USER MOD reduce.3.24.130724 H: found=0, std=0, add=399, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 401 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 171 ASN :FLIP amide:sc=-0.00204 F(o=-3.3,f=-0.27) USER MOD Set 1.2: A 181 MET CE :methyl 178:sc= -0.271 (180deg=-0.249) USER MOD Single : A 135 CYS SG : rot 54:sc= 1.39 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -1.65 K(o=-1.6,f=-2.5!) USER MOD Single : A 175 SER OG : rot -30:sc= 1.08 USER MOD Single : A 178 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0594) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0124) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 1.827 -0.600 0.822 1.00 0.00 N ATOM 2 CA CYS A 135 2.016 -0.223 -0.568 1.00 0.00 C ATOM 3 C CYS A 135 2.017 -1.496 -1.415 1.00 0.00 C ATOM 4 O CYS A 135 2.998 -1.795 -2.093 1.00 0.00 O ATOM 5 CB CYS A 135 3.295 0.594 -0.764 1.00 0.00 C ATOM 6 SG CYS A 135 4.675 -0.174 0.160 1.00 0.00 S ATOM 0 HA CYS A 135 1.198 0.423 -0.886 1.00 0.00 H new ATOM 0 HB2 CYS A 135 3.542 0.649 -1.824 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.140 1.616 -0.419 1.00 0.00 H new ATOM 0 HG CYS A 135 4.792 -1.420 -0.191 1.00 0.00 H new ATOM 12 N TYR A 136 0.905 -2.213 -1.350 1.00 0.00 N ATOM 13 CA TYR A 136 0.764 -3.448 -2.102 1.00 0.00 C ATOM 14 C TYR A 136 -0.695 -3.689 -2.494 1.00 0.00 C ATOM 15 O TYR A 136 -1.570 -2.886 -2.171 1.00 0.00 O ATOM 16 CB TYR A 136 1.219 -4.568 -1.164 1.00 0.00 C ATOM 17 CG TYR A 136 2.438 -4.209 -0.311 1.00 0.00 C ATOM 18 CD1 TYR A 136 3.631 -3.877 -0.919 1.00 0.00 C ATOM 19 CD2 TYR A 136 2.342 -4.216 1.065 1.00 0.00 C ATOM 20 CE1 TYR A 136 4.778 -3.539 -0.116 1.00 0.00 C ATOM 21 CE2 TYR A 136 3.489 -3.878 1.868 1.00 0.00 C ATOM 22 CZ TYR A 136 4.650 -3.557 1.238 1.00 0.00 C ATOM 23 OH TYR A 136 5.733 -3.237 1.996 1.00 0.00 O ATOM 0 H TYR A 136 0.092 -1.962 -0.787 1.00 0.00 H new ATOM 0 HA TYR A 136 1.351 -3.407 -3.020 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.393 -4.834 -0.505 1.00 0.00 H new ATOM 0 HB3 TYR A 136 1.451 -5.453 -1.757 1.00 0.00 H new ATOM 0 HD1 TYR A 136 3.705 -3.871 -1.996 1.00 0.00 H new ATOM 0 HD2 TYR A 136 1.407 -4.475 1.540 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.718 -3.277 -0.578 1.00 0.00 H new ATOM 0 HE2 TYR A 136 3.428 -3.880 2.946 1.00 0.00 H new ATOM 0 HH TYR A 136 5.495 -3.291 2.945 1.00 0.00 H new ATOM 33 N VAL A 137 -0.914 -4.797 -3.185 1.00 0.00 N ATOM 34 CA VAL A 137 -2.252 -5.154 -3.625 1.00 0.00 C ATOM 35 C VAL A 137 -2.419 -6.673 -3.555 1.00 0.00 C ATOM 36 O VAL A 137 -1.480 -7.418 -3.826 1.00 0.00 O ATOM 37 CB VAL A 137 -2.512 -4.588 -5.023 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.554 -3.058 -4.996 1.00 0.00 C ATOM 39 CG2 VAL A 137 -1.467 -5.090 -6.021 1.00 0.00 C ATOM 0 H VAL A 137 -0.187 -5.461 -3.452 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.001 -4.714 -2.966 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.488 -4.944 -5.352 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.740 -2.681 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.352 -2.728 -4.331 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.600 -2.674 -4.636 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -1.675 -4.673 -7.006 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.474 -4.777 -5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -1.506 -6.178 -6.072 1.00 0.00 H new ATOM 49 N ARG A 138 -3.624 -7.087 -3.190 1.00 0.00 N ATOM 50 CA ARG A 138 -3.927 -8.504 -3.081 1.00 0.00 C ATOM 51 C ARG A 138 -4.766 -8.961 -4.276 1.00 0.00 C ATOM 52 O ARG A 138 -5.926 -8.572 -4.409 1.00 0.00 O ATOM 53 CB ARG A 138 -4.687 -8.806 -1.788 1.00 0.00 C ATOM 54 CG ARG A 138 -4.423 -10.238 -1.319 1.00 0.00 C ATOM 55 CD ARG A 138 -5.003 -10.476 0.076 1.00 0.00 C ATOM 56 NE ARG A 138 -4.247 -9.692 1.078 1.00 0.00 N ATOM 57 CZ ARG A 138 -3.277 -10.199 1.851 1.00 0.00 C ATOM 58 NH1 ARG A 138 -2.940 -11.490 1.743 1.00 0.00 N ATOM 59 NH2 ARG A 138 -2.646 -9.413 2.734 1.00 0.00 N ATOM 0 H ARG A 138 -4.402 -6.466 -2.966 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.981 -9.046 -3.069 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -4.384 -8.104 -1.011 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.756 -8.663 -1.948 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -4.864 -10.942 -2.025 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.350 -10.428 -1.307 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -6.054 -10.189 0.096 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -4.957 -11.537 0.322 1.00 0.00 H new ATOM 0 HE ARG A 138 -4.479 -8.705 1.187 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.422 -12.088 1.072 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -2.202 -11.875 2.332 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -2.904 -8.430 2.817 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -1.907 -9.798 3.323 1.00 0.00 H new ATOM 73 N ALA A 139 -4.148 -9.779 -5.114 1.00 0.00 N ATOM 74 CA ALA A 139 -4.823 -10.294 -6.293 1.00 0.00 C ATOM 75 C ALA A 139 -5.732 -11.457 -5.889 1.00 0.00 C ATOM 76 O ALA A 139 -5.251 -12.545 -5.578 1.00 0.00 O ATOM 77 CB ALA A 139 -3.785 -10.703 -7.339 1.00 0.00 C ATOM 0 H ALA A 139 -3.186 -10.098 -5.000 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.451 -9.524 -6.741 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.292 -11.089 -8.223 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.185 -9.836 -7.615 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.137 -11.476 -6.926 1.00 0.00 H new ATOM 83 N LEU A 140 -7.029 -11.187 -5.907 1.00 0.00 N ATOM 84 CA LEU A 140 -8.009 -12.197 -5.546 1.00 0.00 C ATOM 85 C LEU A 140 -8.417 -12.975 -6.798 1.00 0.00 C ATOM 86 O LEU A 140 -9.541 -13.467 -6.890 1.00 0.00 O ATOM 87 CB LEU A 140 -9.187 -11.560 -4.808 1.00 0.00 C ATOM 88 CG LEU A 140 -9.006 -11.358 -3.302 1.00 0.00 C ATOM 89 CD1 LEU A 140 -8.101 -10.158 -3.015 1.00 0.00 C ATOM 90 CD2 LEU A 140 -10.358 -11.236 -2.597 1.00 0.00 C ATOM 0 H LEU A 140 -7.424 -10.283 -6.166 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.577 -12.916 -4.850 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.393 -10.591 -5.262 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -10.069 -12.181 -4.968 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.511 -12.241 -2.897 