835 10.520 -0.797 12.455 1.00 25.00 O ATOM 1433 CB ILE A 835 8.033 1.110 11.244 1.00 25.00 C ATOM 1434 CG1 ILE A 835 7.567 2.571 11.433 1.00 25.00 C ATOM 1435 CG2 ILE A 835 7.465 0.262 12.404 1.00 25.00 C ATOM 1436 CD1 ILE A 835 7.364 3.371 10.147 1.00 25.00 C ATOM 0 H ILE A 835 9.424 1.726 9.237 1.00 25.00 H new ATOM 0 HA ILE A 835 9.970 1.648 12.034 1.00 25.00 H new ATOM 0 HB ILE A 835 7.665 0.719 10.295 1.00 25.00 H new ATOM 0 HG12 ILE A 835 6.629 2.565 11.988 1.00 25.00 H new ATOM 0 HG13 ILE A 835 8.300 3.090 12.051 1.00 25.00 H new ATOM 0 HG21 ILE A 835 6.377 0.330 12.406 1.00 25.00 H new ATOM 0 HG22 ILE A 835 7.763 -0.778 12.274 1.00 25.00 H new ATOM 0 HG23 ILE A 835 7.853 0.635 13.352 1.00 25.00 H new ATOM 0 HD11 ILE A 835 7.037 4.381 10.395 1.00 25.00 H new ATOM 0 HD12 ILE A 835 8.303 3.418 9.596 1.00 25.00 H new ATOM 0 HD13 ILE A 835 6.606 2.885 9.532 1.00 25.00 H new ATOM 1448 N LEU A 836 10.030 -1.172 10.297 1.00 25.00 N ATOM 1449 CA LEU A 836 10.485 -2.561 10.318 1.00 25.00 C ATOM 1450 C LEU A 836 11.970 -2.674 10.620 1.00 25.00 C ATOM 1451 O LEU A 836 12.387 -3.502 11.427 1.00 25.00 O ATOM 1452 CB LEU A 836 10.292 -3.183 8.950 1.00 25.00 C ATOM 1453 CG LEU A 836 9.004 -3.905 8.584 1.00 25.00 C ATOM 1454 CD1 LEU A 836 9.120 -4.208 7.106 1.00 25.00 C ATOM 1455 CD2 LEU A 836 8.830 -5.203 9.387 1.00 25.00 C ATOM 0 H LEU A 836 9.672 -0.861 9.394 1.00 25.00 H new ATOM 0 HA LEU A 836 9.905 -3.062 11.092 1.00 25.00 H new ATOM 0 HB2 LEU A 836 10.430 -2.388 8.217 1.00 25.00 H new ATOM 0 HB3 LEU A 836 11.106 -3.893 8.806 1.00 25.00 H new ATOM 0 HG LEU A 836 8.133 -3.291 8.814 1.00 25.00 H new ATOM 0 HD11 LEU A 836 8.224 -4.730 6.770 1.00 25.00 H new ATOM 0 HD12 LEU A 836 9.227 -3.276 6.551 1.00 25.00 H new ATOM 0 HD13 LEU A 836 9.993 -4.836 6.931 1.00 25.00 H new ATOM 0 HD21 LEU A 836 7.898 -5.689 9.096 1.00 25.00 H new ATOM 0 HD22 LEU A 836 9.667 -5.872 9.184 1.00 25.00 H new ATOM 0 HD23 LEU A 836 8.801 -4.971 10.452 1.00 25.00 H new ATOM 1467 N ALA A 837 12.769 -1.852 9.950 1.00 25.00 N ATOM 1468 CA ALA A 837 14.214 -1.886 10.132 1.00 25.00 C ATOM 1469 C ALA A 837 14.527 -1.457 11.575 1.00 25.00 C ATOM 1470 O ALA A 837 15.388 -2.022 12.254 1.00 25.00 O ATOM 1471 CB ALA A 837 14.906 -0.926 9.114 1.00 25.00 C ATOM 0 H ALA A 837 12.442 -1.157 9.279 1.00 25.00 H new ATOM 0 HA ALA A 837 14.593 -2.893 9.955 1.00 25.00 H new ATOM 0 HB1 ALA A 837 15.986 -0.959 9.259 1.00 25.00 H new ATOM 0 HB2 ALA A 837 14.666 -1.239 8.098 1.00 25.00 H new ATOM 0 HB3 ALA A 837 14.550 0.092 9.274 1.00 25.00 H new ATOM 1477 N GLY A 838 13.828 -0.440 12.039 1.00 25.00 N ATOM 1478 CA GLY A 838 14.092 0.096 13.354 1.00 25.00 C ATOM 1479 C GLY A 838 15.299 1.003 13.266 1.00 25.00 C ATOM 1480 O GLY A 838 15.162 2.162 12.899 1.00 25.00 O ATOM 0 H GLY A 838 13.079 0.027 11.528 1.00 25.00 H new ATOM 0 HA2 GLY A 838 13.227 0.650 13.718 1.00 25.00 H new ATOM 0 HA3 GLY A 838 14.275 -0.711 14.063 1.00 25.00 H new ATOM 1484 N ASP A 839 16.478 0.494 13.596 1.00 25.00 N ATOM 1485 CA ASP A 839 17.698 1.311 13.566 1.00 25.00 C ATOM 1486 C ASP A 839 18.751 0.786 12.596 1.00 25.00 C ATOM 1487 O ASP A 839 19.844 1.335 12.492 1.00 25.00 O ATOM 1488 CB ASP A 839 18.282 1.432 14.978 1.00 25.00 C ATOM 1489 CG ASP A 839 18.315 2.876 15.477 1.00 25.00 C ATOM 1490 OD1 ASP A 839 18.313 3.817 14.648 1.00 25.00 O ATOM 1491 OD2 ASP A 839 18.332 3.066 16.711 1.00 25.00 O ATOM 0 H ASP A 839 16.622 -0.473 13.887 1.00 25.00 H new ATOM 0 HA ASP A 839 17.409 2.296 13.200 1.00 25.00 H new ATOM 0 HB2 ASP A 839 17.690 0.827 15.665 1.00 25.00 H new ATOM 0 HB3 ASP A 839 19.293 1.025 14.985 1.00 25.00 H new ATOM 1496 N LYS A 840 18.445 -0.291 11.886 1.00 25.00 N ATOM 1497 CA LYS A 840 19.439 -0.889 10.992 1.00 25.00 C ATOM 1498 C LYS A 840 19.442 -0.087 9.696 1.00 25.00 C ATOM 1499 O LYS A 840 18.456 0.559 9.368 1.00 25.00 O ATOM 1500 CB LYS A 840 19.170 -2.379 10.780 1.00 25.00 C ATOM 1501 CG LYS A 840 17.806 -2.691 10.266 1.00 25.00 C ATOM 1502 CD LYS A 840 17.422 -4.156 10.447 1.00 25.00 C ATOM 1503 CE LYS A 840 17.963 -5.052 9.344 1.00 25.00 C ATOM 1504 NZ LYS A 840 17.437 -6.436 9.486 1.00 25.00 N ATOM 0 H LYS A 840 17.541 -0.763 11.906 1.00 25.00 H new ATOM 0 HA LYS A 840 20.434 -0.842 11.434 1.00 25.00 H new ATOM 0 HB2 LYS A 840 19.908 -2.773 10.081 1.00 25.00 H new ATOM 0 HB3 LYS A 840 19.317 -2.901 11.726 1.00 25.00 H new ATOM 0 HG2 LYS A 840 17.078 -2.064 10.780 1.00 25.00 H new ATOM 0 HG3 LYS A 840 17.755 -2.436 9.207 1.00 25.00 H new ATOM 0 HD2 LYS A 840 17.795 -4.508 11.409 1.00 25.00 H new ATOM 0 HD3 LYS A 840 16.336 -4.240 10.476 1.00 25.00 H new ATOM 0 HE2 LYS A 840 17.683 -4.649 8.371 1.00 25.00 H new ATOM 0 HE3 LYS A 840 19.052 -5.066 9.381 