USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 141:sc= -0.0122 (180deg=-0.404) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 90:sc= 0.584 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 131:sc= 0.476 USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.0671 K(o=-0.067,f=-1!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -149:sc= -0.926 USER MOD Single : A 59 THR OG1 : rot 92:sc= 0.915 USER MOD Single : A 65 THR OG1 : rot 87:sc= 0.0702 USER MOD Single : A 67 MET CE :methyl -140:sc= 0 (180deg=-0.228) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -130:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 143:sc= -0.0608 (180deg=-2.06) USER MOD Single : A 90 MET CE :methyl 150:sc= -2.4! (180deg=-2.76!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -39.636 1.140 -6.861 1.00 0.00 N ATOM 2 CA MET A 1 -39.461 0.665 -8.223 1.00 0.00 C ATOM 3 C MET A 1 -38.224 1.294 -8.868 1.00 0.00 C ATOM 4 O MET A 1 -37.893 2.445 -8.591 1.00 0.00 O ATOM 5 CB MET A 1 -40.701 1.013 -9.049 1.00 0.00 C ATOM 6 CG MET A 1 -40.939 2.524 -9.071 1.00 0.00 C ATOM 7 SD MET A 1 -42.337 2.907 -10.112 1.00 0.00 S ATOM 8 CE MET A 1 -42.080 4.657 -10.346 1.00 0.00 C ATOM 0 H1 MET A 1 -40.648 1.290 -6.673 1.00 0.00 H new ATOM 0 H2 MET A 1 -39.261 0.434 -6.196 1.00 0.00 H new ATOM 0 H3 MET A 1 -39.125 2.037 -6.738 1.00 0.00 H new ATOM 0 HA MET A 1 -39.324 -0.416 -8.196 1.00 0.00 H new ATOM 0 HB2 MET A 1 -40.578 0.646 -10.068 1.00 0.00 H new ATOM 0 HB3 MET A 1 -41.573 0.510 -8.632 1.00 0.00 H new ATOM 0 HG2 MET A 1 -41.119 2.887 -8.059 1.00 0.00 H new ATOM 0 HG3 MET A 1 -40.050 3.035 -9.440 1.00 0.00 H new ATOM 0 HE1 MET A 1 -42.871 5.060 -10.979 1.00 0.00 H new ATOM 0 HE2 MET A 1 -42.097 5.160 -9.379 1.00 0.00 H new ATOM 0 HE3 MET A 1 -41.114 4.822 -10.824 1.00 0.00 H new ATOM 18 N ASP A 2 -37.575 0.509 -9.717 1.00 0.00 N ATOM 19 CA ASP A 2 -36.382 0.975 -10.403 1.00 0.00 C ATOM 20 C ASP A 2 -36.747 2.156 -11.305 1.00 0.00 C ATOM 21 O ASP A 2 -37.536 2.011 -12.236 1.00 0.00 O ATOM 22 CB ASP A 2 -35.789 -0.126 -11.284 1.00 0.00 C ATOM 23 CG ASP A 2 -34.854 -1.099 -10.562 1.00 0.00 C ATOM 24 OD1 ASP A 2 -34.774 -1.107 -9.324 1.00 0.00 O ATOM 25 OD2 ASP A 2 -34.180 -1.882 -11.333 1.00 0.00 O ATOM 0 H ASP A 2 -37.853 -0.446 -9.945 1.00 0.00 H new ATOM 0 HA ASP A 2 -35.651 1.267 -9.649 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -36.606 -0.694 -11.729 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -35.241 0.340 -12.103 1.00 0.00 H new ATOM 30 N LEU A 3 -36.153 3.300 -10.996 1.00 0.00 N ATOM 31 CA LEU A 3 -36.406 4.506 -11.766 1.00 0.00 C ATOM 32 C LEU A 3 -35.224 4.763 -12.704 1.00 0.00 C ATOM 33 O LEU A 3 -35.391 4.801 -13.922 1.00 0.00 O ATOM 34 CB LEU A 3 -36.720 5.680 -10.837 1.00 0.00 C ATOM 35 CG LEU A 3 -38.140 6.244 -10.925 1.00 0.00 C ATOM 36 CD1 LEU A 3 -38.847 6.160 -9.571 1.00 0.00 C ATOM 37 CD2 LEU A 3 -38.130 7.670 -11.479 1.00 0.00 C ATOM 0 H LEU A 3 -35.498 3.417 -10.223 1.00 0.00 H new ATOM 0 HA LEU A 3 -37.290 4.380 -12.391 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -36.539 5.363 -9.810 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -36.017 6.485 -11.051 1.00 0.00 H new ATOM 0 HG LEU A 3 -38.709 5.631 -11.624 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -39.854 6.567 -9.661 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -38.903 5.119 -9.254 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -38.288 6.734 -8.832 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -39.151 8.047 -11.531 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -37.540 8.311 -10.824 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -37.692 7.670 -12.477 1.00 0.00 H new ATOM 49 N ILE A 4 -34.057 4.933 -12.101 1.00 0.00 N ATOM 50 CA ILE A 4 -32.848 5.185 -12.867 1.00 0.00 C ATOM 51 C ILE A 4 -32.758 4.178 -14.015 1.00 0.00 C ATOM 52 O ILE A 4 -33.335 4.393 -15.080 1.00 0.00 O ATOM 53 CB ILE A 4 -31.623 5.184 -11.950 1.00 0.00 C ATOM 54 CG1 ILE A 4 -30.333 5.042 -12.760 1.00 0.00 C ATOM 55 CG2 ILE A 4 -31.746 4.106 -10.872 1.00 0.00 C ATOM 56 CD1 ILE A 4 -29.293 6.074 -12.320 1.00 0.00 C ATOM 0 H ILE A 4 -33.923 4.901 -11.090 1.00 0.00 H new ATOM 0 HA ILE A 4 -32.881 6.178 -13.315 1.00 0.00 H new ATOM 0 HB ILE A 4 -31.577 6.145 -11.439 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -29.929 4.037 -12.634 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -30.550 5.168 -13.821 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -30.862 4.127 -10.234 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -32.634 4.295 -10.268 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -31.830 3.127 -11.344 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -28.386 5.951 -12.911 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -29.691 7.078 -12.470 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -29.061 5.929 -11.265 1.00 0.00 H new ATOM 68 N GLY A 5 -32.029 3.102 -13.760 1.00 0.00 N ATOM 69 CA GLY A 5 -31.856 2.061 -14.759 1.00 0.00 C ATOM 70 C GLY A 5 -30.692 2.389 -15.696 1.00 0.00 C ATOM 71 O GLY A 5 -29.877 1.523 -16.006 1.00 0.00 O ATOM 0 H GLY A 5 -31.551 2.928 -12.876 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -31.673 1.106 -14.266 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -32.773 1.951 -15.337 1.00 0.00 H new ATOM 75 N PHE A 6 -30.653 3.644 -16.121 1.00 0.00 N ATOM 76 CA PHE A 6 -29.602 4.097 -17.017 1.00 0.00 C ATOM 77 C PHE A 6 -28.235 4.041 -16.332 1.00 0.00 C ATOM 78 O PHE A 6 -27.348 3.309 -16.768 1.00 0.00 O ATOM 79 CB PHE A 6 -29.919 5.550 -17.378 1.00 0.00 C ATOM 80 CG PHE A 6 -29.599 5.914 -18.830 1.00 0.00 C ATOM 81 CD1 PHE A 6 -30.124 5.179 -19.847 1.00 0.00 C ATOM 82 CD2 PHE A 6 -28.791 6.973 -19.103 1.00 0.00 C ATOM 83 CE1 PHE A 6 -29.827 5.517 -21.193 1.00 0.00 C ATOM 84 CE2 PHE A 6 -28.494 7.311 -20.449 1.00 0.00 C ATOM 85 CZ PHE A 6 -29.018 6.576 -21.466 1.00 0.00 C ATOM 0 H PHE A 6 -31.331 4.360 -15.862 1.00 0.00 H new ATOM 0 HA PHE A 6 -29.563 3.457 -17.899 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -30.976 5.738 -17.192 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -29.357 6.209 -16.716 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -30.767 4.338 -19.630 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -28.375 7.557 -18.295 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -30.243 4.933 -22.001 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -27.852 8.152 -20.666 1.00 0.00 H new ATOM 0 HZ PHE A 6 -28.792 6.833 -22.490 1.00 0.00 H new ATOM 95 N GLY A 7 -28.108 4.824 -15.271 1.00 0.00 N ATOM 96 CA GLY A 7 -26.864 4.873 -14.522 1.00 0.00 C ATOM 97 C GLY A 7 -26.310 3.466 -14.287 1.00 0.00 C ATOM 98 O GLY A 7 -25.138 3.204 -14.551 1.00 0.00 O ATOM 0 H GLY A 7 -28.846 5.430 -14.912 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -26.132 5.470 -15.065 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -27.031 5.367 -13.565 1.00 0.00 H new ATOM 102 N TYR A 8 -27.180 2.597 -13.793 1.00 0.00 N ATOM 103 CA TYR A 8 -26.792 1.223 -13.520 1.00 0.00 C ATOM 104 C TYR A 8 -26.089 0.601 -14.728 1.00 0.00 C ATOM 105 O TYR A 8 -24.956 0.135 -14.619 1.00 0.00 O ATOM 106 CB TYR A 8 -28.093 0.463 -13.255 1.00 0.00 C ATOM 107 CG TYR A 8 -27.922 -0.774 -12.370 1.00 0.00 C ATOM 108 CD1 TYR A 8 -27.444 -1.949 -12.912 1.00 0.00 C ATOM 109 CD2 TYR A 8 -28.247 -0.713 -11.030 1.00 0.00 C ATOM 110 CE1 TYR A 8 -27.283 -3.113 -12.079 1.00 0.00 C ATOM 111 CE2 TYR A 8 -28.086 -1.877 -10.197 1.00 0.00 C ATOM 112 CZ TYR A 8 -27.612 -3.019 -10.763 1.00 0.00 C ATOM 113 OH TYR A 8 -27.460 -4.118 -9.976 1.00 0.00 O ATOM 0 H TYR A 8 -28.152 2.817 -13.575 1.00 0.00 H new ATOM 0 HA TYR A 8 -26.102 1.179 -12.677 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -28.807 1.139 -12.784 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -28.524 0.158 -14.208 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -27.191 -1.996 -13.961 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -28.622 0.207 -10.606 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -26.910 -4.039 -12.490 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -28.336 -1.844 -9.147 1.00 0.00 H new ATOM 0 HH TYR A 8 -27.733 -3.904 -9.059 1.00 0.00 H new ATOM 123 N ALA A 9 -26.790 0.614 -15.852 1.00 0.00 N ATOM 124 CA ALA A 9 -26.247 0.057 -17.079 1.00 0.00 C ATOM 125 C ALA A 9 -24.995 0.841 -17.479 1.00 0.00 C ATOM 126 O ALA A 9 -24.169 0.349 -18.247 1.00 0.00 O ATOM 127 CB ALA A 9 -27.320 0.079 -18.169 1.00 0.00 C ATOM 0 H ALA A 9 -27.729 1.002 -15.939 1.00 0.00 H new ATOM 0 HA ALA A 9 -25.953 -0.982 -16.931 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -26.912 -0.339 -19.089 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -28.176 -0.515 -17.849 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -27.637 1.107 -18.347 1.00 0.00 H new ATOM 133 N ALA A 10 -24.892 2.046 -16.940 1.00 0.00 N ATOM 134 CA ALA A 10 -23.754 2.902 -17.231 1.00 0.00 C ATOM 135 C ALA A 10 -22.491 2.287 -16.626 1.00 0.00 C ATOM 136 O ALA A 10 -21.564 1.926 -17.349 1.00 0.00 O ATOM 137 CB ALA A 10 -24.027 4.312 -16.702 1.00 0.00 C ATOM 0 H ALA A 10 -25.578 2.451 -16.303 1.00 0.00 H new ATOM 0 HA ALA A 10 -23.599 2.982 -18.307 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -23.174 4.954 -16.920 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -24.917 4.715 -17.184 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -24.185 4.272 -15.624 1.00 0.00 H new ATOM 143 N LEU A 11 -22.495 2.186 -15.304 1.00 0.00 N ATOM 144 CA LEU A 11 -21.360 1.620 -14.594 1.00 0.00 C ATOM 145 C LEU A 11 -21.093 0.206 -15.113 1.00 0.00 C ATOM 146 O LEU A 11 -19.941 -0.184 -15.296 1.00 0.00 O ATOM 147 CB LEU A 11 -21.587 1.688 -13.082 1.00 0.00 C ATOM 148 CG LEU A 11 -22.492 0.606 -12.490 1.00 0.00 C ATOM 149 CD1 LEU A 11 -21.694 -0.658 -12.163 1.00 0.00 C ATOM 150 CD2 LEU A 11 -23.255 1.134 -11.273 1.00 0.00 C ATOM 0 H LEU A 11 -23.265 2.486 -14.707 1.00 0.00 H new ATOM 0 HA LEU A 11 -20.460 2.205 -14.785 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -20.618 1.634 -12.586 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -22.014 2.662 -12.842 1.00 0.00 H new ATOM 0 HG LEU A 11 -23.234 0.333 -13.241 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -22.361 -1.411 -11.744 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -21.236 -1.045 -13.073 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -20.915 -0.419 -11.439 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -23.891 0.345 -10.872 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -22.546 1.452 -10.509 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -23.873 1.981 -11.570 1.00 0.00 H new ATOM 162 N VAL A 12 -22.176 -0.523 -15.335 1.00 0.00 N ATOM 163 CA VAL A 12 -22.073 -1.886 -15.829 1.00 0.00 C ATOM 164 C VAL A 12 -21.262 -1.893 -17.127 1.00 0.00 C ATOM 165 O VAL A 12 -20.329 -2.680 -17.276 1.00 0.00 O ATOM 166 CB VAL A 12 -23.469 -2.490 -15.993 1.00 0.00 C ATOM 167 CG1 VAL A 12 -23.404 -3.827 -16.735 1.00 0.00 C ATOM 168 CG2 VAL A 12 -24.160 -2.649 -14.637 1.00 0.00 C ATOM 0 H VAL A 12 -23.130 -0.196 -15.182 1.00 0.00 H new ATOM 0 HA VAL A 12 -21.544 -2.514 -15.112 1.00 0.00 H new ATOM 0 HB VAL A 12 -24.064 -1.802 -16.594 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -24.409 -4.235 -16.838 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -22.971 -3.674 -17.724 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -22.785 -4.526 -16.172 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -25.151 -3.080 -14.782 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -23.567 -3.307 -14.001 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -24.255 -1.673 -14.161 1.00 0.00 H new ATOM 178 N THR A 13 -21.649 -1.007 -18.033 1.00 0.00 N ATOM 179 CA THR A 13 -20.969 -0.901 -19.313 1.00 0.00 C ATOM 180 C THR A 13 -19.511 -0.485 -19.111 1.00 0.00 C ATOM 181 O THR A 13 -18.633 -0.900 -19.865 1.00 0.00 O ATOM 182 CB THR A 13 -21.762 0.069 -20.191 1.00 0.00 C ATOM 183 OG1 THR A 13 -22.912 -0.676 -20.582 1.00 0.00 O ATOM 184 CG2 THR A 13 -21.053 