USER MOD reduce.3.24.130724 H: found=0, std=0, add=398, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 400 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= -0.462 X(o=-0.46,f=-0.1!) USER MOD Single : A 171 ASN :FLIP amide:sc= 0.54 F(o=-1.6,f=0.54) USER MOD Single : A 175 SER OG : rot 45:sc= 0.0645 USER MOD Single : A 178 LYS NZ :NH3+ -161:sc= -0.0209 (180deg=-0.463) USER MOD Single : A 181 MET CE :methyl 180:sc= -3.89 (180deg=-3.89) USER MOD Single : A 186 TYR OH : rot -60:sc= 0.8 USER MOD Single : A 189 LYS NZ :NH3+ -163:sc= 0.0529 (180deg=0.00304) USER MOD ----------------------------------------------------------------- ATOM 26 N TYR A 136 4.833 3.596 -0.042 1.00 0.00 N ATOM 27 CA TYR A 136 6.012 4.026 0.690 1.00 0.00 C ATOM 28 C TYR A 136 6.564 2.893 1.555 1.00 0.00 C ATOM 29 O TYR A 136 5.869 2.381 2.432 1.00 0.00 O ATOM 30 CB TYR A 136 5.551 5.168 1.598 1.00 0.00 C ATOM 31 CG TYR A 136 4.896 6.331 0.851 1.00 0.00 C ATOM 32 CD1 TYR A 136 5.636 7.087 -0.034 1.00 0.00 C ATOM 33 CD2 TYR A 136 3.565 6.626 1.065 1.00 0.00 C ATOM 34 CE1 TYR A 136 5.019 8.182 -0.737 1.00 0.00 C ATOM 35 CE2 TYR A 136 2.948 7.721 0.362 1.00 0.00 C ATOM 36 CZ TYR A 136 3.706 8.445 -0.504 1.00 0.00 C ATOM 37 OH TYR A 136 3.123 9.480 -1.168 1.00 0.00 O ATOM 0 HA TYR A 136 6.801 4.331 0.002 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.844 4.775 2.329 1.00 0.00 H new ATOM 0 HB3 TYR A 136 6.409 5.545 2.155 1.00 0.00 H new ATOM 0 HD1 TYR A 136 6.678 6.858 -0.200 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.986 6.036 1.760 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.587 8.781 -1.434 1.00 0.00 H new ATOM 0 HE2 TYR A 136 1.907 7.962 0.519 1.00 0.00 H new ATOM 0 HH TYR A 136 2.182 9.550 -0.903 1.00 0.00 H new ATOM 47 N VAL A 137 7.809 2.532 1.279 1.00 0.00 N ATOM 48 CA VAL A 137 8.462 1.467 2.021 1.00 0.00 C ATOM 49 C VAL A 137 9.869 1.917 2.418 1.00 0.00 C ATOM 50 O VAL A 137 10.523 2.649 1.676 1.00 0.00 O ATOM 51 CB VAL A 137 8.455 0.176 1.201 1.00 0.00 C ATOM 52 CG1 VAL A 137 7.027 -0.318 0.967 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.194 0.366 -0.125 1.00 0.00 C ATOM 0 H VAL A 137 8.383 2.958 0.551 1.00 0.00 H new ATOM 0 HA VAL A 137 7.918 1.253 2.941 1.00 0.00 H new ATOM 0 HB VAL A 137 8.983 -0.587 1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 137 7.051 -1.237 0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.547 -0.511 1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.463 0.442 0.426 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.175 -0.566 -0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.707 1.151 -0.704 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.228 0.649 0.072 1.00 0.00 H new ATOM 63 N ARG A 138 10.295 1.461 3.586 1.00 0.00 N ATOM 64 CA ARG A 138 11.613 1.808 4.091 1.00 0.00 C ATOM 65 C ARG A 138 12.420 0.540 4.380 1.00 0.00 C ATOM 66 O ARG A 138 11.850 -0.510 4.670 1.00 0.00 O ATOM 67 CB ARG A 138 11.512 2.643 5.368 1.00 0.00 C ATOM 68 CG ARG A 138 10.145 2.467 6.032 1.00 0.00 C ATOM 69 CD ARG A 138 9.889 3.571 7.061 1.00 0.00 C ATOM 70 NE ARG A 138 9.559 4.838 6.370 1.00 0.00 N ATOM 71 CZ ARG A 138 9.517 6.033 6.975 1.00 0.00 C ATOM 72 NH1 ARG A 138 9.783 6.132 8.284 1.00 0.00 N ATOM 73 NH2 ARG A 138 9.208 7.130 6.269 1.00 0.00 N ATOM 0 H ARG A 138 9.751 0.853 4.198 1.00 0.00 H new ATOM 0 HA ARG A 138 12.117 2.398 3.325 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.298 2.348 6.063 1.00 0.00 H new ATOM 0 HB3 ARG A 138 11.673 3.695 5.132 1.00 0.00 H new ATOM 0 HG2 ARG A 138 9.363 2.484 5.273 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.096 1.493 6.519 1.00 0.00 H new ATOM 0 HD2 ARG A 138 9.070 3.283 7.721 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.770 3.707 7.688 1.00 0.00 H new ATOM 0 HE ARG A 138 9.351 4.799 5.372 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.018 5.297 8.821 1.00 0.00 H new ATOM 0 HH12 ARG A 138 9.751 7.042 8.744 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.005 7.055 5.272 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.176 8.040 6.729 1.00 0.00 H new ATOM 87 N ALA A 139 13.735 0.681 4.292 1.00 0.00 N ATOM 88 CA ALA A 139 14.626 -0.439 4.541 1.00 0.00 C ATOM 89 C ALA A 139 15.389 -0.197 5.845 1.00 0.00 C ATOM 90 O ALA A 139 16.277 0.652 5.901 1.00 0.00 O ATOM 91 CB ALA A 139 15.561 -0.624 3.344 1.00 0.00 C ATOM 0 H ALA A 139 14.204 1.554 4.052 1.00 0.00 H new ATOM 0 HA ALA A 139 14.059 -1.363 4.657 1.00 0.00 H new ATOM 0 HB1 ALA A 139 16.230 -1.464 3.531 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.971 -0.822 2.449 1.00 0.00 H new ATOM 0 HB3 ALA A 139 16.149 0.282 3.198 1.00 0.00 H new ATOM 97 N LEU A 140 15.016 -0.959 6.862 1.00 0.00 N ATOM 98 CA LEU A 140 15.654 -0.839 8.162 1.00 0.00 C ATOM 99 C LEU A 140 16.595 -2.027 8.376 1.00 0.00 C ATOM 100 O LEU A 140 16.915 -2.372 9.512 1.00 0.00 O ATOM 101 CB LEU A 140 14.603 -0.681 9.263 1.00 0.00 C ATOM 102 CG LEU A 140 13.143 -0.802 8.819 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.838 -2.215 8.317 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.192 -0.374 9.938 1.00 0.00 C ATOM 0 H LEU A 140 14.279 -1.663 6.812 1.00 0.00 H new ATOM 0 HA LEU A 140 16.264 0.063 8.204 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.793 -1.433 10.029 1.00 0.00 H new ATOM 0 HB3 LEU A 140 14.740 0.294 9.732 1.00 0.00 H new ATOM 0 HG LEU A 140 12.983 -0.121 7.983 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.794 -2.274 8.008 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.482 -2.446 7.468 1.00 0.00 H new ATOM 0 HD13 LEU A 140 13.020 -2.933 9.117 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.161 -0.470 9.596 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.346 -1.010 10.809 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.390 0.664 10.207 1.00 0.00 H new ATOM 116 N PHE A 141 17.009 -2.619 7.265 1.00 0.00 N ATOM 117 CA PHE A 141 17.907 -3.760 7.316 1.00 0.00 C ATOM 118 C PHE A 141 19.189 -3.486 6.527 