USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 903 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 810 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 850 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 795 SER OG : rot 103:sc= 0.734 USER MOD Set 2.2: A 804 GLN : amide:sc= 0.65 K(o=1.4,f=0.86) USER MOD Set 3.1: A 775 MET CE :methyl 180:sc= -1.17 (180deg=-0.829) USER MOD Set 3.2: A 776 GLN : amide:sc= -0.344 K(o=-1.5,f=-5.7!) USER MOD Single : A 781 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 786 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 789 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 793 THR OG1 : rot 180:sc= 0 USER MOD Single : A 802 ASN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 806 HIS : no HD1:sc= -0.182 X(o=-0.18,f=-0.064) USER MOD Single : A 808 SER OG : rot -87:sc= 1.14 USER MOD Single : A 811 TYR OH : rot 180:sc= 0 USER MOD Single : A 817 THR OG1 : rot -49:sc= 0.013 USER MOD Single : A 823 LYS NZ :NH3+ 142:sc= 1.23 (180deg=-0.807) USER MOD Single : A 826 TYR OH : rot 180:sc= 0 USER MOD Single : A 827 THR OG1 : rot 71:sc= 1.23 USER MOD Single : A 831 THR OG1 : rot 74:sc= 0.752 USER MOD Single : A 832 SER OG : rot 180:sc= 0 USER MOD Single : A 839 GLN : amide:sc= -0.602 K(o=-0.6,f=-1.2!) USER MOD Single : A 840 THR OG1 : rot 91:sc= 1.23 USER MOD Single : A 842 HIS : no HE2:sc= 1.14 K(o=1.1,f=-5.1!) USER MOD Single : A 845 LYS NZ :NH3+ -158:sc= 1.11 (180deg=-0.213!) USER MOD Single : A 852 ASN : amide:sc= 0.2 X(o=0.2,f=-0.064) USER MOD Single : A 857 LYS NZ :NH3+ -157:sc= -0.0826 (180deg=-0.446) USER MOD Single : A 858 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 860 CYS SG : rot 70:sc= 1.21 USER MOD Single : A 862 THR OG1 : rot 180:sc= 0.0196 USER MOD Single : A 865 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 870 LYS NZ :NH3+ 151:sc= -0.16 (180deg=-0.726) USER MOD Single : A 877 LYS NZ :NH3+ -160:sc= -0.857! (180deg=-2.06!) USER MOD Single : A 878 TYR OH : rot 180:sc= 0 USER MOD Single : A 880 SER OG : rot 48:sc= 0.669 USER MOD Single : A 884 SER OG : rot 31:sc= -0.265 USER MOD Single : A 885 TYR OH : rot -30:sc= -0.0395 USER MOD Single : A 887 LYS NZ :NH3+ -94:sc= 1.16 (180deg=0.161) USER MOD Single : A 888 SER OG : rot 45:sc= 0.998 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 775 -46.784 -19.565 -10.862 1.00 0.00 N ATOM 2 CA MET A 775 -47.564 -18.476 -11.487 1.00 0.00 C ATOM 3 C MET A 775 -48.041 -17.507 -10.416 1.00 0.00 C ATOM 4 O MET A 775 -47.865 -17.775 -9.229 1.00 0.00 O ATOM 5 CB MET A 775 -48.762 -19.053 -12.244 1.00 0.00 C ATOM 6 CG MET A 775 -49.036 -18.365 -13.570 1.00 0.00 C ATOM 7 SD MET A 775 -50.350 -19.164 -14.514 1.00 0.00 S ATOM 8 CE MET A 775 -51.597 -19.394 -13.245 1.00 0.00 C ATOM 0 HA MET A 775 -46.928 -17.943 -12.194 1.00 0.00 H new ATOM 0 HB2 MET A 775 -48.590 -20.114 -12.424 1.00 0.00 H new ATOM 0 HB3 MET A 775 -49.649 -18.976 -11.615 1.00 0.00 H new ATOM 0 HG2 MET A 775 -49.308 -17.326 -13.385 1.00 0.00 H new ATOM 0 HG3 MET A 775 -48.122 -18.355 -14.164 1.00 0.00 H new ATOM 0 HE1 MET A 775 -52.472 -19.878 -13.678 1.00 0.00 H new ATOM 0 HE2 MET A 775 -51.194 -20.019 -12.448 1.00 0.00 H new ATOM 0 HE3 MET A 775 -51.884 -18.425 -12.837 1.00 0.00 H new ATOM 20 N GLN A 776 -48.633 -16.390 -10.847 1.00 0.00 N ATOM 21 CA GLN A 776 -49.170 -15.373 -9.941 1.00 0.00 C ATOM 22 C GLN A 776 -48.062 -14.655 -9.173 1.00 0.00 C ATOM 23 O GLN A 776 -47.403 -15.243 -8.308 1.00 0.00 O ATOM 24 CB GLN A 776 -50.187 -15.986 -8.973 1.00 0.00 C ATOM 25 CG GLN A 776 -51.602 -15.463 -9.161 1.00 0.00 C ATOM 26 CD GLN A 776 -52.268 -15.981 -10.424 1.00 0.00 C ATOM 27 OE1 GLN A 776 -51.662 -16.698 -11.221 1.00 0.00 O ATOM 28 NE2 GLN A 776 -53.526 -15.624 -10.611 1.00 0.00 N ATOM 0 H GLN A 776 -48.753 -16.166 -11.835 1.00 0.00 H new ATOM 0 HA GLN A 776 -49.680 -14.630 -10.555 1.00 0.00 H new ATOM 0 HB2 GLN A 776 -50.189 -17.069 -9.100 1.00 0.00 H new ATOM 0 HB3 GLN A 776 -49.868 -15.786 -7.950 1.00 0.00 H new ATOM 0 HG2 GLN A 776 -52.205 -15.746 -8.298 1.00 0.00 H new ATOM 0 HG3 GLN A 776 -51.579 -14.374 -9.191 1.00 0.00 H new ATOM 0 HE21 GLN A 776 -53.994 -15.029 -9.928 1.00 0.00 H new ATOM 0 HE22 GLN A 776 -54.029 -15.944 -11.439 1.00 0.00 H new ATOM 37 N GLU A 777 -47.849 -13.387 -9.534 1.00 0.00 N ATOM 38 CA GLU A 777 -46.899 -12.498 -8.861 1.00 0.00 C ATOM 39 C GLU A 777 -45.467 -12.791 -9.295 1.00 0.00 C ATOM 40 O GLU A 777 -44.812 -11.958 -9.924 1.00 0.00 O ATOM 41 CB GLU A 777 -47.024 -12.592 -7.332 1.00 0.00 C ATOM 42 CG GLU A 777 -47.067 -11.243 -6.633 1.00 0.00 C ATOM 43 CD GLU A 777 -47.828 -10.198 -7.424 1.00 0.00 C ATOM 44 OE1 GLU A 777 -49.076 -10.218 -7.399 1.00 0.00 O ATOM 45 OE2 GLU A 777 -47.181 -9.351 -8.075 1.00 0.00 O ATOM 0 H GLU A 777 -48.338 -12.943 -10.312 1.00 0.00 H new ATOM 0 HA GLU A 777 -47.147 -11.479 -9.158 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -47.929 -13.147 -7.085 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -46.182 -13.165 -6.943 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -47.531 -11.361 -5.654 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -46.049 -10.894 -6.463 1.00 0.00 H new ATOM 52 N ALA A 778 -44.989 -13.977 -8.970 1.00 0.00 N ATOM 53 CA ALA A 778 -43.629 -14.362 -9.295 1.00 0.00 C ATOM 54 C ALA A 778 -43.610 -15.382 -10.425 1.00 0.00 C ATOM 55 O ALA A 778 -43.242 -16.540 -10.226 1.00 0.00 O ATOM 56 CB ALA A 778 -42.927 -14.909 -8.063 1.00 0.00 C ATOM 0 H ALA A 778 -45.525 -14.693 -8.479 1.00 0.00 H new ATOM 0 HA ALA A 778 -43.092 -13.476 -9.634 1.00 0.00 H new ATOM 0 HB1 ALA A 778 -41.907 -15.194 -8.322 1.00 0.00 H new ATOM 0 HB2 ALA A 778 -42.904 -14.144 -7.287 1.00 0.00 H new ATOM 0 HB3 ALA A 778 -43.465 -15.782 -7.695 1.00 0.00 H new ATOM 62 N VAL A 779 -44.023 -14.950 -11.608 1.00 0.00 N ATOM 63 CA VAL A 779 -44.026 -15.819 -12.776 1.00 0.00 C ATOM 64 C VAL A 779 -42.694 -15.716 -13.501 1.00 0.00 C ATOM 65 O VAL A 779 -41.964 -16.698 -13.641 1.00 0.00 O ATOM 66 CB VAL A 779 -45.158 -15.457 -13.763 1.00 0.00 C ATOM 67 CG1 VAL A 779 -45.480 -16.636 -14.668 1.00 0.00 C ATOM 68 CG2 VAL A 779 -46.402 -15.001 -13.016 1.00 0.00 C ATOM 0 H VAL A 779 -44.360 -14.004 -11.784 1.00 0.00 H new ATOM 0 HA VAL A 779 -44.191 -16.836 -12.421 1.00 0.00 H new ATOM 0 HB VAL A 779 -44.813 -14.631 -14.385 1.00 0.00 H new ATOM 0 HG11 VAL A 779 -46.280 -16.359 -15.355 1.00 0.00 H new ATOM 0 HG12 VAL A 779 -44.592 -16.911 -15.237 1.00 0.00 H new ATOM 0 HG13 VAL A 779 -45.800 -17.484 -14.062 1.00 0.00 H new ATOM 0 HG21 VAL A 779 -47.185 -14.752 -13.732 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -46.749 -15.802 -12.363 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -46.165 -14.122 -12.417 1.00 0.00 H new ATOM 78 N LEU A 780 -42.385 -14.507 -13.937 1.00 0.00 N ATOM 79 CA LEU A 780 -41.148 -14.221 -14.650 1.00 0.00 C ATOM 80 C LEU A 780 -40.630 -12.847 -14.248 1.00 0.00 C ATOM 81 O LEU A 780 -41.037 -11.833 -14.818 1.00 0.00 O ATOM 82 CB LEU A 780 -41.372 -14.254 -16.167 1.00 0.00 C ATOM 83 CG LEU A 780 -41.799 -15.603 -16.744 1.00 0.00 C ATOM 84 CD1 LEU A 780 -42.762 -15.402 -17.904 1.00 0.00 C ATOM 85 CD2 LEU A 780 -40.583 -16.402 -17.189 1.00 0.00 C ATOM 0 H LEU A 780 -42.985 -13.693 -13.807 1.00 0.00 H new ATOM 0 HA LEU A 780 -40.416 -14.985 -14.387 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -42.132 -13.514 -16.420 1.00 0.00 H new ATOM 0 HB3 LEU A 780 -40.450 -13.945 -16.659 1.00 0.00 H new ATOM 0 HG LEU A 780 -42.312 -16.167 -15.964 1.00 0.00 H new ATOM 0 HD11 LEU A 780 -43.057 -16.372 -18.304 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -43.647 -14.869 -17.554 1.00 0.00 H new ATOM 0 HD13 LEU A 780 -42.274 -14.820 -18.686 1.00 0.00 H new ATOM 0 HD21 LEU A 780 -40.906 -17.360 -17.597 1.00 0.00 H new ATOM 0 HD22 LEU A 780 -40.042 -15.845 -17.954 1.00 0.00 H new ATOM 0 HD23 LEU A 780 -39.928 -16.574 -16.335 1.00 0.00 H new ATOM 97 N GLN A 781 -39.737 -12.812 -13.273 1.00 0.00 N ATOM 98 CA GLN A 781 -39.220 -11.550 -12.765 1.00 0.00 C ATOM 99 C GLN A 781 -37.906 -11.196 -13.440 1.00 0.00 C ATOM 100 O GLN A 781 -37.243 -12.056 -14.025 1.00 0.00 O ATOM 101 CB GLN A 781 -39.016 -11.615 -11.248 1.00 0.00 C ATOM 102 CG GLN A 781 -40.111 -12.368 -10.508 1.00 0.00 C ATOM 103 CD GLN A 781 -40.379 -11.794 -9.131 1.00 0.00 C ATOM 104 OE1 GLN A 781 -40.644 -10.602 -8.981 1.00 0.00 O ATOM 105 NE2 GLN A 781 -40.312 -12.637 -8.113 1.00 0.00 N ATOM 0 H GLN A 781 -39.355 -13.641 -12.817 1.00 0.00 H new ATOM 0 HA GLN A 781 -39.955 -10.777 -12.990 1.00 0.00 H new ATOM 0 HB2 GLN A 781 -38.058 -12.091 -11.041 1.00 0.00 H new ATOM 0 HB3 GLN A 781 -38.959 -10.600 -10.856 1.00 0.00 H new ATOM 0 HG2 GLN A 781 -41.029 -12.339 -11.095 1.00 0.00 H new ATOM 0 HG3 GLN A 781 -39.827 -13.416 -10.413 1.00 0.00 H new ATOM 0 HE21 GLN A 781 -40.089 -13.619 -8.278 1.00 0.00 H new ATOM 0 HE22 GLN A 781 -40.483 -12.305 -7.164 1.00 0.00 H new ATOM 114 N LEU A 782 -37.554 -9.923 -13.379 1.00 0.00 N ATOM 115 CA LEU A 782 -36.265 -9.462 -13.874 1.00 0.00 C ATOM 116 C LEU A 782 -35.211 -9.650 -12.791 1.00 0.00 C ATOM 117 O LEU A 782 -34.126 -10.177 -13.036 1.00 0.00 O ATOM 118 CB LEU A 782 -36.342 -7.989 -14.316 1.00 0.00 C ATOM 119 CG LEU A 782 -36.679 -6.965 -13.220 1.00 0.00 C ATOM 120 CD1 LEU A 782 -35.993 -5.638 -13.509 1.00 0.00 C ATOM 121 CD2 LEU A 782 -38.184 -6.770 -13.112 1.00 0.00 C ATOM 0 H LEU A 782 -38.144 -9.187 -12.991 1.00 0.00 H new ATOM 0 HA LEU A 782 -35.987 -10.052 -14.747 1.00 0.00 H new ATOM 0 HB2 LEU A 782 -35.384 -7.714 -14.758 1.00 0.00 H new ATOM 0 HB3 LEU A 782 -37.092 -7.907 -15.103 1.00 0.00 H new ATOM 0 HG LEU A 782 -36.313 -7.348 -12.267 1.00 0.00 H new ATOM 0 HD11 LEU A 782 -36.240 -4.922 -12.725 1.00 0.00 H new ATOM 0 HD12 LEU A 782 -34.913 -5.785 -13.538 1.00 0.00 H new ATOM 0 HD13 LEU A 782 -36.333 -5.254 -14.471 1.00 0.00 H new ATOM 0 HD21 LEU A 782 -38.401 -6.042 -12.331 1.00 0.00 H new ATOM 0 HD22 LEU A 782 -38.573 -6.408 -14.064 1.00 0.00 H new ATOM 0 HD23 LEU A 782 -38.657 -7.720 -12.864 1.00 0.00 H new ATOM 133 N ILE A 783 -35.557 -9.211 -11.590 1.00 0.00 N ATOM 134 CA ILE A 783 -34.736 -9.411 -10.411 1.00 0.00 C ATOM 135 C ILE A 783 -35.653 -9.519 -9.198 1.00 0.00 C ATOM 136 O ILE A 783 -36.632 -10.265 -9.227 1.00 0.00 O ATOM 137 CB ILE A 783 -33.697 -8.277 -10.186 1.00 0.00 C ATOM 138 CG1 ILE A 783 -33.675 -7.286 -11.362 1.00 0.00 C ATOM 139 CG2 ILE A 783 -32.314 -8.878 -9.968 1.00 0.00 C ATOM 140 CD1 ILE A 783 -32.583 -6.243 -11.270 1.00 0.00 C ATOM 0 H ILE A 783 -36.422 -8.703 -11.408 1.00 0.00 H new ATOM 0 HA ILE A 783 -34.163 -10.326 -10.558 1.00 0.00 H new ATOM 0 HB ILE A 783 -33.991 -7.720 -9.296 1.00 0.00 H new ATOM 0 HG12 ILE A 783 -33.553 -7.843 -12.291 1.00 0.00 H new ATOM 0 HG13 ILE A 783 -34.640 -6.782 -11.417 1.00 0.00 H new ATOM 0 HG21 ILE A 783 -31.590 -8.078 -9.811 1.00 0.00 H new ATOM 0 HG22 ILE A 783 -32.333 -9.527 -9.093 1.00 0.00 H new ATOM 0 HG23 ILE A 783 -32.028 -9.459 -10.844 1.00 0.00 H new ATOM 0 HD11 ILE A 783 -32.636 -5.584 -12.136 1.00 0.00 H new ATOM 0 HD12 ILE A 783 -32.715 -5.658 -10.360 1.00 0.00 H new ATOM 0 HD13 ILE A 783 -31.611 -6.735 -11.247 1.00 0.00 H new ATOM 152 N GLU A 784 -35.370 -8.757 -8.153 1.00 0.00 N ATOM 153 CA GLU A 784 -36.193 -8.789 -6.951 1.00 0.00 C ATOM 154 C GLU A 784 -36.735 -7.401 -6.621 1.00 0.00 C ATOM 155 O GLU A 784 -37.938 -7.157 -6.696 1.00 0.00 O ATOM 156 CB GLU A 784 -35.394 -9.321 -5.754 1.00 0.00 C ATOM 157 CG GLU A 784 -34.107 -10.028 -6.134 1.00 0.00 C ATOM 158 CD GLU A 784 -32.931 -9.081 -6.263 1.00 0.00 C ATOM 159 OE1 GLU A 784 -33.145 -7.900 -6.608 1.00 0.00 O ATOM 160 OE2 GLU A 784 -31.785 -9.525 -6.034 1.00 0.00 O ATOM 0 H GLU A 784 -34.581 -8.112 -8.111 1.00 0.00 H new ATOM 0 HA GLU A 784 -37.030 -9.459 -7.147 1.00 0.00 H new ATOM 0 HB2 GLU A 784 -35.157 -8.489 -5.091 1.00 0.00 H new ATOM 0 HB3 GLU A 784 -36.022 -10.010 -5.189 1.00 0.00 H new ATOM 0 HG2 GLU A 784 -33.878 -10.784 -5.383 1.00 0.00 H new ATOM 0 HG3 GLU A 784 -34.251 -10.551 -7.079 1.00 0.00 H new ATOM 167 N VAL A 785 -35.832 -6.483 -6.297 1.00 0.00 N ATOM 168 CA VAL A 785 -36.227 -5.167 -5.799 1.00 0.00 C ATOM 169 C VAL A 785 -36.294 -4.159 -6.939 1.00 0.00 C ATOM 170 O VAL A 785 -36.440 -2.957 -6.715 1.00 0.00 O ATOM 171 CB VAL A 785 -35.264 -4.645 -4.708 1.00 0.00 C ATOM 172 CG1 VAL A 785 -35.602 -5.255 -3.355 1.00 0.00 C ATOM 173 CG2 VAL A 785 -33.815 -4.928 -5.076 1.00 0.00 C ATOM 0 H VAL A 785 -34.824 -6.623 -6.369 1.00 0.00 H new ATOM 0 HA VAL A 785 -37.215 -5.282 -5.353 1.00 0.00 H new ATOM 0 HB VAL A 785 -35.390 -3.564 -4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 785 -34.912 -4.874 -2.602 1.00 0.00 H new ATOM 0 HG12 VAL A 785 -36.623 -4.988 -3.080 1.00 0.00 H new ATOM 0 HG13 VAL A 785 -35.513 -6.340 -3.413 1.00 0.00 H new ATOM 0 HG21 VAL A 785 -33.160 -4.550 -4.291 1.00 0.00 H new ATOM 0 HG22 VAL A 785 -33.670 -6.003 -5.183 1.00 0.00 H new ATOM 0 HG23 VAL A 785 -33.576 -4.434 -6.018 1.00 0.00 H new ATOM 183 N GLN A 786 -36.167 -4.672 -8.160 1.00 0.00 N ATOM 184 CA GLN A 786 -36.268 -3.865 -9.372 1.00 0.00 C ATOM 185 C GLN A 786 -35.212 -2.763 -9.401 1.00 0.00 C ATOM 186 O GLN A 786 -35.463 -1.668 -9.906 1.00 0.00 