0.380 -21.510 1.00 0.00 C ATOM 0 H THR A 13 -22.424 -0.356 -17.906 1.00 0.00 H new ATOM 0 HA THR A 13 -20.931 -1.865 -19.821 1.00 0.00 H new ATOM 0 HB THR A 13 -21.932 0.996 -19.644 1.00 0.00 H new ATOM 0 HG1 THR A 13 -23.627 -0.542 -19.925 1.00 0.00 H new ATOM 0 HG21 THR A 13 -21.659 1.073 -22.094 1.00 0.00 H new ATOM 0 HG22 THR A 13 -20.083 0.832 -21.304 1.00 0.00 H new ATOM 0 HG23 THR A 13 -20.911 -0.542 -22.073 1.00 0.00 H new ATOM 192 N PHE A 14 -19.299 0.330 -18.088 1.00 0.00 N ATOM 193 CA PHE A 14 -17.962 0.807 -17.776 1.00 0.00 C ATOM 194 C PHE A 14 -17.053 -0.348 -17.353 1.00 0.00 C ATOM 195 O PHE A 14 -15.969 -0.525 -17.907 1.00 0.00 O ATOM 196 CB PHE A 14 -18.098 1.788 -16.610 1.00 0.00 C ATOM 197 CG PHE A 14 -17.108 2.954 -16.659 1.00 0.00 C ATOM 198 CD1 PHE A 14 -17.248 3.926 -17.599 1.00 0.00 C ATOM 199 CD2 PHE A 14 -16.087 3.017 -15.762 1.00 0.00 C ATOM 200 CE1 PHE A 14 -16.329 5.008 -17.645 1.00 0.00 C ATOM 201 CE2 PHE A 14 -15.168 4.099 -15.807 1.00 0.00 C ATOM 202 CZ PHE A 14 -15.309 5.071 -16.748 1.00 0.00 C ATOM 0 H PHE A 14 -20.030 0.672 -17.465 1.00 0.00 H new ATOM 0 HA PHE A 14 -17.520 1.278 -18.654 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -19.113 2.186 -16.600 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -17.959 1.246 -15.675 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -18.058 3.875 -18.311 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -15.975 2.244 -15.016 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -16.440 5.780 -18.392 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -14.358 4.150 -15.095 1.00 0.00 H new ATOM 0 HZ PHE A 14 -14.610 5.894 -16.783 1.00 0.00 H new ATOM 212 N GLY A 15 -17.527 -1.104 -16.373 1.00 0.00 N ATOM 213 CA GLY A 15 -16.770 -2.237 -15.868 1.00 0.00 C ATOM 214 C GLY A 15 -16.675 -3.345 -16.919 1.00 0.00 C ATOM 215 O GLY A 15 -15.744 -4.148 -16.897 1.00 0.00 O ATOM 0 H GLY A 15 -18.426 -0.954 -15.915 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -15.769 -1.913 -15.585 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -17.246 -2.625 -14.967 1.00 0.00 H new ATOM 219 N SER A 16 -17.652 -3.352 -17.815 1.00 0.00 N ATOM 220 CA SER A 16 -17.691 -4.348 -18.872 1.00 0.00 C ATOM 221 C SER A 16 -16.539 -4.116 -19.852 1.00 0.00 C ATOM 222 O SER A 16 -15.733 -5.014 -20.092 1.00 0.00 O ATOM 223 CB SER A 16 -19.030 -4.316 -19.610 1.00 0.00 C ATOM 224 OG SER A 16 -19.716 -5.562 -19.526 1.00 0.00 O ATOM 0 H SER A 16 -18.422 -2.684 -17.830 1.00 0.00 H new ATOM 0 HA SER A 16 -17.581 -5.333 -18.418 1.00 0.00 H new ATOM 0 HB2 SER A 16 -19.656 -3.528 -19.191 1.00 0.00 H new ATOM 0 HB3 SER A 16 -18.861 -4.065 -20.657 1.00 0.00 H new ATOM 0 HG SER A 16 -20.567 -5.500 -20.008 1.00 0.00 H new ATOM 230 N ILE A 17 -16.498 -2.907 -20.392 1.00 0.00 N ATOM 231 CA ILE A 17 -15.458 -2.546 -21.340 1.00 0.00 C ATOM 232 C ILE A 17 -14.111 -2.489 -20.617 1.00 0.00 C ATOM 233 O ILE A 17 -13.167 -3.176 -21.002 1.00 0.00 O ATOM 234 CB ILE A 17 -15.822 -1.249 -22.066 1.00 0.00 C ATOM 235 CG1 ILE A 17 -17.161 -1.384 -22.794 1.00 0.00 C ATOM 236 CG2 ILE A 17 -14.698 -0.814 -23.008 1.00 0.00 C ATOM 237 CD1 ILE A 17 -17.709 -0.013 -23.194 1.00 0.00 C ATOM 0 H ILE A 17 -17.168 -2.165 -20.191 1.00 0.00 H new ATOM 0 HA ILE A 17 -15.371 -3.306 -22.117 1.00 0.00 H new ATOM 0 HB ILE A 17 -15.940 -0.462 -21.321 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -17.035 -2.002 -23.683 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -17.879 -1.893 -22.151 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -14.982 0.110 -23.511 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -13.786 -0.649 -22.434 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -14.524 -1.593 -23.751 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -18.661 -0.138 -23.710 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -17.857 0.594 -22.301 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -17.000 0.483 -23.857 1.00 0.00 H new ATOM 249 N PHE A 18 -14.066 -1.663 -19.582 1.00 0.00 N ATOM 250 CA PHE A 18 -12.850 -1.508 -18.801 1.00 0.00 C ATOM 251 C PHE A 18 -12.251 -2.869 -18.443 1.00 0.00 C ATOM 252 O PHE A 18 -11.050 -3.083 -18.600 1.00 0.00 O ATOM 253 CB PHE A 18 -13.236 -0.779 -17.513 1.00 0.00 C ATOM 254 CG PHE A 18 -12.042 -0.355 -16.656 1.00 0.00 C ATOM 255 CD1 PHE A 18 -11.279 -1.296 -16.039 1.00 0.00 C ATOM 256 CD2 PHE A 18 -11.743 0.964 -16.512 1.00 0.00 C ATOM 257 CE1 PHE A 18 -10.170 -0.903 -15.244 1.00 0.00 C ATOM 258 CE2 PHE A 18 -10.634 1.358 -15.716 1.00 0.00 C ATOM 259 CZ PHE A 18 -9.871 0.416 -15.099 1.00 0.00 C ATOM 0 H PHE A 18 -14.852 -1.094 -19.266 1.00 0.00 H new ATOM 0 HA PHE A 18 -12.107 -0.954 -19.375 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -13.819 0.106 -17.769 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -13.883 -1.426 -16.921 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -11.517 -2.343 -16.154 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -12.348 1.712 -17.003 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -9.564 -1.651 -14.755 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -10.397 2.405 -15.601 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.028 0.715 -14.494 1.00 0.00 H new ATOM 269 N GLY A 19 -13.115 -3.755 -17.970 1.00 0.00 N ATOM 270 CA GLY A 19 -12.686 -5.089 -17.588 1.00 0.00 C ATOM 271 C GLY A 19 -11.788 -5.705 -18.664 1.00 0.00 C ATOM 272 O GLY A 19 -10.614 -5.975 -18.417 1.00 0.00 O ATOM 0 H GLY A 19 -14.111 -3.575 -17.843 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -12.147 -5.045 -16.641 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.558 -5.724 -17.429 1.00 0.00 H new ATOM 276 N TYR A 20 -12.375 -5.908 -19.834 1.00 0.00 N ATOM 277 CA TYR A 20 -11.643 -6.487 -20.948 1.00 0.00 C ATOM 278 C TYR A 20 -11.013 -7.825 -20.554 1.00 0.00 C ATOM 279 O TYR A 20 -10.939 -8.156 -19.372 1.00 0.00 O ATOM 280 CB TYR A 20 -10.530 -5.492 -21.283 1.00 0.00 C ATOM 281 CG TYR A 20 -10.420 -5.160 -22.772 1.00 0.00 C ATOM 282 CD1 TYR A 20 -11.439 -4.475 -23.404 1.00 0.00 C ATOM 283 CD2 TYR A 20 -9.303 -5.545 -23.485 1.00 0.00 C ATOM 284 CE1 TYR A 20 -11.335 -4.162 -24.805 1.00 0.00 C ATOM 285 CE2 TYR A 20 -9.200 -5.233 -24.887 1.00 0.00 C ATOM 286 CZ TYR A 20 -10.221 -4.556 -25.478 1.00 0.00 C ATOM 287 OH TYR A 20 -10.123 -4.261 -26.802 1.00 0.00 O ATOM 0 H TYR A 20 -13.349 -5.682 -20.035 1.00 0.00 H new ATOM 0 HA TYR A 20 -12.309 -6.670 -21.791 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -10.702 -4.570 -20.727 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -9.578 -5.898 -20.941 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -12.314 -4.174 -22.847 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -8.506 -6.081 -22.991 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -12.124 -3.626 -25.311 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -8.332 -5.530 -25.456 1.00 0.00 H new ATOM 0 HH TYR A 20 -9.274 -4.603 -27.151 1.00 0.00 H new ATOM 297 N LYS A 21 -10.576 -8.557 -21.568 1.00 0.00 N ATOM 298 CA LYS A 21 -9.955 -9.852 -21.342 1.00 0.00 C ATOM 299 C LYS A 21 -8.776 -9.686 -20.382 1.00 0.00 C ATOM 300 O LYS A 21 -8.232 -8.592 -20.244 1.00 0.00 O ATOM 301 CB LYS A 21 -9.577 -10.504 -22.674 1.00 0.00 C ATOM 302 CG LYS A 21 -9.880 -12.003 -22.656 1.00 0.00 C ATOM 303 CD LYS A 21 -9.652 -12.626 -24.035 1.00 0.00 C ATOM 304 CE LYS A 21 -8.944 -13.977 -23.916 1.00 0.00 C ATOM 305 NZ LYS A 21 -8.601 -14.502 -25.256 1.00 0.00 N ATOM 0 H LYS A 21 -10.639 -8.279 -22.547 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.659 -10.535 -20.867 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.128 -10.028 -23.485 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.517 -10.346 -22.872 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.245 -12.497 -21.921 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.912 -12.165 -22.346 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.608 -12.756 -24.542 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.055 -11.951 -24.649 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.039 -13.868 -23.319 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.587 -14.686 -23.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.121 -15.419 -25.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.470 -14.624 -25.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.970 -13.832 -25.740 1.00 0.00 H new ATOM 319 N ARG A 22 -8.415 -10.790 -19.743 1.00 0.00 N ATOM 320 CA ARG A 22 -7.310 -10.781 -18.799 1.00 0.00 C ATOM 321 C ARG A 22 -6.228 -11.769 -19.240 1.00 0.00 C ATOM 322 O ARG A 22 -6.503 -12.699 -19.996 1.00 0.00 O ATOM 323 CB ARG A 22 -7.785 -11.148 -17.392 1.00 0.00 C ATOM 324 CG ARG A 22 -8.643 -10.032 -16.794 1.00 0.00 C ATOM 325 CD ARG A 22 -9.834 -10.609 -16.025 1.00 0.00 C ATOM 326 NE ARG A 22 -11.101 -10.184 -16.662 1.00 0.00 N ATOM 327 CZ ARG A 22 -11.684 -10.832 -17.679 1.00 0.00 C ATOM 328 NH1 ARG A 22 -11.118 -11.937 -18.182 1.00 0.00 N ATOM 329 NH2 ARG A 22 -12.833 -10.374 -18.195 1.00 0.00 N ATOM 0 H ARG A 22 -8.868 -11.696 -19.861 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.898 -9.772 -18.779 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -8.360 -12.073 -17.428 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -6.924 -11.333 -16.750 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -8.036 -9.420 -16.126 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.001 -9.378 -17.589 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.773 -11.697 -16.007 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.807 -10.271 -14.989 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.558 -9.346 -16.304 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.243 -12.285 -17.791 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.562 -12.430 -18.956 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -13.264 -9.532 -17.813 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -13.277 -10.868 -18.969 1.00 0.00 H new ATOM 343 N ARG A 23 -5.021 -11.534 -18.747 1.00 0.00 N ATOM 344 CA ARG A 23 -3.897 -12.392 -19.080 1.00 0.00 C ATOM 345 C ARG A 23 -3.826 -13.574 -18.112 1.00 0.00 C ATOM 346 O ARG A 23 -4.202 -14.691 -18.463 1.00 0.00 O ATOM 347 CB ARG A 23 -2.578 -11.617 -19.026 1.00 0.00 C ATOM 348 CG ARG A 23 -1.833 -11.709 -20.359 1.00 0.00 C ATOM 349 CD ARG A 23 -0.340 -11.957 -20.137 1.00 0.00 C ATOM 350 NE ARG A 23 0.434 -10.751 -20.507 1.00 0.00 N ATOM 351 CZ ARG A 23 1.728 -10.767 -20.856 1.00 0.00 C ATOM 352 NH1 ARG A 23 2.400 -11.926 -20.886 1.00 0.00 N ATOM 353 NH2 ARG A 23 2.350 -9.624 -21.176 1.00 0.00 N ATOM 0 H ARG A 23 -4.797 -10.762 -18.119 1.00 0.00 H new ATOM 0 HA ARG A 23 -4.049 -12.759 -20.095 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.776 -10.572 -18.787 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -1.952 -12.014 -18.227 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -2.254 -12.515 -20.960 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -1.972 -10.786 -20.922 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.156 -12.211 -19.093 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.011 -12.807 -20.734 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.047 -9.852 -20.496 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.927 -12.796 -20.643 1.00 0.00 H new ATOM 0 HH12 ARG A 23 3.385 -11.938 -21.152 1.00 0.00 H new ATOM 0 HH21 ARG A 23 1.839 -8.742 -21.154 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.335 -9.636 -21.442 1.00 0.00 H new ATOM 367 N GLY A 24 -3.341 -13.288 -16.913 1.00 0.00 N ATOM 368 CA GLY A 24 -3.216 -14.314 -15.892 1.00 0.00 C ATOM 369 C GLY A 24 -3.137 -13.691 -14.496 1.00 0.00 C ATOM 370 O GLY A 24 -2.962 -12.481 -14.361 1.00 0.00 O ATOM 0 H GLY A 24 -3.030 -12.360 -16.626 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -4.069 -14.990 -15.945 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.324 -14.911 -16.079 1.00 0.00 H new ATOM 374 N GLY A 25 -3.269 -14.547 -13.493 1.00 0.00 N ATOM 375 CA GLY A 25 -3.214 -14.096 -12.113 1.00 0.00 C ATOM 