1.00 0.00 C ATOM 119 O PHE A 141 20.173 -4.211 6.663 1.00 0.00 O ATOM 120 CB PHE A 141 17.170 -4.938 6.677 1.00 0.00 C ATOM 121 CG PHE A 141 17.483 -6.292 7.319 1.00 0.00 C ATOM 122 CD1 PHE A 141 18.718 -6.842 7.174 1.00 0.00 C ATOM 123 CD2 PHE A 141 16.526 -6.943 8.033 1.00 0.00 C ATOM 124 CE1 PHE A 141 19.008 -8.098 7.770 1.00 0.00 C ATOM 125 CE2 PHE A 141 16.817 -8.198 8.628 1.00 0.00 C ATOM 126 CZ PHE A 141 18.052 -8.750 8.485 1.00 0.00 C ATOM 0 H PHE A 141 16.739 -2.330 6.325 1.00 0.00 H new ATOM 0 HA PHE A 141 18.187 -3.967 8.349 1.00 0.00 H new ATOM 0 HB2 PHE A 141 16.097 -4.758 6.738 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.426 -4.982 5.618 1.00 0.00 H new ATOM 0 HD1 PHE A 141 19.477 -6.324 6.606 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.545 -6.505 8.147 1.00 0.00 H new ATOM 0 HE1 PHE A 141 19.989 -8.536 7.655 1.00 0.00 H new ATOM 0 HE2 PHE A 141 16.057 -8.715 9.195 1.00 0.00 H new ATOM 0 HZ PHE A 141 18.273 -9.705 8.939 1.00 0.00 H new ATOM 136 N ASP A 142 19.134 -2.438 5.719 1.00 0.00 N ATOM 137 CA ASP A 142 20.279 -2.059 4.907 1.00 0.00 C ATOM 138 C ASP A 142 20.672 -3.233 4.008 1.00 0.00 C ATOM 139 O ASP A 142 20.558 -4.391 4.407 1.00 0.00 O ATOM 140 CB ASP A 142 21.484 -1.710 5.783 1.00 0.00 C ATOM 141 CG ASP A 142 21.192 -0.737 6.926 1.00 0.00 C ATOM 142 OD1 ASP A 142 20.029 -0.286 7.005 1.00 0.00 O ATOM 143 OD2 ASP A 142 22.138 -0.466 7.697 1.00 0.00 O ATOM 0 H ASP A 142 18.316 -1.839 5.609 1.00 0.00 H new ATOM 0 HA ASP A 142 19.999 -1.188 4.315 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.887 -2.631 6.204 1.00 0.00 H new ATOM 0 HB3 ASP A 142 22.262 -1.281 5.151 1.00 0.00 H new ATOM 148 N PHE A 143 21.128 -2.893 2.811 1.00 0.00 N ATOM 149 CA PHE A 143 21.539 -3.906 1.852 1.00 0.00 C ATOM 150 C PHE A 143 22.521 -3.326 0.831 1.00 0.00 C ATOM 151 O PHE A 143 23.662 -3.776 0.739 1.00 0.00 O ATOM 152 CB PHE A 143 20.276 -4.368 1.122 1.00 0.00 C ATOM 153 CG PHE A 143 20.508 -4.747 -0.342 1.00 0.00 C ATOM 154 CD1 PHE A 143 21.284 -5.821 -0.652 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.938 -4.011 -1.333 1.00 0.00 C ATOM 156 CE1 PHE A 143 21.499 -6.172 -2.011 1.00 0.00 C ATOM 157 CE2 PHE A 143 20.153 -4.363 -2.692 1.00 0.00 C ATOM 158 CZ PHE A 143 20.929 -5.435 -3.003 1.00 0.00 C ATOM 0 H PHE A 143 21.222 -1.932 2.483 1.00 0.00 H new ATOM 0 HA PHE A 143 22.035 -4.729 2.367 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.859 -5.227 1.647 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.531 -3.574 1.168 1.00 0.00 H new ATOM 0 HD1 PHE A 143 21.736 -6.406 0.135 1.00 0.00 H new ATOM 0 HD2 PHE A 143 19.322 -3.159 -1.087 1.00 0.00 H new ATOM 0 HE1 PHE A 143 22.115 -7.024 -2.257 1.00 0.00 H new ATOM 0 HE2 PHE A 143 19.700 -3.779 -3.479 1.00 0.00 H new ATOM 0 HZ PHE A 143 21.093 -5.702 -4.037 1.00 0.00 H new ATOM 245 N ASP A 150 18.541 -4.929 -7.967 1.00 0.00 N ATOM 246 CA ASP A 150 17.621 -4.519 -6.920 1.00 0.00 C ATOM 247 C ASP A 150 17.888 -3.057 -6.556 1.00 0.00 C ATOM 248 O ASP A 150 18.776 -2.424 -7.127 1.00 0.00 O ATOM 249 CB ASP A 150 17.810 -5.362 -5.658 1.00 0.00 C ATOM 250 CG ASP A 150 17.864 -6.873 -5.892 1.00 0.00 C ATOM 251 OD1 ASP A 150 16.848 -7.409 -6.384 1.00 0.00 O ATOM 252 OD2 ASP A 150 18.923 -7.459 -5.573 1.00 0.00 O ATOM 0 HA ASP A 150 16.606 -4.652 -7.293 1.00 0.00 H new ATOM 0 HB2 ASP A 150 18.733 -5.052 -5.167 1.00 0.00 H new ATOM 0 HB3 ASP A 150 16.994 -5.145 -4.969 1.00 0.00 H new ATOM 257 N LEU A 151 17.105 -2.563 -5.608 1.00 0.00 N ATOM 258 CA LEU A 151 17.247 -1.188 -5.162 1.00 0.00 C ATOM 259 C LEU A 151 17.999 -1.164 -3.829 1.00 0.00 C ATOM 260 O LEU A 151 17.609 -1.843 -2.881 1.00 0.00 O ATOM 261 CB LEU A 151 15.882 -0.498 -5.111 1.00 0.00 C ATOM 262 CG LEU A 151 15.651 0.444 -3.927 1.00 0.00 C ATOM 263 CD1 LEU A 151 16.599 1.643 -3.986 1.00 0.00 C ATOM 264 CD2 LEU A 151 14.185 0.875 -3.849 1.00 0.00 C ATOM 0 H LEU A 151 16.370 -3.091 -5.137 1.00 0.00 H new ATOM 0 HA LEU A 151 17.841 -0.615 -5.874 1.00 0.00 H new ATOM 0 HB2 LEU A 151 15.749 0.069 -6.032 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.109 -1.266 -5.095 1.00 0.00 H new ATOM 0 HG LEU A 151 15.877 -0.099 -3.009 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.413 2.296 -3.133 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.631 1.293 -3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.429 2.196 -4.910 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.047 1.544 -2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.909 1.393 -4.767 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.553 -0.005 -3.725 1.00 0.00 H new ATOM 276 N PRO A 152 19.090 -0.354 -3.800 1.00 0.00 N ATOM 277 CA PRO A 152 19.899 -0.232 -2.598 1.00 0.00 C ATOM 278 C PRO A 152 19.193 0.623 -1.546 1.00 0.00 C ATOM 279 O PRO A 152 18.563 1.627 -1.876 1.00 0.00 O ATOM 280 CB PRO A 152 21.213 0.371 -3.069 1.00 0.00 C ATOM 281 CG PRO A 152 20.924 0.992 -4.426 1.00 0.00 C ATOM 282 CD PRO A 152 19.581 0.465 -4.903 1.00 0.00 C ATOM 0 HA PRO A 152 20.068 -1.190 -2.106 1.00 0.00 H new ATOM 0 HB2 PRO A 152 21.573 1.121 -2.365 1.00 0.00 H new ATOM 0 HB3 PRO A 152 21.988 -0.392 -3.146 1.00 0.00 H new ATOM 0 HG2 PRO A 152 20.903 2.079 -4.352 1.00 0.00 H new ATOM 0 HG3 PRO A 152 21.709 0.736 -5.138 1.00 0.00 H new ATOM 0 HD2 PRO A 152 18.893 1.280 -5.127 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.688 -0.122 -5.815 1.00 0.00 H new ATOM 290 N PHE A 153 19.320 0.194 -0.298 1.00 0.00 N ATOM 291 CA PHE A 153 18.701 0.908 0.806 1.00 0.00 C ATOM 292 C PHE A 153 19.383 0.564 2.132 1.00 0.00 C ATOM 293 O PHE A 153 20.135 -0.404 2.214 1.00 0.00 O ATOM 294 CB PHE A 153 17.240 0.461 0.866 1.00 0.00 C ATOM 295 CG PHE A 153 17.054 -1.058 0.854 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.546 -1.810 1.874 1.00 0.00 C ATOM 297 CD2 PHE A 153 16.395 -1.656 -0.175 1.00 0.00 C ATOM 298 CE1 PHE A 153 17.374 -3.220 1.865 1.00 0.00 C ATOM 299 CE2 PHE A 153 16.222 -3.065 -0.184 1.00 0.00 C ATOM 300 