USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 617 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 215 MET CE :methyl -170:sc= -2.27 (180deg=-2.7) USER MOD Set 1.2: B 9 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 183 ASN : amide:sc= -1.48 K(o=-1.7,f=-5.1!) USER MOD Set 2.2: B 2 THR OG1 : rot -170:sc= -0.249 USER MOD Set 3.1: A 192 GLN : amide:sc= 1.04 K(o=2.7,f=0.72) USER MOD Set 3.2: A 193 ASN : amide:sc= 1.62 K(o=2.7,f=-1.5) USER MOD Set 4.1: A 155 GLN : amide:sc= 0.659 K(o=0.82,f=-7.7!) USER MOD Set 4.2: A 195 ASN : amide:sc= 0.159 K(o=0.82,f=-0.28) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 TYR OH : rot -83:sc= -1.9! USER MOD Single : A 169 TYR OH : rot 165:sc= 0.463 USER MOD Single : A 170 LYS NZ :NH3+ -156:sc= 1.24 (180deg=1.11) USER MOD Single : A 171 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 176 GLN : amide:sc= -0.255 K(o=-0.26,f=-1) USER MOD Single : A 178 SER OG : rot 180:sc= 0 USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 182 LYS NZ :NH3+ 171:sc= 1.42 (180deg=1.32) USER MOD Single : A 186 THR OG1 : rot 77:sc= -2.53! USER MOD Single : A 188 THR OG1 : rot 14:sc= 0.219 USER MOD Single : A 198 CYS SG : rot 169:sc= 0.22 USER MOD Single : A 199 LYS NZ :NH3+ 153:sc= 0.418 (180deg=0.12) USER MOD Single : A 200 THR OG1 : rot 86:sc= 1.24 USER MOD Single : A 203 LYS NZ :NH3+ 173:sc= -0.91 (180deg=-0.995) USER MOD Single : A 210 THR OG1 : rot 27:sc= 0.384 USER MOD Single : A 214 MET CE :methyl -139:sc= -2.21 (180deg=-4.8!) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 CYS SG : rot -35:sc= -2.38! USER MOD Single : B 10 TYR OH : rot 180:sc= -0.0816 USER MOD ----------------------------------------------------------------- ATOM 170 N ILE A 150 9.618 9.248 5.244 1.00 0.00 N ATOM 171 CA ILE A 150 8.931 8.012 4.888 1.00 0.00 C ATOM 172 C ILE A 150 9.932 6.957 4.402 1.00 0.00 C ATOM 173 O ILE A 150 9.647 5.760 4.404 1.00 0.00 O ATOM 174 CB ILE A 150 7.858 8.269 3.799 1.00 0.00 C ATOM 175 CG1 ILE A 150 7.001 7.022 3.573 1.00 0.00 C ATOM 176 CG2 ILE A 150 8.507 8.712 2.493 1.00 0.00 C ATOM 177 CD1 ILE A 150 6.210 6.605 4.792 1.00 0.00 C ATOM 0 HA ILE A 150 8.433 7.637 5.782 1.00 0.00 H new ATOM 0 HB ILE A 150 7.209 9.072 4.150 1.00 0.00 H new ATOM 0 HG12 ILE A 150 6.312 7.209 2.749 1.00 0.00 H new ATOM 0 HG13 ILE A 150 7.646 6.198 3.269 1.00 0.00 H new ATOM 0 HG21 ILE A 150 7.735 8.886 1.744 1.00 0.00 H new ATOM 0 HG22 ILE A 150 9.066 9.633 2.659 1.00 0.00 H new ATOM 0 HG23 ILE A 150 9.185 7.934 2.141 1.00 0.00 H new ATOM 0 HD11 ILE A 150 5.626 5.715 4.560 1.00 0.00 H new ATOM 0 HD12 ILE A 150 6.894 6.386 5.612 1.00 0.00 H new ATOM 0 HD13 ILE A 150 5.539 7.413 5.084 1.00 0.00 H new ATOM 189 N LEU A 151 11.121 7.411 4.020 1.00 0.00 N ATOM 190 CA LEU A 151 12.169 6.525 3.532 1.00 0.00 C ATOM 191 C LEU A 151 12.666 5.596 4.638 1.00 0.00 C ATOM 192 O LEU A 151 13.182 4.515 4.364 1.00 0.00 O ATOM 193 CB LEU A 151 13.337 7.342 2.980 1.00 0.00 C ATOM 194 CG LEU A 151 12.983 8.277 1.820 1.00 0.00 C ATOM 195 CD1 LEU A 151 14.212 9.042 1.357 1.00 0.00 C ATOM 196 CD2 LEU A 151 12.374 7.495 0.666 1.00 0.00 C ATOM 0 H LEU A 151 11.383 8.397 4.040 1.00 0.00 H new ATOM 0 HA LEU A 151 11.746 5.914 2.734 1.00 0.00 H new ATOM 0 HB2 LEU A 151 13.759 7.937 3.790 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.116 6.656 2.649 1.00 0.00 H new ATOM 0 HG LEU A 151 12.244 8.995 2.174 1.00 0.00 H new ATOM 0 HD11 LEU A 151 13.941 9.701 0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 151 14.603 9.636 2.183 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.974 8.338 1.023 1.00 0.00 H new ATOM 0 HD21 LEU A 151 12.130 8.178 -0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.089 6.751 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 151 11.467 6.995 1.004 1.00 0.00 H new ATOM 208 N ASP A 152 12.503 6.022 5.887 1.00 0.00 N ATOM 209 CA ASP A 152 12.907 5.205 7.025 1.00 0.00 C ATOM 210 C ASP A 152 11.871 4.133 7.319 1.00 0.00 C ATOM 211 O ASP A 152 12.152 3.161 8.023 1.00 0.00 O ATOM 212 CB ASP A 152 13.125 6.061 8.276 1.00 0.00 C ATOM 213 CG ASP A 152 14.469 6.757 8.280 1.00 0.00 C ATOM 214 OD1 ASP A 152 15.493 6.079 8.526 1.00 0.00 O ATOM 215 OD2 ASP A 152 14.510 7.980 8.045 1.00 0.00 O ATOM 0 H ASP A 152 12.096 6.924 6.135 1.00 0.00 H new ATOM 0 HA ASP A 152 13.850 4.727 6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 152 12.334 6.807 8.343 1.00 0.00 H new ATOM 0 HB3 ASP A 152 13.044 5.430 9.161 1.00 0.00 H new ATOM 221 N ILE A 153 10.677 4.305 6.772 1.00 0.00 N ATOM 222 CA ILE A 153 9.597 3.358 7.002 1.00 0.00 C ATOM 223 C ILE A 153 9.686 2.206 6.010 1.00 0.00 C ATOM 224 O ILE A 153 9.120 2.253 4.918 1.00 0.00 O ATOM 225 CB ILE A 153 8.208 4.027 6.905 1.00 0.00 C ATOM 226 CG1 ILE A 153 8.119 5.215 7.871 1.00 0.00 C ATOM 227 CG2 ILE A 153 7.106 3.015 7.205 1.00 0.00 C ATOM 228 CD1 ILE A 153 8.336 4.841 9.326 1.00 0.00 C ATOM 0 H ILE A 153 10.432 5.089 6.167 1.00 0.00 H new ATOM 0 HA ILE A 153 9.711 2.977 8.017 1.00 0.00 H new ATOM 0 HB ILE A 153 8.072 4.395 5.888 1.00 0.00 H new ATOM 0 HG12 ILE A 153 8.860 5.961 7.583 1.00 0.00 H new ATOM 0 HG13 ILE A 153 7.140 5.682 7.768 1.00 0.00 H new ATOM 0 HG21 ILE A 153 6.134 3.503 7.132 1.00 0.00 H new ATOM 0 HG22 ILE A 153 7.157 2.198 6.485 1.00 0.00 H new ATOM 0 HG23 ILE A 153 7.239 2.620 8.212 1.00 0.00 H new ATOM 0 HD11 ILE A 153 8.258 5.734 9.947 1.00 0.00 H new ATOM 0 HD12 ILE A 153 7.580 4.118 9.633 1.00 0.00 H new ATOM 0 HD13 ILE A 153 9.327 4.402 9.445 1.00 0.00 H new ATOM 240 N ARG A 154 10.427 1.185 6.395 1.00 0.00 N ATOM 241 CA ARG A 154 10.600 0.003 5.571 1.00 0.00 C ATOM 242 C ARG A 154 10.182 -1.226 6.360 1.00 0.00 C ATOM 243 O ARG A 154 10.512 -1.350 7.540 1.00 0.00 O ATOM 244 CB ARG A 154 12.057 -0.121 5.120 1.00 0.00 C ATOM 245 CG ARG A 154 12.563 1.099 4.366 1.00 0.00 C ATOM 246 CD ARG A 154 14.012 0.937 3.952 1.00 0.00 C ATOM 247 NE ARG A 154 14.551 2.166 3.370 1.00 0.00 N ATOM 248 CZ ARG A 154 15.850 2.403 3.182 1.00 0.00 C ATOM 249 NH1 ARG A 154 16.755 1.490 3.509 1.00 0.00 N ATOM 250 NH2 ARG A 154 16.240 3.561 2.660 1.00 0.00 N ATOM 0 H ARG A 154 10.925 1.151 7.285 1.00 0.00 H new ATOM 0 HA ARG A 154 9.975 0.088 4.682 1.00 0.00 H new ATOM 0 HB2 ARG A 154 12.687 -0.286 5.994 1.00 0.00 H new ATOM 0 HB3 ARG A 154 12.159 -1.000 4.484 1.00 0.00 H new ATOM 0 HG2 ARG A 154 11.947 1.262 3.482 1.00 0.00 H new ATOM 0 HG3 ARG A 154 12.460 1.984 4.994 1.00 0.00 H new ATOM 0 HD2 ARG A 154 14.608 0.653 4.819 1.00 0.00 H new ATOM 0 HD3 ARG A 154 14.095 0.126 3.229 1.00 0.00 H new ATOM 0 HE ARG A 154 13.889 2.890 3.089 1.00 0.00 H new ATOM 0 HH11 ARG A 154 16.459 0.599 3.907 1.00 0.00 H new ATOM 0 HH12 ARG A 154 17.746 1.679 3.362 1.00 0.00 H new ATOM 0 HH21 ARG A 154 15.547 4.265 2.405 1.00 0.00 H new ATOM 0 HH22 ARG A 154 17.232 3.746 2.515 1.00 0.00 H new ATOM 264 N GLN A 155 9.448 -2.116 5.706 1.00 0.00 N ATOM 265 CA GLN A 155 8.894 -3.290 6.358 1.00 0.00 C ATOM 266 C GLN A 155 10.001 -4.233 6.826 1.00 0.00 C ATOM 267 O GLN A 155 10.979 -4.469 6.114 1.00 0.00 O ATOM 268 CB GLN A 155 7.940 -4.005 5.394 1.00 0.00 C ATOM 269 CG GLN A 155 7.284 -5.248 5.970 1.00 0.00 C ATOM 270 CD GLN A 155 6.232 -5.822 5.041 1.00 0.00 C ATOM 271 OE1 GLN A 155 6.535 -6.630 4.164 1.00 0.00 O ATOM 272 NE2 GLN A 155 4.987 -5.419 5.231 1.00 0.00 N ATOM 0 H GLN A 155 9.222 -2.044 4.714 1.00 0.00 H new ATOM 0 HA GLN A 155 8.340 -2.974 7.242 1.00 0.00 H new ATOM 0 HB2 GLN A 155 7.161 -3.307 5.087 1.00 0.00 H new ATOM 0 HB3 GLN A 155 8.491 -4.283 4.495 1.00 0.00 H new ATOM 0 HG2 GLN A 155 8.046 -6.003 6.164 1.00 0.00 H new ATOM 0 HG3 GLN A 155 6.826 -5.004 6.929 1.00 0.00 H new ATOM 0 HE21 GLN A 155 4.775 -4.747 5.969 1.00 0.00 H new ATOM 0 HE22 GLN A 155 4.238 -5.780 4.640 1.00 0.00 H new ATOM 281 N GLY A 156 9.860 -4.728 8.045 1.00 0.00 N ATOM 282 CA GLY A 156 10.795 -5.698 8.567 1.00 0.00 C ATOM 283 C GLY A 156 10.403 -7.110 8.186 1.00 0.00 C ATOM 284 O GLY A 156 9.228 -7.374 7.945 1.00 0.00 O ATOM 0 H GLY A 156 9.109 -4.472 8.686 1.00 0.00 H new ATOM 0 HA2 GLY A 156 11.794 -5.482 8.188 1.00 0.00 H new ATOM 0 HA3 GLY A 156 10.841 -5.613 9.653 1.00 0.00 H new ATOM 288 N PRO A 157 11.359 -8.051 8.167 1.00 0.00 N ATOM 289 CA PRO A 157 11.128 -9.425 7.692 1.00 0.00 C ATOM 290 C PRO A 157 10.162 -10.204 8.585 1.00 0.00 C ATOM 291 O PRO A 157 9.703 -11.289 8.227 1.00 0.00 O ATOM 292 CB PRO A 157 12.520 -10.060 7.737 1.00 0.00 C ATOM 293 CG PRO A 157 13.280 -9.251 8.731 1.00 0.00 C ATOM 294 CD PRO A 157 12.736 -7.852 8.638 1.00 0.00 C ATOM 0 HA PRO A 157 10.669 -9.435 6.703 1.00 0.00 H new ATOM 0 HB2 PRO A 157 12.467 -11.106 8.037 1.00 0.00 H new ATOM 0 HB3 PRO A 157 12.998 -10.033 6.758 1.00 0.00 H new ATOM 0 HG2 PRO A 157 13.154 -9.652 9.737 1.00 0.00 H new ATOM 0 HG3 PRO A 157 14.348 -9.269 8.512 1.00 0.00 H new ATOM 0 HD2 PRO A 157 12.761 -7.346 9.603 1.00 0.00 H new ATOM 0 HD3 PRO A 157 13.314 -7.242 7.944 1.00 0.00 H new ATOM 302 N LYS A 158 9.869 -9.641 9.746 1.00 0.00 N ATOM 303 CA LYS A 158 8.937 -10.241 10.685 1.00 0.00 C ATOM 304 C LYS A 158 7.828 -9.248 11.013 1.00 0.00 C ATOM 305 O LYS A 158 7.087 -9.410 11.983 1.00 0.00 O ATOM 306 CB LYS A 158 9.672 -10.664 11.958 1.00 0.00 C ATOM 307 CG LYS A 158 10.485 -9.546 12.573 1.00 0.00 C ATOM 308 CD LYS A 158 11.264 -10.018 13.784 1.00 0.00 C ATOM 309 CE LYS A 158 12.084 -8.890 14.381 1.00 0.00 C ATOM 310 NZ LYS A 158 12.845 -9.329 15.578 1.00 0.00 N ATOM 0 H LYS A 158 10.269 -8.758 10.063 1.00 0.00 H new ATOM 0 HA LYS A 158 8.493 -11.128 10.233 1.00 0.00 H new ATOM 0 HB2 LYS A 158 8.946 -11.021 12.688 1.00 0.00 H new ATOM 0 HB3 LYS A 158 10.331 -11.501 11.729 1.00 0.00 H new ATOM 0 HG2 LYS A 158 11.175 -9.147 11.830 1.00 0.00 H new ATOM 0 HG3 LYS A 158 9.822 -8.731 12.862 1.00 0.00 H new ATOM 0 HD2 LYS A 158 10.575 -10.407 14.534 1.00 0.00 H new ATOM 0 HD3 LYS A 158 11.922 -10.839 13.499 1.00 0.00 H new ATOM 0 HE2 LYS A 158 12.777 -8.509 13.631 1.00 0.00 H new ATOM 0 HE3 LYS A 158 11.424 -8.066 14.