376 C GLY A 25 -4.454 -13.274 -11.755 1.00 0.00 C ATOM 377 O GLY A 25 -4.443 -12.048 -11.864 1.00 0.00 O ATOM 0 H GLY A 25 -3.414 -15.550 -13.609 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -3.139 -14.957 -11.448 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -2.318 -13.495 -11.958 1.00 0.00 H new ATOM 381 N VAL A 26 -5.493 -13.980 -11.336 1.00 0.00 N ATOM 382 CA VAL A 26 -6.738 -13.331 -10.961 1.00 0.00 C ATOM 383 C VAL A 26 -6.458 -12.290 -9.875 1.00 0.00 C ATOM 384 O VAL A 26 -6.858 -11.134 -10.001 1.00 0.00 O ATOM 385 CB VAL A 26 -7.767 -14.379 -10.534 1.00 0.00 C ATOM 386 CG1 VAL A 26 -8.514 -13.933 -9.276 1.00 0.00 C ATOM 387 CG2 VAL A 26 -8.743 -14.685 -11.672 1.00 0.00 C ATOM 0 H VAL A 26 -5.499 -14.996 -11.248 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.166 -12.804 -11.814 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.231 -15.298 -10.297 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.240 -14.696 -8.994 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.803 -13.790 -8.462 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.033 -12.995 -9.474 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.464 -15.433 -11.342 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -9.270 -13.773 -11.955 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.192 -15.067 -12.531 1.00 0.00 H new ATOM 397 N PRO A 27 -5.756 -12.750 -8.805 1.00 0.00 N ATOM 398 CA PRO A 27 -5.419 -11.872 -7.698 1.00 0.00 C ATOM 399 C PRO A 27 -4.282 -10.921 -8.079 1.00 0.00 C ATOM 400 O PRO A 27 -3.265 -10.857 -7.390 1.00 0.00 O ATOM 401 CB PRO A 27 -5.055 -12.804 -6.553 1.00 0.00 C ATOM 402 CG PRO A 27 -4.753 -14.150 -7.192 1.00 0.00 C ATOM 403 CD PRO A 27 -5.267 -14.113 -8.622 1.00 0.00 C ATOM 0 HA PRO A 27 -6.243 -11.217 -7.415 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.191 -12.430 -6.004 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -5.875 -12.885 -5.840 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -3.681 -14.348 -7.177 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -5.234 -14.954 -6.634 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -4.476 -14.349 -9.333 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -6.062 -14.843 -8.776 1.00 0.00 H new ATOM 411 N SER A 28 -4.493 -10.207 -9.175 1.00 0.00 N ATOM 412 CA SER A 28 -3.499 -9.263 -9.655 1.00 0.00 C ATOM 413 C SER A 28 -4.095 -7.855 -9.706 1.00 0.00 C ATOM 414 O SER A 28 -3.697 -6.980 -8.938 1.00 0.00 O ATOM 415 CB SER A 28 -2.977 -9.668 -11.035 1.00 0.00 C ATOM 416 OG SER A 28 -2.452 -10.993 -11.040 1.00 0.00 O ATOM 0 H SER A 28 -5.338 -10.263 -9.744 1.00 0.00 H new ATOM 0 HA SER A 28 -2.658 -9.270 -8.961 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.784 -9.595 -11.764 1.00 0.00 H new ATOM 0 HB3 SER A 28 -2.201 -8.970 -11.348 1.00 0.00 H new ATOM 0 HG SER A 28 -2.824 -11.489 -11.799 1.00 0.00 H new ATOM 422 N LEU A 29 -5.041 -7.680 -10.617 1.00 0.00 N ATOM 423 CA LEU A 29 -5.697 -6.393 -10.777 1.00 0.00 C ATOM 424 C LEU A 29 -6.156 -5.886 -9.409 1.00 0.00 C ATOM 425 O LEU A 29 -5.678 -4.858 -8.931 1.00 0.00 O ATOM 426 CB LEU A 29 -6.823 -6.491 -11.808 1.00 0.00 C ATOM 427 CG LEU A 29 -7.670 -7.764 -11.757 1.00 0.00 C ATOM 428 CD1 LEU A 29 -9.140 -7.436 -11.489 1.00 0.00 C ATOM 429 CD2 LEU A 29 -7.491 -8.592 -13.032 1.00 0.00 C ATOM 0 H LEU A 29 -5.369 -8.408 -11.252 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.999 -5.655 -11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.483 -5.634 -11.678 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.386 -6.409 -12.803 1.00 0.00 H new ATOM 0 HG LEU A 29 -7.320 -8.374 -10.924 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.719 -8.359 -11.458 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.229 -6.919 -10.533 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.521 -6.796 -12.285 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -8.104 -9.492 -12.971 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.798 -8.002 -13.895 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.443 -8.873 -13.139 1.00 0.00 H new ATOM 441 N ILE A 30 -7.079 -6.630 -8.817 1.00 0.00 N ATOM 442 CA ILE A 30 -7.609 -6.269 -7.513 1.00 0.00 C ATOM 443 C ILE A 30 -6.463 -5.796 -6.616 1.00 0.00 C ATOM 444 O ILE A 30 -6.619 -4.840 -5.857 1.00 0.00 O ATOM 445 CB ILE A 30 -8.415 -7.427 -6.922 1.00 0.00 C ATOM 446 CG1 ILE A 30 -9.127 -7.000 -5.637 1.00 0.00 C ATOM 447 CG2 ILE A 30 -7.531 -8.657 -6.706 1.00 0.00 C ATOM 448 CD1 ILE A 30 -9.817 -5.646 -5.816 1.00 0.00 C ATOM 0 H ILE A 30 -7.473 -7.482 -9.217 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.309 -5.438 -7.603 1.00 0.00 H new ATOM 0 HB ILE A 30 -9.186 -7.707 -7.640 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.864 -7.753 -5.358 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -8.407 -6.940 -4.821 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -8.129 -9.465 -6.285 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.111 -8.975 -7.660 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.723 -8.408 -6.019 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.315 -5.366 -4.888 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.074 -4.890 -6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -10.554 -5.716 -6.616 1.00 0.00 H new ATOM 460 N ALA A 31 -5.339 -6.487 -6.731 1.00 0.00 N ATOM 461 CA ALA A 31 -4.168 -6.150 -5.940 1.00 0.00 C ATOM 462 C ALA A 31 -3.716 -4.729 -6.285 1.00 0.00 C ATOM 463 O ALA A 31 -3.478 -3.916 -5.394 1.00 0.00 O ATOM 464 CB ALA A 31 -3.070 -7.187 -6.184 1.00 0.00 C ATOM 0 H ALA A 31 -5.214 -7.280 -7.361 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.405 -6.171 -4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.192 -6.934 -5.590 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.431 -8.174 -5.895 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.804 -7.193 -7.241 1.00 0.00 H new ATOM 470 N GLY A 32 -3.611 -4.475 -7.581 1.00 0.00 N ATOM 471 CA GLY A 32 -3.192 -3.167 -8.056 1.00 0.00 C ATOM 472 C GLY A 32 -4.219 -2.095 -7.688 1.00 0.00 C ATOM 473 O GLY A 32 -3.900 -1.142 -6.979 1.00 0.00 O ATOM 0 H GLY A 32 -3.809 -5.153 -8.317 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.224 -2.912 -7.624 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.061 -3.194 -9.138 1.00 0.00 H new ATOM 477 N LEU A 33 -5.432 -2.287 -8.186 1.00 0.00 N ATOM 478 CA LEU A 33 -6.508 -1.348 -7.918 1.00 0.00 C ATOM 479 C LEU A 33 -6.449 -0.917 -6.452 1.00 0.00 C ATOM 480 O LEU A 33 -6.537 0.272 -6.147 1.00 0.00 O ATOM 481 CB LEU A 33 -7.855 -1.945 -8.330 1.00 0.00 C ATOM 482 CG LEU A 33 -9.097 -1.178 -7.874 1.00 0.00 C ATOM 483 CD1 LEU A 33 -9.841 -0.578 -9.069 1.00 0.00 C ATOM 484 CD2 LEU A 33 -10.006 -2.063 -7.019 1.00 0.00 C ATOM 0 H LEU A 33 -5.693 -3.079 -8.773 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.387 -0.448 -8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.879 -2.021 -9.417 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.915 -2.960 -7.938 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.773 -0.348 -7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -10.720 -0.038 -8.717 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.182 0.109 -9.600 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.152 -1.377 -9.742 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.881 -1.493 -6.708 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.324 -2.928 -7.601 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -9.461 -2.400 -6.137 1.00 0.00 H new ATOM 496 N PHE A 34 -6.302 -1.906 -5.582 1.00 0.00 N ATOM 497 CA PHE A 34 -6.231 -1.643 -4.155 1.00 0.00 C ATOM 498 C PHE A 34 -5.043 -0.738 -3.823 1.00 0.00 C ATOM 499 O PHE A 34 -5.208 0.296 -3.177 1.00 0.00 O ATOM 500 CB PHE A 34 -6.038 -2.993 -3.461 1.00 0.00 C ATOM 501 CG PHE A 34 -6.359 -2.975 -1.965 1.00 0.00 C ATOM 502 CD1 PHE A 34 -5.400 -2.622 -1.068 1.00 0.00 C ATOM 503 CD2 PHE A 34 -7.603 -3.313 -1.533 1.00 0.00 C ATOM 504 CE1 PHE A 34 -5.698 -2.605 0.320 1.00 0.00 C ATOM 505 CE2 PHE A 34 -7.901 -3.296 -0.144 1.00 0.00 C ATOM 506 CZ PHE A 34 -6.942 -2.943 0.753 1.00 0.00 C ATOM 0 H PHE A 34 -6.230 -2.891 -5.838 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.140 -1.141 -3.823 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.671 -3.735 -3.949 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -5.006 -3.316 -3.597 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -4.412 -2.355 -1.411 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.364 -3.594 -2.245 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -4.936 -2.324 1.032 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.889 -3.563 0.199 1.00 0.00 H new ATOM 0 HZ PHE A 34 -7.168 -2.931 1.809 1.00 0.00 H new ATOM 516 N VAL A 35 -3.873 -1.159 -4.279 1.00 0.00 N ATOM 517 CA VAL A 35 -2.658 -0.400 -4.038 1.00 0.00 C ATOM 518 C VAL A 35 -2.848 1.032 -4.544 1.00 0.00 C ATOM 519 O VAL A 35 -2.277 1.970 -3.991 1.00 0.00 O ATOM 520 CB VAL A 35 -1.463 -1.107 -4.679 1.00 0.00 C ATOM 521 CG1 VAL A 35 -0.200 -0.250 -4.579 1.00 0.00 C ATOM 522 CG2 VAL A 35 -1.241 -2.485 -4.053 1.00 0.00 C ATOM 0 H VAL A 35 -3.740 -2.017 -4.815 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.449 -0.343 -2.970 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.687 -1.251 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.634 -0.776 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.362 0.698 -5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.028 -0.060 -3.530 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.385 -2.966 -4.527 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.049 -2.373 -2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.130 -3.099 -4.200 1.00 0.00 H new ATOM 532 N GLY A 36 -3.652 1.153 -5.591 1.00 0.00 N ATOM 533 CA GLY A 36 -3.924 2.454 -6.178 1.00 0.00 C ATOM 534 C GLY A 36 -4.919 3.243 -5.325 1.00 0.00 C ATOM 535 O GLY A 36 -4.819 4.465 -5.218 1.00 0.00 O ATOM 0 H GLY A 36 -4.123 0.372 -6.047 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.995 3.016 -6.272 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.323 2.327 -7.184 1.00 0.00 H new ATOM 539 N CYS A 37 -5.857 2.514 -4.740 1.00 0.00 N ATOM 540 CA CYS A 37 -6.870 3.130 -3.900 1.00 0.00 C ATOM 541 C CYS A 37 -6.182 3.696 -2.656 1.00 0.00 C ATOM 542 O CYS A 37 -6.508 4.795 -2.208 1.00 0.00 O ATOM 543 CB CYS A 37 -7.982 2.144 -3.538 1.00 0.00 C ATOM 544 SG CYS A 37 -9.618 2.915 -3.817 1.00 0.00 S ATOM 0 H CYS A 37 -5.937 1.501 -4.831 1.00 0.00 H new ATOM 0 HA CYS A 37 -7.356 3.939 -4.446 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -7.889 1.241 -4.141 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -7.886 1.842 -2.495 1.00 0.00 H new ATOM 0 HG CYS A 37 -10.555 2.068 -3.509 1.00 0.00 H new ATOM 550 N LEU A 38 -5.244 2.921 -2.132 1.00 0.00 N ATOM 551 CA LEU A 38 -4.508 3.331 -0.949 1.00 0.00 C ATOM 552 C LEU A 38 -3.517 4.434 -1.327 1.00 0.00 C ATOM 553 O LEU A 38 -3.276 5.352 -0.544 1.00 0.00 O ATOM 554 CB LEU A 38 -3.855 2.121 -0.278 1.00 0.00 C ATOM 555 CG LEU A 38 -2.425 1.801 -0.719 1.00 0.00 C ATOM 556 CD1 LEU A 38 -1.422 2.751 -0.060 1.00 0.00 C ATOM 557 CD2 LEU A 38 -2.084 0.333 -0.451 1.00 0.00 C ATOM 0 H LEU A 38 -4.977 2.010 -2.506 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.185 3.751 -0.206 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.854 2.285 0.800 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.477 1.246 -0.467 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.357 1.957 -1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.414 2.502 -0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.653 3.778 -0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.484 2.651 1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.062 0.132 -0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.175 0.127 0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.772 -0.307 -1.004 1.00 0.00 H new ATOM 569 N ALA A 39 -2.970 4.308 -2.527 1.00 0.00 N ATOM 570 CA ALA A 39 -2.011 5.283 -3.018 1.00 0.00 C ATOM 571 C ALA A 