O ATOM 187 CB GLN A 786 -37.672 -3.261 -9.501 1.00 0.00 C ATOM 188 CG GLN A 786 -38.372 -3.622 -10.799 1.00 0.00 C ATOM 189 CD GLN A 786 -39.869 -3.805 -10.624 1.00 0.00 C ATOM 190 OE1 GLN A 786 -40.329 -4.841 -10.140 1.00 0.00 O ATOM 191 NE2 GLN A 786 -40.639 -2.798 -11.005 1.00 0.00 N ATOM 0 H GLN A 786 -35.991 -5.661 -8.337 1.00 0.00 H new ATOM 0 HA GLN A 786 -36.088 -4.523 -10.222 1.00 0.00 H new ATOM 0 HB2 GLN A 786 -38.282 -3.598 -8.663 1.00 0.00 H new ATOM 0 HB3 GLN A 786 -37.600 -2.176 -9.426 1.00 0.00 H new ATOM 0 HG2 GLN A 786 -38.189 -2.840 -11.536 1.00 0.00 H new ATOM 0 HG3 GLN A 786 -37.941 -4.541 -11.196 1.00 0.00 H new ATOM 0 HE21 GLN A 786 -40.220 -1.957 -11.401 1.00 0.00 H new ATOM 0 HE22 GLN A 786 -41.652 -2.863 -10.902 1.00 0.00 H new ATOM 200 N LEU A 787 -34.040 -3.064 -8.834 1.00 0.00 N ATOM 201 CA LEU A 787 -32.896 -2.143 -8.812 1.00 0.00 C ATOM 202 C LEU A 787 -33.145 -0.927 -7.917 1.00 0.00 C ATOM 203 O LEU A 787 -32.238 -0.127 -7.678 1.00 0.00 O ATOM 204 CB LEU A 787 -32.538 -1.685 -10.230 1.00 0.00 C ATOM 205 CG LEU A 787 -31.584 -2.607 -10.989 1.00 0.00 C ATOM 206 CD1 LEU A 787 -31.797 -2.478 -12.490 1.00 0.00 C ATOM 207 CD2 LEU A 787 -30.142 -2.288 -10.627 1.00 0.00 C ATOM 0 H LEU A 787 -33.856 -3.956 -8.375 1.00 0.00 H new ATOM 0 HA LEU A 787 -32.057 -2.696 -8.391 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -33.458 -1.586 -10.806 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -32.090 -0.693 -10.172 1.00 0.00 H new ATOM 0 HG LEU A 787 -31.795 -3.637 -10.700 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -31.109 -3.142 -13.014 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -32.823 -2.751 -12.737 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -31.612 -1.449 -12.797 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -29.474 -2.952 -11.175 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -29.921 -1.254 -10.890 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -29.996 -2.429 -9.556 1.00 0.00 H new ATOM 219 N ALA A 788 -34.359 -0.805 -7.398 1.00 0.00 N ATOM 220 CA ALA A 788 -34.730 0.326 -6.557 1.00 0.00 C ATOM 221 C ALA A 788 -34.322 0.082 -5.111 1.00 0.00 C ATOM 222 O ALA A 788 -35.134 0.196 -4.195 1.00 0.00 O ATOM 223 CB ALA A 788 -36.228 0.582 -6.652 1.00 0.00 C ATOM 0 H ALA A 788 -35.109 -1.480 -7.546 1.00 0.00 H new ATOM 0 HA ALA A 788 -34.200 1.209 -6.914 1.00 0.00 H new ATOM 0 HB1 ALA A 788 -36.493 1.429 -6.019 1.00 0.00 H new ATOM 0 HB2 ALA A 788 -36.494 0.803 -7.685 1.00 0.00 H new ATOM 0 HB3 ALA A 788 -36.770 -0.303 -6.319 1.00 0.00 H new ATOM 229 N GLN A 789 -33.060 -0.261 -4.915 1.00 0.00 N ATOM 230 CA GLN A 789 -32.533 -0.527 -3.591 1.00 0.00 C ATOM 231 C GLN A 789 -31.156 0.092 -3.449 1.00 0.00 C ATOM 232 O GLN A 789 -30.180 -0.412 -4.010 1.00 0.00 O ATOM 233 CB GLN A 789 -32.451 -2.035 -3.343 1.00 0.00 C ATOM 234 CG GLN A 789 -32.062 -2.399 -1.919 1.00 0.00 C ATOM 235 CD GLN A 789 -33.266 -2.638 -1.031 1.00 0.00 C ATOM 236 OE1 GLN A 789 -34.220 -1.858 -1.033 1.00 0.00 O ATOM 237 NE2 GLN A 789 -33.231 -3.716 -0.265 1.00 0.00 N ATOM 0 H GLN A 789 -32.377 -0.362 -5.666 1.00 0.00 H new ATOM 0 HA GLN A 789 -33.204 -0.086 -2.854 1.00 0.00 H new ATOM 0 HB2 GLN A 789 -33.417 -2.485 -3.573 1.00 0.00 H new ATOM 0 HB3 GLN A 789 -31.725 -2.469 -4.031 1.00 0.00 H new ATOM 0 HG2 GLN A 789 -31.442 -3.295 -1.933 1.00 0.00 H new ATOM 0 HG3 GLN A 789 -31.456 -1.598 -1.496 1.00 0.00 H new ATOM 0 HE21 GLN A 789 -32.422 -4.336 -0.294 1.00 0.00 H new ATOM 0 HE22 GLN A 789 -34.013 -3.927 0.354 1.00 0.00 H new ATOM 246 N GLU A 790 -31.079 1.194 -2.720 1.00 0.00 N ATOM 247 CA GLU A 790 -29.803 1.841 -2.481 1.00 0.00 C ATOM 248 C GLU A 790 -29.158 1.258 -1.238 1.00 0.00 C ATOM 249 O GLU A 790 -29.679 1.377 -0.130 1.00 0.00 O ATOM 250 CB GLU A 790 -29.939 3.357 -2.337 1.00 0.00 C ATOM 251 CG GLU A 790 -31.196 3.810 -1.616 1.00 0.00 C ATOM 252 CD GLU A 790 -31.555 5.246 -1.930 1.00 0.00 C ATOM 253 OE1 GLU A 790 -31.392 5.664 -3.093 1.00 0.00 O ATOM 254 OE2 GLU A 790 -32.005 5.966 -1.016 1.00 0.00 O ATOM 0 H GLU A 790 -31.880 1.655 -2.287 1.00 0.00 H new ATOM 0 HA GLU A 790 -29.172 1.654 -3.350 1.00 0.00 H new ATOM 0 HB2 GLU A 790 -29.070 3.738 -1.800 1.00 0.00 H new ATOM 0 HB3 GLU A 790 -29.923 3.807 -3.330 1.00 0.00 H new ATOM 0 HG2 GLU A 790 -32.026 3.161 -1.896 1.00 0.00 H new ATOM 0 HG3 GLU A 790 -31.054 3.700 -0.541 1.00 0.00 H new ATOM 261 N GLU A 791 -28.025 0.625 -1.440 1.00 0.00 N ATOM 262 CA GLU A 791 -27.330 -0.063 -0.372 1.00 0.00 C ATOM 263 C GLU A 791 -25.842 0.235 -0.439 1.00 0.00 C ATOM 264 O GLU A 791 -25.056 -0.574 -0.927 1.00 0.00 O ATOM 265 CB GLU A 791 -27.569 -1.570 -0.474 1.00 0.00 C ATOM 266 CG GLU A 791 -28.530 -2.104 0.571 1.00 0.00 C ATOM 267 CD GLU A 791 -28.851 -3.568 0.361 1.00 0.00 C ATOM 268 OE1 GLU A 791 -29.273 -3.939 -0.753 1.00 0.00 O ATOM 269 OE2 GLU A 791 -28.686 -4.362 1.311 1.00 0.00 O ATOM 0 H GLU A 791 -27.559 0.572 -2.346 1.00 0.00 H new ATOM 0 HA GLU A 791 -27.717 0.291 0.584 1.00 0.00 H new ATOM 0 HB2 GLU A 791 -27.958 -1.802 -1.466 1.00 0.00 H new ATOM 0 HB3 GLU A 791 -26.615 -2.088 -0.377 1.00 0.00 H new ATOM 0 HG2 GLU A 791 -28.098 -1.968 1.562 1.00 0.00 H new ATOM 0 HG3 GLU A 791 -29.453 -1.524 0.543 1.00 0.00 H new ATOM 276 N VAL A 792 -25.467 1.417 0.017 1.00 0.00 N ATOM 277 CA VAL A 792 -24.066 1.782 0.097 1.00 0.00 C ATOM 278 C VAL A 792 -23.412 1.042 1.264 1.00 0.00 C ATOM 279 O VAL A 792 -23.527 1.442 2.425 1.00 0.00 O ATOM 280 CB VAL A 792 -23.884 3.315 0.238 1.00 0.00 C ATOM 281 CG1 VAL A 792 -24.838 3.897 1.272 1.00 0.00 C ATOM 282 CG2 VAL A 792 -22.442 3.669 0.571 1.00 0.00 C ATOM 0 H VAL A 792 -26.113 2.139 0.337 1.00 0.00 H new ATOM 0 HA VAL A 792 -23.577 1.488 -0.832 1.00 0.00 H new ATOM 0 HB VAL A 792 -24.127 3.762 -0.726 1.00 0.00 H new ATOM 0 HG11 VAL A 792 -24.683 4.973 1.345 1.00 0.00 H new ATOM 0 HG12 VAL A 792 -25.866 3.698 0.971 1.00 0.00 H new ATOM 0 HG13 VAL A 792 -24.649 3.437 2.242 1.00 0.00 H new ATOM 0 HG21 VAL A 792 -22.345 4.751 0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 792 -22.160 3.197 1.512 1.00 0.00 H new ATOM 0 HG23 VAL A 792 -21.787 3.313 -0.224 1.00 0.00 H new ATOM 292 N THR A 793 -22.772 -0.071 0.953 1.00 0.00 N ATOM 293 CA THR A 793 -22.121 -0.875 1.966 1.00 0.00 C ATOM 294 C THR A 793 -20.621 -0.900 1.734 1.00 0.00 C ATOM 295 O THR A 793 -20.140 -1.471 0.753 1.00 0.00 O ATOM 296 CB THR A 793 -22.667 -2.315 1.983 1.00 0.00 C ATOM 297 OG1 THR A 793 -23.290 -2.631 0.728 1.00 0.00 O ATOM 298 CG2 THR A 793 -23.679 -2.483 3.104 1.00 0.00 C ATOM 0 H THR A 793 -22.690 -0.437 0.005 1.00 0.00 H new ATOM 0 HA THR A 793 -22.333 -0.420 2.933 1.00 0.00 H new ATOM 0 HB THR A 793 -21.830 -2.994 2.148 1.00 0.00 H new ATOM 0 HG1 THR A 793 -23.630 -3.550 0.754 1.00 0.00 H new ATOM 0 HG21 THR A 793 -24.056 -3.506 3.103 1.00 0.00 H new ATOM 0 HG22 THR A 793 -23.201 -2.273 4.061 1.00 0.00 H new ATOM 0 HG23 THR A 793 -24.507 -1.791 2.953 1.00 0.00 H new ATOM 306 N GLU A 794 -19.892 -0.256 2.625 1.00 0.00 N ATOM 307 CA GLU A 794 -18.443 -0.186 2.529 1.00 0.00 C ATOM 308 C GLU A 794 -17.812 -1.400 3.194 1.00 0.00 C ATOM 309 O GLU A 794 -18.513 -2.272 3.710 1.00 0.00 O ATOM 310 CB GLU A 794 -17.925 1.099 3.185 1.00 0.00 C ATOM 311 CG GLU A 794 -18.991 2.166 3.371 1.00 0.00 C ATOM 312 CD GLU A 794 -19.642 2.106 4.736 1.00 0.00 C ATOM 313 OE1 GLU A 794 -20.553 1.271 4.931 1.00 0.00 O ATOM 314 OE2 GLU A 794 -19.252 2.892 5.619 1.00 0.00 O ATOM 0 H GLU A 794 -20.282 0.231 3.432 1.00 0.00 H new ATOM 0 HA GLU A 794 -18.167 -0.177 1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 794 -17.497 0.853 4.157 1.00 0.00 H new ATOM 0 HB3 GLU A 794 -17.118 1.507 2.576 1.00 0.00 H new ATOM 0 HG2 GLU A 794 -18.544 3.150 3.229 1.00 0.00 H new ATOM 0 HG3 GLU A 794 -19.755 2.049 2.603 1.00 0.00 H new ATOM 321 N SER A 795 -16.493 -1.454 3.181 1.00 0.00 N ATOM 322 CA SER A 795 -15.774 -2.548 3.807 1.00 0.00 C ATOM 323 C SER A 795 -15.046 -2.053 5.050 1.00 0.00 C ATOM 324 O SER A 795 -14.045 -1.337 4.950 1.00 0.00 O ATOM 325 CB SER A 795 -14.786 -3.174 2.819 1.00 0.00 C ATOM 326 OG SER A 795 -14.979 -2.664 1.505 1.00 0.00 O ATOM 0 H SER A 795 -15.897 -0.752 2.743 1.00 0.00 H new ATOM 0 HA SER A 795 -16.491 -3.313 4.105 1.00 0.00 H new ATOM 0 HB2 SER A 795 -13.765 -2.972 3.144 1.00 0.00 H new ATOM 0 HB3 SER A 795 -14.910 -4.257 2.813 1.00 0.00 H new ATOM 0 HG SER A 795 -14.283 -2.004 1.305 1.00 0.00 H new ATOM 332 N PRO A 796 -15.574 -2.391 6.240 1.00 0.00 N ATOM 333 CA PRO A 796 -14.947 -2.039 7.519 1.00 0.00 C ATOM 334 C PRO A 796 -13.491 -2.482 7.581 1.00 0.00 C ATOM 335 O PRO A 796 -13.136 -3.543 7.060 1.00 0.00 O ATOM 336 CB PRO A 796 -15.782 -2.803 8.550 1.00 0.00 C ATOM 337 CG PRO A 796 -17.110 -2.977 7.904 1.00 0.00 C ATOM 338 CD PRO A 796 -16.836 -3.127 6.432 1.00 0.00 C ATOM 0 HA PRO A 796 -14.929 -0.962 7.684 1.00 0.00 H new ATOM 0 HB2 PRO A 796 -15.330 -3.765 8.792 1.00 0.00 H new ATOM 0 HB3 PRO A 796 -15.865 -2.246 9.483 1.00 0.00 H new ATOM 0 HG2 PRO A 796 -17.624 -3.854 8.297 1.00 0.00 H new ATOM 0 HG3 PRO A 796 -17.753 -2.118 8.096 1.00 0.00 H new ATOM 0 HD2 PRO A 796 -16.737 -4.174 6.147 1.00 0.00 H new ATOM 0 HD3 PRO A 796 -17.641 -2.707 5.829 1.00 0.00 H new ATOM 346 N LEU A 797 -12.658 -1.665 8.214 1.00 0.00 N ATOM 347 CA LEU A 797 -11.234 -1.952 8.331 1.00 0.00 C ATOM 348 C LEU A 797 -11.010 -3.194 9.184 1.00 0.00 C ATOM 349 O LEU A 797 -11.199 -3.167 10.402 1.00 0.00 O ATOM 350 CB LEU A 797 -10.504 -0.754 8.942 1.00 0.00 C ATOM 351 CG LEU A 797 -10.071 0.319 7.940 1.00 0.00 C ATOM 352 CD1 LEU A 797 -11.184 1.335 7.719 1.00 0.00 C ATOM 353 CD2 LEU A 797 -8.812 1.016 8.424 1.00 0.00 C ATOM 0 H LEU A 797 -12.947 -0.793 8.657 1.00 0.00 H new ATOM 0 HA LEU A 797 -10.834 -2.139 7.334 1.00 0.00 H new ATOM 0 HB2 LEU A 797 -11.153 -0.293 9.687 1.00 0.00 H new ATOM 0 HB3 LEU A 797 -9.621 -1.116 9.469 1.00 0.00 H new ATOM 0 HG LEU A 797 -9.859 -0.169 6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 797 -10.853 2.087 7.003 1.00 0.00 H new ATOM 0 HD12 LEU A 797 -12.067 0.828 7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 797 -11.429 1.817 8.665 1.00 0.00 H new ATOM 0 HD21 LEU A 797 -8.516 1.776 7.701 1.00 0.00 H new ATOM 0 HD22 LEU A 797 -9.005 1.487 9.388 1.00 0.00 H new ATOM 0 HD23 LEU A 797 -8.010 0.286 8.531 1.00 0.00 H new ATOM 365 N GLY A 798 -10.622 -4.281 8.539 1.00 0.00 N ATOM 366 CA GLY A 798 -10.429 -5.532 9.237 1.00 0.00 C ATOM 367 C GLY A 798 -11.543 -6.510 8.936 1.00 0.00 C ATOM 368 O GLY A 798 -11.941 -7.298 9.797 1.00 0.00 O ATOM 0 H GLY A 798 -10.436 -4.319 7.537 1.00 0.00 H new ATOM 0 HA2 GLY A 798 -9.473 -5.968 8.948 1.00 0.00 H new ATOM 0 HA3 GLY A 798 -10.384 -5.348 10.310 1.00 0.00 H new ATOM 372 N GLY A 799 -12.033 -6.468 7.705 1.00 0.00 N ATOM 373 CA GLY A 799 -13.154 -7.297 7.323 1.00 0.00 C ATOM 374 C GLY A 799 -12.982 -7.907 5.947 1.00 0.00 C ATOM 375 O GLY A 799 -12.830 -9.123 5.817 1.00 0.00 O ATOM 0 H GLY A 799 -11.671 -5.871 6.962 1.00 0.00 H new ATOM 0 HA2 GLY A 799 -13.280 -8.093 8.057 1.00 0.00 H new ATOM 0 HA3 GLY A 799 -14.066 -6.700 7.341 1.00 0.00 H new ATOM 379 N ASP A 800 -12.981 -7.068 4.919 1.00 0.00 N ATOM 380 CA ASP A 800 -12.872 -7.547 3.545 1.00 0.00 C ATOM 381 C ASP A 800 -11.894 -6.691 2.753 1.00 0.00 C ATOM 382 O ASP A 800 -12.281 -5.961 1.832 1.00 0.00 O ATOM 383 CB ASP A 800 -14.242 -7.549 2.865 1.00 0.00 C ATOM 384 CG ASP A 800 -14.319 -8.532 1.712 1.00 0.00 C ATOM 385 OD1 ASP A 800 -13.260 -8.899 1.158 1.00 0.00 O ATOM 386 OD2 ASP A 800 -15.443 -8.944 1.354 1.00 0.00 O ATOM 0 H ASP A 800 -13.054 -6.055 5.009 1.00 0.00 H new ATOM 0 HA ASP A 800 -12.495 -8.569 3.572 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -15.008 -7.796 3.600 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -14.463 -6.547 2.499 1.00 0.00 H new ATOM 391 N GLU A 801 -10.628 -6.782 3.126 1.00 0.00 N ATOM 392 CA GLU A 801 -9.579 -5.998 2.493 1.00 0.00 C ATOM 393 C GLU A 801 -9.298 -6.499 1.083 1.00 0.00 C ATOM 394 O GLU A 801 -8.948 -5.720 0.199 1.00 0.00 O ATOM 395 CB GLU A 801 -8.296 -6.054 3.331 1.00 0.00 C ATOM 396 CG GLU A 801 -8.381 -5.285 4.641 1.00 0.00 C ATOM 397 CD GLU A 801 -9.425 -5.849 5.583 1.00 0.00 C ATOM 398 OE1 GLU A 801 -9.399 -7.070 5.846 1.00 0.00 O ATOM 399 OE2 GLU A 801 -10.288 -5.077 6.047 1.00 0.00 O ATOM 0 H GLU A 801 -10.299 -7.397 3.871 1.00 0.00 H new ATOM 0 HA GLU A 801 -9.922 -4.965 2.430 1.00 0.00 H new ATOM 0 HB2 GLU A 801 -8.060 -7.096 3.547 1.00 0.00 H new ATOM 0 HB3 GLU A 801 -7.470 -5.656 2.741 1.00 0.00 H new ATOM 0 HG2 GLU A 801 -7.408 -5.302 5.131 1.00 0.00 H new ATOM 0 HG3 GLU A 801 -8.613 -4.241 4.430 1.00 0.00 H new ATOM 406 N ASN A 802 -9.469 -7.800 0.870 1.00 0.00 N ATOM 407 CA ASN A 802 -9.172 -8.407 -0.425 1.00 0.00 C ATOM 408 C ASN A 802 -10.076 -7.845 -1.511 1.00 0.00 C ATOM 409 O ASN A 802 -9.598 -7.402 -2.555 1.00 0.00 O ATOM 410 CB ASN A 802 -9.316 -9.935 -0.369 1.00 0.00 C ATOM 411 CG ASN A 802 -9.462 -10.555 -1.753 1.00 0.00 C ATOM 412 OD1 ASN A 802 -10.575 -10.770 -2.243 1.00 0.00 O ATOM 413 ND2 ASN A 802 -8.341 -10.848 -2.395 1.00 0.00 N ATOM 0 H ASN A 802 -9.811 -8.454 1.575 1.00 0.00 H new ATOM 0 HA ASN A 802 -8.138 -8.164 -0.667 1.00 0.00 H new