USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 405 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 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= 0 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.43 K(o=-0.43,f=-4.9!) USER MOD Single : A 175 SER OG : rot -47:sc= 0.736 USER MOD Single : A 178 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0374) USER MOD Single : A 181 MET CE :methyl 158:sc= -0.0159 (180deg=-0.222) USER MOD Single : A 186 TYR OH : rot 165:sc= -0.0523 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -2.041 -2.354 -0.588 1.00 0.00 N ATOM 20 CA TYR A 136 -3.305 -3.036 -0.368 1.00 0.00 C ATOM 21 C TYR A 136 -4.459 -2.036 -0.274 1.00 0.00 C ATOM 22 O TYR A 136 -4.243 -0.861 0.023 1.00 0.00 O ATOM 23 CB TYR A 136 -3.164 -3.761 0.973 1.00 0.00 C ATOM 24 CG TYR A 136 -2.219 -4.963 0.934 1.00 0.00 C ATOM 25 CD1 TYR A 136 -0.861 -4.769 0.774 1.00 0.00 C ATOM 26 CD2 TYR A 136 -2.722 -6.241 1.058 1.00 0.00 C ATOM 27 CE1 TYR A 136 0.029 -5.900 0.738 1.00 0.00 C ATOM 28 CE2 TYR A 136 -1.833 -7.373 1.021 1.00 0.00 C ATOM 29 CZ TYR A 136 -0.501 -7.146 0.863 1.00 0.00 C ATOM 30 OH TYR A 136 0.340 -8.215 0.828 1.00 0.00 O ATOM 0 HA TYR A 136 -3.523 -3.716 -1.191 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.805 -3.054 1.721 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -4.149 -4.096 1.298 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -0.467 -3.768 0.676 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -3.784 -6.393 1.183 1.00 0.00 H new ATOM 0 HE1 TYR A 136 1.093 -5.762 0.615 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -2.215 -8.379 1.116 1.00 0.00 H new ATOM 0 HH TYR A 136 -0.177 -9.041 0.930 1.00 0.00 H new ATOM 40 N VAL A 137 -5.657 -2.537 -0.532 1.00 0.00 N ATOM 41 CA VAL A 137 -6.845 -1.702 -0.481 1.00 0.00 C ATOM 42 C VAL A 137 -7.776 -2.215 0.618 1.00 0.00 C ATOM 43 O VAL A 137 -7.602 -3.326 1.117 1.00 0.00 O ATOM 44 CB VAL A 137 -7.512 -1.656 -1.857 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.466 -1.614 -2.973 1.00 0.00 C ATOM 46 CG2 VAL A 137 -8.466 -2.838 -2.043 1.00 0.00 C ATOM 0 H VAL A 137 -5.831 -3.512 -0.777 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.580 -0.675 -0.229 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.099 -0.739 -1.914 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -6.967 -1.582 -3.940 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -5.845 -0.726 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.840 -2.504 -2.918 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.927 -2.782 -3.029 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.910 -3.772 -1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -9.241 -2.804 -1.278 1.00 0.00 H new ATOM 56 N ARG A 138 -8.747 -1.381 0.965 1.00 0.00 N ATOM 57 CA ARG A 138 -9.706 -1.737 1.997 1.00 0.00 C ATOM 58 C ARG A 138 -11.126 -1.390 1.543 1.00 0.00 C ATOM 59 O ARG A 138 -11.437 -0.226 1.298 1.00 0.00 O ATOM 60 CB ARG A 138 -9.404 -1.005 3.305 1.00 0.00 C ATOM 61 CG ARG A 138 -8.538 -1.865 4.227 1.00 0.00 C ATOM 62 CD ARG A 138 -9.244 -2.122 5.561 1.00 0.00 C ATOM 63 NE ARG A 138 -8.907 -1.052 6.526 1.00 0.00 N ATOM 64 CZ ARG A 138 -9.230 -1.086 7.827 1.00 0.00 C ATOM 65 NH1 ARG A 138 -9.899 -2.134 8.324 1.00 0.00 N ATOM 66 NH2 ARG A 138 -8.884 -0.070 8.629 1.00 0.00 N ATOM 0 H ARG A 138 -8.890 -0.460 0.550 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.627 -2.811 2.168 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.893 -0.066 3.091 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.337 -0.752 3.808 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.315 -2.815 3.741 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.585 -1.367 4.406 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.323 -2.160 5.410 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -8.944 -3.091 5.960 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.398 -0.239 6.180 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.163 -2.907 7.713 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.145 -2.160 9.314 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -8.375 0.729 8.250 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -9.129 -0.095 9.619 1.00 0.00 H new ATOM 80 N ALA A 139 -11.950 -2.424 1.443 1.00 0.00 N ATOM 81 CA ALA A 139 -13.329 -2.245 1.023 1.00 0.00 C ATOM 82 C ALA A 139 -14.186 -1.892 2.240 1.00 0.00 C ATOM 83 O ALA A 139 -14.337 -2.702 3.152 1.00 0.00 O ATOM 84 CB ALA A 139 -13.815 -3.509 0.313 1.00 0.00 C ATOM 0 H ALA A 139 -11.688 -3.389 1.646 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.411 -1.422 0.313 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.850 -3.374 -0.002 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.191 -3.698 -0.561 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.751 -4.357 0.995 1.00 0.00 H new ATOM 90 N LEU A 140 -14.724 -0.682 2.213 1.00 0.00 N ATOM 91 CA LEU A 140 -15.564 -0.212 3.303 1.00 0.00 C ATOM 92 C LEU A 140 -17.030 -0.485 2.967 1.00 0.00 C ATOM 93 O LEU A 140 -17.895 0.353 3.218 1.00 0.00 O ATOM 94 CB LEU A 140 -15.266 1.257 3.614 1.00 0.00 C ATOM 95 CG LEU A 140 -13.839 1.727 3.326 1.00 0.00 C ATOM 96 CD1 LEU A 140 -13.808 3.226 3.015 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.899 1.361 4.477 1.00 0.00 C ATOM 0 H LEU A 140 -14.595 -0.013 1.454 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.341 -0.759 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.954 1.876 3.039 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -15.481 1.436 4.668 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.480 1.206 2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -12.782 3.535 2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -14.426 3.429 2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -14.194 3.783 3.869 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.891 1.706 4.247 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -13.245 1.837 5.395 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.891 0.279 4.610 1.00 0.00 H new ATOM 109 N PHE A 141 -17.266 -1.661 2.402 1.00 0.00 N ATOM 110 CA PHE A 141 -18.614 -2.054 2.029 1.00 0.00 C ATOM 111 C PHE A 141 -18.626 -3.460 1.423 1.00 0.00 C ATOM 112 O PHE A 141 -17.839 -3.761 0.527 1.00 0.00 O ATOM 113 CB PHE A 141 -19.096 -1.054 0.976 1.00 0.00 C ATOM 114 CG PHE A 141 -20.390 -0.329 1.353 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.642 -0.021 2.653 1.00 0.00 C ATOM 116 CD2 PHE A 141 -21.287 0.008 0.387 