39 -2.691 6.649 -3.129 1.00 0.00 C ATOM 572 O ALA A 39 -2.178 7.645 -2.620 1.00 0.00 O ATOM 573 CB ALA A 39 -1.438 4.807 -4.354 1.00 0.00 C ATOM 0 H ALA A 39 -3.173 3.546 -3.174 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.177 5.385 -2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.719 5.538 -4.723 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.941 3.847 -4.215 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.246 4.696 -5.078 1.00 0.00 H new ATOM 579 N GLY A 40 -3.834 6.653 -3.798 1.00 0.00 N ATOM 580 CA GLY A 40 -4.589 7.881 -3.983 1.00 0.00 C ATOM 581 C GLY A 40 -5.016 8.470 -2.636 1.00 0.00 C ATOM 582 O GLY A 40 -4.786 9.648 -2.369 1.00 0.00 O ATOM 0 H GLY A 40 -4.256 5.825 -4.219 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.983 8.607 -4.526 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -5.470 7.682 -4.593 1.00 0.00 H new ATOM 586 N TYR A 41 -5.629 7.622 -1.824 1.00 0.00 N ATOM 587 CA TYR A 41 -6.090 8.044 -0.512 1.00 0.00 C ATOM 588 C TYR A 41 -4.924 8.538 0.346 1.00 0.00 C ATOM 589 O TYR A 41 -5.109 9.374 1.230 1.00 0.00 O ATOM 590 CB TYR A 41 -6.697 6.801 0.142 1.00 0.00 C ATOM 591 CG TYR A 41 -7.518 7.096 1.399 1.00 0.00 C ATOM 592 CD1 TYR A 41 -8.782 7.637 1.286 1.00 0.00 C ATOM 593 CD2 TYR A 41 -6.993 6.822 2.645 1.00 0.00 C ATOM 594 CE1 TYR A 41 -9.555 7.915 2.469 1.00 0.00 C ATOM 595 CE2 TYR A 41 -7.766 7.100 3.829 1.00 0.00 C ATOM 596 CZ TYR A 41 -9.008 7.633 3.682 1.00 0.00 C ATOM 597 OH TYR A 41 -9.738 7.896 4.799 1.00 0.00 O ATOM 0 H TYR A 41 -5.817 6.645 -2.049 1.00 0.00 H new ATOM 0 HA TYR A 41 -6.806 8.861 -0.602 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -7.333 6.295 -0.584 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.894 6.110 0.399 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -9.192 7.852 0.310 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -6.003 6.399 2.733 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -10.546 8.338 2.395 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -7.368 6.890 4.811 1.00 0.00 H new ATOM 0 HH TYR A 41 -9.223 7.644 5.593 1.00 0.00 H new ATOM 607 N GLY A 42 -3.748 8.000 0.056 1.00 0.00 N ATOM 608 CA GLY A 42 -2.552 8.376 0.790 1.00 0.00 C ATOM 609 C GLY A 42 -2.053 9.756 0.356 1.00 0.00 C ATOM 610 O GLY A 42 -2.217 10.736 1.082 1.00 0.00 O ATOM 0 H GLY A 42 -3.598 7.307 -0.677 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -2.764 8.382 1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.771 7.634 0.624 1.00 0.00 H new ATOM 614 N ALA A 43 -1.455 9.790 -0.825 1.00 0.00 N ATOM 615 CA ALA A 43 -0.931 11.033 -1.365 1.00 0.00 C ATOM 616 C ALA A 43 -2.025 12.103 -1.322 1.00 0.00 C ATOM 617 O ALA A 43 -1.840 13.162 -0.725 1.00 0.00 O ATOM 618 CB ALA A 43 -0.404 10.794 -2.781 1.00 0.00 C ATOM 0 H ALA A 43 -1.321 8.975 -1.424 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.095 11.391 -0.764 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.011 11.727 -3.185 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.390 10.048 -2.753 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.215 10.437 -3.416 1.00 0.00 H new ATOM 624 N TYR A 44 -3.141 11.788 -1.964 1.00 0.00 N ATOM 625 CA TYR A 44 -4.264 12.709 -2.008 1.00 0.00 C ATOM 626 C TYR A 44 -3.866 14.029 -2.671 1.00 0.00 C ATOM 627 O TYR A 44 -3.311 14.912 -2.020 1.00 0.00 O ATOM 628 CB TYR A 44 -4.645 12.978 -0.551 1.00 0.00 C ATOM 629 CG TYR A 44 -6.017 13.632 -0.377 1.00 0.00 C ATOM 630 CD1 TYR A 44 -7.162 12.930 -0.696 1.00 0.00 C ATOM 631 CD2 TYR A 44 -6.111 14.924 0.099 1.00 0.00 C ATOM 632 CE1 TYR A 44 -8.453 13.545 -0.533 1.00 0.00 C ATOM 633 CE2 TYR A 44 -7.402 15.539 0.263 1.00 0.00 C ATOM 634 CZ TYR A 44 -8.510 14.820 -0.061 1.00 0.00 C ATOM 635 OH TYR A 44 -9.730 15.401 0.093 1.00 0.00 O ATOM 0 H TYR A 44 -3.291 10.908 -2.458 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.086 12.284 -2.584 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.631 12.036 -0.003 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -3.888 13.620 -0.101 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.089 11.919 -1.068 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -5.216 15.474 0.349 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.356 13.007 -0.780 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -7.489 16.549 0.635 1.00 0.00 H new ATOM 0 HH TYR A 44 -9.618 16.311 0.439 1.00 0.00 H new ATOM 645 N ARG A 45 -4.165 14.121 -3.959 1.00 0.00 N ATOM 646 CA ARG A 45 -3.845 15.318 -4.717 1.00 0.00 C ATOM 647 C ARG A 45 -2.430 15.221 -5.291 1.00 0.00 C ATOM 648 O ARG A 45 -2.168 15.704 -6.391 1.00 0.00 O ATOM 649 CB ARG A 45 -3.948 16.569 -3.842 1.00 0.00 C ATOM 650 CG ARG A 45 -4.168 17.819 -4.696 1.00 0.00 C ATOM 651 CD ARG A 45 -4.580 19.010 -3.828 1.00 0.00 C ATOM 652 NE ARG A 45 -5.660 19.772 -4.495 1.00 0.00 N ATOM 653 CZ ARG A 45 -6.124 20.952 -4.062 1.00 0.00 C ATOM 654 NH1 ARG A 45 -5.606 21.512 -2.961 1.00 0.00 N ATOM 655 NH2 ARG A 45 -7.107 21.571 -4.730 1.00 0.00 N ATOM 0 H ARG A 45 -4.625 13.386 -4.496 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.566 15.397 -5.530 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -4.771 16.457 -3.136 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -3.037 16.682 -3.254 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.254 18.059 -5.239 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.939 17.624 -5.441 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -4.919 18.660 -2.853 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.721 19.658 -3.653 1.00 0.00 H new ATOM 0 HE ARG A 45 -6.077 19.374 -5.337 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -4.858 21.040 -2.452 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -5.959 22.410 -2.631 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -7.502 21.144 -5.568 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -7.460 22.469 -4.401 1.00 0.00 H new ATOM 669 N VAL A 46 -1.555 14.592 -4.520 1.00 0.00 N ATOM 670 CA VAL A 46 -0.174 14.425 -4.938 1.00 0.00 C ATOM 671 C VAL A 46 0.483 15.800 -5.074 1.00 0.00 C ATOM 672 O VAL A 46 1.581 15.917 -5.616 1.00 0.00 O ATOM 673 CB VAL A 46 -0.113 13.603 -6.227 1.00 0.00 C ATOM 674 CG1 VAL A 46 1.246 13.760 -6.914 1.00 0.00 C ATOM 675 CG2 VAL A 46 -0.422 12.130 -5.953 1.00 0.00 C ATOM 0 H VAL A 46 -1.776 14.192 -3.608 1.00 0.00 H new ATOM 0 HA VAL A 46 0.388 13.869 -4.187 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.877 13.985 -6.904 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.263 13.166 -7.827 1.00 0.00 H new ATOM 0 HG12 VAL A 46 1.410 14.809 -7.161 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.034 13.417 -6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.372 11.568 -6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.308 11.730 -5.249 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -1.422 12.041 -5.529 1.00 0.00 H new ATOM 685 N SER A 47 -0.217 16.807 -4.572 1.00 0.00 N ATOM 686 CA SER A 47 0.285 18.169 -4.631 1.00 0.00 C ATOM 687 C SER A 47 1.754 18.205 -4.204 1.00 0.00 C ATOM 688 O SER A 47 2.290 17.207 -3.725 1.00 0.00 O ATOM 689 CB SER A 47 -0.547 19.101 -3.747 1.00 0.00 C ATOM 690 OG SER A 47 -0.500 20.451 -4.202 1.00 0.00 O ATOM 0 H SER A 47 -1.127 16.707 -4.123 1.00 0.00 H new ATOM 0 HA SER A 47 0.204 18.519 -5.660 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.582 18.759 -3.733 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.181 19.051 -2.722 1.00 0.00 H new ATOM 0 HG SER A 47 -1.045 21.014 -3.613 1.00 0.00 H new ATOM 696 N ASN A 48 2.364 19.366 -4.394 1.00 0.00 N ATOM 697 CA ASN A 48 3.761 19.544 -4.036 1.00 0.00 C ATOM 698 C ASN A 48 3.892 19.570 -2.512 1.00 0.00 C ATOM 699 O ASN A 48 4.146 20.620 -1.924 1.00 0.00 O ATOM 700 CB ASN A 48 4.304 20.867 -4.579 1.00 0.00 C ATOM 701 CG ASN A 48 5.818 20.795 -4.786 1.00 0.00 C ATOM 702 OD1 ASN A 48 6.369 19.779 -5.176 1.00 0.00 O ATOM 703 ND2 ASN A 48 6.458 21.927 -4.505 1.00 0.00 N ATOM 0 H ASN A 48 1.917 20.192 -4.791 1.00 0.00 H new ATOM 0 HA ASN A 48 4.328 18.718 -4.466 1.00 0.00 H new ATOM 0 HB2 ASN A 48 3.815 21.104 -5.524 1.00 0.00 H new ATOM 0 HB3 ASN A 48 4.066 21.674 -3.886 1.00 0.00 H new ATOM 0 HD21 ASN A 48 7.471 21.980 -4.612 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.936 22.742 -4.182 1.00 0.00 H new ATOM 710 N ASP A 49 3.713 18.400 -1.915 1.00 0.00 N ATOM 711 CA ASP A 49 3.809 18.275 -0.470 1.00 0.00 C ATOM 712 C ASP A 49 4.124 16.822 -0.108 1.00 0.00 C ATOM 713 O ASP A 49 4.985 16.561 0.731 1.00 0.00 O ATOM 714 CB ASP A 49 2.489 18.655 0.204 1.00 0.00 C ATOM 715 CG ASP A 49 2.622 19.191 1.630 1.00 0.00 C ATOM 716 OD1 ASP A 49 3.293 18.587 2.480 1.00 0.00 O ATOM 717 OD2 ASP A 49 1.992 20.293 1.859 1.00 0.00 O ATOM 0 H ASP A 49 3.502 17.531 -2.405 1.00 0.00 H new ATOM 0 HA ASP A 49 4.596 18.945 -0.125 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.991 19.408 -0.406 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.841 17.778 0.220 1.00 0.00 H new ATOM 722 N LYS A 50 3.410 15.916 -0.759 1.00 0.00 N ATOM 723 CA LYS A 50 3.603 14.496 -0.516 1.00 0.00 C ATOM 724 C LYS A 50 4.335 13.874 -1.708 1.00 0.00 C ATOM 725 O LYS A 50 4.690 14.573 -2.656 1.00 0.00 O ATOM 726 CB LYS A 50 2.268 13.821 -0.194 1.00 0.00 C ATOM 727 CG LYS A 50 2.104 13.622 1.314 1.00 0.00 C ATOM 728 CD LYS A 50 0.643 13.791 1.734 1.00 0.00 C ATOM 729 CE LYS A 50 0.537 14.561 3.052 1.00 0.00 C ATOM 730 NZ LYS A 50 -0.836 14.468 3.598 1.00 0.00 N ATOM 0 H LYS A 50 2.697 16.137 -1.454 1.00 0.00 H new ATOM 0 HA LYS A 50 4.232 14.342 0.361 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.448 14.429 -0.576 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.212 12.857 -0.700 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.454 12.628 1.593 1.00 0.00 H new ATOM 0 HG3 LYS A 50 2.725 14.340 1.849 1.00 0.00 H new ATOM 0 HD2 LYS A 50 0.096 14.321 0.954 1.00 0.00 H new ATOM 0 HD3 LYS A 50 0.176 12.812 1.842 1.00 0.00 H new ATOM 0 HE2 LYS A 50 1.249 14.160 3.773 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.801 15.606 2.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.890 14.996 4.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.509 14.872 2.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -1.074 13.470 3.770 1.00 0.00 H new ATOM 744 N ARG A 51 4.537 12.568 -1.620 1.00 0.00 N ATOM 745 CA ARG A 51 5.220 11.844 -2.679 1.00 0.00 C ATOM 746 C ARG A 51 4.366 11.830 -3.949 1.00 0.00 C ATOM 747 O ARG A 51 3.291 12.428 -3.985 1.00 0.00 O ATOM 748 CB ARG A 51 5.519 10.404 -2.258 1.00 0.00 C ATOM 749 CG ARG A 51 4.251 9.701 -1.768 1.00 0.00 C ATOM 750 CD ARG A 51 4.494 9.000 -0.430 1.00 0.00 C ATOM 751 NE ARG A 51 5.655 8.089 -0.540 1.00 0.00 N ATOM 752 CZ ARG A 51 6.030 7.231 0.419 1.00 0.00 C ATOM 753 NH1 ARG A 51 5.337 7.162 1.564 1.00 0.00 N ATOM 754 NH2 ARG A 51 7.097 6.443 0.232 1.00 0.00 N ATOM 0 H ARG A 51 4.240 11.992 -0.832 1.00 0.00 H new ATOM 0 HA ARG A 51 6.162 12.356 -2.876 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.941 9.855 -3.100 1.00 0.00 H new ATOM 0 HB3 ARG A 51 6.269 10.401 -1.467 1.00 0.00 H new ATOM 0 HG2 ARG A 51 3.446 10.428 -1.661 1.00 0.00 H new ATOM 0 HG3 ARG A 51 3.925 8.972 -2.510 1.00 0.00 H new ATOM 0 HD2 ARG A 51 4.674 9.740 0.350 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.607 8.438 -0.138 1.00 0.00 H new ATOM 0 HE ARG A 51 6.204 8.116 -1.399 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.525 7.762 1.705 1.00 0.00 H new ATOM 0 HH12 ARG A 51 5.622 6.509 2.294 1.00 0.00 H new ATOM 0 HH21 ARG A 51 7.624 6.496 -0.640 1.00 0.00 H new ATOM 0 HH22 ARG A 51 7.383 5.790 0.962 1.00 0.00 H new ATOM 768 N ASP A 52 4.876 11.141 -4.959 1.00 0.00 N ATOM 769 CA ASP A 52 4.173 11.041 -6.227 1.00 0.00 C ATOM 770 C ASP A 52 4.088 9.571 -6.643 1.00 0.00 C ATOM 771 O ASP A 52 3.048 8.935 -6.479 1.00 0.00 O ATOM 772 CB ASP A 52 4.914 11.802 -7.328 1.00 0.00 C ATOM 773 CG ASP A 52 6.386 12.097 -7.033 1.00 0.00 C ATOM 774 OD1 ASP A 52 7.055 11.344 -6.311 1.00 0.00 O ATOM 775 OD2 ASP A 52 6.850 13.165 -7.588 1.00 0.00 O ATOM 0 H ASP A 