USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 758 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+ -169:sc= 0 (180deg=-0.104) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 150:sc= -1.24 (180deg=-2.75!) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 155:sc= -0.151 (180deg=-0.644) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0959 USER MOD Single : A 26 ASN : amide:sc= -0.997 K(o=-1,f=-12!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 59:sc= 0.624 USER MOD Single : A 32 ASN : amide:sc= -0.0212 X(o=-0.021,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.298 X(o=-0.3,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 67:sc= 0.5 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.266 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.0255 K(o=-0.025,f=-1.3) USER MOD Single : A 58 MET CE :methyl -164:sc= -2.74 (180deg=-3.82!) USER MOD Single : A 60 THR OG1 : rot -41:sc= 0.457 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= -0.289 USER MOD Single : A 76 LYS NZ :NH3+ 167:sc=-0.00105 (180deg=-0.139) USER MOD Single : A 79 HIS : no HE2:sc= -1.59 K(o=-1.6,f=-4.2!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -19:sc= 0.526 USER MOD Single : A 88 LYS NZ :NH3+ 150:sc= -0.0442 (180deg=-1.14) USER MOD Single : A 89 THR OG1 : rot 81:sc= 0.638 USER MOD Single : A 92 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0395) USER MOD Single : A 95 ASN : amide:sc= -0.644 K(o=-0.64,f=-2.8!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -148:sc= -3.26! (180deg=-4.79!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.018 17.438 -13.026 1.00 0.00 N ATOM 2 CA MET A 1 10.010 16.528 -13.559 1.00 0.00 C ATOM 3 C MET A 1 10.650 15.470 -14.453 1.00 0.00 C ATOM 4 O MET A 1 11.339 15.795 -15.420 1.00 0.00 O ATOM 5 CB MET A 1 8.954 17.306 -14.346 1.00 0.00 C ATOM 6 CG MET A 1 8.065 18.178 -13.473 1.00 0.00 C ATOM 7 SD MET A 1 6.881 19.141 -14.431 1.00 0.00 S ATOM 8 CE MET A 1 5.960 19.945 -13.122 1.00 0.00 C ATOM 0 H1 MET A 1 10.594 18.028 -12.281 1.00 0.00 H new ATOM 0 H2 MET A 1 11.805 16.888 -12.626 1.00 0.00 H new ATOM 0 H3 MET A 1 11.374 18.048 -13.790 1.00 0.00 H new ATOM 0 HA MET A 1 9.530 16.026 -12.719 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.453 17.934 -15.084 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.330 16.601 -14.896 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.527 17.548 -12.765 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.688 18.854 -12.888 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.187 20.579 -13.557 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.496 19.190 -12.487 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.636 20.556 -12.524 1.00 0.00 H new ATOM 18 N ALA A 2 10.418 14.204 -14.123 1.00 0.00 N ATOM 19 CA ALA A 2 10.971 13.099 -14.897 1.00 0.00 C ATOM 20 C ALA A 2 9.905 12.051 -15.196 1.00 0.00 C ATOM 21 O ALA A 2 8.952 11.887 -14.434 1.00 0.00 O ATOM 22 CB ALA A 2 12.141 12.470 -14.157 1.00 0.00 C ATOM 0 H ALA A 2 9.851 13.918 -13.325 1.00 0.00 H new ATOM 0 HA ALA A 2 11.329 13.496 -15.847 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.544 11.646 -14.746 1.00 0.00 H new ATOM 0 HB2 ALA A 2 12.918 13.219 -14.001 1.00 0.00 H new ATOM 0 HB3 ALA A 2 11.801 12.093 -13.192 1.00 0.00 H new ATOM 28 N ARG A 3 10.071 11.344 -16.309 1.00 0.00 N ATOM 29 CA ARG A 3 9.123 10.312 -16.709 1.00 0.00 C ATOM 30 C ARG A 3 9.151 9.140 -15.732 1.00 0.00 C ATOM 31 O ARG A 3 9.993 9.085 -14.836 1.00 0.00 O ATOM 32 CB ARG A 3 9.436 9.820 -18.122 1.00 0.00 C ATOM 33 CG ARG A 3 8.849 10.696 -19.217 1.00 0.00 C ATOM 34 CD ARG A 3 9.466 10.384 -20.572 1.00 0.00 C ATOM 35 NE ARG A 3 10.841 10.865 -20.670 1.00 0.00 N ATOM 36 CZ ARG A 3 11.535 10.879 -21.804 1.00 0.00 C ATOM 37 NH1 ARG A 3 10.984 10.442 -22.928 1.00 0.00 N ATOM 38 NH2 ARG A 3 12.782 11.333 -21.813 1.00 0.00 N ATOM 0 H ARG A 3 10.854 11.468 -16.950 1.00 0.00 H new ATOM 0 HA ARG A 3 8.124 10.748 -16.698 1.00 0.00 H new ATOM 0 HB2 ARG A 3 10.517 9.770 -18.249 1.00 0.00 H new ATOM 0 HB3 ARG A 3 9.055 8.805 -18.237 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.770 10.547 -19.264 1.00 0.00 H new ATOM 0 HG3 ARG A 3 9.015 11.745 -18.973 1.00 0.00 H new ATOM 0 HD2 ARG A 3 9.446 9.307 -20.740 1.00 0.00 H new ATOM 0 HD3 ARG A 3 8.865 10.841 -21.358 1.00 0.00 H new ATOM 0 HE ARG A 3 11.294 11.209 -19.823 1.00 0.00 H new ATOM 0 HH11 ARG A 3 10.025 10.094 -22.924 1.00 0.00 H new ATOM 0 HH12 ARG A 3 11.519 10.454 -23.796 1.00 0.00 H new ATOM 0 HH21 ARG A 3 13.208 11.671 -20.950 1.00 0.00 H new ATOM 0 HH22 ARG A 3 13.315 11.344 -22.683 1.00 0.00 H new ATOM 52 N GLY A 4 8.224 8.204 -15.912 1.00 0.00 N ATOM 53 CA GLY A 4 8.160 7.045 -15.040 1.00 0.00 C ATOM 54 C GLY A 4 8.293 5.741 -15.798 1.00 0.00 C ATOM 55 O GLY A 4 8.739 4.735 -15.245 1.00 0.00 O ATOM 0 H GLY A 4 7.516 8.227 -16.646 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.953 7.111 -14.295 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.213 7.053 -14.500 1.00 0.00 H new ATOM 59 N SER A 5 7.903 5.754 -17.069 1.00 0.00 N ATOM 60 CA SER A 5 7.976 4.560 -17.903 1.00 0.00 C ATOM 61 C SER A 5 6.995 3.497 -17.418 1.00 0.00 C ATOM 62 O SER A 5 6.972 3.149 -16.237 1.00 0.00 O ATOM 63 CB SER A 5 9.398 3.997 -17.901 1.00 0.00 C ATOM 64 OG SER A 5 9.683 3.324 -19.116 1.00 0.00 O ATOM 0 H SER A 5 7.533 6.578 -17.543 1.00 0.00 H new ATOM 0 HA SER A 5 7.706 4.841 -18.921 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.113 4.807 -17.754 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.519 3.309 -17.064 1.00 0.00 H new ATOM 0 HG SER A 5 10.598 2.975 -19.090 1.00 0.00 H new ATOM 70 N VAL A 6 6.185 2.985 -18.338 1.00 0.00 N ATOM 71 CA VAL A 6 5.201 1.960 -18.006 1.00 0.00 C ATOM 72 C VAL A 6 4.425 1.522 -19.243 1.00 0.00 C ATOM 73 O VAL A 6 3.745 2.327 -19.880 1.00 0.00 O ATOM 74 CB VAL A 6 4.208 2.461 -16.941 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.582 3.778 -17.371 1.00 0.00 C ATOM 76 CG2 VAL A 6 3.137 1.412 -16.677 1.00 0.00 C ATOM 0 H VAL A 6 6.190 3.263 -19.319 1.00 0.00 H new ATOM 0 HA VAL A 6 5.752 1.109 -17.607 1.00 0.00 H new ATOM 0 HB VAL A 6 4.753 2.633 -16.013 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.883 4.116 -16.606 1.00 0.00 H new ATOM 0 HG12 VAL A 6 4.364 4.526 -17.504 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.050 3.638 -18.312 1.00 0.00 H new ATOM 0 HG21 VAL A 6 2.443 1.782 -15.922 1.00 0.00 H new ATOM 0 HG22 VAL A 6 2.594 1.207 -17.599 1.00 0.00 H new ATOM 0 HG23 VAL A 6 3.606 0.495 -16.320 1.00 0.00 H new ATOM 86 N SER A 7 4.531 0.239 -19.577 1.00 0.00 N ATOM 87 CA SER A 7 3.841 -0.306 -20.741 1.00 0.00 C ATOM 88 C SER A 7 2.333 -0.101 -20.624 1.00 0.00 C ATOM 89 O SER A 7 1.807 0.105 -19.531 1.00 0.00 O ATOM 90 CB SER A 7 4.155 -1.795 -20.893 1.00 0.00 C ATOM 91 OG SER A 7 5.369 -1.991 -21.598 1.00 0.00 O ATOM 0 H SER A 7 5.087 -0.441 -19.059 1.00 0.00 H new ATOM 0 HA SER A 7 4.194 0.225 -21.625 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.224 -2.258 -19.908 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.340 -2.290 -21.421 1.00 0.00 H new ATOM 0 HG SER A 7 5.548 -2.951 -21.680 1.00 0.00 H new ATOM 97 N ASP A 8 1.646 -0.160 -21.758 1.00 0.00 N ATOM 98 CA ASP A 8 0.199 0.017 -21.785 1.00 0.00 C ATOM 99 C ASP A 8 -0.478 -0.882 -20.756 1.00 0.00 C ATOM 100 O ASP A 8 -1.202 -0.404 -19.882 1.00 0.00 O ATOM 101 CB ASP A 8 -0.348 -0.284 -23.181 1.00 0.00 C ATOM 102 CG ASP A 8 0.120 0.720 -24.216 1.00 0.00 C ATOM 103 OD1 ASP A 8 -0.388 1.861 -24.208 1.00 0.00 O ATOM 104 OD2 ASP A 8 0.996 0.365 -25.033 1.00 0.00 O ATOM 0 H ASP A 8 2.067 -0.329 -22.671 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.019 1.055 -21.534 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.036 -1.284 -23.482 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.438 -0.286 -23.148 1.00 0.00 H new ATOM 109 N GLU A 9 -0.239 -2.185 -20.866 1.00 0.00 N ATOM 110 CA GLU A 9 -0.828 -3.149 -19.945 1.00 0.00 C ATOM 111 C GLU A 9 -0.495 -2.795 -18.498 1.00 0.00 C ATOM 112 O GLU A 9 -1.388 -2.583 -17.679 1.00 0.00 O ATOM 113 CB GLU A 9 -0.330 -4.561 -20.263 1.00 0.00 C ATOM 114 CG GLU A 9 -0.945 -5.155 -21.519 1.00 0.00 C ATOM 115 CD GLU A 9 -0.662 -6.638 -21.662 1.00 0.00 C ATOM 116 OE1 GLU A 9 -1.269 -7.275 -22.550 1.00 0.00 O ATOM 117 OE2 GLU A 9 0.165 -7.162 -20.887 1.00 0.00 O ATOM 0 H GLU A 9 0.358 -2.597 -21.583 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.910 -3.116 -20.069 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.754 -4.538 -20.375 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.549 -5.213 -19.418 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.023 -4.995 -21.502 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.558 -4.629 -22.392 1.00 0.00 H new ATOM 124 N GLU A 10 0.798 -2.732 -18.193 1.00 0.00 N ATOM 125 CA GLU A 10 1.249 -2.405 -16.846 1.00 0.00 C ATOM 126 C GLU A 10 0.540 -1.158 -16.323 1.00 0.00 C ATOM 127 O GLU A 10 -0.003 -1.158 -15.220 1.00 0.00 O ATOM 128 CB GLU A 10 2.764 -2.187 -16.830 1.00 0.00 C ATOM 129 CG GLU A 10 3.313 -1.830 -15.460 1.00 0.00 C ATOM 130 CD GLU A 10 3.090 -2.927 -14.437 1.00 0.00 C ATOM 131 OE1 GLU A 10 4.089 -3.516 -13.973 1.00 0.00 O ATOM 132 OE2 GLU A 10 1.918 -3.197 -14.101 1.00 0.00 O ATOM 0 H GLU A 10 1.550 -2.903 -18.860 1.00 0.00 H new ATOM 0 HA GLU A 10 1.003 -3.243 -16.194 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.257 -3.092 -17.185 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.016 -1.391 -17.531 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.381 -1.627 -15.542 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.840 -0.912 -15.111 1.00 0.00 H new ATOM 139 N MET A 11 0.552 -0.099 -17.124 1.00 0.00 N ATOM 140 CA MET A 11 -0.090 1.154 -16.743 1.00 0.00 C ATOM 141 C MET A 11 -1.525 0.913 -16.286 1.00 0.00 C ATOM 142 O MET A 11 -1.870 1.168 -15.132 1.00 0.00 O ATOM 143 CB MET A 11 -0.074 2.137 -17.915 1.00 0.00 C ATOM 144 CG MET A 11 0.379 3.536 -17.530 1.00 0.00 C ATOM 145 SD MET A 11 -0.986 4.591 -17.009 1.00 0.00 S ATOM 146 CE MET A 11 -0.182 5.596 -15.764 1.00 0.00 C ATOM 0 H MET A 11 0.999 -0.083 -18.041 1.00 0.00 H new ATOM 0 HA MET A 11 0.470 1.582 -15.912 1.00 0.00 H new ATOM 0 HB2 MET A 11 0.586 1.752 -18.692 1.00 0.00 H new ATOM 0 HB3 MET A 11 -1.074 2.193 -18.345 1.00 0.00 H new ATOM 0 HG2 MET A 11 1.109 3.468 -16.723 1.00 0.00 H new ATOM 0 HG3 MET A 11 0.885 3.996 -18.379 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.654 6.578 -15.728 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.275 5.113 -14.791 1.00 0.00 H new ATOM 0 HE3 MET A 11 0.873 5.710 -16.014 1.00 0.00 H new ATOM 156 N MET A 12 -2.357 0.420 -17.197 1.00 0.00 N ATOM 157 CA MET A 12 -3.754 0.143 -16.886 1.00 0.00 C ATOM 158 C MET A 12 -3.883 -0.544 -15.529 1.00 0.00 C ATOM 159 O MET A 12 -4.640 -0.097 -14.667 1.00 0.00 O ATOM 160 CB MET A 12 -4.378 -0.731 -17.975 1.00 0.00 C ATOM 161 CG MET A 12 -5.544 -0.070 -18.692 1.00 0.00 C ATOM 162 SD MET A 12 -6.979 0.158 -17.624 1.00 0.00 S ATOM 163 CE MET A 12 -8.103 0.994 -18.741 1.00 0.00 C ATOM 0 H MET A 12 -2.088 0.204 -18.157 1.00 0.00 H new ATOM 0 HA MET A 12 -4.286 1.093 -16.844 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.612 -0.988 -18.706 1.00 0.00 H new ATOM 0 HB3 MET A 12 -4.719 -1.665 -17.529 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.226 0.899 -19.078 1.00 0.00 H new ATOM 0 HG3 MET A 12 -5.828 -0.678 -19.551 1.00 0.00 H new ATOM 0 HE1 MET A 12 -9.040 1.204 -18.225 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.655 1.930 -19.075 1.00 0.00 H new ATOM 0 HE3 MET A 12 -8.299 0.357 -19.604 1.00 0.00 H new ATOM 173 N GLU A 13 -3.140 -1.631 -15.348 1.00 0.00 N ATOM 174 CA GLU A 13 -3.174 -2.379 -14.097 1.00 0.00 C ATOM 175 C GLU A 13 -2.939 -1.455 -12.905 1.00 0.00 C ATOM 176 O GLU A 13 -3.761 -1.380 -11.991 1.00 0.00 O ATOM 177 CB GLU A 13 -2.120 -3.489 -14.112 1.00 0.00 C