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.843 0.651 3.003 1.00 0.00 C ATOM 118 CE2 PHE A 141 -22.487 0.681 0.737 1.00 0.00 C ATOM 119 CZ PHE A 141 -22.740 0.989 2.038 1.00 0.00 C ATOM 0 H PHE A 141 -16.547 -2.353 2.194 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.257 -2.060 2.909 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.313 -0.315 0.807 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.247 -1.579 0.033 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -19.929 -0.287 3.419 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -21.086 -0.236 -0.646 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -22.044 0.894 4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -23.199 0.949 -0.030 1.00 0.00 H new ATOM 0 HZ PHE A 141 -23.653 1.502 2.304 1.00 0.00 H new ATOM 129 N ASP A 142 -19.528 -4.283 1.938 1.00 0.00 N ATOM 130 CA ASP A 142 -19.653 -5.649 1.459 1.00 0.00 C ATOM 131 C ASP A 142 -20.173 -5.635 0.020 1.00 0.00 C ATOM 132 O ASP A 142 -21.176 -4.988 -0.275 1.00 0.00 O ATOM 133 CB ASP A 142 -20.645 -6.442 2.312 1.00 0.00 C ATOM 134 CG ASP A 142 -20.637 -7.954 2.077 1.00 0.00 C ATOM 135 OD1 ASP A 142 -20.838 -8.347 0.907 1.00 0.00 O ATOM 136 OD2 ASP A 142 -20.428 -8.682 3.070 1.00 0.00 O ATOM 0 H ASP A 142 -20.179 -4.030 2.682 1.00 0.00 H new ATOM 0 HA ASP A 142 -18.671 -6.118 1.517 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.430 -6.252 3.363 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.649 -6.065 2.119 1.00 0.00 H new ATOM 141 N PHE A 143 -19.465 -6.356 -0.837 1.00 0.00 N ATOM 142 CA PHE A 143 -19.842 -6.436 -2.238 1.00 0.00 C ATOM 143 C PHE A 143 -19.848 -7.887 -2.723 1.00 0.00 C ATOM 144 O PHE A 143 -19.172 -8.740 -2.149 1.00 0.00 O ATOM 145 CB PHE A 143 -18.792 -5.651 -3.028 1.00 0.00 C ATOM 146 CG PHE A 143 -18.939 -5.771 -4.546 1.00 0.00 C ATOM 147 CD1 PHE A 143 -19.807 -4.964 -5.212 1.00 0.00 C ATOM 148 CD2 PHE A 143 -18.199 -6.685 -5.230 1.00 0.00 C ATOM 149 CE1 PHE A 143 -19.942 -5.075 -6.621 1.00 0.00 C ATOM 150 CE2 PHE A 143 -18.335 -6.797 -6.639 1.00 0.00 C ATOM 151 CZ PHE A 143 -19.204 -5.990 -7.306 1.00 0.00 C ATOM 0 H PHE A 143 -18.632 -6.890 -0.588 1.00 0.00 H new ATOM 0 HA PHE A 143 -20.844 -6.031 -2.378 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -18.854 -4.599 -2.749 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -17.800 -5.999 -2.740 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -20.394 -4.238 -4.669 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -17.508 -7.325 -4.701 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -20.631 -4.433 -7.149 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -17.748 -7.523 -7.182 1.00 0.00 H new ATOM 0 HZ PHE A 143 -19.308 -6.076 -8.378 1.00 0.00 H new ATOM 250 N LEU A 151 -14.326 -11.399 -7.443 1.00 0.00 N ATOM 251 CA LEU A 151 -14.098 -12.034 -6.156 1.00 0.00 C ATOM 252 C LEU A 151 -15.065 -11.449 -5.126 1.00 0.00 C ATOM 253 O LEU A 151 -15.494 -10.302 -5.252 1.00 0.00 O ATOM 254 CB LEU A 151 -12.626 -11.916 -5.754 1.00 0.00 C ATOM 255 CG LEU A 151 -12.198 -10.572 -5.161 1.00 0.00 C ATOM 256 CD1 LEU A 151 -12.477 -9.429 -6.138 1.00 0.00 C ATOM 257 CD2 LEU A 151 -12.858 -10.338 -3.801 1.00 0.00 C ATOM 0 HA LEU A 151 -14.304 -13.103 -6.216 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -12.405 -12.698 -5.028 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -12.013 -12.114 -6.633 1.00 0.00 H new ATOM 0 HG LEU A 151 -11.121 -10.598 -4.995 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.164 -8.485 -5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -11.922 -9.596 -7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -13.544 -9.390 -6.358 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -12.537 -9.376 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -13.942 -10.339 -3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -12.566 -11.132 -3.114 1.00 0.00 H new ATOM 269 N PRO A 152 -15.390 -12.284 -4.103 1.00 0.00 N ATOM 270 CA PRO A 152 -16.300 -11.862 -3.051 1.00 0.00 C ATOM 271 C PRO A 152 -15.611 -10.894 -2.087 1.00 0.00 C ATOM 272 O PRO A 152 -14.452 -11.090 -1.727 1.00 0.00 O ATOM 273 CB PRO A 152 -16.749 -13.149 -2.380 1.00 0.00 C ATOM 274 CG PRO A 152 -15.726 -14.203 -2.771 1.00 0.00 C ATOM 275 CD PRO A 152 -14.903 -13.649 -3.921 1.00 0.00 C ATOM 0 HA PRO A 152 -17.157 -11.308 -3.433 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -16.793 -13.030 -1.297 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -17.748 -13.433 -2.710 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -15.084 -14.445 -1.924 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -16.223 -15.126 -3.068 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -13.838 -13.662 -3.688 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -15.038 -14.241 -4.826 1.00 0.00 H new ATOM 283 N PHE A 153 -16.354 -9.869 -1.697 1.00 0.00 N ATOM 284 CA PHE A 153 -15.830 -8.869 -0.783 1.00 0.00 C ATOM 285 C PHE A 153 -16.488 -8.987 0.593 1.00 0.00 C ATOM 286 O PHE A 153 -17.102 -10.005 0.907 1.00 0.00 O ATOM 287 CB PHE A 153 -16.162 -7.500 -1.377 1.00 0.00 C ATOM 288 CG PHE A 153 -14.940 -6.726 -1.878 1.00 0.00 C ATOM 289 CD1 PHE A 153 -13.870 -6.542 -1.059 1.00 0.00 C ATOM 290 CD2 PHE A 153 -14.924 -6.222 -3.141 1.00 0.00 C ATOM 291 CE1 PHE A 153 -12.736 -5.824 -1.523 1.00 0.00 C ATOM 292 CE2 PHE A 153 -13.790 -5.504 -3.605 1.00 0.00 C ATOM 293 CZ PHE A 153 -12.720 -5.320 -2.786 1.00 0.00 C ATOM 0 H PHE A 153 -17.316 -9.709 -1.998 1.00 0.00 H new ATOM 0 HA PHE A 153 -14.756 -9.007 -0.657 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -16.859 -7.634 -2.204 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -16.674 -6.902 -0.623 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -13.883 -6.942 -0.056 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -15.774 -6.368 -3.791 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -11.886 -5.678 -0.873 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -13.777 -5.104 -4.608 1.00 0.00 H new ATOM 0 HZ PHE A 153 -11.858 -4.774 -3.139 1.00 0.00 H new ATOM 303 N LYS A 154 -16.338 -7.930 1.379 1.00 0.00 N ATOM 304 CA LYS A 154 -16.910 -7.901 2.713 1.00 0.00 C ATOM 305 C LYS A 154 -16.631 -6.540 3.355 1.00 0.00 C ATOM 306 O LYS A 154 -15.599 -5.926 3.091 1.00 0.00 O ATOM 307 CB LYS A 154 -16.402 -9.085 3.540 1.00 0.00 C ATOM 308 CG LYS A 154 -16.702 -8.885 5.027 1.00 0.00 C ATOM 309 CD LYS A 154 -17.438 -10.096 5.604 1.00 0.00 C ATOM 310 CE LYS A 154 -18.950 -9.866 5.616 1.00 0.00 C ATOM 311 NZ LYS A 154 -19.399 -9.439 6.959 1.00 0.00 N ATOM 0 H LYS A 154 -15.828 -7.087 1.116 1.00 0.00 H new ATOM 0 HA LYS A 154 -17.993 -8.015 2.664 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -16.872 -10.005 3.191 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -15.328 -9.200 3.394 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -15.771 -8.727 5.572 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -17.307 -7.988 5.163 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -17.206 -10.982 5.013 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -17.088 -10.289 6.618 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -19.214 -9.107 4.880 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -19.465 -10.782 5.