USER MOD reduce.3.24.130724 H: found=0, std=0, add=626, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 627 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 157 MET CE :methyl 143:sc= -1.07 (180deg=-3.36!) USER MOD Set 1.2: A 226 THR OG1 : rot 180:sc=-0.00257 USER MOD Set 2.1: A 177 GLN : amide:sc= -2! C(o=-2!,f=-3.4!) USER MOD Set 2.2: A 212 HIS : no HD1:sc= 0 X(o=-2,f=-2.2) USER MOD Set 3.1: A 155 CYS SG : rot -130:sc= -0.0407 USER MOD Set 3.2: A 191 SER OG : rot -122:sc= -0.643 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 143:sc= -0.265 (180deg=-1.52!) USER MOD Single : A 162 SER OG : rot -137:sc= -2.23 USER MOD Single : A 164 TYR OH : rot 150:sc= 0 USER MOD Single : A 167 ASN :FLIP amide:sc= -0.0182 F(o=-1.2,f=-0.018) USER MOD Single : A 169 HIS :FLIP no HD1:sc= -1.7! C(o=-2.7!,f=-1.7!) USER MOD Single : A 170 SER OG : rot 136:sc= 1.18 USER MOD Single : A 172 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0164) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 186 SER OG : rot -138:sc= -1.78 USER MOD Single : A 196 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 203 ASN : amide:sc= -0.755 X(o=-0.75,f=-0.39) USER MOD Single : A 206 CYS SG : rot 180:sc= 0 USER MOD Single : A 207 MET CE :methyl -161:sc= -0.195 (180deg=-0.781) USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 GLN :FLIP amide:sc=-0.00161 F(o=-2.3,f=-0.0016) USER MOD Single : A 217 SER OG : rot 83:sc= 0.741 USER MOD Single : A 227 LYS NZ :NH3+ -107:sc= 0.961 (180deg=-0.272) USER MOD ----------------------------------------------------------------- ATOM 125 N ARG A 151 13.038 1.216 1.994 1.00 0.00 N ATOM 126 CA ARG A 151 12.454 0.131 2.770 1.00 0.00 C ATOM 127 C ARG A 151 10.952 0.344 2.974 1.00 0.00 C ATOM 128 O ARG A 151 10.446 1.457 2.833 1.00 0.00 O ATOM 129 CB ARG A 151 13.175 -0.010 4.120 1.00 0.00 C ATOM 130 CG ARG A 151 12.732 0.986 5.184 1.00 0.00 C ATOM 131 CD ARG A 151 13.094 0.501 6.581 1.00 0.00 C ATOM 132 NE ARG A 151 12.744 -0.903 6.784 1.00 0.00 N ATOM 133 CZ ARG A 151 13.290 -1.677 7.721 1.00 0.00 C ATOM 134 NH1 ARG A 151 14.214 -1.189 8.540 1.00 0.00 N ATOM 135 NH2 ARG A 151 12.910 -2.942 7.837 1.00 0.00 N ATOM 0 HA ARG A 151 12.584 -0.795 2.210 1.00 0.00 H new ATOM 0 HB2 ARG A 151 13.016 -1.020 4.498 1.00 0.00 H new ATOM 0 HB3 ARG A 151 14.247 0.104 3.958 1.00 0.00 H new ATOM 0 HG2 ARG A 151 13.202 1.952 4.999 1.00 0.00 H new ATOM 0 HG3 ARG A 151 11.655 1.138 5.117 1.00 0.00 H new ATOM 0 HD2 ARG A 151 14.163 0.635 6.745 1.00 0.00 H new ATOM 0 HD3 ARG A 151 12.579 1.113 7.321 1.00 0.00 H new ATOM 0 HE ARG A 151 12.040 -1.315 6.172 1.00 0.00 H new ATOM 0 HH11 ARG A 151 14.510 -0.217 8.454 1.00 0.00 H new ATOM 0 HH12 ARG A 151 14.628 -1.787 9.255 1.00 0.00 H new ATOM 0 HH21 ARG A 151 12.201 -3.321 7.209 1.00 0.00 H new ATOM 0 HH22 ARG A 151 13.327 -3.536 8.554 1.00 0.00 H new ATOM 149 N PRO A 152 10.223 -0.732 3.300 1.00 0.00 N ATOM 150 CA PRO A 152 8.775 -0.679 3.514 1.00 0.00 C ATOM 151 C PRO A 152 8.372 0.413 4.497 1.00 0.00 C ATOM 152 O PRO A 152 9.083 0.689 5.464 1.00 0.00 O ATOM 153 CB PRO A 152 8.423 -2.072 4.062 1.00 0.00 C ATOM 154 CG PRO A 152 9.725 -2.747 4.347 1.00 0.00 C ATOM 155 CD PRO A 152 10.756 -2.084 3.477 1.00 0.00 C ATOM 0 HA PRO A 152 8.243 -0.437 2.594 1.00 0.00 H new ATOM 0 HB2 PRO A 152 7.819 -1.994 4.966 1.00 0.00 H new ATOM 0 HB3 PRO A 152 7.840 -2.640 3.337 1.00 0.00 H new ATOM 0 HG2 PRO A 152 9.988 -2.651 5.400 1.00 0.00 H new ATOM 0 HG3 PRO A 152 9.664 -3.813 4.130 1.00 0.00 H new ATOM 0 HD2 PRO A 152 11.737 -2.071 3.953 1.00 0.00 H new ATOM 0 HD3 PRO A 152 10.871 -2.600 2.524 1.00 0.00 H new ATOM 163 N ARG A 153 7.230 1.041 4.232 1.00 0.00 N ATOM 164 CA ARG A 153 6.733 2.116 5.082 1.00 0.00 C ATOM 165 C ARG A 153 5.313 1.832 5.564 1.00 0.00 C ATOM 166 O ARG A 153 4.670 0.881 5.118 1.00 0.00 O ATOM 167 CB ARG A 153 6.767 3.442 4.321 1.00 0.00 C ATOM 168 CG ARG A 153 8.174 3.954 4.057 1.00 0.00 C ATOM 169 CD ARG A 153 8.162 5.397 3.580 1.00 0.00 C ATOM 170 NE ARG A 153 9.499 5.984 3.587 1.00 0.00 N ATOM 171 CZ ARG A 153 9.838 7.066 2.891 1.00 0.00 C ATOM 172 NH1 ARG A 153 8.939 7.691 2.142 1.00 0.00 N ATOM 173 NH2 ARG A 153 11.080 7.527 2.946 1.00 0.00 N ATOM 0 H ARG A 153 6.632 0.823 3.435 1.00 0.00 H new ATOM 0 HA ARG A 153 7.381 2.180 5.956 1.00 0.00 H new ATOM 0 HB2 ARG A 153 6.249 3.319 3.370 1.00 0.00 H new ATOM 0 HB3 ARG A 153 6.217 4.192 4.889 1.00 0.00 H new ATOM 0 HG2 ARG A 153 8.767 3.876 4.968 1.00 0.00 H new ATOM 0 HG3 ARG A 153 8.656 3.326 3.308 1.00 0.00 H new ATOM 0 HD2 ARG A 153 7.751 5.443 2.572 1.00 0.00 H new ATOM 0 HD3 ARG A 153 7.504 5.985 4.219 1.00 0.00 H new ATOM 0 HE ARG A 153 10.216 5.538 4.160 1.00 0.00 H new ATOM 0 HH11 ARG A 153 7.981 7.343 2.097 1.00 0.00 H new ATOM 0 HH12 ARG A 153 9.205 8.520 1.611 1.00 0.00 H new ATOM 0 HH21 ARG A 153 11.775 7.052 3.522 1.00 0.00 H new ATOM 0 HH22 ARG A 153 11.340 8.356 2.412 1.00 0.00 H new ATOM 187 N LEU A 154 4.833 2.669 6.480 1.00 0.00 N ATOM 188 CA LEU A 154 3.493 2.519 7.031 1.00 0.00 C ATOM 189 C LEU A 154 2.563 3.611 6.514 1.00 0.00 C ATOM 190 O LEU A 154 2.952 4.774 6.402 1.00 0.00 O ATOM 191 CB LEU A 154 3.547 2.557 8.560 1.00 0.00 C ATOM 192 CG LEU A 154 2.232 2.218 9.263 1.00 0.00 C ATOM 193 CD1 LEU A 154 1.700 0.876 8.785 1.00 0.00 C ATOM 194 CD2 LEU A 154 2.421 2.211 10.772 1.00 0.00 C ATOM 0 H LEU A 154 5.356 3.460 6.856 1.00 0.00 H new ATOM 0 HA LEU A 154 3.099 1.555 6.709 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.313 1.859 8.899 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.862 3.553 8.873 1.00 0.00 H new ATOM 0 HG LEU A 154 1.500 2.986 9.011 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.764 0.653 9.297 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.525 0.916 7.710 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.429 0.096 9.005 1.00 0.00 H new ATOM 0 HD21 LEU A 154 1.475 1.968 11.256 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.169 1.465 11.042 1.00 0.00 H new ATOM 0 HD23 LEU A 154 2.755 3.195 11.101 1.00 0.00 H new ATOM 206 N CYS A 155 1.332 3.225 6.201 1.00 0.00 N ATOM 207 CA CYS A 155 0.335 4.159 5.694 1.00 0.00 C ATOM 208 C CYS A 155 -0.940 4.087 6.531 1.00 0.00 C ATOM 209 O CYS A 155 -1.410 2.999 6.867 1.00 0.00 O ATOM 210 CB CYS A 155 0.025 3.845 4.227 1.00 0.00 C ATOM 211 SG CYS A 155 -1.193 4.944 3.469 1.00 0.00 S ATOM 0 H CYS A 155 0.999 2.265 6.290 1.00 0.00 H new ATOM 0 HA CYS A 155 0.735 5.171 5.764 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.950 3.898 3.654 1.00 0.00 H new ATOM 0 HB3 CYS A 155 -0.336 2.819 4.156 1.00 0.00 H new ATOM 0 HG CYS A 155 -2.107 4.235 2.876 1.00 0.00 H new ATOM 217 N THR A 156 -1.498 5.247 6.868 1.00 0.00 N ATOM 218 CA THR A 156 -2.718 5.301 7.668 1.00 0.00 C ATOM 219 C THR A 156 -3.678 6.345 7.115 1.00 0.00 C ATOM 220 O THR A 156 -3.519 7.540 7.363 1.00 0.00 O ATOM 221 CB THR A 156 -2.386 5.621 9.125 1.00 0.00 C ATOM 222 OG1 THR A 156 -1.218 4.932 9.535 1.00 0.00 O ATOM 223 CG2 THR A 156 -3.496 5.255 10.086 1.00 0.00 C ATOM 0 H THR A 156 -1.127 6.159 6.601 1.00 0.00 H new ATOM 0 HA THR A 156 -3.199 4.324 7.620 1.00 0.00 H new ATOM 0 HB THR A 156 -2.240 6.701 9.158 1.00 0.00 H new ATOM 0 HG1 THR A 156 -1.020 5.150 10.470 1.00 0.00 H new ATOM 0 HG21 THR A 156 -3.195 5.508 11.103 1.00 0.00 H new ATOM 0 HG22 THR A 156 -4.399 5.808 9.826 1.00 0.00 H new ATOM 0 HG23 THR A 156 -3.694 4.185 10.022 1.00 0.00 H new ATOM 231 N MET A 157 -4.671 5.890 6.360 1.00 0.00 N ATOM 232 CA MET A 157 -5.649 6.792 5.765 1.00 0.00 C ATOM 233 C MET A 157 -7.040 6.560 6.345 1.00 0.00 C ATOM 234 O MET A 157 -7.444 5.423 6.587 1.00 0.00 O ATOM 235 CB MET A 157 -5.684 6.606 4.248 1.00 0.00 C ATOM 236 CG MET A 157 -5.863 5.160 3.818 1.00 0.00 C ATOM 237 SD MET A 157 -6.472 5.008 2.129 1.00 0.00 S ATOM 238 CE MET A 157 -7.919 3.983 2.382 1.00 0.00 C ATOM 0 H MET A 157 -4.820 4.904 6.146 1.00 0.00 H new ATOM 0 HA MET A 157 -5.347 7.813 5.998 1.00 0.00 H new ATOM 0 HB2 MET A 157 -6.498 7.203 3.836 1.00 0.00 H new ATOM 0 HB3 MET A 157 -4.758 6.992 3.821 1.00 0.00 H new ATOM 0 HG2 MET A 157 -4.910 4.639 3.905 1.00 0.00 H new ATOM 0 HG3 MET A 157 -6.559 4.667 4.497 1.00 0.00 H new ATOM 0 HE1 MET A 157 -8.713 4.302 1.707 1.00 0.00 H new ATOM 0 HE2 MET A 157 -7.667 2.942 2.180 1.00 0.00 H new ATOM 0 HE3 MET A 157 -8.259 4.081 3.413 1.00 0.00 H new ATOM 248 N LYS A 158 -7.769 7.649 6.557 1.00 0.00 N ATOM 249 CA LYS A 158 -9.119 7.572 7.099 1.00 0.00 C ATOM 250 C LYS A 158 -10.150 7.604 5.975 1.00 0.00 C ATOM 251 O LYS A 158 -10.195 8.551 5.190 1.00 0.00 O ATOM 252 CB LYS A 158 -9.370 8.726 8.071 1.00 0.00 C ATOM 253 CG LYS A 158 -8.532 8.649 9.337 1.00 0.00 C ATOM 254 CD LYS A 158 -8.463 9.994 10.041 1.00 0.00 C ATOM 255 CE LYS A 158 -7.485 9.966 11.205 1.00 0.00 C ATOM 256 NZ LYS A 158 -7.320 11.311 11.823 1.00 0.00 N ATOM 0 H LYS A 158 -7.447 8.597 6.361 1.00 0.00 H new ATOM 0 HA LYS A 158 -9.218 6.630 7.638 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -9.162 9.668 7.564 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -10.425 8.737 8.344 1.00 0.00 H new ATOM 0 HG2 LYS A 158 -8.957 7.905 10.011 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -7.525 8.315 9.088 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -8.161 10.763 9.330 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -9.454 10.267 10.404 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -7.837 9.261 11.958 1.00 0.00 H new ATOM 0 HE3 LYS A 158 -6.517 9.605 10.