USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 478 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 259 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 261 THR OG1 : rot 180:sc= -1.42! USER MOD Set 2.1: A 236 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 237 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 220 HIS : no HD1:sc= -0.0158 X(o=-0.016,f=-0.069) USER MOD Single : A 230 MET CE :methyl -145:sc= -3.28! (180deg=-5.49!) USER MOD Single : A 239 SER OG : rot 180:sc= 0 USER MOD Single : A 240 ASN : amide:sc= -0.242 K(o=-0.24,f=-3.1!) USER MOD Single : A 242 GLN : amide:sc= -0.201 K(o=-0.2,f=-2.1) USER MOD Single : A 243 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 246 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 251 THR OG1 : rot 119:sc= -2.72 USER MOD Single : A 265 TYR OH : rot 180:sc= 0 USER MOD Single : A 268 SER OG : rot 29:sc= 0.0375 USER MOD Single : A 273 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.00954) USER MOD Single : A 274 LYS NZ :NH3+ 166:sc= -0.0168 (180deg=-0.193) USER MOD ----------------------------------------------------------------- ATOM 148 N ALA A 217 12.336 -9.613 -6.414 1.00 0.00 N ATOM 149 CA ALA A 217 11.272 -9.910 -5.463 1.00 0.00 C ATOM 150 C ALA A 217 10.717 -11.314 -5.682 1.00 0.00 C ATOM 151 O ALA A 217 10.061 -11.581 -6.688 1.00 0.00 O ATOM 152 CB ALA A 217 10.161 -8.877 -5.574 1.00 0.00 C ATOM 0 HA ALA A 217 11.693 -9.867 -4.459 1.00 0.00 H new ATOM 0 HB1 ALA A 217 9.373 -9.111 -4.858 1.00 0.00 H new ATOM 0 HB2 ALA A 217 10.563 -7.886 -5.360 1.00 0.00 H new ATOM 0 HB3 ALA A 217 9.750 -8.892 -6.583 1.00 0.00 H new ATOM 158 N ALA A 218 10.985 -12.206 -4.735 1.00 0.00 N ATOM 159 CA ALA A 218 10.511 -13.581 -4.824 1.00 0.00 C ATOM 160 C ALA A 218 8.988 -13.639 -4.802 1.00 0.00 C ATOM 161 O ALA A 218 8.379 -14.498 -5.441 1.00 0.00 O ATOM 162 CB ALA A 218 11.090 -14.414 -3.690 1.00 0.00 C ATOM 0 H ALA A 218 11.528 -12.001 -3.897 1.00 0.00 H new ATOM 0 HA ALA A 218 10.850 -13.995 -5.773 1.00 0.00 H new ATOM 0 HB1 ALA A 218 10.727 -15.439 -3.769 1.00 0.00 H new ATOM 0 HB2 ALA A 218 12.178 -14.408 -3.753 1.00 0.00 H new ATOM 0 HB3 ALA A 218 10.780 -13.992 -2.734 1.00 0.00 H new ATOM 168 N PHE A 219 8.376 -12.721 -4.061 1.00 0.00 N ATOM 169 CA PHE A 219 6.923 -12.669 -3.954 1.00 0.00 C ATOM 170 C PHE A 219 6.392 -11.311 -4.406 1.00 0.00 C ATOM 171 O PHE A 219 6.816 -10.269 -3.905 1.00 0.00 O ATOM 172 CB PHE A 219 6.486 -12.946 -2.514 1.00 0.00 C ATOM 173 CG PHE A 219 6.931 -14.285 -2.000 1.00 0.00 C ATOM 174 CD1 PHE A 219 8.217 -14.464 -1.517 1.00 