ATOM 178 CG GLU A 13 -2.644 -4.831 -13.629 1.00 0.00 C ATOM 179 CD GLU A 13 -1.730 -5.982 -14.001 1.00 0.00 C ATOM 180 OE1 GLU A 13 -1.341 -6.747 -13.093 1.00 0.00 O ATOM 181 OE2 GLU A 13 -1.401 -6.118 -15.198 1.00 0.00 O ATOM 0 H GLU A 13 -2.508 -2.013 -16.051 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.162 -2.828 -13.998 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.737 -3.601 -15.126 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.280 -3.189 -13.486 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.763 -4.802 -12.546 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.633 -5.005 -14.054 1.00 0.00 H new ATOM 188 N LEU A 14 -1.810 -0.755 -12.921 1.00 0.00 N ATOM 189 CA LEU A 14 -1.465 0.164 -11.842 1.00 0.00 C ATOM 190 C LEU A 14 -2.558 1.209 -11.645 1.00 0.00 C ATOM 191 O LEU A 14 -2.929 1.531 -10.516 1.00 0.00 O ATOM 192 CB LEU A 14 -0.132 0.853 -12.139 1.00 0.00 C ATOM 193 CG LEU A 14 1.127 0.063 -11.780 1.00 0.00 C ATOM 194 CD1 LEU A 14 0.921 -1.420 -12.049 1.00 0.00 C ATOM 195 CD2 LEU A 14 2.325 0.587 -12.559 1.00 0.00 C ATOM 0 H LEU A 14 -1.118 -0.806 -13.669 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.372 -0.414 -10.923 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.097 1.090 -13.202 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.108 1.801 -11.601 1.00 0.00 H new ATOM 0 HG LEU A 14 1.325 0.194 -10.716 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.827 -1.966 -11.788 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.090 -1.787 -11.447 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.698 -1.571 -13.105 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.212 0.013 -12.291 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.136 0.486 -13.628 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.485 1.638 -12.317 1.00 0.00 H new ATOM 207 N ARG A 15 -3.072 1.736 -12.753 1.00 0.00 N ATOM 208 CA ARG A 15 -4.123 2.745 -12.703 1.00 0.00 C ATOM 209 C ARG A 15 -5.292 2.268 -11.845 1.00 0.00 C ATOM 210 O ARG A 15 -5.608 2.871 -10.820 1.00 0.00 O ATOM 211 CB ARG A 15 -4.613 3.072 -14.115 1.00 0.00 C ATOM 212 CG ARG A 15 -3.577 3.784 -14.968 1.00 0.00 C ATOM 213 CD ARG A 15 -3.247 5.160 -14.412 1.00 0.00 C ATOM 214 NE ARG A 15 -3.390 6.207 -15.419 1.00 0.00 N ATOM 215 CZ ARG A 15 -4.557 6.728 -15.778 1.00 0.00 C ATOM 216 NH1 ARG A 15 -5.679 6.301 -15.214 1.00 0.00 N ATOM 217 NH2 ARG A 15 -4.606 7.678 -16.703 1.00 0.00 N ATOM 0 H ARG A 15 -2.777 1.480 -13.695 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.707 3.646 -12.253 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.907 2.147 -14.612 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -5.505 3.695 -14.046 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -2.669 3.183 -15.017 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.949 3.882 -15.988 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -3.903 5.377 -13.569 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -2.226 5.161 -14.031 1.00 0.00 H new ATOM 0 HE ARG A 15 -2.546 6.558 -15.872 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -5.646 5.571 -14.503 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -6.574 6.703 -15.492 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -3.746 8.009 -17.140 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -5.504 8.077 -16.977 1.00 0.00 H new ATOM 231 N GLU A 16 -5.932 1.184 -12.274 1.00 0.00 N ATOM 232 CA GLU A 16 -7.066 0.629 -11.545 1.00 0.00 C ATOM 233 C GLU A 16 -6.670 0.261 -10.118 1.00 0.00 C ATOM 234 O GLU A 16 -7.480 0.350 -9.195 1.00 0.00 O ATOM 235 CB GLU A 16 -7.611 -0.604 -12.268 1.00 0.00 C ATOM 236 CG GLU A 16 -6.598 -1.731 -12.398 1.00 0.00 C ATOM 237 CD GLU A 16 -7.204 -2.996 -12.974 1.00 0.00 C ATOM 238 OE1 GLU A 16 -6.959 -4.082 -12.407 1.00 0.00 O ATOM 239 OE2 GLU A 16 -7.921 -2.901 -13.992 1.00 0.00 O ATOM 0 H GLU A 16 -5.684 0.674 -13.122 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.844 1.391 -11.502 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.485 -0.973 -11.731 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -7.947 -0.312 -13.263 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.776 -1.404 -13.035 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.175 -1.949 -11.417 1.00 0.00 H new ATOM 246 N ALA A 17 -5.418 -0.152 -9.945 1.00 0.00 N ATOM 247 CA ALA A 17 -4.913 -0.531 -8.632 1.00 0.00 C ATOM 248 C ALA A 17 -5.023 0.627 -7.646 1.00 0.00 C ATOM 249 O ALA A 17 -5.428 0.443 -6.498 1.00 0.00 O ATOM 250 CB ALA A 17 -3.470 -1.002 -8.737 1.00 0.00 C ATOM 0 H ALA A 17 -4.735 -0.232 -10.699 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.525 -1.352 -8.258 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.106 -1.282 -7.749 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.416 -1.865 -9.401 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.853 -0.197 -9.137 1.00 0.00 H new ATOM 256 N PHE A 18 -4.658 1.822 -8.101 1.00 0.00 N ATOM 257 CA PHE A 18 -4.715 3.010 -7.258 1.00 0.00 C ATOM 258 C PHE A 18 -6.154 3.482 -7.077 1.00 0.00 C ATOM 259 O PHE A 18 -6.573 3.824 -5.972 1.00 0.00 O ATOM 260 CB PHE A 18 -3.870 4.133 -7.865 1.00 0.00 C ATOM 261 CG PHE A 18 -2.532 3.672 -8.365 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.765 2.790 -7.621 1.00 0.00 C ATOM 263 CD2 PHE A 18 -2.037 4.122 -9.579 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.532 2.364 -8.078 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.806 3.699 -10.042 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.052 2.820 -9.289 1.00 0.00 C ATOM 0 H PHE A 18 -4.320 1.992 -9.048 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.312 2.749 -6.279 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.421 4.586 -8.689 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.721 4.910 -7.116 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.135 2.431 -6.672 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.621 4.812 -10.170 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.055 1.675 -7.488 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.434 4.055 -10.991 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.912 2.490 -9.647 1.00 0.00 H new ATOM 276 N ALA A 19 -6.907 3.497 -8.172 1.00 0.00 N ATOM 277 CA ALA A 19 -8.300 3.925 -8.136 1.00 0.00 C ATOM 278 C ALA A 19 -9.154 2.946 -7.337 1.00 0.00 C ATOM 279 O ALA A 19 -10.271 3.269 -6.932 1.00 0.00 O ATOM 280 CB ALA A 19 -8.844 4.072 -9.550 1.00 0.00 C ATOM 0 H ALA A 19 -6.575 3.218 -9.095 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.344 4.894 -7.639 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.885 4.392 -9.508 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -8.257 4.815 -10.090 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.780 3.114 -10.066 1.00 0.00 H new ATOM 286 N LYS A 20 -8.623 1.749 -7.116 1.00 0.00 N ATOM 287 CA LYS A 20 -9.336 0.722 -6.365 1.00 0.00 C ATOM 288 C LYS A 20 -9.528 1.145 -4.913 1.00 0.00 C ATOM 289 O LYS A 20 -10.656 1.248 -4.429 1.00 0.00 O ATOM 290 CB LYS A 20 -8.574 -0.604 -6.425 1.00 0.00 C ATOM 291 CG LYS A 20 -9.364 -1.731 -7.068 1.00 0.00 C ATOM 292 CD LYS A 20 -9.658 -1.443 -8.531 1.00 0.00 C ATOM 293 CE LYS A 20 -10.804 -2.298 -9.048 1.00 0.00 C ATOM 294 NZ LYS A 20 -12.078 -2.010 -8.331 1.00 0.00 N ATOM 0 H LYS A 20 -7.701 1.465 -7.446 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.318 0.590 -6.819 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.649 -0.457 -6.982 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.294 -0.899 -5.414 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.804 -2.662 -6.985 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.301 -1.873 -6.529 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.906 -0.389 -8.653 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.765 -1.631 -9.127 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.939 -2.118 -10.115 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.552 -3.352 -8.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.883 -2.258 -8.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -12.119 -2.572 -7.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -12.122 -0.998 -8.094 1.00 0.00 H new ATOM 308 N VAL A 21 -8.420 1.391 -4.221 1.00 0.00 N ATOM 309 CA VAL A 21 -8.467 1.806 -2.824 1.00 0.00 C ATOM 310 C VAL A 21 -8.895 3.264 -2.697 1.00 0.00 C ATOM 311 O VAL A 21 -9.404 3.684 -1.658 1.00 0.00 O ATOM 312 CB VAL A 21 -7.100 1.622 -2.137 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.784 0.145 -1.965 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.007 2.321 -2.932 1.00 0.00 C ATOM 0 H VAL A 21 -7.479 1.310 -4.605 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.202 1.170 -2.330 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.145 2.077 -1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.815 0.035 -1.478 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.554 -0.323 -1.351 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.756 -0.337 -2.942 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.048 2.181 -2.433 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.959 1.897 -3.935 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.230 3.386 -2.998 1.00 0.00 H new ATOM 324 N ASP A 22 -8.685 4.031 -3.762 1.00 0.00 N ATOM 325 CA ASP A 22 -9.050 5.442 -3.771 1.00 0.00 C ATOM 326 C ASP A 22 -10.557 5.613 -3.939 1.00 0.00 C ATOM 327 O ASP A 22 -11.058 5.737 -5.056 1.00 0.00 O ATOM 328 CB ASP A 22 -8.314 6.174 -4.894 1.00 0.00 C ATOM 329 CG ASP A 22 -6.859 6.438 -4.557 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.136 6.969 -5.425 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.446 6.116 -3.424 1.00 0.00 O ATOM 0 H ASP A 22 -8.264 3.699 -4.630 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.758 5.873 -2.813 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.371 5.582 -5.808 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -8.815 7.121 -5.096 1.00 0.00 H new ATOM 336 N THR A 23 -11.275 5.616 -2.820 1.00 0.00 N ATOM 337 CA THR A 23 -12.725 5.768 -2.843 1.00 0.00 C ATOM 338 C THR A 23 -13.124 7.147 -3.353 1.00 0.00 C ATOM 339 O THR A 23 -14.004 7.274 -4.205 1.00 0.00 O ATOM 340 CB THR A 23 -13.333 5.554 -1.444 1.00 0.00 C ATOM 341 OG1 THR A 23 -12.292 5.468 -0.464 1.00 0.00 O ATOM 342 CG2 THR A 23 -14.177 4.289 -1.409 1.00 0.00 C ATOM 0 H THR A 23 -10.876 5.515 -1.887 1.00 0.00 H new ATOM 0 HA THR A 23 -13.113 5.007 -3.520 1.00 0.00 H new ATOM 0 HB THR A 23 -13.974 6.406 -1.217 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.688 5.334 0.423 1.00 0.00 H new ATOM 0 HG21 THR A 23 -14.596 4.159 -0.411 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.986 4.371 -2.134 1.00 0.00 H new ATOM 0 HG23 THR A 23 -13.554 3.429 -1.656 1.00 0.00 H new ATOM 350 N ASP A 24 -12.473 8.179 -2.828 1.00 0.00 N ATOM 351 CA ASP A 24 -12.759 9.550 -3.232 1.00 0.00 C ATOM 352 C ASP A 24 -12.165 9.848 -4.605 1.00 0.00 C ATOM 353 O ASP A 24 -12.464 10.875 -5.213 1.00 0.00 O ATOM 354 CB ASP A 24 -12.207 10.536 -2.200 1.00 0.00 C ATOM 355 CG ASP A 24 -10.779 10.218 -1.804 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.860 10.911 -2.290 1.00 0.00 O ATOM 357 OD2 ASP A 24 -10.579 9.279 -1.006 1.00 0.00 O ATOM 0 H ASP A 24 -11.743 8.092 -2.121 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.841 9.665 -3.291 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.252 11.546 -2.606 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.839 10.521 -1.312 1.00 0.00 H new ATOM 362 N GLY A 25 -11.320 8.941 -5.088 1.00 0.00 N ATOM 363 CA GLY A 25 -10.696 9.125 -6.385 1.00 0.00 C ATOM 364 C GLY A 25 -9.937 10.434 -6.483 1.00 0.00 C ATOM 365 O GLY A 25 -10.220 11.261 -7.349 1.00 0.00 O ATOM 0 H GLY A 25 -11.057 8.083 -4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.013 8.297 -6.577 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.461 9.093 -7.161 1.00 0.00 H new ATOM 369 N ASN A 