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -6.646 11.250 12.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -6.960 11.978 11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -8.239 11.645 12.178 1.00 0.00 H new ATOM 270 N LYS A 159 -10.974 6.562 5.903 1.00 0.00 N ATOM 271 CA LYS A 159 -12.007 6.463 4.874 1.00 0.00 C ATOM 272 C LYS A 159 -12.779 7.776 4.740 1.00 0.00 C ATOM 273 O LYS A 159 -12.562 8.540 3.800 1.00 0.00 O ATOM 274 CB LYS A 159 -12.960 5.305 5.201 1.00 0.00 C ATOM 275 CG LYS A 159 -14.278 5.331 4.435 1.00 0.00 C ATOM 276 CD LYS A 159 -14.098 4.882 2.992 1.00 0.00 C ATOM 277 CE LYS A 159 -14.878 3.609 2.703 1.00 0.00 C ATOM 278 NZ LYS A 159 -16.273 3.683 3.219 1.00 0.00 N ATOM 0 H LYS A 159 -10.947 5.771 6.547 1.00 0.00 H new ATOM 0 HA LYS A 159 -11.524 6.265 3.917 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -12.452 4.364 4.992 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -13.176 5.320 6.269 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -15.000 4.682 4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -14.690 6.340 4.454 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -14.429 5.673 2.320 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -13.040 4.715 2.791 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -14.898 3.432 1.628 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -14.368 2.760 3.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -16.915 3.204 2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -16.325 3.217 4.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -16.555 4.679 3.316 1.00 0.00 H new ATOM 292 N GLY A 160 -13.682 8.029 5.682 1.00 0.00 N ATOM 293 CA GLY A 160 -14.472 9.246 5.643 1.00 0.00 C ATOM 294 C GLY A 160 -15.218 9.407 4.331 1.00 0.00 C ATOM 295 O GLY A 160 -15.449 8.427 3.623 1.00 0.00 O ATOM 0 H GLY A 160 -13.881 7.414 6.471 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -15.187 9.239 6.466 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -13.819 10.105 5.795 1.00 0.00 H new ATOM 299 N PRO A 161 -15.607 10.642 3.975 1.00 0.00 N ATOM 300 CA PRO A 161 -16.329 10.915 2.733 1.00 0.00 C ATOM 301 C PRO A 161 -15.407 10.977 1.517 1.00 0.00 C ATOM 302 O PRO A 161 -15.862 11.208 0.397 1.00 0.00 O ATOM 303 CB PRO A 161 -16.950 12.284 2.997 1.00 0.00 C ATOM 304 CG PRO A 161 -15.985 12.959 3.910 1.00 0.00 C ATOM 305 CD PRO A 161 -15.372 11.872 4.757 1.00 0.00 C ATOM 0 HA PRO A 161 -17.049 10.132 2.497 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -17.081 12.846 2.072 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -17.934 12.192 3.457 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -15.219 13.489 3.343 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -16.490 13.698 4.532 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -14.308 12.045 4.921 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -15.841 11.817 5.739 1.00 0.00 H new ATOM 313 N SER A 162 -14.109 10.780 1.740 1.00 0.00 N ATOM 314 CA SER A 162 -13.136 10.825 0.654 1.00 0.00 C ATOM 315 C SER A 162 -12.743 9.423 0.196 1.00 0.00 C ATOM 316 O SER A 162 -12.417 9.215 -0.973 1.00 0.00 O ATOM 317 CB SER A 162 -11.893 11.597 1.094 1.00 0.00 C ATOM 318 OG SER A 162 -11.550 11.289 2.433 1.00 0.00 O ATOM 0 H SER A 162 -13.710 10.589 2.659 1.00 0.00 H new ATOM 0 HA SER A 162 -13.601 11.336 -0.189 1.00 0.00 H new ATOM 0 HB2 SER A 162 -11.058 11.354 0.436 1.00 0.00 H new ATOM 0 HB3 SER A 162 -12.073 12.668 0.998 1.00 0.00 H new ATOM 0 HG SER A 162 -11.308 12.112 2.906 1.00 0.00 H new ATOM 324 N GLY A 163 -12.776 8.463 1.115 1.00 0.00 N ATOM 325 CA GLY A 163 -12.420 7.100 0.768 1.00 0.00 C ATOM 326 C GLY A 163 -10.920 6.875 0.742 1.00 0.00 C ATOM 327 O GLY A 163 -10.229 7.139 1.726 1.00 0.00 O ATOM 0 H GLY A 163 -13.042 8.604 2.090 1.00 0.00 H new ATOM 0 HA2 GLY A 163 -12.873 6.416 1.486 1.00 0.00 H new ATOM 0 HA3 GLY A 163 -12.837 6.858 -0.210 1.00 0.00 H new ATOM 331 N TYR A 164 -10.417 6.384 -0.386 1.00 0.00 N ATOM 332 CA TYR A 164 -8.991 6.119 -0.538 1.00 0.00 C ATOM 333 C TYR A 164 -8.267 7.328 -1.122 1.00 0.00 C ATOM 334 O TYR A 164 -7.358 7.886 -0.503 1.00 0.00 O ATOM 335 CB TYR A 164 -8.766 4.913 -1.453 1.00 0.00 C ATOM 336 CG TYR A 164 -9.630 3.715 -1.128 1.00 0.00 C ATOM 337 CD1 TYR A 164 -10.979 3.690 -1.467 1.00 0.00 C ATOM 338 CD2 TYR A 164 -9.093 2.604 -0.492 1.00 0.00 C ATOM 339 CE1 TYR A 164 -11.766 2.592 -1.177 1.00 0.00 C ATOM 340 CE2 TYR A 164 -9.873 1.503 -0.201 1.00 0.00 C ATOM 341 CZ TYR A 164 -11.208 1.501 -0.544 1.00 0.00 C ATOM 342 OH TYR A 164 -11.989 0.406 -0.254 1.00 0.00 O ATOM 0 H TYR A 164 -10.977 6.161 -1.209 1.00 0.00 H new ATOM 0 HA TYR A 164 -8.588 5.908 0.453 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -8.955 5.213 -2.484 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -7.718 4.617 -1.394 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -11.418 4.542 -1.965 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -8.048 2.601 -0.220 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -12.812 2.588 -1.445 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -9.439 0.647 0.293 1.00 0.00 H new ATOM 0 HH TYR A 164 -11.436 -0.403 -0.270 1.00 0.00 H new ATOM 352 N GLY A 165 -8.674 7.719 -2.325 1.00 0.00 N ATOM 353 CA GLY A 165 -8.054 8.848 -2.988 1.00 0.00 C ATOM 354 C GLY A 165 -6.979 8.426 -3.974 1.00 0.00 C ATOM 355 O GLY A 165 -6.366 9.268 -4.625 1.00 0.00 O ATOM 0 H GLY A 165 -9.424 7.272 -2.853 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -8.818 9.422 -3.512 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -7.617 9.509 -2.240 1.00 0.00 H new ATOM 359 N PHE A 166 -6.743 7.120 -4.086 1.00 0.00 N ATOM 360 CA PHE A 166 -5.728 6.609 -5.000 1.00 0.00 C ATOM 361 C PHE A 166 -6.315 5.585 -5.966 1.00 0.00 C ATOM 362 O PHE A 166 -7.515 5.312 -5.950 1.00 0.00 O ATOM 363 CB PHE A 166 -4.572 5.978 -4.217 1.00 0.00 C ATOM 364 CG PHE A 166 -5.005 4.961 -3.194 1.00 0.00 C ATOM 365 CD1 PHE A 166 -5.722 3.832 -3.566 1.00 0.00 C ATOM 366 CD2 PHE A 166 -4.692 5.135 -1.856 1.00 0.00 C ATOM 367 CE1 PHE A 166 -6.116 2.901 -2.623 1.00 0.00 C ATOM 368 CE2 PHE A 166 -5.082 4.207 -0.909 1.00 0.00 C ATOM 369 CZ PHE A 166 -5.796 3.089 -1.293 1.00 0.00 C ATOM 0 H PHE A 166 -7.238 6.402 -3.558 1.00 0.00 H new ATOM 0 HA PHE A 166 -5.353 7.452 -5.580 1.00 0.00 H new ATOM 0 HB2 PHE A 166 -3.888 5.502 -4.920 1.00 0.00 H new ATOM 0 HB3 PHE A 166 -4.014 6.768 -3.715 1.00 0.00 H new ATOM 0 HD1 PHE A 166 -5.975 3.679 -4.605 1.00 0.00 H new ATOM 0 HD2 PHE A 166 -4.135 6.008 -1.548 1.00 0.00 H new ATOM 0 HE1 PHE A 166 -6.674 2.027 -2.926 1.00 0.00 H new ATOM 0 HE2 PHE A 166 -4.829 4.356 0.130 1.00 0.00 H new ATOM 0 HZ PHE A 166 -6.103 2.363 -0.555 1.00 0.00 H new ATOM 379 N ASN A 167 -5.449 5.015 -6.797 1.00 0.00 N ATOM 380 CA ASN A 167 -5.855 4.008 -7.770 1.00 0.00 C ATOM 381 C ASN A 167 -5.023 2.746 -7.580 1.00 0.00 C ATOM 382 O ASN A 167 -3.971 2.780 -6.943 1.00 0.00 O ATOM 383 CB ASN A 167 -5.682 4.538 -9.198 1.00 0.00 C ATOM 384 CG ASN A 167 -6.791 5.484 -9.649 1.00 0.00 C ATOM 385 OD1 ASN A 167 -7.778 5.739 -8.791 1.00 0.00 O flip ATOM 386 ND2 ASN A 167 -6.759 5.987 -10.772 1.00 0.00 N flip ATOM 0 H ASN A 167 -4.453 5.236 -6.815 1.00 0.00 H new ATOM 0 HA ASN A 167 -6.908 3.774 -7.613 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -4.726 5.056 -9.269 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -5.638 3.693 -9.885 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -5.989 5.772 -11.406 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -7.502 6.619 -11.069 1.00 0.00 H new ATOM 393 N LEU A 168 -5.500 1.630 -8.118 1.00 0.00 N ATOM 394 CA LEU A 168 -4.791 0.366 -7.977 1.00 0.00 C ATOM 395 C LEU A 168 -4.671 -0.373 -9.307 1.00 0.00 C ATOM 396 O LEU A 168 -5.638 -0.487 -10.060 1.00 0.00 O ATOM 397 CB LEU A 168 -5.504 -0.521 -6.956 1.00 0.00 C ATOM 398 CG LEU A 168 -5.816 0.142 -5.610 1.00 0.00 C ATOM 399 CD1 LEU A 168 -4.582 0.837 -5.049 1.00 0.00 C ATOM 400 CD2 LEU A 168 -6.971 1.126 -5.752 1.00 0.00 C ATOM 0 H LEU A 168 -6.368 1.575 -8.652 1.00 0.00 H new ATOM 0 HA LEU A 168 -3.783 0.592 -7.631 1.00 0.00 H new ATOM 0 HB2 LEU A 168 -6.439 -0.871 -7.394 1.00 0.00 H new ATOM 0 HB3 LEU A 168 -4.889 -1.402 -6.773 1.00 0.00 H new ATOM 0 HG LEU A 168 -6.114 -0.637 -4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 168 -4.828 1.300 -4.093 1.00 0.00 H new ATOM 0 HD12 LEU A 168 -3.787 0.106 -4.904 1.00 0.00 H new ATOM 0 HD13 LEU A 168 -4.247 1.603 -5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 168 -7.178 1.586 -4.786 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -6.704 1.899 -6.473 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -7.859 0.597 -6.099 1.00 0.00 H new ATOM 412 N HIS A 169 -3.474 -0.890 -9.573 1.00 0.00 N ATOM 413 CA HIS A 169 -3.208 -1.641 -10.795 1.00 0.00 C ATOM 414 C HIS A 169 -2.421 -2.908 -10.467 1.00 0.00 C ATOM 415 O HIS A 169 -1.566 -2.903 -9.579 1.00 0.00 O ATOM 416 CB HIS