52 5.768 10.647 -4.925 1.00 0.00 H new ATOM 0 HA ASP A 52 3.180 11.470 -6.097 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.853 11.226 -8.251 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.399 12.746 -7.506 1.00 0.00 H new ATOM 780 N VAL A 53 5.195 9.075 -7.175 1.00 0.00 N ATOM 781 CA VAL A 53 5.259 7.692 -7.616 1.00 0.00 C ATOM 782 C VAL A 53 6.074 6.877 -6.610 1.00 0.00 C ATOM 783 O VAL A 53 6.093 5.648 -6.671 1.00 0.00 O ATOM 784 CB VAL A 53 5.820 7.621 -9.037 1.00 0.00 C ATOM 785 CG1 VAL A 53 5.751 6.194 -9.584 1.00 0.00 C ATOM 786 CG2 VAL A 53 5.094 8.599 -9.963 1.00 0.00 C ATOM 0 H VAL A 53 6.055 9.606 -7.311 1.00 0.00 H new ATOM 0 HA VAL A 53 4.260 7.257 -7.653 1.00 0.00 H new ATOM 0 HB VAL A 53 6.869 7.914 -8.997 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.156 6.172 -10.596 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.334 5.531 -8.945 1.00 0.00 H new ATOM 0 HG13 VAL A 53 4.713 5.861 -9.602 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.512 8.528 -10.967 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.033 8.351 -9.994 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.219 9.615 -9.589 1.00 0.00 H new ATOM 796 N LYS A 54 6.729 7.594 -5.708 1.00 0.00 N ATOM 797 CA LYS A 54 7.544 6.952 -4.690 1.00 0.00 C ATOM 798 C LYS A 54 6.692 5.938 -3.925 1.00 0.00 C ATOM 799 O LYS A 54 7.146 4.831 -3.639 1.00 0.00 O ATOM 800 CB LYS A 54 8.204 8.001 -3.794 1.00 0.00 C ATOM 801 CG LYS A 54 9.669 8.211 -4.183 1.00 0.00 C ATOM 802 CD LYS A 54 9.822 9.416 -5.113 1.00 0.00 C ATOM 803 CE LYS A 54 11.157 10.125 -4.878 1.00 0.00 C ATOM 804 NZ LYS A 54 10.935 11.470 -4.301 1.00 0.00 N ATOM 0 H LYS A 54 6.712 8.613 -5.661 1.00 0.00 H new ATOM 0 HA LYS A 54 8.362 6.398 -5.150 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.664 8.944 -3.874 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.142 7.686 -2.752 1.00 0.00 H new ATOM 0 HG2 LYS A 54 10.269 8.361 -3.286 1.00 0.00 H new ATOM 0 HG3 LYS A 54 10.050 7.316 -4.675 1.00 0.00 H new ATOM 0 HD2 LYS A 54 9.758 9.089 -6.151 1.00 0.00 H new ATOM 0 HD3 LYS A 54 9.001 10.114 -4.947 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.777 9.532 -4.206 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.700 10.212 -5.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 11.851 11.938 -4.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 10.361 12.039 -4.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 10.436 11.380 -3.393 1.00 0.00 H new ATOM 818 N VAL A 55 5.471 6.351 -3.616 1.00 0.00 N ATOM 819 CA VAL A 55 4.552 5.492 -2.890 1.00 0.00 C ATOM 820 C VAL A 55 4.106 4.345 -3.799 1.00 0.00 C ATOM 821 O VAL A 55 3.931 3.217 -3.342 1.00 0.00 O ATOM 822 CB VAL A 55 3.382 6.316 -2.349 1.00 0.00 C ATOM 823 CG1 VAL A 55 2.575 6.937 -3.491 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.487 5.469 -1.443 1.00 0.00 C ATOM 0 H VAL A 55 5.097 7.269 -3.856 1.00 0.00 H new ATOM 0 HA VAL A 55 5.046 5.048 -2.026 1.00 0.00 H new ATOM 0 HB VAL A 55 3.793 7.128 -1.749 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.749 7.517 -3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.220 7.590 -4.079 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.180 6.147 -4.129 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.663 6.079 -1.072 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.089 4.627 -2.009 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.070 5.096 -0.601 1.00 0.00 H new ATOM 834 N SER A 56 3.934 4.674 -5.071 1.00 0.00 N ATOM 835 CA SER A 56 3.511 3.686 -6.049 1.00 0.00 C ATOM 836 C SER A 56 4.444 2.474 -6.005 1.00 0.00 C ATOM 837 O SER A 56 3.994 1.347 -5.801 1.00 0.00 O ATOM 838 CB SER A 56 3.483 4.282 -7.458 1.00 0.00 C ATOM 839 OG SER A 56 2.447 3.715 -8.256 1.00 0.00 O ATOM 0 H SER A 56 4.080 5.611 -5.447 1.00 0.00 H new ATOM 0 HA SER A 56 2.499 3.368 -5.798 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.341 5.361 -7.393 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.446 4.116 -7.941 1.00 0.00 H new ATOM 0 HG SER A 56 2.723 3.711 -9.196 1.00 0.00 H new ATOM 845 N LEU A 57 5.726 2.746 -6.199 1.00 0.00 N ATOM 846 CA LEU A 57 6.726 1.692 -6.183 1.00 0.00 C ATOM 847 C LEU A 57 6.926 1.205 -4.747 1.00 0.00 C ATOM 848 O LEU A 57 6.652 0.047 -4.436 1.00 0.00 O ATOM 849 CB LEU A 57 8.015 2.167 -6.857 1.00 0.00 C ATOM 850 CG LEU A 57 8.849 1.085 -7.547 1.00 0.00 C ATOM 851 CD1 LEU A 57 9.768 1.695 -8.607 1.00 0.00 C ATOM 852 CD2 LEU A 57 9.626 0.255 -6.524 1.00 0.00 C ATOM 0 H LEU A 57 6.095 3.682 -6.368 1.00 0.00 H new ATOM 0 HA LEU A 57 6.386 0.835 -6.765 1.00 0.00 H new ATOM 0 HB2 LEU A 57 7.757 2.925 -7.596 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.637 2.653 -6.105 1.00 0.00 H new ATOM 0 HG LEU A 57 8.169 0.406 -8.062 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.350 0.905 -9.082 1.00 0.00 H new ATOM 0 HD12 LEU A 57 9.167 2.206 -9.359 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.443 2.409 -8.136 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.210 -0.506 -7.041 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.295 0.905 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.927 -0.226 -5.840 1.00 0.00 H new ATOM 864 N PHE A 58 7.401 2.115 -3.908 1.00 0.00 N ATOM 865 CA PHE A 58 7.640 1.792 -2.512 1.00 0.00 C ATOM 866 C PHE A 58 6.566 0.844 -1.976 1.00 0.00 C ATOM 867 O PHE A 58 6.875 -0.110 -1.263 1.00 0.00 O ATOM 868 CB PHE A 58 7.577 3.107 -1.732 1.00 0.00 C ATOM 869 CG PHE A 58 7.776 2.947 -0.224 1.00 0.00 C ATOM 870 CD1 PHE A 58 6.729 2.589 0.566 1.00 0.00 C ATOM 871 CD2 PHE A 58 9.001 3.161 0.327 1.00 0.00 C ATOM 872 CE1 PHE A 58 6.914 2.440 1.966 1.00 0.00 C ATOM 873 CE2 PHE A 58 9.186 3.012 1.727 1.00 0.00 C ATOM 874 CZ PHE A 58 8.139 2.655 2.517 1.00 0.00 C ATOM 0 H PHE A 58 7.626 3.075 -4.169 1.00 0.00 H new ATOM 0 HA PHE A 58 8.607 1.300 -2.405 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.339 3.784 -2.119 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.611 3.578 -1.912 1.00 0.00 H new ATOM 0 HD1 PHE A 58 5.756 2.418 0.129 1.00 0.00 H new ATOM 0 HD2 PHE A 58 9.833 3.444 -0.300 1.00 0.00 H new ATOM 0 HE1 PHE A 58 6.082 2.156 2.593 1.00 0.00 H new ATOM 0 HE2 PHE A 58 10.159 3.182 2.164 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.280 2.542 3.582 1.00 0.00 H new ATOM 884 N THR A 59 5.327 1.138 -2.340 1.00 0.00 N ATOM 885 CA THR A 59 4.205 0.323 -1.905 1.00 0.00 C ATOM 886 C THR A 59 4.228 -1.035 -2.609 1.00 0.00 C ATOM 887 O THR A 59 4.280 -2.076 -1.956 1.00 0.00 O ATOM 888 CB THR A 59 2.920 1.116 -2.155 1.00 0.00 C ATOM 889 OG1 THR A 59 3.056 2.267 -1.326 1.00 0.00 O ATOM 890 CG2 THR A 59 1.680 0.407 -1.607 1.00 0.00 C ATOM 0 H THR A 59 5.075 1.930 -2.932 1.00 0.00 H new ATOM 0 HA THR A 59 4.266 0.102 -0.839 1.00 0.00 H new ATOM 0 HB THR A 59 2.799 1.285 -3.225 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.471 2.992 -1.838 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.796 1.011 -1.810 1.00 0.00 H new ATOM 0 HG22 THR A 59 1.574 -0.565 -2.089 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.786 0.269 -0.531 1.00 0.00 H new ATOM 898 N ALA A 60 4.187 -0.980 -3.932 1.00 0.00 N ATOM 899 CA ALA A 60 4.203 -2.194 -4.732 1.00 0.00 C ATOM 900 C ALA A 60 5.235 -3.165 -4.157 1.00 0.00 C ATOM 901 O ALA A 60 4.980 -4.365 -4.064 1.00 0.00 O ATOM 902 CB ALA A 60 4.486 -1.839 -6.193 1.00 0.00 C ATOM 0 H ALA A 60 4.143 -0.115 -4.470 1.00 0.00 H new ATOM 0 HA ALA A 60 3.232 -2.688 -4.699 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.498 -2.749 -6.793 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.708 -1.171 -6.562 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.454 -1.343 -6.266 1.00 0.00 H new ATOM 908 N PHE A 61 6.380 -2.611 -3.786 1.00 0.00 N ATOM 909 CA PHE A 61 7.452 -3.413 -3.222 1.00 0.00 C ATOM 910 C PHE A 61 7.069 -3.950 -1.842 1.00 0.00 C ATOM 911 O PHE A 61 7.257 -5.131 -1.556 1.00 0.00 O ATOM 912 CB PHE A 61 8.669 -2.497 -3.080 1.00 0.00 C ATOM 913 CG PHE A 61 9.996 -3.164 -3.448 1.00 0.00 C ATOM 914 CD1 PHE A 61 10.443 -4.231 -2.732 1.00 0.00 C ATOM 915 CD2 PHE A 61 10.730 -2.690 -4.490 1.00 0.00 C ATOM 916 CE1 PHE A 61 11.674 -4.850 -3.073 1.00 0.00 C ATOM 917 CE2 PHE A 61 11.961 -3.309 -4.832 1.00 0.00 C ATOM 918 CZ PHE A 61 12.408 -4.376 -4.116 1.00 0.00 C ATOM 0 H PHE A 61 6.589 -1.616 -3.865 1.00 0.00 H new ATOM 0 HA PHE A 61 7.658 -4.266 -3.869 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.527 -1.621 -3.712 1.00 0.00 H new ATOM 0 HB3 PHE A 61 8.726 -2.142 -2.051 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.861 -4.607 -1.904 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.376 -1.842 -5.058 1.00 0.00 H new ATOM 0 HE1 PHE A 61 12.028 -5.697 -2.505 1.00 0.00 H new ATOM 0 HE2 PHE A 61 12.543 -2.933 -5.661 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.345 -4.846 -4.375 1.00 0.00 H new ATOM 928 N PHE A 62 6.537 -3.055 -1.021 1.00 0.00 N ATOM 929 CA PHE A 62 6.125 -3.423 0.322 1.00 0.00 C ATOM 930 C PHE A 62 5.005 -4.465 0.286 1.00 0.00 C ATOM 931 O PHE A 62 5.196 -5.602 0.714 1.00 0.00 O ATOM 932 CB PHE A 62 5.602 -2.152 0.994 1.00 0.00 C ATOM 933 CG PHE A 62 5.971 -2.034 2.474 1.00 0.00 C ATOM 934 CD1 PHE A 62 7.227 -1.656 2.834 1.00 0.00 C ATOM 935 CD2 PHE A 62 5.043 -2.306 3.431 1.00 0.00 C ATOM 936 CE1 PHE A 62 7.570 -1.546 4.208 1.00 0.00 C ATOM 937 CE2 PHE A 62 5.386 -2.196 4.804 1.00 0.00 C ATOM 938 CZ PHE A 62 6.642 -1.818 5.164 1.00 0.00 C ATOM 0 H PHE A 62 6.382 -2.076 -1.261 1.00 0.00 H new ATOM 0 HA PHE A 62 6.967 -3.853 0.865 1.00 0.00 H new ATOM 0 HB2 PHE A 62 5.993 -1.285 0.462 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.517 -2.122 0.897 1.00 0.00 H new ATOM 0 HD1 PHE A 62 7.964 -1.439 2.075 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.045 -2.606 3.146 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.568 -1.246 4.493 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.649 -2.413 5.563 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.902 -1.734 6.209 1.00 0.00 H new ATOM 948 N LEU A 63 3.861 -4.039 -0.229 1.00 0.00 N ATOM 949 CA LEU A 63 2.710 -4.921 -0.326 1.00 0.00 C ATOM 950 C LEU A 63 3.145 -6.254 -0.938 1.00 0.00 C ATOM 951 O LEU A 63 2.844 -7.317 -0.397 1.00 0.00 O ATOM 952 CB LEU A 63 1.574 -4.236 -1.088 1.00 0.00 C ATOM 953 CG LEU A 63 0.297 -3.968 -0.290 1.00 0.00 C ATOM 954 CD1 LEU A 63 0.045 -2.466 -0.147 1.00 0.00 C ATOM 955 CD2 LEU A 63 -0.900 -4.694 -0.909 1.00 0.00 C ATOM 0 H LEU A 63 3.706 -3.095 -0.583 1.00 0.00 H new ATOM 0 HA LEU A 63 2.312 -5.140 0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.943 -3.286 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.318 -4.852 -1.950 1.00 0.00 H new ATOM 0 HG LEU A 63 0.432 -4.369 0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.869 -2.303 0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.885 -2.004 0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.061 -2.019 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.795 -4.486 -0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.048 -4.346 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.711 -5.767 -0.915 1.00 0.00 H new ATOM 967 N ALA A 64 3.847 -6.155 -2.057 1.00 0.00 N ATOM 968 CA ALA A 64 4.326 -7.340 -2.748 1.00 0.00 C ATOM 969 C ALA A 64 4.953 -8.297 -1.733 1.00 0.00 C ATOM 970 O ALA A 64 4.458 -9.405 -1.531 1.00 0.00 O ATOM 971 CB ALA A 64 5.309 -6.928 -3.846 1.00 0.00 C ATOM 0 H ALA A 64 4.096 -5.272 -2.503 1.00 0.00 H new ATOM 0 HA ALA A 64 3.501 -7.864 -3.230 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.669 -7.817 -4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.807 -6.272 -4.557 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.153 -6.402 -3.400 1.00 0.00 H new ATOM 977 N THR A 65 6.034 -7.836 -1.122 1.00 0.00 N ATOM 978 CA THR A 65 6.735 -8.638 -0.133 1.00 0.00 C ATOM 979 C THR A 65 5.739 -9.283 0.833 1.00 0.00 C ATOM 980 O THR A 65 5.872 -10.458 1.174 1.00 0.00 O ATOM 981 CB THR A 65 7.761 -7.741 0.562 1.00 0.00 C ATOM 982 OG1 THR A 65 8.806 -7.603 -0.396 1.00 0.00 O ATOM 983 CG2 THR A 65 