CZ PHE A 153 16.715 -3.818 0.835 1.00 0.00 C ATOM 0 H PHE A 153 19.843 -0.639 -0.027 1.00 0.00 H new ATOM 0 HA PHE A 153 18.790 1.983 0.650 1.00 0.00 H new ATOM 0 HB2 PHE A 153 16.784 0.866 1.769 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.704 0.889 0.019 1.00 0.00 H new ATOM 0 HD1 PHE A 153 18.068 -1.335 2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 153 16.003 -1.059 -0.985 1.00 0.00 H new ATOM 0 HE1 PHE A 153 17.766 -3.817 2.675 1.00 0.00 H new ATOM 0 HE2 PHE A 153 15.698 -3.539 -1.001 1.00 0.00 H new ATOM 0 HZ PHE A 153 16.584 -4.890 0.827 1.00 0.00 H new ATOM 310 N LYS A 154 19.094 1.377 3.137 1.00 0.00 N ATOM 311 CA LYS A 154 19.668 1.171 4.456 1.00 0.00 C ATOM 312 C LYS A 154 19.272 2.334 5.368 1.00 0.00 C ATOM 313 O LYS A 154 18.920 3.411 4.890 1.00 0.00 O ATOM 314 CB LYS A 154 21.180 0.957 4.353 1.00 0.00 C ATOM 315 CG LYS A 154 21.827 2.027 3.472 1.00 0.00 C ATOM 316 CD LYS A 154 23.347 2.031 3.640 1.00 0.00 C ATOM 317 CE LYS A 154 23.783 3.077 4.668 1.00 0.00 C ATOM 318 NZ LYS A 154 24.960 2.600 5.426 1.00 0.00 N ATOM 0 H LYS A 154 18.469 2.180 3.065 1.00 0.00 H new ATOM 0 HA LYS A 154 19.270 0.262 4.908 1.00 0.00 H new ATOM 0 HB2 LYS A 154 21.623 0.984 5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 154 21.384 -0.031 3.940 1.00 0.00 H new ATOM 0 HG2 LYS A 154 21.574 1.845 2.428 1.00 0.00 H new ATOM 0 HG3 LYS A 154 21.427 3.007 3.731 1.00 0.00 H new ATOM 0 HD2 LYS A 154 23.684 1.044 3.955 1.00 0.00 H new ATOM 0 HD3 LYS A 154 23.822 2.239 2.681 1.00 0.00 H new ATOM 0 HE2 LYS A 154 24.023 4.013 4.164 1.00 0.00 H new ATOM 0 HE3 LYS A 154 22.962 3.286 5.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 25.242 3.322 6.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 24.719 1.719 5.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 25.747 2.423 4.770 1.00 0.00 H new ATOM 332 N LYS A 155 19.343 2.077 6.666 1.00 0.00 N ATOM 333 CA LYS A 155 18.996 3.089 7.649 1.00 0.00 C ATOM 334 C LYS A 155 17.530 3.487 7.470 1.00 0.00 C ATOM 335 O LYS A 155 17.185 4.664 7.570 1.00 0.00 O ATOM 336 CB LYS A 155 19.967 4.268 7.570 1.00 0.00 C ATOM 337 CG LYS A 155 20.346 4.761 8.968 1.00 0.00 C ATOM 338 CD LYS A 155 19.202 5.561 9.595 1.00 0.00 C ATOM 339 CE LYS A 155 18.300 4.658 10.438 1.00 0.00 C ATOM 340 NZ LYS A 155 17.239 5.454 11.095 1.00 0.00 N ATOM 0 H LYS A 155 19.636 1.183 7.060 1.00 0.00 H new ATOM 0 HA LYS A 155 19.097 2.690 8.658 1.00 0.00 H new ATOM 0 HB2 LYS A 155 20.865 3.968 7.030 1.00 0.00 H new ATOM 0 HB3 LYS A 155 19.512 5.081 7.005 1.00 0.00 H new ATOM 0 HG2 LYS A 155 20.591 3.910 9.604 1.00 0.00 H new ATOM 0 HG3 LYS A 155 21.240 5.382 8.909 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.609 6.358 10.218 1.00 0.00 H new ATOM 0 HD3 LYS A 155 18.614 6.038 8.811 1.00 0.00 H new ATOM 0 HE2 LYS A 155 17.850 3.892 9.807 1.00 0.00 H new ATOM 0 HE3 LYS A 155 18.895 4.141 11.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 16.635 4.826 11.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 17.674 6.169 11.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 16.661 5.927 10.371 1.00 0.00 H new ATOM 354 N GLY A 156 16.705 2.483 7.208 1.00 0.00 N ATOM 355 CA GLY A 156 15.284 2.714 7.013 1.00 0.00 C ATOM 356 C GLY A 156 15.038 3.670 5.844 1.00 0.00 C ATOM 357 O GLY A 156 14.171 4.539 5.920 1.00 0.00 O ATOM 0 H GLY A 156 16.994 1.508 7.126 1.00 0.00 H new ATOM 0 HA2 GLY A 156 14.781 1.766 6.824 1.00 0.00 H new ATOM 0 HA3 GLY A 156 14.851 3.129 7.923 1.00 0.00 H new ATOM 361 N ASP A 157 15.817 3.477 4.790 1.00 0.00 N ATOM 362 CA ASP A 157 15.695 4.311 3.606 1.00 0.00 C ATOM 363 C ASP A 157 14.219 4.438 3.228 1.00 0.00 C ATOM 364 O ASP A 157 13.462 3.474 3.331 1.00 0.00 O ATOM 365 CB ASP A 157 16.436 3.694 2.419 1.00 0.00 C ATOM 366 CG ASP A 157 16.237 4.417 1.086 1.00 0.00 C ATOM 367 OD1 ASP A 157 15.073 4.772 0.801 1.00 0.00 O ATOM 368 OD2 ASP A 157 17.253 4.598 0.381 1.00 0.00 O ATOM 0 H ASP A 157 16.535 2.755 4.731 1.00 0.00 H new ATOM 0 HA ASP A 157 16.127 5.285 3.833 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.502 3.671 2.647 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.112 2.659 2.306 1.00 0.00 H new ATOM 373 N ILE A 158 13.852 5.637 2.798 1.00 0.00 N ATOM 374 CA ILE A 158 12.480 5.903 2.402 1.00 0.00 C ATOM 375 C ILE A 158 12.347 5.732 0.888 1.00 0.00 C ATOM 376 O ILE A 158 13.086 6.349 0.122 1.00 0.00 O ATOM 377 CB ILE A 158 12.034 7.277 2.907 1.00 0.00 C ATOM 378 CG1 ILE A 158 10.552 7.267 3.288 1.00 0.00 C ATOM 379 CG2 ILE A 158 12.355 8.368 1.883 1.00 0.00 C ATOM 380 CD1 ILE A 158 9.675 6.967 2.071 1.00 0.00 C ATOM 0 H ILE A 158 14.482 6.435 2.715 1.00 0.00 H new ATOM 0 HA ILE A 158 11.804 5.183 2.864 1.00 0.00 H new ATOM 0 HB ILE A 158 12.597 7.508 3.811 1.00 0.00 H new ATOM 0 HG12 ILE A 158 10.377 6.518 4.061 1.00 0.00 H new ATOM 0 HG13 ILE A 158 10.275 8.233 3.711 1.00 0.00 H new ATOM 0 HG21 ILE A 158 12.028 9.334 2.266 1.00 0.00 H new ATOM 0 HG22 ILE A 158 13.430 8.394 1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 158 11.836 8.154 0.949 1.00 0.00 H new ATOM 0 HD11 ILE A 158 8.627 6.966 2.369 1.00 0.00 H new ATOM 0 HD12 ILE A 158 9.835 7.731 1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 158 9.938 5.990 1.665 1.00 0.00 H new ATOM 392 N LEU A 159 11.399 4.889 0.501 1.00 0.00 N ATOM 393 CA LEU A 159 11.160 4.629 -0.907 1.00 0.00 C ATOM 394 C LEU A 159 9.653 4.554 -1.159 1.00 0.00 C ATOM 395 O LEU A 159 8.857 4.733 -0.239 1.00 0.00 O ATOM 396 CB LEU A 159 11.920 3.380 -1.358 1.00 0.00 C ATOM 397 CG LEU A 159 13.129 2.986 -0.505 1.00 0.00 C ATOM 398 CD1 LEU A 159 12.880 1.662 0.218 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.405 2.948 -1.348 1.00 0.00 C ATOM 0 H LEU A 159 10.789 4.378 1.139 1.00 0.00 H new ATOM 0 HA LEU A 159 11.546 5.447 -1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.224 2.542 -1.375 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.258 3.535 -2.383 1.00 0.00 H new ATOM 0 HG LEU A 159 13.272 