26 -8.970 10.624 -5.590 1.00 0.00 N ATOM 370 CA ASN A 26 -8.170 11.843 -5.579 1.00 0.00 C ATOM 371 C ASN A 26 -6.795 11.597 -6.193 1.00 0.00 C ATOM 372 O ASN A 26 -6.076 12.537 -6.527 1.00 0.00 O ATOM 373 CB ASN A 26 -8.015 12.362 -4.147 1.00 0.00 C ATOM 374 CG ASN A 26 -7.254 11.397 -3.261 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.975 10.263 -3.653 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.911 11.842 -2.057 1.00 0.00 N ATOM 0 H ASN A 26 -8.722 9.950 -4.866 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.687 12.593 -6.178 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.496 13.320 -4.165 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -9.002 12.542 -3.720 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.396 11.237 -1.417 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -7.162 12.789 -1.773 1.00 0.00 H new ATOM 383 N GLY A 27 -6.437 10.324 -6.340 1.00 0.00 N ATOM 384 CA GLY A 27 -5.150 9.977 -6.914 1.00 0.00 C ATOM 385 C GLY A 27 -4.046 9.935 -5.878 1.00 0.00 C ATOM 386 O GLY A 27 -2.863 9.992 -6.217 1.00 0.00 O ATOM 0 H GLY A 27 -7.015 9.528 -6.072 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.223 9.005 -7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.892 10.702 -7.686 1.00 0.00 H new ATOM 390 N TYR A 28 -4.429 9.834 -4.610 1.00 0.00 N ATOM 391 CA TYR A 28 -3.462 9.786 -3.520 1.00 0.00 C ATOM 392 C TYR A 28 -3.710 8.578 -2.623 1.00 0.00 C ATOM 393 O TYR A 28 -4.845 8.122 -2.477 1.00 0.00 O ATOM 394 CB TYR A 28 -3.530 11.072 -2.694 1.00 0.00 C ATOM 395 CG TYR A 28 -2.783 12.231 -3.315 1.00 0.00 C ATOM 396 CD1 TYR A 28 -1.403 12.191 -3.468 1.00 0.00 C ATOM 397 CD2 TYR A 28 -3.458 13.366 -3.748 1.00 0.00 C ATOM 398 CE1 TYR A 28 -0.716 13.247 -4.035 1.00 0.00 C ATOM 399 CE2 TYR A 28 -2.780 14.427 -4.316 1.00 0.00 C ATOM 400 CZ TYR A 28 -1.409 14.363 -4.457 1.00 0.00 C ATOM 401 OH TYR A 28 -0.730 15.418 -5.022 1.00 0.00 O ATOM 0 H TYR A 28 -5.403 9.784 -4.312 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.467 9.693 -3.955 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.575 11.353 -2.561 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.123 10.878 -1.702 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -0.858 11.319 -3.138 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.531 13.419 -3.639 1.00 0.00 H new ATOM 0 HE1 TYR A 28 0.357 13.199 -4.147 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -3.320 15.302 -4.648 1.00 0.00 H new ATOM 0 HH TYR A 28 -1.365 16.123 -5.265 1.00 0.00 H new ATOM 411 N ILE A 29 -2.642 8.066 -2.022 1.00 0.00 N ATOM 412 CA ILE A 29 -2.744 6.912 -1.137 1.00 0.00 C ATOM 413 C ILE A 29 -1.915 7.114 0.126 1.00 0.00 C ATOM 414 O ILE A 29 -0.697 7.286 0.062 1.00 0.00 O ATOM 415 CB ILE A 29 -2.282 5.621 -1.839 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.182 5.317 -3.039 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.283 4.456 -0.861 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.850 4.013 -3.729 1.00 0.00 C ATOM 0 H ILE A 29 -1.696 8.432 -2.131 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.796 6.813 -0.868 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.264 5.766 -2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.220 5.289 -2.706 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.100 6.131 -3.759 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -1.954 3.551 -1.372 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.605 4.673 -0.036 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.291 4.308 -0.473 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.528 3.863 -4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.823 4.045 -4.092 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.960 3.190 -3.023 1.00 0.00 H new ATOM 430 N SER A 30 -2.582 7.089 1.276 1.00 0.00 N ATOM 431 CA SER A 30 -1.907 7.272 2.556 1.00 0.00 C ATOM 432 C SER A 30 -1.602 5.926 3.206 1.00 0.00 C ATOM 433 O SER A 30 -1.774 4.873 2.591 1.00 0.00 O ATOM 434 CB SER A 30 -2.768 8.121 3.493 1.00 0.00 C ATOM 435 OG SER A 30 -2.009 8.596 4.592 1.00 0.00 O ATOM 0 H SER A 30 -3.589 6.944 1.347 1.00 0.00 H new ATOM 0 HA SER A 30 -0.965 7.789 2.372 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.186 8.965 2.944 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.608 7.529 3.856 1.00 0.00 H new ATOM 0 HG SER A 30 -1.255 9.129 4.263 1.00 0.00 H new ATOM 441 N PHE A 31 -1.149 5.969 4.454 1.00 0.00 N ATOM 442 CA PHE A 31 -0.818 4.752 5.189 1.00 0.00 C ATOM 443 C PHE A 31 -2.082 3.988 5.572 1.00 0.00 C ATOM 444 O PHE A 31 -2.064 2.764 5.700 1.00 0.00 O ATOM 445 CB PHE A 31 -0.015 5.094 6.446 1.00 0.00 C ATOM 446 CG PHE A 31 -0.060 4.020 7.496 1.00 0.00 C ATOM 447 CD1 PHE A 31 -1.051 4.021 8.464 1.00 0.00 C ATOM 448 CD2 PHE A 31 0.888 3.011 7.513 1.00 0.00 C ATOM 449 CE1 PHE A 31 -1.095 3.035 9.432 1.00 0.00 C ATOM 450 CE2 PHE A 31 0.848 2.021 8.478 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.144 2.034 9.439 1.00 0.00 C ATOM 0 H PHE A 31 -1.002 6.832 4.978 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.213 4.118 4.541 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.023 5.275 6.167 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.397 6.022 6.870 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.798 4.801 8.462 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.667 2.997 6.765 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.872 3.048 10.182 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.592 1.238 8.480 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.176 1.263 10.194 1.00 0.00 H new ATOM 461 N ASN A 32 -3.178 4.719 5.751 1.00 0.00 N ATOM 462 CA ASN A 32 -4.451 4.110 6.120 1.00 0.00 C ATOM 463 C ASN A 32 -5.015 3.288 4.966 1.00 0.00 C ATOM 464 O ASN A 32 -5.416 2.140 5.147 1.00 0.00 O ATOM 465 CB ASN A 32 -5.455 5.189 6.533 1.00 0.00 C ATOM 466 CG ASN A 32 -6.614 4.624 7.329 1.00 0.00 C ATOM 467 OD1 ASN A 32 -6.606 4.645 8.560 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.622 4.115 6.629 1.00 0.00 N ATOM 0 H ASN A 32 -3.210 5.733 5.647 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.276 3.444 6.965 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.945 5.948 7.127 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.838 5.686 5.642 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.430 3.721 7.111 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.588 4.118 5.610 1.00 0.00 H new ATOM 475 N GLU A 33 -5.042 3.885 3.778 1.00 0.00 N ATOM 476 CA GLU A 33 -5.557 3.208 2.594 1.00 0.00 C ATOM 477 C GLU A 33 -4.865 1.863 2.393 1.00 0.00 C ATOM 478 O GLU A 33 -5.518 0.820 2.326 1.00 0.00 O ATOM 479 CB GLU A 33 -5.366 4.084 1.354 1.00 0.00 C ATOM 480 CG GLU A 33 -6.066 5.430 1.446 1.00 0.00 C ATOM 481 CD GLU A 33 -7.085 5.634 0.342 1.00 0.00 C ATOM 482 OE1 GLU A 33 -6.754 5.355 -0.829 1.00 0.00 O ATOM 483 OE2 GLU A 33 -8.213 6.073 0.650 1.00 0.00 O ATOM 0 H GLU A 33 -4.713 4.836 3.611 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.622 3.030 2.743 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.300 4.248 1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.739 3.549 0.481 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.562 5.512 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.323 6.226 1.401 1.00 0.00 H new ATOM 490 N LEU A 34 -3.541 1.895 2.295 1.00 0.00 N ATOM 491 CA LEU A 34 -2.759 0.679 2.100 1.00 0.00 C ATOM 492 C LEU A 34 -2.959 -0.289 3.262 1.00 0.00 C ATOM 493 O LEU A 34 -3.289 -1.456 3.060 1.00 0.00 O ATOM 494 CB LEU A 34 -1.275 1.022 1.955 1.00 0.00 C ATOM 495 CG LEU A 34 -0.813 1.424 0.554 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.685 1.684 0.541 1.00 0.00 C ATOM 497 CD2 LEU A 34 -1.177 0.348 -0.457 1.00 0.00 C ATOM 0 H LEU A 34 -2.986 2.749 2.347 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.105 0.196 1.186 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.042 1.837 2.640 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.690 0.160 2.275 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.324 2.345 0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.996 1.969 -0.464 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.920 2.490 1.236 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.214 0.780 0.842 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.840 0.651 -1.448 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.694 -0.589 -0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.258 0.209 -0.468 1.00 0.00 H new ATOM 509 N ASN A 35 -2.756 0.206 4.479 1.00 0.00 N ATOM 510 CA ASN A 35 -2.916 -0.615 5.675 1.00 0.00 C ATOM 511 C ASN A 35 -4.262 -1.332 5.666 1.00 0.00 C ATOM 512 O ASN A 35 -4.345 -2.523 5.963 1.00 0.00 O ATOM 513 CB ASN A 35 -2.793 0.249 6.932 1.00 0.00 C ATOM 514 CG ASN A 35 -3.333 -0.447 8.166 1.00 0.00 C ATOM 515 OD1 ASN A 35 -4.078 0.143 8.948 1.00 0.00 O ATOM 516 ND2 ASN A 35 -2.958 -1.709 8.346 1.00 0.00 N ATOM 0 H ASN A 35 -2.481 1.171 4.663 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.125 -1.365 5.680 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.746 0.506 7.092 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.331 1.185 6.781 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.289 -2.229 9.159 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.339 -2.158 7.671 1.00 0.00 H new ATOM 523 N ASP A 36 -5.316 -0.597 5.324 1.00 0.00 N ATOM 524 CA ASP A 36 -6.659 -1.162 5.276 1.00 0.00 C ATOM 525 C ASP A 36 -6.793 -2.147 4.119 1.00 0.00 C ATOM 526 O ASP A 36 -7.463 -3.174 4.238 1.00 0.00 O ATOM 527 CB ASP A 36 -7.699 -0.049 5.137 1.00 0.00 C ATOM 528 CG ASP A 36 -9.045 -0.440 5.714 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.538 -1.538 5.382 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.606 0.354 6.499 1.00 0.00 O ATOM 0 H ASP A 36 -5.265 0.391 5.076 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.834 -1.698 6.209 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.337 0.847 5.641 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.818 0.204 4.083 1.00 0.00 H new ATOM 535 N LEU A 37 -6.151 -1.829 3.000 1.00 0.00 N ATOM 536 CA LEU A 37 -6.198 -2.685 1.820 1.00 0.00 C ATOM 537 C LEU A 37 -5.534 -4.030 2.097 1.00 0.00 C ATOM 538 O LEU A 37 -6.129 -5.086 1.878 1.00 0.00 O ATOM 539 CB LEU A 37 -5.513 -1.998 0.638 1.00 0.00 C ATOM 540 CG LEU A 37 -5.509 -2.773 -0.680 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.269 -3.647 -0.781 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.770 -3.616 -0.806 1.00 0.00 C ATOM 0 H LEU A 37 -5.591 -0.984 2.885 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.244 -2.861 1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.000 -1.038 0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.480 -1.787 0.915 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.491 -2.057 -1.501 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.283 -4.191 -1.725 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.378 -3.021 -0.736 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.256 -4.357 0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.751 -4.161 -1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.818 -4.324 0.021 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.646 -2.967 -0.780 1.00 0.00 H new ATOM 554 N PHE A 38 -4.297 -3.985 2.580 1.00 0.00 N ATOM 555 CA PHE A 38 -3.552 -5.199 2.889 1.00 0.00 C ATOM 556 C PHE A 38 -4.247 -6.002 3.983 1.00 0.00 C ATOM 557 O PHE A 38 -4.376 -7.223 3.889 1.00 0.00 O ATOM 558 CB PHE A 38 -2.126 -4.852 3.323 1.00 0.00 C ATOM 559 CG PHE A 38 -1.382 -4.016 2.322 1.00 0.00 C ATOM 560 CD1 PHE A 38 -1.639 -4.142 0.967 1.00 0.00 C ATOM 561 CD2 PHE A 38 -0.422 -3.106 2.736 1.00 0.00 C ATOM 562 CE1 PHE A 38 -0.956 -3.374 0.043 1.00 0.00 C ATOM 563 CE2 PHE A 38 0.264 -2.335 1.817 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.002 -2.470 0.468 1.00 0.00 C ATOM 0 H PHE A 38 -3.789 -3.120 2.766 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.512 -5.809 1.986 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.163 -4.319 4.273 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.573 -5.775 3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.382 -4.849 0.628 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.208 -2.998 3.789 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.168 -3.481 -1.011 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.008 -1.627 2.153 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.535 -1.870 -0.252 1.00 0.00 H new ATOM 574 N LYS A 39 -4.696 -5.308 5.024 1.00 0.00 N ATOM 575 CA LYS A 39 -5.380 -5.953 6.138 1.00 0.00 C ATOM 576 C LYS A 39 -6.731 -6.509 5.698 1.00 0.00 C ATOM 577 O LYS A 39 -7.220 -7.491 6.256 1.00 0.00 O ATOM 578 CB LYS A 39 -5.573 -4.961 7.287 1.00 0.00 C ATOM 579 CG LYS A 39 -5.843 -5.628 8.626 1.00 0.00 C ATOM 580 CD LYS A 39 -4.616 -6.361 9.140 1.00 0.00 C ATOM 581 CE LYS A 39 -4.689 -7.851 8.837 1.00 0.00 C ATOM 582 NZ LYS A 39 -5.272 -8.619 9.972 1.00 0.00 N ATOM 0 H LYS A 39 -4.598 -4.297 5.119 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.761 -6.782 6.482 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.682 -4.339 7.373 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.403 -4.297 7.047 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.150 -4.876 9.353 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.671 -6.329 8.524 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.721 -5.939 8.683 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.526 -6.211 10.216 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.291 -8.011 7.943 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.689 -8.227 8.