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -20.428 -9.287 6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -19.164 -10.176 7.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -18.921 -8.553 7.219 1.00 0.00 H new ATOM 325 N LYS A 155 -17.571 -6.108 4.183 1.00 0.00 N ATOM 326 CA LYS A 155 -17.440 -4.832 4.864 1.00 0.00 C ATOM 327 C LYS A 155 -16.068 -4.755 5.536 1.00 0.00 C ATOM 328 O LYS A 155 -15.801 -5.479 6.494 1.00 0.00 O ATOM 329 CB LYS A 155 -18.609 -4.615 5.826 1.00 0.00 C ATOM 330 CG LYS A 155 -19.251 -3.243 5.609 1.00 0.00 C ATOM 331 CD LYS A 155 -18.303 -2.120 6.035 1.00 0.00 C ATOM 332 CE LYS A 155 -18.149 -2.081 7.557 1.00 0.00 C ATOM 333 NZ LYS A 155 -19.007 -1.024 8.137 1.00 0.00 N ATOM 0 H LYS A 155 -18.427 -6.620 4.397 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.491 -4.012 4.148 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -19.355 -5.396 5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -18.258 -4.698 6.855 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -19.514 -3.123 4.558 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -20.178 -3.177 6.179 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -17.328 -2.267 5.571 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -18.684 -1.163 5.680 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -18.417 -3.049 7.981 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -17.107 -1.896 7.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -18.891 -1.011 9.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -18.732 -0.100 7.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -20.002 -1.217 7.903 1.00 0.00 H new ATOM 347 N GLY A 156 -15.234 -3.871 5.008 1.00 0.00 N ATOM 348 CA GLY A 156 -13.896 -3.692 5.545 1.00 0.00 C ATOM 349 C GLY A 156 -12.997 -4.877 5.187 1.00 0.00 C ATOM 350 O GLY A 156 -12.296 -5.410 6.046 1.00 0.00 O ATOM 0 H GLY A 156 -15.459 -3.271 4.214 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.463 -2.772 5.153 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -13.947 -3.584 6.628 1.00 0.00 H new ATOM 354 N ASP A 157 -13.048 -5.254 3.918 1.00 0.00 N ATOM 355 CA ASP A 157 -12.247 -6.367 3.437 1.00 0.00 C ATOM 356 C ASP A 157 -10.882 -5.848 2.980 1.00 0.00 C ATOM 357 O ASP A 157 -10.666 -4.639 2.910 1.00 0.00 O ATOM 358 CB ASP A 157 -12.916 -7.052 2.244 1.00 0.00 C ATOM 359 CG ASP A 157 -13.074 -8.568 2.373 1.00 0.00 C ATOM 360 OD1 ASP A 157 -13.167 -9.033 3.529 1.00 0.00 O ATOM 361 OD2 ASP A 157 -13.097 -9.229 1.312 1.00 0.00 O ATOM 0 H ASP A 157 -13.631 -4.809 3.209 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.142 -7.083 4.252 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -13.902 -6.611 2.097 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -12.334 -6.838 1.348 1.00 0.00 H new ATOM 366 N ILE A 158 -9.997 -6.787 2.681 1.00 0.00 N ATOM 367 CA ILE A 158 -8.659 -6.440 2.233 1.00 0.00 C ATOM 368 C ILE A 158 -8.448 -6.969 0.813 1.00 0.00 C ATOM 369 O ILE A 158 -8.606 -8.163 0.563 1.00 0.00 O ATOM 370 CB ILE A 158 -7.613 -6.932 3.236 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.945 -6.457 4.652 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.205 -6.516 2.807 1.00 0.00 C ATOM 373 CD1 ILE A 158 -7.976 -4.929 4.725 1.00 0.00 C ATOM 0 H ILE A 158 -10.180 -7.789 2.740 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.540 -5.357 2.191 1.00 0.00 H new ATOM 0 HB ILE A 158 -7.637 -8.022 3.248 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -8.911 -6.859 4.957 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.204 -6.843 5.352 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.481 -6.878 3.537 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -5.981 -6.944 1.830 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.149 -5.429 2.748 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -8.214 -4.618 5.742 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -7.001 -4.531 4.443 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -8.735 -4.547 4.042 1.00 0.00 H new ATOM 385 N LEU A 159 -8.093 -6.056 -0.078 1.00 0.00 N ATOM 386 CA LEU A 159 -7.858 -6.417 -1.466 1.00 0.00 C ATOM 387 C LEU A 159 -6.595 -5.712 -1.965 1.00 0.00 C ATOM 388 O LEU A 159 -6.511 -4.485 -1.934 1.00 0.00 O ATOM 389 CB LEU A 159 -9.099 -6.125 -2.312 1.00 0.00 C ATOM 390 CG LEU A 159 -10.081 -7.286 -2.484 1.00 0.00 C ATOM 391 CD1 LEU A 159 -9.448 -8.424 -3.288 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.608 -7.764 -1.130 1.00 0.00 C ATOM 0 H LEU A 159 -7.962 -5.067 0.134 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.683 -7.489 -1.557 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.632 -5.288 -1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.773 -5.801 -3.300 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.938 -6.927 -3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -10.166 -9.237 -3.396 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -9.163 -8.058 -4.274 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -8.563 -8.789 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.304 -8.589 -1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -9.775 -8.100 -0.513 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -11.122 -6.943 -0.629 1.00 0.00 H new ATOM 404 N ARG A 160 -5.643 -6.519 -2.411 1.00 0.00 N ATOM 405 CA ARG A 160 -4.387 -5.988 -2.915 1.00 0.00 C ATOM 406 C ARG A 160 -4.465 -5.790 -4.430 1.00 0.00 C ATOM 407 O ARG A 160 -5.053 -6.607 -5.137 1.00 0.00 O ATOM 408 CB ARG A 160 -3.223 -6.926 -2.589 1.00 0.00 C ATOM 409 CG ARG A 160 -3.703 -8.373 -2.463 1.00 0.00 C ATOM 410 CD ARG A 160 -2.519 -9.339 -2.392 1.00 0.00 C ATOM 411 NE ARG A 160 -1.986 -9.589 -3.750 1.00 0.00 N ATOM 412 CZ ARG A 160 -0.800 -10.162 -3.998 1.00 0.00 C ATOM 413 NH1 ARG A 160 -0.017 -10.549 -2.982 1.00 0.00 N ATOM 414 NH2 ARG A 160 -0.398 -10.348 -5.262 1.00 0.00 N ATOM 0 H ARG A 160 -5.716 -7.536 -2.434 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.213 -5.028 -2.428 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.466 -6.857 -3.370 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -2.750 -6.614 -1.658 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -4.318 -8.479 -1.569 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -4.333 -8.626 -3.316 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -1.737 -8.923 -1.757 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.833 -10.279 -1.937 1.00 0.00 H new ATOM 0 HE ARG A 160 -2.557 -9.308 -4.547 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -0.323 -10.408 -2.019 1.00 0.00 H new ATOM 0 HH12 ARG A 160 0.885 -10.985 -3.171 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -0.994 -10.054 -6.035 1.00 0.00 H new ATOM 0 HH22 ARG A 160 0.504 -10.784 -5.451 1.00 0.00 H new ATOM 428 N ILE A 161 -3.864 -4.700 -4.884 1.00 0.00 N ATOM 429 CA ILE A 161 -3.858 -4.384 -6.302 1.00 0.00 C ATOM 430 C ILE A 161 -2.696 -5.114 -6.978 1.00 0.00 C ATOM 431 O ILE A 161 -1.547 -4.984 -6.556 1.00 0.00 O ATOM 432 CB ILE A 161 -3.838 -2.868 -6.513 1.00 0.00 C ATOM 433 CG1 ILE A 161 -5.116 -2.223 -5.972 1.00 0.00 C ATOM 434 CG2 ILE A 161 -3.599 -2.523 -7.984 1.00 0.00 C ATOM 435 CD1 ILE A 161 -4.936 -0.713 -5.797 1.00 0.00 C ATOM 0 H ILE A 161 -3.378 -4.024 -4.295 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.775 -4.737 -6.775 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.004 -2.454 -5.946 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.943 -2.418 -6.655 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.379 -2.675 -5.016 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -3.589 -1.440 -8.107 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.641 -2.933 -8.303 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.397 -2.950 -8.592 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -5.858 -0.279 -5.411 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -4.124 -0.522 -5.095 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -4.697 -0.261 -6.760 1.00 0.00 H new ATOM 447 N ARG A 162 -3.035 -5.867 -8.015 1.00 0.00 N ATOM 448 CA ARG A 162 -2.034 -6.618 -8.753 1.00 0.00 C ATOM 449 C ARG A 162 -1.993 -6.157 -10.211 1.00 0.00 C ATOM 450 O ARG A 162 -0.927 -6.115 -10.823 1.00 0.00 O ATOM 451 CB ARG A 162 -2.328 -8.119 -8.707 1.00 0.00 C ATOM 452 CG ARG A 162 -3.304 -8.521 -9.813 1.00 0.00 C ATOM 453 CD ARG A 162 -3.892 -9.907 -9.549 1.00 0.00 C ATOM 454 NE ARG A 162 -3.121 -10.934 -10.285 1.00 0.00 N ATOM 455 CZ ARG A 162 -3.417 -11.353 -11.522 1.00 0.00 C ATOM 456 NH1 ARG A 162 -4.470 -10.837 -12.170 1.00 0.00 N ATOM 457 NH2 ARG A 162 -2.660 -12.288 -12.112 1.00 0.00 N ATOM 0 H ARG A 162 -3.989 -5.973 -8.361 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.068 -6.434 -8.283 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -1.399 -8.679 -8.816 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -2.746 -8.382 -7.735 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -4.108 -7.788 -9.878 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -2.791 -8.517 -10.775 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -3.872 -10.122 -8.481 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -4.936 -9.933 -9.860 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.313 -11.349 -9.821 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -5.046 -10.125 -11.721 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -4.695 -11.156 -13.112 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -1.858 -12.681 -11.619 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -2.886 -12.607 -13.054 1.00 0.00 H new ATOM 471 N ASP A 163 -3.168 -5.824 -10.726 1.00 0.00 N ATOM 472 CA ASP A 163 -3.280 -5.367 -12.101 1.00 0.00 C ATOM 473 C ASP A 163 -4.456 -4.395 -12.217 1.00 0.00 C ATOM 474 O ASP A 163 -5.334 -4.372 -11.356 1.00 0.00 O ATOM 475 CB ASP A 163 -3.540 -6.538 -13.050 1.00 0.00 C ATOM 476 CG ASP A 163 -2.503 -7.663 -12.990 1.00 0.00 C ATOM 477 OD1 ASP A 163 -1.303 -7.324 -12.913 1.00 0.00 O ATOM 478 OD2 ASP A 163 -2.936 -8.835 -13.022 1.00 0.00 O ATOM 0 H ASP A 163 -4.050 -5.862 -10.216 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.342 -4.883 -12.373 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.521 -6.957 -12.826 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -3.582 -6.157 -14.070 1.00 0.00 H new ATOM 483 N LYS A 164 -4.433 -3.615 -13.287 1.00 0.00 N ATOM 484 CA LYS A 164 -5.486 -2.643 -13.527 1.00 0.00 C ATOM 485 C LYS A 164 -5.649 -2.435 -15.035 1.00 0.00 C ATOM 486 O LYS A 164 -5.511 -1.317 -15.529 1.00 0.00 O ATOM 487 CB LYS A 164 -5.209 -1.352 -12.755 1.00 0.00 C ATOM 488 CG LYS A 164 -3.864 -0.746 -13.164 1.00 0.00 C ATOM 489 CD LYS A 164 -3.897 0.781 -13.064 1.00 0.00 C ATOM 490 CE LYS A 164 -2.943 1.280 -11.977 1.00 0.00 C ATOM 491 NZ LYS A 164 -3.700 1.719 -10.784 1.00 0.00 N ATOM 0 H LYS A 164 -3.702 -3.636 -13.998 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.440 -3.014 -13.151 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -6.007 -0.634 -12.942 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.209 -1.557 -11.684 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -3.074 -1.139 -12.524 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -3.623 -1.042 -14.185 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -3.621 1.218 -14.024 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -4.911 1.113 -12.843 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -2.248 0.486 -11.702 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -2.346 2.107 -12.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.037 2.055 -10.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -4.345 2.491 -11.