A 169 -2.431 -0.784 -11.800 1.00 0.00 C ATOM 417 CG HIS A 169 -1.010 -0.512 -11.400 1.00 0.00 C ATOM 418 ND1 HIS A 169 -0.475 -0.143 -10.211 1.00 0.00 N flip ATOM 419 CD2 HIS A 169 0.049 -0.614 -12.278 1.00 0.00 C flip ATOM 420 CE1 HIS A 169 0.881 -0.032 -10.393 1.00 0.00 C flip ATOM 421 NE2 HIS A 169 1.172 -0.321 -11.647 1.00 0.00 N flip ATOM 0 H HIS A 169 -2.669 -0.801 -8.953 1.00 0.00 H new ATOM 0 HA HIS A 169 -4.161 -1.918 -11.245 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -2.436 -1.284 -12.769 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -2.950 0.166 -11.929 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -0.028 -0.890 -13.319 1.00 0.00 H new ATOM 0 HE1 HIS A 169 1.595 0.247 -9.632 1.00 0.00 H new ATOM 0 HE2 HIS A 169 2.105 -0.319 -12.059 1.00 0.00 H new ATOM 430 N SER A 170 -2.714 -3.994 -11.175 1.00 0.00 N ATOM 431 CA SER A 170 -2.028 -5.260 -10.940 1.00 0.00 C ATOM 432 C SER A 170 -2.050 -6.145 -12.182 1.00 0.00 C ATOM 433 O SER A 170 -2.795 -5.888 -13.128 1.00 0.00 O ATOM 434 CB SER A 170 -2.672 -5.998 -9.765 1.00 0.00 C ATOM 435 OG SER A 170 -1.827 -7.029 -9.284 1.00 0.00 O ATOM 0 H SER A 170 -3.418 -4.024 -11.913 1.00 0.00 H new ATOM 0 HA SER A 170 -0.988 -5.036 -10.702 1.00 0.00 H new ATOM 0 HB2 SER A 170 -2.884 -5.293 -8.961 1.00 0.00 H new ATOM 0 HB3 SER A 170 -3.626 -6.422 -10.077 1.00 0.00 H new ATOM 0 HG SER A 170 -1.806 -7.005 -8.305 1.00 0.00 H new ATOM 441 N ASP A 171 -1.230 -7.192 -12.167 1.00 0.00 N ATOM 442 CA ASP A 171 -1.152 -8.124 -13.286 1.00 0.00 C ATOM 443 C ASP A 171 -1.271 -9.566 -12.798 1.00 0.00 C ATOM 444 O ASP A 171 -2.178 -10.295 -13.198 1.00 0.00 O ATOM 445 CB ASP A 171 0.164 -7.935 -14.043 1.00 0.00 C ATOM 446 CG ASP A 171 0.263 -8.826 -15.265 1.00 0.00 C ATOM 447 OD1 ASP A 171 -0.330 -8.474 -16.307 1.00 0.00 O ATOM 448 OD2 ASP A 171 0.935 -9.876 -15.182 1.00 0.00 O ATOM 0 H ASP A 171 -0.609 -7.416 -11.390 1.00 0.00 H new ATOM 0 HA ASP A 171 -1.983 -7.917 -13.961 1.00 0.00 H new ATOM 0 HB2 ASP A 171 0.257 -6.893 -14.349 1.00 0.00 H new ATOM 0 HB3 ASP A 171 0.998 -8.147 -13.374 1.00 0.00 H new ATOM 453 N LYS A 172 -0.347 -9.968 -11.930 1.00 0.00 N ATOM 454 CA LYS A 172 -0.346 -11.320 -11.383 1.00 0.00 C ATOM 455 C LYS A 172 -1.169 -11.389 -10.100 1.00 0.00 C ATOM 456 O LYS A 172 -1.533 -10.361 -9.529 1.00 0.00 O ATOM 457 CB LYS A 172 1.086 -11.781 -11.110 1.00 0.00 C ATOM 458 CG LYS A 172 1.841 -12.192 -12.364 1.00 0.00 C ATOM 459 CD LYS A 172 1.348 -13.526 -12.899 1.00 0.00 C ATOM 460 CE LYS A 172 1.986 -14.693 -12.162 1.00 0.00 C ATOM 461 NZ LYS A 172 3.386 -14.934 -12.609 1.00 0.00 N ATOM 0 H LYS A 172 0.411 -9.376 -11.590 1.00 0.00 H new ATOM 0 HA LYS A 172 -0.799 -11.983 -12.120 1.00 0.00 H new ATOM 0 HB2 LYS A 172 1.630 -10.976 -10.615 1.00 0.00 H new ATOM 0 HB3 LYS A 172 1.062 -12.622 -10.418 1.00 0.00 H new ATOM 0 HG2 LYS A 172 1.722 -11.425 -13.130 1.00 0.00 H new ATOM 0 HG3 LYS A 172 2.906 -12.259 -12.143 1.00 0.00 H new ATOM 0 HD2 LYS A 172 0.264 -13.581 -12.800 1.00 0.00 H new ATOM 0 HD3 LYS A 172 1.575 -13.599 -13.963 1.00 0.00 H new ATOM 0 HE2 LYS A 172 1.976 -14.494 -11.090 1.00 0.00 H new ATOM 0 HE3 LYS A 172 1.393 -15.593 -12.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 172 3.745 -15.807 -12.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 172 3.408 -15.031 -13.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 172 3.984 -14.133 -12.324 1.00 0.00 H new ATOM 475 N SER A 173 -1.459 -12.607 -9.652 1.00 0.00 N ATOM 476 CA SER A 173 -2.241 -12.808 -8.437 1.00 0.00 C ATOM 477 C SER A 173 -1.378 -13.370 -7.309 1.00 0.00 C ATOM 478 O SER A 173 -1.891 -13.977 -6.369 1.00 0.00 O ATOM 479 CB SER A 173 -3.413 -13.752 -8.712 1.00 0.00 C ATOM 480 OG SER A 173 -4.451 -13.087 -9.412 1.00 0.00 O ATOM 0 H SER A 173 -1.164 -13.469 -10.112 1.00 0.00 H new ATOM 0 HA SER A 173 -2.625 -11.837 -8.123 1.00 0.00 H new ATOM 0 HB2 SER A 173 -3.067 -14.606 -9.294 1.00 0.00 H new ATOM 0 HB3 SER A 173 -3.798 -14.143 -7.770 1.00 0.00 H new ATOM 0 HG SER A 173 -5.187 -13.712 -9.577 1.00 0.00 H new ATOM 486 N LYS A 174 -0.069 -13.165 -7.406 1.00 0.00 N ATOM 487 CA LYS A 174 0.856 -13.656 -6.388 1.00 0.00 C ATOM 488 C LYS A 174 1.322 -12.530 -5.461 1.00 0.00 C ATOM 489 O LYS A 174 1.293 -12.680 -4.240 1.00 0.00 O ATOM 490 CB LYS A 174 2.065 -14.338 -7.038 1.00 0.00 C ATOM 491 CG LYS A 174 1.690 -15.372 -8.087 1.00 0.00 C ATOM 492 CD LYS A 174 2.829 -16.345 -8.343 1.00 0.00 C ATOM 493 CE LYS A 174 2.316 -17.760 -8.556 1.00 0.00 C ATOM 494 NZ LYS A 174 3.282 -18.780 -8.064 1.00 0.00 N ATOM 0 H LYS A 174 0.375 -12.664 -8.176 1.00 0.00 H new ATOM 0 HA LYS A 174 0.319 -14.388 -5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 174 2.696 -13.578 -7.499 1.00 0.00 H new ATOM 0 HB3 LYS A 174 2.660 -14.819 -6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 174 0.808 -15.921 -7.759 1.00 0.00 H new ATOM 0 HG3 LYS A 174 1.424 -14.869 -9.017 1.00 0.00 H new ATOM 0 HD2 LYS A 174 3.392 -16.025 -9.220 1.00 0.00 H new ATOM 0 HD3 LYS A 174 3.518 -16.330 -7.499 1.00 0.00 H new ATOM 0 HE2 LYS A 174 1.364 -17.883 -8.040 1.00 0.00 H new ATOM 0 HE3 LYS A 174 2.126 -17.922 -9.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 2.895 -19.732 -8.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 4.183 -18.680 -8.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 3.444 -18.642 -7.046 1.00 0.00 H new ATOM 508 N PRO A 175 1.762 -11.384 -6.019 1.00 0.00 N ATOM 509 CA PRO A 175 2.232 -10.251 -5.217 1.00 0.00 C ATOM 510 C PRO A 175 1.100 -9.574 -4.451 1.00 0.00 C ATOM 511 O PRO A 175 1.139 -9.475 -3.224 1.00 0.00 O ATOM 512 CB PRO A 175 2.827 -9.282 -6.251 1.00 0.00 C ATOM 513 CG PRO A 175 2.929 -10.061 -7.520 1.00 0.00 C ATOM 514 CD PRO A 175 1.845 -11.095 -7.457 1.00 0.00 C ATOM 0 HA PRO A 175 2.947 -10.570 -4.458 1.00 0.00 H new ATOM 0 HB2 PRO A 175 2.191 -8.406 -6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 175 3.805 -8.922 -5.933 1.00 0.00 H new ATOM 0 HG2 PRO A 175 2.801 -9.413 -8.387 1.00 0.00 H new ATOM 0 HG3 PRO A 175 3.909 -10.528 -7.614 1.00 0.00 H new ATOM 0 HD2 PRO A 175 0.901 -10.717 -7.850 1.00 0.00 H new ATOM 0 HD3 PRO A 175 2.098 -11.984 -8.035 1.00 0.00 H new ATOM 522 N GLY A 176 0.095 -9.107 -5.183 1.00 0.00 N ATOM 523 CA GLY A 176 -1.033 -8.442 -4.558 1.00 0.00 C ATOM 524 C GLY A 176 -1.512 -7.244 -5.355 1.00 0.00 C ATOM 525 O GLY A 176 -1.444 -7.241 -6.583 1.00 0.00 O ATOM 0 H GLY A 176 0.041 -9.177 -6.199 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -1.853 -9.151 -4.446 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -0.751 -8.119 -3.556 1.00 0.00 H new ATOM 529 N GLN A 177 -1.996 -6.223 -4.654 1.00 0.00 N ATOM 530 CA GLN A 177 -2.484 -5.013 -5.305 1.00 0.00 C ATOM 531 C GLN A 177 -1.475 -3.877 -5.167 1.00 0.00 C ATOM 532 O GLN A 177 -0.974 -3.609 -4.075 1.00 0.00 O ATOM 533 CB GLN A 177 -3.828 -4.593 -4.708 1.00 0.00 C ATOM 534 CG GLN A 177 -4.514 -3.485 -5.488 1.00 0.00 C ATOM 535 CD GLN A 177 -4.671 -3.822 -6.957 1.00 0.00 C ATOM 536 OE1 GLN A 177 -4.060 -3.191 -7.820 1.00 0.00 O ATOM 537 NE2 GLN A 177 -5.492 -4.822 -7.249 1.00 0.00 N ATOM 0 H GLN A 177 -2.060 -6.210 -3.636 1.00 0.00 H new ATOM 0 HA GLN A 177 -2.618 -5.229 -6.365 1.00 0.00 H new ATOM 0 HB2 GLN A 177 -4.487 -5.461 -4.668 1.00 0.00 H new ATOM 0 HB3 GLN A 177 -3.674 -4.262 -3.681 1.00 0.00 H new ATOM 0 HG2 GLN A 177 -5.496 -3.294 -5.055 1.00 0.00 H new ATOM 0 HG3 GLN A 177 -3.938 -2.565 -5.389 1.00 0.00 H new ATOM 0 HE21 GLN A 177 -5.978 -5.318 -6.502 1.00 0.00 H new ATOM 0 HE22 GLN A 177 -5.637 -5.095 -8.221 1.00 0.00 H new ATOM 546 N PHE A 178 -1.180 -3.214 -6.281 1.00 0.00 N ATOM 547 CA PHE A 178 -0.229 -2.109 -6.286 1.00 0.00 C ATOM 548 C PHE A 178 -0.955 -0.791 -6.514 1.00 0.00 C ATOM 549 O PHE A 178 -2.106 -0.781 -6.948 1.00 0.00 O ATOM 550 CB PHE A 178 0.808 -2.309 -7.394 1.00 0.00 C ATOM 551 CG PHE A 178 1.262 -3.734 -7.568 1.00 0.00 C ATOM 552 CD1 PHE A 178 1.259 -4.619 -6.501 1.00 0.00 C ATOM 553 CD2 PHE A 178 1.687 -4.187 -8.807 1.00 0.00 C ATOM 554 CE1 PHE A 178 1.672 -5.927 -6.667 1.00 0.00 C ATOM 555 CE2 PHE A 178 2.101 -5.494 -8.979 1.00 0.00 C ATOM 556 CZ PHE A 178 2.093 -6.365 -7.907 1.00 0.00 C ATOM 0 H PHE A 178 -1.587 -3.424 -7.193 1.00 0.00 H new ATOM 0 HA PHE A 178 0.273 -2.084 -5.319 1.00 0.00 H new ATOM 0 HB2 PHE A 178 0.389 -1.956 -8.336 1.00 0.00 H new ATOM 0 HB3 PHE A 178 1.677 -1.687 -7.179 1.00 0.00 H new ATOM 0 HD1 PHE A 178 0.930 -4.282 -5.529 1.00 0.00 H new ATOM 0 HD2 PHE A 178 1.695 -3.510 -9.648 1.00 0.00 H new ATOM 0 HE1 PHE A 178 1.666 -6.606 -5.827 1.00 0.00 H new ATOM 0 HE2 PHE A 178 2.430 -5.834 -9.950 1.00 0.00 H new ATOM 0 HZ PHE A 178 2.416 -7.387 -8.038 1.00 0.00 H new ATOM 566 N ILE A 179 -0.280 0.324 -6.246 1.00 0.00 N ATOM 567 CA ILE A 179 -0.889 1.627 -6.459 1.00 0.00 C ATOM 568 C ILE A 179 -0.399 2.227 -7.767 1.00 0.00 C ATOM 569 O ILE A 179 0.797 2.225 -8.054 1.00 0.00 O ATOM 570 CB ILE A 179 -0.602 2.593 -5.298 1.00 0.00 C ATOM 571 CG1 ILE A 179 -0.956 1.918 -3.967 1.00 0.00 C ATOM 572 CG2 ILE A 179 -1.385 3.887 -5.483 1.00 0.00 C ATOM 573 CD1 ILE A 179 -1.152 2.882 -2.817 1.00 0.00 C ATOM 0 H ILE A 179 0.674 0.349 -5.886 1.00 0.00 H new ATOM 0 HA ILE A 179 -1.968 1.479 -6.507 