0.00 C ATOM 175 CD2 PHE A 219 6.063 -15.365 -2.000 1.00 0.00 C ATOM 176 CE1 PHE A 219 8.629 -15.696 -1.044 1.00 0.00 C ATOM 177 CE2 PHE A 219 6.469 -16.599 -1.528 1.00 0.00 C ATOM 178 CZ PHE A 219 7.753 -16.764 -1.048 1.00 0.00 C ATOM 0 H PHE A 219 8.864 -12.003 -3.526 1.00 0.00 H new ATOM 0 HA PHE A 219 6.508 -13.437 -4.607 1.00 0.00 H new ATOM 0 HB2 PHE A 219 6.885 -12.166 -1.865 1.00 0.00 H new ATOM 0 HB3 PHE A 219 5.399 -12.886 -2.454 1.00 0.00 H new ATOM 0 HD1 PHE A 219 8.905 -13.632 -1.510 1.00 0.00 H new ATOM 0 HD2 PHE A 219 5.057 -15.241 -2.373 1.00 0.00 H new ATOM 0 HE1 PHE A 219 9.635 -15.823 -0.672 1.00 0.00 H new ATOM 0 HE2 PHE A 219 5.783 -17.433 -1.535 1.00 0.00 H new ATOM 0 HZ PHE A 219 8.072 -17.727 -0.676 1.00 0.00 H new ATOM 188 N HIS A 220 5.463 -11.332 -5.356 1.00 0.00 N ATOM 189 CA HIS A 220 4.874 -10.103 -5.876 1.00 0.00 C ATOM 190 C HIS A 220 3.358 -10.115 -5.710 1.00 0.00 C ATOM 191 O HIS A 220 2.707 -11.135 -5.933 1.00 0.00 O ATOM 192 CB HIS A 220 5.235 -9.924 -7.351 1.00 0.00 C ATOM 193 CG HIS A 220 5.020 -11.157 -8.175 1.00 0.00 C ATOM 194 ND1 HIS A 220 5.999 -12.107 -8.378 1.00 0.00 N ATOM 195 CD2 HIS A 220 3.929 -11.593 -8.846 1.00 0.00 C ATOM 196 CE1 HIS A 220 5.519 -13.073 -9.140 1.00 0.00 C ATOM 197 NE2 HIS A 220 4.265 -12.786 -9.438 1.00 0.00 N ATOM 0 H HIS A 220 5.102 -12.186 -5.781 1.00 0.00 H new ATOM 0 HA HIS A 220 5.278 -9.266 -5.306 1.00 0.00 H new ATOM 0 HB2 HIS A 220 4.639 -9.111 -7.766 1.00 0.00 H new ATOM 0 HB3 HIS A 220 6.280 -9.624 -7.427 1.00 0.00 H new ATOM 0 HD2 HIS A 220 2.972 -11.096 -8.905 1.00 0.00 H new ATOM 0 HE1 HIS A 220 6.060 -13.949 -9.464 1.00 0.00 H new ATOM 0 HE2 HIS A 220 3.647 -13.357 -10.014 1.00 0.00 H new ATOM 205 N GLU A 221 2.802 -8.973 -5.315 1.00 0.00 N ATOM 206 CA GLU A 221 1.362 -8.854 -5.118 1.00 0.00 C ATOM 207 C GLU A 221 0.755 -7.873 -6.116 1.00 0.00 C ATOM 208 O GLU A 221 1.387 -6.888 -6.496 1.00 0.00 O ATOM 209 CB GLU A 221 1.057 -8.399 -3.689 1.00 0.00 C ATOM 210 CG GLU A 221 1.295 -9.475 -2.643 1.00 0.00 C ATOM 211 CD GLU A 221 0.184 -10.506 -2.605 1.00 0.00 C ATOM 212 OE1 GLU A 221 -0.980 -10.118 -2.373 1.00 0.00 O ATOM 213 OE2 GLU A 221 0.479 -11.703 -2.806 1.00 0.00 O ATOM 0 H GLU A 221 3.326 -8.119 -5.126 1.00 0.00 H new ATOM 0 HA GLU A 221 0.916 -9.835 -5.283 1.00 0.00 H new ATOM 0 HB2 GLU A 221 1.674 -7.532 -3.453 1.00 0.00 H new ATOM 0 HB3 GLU A 221 0.018 -8.075 -3.634 1.00 0.00 H new ATOM 0 HG2 GLU A 221 2.242 -9.974 -2.849 1.00 0.00 H new ATOM 0 HG3 GLU A 221 1.387 -9.009 -1.662 1.00 0.00 H new ATOM 220 N GLU A 222 -0.475 -8.151 -6.537 1.00 0.00 