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 17.749 -7.011 8.677 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 17.796 -6.855 10.368 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 16.398 -6.411 9.512 1.00 25.00 H new ATOM 1518 N ASN A 841 20.553 -0.109 8.978 1.00 25.00 N ATOM 1519 CA ASN A 841 20.718 0.705 7.767 1.00 25.00 C ATOM 1520 C ASN A 841 20.226 0.051 6.479 1.00 25.00 C ATOM 1521 O ASN A 841 20.369 0.624 5.413 1.00 25.00 O ATOM 1522 CB ASN A 841 22.200 1.027 7.575 1.00 25.00 C ATOM 1523 CG ASN A 841 22.986 -0.159 7.205 1.00 25.00 C ATOM 1524 OD1 ASN A 841 23.112 -1.128 7.940 1.00 25.00 O ATOM 1525 ND2 ASN A 841 23.514 -0.096 6.045 1.00 25.00 N ATOM 0 H ASN A 841 21.364 -0.683 9.208 1.00 25.00 H new ATOM 0 HA ASN A 841 20.105 1.591 7.933 1.00 25.00 H new ATOM 0 HB2 ASN A 841 22.307 1.787 6.801 1.00 25.00 H new ATOM 0 HB3 ASN A 841 22.599 1.452 8.496 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.070 -0.876 5.695 1.00 25.00 H new ATOM 0 HD22 ASN A 841 23.380 0.735 5.468 1.00 25.00 H new ATOM 1532 N TYR A 842 19.664 -1.141 6.571 1.00 25.00 N ATOM 1533 CA TYR A 842 19.182 -1.853 5.390 1.00 25.00 C ATOM 1534 C TYR A 842 17.999 -2.675 5.859 1.00 25.00 C ATOM 1535 O TYR A 842 17.873 -2.899 7.039 1.00 25.00 O ATOM 1536 CB TYR A 842 20.277 -2.768 4.823 1.00 25.00 C ATOM 1537 CG TYR A 842 20.510 -4.020 5.647 1.00 25.00 C ATOM 1538 CD1 TYR A 842 21.385 -4.014 6.753 1.00 25.00 C ATOM 1539 CD2 TYR A 842 19.857 -5.227 5.318 1.00 25.00 C ATOM 1540 CE1 TYR A 842 21.596 -5.194 7.519 1.00 25.00 C ATOM 1541 CE2 TYR A 842 20.074 -6.403 6.068 1.00 25.00 C ATOM 1542 CZ TYR A 842 20.937 -6.375 7.166 1.00 25.00 C ATOM 1543 OH TYR A 842 21.137 -7.515 7.901 1.00 25.00 O ATOM 0 H TYR A 842 19.528 -1.641 7.450 1.00 25.00 H new ATOM 0 HA TYR A 842 18.904 -1.162 4.595 1.00 25.00 H new ATOM 0 HB2 TYR A 842 20.007 -3.057 3.807 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.209 -2.207 4.758 1.00 25.00 H new ATOM 0 HD1 TYR A 842 21.900 -3.104 7.021 1.00 25.00 H new ATOM 0 HD2 TYR A 842 19.179 -5.251 4.478 1.00 25.00 H new ATOM 0 HE1 TYR A 842 22.262 -5.177 8.369 1.00 25.00 H new ATOM 0 HE2 TYR A 842 19.575 -7.321 5.794 1.00 25.00 H new ATOM 0 HH TYR A 842 20.604 -8.245 7.523 1.00 25.00 H new ATOM 1553 N ILE A 843 17.151 -3.129 4.958 1.00 25.00 N ATOM 1554 CA ILE A 843 16.026 -3.990 5.301 1.00 25.00 C ATOM 1555 C ILE A 843 16.297 -5.327 4.652 1.00 25.00 C ATOM 1556 O ILE A 843 16.990 -5.396 3.635 1.00 25.00 O ATOM 1557 CB ILE A 843 14.676 -3.393 4.778 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.483 -3.963 5.554 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.486 -3.602 3.275 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.352 -3.296 6.851 1.00 25.00 C ATOM 0 H ILE A 843 17.219 -2.913 3.963 1.00 25.00 H new ATOM 0 HA ILE A 843 15.929 -4.084 6.383 1.00 25.00 H new ATOM 0 HB ILE A 843 14.725 -2.318 4.950 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.568 -3.831 4.976 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.615 -5.035 5.701 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.535 -3.169 2.965 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.299 -3.117 2.735 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.489 -4.669 3.053 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.501 -3.712 7.390 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.260 -3.451 7.433 1.00 25.00 H new ATOM 0 HD13 ILE A 843 13.197 -2.228 6.697 1.00 25.00 H new ATOM 1572 N THR A 844 15.763 -6.398 5.200 1.00 25.00 N ATOM 1573 CA THR A 844 15.890 -7.679 4.524 1.00 25.00 C ATOM 1574 C THR A 844 14.651 -7.849 3.656 1.00 25.00 C ATOM 1575 O THR A 844 13.581 -7.340 3.980 1.00 25.00 O ATOM 1576 CB THR A 844 16.013 -8.880 5.490 1.00 25.00 C ATOM 1577 OG1 THR A 844 14.827 -9.004 6.269 1.00 25.00 O ATOM 1578 CG2 THR A 844 17.185 -8.723 6.430 1.00 25.00 C ATOM 0 H THR A 844 15.252 -6.415 6.083 1.00 25.00 H new ATOM 0 HA THR A 844 16.811 -7.671 3.942 1.00 25.00 H new ATOM 0 HB THR A 844 16.166 -9.770 4.879 1.00 25.00 H new ATOM 0 HG1 THR A 844 14.913 -9.768 6.877 1.00 25.00 H new ATOM 0 HG21 THR A 844 17.238 -9.587 7.093 1.00 25.00 H new ATOM 0 HG22 THR A 844 18.107 -8.651 5.853 1.00 25.00 H new ATOM 0 HG23 THR A 844 17.057 -7.818 7.023 1.00 25.00 H new ATOM 1586 N MET A 845 14.785 -8.582 2.562 1.00 25.00 N ATOM 1587 CA MET A 845 13.640 -8.922 1.720 1.00 25.00 C ATOM 1588 C MET A 845 12.592 -9.646 2.556 1.00 25.00 C ATOM 1589 O MET A 845 11.400 -9.520 2.328 1.00 25.00 O ATOM 1590 CB MET A 845 14.088 -9.839 0.584 1.00 25.00 C ATOM 1591 CG MET A 845 15.089 -9.193 -0.329 1.00 25.00 C ATOM 1592 SD MET A 845 15.543 -10.230 -1.711 1.00 25.00 S ATOM 1593 CE MET A 845 16.759 -9.169 -2.468 1.00 25.00 C ATOM 0 H MET A 845 