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.305 -9.629 9.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.683 -8.487 10.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.236 -8.278 10.163 1.00 0.00 H new ATOM 596 N ALA A 40 -7.328 -5.874 4.696 1.00 0.00 N ATOM 597 CA ALA A 40 -8.621 -6.307 4.180 1.00 0.00 C ATOM 598 C ALA A 40 -8.507 -7.654 3.474 1.00 0.00 C ATOM 599 O ALA A 40 -9.476 -8.407 3.395 1.00 0.00 O ATOM 600 CB ALA A 40 -9.189 -5.260 3.233 1.00 0.00 C ATOM 0 H ALA A 40 -6.937 -5.058 4.225 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.300 -6.425 5.024 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.155 -5.597 2.855 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.316 -4.318 3.766 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.504 -5.115 2.398 1.00 0.00 H new ATOM 606 N ALA A 41 -7.316 -7.950 2.962 1.00 0.00 N ATOM 607 CA ALA A 41 -7.076 -9.207 2.264 1.00 0.00 C ATOM 608 C ALA A 41 -7.429 -10.400 3.145 1.00 0.00 C ATOM 609 O ALA A 41 -7.733 -11.484 2.646 1.00 0.00 O ATOM 610 CB ALA A 41 -5.625 -9.291 1.815 1.00 0.00 C ATOM 0 H ALA A 41 -6.503 -7.336 3.018 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.720 -9.235 1.385 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.459 -10.235 1.295 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.404 -8.462 1.142 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.971 -9.236 2.685 1.00 0.00 H new ATOM 616 N CYS A 42 -7.386 -10.194 4.457 1.00 0.00 N ATOM 617 CA CYS A 42 -7.701 -11.254 5.408 1.00 0.00 C ATOM 618 C CYS A 42 -6.896 -12.514 5.104 1.00 0.00 C ATOM 619 O CYS A 42 -7.458 -13.595 4.925 1.00 0.00 O ATOM 620 CB CYS A 42 -9.197 -11.571 5.375 1.00 0.00 C ATOM 621 SG CYS A 42 -10.251 -10.213 5.937 1.00 0.00 S ATOM 0 H CYS A 42 -7.136 -9.303 4.886 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.433 -10.904 6.405 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.479 -11.838 4.356 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -9.386 -12.445 5.998 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.181 -9.230 5.089 1.00 0.00 H new ATOM 627 N LEU A 43 -5.577 -12.367 5.046 1.00 0.00 N ATOM 628 CA LEU A 43 -4.693 -13.492 4.762 1.00 0.00 C ATOM 629 C LEU A 43 -4.076 -14.036 6.046 1.00 0.00 C ATOM 630 O LEU A 43 -4.012 -13.357 7.071 1.00 0.00 O ATOM 631 CB LEU A 43 -3.589 -13.066 3.793 1.00 0.00 C ATOM 632 CG LEU A 43 -3.947 -13.110 2.306 1.00 0.00 C ATOM 633 CD1 LEU A 43 -3.387 -11.894 1.586 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.431 -14.394 1.671 1.00 0.00 C ATOM 0 H LEU A 43 -5.096 -11.479 5.192 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.286 -14.282 4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.286 -12.049 4.043 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.722 -13.707 3.957 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.033 -13.093 2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.652 -11.943 0.530 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.805 -10.988 2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.302 -11.879 1.688 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.695 -14.408 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.347 -14.442 1.775 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.881 -15.253 2.169 1.00 0.00 H new ATOM 646 N PRO A 44 -3.607 -15.292 5.991 1.00 0.00 N ATOM 647 CA PRO A 44 -2.984 -15.955 7.140 1.00 0.00 C ATOM 648 C PRO A 44 -1.624 -15.359 7.486 1.00 0.00 C ATOM 649 O PRO A 44 -0.583 -15.945 7.186 1.00 0.00 O ATOM 650 CB PRO A 44 -2.829 -17.404 6.672 1.00 0.00 C ATOM 651 CG PRO A 44 -2.770 -17.318 5.186 1.00 0.00 C ATOM 652 CD PRO A 44 -3.650 -16.161 4.803 1.00 0.00 C ATOM 0 HA PRO A 44 -3.581 -15.846 8.046 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.925 -17.857 7.079 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.668 -18.018 7.000 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -1.747 -17.160 4.845 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -3.120 -18.243 4.727 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -3.277 -15.648 3.916 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -4.666 -16.486 4.579 1.00 0.00 H new ATOM 660 N LEU A 45 -1.639 -14.191 8.119 1.00 0.00 N ATOM 661 CA LEU A 45 -0.406 -13.515 8.507 1.00 0.00 C ATOM 662 C LEU A 45 -0.603 -12.719 9.792 1.00 0.00 C ATOM 663 O LEU A 45 -1.713 -12.313 10.137 1.00 0.00 O ATOM 664 CB LEU A 45 0.064 -12.587 7.386 1.00 0.00 C ATOM 665 CG LEU A 45 0.588 -13.271 6.123 1.00 0.00 C ATOM 666 CD1 LEU A 45 0.553 -12.313 4.942 1.00 0.00 C ATOM 667 CD2 LEU A 45 1.999 -13.795 6.345 1.00 0.00 C ATOM 0 H LEU A 45 -2.491 -13.692 8.374 1.00 0.00 H new ATOM 0 HA LEU A 45 0.355 -14.274 8.685 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.767 -11.939 7.106 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.851 -11.944 7.780 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.061 -14.117 5.897 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.930 -12.818 4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.473 -11.988 4.768 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.177 -11.446 5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 45 2.355 -14.278 5.435 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.660 -12.966 6.597 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.995 -14.517 7.162 1.00 0.00 H new ATOM 679 N PRO A 46 0.501 -12.487 10.520 1.00 0.00 N ATOM 680 CA PRO A 46 0.476 -11.734 11.778 1.00 0.00 C ATOM 681 C PRO A 46 0.188 -10.253 11.562 1.00 0.00 C ATOM 682 O PRO A 46 -0.206 -9.839 10.472 1.00 0.00 O ATOM 683 CB PRO A 46 1.888 -11.929 12.336 1.00 0.00 C ATOM 684 CG PRO A 46 2.734 -12.196 11.139 1.00 0.00 C ATOM 685 CD PRO A 46 1.857 -12.940 10.170 1.00 0.00 C ATOM 0 HA PRO A 46 -0.313 -12.082 12.445 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.228 -11.043 12.872 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.924 -12.760 13.040 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.097 -11.266 10.702 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.611 -12.787 11.405 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.106 -12.700 9.136 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.961 -14.019 10.281 1.00 0.00 H new ATOM 693 N GLY A 47 0.387 -9.456 12.608 1.00 0.00 N ATOM 694 CA GLY A 47 0.144 -8.029 12.511 1.00 0.00 C ATOM 695 C GLY A 47 1.364 -7.263 12.042 1.00 0.00 C ATOM 696 O GLY A 47 1.277 -6.442 11.131 1.00 0.00 O ATOM 0 H GLY A 47 0.712 -9.774 13.521 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.681 -7.850 11.821 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.167 -7.650 13.484 1.00 0.00 H new ATOM 700 N TYR A 48 2.505 -7.533 12.667 1.00 0.00 N ATOM 701 CA TYR A 48 3.748 -6.860 12.311 1.00 0.00 C ATOM 702 C TYR A 48 4.055 -7.031 10.827 1.00 0.00 C ATOM 703 O TYR A 48 4.678 -6.170 10.206 1.00 0.00 O ATOM 704 CB TYR A 48 4.906 -7.405 13.149 1.00 0.00 C ATOM 705 CG TYR A 48 5.073 -8.905 13.048 1.00 0.00 C ATOM 706 CD1 TYR A 48 4.548 -9.748 14.020 1.00 0.00 C ATOM 707 CD2 TYR A 48 5.754 -9.478 11.982 1.00 0.00 C ATOM 708 CE1 TYR A 48 4.697 -11.119 13.932 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.907 -10.848 11.885 1.00 0.00 C ATOM 710 CZ TYR A 48 5.378 -11.663 12.864 1.00 0.00 C ATOM 711 OH TYR A 48 5.530 -13.029 12.771 1.00 0.00 O ATOM 0 H TYR A 48 2.594 -8.213 13.422 1.00 0.00 H new ATOM 0 HA TYR A 48 3.627 -5.797 12.518 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.831 -6.923 12.833 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.747 -7.135 14.193 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.015 -9.325 14.858 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.171 -8.842 11.215 1.00 0.00 H new ATOM 0 HE1 TYR A 48 4.282 -11.761 14.695 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.437 -11.278 11.048 1.00 0.00 H new ATOM 0 HH TYR A 48 6.033 -13.248 11.959 1.00 0.00 H new ATOM 721 N ARG A 49 3.613 -8.151 10.264 1.00 0.00 N ATOM 722 CA ARG A 49 3.839 -8.438 8.852 1.00 0.00 C ATOM 723 C ARG A 49 3.195 -7.371 7.970 1.00 0.00 C ATOM 724 O ARG A 49 3.883 -6.651 7.245 1.00 0.00 O ATOM 725 CB ARG A 49 3.281 -9.816 8.494 1.00 0.00 C ATOM 726 CG ARG A 49 4.333 -10.913 8.476 1.00 0.00 C ATOM 727 CD ARG A 49 4.978 -11.044 7.105 1.00 0.00 C ATOM 728 NE ARG A 49 5.354 -12.422 6.805 1.00 0.00 N ATOM 729 CZ ARG A 49 6.205 -12.760 5.843 1.00 0.00 C ATOM 730 NH1 ARG A 49 6.765 -11.823 5.090 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.497 -14.037 5.632 1.00 0.00 N ATOM 0 H ARG A 49 3.096 -8.875 10.764 1.00 0.00 H new ATOM 0 HA ARG A 49 4.914 -8.432 8.673 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.504 -10.081 9.211 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.806 -9.763 7.514 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.099 -10.696 9.220 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.876 -11.862 8.756 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.287 -10.683 6.344 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.863 -10.409 7.059 1.00 0.00 H new ATOM 0 HE ARG A 49 4.940 -13.167 7.365 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.542 -10.840 5.249 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.418 -12.085 4.352 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.068 -14.760 6.209 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.151 -14.295 4.893 1.00 0.00 H new ATOM 745 N VAL A 50 1.871 -7.276 8.037 1.00 0.00 N ATOM 746 CA VAL A 50 1.134 -6.297 7.246 1.00 0.00 C ATOM 747 C VAL A 50 1.597 -4.878 7.557 1.00 0.00 C ATOM 748 O VAL A 50 1.675 -4.032 6.667 1.00 0.00 O ATOM 749 CB VAL A 50 -0.381 -6.397 7.500 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.681 -6.312 8.989 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.122 -5.311 6.736 1.00 0.00 C ATOM 0 H VAL A 50 1.287 -7.865 8.631 1.00 0.00 H new ATOM 0 HA VAL A 50 1.335 -6.521 6.198 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.728 -7.365 7.139 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.757 -6.385 9.148 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.181 -7.130 9.508 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.320 -5.360 9.379 