1.00 0.00 H new ATOM 0 HB ILE A 179 0.459 2.843 -5.288 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -1.868 1.336 -4.099 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -0.165 1.215 -3.707 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -1.173 4.562 -4.654 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -1.091 4.359 -6.420 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -2.452 3.666 -5.507 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -1.399 2.325 -1.913 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -0.234 3.447 -2.655 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -1.964 3.570 -3.053 1.00 0.00 H new ATOM 585 N ARG A 180 -1.334 2.712 -8.569 1.00 0.00 N ATOM 586 CA ARG A 180 -1.004 3.288 -9.864 1.00 0.00 C ATOM 587 C ARG A 180 -1.077 4.813 -9.839 1.00 0.00 C ATOM 588 O ARG A 180 -0.313 5.487 -10.531 1.00 0.00 O ATOM 589 CB ARG A 180 -1.942 2.723 -10.937 1.00 0.00 C ATOM 590 CG ARG A 180 -3.329 3.344 -10.933 1.00 0.00 C ATOM 591 CD ARG A 180 -4.236 2.694 -11.965 1.00 0.00 C ATOM 592 NE ARG A 180 -3.709 2.826 -13.322 1.00 0.00 N ATOM 593 CZ ARG A 180 -4.421 2.585 -14.421 1.00 0.00 C ATOM 594 NH1 ARG A 180 -5.688 2.200 -14.328 1.00 0.00 N ATOM 595 NH2 ARG A 180 -3.866 2.730 -15.617 1.00 0.00 N ATOM 0 H ARG A 180 -2.329 2.718 -8.346 1.00 0.00 H new ATOM 0 HA ARG A 180 0.024 3.016 -10.103 1.00 0.00 H new ATOM 0 HB2 ARG A 180 -1.490 2.875 -11.917 1.00 0.00 H new ATOM 0 HB3 ARG A 180 -2.036 1.647 -10.793 1.00 0.00 H new ATOM 0 HG2 ARG A 180 -3.772 3.241 -9.942 1.00 0.00 H new ATOM 0 HG3 ARG A 180 -3.251 4.412 -11.138 1.00 0.00 H new ATOM 0 HD2 ARG A 180 -4.358 1.638 -11.725 1.00 0.00 H new ATOM 0 HD3 ARG A 180 -5.225 3.149 -11.915 1.00 0.00 H new ATOM 0 HE ARG A 180 -2.739 3.120 -13.434 1.00 0.00 H new ATOM 0 HH11 ARG A 180 -6.121 2.087 -13.411 1.00 0.00 H new ATOM 0 HH12 ARG A 180 -6.229 2.017 -15.173 1.00 0.00 H new ATOM 0 HH21 ARG A 180 -2.893 3.026 -15.695 1.00 0.00 H new ATOM 0 HH22 ARG A 180 -4.412 2.545 -16.458 1.00 0.00 H new ATOM 609 N SER A 181 -1.998 5.356 -9.048 1.00 0.00 N ATOM 610 CA SER A 181 -2.152 6.805 -8.959 1.00 0.00 C ATOM 611 C SER A 181 -2.677 7.238 -7.593 1.00 0.00 C ATOM 612 O SER A 181 -3.379 6.488 -6.916 1.00 0.00 O ATOM 613 CB SER A 181 -3.095 7.302 -10.057 1.00 0.00 C ATOM 614 OG SER A 181 -3.094 8.717 -10.127 1.00 0.00 O ATOM 0 H SER A 181 -2.643 4.822 -8.465 1.00 0.00 H new ATOM 0 HA SER A 181 -1.165 7.248 -9.094 1.00 0.00 H new ATOM 0 HB2 SER A 181 -2.791 6.887 -11.018 1.00 0.00 H new ATOM 0 HB3 SER A 181 -4.106 6.945 -9.862 1.00 0.00 H new ATOM 0 HG SER A 181 -3.703 9.010 -10.837 1.00 0.00 H new ATOM 620 N VAL A 182 -2.331 8.461 -7.203 1.00 0.00 N ATOM 621 CA VAL A 182 -2.762 9.020 -5.926 1.00 0.00 C ATOM 622 C VAL A 182 -3.349 10.416 -6.117 1.00 0.00 C ATOM 623 O VAL A 182 -2.844 11.205 -6.916 1.00 0.00 O ATOM 624 CB VAL A 182 -1.594 9.099 -4.927 1.00 0.00 C ATOM 625 CG1 VAL A 182 -2.093 9.515 -3.552 1.00 0.00 C ATOM 626 CG2 VAL A 182 -0.861 7.768 -4.858 1.00 0.00 C ATOM 0 H VAL A 182 -1.749 9.088 -7.758 1.00 0.00 H new ATOM 0 HA VAL A 182 -3.527 8.355 -5.525 1.00 0.00 H new ATOM 0 HB VAL A 182 -0.892 9.856 -5.276 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -1.253 9.565 -2.860 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -2.568 10.494 -3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -2.817 8.784 -3.191 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.038 7.842 -4.147 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -1.551 6.989 -4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 182 -0.468 7.518 -5.843 1.00 0.00 H new ATOM 636 N ASP A 183 -4.417 10.717 -5.385 1.00 0.00 N ATOM 637 CA ASP A 183 -5.068 12.019 -5.482 1.00 0.00 C ATOM 638 C ASP A 183 -4.446 13.015 -4.503 1.00 0.00 C ATOM 639 O ASP A 183 -4.413 12.766 -3.299 1.00 0.00 O ATOM 640 CB ASP A 183 -6.565 11.884 -5.198 1.00 0.00 C ATOM 641 CG ASP A 183 -7.329 13.164 -5.475 1.00 0.00 C ATOM 642 OD1 ASP A 183 -6.809 14.016 -6.225 1.00 0.00 O ATOM 643 OD2 ASP A 183 -8.448 13.314 -4.942 1.00 0.00 O ATOM 0 H ASP A 183 -4.850 10.078 -4.719 1.00 0.00 H new ATOM 0 HA ASP A 183 -4.925 12.393 -6.496 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -6.976 11.081 -5.809 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -6.709 11.598 -4.156 1.00 0.00 H new ATOM 648 N PRO A 184 -3.945 14.160 -5.000 1.00 0.00 N ATOM 649 CA PRO A 184 -3.331 15.180 -4.146 1.00 0.00 C ATOM 650 C PRO A 184 -4.327 15.781 -3.159 1.00 0.00 C ATOM 651 O PRO A 184 -5.441 16.149 -3.532 1.00 0.00 O ATOM 652 CB PRO A 184 -2.848 16.252 -5.134 1.00 0.00 C ATOM 653 CG PRO A 184 -2.845 15.586 -6.468 1.00 0.00 C ATOM 654 CD PRO A 184 -3.935 14.556 -6.418 1.00 0.00 C ATOM 0 HA PRO A 184 -2.531 14.762 -3.534 1.00 0.00 H new ATOM 0 HB2 PRO A 184 -3.509 17.118 -5.129 1.00 0.00 H new ATOM 0 HB3 PRO A 184 -1.852 16.609 -4.871 1.00 0.00 H new ATOM 0 HG2 PRO A 184 -3.026 16.307 -7.265 1.00 0.00 H new ATOM 0 HG3 PRO A 184 -1.879 15.123 -6.671 1.00 0.00 H new ATOM 0 HD2 PRO A 184 -4.895 14.968 -6.730 1.00 0.00 H new ATOM 0 HD3 PRO A 184 -3.723 13.711 -7.073 1.00 0.00 H new ATOM 662 N ASP A 185 -3.915 15.880 -1.897 1.00 0.00 N ATOM 663 CA ASP A 185 -4.761 16.441 -0.844 1.00 0.00 C ATOM 664 C ASP A 185 -5.827 15.438 -0.395 1.00 0.00 C ATOM 665 O ASP A 185 -6.787 15.802 0.283 1.00 0.00 O ATOM 666 CB ASP A 185 -5.425 17.738 -1.323 1.00 0.00 C ATOM 667 CG ASP A 185 -5.892 18.618 -0.178 1.00 0.00 C ATOM 668 OD1 ASP A 185 -6.414 18.077 0.818 1.00 0.00 O ATOM 669 OD2 ASP A 185 -5.733 19.853 -0.279 1.00 0.00 O ATOM 0 H ASP A 185 -2.995 15.577 -1.577 1.00 0.00 H new ATOM 0 HA ASP A 185 -4.123 16.664 0.011 1.00 0.00 H new ATOM 0 HB2 ASP A 185 -4.720 18.296 -1.939 1.00 0.00 H new ATOM 0 HB3 ASP A 185 -6.277 17.492 -1.957 1.00 0.00 H new ATOM 674 N SER A 186 -5.653 14.171 -0.764 1.00 0.00 N ATOM 675 CA SER A 186 -6.601 13.131 -0.379 1.00 0.00 C ATOM 676 C SER A 186 -6.083 12.365 0.835 1.00 0.00 C ATOM 677 O SER A 186 -4.899 12.438 1.161 1.00 0.00 O ATOM 678 CB SER A 186 -6.846 12.172 -1.545 1.00 0.00 C ATOM 679 OG SER A 186 -7.627 12.788 -2.555 1.00 0.00 O ATOM 0 H SER A 186 -4.868 13.842 -1.326 1.00 0.00 H new ATOM 0 HA SER A 186 -7.546 13.606 -0.116 1.00 0.00 H new ATOM 0 HB2 SER A 186 -5.892 11.851 -1.963 1.00 0.00 H new ATOM 0 HB3 SER A 186 -7.353 11.277 -1.184 1.00 0.00 H new ATOM 0 HG SER A 186 -8.294 12.151 -2.887 1.00 0.00 H new ATOM 685 N PRO A 187 -6.962 11.617 1.529 1.00 0.00 N ATOM 686 CA PRO A 187 -6.573 10.846 2.712 1.00 0.00 C ATOM 687 C PRO A 187 -5.280 10.070 2.498 1.00 0.00 C ATOM 688 O PRO A 187 -4.433 9.999 3.388 1.00 0.00 O ATOM 689 CB PRO A 187 -7.750 9.892 2.907 1.00 0.00 C ATOM 690 CG PRO A 187 -8.922 10.629 2.357 1.00 0.00 C ATOM 691 CD PRO A 187 -8.398 11.468 1.220 1.00 0.00 C ATOM 0 HA PRO A 187 -6.376 11.484 3.574 1.00 0.00 H new ATOM 0 HB2 PRO A 187 -7.590 8.951 2.380 1.00 0.00 H new ATOM 0 HB3 PRO A 187 -7.893 9.648 3.960 1.00 0.00 H new ATOM 0 HG2 PRO A 187 -9.688 9.936 2.008 1.00 0.00 H new ATOM 0 HG3 PRO A 187 -9.382 11.254 3.122 1.00 0.00 H new ATOM 0 HD2 PRO A 187 -8.552 10.980 0.258 1.00 0.00 H new ATOM 0 HD3 PRO A 187 -8.900 12.434 1.171 1.00 0.00 H new ATOM 699 N ALA A 188 -5.129 9.497 1.309 1.00 0.00 N ATOM 700 CA ALA A 188 -3.931 8.739 0.981 1.00 0.00 C ATOM 701 C ALA A 188 -2.692 9.623 1.066 1.00 0.00 C ATOM 702 O ALA A 188 -1.668 9.226 1.623 1.00 0.00 O ATOM 703 CB ALA A 188 -4.057 8.138 -0.409 1.00 0.00 C ATOM 0 H ALA A 188 -5.820 9.544 0.560 1.00 0.00 H new ATOM 0 HA ALA A 188 -3.824 7.932 1.706 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -3.155 7.573 -0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -4.920 7.473 -0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -4.186 8.936 -1.140 1.00 0.00 H new ATOM 709 N GLU A 189 -2.795 10.825 0.509 1.00 0.00 N ATOM 710 CA GLU A 189 -1.686 11.772 0.518 1.00 0.00 C ATOM 711 C GLU A 189 -1.382 12.241 1.937 1.00 0.00 C ATOM 712 O GLU A 189 -0.248 12.138 2.405 1.00 0.00 O ATOM 713 CB GLU A 189 -2.013 12.975 -0.368 1.00 0.00 C ATOM 714 CG GLU A 189 -0.786 13.755 -0.812 1.00 0.00 C ATOM 715 CD GLU A 189 0.042 13.003 -1.837 1.00 0.00 C ATOM 716 OE1 GLU A 189 -0.543 12.216 -2.610 1.00 0.00 O ATOM 717 OE2 GLU A 189 1.275 13.203 -1.866 1.00 0.00 O ATOM 0 H GLU A 189 -3.637 11.167 0.045 1.00 0.00 H new ATOM 0 HA GLU A 189 -0.804 11.266 0.125 1.00 0.00 H new ATOM 0 HB2 GLU A 189 -2.553 12.630 -1.250 1.00 0.00 H new ATOM 0 HB3 GLU A 189 -2.682 13.644 0.174 1.00 0.00 H new ATOM 0 HG2 GLU A 189 -1.100 14.710 -1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 189 -0.167 13.978 0.057 1.00 0.00 H new ATOM 724 N ALA A 190 -2.402 12.756 2.616 1.00 0.00 N ATOM 725 CA ALA A 190 -2.245 13.242 3.983 1.00 0.00 C ATOM 726 C ALA A 190 -1.679 12.157 4.895 1.00 0.00 C ATOM 727 O ALA A 190 -1.036 12.451 5.903 1.00 0.00 O ATOM 728 CB ALA A 190 -3.578 13.739 4.522 1.00 0.00 C ATOM 0 H ALA A 190 -3.347 12.848 2.242 1.00 0.00 H new ATOM 0 HA ALA A 190 -1.537 14.071 3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -3.447 14.099 5.543 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -3.944 14.552 3.895 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -4.300 12.923 4.515 1.00 0.00 H new ATOM 734 N