3.749 0.260 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.754 1.405 0.817 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.011 1.760 0.868 1.00 0.00 H new ATOM 0 HD13 LEU A 159 12.698 0.876 -0.515 1.00 0.00 H new ATOM 0 HD21 LEU A 159 15.249 2.666 -0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.290 2.218 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.587 3.933 -1.778 1.00 0.00 H new ATOM 411 N ARG A 160 9.306 4.290 -2.410 1.00 0.00 N ATOM 412 CA ARG A 160 7.908 4.191 -2.795 1.00 0.00 C ATOM 413 C ARG A 160 7.680 2.940 -3.645 1.00 0.00 C ATOM 414 O ARG A 160 8.557 2.531 -4.403 1.00 0.00 O ATOM 415 CB ARG A 160 7.465 5.423 -3.585 1.00 0.00 C ATOM 416 CG ARG A 160 8.057 5.413 -4.995 1.00 0.00 C ATOM 417 CD ARG A 160 7.079 4.795 -5.997 1.00 0.00 C ATOM 418 NE ARG A 160 7.752 4.582 -7.297 1.00 0.00 N ATOM 419 CZ ARG A 160 7.675 5.433 -8.330 1.00 0.00 C ATOM 420 NH1 ARG A 160 6.956 6.559 -8.220 1.00 0.00 N ATOM 421 NH2 ARG A 160 8.319 5.159 -9.473 1.00 0.00 N ATOM 0 H ARG A 160 9.969 4.141 -3.171 1.00 0.00 H new ATOM 0 HA ARG A 160 7.316 4.128 -1.882 1.00 0.00 H new ATOM 0 HB2 ARG A 160 6.377 5.450 -3.644 1.00 0.00 H new ATOM 0 HB3 ARG A 160 7.778 6.327 -3.062 1.00 0.00 H new ATOM 0 HG2 ARG A 160 8.299 6.431 -5.299 1.00 0.00 H new ATOM 0 HG3 ARG A 160 8.990 4.849 -4.997 1.00 0.00 H new ATOM 0 HD2 ARG A 160 6.703 3.846 -5.613 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.217 5.450 -6.127 1.00 0.00 H new ATOM 0 HE ARG A 160 8.309 3.736 -7.415 1.00 0.00 H new ATOM 0 HH11 ARG A 160 6.467 6.769 -7.350 1.00 0.00 H new ATOM 0 HH12 ARG A 160 6.898 7.206 -9.006 1.00 0.00 H new ATOM 0 HH21 ARG A 160 8.868 4.303 -9.557 1.00 0.00 H new ATOM 0 HH22 ARG A 160 8.261 5.806 -10.259 1.00 0.00 H new ATOM 435 N ILE A 161 6.495 2.366 -3.489 1.00 0.00 N ATOM 436 CA ILE A 161 6.140 1.168 -4.233 1.00 0.00 C ATOM 437 C ILE A 161 5.537 1.571 -5.580 1.00 0.00 C ATOM 438 O ILE A 161 4.523 2.265 -5.627 1.00 0.00 O ATOM 439 CB ILE A 161 5.229 0.268 -3.396 1.00 0.00 C ATOM 440 CG1 ILE A 161 5.954 -1.015 -2.985 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.920 -0.023 -4.132 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.266 -0.698 -2.266 1.00 0.00 C ATOM 0 H ILE A 161 5.769 2.708 -2.859 1.00 0.00 H new ATOM 0 HA ILE A 161 7.028 0.573 -4.445 1.00 0.00 H new ATOM 0 HB ILE A 161 4.971 0.799 -2.480 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.312 -1.607 -2.333 1.00 0.00 H new ATOM 0 HG13 ILE A 161 6.157 -1.621 -3.868 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.291 -0.665 -3.515 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.399 0.913 -4.331 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.137 -0.525 -5.075 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.761 -1.628 -1.985 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.916 -0.127 -2.929 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.058 -0.113 -1.370 1.00 0.00 H new ATOM 454 N ARG A 162 6.188 1.118 -6.642 1.00 0.00 N ATOM 455 CA ARG A 162 5.729 1.423 -7.987 1.00 0.00 C ATOM 456 C ARG A 162 5.020 0.209 -8.593 1.00 0.00 C ATOM 457 O ARG A 162 3.929 0.334 -9.146 1.00 0.00 O ATOM 458 CB ARG A 162 6.896 1.827 -8.889 1.00 0.00 C ATOM 459 CG ARG A 162 6.503 1.742 -10.365 1.00 0.00 C ATOM 460 CD ARG A 162 7.544 2.430 -11.250 1.00 0.00 C ATOM 461 NE ARG A 162 7.902 1.551 -12.386 1.00 0.00 N ATOM 462 CZ ARG A 162 7.221 1.499 -13.539 1.00 0.00 C ATOM 463 NH1 ARG A 162 6.143 2.273 -13.716 1.00 0.00 N ATOM 464 NH2 ARG A 162 7.619 0.671 -14.516 1.00 0.00 N ATOM 0 H ARG A 162 7.029 0.543 -6.598 1.00 0.00 H new ATOM 0 HA ARG A 162 5.032 2.259 -7.919 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.210 2.843 -8.650 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.750 1.177 -8.698 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.404 0.697 -10.659 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.529 2.209 -10.513 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.150 3.376 -11.621 1.00 0.00 H new ATOM 0 HD3 ARG A 162 8.434 2.663 -10.665 1.00 0.00 H new ATOM 0 HE ARG A 162 8.718 0.947 -12.285 1.00 0.00 H new ATOM 0 HH11 ARG A 162 5.840 2.903 -12.973 1.00 0.00 H new ATOM 0 HH12 ARG A 162 5.625 2.233 -14.594 1.00 0.00 H new ATOM 0 HH21 ARG A 162 8.440 0.081 -14.381 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.101 0.631 -15.394 1.00 0.00 H new ATOM 478 N ASP A 163 5.672 -0.939 -8.470 1.00 0.00 N ATOM 479 CA ASP A 163 5.118 -2.174 -8.998 1.00 0.00 C ATOM 480 C ASP A 163 5.573 -3.346 -8.125 1.00 0.00 C ATOM 481 O ASP A 163 6.477 -3.199 -7.304 1.00 0.00 O ATOM 482 CB ASP A 163 5.608 -2.430 -10.425 1.00 0.00 C ATOM 483 CG ASP A 163 4.633 -2.009 -11.528 1.00 0.00 C ATOM 484 OD1 ASP A 163 3.415 -2.047 -11.252 1.00 0.00 O ATOM 485 OD2 ASP A 163 5.129 -1.661 -12.621 1.00 0.00 O ATOM 0 H ASP A 163 6.578 -1.039 -8.013 1.00 0.00 H new ATOM 0 HA ASP A 163 4.032 -2.084 -8.999 1.00 0.00 H new ATOM 0 HB2 ASP A 163 6.549 -1.900 -10.571 1.00 0.00 H new ATOM 0 HB3 ASP A 163 5.821 -3.493 -10.535 1.00 0.00 H new ATOM 490 N LYS A 164 4.924 -4.482 -8.333 1.00 0.00 N ATOM 491 CA LYS A 164 5.251 -5.679 -7.576 1.00 0.00 C ATOM 492 C LYS A 164 5.112 -6.904 -8.481 1.00 0.00 C ATOM 493 O LYS A 164 4.004 -7.383 -8.718 1.00 0.00 O ATOM 494 CB LYS A 164 4.404 -5.755 -6.304 1.00 0.00 C ATOM 495 CG LYS A 164 2.911 -5.695 -6.635 1.00 0.00 C ATOM 496 CD LYS A 164 2.166 -6.886 -6.028 1.00 0.00 C ATOM 497 CE LYS A 164 1.811 -7.916 -7.102 1.00 0.00 C ATOM 498 NZ LYS A 164 0.736 -8.814 -6.623 1.00 0.00 N ATOM 0 H LYS A 164 4.174 -4.599 -9.014 1.00 0.00 H new ATOM 0 HA LYS A 164 6.288 -5.647 -7.241 1.00 0.00 H new ATOM 0 HB2 LYS A 164 4.625 -6.679 -5.770 1.00 0.00 H new ATOM 0 HB3 LYS A 164 4.666 -4.932 -5.639 1.00 0.00 H new ATOM 0 HG2 LYS A 164 2.488 -4.765 -6.255 1.00 0.00 H new ATOM 0 HG3 LYS A 164 2.775 -5.689 -7.716 1.00 0.00 H new ATOM 0 HD2 LYS A 164 2.784 -7.353 -5.261 1.00 0.00 H new ATOM 0 HD3 LYS A 164 1.257 -6.539 -5.537 1.00 0.00 H new ATOM 0 HE2 LYS A 164 1.490 -7.407 -8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 164 2.694 -8.501 -7.