8.433 -8.433 1.750 1.00 0.00 C ATOM 0 H THR A 65 6.442 -6.917 -1.292 1.00 0.00 H new ATOM 0 HA THR A 65 7.269 -9.465 -0.601 1.00 0.00 H new ATOM 0 HB THR A 65 7.274 -6.827 0.902 1.00 0.00 H new ATOM 0 HG1 THR A 65 8.606 -6.851 -0.992 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.152 -7.754 2.208 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.677 -8.710 2.485 1.00 0.00 H new ATOM 0 HG23 THR A 65 8.949 -9.329 1.405 1.00 0.00 H new ATOM 991 N ILE A 66 4.763 -8.488 1.245 1.00 0.00 N ATOM 992 CA ILE A 66 3.745 -8.967 2.165 1.00 0.00 C ATOM 993 C ILE A 66 2.944 -10.085 1.495 1.00 0.00 C ATOM 994 O ILE A 66 3.108 -11.257 1.831 1.00 0.00 O ATOM 995 CB ILE A 66 2.881 -7.805 2.661 1.00 0.00 C ATOM 996 CG1 ILE A 66 3.688 -6.869 3.563 1.00 0.00 C ATOM 997 CG2 ILE A 66 1.616 -8.318 3.351 1.00 0.00 C ATOM 998 CD1 ILE A 66 3.012 -5.501 3.677 1.00 0.00 C ATOM 0 H ILE A 66 4.655 -7.515 0.959 1.00 0.00 H new ATOM 0 HA ILE A 66 4.207 -9.394 3.055 1.00 0.00 H new ATOM 0 HB ILE A 66 2.562 -7.223 1.797 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.791 -7.312 4.554 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.694 -6.749 3.162 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.020 -7.472 3.694 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.033 -8.911 2.647 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.893 -8.937 4.205 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.606 -4.855 4.323 1.00 0.00 H new ATOM 0 HD12 ILE A 66 2.933 -5.051 2.688 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.015 -5.622 4.101 1.00 0.00 H new ATOM 1010 N MET A 67 2.096 -9.684 0.559 1.00 0.00 N ATOM 1011 CA MET A 67 1.270 -10.638 -0.161 1.00 0.00 C ATOM 1012 C MET A 67 2.082 -11.869 -0.568 1.00 0.00 C ATOM 1013 O MET A 67 1.917 -12.944 0.007 1.00 0.00 O ATOM 1014 CB MET A 67 0.692 -9.972 -1.411 1.00 0.00 C ATOM 1015 CG MET A 67 -0.722 -9.449 -1.149 1.00 0.00 C ATOM 1016 SD MET A 67 -1.437 -8.835 -2.665 1.00 0.00 S ATOM 1017 CE MET A 67 -2.783 -7.868 -2.003 1.00 0.00 C ATOM 0 H MET A 67 1.963 -8.711 0.283 1.00 0.00 H new ATOM 0 HA MET A 67 0.462 -10.960 0.497 1.00 0.00 H new ATOM 0 HB2 MET A 67 1.337 -9.149 -1.720 1.00 0.00 H new ATOM 0 HB3 MET A 67 0.673 -10.688 -2.233 1.00 0.00 H new ATOM 0 HG2 MET A 67 -1.344 -10.246 -0.741 1.00 0.00 H new ATOM 0 HG3 MET A 67 -0.692 -8.654 -0.403 1.00 0.00 H new ATOM 0 HE1 MET A 67 -3.667 -8.000 -2.627 1.00 0.00 H new ATOM 0 HE2 MET A 67 -3.003 -8.197 -0.987 1.00 0.00 H new ATOM 0 HE3 MET A 67 -2.502 -6.815 -1.990 1.00 0.00 H new ATOM 1027 N GLY A 68 2.943 -11.671 -1.556 1.00 0.00 N ATOM 1028 CA GLY A 68 3.781 -12.752 -2.047 1.00 0.00 C ATOM 1029 C GLY A 68 2.941 -13.981 -2.399 1.00 0.00 C ATOM 1030 O GLY A 68 3.426 -15.109 -2.331 1.00 0.00 O ATOM 0 H GLY A 68 3.078 -10.778 -2.030 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.331 -12.419 -2.927 1.00 0.00 H new ATOM 0 HA3 GLY A 68 4.520 -13.017 -1.290 1.00 0.00 H new ATOM 1034 N VAL A 69 1.695 -13.720 -2.768 1.00 0.00 N ATOM 1035 CA VAL A 69 0.783 -14.791 -3.132 1.00 0.00 C ATOM 1036 C VAL A 69 1.292 -15.481 -4.399 1.00 0.00 C ATOM 1037 O VAL A 69 1.901 -16.548 -4.327 1.00 0.00 O ATOM 1038 CB VAL A 69 -0.637 -14.241 -3.280 1.00 0.00 C ATOM 1039 CG1 VAL A 69 -1.619 -15.353 -3.656 1.00 0.00 C ATOM 1040 CG2 VAL A 69 -1.083 -13.524 -2.004 1.00 0.00 C ATOM 0 H VAL A 69 1.296 -12.783 -2.823 1.00 0.00 H new ATOM 0 HA VAL A 69 0.745 -15.544 -2.345 1.00 0.00 H new ATOM 0 HB VAL A 69 -0.631 -13.511 -4.090 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.621 -14.935 -3.755 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.317 -15.800 -4.603 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.619 -16.116 -2.878 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -2.096 -13.143 -2.136 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.065 -14.223 -1.168 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.407 -12.694 -1.798 1.00 0.00 H new ATOM 1050 N ARG A 70 1.024 -14.844 -5.529 1.00 0.00 N ATOM 1051 CA ARG A 70 1.448 -15.383 -6.811 1.00 0.00 C ATOM 1052 C ARG A 70 2.881 -15.911 -6.717 1.00 0.00 C ATOM 1053 O ARG A 70 3.746 -15.265 -6.128 1.00 0.00 O ATOM 1054 CB ARG A 70 1.374 -14.319 -7.908 1.00 0.00 C ATOM 1055 CG ARG A 70 0.800 -14.903 -9.200 1.00 0.00 C ATOM 1056 CD ARG A 70 -0.689 -15.220 -9.045 1.00 0.00 C ATOM 1057 NE ARG A 70 -1.136 -16.104 -10.145 1.00 0.00 N ATOM 1058 CZ ARG A 70 -2.293 -16.780 -10.142 1.00 0.00 C ATOM 1059 NH1 ARG A 70 -3.126 -16.678 -9.098 1.00 0.00 N ATOM 1060 NH2 ARG A 70 -2.616 -17.559 -11.184 1.00 0.00 N ATOM 0 H ARG A 70 0.519 -13.960 -5.584 1.00 0.00 H new ATOM 0 HA ARG A 70 0.773 -16.199 -7.067 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.753 -13.488 -7.573 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.369 -13.917 -8.097 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.942 -14.196 -10.017 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.343 -15.810 -9.466 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.868 -15.702 -8.084 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -1.268 -14.297 -9.051 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.525 -16.205 -10.956 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -2.880 -16.086 -8.305 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -4.007 -17.193 -9.096 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.981 -17.637 -11.979 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -3.497 -18.074 -11.182 1.00 0.00 H new ATOM 1074 N PHE A 71 3.088 -17.079 -7.307 1.00 0.00 N ATOM 1075 CA PHE A 71 4.401 -17.700 -7.297 1.00 0.00 C ATOM 1076 C PHE A 71 5.034 -17.665 -8.690 1.00 0.00 C ATOM 1077 O PHE A 71 6.246 -17.502 -8.820 1.00 0.00 O ATOM 1078 CB PHE A 71 4.203 -19.158 -6.876 1.00 0.00 C ATOM 1079 CG PHE A 71 5.508 -19.905 -6.592 1.00 0.00 C ATOM 1080 CD1 PHE A 71 6.334 -19.478 -5.599 1.00 0.00 C ATOM 1081 CD2 PHE A 71 5.841 -20.997 -7.331 1.00 0.00 C ATOM 1082 CE1 PHE A 71 7.544 -20.172 -5.335 1.00 0.00 C ATOM 1083 CE2 PHE A 71 7.051 -21.691 -7.067 1.00 0.00 C ATOM 1084 CZ PHE A 71 7.877 -21.264 -6.075 1.00 0.00 C ATOM 0 H PHE A 71 2.368 -17.612 -7.795 1.00 0.00 H new ATOM 0 HA PHE A 71 5.061 -17.165 -6.614 1.00 0.00 H new ATOM 0 HB2 PHE A 71 3.578 -19.186 -5.983 1.00 0.00 H new ATOM 0 HB3 PHE A 71 3.660 -19.682 -7.662 1.00 0.00 H new ATOM 0 HD1 PHE A 71 6.069 -18.611 -5.012 1.00 0.00 H new ATOM 0 HD2 PHE A 71 5.185 -21.336 -8.119 1.00 0.00 H new ATOM 0 HE1 PHE A 71 8.200 -19.833 -4.547 1.00 0.00 H new ATOM 0 HE2 PHE A 71 7.315 -22.558 -7.654 1.00 0.00 H new ATOM 0 HZ PHE A 71 8.798 -21.792 -5.874 1.00 0.00 H new ATOM 1094 N LYS A 72 4.185 -17.822 -9.695 1.00 0.00 N ATOM 1095 CA LYS A 72 4.647 -17.810 -11.073 1.00 0.00 C ATOM 1096 C LYS A 72 4.925 -16.368 -11.500 1.00 0.00 C ATOM 1097 O LYS A 72 5.175 -15.505 -10.660 1.00 0.00 O ATOM 1098 CB LYS A 72 3.650 -18.538 -11.977 1.00 0.00 C ATOM 1099 CG LYS A 72 4.357 -19.588 -12.837 1.00 0.00 C ATOM 1100 CD LYS A 72 3.344 -20.437 -13.608 1.00 0.00 C ATOM 1101 CE LYS A 72 4.042 -21.309 -14.653 1.00 0.00 C ATOM 1102 NZ LYS A 72 3.454 -22.667 -14.672 1.00 0.00 N ATOM 0 H LYS A 72 3.180 -17.958 -9.583 1.00 0.00 H new ATOM 0 HA LYS A 72 5.585 -18.357 -11.166 1.00 0.00 H new ATOM 0 HB2 LYS A 72 2.884 -19.017 -11.368 1.00 0.00 H new ATOM 0 HB3 LYS A 72 3.143 -17.818 -12.619 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.032 -19.096 -13.537 1.00 0.00 H new ATOM 0 HG3 LYS A 72 4.968 -20.231 -12.203 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.790 -21.069 -12.913 1.00 0.00 H new ATOM 0 HD3 LYS A 72 2.618 -19.788 -14.097 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.948 -20.852 -15.638 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.107 -21.371 -14.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 3.940 -23.246 -15.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 3.566 -23.107 -13.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.443 -22.604 -14.906 1.00 0.00 H new ATOM 1116 N ARG A 73 4.874 -16.151 -12.806 1.00 0.00 N ATOM 1117 CA ARG A 73 5.117 -14.828 -13.356 1.00 0.00 C ATOM 1118 C ARG A 73 4.063 -14.489 -14.412 1.00 0.00 C ATOM 1119 O ARG A 73 3.903 -15.217 -15.391 1.00 0.00 O ATOM 1120 CB ARG A 73 6.508 -14.742 -13.988 1.00 0.00 C ATOM 1121 CG ARG A 73 7.581 -15.257 -13.026 1.00 0.00 C ATOM 1122 CD ARG A 73 8.709 -15.957 -13.786 1.00 0.00 C ATOM 1123 NE ARG A 73 9.391 -16.926 -12.900 1.00 0.00 N ATOM 1124 CZ ARG A 73 10.473 -17.634 -13.252 1.00 0.00 C ATOM 1125 NH1 ARG A 73 11.003 -17.484 -14.474 1.00 0.00 N ATOM 1126 NH2 ARG A 73 11.026 -18.491 -12.383 1.00 0.00 N ATOM 0 H ARG A 73 4.668 -16.870 -13.500 1.00 0.00 H new ATOM 0 HA ARG A 73 5.057 -14.112 -12.536 1.00 0.00 H new ATOM 0 HB2 ARG A 73 6.530 -15.325 -14.908 1.00 0.00 H new ATOM 0 HB3 ARG A 73 6.724 -13.709 -14.260 1.00 0.00 H new ATOM 0 HG2 ARG A 73 7.987 -14.426 -12.450 1.00 0.00 H new ATOM 0 HG3 ARG A 73 7.133 -15.950 -12.313 1.00 0.00 H new ATOM 0 HD2 ARG A 73 8.306 -16.471 -14.659 1.00 0.00 H new ATOM 0 HD3 ARG A 73 9.424 -15.220 -14.152 1.00 0.00 H new ATOM 0 HE ARG A 73 9.014 -17.064 -11.962 1.00 0.00 H new ATOM 0 HH11 ARG A 73 10.583 -16.831 -15.136 1.00 0.00 H new ATOM 0 HH12 ARG A 73 11.827 -18.023 -14.742 1.00 0.00 H new ATOM 0 HH21 ARG A 73 10.623 -18.605 -11.453 1.00 0.00 H new ATOM 0 HH22 ARG A 73 11.850 -19.030 -12.652 1.00 0.00 H new ATOM 1140 N SER A 74 3.371 -13.384 -14.177 1.00 0.00 N ATOM 1141 CA SER A 74 2.336 -12.940 -15.096 1.00 0.00 C ATOM 1142 C SER A 74 2.793 -11.676 -15.827 1.00 0.00 C ATOM 1143 O SER A 74 2.977 -11.691 -17.043 1.00 0.00 O ATOM 1144 CB SER A 74 1.021 -12.681 -14.360 1.00 0.00 C ATOM 1145 OG SER A 74 -0.094 -12.664 -15.248 1.00 0.00 O ATOM 0 H SER A 74 3.506 -12.783 -13.364 1.00 0.00 H new ATOM 0 HA SER A 74 2.163 -13.731 -15.825 1.00 0.00 H new ATOM 0 HB2 SER A 74 0.871 -13.452 -13.604 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.081 -11.728 -13.835 1.00 0.00 H new ATOM 0 HG SER A 74 -0.629 -11.859 -15.086 1.00 0.00 H new ATOM 1151 N LYS A 75 2.964 -10.613 -15.055 1.00 0.00 N ATOM 1152 CA LYS A 75 3.396 -9.344 -15.614 1.00 0.00 C ATOM 1153 C LYS A 75 4.925 -9.282 -15.606 1.00 0.00 C ATOM 1154 O LYS A 75 5.567 -9.577 -16.612 1.00 0.00 O ATOM 1155 CB LYS A 75 2.729 -8.180 -14.879 1.00 0.00 C ATOM 1156 CG LYS A 75 1.876 -7.343 -15.835 1.00 0.00 C ATOM 1157 CD LYS A 75 1.920 -5.862 -15.455 1.00 0.00 C ATOM 1158 CE LYS A 75 2.413 -5.010 -16.627 1.00 0.00 C ATOM 1159 NZ LYS A 75 2.948 -3.719 -16.140 1.00 0.00 N ATOM 0 H LYS A 75 2.811 -10.605 -14.047 1.00 0.00 H new ATOM 0 HA LYS A 75 3.079 -9.258 -16.653 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.105 -8.565 -14.072 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.491 -7.550 -14.420 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.236 -7.471 -16.856 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.845 -7.697 -15.813 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.927 -5.531 -15.152 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.578 -5.722 -14.597 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.187 -5.548 -17.175 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.594 -4.831 -17.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.278 -3.153 -16.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.200 -3.201 -15.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.743 -3.895 -15.493 1.00 0.00 H new ATOM 1173 N LYS A 76 5.463 -8.896 -14.458 1.00 0.00 N ATOM 1174 CA LYS A 76 6.904 -8.791 -14.306 1.00 0.00 C ATOM 1175 C LYS A 76 7.456 -10.120 -13.786 1.00 0.00 C ATOM 1176 O LYS A 76 7.782 -11.010 -14.570 1.00 0.00 O ATOM 1177 CB LYS A 76 7.265 -7.590 -13.428 1.00 0.00 C ATOM 1178 CG LYS A 76 7.781 -6.426 -14.277 1.00 0.00 C ATOM 1179 CD LYS A 76 7.906 -5.151 -13.440 1.00 0.00 C ATOM 1180 CE LYS A 76 8.845 -4.146 -14.110 1.00 0.00 C ATOM 1181 NZ LYS A 76 10.212 -4.267 -13.557 1.00 0.00 N ATOM 0 H LYS A 76 4.927 -8.652 -13.625 1.00 0.00 H new ATOM 0 HA LYS A 76 7.376 -8.605 -15.271 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.389 -7.272 -12.862 1.00 0.00 H new ATOM 0 HB3 LYS A 76 8.025 -7.881 -12.702 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.751 -6.683 -14.702 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.103 -6.252 -15.113 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.922 -4.702 -13.306 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.281 -5.399 -12.447 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.865 -4.319 -15.186 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.473 -3.133 -13.