SER A 191 -1.925 10.902 4.534 1.00 0.00 N ATOM 735 CA SER A 191 -1.449 9.770 5.311 1.00 0.00 C ATOM 736 C SER A 191 0.003 9.439 4.973 1.00 0.00 C ATOM 737 O SER A 191 0.696 8.781 5.749 1.00 0.00 O ATOM 738 CB SER A 191 -2.340 8.561 5.038 1.00 0.00 C ATOM 739 OG SER A 191 -1.737 7.366 5.492 1.00 0.00 O ATOM 0 H SER A 191 -2.455 10.645 3.702 1.00 0.00 H new ATOM 0 HA SER A 191 -1.494 10.030 6.369 1.00 0.00 H new ATOM 0 HB2 SER A 191 -3.302 8.696 5.533 1.00 0.00 H new ATOM 0 HB3 SER A 191 -2.539 8.487 3.969 1.00 0.00 H new ATOM 0 HG SER A 191 -1.649 6.739 4.744 1.00 0.00 H new ATOM 745 N GLY A 192 0.456 9.894 3.807 1.00 0.00 N ATOM 746 CA GLY A 192 1.820 9.628 3.387 1.00 0.00 C ATOM 747 C GLY A 192 1.892 8.495 2.385 1.00 0.00 C ATOM 748 O GLY A 192 2.823 7.690 2.409 1.00 0.00 O ATOM 0 H GLY A 192 -0.097 10.441 3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 192 2.247 10.529 2.947 1.00 0.00 H new ATOM 0 HA3 GLY A 192 2.426 9.381 4.258 1.00 0.00 H new ATOM 752 N LEU A 193 0.898 8.433 1.508 1.00 0.00 N ATOM 753 CA LEU A 193 0.831 7.392 0.492 1.00 0.00 C ATOM 754 C LEU A 193 1.317 7.909 -0.859 1.00 0.00 C ATOM 755 O LEU A 193 1.160 9.088 -1.177 1.00 0.00 O ATOM 756 CB LEU A 193 -0.605 6.876 0.375 1.00 0.00 C ATOM 757 CG LEU A 193 -0.811 5.721 -0.605 1.00 0.00 C ATOM 758 CD1 LEU A 193 -2.100 4.980 -0.282 1.00 0.00 C ATOM 759 CD2 LEU A 193 -0.833 6.233 -2.040 1.00 0.00 C ATOM 0 H LEU A 193 0.123 9.096 1.481 1.00 0.00 H new ATOM 0 HA LEU A 193 1.486 6.574 0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -0.939 6.556 1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -1.247 7.704 0.074 1.00 0.00 H new ATOM 0 HG LEU A 193 0.023 5.027 -0.504 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -2.235 4.160 -0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -2.047 4.582 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -2.943 5.666 -0.358 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -0.981 5.396 -2.723 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -1.648 6.947 -2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 193 0.114 6.723 -2.266 1.00 0.00 H new ATOM 771 N ARG A 194 1.906 7.017 -1.650 1.00 0.00 N ATOM 772 CA ARG A 194 2.414 7.378 -2.969 1.00 0.00 C ATOM 773 C ARG A 194 2.297 6.202 -3.934 1.00 0.00 C ATOM 774 O ARG A 194 2.564 5.059 -3.567 1.00 0.00 O ATOM 775 CB ARG A 194 3.871 7.831 -2.874 1.00 0.00 C ATOM 776 CG ARG A 194 4.077 9.030 -1.963 1.00 0.00 C ATOM 777 CD ARG A 194 5.445 9.661 -2.172 1.00 0.00 C ATOM 778 NE ARG A 194 5.587 10.230 -3.510 1.00 0.00 N ATOM 779 CZ ARG A 194 6.586 11.032 -3.872 1.00 0.00 C ATOM 780 NH1 ARG A 194 7.532 11.360 -3.001 1.00 0.00 N ATOM 781 NH2 ARG A 194 6.639 11.508 -5.109 1.00 0.00 N ATOM 0 H ARG A 194 2.043 6.038 -1.400 1.00 0.00 H new ATOM 0 HA ARG A 194 1.811 8.202 -3.350 1.00 0.00 H new ATOM 0 HB2 ARG A 194 4.478 7.001 -2.512 1.00 0.00 H new ATOM 0 HB3 ARG A 194 4.232 8.078 -3.872 1.00 0.00 H new ATOM 0 HG2 ARG A 194 3.301 9.771 -2.154 1.00 0.00 H new ATOM 0 HG3 ARG A 194 3.973 8.720 -0.923 1.00 0.00 H new ATOM 0 HD2 ARG A 194 5.602 10.442 -1.428 1.00 0.00 H new ATOM 0 HD3 ARG A 194 6.219 8.910 -2.014 1.00 0.00 H new ATOM 0 HE ARG A 194 4.879 9.999 -4.208 1.00 0.00 H new ATOM 0 HH11 ARG A 194 7.496 10.997 -2.048 1.00 0.00 H new ATOM 0 HH12 ARG A 194 8.295 11.975 -3.284 1.00 0.00 H new ATOM 0 HH21 ARG A 194 5.914 11.260 -5.783 1.00 0.00 H new ATOM 0 HH22 ARG A 194 7.404 12.123 -5.387 1.00 0.00 H new ATOM 795 N ALA A 195 1.895 6.490 -5.168 1.00 0.00 N ATOM 796 CA ALA A 195 1.738 5.457 -6.189 1.00 0.00 C ATOM 797 C ALA A 195 2.953 4.533 -6.246 1.00 0.00 C ATOM 798 O ALA A 195 4.003 4.843 -5.685 1.00 0.00 O ATOM 799 CB ALA A 195 1.501 6.096 -7.548 1.00 0.00 C ATOM 0 H ALA A 195 1.671 7.433 -5.487 1.00 0.00 H new ATOM 0 HA ALA A 195 0.872 4.852 -5.920 1.00 0.00 H new ATOM 0 HB1 ALA A 195 1.385 5.317 -8.301 1.00 0.00 H new ATOM 0 HB2 ALA A 195 0.596 6.703 -7.512 1.00 0.00 H new ATOM 0 HB3 ALA A 195 2.351 6.727 -7.806 1.00 0.00 H new ATOM 805 N GLN A 196 2.795 3.398 -6.934 1.00 0.00 N ATOM 806 CA GLN A 196 3.866 2.405 -7.091 1.00 0.00 C ATOM 807 C GLN A 196 4.007 1.507 -5.862 1.00 0.00 C ATOM 808 O GLN A 196 4.515 0.393 -5.958 1.00 0.00 O ATOM 809 CB GLN A 196 5.214 3.092 -7.403 1.00 0.00 C ATOM 810 CG GLN A 196 5.268 3.709 -8.791 1.00 0.00 C ATOM 811 CD GLN A 196 6.572 4.435 -9.057 1.00 0.00 C ATOM 812 OE1 GLN A 196 7.632 3.816 -9.150 1.00 0.00 O ATOM 813 NE2 GLN A 196 6.500 5.755 -9.181 1.00 0.00 N ATOM 0 H GLN A 196 1.924 3.141 -7.397 1.00 0.00 H new ATOM 0 HA GLN A 196 3.586 1.772 -7.933 1.00 0.00 H new ATOM 0 HB2 GLN A 196 5.398 3.868 -6.661 1.00 0.00 H new ATOM 0 HB3 GLN A 196 6.017 2.361 -7.306 1.00 0.00 H new ATOM 0 HG2 GLN A 196 5.133 2.926 -9.538 1.00 0.00 H new ATOM 0 HG3 GLN A 196 4.438 4.406 -8.907 1.00 0.00 H new ATOM 0 HE21 GLN A 196 5.600 6.227 -9.097 1.00 0.00 H new ATOM 0 HE22 GLN A 196 7.345 6.297 -9.361 1.00 0.00 H new ATOM 822 N ASP A 197 3.578 1.986 -4.706 1.00 0.00 N ATOM 823 CA ASP A 197 3.701 1.205 -3.485 1.00 0.00 C ATOM 824 C ASP A 197 2.817 -0.040 -3.503 1.00 0.00 C ATOM 825 O ASP A 197 1.667 -0.005 -3.941 1.00 0.00 O ATOM 826 CB ASP A 197 3.398 2.059 -2.253 1.00 0.00 C ATOM 827 CG ASP A 197 2.034 2.711 -2.317 1.00 0.00 C ATOM 828 OD1 ASP A 197 1.496 2.841 -3.433 1.00 0.00 O ATOM 829 OD2 ASP A 197 1.511 3.104 -1.253 1.00 0.00 O ATOM 0 H ASP A 197 3.146 2.902 -4.587 1.00 0.00 H new ATOM 0 HA ASP A 197 4.736 0.869 -3.430 1.00 0.00 H new ATOM 0 HB2 ASP A 197 3.457 1.436 -1.360 1.00 0.00 H new ATOM 0 HB3 ASP A 197 4.161 2.831 -2.154 1.00 0.00 H new ATOM 834 N ARG A 198 3.387 -1.142 -3.020 1.00 0.00 N ATOM 835 CA ARG A 198 2.700 -2.424 -2.959 1.00 0.00 C ATOM 836 C ARG A 198 2.009 -2.593 -1.608 1.00 0.00 C ATOM 837 O ARG A 198 2.630 -2.406 -0.562 1.00 0.00 O ATOM 838 CB ARG A 198 3.707 -3.565 -3.148 1.00 0.00 C ATOM 839 CG ARG A 198 4.782 -3.288 -4.191 1.00 0.00 C ATOM 840 CD ARG A 198 4.279 -3.536 -5.602 1.00 0.00 C ATOM 841 NE ARG A 198 3.967 -2.294 -6.305 1.00 0.00 N ATOM 842 CZ ARG A 198 3.992 -2.164 -7.630 1.00 0.00 C ATOM 843 NH1 ARG A 198 4.317 -3.194 -8.403 1.00 0.00 N ATOM 844 NH2 ARG A 198 3.689 -0.999 -8.186 1.00 0.00 N ATOM 0 H ARG A 198 4.341 -1.168 -2.660 1.00 0.00 H new ATOM 0 HA ARG A 198 1.954 -2.453 -3.753 1.00 0.00 H new ATOM 0 HB2 ARG A 198 4.189 -3.770 -2.192 1.00 0.00 H new ATOM 0 HB3 ARG A 198 3.166 -4.468 -3.432 1.00 0.00 H new ATOM 0 HG2 ARG A 198 5.117 -2.255 -4.101 1.00 0.00 H new ATOM 0 HG3 ARG A 198 5.648 -3.922 -3.997 1.00 0.00 H new ATOM 0 HD2 ARG A 198 5.033 -4.089 -6.162 1.00 0.00 H new ATOM 0 HD3 ARG A 198 3.388 -4.163 -5.563 1.00 0.00 H new ATOM 0 HE ARG A 198 3.715 -1.478 -5.748 1.00 0.00 H new ATOM 0 HH11 ARG A 198 4.550 -4.094 -7.983 1.00 0.00 H new ATOM 0 HH12 ARG A 198 4.334 -3.085 -9.417 1.00 0.00 H new ATOM 0 HH21 ARG A 198 3.437 -0.204 -7.599 1.00 0.00 H new ATOM 0 HH22 ARG A 198 3.708 -0.898 -9.201 1.00 0.00 H new ATOM 858 N ILE A 199 0.733 -2.960 -1.629 1.00 0.00 N ATOM 859 CA ILE A 199 -0.016 -3.165 -0.393 1.00 0.00 C ATOM 860 C ILE A 199 0.480 -4.410 0.334 1.00 0.00 C ATOM 861 O ILE A 199 0.380 -5.523 -0.183 1.00 0.00 O ATOM 862 CB ILE A 199 -1.526 -3.304 -0.666 1.00 0.00 C ATOM 863 CG1 ILE A 199 -2.014 -2.151 -1.548 1.00 0.00 C ATOM 864 CG2 ILE A 199 -2.302 -3.346 0.643 1.00 0.00 C ATOM 865 CD1 ILE A 199 -1.965 -0.801 -0.864 1.00 0.00 C ATOM 0 H ILE A 199 0.197 -3.121 -2.482 1.00 0.00 H new ATOM 0 HA ILE A 199 0.146 -2.288 0.233 1.00 0.00 H new ATOM 0 HB ILE A 199 -1.700 -4.241 -1.196 1.00 0.00 H new ATOM 0 HG12 ILE A 199 -1.406 -2.113 -2.452 1.00 0.00 H new ATOM 0 HG13 ILE A 199 -3.038 -2.353 -1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 199 -3.367 -3.444 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 199 -1.969 -4.198 1.236 1.00 0.00 H new ATOM 0 HG23 ILE A 199 -2.126 -2.426 1.200 1.00 0.00 H new ATOM 0 HD11 ILE A 199 -2.325 -0.033 -1.549 1.00 0.00 H new ATOM 0 HD12 ILE A 199 -2.596 -0.820 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 199 -0.938 -0.577 -0.575 1.00 0.00 H new ATOM 877 N VAL A 200 1.028 -4.216 1.530 1.00 0.00 N ATOM 878 CA VAL A 200 1.553 -5.326 2.317 1.00 0.00 C ATOM 879 C VAL A 200 0.544 -5.810 3.355 1.00 0.00 C ATOM 880 O VAL A 200 0.322 -7.012 3.498 1.00 0.00 O ATOM 881 CB VAL A 200 2.861 -4.939 3.033 1.00 0.00 C ATOM 882 CG1 VAL A 200 3.532 -6.170 3.622 1.00 0.00 C ATOM 883 CG2 VAL A 200 3.800 -4.217 2.078 1.00 0.00 C ATOM 0 H VAL A 200 1.120 -3.302 1.974 1.00 0.00 H new ATOM 0 HA VAL A 200 1.753 -6.134 1.613 1.00 0.00 H new ATOM 0 HB VAL A 200 2.618 -4.260 3.850 1.00 0.00 H new ATOM 0 HG11 VAL A 200 4.454 -5.877 4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 200 2.862 -6.641 4.341 1.00 0.00 H new ATOM 0 HG13 VAL A 200 3.762 -6.876 2.824 1.00 0.00 H new ATOM 0 HG21 VAL A 200 4.718 -3.952 2.602 1.00 0.00 H new ATOM 0 HG22 VAL A 200 4.037 -4.870 1.238 1.00 0.00 H new ATOM 0 HG23 VAL A 200 3.318 -3.312 1.709 1.00 0.00 H new ATOM 893 N GLU A 201 -0.064 -4.875 4.082 1.00 0.00 N ATOM 894 CA GLU A 201 -1.044 -5.234 5.105 1.00 0.00 C ATOM 895 C GLU A 201 -2.241 -4.287 5.078 1.00 0.00 C ATOM 896 O GLU A 201 -2.251 -3.300 4.343 1.00 0.00 O ATOM 897 CB GLU A 201 -0.397 -5.231 6.496 1.00 0.00 C ATOM 898 