ATOM 0 HB2 ASN A 802 -8.444 -10.362 0.127 1.00 0.00 H new ATOM 0 HB3 ASN A 802 -10.185 -10.194 0.236 1.00 0.00 H new ATOM 0 HD21 ASN A 802 -8.380 -11.265 -3.325 1.00 0.00 H new ATOM 0 HD22 ASN A 802 -7.439 -10.656 -1.959 1.00 0.00 H new ATOM 420 N ALA A 803 -11.379 -7.853 -1.264 1.00 0.00 N ATOM 421 CA ALA A 803 -12.327 -7.356 -2.245 1.00 0.00 C ATOM 422 C ALA A 803 -12.120 -5.866 -2.479 1.00 0.00 C ATOM 423 O ALA A 803 -12.234 -5.381 -3.604 1.00 0.00 O ATOM 424 CB ALA A 803 -13.751 -7.633 -1.800 1.00 0.00 C ATOM 0 H ALA A 803 -11.799 -8.196 -0.400 1.00 0.00 H new ATOM 0 HA ALA A 803 -12.155 -7.880 -3.185 1.00 0.00 H new ATOM 0 HB1 ALA A 803 -14.446 -7.253 -2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 803 -13.894 -8.707 -1.684 1.00 0.00 H new ATOM 0 HB3 ALA A 803 -13.937 -7.138 -0.847 1.00 0.00 H new ATOM 430 N GLN A 804 -11.790 -5.148 -1.411 1.00 0.00 N ATOM 431 CA GLN A 804 -11.533 -3.718 -1.501 1.00 0.00 C ATOM 432 C GLN A 804 -10.294 -3.447 -2.347 1.00 0.00 C ATOM 433 O GLN A 804 -10.308 -2.583 -3.225 1.00 0.00 O ATOM 434 CB GLN A 804 -11.355 -3.118 -0.108 1.00 0.00 C ATOM 435 CG GLN A 804 -11.325 -1.599 -0.103 1.00 0.00 C ATOM 436 CD GLN A 804 -11.575 -1.017 1.272 1.00 0.00 C ATOM 437 OE1 GLN A 804 -12.712 -0.970 1.739 1.00 0.00 O ATOM 438 NE2 GLN A 804 -10.516 -0.567 1.926 1.00 0.00 N ATOM 0 H GLN A 804 -11.694 -5.535 -0.472 1.00 0.00 H new ATOM 0 HA GLN A 804 -12.392 -3.248 -1.979 1.00 0.00 H new ATOM 0 HB2 GLN A 804 -12.168 -3.460 0.533 1.00 0.00 H new ATOM 0 HB3 GLN A 804 -10.428 -3.493 0.325 1.00 0.00 H new ATOM 0 HG2 GLN A 804 -10.356 -1.257 -0.468 1.00 0.00 H new ATOM 0 HG3 GLN A 804 -12.078 -1.222 -0.796 1.00 0.00 H new ATOM 0 HE21 GLN A 804 -9.591 -0.626 1.501 1.00 0.00 H new ATOM 0 HE22 GLN A 804 -10.625 -0.161 2.855 1.00 0.00 H new ATOM 447 N LEU A 805 -9.230 -4.197 -2.081 1.00 0.00 N ATOM 448 CA LEU A 805 -7.976 -4.048 -2.811 1.00 0.00 C ATOM 449 C LEU A 805 -8.156 -4.452 -4.274 1.00 0.00 C ATOM 450 O LEU A 805 -7.495 -3.922 -5.169 1.00 0.00 O ATOM 451 CB LEU A 805 -6.870 -4.873 -2.135 1.00 0.00 C ATOM 452 CG LEU A 805 -6.055 -5.780 -3.051 1.00 0.00 C ATOM 453 CD1 LEU A 805 -4.589 -5.381 -3.020 1.00 0.00 C ATOM 454 CD2 LEU A 805 -6.223 -7.236 -2.649 1.00 0.00 C ATOM 0 H LEU A 805 -9.211 -4.919 -1.360 1.00 0.00 H new ATOM 0 HA LEU A 805 -7.677 -3.000 -2.792 1.00 0.00 H new ATOM 0 HB2 LEU A 805 -6.187 -4.186 -1.635 1.00 0.00 H new ATOM 0 HB3 LEU A 805 -7.326 -5.489 -1.360 1.00 0.00 H new ATOM 0 HG LEU A 805 -6.423 -5.664 -4.070 1.00 0.00 H new ATOM 0 HD11 LEU A 805 -4.019 -6.037 -3.678 1.00 0.00 H new ATOM 0 HD12 LEU A 805 -4.485 -4.350 -3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 805 -4.209 -5.470 -2.002 1.00 0.00 H new ATOM 0 HD21 LEU A 805 -5.634 -7.867 -3.314 1.00 0.00 H new ATOM 0 HD22 LEU A 805 -5.881 -7.372 -1.623 1.00 0.00 H new ATOM 0 HD23 LEU A 805 -7.274 -7.514 -2.721 1.00 0.00 H new ATOM 466 N HIS A 806 -9.067 -5.384 -4.509 1.00 0.00 N ATOM 467 CA HIS A 806 -9.382 -5.819 -5.861 1.00 0.00 C ATOM 468 C HIS A 806 -10.174 -4.746 -6.600 1.00 0.00 C ATOM 469 O HIS A 806 -9.885 -4.436 -7.753 1.00 0.00 O ATOM 470 CB HIS A 806 -10.181 -7.123 -5.821 1.00 0.00 C ATOM 471 CG HIS A 806 -9.830 -8.076 -6.919 1.00 0.00 C ATOM 472 ND1 HIS A 806 -10.306 -9.365 -6.972 1.00 0.00 N ATOM 473 CD2 HIS A 806 -9.049 -7.920 -8.013 1.00 0.00 C ATOM 474 CE1 HIS A 806 -9.833 -9.963 -8.049 1.00 0.00 C ATOM 475 NE2 HIS A 806 -9.067 -9.106 -8.701 1.00 0.00 N ATOM 0 H HIS A 806 -9.602 -5.855 -3.779 1.00 0.00 H new ATOM 0 HA HIS A 806 -8.447 -5.989 -6.395 1.00 0.00 H new ATOM 0 HB2 HIS A 806 -10.015 -7.611 -4.861 1.00 0.00 H new ATOM 0 HB3 HIS A 806 -11.244 -6.890 -5.880 1.00 0.00 H new ATOM 0 HD2 HIS A 806 -8.511 -7.026 -8.293 1.00 0.00 H new ATOM 0 HE1 HIS A 806 -10.037 -10.981 -8.347 1.00 0.00 H new ATOM 0 HE2 HIS A 806 -8.571 -9.295 -9.572 1.00 0.00 H new ATOM 484 N ALA A 807 -11.155 -4.169 -5.915 1.00 0.00 N ATOM 485 CA ALA A 807 -12.038 -3.172 -6.513 1.00 0.00 C ATOM 486 C ALA A 807 -11.303 -1.867 -6.814 1.00 0.00 C ATOM 487 O ALA A 807 -11.655 -1.153 -7.755 1.00 0.00 O ATOM 488 CB ALA A 807 -13.223 -2.906 -5.599 1.00 0.00 C ATOM 0 H ALA A 807 -11.360 -4.376 -4.938 1.00 0.00 H new ATOM 0 HA ALA A 807 -12.395 -3.575 -7.461 1.00 0.00 H new ATOM 0 HB1 ALA A 807 -13.875 -2.161 -6.055 1.00 0.00 H new ATOM 0 HB2 ALA A 807 -13.780 -3.831 -5.447 1.00 0.00 H new ATOM 0 HB3 ALA A 807 -12.865 -2.536 -4.638 1.00 0.00 H new ATOM 494 N SER A 808 -10.287 -1.557 -6.015 1.00 0.00 N ATOM 495 CA SER A 808 -9.520 -0.329 -6.200 1.00 0.00 C ATOM 496 C SER A 808 -8.547 -0.464 -7.367 1.00 0.00 C ATOM 497 O SER A 808 -7.976 0.523 -7.833 1.00 0.00 O ATOM 498 CB SER A 808 -8.753 0.013 -4.923 1.00 0.00 C ATOM 499 OG SER A 808 -8.337 -1.165 -4.255 1.00 0.00 O ATOM 0 H SER A 808 -9.976 -2.137 -5.235 1.00 0.00 H new ATOM 0 HA SER A 808 -10.220 0.476 -6.425 1.00 0.00 H new ATOM 0 HB2 SER A 808 -7.884 0.624 -5.168 1.00 0.00 H new ATOM 0 HB3 SER A 808 -9.384 0.607 -4.262 1.00 0.00 H new ATOM 0 HG SER A 808 -9.049 -1.469 -3.654 1.00 0.00 H new ATOM 505 N GLY A 809 -8.355 -1.698 -7.826 1.00 0.00 N ATOM 506 CA GLY A 809 -7.451 -1.954 -8.929 1.00 0.00 C ATOM 507 C GLY A 809 -6.006 -2.045 -8.479 1.00 0.00 C ATOM 508 O GLY A 809 -5.110 -2.293 -9.283 1.00 0.00 O ATOM 0 H GLY A 809 -8.813 -2.528 -7.450 1.00 0.00 H new ATOM 0 HA2 GLY A 809 -7.735 -2.884 -9.421 1.00 0.00 H new ATOM 0 HA3 GLY A 809 -7.550 -1.159 -9.669 1.00 0.00 H new ATOM 512 N TYR A 810 -5.780 -1.875 -7.183 1.00 0.00 N ATOM 513 CA TYR A 810 -4.429 -1.886 -6.639 1.00 0.00 C ATOM 514 C TYR A 810 -3.969 -3.310 -6.355 1.00 0.00 C ATOM 515 O TYR A 810 -2.880 -3.530 -5.823 1.00 0.00 O ATOM 516 CB TYR A 810 -4.357 -1.035 -5.373 1.00 0.00 C ATOM 517 CG TYR A 810 -3.951 0.399 -5.640 1.00 0.00 C ATOM 518 CD1 TYR A 810 -3.283 0.743 -6.810 1.00 0.00 C ATOM 519 CD2 TYR A 810 -4.234 1.409 -4.728 1.00 0.00 C ATOM 520 CE1 TYR A 810 -2.911 2.046 -7.064 1.00 0.00 C ATOM 521 CE2 TYR A 810 -3.865 2.718 -4.975 1.00 0.00 C ATOM 522 CZ TYR A 810 -3.204 3.030 -6.145 1.00 0.00 C ATOM 523 OH TYR A 810 -2.830 4.332 -6.398 1.00 0.00 O ATOM 0 H TYR A 810 -6.514 -1.728 -6.490 1.00 0.00 H new ATOM 0 HA TYR A 810 -3.758 -1.457 -7.383 1.00 0.00 H new ATOM 0 HB2 TYR A 810 -5.329 -1.045 -4.881 1.00 0.00 H new ATOM 0 HB3 TYR A 810 -3.645 -1.485 -4.681 1.00 0.00 H new ATOM 0 HD1 TYR A 810 -3.051 -0.025 -7.533 1.00 0.00 H new ATOM 0 HD2 TYR A 810 -4.751 1.167 -3.811 1.00 0.00 H new ATOM 0 HE1 TYR A 810 -2.393 2.294 -7.978 1.00 0.00 H new ATOM 0 HE2 TYR A 810 -4.093 3.492 -4.257 1.00 0.00 H new ATOM 0 HH TYR A 810 -3.111 4.904 -5.653 1.00 0.00 H new ATOM 533 N TYR A 811 -4.806 -4.272 -6.732 1.00 0.00 N ATOM 534 CA TYR A 811 -4.478 -5.686 -6.601 1.00 0.00 C ATOM 535 C TYR A 811 -3.195 -6.009 -7.363 1.00 0.00 C ATOM 536 O TYR A 811 -2.426 -6.881 -6.965 1.00 0.00 O ATOM 537 CB TYR A 811 -5.633 -6.542 -7.134 1.00 0.00 C ATOM 538 CG TYR A 811 -5.412 -8.033 -6.997 1.00 0.00 C ATOM 539 CD1 TYR A 811 -5.206 -8.611 -5.752 1.00 0.00 C ATOM 540 CD2 TYR A 811 -5.409 -8.863 -8.113 1.00 0.00 C ATOM 541 CE1 TYR A 811 -5.005 -9.970 -5.618 1.00 0.00 C ATOM 542 CE2 TYR A 811 -5.208 -10.225 -7.988 1.00 0.00 C ATOM 543 CZ TYR A 811 -5.006 -10.773 -6.738 1.00 0.00 C ATOM 544 OH TYR A 811 -4.810 -12.128 -6.602 1.00 0.00 O ATOM 0 H TYR A 811 -5.726 -4.094 -7.135 1.00 0.00 H new ATOM 0 HA TYR A 811 -4.323 -5.912 -5.546 1.00 0.00 H new ATOM 0 HB2 TYR A 811 -6.546 -6.271 -6.604 1.00 0.00 H new ATOM 0 HB3 TYR A 811 -5.792 -6.304 -8.186 1.00 0.00 H new ATOM 0 HD1 TYR A 811 -5.203 -7.986 -4.872 1.00 0.00 H new ATOM 0 HD2 TYR A 811 -5.566 -8.437 -9.093 1.00 0.00 H new ATOM 0 HE1 TYR A 811 -4.848 -10.402 -4.641 1.00 0.00 H new ATOM 0 HE2 TYR A 811 -5.209 -10.857 -8.864 1.00 0.00 H new ATOM 0 HH TYR A 811 -4.840 -12.553 -7.485 1.00 0.00 H new ATOM 554 N ALA A 812 -2.974 -5.285 -8.458 1.00 0.00 N ATOM 555 CA ALA A 812 -1.780 -5.463 -9.273 1.00 0.00 C ATOM 556 C ALA A 812 -0.516 -5.222 -8.455 1.00 0.00 C ATOM 557 O ALA A 812 0.437 -5.992 -8.533 1.00 0.00 O ATOM 558 CB ALA A 812 -1.816 -4.532 -10.477 1.00 0.00 C ATOM 0 H ALA A 812 -3.612 -4.566 -8.801 1.00 0.00 H new ATOM 0 HA ALA A 812 -1.763 -6.494 -9.626 1.00 0.00 H new ATOM 0 HB1 ALA A 812 -0.917 -4.677 -11.076 1.00 0.00 H new ATOM 0 HB2 ALA A 812 -2.695 -4.754 -11.082 1.00 0.00 H new ATOM 0 HB3 ALA A 812 -1.862 -3.498 -10.136 1.00 0.00 H new ATOM 564 N LEU A 813 -0.529 -4.166 -7.647 1.00 0.00 N ATOM 565 CA LEU A 813 0.629 -3.802 -6.836 1.00 0.00 C ATOM 566 C LEU A 813 0.929 -4.888 -5.810 1.00 0.00 C ATOM 567 O LEU A 813 2.090 -5.164 -5.498 1.00 0.00 O ATOM 568 CB LEU A 813 0.376 -2.472 -6.117 1.00 0.00 C ATOM 569 CG LEU A 813 0.894 -1.228 -6.844 1.00 0.00 C ATOM 570 CD1 LEU A 813 0.321 0.032 -6.215 1.00 0.00 C ATOM 571 CD2 LEU A 813 2.413 -1.192 -6.818 1.00 0.00 C ATOM 0 H LEU A 813 -1.331 -3.546 -7.536 1.00 0.00 H new ATOM 0 HA LEU A 813 1.488 -3.695 -7.498 1.00 0.00 H new ATOM 0 HB2 LEU A 813 -0.697 -2.361 -5.960 1.00 0.00 H new ATOM 0 HB3 LEU A 813 0.840 -2.516 -5.131 1.00 0.00 H new ATOM 0 HG LEU A 813 0.568 -1.274 -7.883 1.00 0.00 H new ATOM 0 HD11 LEU A 813 0.699 0.907 -6.744 1.00 0.00 H new ATOM 0 HD12 LEU A 813 -0.767 0.010 -6.282 1.00 0.00 H new ATOM 0 HD13 LEU A 813 0.619 0.084 -5.168 1.00 0.00 H new ATOM 0 HD21 LEU A 813 2.765 -0.302 -7.339 1.00 0.00 H new ATOM 0 HD22 LEU A 813 2.759 -1.168 -5.785 1.00 0.00 H new ATOM 0 HD23 LEU A 813 2.807 -2.080 -7.312 1.00 0.00 H new ATOM 583 N PHE A 814 -0.135 -5.511 -5.318 1.00 0.00 N ATOM 584 CA PHE A 814 -0.042 -6.522 -4.273 1.00 0.00 C ATOM 585 C PHE A 814 0.802 -7.718 -4.712 1.00 0.00 C ATOM 586 O PHE A 814 1.621 -8.218 -3.946 1.00 0.00 O ATOM 587 CB PHE A 814 -1.441 -6.993 -3.880 1.00 0.00 C ATOM 588 CG PHE A 814 -1.519 -7.582 -2.501 1.00 0.00 C ATOM 589 CD1 PHE A 814 -0.947 -6.933 -1.418 1.00 0.00 C ATOM 590 CD2 PHE A 814 -2.170 -8.786 -2.288 1.00 0.00 C ATOM 591 CE1 PHE A 814 -1.024 -7.473 -0.148 1.00 0.00 C ATOM 592 CE2 PHE A 814 -2.252 -9.329 -1.022 1.00 0.00 C ATOM 593 CZ PHE A 814 -1.678 -8.673 0.050 1.00 0.00 C ATOM 0 H PHE A 814 -1.088 -5.329 -5.633 1.00 0.00 H new ATOM 0 HA PHE A 814 0.449 -6.065 -3.414 1.00 0.00 H new ATOM 0 HB2 PHE A 814 -2.129 -6.150 -3.944 1.00 0.00 H new ATOM 0 HB3 PHE A 814 -1.780 -7.736 -4.602 1.00 0.00 H new ATOM 0 HD1 PHE A 814 -0.435 -5.994 -1.568 1.00 0.00 H new ATOM 0 HD2 PHE A 814 -2.618 -9.306 -3.122 1.00 0.00 H new ATOM 0 HE1 PHE A 814 -0.574 -6.958 0.688 1.00 0.00 H new ATOM 0 HE2 PHE A 814 -2.765 -10.267 -0.869 1.00 0.00 H new ATOM 0 HZ PHE A 814 -1.741 -9.098 1.041 1.00 0.00 H new ATOM 603 N VAL A 815 0.609 -8.169 -5.944 1.00 0.00 N ATOM 604 CA VAL A 815 1.328 -9.338 -6.440 1.00 0.00 C ATOM 605 C VAL A 815 2.463 -8.940 -7.371 1.00 0.00 C ATOM 606 O VAL A 815 3.026 -9.775 -8.078 1.00 0.00 O ATOM 607 CB VAL A 815 0.400 -10.329 -7.176 1.00 0.00 C ATOM 608 CG1 VAL A 815 -0.101 -11.396 -6.218 1.00 0.00 C ATOM 609 CG2 VAL A 815 -0.765 -9.606 -7.841 1.00 0.00 C ATOM 0 H VAL A 815 -0.034 -7.748 -6.615 1.00 0.00 H new ATOM 0 HA VAL A 815 1.737 -9.833 -5.559 1.00 0.00 H new ATOM 0 HB VAL A 815 0.978 -10.814 -7.962 1.00 0.00 H new ATOM 0 HG11 VAL A 815 -0.754 -12.087 -6.752 1.00 0.00 H new ATOM 0 HG12 VAL A 815 0.747 -11.943 -5.807 1.00 0.00 H new ATOM 0 HG13 VAL A 815 -0.657 -10.925 -5.407 1.00 0.00 H new ATOM 0 HG21 VAL A 815 -1.400 -10.331 -8.351 1.00 0.00 H new ATOM 0 HG22 VAL A 815 -1.348 -9.082 -7.084 1.00 0.00 H new ATOM 0 HG23 VAL A 815 -0.381 -8.887 -8.565 1.00 0.00 H new ATOM 619 N ASP A 816 2.805 -7.662 -7.369 1.00 0.00 N ATOM 620 CA ASP A 816 3.889 -7.183 -8.211 1.00 0.00 C ATOM 621 C ASP A 816 5.078 -6.736 -7.377 1.00 0.00 C ATOM 622 O ASP A 816 6.087 -7.433 -7.301 1.00 0.00 O ATOM 623 CB ASP A 816 3.432 -6.036 -9.112 1.00 0.00 C ATOM 624 CG ASP A 816 4.466 -5.703 -10.166 1.00 0.00 C ATOM 625 OD1 ASP A 816 4.825 -6.601 -10.954 1.00 0.00 O ATOM 626 OD2 ASP A 816 4.931 -4.546 -10.205 1.00 0.00 O ATOM 0 H ASP A 816 2.354 -6.945 -6.801 1.00 0.00 H new ATOM 0 HA ASP A 816 4.195 -8.019 -8.840 1.00 0.00 H new ATOM 0 HB2 ASP A 816 2.493 -6.306 -9.596 1.00 0.00 H new ATOM 0 HB3 ASP A 816 3.235 -5.153 -8.504 1.00 0.00 H new ATOM 631 N THR A 817 4.952 -5.587 -6.732 1.00 0.00 N ATOM 632 CA THR A 817 6.073 -5.009 -6.013 1.00 0.00 C ATOM 633 C THR A 817 6.189 -5.564 -4.593 1.00 0.00 C ATOM 634 O THR A 817 7.272 -5.569 -4.027 1.00 0.00 O ATOM 635 CB THR A 817 5.997 -3.461 -5.982 1.00 0.00 C ATOM 636 OG1 THR A 817 7.309 -2.904 -5.810 1.00 0.00 O ATOM 637 CG2 THR A 817 5.085 -2.962 -4.869 1.00 0.00 C ATOM 0 H THR A 817 4.091 -5.041 -6.692 1.00 0.00 H new ATOM 0 HA THR A 817 6.972 -5.295 -6.560 1.00 0.00 H new ATOM 0 HB THR A 817 5.579 -3.136 -6.935 1.00 0.00 H new ATOM 0 HG1 THR A 817 7.758 -3.349 -5.061 1.00 0.00 H new ATOM 0 HG21 THR A 817 5.059 -1.872 -4.881 1.00 0.00 H new ATOM 0 HG22 THR A 817 4.078 -3.351 -5.022 1.00 0.00 H new ATOM 0 HG23 THR A 817 5.464 -3.305 -3.906 1.00 0.00 H new ATOM 645 N VAL A 818 5.092 -6.067 -4.036 1.00 0.00 N ATOM 646 CA VAL A 818 5.101 -6.521 -2.644 1.00 0.00 C ATOM 647 C VAL A 818 6.010 -7.745 -2.451 1.00 0.00 C ATOM 648 O VAL A 818 6.957 -7.690 -1.662 1.00 0.00 O ATOM 649 CB VAL A 818 3.677 -6.826 -2.125 1.00 0.00 