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -4.251 0.920 -10.409 1.00 0.00 H new ATOM 505 N PRO A 165 -5.947 -3.558 -15.740 1.00 0.00 N ATOM 506 CA PRO A 165 -6.130 -3.510 -17.181 1.00 0.00 C ATOM 507 C PRO A 165 -7.479 -2.883 -17.542 1.00 0.00 C ATOM 508 O PRO A 165 -7.978 -3.071 -18.650 1.00 0.00 O ATOM 509 CB PRO A 165 -6.004 -4.952 -17.642 1.00 0.00 C ATOM 510 CG PRO A 165 -6.218 -5.806 -16.403 1.00 0.00 C ATOM 511 CD PRO A 165 -6.118 -4.899 -15.188 1.00 0.00 C ATOM 0 HA PRO A 165 -5.391 -2.881 -17.678 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.744 -5.183 -18.408 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -5.023 -5.138 -18.080 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -7.193 -6.291 -16.438 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.470 -6.597 -16.351 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -7.015 -4.962 -14.572 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.276 -5.177 -14.555 1.00 0.00 H new ATOM 519 N GLU A 166 -8.030 -2.151 -16.585 1.00 0.00 N ATOM 520 CA GLU A 166 -9.311 -1.496 -16.788 1.00 0.00 C ATOM 521 C GLU A 166 -9.341 -0.151 -16.057 1.00 0.00 C ATOM 522 O GLU A 166 -8.351 0.249 -15.446 1.00 0.00 O ATOM 523 CB GLU A 166 -10.464 -2.393 -16.334 1.00 0.00 C ATOM 524 CG GLU A 166 -10.216 -3.849 -16.732 1.00 0.00 C ATOM 525 CD GLU A 166 -10.358 -4.035 -18.244 1.00 0.00 C ATOM 526 OE1 GLU A 166 -11.172 -3.293 -18.834 1.00 0.00 O ATOM 527 OE2 GLU A 166 -9.647 -4.915 -18.777 1.00 0.00 O ATOM 0 H GLU A 166 -7.613 -1.997 -15.667 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.437 -1.311 -17.855 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.580 -2.323 -15.252 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.397 -2.045 -16.778 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.217 -4.151 -16.417 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -10.923 -4.497 -16.214 1.00 0.00 H new ATOM 534 N GLU A 167 -10.487 0.507 -16.143 1.00 0.00 N ATOM 535 CA GLU A 167 -10.658 1.797 -15.498 1.00 0.00 C ATOM 536 C GLU A 167 -11.733 1.709 -14.411 1.00 0.00 C ATOM 537 O GLU A 167 -12.760 1.058 -14.600 1.00 0.00 O ATOM 538 CB GLU A 167 -11.003 2.881 -16.521 1.00 0.00 C ATOM 539 CG GLU A 167 -9.887 3.924 -16.612 1.00 0.00 C ATOM 540 CD GLU A 167 -10.322 5.248 -15.981 1.00 0.00 C ATOM 541 OE1 GLU A 167 -10.588 5.234 -14.760 1.00 0.00 O ATOM 542 OE2 GLU A 167 -10.379 6.244 -16.734 1.00 0.00 O ATOM 0 H GLU A 167 -11.306 0.171 -16.649 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.714 2.073 -15.028 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -11.161 2.426 -17.499 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -11.938 3.367 -16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.995 3.552 -16.108 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.619 4.085 -17.656 1.00 0.00 H new ATOM 549 N GLN A 168 -11.460 2.372 -13.298 1.00 0.00 N ATOM 550 CA GLN A 168 -12.389 2.376 -12.181 1.00 0.00 C ATOM 551 C GLN A 168 -12.161 1.151 -11.296 1.00 0.00 C ATOM 552 O GLN A 168 -11.906 1.284 -10.099 1.00 0.00 O ATOM 553 CB GLN A 168 -13.836 2.435 -12.674 1.00 0.00 C ATOM 554 CG GLN A 168 -13.993 3.460 -13.798 1.00 0.00 C ATOM 555 CD GLN A 168 -15.220 4.345 -13.567 1.00 0.00 C ATOM 556 OE1 GLN A 168 -16.331 4.022 -13.952 1.00 0.00 O ATOM 557 NE2 GLN A 168 -14.957 5.477 -12.920 1.00 0.00 N ATOM 0 H GLN A 168 -10.608 2.911 -13.145 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.206 3.269 -11.584 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -14.143 1.451 -13.029 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.495 2.695 -11.846 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -13.099 4.080 -13.856 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -14.087 2.945 -14.754 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -14.003 5.686 -12.625 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -15.709 6.136 -12.719 1.00 0.00 H new ATOM 566 N TRP A 169 -12.258 -0.016 -11.917 1.00 0.00 N ATOM 567 CA TRP A 169 -12.065 -1.264 -11.200 1.00 0.00 C ATOM 568 C TRP A 169 -10.755 -1.888 -11.682 1.00 0.00 C ATOM 569 O TRP A 169 -10.430 -1.822 -12.866 1.00 0.00 O ATOM 570 CB TRP A 169 -13.270 -2.191 -11.378 1.00 0.00 C ATOM 571 CG TRP A 169 -14.562 -1.658 -10.756 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.086 -0.429 -10.868 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.479 -2.391 -9.916 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.268 -0.318 -10.164 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.515 -1.548 -9.567 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.435 -3.723 -9.467 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.583 -1.943 -8.754 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -16.509 -4.102 -8.655 1.00 0.00 C ATOM 579 CH2 TRP A 169 -17.560 -3.266 -8.294 1.00 0.00 C ATOM 0 H TRP A 169 -12.468 -0.123 -12.909 1.00 0.00 H new ATOM 0 HA TRP A 169 -11.992 -1.085 -10.127 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.433 -2.358 -12.443 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.039 -3.160 -10.936 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.640 0.373 -11.437 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -16.853 0.515 -10.095 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -14.635 -4.400 -9.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.382 -1.264 -8.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -16.523 -5.115 -8.282 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -18.354 -3.635 -7.662 1.00 0.00 H new ATOM 590 N TRP A 170 -10.036 -2.481 -10.739 1.00 0.00 N ATOM 591 CA TRP A 170 -8.769 -3.117 -11.053 1.00 0.00 C ATOM 592 C TRP A 170 -8.789 -4.529 -10.466 1.00 0.00 C ATOM 593 O TRP A 170 -9.624 -4.841 -9.618 1.00 0.00 O ATOM 594 CB TRP A 170 -7.594 -2.277 -10.547 1.00 0.00 C ATOM 595 CG TRP A 170 -7.687 -0.793 -10.911 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.130 -0.251 -12.052 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.307 0.322 -10.077 1.00 0.00 C ATOM 598 NE1 TRP A 170 -8.066 1.128 -12.016 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.549 1.486 -10.776 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.778 0.346 -8.775 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.291 2.760 -10.256 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.526 1.626 -8.269 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.763 2.808 -8.960 1.00 0.00 C ATOM 0 H TRP A 170 -10.308 -2.534 -9.757 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.632 -3.191 -12.132 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.533 -2.371 -9.463 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.668 -2.683 -10.955 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.492 -0.821 -12.895 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.346 1.766 -12.761 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.581 -0.553 -8.