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 0.507 -9.507 -7.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 1.056 -9.313 -5.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -0.111 -8.253 -6.400 1.00 0.00 H new ATOM 512 N PRO A 165 6.283 -7.389 -8.977 1.00 0.00 N ATOM 513 CA PRO A 165 6.302 -8.549 -9.851 1.00 0.00 C ATOM 514 C PRO A 165 6.064 -9.836 -9.060 1.00 0.00 C ATOM 515 O PRO A 165 5.192 -10.631 -9.407 1.00 0.00 O ATOM 516 CB PRO A 165 7.663 -8.510 -10.527 1.00 0.00 C ATOM 517 CG PRO A 165 8.529 -7.602 -9.667 1.00 0.00 C ATOM 518 CD PRO A 165 7.612 -6.846 -8.719 1.00 0.00 C ATOM 0 HA PRO A 165 5.503 -8.530 -10.592 1.00 0.00 H new ATOM 0 HB2 PRO A 165 8.093 -9.509 -10.597 1.00 0.00 H new ATOM 0 HB3 PRO A 165 7.583 -8.126 -11.544 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.258 -8.188 -9.107 1.00 0.00 H new ATOM 0 HG3 PRO A 165 9.090 -6.907 -10.291 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.906 -6.996 -7.680 1.00 0.00 H new ATOM 0 HD3 PRO A 165 7.645 -5.773 -8.908 1.00 0.00 H new ATOM 526 N GLU A 166 6.855 -10.002 -8.010 1.00 0.00 N ATOM 527 CA GLU A 166 6.741 -11.180 -7.166 1.00 0.00 C ATOM 528 C GLU A 166 6.036 -10.827 -5.855 1.00 0.00 C ATOM 529 O GLU A 166 5.544 -9.711 -5.691 1.00 0.00 O ATOM 530 CB GLU A 166 8.116 -11.798 -6.900 1.00 0.00 C ATOM 531 CG GLU A 166 8.941 -11.875 -8.187 1.00 0.00 C ATOM 532 CD GLU A 166 9.858 -13.099 -8.176 1.00 0.00 C ATOM 533 OE1 GLU A 166 10.723 -13.153 -7.276 1.00 0.00 O ATOM 534 OE2 GLU A 166 9.673 -13.954 -9.069 1.00 0.00 O ATOM 0 H GLU A 166 7.577 -9.341 -7.724 1.00 0.00 H new ATOM 0 HA GLU A 166 6.140 -11.923 -7.691 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.648 -11.203 -6.158 1.00 0.00 H new ATOM 0 HB3 GLU A 166 7.995 -12.797 -6.481 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.275 -11.923 -9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 166 9.538 -10.970 -8.296 1.00 0.00 H new ATOM 541 N GLU A 167 6.009 -11.799 -4.955 1.00 0.00 N ATOM 542 CA GLU A 167 5.372 -11.604 -3.663 1.00 0.00 C ATOM 543 C GLU A 167 6.425 -11.545 -2.555 1.00 0.00 C ATOM 544 O GLU A 167 6.094 -11.632 -1.373 1.00 0.00 O ATOM 545 CB GLU A 167 4.347 -12.706 -3.387 1.00 0.00 C ATOM 546 CG GLU A 167 2.990 -12.361 -4.004 1.00 0.00 C ATOM 547 CD GLU A 167 1.935 -13.402 -3.626 1.00 0.00 C ATOM 548 OE1 GLU A 167 1.528 -13.394 -2.444 1.00 0.00 O ATOM 549 OE2 GLU A 167 1.560 -14.182 -4.528 1.00 0.00 O ATOM 0 H GLU A 167 6.417 -12.723 -5.094 1.00 0.00 H new ATOM 0 HA GLU A 167 4.840 -10.653 -3.682 1.00 0.00 H new ATOM 0 HB2 GLU A 167 4.706 -13.651 -3.794 1.00 0.00 H new ATOM 0 HB3 GLU A 167 4.237 -12.844 -2.311 1.00 0.00 H new ATOM 0 HG2 GLU A 167 2.672 -11.376 -3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 167 3.082 -12.309 -5.089 1.00 0.00 H new ATOM 556 N GLN A 168 7.673 -11.396 -2.976 1.00 0.00 N ATOM 557 CA GLN A 168 8.777 -11.323 -2.034 1.00 0.00 C ATOM 558 C GLN A 168 9.564 -10.027 -2.237 1.00 0.00 C ATOM 559 O GLN A 168 9.950 -9.374 -1.270 1.00 0.00 O ATOM 560 CB GLN A 168 9.690 -12.545 -2.164 1.00 0.00 C ATOM 561 CG GLN A 168 11.061 -12.273 -1.542 1.00 0.00 C ATOM 562 CD GLN A 168 12.002 -13.461 -1.750 1.00 0.00 C ATOM 563 OE1 GLN A 168 12.884 -13.448 -2.593 1.00 0.00 O ATOM 564 NE2 GLN A 168 11.766 -14.488 -0.937 1.00 0.00 N ATOM 0 H GLN A 168 7.944 -11.324 -3.957 1.00 0.00 H new ATOM 0 HA GLN A 168 8.367 -11.322 -1.024 1.00 0.00 H new ATOM 0 HB2 GLN A 168 9.228 -13.402 -1.674 1.00 0.00 H new ATOM 0 HB3 GLN A 168 9.809 -12.804 -3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 168 11.495 -11.378 -1.987 1.00 0.00 H new ATOM 0 HG3 GLN A 168 10.948 -12.076 -0.476 1.00 0.00 H new ATOM 0 HE21 GLN A 168 11.011 -14.434 -0.253 1.00 0.00 H new ATOM 0 HE22 GLN A 168 12.340 -15.329 -0.998 1.00 0.00 H new ATOM 573 N TRP A 169 9.777 -9.695 -3.501 1.00 0.00 N ATOM 574 CA TRP A 169 10.511 -8.488 -3.844 1.00 0.00 C ATOM 575 C TRP A 169 9.538 -7.517 -4.514 1.00 0.00 C ATOM 576 O TRP A 169 8.772 -7.907 -5.394 1.00 0.00 O ATOM 577 CB TRP A 169 11.725 -8.813 -4.716 1.00 0.00 C ATOM 578 CG TRP A 169 12.910 -9.394 -3.941 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.096 -10.662 -3.548 1.00 0.00 C ATOM 580 CD2 TRP A 169 14.072 -8.674 -3.480 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.289 -10.811 -2.869 1.00 0.00 N ATOM 582 CE2 TRP A 169 14.901 -9.563 -2.826 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.412 -7.317 -3.611 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.123 -9.193 -2.252 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.637 -6.962 -3.031 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.482 -7.844 -2.370 1.00 0.00 C ATOM 0 H TRP A 169 9.455 -10.240 -4.301 1.00 0.00 H new ATOM 0 HA TRP A 169 10.914 -8.015 -2.948 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.426 -9.522 -5.488 1.00 0.00 H new ATOM 0 HB3 TRP A 169 12.047 -7.905 -5.225 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.400 -11.466 -3.738 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.654 -11.677 -2.472 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.779 -6.604 -4.