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -7.989 -10.036 -1.938 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.122 -10.324 -3.465 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.546 -9.257 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -10.199 -11.093 -1.528 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -10.903 -10.382 -3.000 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -10.937 -12.145 -2.760 1.00 0.00 H new ATOM 102 N PHE A 141 -7.481 -13.064 -7.732 1.00 0.00 N ATOM 103 CA PHE A 141 -7.729 -13.775 -8.975 1.00 0.00 C ATOM 104 C PHE A 141 -6.445 -14.416 -9.506 1.00 0.00 C ATOM 105 O PHE A 141 -5.348 -13.918 -9.252 1.00 0.00 O ATOM 106 CB PHE A 141 -8.227 -12.743 -9.988 1.00 0.00 C ATOM 107 CG PHE A 141 -9.708 -12.388 -9.839 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.094 -11.451 -8.932 1.00 0.00 C ATOM 109 CD2 PHE A 141 -10.638 -13.008 -10.612 1.00 0.00 C ATOM 110 CE1 PHE A 141 -11.468 -11.122 -8.792 1.00 0.00 C ATOM 111 CE2 PHE A 141 -12.012 -12.679 -10.472 1.00 0.00 C ATOM 112 CZ PHE A 141 -12.398 -11.742 -9.565 1.00 0.00 C ATOM 0 H PHE A 141 -6.550 -12.656 -7.653 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.458 -14.569 -8.811 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.634 -11.834 -9.886 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -8.055 -13.125 -10.994 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.355 -10.957 -8.318 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.332 -13.751 -11.333 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.774 -10.379 -8.071 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -12.751 -13.173 -11.086 1.00 0.00 H new ATOM 0 HZ PHE A 141 -13.443 -11.491 -9.459 1.00 0.00 H new ATOM 122 N ASP A 142 -6.624 -15.508 -10.234 1.00 0.00 N ATOM 123 CA ASP A 142 -5.492 -16.221 -10.802 1.00 0.00 C ATOM 124 C ASP A 142 -5.247 -15.725 -12.229 1.00 0.00 C ATOM 125 O ASP A 142 -6.183 -15.605 -13.018 1.00 0.00 O ATOM 126 CB ASP A 142 -5.765 -17.725 -10.866 1.00 0.00 C ATOM 127 CG ASP A 142 -7.237 -18.109 -11.037 1.00 0.00 C ATOM 128 OD1 ASP A 142 -8.012 -17.819 -10.100 1.00 0.00 O ATOM 129 OD2 ASP A 142 -7.553 -18.683 -12.102 1.00 0.00 O ATOM 0 H ASP A 142 -7.535 -15.916 -10.444 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.625 -16.038 -10.167 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.196 -18.147 -11.695 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -5.388 -18.186 -9.953 1.00 0.00 H new ATOM 134 N PHE A 143 -3.984 -15.448 -12.516 1.00 0.00 N ATOM 135 CA PHE A 143 -3.603 -14.967 -13.833 1.00 0.00 C ATOM 136 C PHE A 143 -2.105 -15.163 -14.077 1.00 0.00 C ATOM 137 O PHE A 143 -1.312 -14.248 -13.855 1.00 0.00 O ATOM 138 CB PHE A 143 -3.924 -13.472 -13.872 1.00 0.00 C ATOM 139 CG PHE A 143 -4.022 -12.894 -15.287 1.00 0.00 C ATOM 140 CD1 PHE A 143 -4.915 -13.411 -16.171 1.00 0.00 C ATOM 141 CD2 PHE A 143 -3.216 -11.863 -15.657 1.00 0.00 C ATOM 142 CE1 PHE A 143 -5.006 -12.875 -17.483 1.00 0.00 C ATOM 143 CE2 PHE A 143 -3.307 -11.326 -16.968 1.00 0.00 C ATOM 144 CZ PHE A 143 -4.200 -11.843 -17.854 1.00 0.00 C ATOM 0 H PHE A 143 -3.211 -15.548 -11.858 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.143 -15.519 -14.602 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.867 -13.299 -13.354 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -3.154 -12.931 -13.322 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -5.555 -14.229 -15.876 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -2.507 -11.453 -14.953 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -5.715 -13.286 -18.186 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -2.667 -10.507 -17.262 1.00 0.00 H new ATOM 0 HZ PHE A 143 -4.269 -11.435 -18.851 1.00 0.00 H new ATOM 243 N LEU A 151 1.306 -8.284 -15.308 1.00 0.00 N ATOM 244 CA LEU A 151 1.927 -8.998 -14.205 1.00 0.00 C ATOM 245 C LEU A 151 1.015 -10.144 -13.767 1.00 0.00 C ATOM 246 O LEU A 151 -0.101 -9.913 -13.306 1.00 0.00 O ATOM 247 CB LEU A 151 2.286 -8.030 -13.075 1.00 0.00 C ATOM 248 CG LEU A 151 3.468 -8.438 -12.194 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.776 -8.418 -12.987 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.545 -7.563 -10.940 1.00 0.00 C ATOM 0 HA LEU A 151 2.869 -9.445 -14.522 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.504 -7.056 -13.513 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.410 -7.905 -12.439 1.00 0.00 H new ATOM 0 HG LEU A 151 3.308 -9.464 -11.862 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.600 -8.712 -12.337 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.706 -9.115 -13.822 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.955 -7.413 -13.368 1.00 0.00 H new ATOM 0 HD21 LEU A 151 4.394 -7.874 -10.331 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.670 -6.520 -11.231 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.626 -7.671 -10.364 1.00 0.00 H new ATOM 262 N PRO A 152 1.536 -11.390 -13.931 1.00 0.00 N ATOM 263 CA PRO A 152 0.781 -12.573 -13.558 1.00 0.00 C ATOM 264 C PRO A 152 0.752 -12.749 -12.038 1.00 0.00 C ATOM 265 O PRO A 152 1.518 -12.108 -11.322 1.00 0.00 O ATOM 266 CB PRO A 152 1.471 -13.722 -14.276 1.00 0.00 C ATOM 267 CG PRO A 152 2.854 -13.212 -14.646 1.00 0.00 C ATOM 268 CD PRO A 152 2.855 -11.702 -14.475 1.00 0.00 C ATOM 0 HA PRO A 152 -0.268 -12.511 -13.848 1.00 0.00 H new ATOM 0 HB2 PRO A 152 1.538 -14.600 -13.634 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.913 -14.018 -15.164 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.612 -13.669 -14.010 1.00 0.00 H new ATOM 0 HG3 PRO A 152 3.097 -13.480 -15.674 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.648 -11.380 -13.800 1.00 0.00 H new ATOM 0 HD3 PRO A 152 3.021 -11.196 -15.426 1.00 0.00 H new ATOM 276 N PHE A 153 -0.140 -13.620 -11.592 1.00 0.00 N ATOM 277 CA PHE A 153 -0.280 -13.888 -10.171 1.00 0.00 C ATOM 278 C PHE A 153 -1.111 -15.149 -9.930 1.00 0.00 C ATOM 279 O PHE A 153 -1.519 -15.820 -10.878 1.00 0.00 O ATOM 280 CB PHE A 153 -1.005 -12.688 -9.559 1.00 0.00 C ATOM 281 CG PHE A 153 -2.210 -12.209 -10.371 1.00 0.00 C ATOM 282 CD1 PHE A 153 -3.317 -12.993 -10.472 1.00 0.00 C ATOM 283 CD2 PHE A 153 -2.174 -10.999 -10.990 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.435 -12.549 -11.225 1.00 0.00 C ATOM 285 CE2 PHE A 153 -3.293 -10.554 -11.744 1.00 0.00 C ATOM 286 CZ PHE A 153 -4.400 -11.338 -11.845 1.00 0.00 C ATOM 0 H PHE A 153 -0.774 -14.150 -12.190 1.00 0.00 H new ATOM 0 HA PHE A 153 0.702 -14.042 -9.723 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -1.338 -12.951 -8.555 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.299 -11.864 -9.455 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.345 -13.954 -9.979 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.295 -10.376 -10.909 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.313 -13.172 -11.306 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.265 -9.593 -12.237 1.00 0.00 H new ATOM 0 HZ PHE A 153 -5.251 -10.999 -12.417 1.00 0.00 H new ATOM 296 N LYS A 154 -1.338 -15.435 -8.655 1.00 0.00 N ATOM 297 CA LYS A 154 -2.115 -16.604 -8.277 1.00 0.00 C ATOM 298 C LYS A 154 -3.135 -16.209 -7.208 1.00 0.00 C ATOM 299 O LYS A 154 -2.783 -15.581 -6.211 1.00 0.00 O ATOM 300 CB LYS A 154 -1.189 -17.746 -7.852 1.00 0.00 C ATOM 301 CG LYS A 154 -1.826 -18.582 -6.740 1.00 0.00 C ATOM 302 CD LYS A 154 -0.781 -19.462 -6.051 1.00 0.00 C ATOM 303 CE LYS A 154 -0.518 -20.735 -6.857 1.00 0.00 C ATOM 304 NZ LYS A 154 0.865 -21.213 -6.635 1.00 0.00 N ATOM 0 H LYS A 154 -0.998 -14.878 -7.872 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.678 -16.981 -9.131 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -0.971 -18.381 -8.711 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.238 -17.339 -7.507 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -2.293 -17.924 -6.007 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.616 -19.207 -7.157 1.00 0.00 H new ATOM 0 HD2 LYS A 154 0.148 -18.904 -5.932 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -1.125 -19.725 -5.051 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -1.228 -21.510 -6.566 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -0.676 -20.540 -7.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 1.027 -22.078 -7.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 1.538 -20.479 -6.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 1.003 -21.419 -5.625 1.00 0.00 H new ATOM 318 N LYS A 155 -4.379 -16.594 -7.454 1.00 0.00 N ATOM 319 CA LYS A 155 -5.453 -16.287 -6.524 1.00 0.00 C ATOM 320 C LYS A 155 -4.872 -16.104 -5.120 1.00 0.00 C ATOM 321 O LYS A 155 -4.209 -16.998 -4.598 1.00 0.00 O ATOM 322 CB LYS A 155 -6.548 -17.353 -6.601 1.00 0.00 C ATOM 323 CG LYS A 155 -7.662 -17.069 -5.592 1.00 0.00 C ATOM 324 CD LYS A 155 -9.031 -17.437 -6.168 1.00 0.00 C ATOM 325 CE LYS A 155 -9.373 -16.558 -7.372 1.00 0.00 C ATOM 326 NZ LYS A 155 -10.804 -16.699 -7.726 1.00 0.00 N ATOM 0 H LYS A 155 -4.667 -17.115 -8.282 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.933 -15.347 -6.795 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -6.963 -17.381 -7.608 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.118 -18.336 -6.406 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.483 -17.636 -4.679 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.650 -16.014 -5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.034 -18.485 -6.466 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -9.796 -17.322 -5.400 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -9.149 -15.516 -7.144 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -8.752 -16.839 -8.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -11.020 -16.096 -8.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -11.007 -17.691 -7.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -11.392 -16.409 -6.918 1.00 0.00 H new ATOM 340 N GLY A 156 -5.140 -14.938 -4.550 1.00 0.00 N ATOM 341 CA GLY A 156 -4.652 -14.626 -3.219 1.00 0.00 C ATOM 342 C GLY A 156 -3.152 -14.324 -3.242 1.00 0.00 C ATOM 343 O GLY A 156 -2.391 -14.882 -2.452 1.00 0.00 O ATOM 0 H GLY A 156 -5.689 -14.198 -4.987 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.193 -13.768 -2.821 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.848 -15.464 -2.550 1.00 0.00 H new ATOM 347 N ASP A 157 -2.772 -13.444 -4.155 1.00 0.00 N ATOM 348 CA ASP A 157 -1.377 -13.061 -4.291 1.00 0.00 C ATOM 349 C ASP A 157 -1.214 -11.591 -3.898 1.00 0.00 C ATOM 350 O ASP A 157 -2.198 -10.859 -3.801 1.00 0.00 O ATOM 351 CB ASP A 157 -0.901 -13.219 -5.736 1.00 0.00 C ATOM 352 CG ASP A 157 0.574 -12.885 -5.972 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.362 -13.096 -5.026 1.00 0.00 O ATOM 354 OD2 ASP A 157 0.879 -12.424 -7.093 1.00 0.00 O ATOM 0 H ASP A 157 -3.406 -12.984 -4.809 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.786 -13.708 -3.643 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -1.080 -14.247 -6.051 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.510 -12.579 -6.375 1.00 0.00 H new ATOM 359 N ILE A 158 0.034 -11.202 -3.683 1.00 0.00 N ATOM 360 CA ILE A 158 0.337 -9.833 -3.304 1.00 0.00 C ATOM 361 C ILE A 158 1.224 -9.196 -4.376 1.00 0.00 C ATOM 362 O ILE A 158 2.018 -9.881 -5.017 1.00 0.00 O ATOM 363 CB ILE A 158 0.941 -9.788 -1.900 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.152 -9.669 -0.835 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.978 -8.669 -1.784 1.00 0.00 C ATOM 366 CD1 ILE A 158 -0.811 -11.023 -0.572 1.00 0.00 C ATOM 0 H ILE A 158 0.848 -11.812 -3.764 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.576 -9.241 -3.252 1.00 0.00 H new ATOM 0 HB ILE A 158 1.462 -10.729 -1.723 1.00 0.00 H new ATOM 0 HG12 ILE A 158 0.277 -9.284 0.090 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -0.905 -8.951 -1.160 1.00 0.00 H new ATOM 0 HG21 ILE A 158 2.392 -8.659 -0.776 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.779 -8.839 -2.503 1.00 0.00 H new ATOM 0 HG23 ILE A 158 1.503 -7.710 -1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -1.584 -10.910 0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -1.260 -11.394 -1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -0.060 -11.732 -0.223 1.00 0.00 H new ATOM 378 N LEU A 159 1.057 -7.891 -4.537 1.00 0.00 N ATOM 379 CA LEU A 159 1.832 -7.154 -5.520 1.00 0.00 C ATOM 380 C LEU A 159 2.088 -5.736 -5.003 1.00 0.00 C ATOM 381 O LEU A 159 1.197 -5.112 -4.429 1.00 0.00 O ATOM 382 CB LEU A 159 1.143 -7.195 -6.885 1.00 0.00 C ATOM 383 CG LEU A 159 0.560 -8.546 -7.303 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.699 -8.362 -8.151 