N ATOM 221 CA GLU A 222 -1.167 -7.293 -7.492 1.00 0.00 C ATOM 222 C GLU A 222 -2.675 -7.327 -7.261 1.00 0.00 C ATOM 223 O GLU A 222 -3.291 -8.393 -7.261 1.00 0.00 O ATOM 224 CB GLU A 222 -0.850 -7.728 -8.925 1.00 0.00 C ATOM 225 CG GLU A 222 -1.623 -6.956 -9.981 1.00 0.00 C ATOM 226 CD GLU A 222 -1.775 -7.732 -11.275 1.00 0.00 C ATOM 227 OE1 GLU A 222 -0.831 -8.459 -11.646 1.00 0.00 O ATOM 228 OE2 GLU A 222 -2.840 -7.611 -11.916 1.00 0.00 O ATOM 0 H GLU A 222 -1.012 -8.963 -6.232 1.00 0.00 H new ATOM 0 HA GLU A 222 -0.817 -6.271 -7.344 1.00 0.00 H new ATOM 0 HB2 GLU A 222 0.218 -7.604 -9.105 1.00 0.00 H new ATOM 0 HB3 GLU A 222 -1.070 -8.790 -9.030 1.00 0.00 H new ATOM 0 HG2 GLU A 222 -2.611 -6.706 -9.593 1.00 0.00 H new ATOM 0 HG3 GLU A 222 -1.113 -6.014 -10.184 1.00 0.00 H new ATOM 235 N PHE A 223 -3.264 -6.152 -7.064 1.00 0.00 N ATOM 236 CA PHE A 223 -4.699 -6.046 -6.830 1.00 0.00 C ATOM 237 C PHE A 223 -5.276 -4.821 -7.534 1.00 0.00 C ATOM 238 O PHE A 223 -4.616 -3.788 -7.648 1.00 0.00 O ATOM 239 CB PHE A 223 -4.989 -5.970 -5.330 1.00 0.00 C ATOM 240 CG PHE A 223 -4.137 -4.966 -4.605 1.00 0.00 C ATOM 241 CD1 PHE A 223 -2.797 -5.222 -4.363 1.00 0.00 C ATOM 242 CD2 PHE A 223 -4.677 -3.768 -4.166 1.00 0.00 C ATOM 243 CE1 PHE A 223 -2.010 -4.301 -3.697 1.00 0.00 C ATOM 244 CE2 PHE A 223 -3.895 -2.843 -3.500 1.00 0.00 C ATOM 245 CZ PHE A 223 -2.561 -3.110 -3.264 1.00 0.00 C ATOM 0 H PHE A 223 -2.769 -5.260 -7.062 1.00 0.00 H new ATOM 0 HA PHE A 223 -5.175 -6.937 -7.240 1.00 0.00 H new ATOM 0 HB2 PHE A 223 -6.039 -5.717 -5.183 1.00 0.00 H new ATOM 0 HB3 PHE A 223 -4.833 -6.954 -4.888 1.00 0.00 H new ATOM 0 HD1 PHE A 223 -2.362 -6.152 -4.699 1.00 0.00 H new ATOM 0 HD2 PHE A 223 -5.720 -3.555 -4.346 1.00 0.00 H new ATOM 0 HE1 PHE A 223 -0.966 -4.512 -3.515 1.00 0.00 H new ATOM 0 HE2 PHE A 223 -4.327 -1.912 -3.164 1.00 0.00 H new ATOM 0 HZ PHE A 223 -1.949 -2.389 -2.742 1.00 0.00 H new ATOM 255 N VAL A 224 -6.513 -4.944 -8.005 1.00 0.00 N ATOM 256 CA VAL A 224 -7.180 -3.848 -8.697 1.00 0.00 C ATOM 257 C VAL A 224 -8.102 -3.083 -7.754 1.00 0.00 C ATOM 258 O VAL A 224 -9.136 -3.597 -7.326 1.00 0.00 O ATOM 259 CB VAL A 224 -8.000 -4.358 -9.897 1.00 0.00 C ATOM 260 CG1 VAL A 224 -8.458 -3.196 -10.764 1.00 0.00 C ATOM 261 CG2 VAL A 224 -7.188 -5.354 -10.712 1.00 0.00 C ATOM 0 H VAL A 224 -7.073 -5.792 -7.920 1.00 0.00 H new ATOM 0 HA VAL A 224 -6.398 -3.180 -9.058 1.00 0.00 H new ATOM 0 HB VAL A 224 -8.886 -4.869 -9.519 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -9.036 -3.576 -11.607 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -9.079 -2.523 -10.172 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -7.588 -2.654 -11.135 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -7.783 -5.704 -11.556 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -6.284 -4.870 -11.081 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -6.915 -6.202 -10.084 1.00 0.00 H new ATOM 271 N VAL A 225 -7.721 -1.850 -7.434 1.00 0.00 N ATOM 272 CA VAL A 225 -8.514 -1.012 -6.543 1.00 0.00 C ATOM 273 C VAL A 225 -9.431 -0.084 -7.332 1.00 0.00 C ATOM 274 O VAL A 225 -9.078 0.377 -8.418 1.00 0.00 O ATOM 275 CB VAL A 225 -7.616 -0.166 -5.621 1.00 0.00 C ATOM 276 CG1 VAL A 225 -8.419 0.951 -4.971 1.00 0.00 C ATOM 277 CG2 VAL A 225 -6.959 -1.044 -4.567 1.00 0.00 C ATOM 0 H VAL A 225 -6.868 -1.410 -7.779 1.00 0.00 H new ATOM 0 HA VAL A 225 -9.119 -1.683 -5.933 1.00 0.00 H new ATOM 0 HB VAL A 225 -6.830 0.288 -6.225 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -7.768 1.538 -4.323 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -8.838 1.595 -5.744 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -9.227 0.521 -4.379 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -6.328 -0.430 -3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -7.728 -1.528 -3.965 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -6.349 -1.804 -5.055 1.00 0.00 H new ATOM 287 N ARG A 226 -10.609 0.186 -6.779 1.00 0.00 N ATOM 288 CA ARG A 226 -11.577 1.059 -7.432 1.00 0.00 C ATOM 289 C ARG A 226 -11.009 2.464 -7.611 1.00 0.00 C ATOM 290 O ARG A 226 -10.206 2.926 -6.801 1.00 0.00 O ATOM 291 CB ARG A 226 -12.871 1.120 -6.617 1.00 0.00 C ATOM 292 CG ARG A 226 -13.865 0.026 -6.970 1.00 0.00 C ATOM 293 CD ARG A 226 -14.690 0.395 -8.192 1.00 0.00 C ATOM 294 NE ARG A 226 -15.792 1.294 -7.858 1.00 0.00 N ATOM 295 CZ ARG A 226 -16.829 0.938 -7.108 1.00 0.00 C ATOM 296 NH1 ARG A 226 -16.904 -0.291 -6.616 1.00 0.00 N ATOM 297 NH2 ARG A 226 -17.792 1.812 -6.847 1.00 0.00 N ATOM 0 H ARG A 226 -10.916 -0.187 -5.881 1.00 0.00 H new ATOM 0 HA ARG A 226 -11.795 0.646 -8.417 1.00 0.00 H new ATOM 0 HB2 ARG A 226 -12.627 1.049 -5.557 1.00 0.00 H new ATOM 0 HB3 ARG A 226 -13.342 2.091 -6.771 1.00 0.00 H new ATOM 0 HG2 ARG A 226 -13.331 -0.905 -7.158 1.00 0.00 H new ATOM 0 HG3 ARG A 226 -14.527 -0.152 -6.123 1.00 0.00 H new ATOM 0 HD2 ARG A 226 -14.047 0.870 -8.933 1.00 0.00 H new ATOM 0 HD3 ARG A 226 -15.087 -0.512 -8.648 1.00 0.00 H new ATOM 0 HE ARG A 226 -15.764 2.247 -8.220 1.00 0.00 H new ATOM 0 HH11 ARG A 226 -16.164 -0.965 -6.813 1.00 0.00 H new ATOM 0 HH12 ARG A 226 -17.701 -0.562 -6.040 1.00 0.00 H new