15.675 -8.955 2.233 1.00 25.00 H new ATOM 0 HA MET A 845 13.217 -8.006 1.306 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.521 -10.746 1.006 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.217 -10.142 0.003 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.678 -8.256 -0.704 1.00 25.00 H new ATOM 0 HG3 MET A 845 15.984 -8.943 0.241 1.00 25.00 H new ATOM 0 HE1 MET A 845 17.436 -9.768 -3.077 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.259 -8.434 -3.098 1.00 25.00 H new ATOM 0 HE3 MET A 845 17.327 -8.656 -1.692 1.00 25.00 H new ATOM 1603 N ASP A 846 13.064 -10.402 3.534 1.00 25.00 N ATOM 1604 CA ASP A 846 12.204 -11.146 4.443 1.00 25.00 C ATOM 1605 C ASP A 846 11.383 -10.235 5.342 1.00 25.00 C ATOM 1606 O ASP A 846 10.261 -10.563 5.678 1.00 25.00 O ATOM 1607 CB ASP A 846 13.062 -12.069 5.303 1.00 25.00 C ATOM 1608 CG ASP A 846 13.731 -13.155 4.485 1.00 25.00 C ATOM 1609 OD1 ASP A 846 14.808 -12.880 3.915 1.00 25.00 O ATOM 1610 OD2 ASP A 846 13.181 -14.273 4.381 1.00 25.00 O ATOM 0 H ASP A 846 14.060 -10.518 3.721 1.00 25.00 H new ATOM 0 HA ASP A 846 11.504 -11.722 3.838 1.00 25.00 H new ATOM 0 HB2 ASP A 846 13.824 -11.481 5.816 1.00 25.00 H new ATOM 0 HB3 ASP A 846 12.441 -12.527 6.073 1.00 25.00 H new ATOM 1615 N GLU A 847 11.934 -9.090 5.722 1.00 25.00 N ATOM 1616 CA GLU A 847 11.204 -8.134 6.559 1.00 25.00 C ATOM 1617 C GLU A 847 10.060 -7.513 5.761 1.00 25.00 C ATOM 1618 O GLU A 847 8.959 -7.355 6.276 1.00 25.00 O ATOM 1619 CB GLU A 847 12.152 -7.063 7.142 1.00 25.00 C ATOM 1620 CG GLU A 847 12.862 -7.594 8.407 1.00 25.00 C ATOM 1621 CD GLU A 847 14.250 -7.002 8.683 1.00 25.00 C ATOM 1622 OE1 GLU A 847 14.806 -6.236 7.868 1.00 25.00 O ATOM 1623 OE2 GLU A 847 14.808 -7.341 9.752 1.00 25.00 O ATOM 0 H GLU A 847 12.878 -8.797 5.468 1.00 25.00 H new ATOM 0 HA GLU A 847 10.774 -8.665 7.408 1.00 25.00 H new ATOM 0 HB2 GLU A 847 12.893 -6.780 6.394 1.00 25.00 H new ATOM 0 HB3 GLU A 847 11.587 -6.164 7.386 1.00 25.00 H new ATOM 0 HG2 GLU A 847 12.225 -7.398 9.269 1.00 25.00 H new ATOM 0 HG3 GLU A 847 12.958 -8.676 8.321 1.00 25.00 H new ATOM 1630 N LEU A 848 10.299 -7.195 4.497 1.00 25.00 N ATOM 1631 CA LEU A 848 9.230 -6.659 3.646 1.00 25.00 C ATOM 1632 C LEU A 848 8.175 -7.742 3.434 1.00 25.00 C ATOM 1633 O LEU A 848 6.983 -7.486 3.471 1.00 25.00 O ATOM 1634 CB LEU A 848 9.794 -6.210 2.298 1.00 25.00 C ATOM 1635 CG LEU A 848 10.768 -5.023 2.376 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.483 -4.881 1.051 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.049 -3.719 2.723 1.00 25.00 C ATOM 0 H LEU A 848 11.205 -7.294 4.038 1.00 25.00 H new ATOM 0 HA LEU A 848 8.780 -5.794 4.134 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.306 -7.053 1.834 1.00 25.00 H new ATOM 0 HB3 LEU A 848 8.965 -5.941 1.644 1.00 25.00 H new ATOM 0 HG LEU A 848 11.486 -5.222 3.172 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.176 -4.041 1.099 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.036 -5.795 0.836 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.753 -4.705 0.261 1.00 25.00 H new ATOM 0 HD21 LEU A 848 10.773 -2.905 2.768 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.304 -3.500 1.958 1.00 25.00 H new ATOM 0 HD23 LEU A 848 9.557 -3.821 3.690 1.00 25.00 H new ATOM 1649 N ARG A 849 8.633 -8.969 3.242 1.00 25.00 N ATOM 1650 CA ARG A 849 7.750 -10.133 3.066 1.00 25.00 C ATOM 1651 C ARG A 849 7.134 -10.604 4.388 1.00 25.00 C ATOM 1652 O ARG A 849 6.590 -11.704 4.464 1.00 25.00 O ATOM 1653 CB ARG A 849 8.555 -11.281 2.450 1.00 25.00 C ATOM 1654 CG ARG A 849 8.793 -11.134 0.945 1.00 25.00 C ATOM 1655 CD ARG A 849 9.918 -12.048 0.461 1.00 25.00 C ATOM 1656 NE ARG A 849 9.972 -13.300 1.239 1.00 25.00 N ATOM 1657 CZ ARG A 849 11.059 -13.794 1.824 1.00 25.00 C ATOM 1658 NH1 ARG A 849 12.236 -13.235 1.710 1.00 25.00 N ATOM 1659 NH2 ARG A 849 10.959 -14.870 2.549 1.00 25.00 N ATOM 0 H ARG A 849 9.627 -9.196 3.202 1.00 25.00 H new ATOM 0 HA ARG A 849 6.932 -9.833 2.411 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.518 -11.348 2.955 1.00 25.00 H new ATOM 0 HB3 ARG A 849 8.032 -12.219 2.635 1.00 25.00 H new ATOM 0 HG2 ARG A 849 7.875 -11.369 0.406 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.041 -10.098 0.715 1.00 25.00 H new ATOM 0 HD2 ARG A 849 9.771 -12.280 -0.594 1.00 25.00 H new ATOM 0 HD3 ARG A 849 10.872 -11.527 0.542 1.00 25.00 H new ATOM 0 HE ARG A 849 9.106 -13.829 1.336 1.00 25.00 H new ATOM 0 HH11 ARG A 849 12.346 -12.386 1.155 1.00 25.00 H new ATOM 0 HH12 ARG A 849 13.044 -13.648 2.176 1.00 25.00 H new ATOM 0 HH21 ARG A 849 10.054 -15.325 2.664 1.00 25.00 H new ATOM 0 HH22 ARG A 849 11.786 -15.258 3.003 1.00 25.00 H new ATOM 1673 N ARG A 850 7.226 -9.783 