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.611 -9.401 -8.014 1.00 0.00 C ATOM 0 H LEU A 159 0.397 -7.326 -4.003 1.00 0.00 H new ATOM 0 HA LEU A 159 2.806 -7.622 -5.666 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.339 -6.459 -6.886 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.862 -6.882 -7.642 1.00 0.00 H new ATOM 0 HG LEU A 159 0.264 -9.083 -6.402 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.093 -9.338 -8.434 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.450 -7.821 -7.575 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.453 -7.795 -9.049 1.00 0.00 H new ATOM 0 HD21 LEU A 159 1.170 -10.356 -8.300 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.961 -8.881 -8.906 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.452 -9.576 -7.343 1.00 0.00 H new ATOM 397 N ARG A 160 3.308 -5.271 -5.225 1.00 0.00 N ATOM 398 CA ARG A 160 3.692 -3.940 -4.788 1.00 0.00 C ATOM 399 C ARG A 160 3.344 -2.908 -5.863 1.00 0.00 C ATOM 400 O ARG A 160 4.011 -2.828 -6.893 1.00 0.00 O ATOM 401 CB ARG A 160 5.192 -3.869 -4.490 1.00 0.00 C ATOM 402 CG ARG A 160 5.517 -2.667 -3.601 1.00 0.00 C ATOM 403 CD ARG A 160 6.572 -1.771 -4.255 1.00 0.00 C ATOM 404 NE ARG A 160 7.925 -2.180 -3.817 1.00 0.00 N ATOM 405 CZ ARG A 160 8.856 -1.331 -3.362 1.00 0.00 C ATOM 406 NH1 ARG A 160 8.586 -0.020 -3.283 1.00 0.00 N ATOM 407 NH2 ARG A 160 10.057 -1.791 -2.988 1.00 0.00 N ATOM 0 H ARG A 160 4.044 -5.792 -5.702 1.00 0.00 H new ATOM 0 HA ARG A 160 3.141 -3.719 -3.874 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.513 -4.787 -3.998 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.749 -3.797 -5.424 1.00 0.00 H new ATOM 0 HG2 ARG A 160 4.610 -2.091 -3.416 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.878 -3.013 -2.633 1.00 0.00 H new ATOM 0 HD2 ARG A 160 6.496 -1.838 -5.340 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.393 -0.730 -3.987 1.00 0.00 H new ATOM 0 HE ARG A 160 8.164 -3.171 -3.865 1.00 0.00 H new ATOM 0 HH11 ARG A 160 7.672 0.331 -3.569 1.00 0.00 H new ATOM 0 HH12 ARG A 160 9.295 0.627 -2.937 1.00 0.00 H new ATOM 0 HH21 ARG A 160 10.263 -2.788 -3.050 1.00 0.00 H new ATOM 0 HH22 ARG A 160 10.766 -1.144 -2.642 1.00 0.00 H new ATOM 421 N ILE A 161 2.298 -2.143 -5.585 1.00 0.00 N ATOM 422 CA ILE A 161 1.852 -1.119 -6.516 1.00 0.00 C ATOM 423 C ILE A 161 2.692 0.145 -6.317 1.00 0.00 C ATOM 424 O ILE A 161 2.794 0.658 -5.204 1.00 0.00 O ATOM 425 CB ILE A 161 0.347 -0.885 -6.374 1.00 0.00 C ATOM 426 CG1 ILE A 161 -0.443 -1.841 -7.271 1.00 0.00 C ATOM 427 CG2 ILE A 161 -0.009 0.579 -6.644 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.235 -1.506 -8.749 1.00 0.00 C ATOM 0 H ILE A 161 1.747 -2.211 -4.729 1.00 0.00 H new ATOM 0 HA ILE A 161 2.005 -1.446 -7.544 1.00 0.00 H new ATOM 0 HB ILE A 161 0.064 -1.100 -5.344 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.129 -2.867 -7.080 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.504 -1.781 -7.027 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.085 0.718 -6.536 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.512 1.218 -5.931 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.292 0.846 -7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -0.808 -2.201 -9.364 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.572 -0.488 -8.942 1.00 0.00 H new ATOM 0 HD13 ILE A 161 0.823 -1.591 -8.996 1.00 0.00 H new ATOM 440 N ARG A 162 3.273 0.609 -7.414 1.00 0.00 N ATOM 441 CA ARG A 162 4.101 1.803 -7.374 1.00 0.00 C ATOM 442 C ARG A 162 3.637 2.806 -8.433 1.00 0.00 C ATOM 443 O ARG A 162 3.838 4.010 -8.282 1.00 0.00 O ATOM 444 CB ARG A 162 5.573 1.460 -7.617 1.00 0.00 C ATOM 445 CG ARG A 162 6.472 2.660 -7.312 1.00 0.00 C ATOM 446 CD ARG A 162 7.860 2.203 -6.859 1.00 0.00 C ATOM 447 NE ARG A 162 8.887 3.155 -7.338 1.00 0.00 N ATOM 448 CZ ARG A 162 10.161 3.158 -6.922 1.00 0.00 C ATOM 449 NH1 ARG A 162 10.572 2.260 -6.017 1.00 0.00 N ATOM 450 NH2 ARG A 162 11.023 4.060 -7.411 1.00 0.00 N ATOM 0 H ARG A 162 3.187 0.180 -8.335 1.00 0.00 H new ATOM 0 HA ARG A 162 4.001 2.244 -6.382 1.00 0.00 H new ATOM 0 HB2 ARG A 162 5.862 0.616 -6.991 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.712 1.151 -8.653 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.563 3.286 -8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.015 3.273 -6.535 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.893 2.136 -5.772 1.00 0.00 H new ATOM 0 HD3 ARG A 162 8.068 1.206 -7.246 1.00 0.00 H new ATOM 0 HE ARG A 162 8.608 3.852 -8.028 1.00 0.00 H new ATOM 0 HH11 ARG A 162 9.915 1.574 -5.645 1.00 0.00 H new ATOM 0 HH12 ARG A 162 11.542 2.262 -5.700 1.00 0.00 H new ATOM 0 HH21 ARG A 162 10.709 4.744 -8.100 1.00 0.00 H new ATOM 0 HH22 ARG A 162 11.993 4.063 -7.095 1.00 0.00 H new ATOM 464 N ASP A 163 3.024 2.272 -9.479 1.00 0.00 N ATOM 465 CA ASP A 163 2.530 3.105 -10.561 1.00 0.00 C ATOM 466 C ASP A 163 1.051 2.797 -10.803 1.00 0.00 C ATOM 467 O ASP A 163 0.638 1.639 -10.746 1.00 0.00 O ATOM 468 CB ASP A 163 3.289 2.830 -11.860 1.00 0.00 C ATOM 469 CG ASP A 163 4.668 2.192 -11.680 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.750 1.236 -10.879 1.00 0.00 O ATOM 471 OD2 ASP A 163 5.608 2.675 -12.347 1.00 0.00 O ATOM 0 H ASP A 163 2.858 1.273 -9.600 1.00 0.00 H new ATOM 0 HA ASP A 163 2.672 4.147 -10.275 1.00 0.00 H new ATOM 0 HB2 ASP A 163 2.682 2.177 -12.487 1.00 0.00 H new ATOM 0 HB3 ASP A 163 3.408 3.769 -12.400 1.00 0.00 H new ATOM 476 N LYS A 164 0.294 3.851 -11.068 1.00 0.00 N ATOM 477 CA LYS A 164 -1.130 3.707 -11.318 1.00 0.00 C ATOM 478 C LYS A 164 -1.572 4.753 -12.343 1.00 0.00 C ATOM 479 O LYS A 164 -2.382 5.626 -12.034 1.00 0.00 O ATOM 480 CB LYS A 164 -1.914 3.762 -10.005 1.00 0.00 C ATOM 481 CG LYS A 164 -1.095 3.174 -8.853 1.00 0.00 C ATOM 482 CD LYS A 164 -1.775 3.440 -7.508 1.00 0.00 C ATOM 483 CE LYS A 164 -1.399 4.820 -6.967 1.00 0.00 C ATOM 484 NZ LYS A 164 -1.065 4.739 -5.527 1.00 0.00 N ATOM 0 H LYS A 164 0.640 4.809 -11.115 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.344 2.729 -11.748 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -2.178 4.795 -9.778 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -2.848 3.210 -10.111 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -0.975 2.100 -8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -0.096 3.610 -8.852 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.857 3.373 -7.624 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -1.483 2.673 -6.791 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -0.548 5.215 -7.522 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -2.227 5.513 -7.