ATOM 0 HH21 ARG A 226 -17.737 2.759 -7.222 1.00 0.00 H new ATOM 0 HH22 ARG A 226 -18.588 1.537 -6.271 1.00 0.00 H new ATOM 311 N GLU A 227 -11.431 3.136 -8.677 1.00 0.00 N ATOM 312 CA GLU A 227 -10.962 4.488 -8.962 1.00 0.00 C ATOM 313 C GLU A 227 -11.445 5.467 -7.895 1.00 0.00 C ATOM 314 O GLU A 227 -10.855 6.530 -7.701 1.00 0.00 O ATOM 315 CB GLU A 227 -11.447 4.939 -10.341 1.00 0.00 C ATOM 316 CG GLU A 227 -10.545 5.972 -10.995 1.00 0.00 C ATOM 317 CD GLU A 227 -9.390 5.344 -11.749 1.00 0.00 C ATOM 318 OE1 GLU A 227 -8.866 4.312 -11.280 1.00 0.00 O ATOM 319 OE2 GLU A 227 -9.009 5.885 -12.808 1.00 0.00 O ATOM 0 H GLU A 227 -12.096 2.768 -9.357 1.00 0.00 H new ATOM 0 HA GLU A 227 -9.872 4.477 -8.954 1.00 0.00 H new ATOM 0 HB2 GLU A 227 -11.521 4.069 -10.993 1.00 0.00 H new ATOM 0 HB3 GLU A 227 -12.451 5.353 -10.246 1.00 0.00 H new ATOM 0 HG2 GLU A 227 -11.134 6.581 -11.681 1.00 0.00 H new ATOM 0 HG3 GLU A 227 -10.153 6.643 -10.230 1.00 0.00 H new ATOM 326 N ASP A 228 -12.520 5.100 -7.207 1.00 0.00 N ATOM 327 CA ASP A 228 -13.082 5.945 -6.159 1.00 0.00 C ATOM 328 C ASP A 228 -12.539 5.547 -4.791 1.00 0.00 C ATOM 329 O ASP A 228 -12.701 6.276 -3.811 1.00 0.00 O ATOM 330 CB ASP A 228 -14.609 5.851 -6.163 1.00 0.00 C ATOM 331 CG ASP A 228 -15.248 6.768 -5.139 1.00 0.00 C ATOM 332 OD1 ASP A 228 -15.493 7.947 -5.469 1.00 0.00 O ATOM 333 OD2 ASP A 228 -15.503 6.306 -4.007 1.00 0.00 O ATOM 0 H ASP A 228 -13.020 4.223 -7.356 1.00 0.00 H new ATOM 0 HA ASP A 228 -12.789 6.975 -6.360 1.00 0.00 H new ATOM 0 HB2 ASP A 228 -14.983 6.103 -7.155 1.00 0.00 H new ATOM 0 HB3 ASP A 228 -14.907 4.822 -5.961 1.00 0.00 H new ATOM 338 N LEU A 229 -11.895 4.387 -4.730 1.00 0.00 N ATOM 339 CA LEU A 229 -11.328 3.891 -3.480 1.00 0.00 C ATOM 340 C LEU A 229 -9.835 4.195 -3.401 1.00 0.00 C ATOM 341 O LEU A 229 -9.208 4.007 -2.359 1.00 0.00 O ATOM 342 CB LEU A 229 -11.561 2.385 -3.354 1.00 0.00 C ATOM 343 CG LEU A 229 -13.021 1.933 -3.302 1.00 0.00 C ATOM 344 CD1 LEU A 229 -13.107 0.419 -3.186 1.00 0.00 C ATOM 345 CD2 LEU A 229 -13.744 2.601 -2.142 1.00 0.00 C ATOM 0 H LEU A 229 -11.752 3.772 -5.531 1.00 0.00 H new ATOM 0 HA LEU A 229 -11.828 4.400 -2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -11.079 1.891 -4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -11.061 2.035 -2.451 1.00 0.00 H new ATOM 0 HG LEU A 229 -13.508 2.234 -4.229 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -14.153 0.116 -3.150 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -12.625 -0.040 -4.049 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -12.604 0.095 -2.275 