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.192 -5.397 6.927 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.772 -4.332 7.064 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.934 -5.424 5.668 1.00 0.00 H new ATOM 761 N ARG A 51 1.905 -4.626 8.825 1.00 0.00 N ATOM 762 CA ARG A 51 2.361 -3.309 9.253 1.00 0.00 C ATOM 763 C ARG A 51 3.746 -3.004 8.691 1.00 0.00 C ATOM 764 O ARG A 51 4.095 -1.845 8.472 1.00 0.00 O ATOM 765 CB ARG A 51 2.388 -3.227 10.781 1.00 0.00 C ATOM 766 CG ARG A 51 2.042 -1.850 11.323 1.00 0.00 C ATOM 767 CD ARG A 51 2.714 -1.595 12.663 1.00 0.00 C ATOM 768 NE ARG A 51 1.740 -1.362 13.728 1.00 0.00 N ATOM 769 CZ ARG A 51 1.099 -2.338 14.362 1.00 0.00 C ATOM 770 NH1 ARG A 51 1.325 -3.603 14.041 1.00 0.00 N ATOM 771 NH2 ARG A 51 0.228 -2.045 15.319 1.00 0.00 N ATOM 0 H ARG A 51 1.847 -5.316 9.574 1.00 0.00 H new ATOM 0 HA ARG A 51 1.661 -2.567 8.869 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.686 -3.955 11.188 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.380 -3.508 11.134 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.352 -1.088 10.608 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.961 -1.762 11.434 1.00 0.00 H new ATOM 0 HD2 ARG A 51 3.339 -2.449 12.924 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.374 -0.731 12.579 1.00 0.00 H new ATOM 0 HE ARG A 51 1.542 -0.399 13.999 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.993 -3.831 13.305 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.831 -4.349 14.530 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.051 -1.072 15.567 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.265 -2.793 15.807 1.00 0.00 H new ATOM 785 N GLU A 52 4.530 -4.053 8.462 1.00 0.00 N ATOM 786 CA GLU A 52 5.878 -3.896 7.926 1.00 0.00 C ATOM 787 C GLU A 52 5.837 -3.577 6.434 1.00 0.00 C ATOM 788 O GLU A 52 6.508 -2.655 5.968 1.00 0.00 O ATOM 789 CB GLU A 52 6.697 -5.166 8.166 1.00 0.00 C ATOM 790 CG GLU A 52 7.667 -5.054 9.329 1.00 0.00 C ATOM 791 CD GLU A 52 8.585 -3.854 9.210 1.00 0.00 C ATOM 792 OE1 GLU A 52 9.661 -3.989 8.590 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.228 -2.779 9.736 1.00 0.00 O ATOM 0 H GLU A 52 4.256 -5.019 8.639 1.00 0.00 H new ATOM 0 HA GLU A 52 6.353 -3.063 8.444 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.017 -5.997 8.350 1.00 0.00 H new ATOM 0 HB3 GLU A 52 7.255 -5.405 7.260 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.105 -4.986 10.260 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.268 -5.962 9.385 1.00 0.00 H new ATOM 800 N ILE A 53 5.046 -4.344 5.693 1.00 0.00 N ATOM 801 CA ILE A 53 4.918 -4.143 4.255 1.00 0.00 C ATOM 802 C ILE A 53 4.309 -2.780 3.942 1.00 0.00 C ATOM 803 O ILE A 53 4.709 -2.113 2.988 1.00 0.00 O ATOM 804 CB ILE A 53 4.052 -5.241 3.608 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.679 -5.299 4.280 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.750 -6.589 3.700 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.770 -6.364 3.707 1.00 0.00 C ATOM 0 H ILE A 53 4.484 -5.110 6.064 1.00 0.00 H new ATOM 0 HA ILE A 53 5.924 -4.193 3.839 1.00 0.00 H new ATOM 0 HB ILE A 53 3.911 -4.999 2.555 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.813 -5.482 5.346 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.194 -4.328 4.182 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.126 -7.354 3.239 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.707 -6.539 3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.918 -6.841 4.747 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.814 -6.347 4.231 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.606 -6.170 2.647 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.234 -7.343 3.829 1.00 0.00 H new ATOM 819 N THR A 54 3.339 -2.371 4.754 1.00 0.00 N ATOM 820 CA THR A 54 2.674 -1.089 4.566 1.00 0.00 C ATOM 821 C THR A 54 3.577 0.065 4.988 1.00 0.00 C ATOM 822 O THR A 54 3.593 1.117 4.350 1.00 0.00 O ATOM 823 CB THR A 54 1.359 -1.014 5.364 1.00 0.00 C ATOM 824 OG1 THR A 54 0.636 0.169 5.007 1.00 0.00 O ATOM 825 CG2 THR A 54 1.633 -1.016 6.860 1.00 0.00 C ATOM 0 H THR A 54 2.997 -2.911 5.549 1.00 0.00 H new ATOM 0 HA THR A 54 2.450 -1.003 3.503 1.00 0.00 H new ATOM 0 HB THR A 54 0.761 -1.892 5.120 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.200 0.208 5.518 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.689 -0.962 7.403 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.157 -1.932 7.133 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.249 -0.155 7.118 1.00 0.00 H new ATOM 833 N GLU A 55 4.328 -0.140 6.065 1.00 0.00 N ATOM 834 CA GLU A 55 5.233 0.885 6.571 1.00 0.00 C ATOM 835 C GLU A 55 6.392 1.113 5.604 1.00 0.00 C ATOM 836 O GLU A 55 6.725 2.251 5.277 1.00 0.00 O ATOM 837 CB GLU A 55 5.775 0.486 7.945 1.00 0.00 C ATOM 838 CG GLU A 55 4.857 0.867 9.095 1.00 0.00 C ATOM 839 CD GLU A 55 5.403 0.441 10.444 1.00 0.00 C ATOM 840 OE1 GLU A 55 5.838 -0.723 10.566 1.00 0.00 O ATOM 841 OE2 GLU A 55 5.396 1.272 11.376 1.00 0.00 O ATOM 0 H GLU A 55 4.328 -1.006 6.604 1.00 0.00 H new ATOM 0 HA GLU A 55 4.671 1.814 6.665 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.938 -0.592 7.963 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.746 0.958 8.094 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.707 1.947 9.093 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.880 0.409 8.942 1.00 0.00 H new ATOM 848 N ASN A 56 7.001 0.022 5.150 1.00 0.00 N ATOM 849 CA ASN A 56 8.122 0.103 4.221 1.00 0.00 C ATOM 850 C ASN A 56 7.667 0.627 2.863 1.00 0.00 C ATOM 851 O ASN A 56 8.325 1.477 2.261 1.00 0.00 O ATOM 852 CB ASN A 56 8.774 -1.271 4.057 1.00 0.00 C ATOM 853 CG ASN A 56 9.371 -1.788 5.352 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.370 -1.093 6.369 1.00 0.00 O ATOM 855 ND2 ASN A 56 9.884 -3.012 5.321 1.00 0.00 N ATOM 0 H ASN A 56 6.737 -0.928 5.410 1.00 0.00 H new ATOM 0 HA ASN A 56 8.853 0.799 4.632 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.031 -1.981 3.694 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.555 -1.211 3.299 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.299 -3.412 6.162 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.863 -3.552 4.456 1.00 0.00 H new ATOM 862 N LEU A 57 6.537 0.117 2.387 1.00 0.00 N ATOM 863 CA LEU A 57 5.992 0.535 1.099 1.00 0.00 C ATOM 864 C LEU A 57 5.699 2.032 1.091 1.00 0.00 C ATOM 865 O LEU A 57 6.031 2.734 0.137 1.00 0.00 O ATOM 866 CB LEU A 57 4.715 -0.247 0.786 1.00 0.00 C ATOM 867 CG LEU A 57 4.089 0.011 -0.586 1.00 0.00 C ATOM 868 CD1 LEU A 57 5.119 -0.178 -1.687 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.894 -0.904 -0.807 1.00 0.00 C ATOM 0 H LEU A 57 5.980 -0.586 2.873 1.00 0.00 H new ATOM 0 HA LEU A 57 6.737 0.325 0.332 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.935 -1.311 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.974 -0.015 1.551 1.00 0.00 H new ATOM 0 HG LEU A 57 3.741 1.043 -0.617 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.655 0.010 -2.655 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.943 0.520 -1.538 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.499 -1.199 -1.659 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.461 -0.707 -1.788 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.217 -1.944 -0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.146 -0.718 -0.036 1.00 0.00 H new ATOM 881 N MET A 58 5.078 2.514 2.163 1.00 0.00 N ATOM 882 CA MET A 58 4.744 3.928 2.280 1.00 0.00 C ATOM 883 C MET A 58 6.005 4.773 2.430 1.00 0.00 C ATOM 884 O MET A 58 6.093 5.874 1.887 1.00 0.00 O ATOM 885 CB MET A 58 3.817 4.158 3.475 1.00 0.00 C ATOM 886 CG MET A 58 2.394 3.675 3.241 1.00 0.00 C ATOM 887 SD MET A 58 1.541 4.621 1.965 1.00 0.00 S ATOM 888 CE MET A 58 1.496 6.245 2.719 1.00 0.00 C ATOM 0 H MET A 58 4.796 1.946 2.962 1.00 0.00 H new ATOM 0 HA MET A 58 4.230 4.231 1.368 1.00 0.00 H new ATOM 0 HB2 MET A 58 4.227 3.647 4.346 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.797 5.222 3.710 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.414 2.623 2.956 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.834 3.742 4.173 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.767 6.867 2.200 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.213 6.152 3.767 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.481 6.706 2.649 1.00 0.00 H new ATOM 898 N ALA A 59 6.976 4.252 3.173 1.00 0.00 N ATOM 899 CA ALA A 59 8.233 4.959 3.393 1.00 0.00 C ATOM 900 C ALA A 59 9.041 5.056 2.103 1.00 0.00 C ATOM 901 O ALA A 59 9.584 6.112 1.776 1.00 0.00 O ATOM 902 CB ALA A 59 9.045 4.266 4.476 1.00 0.00 C ATOM 0 H ALA A 59 6.917 3.343 3.633 1.00 0.00 H new ATOM 0 HA ALA A 59 8.000 5.972 3.722 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.980 4.804 4.630 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.476 4.254 5.406 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.261 3.243 4.170 1.00 0.00 H new ATOM 908 N THR A 60 9.117 3.948 1.373 1.00 0.00 N ATOM 909 CA THR A 60 9.861 3.908 0.120 1.00 0.00 C ATOM 910 C THR A 60 8.969 4.273 -1.061 1.00 0.00 C ATOM 911 O THR A 60 9.383 4.182 -2.216 1.00 0.00 O ATOM 912 CB THR A 60 10.475 2.516 -0.125 1.00 0.00 C ATOM 913 OG1 THR A 60 11.391 2.572 -1.224 1.00 0.00 O ATOM 914 CG2 THR A 60 9.389 1.491 -0.415 1.00 0.00 C ATOM 0 H THR A 60 8.672 3.066 1.628 1.00 0.00 H new ATOM 0 HA THR A 60 10.663 4.641 0.205 1.00 0.00 H new ATOM 0 HB THR A 60 11.008 2.213 0.776 1.00 0.00 H new ATOM 0 HG1 THR A 60 11.018 3.137 -1.933 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.845 0.516 -0.585 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.709 1.431 0.435 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.833 1.791 -1.303 1.00 0.00 H new ATOM 922 N GLY A 61 7.740 4.687 -0.763 1.00 0.00 N ATOM 923 CA GLY A 61 6.809 5.060 -1.812 1.00 0.00 C ATOM 924 C GLY A 61 6.554 6.554 -1.856 1.00 0.00 C ATOM 925 O GLY A 61 6.101 7.083 -2.872 1.00 0.00 O ATOM 0 H GLY A 61 7.374 4.770 0.185 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.201 4.733 -2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.865 4.538 -1.658 1.00 0.00 H new ATOM 929 N ASP A 62 6.843 7.234 -0.754 1.00 0.00 N ATOM 930 CA ASP A 62 6.642 8.676 -0.670 1.00 0.00 C ATOM 931 C ASP A 62 7.935 9.425 -0.978 1.00 0.00 C ATOM 932 O ASP A 62 8.865 9.437 -0.170 1.00 0.00 O ATOM 933 CB ASP A 62 6.133 9.062 0.720 1.00 0.00 C ATOM 934 CG ASP A 62 4.636 9.304 0.742 1.00 0.00 C ATOM 935 OD1 ASP A 62 4.206 10.402 0.330 1.00 0.00 O ATOM 936 OD2 ASP A 62 3.896 8.395 1.170 1.00 0.00 O ATOM 0 H ASP A 62 7.218 6.810 0.095 1.00 0.00 H new ATOM 0 HA ASP A 62 5.895 8.957 -1.413 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.381 8.270 1.427 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.649 9.962 1.056 1.00 0.00 H new ATOM 941 N LEU A 63 7.988 10.047 -2.151 1.00 0.00 N ATOM 942 CA LEU A 63 9.169 10.797 -2.566 1.00 0.00 C ATOM 943 C LEU A 63 9.241 12.140 -1.848 1.00 0.00 C ATOM 944 O LEU A 63 10.207 12.426 -1.140 1.00 0.00 O ATOM 945 CB LEU A 63 9.151 11.015 -4.079 1.00 0.00 C ATOM 946 CG LEU A 63 8.635 9.848 -4.921 1.00 0.00 C ATOM 947 CD1 LEU A 63 8.800 10.143 -6.403 1.00 0.00 C ATOM 948 CD2 LEU A 63 9.356 8.561 -4.547 1.00 0.00 C ATOM 0 H LEU A 63 7.228 10.047 -2.831 1.00 0.00 H new ATOM 0 HA LEU A 63 10.052 10.216 -2.299 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.537 11.890 -4.292 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.165 11.250 -4.404 1.00 0.00 H new ATOM 0 HG LEU A 63 7.572 9.719 -4.715 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.427 9.301 -6.985 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.237 11.040 -6.660 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.855 10.300 -6.627 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.976 7.741 -5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.425 8.679 -4.723 