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 13.392 -8.528 15.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 12.183 -9.669 16.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 13.494 -10.098 15.314 1.00 0.00 H new ATOM 324 N GLU A 159 7.739 -8.203 10.202 1.00 0.00 N ATOM 325 CA GLU A 159 6.727 -7.175 10.383 1.00 0.00 C ATOM 326 C GLU A 159 5.538 -7.400 9.454 1.00 0.00 C ATOM 327 O GLU A 159 5.679 -7.391 8.229 1.00 0.00 O ATOM 328 CB GLU A 159 7.337 -5.792 10.140 1.00 0.00 C ATOM 329 CG GLU A 159 6.326 -4.656 10.157 1.00 0.00 C ATOM 330 CD GLU A 159 6.981 -3.296 10.048 1.00 0.00 C ATOM 331 OE1 GLU A 159 8.044 -3.190 9.403 1.00 0.00 O ATOM 332 OE2 GLU A 159 6.437 -2.326 10.614 1.00 0.00 O ATOM 0 H GLU A 159 8.360 -8.046 9.408 1.00 0.00 H new ATOM 0 HA GLU A 159 6.364 -7.231 11.409 1.00 0.00 H new ATOM 0 HB2 GLU A 159 8.094 -5.602 10.901 1.00 0.00 H new ATOM 0 HB3 GLU A 159 7.847 -5.796 9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 159 5.625 -4.785 9.332 1.00 0.00 H new ATOM 0 HG3 GLU A 159 5.746 -4.704 11.079 1.00 0.00 H new ATOM 340 N PRO A 160 4.349 -7.620 10.037 1.00 0.00 N ATOM 341 CA PRO A 160 3.102 -7.741 9.279 1.00 0.00 C ATOM 342 C PRO A 160 2.752 -6.442 8.561 1.00 0.00 C ATOM 343 O PRO A 160 3.082 -5.347 9.022 1.00 0.00 O ATOM 344 CB PRO A 160 2.049 -8.052 10.346 1.00 0.00 C ATOM 345 CG PRO A 160 2.654 -7.616 11.634 1.00 0.00 C ATOM 346 CD PRO A 160 4.136 -7.779 11.482 1.00 0.00 C ATOM 0 HA PRO A 160 3.171 -8.504 8.503 1.00 0.00 H new ATOM 0 HB2 PRO A 160 1.119 -7.519 10.148 1.00 0.00 H new ATOM 0 HB3 PRO A 160 1.809 -9.115 10.364 1.00 0.00 H new ATOM 0 HG2 PRO A 160 2.398 -6.579 11.852 1.00 0.00 H new ATOM 0 HG3 PRO A 160 2.280 -8.218 12.462 1.00 0.00 H new ATOM 0 HD2 PRO A 160 4.683 -7.030 12.054 1.00 0.00 H new ATOM 0 HD3 PRO A 160 4.471 -8.755 11.833 1.00 0.00 H new ATOM 354 N PHE A 161 2.063 -6.584 7.436 1.00 0.00 N ATOM 355 CA PHE A 161 1.718 -5.453 6.586 1.00 0.00 C ATOM 356 C PHE A 161 0.818 -4.458 7.319 1.00 0.00 C ATOM 357 O PHE A 161 0.822 -3.266 7.013 1.00 0.00 O ATOM 358 CB PHE A 161 1.033 -5.955 5.313 1.00 0.00 C ATOM 359 CG PHE A 161 0.844 -4.902 4.259 1.00 0.00 C ATOM 360 CD1 PHE A 161 1.893 -4.542 3.427 1.00 0.00 C ATOM 361 CD2 PHE A 161 -0.381 -4.280 4.094 1.00 0.00 C ATOM 362 CE1 PHE A 161 1.722 -3.579 2.452 1.00 0.00 C ATOM 363 CE2 PHE A 161 -0.558 -3.316 3.124 1.00 0.00 C ATOM 364 CZ PHE A 161 0.494 -2.965 2.301 1.00 0.00 C ATOM 0 H PHE A 161 1.729 -7.483 7.088 1.00 0.00 H new ATOM 0 HA PHE A 161 2.637 -4.931 6.320 1.00 0.00 H new ATOM 0 HB2 PHE A 161 1.623 -6.771 4.894 1.00 0.00 H new ATOM 0 HB3 PHE A 161 0.059 -6.368 5.577 1.00 0.00 H new ATOM 0 HD1 PHE A 161 2.855 -5.020 3.543 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -1.208 -4.553 4.732 1.00 0.00 H new ATOM 0 HE1 PHE A 161 2.546 -3.307 1.809 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -1.518 -2.836 3.008 1.00 0.00 H new ATOM 0 HZ PHE A 161 0.357 -2.211 1.540 1.00 0.00 H new ATOM 374 N ARG A 162 0.063 -4.946 8.299 1.00 0.00 N ATOM 375 CA ARG A 162 -0.826 -4.086 9.066 1.00 0.00 C ATOM 376 C ARG A 162 -0.018 -3.118 9.927 1.00 0.00 C ATOM 377 O ARG A 162 -0.319 -1.924 9.979 1.00 0.00 O ATOM 378 CB ARG A 162 -1.768 -4.915 9.941 1.00 0.00 C ATOM 379 CG ARG A 162 -2.905 -4.094 10.521 1.00 0.00 C ATOM 380 CD ARG A 162 -3.845 -4.932 11.366 1.00 0.00 C ATOM 381 NE ARG A 162 -5.059 -4.187 11.702 1.00 0.00 N ATOM 382 CZ ARG A 162 -5.898 -4.502 12.687 1.00 0.00 C ATOM 383 NH1 ARG A 162 -5.652 -5.544 13.468 1.00 0.00 N ATOM 384 NH2 ARG A 162 -6.984 -3.764 12.886 1.00 0.00 N ATOM 0 H ARG A 162 0.050 -5.927 8.578 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.430 -3.511 8.364 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -2.181 -5.732 9.350 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -1.199 -5.365 10.754 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -2.495 -3.287 11.129 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -3.465 -3.629 9.710 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -4.110 -5.841 10.827 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.339 -5.240 12.281 1.00 0.00 H new ATOM 0 HE ARG A 162 -5.279 -3.365 11.140 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -4.817 -6.109 13.316 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -6.298 -5.781 14.221 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -7.172 -2.961 12.286 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -7.630 -4.000 13.639 1.00 0.00 H new ATOM 398 N ASP A 163 1.018 -3.637 10.582 1.00 0.00 N ATOM 399 CA ASP A 163 1.915 -2.803 11.383 1.00 0.00 C ATOM 400 C ASP A 163 2.700 -1.855 10.488 1.00 0.00 C ATOM 401 O ASP A 163 3.031 -0.733 10.879 1.00 0.00 O ATOM 402 CB ASP A 163 2.889 -3.667 12.193 1.00 0.00 C ATOM 403 CG ASP A 163 2.253 -4.298 13.416 1.00 0.00 C ATOM 404 OD1 ASP A 163 1.376 -5.172 13.257 1.00 0.00 O ATOM 405 OD2 ASP A 163 2.649 -3.938 14.545 1.00 0.00 O ATOM 0 H ASP A 163 1.258 -4.628 10.575 1.00 0.00 H new ATOM 0 HA ASP A 163 1.303 -2.223 12.073 1.00 0.00 H new ATOM 0 HB2 ASP A 163 3.286 -4.454 11.552 1.00 0.00 H new ATOM 0 HB3 ASP A 163 3.734 -3.054 12.506 1.00 0.00 H new ATOM 411 N TYR A 164 2.982 -2.314 9.278 1.00 0.00 N ATOM 412 CA TYR A 164 3.723 -1.526 8.310 1.00 0.00 C ATOM 413 C TYR A 164 2.903 -0.321 7.864 1.00 0.00 C ATOM 414 O TYR A 164 3.369 0.813 7.938 1.00 0.00 O ATOM 415 CB TYR A 164 4.104 -2.403 7.113 1.00 0.00 C ATOM 416 CG TYR A 164 4.671 -1.648 5.931 1.00 0.00 C ATOM 417 CD1 TYR A 164 5.869 -0.953 6.029 1.00 0.00 C ATOM 418 CD2 TYR A 164 4.010 -1.649 4.709 1.00 0.00 C ATOM 419 CE1 TYR A 164 6.392 -0.278 4.943 1.00 0.00 C ATOM 420 CE2 TYR A 164 4.523 -0.975 3.620 1.00 0.00 C ATOM 421 CZ TYR A 164 5.714 -0.293 3.741 1.00 0.00 C ATOM 422 OH TYR A 164 6.229 0.371 2.656 1.00 0.00 O ATOM 0 H TYR A 164 2.705 -3.237 8.943 1.00 0.00 H new ATOM 0 HA TYR A 164 4.636 -1.155 8.775 1.00 0.00 H new ATOM 0 HB2 TYR A 164 4.836 -3.142 7.440 1.00 0.00 H new ATOM 0 HB3 TYR A 164 3.221 -2.952 6.786 1.00 0.00 H new ATOM 0 HD1 TYR A 164 6.400 -0.940 6.969 1.00 0.00 H new ATOM 0 HD2 TYR A 164 3.079 -2.187 4.610 1.00 0.00 H new ATOM 0 HE1 TYR A 164 7.325 0.258 5.034 1.00 0.00 H new ATOM 0 HE2 TYR A 164 3.994 -0.982 2.678 1.00 0.00 H new ATOM 0 HH TYR A 164 5.984 1.319 2.706 1.00 0.00 H new ATOM 432 N VAL A 165 1.673 -0.573 7.430 1.00 0.00 N ATOM 433 CA VAL A 165 0.777 0.489 6.986 1.00 0.00 C ATOM 434 C VAL A 165 0.470 1.466 8.114 1.00 0.00 C ATOM 435 O VAL A 165 0.346 2.670 7.876 1.00 0.00 O ATOM 436 CB VAL A 165 -0.532 -0.092 6.410 1.00 0.00 C ATOM 437 CG1 VAL A 165 -1.683 0.900 6.493 1.00 0.00 C ATOM 438 CG2 VAL A 165 -0.312 -0.498 4.969 1.00 0.00 C ATOM 0 H VAL A 165 1.272 -1.509 7.376 1.00 0.00 H new ATOM 0 HA VAL A 165 1.290 1.035 6.194 1.00 0.00 H new ATOM 0 HB VAL A 165 -0.803 -0.961 7.010 1.00 0.00 H new ATOM 0 HG11 VAL A 165 -2.583 0.448 6.076 1.00 0.00 H new ATOM 0 HG12 VAL A 165 -1.859 1.166 7.535 1.00 0.00 H new ATOM 0 HG13 VAL A 165 -1.432 1.797 5.927 1.00 0.00 H new ATOM 0 HG21 VAL A 165 -1.236 -0.908 4.562 1.00 0.00 H new ATOM 0 HG22 VAL A 165 -0.014 0.374 4.387 1.00 0.00 H new ATOM 0 HG23 VAL A 165 0.473 -1.253 4.919 1.00 0.00 H new ATOM 448 N ASP A 166 0.371 0.951 9.336 1.00 0.00 N ATOM 449 CA ASP A 166 0.130 1.790 10.505 1.00 0.00 C ATOM 450 C ASP A 166 1.129 2.937 10.553 1.00 0.00 C ATOM 451 O ASP A 166 0.753 4.099 10.688 1.00 0.00 O ATOM 452 CB ASP A 166 0.231 0.957 11.787 1.00 0.00 C ATOM 453 CG ASP A 166 0.094 1.795 13.047 1.00 0.00 C ATOM 454 OD1 ASP A 166 1.120 2.315 13.540 1.00 0.00 O ATOM 455 OD2 ASP A 166 -1.034 1.918 13.561 1.00 0.00 