C ATOM 650 CG1 VAL A 818 3.725 -7.384 -0.709 1.00 0.00 C ATOM 651 CG2 VAL A 818 2.810 -5.576 -2.174 1.00 0.00 C ATOM 0 H VAL A 818 4.198 -6.171 -4.515 1.00 0.00 H new ATOM 0 HA VAL A 818 5.505 -5.698 -2.055 1.00 0.00 H new ATOM 0 HB VAL A 818 3.234 -7.580 -2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 818 2.712 -7.591 -0.365 1.00 0.00 H new ATOM 0 HG12 VAL A 818 4.306 -8.306 -0.701 1.00 0.00 H new ATOM 0 HG13 VAL A 818 4.191 -6.655 -0.046 1.00 0.00 H new ATOM 0 HG21 VAL A 818 1.812 -5.811 -1.805 1.00 0.00 H new ATOM 0 HG22 VAL A 818 3.254 -4.800 -1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 818 2.742 -5.220 -3.202 1.00 0.00 H new ATOM 661 N PRO A 819 5.765 -8.861 -3.173 1.00 0.00 N ATOM 662 CA PRO A 819 6.586 -10.068 -3.034 1.00 0.00 C ATOM 663 C PRO A 819 8.033 -9.823 -3.456 1.00 0.00 C ATOM 664 O PRO A 819 8.970 -10.338 -2.841 1.00 0.00 O ATOM 665 CB PRO A 819 5.922 -11.082 -3.975 1.00 0.00 C ATOM 666 CG PRO A 819 4.557 -10.543 -4.228 1.00 0.00 C ATOM 667 CD PRO A 819 4.688 -9.052 -4.161 1.00 0.00 C ATOM 0 HA PRO A 819 6.633 -10.407 -1.999 1.00 0.00 H new ATOM 0 HB2 PRO A 819 6.484 -11.184 -4.904 1.00 0.00 H new ATOM 0 HB3 PRO A 819 5.877 -12.071 -3.519 1.00 0.00 H new ATOM 0 HG2 PRO A 819 4.186 -10.860 -5.203 1.00 0.00 H new ATOM 0 HG3 PRO A 819 3.849 -10.907 -3.484 1.00 0.00 H new ATOM 0 HD2 PRO A 819 4.948 -8.625 -5.130 1.00 0.00 H new ATOM 0 HD3 PRO A 819 3.759 -8.579 -3.843 1.00 0.00 H new ATOM 675 N ASP A 820 8.211 -9.016 -4.495 1.00 0.00 N ATOM 676 CA ASP A 820 9.540 -8.737 -5.027 1.00 0.00 C ATOM 677 C ASP A 820 10.321 -7.820 -4.086 1.00 0.00 C ATOM 678 O ASP A 820 11.541 -7.929 -3.971 1.00 0.00 O ATOM 679 CB ASP A 820 9.445 -8.110 -6.420 1.00 0.00 C ATOM 680 CG ASP A 820 9.810 -9.090 -7.521 1.00 0.00 C ATOM 681 OD1 ASP A 820 10.808 -9.822 -7.367 1.00 0.00 O ATOM 682 OD2 ASP A 820 9.092 -9.140 -8.544 1.00 0.00 O ATOM 0 H ASP A 820 7.452 -8.543 -4.986 1.00 0.00 H new ATOM 0 HA ASP A 820 10.075 -9.683 -5.108 1.00 0.00 H new ATOM 0 HB2 ASP A 820 8.431 -7.745 -6.583 1.00 0.00 H new ATOM 0 HB3 ASP A 820 10.107 -7.246 -6.472 1.00 0.00 H new ATOM 687 N ASP A 821 9.610 -6.921 -3.409 1.00 0.00 N ATOM 688 CA ASP A 821 10.226 -6.046 -2.412 1.00 0.00 C ATOM 689 C ASP A 821 10.711 -6.870 -1.231 1.00 0.00 C ATOM 690 O ASP A 821 11.775 -6.609 -0.676 1.00 0.00 O ATOM 691 CB ASP A 821 9.239 -4.985 -1.921 1.00 0.00 C ATOM 692 CG ASP A 821 9.500 -3.613 -2.514 1.00 0.00 C ATOM 693 OD1 ASP A 821 9.685 -3.514 -3.745 1.00 0.00 O ATOM 694 OD2 ASP A 821 9.502 -2.625 -1.752 1.00 0.00 O ATOM 0 H ASP A 821 8.607 -6.779 -3.532 1.00 0.00 H new ATOM 0 HA ASP A 821 11.070 -5.541 -2.882 1.00 0.00 H new ATOM 0 HB2 ASP A 821 8.225 -5.296 -2.172 1.00 0.00 H new ATOM 0 HB3 ASP A 821 9.293 -4.921 -0.834 1.00 0.00 H new ATOM 699 N VAL A 822 9.917 -7.868 -0.854 1.00 0.00 N ATOM 700 CA VAL A 822 10.311 -8.812 0.185 1.00 0.00 C ATOM 701 C VAL A 822 11.588 -9.546 -0.229 1.00 0.00 C ATOM 702 O VAL A 822 12.519 -9.699 0.566 1.00 0.00 O ATOM 703 CB VAL A 822 9.176 -9.823 0.471 1.00 0.00 C ATOM 704 CG1 VAL A 822 9.693 -11.057 1.197 1.00 0.00 C ATOM 705 CG2 VAL A 822 8.067 -9.160 1.275 1.00 0.00 C ATOM 0 H VAL A 822 8.995 -8.043 -1.254 1.00 0.00 H new ATOM 0 HA VAL A 822 10.505 -8.254 1.101 1.00 0.00 H new ATOM 0 HB VAL A 822 8.773 -10.149 -0.488 1.00 0.00 H new ATOM 0 HG11 VAL A 822 8.867 -11.744 1.380 1.00 0.00 H new ATOM 0 HG12 VAL A 822 10.446 -11.551 0.584 1.00 0.00 H new ATOM 0 HG13 VAL A 822 10.136 -10.761 2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 822 7.275 -9.884 1.469 1.00 0.00 H new ATOM 0 HG22 VAL A 822 8.469 -8.800 2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 822 7.661 -8.320 0.711 1.00 0.00 H new ATOM 715 N LYS A 823 11.630 -9.976 -1.486 1.00 0.00 N ATOM 716 CA LYS A 823 12.821 -10.605 -2.051 1.00 0.00 C ATOM 717 C LYS A 823 14.009 -9.654 -1.971 1.00 0.00 C ATOM 718 O LYS A 823 15.109 -10.043 -1.572 1.00 0.00 O ATOM 719 CB LYS A 823 12.574 -10.979 -3.511 1.00 0.00 C ATOM 720 CG LYS A 823 12.010 -12.373 -3.711 1.00 0.00 C ATOM 721 CD LYS A 823 12.663 -13.076 -4.892 1.00 0.00 C ATOM 722 CE LYS A 823 12.916 -12.129 -6.059 1.00 0.00 C ATOM 723 NZ LYS A 823 11.850 -12.225 -7.087 1.00 0.00 N ATOM 0 H LYS A 823 10.848 -9.900 -2.137 1.00 0.00 H new ATOM 0 HA LYS A 823 13.041 -11.505 -1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 823 11.886 -10.255 -3.948 1.00 0.00 H new ATOM 0 HB3 LYS A 823 13.513 -10.897 -4.059 1.00 0.00 H new ATOM 0 HG2 LYS A 823 12.163 -12.961 -2.806 1.00 0.00 H new ATOM 0 HG3 LYS A 823 10.934 -12.311 -3.873 1.00 0.00 H new ATOM 0 HD2 LYS A 823 13.607 -13.517 -4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 823 12.025 -13.895 -5.223 1.00 0.00 H new ATOM 0 HE2 LYS A 823 12.974 -11.105 -5.690 1.00 0.00 H new ATOM 0 HE3 LYS A 823 13.880 -12.360 -6.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 11.648 -11.278 -7.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 12.166 -12.848 -7.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 10.987 -12.616 -6.657 1.00 0.00 H new ATOM 737 N ARG A 824 13.771 -8.405 -2.359 1.00 0.00 N ATOM 738 CA ARG A 824 14.786 -7.365 -2.293 1.00 0.00 C ATOM 739 C ARG A 824 15.277 -7.194 -0.862 1.00 0.00 C ATOM 740 O ARG A 824 16.477 -7.181 -0.616 1.00 0.00 O ATOM 741 CB ARG A 824 14.223 -6.042 -2.826 1.00 0.00 C ATOM 742 CG ARG A 824 15.209 -4.888 -2.776 1.00 0.00 C ATOM 743 CD ARG A 824 14.497 -3.568 -2.535 1.00 0.00 C ATOM 744 NE ARG A 824 15.422 -2.511 -2.134 1.00 0.00 N ATOM 745 CZ ARG A 824 15.258 -1.224 -2.431 1.00 0.00 C ATOM 746 NH1 ARG A 824 14.250 -0.835 -3.201 1.00 0.00 N ATOM 747 NH2 ARG A 824 16.118 -0.323 -1.981 1.00 0.00 N ATOM 0 H ARG A 824 12.873 -8.089 -2.726 1.00 0.00 H new ATOM 0 HA ARG A 824 15.631 -7.661 -2.915 1.00 0.00 H new ATOM 0 HB2 ARG A 824 13.899 -6.186 -3.857 1.00 0.00 H new ATOM 0 HB3 ARG A 824 13.338 -5.776 -2.248 1.00 0.00 H new ATOM 0 HG2 ARG A 824 15.937 -5.062 -1.983 1.00 0.00 H new ATOM 0 HG3 ARG A 824 15.764 -4.839 -3.713 1.00 0.00 H new ATOM 0 HD2 ARG A 824 13.975 -3.267 -3.443 1.00 0.00 H new ATOM 0 HD3 ARG A 824 13.741 -3.700 -1.761 1.00 0.00 H new ATOM 0 HE ARG A 824 16.245 -2.776 -1.593 1.00 0.00 H new ATOM 0 HH11 ARG A 824 13.594 -1.524 -3.570 1.00 0.00 H new ATOM 0 HH12 ARG A 824 14.131 0.153 -3.424 1.00 0.00 H new ATOM 0 HH21 ARG A 824 16.908 -0.615 -1.406 1.00 0.00 H new ATOM 0 HH22 ARG A 824 15.990 0.663 -2.210 1.00 0.00 H new ATOM 761 N LEU A 825 14.338 -7.093 0.077 1.00 0.00 N ATOM 762 CA LEU A 825 14.664 -6.964 1.499 1.00 0.00 C ATOM 763 C LEU A 825 15.571 -8.103 1.956 1.00 0.00 C ATOM 764 O LEU A 825 16.563 -7.881 2.653 1.00 0.00 O ATOM 765 CB LEU A 825 13.385 -6.959 2.338 1.00 0.00 C ATOM 766 CG LEU A 825 12.925 -5.584 2.822 1.00 0.00 C ATOM 767 CD1 LEU A 825 11.617 -5.699 3.589 1.00 0.00 C ATOM 768 CD2 LEU A 825 13.996 -4.943 3.688 1.00 0.00 C ATOM 0 H LEU A 825 13.338 -7.098 -0.122 1.00 0.00 H new ATOM 0 HA LEU A 825 15.191 -6.020 1.639 1.00 0.00 H new ATOM 0 HB2 LEU A 825 12.583 -7.406 1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 825 13.538 -7.599 3.207 1.00 0.00 H new ATOM 0 HG LEU A 825 12.758 -4.949 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 825 11.305 -4.711 3.926 1.00 0.00 H new ATOM 0 HD12 LEU A 825 10.850 -6.120 2.939 1.00 0.00 H new ATOM 0 HD13 LEU A 825 11.758 -6.349 4.453 1.00 0.00 H new ATOM 0 HD21 LEU A 825 13.654 -3.964 4.025 1.00 0.00 H new ATOM 0 HD22 LEU A 825 14.192 -5.577 4.553 1.00 0.00 H new ATOM 0 HD23 LEU A 825 14.912 -4.827 3.108 1.00 0.00 H new ATOM 780 N TYR A 826 15.228 -9.320 1.553 1.00 0.00 N ATOM 781 CA TYR A 826 16.030 -10.495 1.875 1.00 0.00 C ATOM 782 C TYR A 826 17.422 -10.375 1.260 1.00 0.00 C ATOM 783 O TYR A 826 18.414 -10.823 1.838 1.00 0.00 O ATOM 784 CB TYR A 826 15.328 -11.760 1.369 1.00 0.00 C ATOM 785 CG TYR A 826 14.486 -12.451 2.417 1.00 0.00 C ATOM 786 CD1 TYR A 826 14.842 -12.412 3.761 1.00 0.00 C ATOM 787 CD2 TYR A 826 13.335 -13.142 2.063 1.00 0.00 C ATOM 788 CE1 TYR A 826 14.075 -13.044 4.719 1.00 0.00 C ATOM 789 CE2 TYR A 826 12.561 -13.776 3.015 1.00 0.00 C ATOM 790 CZ TYR A 826 12.936 -13.723 4.342 1.00 0.00 C ATOM 791 OH TYR A 826 12.168 -14.351 5.297 1.00 0.00 O ATOM 0 H TYR A 826 14.395 -9.520 0.999 1.00 0.00 H new ATOM 0 HA TYR A 826 16.139 -10.562 2.957 1.00 0.00 H new ATOM 0 HB2 TYR A 826 14.694 -11.498 0.522 1.00 0.00 H new ATOM 0 HB3 TYR A 826 16.079 -12.459 1.001 1.00 0.00 H new ATOM 0 HD1 TYR A 826 15.732 -11.879 4.060 1.00 0.00 H new ATOM 0 HD2 TYR A 826 13.040 -13.184 1.025 1.00 0.00 H new ATOM 0 HE1 TYR A 826 14.366 -13.007 5.758 1.00 0.00 H new ATOM 0 HE2 TYR A 826 11.669 -14.310 2.723 1.00 0.00 H new ATOM 0 HH TYR A 826 11.400 -14.783 4.867 1.00 0.00 H new ATOM 801 N THR A 827 17.486 -9.745 0.095 1.00 0.00 N ATOM 802 CA THR A 827 18.746 -9.534 -0.602 1.00 0.00 C ATOM 803 C THR A 827 19.616 -8.507 0.131 1.00 0.00 C ATOM 804 O THR A 827 20.828 -8.695 0.275 1.00 0.00 O ATOM 805 CB THR A 827 18.495 -9.075 -2.049 1.00 0.00 C ATOM 806 OG1 THR A 827 17.598 -9.992 -2.692 1.00 0.00 O ATOM 807 CG2 THR A 827 19.793 -8.989 -2.839 1.00 0.00 C ATOM 0 H THR A 827 16.672 -9.368 -0.390 1.00 0.00 H new ATOM 0 HA THR A 827 19.279 -10.485 -0.621 1.00 0.00 H new ATOM 0 HB THR A 827 18.053 -8.079 -2.019 1.00 0.00 H new ATOM 0 HG1 THR A 827 16.698 -9.885 -2.319 1.00 0.00 H new ATOM 0 HG21 THR A 827 19.579 -8.662 -3.856 1.00 0.00 H new ATOM 0 HG22 THR A 827 20.463 -8.274 -2.361 1.00 0.00 H new ATOM 0 HG23 THR A 827 20.268 -9.970 -2.866 1.00 0.00 H new ATOM 815 N GLU A 828 18.999 -7.425 0.603 1.00 0.00 N ATOM 816 CA GLU A 828 19.720 -6.427 1.386 1.00 0.00 C ATOM 817 C GLU A 828 20.204 -7.044 2.694 1.00 0.00 C ATOM 818 O GLU A 828 21.295 -6.738 3.168 1.00 0.00 O ATOM 819 CB GLU A 828 18.845 -5.200 1.689 1.00 0.00 C ATOM 820 CG GLU A 828 17.818 -4.876 0.616 1.00 0.00 C ATOM 821 CD GLU A 828 18.409 -4.150 -0.575 1.00 0.00 C ATOM 822 OE1 GLU A 828 19.526 -4.504 -1.001 1.00 0.00 O ATOM 823 OE2 GLU A 828 17.750 -3.227 -1.100 1.00 0.00 O ATOM 0 H GLU A 828 18.011 -7.219 0.458 1.00 0.00 H new ATOM 0 HA GLU A 828 20.573 -6.095 0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 828 18.326 -5.364 2.633 1.00 0.00 H new ATOM 0 HB3 GLU A 828 19.492 -4.334 1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 828 17.353 -5.801 0.275 1.00 0.00 H new ATOM 0 HG3 GLU A 828 17.028 -4.264 1.051 1.00 0.00 H new ATOM 830 N ALA A 829 19.389 -7.928 3.258 1.00 0.00 N ATOM 831 CA ALA A 829 19.735 -8.620 4.497 1.00 0.00 C ATOM 832 C ALA A 829 20.964 -9.502 4.307 1.00 0.00 C ATOM 833 O ALA A 829 21.837 -9.557 5.171 1.00 0.00 O ATOM 834 CB ALA A 829 18.559 -9.450 4.991 1.00 0.00 C ATOM 0 H ALA A 829 18.479 -8.184 2.875 1.00 0.00 H new ATOM 0 HA ALA A 829 19.971 -7.866 5.248 1.00 0.00 H new ATOM 0 HB1 ALA A 829 18.835 -9.958 5.915 1.00 0.00 H new ATOM 0 HB2 ALA A 829 17.706 -8.798 5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 829 18.293 -10.189 4.236 1.00 0.00 H new ATOM 840 N ALA A 830 21.032 -10.174 3.161 1.00 0.00 N ATOM 841 CA ALA A 830 22.166 -11.034 2.832 1.00 0.00 C ATOM 842 C ALA A 830 23.446 -10.218 2.651 1.00 0.00 C ATOM 843 O ALA A 830 24.552 -10.759 2.670 1.00 0.00 O ATOM 844 CB ALA A 830 21.869 -11.834 1.573 1.00 0.00 C ATOM 0 H ALA A 830 20.311 -10.139 2.441 1.00 0.00 H new ATOM 0 HA ALA A 830 22.321 -11.722 3.663 1.00 0.00 H new ATOM 0 HB1 ALA A 830 22.721 -12.471 1.337 1.00 0.00 H new ATOM 0 HB2 ALA A 830 20.987 -12.453 1.735 1.00 0.00 H new ATOM 0 HB3 ALA A 830 21.686 -11.152 0.743 1.00 0.00 H new ATOM 850 N THR A 831 23.286 -8.916 2.466 1.00 0.00 N ATOM 851 CA THR A 831 24.419 -8.015 2.324 1.00 0.00 C ATOM 852 C THR A 831 24.568 -7.133 3.567 1.00 0.00 C ATOM 853 O THR A 831 25.402 -6.225 3.607 1.00 0.00 O ATOM 854 CB THR A 831 24.255 -7.140 1.063 1.00 0.00 C ATOM 855 OG1 THR A 831 23.531 -7.872 0.060 1.00 0.00 O ATOM 856 CG2 THR A 831 25.607 -6.721 0.504 1.00 0.00 C ATOM 0 H THR A 831 22.376 -8.458 2.411 1.00 0.00 H new ATOM 0 HA THR A 831 25.323 -8.615 2.218 1.00 0.00 H new ATOM 0 HB THR A 831 23.704 -6.242 1.341 1.00 0.00 H new ATOM 0 HG1 THR A 831 22.586 -7.926 0.313 1.00 0.00 H new ATOM 0 HG21 THR A 831 25.459 -6.106 -0.384 1.00 0.00 H new ATOM 0 HG22 THR A 831 26.150 -6.148 1.256 1.00 0.00 H new ATOM 0 HG23 THR A 831 26.182 -7.608 0.239 1.00 0.00 H new ATOM 864 N SER A 832 23.746 -7.421 4.581 1.00 0.00 N ATOM 865 CA SER A 832 23.748 -6.689 5.846 1.00 0.00 C ATOM 866 C SER A 832 23.535 -5.198 5.613 1.00 0.00 C ATOM 867 O SER A 832 24.032 -4.355 6.360 1.00 0.00 O ATOM 868 CB SER A 832 25.049 -6.940 6.621 1.00 0.00 C ATOM 869 OG SER A 832 25.636 -8.185 6.259 1.00 0.00 O ATOM 0 H SER A 832 23.058 -8.173 4.544 1.00 0.00 H new ATOM 0 HA SER A 832 22.918 -7.058 6.449 1.00 0.00 H new ATOM 0 HB2 SER A 832 25.754 -6.132 6.423 1.00 0.00 H new ATOM 0 HB3 SER A 832 24.845 -6.930 7.692 1.00 0.00 H new ATOM 0 HG SER A 832 26.464 -8.317 6.767 1.00 0.00 H new ATOM 875 N ASP A 833 22.777 -4.881 4.575 1.00 0.00 N ATOM 876 CA ASP A 833 22.478 -3.502 4.243 1.00 0.00 C ATOM 877 C ASP A 833 21.248 -3.048 5.006 1.00 0.00 C ATOM 878 O ASP A 833 20.159 -2.915 4.447 1.00 0.00 O ATOM 879 CB ASP A 833 22.267 -3.334 2.741 1.00 0.00 C ATOM 880 CG ASP A 833 22.604 -1.932 2.270 1.00 0.00 C ATOM 