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.754 -9.908 -1.746 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 15.946 -5.930 -3.103 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.412 -7.491 -1.949 1.00 0.00 H new ATOM 597 N TRP A 170 9.599 -6.269 -4.071 1.00 0.00 N ATOM 598 CA TRP A 170 8.731 -5.239 -4.617 1.00 0.00 C ATOM 599 C TRP A 170 9.609 -4.217 -5.343 1.00 0.00 C ATOM 600 O TRP A 170 10.711 -3.908 -4.891 1.00 0.00 O ATOM 601 CB TRP A 170 7.867 -4.612 -3.521 1.00 0.00 C ATOM 602 CG TRP A 170 6.809 -5.556 -2.946 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.476 -6.781 -3.375 1.00 0.00 C ATOM 604 CD2 TRP A 170 5.954 -5.300 -1.812 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.472 -7.331 -2.605 1.00 0.00 N ATOM 606 CE2 TRP A 170 5.145 -6.402 -1.624 1.00 0.00 C ATOM 607 CE3 TRP A 170 5.866 -4.175 -0.974 1.00 0.00 C ATOM 608 CZ2 TRP A 170 4.192 -6.487 -0.603 1.00 0.00 C ATOM 609 CZ3 TRP A 170 4.908 -4.276 0.042 1.00 0.00 C ATOM 610 CH2 TRP A 170 4.087 -5.378 0.246 1.00 0.00 C ATOM 0 H TRP A 170 10.235 -5.948 -3.341 1.00 0.00 H new ATOM 0 HA TRP A 170 8.029 -5.666 -5.333 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.514 -4.272 -2.712 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.371 -3.729 -3.924 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.936 -7.276 -4.218 1.00 0.00 H new ATOM 0 HE1 TRP A 170 5.048 -8.250 -2.732 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.488 -3.302 -1.104 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.571 -7.361 -0.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 4.800 -3.438 0.715 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.372 -5.380 1.055 1.00 0.00 H new ATOM 621 N ASN A 171 9.089 -3.722 -6.456 1.00 0.00 N ATOM 622 CA ASN A 171 9.811 -2.742 -7.249 1.00 0.00 C ATOM 623 C ASN A 171 9.423 -1.334 -6.791 1.00 0.00 C ATOM 624 O ASN A 171 8.427 -0.781 -7.254 1.00 0.00 O ATOM 625 CB ASN A 171 9.463 -2.869 -8.733 1.00 0.00 C ATOM 626 CG ASN A 171 10.447 -2.079 -9.598 1.00 0.00 C ATOM 627 OD1 ASN A 171 9.971 -0.917 -10.035 1.00 0.00 O flip ATOM 628 ND2 ASN A 171 11.566 -2.496 -9.850 1.00 0.00 N flip ATOM 0 H ASN A 171 8.175 -3.982 -6.828 1.00 0.00 H new ATOM 0 HA ASN A 171 10.878 -2.919 -7.112 1.00 0.00 H new ATOM 0 HB2 ASN A 171 9.479 -3.919 -9.025 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.450 -2.506 -8.905 1.00 0.00 H new ATOM 0 HD21 ASN A 171 11.869 -3.398 -9.482 1.00 0.00 H new ATOM 0 HD22 ASN A 171 12.198 -1.943 -10.428 1.00 0.00 H new ATOM 635 N ALA A 172 10.229 -0.797 -5.887 1.00 0.00 N ATOM 636 CA ALA A 172 9.982 0.534 -5.362 1.00 0.00 C ATOM 637 C ALA A 172 11.075 1.484 -5.855 1.00 0.00 C ATOM 638 O ALA A 172 12.134 1.041 -6.298 1.00 0.00 O ATOM 639 CB ALA A 172 9.906 0.475 -3.835 1.00 0.00 C ATOM 0 H ALA A 172 11.054 -1.260 -5.505 1.00 0.00 H new ATOM 0 HA ALA A 172 9.027 0.916 -5.721 1.00 0.00 H new ATOM 0 HB1 ALA A 172 9.721 1.474 -3.441 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.095 -0.189 -3.536 1.00 0.00 H new ATOM 0 HB3 ALA A 172 10.848 0.098 -3.438 1.00 0.00 H new ATOM 645 N GLU A 173 10.781 2.772 -5.764 1.00 0.00 N ATOM 646 CA GLU A 173 11.727 3.788 -6.195 1.00 0.00 C ATOM 647 C GLU A 173 12.393 4.443 -4.984 1.00 0.00 C ATOM 648 O GLU A 173 11.720 4.799 -4.017 1.00 0.00 O ATOM 649 CB GLU A 173 11.042 4.835 -7.076 1.00 0.00 C ATOM 650 CG GLU A 173 11.528 4.736 -8.523 1.00 0.00 C ATOM 651 CD GLU A 173 11.067 5.945 -9.341 1.00 0.00 C ATOM 652 OE1 GLU A 173 10.172 6.660 -8.840 1.00 0.00 O ATOM 653 OE2 GLU A 173 11.619 6.126 -10.447 1.00 0.00 O ATOM 0 H GLU A 173 9.901 3.136 -5.398 1.00 0.00 H new ATOM 0 HA GLU A 173 12.500 3.306 -6.793 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.962 4.694 -7.041 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.246 5.833 -6.687 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.616 4.674 -8.541 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.149 3.820 -8.976 1.00 0.00 H new ATOM 660 N ASP A 174 13.708 4.580 -5.074 1.00 0.00 N ATOM 661 CA ASP A 174 14.472 5.186 -3.997 1.00 0.00 C ATOM 662 C ASP A 174 14.273 6.702 -4.025 1.00 0.00 C ATOM 663 O ASP A 174 13.759 7.246 -5.000 1.00 0.00 O ATOM 664 CB ASP A 174 15.968 4.902 -4.157 1.00 0.00 C ATOM 665 CG ASP A 174 16.779 4.963 -2.861 1.00 0.00 C ATOM 666 OD1 ASP A 174 16.549 5.921 -2.092 1.00 0.00 O ATOM 667 OD2 ASP A 174 17.612 4.050 -2.670 1.00 0.00 O ATOM 0 H ASP A 174 14.263 4.282 -5.876 1.00 0.00 H new ATOM 0 HA ASP A 174 14.122 4.762 -3.056 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.090 3.913 -4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.385 5.620 -4.863 1.00 0.00 H new ATOM 672 N SER A 175 14.689 7.342 -2.941 1.00 0.00 N ATOM 673 CA SER A 175 14.561 8.785 -2.830 1.00 0.00 C ATOM 674 C SER A 175 15.241 9.464 -4.021 1.00 0.00 C ATOM 675 O SER A 175 14.972 10.629 -4.312 1.00 0.00 O ATOM 676 CB SER A 175 15.163 9.290 -1.516 1.00 0.00 C ATOM 677 OG SER A 175 14.348 8.961 -0.395 1.00 0.00 O ATOM 0 H SER A 175 15.114 6.888 -2.133 1.00 0.00 H new ATOM 0 HA SER A 175 13.500 9.037 -2.834 1.00 0.00 H new ATOM 0 HB2 SER A 175 16.155 8.859 -1.382 1.00 0.00 H new ATOM 0 HB3 SER A 175 15.290 10.371 -1.567 1.00 0.00 H new ATOM 0 HG SER A 175 14.054 8.029 -0.466 1.00 0.00 H new ATOM 683 N GLU A 176 16.108 8.707 -4.677 1.00 0.00 N ATOM 684 CA GLU A 176 16.828 9.220 -5.830 1.00 0.00 C ATOM 685 C GLU A 176 15.967 9.099 -7.090 1.00 0.00 C ATOM 686 O GLU A 176 16.212 9.785 -8.082 1.00 0.00 O ATOM 687 CB GLU A 176 18.165 8.501 -6.007 1.00 0.00 C ATOM 688 CG GLU A 176 19.039 8.653 -4.760 1.00 0.00 C ATOM 689 CD GLU A 176 20.306 7.804 -4.873 1.00 0.00 C ATOM 690 OE1 GLU A 176 21.108 8.097 -5.786 1.00 0.00 O ATOM 691 OE2 GLU A 176 20.446 6.879 -4.043 1.00 0.00 O ATOM 0 H GLU A 176 16.328 7.742 -4.432 1.00 0.00 H new ATOM 0 HA GLU A 176 17.042 10.275 -5.660 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.990 7.444 -6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.688 8.906 -6.873 1.00 0.00 H new ATOM 0 HG2 GLU A 176 19.309 9.700 -4.626 1.00 0.00 H new ATOM 0 HG3 GLU A 176 18.474 8.354 -3.877 1.00 0.00 H new ATOM 698 N GLY A 177 14.979 8.220 -7.010 1.00 0.00 N ATOM 699 CA GLY A 177 14.082 7.999 -8.132 1.00 0.00 C ATOM 700 C GLY A 177 14.521 6.786 -8.955 1.00 0.00 C ATOM 701 O GLY A 177 14.232 6.702 -10.147 1.00 0.00 O ATOM 0 H GLY A 177 14.780 7.653 -6.186 1.00 0.00 H new ATOM 0 HA2 GLY A 177 13.067 7.846 -7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 177 14.062 8.885 -8.766 1.00 0.00 H new ATOM 705 N LYS A 178 15.212 5.876 -8.284 1.00 0.00 N ATOM 706 CA LYS A 178 15.694 4.670 -8.938 1.00 0.00 C ATOM 707 C LYS A 178 14.706 3.529 -8.686 1.00 0.00 C ATOM 708 O LYS A 178 14.457 3.161 -7.540 1.00 0.00 O ATOM 709 CB LYS A 178 17.124 4.355 -8.495 1.00 0.00 C ATOM 710 CG LYS A 178 17.286 4.552 -6.986 1.00 0.00 C ATOM 711 CD LYS A 178 18.307 3.568 -6.411 1.00 0.00 C ATOM 712 CE LYS A 178 19.736 4.048 -6.669 1.00 0.00 C ATOM 713 NZ LYS A 178 20.203 3.597 -7.999 1.00 0.00 N ATOM 0 H LYS A 178 15.450 5.949 -7.295 1.00 0.00 H new ATOM 0 HA LYS A 178 15.745 4.816 -10.017 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.373 3.327 -8.760 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.824 5.000 -9.027 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.605 5.574 -6.781 1.00 0.00 H new ATOM 0 HG3 LYS A 178 16.324 4.414 -6.492 1.00 0.00 H new ATOM 0 HD2 LYS A 178 18.145 3.456 -5.339 1.00 0.00 H new ATOM 0 HD3 LYS A 178 18.163 2.585 -6.860 1.00 0.00 H new ATOM 0 HE2 LYS A 178 19.776 5.136 -6.613 1.00 0.00 H new ATOM 0 HE3 LYS A 178 20.400 3.664 -5.