5.423 1.00 25.00 N ATOM 1674 CA ARG A 850 6.687 -10.133 6.740 1.00 25.00 C ATOM 1675 C ARG A 850 5.502 -9.246 7.022 1.00 25.00 C ATOM 1676 O ARG A 850 4.525 -9.684 7.611 1.00 25.00 O ATOM 1677 CB ARG A 850 7.757 -9.950 7.814 1.00 25.00 C ATOM 1678 CG ARG A 850 7.358 -10.400 9.191 1.00 25.00 C ATOM 1679 CD ARG A 850 8.470 -10.058 10.152 1.00 25.00 C ATOM 1680 NE ARG A 850 8.150 -10.467 11.527 1.00 25.00 N ATOM 1681 CZ ARG A 850 8.922 -10.248 12.583 1.00 25.00 C ATOM 1682 NH1 ARG A 850 10.076 -9.629 12.491 1.00 25.00 N ATOM 1683 NH2 ARG A 850 8.526 -10.661 13.756 1.00 25.00 N ATOM 0 H ARG A 850 7.669 -8.865 5.382 1.00 25.00 H new ATOM 0 HA ARG A 850 6.376 -11.178 6.749 1.00 25.00 H new ATOM 0 HB2 ARG A 850 8.650 -10.498 7.513 1.00 25.00 H new ATOM 0 HB3 ARG A 850 8.030 -8.896 7.858 1.00 25.00 H new ATOM 0 HG2 ARG A 850 6.432 -9.911 9.495 1.00 25.00 H new ATOM 0 HG3 ARG A 850 7.169 -11.473 9.198 1.00 25.00 H new ATOM 0 HD2 ARG A 850 9.390 -10.548 9.832 1.00 25.00 H new ATOM 0 HD3 ARG A 850 8.655 -8.984 10.126 1.00 25.00 H new ATOM 0 HE ARG A 850 7.268 -10.956 11.681 1.00 25.00 H new ATOM 0 HH11 ARG A 850 10.406 -9.298 11.584 1.00 25.00 H new ATOM 0 HH12 ARG A 850 10.642 -9.479 13.326 1.00 25.00 H new ATOM 0 HH21 ARG A 850 7.633 -11.145 13.852 1.00 25.00 H new ATOM 0 HH22 ARG A 850 9.109 -10.500 14.577 1.00 25.00 H new ATOM 1697 N GLU A 851 5.592 -8.000 6.586 1.00 25.00 N ATOM 1698 CA GLU A 851 4.473 -7.074 6.721 1.00 25.00 C ATOM 1699 C GLU A 851 3.559 -7.233 5.513 1.00 25.00 C ATOM 1700 O GLU A 851 2.361 -7.035 5.610 1.00 25.00 O ATOM 1701 CB GLU A 851 4.966 -5.626 6.835 1.00 25.00 C ATOM 1702 CG GLU A 851 5.837 -5.143 5.673 1.00 25.00 C ATOM 1703 CD GLU A 851 6.189 -3.664 5.793 1.00 25.00 C ATOM 1704 OE1 GLU A 851 5.889 -3.063 6.847 1.00 25.00 O ATOM 1705 OE2 GLU A 851 6.777 -3.103 4.847 1.00 25.00 O ATOM 0 H GLU A 851 6.420 -7.606 6.139 1.00 25.00 H new ATOM 0 HA GLU A 851 3.924 -7.304 7.634 1.00 25.00 H new ATOM 0 HB2 GLU A 851 4.100 -4.969 6.917 1.00 25.00 H new ATOM 0 HB3 GLU A 851 5.533 -5.523 7.760 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.754 -5.731 5.639 1.00 25.00 H new ATOM 0 HG3 GLU A 851 5.313 -5.315 4.733 1.00 25.00 H new ATOM 1712 N LEU A 852 4.139 -7.605 4.379 1.00 25.00 N ATOM 1713 CA LEU A 852 3.385 -7.789 3.149 1.00 25.00 C ATOM 1714 C LEU A 852 3.541 -9.219 2.624 1.00 25.00 C ATOM 1715 O LEU A 852 4.459 -9.512 1.867 1.00 25.00 O ATOM 1716 CB LEU A 852 3.877 -6.823 2.051 1.00 25.00 C ATOM 1717 CG LEU A 852 3.492 -5.329 1.995 1.00 25.00 C ATOM 1718 CD1 LEU A 852 2.862 -4.733 3.198 1.00 25.00 C ATOM 1719 CD2 LEU A 852 4.736 -4.524 1.615 1.00 25.00 C ATOM 0 H LEU A 852 5.139 -7.786 4.287 1.00 25.00 H new ATOM 0 HA LEU A 852 2.339 -7.587 3.381 1.00 25.00 H new ATOM 0 HB2 LEU A 852 4.966 -6.858 2.077 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.566 -7.256 1.100 1.00 25.00 H new ATOM 0 HG LEU A 852 2.698 -5.280 1.250 1.00 25.00 H new ATOM 0 HD11 LEU A 852 2.647 -3.680 3.013 1.00 25.00 H new ATOM 0 HD12 LEU A 852 1.934 -5.259 3.421 1.00 25.00 H new ATOM 0 HD13 LEU A 852 3.541 -4.821 4.046 1.00 25.00 H new ATOM 0 HD21 LEU A 852 4.484 -3.464 1.570 1.00 25.00 H new ATOM 0 HD22 LEU A 852 5.513 -4.681 2.363 1.00 25.00 H new ATOM 0 HD23 LEU A 852 5.098 -4.852 0.641 1.00 25.00 H new ATOM 1731 N PRO A 853 2.624 -10.130 2.985 1.00 25.00 N ATOM 1732 CA PRO A 853 2.703 -11.400 2.245 1.00 25.00 C ATOM 1733 C PRO A 853 2.407 -11.378 0.694 1.00 25.00 C ATOM 1734 O PRO A 853 2.829 -12.300 -0.004 1.00 25.00 O ATOM 1735 CB PRO A 853 1.696 -12.285 2.992 1.00 25.00 C ATOM 1736 CG PRO A 853 0.702 -11.331 3.568 1.00 25.00 C ATOM 1737 CD PRO A 853 1.505 -10.114 3.951 1.00 25.00 C ATOM 0 HA PRO A 853 3.737 -11.746 2.237 1.00 25.00 H new ATOM 0 HB2 PRO A 853 1.218 -12.995 2.318 1.00 25.00 H new ATOM 0 HB3 PRO A 853 2.185 -12.867 3.774 1.00 25.00 H new ATOM 0 HG2 PRO A 853 -0.071 -11.081 2.842 1.00 25.00 H new ATOM 0 HG3 PRO A 853 0.199 -11.761 4.434 1.00 25.00 H new ATOM 0 HD2 PRO A 853 0.916 -9.201 3.869 1.00 25.00 H new ATOM 0 HD3 PRO A 853 1.860 -10.173 4.980 1.00 25.00 H new ATOM 1745 N PRO A 854 1.680 -10.364 0.138 1.00 25.00 N ATOM 1746 CA PRO A 854 1.424 -10.389 -1.310 1.00 25.00 C ATOM 1747 C PRO A 854 2.513 -9.807 -2.232 1.00 25.00 C ATOM 1748 O PRO A 854 3.635 -9.534 -1.825 1.00 25.00 O ATOM 1749 CB PRO A 854 0.208 -9.475 -1.404 1.00 25.00 C ATOM 1750 CG PRO A 854 0.465 -8.504 -0.477 1.00 25.00 C ATOM 1751 CD PRO A 854 1.009 -9.174 0.698 1.00 25.00 C ATOM 0 HA PRO A 854 1.338 -11.422 -1.647 1.00 25.00 H new ATOM 0 HB2 PRO A 854 0.098 -9.056 -2.404 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.715 -10.010 -1.179 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.174 -7.774 -0.868 