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.489 3.657 -10.824 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.119 1.700 -7.271 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.541 3.759 -8.500 1.00 0.00 H new ATOM 614 N ASN A 171 -7.862 -5.347 -10.941 1.00 0.00 N ATOM 615 CA ASN A 171 -7.762 -6.720 -10.474 1.00 0.00 C ATOM 616 C ASN A 171 -6.917 -6.760 -9.199 1.00 0.00 C ATOM 617 O ASN A 171 -5.721 -6.480 -9.234 1.00 0.00 O ATOM 618 CB ASN A 171 -7.087 -7.610 -11.518 1.00 0.00 C ATOM 619 CG ASN A 171 -8.121 -8.420 -12.301 1.00 0.00 C ATOM 620 OD1 ASN A 171 -9.222 -8.679 -11.842 1.00 0.00 O ATOM 621 ND2 ASN A 171 -7.709 -8.806 -13.504 1.00 0.00 N ATOM 0 H ASN A 171 -7.172 -5.085 -11.645 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.771 -7.087 -10.288 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.507 -6.994 -12.205 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.387 -8.286 -11.027 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -8.327 -9.353 -14.104 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.775 -8.555 -13.828 1.00 0.00 H new ATOM 628 N ALA A 172 -7.574 -7.113 -8.104 1.00 0.00 N ATOM 629 CA ALA A 172 -6.897 -7.194 -6.820 1.00 0.00 C ATOM 630 C ALA A 172 -7.048 -8.610 -6.257 1.00 0.00 C ATOM 631 O ALA A 172 -7.970 -9.334 -6.631 1.00 0.00 O ATOM 632 CB ALA A 172 -7.460 -6.129 -5.877 1.00 0.00 C ATOM 0 H ALA A 172 -8.567 -7.346 -8.079 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.831 -6.996 -6.935 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -6.952 -6.190 -4.914 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.302 -5.141 -6.309 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.528 -6.296 -5.735 1.00 0.00 H new ATOM 638 N GLU A 173 -6.130 -8.959 -5.369 1.00 0.00 N ATOM 639 CA GLU A 173 -6.150 -10.275 -4.751 1.00 0.00 C ATOM 640 C GLU A 173 -6.670 -10.180 -3.316 1.00 0.00 C ATOM 641 O GLU A 173 -6.029 -9.573 -2.458 1.00 0.00 O ATOM 642 CB GLU A 173 -4.763 -10.920 -4.791 1.00 0.00 C ATOM 643 CG GLU A 173 -4.855 -12.431 -4.568 1.00 0.00 C ATOM 644 CD GLU A 173 -3.473 -13.082 -4.653 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.080 -13.435 -5.786 1.00 0.00 O ATOM 646 OE2 GLU A 173 -2.841 -13.212 -3.582 1.00 0.00 O ATOM 0 H GLU A 173 -5.368 -8.355 -5.062 1.00 0.00 H new ATOM 0 HA GLU A 173 -6.827 -10.912 -5.320 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.292 -10.719 -5.753 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.128 -10.474 -4.026 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -5.296 -12.632 -3.592 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -5.516 -12.873 -5.314 1.00 0.00 H new ATOM 653 N ASP A 174 -7.828 -10.786 -3.098 1.00 0.00 N ATOM 654 CA ASP A 174 -8.441 -10.778 -1.780 1.00 0.00 C ATOM 655 C ASP A 174 -7.552 -11.550 -0.803 1.00 0.00 C ATOM 656 O ASP A 174 -6.594 -12.202 -1.213 1.00 0.00 O ATOM 657 CB ASP A 174 -9.814 -11.454 -1.808 1.00 0.00 C ATOM 658 CG ASP A 174 -10.795 -10.966 -0.740 1.00 0.00 C ATOM 659 OD1 ASP A 174 -10.512 -11.218 0.451 1.00 0.00 O ATOM 660 OD2 ASP A 174 -11.808 -10.351 -1.140 1.00 0.00 O ATOM 0 H ASP A 174 -8.358 -11.286 -3.812 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.556 -9.740 -1.468 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.260 -11.296 -2.790 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -9.676 -12.529 -1.690 1.00 0.00 H new ATOM 665 N SER A 175 -7.902 -11.450 0.471 1.00 0.00 N ATOM 666 CA SER A 175 -7.148 -12.131 1.509 1.00 0.00 C ATOM 667 C SER A 175 -7.504 -13.619 1.524 1.00 0.00 C ATOM 668 O SER A 175 -7.434 -14.268 2.566 1.00 0.00 O ATOM 669 CB SER A 175 -7.414 -11.508 2.881 1.00 0.00 C ATOM 670 OG SER A 175 -6.604 -12.090 3.898 1.00 0.00 O ATOM 0 H SER A 175 -8.698 -10.908 0.808 1.00 0.00 H new ATOM 0 HA SER A 175 -6.086 -12.020 1.289 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.223 -10.436 2.835 1.00 0.00 H new ATOM 0 HB3 SER A 175 -8.466 -11.634 3.139 1.00 0.00 H new ATOM 0 HG SER A 175 -6.630 -13.066 3.818 1.00 0.00 H new ATOM 676 N GLU A 176 -7.880 -14.117 0.355 1.00 0.00 N ATOM 677 CA GLU A 176 -8.247 -15.516 0.220 1.00 0.00 C ATOM 678 C GLU A 176 -7.583 -16.122 -1.018 1.00 0.00 C ATOM 679 O GLU A 176 -7.698 -17.321 -1.263 1.00 0.00 O ATOM 680 CB GLU A 176 -9.767 -15.680 0.164 1.00 0.00 C ATOM 681 CG GLU A 176 -10.347 -15.897 1.562 1.00 0.00 C ATOM 682 CD GLU A 176 -11.751 -15.296 1.672 1.00 0.00 C ATOM 683 OE1 GLU A 176 -12.543 -15.529 0.734 1.00 0.00 O ATOM 684 OE2 GLU A 176 -12.000 -14.618 2.693 1.00 0.00 O ATOM 0 H GLU A 176 -7.938 -13.576 -0.508 1.00 0.00 H new ATOM 0 HA GLU A 176 -7.889 -16.053 1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.215 -14.794 -0.286 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.022 -16.526 -0.475 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -10.386 -16.964 1.782 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -9.693 -15.442 2.306 1.00 0.00 H new ATOM 691 N GLY A 177 -6.904 -15.265 -1.765 1.00 0.00 N ATOM 692 CA GLY A 177 -6.221 -15.701 -2.972 1.00 0.00 C ATOM 693 C GLY A 177 -7.095 -15.475 -4.207 1.00 0.00 C ATOM 694 O GLY A 177 -6.642 -15.667 -5.335 1.00 0.00 O ATOM 0 H GLY A 177 -6.812 -14.270 -1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.283 -15.156 -3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -5.968 -16.758 -2.889 1.00 0.00 H new ATOM 698 N LYS A 178 -8.331 -15.071 -3.953 1.00 0.00 N ATOM 699 CA LYS A 178 -9.272 -14.818 -5.031 1.00 0.00 C ATOM 700 C LYS A 178 -8.902 -13.508 -5.729 1.00 0.00 C ATOM 701 O LYS A 178 -8.992 -12.436 -5.133 1.00 0.00 O ATOM 702 CB LYS A 178 -10.709 -14.850 -4.506 1.00 0.00 C ATOM 703 CG LYS A 178 -11.141 -16.280 -4.176 1.00 0.00 C ATOM 704 CD LYS A 178 -12.634 -16.477 -4.443 1.00 0.00 C ATOM 705 CE LYS A 178 -13.445 -16.335 -3.153 1.00 0.00 C ATOM 706 NZ LYS A 178 -13.300 -17.544 -2.314 1.00 0.00 N ATOM 0 H LYS A 178 -8.703 -14.913 -3.016 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.213 -15.607 -5.781 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -10.788 -14.228 -3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.382 -14.426 -5.252 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.565 -16.985 -4.775 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -10.923 -16.497 -3.130 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -12.976 -15.745 -5.174 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -12.803 -17.463 -4.876 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -13.108 -15.459 -2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -14.496 -16.176 -3.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -14.005 -17.523 -1.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -13.448 -18.392 -2.