881 OD1 ASP A 833 22.235 -0.960 2.967 1.00 0.00 O ATOM 882 OD2 ASP A 833 23.241 -1.795 1.206 1.00 0.00 O ATOM 0 H ASP A 833 22.357 -5.566 3.947 1.00 0.00 H new ATOM 0 HA ASP A 833 23.327 -2.882 4.531 1.00 0.00 H new ATOM 0 HB2 ASP A 833 22.886 -4.054 2.206 1.00 0.00 H new ATOM 0 HB3 ASP A 833 21.230 -3.559 2.494 1.00 0.00 H new ATOM 887 N PHE A 834 21.429 -2.844 6.298 1.00 0.00 N ATOM 888 CA PHE A 834 20.348 -2.406 7.172 1.00 0.00 C ATOM 889 C PHE A 834 19.837 -1.021 6.782 1.00 0.00 C ATOM 890 O PHE A 834 18.685 -0.681 7.055 1.00 0.00 O ATOM 891 CB PHE A 834 20.805 -2.420 8.633 1.00 0.00 C ATOM 892 CG PHE A 834 21.439 -3.722 9.045 1.00 0.00 C ATOM 893 CD1 PHE A 834 20.676 -4.872 9.174 1.00 0.00 C ATOM 894 CD2 PHE A 834 22.801 -3.797 9.290 1.00 0.00 C ATOM 895 CE1 PHE A 834 21.259 -6.070 9.544 1.00 0.00 C ATOM 896 CE2 PHE A 834 23.389 -4.992 9.658 1.00 0.00 C ATOM 897 CZ PHE A 834 22.619 -6.129 9.784 1.00 0.00 C ATOM 0 H PHE A 834 22.323 -2.975 6.772 1.00 0.00 H new ATOM 0 HA PHE A 834 19.521 -3.106 7.056 1.00 0.00 H new ATOM 0 HB2 PHE A 834 21.517 -1.610 8.792 1.00 0.00 H new ATOM 0 HB3 PHE A 834 19.948 -2.221 9.277 1.00 0.00 H new ATOM 0 HD1 PHE A 834 19.614 -4.832 8.983 1.00 0.00 H new ATOM 0 HD2 PHE A 834 23.410 -2.911 9.192 1.00 0.00 H new ATOM 0 HE1 PHE A 834 20.653 -6.958 9.645 1.00 0.00 H new ATOM 0 HE2 PHE A 834 24.451 -5.036 9.847 1.00 0.00 H new ATOM 0 HZ PHE A 834 23.078 -7.064 10.070 1.00 0.00 H new ATOM 907 N ALA A 835 20.681 -0.232 6.134 1.00 0.00 N ATOM 908 CA ALA A 835 20.254 1.057 5.611 1.00 0.00 C ATOM 909 C ALA A 835 19.190 0.851 4.542 1.00 0.00 C ATOM 910 O ALA A 835 18.169 1.542 4.514 1.00 0.00 O ATOM 911 CB ALA A 835 21.434 1.831 5.046 1.00 0.00 C ATOM 0 H ALA A 835 21.660 -0.460 5.958 1.00 0.00 H new ATOM 0 HA ALA A 835 19.830 1.642 6.427 1.00 0.00 H new ATOM 0 HB1 ALA A 835 21.089 2.791 4.661 1.00 0.00 H new ATOM 0 HB2 ALA A 835 22.169 1.999 5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 835 21.891 1.259 4.238 1.00 0.00 H new ATOM 917 N ALA A 836 19.419 -0.143 3.693 1.00 0.00 N ATOM 918 CA ALA A 836 18.481 -0.466 2.631 1.00 0.00 C ATOM 919 C ALA A 836 17.278 -1.190 3.208 1.00 0.00 C ATOM 920 O ALA A 836 16.154 -1.029 2.736 1.00 0.00 O ATOM 921 CB ALA A 836 19.157 -1.308 1.562 1.00 0.00 C ATOM 0 H ALA A 836 20.247 -0.738 3.721 1.00 0.00 H new ATOM 0 HA ALA A 836 18.140 0.459 2.165 1.00 0.00 H new ATOM 0 HB1 ALA A 836 18.440 -1.541 0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 836 19.994 -0.754 1.138 1.00 0.00 H new ATOM 0 HB3 ALA A 836 19.522 -2.234 2.005 1.00 0.00 H new ATOM 927 N LEU A 837 17.531 -1.981 4.243 1.00 0.00 N ATOM 928 CA LEU A 837 16.475 -2.668 4.974 1.00 0.00 C ATOM 929 C LEU A 837 15.448 -1.667 5.487 1.00 0.00 C ATOM 930 O LEU A 837 14.254 -1.801 5.229 1.00 0.00 O ATOM 931 CB LEU A 837 17.067 -3.444 6.152 1.00 0.00 C ATOM 932 CG LEU A 837 16.873 -4.960 6.100 1.00 0.00 C ATOM 933 CD1 LEU A 837 17.788 -5.581 5.060 1.00 0.00 C ATOM 934 CD2 LEU A 837 17.128 -5.576 7.465 1.00 0.00 C ATOM 0 H LEU A 837 18.470 -2.164 4.598 1.00 0.00 H new ATOM 0 HA LEU A 837 15.984 -3.365 4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 837 18.135 -3.233 6.205 1.00 0.00 H new ATOM 0 HB3 LEU A 837 16.622 -3.069 7.073 1.00 0.00 H new ATOM 0 HG LEU A 837 15.841 -5.163 5.815 1.00 0.00 H new ATOM 0 HD11 LEU A 837 17.635 -6.660 5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 837 17.561 -5.163 4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 837 18.826 -5.367 5.314 1.00 0.00 H new ATOM 0 HD21 LEU A 837 16.985 -6.655 7.410 1.00 0.00 H new ATOM 0 HD22 LEU A 837 18.150 -5.361 7.776 1.00 0.00 H new ATOM 0 HD23 LEU A 837 16.432 -5.155 8.190 1.00 0.00 H new ATOM 946 N ALA A 838 15.932 -0.657 6.200 1.00 0.00 N ATOM 947 CA ALA A 838 15.066 0.381 6.744 1.00 0.00 C ATOM 948 C ALA A 838 14.347 1.134 5.631 1.00 0.00 C ATOM 949 O ALA A 838 13.151 1.406 5.731 1.00 0.00 O ATOM 950 CB ALA A 838 15.867 1.344 7.607 1.00 0.00 C ATOM 0 H ALA A 838 16.922 -0.535 6.415 1.00 0.00 H new ATOM 0 HA ALA A 838 14.312 -0.101 7.367 1.00 0.00 H new ATOM 0 HB1 ALA A 838 15.205 2.113 8.005 1.00 0.00 H new ATOM 0 HB2 ALA A 838 16.326 0.798 8.431 1.00 0.00 H new ATOM 0 HB3 ALA A 838 16.645 1.812 7.004 1.00 0.00 H new ATOM 956 N GLN A 839 15.075 1.456 4.567 1.00 0.00 N ATOM 957 CA GLN A 839 14.502 2.176 3.436 1.00 0.00 C ATOM 958 C GLN A 839 13.366 1.382 2.794 1.00 0.00 C ATOM 959 O GLN A 839 12.288 1.921 2.538 1.00 0.00 O ATOM 960 CB GLN A 839 15.578 2.477 2.392 1.00 0.00 C ATOM 961 CG GLN A 839 16.517 3.614 2.775 1.00 0.00 C ATOM 962 CD GLN A 839 15.995 4.463 3.921 1.00 0.00 C ATOM 963 OE1 GLN A 839 15.037 5.220 3.768 1.00 0.00 O ATOM 964 NE2 GLN A 839 16.625 4.343 5.080 1.00 0.00 N ATOM 0 H GLN A 839 16.064 1.229 4.464 1.00 0.00 H new ATOM 0 HA GLN A 839 14.096 3.115 3.812 1.00 0.00 H new ATOM 0 HB2 GLN A 839 16.167 1.575 2.223 1.00 0.00 H new ATOM 0 HB3 GLN A 839 15.093 2.723 1.447 1.00 0.00 H new ATOM 0 HG2 GLN A 839 17.486 3.198 3.052 1.00 0.00 H new ATOM 0 HG3 GLN A 839 16.680 4.250 1.905 1.00 0.00 H new ATOM 0 HE21 GLN A 839 17.416 3.704 5.167 1.00 0.00 H new ATOM 0 HE22 GLN A 839 16.320 4.889 5.885 1.00 0.00 H new ATOM 973 N THR A 840 13.603 0.100 2.550 1.00 0.00 N ATOM 974 CA THR A 840 12.594 -0.752 1.937 1.00 0.00 C ATOM 975 C THR A 840 11.416 -0.975 2.887 1.00 0.00 C ATOM 976 O THR A 840 10.262 -0.969 2.464 1.00 0.00 O ATOM 977 CB THR A 840 13.182 -2.112 1.508 1.00 0.00 C ATOM 978 OG1 THR A 840 14.470 -1.919 0.913 1.00 0.00 O ATOM 979 CG2 THR A 840 12.266 -2.818 0.514 1.00 0.00 C ATOM 0 H THR A 840 14.482 -0.371 2.766 1.00 0.00 H new ATOM 0 HA THR A 840 12.239 -0.236 1.045 1.00 0.00 H new ATOM 0 HB THR A 840 13.275 -2.736 2.397 1.00 0.00 H new ATOM 0 HG1 THR A 840 15.162 -1.981 1.604 1.00 0.00 H new ATOM 0 HG21 THR A 840 12.706 -3.774 0.229 1.00 0.00 H new ATOM 0 HG22 THR A 840 11.293 -2.989 0.974 1.00 0.00 H new ATOM 0 HG23 THR A 840 12.144 -2.196 -0.373 1.00 0.00 H new ATOM 987 N ALA A 841 11.709 -1.144 4.175 1.00 0.00 N ATOM 988 CA ALA A 841 10.663 -1.317 5.180 1.00 0.00 C ATOM 989 C ALA A 841 9.823 -0.049 5.306 1.00 0.00 C ATOM 990 O ALA A 841 8.630 -0.101 5.617 1.00 0.00 O ATOM 991 CB ALA A 841 11.267 -1.690 6.526 1.00 0.00 C ATOM 0 H ALA A 841 12.659 -1.165 4.546 1.00 0.00 H new ATOM 0 HA ALA A 841 10.013 -2.130 4.858 1.00 0.00 H new ATOM 0 HB1 ALA A 841 10.471 -1.814 7.260 1.00 0.00 H new ATOM 0 HB2 ALA A 841 11.821 -2.624 6.430 1.00 0.00 H new ATOM 0 HB3 ALA A 841 11.942 -0.900 6.853 1.00 0.00 H new ATOM 997 N HIS A 842 10.460 1.090 5.073 1.00 0.00 N ATOM 998 CA HIS A 842 9.763 2.368 5.048 1.00 0.00 C ATOM 999 C HIS A 842 8.841 2.429 3.842 1.00 0.00 C ATOM 1000 O HIS A 842 7.662 2.774 3.962 1.00 0.00 O ATOM 1001 CB HIS A 842 10.764 3.526 5.000 1.00 0.00 C ATOM 1002 CG HIS A 842 10.268 4.779 5.649 1.00 0.00 C ATOM 1003 ND1 HIS A 842 10.391 5.028 6.998 1.00 0.00 N ATOM 1004 CD2 HIS A 842 9.652 5.861 5.122 1.00 0.00 C ATOM 1005 CE1 HIS A 842 9.870 6.209 7.275 1.00 0.00 C ATOM 1006 NE2 HIS A 842 9.414 6.734 6.152 1.00 0.00 N ATOM 0 H HIS A 842 11.463 1.155 4.898 1.00 0.00 H new ATOM 0 HA HIS A 842 9.171 2.460 5.958 1.00 0.00 H new ATOM 0 HB2 HIS A 842 11.688 3.216 5.488 1.00 0.00 H new ATOM 0 HB3 HIS A 842 11.009 3.739 3.960 1.00 0.00 H new ATOM 0 HD1 HIS A 842 10.818 4.398 7.677 1.00 0.00 H new ATOM 0 HD2 HIS A 842 9.395 6.010 4.084 1.00 0.00 H new ATOM 0 HE1 HIS A 842 9.824 6.667 8.252 1.00 0.00 H new ATOM 1015 N ARG A 843 9.381 2.074 2.685 1.00 0.00 N ATOM 1016 CA ARG A 843 8.604 2.044 1.459 1.00 0.00 C ATOM 1017 C ARG A 843 7.418 1.092 1.607 1.00 0.00 C ATOM 1018 O ARG A 843 6.289 1.454 1.289 1.00 0.00 O ATOM 1019 CB ARG A 843 9.484 1.613 0.284 1.00 0.00 C ATOM 1020 CG ARG A 843 8.796 1.729 -1.068 1.00 0.00 C ATOM 1021 CD ARG A 843 8.382 0.366 -1.598 1.00 0.00 C ATOM 1022 NE ARG A 843 8.054 0.398 -3.026 1.00 0.00 N ATOM 1023 CZ ARG A 843 6.956 0.964 -3.533 1.00 0.00 C ATOM 1024 NH1 ARG A 843 6.092 1.583 -2.738 1.00 0.00 N ATOM 1025 NH2 ARG A 843 6.729 0.915 -4.841 1.00 0.00 N ATOM 0 H ARG A 843 10.358 1.802 2.572 1.00 0.00 H new ATOM 0 HA ARG A 843 8.225 3.047 1.262 1.00 0.00 H new ATOM 0 HB2 ARG A 843 10.388 2.222 0.276 1.00 0.00 H new ATOM 0 HB3 ARG A 843 9.797 0.580 0.435 1.00 0.00 H new ATOM 0 HG2 ARG A 843 7.918 2.368 -0.977 1.00 0.00 H new ATOM 0 HG3 ARG A 843 9.468 2.209 -1.780 1.00 0.00 H new ATOM 0 HD2 ARG A 843 9.189 -0.347 -1.429 1.00 0.00 H new ATOM 0 HD3 ARG A 843 7.518 0.008 -1.038 1.00 0.00 H new ATOM 0 HE ARG A 843 8.707 -0.041 -3.675 1.00 0.00 H new ATOM 0 HH11 ARG A 843 6.265 1.628 -1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 843 5.255 2.013 -3.131 1.00 0.00 H new ATOM 0 HH21 ARG A 843 7.393 0.445 -5.457 1.00 0.00 H new ATOM 0 HH22 ARG A 843 5.891 1.347 -5.230 1.00 0.00 H new ATOM 1039 N LEU A 844 7.685 -0.108 2.124 1.00 0.00 N ATOM 1040 CA LEU A 844 6.651 -1.130 2.287 1.00 0.00 C ATOM 1041 C LEU A 844 5.554 -0.644 3.228 1.00 0.00 C ATOM 1042 O LEU A 844 4.370 -0.915 3.012 1.00 0.00 O ATOM 1043 CB LEU A 844 7.261 -2.430 2.817 1.00 0.00 C ATOM 1044 CG LEU A 844 7.247 -3.600 1.828 1.00 0.00 C ATOM 1045 CD1 LEU A 844 8.636 -4.212 1.699 1.00 0.00 C ATOM 1046 CD2 LEU A 844 6.237 -4.653 2.262 1.00 0.00 C ATOM 0 H LEU A 844 8.612 -0.396 2.438 1.00 0.00 H new ATOM 0 HA LEU A 844 6.208 -1.323 1.310 1.00 0.00 H new ATOM 0 HB2 LEU A 844 8.292 -2.236 3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 844 6.721 -2.727 3.716 1.00 0.00 H new ATOM 0 HG LEU A 844 6.950 -3.219 0.851 1.00 0.00 H new ATOM 0 HD11 LEU A 844 8.604 -5.041 0.992 1.00 0.00 H new ATOM 0 HD12 LEU A 844 9.335 -3.456 1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 844 8.964 -4.577 2.672 1.00 0.00 H new ATOM 0 HD21 LEU A 844 6.240 -5.477 1.548 1.00 0.00 H new ATOM 0 HD22 LEU A 844 6.504 -5.028 3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 844 5.242 -4.209 2.299 1.00 0.00 H new ATOM 1058 N LYS A 845 5.961 0.078 4.272 1.00 0.00 N ATOM 1059 CA LYS A 845 5.027 0.724 5.178 1.00 0.00 C ATOM 1060 C LYS A 845 4.059 1.607 4.400 1.00 0.00 C ATOM 1061 O LYS A 845 2.844 1.551 4.602 1.00 0.00 O ATOM 1062 CB LYS A 845 5.804 1.573 6.173 1.00 0.00 C ATOM 1063 CG LYS A 845 4.956 2.122 7.297 1.00 0.00 C ATOM 1064 CD LYS A 845 5.347 1.495 8.617 1.00 0.00 C ATOM 1065 CE LYS A 845 6.596 2.143 9.188 1.00 0.00 C ATOM 1066 NZ LYS A 845 7.825 1.372 8.871 1.00 0.00 N ATOM 0 H LYS A 845 6.942 0.228 4.508 1.00 0.00 H new ATOM 0 HA LYS A 845 4.456 -0.039 5.707 1.00 0.00 H new ATOM 0 HB2 LYS A 845 6.610 0.974 6.597 1.00 0.00 H new ATOM 0 HB3 LYS A 845 6.270 2.403 5.642 1.00 0.00 H new ATOM 0 HG2 LYS A 845 5.074 3.204 7.353 1.00 0.00 H new ATOM 0 HG3 LYS A 845 3.903 1.927 7.094 1.00 0.00 H new ATOM 0 HD2 LYS A 845 4.526 1.595 9.327 1.00 0.00 H new ATOM 0 HD3 LYS A 845 5.520 0.428 8.478 1.00 0.00 H new ATOM 0 HE2 LYS A 845 6.692 3.154 8.792 1.00 0.00 H new ATOM 0 HE3 LYS A 845 6.494 2.232 10.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 845 8.571 1.611 9.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 845 7.619 0.354 8.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 845 8.147 1.611 7.911 1.00 0.00 H new ATOM 1080 N GLY A 846 4.620 2.409 3.500 1.00 0.00 N ATOM 1081 CA GLY A 846 3.823 3.323 2.707 1.00 0.00 C ATOM 1082 C GLY A 846 2.824 2.612 1.815 1.00 0.00 C ATOM 1083 O GLY A 846 1.671 3.041 1.706 1.00 0.00 O ATOM 0 H GLY A 846 5.621 2.441 3.306 1.00 0.00 H new ATOM 0 HA2 GLY A 846 3.290 4.003 3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 846 4.484 3.933 2.091 1.00 0.00 H new ATOM 1087 N VAL A 847 3.255 1.520 1.185 1.00 0.00 N ATOM 1088 CA VAL A 847 2.380 0.766 0.290 1.00 0.00 C ATOM 1089 C VAL A 847 1.188 0.198 1.045 1.00 0.00 C ATOM 1090 O VAL A 847 0.051 0.394 0.642 1.00 0.00 O ATOM 1091 CB VAL A 847 3.096 -0.403 -0.427 1.00 0.00 C ATOM 1092 CG1 VAL A 847 2.620 -0.511 -1.863 1.00 0.00 C ATOM 1093 CG2 VAL A 847 4.600 -0.240 -0.397 1.00 0.00 C ATOM 0 H VAL A 847 4.197 1.140 1.277 1.00 0.00 H new ATOM 0 HA VAL A 847 2.055 1.483 -0.464 1.00 0.00 H new ATOM 0 HB VAL A 847 2.845 -1.318 0.109 1.00 0.00 H new ATOM 0 HG11 VAL A 847 3.132 -1.338 -2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 847 1.545 -0.690 -1.877 1.00 0.00 H new ATOM 0 HG13 VAL A 847 2.840 0.417 -2.390 1.00 0.00 H new ATOM 0 HG21 VAL A 847 5.067 -1.080 -0.910 1.00 0.00 H new ATOM 0 HG22 VAL A 847 4.875 0.689 -0.896 1.00 0.00 H new ATOM 0 HG23 VAL A 847 4.942 -0.211 0.637 1.00 0.00 H new ATOM 1103 N PHE A 848 1.451 -0.480 2.157 1.00 0.00 N ATOM 1104 CA PHE A 848 0.392 -1.134 2.922 1.00 0.00 C ATOM 1105 C PHE A 848 -0.565 -0.102 3.514 1.00 0.00 C ATOM 1106 O PHE A 848 -1.782 -0.299 3.518 1.00 0.00 O ATOM 1107 CB PHE A 848 0.995 -2.019 4.018 1.00 0.00 C ATOM 1108 CG PHE A 848 1.382 -3.390 3.523 1.00 0.00 C ATOM 1109 CD1 PHE A 848 2.155 -3.540 2.380 1.00 0.00 C ATOM 1110 CD2 PHE A 848 0.967 -4.528 4.195 1.00 0.00 C ATOM 1111 CE1 PHE A 848 2.501 -4.795 1.918 1.00 0.00 C ATOM 1112 CE2 PHE A 848 1.310 -5.787 3.736 1.00 0.00 C ATOM 1113 CZ PHE A 848 2.080 -5.920 2.598 1.00 0.00 C ATOM 0 H PHE A 848 2.386 -0.592 2.549 1.00 0.00 H new ATOM 0 HA PHE A 848 -0.181 -1.770 2.247 1.00 0.00 H new ATOM 0 HB2 PHE A 848 1.875 -1.526 4.432 1.00 0.00 H new ATOM 0 HB3 PHE A 848 0.276 -2.122 4.831 1.00 0.00 H new ATOM 0 HD1 PHE A 848 2.490 -2.664 1.845 1.00 0.00 H new ATOM 0 HD2 PHE A 848 0.368 -4.431 5.089 1.00 0.00 H new ATOM 0 HE1 PHE A 848 3.101 -4.896 1.025 1.00 0.00 H new ATOM 0 HE2 PHE A 848 0.976 -6.666 4.268 1.00 0.00 H new ATOM 0 HZ PHE A 848 2.352 -6.902 2.241 1.00 0.00 H new ATOM 1123 N ALA A 849 -0.017 1.015 3.980 1.00 0.00 N ATOM 1124 CA ALA A 849 -0.836 2.096 4.510 1.00 0.00 C ATOM 1125 C ALA A 849 -1.790 2.622 3.440 1.00 0.00 C ATOM 1126 O ALA A 849 -2.956 2.907 3.719 1.00 0.00 O ATOM 1127 CB ALA A 849 0.041 3.217 5.046 1.00 0.00 C ATOM 0 H ALA A 849 0.987 1.194 4.001 1.00 0.00 H new ATOM 0 HA ALA A 849 -1.431 1.703 5.334 1.00 0.00 H new ATOM 0 HB1 ALA A 849 -0.589 4.016 5.438 1.00 0.00 H new ATOM 0 HB2 ALA A 849 0.677 2.832 5.843 1.00 0.00 H new ATOM 0 HB3 ALA A 849 0.664 3.608 4.242 1.00 0.00 H new ATOM 1133 N MET A 850 -1.299 2.724 2.209 1.00 0.00 N ATOM 1134 CA MET A 850 -2.125 3.178 1.095 1.00 0.00 C ATOM 1135 C MET A 850 -2.964 2.026 0.536 1.00 0.00 C ATOM 1136 O MET A 850 -3.925 2.243 -0.199 1.00 0.00 O ATOM 1137 CB MET A 850 -1.250 3.805 -0.004 1.00 0.00 C ATOM 1138 CG MET A 850 -0.887 2.855 -1.141 1.00 0.00 C ATOM 1139 SD MET A 850 0.406 3.508 -2.219 1.00 0.00 S ATOM 1140 CE MET A 850 -0.284 3.127 -3.828 1.00 0.00 C ATOM 0 H MET A 850 -0.336 2.499 1.958 1.00 0.00 H new ATOM 0 HA MET A 850 -2.809 3.943 1.463 1.00 0.00 H new ATOM 0 HB2 MET A 850 -1.773 4.666 -0.420 1.00 0.00 H new ATOM 0 HB3 MET A 850 -0.331 4.178 0.449 1.00 0.00 H new ATOM 0 HG2 MET A 850 -0.557 1.904 -0.722 1.00 0.00 H new ATOM 0 HG3 MET A 850 -1.778 2.650 -1.734 1.00 0.00 H new ATOM 0 HE1 MET A 850 0.398 3.468 -4.607 1.00 0.00 H new ATOM 0 HE2 MET A 850 -0.426 2.050 -3.917 1.00 0.00 H new ATOM 0 HE3 MET A 850 -1.244 3.630 -3.941 1.00 0.00 H new ATOM 1150 N LEU A 851 -2.590 0.805 0.895 1.00 0.00 N ATOM 1151 CA LEU A 851 -3.341 -0.378 0.498 1.00 0.00 C ATOM 1152 C LEU A 851 -4.379 -0.715 1.557 1.00 0.00 C ATOM 1153 O LEU A 851 -5.105 -1.701 1.438 1.00 0.00 O ATOM 1154 CB LEU A 851 -2.401 -1.569 0.272 1.00 0.00 C ATOM 1155 CG LEU A 851 -1.642 -1.546 -1.059 1.00 0.00 C ATOM 1156 CD1 LEU A 851 -0.702 -2.736 -1.168 1.00 0.00 C ATOM 1157 CD2 LEU A 851 -2.614 -1.522 -2.229 1.00 0.00 C ATOM 0 H LEU A 851 -1.766 0.608 1.464 1.00 0.00 H new ATOM 0 HA LEU A 851 -3.851 -0.166 -0.442 1.00 0.00 H new ATOM 0 HB2 LEU A 851 -1.677 -1.602 1.086 1.00 0.00 H new ATOM 0 HB3 LEU A 851 -2.983 -2.489 0.326 1.00 0.00 H new ATOM 0 HG LEU A 851 -1.042 -0.637 -1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 851 -0.175 -2.697 -2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 851 0.020 -2.705 -0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 851 -1.277 -3.660 -1.109 1.00 0.00 H new ATOM 0 HD21 LEU A 851 -2.056 -1.506 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU A 851 -3.244 -2.411 -2.197 1.00 0.00 H new ATOM 0 HD23 LEU A 851 -3.240 -0.632 -2.164 1.00 0.00 H new ATOM 1169 N ASN A 852 -4.398 0.096 2.622 1.00 0.00 N ATOM 1170 CA ASN A 852 -5.409 0.002 3.677 1.00 0.00 C ATOM 1171 C ASN A 852 -5.147 -1.222 4.543 1.00 0.00 C ATOM 1172 O ASN A 852 -5.995 -1.657 5.326 1.00 0.00 O ATOM 1173 CB ASN A 852 -6.827 -0.040 3.087 1.00 0.00 C ATOM 1174 CG ASN A 852 -7.850 0.652 3.967 1.00 0.00 C ATOM 1175 OD1 ASN A 852 -8.502 1.608 3.551 1.00 0.00 O ATOM 1176 ND2 ASN A 852 -8.008 0.167 5.186 1.00 0.00 N ATOM 0 H ASN A 852 -3.712 0.835 2.775 1.00 0.00 H new ATOM 0 HA ASN A 852 -5.339 0.894 4.300 1.00 0.00 H new ATOM 0 HB2 ASN A 852 -6.821 0.432 2.104 1.00 0.00 H new ATOM 0 HB3 ASN A 852 -7.124 -1.078 2.940 1.00 0.00 H new ATOM 0 HD21 ASN A 852 -8.690 0.587 5.818 1.00 0.00 H new ATOM 0 HD22 ASN A 852 -7.448 -0.628 5.495 1.00 0.00 H new ATOM 1183 N LEU A 853 -3.949 -1.752 4.407 1.00 0.00 N ATOM 1184 CA LEU A 853 -3.531 -2.917 5.147 1.00 0.00 C ATOM 1185 C LEU A 853 -2.904 -2.492 6.468 1.00 0.00 C ATOM 1186 O LEU A 853 -1.683 -2.508 6.624 1.00 0.00 O ATOM 1187 CB LEU A 853 -2.546 -3.723 4.303 1.00 0.00 C ATOM 1188 CG LEU A 853 -3.202 -4.635 3.266 1.00 0.00 C ATOM 1189 CD1 LEU A 853 -2.158 -5.283 2.377 1.00 0.00 C ATOM 1190 CD2 LEU A 853 -4.047 -5.700 3.946 1.00 0.00 C ATOM 0 H LEU A 853 -3.237 -1.383 3.776 1.00 0.00 H new ATOM 0 HA LEU A 853 -4.393 -3.546 5.370 1.00 0.00 H new ATOM 0 HB2 LEU A 853 -1.876 -3.033 3.790 1.00 0.00 H new ATOM 0 HB3 LEU A 853 -1.931 -4.331 4.966 1.00 0.00 H new ATOM 0 HG LEU A 853 -3.851 -4.021 2.642 1.00 0.00 H new ATOM 0 HD11 LEU A 853 -2.650 -5.927 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 853 -1.593 -4.510 1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 853 -1.479 -5.879 2.987 1.00 0.00 H new ATOM 0 HD21 LEU A 853 -4.505 -6.338 3.190 1.00 0.00 H new ATOM 0 HD22 LEU A 853 -3.416 -6.304 4.597 1.00 0.00 H new ATOM 0 HD23 LEU A 853 -4.827 -5.222 4.538 1.00 0.00 H new ATOM 1202 N VAL A 854 -3.761 -2.096 7.401 1.00 0.00 N ATOM 1203 CA VAL A 854 -3.331 -1.570 8.695 1.00 0.00 C ATOM 1204 C VAL A 854 -2.401 -2.535 9.439 1.00 0.00 C ATOM 1205 O VAL A 854 -1.289 -2.150 9.803 1.00 0.00 O ATOM 1206 CB VAL A 854 -4.529 -1.207 9.608 1.00 0.00 C ATOM 1207 CG1 VAL A 854 -4.212 0.029 10.436 1.00 0.00 C ATOM 1208 CG2 VAL A 854 -5.797 -0.992 8.792 1.00 0.00 C ATOM 0 H VAL A 854 -4.774 -2.130 7.284 1.00 0.00 H new ATOM 0 HA VAL A 854 -2.776 -0.660 8.467 1.00 0.00 H new ATOM 0 HB VAL A 854 -4.703 -2.044 10.284 1.00 0.00 H new ATOM 0 HG11 VAL A 854 -5.064 0.270 11.071 1.00 0.00 H new ATOM 0 HG12 VAL A 854 -3.338 -0.164 11.059 1.00 0.00 H new ATOM 0 HG13 VAL A 854 -4.006 0.869 9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 854 -6.621 -0.739 9.459 1.00 0.00 H new ATOM 0 HG22 VAL A 854 -5.640 -0.178 8.084 1.00 0.00 H new ATOM 0 HG23 VAL A 854 -6.039 -1.905 8.248 1.00 0.00 H new ATOM 1218 N PRO A 855 -2.821 -3.799 9.680 1.00 0.00 N ATOM 1219 CA PRO A 855 -1.975 -4.777 10.375 1.00 0.00 C ATOM 1220 C PRO A 855 -0.662 -5.028 9.636 1.00 0.00 C ATOM 1221 O PRO A 855 0.385 -5.212 10.256 1.00 0.00 O ATOM 1222 CB PRO A 855 -2.827 -6.049 10.408 1.00 0.00 C ATOM 1223 CG PRO A 855 -4.226 -5.580 10.213 1.00 0.00 C ATOM 1224 CD PRO A 855 -4.133 -4.374 9.325 1.00 0.00 C ATOM 0 HA PRO A 855 -1.686 -4.429 11.366 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -2.530 -6.743 9.622 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -2.715 -6.574 11.356 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -4.838 -6.357 9.755 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -4.691 -5.329 11.166 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -4.183 -4.645 8.270 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -4.945 -3.672 9.512 1.00 0.00 H new ATOM 1232 N GLY A 856 -0.724 -5.021 8.309 1.00 0.00 N ATOM 1233 CA GLY A 856 0.477 -5.174 7.509 1.00 0.00 C ATOM 1234 C GLY A 856 1.415 -3.996 7.662 1.00 0.00 C ATOM 1235 O GLY A 856 2.625 -4.166 7.803 1.00 0.00 O ATOM 0 H GLY A 856 -1.585 -4.912 7.773 1.00 0.00 H new ATOM 0 HA2 GLY A 856 0.993 -6.089 7.801 1.00 0.00 H new ATOM 0 HA3 GLY A 856 0.202 -5.285 6.460 1.00 0.00 H new ATOM 1239 N LYS A 857 0.853 -2.794 7.643 1.00 0.00 N ATOM 1240 CA LYS A 857 1.630 -1.583 7.849 1.00 0.00 C ATOM 1241 C LYS A 857 2.233 -1.586 9.253 1.00 0.00 C ATOM 1242 O LYS A 857 3.385 -1.203 9.444 1.00 0.00 O ATOM 1243 CB LYS A 857 0.748 -0.343 7.621 1.00 0.00 C ATOM 1244 CG LYS A 857 1.194 0.901 8.377 1.00 0.00 C ATOM 1245 CD LYS A 857 0.308 1.176 9.586 1.00 0.00 C ATOM 1246 CE LYS A 857 -0.881 2.061 9.230 1.00 0.00 C ATOM 1247 NZ LYS A 857 -0.467 3.430 8.821 1.00 0.00 N ATOM 0 H LYS A 857 -0.142 -2.634 7.486 1.00 0.00 H new ATOM 0 HA LYS A 857 2.447 -1.550 7.128 1.00 0.00 H new ATOM 0 HB2 LYS A 857 0.730 -0.117 6.555 1.00 0.00 H new ATOM 0 HB3 LYS A 857 -0.275 -0.582 7.913 1.00 0.00 H new ATOM 0 HG2 LYS A 857 2.227 0.777 8.704 1.00 0.00 H new ATOM 0 HG3 LYS A 857 1.172 1.761 7.707 1.00 0.00 H new ATOM 0 HD2 LYS A 857 -0.052 0.232 9.995 1.00 0.00 H new ATOM 0 HD3 LYS A 857 0.898 1.657 10.366 1.00 0.00 H new ATOM 0 HE2 LYS A 857 -1.445 1.598 8.421 1.00 0.00 H new ATOM 0 HE3 LYS A 857 -1.550 2.128 10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 857 -1.258 4.089 8.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 857 0.345 3.733 9.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 857 -0.198 3.426 7.816 1.00 0.00 H new ATOM 1261 N GLN A 858 1.452 -2.055 10.224 1.00 0.00 N ATOM 1262 CA GLN A 858 1.910 -2.166 11.603 1.00 0.00 C ATOM 1263 C GLN A 858 3.066 -3.162 11.701 1.00 0.00 C ATOM 1264 O GLN A 858 3.997 -2.980 12.492 1.00 0.00 O ATOM 1265 CB GLN A 858 0.742 -2.577 12.513 1.00 0.00 C ATOM 1266 CG GLN A 858 0.941 -3.893 13.250 1.00 0.00 C ATOM 1267 CD GLN A 858 -0.128 -4.148 14.292 1.00 0.00 C ATOM 1268 OE1 GLN A 858 -1.239 -3.626 14.204 1.00 0.00 O ATOM 1269 NE2 GLN A 858 0.200 -4.951 15.289 1.00 0.00 N ATOM 0 H GLN A 858 0.492 -2.366 10.077 1.00 0.00 H new ATOM 0 HA GLN A 858 2.277 -1.195 11.937 1.00 0.00 H new ATOM 0 HB2 GLN A 858 0.576 -1.788 13.246 1.00 0.00 H new ATOM 0 HB3 GLN A 858 -0.163 -2.648 11.910 1.00 0.00 H new ATOM 0 HG2 GLN A 858 0.943 -4.711 12.530 1.00 0.00 H new ATOM 0 HG3 GLN A 858 1.919 -3.890 13.732 1.00 0.00 H new ATOM 0 HE21 GLN A 858 1.132 -5.364 15.326 1.00 0.00 H new ATOM 0 HE22 GLN A 858 -0.479 -5.158 16.022 1.00 0.00 H new ATOM 1278 N LEU A 859 3.008 -4.208 10.884 1.00 0.00 N ATOM 1279 CA LEU A 859 4.101 -5.163 10.801 1.00 0.00 C ATOM 1280 C LEU A 859 5.357 -4.460 10.304 1.00 0.00 C ATOM 1281 O LEU A 859 6.446 -4.659 10.838 1.00 0.00 O ATOM 1282 CB LEU A 859 3.738 -6.322 9.868 1.00 0.00 C ATOM 1283 CG LEU A 859 3.138 -7.549 10.557 1.00 0.00 C ATOM 1284 CD1 LEU A 859 2.529 -8.493 9.531 1.00 0.00 C ATOM 1285 CD2 LEU A 859 4.195 -8.268 11.384 1.00 0.00 C ATOM 0 H LEU A 859 2.218 -4.414 10.273 1.00 0.00 H new ATOM 0 HA LEU A 859 4.286 -5.572 11.794 1.00 0.00 H new ATOM 0 HB2 LEU A 859 3.029 -5.960 9.124 1.00 0.00 H new ATOM 0 HB3 LEU A 859 4.635 -6.629 9.330 1.00 0.00 H new ATOM 0 HG LEU A 859 2.347 -7.214 11.228 1.00 0.00 H new ATOM 0 HD11 LEU A 859 2.107 -9.360 10.040 1.00 0.00 H new ATOM 0 HD12 LEU A 859 1.742 -7.976 8.983 1.00 0.00 H new ATOM 0 HD13 LEU A 859 3.301 -8.821 8.835 1.00 0.00 H new ATOM 0 HD21 LEU A 859 3.750 -9.138 11.867 1.00 0.00 H new ATOM 0 HD22 LEU A 859 5.008 -8.590 10.734 1.00 0.00 H new ATOM 0 HD23 LEU A 859 4.585 -7.591 12.144 1.00 0.00 H new ATOM 1297 N CYS A 860 5.183 -3.602 9.304 1.00 0.00 N ATOM 1298 CA CYS A 860 6.284 -2.821 8.754 1.00 0.00 C ATOM 1299 C CYS A 860 6.800 -1.801 9.771 1.00 0.00 C ATOM 1300 O CYS A 860 7.965 -1.399 9.725 1.00 0.00 O ATOM 1301 CB CYS A 860 5.845 -2.108 7.473 1.00 0.00 C ATOM 1302 SG CYS A 860 5.008 -3.176 6.279 1.00 0.00 S ATOM 0 H CYS A 860 4.283 -3.430 8.856 1.00 0.00 H new ATOM 0 HA CYS A 860 7.096 -3.509 8.518 1.00 0.00 H new ATOM 0 HB2 CYS A 860 5.179 -1.287 7.738 1.00 0.00 H new ATOM 0 HB3 CYS A 860 6.721 -1.667 6.997 1.00 0.00 H new ATOM 0 HG CYS A 860 3.840 -3.511 6.741 1.00 0.00 H new ATOM 1308 N GLU A 861 5.928 -1.363 10.676 1.00 0.00 N ATOM 1309 CA GLU A 861 6.334 -0.463 11.752 1.00 0.00 C ATOM 1310 C GLU A 861 7.282 -1.191 12.699 1.00 0.00 C ATOM 1311 O GLU A 861 8.404 -0.738 12.957 1.00 0.00 O ATOM 1312 CB GLU A 861 5.117 0.036 12.542 1.00 0.00 C ATOM 1313 CG GLU A 861 4.107 0.801 11.710 1.00 0.00 C ATOM 1314 CD GLU A 861 4.294 2.302 11.790 1.00 0.00 C ATOM 1315 OE1 GLU A 861 5.341 2.749 12.308 1.00 0.00 O ATOM 1316 OE2 GLU A 861 3.400 3.038 11.328 1.00 0.00 O ATOM 0 H GLU A 861 4.940 -1.615 10.686 1.00 0.00 H new ATOM 0 HA GLU A 861 6.836 0.396 11.306 1.00 0.00 H new ATOM 0 HB2 GLU A 861 4.620 -0.819 13.000 1.00 0.00 H new ATOM 0 HB3 GLU A 861 5.462 0.677 13.353 1.00 0.00 H new ATOM 0 HG2 GLU A 861 4.187 0.485 10.670 1.00 0.00 H new ATOM 0 HG3 GLU A 861 3.101 0.547 12.044 1.00 0.00 H new ATOM 1323 N THR A 862 6.823 -2.337 13.189 1.00 0.00 N ATOM 1324 CA THR A 862 7.605 -3.157 14.100 1.00 0.00 C ATOM 1325 C THR A 862 8.888 -3.642 13.428 1.00 0.00 C ATOM 1326 O THR A 862 9.946 -3.707 14.057 1.00 0.00 O ATOM 1327 CB THR A 862 6.787 -4.369 14.597 1.00 0.00 C ATOM 1328 OG1 THR A 862 5.396 -4.014 14.723 1.00 0.00 O ATOM 1329 CG2 THR A 862 7.308 -4.860 15.940 1.00 0.00 C ATOM 0 H THR A 862 5.904 -2.720 12.966 1.00 0.00 H new ATOM 0 HA THR A 862 7.867 -2.537 14.957 1.00 0.00 H new ATOM 0 HB THR A 862 6.892 -5.170 13.865 1.00 0.00 H new ATOM 0 HG1 THR A 862 4.887 -4.791 15.037 1.00 0.00 H new ATOM 0 HG21 THR A 862 6.716 -5.714 16.270 1.00 0.00 H new ATOM 0 HG22 THR A 862 8.351 -5.159 15.838 1.00 0.00 H new ATOM 0 HG23 THR A 862 7.230 -4.059 16.675 1.00 0.00 H new ATOM 1337 N LEU A 863 8.789 -3.964 12.142 1.00 0.00 N ATOM 1338 CA LEU A 863 9.944 -4.382 11.358 1.00 0.00 C ATOM 1339 C LEU A 863 11.026 -3.307 11.374 1.00 0.00 C ATOM 1340 O LEU A 863 12.178 -3.588 11.691 1.00 0.00 O ATOM 1341 CB LEU A 863 9.529 -4.676 9.914 1.00 0.00 C ATOM 1342 CG LEU A 863 10.013 -6.013 9.336 1.00 0.00 C ATOM 1343 CD1 LEU A 863 10.302 -5.874 7.851 1.00 0.00 C ATOM 1344 CD2 LEU A 863 11.249 -6.516 10.069 1.00 0.00 C ATOM 0 H LEU A 863 7.914 -3.943 11.619 1.00 0.00 H new ATOM 0 HA LEU A 863 10.347 -5.290 11.806 1.00 0.00 H new ATOM 0 HB2 LEU A 863 8.441 -4.650 9.857 1.00 0.00 H new ATOM 0 HB3 LEU A 863 9.901 -3.872 9.279 1.00 0.00 H new ATOM 0 