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.184 8.340 -3.494 1.00 0.00 H new ATOM 960 N ASP A 64 8.212 12.960 -2.032 1.00 0.00 N ATOM 961 CA ASP A 64 8.157 14.273 -1.399 1.00 0.00 C ATOM 962 C ASP A 64 7.934 14.142 0.105 1.00 0.00 C ATOM 963 O ASP A 64 8.185 15.078 0.862 1.00 0.00 O ATOM 964 CB ASP A 64 7.043 15.116 -2.022 1.00 0.00 C ATOM 965 CG ASP A 64 6.947 14.931 -3.523 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.622 15.681 -4.258 1.00 0.00 O ATOM 967 OD2 ASP A 64 6.196 14.035 -3.963 1.00 0.00 O ATOM 0 H ASP A 64 7.404 12.739 -2.614 1.00 0.00 H new ATOM 0 HA ASP A 64 9.113 14.770 -1.564 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.090 14.849 -1.564 1.00 0.00 H new ATOM 0 HB3 ASP A 64 7.220 16.168 -1.799 1.00 0.00 H new ATOM 972 N GLN A 65 7.459 12.974 0.527 1.00 0.00 N ATOM 973 CA GLN A 65 7.200 12.723 1.940 1.00 0.00 C ATOM 974 C GLN A 65 6.107 13.649 2.466 1.00 0.00 C ATOM 975 O GLN A 65 6.297 14.343 3.465 1.00 0.00 O ATOM 976 CB GLN A 65 8.480 12.909 2.756 1.00 0.00 C ATOM 977 CG GLN A 65 9.699 12.249 2.134 1.00 0.00 C ATOM 978 CD GLN A 65 10.978 12.555 2.890 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.401 11.787 3.753 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.600 13.683 2.567 1.00 0.00 N ATOM 0 H GLN A 65 7.246 12.188 -0.088 1.00 0.00 H new ATOM 0 HA GLN A 65 6.859 11.693 2.044 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.675 13.975 2.873 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.327 12.501 3.755 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.548 11.170 2.105 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.802 12.584 1.102 1.00 0.00 H new ATOM 0 HE21 GLN A 65 11.213 14.290 1.845 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.465 13.942 3.041 1.00 0.00 H new ATOM 989 N ASP A 66 4.965 13.653 1.788 1.00 0.00 N ATOM 990 CA ASP A 66 3.841 14.492 2.189 1.00 0.00 C ATOM 991 C ASP A 66 2.801 13.680 2.953 1.00 0.00 C ATOM 992 O ASP A 66 1.888 14.237 3.561 1.00 0.00 O ATOM 993 CB ASP A 66 3.199 15.140 0.961 1.00 0.00 C ATOM 994 CG ASP A 66 4.221 15.539 -0.084 1.00 0.00 C ATOM 995 OD1 ASP A 66 5.342 15.935 0.301 1.00 0.00 O ATOM 996 OD2 ASP A 66 3.902 15.455 -1.289 1.00 0.00 O ATOM 0 H ASP A 66 4.793 13.085 0.958 1.00 0.00 H new ATOM 0 HA ASP A 66 4.220 15.274 2.848 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.484 14.446 0.519 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.637 16.021 1.271 1.00 0.00 H new ATOM 1001 N GLY A 67 2.945 12.359 2.918 1.00 0.00 N ATOM 1002 CA GLY A 67 2.011 11.491 3.610 1.00 0.00 C ATOM 1003 C GLY A 67 1.049 10.802 2.662 1.00 0.00 C ATOM 1004 O GLY A 67 0.145 10.087 3.096 1.00 0.00 O ATOM 0 H GLY A 67 3.693 11.874 2.422 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.566 10.738 4.170 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.445 12.076 4.335 1.00 0.00 H new ATOM 1008 N ARG A 68 1.243 11.015 1.365 1.00 0.00 N ATOM 1009 CA ARG A 68 0.383 10.411 0.354 1.00 0.00 C ATOM 1010 C ARG A 68 1.184 10.045 -0.892 1.00 0.00 C ATOM 1011 O ARG A 68 2.114 10.757 -1.275 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.751 11.367 -0.019 1.00 0.00 C ATOM 1013 CG ARG A 68 -0.295 12.800 -0.234 1.00 0.00 C ATOM 1014 CD ARG A 68 -0.750 13.707 0.900 1.00 0.00 C ATOM 1015 NE ARG A 68 -0.137 15.030 0.822 1.00 0.00 N ATOM 1016 CZ ARG A 68 -0.455 16.036 1.630 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -1.375 15.869 2.570 1.00 0.00 N ATOM 1018 NH2 ARG A 68 0.148 17.210 1.498 1.00 0.00 N ATOM 0 H ARG A 68 1.988 11.601 0.989 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.043 9.499 0.773 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.233 11.008 -0.928 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.504 11.349 0.769 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.792 12.829 -0.311 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.691 13.171 -1.179 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.835 13.808 0.870 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.499 13.247 1.856 1.00 0.00 H new ATOM 0 HE ARG A 68 0.574 15.191 0.109 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -1.840 14.967 2.674 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -1.618 16.642 3.189 1.00 0.00 H new ATOM 0 HH21 ARG A 68 0.856 17.341 0.776 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -0.097 17.982 2.119 1.00 0.00 H new ATOM 1032 N ILE A 69 0.818 8.933 -1.519 1.00 0.00 N ATOM 1033 CA ILE A 69 1.502 8.473 -2.721 1.00 0.00 C ATOM 1034 C ILE A 69 0.666 8.744 -3.967 1.00 0.00 C ATOM 1035 O ILE A 69 -0.534 8.469 -3.994 1.00 0.00 O ATOM 1036 CB ILE A 69 1.821 6.968 -2.648 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.429 6.620 -1.287 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.763 6.571 -3.773 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.805 5.161 -1.150 1.00 0.00 C ATOM 0 H ILE A 69 0.051 8.333 -1.215 1.00 0.00 H new ATOM 0 HA ILE A 69 2.436 9.031 -2.784 1.00 0.00 H new ATOM 0 HB ILE A 69 0.893 6.408 -2.764 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.316 7.232 -1.127 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.717 6.879 -0.503 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.979 5.505 -3.708 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.295 6.788 -4.733 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.692 7.135 -3.686 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.229 4.986 -0.161 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.917 4.543 -1.278 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.540 4.902 -1.912 1.00 0.00 H new ATOM 1051 N SER A 70 1.307 9.284 -4.998 1.00 0.00 N ATOM 1052 CA SER A 70 0.622 9.594 -6.248 1.00 0.00 C ATOM 1053 C SER A 70 0.805 8.469 -7.262 1.00 0.00 C ATOM 1054 O SER A 70 1.645 7.587 -7.082 1.00 0.00 O ATOM 1055 CB SER A 70 1.147 10.909 -6.828 1.00 0.00 C ATOM 1056 OG SER A 70 2.203 10.677 -7.743 1.00 0.00 O ATOM 0 H SER A 70 2.300 9.516 -4.993 1.00 0.00 H new ATOM 0 HA SER A 70 -0.442 9.697 -6.035 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.337 11.438 -7.330 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.496 11.553 -6.021 1.00 0.00 H new ATOM 0 HG SER A 70 2.520 11.533 -8.101 1.00 0.00 H new ATOM 1062 N PHE A 71 0.012 8.506 -8.327 1.00 0.00 N ATOM 1063 CA PHE A 71 0.084 7.489 -9.370 1.00 0.00 C ATOM 1064 C PHE A 71 1.521 7.301 -9.847 1.00 0.00 C ATOM 1065 O PHE A 71 2.041 6.185 -9.862 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.810 7.874 -10.549 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.245 7.463 -10.373 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.847 7.520 -9.127 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.991 7.020 -11.454 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.166 7.143 -8.961 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.310 6.642 -11.294 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.899 6.702 -10.046 1.00 0.00 C ATOM 0 H PHE A 71 -0.688 9.229 -8.491 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.267 6.547 -8.949 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.765 8.954 -10.692 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.418 7.416 -11.457 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.279 7.863 -8.275 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.536 6.970 -12.432 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.624 7.193 -7.984 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.881 6.300 -12.145 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.930 6.405 -9.919 1.00 0.00 H new ATOM 1082 N ASP A 72 2.157 8.401 -10.237 1.00 0.00 N ATOM 1083 CA ASP A 72 3.534 8.359 -10.715 1.00 0.00 C ATOM 1084 C ASP A 72 4.459 7.774 -9.654 1.00 0.00 C ATOM 1085 O ASP A 72 5.352 6.984 -9.962 1.00 0.00 O ATOM 1086 CB ASP A 72 4.005 9.762 -11.103 1.00 0.00 C ATOM 1087 CG ASP A 72 5.196 9.734 -12.042 1.00 0.00 C ATOM 1088 OD1 ASP A 72 5.501 8.649 -12.581 1.00 0.00 O ATOM 1089 OD2 ASP A 72 5.821 10.797 -12.237 1.00 0.00 O ATOM 0 H ASP A 72 1.741 9.332 -10.231 1.00 0.00 H new ATOM 0 HA ASP A 72 3.568 7.717 -11.595 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.184 10.299 -11.578 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.269 10.316 -10.202 1.00 0.00 H new ATOM 1094 N GLU A 73 4.242 8.168 -8.403 1.00 0.00 N ATOM 1095 CA GLU A 73 5.059 7.683 -7.297 1.00 0.00 C ATOM 1096 C GLU A 73 5.021 6.160 -7.219 1.00 0.00 C ATOM 1097 O GLU A 73 6.048 5.494 -7.358 1.00 0.00 O ATOM 1098 CB GLU A 73 4.576 8.284 -5.975 1.00 0.00 C ATOM 1099 CG GLU A 73 4.859 9.772 -5.844 1.00 0.00 C ATOM 1100 CD GLU A 73 4.605 10.293 -4.443 1.00 0.00 C ATOM 1101 OE1 GLU A 73 5.508 10.165 -3.590 1.00 0.00 O ATOM 1102 OE2 GLU A 73 3.503 10.827 -4.198 1.00 0.00 O ATOM 0 H GLU A 73 3.508 8.821 -8.130 1.00 0.00 H new ATOM 0 HA GLU A 73 6.088 7.995 -7.476 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.503 8.117 -5.880 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.055 7.757 -5.150 1.00 0.00 H new ATOM 0 HG2 GLU A 73 5.896 9.966 -6.117 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.235 10.320 -6.550 1.00 0.00 H new ATOM 1109 N PHE A 74 3.830 5.614 -6.995 1.00 0.00 N ATOM 1110 CA PHE A 74 3.657 4.169 -6.897 1.00 0.00 C ATOM 1111 C PHE A 74 4.230 3.468 -8.126 1.00 0.00 C ATOM 1112 O PHE A 74 5.102 2.607 -8.012 1.00 0.00 O ATOM 1113 CB PHE A 74 2.175 3.821 -6.742 1.00 0.00 C ATOM 1114 CG PHE A 74 1.845 3.179 -5.424 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.831 3.685 -4.626 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.549 2.071 -4.984 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.525 3.097 -3.414 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.247 1.477 -3.773 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.234 1.992 -2.986 1.00 0.00 C ATOM 0 H PHE A 74 2.970 6.150 -6.878 1.00 0.00 H new ATOM 0 HA PHE A 74 4.199 3.822 -6.017 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.583 4.729 -6.853 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.881 3.149 -7.548 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.273 4.549 -4.956 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.343 1.666 -5.594 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.268 3.501 -2.802 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.802 0.612 -3.442 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.998 1.531 -2.038 1.00 0.00 H new ATOM 1129 N ILE A 75 3.732 3.844 -9.299 1.00 0.00 N ATOM 1130 CA ILE A 75 4.194 3.252 -10.549 1.00 0.00 C ATOM 1131 C ILE A 75 5.714 3.316 -10.659 1.00 0.00 C ATOM 1132 O ILE A 75 6.355 2.368 -11.111 1.00 0.00 O ATOM 1133 CB ILE A 75 3.572 3.958 -11.769 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.046 3.943 -11.671 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.032 3.291 -13.057 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.376 5.004 -12.515 1.00 0.00 C ATOM 0 H ILE A 75 3.009 4.555 -9.410 1.00 0.00 H new ATOM 0 HA ILE A 75 3.876 2.209 -10.541 1.00 0.00 H new ATOM 0 HB ILE A 75 3.906 4.995 -11.780 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.680 2.963 -11.976 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.755 4.082 -10.630 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.585 3.800 -13.910 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.118 3.348 -13.129 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.723 2.246 -13.056 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.295 4.934 -12.396 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.713 5.990 -12.195 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.637 4.854 -13.563 1.00 0.00 H new ATOM 1148 N LYS A 76 6.285 4.440 -10.240 1.00 0.00 N ATOM 1149 CA LYS A 76 7.730 4.629 -10.287 1.00 0.00 C ATOM 1150 C LYS A 76 8.443 3.584 -9.434 1.00 0.00 C ATOM 1151 O LYS A 76 9.437 2.995 -9.860 1.00 0.00 O ATOM 1152 CB LYS A 76 8.098 6.034 -9.805 1.00 0.00 C ATOM 1153 CG LYS A 76 8.114 7.072 -10.914 1.00 0.00 C ATOM 1154 CD LYS A 76 8.148 8.484 -10.354 1.00 0.00 C ATOM 1155 CE LYS A 76 9.515 8.822 -9.777 1.00 0.00 C ATOM 1156 NZ LYS A 76 10.539 8.995 -10.844 1.00 0.00 N ATOM 0 H LYS A 76 5.768 5.235 -9.864 1.00 0.00 H new ATOM 0 HA LYS A 76 8.053 4.511 -11.321 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.387 6.344 -9.039 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.081 6.002 -9.334 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.983 6.911 -11.552 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.231 6.949 -11.541 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.898 9.195 -11.142 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.389 8.588 -9.579 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.445 9.737 -9.189 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.829 8.030 -9.