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -12.345 -17.569 -1.903 1.00 0.00 H new ATOM 720 N ARG A 179 -8.491 -13.638 -6.982 1.00 0.00 N ATOM 721 CA ARG A 179 -8.106 -12.477 -7.767 1.00 0.00 C ATOM 722 C ARG A 179 -9.246 -12.065 -8.700 1.00 0.00 C ATOM 723 O ARG A 179 -9.639 -12.828 -9.581 1.00 0.00 O ATOM 724 CB ARG A 179 -6.855 -12.766 -8.600 1.00 0.00 C ATOM 725 CG ARG A 179 -5.745 -13.362 -7.732 1.00 0.00 C ATOM 726 CD ARG A 179 -4.786 -14.208 -8.572 1.00 0.00 C ATOM 727 NE ARG A 179 -4.222 -15.302 -7.749 1.00 0.00 N ATOM 728 CZ ARG A 179 -3.062 -15.918 -8.014 1.00 0.00 C ATOM 729 NH1 ARG A 179 -2.335 -15.552 -9.079 1.00 0.00 N ATOM 730 NH2 ARG A 179 -2.628 -16.900 -7.212 1.00 0.00 N ATOM 0 H ARG A 179 -8.416 -14.529 -7.473 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.888 -11.665 -7.073 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -7.102 -13.457 -9.406 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.503 -11.846 -9.066 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.193 -12.561 -7.240 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -6.184 -13.976 -6.946 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -5.312 -14.623 -9.432 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -3.982 -13.583 -8.961 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.749 -15.605 -6.930 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -2.665 -14.804 -9.689 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -1.452 -16.022 -9.280 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -3.181 -17.178 -6.401 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -1.745 -17.370 -7.413 1.00 0.00 H new ATOM 744 N GLY A 180 -9.747 -10.859 -8.473 1.00 0.00 N ATOM 745 CA GLY A 180 -10.834 -10.337 -9.282 1.00 0.00 C ATOM 746 C GLY A 180 -10.796 -8.808 -9.331 1.00 0.00 C ATOM 747 O GLY A 180 -9.841 -8.192 -8.859 1.00 0.00 O ATOM 0 H GLY A 180 -9.420 -10.229 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.765 -10.739 -10.293 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.788 -10.668 -8.872 1.00 0.00 H new ATOM 751 N MET A 181 -11.846 -8.239 -9.905 1.00 0.00 N ATOM 752 CA MET A 181 -11.944 -6.794 -10.021 1.00 0.00 C ATOM 753 C MET A 181 -12.528 -6.180 -8.747 1.00 0.00 C ATOM 754 O MET A 181 -13.439 -6.745 -8.142 1.00 0.00 O ATOM 755 CB MET A 181 -12.832 -6.437 -11.214 1.00 0.00 C ATOM 756 CG MET A 181 -12.274 -5.231 -11.973 1.00 0.00 C ATOM 757 SD MET A 181 -11.338 -5.782 -13.389 1.00 0.00 S ATOM 758 CE MET A 181 -12.672 -6.241 -14.483 1.00 0.00 C ATOM 0 H MET A 181 -12.636 -8.753 -10.295 1.00 0.00 H new ATOM 0 HA MET A 181 -10.942 -6.391 -10.169 1.00 0.00 H new ATOM 0 HB2 MET A 181 -12.905 -7.292 -11.886 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.842 -6.217 -10.867 1.00 0.00 H new ATOM 0 HG2 MET A 181 -13.090 -4.584 -12.295 1.00 0.00 H new ATOM 0 HG3 MET A 181 -11.639 -4.639 -11.315 1.00 0.00 H new ATOM 0 HE1 MET A 181 -12.317 -6.233 -15.513 1.00 0.00 H new ATOM 0 HE2 MET A 181 -13.024 -7.241 -14.228 1.00 0.00 H new ATOM 0 HE3 MET A 181 -13.491 -5.530 -14.376 1.00 0.00 H new ATOM 768 N ILE A 182 -11.981 -5.031 -8.378 1.00 0.00 N ATOM 769 CA ILE A 182 -12.437 -4.336 -7.187 1.00 0.00 C ATOM 770 C ILE A 182 -12.535 -2.837 -7.484 1.00 0.00 C ATOM 771 O ILE A 182 -11.761 -2.305 -8.278 1.00 0.00 O ATOM 772 CB ILE A 182 -11.537 -4.667 -5.995 1.00 0.00 C ATOM 773 CG1 ILE A 182 -10.196 -3.938 -6.099 1.00 0.00 C ATOM 774 CG2 ILE A 182 -11.357 -6.180 -5.848 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.297 -2.520 -5.532 1.00 0.00 C ATOM 0 H ILE A 182 -11.227 -4.565 -8.882 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.435 -4.674 -6.907 1.00 0.00 H new ATOM 0 HB ILE A 182 -12.027 -4.310 -5.089 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -9.432 -4.496 -5.558 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -9.881 -3.895 -7.142 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.713 -6.388 -4.994 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -12.329 -6.649 -5.693 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -10.901 -6.582 -6.753 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -9.330 -2.024 -5.618 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -11.045 -1.957 -6.091 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.588 -2.568 -4.483 1.00 0.00 H new ATOM 787 N PRO A 183 -13.520 -2.182 -6.812 1.00 0.00 N ATOM 788 CA PRO A 183 -13.730 -0.756 -6.997 1.00 0.00 C ATOM 789 C PRO A 183 -12.652 0.055 -6.276 1.00 0.00 C ATOM 790 O PRO A 183 -12.237 -0.299 -5.173 1.00 0.00 O ATOM 791 CB PRO A 183 -15.128 -0.493 -6.463 1.00 0.00 C ATOM 792 CG PRO A 183 -15.469 -1.682 -5.579 1.00 0.00 C ATOM 793 CD PRO A 183 -14.457 -2.779 -5.865 1.00 0.00 C ATOM 0 HA PRO A 183 -13.652 -0.451 -8.040 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.160 0.437 -5.896 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.845 -0.394 -7.278 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.437 -1.398 -4.527 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.481 -2.033 -5.784 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -13.950 -3.097 -4.954 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -14.938 -3.661 -6.287 1.00 0.00 H new ATOM 801 N VAL A 184 -12.229 1.128 -6.927 1.00 0.00 N ATOM 802 CA VAL A 184 -11.206 1.992 -6.362 1.00 0.00 C ATOM 803 C VAL A 184 -11.858 2.974 -5.385 1.00 0.00 C ATOM 804 O VAL A 184 -11.244 3.369 -4.395 1.00 0.00 O ATOM 805 CB VAL A 184 -10.431 2.689 -7.482 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.505 3.768 -6.918 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.647 1.674 -8.318 1.00 0.00 C ATOM 0 H VAL A 184 -12.576 1.419 -7.841 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.479 1.406 -5.799 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.153 3.177 -8.137 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.966 4.248 -7.735 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.096 4.513 -6.386 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.792 3.313 -6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.105 2.194 -9.107 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -8.939 1.146 -7.679 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.338 0.958 -8.763 1.00 0.00 H new ATOM 817 N PRO A 185 -13.125 3.349 -5.708 1.00 0.00 N ATOM 818 CA PRO A 185 -13.866 4.278 -4.870 1.00 0.00 C ATOM 819 C PRO A 185 -14.356 3.593 -3.593 1.00 0.00 C ATOM 820 O PRO A 185 -14.156 4.106 -2.494 1.00 0.00 O ATOM 821 CB PRO A 185 -15.000 4.779 -5.749 1.00 0.00 C ATOM 822 CG PRO A 185 -15.129 