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.445 -7.960 -0.225 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.709 -8.535 1.236 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.224 -9.450 1.402 1.00 25.00 H new ATOM 1759 N ASP A 855 2.102 -9.580 -3.479 1.00 25.00 N ATOM 1760 CA ASP A 855 2.885 -8.917 -4.538 1.00 25.00 C ATOM 1761 C ASP A 855 3.480 -7.582 -4.077 1.00 25.00 C ATOM 1762 O ASP A 855 4.499 -7.135 -4.569 1.00 25.00 O ATOM 1763 CB ASP A 855 1.916 -8.639 -5.694 1.00 25.00 C ATOM 1764 CG ASP A 855 2.581 -8.611 -7.054 1.00 25.00 C ATOM 1765 OD1 ASP A 855 3.791 -8.393 -7.168 1.00 25.00 O ATOM 1766 OD2 ASP A 855 1.850 -8.849 -8.043 1.00 25.00 O ATOM 0 H ASP A 855 1.176 -9.863 -3.799 1.00 25.00 H new ATOM 0 HA ASP A 855 3.715 -9.563 -4.822 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.138 -9.403 -5.696 1.00 25.00 H new ATOM 0 HB3 ASP A 855 1.423 -7.682 -5.521 1.00 25.00 H new ATOM 1771 N GLN A 856 2.824 -6.961 -3.105 1.00 25.00 N ATOM 1772 CA GLN A 856 3.252 -5.682 -2.546 1.00 25.00 C ATOM 1773 C GLN A 856 4.709 -5.778 -2.056 1.00 25.00 C ATOM 1774 O GLN A 856 5.481 -4.834 -2.184 1.00 25.00 O ATOM 1775 CB GLN A 856 2.327 -5.314 -1.389 1.00 25.00 C ATOM 1776 CG GLN A 856 0.801 -5.312 -1.695 1.00 25.00 C ATOM 1777 CD GLN A 856 0.302 -4.076 -2.377 1.00 25.00 C ATOM 1778 OE1 GLN A 856 1.045 -3.354 -3.003 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -0.980 -3.838 -2.265 1.00 25.00 N ATOM 0 H GLN A 856 1.975 -7.332 -2.679 1.00 25.00 H new ATOM 0 HA GLN A 856 3.200 -4.910 -3.314 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.510 -6.010 -0.571 1.00 25.00 H new ATOM 0 HB3 GLN A 856 2.605 -4.322 -1.032 1.00 25.00 H new ATOM 0 HG2 GLN A 856 0.568 -6.174 -2.320 1.00 25.00 H new ATOM 0 HG3 GLN A 856 0.256 -5.440 -0.759 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -1.571 -4.472 -1.728 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -1.388 -3.018 -2.715 1.00 25.00 H new ATOM 1788 N ALA A 857 5.094 -6.925 -1.511 1.00 25.00 N ATOM 1789 CA ALA A 857 6.453 -7.098 -1.010 1.00 25.00 C ATOM 1790 C ALA A 857 7.485 -7.130 -2.127 1.00 25.00 C ATOM 1791 O ALA A 857 8.506 -6.465 -2.048 1.00 25.00 O ATOM 1792 CB ALA A 857 6.548 -8.369 -0.211 1.00 25.00 C ATOM 0 H ALA A 857 4.492 -7.742 -1.405 1.00 25.00 H new ATOM 0 HA ALA A 857 6.672 -6.236 -0.380 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.566 -8.491 0.159 1.00 25.00 H new ATOM 0 HB2 ALA A 857 5.858 -8.321 0.632 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.289 -9.217 -0.844 1.00 25.00 H new ATOM 1798 N GLU A 858 7.235 -7.916 -3.161 1.00 25.00 N ATOM 1799 CA GLU A 858 8.207 -8.051 -4.246 1.00 25.00 C ATOM 1800 C GLU A 858 8.283 -6.778 -5.054 1.00 25.00 C ATOM 1801 O GLU A 858 9.333 -6.417 -5.564 1.00 25.00 O ATOM 1802 CB GLU A 858 7.894 -9.236 -5.139 1.00 25.00 C ATOM 1803 CG GLU A 858 6.483 -9.351 -5.611 1.00 25.00 C ATOM 1804 CD GLU A 858 6.255 -10.607 -6.423 1.00 25.00 C ATOM 1805 OE1 GLU A 858 6.784 -10.707 -7.557 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.531 -11.506 -5.941 1.00 25.00 O ATOM 0 H GLU A 858 6.383 -8.465 -3.277 1.00 25.00 H new ATOM 0 HA GLU A 858 9.181 -8.234 -3.792 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.545 -9.188 -6.012 1.00 25.00 H new ATOM 0 HB3 GLU A 858 8.150 -10.148 -4.600 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.812 -9.349 -4.752 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.231 -8.479 -6.214 1.00 25.00 H new ATOM 1813 N TYR A 859 7.162 -6.092 -5.129 1.00 25.00 N ATOM 1814 CA TYR A 859 7.107 -4.759 -5.740 1.00 25.00 C ATOM 1815 C TYR A 859 8.124 -3.875 -5.032 1.00 25.00 C ATOM 1816 O TYR A 859 9.000 -3.296 -5.671 1.00 25.00 O ATOM 1817 CB TYR A 859 5.686 -4.165 -5.641 1.00 25.00 C ATOM 1818 CG TYR A 859 5.591 -2.697 -5.206 1.00 25.00 C ATOM 1819 CD1 TYR A 859 6.225 -1.664 -5.932 1.00 25.00 C ATOM 1820 CD2 TYR A 859 4.848 -2.335 -4.063 1.00 25.00 C ATOM 1821 CE1 TYR A 859 6.098 -0.309 -5.541 1.00 25.00 C ATOM 1822 CE2 TYR A 859 4.711 -0.981 -3.679 1.00 25.00 C ATOM 1823 CZ TYR A 859 5.330 0.019 -4.429 1.00 25.00 C ATOM 1824 OH TYR A 859 5.193 1.331 -4.077 1.00 25.00 O ATOM 0 H TYR A 859 6.266 -6.428 -4.775 1.00 25.00 H new ATOM 0 HA TYR A 859 7.348 -4.823 -6.801 1.00 25.00 H new ATOM 0 HB2 TYR A 859 5.205 -4.265 -6.614 1.00 25.00 H new ATOM 0 HB3 TYR A 859 5.112 -4.768 -4.938 1.00 25.00 H new ATOM 0 HD1 TYR A 859 6.817 -1.912 -6.801 1.00 25.00 H new ATOM 0 HD2 TYR A 859 4.376 -3.105 -3.471 1.00 25.00 H new ATOM 0 HE1 TYR A 859 6.596 0.467 -6.104 1.00 25.00 H new ATOM 0 HE2 TYR A 859 4.129 -0.722 -2.807 1.00 25.00 H new ATOM 0 HH TYR A 859 5.848 1.553 -3.382 1.00 25.00 H new ATOM 1834 N CYS A 860 8.021 -3.788 -3.717 1.00 25.00 N ATOM 1835 CA CYS A 860 