CG GLU A 201 -0.265 -3.851 7.120 1.00 0.00 C ATOM 899 CD GLU A 201 0.782 -3.803 8.216 1.00 0.00 C ATOM 900 OE1 GLU A 201 1.643 -4.707 8.253 1.00 0.00 O ATOM 901 OE2 GLU A 201 0.742 -2.862 9.036 1.00 0.00 O ATOM 0 H GLU A 201 0.102 -3.873 3.984 1.00 0.00 H new ATOM 0 HA GLU A 201 -1.401 -6.240 4.886 1.00 0.00 H new ATOM 0 HB2 GLU A 201 -0.987 -5.863 7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 201 0.593 -5.681 6.425 1.00 0.00 H new ATOM 0 HG2 GLU A 201 -0.007 -3.129 6.345 1.00 0.00 H new ATOM 0 HG3 GLU A 201 -1.229 -3.548 7.530 1.00 0.00 H new ATOM 908 N VAL A 202 -3.246 -4.601 5.889 1.00 0.00 N ATOM 909 CA VAL A 202 -4.454 -3.789 5.968 1.00 0.00 C ATOM 910 C VAL A 202 -5.114 -3.916 7.338 1.00 0.00 C ATOM 911 O VAL A 202 -5.677 -4.957 7.673 1.00 0.00 O ATOM 912 CB VAL A 202 -5.471 -4.195 4.883 1.00 0.00 C ATOM 913 CG1 VAL A 202 -6.650 -3.231 4.860 1.00 0.00 C ATOM 914 CG2 VAL A 202 -4.798 -4.263 3.521 1.00 0.00 C ATOM 0 H VAL A 202 -3.247 -5.416 6.503 1.00 0.00 H new ATOM 0 HA VAL A 202 -4.152 -2.754 5.808 1.00 0.00 H new ATOM 0 HB VAL A 202 -5.853 -5.187 5.124 1.00 0.00 H new ATOM 0 HG11 VAL A 202 -7.355 -3.537 4.087 1.00 0.00 H new ATOM 0 HG12 VAL A 202 -7.148 -3.242 5.830 1.00 0.00 H new ATOM 0 HG13 VAL A 202 -6.292 -2.224 4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 202 -5.531 -4.551 2.767 1.00 0.00 H new ATOM 0 HG22 VAL A 202 -4.384 -3.286 3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 202 -3.996 -5.001 3.548 1.00 0.00 H new ATOM 924 N ASN A 203 -5.045 -2.849 8.126 1.00 0.00 N ATOM 925 CA ASN A 203 -5.637 -2.838 9.461 1.00 0.00 C ATOM 926 C ASN A 203 -4.866 -3.744 10.417 1.00 0.00 C ATOM 927 O ASN A 203 -5.413 -4.213 11.416 1.00 0.00 O ATOM 928 CB ASN A 203 -7.104 -3.275 9.403 1.00 0.00 C ATOM 929 CG ASN A 203 -7.862 -2.924 10.669 1.00 0.00 C ATOM 930 OD1 ASN A 203 -8.229 -1.770 10.886 1.00 0.00 O ATOM 931 ND2 ASN A 203 -8.100 -3.922 11.513 1.00 0.00 N ATOM 0 H ASN A 203 -4.584 -1.978 7.864 1.00 0.00 H new ATOM 0 HA ASN A 203 -5.583 -1.816 9.836 1.00 0.00 H new ATOM 0 HB2 ASN A 203 -7.588 -2.801 8.549 1.00 0.00 H new ATOM 0 HB3 ASN A 203 -7.153 -4.352 9.240 1.00 0.00 H new ATOM 0 HD21 ASN A 203 -8.606 -3.746 12.381 1.00 0.00 H new ATOM 0 HD22 ASN A 203 -7.777 -4.864 11.293 1.00 0.00 H new ATOM 938 N GLY A 204 -3.593 -3.980 10.115 1.00 0.00 N ATOM 939 CA GLY A 204 -2.776 -4.819 10.972 1.00 0.00 C ATOM 940 C GLY A 204 -2.546 -6.212 10.413 1.00 0.00 C ATOM 941 O GLY A 204 -1.636 -6.914 10.854 1.00 0.00 O ATOM 0 H GLY A 204 -3.114 -3.607 9.295 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -1.812 -4.335 11.129 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -3.254 -4.902 11.948 1.00 0.00 H new ATOM 945 N VAL A 205 -3.363 -6.622 9.446 1.00 0.00 N ATOM 946 CA VAL A 205 -3.219 -7.947 8.851 1.00 0.00 C ATOM 947 C VAL A 205 -2.115 -7.959 7.798 1.00 0.00 C ATOM 948 O VAL A 205 -2.340 -7.609 6.639 1.00 0.00 O ATOM 949 CB VAL A 205 -4.538 -8.441 8.221 1.00 0.00 C ATOM 950 CG1 VAL A 205 -5.610 -8.601 9.287 1.00 0.00 C ATOM 951 CG2 VAL A 205 -5.004 -7.496 7.123 1.00 0.00 C ATOM 0 H VAL A 205 -4.124 -6.062 9.061 1.00 0.00 H new ATOM 0 HA VAL A 205 -2.950 -8.626 9.660 1.00 0.00 H new ATOM 0 HB VAL A 205 -4.355 -9.416 7.769 1.00 0.00 H new ATOM 0 HG11 VAL A 205 -6.533 -8.950 8.825 1.00 0.00 H new ATOM 0 HG12 VAL A 205 -5.279 -9.327 10.030 1.00 0.00 H new ATOM 0 HG13 VAL A 205 -5.787 -7.641 9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 205 -5.935 -7.867 6.695 1.00 0.00 H new ATOM 0 HG22 VAL A 205 -5.167 -6.503 7.542 1.00 0.00 H new ATOM 0 HG23 VAL A 205 -4.244 -7.440 6.344 1.00 0.00 H new ATOM 961 N CYS A 206 -0.917 -8.360 8.214 1.00 0.00 N ATOM 962 CA CYS A 206 0.232 -8.414 7.316 1.00 0.00 C ATOM 963 C CYS A 206 0.291 -9.747 6.576 1.00 0.00 C ATOM 964 O CYS A 206 0.685 -10.766 7.143 1.00 0.00 O ATOM 965 CB CYS A 206 1.527 -8.197 8.099 1.00 0.00 C ATOM 966 SG CYS A 206 2.986 -7.949 7.060 1.00 0.00 S ATOM 0 H CYS A 206 -0.717 -8.653 9.170 1.00 0.00 H new ATOM 0 HA CYS A 206 0.119 -7.618 6.580 1.00 0.00 H new ATOM 0 HB2 CYS A 206 1.405 -7.330 8.748 1.00 0.00 H new ATOM 0 HB3 CYS A 206 1.697 -9.058 8.745 1.00 0.00 H new ATOM 0 HG CYS A 206 4.030 -7.772 7.814 1.00 0.00 H new ATOM 972 N MET A 207 -0.100 -9.729 5.306 1.00 0.00 N ATOM 973 CA MET A 207 -0.087 -10.933 4.485 1.00 0.00 C ATOM 974 C MET A 207 0.614 -10.680 3.155 1.00 0.00 C ATOM 975 O MET A 207 0.027 -10.123 2.227 1.00 0.00 O ATOM 976 CB MET A 207 -1.516 -11.421 4.239 1.00 0.00 C ATOM 977 CG MET A 207 -2.136 -12.113 5.441 1.00 0.00 C ATOM 978 SD MET A 207 -1.217 -13.579 5.948 1.00 0.00 S ATOM 979 CE MET A 207 -1.295 -14.562 4.453 1.00 0.00 C ATOM 0 H MET A 207 -0.430 -8.893 4.823 1.00 0.00 H new ATOM 0 HA MET A 207 0.466 -11.703 5.023 1.00 0.00 H new ATOM 0 HB2 MET A 207 -2.138 -10.571 3.958 1.00 0.00 H new ATOM 0 HB3 MET A 207 -1.516 -12.109 3.394 1.00 0.00 H new ATOM 0 HG2 MET A 207 -2.183 -11.412 6.275 1.00 0.00 H new ATOM 0 HG3 MET A 207 -3.162 -12.396 5.204 1.00 0.00 H new ATOM 0 HE1 MET A 207 -1.082 -15.604 4.691 1.00 0.00 H new ATOM 0 HE2 MET A 207 -2.292 -14.485 4.019 1.00 0.00 H new ATOM 0 HE3 MET A 207 -0.558 -14.196 3.738 1.00 0.00 H new ATOM 989 N GLU A 208 1.874 -11.093 3.066 1.00 0.00 N ATOM 990 CA GLU A 208 2.647 -10.909 1.845 1.00 0.00 C ATOM 991 C GLU A 208 2.107 -11.793 0.727 1.00 0.00 C ATOM 992 O GLU A 208 2.340 -13.002 0.710 1.00 0.00 O ATOM 993 CB GLU A 208 4.123 -11.221 2.092 1.00 0.00 C ATOM 994 CG GLU A 208 5.039 -10.712 0.991 1.00 0.00 C ATOM 995 CD GLU A 208 6.479 -10.581 1.445 1.00 0.00 C ATOM 996 OE1 GLU A 208 6.708 -10.039 2.547 1.00 0.00 O ATOM 997 OE2 GLU A 208 7.379 -11.019 0.697 1.00 0.00 O ATOM 0 H GLU A 208 2.379 -11.555 3.822 1.00 0.00 H new ATOM 0 HA GLU A 208 2.555 -9.867 1.540 1.00 0.00 H new ATOM 0 HB2 GLU A 208 4.427 -10.779 3.041 1.00 0.00 H new ATOM 0 HB3 GLU A 208 4.248 -12.300 2.189 1.00 0.00 H new ATOM 0 HG2 GLU A 208 4.991 -11.392 0.140 1.00 0.00 H new ATOM 0 HG3 GLU A 208 4.681 -9.742 0.645 1.00 0.00 H new ATOM 1004 N GLY A 209 1.381 -11.182 -0.201 1.00 0.00 N ATOM 1005 CA GLY A 209 0.812 -11.925 -1.309 1.00 0.00 C ATOM 1006 C GLY A 209 -0.704 -11.955 -1.265 1.00 0.00 C ATOM 1007 O GLY A 209 -1.329 -12.855 -1.827 1.00 0.00 O ATOM 0 H GLY A 209 1.176 -10.183 -0.206 1.00 0.00 H new ATOM 0 HA2 GLY A 209 1.137 -11.478 -2.248 1.00 0.00 H new ATOM 0 HA3 GLY A 209 1.194 -12.946 -1.293 1.00 0.00 H new ATOM 1011 N LYS A 210 -1.298 -10.970 -0.595 1.00 0.00 N ATOM 1012 CA LYS A 210 -2.751 -10.889 -0.479 1.00 0.00 C ATOM 1013 C LYS A 210 -3.415 -10.905 -1.853 1.00 0.00 C ATOM 1014 O LYS A 210 -2.785 -10.592 -2.864 1.00 0.00 O ATOM 1015 CB LYS A 210 -3.154 -9.622 0.280 1.00 0.00 C ATOM 1016 CG LYS A 210 -3.030 -9.752 1.789 1.00 0.00 C ATOM 1017 CD LYS A 210 -4.219 -10.487 2.384 1.00 0.00 C ATOM 1018 CE LYS A 210 -5.232 -9.521 2.978 1.00 0.00 C ATOM 1019 NZ LYS A 210 -6.228 -10.216 3.839 1.00 0.00 N ATOM 0 H LYS A 210 -0.795 -10.217 -0.125 1.00 0.00 H new ATOM 0 HA LYS A 210 -3.092 -11.763 0.076 1.00 0.00 H new ATOM 0 HB2 LYS A 210 -2.532 -8.793 -0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 210 -4.184 -9.370 0.029 1.00 0.00 H new ATOM 0 HG2 LYS A 210 -2.111 -10.285 2.035 1.00 0.00 H new ATOM 0 HG3 LYS A 210 -2.953 -8.761 2.236 1.00 0.00 H new ATOM 0 HD2 LYS A 210 -4.699 -11.090 1.613 1.00 0.00 H new ATOM 0 HD3 LYS A 210 -3.874 -11.174 3.157 1.00 0.00 H new ATOM 0 HE2 LYS A 210 -4.711 -8.765 3.565 1.00 0.00 H new ATOM 0 HE3 LYS A 210 -5.750 -8.999 2.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 -6.899 -9.521 4.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 -6.744 -10.920 3.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 -5.737 -10.693 4.622 1.00 0.00 H new ATOM 1033 N GLN A 211 -4.691 -11.278 -1.880 1.00 0.00 N ATOM 1034 CA GLN A 211 -5.446 -11.344 -3.128 1.00 0.00 C ATOM 1035 C GLN A 211 -6.288 -10.088 -3.329 1.00 0.00 C ATOM 1036 O GLN A 211 -6.570 -9.357 -2.379 1.00 0.00 O ATOM 1037 CB GLN A 211 -6.350 -12.581 -3.132 1.00 0.00 C ATOM 1038 CG GLN A 211 -5.618 -13.876 -2.806 1.00 0.00 C ATOM 1039 CD GLN A 211 -4.869 -14.480 -3.981 1.00 0.00 C ATOM 1040 OE1 GLN A 211 -4.698 -13.720 -5.054 1.00 0.00 O flip ATOM 1041 NE2 GLN A 211 -4.443 -15.634 -3.921 1.00 0.00 N flip ATOM 0 H GLN A 211 -5.225 -11.540 -1.051 1.00 0.00 H new ATOM 0 HA GLN A 211 -4.733 -11.414 -3.950 1.00 0.00 H new ATOM 0 HB2 GLN A 211 -7.152 -12.436 -2.409 1.00 0.00 H new ATOM 0 HB3 GLN A 211 -6.817 -12.675 -4.112 1.00 0.00 H new ATOM 0 HG2 GLN A 211 -4.912 -13.687 -1.997 1.00 0.00 H new ATOM 0 HG3 GLN A 211 -6.339 -14.605 -2.436 1.00 0.00 H new ATOM 0 HE21 GLN A 211 -4.593 -16.190 -3.079 1.00 0.00 H new ATOM 0 HE22 GLN A 211 -3.940 -16.034 -4.713 1.00 0.00 H new ATOM 1050 N HIS A 212 -6.688 -9.844 -4.575 1.00 0.00 N ATOM 1051 CA HIS A 212 -7.500 -8.678 -4.912 1.00 0.00 C ATOM 1052 C HIS A 212 -8.680 -8.533 -3.953 1.00 0.00 C ATOM 1053 O HIS A 212 -8.799 -7.531 -3.248 1.00 0.00 O ATOM 1054 CB HIS A 212 -8.010 -8.786 -6.350 1.00 0.00 C ATOM 1055 CG HIS A 212 -8.794 -7.592 -6.796 1.00 0.00 C ATOM 1056 ND1 HIS A 212 -8.452 -6.300 -6.459 1.00 0.00 N ATOM 1057 CD2 HIS A 212 -9.911 -7.498 -7.557 1.00 0.00 C ATOM 1058 CE1 HIS A 212 -9.324 -5.462 -6.991 1.00 0.00 C