3.772 -6.880 1.00 0.00 C ATOM 823 CD PRO A 185 -13.882 2.902 -6.872 1.00 0.00 C ATOM 0 HA PRO A 185 -13.255 5.109 -4.519 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -15.929 4.852 -5.184 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.783 5.775 -6.136 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.022 3.161 -6.748 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.232 4.283 -7.837 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.137 1.845 -6.796 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.307 3.026 -7.790 1.00 0.00 H new ATOM 831 N TYR A 186 -14.989 2.444 -3.782 1.00 0.00 N ATOM 832 CA TYR A 186 -15.510 1.684 -2.658 1.00 0.00 C ATOM 833 C TYR A 186 -14.388 1.294 -1.693 1.00 0.00 C ATOM 834 O TYR A 186 -14.579 1.302 -0.477 1.00 0.00 O ATOM 835 CB TYR A 186 -16.117 0.413 -3.254 1.00 0.00 C ATOM 836 CG TYR A 186 -17.640 0.332 -3.128 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.429 1.339 -3.647 1.00 0.00 C ATOM 838 CD2 TYR A 186 -18.224 -0.746 -2.497 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.863 1.264 -3.528 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.658 -0.822 -2.378 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.406 0.187 -2.900 1.00 0.00 C ATOM 842 OH TYR A 186 -21.759 0.115 -2.788 1.00 0.00 O ATOM 0 H TYR A 186 -15.153 2.021 -4.696 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.238 2.274 -2.100 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -15.846 0.353 -4.308 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.675 -0.454 -2.762 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -17.971 2.183 -4.142 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -17.606 -1.534 -2.092 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.492 2.045 -3.928 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -20.128 -1.661 -1.886 1.00 0.00 H new ATOM 0 HH TYR A 186 -22.019 -0.797 -2.541 1.00 0.00 H new ATOM 852 N VAL A 187 -13.243 0.961 -2.270 1.00 0.00 N ATOM 853 CA VAL A 187 -12.090 0.570 -1.476 1.00 0.00 C ATOM 854 C VAL A 187 -11.283 1.816 -1.107 1.00 0.00 C ATOM 855 O VAL A 187 -11.578 2.914 -1.579 1.00 0.00 O ATOM 856 CB VAL A 187 -11.266 -0.475 -2.231 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.162 -1.583 -2.787 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.444 0.176 -3.345 1.00 0.00 C ATOM 0 H VAL A 187 -13.089 0.954 -3.278 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.408 0.103 -0.544 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.572 -0.929 -1.524 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.551 -2.312 -3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.683 -2.076 -1.966 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -12.891 -1.152 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -9.868 -0.588 -3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.113 0.669 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -9.765 0.911 -2.914 1.00 0.00 H new ATOM 868 N GLU A 188 -10.281 1.606 -0.268 1.00 0.00 N ATOM 869 CA GLU A 188 -9.429 2.698 0.171 1.00 0.00 C ATOM 870 C GLU A 188 -7.968 2.246 0.216 1.00 0.00 C ATOM 871 O GLU A 188 -7.671 1.070 0.010 1.00 0.00 O ATOM 872 CB GLU A 188 -9.880 3.234 1.531 1.00 0.00 C ATOM 873 CG GLU A 188 -9.787 4.760 1.578 1.00 0.00 C ATOM 874 CD GLU A 188 -11.161 5.387 1.818 1.00 0.00 C ATOM 875 OE1 GLU A 188 -11.955 5.400 0.852 1.00 0.00 O ATOM 876 OE2 GLU A 188 -11.387 5.837 2.961 1.00 0.00 O ATOM 0 H GLU A 188 -10.039 0.694 0.120 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.515 3.512 -0.549 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -10.906 2.923 1.726 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -9.261 2.804 2.319 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.102 5.062 2.371 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.373 5.131 0.641 1.00 0.00 H new ATOM 883 N LYS A 189 -7.094 3.205 0.486 1.00 0.00 N ATOM 884 CA LYS A 189 -5.670 2.920 0.562 1.00 0.00 C ATOM 885 C LYS A 189 -5.313 2.507 1.990 1.00 0.00 C ATOM 886 O LYS A 189 -5.526 3.268 2.933 1.00 0.00 O ATOM 887 CB LYS A 189 -4.859 4.108 0.044 1.00 0.00 C ATOM 888 CG LYS A 189 -4.335 3.840 -1.369 1.00 0.00 C ATOM 889 CD LYS A 189 -3.926 5.144 -2.059 1.00 0.00 C ATOM 890 CE LYS A 189 -2.764 4.910 -3.026 1.00 0.00 C ATOM 891 NZ LYS A 189 -1.490 5.369 -2.427 1.00 0.00 N ATOM 0 H LYS A 189 -7.344 4.179 0.655 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.413 2.082 -0.086 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.480 5.004 0.042 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.022 4.302 0.715 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -3.480 3.166 -1.322 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -5.104 3.339 -1.957 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -4.778 5.556 -2.601 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -3.638 5.881 -1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -2.696 3.850 -3.272 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -2.947 5.443 -3.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -0.712 5.203 -3.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -1.553 6.385 -2.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -1.310 4.842 -1.549 1.00 0.00 H new ATOM 905 N TYR A 190 -4.774 1.302 2.107 1.00 0.00 N ATOM 906 CA TYR A 190 -4.384 0.778 3.405 1.00 0.00 C ATOM 907 C TYR A 190 -3.120 -0.077 3.294 1.00 0.00 C ATOM 908 O TYR A 190 -3.098 -1.067 2.566 1.00 0.00 O ATOM 909 CB TYR A 190 -5.543 -0.105 3.868 1.00 0.00 C ATOM 910 CG TYR A 190 -5.269 -0.857 5.173 1.00 0.00 C ATOM 911 CD1 TYR A 190 -4.671 -2.101 5.139 1.00 0.00 C ATOM 912 CD2 TYR A 190 -5.621 -0.294 6.381 1.00 0.00 C ATOM 913 CE1 TYR A 190 -4.412 -2.809 6.366 1.00 0.00 C ATOM 914 CE2 TYR A 190 -5.363 -1.001 7.609 1.00 0.00 C ATOM 915 CZ TYR A 190 -4.771 -2.224 7.540 1.00 0.00 C ATOM 916 OH TYR A 190 -4.528 -2.893 8.699 1.00 0.00 O ATOM 0 H TYR A 190 -4.598 0.673 1.323 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.174 1.591 4.100 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -6.430 0.515 3.997 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -5.771 -0.828 3.085 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.398 -2.543 4.192 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -6.091 0.678 6.407 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -3.944 -3.782 6.354 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -5.633 -0.571 8.562 1.00 0.00 H new ATOM 0 HH TYR A 190 -4.836 -2.355 9.458 1.00 0.00 H new