8.915 -2.958 -2.929 1.00 25.00 C ATOM 1836 C CYS A 860 10.363 -3.425 -3.067 1.00 25.00 C ATOM 1837 O CYS A 860 11.265 -2.612 -3.199 1.00 25.00 O ATOM 1838 CB CYS A 860 8.492 -2.997 -1.461 1.00 25.00 C ATOM 1839 SG CYS A 860 6.884 -2.244 -1.129 1.00 25.00 S ATOM 0 H CYS A 860 7.320 -4.287 -3.169 1.00 25.00 H new ATOM 0 HA CYS A 860 8.852 -1.935 -3.300 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.469 -4.035 -1.129 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.248 -2.488 -0.864 1.00 25.00 H new ATOM 0 HG CYS A 860 6.213 -2.148 -2.238 1.00 25.00 H new ATOM 1845 N ILE A 861 10.575 -4.735 -3.054 1.00 25.00 N ATOM 1846 CA ILE A 861 11.917 -5.322 -3.178 1.00 25.00 C ATOM 1847 C ILE A 861 12.556 -4.914 -4.501 1.00 25.00 C ATOM 1848 O ILE A 861 13.742 -4.601 -4.561 1.00 25.00 O ATOM 1849 CB ILE A 861 11.832 -6.891 -3.095 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.624 -7.315 -1.632 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.087 -7.581 -3.717 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.151 -8.757 -1.437 1.00 25.00 C ATOM 0 H ILE A 861 9.829 -5.424 -2.958 1.00 25.00 H new ATOM 0 HA ILE A 861 12.532 -4.951 -2.358 1.00 25.00 H new ATOM 0 HB ILE A 861 10.978 -7.221 -3.687 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.562 -7.180 -1.094 1.00 25.00 H new ATOM 0 HG13 ILE A 861 10.896 -6.645 -1.175 1.00 25.00 H new ATOM 0 HG21 ILE A 861 12.984 -8.663 -3.637 1.00 25.00 H new ATOM 0 HG22 ILE A 861 13.173 -7.301 -4.767 1.00 25.00 H new ATOM 0 HG23 ILE A 861 13.981 -7.261 -3.182 1.00 25.00 H new ATOM 0 HD11 ILE A 861 11.033 -8.961 -0.373 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.195 -8.898 -1.941 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.887 -9.442 -1.858 1.00 25.00 H new ATOM 1864 N ALA A 862 11.762 -4.919 -5.559 1.00 25.00 N ATOM 1865 CA ALA A 862 12.247 -4.623 -6.900 1.00 25.00 C ATOM 1866 C ALA A 862 12.720 -3.179 -7.058 1.00 25.00 C ATOM 1867 O ALA A 862 13.625 -2.899 -7.830 1.00 25.00 O ATOM 1868 CB ALA A 862 11.140 -4.912 -7.898 1.00 25.00 C ATOM 0 H ALA A 862 10.765 -5.128 -5.514 1.00 25.00 H new ATOM 0 HA ALA A 862 13.113 -5.258 -7.084 1.00 25.00 H new ATOM 0 HB1 ALA A 862 11.493 -4.694 -8.906 1.00 25.00 H new ATOM 0 HB2 ALA A 862 10.856 -5.962 -7.832 1.00 25.00 H new ATOM 0 HB3 ALA A 862 10.275 -4.288 -7.673 1.00 25.00 H new ATOM 1874 N ARG A 863 12.091 -2.265 -6.340 1.00 25.00 N ATOM 1875 CA ARG A 863 12.444 -0.847 -6.424 1.00 25.00 C ATOM 1876 C ARG A 863 13.488 -0.471 -5.370 1.00 25.00 C ATOM 1877 O ARG A 863 14.047 0.612 -5.399 1.00 25.00 O ATOM 1878 CB ARG A 863 11.177 0.015 -6.271 1.00 25.00 C ATOM 1879 CG ARG A 863 10.340 0.112 -7.525 1.00 25.00 C ATOM 1880 CD ARG A 863 9.252 -0.915 -7.510 1.00 25.00 C ATOM 1881 NE ARG A 863 8.264 -0.675 -8.564 1.00 25.00 N ATOM 1882 CZ ARG A 863 7.542 -1.602 -9.174 1.00 25.00 C ATOM 1883 NH1 ARG A 863 7.671 -2.883 -8.911 1.00 25.00 N ATOM 1884 NH2 ARG A 863 6.665 -1.231 -10.058 1.00 25.00 N ATOM 0 H ARG A 863 11.332 -2.473 -5.691 1.00 25.00 H new ATOM 0 HA ARG A 863 12.886 -0.658 -7.402 1.00 25.00 H new ATOM 0 HB2 ARG A 863 10.564 -0.398 -5.470 1.00 25.00 H new ATOM 0 HB3 ARG A 863 11.469 1.019 -5.964 1.00 25.00 H new ATOM 0 HG2 ARG A 863 9.906 1.109 -7.603 1.00 25.00 H new ATOM 0 HG3 ARG A 863 10.971 -0.031 -8.402 1.00 25.00 H new ATOM 0 HD2 ARG A 863 9.686 -1.907 -7.638 1.00 25.00 H new ATOM 0 HD3 ARG A 863 8.757 -0.906 -6.539 1.00 25.00 H new ATOM 0 HE ARG A 863 8.119 0.292 -8.854 1.00 25.00 H new ATOM 0 HH11 ARG A 863 8.347 -3.195 -8.214 1.00 25.00 H new ATOM 0 HH12 ARG A 863 7.095 -3.565 -9.404 1.00 25.00 H new ATOM 0 HH21 ARG A 863 6.543 -0.241 -10.271 1.00 25.00 H new ATOM 0 HH22 ARG A 863 6.099 -1.930 -10.539 1.00 25.00 H new ATOM 1898 N MET A 864 13.768 -1.363 -4.438 1.00 25.00 N ATOM 1899 CA MET A 864 14.726 -1.062 -3.379 1.00 25.00 C ATOM 1900 C MET A 864 16.178 -1.197 -3.836 1.00 25.00 C ATOM 1901 O MET A 864 16.479 -1.932 -4.770 1.00 25.00 O ATOM 1902 CB MET A 864 14.459 -1.943 -2.189 1.00 25.00 C ATOM 1903 CG MET A 864 14.641 -1.224 -0.876 1.00 25.00 C ATOM 1904 SD MET A 864 13.642 -1.911 0.423 1.00 25.00 S ATOM 1905 CE MET A 864 12.054 -1.098 0.142 1.00 25.00 C ATOM 0 H MET A 864 13.353 -2.294 -4.388 1.00 25.00 H new ATOM 0 HA MET A 864 14.588 -0.017 -3.101 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.441 -2.328 -2.249 1.00 25.00 H new ATOM 0 HB3 MET A 864 15.128 -2.803 -2.222 1.00 25.00 H new ATOM 0 HG2 MET A 864 15.690 -1.268 -0.584 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.390 -0.171 -1.005 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.334 -1.438 0.887 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.179 -0.018 0.224 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.689 -1.347 -0.855 1.00 25.00 H new ATOM 1915 N ALA A 865 17.085 -0.475 -3.186 1.00 25.00 N ATOM 1916 CA ALA A 865 18.477 -0.471 -3.614 1.00 25.00 C ATOM 1917 C ALA A 865 19.170 -1.802 -3.243 1.00 25.00 C ATOM 1918 O ALA A 865 18.959 -2.328 -2.162 1.00 25.00 O ATOM 1919 CB ALA A 865 19.221 0.732 -3.015 1.00 25.00 C ATOM 0 H ALA A 865 16.885 0.107 -2.372 1.00 25.00 H new ATOM 0 HA ALA A 865 18.504 -0.376 -4.700 1.00 25.00 H new ATOM 0 HB1 ALA A 865 20.260 0.719 -3.345 1.00 25.00 H new ATOM 0 HB2 ALA A 865 18.746 1.655 -3.347 1.00 25.00 H new ATOM 0 HB3 ALA A 865 19.186 0.677 -1.927 1.00 25.00 H new ATOM 1925 N PRO A 866 19.991 -2.359 -4.147 1.00 25.00 N ATOM 1926 CA PRO A 866 20.650 -3.665 -4.026 1.00 25.00 C ATOM 1927 C PRO A 866 21.853 -3.710 -3.084 1.00 25.00 C ATOM 1928 O PRO A 866 22.988 -3.412 -3.459 1.00 25.00 O ATOM 1929 CB PRO A 866 21.069 -3.951 -5.463 1.00 25.00 C ATOM 1930 CG PRO A 866 21.363 -2.606 -6.029 1.00 25.00 C ATOM 1931 CD PRO A 866 20.324 -1.709 -5.420 1.00 25.00 C ATOM 0 HA PRO A 866 19.980 -4.400 -3.579 1.00 25.00 H new ATOM 0 HB2 PRO A 866 21.944 -4.600 -5.502 1.00 25.00 H new ATOM 0 HB3 PRO A 866 20.276 -4.452 -6.017 1.00 25.00 H new ATOM 0 HG2 PRO A 866 22.370 -2.278 -5.772 1.00 25.00 H new ATOM 0 HG3 PRO A 866 21.296 -2.610 -7.117 1.00 25.00 H new ATOM 0 HD2 PRO A 866 20.709 -0.701 -5.264 1.00 25.00 H new ATOM 0 HD3 PRO A 866 19.448 -1.620 -6.063 1.00 25.00 H new ATOM 1939 N TYR A 867 21.602 -4.097 -1.849 1.00 25.00 N ATOM 1940 CA TYR A 867 22.668 -4.198 -0.853 1.00 25.00 C ATOM 1941 C TYR A 867 23.209 -5.619 -0.715 1.00 25.00 C ATOM 1942 O TYR A 867 22.521 -6.523 -0.267 1.00 25.00 O ATOM 1943 CB TYR A 867 22.156 -3.690 0.488 1.00 25.00 C ATOM 1944 CG TYR A 867 22.594 -2.274 0.765 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.603 -1.290 -0.261 1.00 25.00 C ATOM 1946 CD2 TYR A 867 23.017 -1.902 2.057 1.00 25.00 C ATOM 1947 CE1 TYR A 867 23.047 0.030 0.015 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.455 -0.586 2.327 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.466 0.365 1.310 1.00 25.00 C ATOM 1950 OH TYR A 867 23.882 1.636 1.601 1.00 25.00 O ATOM 0 H TYR A 867 20.675 -4.347 -1.505 1.00 25.00 H new ATOM 0 HA TYR A 867 23.500 -3.580 -1.192 1.00 25.00 H new ATOM 0 HB2 TYR A 867 21.067 -3.741 0.502 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.516 -4.342 1.283 1.00 25.00 H new ATOM 0 HD1 TYR A 867 22.270 -1.548 -1.256 1.00 25.00 H new ATOM 0 HD2 TYR A 867 23.006 -2.633 2.852 1.00 25.00 H new ATOM 0 HE1 TYR A 867 23.062 0.773 -0.769 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.781 -0.318 3.321 1.00 25.00 H new ATOM 0 HH TYR A 867 23.104 2.229 1.661 1.00 25.00 H new ATOM 2048 N GLY A 875 19.656 -11.349 0.732 1.00 25.00 N ATOM 2049 CA GLY A 875 18.392 -10.652 0.603 1.00 25.00 C ATOM 2050 C GLY A 875 18.386 -9.366 1.404 1.00 25.00 C ATOM 2051 O GLY A 875 17.511 -9.179 2.233 1.00 25.00 O ATOM 0 HA2 GLY A 875 18.203 -10.429 -0.447 1.00 25.00 H new ATOM 0 HA3 GLY A 875 17.582 -11.298 0.943 1.00 25.00 H new ATOM 2055 N ALA A 876 19.359 -8.493 1.176 1.00 25.00 N ATOM 2056 CA ALA A 876 19.458 -7.211 1.872 1.00 25.00 C ATOM 2057 C ALA A 876 19.224 -6.091 0.859 1.00 25.00 C ATOM 2058 O ALA A 876 19.693 -6.165 -0.273 1.00 25.00 O ATOM 2059 CB ALA A 876 20.841 -7.062 2.526 1.00 25.00 C ATOM 0 H ALA A 876 20.106 -8.653 0.500 1.00 25.00 H new ATOM 0 HA ALA A 876 18.707 -7.159 2.661 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.899 -6.103 3.040 1.00 25.00 H new ATOM 0 HB2 ALA A 876 20.993 -7.868 3.244 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.613 -7.110 1.758 1.00 25.00 H new ATOM 2065 N LEU A 877 18.494 -5.066 1.264 1.00 25.00 N ATOM 2066 CA LEU A 877 18.237 -3.915 0.403 1.00 25.00 C ATOM 2067 C LEU A 877 18.252 -2.616 1.192 1.00 25.00 C ATOM 2068 O LEU A 877 17.944 -2.609 2.372 1.00 25.00 O ATOM 2069 CB LEU A 877 16.875 -4.047 -0.267 1.00 25.00 C ATOM 2070 CG LEU A 877 16.590 -5.310 -1.089 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.112 -5.587 -1.028 1.00 25.00 C ATOM 2072 CD2 LEU A 877 17.074 -5.163 -2.541 1.00 25.00 C ATOM 0 H LEU A 877 18.065 -5.004 2.187 1.00 25.00 H new ATOM 0 HA LEU A 877 19.029 -3.892 -0.345 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.114 -3.977 0.510 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.742 -3.186 -0.922 1.00 25.00 H new ATOM 0 HG LEU A 877 17.141 -6.151 -0.668 1.00 25.00 H new ATOM 0 HD11 LEU A 877 14.885 -6.482 -1.607 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.813 -5.740 0.009 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.566 -4.740 -1.442 1.00 25.00 H new ATOM 0 HD21 LEU A 877 16.855 -6.078 -3.092 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.562 -4.324 -3.012 1.00 25.00 H new ATOM 0 HD23 LEU A 877 18.149 -4.983 -2.550 1.00 25.00 H new ATOM 2084 N ASP A 878 18.594 -1.514 0.548 1.00 25.00 N ATOM 2085 CA ASP A 878 18.587 -0.212 1.217 1.00 25.00 C ATOM 2086 C ASP A 878 17.229 0.427 1.093 1.00 25.00 C ATOM 2087 O ASP A 878 16.840 0.902 0.030 1.00 25.00 O ATOM 2088 CB ASP A 878 19.647 0.708 0.654 1.00 25.00 C ATOM 2089 CG ASP A 878 19.944 1.868 1.580 1.00 25.00 C ATOM 2090 OD1 ASP A 878 19.016 2.290 2.302 1.00 25.00 O ATOM 2091 OD2 ASP A 878 21.084 2.368 1.587 1.00 25.00 O ATOM 0 H ASP A 878 18.879 -1.487 -0.431 1.00 25.00 H new ATOM 0 HA ASP A 878 18.814 -0.377 2.270 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.562 0.142 0.478 1.00 25.00 H new ATOM 0 HB3 ASP A 878 19.318 1.091 -0.312 1.00 25.00 H new ATOM 2096 N TYR A 879 16.508 0.420 2.200 1.00 25.00 N ATOM 2097 CA TYR A 879 15.163 0.955 2.240 1.00 25.00 C ATOM 2098 C TYR A 879 15.136 2.480 2.106 1.00 25.00 C ATOM 2099 O TYR A 879 14.190 3.033 1.584 1.00 25.00 O ATOM 2100 CB TYR A 879 14.481 0.520 3.530 1.00 25.00 C ATOM 2101 CG TYR A 879 15.128 1.039 4.795 1.00 25.00 C ATOM 2102 CD1 TYR A 879 14.817 2.318 5.296 1.00 25.00 C ATOM 2103 CD2 TYR A 879 16.050 0.251 5.504 1.00 25.00 C ATOM 2104 CE1 TYR A 879 15.425 2.804 6.472 1.00 25.00 C ATOM 2105 CE2 TYR A 879 16.655 0.729 6.688 1.00 25.00 C ATOM 2106 CZ TYR A 879 16.335 2.004 7.162 1.00 25.00 C ATOM 2107 OH TYR A 879 16.912 2.464 8.316 1.00 25.00 O ATOM 0 H TYR A 879 16.837 0.046 3.090 1.00 25.00 H new ATOM 0 HA TYR A 879 14.621 0.556 1.383 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.443 0.853 3.506 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.465 -0.569 3.567 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.103 2.936 4.772 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.300 -0.734 5.139 1.00 25.00 H new ATOM 0 HE1 TYR A 879 15.187 3.792 6.837 1.00 25.00 H new ATOM 0 HE2 TYR A 879 17.361 0.112 7.224 1.00 25.00 H new ATOM 0 HH TYR A 879 17.644 1.867 8.576 1.00 25.00 H new ATOM 2117 N MET A 880 16.169 3.157 2.597 1.00 25.00 N ATOM 2118 CA MET A 880 16.207 4.626 2.577 1.00 25.00 C ATOM 2119 C MET A 880 16.927 5.208 1.360 1.00 25.00 C ATOM 2120 O MET A 880 16.739 6.372 1.033 1.00 25.00 O ATOM 2121 CB MET A 880 16.800 5.166 3.884 1.00 25.00 C ATOM 2122 CG MET A 880 18.155 4.603 4.245 1.00 25.00 C ATOM 2123 SD MET A 880 18.721 5.179 5.852 1.00 25.00 S ATOM 2124 CE MET A 880 20.253 4.268 5.972 1.00 25.00 C ATOM 0 H MET A 880 16.991 2.719 3.013 1.00 25.00 H new ATOM 0 HA MET A 880 15.172 4.958 2.490 1.00 25.00 H new ATOM 0 HB2 MET A 880 16.881 6.250 3.809 1.00 25.00 H new ATOM 0 HB3 MET A 880 16.106 4.954 4.697 1.00 25.00 H new ATOM 0 HG2 MET A 880 18.106 3.514 4.248 1.00 25.00 H new ATOM 0 HG3 MET A 880 18.880 4.887 3.482 1.00 25.00 H new ATOM 0 HE1 MET A 880 20.744 4.505 6.916 1.00 25.00 H new ATOM 0 HE2 MET A 880 20.045 3.199 5.929 1.00 25.00 H new ATOM 0 HE3 MET A 880 20.906 4.544 5.144 1.00 25.00 H new ATOM 2134 N SER A 881 17.736 4.400 0.688 1.00 25.00 N ATOM 2135 CA SER A 881 18.428 4.836 -0.536 1.00 25.00 C ATOM 2136 C SER A 881 17.843 4.096 -1.733 1.00 25.00 C ATOM 2137 O SER A 881 18.462 4.004 -2.797 1.00 25.00 O ATOM 2138 CB SER A 881 19.934 4.591 -0.442 1.00 25.00 C ATOM 2139 OG SER A 881 20.617 5.212 -1.521 1.00 25.00 O ATOM 0 H SER A 881 17.935 3.438 0.963 1.00 25.00 H new ATOM 0 HA SER A 881 18.279 5.909 -0.658 1.00 25.00 H new ATOM 0 HB2 SER A 881 20.311 4.979 0.504 1.00 25.00 H new ATOM 0 HB3 SER A 881 20.133 3.519 -0.449 1.00 25.00 H new ATOM 0 HG SER A 881 20.148 5.018 -2.360 1.00 25.00 H new ATOM 2145 N PHE A 882 16.648 3.564 -1.533 1.00 25.00 N ATOM 2146 CA PHE A 882 15.891 2.884 -2.581 1.00 25.00 C ATOM 2147 C PHE A 882 15.668 3.746 -3.826 1.00 25.00 C ATOM 2148 O PHE A 882 15.822 4.968 -3.802 1.00 25.00 O ATOM 2149 CB PHE A 882 14.518 2.468 -2.023 1.00 25.00 C ATOM 2150 CG PHE A 882 13.499 3.584 -1.980 1.00 25.00 C ATOM 2151 CD1 PHE A 882 13.591 4.628 -1.038 1.00 25.00 C ATOM 2152 CD2 PHE A 882 12.422 3.584 -2.890 1.00 25.00 C ATOM 2153 CE1 PHE A 882 12.614 5.654 -0.996 1.00 25.00 C ATOM 2154 CE2 PHE A 882 11.441 4.604 -2.857 1.00 25.00 C ATOM 2155 CZ PHE A 882 11.535 5.637 -1.902 1.00 25.00 C ATOM 0 H PHE A 882 16.169 3.590 -0.633 1.00 25.00 H new ATOM 0 HA PHE A 882 16.483 2.020 -2.885 1.00 25.00 H new ATOM 0 HB2 PHE A 882 14.123 1.655 -2.632 1.00 25.00 H new ATOM 0 HB3 PHE A 882 14.652 2.076 -1.015 1.00 25.00 H new ATOM 0 HD1 PHE A 882 14.415 4.647 -0.340 1.00 25.00 H new ATOM 0 HD2 PHE A 882 12.344 2.794 -3.623 1.00 25.00 H new ATOM 0 HE1 PHE A 882 12.697 6.449 -0.270 1.00 25.00 H new ATOM 0 HE2 PHE A 882 10.623 4.591 -3.562 1.00 25.00 H new ATOM 0 HZ PHE A 882 10.783 6.412 -1.865 1.00 25.00 H new