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -0.812 5.685 -5.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.887 4.382 -4.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -0.261 4.093 -5.393 1.00 0.00 H new ATOM 498 N PRO A 165 -1.006 4.628 -13.574 1.00 0.00 N ATOM 499 CA PRO A 165 -1.333 5.552 -14.645 1.00 0.00 C ATOM 500 C PRO A 165 -2.723 5.260 -15.216 1.00 0.00 C ATOM 501 O PRO A 165 -3.124 5.855 -16.216 1.00 0.00 O ATOM 502 CB PRO A 165 -0.221 5.380 -15.667 1.00 0.00 C ATOM 503 CG PRO A 165 0.430 4.042 -15.353 1.00 0.00 C ATOM 504 CD PRO A 165 -0.043 3.607 -13.975 1.00 0.00 C ATOM 0 HA PRO A 165 -1.387 6.587 -14.306 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -0.618 5.393 -16.682 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.502 6.192 -15.598 1.00 0.00 H new ATOM 0 HG2 PRO A 165 0.157 3.299 -16.103 1.00 0.00 H new ATOM 0 HG3 PRO A 165 1.516 4.131 -15.373 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.503 2.620 -14.008 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.788 3.548 -13.272 1.00 0.00 H new ATOM 512 N GLU A 166 -3.418 4.345 -14.557 1.00 0.00 N ATOM 513 CA GLU A 166 -4.753 3.966 -14.987 1.00 0.00 C ATOM 514 C GLU A 166 -5.693 3.878 -13.783 1.00 0.00 C ATOM 515 O GLU A 166 -5.264 4.045 -12.643 1.00 0.00 O ATOM 516 CB GLU A 166 -4.726 2.647 -15.760 1.00 0.00 C ATOM 517 CG GLU A 166 -3.636 2.661 -16.834 1.00 0.00 C ATOM 518 CD GLU A 166 -4.101 3.420 -18.078 1.00 0.00 C ATOM 519 OE1 GLU A 166 -4.812 2.793 -18.892 1.00 0.00 O ATOM 520 OE2 GLU A 166 -3.735 4.610 -18.186 1.00 0.00 O ATOM 0 H GLU A 166 -3.082 3.855 -13.728 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.129 4.736 -15.661 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.551 1.821 -15.070 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.697 2.474 -16.225 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -2.734 3.126 -16.436 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.374 1.638 -17.105 1.00 0.00 H new ATOM 527 N GLU A 167 -6.958 3.618 -14.079 1.00 0.00 N ATOM 528 CA GLU A 167 -7.963 3.506 -13.034 1.00 0.00 C ATOM 529 C GLU A 167 -8.490 2.072 -12.958 1.00 0.00 C ATOM 530 O GLU A 167 -9.672 1.855 -12.694 1.00 0.00 O ATOM 531 CB GLU A 167 -9.104 4.498 -13.263 1.00 0.00 C ATOM 532 CG GLU A 167 -8.714 5.900 -12.790 1.00 0.00 C ATOM 533 CD GLU A 167 -9.192 6.148 -11.358 1.00 0.00 C ATOM 534 OE1 GLU A 167 -8.994 5.237 -10.527 1.00 0.00 O ATOM 535 OE2 GLU A 167 -9.745 7.246 -11.127 1.00 0.00 O ATOM 0 H GLU A 167 -7.310 3.482 -15.026 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.497 3.753 -12.080 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.360 4.526 -14.322 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -9.994 4.164 -12.729 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -7.632 6.017 -12.841 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.147 6.646 -13.456 1.00 0.00 H new ATOM 542 N GLN A 168 -7.589 1.130 -13.193 1.00 0.00 N ATOM 543 CA GLN A 168 -7.948 -0.278 -13.154 1.00 0.00 C ATOM 544 C GLN A 168 -6.705 -1.149 -13.335 1.00 0.00 C ATOM 545 O GLN A 168 -6.580 -2.198 -12.705 1.00 0.00 O ATOM 546 CB GLN A 168 -9.005 -0.603 -14.212 1.00 0.00 C ATOM 547 CG GLN A 168 -10.417 -0.390 -13.661 1.00 0.00 C ATOM 548 CD GLN A 168 -11.327 -1.569 -14.012 1.00 0.00 C ATOM 549 OE1 GLN A 168 -11.979 -2.157 -13.166 1.00 0.00 O ATOM 550 NE2 GLN A 168 -11.333 -1.881 -15.305 1.00 0.00 N ATOM 0 H GLN A 168 -6.610 1.314 -13.411 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.380 -0.496 -12.177 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -8.854 0.028 -15.088 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.891 -1.636 -14.540 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.374 -0.269 -12.579 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -10.835 0.530 -14.069 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -10.763 -1.347 -15.961 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -11.908 -2.654 -15.640 1.00 0.00 H new ATOM 559 N TRP A 169 -5.815 -0.683 -14.200 1.00 0.00 N ATOM 560 CA TRP A 169 -4.586 -1.407 -14.472 1.00 0.00 C ATOM 561 C TRP A 169 -3.418 -0.566 -13.954 1.00 0.00 C ATOM 562 O TRP A 169 -3.043 0.430 -14.571 1.00 0.00 O ATOM 563 CB TRP A 169 -4.465 -1.744 -15.960 1.00 0.00 C ATOM 564 CG TRP A 169 -5.281 -2.964 -16.389 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.457 -2.987 -17.031 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.931 -4.349 -16.181 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.890 -4.279 -17.250 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.932 -5.134 -16.716 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.806 -4.920 -15.559 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.909 -6.533 -16.686 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.798 -6.319 -15.536 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.798 -7.124 -16.071 1.00 0.00 C ATOM 0 H TRP A 169 -5.922 0.187 -14.721 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.582 -2.367 -13.955 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.785 -0.882 -16.545 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.416 -1.919 -16.198 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -6.998 -2.105 -17.339 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.753 -4.556 -17.717 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -3.011 -4.326 -15.