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.837 -3.578 -14.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.191 -4.080 -12.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.571 -5.229 -13.725 1.00 0.00 H new ATOM 1195 N ILE A 77 7.543 -10.212 -12.467 1.00 0.00 N ATOM 1196 CA ILE A 77 8.049 -11.418 -11.833 1.00 0.00 C ATOM 1197 C ILE A 77 6.991 -11.967 -10.874 1.00 0.00 C ATOM 1198 O ILE A 77 6.031 -12.605 -11.302 1.00 0.00 O ATOM 1199 CB ILE A 77 9.400 -11.147 -11.169 1.00 0.00 C ATOM 1200 CG1 ILE A 77 9.510 -9.687 -10.725 1.00 0.00 C ATOM 1201 CG2 ILE A 77 10.554 -11.555 -12.087 1.00 0.00 C ATOM 1202 CD1 ILE A 77 10.061 -8.811 -11.851 1.00 0.00 C ATOM 0 H ILE A 77 7.272 -9.471 -11.820 1.00 0.00 H new ATOM 0 HA ILE A 77 8.236 -12.191 -12.578 1.00 0.00 H new ATOM 0 HB ILE A 77 9.469 -11.762 -10.272 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.529 -9.321 -10.421 1.00 0.00 H new ATOM 0 HG13 ILE A 77 10.160 -9.616 -9.853 1.00 0.00 H new ATOM 0 HG21 ILE A 77 11.503 -11.352 -11.591 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.482 -12.619 -12.311 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.500 -10.985 -13.014 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.129 -7.778 -11.509 1.00 0.00 H new ATOM 0 HD12 ILE A 77 11.052 -9.165 -12.136 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.395 -8.865 -12.713 1.00 0.00 H new ATOM 1214 N MET A 78 7.204 -11.700 -9.593 1.00 0.00 N ATOM 1215 CA MET A 78 6.281 -12.159 -8.570 1.00 0.00 C ATOM 1216 C MET A 78 5.093 -11.204 -8.434 1.00 0.00 C ATOM 1217 O MET A 78 3.943 -11.612 -8.586 1.00 0.00 O ATOM 1218 CB MET A 78 7.012 -12.258 -7.230 1.00 0.00 C ATOM 1219 CG MET A 78 7.071 -13.708 -6.743 1.00 0.00 C ATOM 1220 SD MET A 78 6.106 -13.891 -5.253 1.00 0.00 S ATOM 1221 CE MET A 78 7.030 -15.185 -4.442 1.00 0.00 C ATOM 0 H MET A 78 8.002 -11.172 -9.241 1.00 0.00 H new ATOM 0 HA MET A 78 5.904 -13.139 -8.862 1.00 0.00 H new ATOM 0 HB2 MET A 78 8.023 -11.864 -7.333 1.00 0.00 H new ATOM 0 HB3 MET A 78 6.504 -11.642 -6.488 1.00 0.00 H new ATOM 0 HG2 MET A 78 6.691 -14.376 -7.516 1.00 0.00 H new ATOM 0 HG3 MET A 78 8.105 -13.995 -6.554 1.00 0.00 H new ATOM 0 HE1 MET A 78 6.560 -15.424 -3.488 1.00 0.00 H new ATOM 0 HE2 MET A 78 7.043 -16.074 -5.073 1.00 0.00 H new ATOM 0 HE3 MET A 78 8.052 -14.848 -4.269 1.00 0.00 H new ATOM 1231 N PRO A 79 5.421 -9.917 -8.141 1.00 0.00 N ATOM 1232 CA PRO A 79 4.395 -8.900 -7.983 1.00 0.00 C ATOM 1233 C PRO A 79 3.823 -8.483 -9.340 1.00 0.00 C ATOM 1234 O PRO A 79 4.281 -7.510 -9.937 1.00 0.00 O ATOM 1235 CB PRO A 79 5.081 -7.759 -7.251 1.00 0.00 C ATOM 1236 CG PRO A 79 6.573 -7.982 -7.437 1.00 0.00 C ATOM 1237 CD PRO A 79 6.772 -9.397 -7.954 1.00 0.00 C ATOM 0 HA PRO A 79 3.533 -9.256 -7.418 1.00 0.00 H new ATOM 0 HB2 PRO A 79 4.776 -6.795 -7.658 1.00 0.00 H new ATOM 0 HB3 PRO A 79 4.815 -7.757 -6.194 1.00 0.00 H new ATOM 0 HG2 PRO A 79 6.982 -7.257 -8.141 1.00 0.00 H new ATOM 0 HG3 PRO A 79 7.100 -7.843 -6.493 1.00 0.00 H new ATOM 0 HD2 PRO A 79 7.331 -9.402 -8.890 1.00 0.00 H new ATOM 0 HD3 PRO A 79 7.335 -10.003 -7.244 1.00 0.00 H new ATOM 1245 N ALA A 80 2.831 -9.239 -9.786 1.00 0.00 N ATOM 1246 CA ALA A 80 2.192 -8.960 -11.061 1.00 0.00 C ATOM 1247 C ALA A 80 1.123 -7.884 -10.865 1.00 0.00 C ATOM 1248 O ALA A 80 1.060 -6.920 -11.627 1.00 0.00 O ATOM 1249 CB ALA A 80 1.618 -10.255 -11.639 1.00 0.00 C ATOM 0 H ALA A 80 2.454 -10.045 -9.287 1.00 0.00 H new ATOM 0 HA ALA A 80 2.917 -8.577 -11.779 1.00 0.00 H new ATOM 0 HB1 ALA A 80 1.139 -10.046 -12.595 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.422 -10.976 -11.786 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.883 -10.668 -10.948 1.00 0.00 H new ATOM 1255 N GLY A 81 0.307 -8.084 -9.840 1.00 0.00 N ATOM 1256 CA GLY A 81 -0.757 -7.143 -9.535 1.00 0.00 C ATOM 1257 C GLY A 81 -0.209 -5.913 -8.809 1.00 0.00 C ATOM 1258 O GLY A 81 -0.664 -4.795 -9.044 1.00 0.00 O ATOM 0 H GLY A 81 0.362 -8.884 -9.210 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -1.251 -6.836 -10.457 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -1.511 -7.629 -8.916 1.00 0.00 H new ATOM 1262 N LEU A 82 0.761 -6.161 -7.940 1.00 0.00 N ATOM 1263 CA LEU A 82 1.375 -5.088 -7.178 1.00 0.00 C ATOM 1264 C LEU A 82 1.991 -4.071 -8.142 1.00 0.00 C ATOM 1265 O LEU A 82 1.619 -2.899 -8.134 1.00 0.00 O ATOM 1266 CB LEU A 82 2.370 -5.653 -6.163 1.00 0.00 C ATOM 1267 CG LEU A 82 1.942 -5.588 -4.696 1.00 0.00 C ATOM 1268 CD1 LEU A 82 1.415 -4.196 -4.339 1.00 0.00 C ATOM 1269 CD2 LEU A 82 0.926 -6.685 -4.372 1.00 0.00 C ATOM 0 H LEU A 82 1.136 -7.090 -7.747 1.00 0.00 H new ATOM 0 HA LEU A 82 0.623 -4.559 -6.592 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.566 -6.694 -6.418 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.312 -5.116 -6.270 1.00 0.00 H new ATOM 0 HG LEU A 82 2.820 -5.769 -4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.118 -4.177 -3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.198 -3.456 -4.507 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.554 -3.962 -4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.638 -6.616 -3.323 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.043 -6.560 -4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.371 -7.661 -4.563 1.00 0.00 H new ATOM 1281 N VAL A 83 2.922 -4.558 -8.949 1.00 0.00 N ATOM 1282 CA VAL A 83 3.593 -3.707 -9.917 1.00 0.00 C ATOM 1283 C VAL A 83 2.560 -3.141 -10.894 1.00 0.00 C ATOM 1284 O VAL A 83 2.528 -1.936 -11.140 1.00 0.00 O ATOM 1285 CB VAL A 83 4.710 -4.486 -10.614 1.00 0.00 C ATOM 1286 CG1 VAL A 83 5.315 -3.671 -11.759 1.00 0.00 C ATOM 1287 CG2 VAL A 83 5.788 -4.911 -9.614 1.00 0.00 C ATOM 0 H VAL A 83 3.228 -5.531 -8.952 1.00 0.00 H new ATOM 0 HA VAL A 83 4.067 -2.862 -9.418 1.00 0.00 H new ATOM 0 HB VAL A 83 4.273 -5.389 -11.040 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.107 -4.248 -12.238 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.541 -3.441 -12.491 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.730 -2.743 -11.366 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.570 -5.463 -10.135 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.219 -4.026 -9.145 1.00 0.00 H new ATOM 0 HG23 VAL A 83 5.344 -5.547 -8.848 1.00 0.00 H new ATOM 1297 N ALA A 84 1.742 -4.037 -11.425 1.00 0.00 N ATOM 1298 CA ALA A 84 0.711 -3.642 -12.370 1.00 0.00 C ATOM 1299 C ALA A 84 -0.076 -2.462 -11.796 1.00 0.00 C ATOM 1300 O ALA A 84 -0.541 -1.600 -12.541 1.00 0.00 O ATOM 1301 CB ALA A 84 -0.185 -4.843 -12.680 1.00 0.00 C ATOM 0 H ALA A 84 1.772 -5.036 -11.219 1.00 0.00 H new ATOM 0 HA ALA A 84 1.157 -3.316 -13.310 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.958 -4.547 -13.389 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.416 -5.643 -13.112 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.652 -5.196 -11.760 1.00 0.00 H new ATOM 1307 N GLY A 85 -0.200 -2.460 -10.477 1.00 0.00 N ATOM 1308 CA GLY A 85 -0.921 -1.399 -9.794 1.00 0.00 C ATOM 1309 C GLY A 85 -0.113 -0.100 -9.791 1.00 0.00 C ATOM 1310 O GLY A 85 -0.617 0.950 -10.187 1.00 0.00 O ATOM 0 H GLY A 85 0.187 -3.177 -9.863 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.881 -1.233 -10.284 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.134 -1.701 -8.769 1.00 0.00 H new ATOM 1314 N LEU A 86 1.127 -0.213 -9.340 1.00 0.00 N ATOM 1315 CA LEU A 86 2.010 0.939 -9.280 1.00 0.00 C ATOM 1316 C LEU A 86 1.996 1.658 -10.631 1.00 0.00 C ATOM 1317 O LEU A 86 2.043 2.886 -10.685 1.00 0.00 O ATOM 1318 CB LEU A 86 3.408 0.520 -8.820 1.00 0.00 C ATOM 1319 CG LEU A 86 4.515 0.612 -9.872 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.092 2.027 -9.939 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.599 -0.438 -9.619 1.00 0.00 C ATOM 0 H LEU A 86 1.542 -1.085 -9.012 1.00 0.00 H new ATOM 0 HA LEU A 86 1.656 1.652 -8.535 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.690 1.140 -7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.358 -0.508 -8.462 1.00 0.00 H new ATOM 0 HG LEU A 86 4.079 0.397 -10.847 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.877 2.065 -10.695 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.302 2.730 -10.202 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.509 2.296 -8.969 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.374 -0.352 -10.380 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.038 -0.278 -8.634 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.158 -1.434 -9.662 1.00 0.00 H new ATOM 1333 N SER A 87 1.932 0.861 -11.687 1.00 0.00 N ATOM 1334 CA SER A 87 1.912 1.406 -13.034 1.00 0.00 C ATOM 1335 C SER A 87 0.575 2.103 -13.297 1.00 0.00 C ATOM 1336 O SER A 87 0.546 3.266 -13.696 1.00 0.00 O ATOM 1337 CB SER A 87 2.152 0.310 -14.075 1.00 0.00 C ATOM 1338 OG SER A 87 2.808 0.812 -15.237 1.00 0.00 O ATOM 0 H SER A 87 1.893 -0.157 -11.638 1.00 0.00 H new ATOM 0 HA SER A 87 2.718 2.135 -13.120 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.754 -0.484 -13.633 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.198 -0.134 -14.360 1.00 0.00 H new ATOM 0 HG SER A 87 2.945 0.082 -15.877 1.00 0.00 H new ATOM 1344 N LEU A 88 -0.498 1.363 -13.062 1.00 0.00 N ATOM 1345 CA LEU A 88 -1.834 1.896 -13.268 1.00 0.00 C ATOM 1346 C LEU A 88 -2.004 3.169 -12.437 1.00 0.00 C ATOM 1347 O LEU A 88 -2.833 4.019 -12.760 1.00 0.00 O ATOM 1348 CB LEU A 88 -2.888 0.826 -12.977 1.00 0.00 C ATOM 1349 CG LEU A 88 -3.730 0.370 -14.171 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -4.553 -0.871 -13.820 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -4.606 1.512 -14.691 1.00 0.00 C ATOM 0 H LEU A 88 -0.470 0.399 -12.731 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.976 2.175 -14.312 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.386 -0.046 -12.558 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.560 1.206 -12.208 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.054 0.089 -14.979 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.142 -1.174 -14.686 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -3.884 -1.683 -13.534 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.221 -0.642 -12.989 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.194 1.162 -15.539 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.275 1.847 -13.899 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.973 2.342 -15.006 1.00 0.00 H new ATOM 1363 N MET A 89 -1.206 3.261 -11.384 1.00 0.00 N ATOM 1364 CA MET A 89 -1.259 4.416 -10.504 1.00 0.00 C ATOM 1365 C MET A 89 -0.576 5.626 -11.146 1.00 0.00 C ATOM 1366 O MET A 89 -1.237 6.601 -11.499 1.00 0.00 O ATOM 1367 CB MET A 89 -0.566 4.083 -9.181 1.00 0.00 C ATOM 1368 CG MET A 89 -1.128 4.932 -8.039 1.00 0.00 C ATOM 1369 SD MET A 89 0.203 5.745 -7.171 1.00 0.00 S ATOM 1370 CE MET A 89 0.501 7.116 -8.275 1.00 0.00 C ATOM 0 H MET A 89 -0.519 2.555 -11.120 1.00 0.00 H new ATOM 0 HA MET A 89 -2.305 4.664 -10.325 1.00 0.00 H new ATOM 0 HB2 MET A 89 -0.699 3.026 -8.953 1.00 0.00 H new ATOM 0 HB3 MET A 89 0.506 4.256 -9.274 1.00 0.00 H new ATOM 0 HG2 MET A 89 -1.822 5.674 -8.434 1.00 0.00 H new ATOM 0 HG3 MET A 89 -1.692 4.303 -7.350 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.748 8.004 -7.694 1.00 0.00 H new ATOM 0 HE2 MET A 89 1.331 6.875 -8.939 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.394 7.307 -8.868 1.00 0.00 H new ATOM 1380 N MET A 90 0.738 5.522 -11.279 1.00 0.00 N ATOM 1381 CA MET A 90 1.517 6.595 -11.873 1.00 0.00 C ATOM 1382 C MET A 90 0.909 7.043 -13.203 1.00 0.00 C ATOM 1383 O