O ATOM 0 H ASP A 166 0.454 -0.044 9.542 1.00 0.00 H new ATOM 0 HA ASP A 166 -0.876 2.204 10.429 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -0.545 0.191 11.779 1.00 0.00 H new ATOM 0 HB3 ASP A 166 1.190 0.439 11.803 1.00 0.00 H new ATOM 461 N ARG A 167 2.400 2.606 10.389 1.00 0.00 N ATOM 462 CA ARG A 167 3.458 3.601 10.454 1.00 0.00 C ATOM 463 C ARG A 167 3.669 4.274 9.102 1.00 0.00 C ATOM 464 O ARG A 167 3.925 5.474 9.038 1.00 0.00 O ATOM 465 CB ARG A 167 4.759 2.957 10.933 1.00 0.00 C ATOM 466 CG ARG A 167 4.608 2.186 12.235 1.00 0.00 C ATOM 467 CD ARG A 167 5.945 1.683 12.749 1.00 0.00 C ATOM 468 NE ARG A 167 6.519 0.645 11.894 1.00 0.00 N ATOM 469 CZ ARG A 167 7.819 0.544 11.614 1.00 0.00 C ATOM 470 NH1 ARG A 167 8.678 1.435 12.097 1.00 0.00 N ATOM 471 NH2 ARG A 167 8.256 -0.458 10.868 1.00 0.00 N ATOM 0 H ARG A 167 2.724 1.656 10.210 1.00 0.00 H new ATOM 0 HA ARG A 167 3.156 4.368 11.167 1.00 0.00 H new ATOM 0 HB2 ARG A 167 5.127 2.282 10.160 1.00 0.00 H new ATOM 0 HB3 ARG A 167 5.513 3.733 11.064 1.00 0.00 H new ATOM 0 HG2 ARG A 167 4.147 2.828 12.986 1.00 0.00 H new ATOM 0 HG3 ARG A 167 3.936 1.341 12.082 1.00 0.00 H new ATOM 0 HD2 ARG A 167 6.642 2.518 12.818 1.00 0.00 H new ATOM 0 HD3 ARG A 167 5.818 1.289 13.758 1.00 0.00 H new ATOM 0 HE ARG A 167 5.887 -0.044 11.487 1.00 0.00 H new ATOM 0 HH11 ARG A 167 8.344 2.199 12.684 1.00 0.00 H new ATOM 0 HH12 ARG A 167 9.672 1.355 11.881 1.00 0.00 H new ATOM 0 HH21 ARG A 167 7.599 -1.151 10.509 1.00 0.00 H new ATOM 0 HH22 ARG A 167 9.250 -0.538 10.652 1.00 0.00 H new ATOM 485 N PHE A 168 3.553 3.496 8.029 1.00 0.00 N ATOM 486 CA PHE A 168 3.719 4.016 6.675 1.00 0.00 C ATOM 487 C PHE A 168 2.753 5.165 6.425 1.00 0.00 C ATOM 488 O PHE A 168 3.161 6.260 6.046 1.00 0.00 O ATOM 489 CB PHE A 168 3.495 2.895 5.649 1.00 0.00 C ATOM 490 CG PHE A 168 3.619 3.336 4.216 1.00 0.00 C ATOM 491 CD1 PHE A 168 4.865 3.477 3.624 1.00 0.00 C ATOM 492 CD2 PHE A 168 2.489 3.600 3.458 1.00 0.00 C ATOM 493 CE1 PHE A 168 4.979 3.879 2.304 1.00 0.00 C ATOM 494 CE2 PHE A 168 2.598 4.004 2.141 1.00 0.00 C ATOM 495 CZ PHE A 168 3.844 4.142 1.563 1.00 0.00 C ATOM 0 H PHE A 168 3.344 2.499 8.072 1.00 0.00 H new ATOM 0 HA PHE A 168 4.736 4.392 6.567 1.00 0.00 H new ATOM 0 HB2 PHE A 168 4.215 2.098 5.836 1.00 0.00 H new ATOM 0 HB3 PHE A 168 2.503 2.471 5.802 1.00 0.00 H new ATOM 0 HD1 PHE A 168 5.756 3.271 4.199 1.00 0.00 H new ATOM 0 HD2 PHE A 168 1.511 3.489 3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 168 5.955 3.987 1.854 1.00 0.00 H new ATOM 0 HE2 PHE A 168 1.709 4.212 1.564 1.00 0.00 H new ATOM 0 HZ PHE A 168 3.931 4.455 0.533 1.00 0.00 H new ATOM 505 N TYR A 169 1.479 4.918 6.684 1.00 0.00 N ATOM 506 CA TYR A 169 0.441 5.905 6.441 1.00 0.00 C ATOM 507 C TYR A 169 0.606 7.141 7.329 1.00 0.00 C ATOM 508 O TYR A 169 0.510 8.265 6.844 1.00 0.00 O ATOM 509 CB TYR A 169 -0.944 5.276 6.634 1.00 0.00 C ATOM 510 CG TYR A 169 -2.008 6.243 7.102 1.00 0.00 C ATOM 511 CD1 TYR A 169 -2.581 7.153 6.228 1.00 0.00 C ATOM 512 CD2 TYR A 169 -2.431 6.247 8.425 1.00 0.00 C ATOM 513 CE1 TYR A 169 -3.544 8.039 6.656 1.00 0.00 C ATOM 514 CE2 TYR A 169 -3.397 7.132 8.862 1.00 0.00 C ATOM 515 CZ TYR A 169 -3.950 8.026 7.972 1.00 0.00 C ATOM 516 OH TYR A 169 -4.913 8.912 8.397 1.00 0.00 O ATOM 0 H TYR A 169 1.138 4.036 7.065 1.00 0.00 H new ATOM 0 HA TYR A 169 0.537 6.239 5.408 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -1.263 4.832 5.691 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -0.864 4.465 7.357 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -2.267 7.167 5.195 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -1.997 5.547 9.123 1.00 0.00 H new ATOM 0 HE1 TYR A 169 -3.980 8.742 5.962 1.00 0.00 H new ATOM 0 HE2 TYR A 169 -3.716 7.123 9.894 1.00 0.00 H new ATOM 0 HH TYR A 169 -5.259 8.626 9.268 1.00 0.00 H new ATOM 526 N LYS A 170 0.861 6.948 8.621 1.00 0.00 N ATOM 527 CA LYS A 170 0.890 8.083 9.541 1.00 0.00 C ATOM 528 C LYS A 170 2.138 8.934 9.342 1.00 0.00 C ATOM 529 O LYS A 170 2.109 10.146 9.555 1.00 0.00 O ATOM 530 CB LYS A 170 0.738 7.640 11.001 1.00 0.00 C ATOM 531 CG LYS A 170 1.877 6.805 11.558 1.00 0.00 C ATOM 532 CD LYS A 170 1.479 6.206 12.896 1.00 0.00 C ATOM 533 CE LYS A 170 2.584 5.364 13.503 1.00 0.00 C ATOM 534 NZ LYS A 170 2.080 4.537 14.630 1.00 0.00 N ATOM 0 H LYS A 170 1.046 6.040 9.047 1.00 0.00 H new ATOM 0 HA LYS A 170 0.028 8.707 9.305 1.00 0.00 H new ATOM 0 HB2 LYS A 170 0.627 8.529 11.621 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -0.186 7.069 11.094 1.00 0.00 H new ATOM 0 HG2 LYS A 170 2.133 6.011 10.857 1.00 0.00 H new ATOM 0 HG3 LYS A 170 2.767 7.423 11.678 1.00 0.00 H new ATOM 0 HD2 LYS A 170 1.216 7.008 13.586 1.00 0.00 H new ATOM 0 HD3 LYS A 170 0.588 5.592 12.766 1.00 0.00 H new ATOM 0 HE2 LYS A 170 3.012 4.716 12.738 1.00 0.00 H new ATOM 0 HE3 LYS A 170 3.385 6.013 13.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 2.868 4.300 15.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 1.358 5.070 15.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 1.661 3.661 14.258 1.00 0.00 H new ATOM 548 N THR A 171 3.225 8.312 8.912 1.00 0.00 N ATOM 549 CA THR A 171 4.424 9.058 8.569 1.00 0.00 C ATOM 550 C THR A 171 4.204 9.799 7.254 1.00 0.00 C ATOM 551 O THR A 171 4.510 10.981 7.133 1.00 0.00 O ATOM 552 CB THR A 171 5.652 8.134 8.441 1.00 0.00 C ATOM 553 OG1 THR A 171 5.766 7.318 9.613 1.00 0.00 O ATOM 554 CG2 THR A 171 6.930 8.940 8.256 1.00 0.00 C ATOM 0 H THR A 171 3.301 7.302 8.793 1.00 0.00 H new ATOM 0 HA THR A 171 4.620 9.768 9.372 1.00 0.00 H new ATOM 0 HB THR A 171 5.514 7.504 7.562 1.00 0.00 H new ATOM 0 HG1 THR A 171 5.133 6.572 9.555 1.00 0.00 H new ATOM 0 HG21 THR A 171 7.779 8.262 8.169 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.852 9.542 7.351 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.075 9.594 9.116 1.00 0.00 H new ATOM 562 N LEU A 172 3.624 9.095 6.289 1.00 0.00 N ATOM 563 CA LEU A 172 3.352 9.649 4.970 1.00 0.00 C ATOM 564 C LEU A 172 2.367 10.815 5.059 1.00 0.00 C ATOM 565 O LEU A 172 2.516 11.825 4.369 1.00 0.00 O ATOM 566 CB LEU A 172 2.805 8.548 4.069 1.00 0.00 C ATOM 567 CG LEU A 172 2.642 8.908 2.600 1.00 0.00 C ATOM 568 CD1 LEU A 172 3.961 9.387 2.008 1.00 0.00 C ATOM 569 CD2 LEU A 172 2.129 7.704 1.842 1.00 0.00 C ATOM 0 H LEU A 172 3.330 8.125 6.400 1.00 0.00 H new ATOM 0 HA LEU A 172 4.279 10.035 4.547 1.00 0.00 H new ATOM 0 HB2 LEU A 172 3.467 7.685 4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 172 1.835 8.237 4.456 1.00 0.00 H new ATOM 0 HG LEU A 172 1.923 9.723 2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 172 3.818 9.638 0.957 1.00 0.00 H new ATOM 0 HD12 LEU A 172 4.303 10.269 2.549 1.00 0.00 H new ATOM 0 HD13 LEU A 172 4.707 8.597 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 172 2.011 7.960 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 172 2.840 6.883 1.939 1.00 0.00 H new ATOM 0 HD23 LEU A 172 1.166 7.400 2.251 1.00 0.00 H new ATOM 581 N ARG A 173 1.359 10.670 5.913 1.00 0.00 N ATOM 582 CA ARG A 173 0.417 11.746 6.196 1.00 0.00 C ATOM 583 C ARG A 173 1.156 13.006 6.664 1.00 0.00 C ATOM 584 O ARG A 173 0.733 14.125 6.383 1.00 0.00 O ATOM 585 CB ARG A 173 -0.589 11.280 7.255 1.00 0.00 C ATOM 586 CG ARG A 173 -1.654 12.304 7.598 1.00 0.00 C ATOM 587 CD ARG A 173 -2.726 11.712 8.500 1.00 0.00 C ATOM 588 NE ARG A 173 -3.637 12.737 9.007 1.00 0.00 N ATOM 589 CZ ARG A 173 -4.705 12.496 9.768 1.00 0.00 C ATOM 590 NH1 ARG A 173 -5.091 11.248 10.017 1.00 0.00 N ATOM 591 NH2 ARG A 173 -5.406 13.514 10.254 1.00 0.00 N ATOM 0 H ARG A 173 1.173 9.808 6.426 1.00 0.00 H new ATOM 0 HA ARG A 173 -0.121 11.997 5.282 1.00 0.00 H new ATOM 0 HB2 ARG A 173 -1.076 10.371 6.902 1.00 0.00 H new ATOM 0 HB3 ARG A 173 -0.047 11.018 8.164 1.00 0.00 H new ATOM 0 HG2 ARG A 173 -1.193 13.159 8.092 1.00 0.00 H new ATOM 0 HG3 ARG A 173 -2.112 12.675 6.681 1.00 0.00 H new ATOM 0 HD2 ARG A 173 -3.293 10.963 7.947 1.00 0.00 H new ATOM 0 HD3 ARG A 173 -2.253 11.199 9.338 1.00 0.00 H new ATOM 0 HE ARG A 173 -3.441 13.707 8.761 1.00 0.00 H new ATOM 0 HH11 ARG A 173 -4.569 10.465 9.625 1.00 0.00 H new ATOM 0 HH12 ARG A 173 -5.909 11.074 10.600 1.00 0.00 H new ATOM 0 HH21 ARG A 173 -5.126 14.472 10.044 1.00 0.00 H new ATOM 0 HH22 ARG A 173 -6.224 13.338 10.837 1.00 0.00 H new ATOM 605 N ALA A 174 2.290 12.807 7.330 1.00 0.00 N ATOM 606 CA ALA A 174 3.061 13.911 7.894 1.00 0.00 C ATOM 607 C ALA A 174 4.093 14.457 6.906 1.00 0.00 C ATOM 608 O ALA A 174 4.552 15.590 7.054 1.00 0.00 O ATOM 609 CB ALA A 174 3.750 13.464 9.175 1.00 0.00 C ATOM 0 H ALA A 174 2.697 11.886 7.493 1.00 0.00 H new ATOM 0 HA ALA A 174 2.363 14.718 8.116 1.00 0.00 H new ATOM 0 HB1 ALA A 174 4.323 14.294 9.589 1.00 0.00 H new ATOM 0 HB2 ALA A 174 3.000 13.144 9.899 