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 11.391 9.434 -10.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.785 8.067 -11.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.158 9.605 -11.595 1.00 0.00 H new ATOM 1170 N ILE A 77 7.928 3.359 -8.230 1.00 0.00 N ATOM 1171 CA ILE A 77 8.515 2.383 -7.319 1.00 0.00 C ATOM 1172 C ILE A 77 8.403 0.970 -7.881 1.00 0.00 C ATOM 1173 O ILE A 77 9.275 0.130 -7.655 1.00 0.00 O ATOM 1174 CB ILE A 77 7.841 2.428 -5.935 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.495 3.498 -5.059 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.918 1.066 -5.264 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.180 4.912 -5.495 1.00 0.00 C ATOM 0 H ILE A 77 7.106 3.839 -7.863 1.00 0.00 H new ATOM 0 HA ILE A 77 9.567 2.646 -7.210 1.00 0.00 H new ATOM 0 HB ILE A 77 6.790 2.687 -6.067 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.167 3.363 -4.028 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.576 3.355 -5.071 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.437 1.114 -4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.409 0.326 -5.882 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.962 0.780 -5.141 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.677 5.617 -4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.533 5.066 -6.515 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.103 5.073 -5.456 1.00 0.00 H new ATOM 1189 N PHE A 78 7.325 0.715 -8.616 1.00 0.00 N ATOM 1190 CA PHE A 78 7.100 -0.596 -9.211 1.00 0.00 C ATOM 1191 C PHE A 78 8.082 -0.853 -10.350 1.00 0.00 C ATOM 1192 O PHE A 78 8.583 -1.966 -10.515 1.00 0.00 O ATOM 1193 CB PHE A 78 5.664 -0.705 -9.727 1.00 0.00 C ATOM 1194 CG PHE A 78 4.723 -1.349 -8.750 1.00 0.00 C ATOM 1195 CD1 PHE A 78 3.867 -2.362 -9.155 1.00 0.00 C ATOM 1196 CD2 PHE A 78 4.692 -0.943 -7.425 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.000 -2.957 -8.258 1.00 0.00 C ATOM 1198 CE2 PHE A 78 3.828 -1.534 -6.524 1.00 0.00 C ATOM 1199 CZ PHE A 78 2.981 -2.543 -6.941 1.00 0.00 C ATOM 0 H PHE A 78 6.595 1.399 -8.813 1.00 0.00 H new ATOM 0 HA PHE A 78 7.261 -1.349 -8.440 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.297 0.292 -9.969 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.662 -1.279 -10.653 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.878 -2.690 -10.184 1.00 0.00 H new ATOM 0 HD2 PHE A 78 5.352 -0.155 -7.093 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.338 -3.745 -8.587 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.814 -1.208 -5.495 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.305 -3.007 -6.238 1.00 0.00 H new ATOM 1209 N HIS A 79 8.353 0.185 -11.135 1.00 0.00 N ATOM 1210 CA HIS A 79 9.276 0.073 -12.259 1.00 0.00 C ATOM 1211 C HIS A 79 10.715 0.299 -11.805 1.00 0.00 C ATOM 1212 O HIS A 79 11.660 -0.016 -12.528 1.00 0.00 O ATOM 1213 CB HIS A 79 8.908 1.081 -13.350 1.00 0.00 C ATOM 1214 CG HIS A 79 8.067 0.500 -14.444 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.562 0.194 -15.694 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.755 0.166 -14.469 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.591 -0.300 -16.441 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.485 -0.328 -15.720 1.00 0.00 N ATOM 0 H HIS A 79 7.947 1.113 -11.014 1.00 0.00 H new ATOM 0 HA HIS A 79 9.196 -0.936 -12.664 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.373 1.916 -12.896 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.823 1.486 -13.783 1.00 0.00 H new ATOM 0 HD1 HIS A 79 9.527 0.328 -15.995 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.052 0.269 -13.656 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.686 -0.625 -17.466 1.00 0.00 H new ATOM 1226 N GLY A 80 10.873 0.847 -10.605 1.00 0.00 N ATOM 1227 CA GLY A 80 12.200 1.106 -10.077 1.00 0.00 C ATOM 1228 C GLY A 80 12.733 -0.052 -9.257 1.00 0.00 C ATOM 1229 O GLY A 80 13.475 -0.894 -9.767 1.00 0.00 O ATOM 0 H GLY A 80 10.106 1.116 -9.989 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.883 1.308 -10.902 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.173 2.003 -9.459 1.00 0.00 H new ATOM 1233 N LEU A 81 12.359 -0.096 -7.983 1.00 0.00 N ATOM 1234 CA LEU A 81 12.805 -1.159 -7.091 1.00 0.00 C ATOM 1235 C LEU A 81 12.489 -2.532 -7.676 1.00 0.00 C ATOM 1236 O LEU A 81 11.383 -2.772 -8.161 1.00 0.00 O ATOM 1237 CB LEU A 81 12.144 -1.013 -5.719 1.00 0.00 C ATOM 1238 CG LEU A 81 12.239 0.370 -5.073 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.401 0.426 -3.805 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.689 0.720 -4.771 1.00 0.00 C ATOM 0 H LEU A 81 11.748 0.593 -7.545 1.00 0.00 H new ATOM 0 HA LEU A 81 13.886 -1.073 -6.978 1.00 0.00 H new ATOM 0 HB2 LEU A 81 11.090 -1.276 -5.815 1.00 0.00 H new ATOM 0 HB3 LEU A 81 12.593 -1.740 -5.042 1.00 0.00 H new ATOM 0 HG LEU A 81 11.847 1.105 -5.776 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.481 1.418 -3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.359 0.221 -4.048 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.762 -0.320 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.737 1.707 -4.312 1.00 0.00 H new ATOM 0 HD22 LEU A 81 14.107 -0.019 -4.087 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.263 0.723 -5.697 1.00 0.00 H new ATOM 1252 N LYS A 82 13.467 -3.430 -7.626 1.00 0.00 N ATOM 1253 CA LYS A 82 13.293 -4.780 -8.149 1.00 0.00 C ATOM 1254 C LYS A 82 12.093 -5.464 -7.500 1.00 0.00 C ATOM 1255 O LYS A 82 11.436 -4.891 -6.631 1.00 0.00 O ATOM 1256 CB LYS A 82 14.557 -5.608 -7.909 1.00 0.00 C ATOM 1257 CG LYS A 82 15.634 -5.392 -8.958 1.00 0.00 C ATOM 1258 CD LYS A 82 17.023 -5.634 -8.390 1.00 0.00 C ATOM 1259 CE LYS A 82 18.091 -4.933 -9.214 1.00 0.00 C ATOM 1260 NZ LYS A 82 18.612 -5.805 -10.303 1.00 0.00 N ATOM 0 H LYS A 82 14.388 -3.247 -7.229 1.00 0.00 H new ATOM 0 HA LYS A 82 13.112 -4.708 -9.221 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.962 -5.361 -6.928 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.290 -6.665 -7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 82 15.463 -6.062 -9.800 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.570 -4.374 -9.343 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.064 -5.278 -7.361 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.226 -6.705 -8.365 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.677 -4.021 -9.645 1.00 0.00 H new ATOM 0 HE3 LYS A 82 18.913 -4.633 -8.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.338 -5.291 -10.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.030 -6.663 -9.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.832 -6.070 -10.938 1.00 0.00 H new ATOM 1274 N SER A 83 11.816 -6.691 -7.928 1.00 0.00 N ATOM 1275 CA SER A 83 10.695 -7.452 -7.389 1.00 0.00 C ATOM 1276 C SER A 83 10.743 -7.487 -5.865 1.00 0.00 C ATOM 1277 O SER A 83 11.527 -8.228 -5.273 1.00 0.00 O ATOM 1278 CB SER A 83 10.705 -8.878 -7.943 1.00 0.00 C ATOM 1279 OG SER A 83 10.797 -8.875 -9.357 1.00 0.00 O ATOM 0 H SER A 83 12.352 -7.179 -8.646 1.00 0.00 H new ATOM 0 HA SER A 83 9.773 -6.957 -7.695 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.546 -9.429 -7.522 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.797 -9.397 -7.636 1.00 0.00 H new ATOM 0 HG SER A 83 10.803 -9.798 -9.686 1.00 0.00 H new ATOM 1285 N THR A 84 9.896 -6.679 -5.234 1.00 0.00 N ATOM 1286 CA THR A 84 9.842 -6.615 -3.778 1.00 0.00 C ATOM 1287 C THR A 84 8.587 -7.295 -3.244 1.00 0.00 C ATOM 1288 O THR A 84 7.697 -7.665 -4.010 1.00 0.00 O ATOM 1289 CB THR A 84 9.875 -5.157 -3.278 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.508 -4.320 -4.253 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.618 -5.056 -1.955 1.00 0.00 C ATOM 0 H THR A 84 9.238 -6.060 -5.708 1.00 0.00 H new ATOM 0 HA THR A 84 10.722 -7.139 -3.406 1.00 0.00 H new ATOM 0 HB THR A 84 8.848 -4.824 -3.126 1.00 0.00 H new ATOM 0 HG1 THR A 84 11.039 -4.873 -4.863 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.628 -4.018 -1.622 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.117 -5.672 -1.208 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.642 -5.406 -2.085 1.00 0.00 H new ATOM 1299 N ASP A 85 8.522 -7.457 -1.927 1.00 0.00 N ATOM 1300 CA ASP A 85 7.374 -8.091 -1.291 1.00 0.00 C ATOM 1301 C ASP A 85 6.172 -7.153 -1.280 1.00 0.00 C ATOM 1302 O ASP A 85 5.053 -7.556 -1.604 1.00 0.00 O ATOM 1303 CB ASP A 85 7.724 -8.509 0.139 1.00 0.00 C ATOM 1304 CG ASP A 85 9.142 -9.028 0.260 1.00 0.00 C ATOM 1305 OD1 ASP A 85 10.078 -8.200 0.272 1.00 0.00 O ATOM 1306 OD2 ASP A 85 9.319 -10.261 0.344 1.00 0.00 O ATOM 0 H ASP A 85 9.251 -7.158 -1.279 1.00 0.00 H new ATOM 0 HA ASP A 85 7.114 -8.978 -1.868 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.594 -7.656 0.806 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.029 -9.281 0.469 1.00 0.00 H new ATOM 1311 N VAL A 86 6.408 -5.899 -0.905 1.00 0.00 N ATOM 1312 CA VAL A 86 5.344 -4.905 -0.851 1.00 0.00 C ATOM 1313 C VAL A 86 4.694 -4.721 -2.219 1.00 0.00 C ATOM 1314 O VAL A 86 3.476 -4.573 -2.323 1.00 0.00 O ATOM 1315 CB VAL A 86 5.873 -3.543 -0.361 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.302 -3.631 1.095 1.00 0.00 C ATOM 1317 CG2 VAL A 86 7.024 -3.073 -1.237 1.00 0.00 C ATOM 0 H VAL A 86 7.327 -5.548 -0.634 1.00 0.00 H new ATOM 0 HA VAL A 86 4.601 -5.275 -0.144 1.00 0.00 H new ATOM 0 HB VAL A 86 5.068 -2.811 -0.435 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.673 -2.660 1.424 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.449 -3.921 1.709 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.092 -4.375 1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.386 -2.110 -0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.833 -3.802 -1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.679 -2.970 -2.266 1.00 0.00 H new ATOM 1327 N ALA A 87 5.513 -4.735 -3.264 1.00 0.00 N ATOM 1328 CA ALA A 87 5.017 -4.573 -4.626 1.00 0.00 C ATOM 1329 C ALA A 87 4.102 -5.728 -5.017 1.00 0.00 C ATOM 1330 O ALA A 87 2.953 -5.519 -5.408 1.00 0.00 O ATOM 1331 CB ALA A 87 6.180 -4.466 -5.601 1.00 0.00 C ATOM 0 H ALA A 87 6.523 -4.857 -3.195 1.00 0.00 H new ATOM 0 HA ALA A 87 4.435 -3.652 -4.668 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.796 -4.345 -6.614 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.795 -3.604 -5.341 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.784 -5.372 -5.548 1.00 0.00 H new ATOM 1337 N LYS A 88 4.618 -6.949 -4.911 1.00 0.00 N ATOM 1338 CA LYS A 88 3.846 -8.138 -5.253 1.00 0.00 C ATOM 1339 C LYS A 88 2.561 -8.207 -4.435 1.00 0.00 C ATOM 1340 O LYS A 88 1.471 -8.367 -4.986 1.00 0.00 O ATOM 1341 CB LYS A 88 4.682 -9.397 -5.017 1.00 0.00 C ATOM 1342 CG LYS A 88 3.962 -10.683 -5.386 1.00 0.00 C ATOM 1343 CD LYS A 88 4.518 -11.873 -4.623 1.00 0.00 C ATOM 1344 CE LYS A 88 5.723 -12.476 -5.330 1.00 0.00 C ATOM 1345 NZ LYS A 88 6.943 -11.641 -5.158 1.00 0.00 N ATOM 0 H LYS A 88 5.567 -7.140 -4.591 1.00 0.00 H new ATOM 0 HA LYS A 88 3.580 -8.078 -6.308 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.602 -9.326 -5.597 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.970 -9.440 -3.967 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.898 -10.579 -5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.058 -10.860 -6.457 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.803 -11.561 -3.618 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.742 -12.631 -4.514 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.910 -13.476 -4.940 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.504 -12.584 -6.