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.705 -7.125 -17.114 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -2.956 -6.808 -15.070 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.718 -8.199 -16.013 1.00 0.00 H new ATOM 583 N TRP A 170 -2.874 -0.998 -12.825 1.00 0.00 N ATOM 584 CA TRP A 170 -1.756 -0.297 -12.217 1.00 0.00 C ATOM 585 C TRP A 170 -0.518 -1.187 -12.339 1.00 0.00 C ATOM 586 O TRP A 170 -0.634 -2.397 -12.530 1.00 0.00 O ATOM 587 CB TRP A 170 -2.074 0.091 -10.771 1.00 0.00 C ATOM 588 CG TRP A 170 -3.361 0.903 -10.613 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.079 1.505 -11.571 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.058 1.178 -9.380 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.184 2.145 -11.047 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.171 1.940 -9.672 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.759 0.794 -8.061 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.072 2.385 -8.699 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.670 1.248 -7.099 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.794 2.015 -7.377 1.00 0.00 C ATOM 0 H TRP A 170 -3.187 -1.825 -12.316 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.561 0.642 -12.734 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.153 -0.816 -10.171 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.241 0.668 -10.369 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -3.825 1.491 -12.621 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -5.882 2.672 -11.572 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -2.895 0.196 -7.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.935 2.982 -8.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.485 0.983 -6.068 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.451 2.325 -6.577 1.00 0.00 H new ATOM 607 N ASN A 171 0.640 -0.555 -12.222 1.00 0.00 N ATOM 608 CA ASN A 171 1.900 -1.274 -12.316 1.00 0.00 C ATOM 609 C ASN A 171 2.403 -1.598 -10.909 1.00 0.00 C ATOM 610 O ASN A 171 2.738 -0.697 -10.142 1.00 0.00 O ATOM 611 CB ASN A 171 2.966 -0.429 -13.017 1.00 0.00 C ATOM 612 CG ASN A 171 3.701 -1.245 -14.081 1.00 0.00 C ATOM 613 OD1 ASN A 171 3.102 -1.253 -15.268 1.00 0.00 O flip ATOM 614 ND2 ASN A 171 4.744 -1.831 -13.840 1.00 0.00 N flip ATOM 0 H ASN A 171 0.733 0.448 -12.063 1.00 0.00 H new ATOM 0 HA ASN A 171 1.727 -2.184 -12.890 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.499 0.441 -13.479 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.680 -0.056 -12.283 1.00 0.00 H new ATOM 0 HD21 ASN A 171 5.151 -1.784 -12.906 1.00 0.00 H new ATOM 0 HD22 ASN A 171 5.208 -2.368 -14.573 1.00 0.00 H new ATOM 621 N ALA A 172 2.440 -2.890 -10.612 1.00 0.00 N ATOM 622 CA ALA A 172 2.897 -3.345 -9.310 1.00 0.00 C ATOM 623 C ALA A 172 3.971 -4.418 -9.498 1.00 0.00 C ATOM 624 O ALA A 172 4.160 -4.926 -10.602 1.00 0.00 O ATOM 625 CB ALA A 172 1.703 -3.850 -8.498 1.00 0.00 C ATOM 0 H ALA A 172 2.161 -3.635 -11.251 1.00 0.00 H new ATOM 0 HA ALA A 172 3.346 -2.524 -8.752 1.00 0.00 H new ATOM 0 HB1 ALA A 172 2.046 -4.191 -7.521 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.983 -3.042 -8.368 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.228 -4.677 -9.025 1.00 0.00 H new ATOM 631 N GLU A 173 4.648 -4.731 -8.402 1.00 0.00 N ATOM 632 CA GLU A 173 5.697 -5.735 -8.432 1.00 0.00 C ATOM 633 C GLU A 173 5.156 -7.085 -7.958 1.00 0.00 C ATOM 634 O GLU A 173 4.155 -7.140 -7.244 1.00 0.00 O ATOM 635 CB GLU A 173 6.897 -5.298 -7.590 1.00 0.00 C ATOM 636 CG GLU A 173 7.825 -4.381 -8.390 1.00 0.00 C ATOM 637 CD GLU A 173 7.407 -2.917 -8.244 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.212 -2.641 -8.483 1.00 0.00 O ATOM 639 OE2 GLU A 173 8.293 -2.107 -7.895 1.00 0.00 O ATOM 0 H GLU A 173 4.490 -4.307 -7.488 1.00 0.00 H new ATOM 0 HA GLU A 173 6.038 -5.845 -9.462 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.549 -4.779 -6.697 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.449 -6.176 -7.254 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.851 -4.506 -8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.805 -4.666 -9.442 1.00 0.00 H new ATOM 646 N ASP A 174 5.841 -8.141 -8.372 1.00 0.00 N ATOM 647 CA ASP A 174 5.440 -9.486 -7.998 1.00 0.00 C ATOM 648 C ASP A 174 6.230 -9.924 -6.762 1.00 0.00 C ATOM 649 O ASP A 174 6.764 -9.087 -6.035 1.00 0.00 O ATOM 650 CB ASP A 174 5.734 -10.480 -9.123 1.00 0.00 C ATOM 651 CG ASP A 174 7.218 -10.685 -9.434 1.00 0.00 C ATOM 652 OD1 ASP A 174 8.024 -9.891 -8.904 1.00 0.00 O ATOM 653 OD2 ASP A 174 7.513 -11.632 -10.195 1.00 0.00 O ATOM 0 H ASP A 174 6.671 -8.092 -8.963 1.00 0.00 H new ATOM 0 HA ASP A 174 4.369 -9.475 -7.796 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.297 -11.443 -8.860 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.232 -10.139 -10.029 1.00 0.00 H new ATOM 658 N SER A 175 6.280 -11.232 -6.564 1.00 0.00 N ATOM 659 CA SER A 175 6.995 -11.791 -5.429 1.00 0.00 C ATOM 660 C SER A 175 8.491 -11.865 -5.739 1.00 0.00 C ATOM 661 O SER A 175 9.248 -12.507 -5.013 1.00 0.00 O ATOM 662 CB SER A 175 6.458 -13.177 -5.068 1.00 0.00 C ATOM 663 OG SER A 175 7.170 -13.757 -3.977 1.00 0.00 O ATOM 0 H SER A 175 5.837 -11.922 -7.171 1.00 0.00 H new ATOM 0 HA SER A 175 6.840 -11.137 -4.571 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.401 -13.101 -4.812 1.00 0.00 H new ATOM 0 HB3 SER A 175 6.530 -13.831 -5.937 1.00 0.00 H new ATOM 0 HG SER A 175 8.097 -13.438 -3.984 1.00 0.00 H new ATOM 669 N GLU A 176 8.874 -11.198 -6.818 1.00 0.00 N ATOM 670 CA GLU A 176 10.266 -11.179 -7.232 1.00 0.00 C ATOM 671 C GLU A 176 10.709 -9.748 -7.543 1.00 0.00 C ATOM 672 O GLU A 176 11.876 -9.508 -7.849 1.00 0.00 O ATOM 673 CB GLU A 176 10.492 -12.098 -8.435 1.00 0.00 C ATOM 674 CG GLU A 176 10.343 -13.567 -8.038 1.00 0.00 C ATOM 675 CD GLU A 176 9.025 -14.145 -8.557 1.00 0.00 C ATOM 676 OE1 GLU A 176 8.614 -13.720 -9.659 1.00 0.00 O ATOM 677 OE2 GLU A 176 8.457 -14.997 -7.841 1.00 0.00 O ATOM 0 H GLU A 176 8.244 -10.666 -7.418 1.00 0.00 H new ATOM 0 HA GLU A 176 10.875 -11.555 -6.410 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.777 -11.856 -9.221 1.00 0.00 H new ATOM 0 HB3 GLU A 176 11.487 -11.928 -8.845 1.00 0.00 H new ATOM 0 HG2 GLU A 176 11.178 -14.142 -8.438 1.00 0.00 H new ATOM 0 HG3 GLU A 176 10.382 -13.660 -6.953 1.00 0.00 H new ATOM 684 N GLY A 177 9.753 -8.835 -7.457 1.00 0.00 N ATOM 685 CA GLY A 177 10.030 -7.434 -7.726 1.00 0.00 C ATOM 686 C GLY A 177 9.647 -7.065 -9.160 1.00 0.00 C ATOM 687 O GLY A 177 9.594 -5.887 -9.509 1.00 0.00 O ATOM 0 H GLY A 177 8.786 -9.038 -7.205 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.476 -6.809 -7.026 1.00 0.00 H new ATOM 0 HA3 GLY A 177 11.089 -7.232 -7.565 1.00 0.00 H new ATOM 691 N LYS A 178 9.389 -8.095 -9.953 1.00 0.00 N ATOM 692 CA LYS A 178 9.013 -7.893 -11.342 1.00 0.00 C ATOM 693 C LYS A 178 7.806 -6.956 -11.408 1.00 0.00 C ATOM 694 O LYS A 178 6.723 -7.297 -10.936 1.00 0.00 O ATOM 695 CB LYS A 178 8.785 -9.238 -12.035 1.00 0.00 C ATOM 696 CG LYS A 178 10.092 -10.027 -12.144 1.00 0.00 C ATOM 697 CD LYS A 178 10.392 -10.392 -13.599 1.00 0.00 C ATOM 698 CE LYS A 178 11.087 -9.235 -14.322 1.00 0.00 C ATOM 699 NZ LYS A 178 10.129 -8.522 -15.197 1.00 0.00 N ATOM 0 H LYS A 178 9.433 -9.071 -9.660 1.00 0.00 H new ATOM 0 HA LYS A 178 9.822 -7.410 -11.890 1.00 0.00 H new ATOM 0 HB2 LYS A 178 8.051 -9.819 -11.477 1.00 0.00 H new ATOM 0 HB3 LYS A 178 8.371 -9.073 -13.030 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.913 -9.436 -11.737 1.00 0.00 H new ATOM 0 HG3 LYS A 178 10.024 -10.935 -11.544 1.00 0.00 H new ATOM 0 HD2 LYS A 178 11.025 -11.279 -13.632 1.00 0.00 H new ATOM 0 HD3 LYS A 178 9.464 -10.643 -14.114 1.00 0.00 H new ATOM 0 HE2 LYS A 178 11.508 -8.543 -13.593 1.00 0.00 H new ATOM 0 HE3 LYS A 178 11.918 -9.616 -14.