MET A 90 1.114 8.177 -13.633 1.00 0.00 O ATOM 1384 CB MET A 90 2.952 6.117 -12.103 1.00 0.00 C ATOM 1385 CG MET A 90 2.983 4.903 -13.033 1.00 0.00 C ATOM 1386 SD MET A 90 4.380 5.016 -14.139 1.00 0.00 S ATOM 1387 CE MET A 90 3.528 5.246 -15.691 1.00 0.00 C ATOM 0 H MET A 90 1.283 4.711 -10.986 1.00 0.00 H new ATOM 0 HA MET A 90 1.512 7.444 -11.189 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.544 6.925 -12.534 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.411 5.860 -11.148 1.00 0.00 H new ATOM 0 HG2 MET A 90 3.047 3.987 -12.446 1.00 0.00 H new ATOM 0 HG3 MET A 90 2.058 4.851 -13.607 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.149 5.839 -16.363 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.328 4.275 -16.144 1.00 0.00 H new ATOM 0 HE3 MET A 90 2.586 5.765 -15.515 1.00 0.00 H new ATOM 1397 N ILE A 91 0.173 6.129 -13.819 1.00 0.00 N ATOM 1398 CA ILE A 91 -0.467 6.416 -15.091 1.00 0.00 C ATOM 1399 C ILE A 91 -1.845 7.031 -14.837 1.00 0.00 C ATOM 1400 O ILE A 91 -2.289 7.899 -15.588 1.00 0.00 O ATOM 1401 CB ILE A 91 -0.505 5.162 -15.967 1.00 0.00 C ATOM 1402 CG1 ILE A 91 -0.204 5.503 -17.427 1.00 0.00 C ATOM 1403 CG2 ILE A 91 -1.838 4.426 -15.813 1.00 0.00 C ATOM 1404 CD1 ILE A 91 0.980 4.687 -17.948 1.00 0.00 C ATOM 0 H ILE A 91 0.006 5.189 -13.460 1.00 0.00 H new ATOM 0 HA ILE A 91 0.112 7.150 -15.651 1.00 0.00 H new ATOM 0 HB ILE A 91 0.278 4.484 -15.627 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.084 5.305 -18.039 1.00 0.00 H new ATOM 0 HG13 ILE A 91 0.015 6.567 -17.518 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.839 3.539 -16.446 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.972 4.130 -14.773 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.654 5.085 -16.110 1.00 0.00 H new ATOM 0 HD11 ILE A 91 1.173 4.949 -18.988 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.864 4.905 -17.349 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.748 3.624 -17.878 1.00 0.00 H new ATOM 1416 N LEU A 92 -2.483 6.557 -13.777 1.00 0.00 N ATOM 1417 CA LEU A 92 -3.801 7.049 -13.415 1.00 0.00 C ATOM 1418 C LEU A 92 -3.700 8.526 -13.026 1.00 0.00 C ATOM 1419 O LEU A 92 -4.675 9.268 -13.134 1.00 0.00 O ATOM 1420 CB LEU A 92 -4.423 6.168 -12.330 1.00 0.00 C ATOM 1421 CG LEU A 92 -5.449 6.847 -11.420 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -6.492 5.844 -10.925 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.760 7.576 -10.264 1.00 0.00 C ATOM 0 H LEU A 92 -2.111 5.837 -13.157 1.00 0.00 H new ATOM 0 HA LEU A 92 -4.477 6.989 -14.268 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.902 5.316 -12.812 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.621 5.772 -11.707 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.978 7.599 -12.005 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.209 6.353 -10.280 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.014 5.411 -11.778 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.997 5.052 -10.363 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.512 8.050 -9.633 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.188 6.861 -9.673 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.089 8.337 -10.662 1.00 0.00 H new ATOM 1435 N ARG A 93 -2.512 8.907 -12.581 1.00 0.00 N ATOM 1436 CA ARG A 93 -2.272 10.282 -12.175 1.00 0.00 C ATOM 1437 C ARG A 93 -1.666 11.078 -13.332 1.00 0.00 C ATOM 1438 O ARG A 93 -2.097 12.195 -13.615 1.00 0.00 O ATOM 1439 CB ARG A 93 -1.327 10.344 -10.973 1.00 0.00 C ATOM 1440 CG ARG A 93 -2.107 10.559 -9.674 1.00 0.00 C ATOM 1441 CD ARG A 93 -2.515 12.025 -9.516 1.00 0.00 C ATOM 1442 NE ARG A 93 -3.834 12.115 -8.851 1.00 0.00 N ATOM 1443 CZ ARG A 93 -4.484 13.264 -8.624 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -3.942 14.428 -9.008 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -5.677 13.250 -8.014 1.00 0.00 N ATOM 0 H ARG A 93 -1.706 8.289 -12.493 1.00 0.00 H new ATOM 0 HA ARG A 93 -3.231 10.717 -11.892 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.754 9.419 -10.908 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.611 11.154 -11.110 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.996 9.928 -9.671 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.496 10.254 -8.824 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -1.766 12.558 -8.930 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -2.558 12.506 -10.493 1.00 0.00 H new ATOM 0 HE ARG A 93 -4.276 11.248 -8.546 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.034 14.439 -9.473 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.437 15.303 -8.835 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.090 12.364 -7.722 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -6.172 14.125 -7.841 1.00 0.00 H new ATOM 1459 N LEU A 94 -0.674 10.474 -13.970 1.00 0.00 N ATOM 1460 CA LEU A 94 -0.005 11.113 -15.090 1.00 0.00 C ATOM 1461 C LEU A 94 -1.028 11.410 -16.188 1.00 0.00 C ATOM 1462 O LEU A 94 -0.765 12.208 -17.086 1.00 0.00 O ATOM 1463 CB LEU A 94 1.176 10.263 -15.564 1.00 0.00 C ATOM 1464 CG LEU A 94 1.722 10.590 -16.955 1.00 0.00 C ATOM 1465 CD1 LEU A 94 3.247 10.474 -16.988 1.00 0.00 C ATOM 1466 CD2 LEU A 94 1.058 9.718 -18.023 1.00 0.00 C ATOM 0 H LEU A 94 -0.317 9.548 -13.732 1.00 0.00 H new ATOM 0 HA LEU A 94 0.421 12.068 -14.784 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.987 10.369 -14.843 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.873 9.216 -15.551 1.00 0.00 H new ATOM 0 HG LEU A 94 1.474 11.626 -17.184 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.608 10.712 -17.988 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.681 11.171 -16.271 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.540 9.457 -16.729 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.464 9.970 -19.003 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.254 8.667 -17.809 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.018 9.894 -18.019 1.00 0.00 H new ATOM 1478 N VAL A 95 -2.173 10.752 -16.080 1.00 0.00 N ATOM 1479 CA VAL A 95 -3.236 10.935 -17.053 1.00 0.00 C ATOM 1480 C VAL A 95 -3.345 12.419 -17.409 1.00 0.00 C ATOM 1481 O VAL A 95 -3.061 12.812 -18.540 1.00 0.00 O ATOM 1482 CB VAL A 95 -4.544 10.353 -16.514 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -5.754 11.024 -17.168 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -4.589 8.836 -16.706 1.00 0.00 C ATOM 0 H VAL A 95 -2.388 10.091 -15.333 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.009 10.395 -17.972 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.585 10.557 -15.444 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.671 10.592 -16.767 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.735 12.093 -16.958 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.719 10.866 -18.246 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -5.529 8.447 -16.314 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.513 8.601 -17.768 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -3.756 8.377 -16.173 1.00 0.00 H new ATOM 1494 N LEU A 96 -3.756 13.203 -16.423 1.00 0.00 N ATOM 1495 CA LEU A 96 -3.905 14.635 -16.619 1.00 0.00 C ATOM 1496 C LEU A 96 -2.615 15.341 -16.196 1.00 0.00 C ATOM 1497 O LEU A 96 -2.284 16.404 -16.719 1.00 0.00 O ATOM 1498 CB LEU A 96 -5.152 15.148 -15.895 1.00 0.00 C ATOM 1499 CG LEU A 96 -5.284 14.750 -14.423 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.719 15.943 -13.570 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -6.225 13.555 -14.260 1.00 0.00 C ATOM 0 H LEU A 96 -3.990 12.874 -15.486 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.061 14.860 -17.674 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.163 16.236 -15.959 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -6.032 14.788 -16.429 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.303 14.438 -14.064 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -5.805 15.633 -12.528 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.978 16.738 -13.652 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.684 16.309 -13.921 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.301 13.293 -13.205 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -7.213 13.815 -14.641 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.833 12.704 -14.818 1.00 0.00 H new ATOM 1513 N LEU A 97 -1.921 14.721 -15.253 1.00 0.00 N ATOM 1514 CA LEU A 97 -0.674 15.276 -14.754 1.00 0.00 C ATOM 1515 C LEU A 97 -0.787 16.801 -14.697 1.00 0.00 C ATOM 1516 O LEU A 97 0.164 17.510 -15.023 1.00 0.00 O ATOM 1517 CB LEU A 97 0.507 14.778 -15.590 1.00 0.00 C ATOM 1518 CG LEU A 97 1.870 14.784 -14.895 1.00 0.00 C ATOM 1519 CD1 LEU A 97 2.862 13.877 -15.626 1.00 0.00 C ATOM 1520 CD2 LEU A 97 2.402 16.211 -14.745 1.00 0.00 C ATOM 0 H LEU A 97 -2.198 13.840 -14.821 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.483 14.931 -13.738 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.292 13.760 -15.916 1.00 0.00 H new ATOM 0 HB3 LEU A 97 0.576 15.393 -16.487 1.00 0.00 H new ATOM 0 HG LEU A 97 1.743 14.380 -13.891 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.823 13.899 -15.112 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.481 12.856 -15.638 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.990 14.229 -16.650 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.372 16.187 -14.248 1.00 0.00 H new ATOM 0 HD22 LEU A 97 2.510 16.664 -15.730 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.704 16.799 -14.150 1.00 0.00 H new ATOM 1532 N LEU A 98 -1.957 17.260 -14.280 1.00 0.00 N ATOM 1533 CA LEU A 98 -2.207 18.688 -14.175 1.00 0.00 C ATOM 1534 C LEU A 98 -1.952 19.142 -12.737 1.00 0.00 C ATOM 1535 O LEU A 98 -1.319 20.172 -12.510 1.00 0.00 O ATOM 1536 CB LEU A 98 -3.608 19.026 -14.688 1.00 0.00 C ATOM 1537 CG LEU A 98 -3.824 18.881 -16.196 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -5.109 19.585 -16.636 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -2.603 19.376 -16.974 1.00 0.00 C ATOM 0 H LEU A 98 -2.743 16.669 -14.011 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.518 19.243 -14.811 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.325 18.385 -14.175 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.839 20.053 -14.405 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.944 17.822 -16.424 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -5.239 19.467 -17.712 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.961 19.145 -16.117 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.044 20.646 -16.393 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.782 19.262 -18.043 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -2.428 20.427 -16.745 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.728 18.792 -16.688 1.00 0.00 H new ATOM 1551 N LEU A 99 -2.459 18.351 -11.802 1.00 0.00 N ATOM 1552 CA LEU A 99 -2.294 18.659 -10.391 1.00 0.00 C ATOM 1553 C LEU A 99 -0.826 18.474 -10.001 1.00 0.00 C ATOM 1554 O LEU A 99 -0.267 19.289 -9.269 1.00 0.00 O ATOM 1555 CB LEU A 99 -3.264 17.832 -9.546 1.00 0.00 C ATOM 1556 CG LEU A 99 -4.446 18.594 -8.943 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -5.542 17.630 -8.483 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -3.985 19.518 -7.815 1.00 0.00 C ATOM 0 H LEU A 99 -2.984 17.498 -11.994 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.546 19.701 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.655 17.024 -10.164 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.703 17.369 -8.734 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.877 19.225 -9.720 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.370 18.197 -8.058 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.898 17.050 -9.335 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.139 16.955 -7.728 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.845 20.047 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.514 18.927 -7.030 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.267 20.239 -8.206 1.00 0.00 H new TER 1570 LEU A 99