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 21.242 3.640 -8.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 19.891 2.619 -8.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 19.805 4.215 -8.735 1.00 0.00 H new ATOM 727 N ARG A 179 14.170 3.001 -9.777 1.00 0.00 N ATOM 728 CA ARG A 179 13.216 1.910 -9.689 1.00 0.00 C ATOM 729 C ARG A 179 13.947 0.568 -9.631 1.00 0.00 C ATOM 730 O ARG A 179 14.591 0.165 -10.598 1.00 0.00 O ATOM 731 CB ARG A 179 12.264 1.913 -10.888 1.00 0.00 C ATOM 732 CG ARG A 179 12.173 3.306 -11.512 1.00 0.00 C ATOM 733 CD ARG A 179 10.850 3.486 -12.259 1.00 0.00 C ATOM 734 NE ARG A 179 10.954 4.619 -13.206 1.00 0.00 N ATOM 735 CZ ARG A 179 10.181 4.764 -14.291 1.00 0.00 C ATOM 736 NH1 ARG A 179 9.244 3.849 -14.574 1.00 0.00 N ATOM 737 NH2 ARG A 179 10.345 5.825 -15.094 1.00 0.00 N ATOM 0 H ARG A 179 14.379 3.309 -10.727 1.00 0.00 H new ATOM 0 HA ARG A 179 12.635 2.050 -8.777 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.611 1.198 -11.634 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.273 1.587 -10.571 1.00 0.00 H new ATOM 0 HG2 ARG A 179 12.261 4.064 -10.733 1.00 0.00 H new ATOM 0 HG3 ARG A 179 13.006 3.456 -12.199 1.00 0.00 H new ATOM 0 HD2 ARG A 179 10.600 2.572 -12.798 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.043 3.668 -11.549 1.00 0.00 H new ATOM 0 HE ARG A 179 11.658 5.334 -13.021 1.00 0.00 H new ATOM 0 HH11 ARG A 179 9.119 3.042 -13.963 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.656 3.960 -15.400 1.00 0.00 H new ATOM 0 HH21 ARG A 179 11.058 6.522 -14.879 1.00 0.00 H new ATOM 0 HH22 ARG A 179 9.757 5.935 -15.920 1.00 0.00 H new ATOM 751 N GLY A 180 13.825 -0.087 -8.486 1.00 0.00 N ATOM 752 CA GLY A 180 14.467 -1.376 -8.289 1.00 0.00 C ATOM 753 C GLY A 180 13.649 -2.256 -7.341 1.00 0.00 C ATOM 754 O GLY A 180 12.663 -1.804 -6.763 1.00 0.00 O ATOM 0 H GLY A 180 13.291 0.251 -7.685 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.583 -1.879 -9.249 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.468 -1.230 -7.883 1.00 0.00 H new ATOM 758 N MET A 181 14.091 -3.499 -7.210 1.00 0.00 N ATOM 759 CA MET A 181 13.412 -4.447 -6.342 1.00 0.00 C ATOM 760 C MET A 181 13.939 -4.351 -4.910 1.00 0.00 C ATOM 761 O MET A 181 15.126 -4.110 -4.695 1.00 0.00 O ATOM 762 CB MET A 181 13.626 -5.866 -6.872 1.00 0.00 C ATOM 763 CG MET A 181 13.494 -5.909 -8.395 1.00 0.00 C ATOM 764 SD MET A 181 11.960 -5.148 -8.897 1.00 0.00 S ATOM 765 CE MET A 181 10.810 -6.083 -7.902 1.00 0.00 C ATOM 0 H MET A 181 14.910 -3.871 -7.690 1.00 0.00 H new ATOM 0 HA MET A 181 12.348 -4.209 -6.334 1.00 0.00 H new ATOM 0 HB2 MET A 181 14.614 -6.222 -6.579 1.00 0.00 H new ATOM 0 HB3 MET A 181 12.897 -6.540 -6.421 1.00 0.00 H new ATOM 0 HG2 MET A 181 14.335 -5.390 -8.856 1.00 0.00 H new ATOM 0 HG3 MET A 181 13.528 -6.942 -8.742 1.00 0.00 H new ATOM 0 HE1 MET A 181 9.795 -5.734 -8.094 1.00 0.00 H new ATOM 0 HE2 MET A 181 10.884 -7.140 -8.157 1.00 0.00 H new ATOM 0 HE3 MET A 181 11.047 -5.947 -6.847 1.00 0.00 H new ATOM 775 N ILE A 182 13.031 -4.547 -3.965 1.00 0.00 N ATOM 776 CA ILE A 182 13.388 -4.487 -2.558 1.00 0.00 C ATOM 777 C ILE A 182 12.637 -5.581 -1.797 1.00 0.00 C ATOM 778 O ILE A 182 11.578 -6.029 -2.234 1.00 0.00 O ATOM 779 CB ILE A 182 13.151 -3.080 -2.005 1.00 0.00 C ATOM 780 CG1 ILE A 182 11.688 -2.663 -2.174 1.00 0.00 C ATOM 781 CG2 ILE A 182 14.111 -2.072 -2.640 1.00 0.00 C ATOM 782 CD1 ILE A 182 11.276 -1.660 -1.096 1.00 0.00 C ATOM 0 H ILE A 182 12.048 -4.748 -4.147 1.00 0.00 H new ATOM 0 HA ILE A 182 14.452 -4.682 -2.427 1.00 0.00 H new ATOM 0 HB ILE A 182 13.360 -3.094 -0.935 1.00 0.00 H new ATOM 0 HG12 ILE A 182 11.543 -2.222 -3.160 1.00 0.00 H new ATOM 0 HG13 ILE A 182 11.047 -3.543 -2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 182 13.921 -1.080 -2.229 1.00 0.00 H new ATOM 0 HG22 ILE A 182 15.139 -2.363 -2.425 1.00 0.00 H new ATOM 0 HG23 ILE A 182 13.958 -2.053 -3.719 1.00 0.00 H new ATOM 0 HD11 ILE A 182 10.232 -1.380 -1.239 1.00 0.00 H new ATOM 0 HD12 ILE A 182 11.399 -2.113 -0.112 1.00 0.00 H new ATOM 0 HD13 ILE A 182 11.903 -0.771 -1.167 1.00 0.00 H new ATOM 794 N PRO A 183 13.229 -5.989 -0.643 1.00 0.00 N ATOM 795 CA PRO A 183 12.627 -7.023 0.182 1.00 0.00 C ATOM 796 C PRO A 183 11.424 -6.477 0.953 1.00 0.00 C ATOM 797 O PRO A 183 11.428 -5.325 1.384 1.00 0.00 O ATOM 798 CB PRO A 183 13.747 -7.502 1.091 1.00 0.00 C ATOM 799 CG PRO A 183 14.802 -6.408 1.065 1.00 0.00 C ATOM 800 CD PRO A 183 14.483 -5.481 -0.096 1.00 0.00 C ATOM 0 HA PRO A 183 12.227 -7.850 -0.405 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.383 -7.669 2.105 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.157 -8.449 0.740 1.00 0.00 H new ATOM 0 HG2 PRO A 183 14.803 -5.856 2.005 1.00 0.00 H new ATOM 0 HG3 PRO A 183 15.796 -6.839 0.947 1.00 0.00 H new ATOM 0 HD2 PRO A 183 14.380 -4.449 0.239 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.276 -5.496 -0.844 1.00 0.00 H new ATOM 808 N VAL A 184 10.421 -7.330 1.103 1.00 0.00 N ATOM 809 CA VAL A 184 9.213 -6.947 1.815 1.00 0.00 C ATOM 810 C VAL A 184 9.504 -6.897 3.315 1.00 0.00 