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 10.638 -7.818 -15.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 9.659 -9.204 -15.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 9.415 -8.042 -14.612 1.00 0.00 H new ATOM 713 N ARG A 179 8.034 -5.792 -11.998 1.00 0.00 N ATOM 714 CA ARG A 179 6.978 -4.801 -12.132 1.00 0.00 C ATOM 715 C ARG A 179 6.200 -5.027 -13.430 1.00 0.00 C ATOM 716 O ARG A 179 6.791 -5.119 -14.505 1.00 0.00 O ATOM 717 CB ARG A 179 7.550 -3.382 -12.129 1.00 0.00 C ATOM 718 CG ARG A 179 8.764 -3.283 -11.204 1.00 0.00 C ATOM 719 CD ARG A 179 9.931 -2.585 -11.904 1.00 0.00 C ATOM 720 NE ARG A 179 9.604 -1.160 -12.134 1.00 0.00 N ATOM 721 CZ ARG A 179 10.494 -0.238 -12.527 1.00 0.00 C ATOM 722 NH1 ARG A 179 11.772 -0.587 -12.734 1.00 0.00 N ATOM 723 NH2 ARG A 179 10.108 1.031 -12.711 1.00 0.00 N ATOM 0 H ARG A 179 8.934 -5.512 -12.389 1.00 0.00 H new ATOM 0 HA ARG A 179 6.309 -4.912 -11.279 1.00 0.00 H new ATOM 0 HB2 ARG A 179 7.836 -3.099 -13.142 1.00 0.00 H new ATOM 0 HB3 ARG A 179 6.784 -2.678 -11.806 1.00 0.00 H new ATOM 0 HG2 ARG A 179 8.495 -2.733 -10.302 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.068 -4.281 -10.890 1.00 0.00 H new ATOM 0 HD2 ARG A 179 10.832 -2.666 -11.296 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.142 -3.076 -12.854 1.00 0.00 H new ATOM 0 HE ARG A 179 8.641 -0.861 -11.984 1.00 0.00 H new ATOM 0 HH11 ARG A 179 12.066 -1.553 -12.592 1.00 0.00 H new ATOM 0 HH12 ARG A 179 12.450 0.114 -13.033 1.00 0.00 H new ATOM 0 HH21 ARG A 179 9.136 1.297 -12.552 1.00 0.00 H new ATOM 0 HH22 ARG A 179 10.786 1.732 -13.010 1.00 0.00 H new ATOM 737 N GLY A 180 4.885 -5.111 -13.288 1.00 0.00 N ATOM 738 CA GLY A 180 4.020 -5.324 -14.436 1.00 0.00 C ATOM 739 C GLY A 180 2.623 -4.756 -14.183 1.00 0.00 C ATOM 740 O GLY A 180 2.397 -4.077 -13.182 1.00 0.00 O ATOM 0 H GLY A 180 4.398 -5.035 -12.395 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.455 -4.851 -15.316 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.950 -6.391 -14.650 1.00 0.00 H new ATOM 744 N MET A 181 1.721 -5.055 -15.106 1.00 0.00 N ATOM 745 CA MET A 181 0.351 -4.583 -14.994 1.00 0.00 C ATOM 746 C MET A 181 -0.493 -5.542 -14.154 1.00 0.00 C ATOM 747 O MET A 181 -0.418 -6.758 -14.329 1.00 0.00 O ATOM 748 CB MET A 181 -0.260 -4.455 -16.392 1.00 0.00 C ATOM 749 CG MET A 181 -1.252 -3.292 -16.451 1.00 0.00 C ATOM 750 SD MET A 181 -0.520 -1.908 -17.309 1.00 0.00 S ATOM 751 CE MET A 181 -0.104 -0.868 -15.920 1.00 0.00 C ATOM 0 H MET A 181 1.912 -5.618 -15.935 1.00 0.00 H new ATOM 0 HA MET A 181 0.360 -3.611 -14.501 1.00 0.00 H new ATOM 0 HB2 MET A 181 0.531 -4.301 -17.126 1.00 0.00 H new ATOM 0 HB3 MET A 181 -0.766 -5.383 -16.658 1.00 0.00 H new ATOM 0 HG2 MET A 181 -2.163 -3.606 -16.961 1.00 0.00 H new ATOM 0 HG3 MET A 181 -1.537 -2.995 -15.442 1.00 0.00 H new ATOM 0 HE1 MET A 181 0.398 0.031 -16.276 1.00 0.00 H new ATOM 0 HE2 MET A 181 -1.014 -0.589 -15.389 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.558 -1.410 -15.245 1.00 0.00 H new ATOM 761 N ILE A 182 -1.279 -4.961 -13.259 1.00 0.00 N ATOM 762 CA ILE A 182 -2.137 -5.749 -12.391 1.00 0.00 C ATOM 763 C ILE A 182 -3.535 -5.127 -12.361 1.00 0.00 C ATOM 764 O ILE A 182 -3.673 -3.908 -12.284 1.00 0.00 O ATOM 765 CB ILE A 182 -1.502 -5.904 -11.008 1.00 0.00 C ATOM 766 CG1 ILE A 182 -0.155 -6.622 -11.099 1.00 0.00 C ATOM 767 CG2 ILE A 182 -2.460 -6.601 -10.040 1.00 0.00 C ATOM 768 CD1 ILE A 182 0.755 -6.234 -9.932 1.00 0.00 C ATOM 0 H ILE A 182 -1.339 -3.953 -13.116 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.247 -6.761 -12.781 1.00 0.00 H new ATOM 0 HB ILE A 182 -1.308 -4.909 -10.608 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.313 -7.700 -11.098 1.00 0.00 H new ATOM 0 HG13 ILE A 182 0.331 -6.372 -12.042 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -1.984 -6.699 -9.064 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -3.371 -6.011 -9.942 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -2.708 -7.591 -10.423 1.00 0.00 H new ATOM 0 HD11 ILE A 182 1.706 -6.759 -10.022 1.00 0.00 H new ATOM 0 HD12 ILE A 182 0.931 -5.159 -9.950 1.00 0.00 H new ATOM 0 HD13 ILE A 182 0.277 -6.508 -8.991 1.00 0.00 H new ATOM 780 N PRO A 183 -4.562 -6.016 -12.426 1.00 0.00 N ATOM 781 CA PRO A 183 -5.942 -5.567 -12.407 1.00 0.00 C ATOM 782 C PRO A 183 -6.360 -5.136 -10.999 1.00 0.00 C ATOM 783 O PRO A 183 -6.289 -5.925 -10.058 1.00 0.00 O ATOM 784 CB PRO A 183 -6.746 -6.747 -12.929 1.00 0.00 C ATOM 785 CG PRO A 183 -5.847 -7.963 -12.783 1.00 0.00 C ATOM 786 CD PRO A 183 -4.434 -7.468 -12.519 1.00 0.00 C ATOM 0 HA PRO A 183 -6.105 -4.684 -13.025 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.668 -6.873 -12.361 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -7.031 -6.595 -13.970 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -6.190 -8.595 -11.964 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.876 -8.570 -13.688 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -4.032 -7.890 -11.598 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.757 -7.755 -13.323 1.00 0.00 H new ATOM 794 N VAL A 184 -6.785 -3.886 -10.900 1.00 0.00 N ATOM 795 CA VAL A 184 -7.213 -3.340 -9.623 1.00 0.00 C ATOM 796 C VAL A 184 -8.527 -4.004 -9.205 1.00 0.00 C ATOM 797 O VAL A 184 -8.806 -4.138 -8.014 1.00 0.00 O ATOM 798 CB VAL A 184 -7.317 -1.816 -9.713 1.00 0.00 C ATOM 799 CG1 VAL A 184 -8.129 -1.251 -8.546 1.00 0.00 C