1.00 0.00 H new ATOM 0 HB3 ALA A 174 4.421 12.633 8.956 1.00 0.00 H new ATOM 615 N GLU A 175 4.458 13.652 5.911 1.00 0.00 N ATOM 616 CA GLU A 175 5.454 14.055 4.918 1.00 0.00 C ATOM 617 C GLU A 175 5.081 15.381 4.262 1.00 0.00 C ATOM 618 O GLU A 175 3.937 15.579 3.832 1.00 0.00 O ATOM 619 CB GLU A 175 5.618 12.976 3.843 1.00 0.00 C ATOM 620 CG GLU A 175 6.143 11.651 4.372 1.00 0.00 C ATOM 621 CD GLU A 175 7.521 11.767 4.988 1.00 0.00 C ATOM 622 OE1 GLU A 175 8.521 11.617 4.251 1.00 0.00 O ATOM 623 OE2 GLU A 175 7.609 12.002 6.207 1.00 0.00 O ATOM 0 H GLU A 175 4.079 12.716 5.770 1.00 0.00 H new ATOM 0 HA GLU A 175 6.401 14.183 5.442 1.00 0.00 H new ATOM 0 HB2 GLU A 175 4.654 12.807 3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 175 6.298 13.344 3.074 1.00 0.00 H new ATOM 0 HG2 GLU A 175 5.449 11.262 5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 175 6.174 10.927 3.558 1.00 0.00 H new ATOM 631 N GLN A 176 6.053 16.281 4.190 1.00 0.00 N ATOM 632 CA GLN A 176 5.847 17.597 3.599 1.00 0.00 C ATOM 633 C GLN A 176 5.819 17.501 2.074 1.00 0.00 C ATOM 634 O GLN A 176 6.839 17.660 1.402 1.00 0.00 O ATOM 635 CB GLN A 176 6.942 18.566 4.067 1.00 0.00 C ATOM 636 CG GLN A 176 6.800 19.983 3.519 1.00 0.00 C ATOM 637 CD GLN A 176 5.430 20.587 3.774 1.00 0.00 C ATOM 638 OE1 GLN A 176 4.760 20.262 4.753 1.00 0.00 O ATOM 639 NE2 GLN A 176 5.012 21.484 2.896 1.00 0.00 N ATOM 0 H GLN A 176 6.999 16.122 4.536 1.00 0.00 H new ATOM 0 HA GLN A 176 4.883 17.983 3.930 1.00 0.00 H new ATOM 0 HB2 GLN A 176 6.934 18.607 5.156 1.00 0.00 H new ATOM 0 HB3 GLN A 176 7.913 18.170 3.771 1.00 0.00 H new ATOM 0 HG2 GLN A 176 7.561 20.619 3.972 1.00 0.00 H new ATOM 0 HG3 GLN A 176 6.991 19.972 2.446 1.00 0.00 H new ATOM 0 HE21 GLN A 176 5.597 21.727 2.097 1.00 0.00 H new ATOM 0 HE22 GLN A 176 4.104 21.933 3.018 1.00 0.00 H new ATOM 648 N ALA A 177 4.636 17.223 1.549 1.00 0.00 N ATOM 649 CA ALA A 177 4.427 17.102 0.117 1.00 0.00 C ATOM 650 C ALA A 177 2.960 17.332 -0.199 1.00 0.00 C ATOM 651 O ALA A 177 2.097 17.128 0.661 1.00 0.00 O ATOM 652 CB ALA A 177 4.863 15.726 -0.368 1.00 0.00 C ATOM 0 H ALA A 177 3.794 17.075 2.105 1.00 0.00 H new ATOM 0 HA ALA A 177 5.028 17.852 -0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 177 4.700 15.651 -1.443 1.00 0.00 H new ATOM 0 HB2 ALA A 177 5.921 15.582 -0.150 1.00 0.00 H new ATOM 0 HB3 ALA A 177 4.280 14.959 0.142 1.00 0.00 H new ATOM 658 N SER A 178 2.678 17.769 -1.416 1.00 0.00 N ATOM 659 CA SER A 178 1.309 18.006 -1.837 1.00 0.00 C ATOM 660 C SER A 178 0.589 16.680 -2.031 1.00 0.00 C ATOM 661 O SER A 178 1.232 15.673 -2.333 1.00 0.00 O ATOM 662 CB SER A 178 1.272 18.816 -3.135 1.00 0.00 C ATOM 663 OG SER A 178 -0.023 19.336 -3.377 1.00 0.00 O ATOM 0 H SER A 178 3.380 17.966 -2.129 1.00 0.00 H new ATOM 0 HA SER A 178 0.804 18.579 -1.060 1.00 0.00 H new ATOM 0 HB2 SER A 178 1.990 19.634 -3.077 1.00 0.00 H new ATOM 0 HB3 SER A 178 1.575 18.184 -3.970 1.00 0.00 H new ATOM 0 HG SER A 178 -0.018 19.850 -4.211 1.00 0.00 H new ATOM 669 N GLN A 179 -0.728 16.680 -1.849 1.00 0.00 N ATOM 670 CA GLN A 179 -1.513 15.450 -1.889 1.00 0.00 C ATOM 671 C GLN A 179 -1.208 14.632 -3.143 1.00 0.00 C ATOM 672 O GLN A 179 -0.974 13.426 -3.057 1.00 0.00 O ATOM 673 CB GLN A 179 -3.007 15.768 -1.811 1.00 0.00 C ATOM 674 CG GLN A 179 -3.880 14.535 -1.631 1.00 0.00 C ATOM 675 CD GLN A 179 -5.346 14.874 -1.442 1.00 0.00 C ATOM 676 OE1 GLN A 179 -5.845 15.870 -1.971 1.00 0.00 O ATOM 677 NE2 GLN A 179 -6.047 14.046 -0.684 1.00 0.00 N ATOM 0 H GLN A 179 -1.276 17.522 -1.672 1.00 0.00 H new ATOM 0 HA GLN A 179 -1.234 14.849 -1.023 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -3.182 16.452 -0.981 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -3.308 16.287 -2.721 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -3.771 13.888 -2.502 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -3.529 13.970 -0.768 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -5.596 13.233 -0.265 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -7.038 14.221 -0.519 1.00 0.00 H new ATOM 686 N GLU A 180 -1.152 15.297 -4.293 1.00 0.00 N ATOM 687 CA GLU A 180 -0.956 14.599 -5.561 1.00 0.00 C ATOM 688 C GLU A 180 0.399 13.895 -5.593 1.00 0.00 C ATOM 689 O GLU A 180 0.488 12.710 -5.922 1.00 0.00 O ATOM 690 CB GLU A 180 -1.060 15.570 -6.737 1.00 0.00 C ATOM 691 CG GLU A 180 -0.963 14.887 -8.092 1.00 0.00 C ATOM 692 CD GLU A 180 -0.915 15.869 -9.239 1.00 0.00 C ATOM 693 OE1 GLU A 180 0.199 16.230 -9.668 1.00 0.00 O ATOM 694 OE2 GLU A 180 -1.987 16.282 -9.723 1.00 0.00 O ATOM 0 H GLU A 180 -1.239 16.310 -4.374 1.00 0.00 H new ATOM 0 HA GLU A 180 -1.743 13.850 -5.650 1.00 0.00 H new ATOM 0 HB2 GLU A 180 -2.008 16.105 -6.675 1.00 0.00 H new ATOM 0 HB3 GLU A 180 -0.268 16.314 -6.656 1.00 0.00 H new ATOM 0 HG2 GLU A 180 -0.070 14.263 -8.116 1.00 0.00 H new ATOM 0 HG3 GLU A 180 -1.819 14.224 -8.222 1.00 0.00 H new ATOM 702 N VAL A 181 1.447 14.633 -5.242 1.00 0.00 N ATOM 703 CA VAL A 181 2.798 14.084 -5.207 1.00 0.00 C ATOM 704 C VAL A 181 2.887 12.958 -4.185 1.00 0.00 C ATOM 705 O VAL A 181 3.529 11.933 -4.419 1.00 0.00 O ATOM 706 CB VAL A 181 3.840 15.171 -4.862 1.00 0.00 C ATOM 707 CG1 VAL A 181 5.249 14.600 -4.867 1.00 0.00 C ATOM 708 CG2 VAL A 181 3.736 16.338 -5.830 1.00 0.00 C ATOM 0 H VAL A 181 1.386 15.616 -4.977 1.00 0.00 H new ATOM 0 HA VAL A 181 3.019 13.695 -6.201 1.00 0.00 H new ATOM 0 HB VAL A 181 3.626 15.534 -3.857 1.00 0.00 H new ATOM 0 HG11 VAL A 181 5.962 15.387 -4.621 1.00 0.00 H new ATOM 0 HG12 VAL A 181 5.321 13.802 -4.128 1.00 0.00 H new ATOM 0 HG13 VAL A 181 5.476 14.201 -5.856 1.00 0.00 H new ATOM 0 HG21 VAL A 181 4.478 17.093 -5.571 1.00 0.00 H new ATOM 0 HG22 VAL A 181 3.917 15.986 -6.846 1.00 0.00 H new ATOM 0 HG23 VAL A 181 2.739 16.773 -5.769 1.00 0.00 H new ATOM 718 N LYS A 182 2.209 13.153 -3.061 1.00 0.00 N ATOM 719 CA LYS A 182 2.190 12.181 -1.992 1.00 0.00 C ATOM 720 C LYS A 182 1.532 10.884 -2.458 1.00 0.00 C ATOM 721 O LYS A 182 2.015 9.795 -2.154 1.00 0.00 O ATOM 722 CB LYS A 182 1.451 12.773 -0.794 1.00 0.00 C ATOM 723 CG LYS A 182 1.447 11.885 0.431 1.00 0.00 C ATOM 724 CD LYS A 182 0.923 12.630 1.643 1.00 0.00 C ATOM 725 CE LYS A 182 1.855 13.764 2.041 1.00 0.00 C ATOM 726 NZ LYS A 182 1.487 14.355 3.354 1.00 0.00 N ATOM 0 H LYS A 182 1.659 13.991 -2.871 1.00 0.00 H new ATOM 0 HA LYS A 182 3.212 11.942 -1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 182 1.908 13.728 -0.535 1.00 0.00 H new ATOM 0 HB3 LYS A 182 0.420 12.980 -1.083 1.00 0.00 H new ATOM 0 HG2 LYS A 182 0.829 11.006 0.245 1.00 0.00 H new ATOM 0 HG3 LYS A 182 2.458 11.528 0.629 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -0.068 13.030 1.426 1.00 0.00 H new ATOM 0 HD3 LYS A 182 0.812 11.938 2.478 1.00 0.00 H new ATOM 0 HE2 LYS A 182 2.879 13.393 2.085 1.00 0.00 H new ATOM 0 HE3 LYS A 182 1.830 14.539 1.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 2.230 15.016 3.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 0.585 14.866 3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 1.387 13.598 4.060 1.00 0.00 H new ATOM 740 N ASN A 183 0.446 11.009 -3.216 1.00 0.00 N ATOM 741 CA ASN A 183 -0.249 9.845 -3.760 1.00 0.00 C ATOM 742 C ASN A 183 0.680 9.023 -4.642 1.00 0.00 C ATOM 743 O ASN A 183 0.773 7.803 -4.493 1.00 0.00 O ATOM 744 CB ASN A 183 -1.472 10.254 -4.581 1.00 0.00 C ATOM 745 CG ASN A 183 -2.566 10.905 -3.755 1.00 0.00 C ATOM 746 OD1 ASN A 183 -2.708 10.635 -2.565 1.00 0.00 O ATOM 747 ND2 ASN A 183 -3.354 11.755 -4.394 1.00 0.00 N ATOM 0 H ASN A 183 0.028 11.905 -3.468 1.00 0.00 H new ATOM 0 HA ASN A 183 -0.576 9.246 -2.910 1.00 0.00 H new ATOM 0 HB2 ASN A 183 -1.159 10.945 -5.364 1.00 0.00 H new ATOM 0 HB3 ASN A 183 -1.878 9.372 -5.077 1.00 0.00 H new ATOM 0 HD21 ASN A 183 -4.116 12.216 -3.897 1.00 0.00 H new ATOM 0 HD22 ASN A 183 -3.199 11.949 -5.383 1.00 0.00 H new ATOM 754 N ALA A 184 1.368 9.704 -5.556 1.00 0.00 N ATOM 755 CA ALA A 184 2.296 9.047 -6.468 1.00 0.00 C ATOM 756 C ALA A 184 3.415 8.359 -5.694 1.00 0.00 C ATOM 757 O ALA A 184 3.855 7.263 -6.049 1.00 0.00 O ATOM 758 CB ALA A 184 2.870 10.055 -7.451 1.00 0.00 C ATOM 0 H ALA A 184 1.298 10.714 -5.683 1.00 0.00 H new ATOM 0 HA ALA A 184 1.751 8.286 -7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 184 3.562 9.551 -8.126 1.00 0.00 H new ATOM 0 HB2 ALA A 184 2.060 10.502 -8.028 1.00 0.00 H new ATOM 0 HB3 ALA A 184 3.400 10.835 -6.904 1.00 0.00 H new ATOM 764 N ALA A 185 3.865 9.012 -4.630 1.00 0.00 N ATOM 765 CA ALA A 185 4.879 8.444 -3.757 1.00 0.00 C ATOM 766 C ALA A 185 4.351 7.192 -3.069 1.00 0.00 C ATOM 767 O ALA A 185 5.034 6.175 -3.013 1.00 0.00 O ATOM 768 CB ALA A 185 5.324 9.468 -2.724 1.00 0.00 C ATOM 0 H ALA A 185 3.541 9.938 -4.352 1.00 0.00 H new ATOM 0 HA ALA A 185 5.740 8.167 -4.365 1.00 0.00 H new ATOM 0 HB1 ALA A 185 6.083 9.027 -2.078 1.00 0.00 H new ATOM 0 HB2 ALA A 185 5.740 10.339 -3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 185 4.468 9.773 -2.122 1.00 0.00 H new ATOM 774 N THR A 186 3.124 7.268 -2.570 1.00 0.00 N ATOM 775 CA THR A 186 2.511 6.155 -1.860 1.00 0.00 C ATOM 776 C THR A 186 2.497 4.893 -2.709 1.00 0.00 C ATOM 777 O THR A 186 2.970 3.843 -2.281 1.00 0.00 O ATOM 778 CB THR A 186 1.061 6.472 -1.467 1.00 0.00 C ATOM 779 OG1 THR A 186 0.975 7.768 -0.870 1.00 0.00 O ATOM 780 CG2 THR A 186 0.522 5.425 -0.502 1.00 0.00 C ATOM 0 H THR A 186 2.531 8.095 -2.645 1.00 0.00 H new ATOM 0 HA THR A 186 3.114 5.995 -0.966 1.00 0.00 H new ATOM 0 HB THR A 186 0.457 6.458 -2.374 1.00 0.00 H new ATOM 0 HG1 THR A 186 1.021 8.454 -1.569 1.00 0.00 H new ATOM 0 HG21 THR A 186 -0.507 5.670 -0.237 1.00 0.00 H new ATOM 0 HG22 THR A 186 0.551 4.444 -0.976 1.00 0.00 H new ATOM 0 HG23 THR A 186 1.135 5.411 0.399 1.00 0.00 H new ATOM 788 N GLU A 187 1.960 5.020 -3.917 1.00 0.00 N ATOM 789 CA GLU A 187 1.797 3.889 -4.822 1.00 0.00 C ATOM 790 C GLU A 187 3.110 3.140 -5.032 1.00 0.00 C ATOM 791 O GLU A 187 3.142 1.910 -5.044 1.00 0.00 O ATOM 792 CB GLU A 187 1.262 4.377 -6.163 1.00 0.00 C ATOM 793 CG GLU A 187 -0.122 4.995 -6.087 1.00 0.00 C ATOM 794 CD GLU A 187 -1.175 4.068 -6.648 1.00 0.00 C ATOM 795 OE1 GLU A 187 -1.636 4.302 -7.781 1.00 0.00 O ATOM 796 OE2 GLU A 187 -1.546 3.104 -5.952 1.00 0.00 O ATOM 0 H GLU A 187 1.627 5.907 -4.295 1.00 0.00 H new ATOM 0 HA GLU A 187 1.087 3.197 -4.369 1.00 0.00 H new ATOM 0 HB2 GLU A 187 1.955 5.112 -6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 187 1.237 3.539 -6.859 1.00 0.00 H new ATOM 0 HG2 GLU A 187 -0.359 5.231 -5.050 1.00 0.00 H new ATOM 0 HG3 GLU A 187 -0.132 5.935 -6.639 1.00 0.00 H new ATOM 804 N THR A 188 4.193 3.887 -5.180 1.00 0.00 N ATOM 805 CA THR A 188 5.491 3.289 -5.426 1.00 0.00 C ATOM 806 C THR A 188 6.119 2.765 -4.132 1.00 0.00 C ATOM 807 O THR A 188 6.576 1.621 -4.081 1.00 0.00 O ATOM 808 CB THR A 188 6.443 4.291 -6.111 1.00 0.00 C ATOM 809 OG1 THR A 188 6.357 5.573 -5.472 1.00 0.00 O ATOM 810 CG2 THR A 188 6.104 4.435 -7.585 1.00 0.00 C ATOM 0 H THR A 188 4.197 4.906 -5.134 1.00 0.00 H new ATOM 0 HA THR A 188 5.336 2.444 -6.096 1.00 0.00 H new ATOM 0 HB THR A 188 7.460 3.909 -6.020 1.00 0.00 H new ATOM 0 HG1 THR A 188 5.884 5.482 -4.618 1.00 0.00 H new ATOM 0 HG21 THR A 188 6.788 5.146 -8.048 1.00 0.00 H new ATOM 0 HG22 THR A 188 6.200 3.467 -8.077 1.00 0.00 H new ATOM 0 HG23 THR A 188 5.081 4.795 -7.689 1.00 0.00 H new ATOM 818 N LEU A 189 6.110 3.592 -3.091 1.00 0.00 N ATOM 819 CA LEU A 189 6.731 3.249 -1.811 1.00 0.00 C ATOM 820 C LEU A 189 6.046 2.058 -1.153 1.00 0.00 C ATOM 821 O LEU A 189 6.707 1.224 -0.537 1.00 0.00 O ATOM 822 CB LEU A 189 6.681 4.450 -0.864 1.00 0.00 C ATOM 823 CG LEU A 189 7.452 5.686 -1.329 1.00 0.00 C ATOM 824 CD1 LEU A 189 7.121 6.880 -0.448 1.00 0.00 C ATOM 825 CD2 LEU A 189 8.948 5.413 -1.316 1.00 0.00 C ATOM 0 H LEU A 189 5.675 4.515 -3.108 1.00 0.00 H new ATOM 0 HA LEU A 189 7.767 2.978 -2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 189 5.638 4.729 -0.713 1.00 0.00 H new ATOM 0 HB3 LEU A 189 7.072 4.143 0.106 1.00 0.00 H new ATOM 0 HG LEU A 189 7.152 5.918 -2.351 1.00 0.00 H new ATOM 0 HD11 LEU A 189 7.678 7.752 -0.792 1.00 0.00 H new ATOM 0 HD12 LEU A 189 6.052 7.087 -0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 189 7.395 6.658 0.583 1.00 0.00 H new ATOM 0 HD21 LEU A 189 9.483 6.302 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 189 9.263 5.158 -0.304 1.00 0.00 H new ATOM 0 HD23 LEU A 189 9.172 4.582 -1.985 1.00 0.00 H new ATOM 837 N LEU A 190 4.725 1.987 -1.292 1.00 0.00 N ATOM 838 CA LEU A 190 3.926 0.930 -0.674 1.00 0.00 C ATOM 839 C LEU A 190 4.479 -0.450 -1.013 1.00 0.00 C ATOM 840 O LEU A 190 4.716 -1.270 -0.128 1.00 0.00 O ATOM 841 CB LEU A 190 2.469 1.041 -1.139 1.00 0.00 C ATOM 842 CG LEU A 190 1.489 0.060 -0.495 1.00 0.00 C ATOM 843 CD1 LEU A 190 1.457 0.252 1.013 1.00 0.00 C ATOM 844 CD2 LEU A 190 0.095 0.234 -1.087 1.00 0.00 C ATOM 0 H LEU A 190 4.179 2.657 -1.834 1.00 0.00 H new ATOM 0 HA LEU A 190 3.973 1.055 0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 190 2.121 2.055 -0.942 1.00 0.00 H new ATOM 0 HB3 LEU A 190 2.440 0.898 -2.219 1.00 0.00 H new ATOM 0 HG LEU A 190 1.828 -0.955 -0.705 1.00 0.00 H new ATOM 0 HD11 LEU A 190 0.754 -0.454 1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 190 2.452 0.079 1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 190 1.142 1.270 1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -0.590 -0.472 -0.618 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -0.252 1.251 -0.907 1.00 0.00 H new ATOM 0 HD23 LEU A 190 0.130 0.047 -2.160 1.00 0.00 H new ATOM 856 N VAL A 191 4.678 -0.696 -2.297 1.00 0.00 N ATOM 857 CA VAL A 191 5.206 -1.972 -2.756 1.00 0.00 C ATOM 858 C VAL A 191 6.724 -2.030 -2.577 1.00 0.00 C ATOM 859 O VAL A 191 7.279 -3.077 -2.252 1.00 0.00 O ATOM 860 CB VAL A 191 4.853 -2.220 -4.236 1.00 0.00 C ATOM 861 CG1 VAL A 191 5.264 -3.619 -4.660 1.00 0.00 C ATOM 862 CG2 VAL A 191 3.368 -2.003 -4.481 1.00 0.00 C ATOM 0 H VAL A 191 4.482 -0.028 -3.042 1.00 0.00 H new ATOM 0 HA VAL A 191 4.745 -2.752 -2.149 1.00 0.00 H new ATOM 0 HB VAL A 191 5.407 -1.502 -4.840 1.00 0.00 H new ATOM 0 HG11 VAL A 191 5.005 -3.772 -5.708 1.00 0.00 H new ATOM 0 HG12 VAL A 191 6.340 -3.737 -4.531 1.00 0.00 H new ATOM 0 HG13 VAL A 191 4.742 -4.353 -4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 191 3.142 -2.184 -5.532 1.00 0.00 H new ATOM 0 HG22 VAL A 191 2.793 -2.692 -3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 191 3.103 -0.977 -4.224 1.00 0.00 H new ATOM 872 N GLN A 192 7.380 -0.889 -2.770 1.00 0.00 N ATOM 873 CA GLN A 192 8.833 -0.808 -2.754 1.00 0.00 C ATOM 874 C GLN A 192 9.422 -1.191 -1.398 1.00 0.00 C ATOM 875 O GLN A 192 10.354 -1.994 -1.326 1.00 0.00 O ATOM 876 CB GLN A 192 9.270 0.611 -3.118 1.00 0.00 C ATOM 877 CG GLN A 192 10.769 0.805 -3.107 1.00 0.00 C ATOM 878 CD GLN A 192 11.173 2.259 -3.250 1.00 0.00 C ATOM 879 OE1 GLN A 192 11.368 2.758 -4.359 1.00 0.00 O ATOM 880 NE2 GLN A 192 11.294 2.952 -2.129 1.00 0.00 N ATOM 0 H GLN A 192 6.917 0.004 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 192 9.208 -1.522 -3.487 1.00 0.00 H new ATOM 0 HB2 GLN A 192 8.888 0.857 -4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 192 8.816 1.313 -2.418 1.00 0.00 H new ATOM 0 HG2 GLN A 192 11.175 0.409 -2.176 1.00 0.00 H new ATOM 0 HG3 GLN A 192 11.212 0.228 -3.919 1.00 0.00 H new ATOM 0 HE21 GLN A 192 11.124 2.501 -1.230 1.00 0.00 H new ATOM 0 HE22 GLN A 192 11.558 3.937 -2.164 1.00 0.00 H new ATOM 889 N ASN A 193 8.879 -0.612 -0.334 1.00 0.00 N ATOM 890 CA ASN A 193 9.454 -0.762 1.003 1.00 0.00 C ATOM 891 C ASN A 193 8.947 -2.017 1.707 1.00 0.00 C ATOM 892 O ASN A 193 9.322 -2.290 2.850 1.00 0.00 O ATOM 893 CB ASN A 193 9.149 0.475 1.856 1.00 0.00 C ATOM 894 CG ASN A 193 9.958 1.697 1.451 1.00 0.00 C ATOM 895 OD1 ASN A 193 10.400 1.822 0.308 1.00 0.00 O ATOM 896 ND2 ASN A 193 10.143 2.619 2.383 1.00 0.00 N ATOM 0 H ASN A 193 8.040 -0.033 -0.368 1.00 0.00 H new ATOM 0 HA ASN A 193 10.532 -0.863 0.882 1.00 0.00 H new ATOM 0 HB2 ASN A 193 8.087 0.709 1.779 1.00 0.00 H new ATOM 0 HB3 ASN A 193 9.350 0.245 2.902 1.00 0.00 H new ATOM 0 HD21 ASN A 193 10.666 3.467 2.165 1.00 0.00 H new ATOM 0 HD22 ASN A 193 9.762 2.481 3.319 1.00 0.00 H new ATOM 903 N ALA A 194 8.092 -2.772 1.036 1.00 0.00 N ATOM 904 CA ALA A 194 7.611 -4.041 1.572 1.00 0.00 C ATOM 905 C ALA A 194 8.644 -5.147 1.347 1.00 0.00 C ATOM 906 O ALA A 194 9.483 -5.048 0.450 1.00 0.00 O ATOM 907 CB ALA A 194 6.281 -4.411 0.928 1.00 0.00 C ATOM 0 H ALA A 194 7.715 -2.531 0.119 1.00 0.00 H new ATOM 0 HA ALA A 194 7.460 -3.931 2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 194 5.931 -5.360 1.335 1.00 0.00 H new ATOM 0 HB2 ALA A 194 5.547 -3.633 1.137 1.00 0.00 H new ATOM 0 HB3 ALA A 194 6.412 -4.505 -0.150 1.00 0.00 H new ATOM 913 N ASN A 195 8.585 -6.184 2.179 1.00 0.00 N ATOM 914 CA ASN A 195 9.479 -7.339 2.054 1.00 0.00 C ATOM 915 C ASN A 195 9.246 -8.055 0.733 1.00 0.00 C ATOM 916 O ASN A 195 8.166 -7.946 0.157 1.00 0.00 O ATOM 917 CB ASN A 195 9.230 -8.350 3.177 1.00 0.00 C ATOM 918 CG ASN A 195 9.510 -7.810 4.555 1.00 0.00 C ATOM 919 OD1 ASN A 195 10.399 -6.983 4.749 1.00 0.00 O ATOM 920 ND2 ASN A 195 8.740 -8.274 5.519 1.00 0.00 N ATOM 0 H ASN A 195 7.924 -6.251 2.953 1.00 0.00 H new ATOM 0 HA ASN A 195 10.500 -6.961 2.109 1.00 0.00 H new ATOM 0 HB2 ASN A 195 8.193 -8.682 3.131 1.00 0.00 H new ATOM 0 HB3 ASN A 195 9.853 -9.228 3.007 1.00 0.00 H new ATOM 0 HD21 ASN A 195 8.869 -7.947 6.477 1.00 0.00 H new ATOM 0 HD22 ASN A 195 8.015 -8.960 5.307 1.00 0.00 H new ATOM 927 N PRO A 196 