HG LEU A 863 9.218 -6.745 9.474 1.00 0.00 H new ATOM 0 HD11 LEU A 863 10.644 -6.830 7.456 1.00 0.00 H new ATOM 0 HD12 LEU A 863 9.394 -5.570 7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 863 11.076 -5.121 7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 863 11.568 -7.465 9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 863 12.052 -5.785 9.972 1.00 0.00 H new ATOM 0 HD23 LEU A 863 11.014 -6.659 11.124 1.00 0.00 H new ATOM 1356 N GLU A 864 10.643 -2.075 11.051 1.00 0.00 N ATOM 1357 CA GLU A 864 11.585 -0.959 11.028 1.00 0.00 C ATOM 1358 C GLU A 864 12.259 -0.791 12.385 1.00 0.00 C ATOM 1359 O GLU A 864 13.463 -0.550 12.467 1.00 0.00 O ATOM 1360 CB GLU A 864 10.867 0.333 10.645 1.00 0.00 C ATOM 1361 CG GLU A 864 11.247 0.859 9.271 1.00 0.00 C ATOM 1362 CD GLU A 864 10.850 2.306 9.075 1.00 0.00 C ATOM 1363 OE1 GLU A 864 9.888 2.753 9.729 1.00 0.00 O ATOM 1364 OE2 GLU A 864 11.483 2.999 8.262 1.00 0.00 O ATOM 0 H GLU A 864 9.687 -1.824 10.801 1.00 0.00 H new ATOM 0 HA GLU A 864 12.350 -1.178 10.283 1.00 0.00 H new ATOM 0 HB2 GLU A 864 9.791 0.162 10.674 1.00 0.00 H new ATOM 0 HB3 GLU A 864 11.089 1.096 11.391 1.00 0.00 H new ATOM 0 HG2 GLU A 864 12.323 0.759 9.132 1.00 0.00 H new ATOM 0 HG3 GLU A 864 10.768 0.247 8.506 1.00 0.00 H new ATOM 1371 N HIS A 865 11.477 -0.929 13.446 1.00 0.00 N ATOM 1372 CA HIS A 865 12.000 -0.831 14.806 1.00 0.00 C ATOM 1373 C HIS A 865 13.009 -1.947 15.088 1.00 0.00 C ATOM 1374 O HIS A 865 14.020 -1.724 15.748 1.00 0.00 O ATOM 1375 CB HIS A 865 10.844 -0.887 15.811 1.00 0.00 C ATOM 1376 CG HIS A 865 11.240 -0.615 17.233 1.00 0.00 C ATOM 1377 ND1 HIS A 865 11.706 0.605 17.670 1.00 0.00 N ATOM 1378 CD2 HIS A 865 11.205 -1.413 18.325 1.00 0.00 C ATOM 1379 CE1 HIS A 865 11.942 0.542 18.968 1.00 0.00 C ATOM 1380 NE2 HIS A 865 11.642 -0.670 19.396 1.00 0.00 N ATOM 0 H HIS A 865 10.475 -1.110 13.393 1.00 0.00 H new ATOM 0 HA HIS A 865 12.519 0.122 14.911 1.00 0.00 H new ATOM 0 HB2 HIS A 865 10.086 -0.163 15.514 1.00 0.00 H new ATOM 0 HB3 HIS A 865 10.381 -1.873 15.758 1.00 0.00 H new ATOM 0 HD2 HIS A 865 10.891 -2.446 18.351 1.00 0.00 H new ATOM 0 HE1 HIS A 865 12.318 1.349 19.579 1.00 0.00 H new ATOM 0 HE2 HIS A 865 11.721 -0.999 20.358 1.00 0.00 H new ATOM 1389 N LEU A 866 12.738 -3.139 14.574 1.00 0.00 N ATOM 1390 CA LEU A 866 13.635 -4.273 14.767 1.00 0.00 C ATOM 1391 C LEU A 866 14.887 -4.125 13.908 1.00 0.00 C ATOM 1392 O LEU A 866 15.951 -4.637 14.250 1.00 0.00 O ATOM 1393 CB LEU A 866 12.923 -5.582 14.430 1.00 0.00 C ATOM 1394 CG LEU A 866 12.117 -6.195 15.575 1.00 0.00 C ATOM 1395 CD1 LEU A 866 10.993 -7.060 15.032 1.00 0.00 C ATOM 1396 CD2 LEU A 866 13.023 -7.009 16.486 1.00 0.00 C ATOM 0 H LEU A 866 11.906 -3.347 14.021 1.00 0.00 H new ATOM 0 HA LEU A 866 13.933 -4.293 15.815 1.00 0.00 H new ATOM 0 HB2 LEU A 866 12.253 -5.407 13.588 1.00 0.00 H new ATOM 0 HB3 LEU A 866 13.667 -6.308 14.100 1.00 0.00 H new ATOM 0 HG LEU A 866 11.677 -5.386 16.158 1.00 0.00 H new ATOM 0 HD11 LEU A 866 10.430 -7.488 15.861 1.00 0.00 H new ATOM 0 HD12 LEU A 866 10.329 -6.451 14.419 1.00 0.00 H new ATOM 0 HD13 LEU A 866 11.412 -7.863 14.425 1.00 0.00 H new ATOM 0 HD21 LEU A 866 12.433 -7.439 17.296 1.00 0.00 H new ATOM 0 HD22 LEU A 866 13.490 -7.810 15.913 1.00 0.00 H new ATOM 0 HD23 LEU A 866 13.795 -6.363 16.903 1.00 0.00 H new ATOM 1408 N ILE A 867 14.753 -3.415 12.794 1.00 0.00 N ATOM 1409 CA ILE A 867 15.885 -3.156 11.916 1.00 0.00 C ATOM 1410 C ILE A 867 16.778 -2.105 12.550 1.00 0.00 C ATOM 1411 O ILE A 867 18.004 -2.215 12.538 1.00 0.00 O ATOM 1412 CB ILE A 867 15.425 -2.679 10.517 1.00 0.00 C ATOM 1413 CG1 ILE A 867 14.677 -3.800 9.794 1.00 0.00 C ATOM 1414 CG2 ILE A 867 16.613 -2.211 9.688 1.00 0.00 C ATOM 1415 CD1 ILE A 867 13.827 -3.316 8.640 1.00 0.00 C ATOM 0 H ILE A 867 13.872 -3.009 12.478 1.00 0.00 H new ATOM 0 HA ILE A 867 16.436 -4.087 11.783 1.00 0.00 H new ATOM 0 HB ILE A 867 14.748 -1.835 10.648 1.00 0.00 H new ATOM 0 HG12 ILE A 867 15.400 -4.526 9.422 1.00 0.00 H new ATOM 0 HG13 ILE A 867 14.041 -4.321 10.509 1.00 0.00 H new ATOM 0 HG21 ILE A 867 16.266 -1.880 8.709 1.00 0.00 H new ATOM 0 HG22 ILE A 867 17.108 -1.383 10.196 1.00 0.00 H new ATOM 0 HG23 ILE A 867 17.317 -3.034 9.564 1.00 0.00 H new ATOM 0 HD11 ILE A 867 13.327 -4.166 8.175 1.00 0.00 H new ATOM 0 HD12 ILE A 867 13.081 -2.612 9.008 1.00 0.00 H new ATOM 0 HD13 ILE A 867 14.461 -2.821 7.904 1.00 0.00 H new ATOM 1427 N ARG A 868 16.137 -1.102 13.129 1.00 0.00 N ATOM 1428 CA ARG A 868 16.832 -0.043 13.842 1.00 0.00 C ATOM 1429 C ARG A 868 17.558 -0.613 15.065 1.00 0.00 C ATOM 1430 O ARG A 868 18.663 -0.182 15.403 1.00 0.00 O ATOM 1431 CB ARG A 868 15.826 1.052 14.235 1.00 0.00 C ATOM 1432 CG ARG A 868 15.459 1.089 15.700 1.00 0.00 C ATOM 1433 CD ARG A 868 16.333 2.068 16.449 1.00 0.00 C ATOM 1434 NE ARG A 868 15.584 3.203 16.977 1.00 0.00 N ATOM 1435 CZ ARG A 868 15.377 3.414 18.272 1.00 0.00 C ATOM 1436 NH1 ARG A 868 15.813 2.542 19.176 1.00 0.00 N ATOM 1437 NH2 ARG A 868 14.715 4.496 18.660 1.00 0.00 N ATOM 0 H ARG A 868 15.122 -1.000 13.118 1.00 0.00 H new ATOM 0 HA ARG A 868 17.588 0.403 13.196 1.00 0.00 H new ATOM 0 HB2 ARG A 868 16.240 2.021 13.955 1.00 0.00 H new ATOM 0 HB3 ARG A 868 14.916 0.914 13.652 1.00 0.00 H new ATOM 0 HG2 ARG A 868 14.412 1.372 15.810 1.00 0.00 H new ATOM 0 HG3 ARG A 868 15.568 0.094 16.132 1.00 0.00 H new ATOM 0 HD2 ARG A 868 16.828 1.551 17.271 1.00 0.00 H new ATOM 0 HD3 ARG A 868 17.116 2.432 15.784 1.00 0.00 H new ATOM 0 HE ARG A 868 15.197 3.874 16.313 1.00 0.00 H new ATOM 0 HH11 ARG A 868 16.311 1.703 18.877 1.00 0.00 H new ATOM 0 HH12 ARG A 868 15.650 2.712 20.168 1.00 0.00 H new ATOM 0 HH21 ARG A 868 14.369 5.159 17.966 1.00 0.00 H new ATOM 0 HH22 ARG A 868 14.552 4.665 19.652 1.00 0.00 H new ATOM 1451 N GLU A 869 16.927 -1.582 15.722 1.00 0.00 N ATOM 1452 CA GLU A 869 17.522 -2.270 16.850 1.00 0.00 C ATOM 1453 C GLU A 869 18.479 -3.360 16.375 1.00 0.00 C ATOM 1454 O GLU A 869 19.064 -4.083 17.182 1.00 0.00 O ATOM 1455 CB GLU A 869 16.417 -2.866 17.714 1.00 0.00 C ATOM 1456 CG GLU A 869 16.427 -2.355 19.137 1.00 0.00 C ATOM 1457 CD GLU A 869 15.983 -0.907 19.269 1.00 0.00 C ATOM 1458 OE1 GLU A 869 16.713 -0.010 18.795 1.00 0.00 O ATOM 1459 OE2 GLU A 869 14.916 -0.661 19.871 1.00 0.00 O ATOM 0 H GLU A 869 15.990 -1.908 15.483 1.00 0.00 H new ATOM 0 HA GLU A 869 18.097 -1.557 17.441 1.00 0.00 H new ATOM 0 HB2 GLU A 869 15.451 -2.641 17.262 1.00 0.00 H new ATOM 0 HB3 GLU A 869 16.519 -3.951 17.725 1.00 0.00 H new ATOM 0 HG2 GLU A 869 15.774 -2.983 19.744 1.00 0.00 H new ATOM 0 HG3 GLU A 869 17.434 -2.456 19.543 1.00 0.00 H new ATOM 1466 N LYS A 870 18.614 -3.471 15.053 1.00 0.00 N ATOM 1467 CA LYS A 870 19.556 -4.388 14.419 1.00 0.00 C ATOM 1468 C LYS A 870 19.382 -5.818 14.926 1.00 0.00 C ATOM 1469 O LYS A 870 20.351 -6.480 15.307 1.00 0.00 O ATOM 1470 CB LYS A 870 20.994 -3.911 14.643 1.00 0.00 C ATOM 1471 CG LYS A 870 21.237 -2.477 14.197 1.00 0.00 C ATOM 1472 CD LYS A 870 21.348 -2.373 12.685 1.00 0.00 C ATOM 1473 CE LYS A 870 22.502 -1.472 12.273 1.00 0.00 C ATOM 1474 NZ LYS A 870 23.810 -1.980 12.770 1.00 0.00 N ATOM 0 H LYS A 870 18.068 -2.922 14.389 1.00 0.00 H new ATOM 0 HA LYS A 870 19.346 -4.392 13.350 1.00 0.00 H new ATOM 0 HB2 LYS A 870 21.236 -3.999 15.702 1.00 0.00 H new ATOM 0 HB3 LYS A 870 21.675 -4.570 14.104 1.00 0.00 H new ATOM 0 HG2 LYS A 870 20.422 -1.843 14.547 1.00 0.00 H new ATOM 0 HG3 LYS A 870 22.152 -2.103 14.656 1.00 0.00 H new ATOM 0 HD2 LYS A 870 21.491 -3.367 12.260 1.00 0.00 H new ATOM 0 HD3 LYS A 870 20.416 -1.983 12.276 1.00 0.00 H new ATOM 0 HE2 LYS A 870 22.532 -1.395 11.186 1.00 0.00 H new ATOM 0 HE3 LYS A 870 22.333 -0.467 12.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 870 24.567 -1.685 12.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 870 23.996 -1.592 13.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 870 23.783 -3.018 12.820 1.00 0.00 H new ATOM 1488 N ASP A 871 18.143 -6.287 14.935 1.00 0.00 N ATOM 1489 CA ASP A 871 17.847 -7.646 15.359 1.00 0.00 C ATOM 1490 C ASP A 871 17.512 -8.511 14.153 1.00 0.00 C ATOM 1491 O ASP A 871 16.347 -8.649 13.785 1.00 0.00 O ATOM 1492 CB ASP A 871 16.691 -7.663 16.360 1.00 0.00 C ATOM 1493 CG ASP A 871 16.883 -8.709 17.438 1.00 0.00 C ATOM 1494 OD1 ASP A 871 17.604 -8.428 18.420 1.00 0.00 O ATOM 1495 OD2 ASP A 871 16.321 -9.817 17.309 1.00 0.00 O ATOM 0 H ASP A 871 17.326 -5.745 14.653 1.00 0.00 H new ATOM 0 HA ASP A 871 18.731 -8.052 15.851 1.00 0.00 H new ATOM 0 HB2 ASP A 871 16.598 -6.680 16.822 1.00 0.00 H new ATOM 0 HB3 ASP A 871 15.758 -7.856 15.831 1.00 0.00 H new ATOM 1500 N VAL A 872 18.550 -9.083 13.546 1.00 0.00 N ATOM 1501 CA VAL A 872 18.412 -9.866 12.316 1.00 0.00 C ATOM 1502 C VAL A 872 17.339 -10.961 12.431 1.00 0.00 C ATOM 1503 O VAL A 872 16.439 -11.017 11.593 1.00 0.00 O ATOM 1504 CB VAL A 872 19.760 -10.499 11.896 1.00 0.00 C ATOM 1505 CG1 VAL A 872 19.582 -11.429 10.702 1.00 0.00 C ATOM 1506 CG2 VAL A 872 20.774 -9.413 11.572 1.00 0.00 C ATOM 0 H VAL A 872 19.508 -9.018 13.890 1.00 0.00 H new ATOM 0 HA VAL A 872 18.092 -9.164 11.546 1.00 0.00 H new ATOM 0 HB VAL A 872 20.131 -11.091 12.733 1.00 0.00 H new ATOM 0 HG11 VAL A 872 20.546 -11.859 10.429 1.00 0.00 H new ATOM 0 HG12 VAL A 872 18.889 -12.228 10.964 1.00 0.00 H new ATOM 0 HG13 VAL A 872 19.184 -10.865 9.858 1.00 0.00 H new ATOM 0 HG21 VAL A 872 21.718 -9.872 11.278 1.00 0.00 H new ATOM 0 HG22 VAL A 872 20.399 -8.798 10.754 1.00 0.00 H new ATOM 0 HG23 VAL A 872 20.933 -8.789 12.452 1.00 0.00 H new ATOM 1516 N PRO A 873 17.407 -11.843 13.457 1.00 0.00 N ATOM 1517 CA PRO A 873 16.406 -12.905 13.638 1.00 0.00 C ATOM 1518 C PRO A 873 14.986 -12.351 13.716 1.00 0.00 C ATOM 1519 O PRO A 873 14.053 -12.925 13.152 1.00 0.00 O ATOM 1520 CB PRO A 873 16.805 -13.555 14.965 1.00 0.00 C ATOM 1521 CG PRO A 873 18.254 -13.255 15.114 1.00 0.00 C ATOM 1522 CD PRO A 873 18.452 -11.899 14.502 1.00 0.00 C ATOM 0 HA PRO A 873 16.394 -13.601 12.800 1.00 0.00 H new ATOM 0 HB2 PRO A 873 16.229 -13.146 15.795 1.00 0.00 H new ATOM 0 HB3 PRO A 873 16.623 -14.630 14.950 1.00 0.00 H new ATOM 0 HG2 PRO A 873 18.549 -13.258 16.163 1.00 0.00 H new ATOM 0 HG3 PRO A 873 18.863 -14.005 14.610 1.00 0.00 H new ATOM 0 HD2 PRO A 873 18.329 -11.104 15.237 1.00 0.00 H new ATOM 0 HD3 PRO A 873 19.451 -11.790 14.079 1.00 0.00 H new ATOM 1530 N GLY A 874 14.833 -11.222 14.403 1.00 0.00 N ATOM 1531 CA GLY A 874 13.539 -10.579 14.484 1.00 0.00 C ATOM 1532 C GLY A 874 13.084 -10.077 13.131 1.00 0.00 C ATOM 1533 O GLY A 874 11.931 -10.267 12.746 1.00 0.00 O ATOM 0 H GLY A 874 15.582 -10.744 14.903 1.00 0.00 H new ATOM 0 HA2 GLY A 874 12.806 -11.283 14.878 1.00 0.00 H new ATOM 0 HA3 GLY A 874 13.589 -9.746 15.185 1.00 0.00 H new ATOM 1537 N ILE A 875 14.003 -9.454 12.404 1.00 0.00 N ATOM 1538 CA ILE A 875 13.717 -8.946 11.069 1.00 0.00 C ATOM 1539 C ILE A 875 13.248 -10.069 10.150 1.00 0.00 C ATOM 1540 O ILE A 875 12.177 -9.983 9.552 1.00 0.00 O ATOM 1541 CB ILE A 875 14.960 -8.270 10.445 1.00 0.00 C ATOM 1542 CG1 ILE A 875 15.379 -7.057 11.273 1.00 0.00 C ATOM 1543 CG2 ILE A 875 14.692 -7.854 9.002 1.00 0.00 C ATOM 1544 CD1 ILE A 875 16.831 -6.660 11.087 1.00 0.00 C ATOM 0 H ILE A 875 14.959 -9.288 12.719 1.00 0.00 H new ATOM 0 HA ILE A 875 12.925 -8.205 11.172 1.00 0.00 H new ATOM 0 HB ILE A 875 15.773 -8.996 10.445 1.00 0.00 H new ATOM 0 HG12 ILE A 875 14.744 -6.211 11.008 1.00 0.00 H new ATOM 0 HG13 ILE A 875 15.203 -7.270 12.327 1.00 0.00 H new ATOM 0 HG21 ILE A 875 15.583 -7.381 8.588 1.00 0.00 H new ATOM 0 HG22 ILE A 875 14.440 -8.734 8.410 1.00 0.00 H new ATOM 0 HG23 ILE A 875 13.861 -7.149 8.975 1.00 0.00 H new ATOM 0 HD11 ILE A 875 17.053 -5.791 11.707 1.00 0.00 H new ATOM 0 HD12 ILE A 875 17.475 -7.489 11.380 1.00 0.00 H new ATOM 0 HD13 ILE A 875 17.010 -6.414 10.040 1.00 0.00 H new ATOM 1556 N GLU A 876 14.052 -11.123 10.059 1.00 0.00 N ATOM 1557 CA GLU A 876 13.750 -12.251 9.185 1.00 0.00 C ATOM 1558 C GLU A 876 12.386 -12.849 9.513 1.00 0.00 C ATOM 1559 O GLU A 876 11.586 -13.123 8.618 1.00 0.00 O ATOM 1560 CB GLU A 876 14.825 -13.333 9.310 1.00 0.00 C ATOM 1561 CG GLU A 876 16.222 -12.853 8.957 1.00 0.00 C ATOM 1562 CD GLU A 876 17.184 -13.999 8.727 1.00 0.00 C ATOM 1563 OE1 GLU A 876 17.206 -14.549 7.607 1.00 0.00 O ATOM 1564 OE2 GLU A 876 17.920 -14.362 9.667 1.00 0.00 O ATOM 0 H GLU A 876 14.922 -11.220 10.583 1.00 0.00 H new ATOM 0 HA GLU A 876 13.733 -11.879 8.161 1.00 0.00 H new ATOM 0 HB2 GLU A 876 14.829 -13.712 10.332 1.00 0.00 H new ATOM 0 HB3 GLU A 876 14.563 -14.169 8.661 1.00 0.00 H new ATOM 0 HG2 GLU A 876 16.175 -12.236 8.060 1.00 0.00 H new ATOM 0 HG3 GLU A 876 16.600 -12.220 9.760 1.00 0.00 H new ATOM 1571 N LYS A 877 12.130 -13.036 10.801 1.00 0.00 N ATOM 1572 CA LYS A 877 10.888 -13.638 11.262 1.00 0.00 C ATOM 1573 C LYS A 877 9.683 -12.797 10.860 1.00 0.00 C ATOM 1574 O LYS A 877 8.645 -13.327 10.456 1.00 0.00 O ATOM 1575 CB LYS A 877 10.919 -13.799 12.780 1.00 0.00 C ATOM 1576 CG LYS A 877 9.680 -14.469 13.344 1.00 0.00 C ATOM 1577 CD LYS A 877 9.380 -13.997 14.758 1.00 0.00 C ATOM 1578 CE LYS A 877 9.712 -15.068 15.786 1.00 0.00 C ATOM 1579 NZ LYS A 877 9.505 -16.445 15.259 1.00 0.00 N ATOM 0 H LYS A 877 12.772 -12.777 11.550 1.00 0.00 H new ATOM 0 HA LYS A 877 10.794 -14.617 10.792 1.00 0.00 H new ATOM 0 HB2 LYS A 877 11.796 -14.383 13.057 1.00 0.00 H new ATOM 0 HB3 LYS A 877 11.032 -12.817 13.239 1.00 0.00 H new ATOM 0 HG2 LYS A 877 8.826 -14.256 12.700 1.00 0.00 H new ATOM 0 HG3 LYS A 877 9.818 -15.550 13.343 1.00 0.00 H new ATOM 0 HD2 LYS A 877 9.955 -13.096 14.971 1.00 0.00 H new ATOM 0 HD3 LYS A 877 8.326 -13.729 14.837 1.00 0.00 H new ATOM 0 HE2 LYS A 877 10.749 -14.955 16.102 1.00 0.00 H new ATOM 0 HE3 LYS A 877 9.092 -14.923 16.