ATOM 1059 NE2 HIS A 212 -10.219 -6.164 -7.663 1.00 0.00 N ATOM 0 H HIS A 212 -6.462 -10.441 -5.370 1.00 0.00 H new ATOM 0 HA HIS A 212 -6.871 -7.793 -4.819 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -7.161 -8.924 -7.019 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -8.634 -9.675 -6.440 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -10.457 -8.319 -7.998 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -9.308 -4.387 -6.893 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -11.011 -5.778 -8.177 1.00 0.00 H new ATOM 1068 N GLY A 213 -9.548 -9.540 -3.930 1.00 0.00 N ATOM 1069 CA GLY A 213 -10.704 -9.504 -3.053 1.00 0.00 C ATOM 1070 C GLY A 213 -10.313 -9.373 -1.595 1.00 0.00 C ATOM 1071 O GLY A 213 -11.039 -8.775 -0.801 1.00 0.00 O ATOM 0 H GLY A 213 -9.471 -10.380 -4.503 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -11.344 -8.667 -3.332 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -11.290 -10.413 -3.190 1.00 0.00 H new ATOM 1075 N ASP A 214 -9.157 -9.928 -1.244 1.00 0.00 N ATOM 1076 CA ASP A 214 -8.666 -9.863 0.127 1.00 0.00 C ATOM 1077 C ASP A 214 -8.338 -8.424 0.502 1.00 0.00 C ATOM 1078 O ASP A 214 -8.720 -7.946 1.570 1.00 0.00 O ATOM 1079 CB ASP A 214 -7.427 -10.745 0.293 1.00 0.00 C ATOM 1080 CG ASP A 214 -7.777 -12.210 0.463 1.00 0.00 C ATOM 1081 OD1 ASP A 214 -8.607 -12.717 -0.320 1.00 0.00 O ATOM 1082 OD2 ASP A 214 -7.222 -12.850 1.381 1.00 0.00 O ATOM 0 H ASP A 214 -8.544 -10.427 -1.889 1.00 0.00 H new ATOM 0 HA ASP A 214 -9.448 -10.231 0.792 1.00 0.00 H new ATOM 0 HB2 ASP A 214 -6.782 -10.627 -0.578 1.00 0.00 H new ATOM 0 HB3 ASP A 214 -6.858 -10.408 1.159 1.00 0.00 H new ATOM 1087 N VAL A 215 -7.638 -7.735 -0.393 1.00 0.00 N ATOM 1088 CA VAL A 215 -7.269 -6.345 -0.167 1.00 0.00 C ATOM 1089 C VAL A 215 -8.499 -5.450 -0.238 1.00 0.00 C ATOM 1090 O VAL A 215 -8.610 -4.468 0.494 1.00 0.00 O ATOM 1091 CB VAL A 215 -6.236 -5.860 -1.201 1.00 0.00 C ATOM 1092 CG1 VAL A 215 -5.742 -4.465 -0.851 1.00 0.00 C ATOM 1093 CG2 VAL A 215 -5.075 -6.838 -1.294 1.00 0.00 C ATOM 0 H VAL A 215 -7.315 -8.118 -1.282 1.00 0.00 H new ATOM 0 HA VAL A 215 -6.825 -6.286 0.827 1.00 0.00 H new ATOM 0 HB VAL A 215 -6.720 -5.813 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 215 -5.013 -4.140 -1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 215 -6.584 -3.773 -0.842 1.00 0.00 H new ATOM 0 HG13 VAL A 215 -5.275 -4.481 0.134 1.00 0.00 H new ATOM 0 HG21 VAL A 215 -4.355 -6.479 -2.029 1.00 0.00 H new ATOM 0 HG22 VAL A 215 -4.590 -6.920 -0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 215 -5.447 -7.816 -1.598 1.00 0.00 H new ATOM 1103 N VAL A 216 -9.424 -5.805 -1.124 1.00 0.00 N ATOM 1104 CA VAL A 216 -10.654 -5.044 -1.292 1.00 0.00 C ATOM 1105 C VAL A 216 -11.564 -5.220 -0.083 1.00 0.00 C ATOM 1106 O VAL A 216 -12.157 -4.259 0.407 1.00 0.00 O ATOM 1107 CB VAL A 216 -11.411 -5.477 -2.562 1.00 0.00 C ATOM 1108 CG1 VAL A 216 -12.635 -4.601 -2.785 1.00 0.00 C ATOM 1109 CG2 VAL A 216 -10.490 -5.436 -3.773 1.00 0.00 C ATOM 0 H VAL A 216 -9.344 -6.616 -1.737 1.00 0.00 H new ATOM 0 HA VAL A 216 -10.375 -3.995 -1.389 1.00 0.00 H new ATOM 0 HB VAL A 216 -11.750 -6.504 -2.425 1.00 0.00 H new ATOM 0 HG11 VAL A 216 -13.154 -4.924 -3.687 1.00 0.00 H new ATOM 0 HG12 VAL A 216 -13.305 -4.688 -1.930 1.00 0.00 H new ATOM 0 HG13 VAL A 216 -12.324 -3.563 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 216 -11.042 -5.745 -4.661 1.00 0.00 H new ATOM 0 HG22 VAL A 216 -10.117 -4.421 -3.912 1.00 0.00 H new ATOM 0 HG23 VAL A 216 -9.650 -6.112 -3.614 1.00 0.00 H new ATOM 1119 N SER A 217 -11.665 -6.455 0.396 1.00 0.00 N ATOM 1120 CA SER A 217 -12.499 -6.758 1.553 1.00 0.00 C ATOM 1121 C SER A 217 -11.851 -6.245 2.835 1.00 0.00 C ATOM 1122 O SER A 217 -12.538 -5.830 3.768 1.00 0.00 O ATOM 1123 CB SER A 217 -12.736 -8.265 1.657 1.00 0.00 C ATOM 1124 OG SER A 217 -13.474 -8.744 0.546 1.00 0.00 O ATOM 0 H SER A 217 -11.180 -7.261 0.002 1.00 0.00 H new ATOM 0 HA SER A 217 -13.457 -6.255 1.422 1.00 0.00 H new ATOM 0 HB2 SER A 217 -11.779 -8.784 1.712 1.00 0.00 H new ATOM 0 HB3 SER A 217 -13.274 -8.489 2.578 1.00 0.00 H new ATOM 0 HG SER A 217 -12.867 -8.901 -0.207 1.00 0.00 H new ATOM 1130 N ALA A 218 -10.523 -6.276 2.870 1.00 0.00 N ATOM 1131 CA ALA A 218 -9.775 -5.815 4.033 1.00 0.00 C ATOM 1132 C ALA A 218 -10.109 -4.364 4.362 1.00 0.00 C ATOM 1133 O ALA A 218 -10.386 -4.027 5.512 1.00 0.00 O ATOM 1134 CB ALA A 218 -8.281 -5.973 3.793 1.00 0.00 C ATOM 0 H ALA A 218 -9.942 -6.617 2.104 1.00 0.00 H new ATOM 0 HA ALA A 218 -10.063 -6.428 4.887 1.00 0.00 H new ATOM 0 HB1 ALA A 218 -7.733 -5.625 4.669 1.00 0.00 H new ATOM 0 HB2 ALA A 218 -8.050 -7.023 3.614 1.00 0.00 H new ATOM 0 HB3 ALA A 218 -7.988 -5.384 2.924 1.00 0.00 H new ATOM 1140 N ILE A 219 -10.087 -3.510 3.343 1.00 0.00 N ATOM 1141 CA ILE A 219 -10.394 -2.097 3.531 1.00 0.00 C ATOM 1142 C ILE A 219 -11.837 -1.916 3.988 1.00 0.00 C ATOM 1143 O ILE A 219 -12.127 -1.090 4.854 1.00 0.00 O ATOM 1144 CB ILE A 219 -10.165 -1.286 2.238 1.00 0.00 C ATOM 1145 CG1 ILE A 219 -8.758 -1.544 1.688 1.00 0.00 C ATOM 1146 CG2 ILE A 219 -10.380 0.201 2.496 1.00 0.00 C ATOM 1147 CD1 ILE A 219 -7.655 -0.924 2.518 1.00 0.00 C ATOM 0 H ILE A 219 -9.861 -3.771 2.383 1.00 0.00 H new ATOM 0 HA ILE A 219 -9.717 -1.723 4.299 1.00 0.00 H new ATOM 0 HB ILE A 219 -10.889 -1.611 1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 219 -8.593 -2.620 1.627 1.00 0.00 H new ATOM 0 HG13 ILE A 219 -8.698 -1.154 0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 219 -10.214 0.758 1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 219 -11.400 0.366 2.842 1.00 0.00 H new ATOM 0 HG23 ILE A 219 -9.679 0.543 3.257 1.00 0.00 H new ATOM 0 HD11 ILE A 219 -6.689 -1.150 2.066 1.00 0.00 H new ATOM 0 HD12 ILE A 219 -7.793 0.156 2.558 1.00 0.00 H new ATOM 0 HD13 ILE A 219 -7.687 -1.332 3.528 1.00 0.00 H new ATOM 1159 N ARG A 220 -12.738 -2.699 3.404 1.00 0.00 N ATOM 1160 CA ARG A 220 -14.153 -2.633 3.754 1.00 0.00 C ATOM 1161 C ARG A 220 -14.354 -2.915 5.239 1.00 0.00 C ATOM 1162 O ARG A 220 -15.125 -2.232 5.913 1.00 0.00 O ATOM 1163 CB ARG A 220 -14.956 -3.634 2.920 1.00 0.00 C ATOM 1164 CG ARG A 220 -16.462 -3.454 3.033 1.00 0.00 C ATOM 1165 CD ARG A 220 -17.198 -4.156 1.901 1.00 0.00 C ATOM 1166 NE ARG A 220 -18.061 -5.230 2.391 1.00 0.00 N ATOM 1167 CZ ARG A 220 -17.621 -6.443 2.721 1.00 0.00 C ATOM 1168 NH1 ARG A 220 -16.332 -6.741 2.611 1.00 0.00 N ATOM 1169 NH2 ARG A 220 -18.471 -7.360 3.161 1.00 0.00 N ATOM 0 H ARG A 220 -12.514 -3.387 2.686 1.00 0.00 H new ATOM 0 HA ARG A 220 -14.510 -1.626 3.539 1.00 0.00 H new ATOM 0 HB2 ARG A 220 -14.665 -3.538 1.874 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -14.695 -4.645 3.232 1.00 0.00 H new ATOM 0 HG2 ARG A 220 -16.805 -3.848 3.990 1.00 0.00 H new ATOM 0 HG3 ARG A 220 -16.704 -2.391 3.021 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -17.799 -3.429 1.354 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -16.474 -4.566 1.197 1.00 0.00 H new ATOM 0 HE ARG A 220 -19.058 -5.039 2.486 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -15.673 -6.039 2.272 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -16.000 -7.671 2.865 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -19.463 -7.137 3.247 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -18.134 -8.289 3.414 1.00 0.00 H new ATOM 1183 N ALA A 221 -13.652 -3.926 5.743 1.00 0.00 N ATOM 1184 CA ALA A 221 -13.748 -4.298 7.151 1.00 0.00 C ATOM 1185 C ALA A 221 -12.808 -3.460 8.018 1.00 0.00 C ATOM 1186 O ALA A 221 -12.684 -3.701 9.219 1.00 0.00 O ATOM 1187 CB ALA A 221 -13.447 -5.779 7.326 1.00 0.00 C ATOM 0 H ALA A 221 -13.011 -4.502 5.198 1.00 0.00 H new ATOM 0 HA ALA A 221 -14.768 -4.100 7.479 1.00 0.00 H new ATOM 0 HB1 ALA A 221 -13.522 -6.043 8.381 1.00 0.00 H new ATOM 0 HB2 ALA A 221 -14.164 -6.366 6.753 1.00 0.00 H new ATOM 0 HB3 ALA A 221 -12.439 -5.990 6.970 1.00 0.00 H new ATOM 1193 N GLY A 222 -12.145 -2.480 7.407 1.00 0.00 N ATOM 1194 CA GLY A 222 -11.227 -1.633 8.148 1.00 0.00 C ATOM 1195 C GLY A 222 -11.895 -0.394 8.717 1.00 0.00 C ATOM 1196 O GLY A 222 -11.222 0.581 9.049 1.00 0.00 O ATOM 0 H GLY A 222 -12.227 -2.259 6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 222 -10.786 -2.208 8.962 1.00 0.00 H new ATOM 0 HA3 GLY A 222 -10.410 -1.331 7.493 1.00 0.00 H new ATOM 1200 N GLY A 223 -13.220 -0.431 8.834 1.00 0.00 N ATOM 1201 CA GLY A 223 -13.953 0.703 9.371 1.00 0.00 C ATOM 1202 C GLY A 223 -13.580 2.016 8.709 1.00 0.00 C ATOM 1203 O GLY A 223 -13.428 2.084 7.489 1.00 0.00 O ATOM 0 H GLY A 223 -13.799 -1.227 8.566 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -15.022 0.530 9.246 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -13.765 0.776 10.442 1.00 0.00 H new ATOM 1207 N ASP A 224 -13.435 3.062 9.518 1.00 0.00 N ATOM 1208 CA ASP A 224 -13.080 4.381 9.008 1.00 0.00 C ATOM 1209 C ASP A 224 -11.565 4.574 8.991 1.00 0.00 C ATOM 1210 O ASP A 224 -11.040 5.371 8.214 1.00 0.00 O ATOM 1211 CB ASP A 224 -13.736 5.471 9.857 1.00 0.00 C ATOM 1212 CG ASP A 224 -15.244 5.494 9.704 1.00 0.00 C ATOM 1213 OD1 ASP A 224 -15.913 4.611 10.281 1.00 0.00 O ATOM 1214 OD2 ASP A 224 -15.757 6.395 9.007 1.00 0.00 O