ATOM 800 CG2 VAL A 184 -5.929 -1.175 -9.776 1.00 0.00 C ATOM 0 H VAL A 184 -6.842 -3.235 -11.683 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.477 -3.557 -8.849 1.00 0.00 H new ATOM 0 HB VAL A 184 -7.842 -1.570 -10.636 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.187 -0.166 -8.635 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.135 -1.671 -8.565 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.645 -1.513 -7.605 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.031 -0.092 -9.840 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.367 -1.435 -8.879 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.398 -1.542 -10.655 1.00 0.00 H new ATOM 810 N PRO A 185 -9.317 -4.413 -10.232 1.00 0.00 N ATOM 811 CA PRO A 185 -10.594 -5.061 -9.983 1.00 0.00 C ATOM 812 C PRO A 185 -10.395 -6.504 -9.516 1.00 0.00 C ATOM 813 O PRO A 185 -11.264 -7.072 -8.857 1.00 0.00 O ATOM 814 CB PRO A 185 -11.349 -4.960 -11.298 1.00 0.00 C ATOM 815 CG PRO A 185 -10.300 -4.679 -12.362 1.00 0.00 C ATOM 816 CD PRO A 185 -9.018 -4.271 -11.654 1.00 0.00 C ATOM 0 HA PRO A 185 -11.157 -4.587 -9.179 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.885 -5.885 -11.513 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.091 -4.163 -11.262 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.132 -5.564 -12.976 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.636 -3.886 -13.030 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.184 -4.907 -11.948 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.739 -3.246 -11.899 1.00 0.00 H new ATOM 824 N TYR A 186 -9.246 -7.055 -9.876 1.00 0.00 N ATOM 825 CA TYR A 186 -8.921 -8.422 -9.502 1.00 0.00 C ATOM 826 C TYR A 186 -7.997 -8.452 -8.283 1.00 0.00 C ATOM 827 O TYR A 186 -7.657 -9.523 -7.785 1.00 0.00 O ATOM 828 CB TYR A 186 -8.186 -9.023 -10.701 1.00 0.00 C ATOM 829 CG TYR A 186 -9.107 -9.466 -11.839 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.065 -8.600 -12.328 1.00 0.00 C ATOM 831 CD2 TYR A 186 -8.983 -10.731 -12.376 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.932 -9.016 -13.398 1.00 0.00 C ATOM 833 CE2 TYR A 186 -9.850 -11.147 -13.448 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.782 -10.270 -13.906 1.00 0.00 C ATOM 835 OH TYR A 186 -11.602 -10.662 -14.917 1.00 0.00 O ATOM 0 H TYR A 186 -8.528 -6.580 -10.423 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.824 -8.975 -9.246 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.478 -8.288 -11.085 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.604 -9.881 -10.364 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.163 -7.610 -11.907 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.235 -11.409 -11.992 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.685 -8.348 -13.790 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.762 -12.134 -13.878 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.381 -11.580 -15.181 1.00 0.00 H new ATOM 845 N VAL A 187 -7.616 -7.263 -7.840 1.00 0.00 N ATOM 846 CA VAL A 187 -6.737 -7.140 -6.689 1.00 0.00 C ATOM 847 C VAL A 187 -7.334 -6.133 -5.703 1.00 0.00 C ATOM 848 O VAL A 187 -8.204 -5.344 -6.067 1.00 0.00 O ATOM 849 CB VAL A 187 -5.326 -6.765 -7.146 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.855 -7.680 -8.278 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.258 -5.295 -7.566 1.00 0.00 C ATOM 0 H VAL A 187 -7.900 -6.376 -8.257 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.653 -8.094 -6.169 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.652 -6.904 -6.300 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.849 -7.392 -8.584 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.847 -8.713 -7.931 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.533 -7.588 -9.126 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.244 -5.055 -7.886 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.950 -5.120 -8.390 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.531 -4.662 -6.722 1.00 0.00 H new ATOM 861 N GLU A 188 -6.841 -6.195 -4.474 1.00 0.00 N ATOM 862 CA GLU A 188 -7.315 -5.298 -3.433 1.00 0.00 C ATOM 863 C GLU A 188 -6.221 -4.295 -3.058 1.00 0.00 C ATOM 864 O GLU A 188 -5.040 -4.543 -3.293 1.00 0.00 O ATOM 865 CB GLU A 188 -7.784 -6.082 -2.206 1.00 0.00 C ATOM 866 CG GLU A 188 -8.968 -5.388 -1.530 1.00 0.00 C ATOM 867 CD GLU A 188 -8.837 -5.440 -0.007 1.00 0.00 C ATOM 868 OE1 GLU A 188 -7.707 -5.212 0.474 1.00 0.00 O ATOM 869 OE2 GLU A 188 -9.872 -5.707 0.642 1.00 0.00 O ATOM 0 H GLU A 188 -6.119 -6.851 -4.176 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.171 -4.745 -3.819 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.071 -7.091 -2.503 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -6.962 -6.180 -1.497 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.022 -4.350 -1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.898 -5.868 -1.835 1.00 0.00 H new ATOM 876 N LYS A 189 -6.654 -3.184 -2.482 1.00 0.00 N ATOM 877 CA LYS A 189 -5.727 -2.142 -2.073 1.00 0.00 C ATOM 878 C LYS A 189 -5.307 -2.381 -0.621 1.00 0.00 C ATOM 879 O LYS A 189 -6.110 -2.219 0.296 1.00 0.00 O ATOM 880 CB LYS A 189 -6.333 -0.759 -2.318 1.00 0.00 C ATOM 881 CG LYS A 189 -6.498 -0.490 -3.815 1.00 0.00 C ATOM 882 CD LYS A 189 -7.881 0.089 -4.119 1.00 0.00 C ATOM 883 CE LYS A 189 -8.968 -0.978 -3.974 1.00 0.00 C ATOM 884 NZ LYS A 189 -9.698 -1.151 -5.249 1.00 0.00 N ATOM 0 H LYS A 189 -7.635 -2.982 -2.288 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.821 -2.179 -2.678 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -7.302 -0.690 -1.824 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -5.694 0.005 -1.876 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.727 0.204 -4.150 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -6.357 -1.416 -4.372 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -8.088 0.918 -3.443 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -7.895 0.492 -5.132 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -8.519 -1.925 -3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -9.664 -0.692 -3.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -10.506 -1.789 -5.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -10.042 -0.227 -5.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -9.060 -1.558 -5.962 1.00 0.00 H new