10.236 -8.825 0.248 1.00 0.00 N ATOM 928 CA PRO A 196 10.075 -9.639 -0.960 1.00 0.00 C ATOM 929 C PRO A 196 8.927 -10.634 -0.802 1.00 0.00 C ATOM 930 O PRO A 196 8.246 -10.982 -1.767 1.00 0.00 O ATOM 931 CB PRO A 196 11.417 -10.373 -1.096 1.00 0.00 C ATOM 932 CG PRO A 196 12.067 -10.256 0.243 1.00 0.00 C ATOM 933 CD PRO A 196 11.583 -8.960 0.826 1.00 0.00 C ATOM 0 HA PRO A 196 9.832 -9.039 -1.837 1.00 0.00 H new ATOM 0 HB2 PRO A 196 11.268 -11.417 -1.371 1.00 0.00 H new ATOM 0 HB3 PRO A 196 12.034 -9.923 -1.874 1.00 0.00 H new ATOM 0 HG2 PRO A 196 11.797 -11.096 0.882 1.00 0.00 H new ATOM 0 HG3 PRO A 196 13.153 -10.261 0.151 1.00 0.00 H new ATOM 0 HD2 PRO A 196 11.554 -8.992 1.915 1.00 0.00 H new ATOM 0 HD3 PRO A 196 12.228 -8.126 0.549 1.00 0.00 H new ATOM 941 N ASP A 197 8.718 -11.064 0.439 1.00 0.00 N ATOM 942 CA ASP A 197 7.635 -11.977 0.787 1.00 0.00 C ATOM 943 C ASP A 197 6.279 -11.350 0.462 1.00 0.00 C ATOM 944 O ASP A 197 5.479 -11.923 -0.280 1.00 0.00 O ATOM 945 CB ASP A 197 7.735 -12.324 2.278 1.00 0.00 C ATOM 946 CG ASP A 197 6.573 -13.148 2.792 1.00 0.00 C ATOM 947 OD1 ASP A 197 6.473 -14.336 2.424 1.00 0.00 O ATOM 948 OD2 ASP A 197 5.782 -12.623 3.603 1.00 0.00 O ATOM 0 H ASP A 197 9.296 -10.788 1.233 1.00 0.00 H new ATOM 0 HA ASP A 197 7.724 -12.891 0.199 1.00 0.00 H new ATOM 0 HB2 ASP A 197 8.662 -12.871 2.453 1.00 0.00 H new ATOM 0 HB3 ASP A 197 7.796 -11.400 2.853 1.00 0.00 H new ATOM 954 N CYS A 198 6.049 -10.151 0.982 1.00 0.00 N ATOM 955 CA CYS A 198 4.815 -9.423 0.711 1.00 0.00 C ATOM 956 C CYS A 198 4.787 -8.930 -0.734 1.00 0.00 C ATOM 957 O CYS A 198 3.742 -8.928 -1.380 1.00 0.00 O ATOM 958 CB CYS A 198 4.680 -8.236 1.666 1.00 0.00 C ATOM 959 SG CYS A 198 3.206 -7.226 1.392 1.00 0.00 S ATOM 0 H CYS A 198 6.701 -9.661 1.594 1.00 0.00 H new ATOM 0 HA CYS A 198 3.977 -10.103 0.865 1.00 0.00 H new ATOM 0 HB2 CYS A 198 4.666 -8.608 2.690 1.00 0.00 H new ATOM 0 HB3 CYS A 198 5.563 -7.604 1.569 1.00 0.00 H new ATOM 0 HG CYS A 198 3.058 -6.396 2.382 1.00 0.00 H new ATOM 965 N LYS A 199 5.950 -8.526 -1.228 1.00 0.00 N ATOM 966 CA LYS A 199 6.093 -7.981 -2.576 1.00 0.00 C ATOM 967 C LYS A 199 5.652 -8.994 -3.633 1.00 0.00 C ATOM 968 O LYS A 199 5.098 -8.627 -4.668 1.00 0.00 O ATOM 969 CB LYS A 199 7.552 -7.572 -2.785 1.00 0.00 C ATOM 970 CG LYS A 199 7.816 -6.726 -4.017 1.00 0.00 C ATOM 971 CD LYS A 199 9.219 -6.136 -3.971 1.00 0.00 C ATOM 972 CE LYS A 199 9.374 -5.173 -2.800 1.00 0.00 C ATOM 973 NZ LYS A 199 10.782 -4.757 -2.586 1.00 0.00 N ATOM 0 H LYS A 199 6.825 -8.566 -0.705 1.00 0.00 H new ATOM 0 HA LYS A 199 5.448 -7.109 -2.684 1.00 0.00 H new ATOM 0 HB2 LYS A 199 7.887 -7.021 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 199 8.160 -8.474 -2.846 1.00 0.00 H new ATOM 0 HG2 LYS A 199 7.701 -7.334 -4.914 1.00 0.00 H new ATOM 0 HG3 LYS A 199 7.080 -5.924 -4.079 1.00 0.00 H new ATOM 0 HD2 LYS A 199 9.951 -6.939 -3.884 1.00 0.00 H new ATOM 0 HD3 LYS A 199 9.428 -5.614 -4.905 1.00 0.00 H new ATOM 0 HE2 LYS A 199 8.761 -4.289 -2.977 1.00 0.00 H new ATOM 0 HE3 LYS A 199 8.997 -5.646 -1.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 199 10.802 -3.819 -2.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 199 11.258 -5.447 -1.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 199 11.274 -4.713 -3.501 1.00 0.00 H new ATOM 987 N THR A 200 5.894 -10.270 -3.356 1.00 0.00 N ATOM 988 CA THR A 200 5.443 -11.344 -4.228 1.00 0.00 C ATOM 989 C THR A 200 3.917 -11.398 -4.251 1.00 0.00 C ATOM 990 O THR A 200 3.300 -11.545 -5.308 1.00 0.00 O ATOM 991 CB THR A 200 5.999 -12.706 -3.759 1.00 0.00 C ATOM 992 OG1 THR A 200 7.431 -12.651 -3.664 1.00 0.00 O ATOM 993 CG2 THR A 200 5.596 -13.816 -4.715 1.00 0.00 C ATOM 0 H THR A 200 6.403 -10.585 -2.530 1.00 0.00 H new ATOM 0 HA THR A 200 5.815 -11.141 -5.232 1.00 0.00 H new ATOM 0 HB THR A 200 5.578 -12.921 -2.777 1.00 0.00 H new ATOM 0 HG1 THR A 200 7.687 -12.297 -2.787 1.00 0.00 H new ATOM 0 HG21 THR A 200 6.000 -14.765 -4.362 1.00 0.00 H new ATOM 0 HG22 THR A 200 4.509 -13.879 -4.761 1.00 0.00 H new ATOM 0 HG23 THR A 200 5.990 -13.601 -5.709 1.00 0.00 H new ATOM 1001 N ILE A 201 3.316 -11.241 -3.075 1.00 0.00 N ATOM 1002 CA ILE A 201 1.868 -11.305 -2.930 1.00 0.00 C ATOM 1003 C ILE A 201 1.202 -10.074 -3.545 1.00 0.00 C ATOM 1004 O ILE A 201 0.125 -10.164 -4.135 1.00 0.00 O ATOM 1005 CB ILE A 201 1.468 -11.418 -1.440 1.00 0.00 C ATOM 1006 CG1 ILE A 201 2.143 -12.637 -0.804 1.00 0.00 C ATOM 1007 CG2 ILE A 201 -0.046 -11.504 -1.293 1.00 0.00 C ATOM 1008 CD1 ILE A 201 1.886 -12.769 0.682 1.00 0.00 C ATOM 0 H ILE A 201 3.816 -11.067 -2.203 1.00 0.00 H new ATOM 0 HA ILE A 201 1.524 -12.194 -3.459 1.00 0.00 H new ATOM 0 HB ILE A 201 1.807 -10.522 -0.921 1.00 0.00 H new ATOM 0 HG12 ILE A 201 1.792 -13.539 -1.306 1.00 0.00 H new ATOM 0 HG13 ILE A 201 3.218 -12.576 -0.974 1.00 0.00 H new ATOM 0 HG21 ILE A 201 -0.305 -11.583 -0.237 1.00 0.00 H new ATOM 0 HG22 ILE A 201 -0.504 -10.608 -1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 201 -0.414 -12.382 -1.823 1.00 0.00 H new ATOM 0 HD11 ILE A 201 2.395 -13.655 1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 201 2.263 -11.885 1.196 1.00 0.00 H new ATOM 0 HD13 ILE A 201 0.815 -12.863 0.859 1.00 0.00 H new ATOM 1020 N LEU A 202 1.859 -8.929 -3.414 1.00 0.00 N ATOM 1021 CA LEU A 202 1.334 -7.676 -3.945 1.00 0.00 C ATOM 1022 C LEU A 202 1.223 -7.733 -5.467 1.00 0.00 C ATOM 1023 O LEU A 202 0.313 -7.140 -6.049 1.00 0.00 O ATOM 1024 CB LEU A 202 2.219 -6.502 -3.522 1.00 0.00 C ATOM 1025 CG LEU A 202 2.350 -6.298 -2.009 1.00 0.00 C ATOM 1026 CD1 LEU A 202 3.251 -5.112 -1.703 1.00 0.00 C ATOM 1027 CD2 LEU A 202 0.981 -6.108 -1.369 1.00 0.00 C ATOM 0 H LEU A 202 2.760 -8.841 -2.943 1.00 0.00 H new ATOM 0 HA LEU A 202 0.335 -7.527 -3.534 1.00 0.00 H new ATOM 0 HB2 LEU A 202 3.215 -6.649 -3.941 1.00 0.00 H new ATOM 0 HB3 LEU A 202 1.819 -5.589 -3.963 1.00 0.00 H new ATOM 0 HG LEU A 202 2.804 -7.193 -1.584 1.00 0.00 H new ATOM 0 HD11 LEU A 202 3.331 -4.985 -0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 202 4.242 -5.290 -2.121 1.00 0.00 H new ATOM 0 HD13 LEU A 202 2.828 -4.210 -2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 202 1.098 -5.965 -0.295 1.00 0.00 H new ATOM 0 HD22 LEU A 202 0.496 -5.233 -1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 202 0.368 -6.990 -1.553 1.00 0.00 H new ATOM 1039 N LYS A 203 2.146 -8.451 -6.104 1.00 0.00 N ATOM 1040 CA LYS A 203 2.089 -8.664 -7.547 1.00 0.00 C ATOM 1041 C LYS A 203 0.830 -9.434 -7.923 1.00 0.00 C ATOM 1042 O LYS A 203 0.175 -9.129 -8.919 1.00 0.00 O ATOM 1043 CB LYS A 203 3.325 -9.424 -8.035 1.00 0.00 C ATOM 1044 CG LYS A 203 4.610 -8.621 -7.957 1.00 0.00 C ATOM 1045 CD LYS A 203 5.796 -9.428 -8.458 1.00 0.00 C ATOM 1046 CE LYS A 203 7.062 -8.587 -8.528 1.00 0.00 C ATOM 1047 NZ LYS A 203 7.437 -8.027 -7.204 1.00 0.00 N ATOM 0 H LYS A 203 2.941 -8.894 -5.643 1.00 0.00 H new ATOM 0 HA LYS A 203 2.066 -7.687 -8.030 1.00 0.00 H new ATOM 0 HB2 LYS A 203 3.439 -10.332 -7.443 1.00 0.00 H new ATOM 0 HB3 LYS A 203 3.164 -9.735 -9.067 1.00 0.00 H new ATOM 0 HG2 LYS A 203 4.510 -7.712 -8.550 1.00 0.00 H new ATOM 0 HG3 LYS A 203 4.787 -8.312 -6.927 1.00 0.00 H new ATOM 0 HD2 LYS A 203 5.961 -10.280 -7.798 1.00 0.00 H new ATOM 0 HD3 LYS A 203 5.571 -9.830 -9.446 1.00 0.00 H new ATOM 0 HE2 LYS A 203 7.881 -9.197 -8.908 1.00 0.00 H new ATOM 0 HE3 LYS A 203 6.916 -7.772 -9.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 8.365 -7.562 -7.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 6.723 -7.332 -6.