ATOM 0 H ASP A 224 -13.558 3.021 10.530 1.00 0.00 H new ATOM 0 HA ASP A 224 -13.446 4.456 7.984 1.00 0.00 H new ATOM 0 HB2 ASP A 224 -13.482 5.313 10.905 1.00 0.00 H new ATOM 0 HB3 ASP A 224 -13.330 6.442 9.574 1.00 0.00 H new ATOM 1219 N GLU A 225 -10.869 3.837 9.850 1.00 0.00 N ATOM 1220 CA GLU A 225 -9.416 3.924 9.931 1.00 0.00 C ATOM 1221 C GLU A 225 -8.772 2.763 9.183 1.00 0.00 C ATOM 1222 O GLU A 225 -8.977 1.600 9.529 1.00 0.00 O ATOM 1223 CB GLU A 225 -8.963 3.922 11.393 1.00 0.00 C ATOM 1224 CG GLU A 225 -7.530 4.387 11.588 1.00 0.00 C ATOM 1225 CD GLU A 225 -7.122 4.419 13.047 1.00 0.00 C ATOM 1226 OE1 GLU A 225 -7.618 3.574 13.822 1.00 0.00 O ATOM 1227 OE2 GLU A 225 -6.305 5.290 13.417 1.00 0.00 O ATOM 0 H GLU A 225 -11.288 3.172 10.500 1.00 0.00 H new ATOM 0 HA GLU A 225 -9.100 4.858 9.467 1.00 0.00 H new ATOM 0 HB2 GLU A 225 -9.626 4.566 11.971 1.00 0.00 H new ATOM 0 HB3 GLU A 225 -9.067 2.914 11.795 1.00 0.00 H new ATOM 0 HG2 GLU A 225 -6.859 3.724 11.041 1.00 0.00 H new ATOM 0 HG3 GLU A 225 -7.413 5.383 11.160 1.00 0.00 H new ATOM 1234 N THR A 226 -8.002 3.083 8.148 1.00 0.00 N ATOM 1235 CA THR A 226 -7.344 2.059 7.347 1.00 0.00 C ATOM 1236 C THR A 226 -5.830 2.083 7.538 1.00 0.00 C ATOM 1237 O THR A 226 -5.129 2.890 6.928 1.00 0.00 O ATOM 1238 CB THR A 226 -7.684 2.248 5.868 1.00 0.00 C ATOM 1239 OG1 THR A 226 -9.044 2.612 5.709 1.00 0.00 O ATOM 1240 CG2 THR A 226 -7.440 1.010 5.033 1.00 0.00 C ATOM 0 H THR A 226 -7.819 4.040 7.846 1.00 0.00 H new ATOM 0 HA THR A 226 -7.710 1.089 7.684 1.00 0.00 H new ATOM 0 HB THR A 226 -7.019 3.038 5.518 1.00 0.00 H new ATOM 0 HG1 THR A 226 -9.242 2.730 4.756 1.00 0.00 H new ATOM 0 HG21 THR A 226 -7.702 1.214 3.995 1.00 0.00 H new ATOM 0 HG22 THR A 226 -6.388 0.732 5.094 1.00 0.00 H new ATOM 0 HG23 THR A 226 -8.054 0.191 5.408 1.00 0.00 H new ATOM 1248 N LYS A 227 -5.331 1.180 8.377 1.00 0.00 N ATOM 1249 CA LYS A 227 -3.898 1.080 8.638 1.00 0.00 C ATOM 1250 C LYS A 227 -3.246 0.164 7.612 1.00 0.00 C ATOM 1251 O LYS A 227 -3.248 -1.057 7.767 1.00 0.00 O ATOM 1252 CB LYS A 227 -3.646 0.544 10.048 1.00 0.00 C ATOM 1253 CG LYS A 227 -4.590 1.112 11.094 1.00 0.00 C ATOM 1254 CD LYS A 227 -4.026 0.958 12.497 1.00 0.00 C ATOM 1255 CE LYS A 227 -4.396 2.138 13.382 1.00 0.00 C ATOM 1256 NZ LYS A 227 -5.515 1.810 14.308 1.00 0.00 N ATOM 0 H LYS A 227 -5.899 0.505 8.889 1.00 0.00 H new ATOM 0 HA LYS A 227 -3.461 2.075 8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -3.741 -0.542 10.037 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -2.620 0.771 10.336 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -4.771 2.167 10.887 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -5.553 0.605 11.030 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -4.402 0.037 12.942 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -2.941 0.867 12.446 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -3.525 2.445 13.960 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -4.679 2.985 12.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -6.382 2.288 13.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -5.669 0.782 14.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -5.277 2.131 15.268 1.00 0.00 H new ATOM 1270 N LEU A 228 -2.709 0.754 6.552 1.00 0.00 N ATOM 1271 CA LEU A 228 -2.081 -0.021 5.491 1.00 0.00 C ATOM 1272 C LEU A 228 -0.565 0.139 5.478 1.00 0.00 C ATOM 1273 O LEU A 228 -0.042 1.236 5.650 1.00 0.00 O ATOM 1274 CB LEU A 228 -2.652 0.401 4.137 1.00 0.00 C ATOM 1275 CG LEU A 228 -4.173 0.557 4.098 1.00 0.00 C ATOM 1276 CD1 LEU A 228 -4.640 0.913 2.695 1.00 0.00 C ATOM 1277 CD2 LEU A 228 -4.849 -0.717 4.581 1.00 0.00 C ATOM 0 H LEU A 228 -2.696 1.763 6.405 1.00 0.00 H new ATOM 0 HA LEU A 228 -2.299 -1.072 5.682 1.00 0.00 H new ATOM 0 HB2 LEU A 228 -2.197 1.348 3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 228 -2.358 -0.336 3.390 1.00 0.00 H new ATOM 0 HG LEU A 228 -4.453 1.371 4.766 1.00 0.00 H new ATOM 0 HD11 LEU A 228 -5.725 1.019 2.689 1.00 0.00 H new ATOM 0 HD12 LEU A 228 -4.181 1.852 2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 228 -4.349 0.123 2.003 1.00 0.00 H new ATOM 0 HD21 LEU A 228 -5.931 -0.590 4.547 1.00 0.00 H new ATOM 0 HD22 LEU A 228 -4.561 -1.548 3.937 1.00 0.00 H new ATOM 0 HD23 LEU A 228 -4.540 -0.927 5.605 1.00 0.00 H new ATOM 1289 N LEU A 229 0.126 -0.968 5.236 1.00 0.00 N ATOM 1290 CA LEU A 229 1.584 -0.975 5.154 1.00 0.00 C ATOM 1291 C LEU A 229 1.989 -1.206 3.706 1.00 0.00 C ATOM 1292 O LEU A 229 1.758 -2.284 3.158 1.00 0.00 O ATOM 1293 CB LEU A 229 2.172 -2.075 6.042 1.00 0.00 C ATOM 1294 CG LEU A 229 3.698 -2.186 6.020 1.00 0.00 C ATOM 1295 CD1 LEU A 229 4.327 -1.138 6.925 1.00 0.00 C ATOM 1296 CD2 LEU A 229 4.134 -3.583 6.437 1.00 0.00 C ATOM 0 H LEU A 229 -0.304 -1.882 5.092 1.00 0.00 H new ATOM 0 HA LEU A 229 1.969 -0.017 5.503 1.00 0.00 H new ATOM 0 HB2 LEU A 229 1.851 -1.900 7.069 1.00 0.00 H new ATOM 0 HB3 LEU A 229 1.750 -3.032 5.735 1.00 0.00 H new ATOM 0 HG LEU A 229 4.041 -2.006 5.001 1.00 0.00 H new ATOM 0 HD11 LEU A 229 5.412 -1.235 6.894 1.00 0.00 H new ATOM 0 HD12 LEU A 229 4.042 -0.143 6.583 1.00 0.00 H new ATOM 0 HD13 LEU A 229 3.978 -1.284 7.947 1.00 0.00 H new ATOM 0 HD21 LEU A 229 5.222 -3.646 6.416 1.00 0.00 H new ATOM 0 HD22 LEU A 229 3.778 -3.789 7.446 1.00 0.00 H new ATOM 0 HD23 LEU A 229 3.715 -4.316 5.748 1.00 0.00 H new ATOM 1308 N VAL A 230 2.561 -0.190 3.072 1.00 0.00 N ATOM 1309 CA VAL A 230 2.945 -0.310 1.674 1.00 0.00 C ATOM 1310 C VAL A 230 4.412 0.021 1.433 1.00 0.00 C ATOM 1311 O VAL A 230 5.017 0.822 2.146 1.00 0.00 O ATOM 1312 CB VAL A 230 2.082 0.605 0.780 1.00 0.00 C ATOM 1313 CG1 VAL A 230 0.615 0.211 0.868 1.00 0.00 C ATOM 1314 CG2 VAL A 230 2.275 2.064 1.167 1.00 0.00 C ATOM 0 H VAL A 230 2.766 0.714 3.498 1.00 0.00 H new ATOM 0 HA VAL A 230 2.781 -1.355 1.412 1.00 0.00 H new ATOM 0 HB VAL A 230 2.404 0.481 -0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 230 0.023 0.868 0.231 1.00 0.00 H new ATOM 0 HG12 VAL A 230 0.495 -0.821 0.537 1.00 0.00 H new ATOM 0 HG13 VAL A 230 0.275 0.303 1.899 1.00 0.00 H new ATOM 0 HG21 VAL A 230 1.659 2.695 0.526 1.00 0.00 H new ATOM 0 HG22 VAL A 230 1.981 2.206 2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.323 2.337 1.045 1.00 0.00 H new ATOM 1324 N VAL A 231 4.952 -0.585 0.386 1.00 0.00 N ATOM 1325 CA VAL A 231 6.329 -0.365 -0.032 1.00 0.00 C ATOM 1326 C VAL A 231 6.290 0.180 -1.446 1.00 0.00 C ATOM 1327 O VAL A 231 5.501 -0.294 -2.249 1.00 0.00 O ATOM 1328 CB VAL A 231 7.154 -1.669 -0.010 1.00 0.00 C ATOM 1329 CG1 VAL A 231 8.643 -1.361 0.041 1.00 0.00 C ATOM 1330 CG2 VAL A 231 6.742 -2.549 1.160 1.00 0.00 C ATOM 0 H VAL A 231 4.444 -1.247 -0.201 1.00 0.00 H new ATOM 0 HA VAL A 231 6.807 0.331 0.658 1.00 0.00 H new ATOM 0 HB VAL A 231 6.952 -2.216 -0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 231 9.207 -2.294 0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 231 8.925 -0.780 -0.837 1.00 0.00 H new ATOM 0 HG13 VAL A 231 8.865 -0.788 0.941 1.00 0.00 H new ATOM 0 HG21 VAL A 231 7.337 -3.462 1.155 1.00 0.00 H new ATOM 0 HG22 VAL A 231 6.908 -2.013 2.094 1.00 0.00 H new ATOM 0 HG23 VAL A 231 5.686 -2.803 1.070 1.00 0.00 H new ATOM 1340 N ASP A 232 7.104 1.175 -1.760 1.00 0.00 N ATOM 1341 CA ASP A 232 7.067 1.756 -3.092 1.00 0.00 C ATOM 1342 C ASP A 232 7.572 0.762 -4.132 1.00 0.00 C ATOM 1343 O ASP A 232 8.500 0.002 -3.870 1.00 0.00 O ATOM 1344 CB ASP A 232 7.910 3.032 -3.119 1.00 0.00 C ATOM 1345 CG ASP A 232 7.537 3.946 -4.266 1.00 0.00 C ATOM 1346 OD1 ASP A 232 6.921 3.458 -5.235 1.00 0.00 O ATOM 1347 OD2 ASP A 232 7.860 5.151 -4.196 1.00 0.00 O ATOM 0 H ASP A 232 7.786 1.591 -1.125 1.00 0.00 H new ATOM 0 HA ASP A 232 6.034 2.003 -3.338 1.00 0.00 H new ATOM 0 HB2 ASP A 232 7.786 3.566 -2.177 1.00 0.00 H new ATOM 0 HB3 ASP A 232 8.964 2.766 -3.198 1.00 0.00 H new ATOM 1352 N ARG A 233 6.960 0.778 -5.321 1.00 0.00 N ATOM 1353 CA ARG A 233 7.377 -0.122 -6.405 1.00 0.00 C ATOM 1354 C ARG A 233 8.856 0.069 -6.649 1.00 0.00 C ATOM 1355 O ARG A 233 9.557 -0.832 -7.105 1.00 0.00 O ATOM 1356 CB ARG A 233 6.616 0.147 -7.707 1.00 0.00 C ATOM 1357 CG ARG A 233 6.845 -0.912 -8.772 1.00 0.00 C ATOM 1358 CD ARG A 233 6.500 -0.392 -10.158 1.00 0.00 C ATOM 1359 NE ARG A 233 7.280 0.793 -10.506 1.00 0.00 N ATOM 1360 CZ ARG A 233 7.147 1.460 -11.650 1.00 0.00 C ATOM 1361 NH1 ARG A 233 6.265 1.063 -12.561 1.00 0.00 N ATOM 1362 NH2 ARG A 233 7.897 2.528 -11.884 1.00 0.00 N ATOM 0 H ARG A 233 6.183 1.396 -5.557 1.00 0.00 H new ATOM 0 HA ARG A 233 7.155 -1.144 -6.099 1.00 0.00 H new ATOM 0 HB2 ARG A 233 5.550 0.208 -7.489 1.00 0.00 H new ATOM 0 HB3 ARG A 233 6.917 1.118 -8.101 1.00 0.00 H new ATOM 0 HG2 ARG A 233 7.887 -1.231 -8.751 1.00 0.00 H new ATOM 0 HG3 ARG A 233 6.238 -1.790 -8.550 1.00 0.00 H new ATOM 0 HD2 ARG A 233 6.681 -1.175 -10.895 1.00 0.00 H new ATOM 0 HD3 ARG A 233 5.437 -0.153 -10.202 1.00 0.00 H new ATOM 0 HE ARG A 233 7.968 1.129 -9.832 1.00 0.00 H new ATOM 0 HH11 ARG A 233 5.685 0.243 -12.386 1.00 0.00 H new ATOM 0 HH12 ARG A 233 6.168 1.579 -13.436 1.00 0.00 H new ATOM 0 HH21 ARG A 233 8.575 2.838 -11.188 1.00 0.00 H new ATOM 0 HH22 ARG A 233 7.796 3.040 -12.760 1.00 0.00 H new