C ATOM 811 O VAL A 184 9.021 -6.009 4.016 1.00 0.00 O ATOM 812 CB VAL A 184 8.072 -7.902 1.458 1.00 0.00 C ATOM 813 CG1 VAL A 184 6.879 -7.705 2.397 1.00 0.00 C ATOM 814 CG2 VAL A 184 7.654 -7.737 -0.003 1.00 0.00 C ATOM 0 H VAL A 184 10.420 -8.285 0.744 1.00 0.00 H new ATOM 0 HA VAL A 184 8.891 -5.950 1.514 1.00 0.00 H new ATOM 0 HB VAL A 184 8.436 -8.921 1.587 1.00 0.00 H new ATOM 0 HG11 VAL A 184 6.082 -8.396 2.122 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.189 -7.899 3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 184 6.516 -6.680 2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 184 6.842 -8.428 -0.229 1.00 0.00 H new ATOM 0 HG22 VAL A 184 7.318 -6.714 -0.172 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.504 -7.952 -0.651 1.00 0.00 H new ATOM 824 N PRO A 185 10.314 -7.887 3.778 1.00 0.00 N ATOM 825 CA PRO A 185 10.675 -7.965 5.182 1.00 0.00 C ATOM 826 C PRO A 185 11.716 -6.900 5.540 1.00 0.00 C ATOM 827 O PRO A 185 11.390 -5.898 6.174 1.00 0.00 O ATOM 828 CB PRO A 185 11.186 -9.383 5.380 1.00 0.00 C ATOM 829 CG PRO A 185 11.526 -9.901 3.993 1.00 0.00 C ATOM 830 CD PRO A 185 10.905 -8.956 2.977 1.00 0.00 C ATOM 0 HA PRO A 185 9.833 -7.763 5.844 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.063 -9.395 6.027 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.430 -10.008 5.856 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.607 -9.950 3.858 1.00 0.00 H new ATOM 0 HG3 PRO A 185 11.142 -10.912 3.858 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.655 -8.567 2.288 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.151 -9.462 2.374 1.00 0.00 H new ATOM 838 N TYR A 186 12.946 -7.154 5.117 1.00 0.00 N ATOM 839 CA TYR A 186 14.034 -6.231 5.385 1.00 0.00 C ATOM 840 C TYR A 186 13.534 -4.785 5.410 1.00 0.00 C ATOM 841 O TYR A 186 14.042 -3.961 6.169 1.00 0.00 O ATOM 842 CB TYR A 186 15.022 -6.396 4.228 1.00 0.00 C ATOM 843 CG TYR A 186 16.248 -7.243 4.573 1.00 0.00 C ATOM 844 CD1 TYR A 186 16.090 -8.467 5.190 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.512 -6.784 4.265 1.00 0.00 C ATOM 846 CE1 TYR A 186 17.244 -9.265 5.515 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.667 -7.581 4.589 1.00 0.00 C ATOM 848 CZ TYR A 186 18.476 -8.782 5.198 1.00 0.00 C ATOM 849 OH TYR A 186 19.566 -9.535 5.504 1.00 0.00 O ATOM 0 H TYR A 186 13.212 -7.986 4.591 1.00 0.00 H new ATOM 0 HA TYR A 186 14.486 -6.442 6.354 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.504 -6.852 3.384 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.354 -5.410 3.904 1.00 0.00 H new ATOM 0 HD1 TYR A 186 15.100 -8.827 5.429 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.635 -5.827 3.781 1.00 0.00 H new ATOM 0 HE1 TYR A 186 17.134 -10.224 5.999 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.662 -7.233 4.354 1.00 0.00 H new ATOM 0 HH TYR A 186 19.596 -9.690 6.471 1.00 0.00 H new ATOM 859 N VAL A 187 12.543 -4.522 4.571 1.00 0.00 N ATOM 860 CA VAL A 187 11.969 -3.189 4.487 1.00 0.00 C ATOM 861 C VAL A 187 10.531 -3.225 5.010 1.00 0.00 C ATOM 862 O VAL A 187 9.989 -4.297 5.273 1.00 0.00 O ATOM 863 CB VAL A 187 12.070 -2.665 3.053 1.00 0.00 C ATOM 864 CG1 VAL A 187 13.328 -3.194 2.364 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.816 -3.016 2.251 1.00 0.00 C ATOM 0 H VAL A 187 12.123 -5.208 3.944 1.00 0.00 H new ATOM 0 HA VAL A 187 12.526 -2.493 5.113 1.00 0.00 H new ATOM 0 HB VAL A 187 12.145 -1.578 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 187 13.376 -2.807 1.346 1.00 0.00 H new ATOM 0 HG12 VAL A 187 14.209 -2.870 2.917 1.00 0.00 H new ATOM 0 HG13 VAL A 187 13.297 -4.283 2.337 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.914 -2.632 1.236 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.696 -4.099 2.219 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.943 -2.568 2.726 1.00 0.00 H new ATOM 875 N GLU A 188 9.954 -2.040 5.145 1.00 0.00 N ATOM 876 CA GLU A 188 8.590 -1.922 5.632 1.00 0.00 C ATOM 877 C GLU A 188 7.821 -0.885 4.811 1.00 0.00 C ATOM 878 O GLU A 188 8.285 -0.456 3.755 1.00 0.00 O ATOM 879 CB GLU A 188 8.568 -1.570 7.120 1.00 0.00 C ATOM 880 CG GLU A 188 9.896 -0.948 7.557 1.00 0.00 C ATOM 881 CD GLU A 188 9.693 0.008 8.735 1.00 0.00 C ATOM 882 OE1 GLU A 188 9.161 -0.465 9.762 1.00 0.00 O ATOM 883 OE2 GLU A 188 10.074 1.188 8.580 1.00 0.00 O ATOM 0 H GLU A 188 10.406 -1.153 4.925 1.00 0.00 H new ATOM 0 HA GLU A 188 8.098 -2.887 5.514 1.00 0.00 H new ATOM 0 HB2 GLU A 188 7.753 -0.874 7.321 1.00 0.00 H new ATOM 0 HB3 GLU A 188 8.372 -2.468 7.707 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.595 -1.735 7.839 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.342 -0.410 6.721 1.00 0.00 H new ATOM 890 N LYS A 189 6.660 -0.511 5.328 1.00 0.00 N ATOM 891 CA LYS A 189 5.822 0.468 4.656 1.00 0.00 C ATOM 892 C LYS A 189 5.976 1.824 5.347 1.00 0.00 C ATOM 893 O LYS A 189 6.799 1.975 6.249 1.00 0.00 O ATOM 894 CB LYS A 189 4.376 -0.024 4.583 1.00 0.00 C ATOM 895 CG LYS A 189 3.948 -0.255 3.133 1.00 0.00 C ATOM 896 CD LYS A 189 4.202 -1.703 2.708 1.00 0.00 C ATOM 897 CE LYS A 189 2.958 -2.312 2.059 1.00 0.00 C ATOM 898 NZ LYS A 189 2.732 -1.724 0.720 1.00 0.00 N ATOM 0 H LYS A 189 6.280 -0.868 6.204 1.00 0.00 H new ATOM 0 HA LYS A 189 6.142 0.598 3.622 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.275 -0.951 5.148 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.715 0.707 5.049 1.00 0.00 H new ATOM 0 HG2 LYS A 189 2.889 -0.020 3.021 1.00 0.00 H new ATOM 0 HG3 LYS A 189 4.496 0.421 2.477 1.00 0.00 H new ATOM 0 HD2 LYS A 189 5.036 -1.739 2.007 1.00 0.00 H new ATOM 0 HD3 LYS A 189 4.490 -2.295 3.577 1.00 0.00 H new ATOM 0 HE2 LYS A 189 3.077 -3.392 1.973 1.00 0.00 H new ATOM 0 HE3 LYS A 189 2.088 -2.137 2.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 1.757 -1.918 0.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 2.883 -0.696 0.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 3.397 -2.144 0.040 1.00 0.00 H new