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 7.486 -8.794 -6.504 1.00 0.00 H new ATOM 1061 N ALA A 204 0.494 -10.427 -7.109 1.00 0.00 N ATOM 1062 CA ALA A 204 -0.694 -11.235 -7.336 1.00 0.00 C ATOM 1063 C ALA A 204 -1.952 -10.395 -7.171 1.00 0.00 C ATOM 1064 O ALA A 204 -2.919 -10.547 -7.919 1.00 0.00 O ATOM 1065 CB ALA A 204 -0.720 -12.422 -6.386 1.00 0.00 C ATOM 0 H ALA A 204 1.031 -10.692 -6.283 1.00 0.00 H new ATOM 0 HA ALA A 204 -0.663 -11.611 -8.359 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -1.616 -13.016 -6.570 1.00 0.00 H new ATOM 0 HB2 ALA A 204 0.164 -13.038 -6.550 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -0.727 -12.064 -5.356 1.00 0.00 H new ATOM 1071 N LEU A 205 -1.923 -9.503 -6.191 1.00 0.00 N ATOM 1072 CA LEU A 205 -3.036 -8.600 -5.933 1.00 0.00 C ATOM 1073 C LEU A 205 -3.205 -7.604 -7.076 1.00 0.00 C ATOM 1074 O LEU A 205 -4.299 -7.445 -7.619 1.00 0.00 O ATOM 1075 CB LEU A 205 -2.812 -7.856 -4.614 1.00 0.00 C ATOM 1076 CG LEU A 205 -2.832 -8.736 -3.366 1.00 0.00 C ATOM 1077 CD1 LEU A 205 -2.318 -7.963 -2.167 1.00 0.00 C ATOM 1078 CD2 LEU A 205 -4.239 -9.247 -3.100 1.00 0.00 C ATOM 0 H LEU A 205 -1.133 -9.385 -5.556 1.00 0.00 H new ATOM 0 HA LEU A 205 -3.948 -9.192 -5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 205 -1.852 -7.342 -4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 205 -3.580 -7.089 -4.512 1.00 0.00 H new ATOM 0 HG LEU A 205 -2.178 -9.591 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 205 -2.338 -8.603 -1.285 1.00 0.00 H new ATOM 0 HD12 LEU A 205 -1.295 -7.637 -2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 205 -2.951 -7.092 -1.997 1.00 0.00 H new ATOM 0 HD21 LEU A 205 -4.236 -9.873 -2.207 1.00 0.00 H new ATOM 0 HD22 LEU A 205 -4.911 -8.402 -2.949 1.00 0.00 H new ATOM 0 HD23 LEU A 205 -4.580 -9.834 -3.953 1.00 0.00 H new ATOM 1090 N GLY A 206 -2.112 -6.953 -7.447 1.00 0.00 N ATOM 1091 CA GLY A 206 -2.157 -5.970 -8.511 1.00 0.00 C ATOM 1092 C GLY A 206 -2.484 -4.578 -7.999 1.00 0.00 C ATOM 1093 O GLY A 206 -2.920 -4.420 -6.859 1.00 0.00 O ATOM 0 H GLY A 206 -1.192 -7.088 -7.029 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -1.195 -5.949 -9.024 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -2.904 -6.269 -9.247 1.00 0.00 H new ATOM 1097 N PRO A 207 -2.285 -3.543 -8.827 1.00 0.00 N ATOM 1098 CA PRO A 207 -2.537 -2.157 -8.439 1.00 0.00 C ATOM 1099 C PRO A 207 -4.007 -1.755 -8.572 1.00 0.00 C ATOM 1100 O PRO A 207 -4.379 -0.625 -8.258 1.00 0.00 O ATOM 1101 CB PRO A 207 -1.680 -1.368 -9.421 1.00 0.00 C ATOM 1102 CG PRO A 207 -1.631 -2.211 -10.651 1.00 0.00 C ATOM 1103 CD PRO A 207 -1.779 -3.645 -10.209 1.00 0.00 C ATOM 0 HA PRO A 207 -2.299 -1.980 -7.390 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -2.116 -0.391 -9.629 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -0.681 -1.193 -9.022 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -2.430 -1.935 -11.339 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -0.689 -2.066 -11.181 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -2.473 -4.190 -10.849 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -0.827 -4.175 -10.247 1.00 0.00 H new ATOM 1111 N ALA A 208 -4.836 -2.680 -9.041 1.00 0.00 N ATOM 1112 CA ALA A 208 -6.268 -2.424 -9.176 1.00 0.00 C ATOM 1113 C ALA A 208 -7.022 -2.955 -7.963 1.00 0.00 C ATOM 1114 O ALA A 208 -8.254 -2.897 -7.898 1.00 0.00 O ATOM 1115 CB ALA A 208 -6.805 -3.043 -10.456 1.00 0.00 C ATOM 0 H ALA A 208 -4.544 -3.612 -9.334 1.00 0.00 H new ATOM 0 HA ALA A 208 -6.421 -1.346 -9.230 1.00 0.00 H new ATOM 0 HB1 ALA A 208 -7.873 -2.841 -10.538 1.00 0.00 H new ATOM 0 HB2 ALA A 208 -6.288 -2.612 -11.313 1.00 0.00 H new ATOM 0 HB3 ALA A 208 -6.640 -4.120 -10.436 1.00 0.00 H new ATOM 1121 N ALA A 209 -6.270 -3.480 -7.010 1.00 0.00 N ATOM 1122 CA ALA A 209 -6.829 -3.954 -5.755 1.00 0.00 C ATOM 1123 C ALA A 209 -6.849 -2.814 -4.739 1.00 0.00 C ATOM 1124 O ALA A 209 -6.377 -1.716 -5.034 1.00 0.00 O ATOM 1125 CB ALA A 209 -6.016 -5.133 -5.246 1.00 0.00 C ATOM 0 H ALA A 209 -5.259 -3.589 -7.084 1.00 0.00 H new ATOM 0 HA ALA A 209 -7.854 -4.290 -5.910 1.00 0.00 H new ATOM 0 HB1 ALA A 209 -6.437 -5.486 -4.305 1.00 0.00 H new ATOM 0 HB2 ALA A 209 -6.043 -5.938 -5.981 1.00 0.00 H new ATOM 0 HB3 ALA A 209 -4.984 -4.822 -5.087 1.00 0.00 H new ATOM 1131 N THR A 210 -7.391 -3.060 -3.553 1.00 0.00 N ATOM 1132 CA THR A 210 -7.491 -2.010 -2.546 1.00 0.00 C ATOM 1133 C THR A 210 -6.666 -2.374 -1.320 1.00 0.00 C ATOM 1134 O THR A 210 -6.431 -3.558 -1.082 1.00 0.00 O ATOM 1135 CB THR A 210 -8.959 -1.741 -2.133 1.00 0.00 C ATOM 1136 OG1 THR A 210 -9.025 -0.658 -1.189 1.00 0.00 O ATOM 1137 CG2 THR A 210 -9.595 -2.982 -1.522 1.00 0.00 C ATOM 0 H THR A 210 -7.764 -3.965 -3.266 1.00 0.00 H new ATOM 0 HA THR A 210 -7.098 -1.095 -2.990 1.00 0.00 H new ATOM 0 HB THR A 210 -9.511 -1.472 -3.034 1.00 0.00 H new ATOM 0 HG1 THR A 210 -8.257 -0.063 -1.319 1.00 0.00 H new ATOM 0 HG21 THR A 210 -10.625 -2.762 -1.242 1.00 0.00 H new ATOM 0 HG22 THR A 210 -9.582 -3.793 -2.250 1.00 0.00 H new ATOM 0 HG23 THR A 210 -9.034 -3.280 -0.636 1.00 0.00 H new ATOM 1145 N LEU A 211 -6.231 -1.374 -0.556 1.00 0.00 N ATOM 1146 CA LEU A 211 -5.323 -1.588 0.571 1.00 0.00 C ATOM 1147 C LEU A 211 -5.796 -2.725 1.474 1.00 0.00 C ATOM 1148 O LEU A 211 -4.993 -3.547 1.923 1.00 0.00 O ATOM 1149 CB LEU A 211 -5.201 -0.311 1.398 1.00 0.00 C ATOM 1150 CG LEU A 211 -4.201 -0.382 2.549 1.00 0.00 C ATOM 1151 CD1 LEU A 211 -2.776 -0.351 2.020 1.00 0.00 C ATOM 1152 CD2 LEU A 211 -4.443 0.748 3.529 1.00 0.00 C ATOM 0 H LEU A 211 -6.495 -0.399 -0.698 1.00 0.00 H new ATOM 0 HA LEU A 211 -4.352 -1.860 0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -4.914 0.506 0.737 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -6.182 -0.063 1.803 1.00 0.00 H new ATOM 0 HG LEU A 211 -4.343 -1.325 3.077 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -2.077 -0.402 2.855 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -2.615 -1.202 1.359 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -2.613 0.574 1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -3.722 0.684 4.344 1.00 0.00 H new ATOM 0 HD22 LEU A 211 -4.328 1.704 3.018 1.00 0.00 H new ATOM 0 HD23 LEU A 211 -5.453 0.671 3.931 1.00 0.00 H new ATOM 1164 N GLU A 212 -7.106 -2.775 1.707 1.00 0.00 N ATOM 1165 CA GLU A 212 -7.712 -3.777 2.575 1.00 0.00 C ATOM 1166 C GLU A 212 -7.344 -5.194 2.133 1.00 0.00 C ATOM 1167 O GLU A 212 -7.262 -6.114 2.953 1.00 0.00 O ATOM 1168 CB GLU A 212 -9.230 -3.604 2.573 1.00 0.00 C ATOM 1169 CG GLU A 212 -9.946 -4.517 3.551 1.00 0.00 C ATOM 1170 CD GLU A 212 -11.447 -4.330 3.537 1.00 0.00 C ATOM 1171 OE1 GLU A 212 -11.921 -3.270 3.997 1.00 0.00 O ATOM 1172 OE2 GLU A 212 -12.162 -5.248 3.086 1.00 0.00 O ATOM 0 H GLU A 212 -7.775 -2.122 1.299 1.00 0.00 H new ATOM 0 HA GLU A 212 -7.328 -3.633 3.585 1.00 0.00 H new ATOM 0 HB2 GLU A 212 -9.470 -2.568 2.813 1.00 0.00 H new ATOM 0 HB3 GLU A 212 -9.608 -3.794 1.568 1.00 0.00 H new ATOM 0 HG2 GLU A 212 -9.712 -5.554 3.311 1.00 0.00 H new ATOM 0 HG3 GLU A 212 -9.571 -4.330 4.557 1.00 0.00 H new ATOM 1180 N GLU A 213 -7.092 -5.365 0.841 1.00 0.00 N ATOM 1181 CA GLU A 213 -6.741 -6.664 0.312 1.00 0.00 C ATOM 1182 C GLU A 213 -5.318 -7.034 0.712 1.00 0.00 C ATOM 1183 O GLU A 213 -5.055 -8.173 1.087 1.00 0.00 O ATOM 1184 CB GLU A 213 -6.916 -6.694 -1.204 1.00 0.00 C ATOM 1185 CG GLU A 213 -8.374 -6.605 -1.622 1.00 0.00 C ATOM 1186 CD GLU A 213 -8.566 -6.633 -3.120 1.00 0.00 C ATOM 1187 OE1 GLU A 213 -8.655 -5.550 -3.729 1.00 0.00 O ATOM 1188 OE2 GLU A 213 -8.649 -7.737 -3.694 1.00 0.00 O ATOM 0 H GLU A 213 -7.126 -4.618 0.147 1.00 0.00 H new ATOM 0 HA GLU A 213 -7.415 -7.407 0.738 1.00 0.00 H new ATOM 0 HB2 GLU A 213 -6.363 -5.866 -1.647 1.00 0.00 H new ATOM 0 HB3 GLU A 213 -6.483 -7.613 -1.599 1.00 0.00 H new ATOM 0 HG2 GLU A 213 -8.924 -7.433 -1.176 1.00 0.00 H new ATOM 0 HG3 GLU A 213 -8.804 -5.686 -1.224 1.00 0.00 H new ATOM 1196 N MET A 214 -4.413 -6.057 0.664 1.00 0.00 N ATOM 1197 CA MET A 214 -3.015 -6.268 1.045 1.00 0.00 C ATOM 1198 C MET A 214 -2.891 -6.533 2.534 1.00 0.00 C ATOM 1199 O MET A 214 -2.115 -7.391 2.958 1.00 0.00 O ATOM 1200 CB MET A 214 -2.152 -5.052 0.688 1.00 0.00 C ATOM 1201 CG MET A 214 -2.049 -4.782 -0.799 1.00 0.00 C ATOM 1202 SD MET A 214 -3.576 -4.153 -1.505 1.00 0.00 S ATOM 1203 CE MET A 214 -3.272 -4.443 -3.238 1.00 0.00 C ATOM 0 H MET A 214 -4.624 -5.106 0.363 1.00 0.00 H new ATOM 0 HA MET A 214 -2.662 -7.136 0.489 1.00 0.00 H new ATOM 0 HB2 MET A 214 -2.565 -4.170 1.179 1.00 0.00 H new ATOM 0 HB3 MET A 214 -1.150 -5.201 1.090 1.00 0.00 H new ATOM 0 HG2 MET A 214 -1.249 -4.063 -0.978 1.00 0.00 H new ATOM 0 HG3 MET A 214 -1.770 -5.703 -1.312 1.00 0.00 H new ATOM 0 HE1 MET A 214 -3.627 -3.591 -3.817 1.00 0.00 H new ATOM 0 HE2 MET A 214 -2.202 -4.573 -3.403 1.00 0.00 H new ATOM 0 HE3 MET A 214 -3.800 -5.342 -3.555 1.00 0.00 H new ATOM 1213 N MET A 215 -3.653 -5.777 3.315 1.00 0.00 N ATOM 1214 CA MET A 215 -3.657 -5.908 4.772 1.00 0.00 C ATOM 1215 C MET A 215 -3.855 -7.363 5.181 1.00 0.00 C ATOM 1216 O MET A 215 -3.112 -7.896 6.002 1.00 0.00 O ATOM 1217 CB MET A 215 -4.773 -5.056 5.386 1.00 0.00 C ATOM 1218 CG MET A 215 -4.755 -3.602 4.948 1.00 0.00 C ATOM 1219 SD MET A 215 -3.287 -2.713 5.496 1.00 0.00 S ATOM 1220 CE MET A 215 -3.561 -2.660 7.264 1.00 0.00 C ATOM 0 H MET A 215 -4.284 -5.058 2.961 1.00 0.00 H new ATOM 0 HA MET A 215 -2.692 -5.560 5.141 1.00 0.00 H new ATOM 0 HB2 MET A 215 -5.736 -5.492 5.121 1.00 0.00 H new ATOM 0 HB3 MET A 215 -4.692 -5.098 6.472 1.00 0.00 H new ATOM 0 HG2 MET A 215 -4.815 -3.556 3.861 1.00 0.00 H new ATOM 0 HG3 MET A 215 -5.641 -3.101 5.337 1.00 0.00 H new ATOM 0 HE1 MET A 215 -2.834 -1.992 7.725 1.00 0.00 H new ATOM 0 HE2 MET A 215 -4.568 -2.295 7.465 1.00 0.00 H new ATOM 0 HE3 MET A 215 -3.448 -3.661 7.680 1.00 0.00 H new ATOM 1230 N THR A 216 -4.854 -7.998 4.588 1.00 0.00 N ATOM 1231 CA THR A 216 -5.156 -9.388 4.879 1.00 0.00 C ATOM 1232 C THR A 216 -4.241 -10.328 4.088 