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 877 9.410 -17.110 16.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 877 8.640 -16.469 14.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 877 10.320 -16.719 14.674 1.00 0.00 H new ATOM 1593 N TYR A 878 9.825 -11.486 10.967 1.00 0.00 N ATOM 1594 CA TYR A 878 8.735 -10.583 10.646 1.00 0.00 C ATOM 1595 C TYR A 878 8.523 -10.503 9.142 1.00 0.00 C ATOM 1596 O TYR A 878 7.400 -10.321 8.683 1.00 0.00 O ATOM 1597 CB TYR A 878 8.989 -9.195 11.229 1.00 0.00 C ATOM 1598 CG TYR A 878 8.541 -9.067 12.670 1.00 0.00 C ATOM 1599 CD1 TYR A 878 8.967 -9.975 13.633 1.00 0.00 C ATOM 1600 CD2 TYR A 878 7.696 -8.040 13.067 1.00 0.00 C ATOM 1601 CE1 TYR A 878 8.563 -9.864 14.947 1.00 0.00 C ATOM 1602 CE2 TYR A 878 7.288 -7.923 14.382 1.00 0.00 C ATOM 1603 CZ TYR A 878 7.726 -8.837 15.318 1.00 0.00 C ATOM 1604 OH TYR A 878 7.328 -8.719 16.630 1.00 0.00 O ATOM 0 H TYR A 878 10.682 -11.026 11.273 1.00 0.00 H new ATOM 0 HA TYR A 878 7.826 -10.980 11.097 1.00 0.00 H new ATOM 0 HB2 TYR A 878 10.053 -8.969 11.164 1.00 0.00 H new ATOM 0 HB3 TYR A 878 8.468 -8.452 10.625 1.00 0.00 H new ATOM 0 HD1 TYR A 878 9.626 -10.781 13.347 1.00 0.00 H new ATOM 0 HD2 TYR A 878 7.352 -7.322 12.337 1.00 0.00 H new ATOM 0 HE1 TYR A 878 8.902 -10.580 15.681 1.00 0.00 H new ATOM 0 HE2 TYR A 878 6.629 -7.119 14.676 1.00 0.00 H new ATOM 0 HH TYR A 878 6.740 -7.941 16.725 1.00 0.00 H new ATOM 1614 N ILE A 879 9.599 -10.638 8.375 1.00 0.00 N ATOM 1615 CA ILE A 879 9.488 -10.660 6.921 1.00 0.00 C ATOM 1616 C ILE A 879 8.643 -11.851 6.468 1.00 0.00 C ATOM 1617 O ILE A 879 7.735 -11.705 5.646 1.00 0.00 O ATOM 1618 CB ILE A 879 10.873 -10.708 6.232 1.00 0.00 C ATOM 1619 CG1 ILE A 879 11.652 -9.422 6.514 1.00 0.00 C ATOM 1620 CG2 ILE A 879 10.722 -10.913 4.730 1.00 0.00 C ATOM 1621 CD1 ILE A 879 13.074 -9.444 5.991 1.00 0.00 C ATOM 0 H ILE A 879 10.550 -10.733 8.731 1.00 0.00 H new ATOM 0 HA ILE A 879 9.000 -9.732 6.623 1.00 0.00 H new ATOM 0 HB ILE A 879 11.428 -11.552 6.640 1.00 0.00 H new ATOM 0 HG12 ILE A 879 11.122 -8.581 6.066 1.00 0.00 H new ATOM 0 HG13 ILE A 879 11.673 -9.249 7.590 1.00 0.00 H new ATOM 0 HG21 ILE A 879 11.708 -10.944 4.266 1.00 0.00 H new ATOM 0 HG22 ILE A 879 10.203 -11.853 4.541 1.00 0.00 H new ATOM 0 HG23 ILE A 879 10.147 -10.090 4.306 1.00 0.00 H new ATOM 0 HD11 ILE A 879 13.563 -8.499 6.228 1.00 0.00 H new ATOM 0 HD12 ILE A 879 13.621 -10.263 6.458 1.00 0.00 H new ATOM 0 HD13 ILE A 879 13.062 -9.585 4.910 1.00 0.00 H new ATOM 1633 N SER A 880 8.925 -13.027 7.020 1.00 0.00 N ATOM 1634 CA SER A 880 8.140 -14.210 6.699 1.00 0.00 C ATOM 1635 C SER A 880 6.716 -14.058 7.229 1.00 0.00 C ATOM 1636 O SER A 880 5.777 -14.614 6.668 1.00 0.00 O ATOM 1637 CB SER A 880 8.791 -15.467 7.273 1.00 0.00 C ATOM 1638 OG SER A 880 9.619 -15.158 8.379 1.00 0.00 O ATOM 0 H SER A 880 9.683 -13.184 7.684 1.00 0.00 H new ATOM 0 HA SER A 880 8.102 -14.313 5.615 1.00 0.00 H new ATOM 0 HB2 SER A 880 8.018 -16.172 7.580 1.00 0.00 H new ATOM 0 HB3 SER A 880 9.382 -15.959 6.500 1.00 0.00 H new ATOM 0 HG SER A 880 9.133 -14.575 8.999 1.00 0.00 H new ATOM 1644 N ASP A 881 6.566 -13.298 8.313 1.00 0.00 N ATOM 1645 CA ASP A 881 5.244 -12.973 8.856 1.00 0.00 C ATOM 1646 C ASP A 881 4.466 -12.092 7.880 1.00 0.00 C ATOM 1647 O ASP A 881 3.246 -12.195 7.759 1.00 0.00 O ATOM 1648 CB ASP A 881 5.382 -12.262 10.205 1.00 0.00 C ATOM 1649 CG ASP A 881 4.205 -12.503 11.127 1.00 0.00 C ATOM 1650 OD1 ASP A 881 3.489 -13.509 10.947 1.00 0.00 O ATOM 1651 OD2 ASP A 881 3.997 -11.693 12.053 1.00 0.00 O ATOM 0 H ASP A 881 7.344 -12.894 8.835 1.00 0.00 H new ATOM 0 HA ASP A 881 4.696 -13.904 9.002 1.00 0.00 H new ATOM 0 HB2 ASP A 881 6.295 -12.600 10.695 1.00 0.00 H new ATOM 0 HB3 ASP A 881 5.489 -11.191 10.035 1.00 0.00 H new ATOM 1656 N ILE A 882 5.184 -11.222 7.188 1.00 0.00 N ATOM 1657 CA ILE A 882 4.606 -10.422 6.115 1.00 0.00 C ATOM 1658 C ILE A 882 4.252 -11.320 4.927 1.00 0.00 C ATOM 1659 O ILE A 882 3.272 -11.083 4.217 1.00 0.00 O ATOM 1660 CB ILE A 882 5.570 -9.297 5.663 1.00 0.00 C ATOM 1661 CG1 ILE A 882 5.781 -8.296 6.799 1.00 0.00 C ATOM 1662 CG2 ILE A 882 5.034 -8.582 4.428 1.00 0.00 C ATOM 1663 CD1 ILE A 882 7.061 -7.500 6.677 1.00 0.00 C ATOM 0 H ILE A 882 6.176 -11.050 7.351 1.00 0.00 H new ATOM 0 HA ILE A 882 3.700 -9.951 6.497 1.00 0.00 H new ATOM 0 HB ILE A 882 6.527 -9.752 5.406 1.00 0.00 H new ATOM 0 HG12 ILE A 882 4.936 -7.607 6.826 1.00 0.00 H new ATOM 0 HG13 ILE A 882 5.786 -8.832 7.748 1.00 0.00 H new ATOM 0 HG21 ILE A 882 5.730 -7.797 4.132 1.00 0.00 H new ATOM 0 HG22 ILE A 882 4.925 -9.297 3.612 1.00 0.00 H new ATOM 0 HG23 ILE A 882 4.064 -8.140 4.656 1.00 0.00 H new ATOM 0 HD11 ILE A 882 7.143 -6.811 7.518 1.00 0.00 H new ATOM 0 HD12 ILE A 882 7.914 -8.179 6.680 1.00 0.00 H new ATOM 0 HD13 ILE A 882 7.051 -6.935 5.745 1.00 0.00 H new ATOM 1675 N ASP A 883 5.046 -12.366 4.733 1.00 0.00 N ATOM 1676 CA ASP A 883 4.842 -13.283 3.620 1.00 0.00 C ATOM 1677 C ASP A 883 3.605 -14.120 3.871 1.00 0.00 C ATOM 1678 O ASP A 883 2.780 -14.316 2.983 1.00 0.00 O ATOM 1679 CB ASP A 883 6.063 -14.186 3.442 1.00 0.00 C ATOM 1680 CG ASP A 883 5.844 -15.276 2.410 1.00 0.00 C ATOM 1681 OD1 ASP A 883 5.746 -14.957 1.207 1.00 0.00 O ATOM 1682 OD2 ASP A 883 5.786 -16.460 2.796 1.00 0.00 O ATOM 0 H ASP A 883 5.837 -12.600 5.333 1.00 0.00 H new ATOM 0 HA ASP A 883 4.705 -12.706 2.706 1.00 0.00 H new ATOM 0 HB2 ASP A 883 6.918 -13.578 3.146 1.00 0.00 H new ATOM 0 HB3 ASP A 883 6.313 -14.644 4.399 1.00 0.00 H new ATOM 1687 N SER A 884 3.478 -14.588 5.100 1.00 0.00 N ATOM 1688 CA SER A 884 2.322 -15.356 5.515 1.00 0.00 C ATOM 1689 C SER A 884 1.076 -14.474 5.504 1.00 0.00 C ATOM 1690 O SER A 884 -0.025 -14.939 5.209 1.00 0.00 O ATOM 1691 CB SER A 884 2.576 -15.926 6.904 1.00 0.00 C ATOM 1692 OG SER A 884 3.195 -14.970 7.740 1.00 0.00 O ATOM 0 H SER A 884 4.171 -14.446 5.834 1.00 0.00 H new ATOM 0 HA SER A 884 2.155 -16.180 4.821 1.00 0.00 H new ATOM 0 HB2 SER A 884 1.633 -16.245 7.348 1.00 0.00 H new ATOM 0 HB3 SER A 884 3.208 -16.811 6.828 1.00 0.00 H new ATOM 0 HG SER A 884 2.902 -14.071 7.482 1.00 0.00 H new ATOM 1698 N TYR A 885 1.279 -13.194 5.808 1.00 0.00 N ATOM 1699 CA TYR A 885 0.221 -12.182 5.733 1.00 0.00 C ATOM 1700 C TYR A 885 -0.350 -12.140 4.331 1.00 0.00 C ATOM 1701 O TYR A 885 -1.546 -12.362 4.094 1.00 0.00 O ATOM 1702 CB TYR A 885 0.816 -10.805 6.037 1.00 0.00 C ATOM 1703 CG TYR A 885 -0.199 -9.729 6.345 1.00 0.00 C ATOM 1704 CD1 TYR A 885 -0.836 -9.666 7.577 1.00 0.00 C ATOM 1705 CD2 TYR A 885 -0.506 -8.762 5.398 1.00 0.00 C ATOM 1706 CE1 TYR A 885 -1.758 -8.674 7.849 1.00 0.00 C ATOM 1707 CE2 TYR A 885 -1.422 -7.766 5.664 1.00 0.00 C ATOM 1708 CZ TYR A 885 -2.044 -7.725 6.891 1.00 0.00 C ATOM 1709 OH TYR A 885 -2.958 -6.731 7.160 1.00 0.00 O ATOM 0 H TYR A 885 2.180 -12.827 6.113 1.00 0.00 H new ATOM 0 HA TYR A 885 -0.559 -12.434 6.452 1.00 0.00 H new ATOM 0 HB2 TYR A 885 1.495 -10.897 6.885 1.00 0.00 H new ATOM 0 HB3 TYR A 885 1.414 -10.487 5.183 1.00 0.00 H new ATOM 0 HD1 TYR A 885 -0.608 -10.403 8.333 1.00 0.00 H new ATOM 0 HD2 TYR A 885 -0.018 -8.790 4.435 1.00 0.00 H new ATOM 0 HE1 TYR A 885 -2.253 -8.642 8.808 1.00 0.00 H new ATOM 0 HE2 TYR A 885 -1.650 -7.023 4.914 1.00 0.00 H new ATOM 0 HH TYR A 885 -3.629 -7.066 7.791 1.00 0.00 H new ATOM 1719 N VAL A 886 0.550 -11.875 3.410 1.00 0.00 N ATOM 1720 CA VAL A 886 0.238 -11.732 2.010 1.00 0.00 C ATOM 1721 C VAL A 886 -0.288 -13.052 1.440 1.00 0.00 C ATOM 1722 O VAL A 886 -1.198 -13.061 0.610 1.00 0.00 O ATOM 1723 CB VAL A 886 1.509 -11.247 1.284 1.00 0.00 C ATOM 1724 CG1 VAL A 886 1.685 -11.890 -0.081 1.00 0.00 C ATOM 1725 CG2 VAL A 886 1.501 -9.734 1.158 1.00 0.00 C ATOM 0 H VAL A 886 1.540 -11.751 3.621 1.00 0.00 H new ATOM 0 HA VAL A 886 -0.554 -10.997 1.864 1.00 0.00 H new ATOM 0 HB VAL A 886 2.359 -11.555 1.892 1.00 0.00 H new ATOM 0 HG11 VAL A 886 2.595 -11.512 -0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 886 1.758 -12.972 0.033 1.00 0.00 H new ATOM 0 HG13 VAL A 886 0.828 -11.648 -0.710 1.00 0.00 H new ATOM 0 HG21 VAL A 886 2.405 -9.407 0.643 1.00 0.00 H new ATOM 0 HG22 VAL A 886 0.626 -9.421 0.589 1.00 0.00 H new ATOM 0 HG23 VAL A 886 1.467 -9.286 2.151 1.00 0.00 H new ATOM 1735 N LYS A 887 0.264 -14.159 1.928 1.00 0.00 N ATOM 1736 CA LYS A 887 -0.183 -15.491 1.542 1.00 0.00 C ATOM 1737 C LYS A 887 -1.678 -15.659 1.782 1.00 0.00 C ATOM 1738 O LYS A 887 -2.414 -16.066 0.885 1.00 0.00 O ATOM 1739 CB LYS A 887 0.573 -16.554 2.338 1.00 0.00 C ATOM 1740 CG LYS A 887 1.696 -17.219 1.564 1.00 0.00 C ATOM 1741 CD LYS A 887 2.691 -17.876 2.503 1.00 0.00 C ATOM 1742 CE LYS A 887 3.476 -18.975 1.806 1.00 0.00 C ATOM 1743 NZ LYS A 887 4.855 -18.542 1.470 1.00 0.00 N ATOM 0 H LYS A 887 1.031 -14.157 2.600 1.00 0.00 H new ATOM 0 HA LYS A 887 0.020 -15.613 0.478 1.00 0.00 H new ATOM 0 HB2 LYS A 887 0.986 -16.096 3.237 1.00 0.00 H new ATOM 0 HB3 LYS A 887 -0.132 -17.318 2.665 1.00 0.00 H new ATOM 0 HG2 LYS A 887 1.282 -17.966 0.886 1.00 0.00 H new ATOM 0 HG3 LYS A 887 2.206 -16.478 0.949 1.00 0.00 H new ATOM 0 HD2 LYS A 887 3.380 -17.124 2.888 1.00 0.00 H new ATOM 0 HD3 LYS A 887 2.163 -18.293 3.360 1.00 0.00 H new ATOM 0 HE2 LYS A 887 3.518 -19.855 2.449 1.00 0.00 H new ATOM 0 HE3 LYS A 887 2.956 -19.271 0.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 887 4.877 -18.176 0.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 887 5.154 -17.794 2.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 887 5.502 -19.352 1.550 1.00 0.00 H new ATOM 1757 N SER A 888 -2.121 -15.344 2.995 1.00 0.00 N ATOM 1758 CA SER A 888 -3.523 -15.501 3.361 1.00 0.00 C ATOM 1759 C SER A 888 -4.418 -14.510 2.619 1.00 0.00 C ATOM 1760 O SER A 888 -5.567 -14.820 2.302 1.00 0.00 O ATOM 1761 CB SER A 888 -3.701 -15.328 4.869 1.00 0.00 C ATOM 1762 OG SER A 888 -2.682 -14.505 5.419 1.00 0.00 O ATOM 0 H SER A 888 -1.529 -14.979 3.741 1.00 0.00 H new ATOM 0 HA SER A 888 -3.824 -16.508 3.072 1.00 0.00 H new ATOM 0 HB2 SER A 888 -4.677 -14.888 5.074 1.00 0.00 H new ATOM 0 HB3 SER A 888 -3.684 -16.304 5.354 1.00 0.00 H new ATOM 0 HG SER A 888 -2.547 -13.723 4.844 1.00 0.00 H new ATOM 1768 N LEU A 889 -3.890 -13.319 2.348 1.00 0.00 N ATOM 1769 CA LEU A 889 -4.669 -12.277 1.687 1.00 0.00 C ATOM 1770 C LEU A 889 -4.901 -12.593 0.209 1.00 0.00 C ATOM 1771 O LEU A 889 -5.911 -12.184 -0.367 1.00 0.00 O ATOM 1772 CB LEU A 889 -3.981 -10.921 1.832 1.00 0.00 C ATOM 1773 CG LEU A 889 -4.778 -9.882 2.617 1.00 0.00 C ATOM 1774 CD1 LEU A 889 -4.063 -9.533 3.910 1.00 0.00 C ATOM 1775 CD2 LEU A 889 -5.006 -8.638 1.772 1.00 0.00 C ATOM 0 H LEU A 889 -2.932 -13.053 2.575 1.00 0.00 H new ATOM 0 HA LEU A 889 -5.642 -12.238 2.176 1.00 0.00 H new ATOM 0 HB2 LEU A 889 -3.019 -11.068 2.323 1.00 0.00 H new ATOM 0 HB3 LEU A 889 -3.775 -10.525 0.838 1.00 0.00 H new ATOM 0 HG LEU A 889 -5.750 -10.306 2.868 1.00 0.00 H new ATOM 0 HD11 LEU A 889 -4.644 -8.791 4.458 1.00 0.00 H new ATOM 0 HD12 LEU A 889 -3.954 -10.430 4.519 1.00 0.00 H new ATOM 0 HD13 LEU A 889 -3.078 -9.126 3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 889 -5.576 -7.907 2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 889 -4.045 -8.208 1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 889 -5.561 -8.906 0.873 1.00 0.00 H new ATOM 1787 N LEU A 890 -3.960 -13.309 -0.397 1.00 0.00 N ATOM 1788 CA LEU A 890 -4.079 -13.705 -1.795 1.00 0.00 C ATOM 1789 C LEU A 890 -5.183 -14.739 -1.978 1.00 0.00 C ATOM 1790 O LEU A 890 -5.028 -15.878 -1.493 1.00 0.00 O ATOM 1791 CB LEU A 890 -2.750 -14.267 -2.300 1.00 0.00 C ATOM 1792 CG LEU A 890 -1.654 -13.227 -2.523 1.00 0.00 C ATOM 1793 CD1 LEU A 890 -0.373 -13.894 -3.000 1.00 0.00 C ATOM 1794 CD2 LEU A 890 -2.117 -12.178 -3.520 1.00 0.00 C ATOM 1795 OXT LEU A 890 -6.206 -14.414 -2.613 1.00 0.00 O ATOM 0 H LEU A 890 -3.105 -13.627 0.059 1.00 0.00 H new ATOM 0 HA LEU A 890 -4.338 -12.820 -2.376 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -2.389 -15.006 -1.584 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -2.928 -14.793 -3.238 1.00 0.00 H new ATOM 0 HG LEU A 890 -1.446 -12.733 -1.574 1.00 0.00 H new ATOM 0 HD11 LEU A 890 0.396 -13.137 -3.153 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -0.034 -14.609 -2.250 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -0.562 -14.415 -3.939 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -1.326 -11.443 -3.669 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -2.351 -12.658 -4.471 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -3.007 -11.680 -3.137 1.00 0.00 H new TER 1807 LEU A 890