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.786 -12.250 -5.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.000 -10.947 -5.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.896 -11.142 -4.247 1.00 0.00 H new ATOM 1359 N THR A 89 2.695 -8.082 -3.118 1.00 0.00 N ATOM 1360 CA THR A 89 1.544 -8.129 -2.226 1.00 0.00 C ATOM 1361 C THR A 89 0.507 -7.080 -2.609 1.00 0.00 C ATOM 1362 O THR A 89 -0.695 -7.346 -2.597 1.00 0.00 O ATOM 1363 CB THR A 89 1.962 -7.912 -0.759 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.876 -8.936 -0.352 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.746 -7.917 0.156 1.00 0.00 C ATOM 0 H THR A 89 3.589 -7.947 -2.646 1.00 0.00 H new ATOM 0 HA THR A 89 1.105 -9.122 -2.328 1.00 0.00 H new ATOM 0 HB THR A 89 2.450 -6.940 -0.684 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.777 -8.715 -0.668 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.065 -7.762 1.187 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.067 -7.117 -0.137 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.234 -8.876 0.075 1.00 0.00 H new ATOM 1373 N PHE A 90 0.979 -5.885 -2.949 1.00 0.00 N ATOM 1374 CA PHE A 90 0.092 -4.795 -3.336 1.00 0.00 C ATOM 1375 C PHE A 90 -0.730 -5.171 -4.565 1.00 0.00 C ATOM 1376 O PHE A 90 -1.961 -5.170 -4.526 1.00 0.00 O ATOM 1377 CB PHE A 90 0.900 -3.527 -3.617 1.00 0.00 C ATOM 1378 CG PHE A 90 0.086 -2.418 -4.219 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.112 -2.351 -5.589 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.481 -1.442 -3.415 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -0.862 -1.331 -6.146 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -1.232 -0.421 -3.968 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.422 -0.365 -5.334 1.00 0.00 C ATOM 0 H PHE A 90 1.971 -5.647 -2.964 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.592 -4.606 -2.508 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.345 -3.176 -2.686 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.721 -3.771 -4.291 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.324 -3.104 -6.229 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.335 -1.479 -2.346 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.009 -1.290 -7.215 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.670 0.333 -3.331 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.007 0.433 -5.767 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.040 -5.493 -5.654 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.705 -5.870 -6.895 1.00 0.00 C ATOM 1395 C ARG A 91 -1.743 -6.961 -6.647 1.00 0.00 C ATOM 1396 O ARG A 91 -2.909 -6.818 -7.015 1.00 0.00 O ATOM 1397 CB ARG A 91 0.321 -6.353 -7.922 1.00 0.00 C ATOM 1398 CG ARG A 91 0.249 -5.614 -9.249 1.00 0.00 C ATOM 1399 CD ARG A 91 1.437 -5.949 -10.138 1.00 0.00 C ATOM 1400 NE ARG A 91 1.159 -5.680 -11.547 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.826 -6.242 -12.548 1.00 0.00 C ATOM 1402 NH1 ARG A 91 2.804 -7.102 -12.297 1.00 0.00 N ATOM 1403 NH2 ARG A 91 1.515 -5.946 -13.803 1.00 0.00 N ATOM 0 H ARG A 91 0.979 -5.500 -5.702 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.215 -4.989 -7.286 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.322 -6.238 -7.505 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.171 -7.418 -8.100 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.676 -5.875 -9.763 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.220 -4.540 -9.067 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.302 -5.367 -9.822 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.698 -7.000 -10.014 1.00 0.00 H new ATOM 0 HE ARG A 91 0.411 -5.024 -11.774 1.00 0.00 H new ATOM 0 HH11 ARG A 91 3.045 -7.333 -11.333 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.315 -7.532 -13.068 1.00 0.00 H new ATOM 0 HH21 ARG A 91 0.763 -5.286 -14.000 1.00 0.00 H new ATOM 0 HH22 ARG A 91 2.028 -6.378 -14.571 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.311 -8.050 -6.021 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.201 -9.165 -5.722 1.00 0.00 C ATOM 1419 C LYS A 92 -3.374 -8.709 -4.861 1.00 0.00 C ATOM 1420 O LYS A 92 -4.531 -8.805 -5.269 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.434 -10.280 -5.008 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.984 -11.398 -5.932 1.00 0.00 C ATOM 1423 CD LYS A 92 -1.630 -12.723 -5.560 1.00 0.00 C ATOM 1424 CE LYS A 92 -2.897 -12.970 -6.364 1.00 0.00 C ATOM 1425 NZ LYS A 92 -2.597 -13.363 -7.768 1.00 0.00 N ATOM 0 H LYS A 92 -0.349 -8.184 -5.711 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.592 -9.548 -6.665 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.560 -9.852 -4.518 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.065 -10.700 -4.225 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.238 -11.145 -6.961 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.101 -11.495 -5.886 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.924 -13.535 -5.733 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.866 -12.728 -4.496 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -3.483 -13.754 -5.885 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -3.509 -12.068 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -3.470 -13.685 -8.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.212 -12.545 -8.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.899 -14.134 -7.771 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.068 -8.209 -3.668 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.097 -7.735 -2.751 1.00 0.00 C ATOM 1441 C ALA A 93 -5.065 -6.790 -3.455 1.00 0.00 C ATOM 1442 O ALA A 93 -6.273 -7.031 -3.480 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.460 -7.045 -1.554 1.00 0.00 C ATOM 0 H ALA A 93 -2.115 -8.122 -3.314 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.662 -8.598 -2.400 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.240 -6.696 -0.878 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.813 -7.749 -1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.869 -6.195 -1.896 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.529 -5.715 -4.023 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.347 -4.735 -4.727 1.00 0.00 C ATOM 1451 C ILE A 94 -6.115 -5.383 -5.875 1.00 0.00 C ATOM 1452 O ILE A 94 -7.117 -4.846 -6.344 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.491 -3.583 -5.282 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.180 -2.240 -5.032 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.234 -3.783 -6.769 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.317 -1.249 -4.282 1.00 0.00 C ATOM 0 H ILE A 94 -3.532 -5.501 -4.009 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.054 -4.334 -4.001 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.532 -3.580 -4.764 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.470 -1.806 -5.989 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.097 -2.411 -4.468 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.627 -2.960 -7.147 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.706 -4.724 -6.924 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.184 -3.808 -7.302 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.869 -0.320 -4.140 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.048 -1.663 -3.310 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.411 -1.049 -4.854 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.638 -6.541 -6.319 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.281 -7.264 -7.411 1.00 0.00 C ATOM 1470 C ASN A 95 -7.351 -8.213 -6.880 1.00 0.00 C ATOM 1471 O ASN A 95 -7.817 -9.103 -7.593 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.240 -8.048 -8.212 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.617 -7.219 -9.318 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.138 -6.166 -9.688 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.497 -7.691 -9.853 1.00 0.00 N ATOM 0 H ASN A 95 -4.809 -6.999 -5.940 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.760 -6.535 -8.065 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.457 -8.399 -7.540 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.709 -8.932 -8.644 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.033 -7.177 -10.602 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.101 -8.568 -9.515 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.738 -8.017 -5.624 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.754 -8.852 -4.997 1.00 0.00 C ATOM 1484 C LYS A 96 -8.287 -10.301 -4.903 1.00 0.00 C ATOM 1485 O LYS A 96 -9.087 -11.210 -4.683 1.00 0.00 O ATOM 1486 CB LYS A 96 -10.063 -8.778 -5.786 1.00 0.00 C ATOM 1487 CG LYS A 96 -10.538 -7.359 -6.045 1.00 0.00 C ATOM 1488 CD LYS A 96 -11.795 -7.037 -5.256 1.00 0.00 C ATOM 1489 CE LYS A 96 -13.008 -7.764 -5.817 1.00 0.00 C ATOM 1490 NZ LYS A 96 -13.677 -6.977 -6.891 1.00 0.00 N ATOM 0 H LYS A 96 -7.362 -7.286 -5.020 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.923 -8.477 -3.988 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.931 -9.288 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.837 -9.317 -5.240 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -9.749 -6.656 -5.777 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.733 -7.229 -7.110 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -11.652 -7.317 -4.212 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -11.973 -5.962 -5.276 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.701 -8.732 -6.213 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.718 -7.960 -5.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.499 -7.505 -7.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.993 -6.064 -6.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.007 -6.812 -7.669 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.985 -10.509 -5.070 1.00 0.00 N ATOM 1505 CA LYS A 97 -6.409 -11.847 -5.001 1.00 0.00 C ATOM 1506 C LYS A 97 -6.985 -12.744 -6.092 1.00 0.00 C ATOM 1507 O LYS A 97 -7.246 -13.918 -5.831 1.00 0.00 O ATOM 1508 CB LYS A 97 -6.668 -12.467 -3.627 1.00 0.00 C ATOM 1509 CG LYS A 97 -6.193 -11.604 -2.471 1.00 0.00 C ATOM 1510 CD LYS A 97 -4.693 -11.368 -2.530 1.00 0.00 C ATOM 1511 CE LYS A 97 -3.920 -12.678 -2.486 1.00 0.00 C ATOM 1512 NZ LYS A 97 -4.379 -13.555 -1.373 1.00 0.00 N ATOM 0 H LYS A 97 -6.309 -9.768 -5.254 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.334 -11.760 -5.156 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.737 -12.651 -3.517 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.170 -13.435 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.714 -10.647 -2.493 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.450 -12.085 -1.527 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -4.444 -10.828 -3.444 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.390 -10.737 -1.694 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -4.039 -13.202 -3.434 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -2.857 -12.469 -2.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.578 -14.117 -1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -4.756 -12.968 -0.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -5.124 -14.193 -1.719 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.767 8.161 -1.574 1.00 0.00 CA HETATM 1528 CA CA A 102 4.561 12.516 -1.862 1.00 0.00 CA