1.00 0.00 C ATOM 1233 O THR A 216 -3.934 -11.432 4.535 1.00 0.00 O ATOM 1234 CB THR A 216 -6.633 -9.690 4.559 1.00 0.00 C ATOM 1235 OG1 THR A 216 -7.466 -8.735 5.232 1.00 0.00 O ATOM 1236 CG2 THR A 216 -7.027 -11.096 4.991 1.00 0.00 C ATOM 0 H THR A 216 -5.471 -7.569 3.899 1.00 0.00 H new ATOM 0 HA THR A 216 -4.980 -9.558 5.941 1.00 0.00 H new ATOM 0 HB THR A 216 -6.767 -9.621 3.479 1.00 0.00 H new ATOM 0 HG1 THR A 216 -8.407 -8.922 5.030 1.00 0.00 H new ATOM 0 HG21 THR A 216 -8.075 -11.271 4.749 1.00 0.00 H new ATOM 0 HG22 THR A 216 -6.407 -11.824 4.468 1.00 0.00 H new ATOM 0 HG23 THR A 216 -6.881 -11.201 6.066 1.00 0.00 H new ATOM 1244 N ALA A 217 -3.779 -9.874 2.926 1.00 0.00 N ATOM 1245 CA ALA A 217 -2.922 -10.683 2.065 1.00 0.00 C ATOM 1246 C ALA A 217 -1.585 -10.991 2.732 1.00 0.00 C ATOM 1247 O ALA A 217 -1.042 -12.084 2.582 1.00 0.00 O ATOM 1248 CB ALA A 217 -2.688 -9.981 0.734 1.00 0.00 C ATOM 0 H ALA A 217 -3.985 -8.945 2.558 1.00 0.00 H new ATOM 0 HA ALA A 217 -3.436 -11.627 1.887 1.00 0.00 H new ATOM 0 HB1 ALA A 217 -2.047 -10.598 0.105 1.00 0.00 H new ATOM 0 HB2 ALA A 217 -3.643 -9.822 0.234 1.00 0.00 H new ATOM 0 HB3 ALA A 217 -2.206 -9.019 0.910 1.00 0.00 H new ATOM 1254 N CYS A 218 -1.063 -10.025 3.471 1.00 0.00 N ATOM 1255 CA CYS A 218 0.237 -10.174 4.104 1.00 0.00 C ATOM 1256 C CYS A 218 0.098 -10.268 5.624 1.00 0.00 C ATOM 1257 O CYS A 218 1.047 -10.002 6.368 1.00 0.00 O ATOM 1258 CB CYS A 218 1.154 -9.012 3.708 1.00 0.00 C ATOM 1259 SG CYS A 218 2.837 -9.122 4.368 1.00 0.00 S ATOM 0 H CYS A 218 -1.520 -9.130 3.647 1.00 0.00 H new ATOM 0 HA CYS A 218 0.687 -11.104 3.755 1.00 0.00 H new ATOM 0 HB2 CYS A 218 1.207 -8.962 2.620 1.00 0.00 H new ATOM 0 HB3 CYS A 218 0.704 -8.079 4.048 1.00 0.00 H new ATOM 0 HG CYS A 218 2.804 -9.652 5.555 1.00 0.00 H new ATOM 1472 N THR B 2 -2.464 4.610 -3.859 1.00 0.00 N ATOM 1473 CA THR B 2 -2.035 5.962 -3.524 1.00 0.00 C ATOM 1474 C THR B 2 -2.401 6.306 -2.065 1.00 0.00 C ATOM 1475 O THR B 2 -2.963 5.477 -1.343 1.00 0.00 O ATOM 1476 CB THR B 2 -2.564 7.038 -4.531 1.00 0.00 C ATOM 1477 OG1 THR B 2 -3.473 7.944 -3.898 1.00 0.00 O ATOM 1478 CG2 THR B 2 -3.259 6.426 -5.743 1.00 0.00 C ATOM 0 HA THR B 2 -0.949 5.984 -3.615 1.00 0.00 H new ATOM 0 HB THR B 2 -1.678 7.573 -4.873 1.00 0.00 H new ATOM 0 HG1 THR B 2 -3.906 8.502 -4.578 1.00 0.00 H new ATOM 0 HG21 THR B 2 -3.604 7.221 -6.404 1.00 0.00 H new ATOM 0 HG22 THR B 2 -2.559 5.786 -6.279 1.00 0.00 H new ATOM 0 HG23 THR B 2 -4.112 5.833 -5.412 1.00 0.00 H new ATOM 1486 N PHE B 3 -2.037 7.492 -1.609 1.00 0.00 N ATOM 1487 CA PHE B 3 -2.357 7.911 -0.249 1.00 0.00 C ATOM 1488 C PHE B 3 -3.869 7.975 -0.079 1.00 0.00 C ATOM 1489 O PHE B 3 -4.390 7.744 1.016 1.00 0.00 O ATOM 1490 CB PHE B 3 -1.721 9.267 0.056 1.00 0.00 C ATOM 1491 CG PHE B 3 -1.819 9.666 1.498 1.00 0.00 C ATOM 1492 CD1 PHE B 3 -1.256 8.873 2.484 1.00 0.00 C ATOM 1493 CD2 PHE B 3 -2.474 10.828 1.873 1.00 0.00 C ATOM 1494 CE1 PHE B 3 -1.341 9.231 3.813 1.00 0.00 C ATOM 1495 CE2 PHE B 3 -2.560 11.191 3.203 1.00 0.00 C ATOM 1496 CZ PHE B 3 -1.993 10.391 4.175 1.00 0.00 C ATOM 0 H PHE B 3 -1.522 8.182 -2.155 1.00 0.00 H new ATOM 0 HA PHE B 3 -1.952 7.184 0.455 1.00 0.00 H new ATOM 0 HB2 PHE B 3 -0.671 9.240 -0.234 1.00 0.00 H new ATOM 0 HB3 PHE B 3 -2.201 10.030 -0.557 1.00 0.00 H new ATOM 0 HD1 PHE B 3 -0.744 7.963 2.209 1.00 0.00 H new ATOM 0 HD2 PHE B 3 -2.922 11.456 1.118 1.00 0.00 H new ATOM 0 HE1 PHE B 3 -0.897 8.603 4.571 1.00 0.00 H new ATOM 0 HE2 PHE B 3 -3.071 12.101 3.483 1.00 0.00 H new ATOM 0 HZ PHE B 3 -2.060 10.673 5.215 1.00 0.00 H new ATOM 1526 N ASP B 5 -6.311 5.982 -1.148 1.00 0.00 N ATOM 1527 CA ASP B 5 -6.874 4.698 -0.692 1.00 0.00 C ATOM 1528 C ASP B 5 -6.517 4.434 0.763 1.00 0.00 C ATOM 1529 O ASP B 5 -7.307 3.854 1.510 1.00 0.00 O ATOM 1530 CB ASP B 5 -6.393 3.533 -1.562 1.00 0.00 C ATOM 1531 CG ASP B 5 -7.273 2.301 -1.433 1.00 0.00 C ATOM 1532 OD1 ASP B 5 -8.448 2.365 -1.849 1.00 0.00 O ATOM 1533 OD2 ASP B 5 -6.791 1.258 -0.949 1.00 0.00 O ATOM 0 HA ASP B 5 -7.958 4.772 -0.784 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -6.369 3.850 -2.605 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -5.371 3.275 -1.284 1.00 0.00 H new ATOM 1539 N LEU B 6 -5.326 4.868 1.162 1.00 0.00 N ATOM 1540 CA LEU B 6 -4.900 4.759 2.552 1.00 0.00 C ATOM 1541 C LEU B 6 -5.884 5.494 3.459 1.00 0.00 C ATOM 1542 O LEU B 6 -6.333 4.964 4.477 1.00 0.00 O ATOM 1543 CB LEU B 6 -3.498 5.345 2.735 1.00 0.00 C ATOM 1544 CG LEU B 6 -2.451 4.381 3.290 1.00 0.00 C ATOM 1545 CD1 LEU B 6 -2.987 3.666 4.516 1.00 0.00 C ATOM 1546 CD2 LEU B 6 -2.017 3.387 2.226 1.00 0.00 C ATOM 0 H LEU B 6 -4.639 5.298 0.543 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.877 3.703 2.822 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -3.150 5.717 1.771 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -3.566 6.204 3.403 1.00 0.00 H new ATOM 0 HG LEU B 6 -1.574 4.957 3.587 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.229 2.983 4.899 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -3.237 4.398 5.284 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -3.880 3.103 4.247 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -1.271 2.710 2.643 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -2.881 2.813 1.890 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -1.587 3.924 1.380 1.00 0.00 H new ATOM 1558 N LEU B 7 -6.219 6.718 3.069 1.00 0.00 N ATOM 1559 CA LEU B 7 -7.171 7.527 3.815 1.00 0.00 C ATOM 1560 C LEU B 7 -8.569 6.901 3.775 1.00 0.00 C ATOM 1561 O LEU B 7 -9.250 6.856 4.800 1.00 0.00 O ATOM 1562 CB LEU B 7 -7.213 8.961 3.276 1.00 0.00 C ATOM 1563 CG LEU B 7 -5.953 9.794 3.538 1.00 0.00 C ATOM 1564 CD1 LEU B 7 -6.039 11.137 2.834 1.00 0.00 C ATOM 1565 CD2 LEU B 7 -5.752 10.009 5.031 1.00 0.00 C ATOM 0 H LEU B 7 -5.843 7.172 2.237 1.00 0.00 H new ATOM 0 HA LEU B 7 -6.838 7.561 4.852 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -7.387 8.923 2.201 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -8.067 9.474 3.719 1.00 0.00 H new ATOM 0 HG LEU B 7 -5.100 9.243 3.142 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -5.134 11.711 3.034 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -6.139 10.979 1.760 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -6.906 11.686 3.202 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -4.853 10.602 5.195 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -6.614 10.535 5.442 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -5.646 9.044 5.526 1.00 0.00 H new ATOM 1597 N TYR B 9 -9.369 3.813 3.458 1.00 0.00 N ATOM 1598 CA TYR B 9 -9.316 2.642 4.323 1.00 0.00 C ATOM 1599 C TYR B 9 -9.543 3.014 5.785 1.00 0.00 C ATOM 1600 O TYR B 9 -10.360 2.398 6.474 1.00 0.00 O ATOM 1601 CB TYR B 9 -7.967 1.933 4.162 1.00 0.00 C ATOM 1602 CG TYR B 9 -7.759 0.804 5.140 1.00 0.00 C ATOM 1603 CD1 TYR B 9 -8.435 -0.398 4.992 1.00 0.00 C ATOM 1604 CD2 TYR B 9 -6.896 0.945 6.219 1.00 0.00 C ATOM 1605 CE1 TYR B 9 -8.260 -1.427 5.892 1.00 0.00 C ATOM 1606 CE2 TYR B 9 -6.712 -0.080 7.124 1.00 0.00 C ATOM 1607 CZ TYR B 9 -7.399 -1.265 6.956 1.00 0.00 C ATOM 1608 OH TYR B 9 -7.229 -2.293 7.857 1.00 0.00 O ATOM 0 HA TYR B 9 -10.118 1.967 4.024 1.00 0.00 H new ATOM 0 HB2 TYR B 9 -7.890 1.543 3.147 1.00 0.00 H new ATOM 0 HB3 TYR B 9 -7.166 2.662 4.285 1.00 0.00 H new ATOM 0 HD1 TYR B 9 -9.109 -0.530 4.158 1.00 0.00 H new ATOM 0 HD2 TYR B 9 -6.360 1.873 6.352 1.00 0.00 H new ATOM 0 HE1 TYR B 9 -8.795 -2.356 5.764 1.00 0.00 H new ATOM 0 HE2 TYR B 9 -6.036 0.044 7.957 1.00 0.00 H new ATOM 0 HH TYR B 9 -6.589 -2.021 8.547 1.00 0.00 H new ATOM 1618 N TYR B 10 -8.817 4.015 6.257 1.00 0.00 N ATOM 1619 CA TYR B 10 -8.933 4.447 7.640 1.00 0.00 C ATOM 1620 C TYR B 10 -10.270 5.139 7.895 1.00 0.00 C ATOM 1621 O TYR B 10 -10.912 4.903 8.921 1.00 0.00 O ATOM 1622 CB TYR B 10 -7.756 5.349 8.020 1.00 0.00 C ATOM 1623 CG TYR B 10 -6.504 4.569 8.365 1.00 0.00 C ATOM 1624 CD1 TYR B 10 -5.592 4.180 7.387 1.00 0.00 C ATOM 1625 CD2 TYR B 10 -6.245 4.208 9.681 1.00 0.00 C ATOM 1626 CE1 TYR B 10 -4.461 3.458 7.717 1.00 0.00 C ATOM 1627 CE2 TYR B 10 -5.117 3.485 10.014 1.00 0.00 C ATOM 1628 CZ TYR B 10 -4.231 3.114 9.030 1.00 0.00 C ATOM 1629 OH TYR B 10 -3.111 2.387 9.361 1.00 0.00 O ATOM 0 H TYR B 10 -8.142 4.543 5.703 1.00 0.00 H new ATOM 0 HA TYR B 10 -8.901 3.563 8.276 1.00 0.00 H new ATOM 0 HB2 TYR B 10 -7.541 6.025 7.192 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -8.039 5.968 8.872 1.00 0.00 H new ATOM 0 HD1 TYR B 10 -5.771 4.446 6.356 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -6.938 4.498 10.457 1.00 0.00 H new ATOM 0 HE1 TYR B 10 -3.761 3.165 6.949 1.00 0.00 H new ATOM 0 HE2 TYR B 10 -4.931 3.212 11.042 1.00 0.00 H new ATOM 0 HH TYR B 10 -3.098 2.229 10.328 1.00 0.00 H new