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -14.782 2.268 -2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -13.256 2.331 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -13.713 3.683 -2.269 1.00 0.00 H new ATOM 357 N MET A 230 -9.274 4.668 -4.509 1.00 0.00 N ATOM 358 CA MET A 230 -7.855 5.002 -4.563 1.00 0.00 C ATOM 359 C MET A 230 -7.493 6.015 -3.482 1.00 0.00 C ATOM 360 O MET A 230 -6.780 5.695 -2.531 1.00 0.00 O ATOM 361 CB MET A 230 -7.492 5.558 -5.941 1.00 0.00 C ATOM 362 CG MET A 230 -7.379 4.490 -7.017 1.00 0.00 C ATOM 363 SD MET A 230 -6.227 3.175 -6.572 1.00 0.00 S ATOM 364 CE MET A 230 -5.318 2.989 -8.103 1.00 0.00 C ATOM 0 H MET A 230 -9.779 4.829 -5.380 1.00 0.00 H new ATOM 0 HA MET A 230 -7.286 4.089 -4.386 1.00 0.00 H new ATOM 0 HB2 MET A 230 -8.247 6.285 -6.240 1.00 0.00 H new ATOM 0 HB3 MET A 230 -6.545 6.092 -5.870 1.00 0.00 H new ATOM 0 HG2 MET A 230 -8.363 4.059 -7.200 1.00 0.00 H new ATOM 0 HG3 MET A 230 -7.055 4.952 -7.949 1.00 0.00 H new ATOM 0 HE1 MET A 230 -5.058 1.940 -8.247 1.00 0.00 H new ATOM 0 HE2 MET A 230 -5.935 3.327 -8.936 1.00 0.00 H new ATOM 0 HE3 MET A 230 -4.407 3.586 -8.060 1.00 0.00 H new ATOM 374 N GLY A 231 -7.989 7.240 -3.634 1.00 0.00 N ATOM 375 CA GLY A 231 -7.706 8.281 -2.664 1.00 0.00 C ATOM 376 C GLY A 231 -7.608 7.744 -1.250 1.00 0.00 C ATOM 377 O GLY A 231 -6.589 7.920 -0.580 1.00 0.00 O ATOM 0 H GLY A 231 -8.582 7.529 -4.412 1.00 0.00 H new ATOM 0 HA2 GLY A 231 -6.771 8.775 -2.928 1.00 0.00 H new ATOM 0 HA3 GLY A 231 -8.489 9.038 -2.709 1.00 0.00 H new ATOM 381 N LEU A 232 -8.669 7.088 -0.793 1.00 0.00 N ATOM 382 CA LEU A 232 -8.699 6.524 0.553 1.00 0.00 C ATOM 383 C LEU A 232 -7.615 5.465 0.724 1.00 0.00 C ATOM 384 O LEU A 232 -6.834 5.510 1.674 1.00 0.00 O ATOM 385 CB LEU A 232 -10.072 5.916 0.841 1.00 0.00 C ATOM 386 CG LEU A 232 -11.218 6.908 1.039 1.00 0.00 C ATOM 387 CD1 LEU A 232 -12.560 6.199 0.952 1.00 0.00 C ATOM 388 CD2 LEU A 232 -11.078 7.626 2.374 1.00 0.00 C ATOM 0 H LEU A 232 -9.520 6.933 -1.334 1.00 0.00 H new ATOM 0 HA LEU A 232 -8.509 7.329 1.262 1.00 0.00 H new ATOM 0 HB2 LEU A 232 -10.332 5.251 0.018 1.00 0.00 H new ATOM 0 HB3 LEU A 232 -9.993 5.299 1.736 1.00 0.00 H new ATOM 0 HG LEU A 232 -11.171 7.651 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 232 -13.363 6.922 1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 232 -12.662 5.733 -0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 232 -12.618 5.434 1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -11.902 8.328 2.498 1.00 0.00 H new ATOM 0 HD22 LEU A 232 -11.098 6.896 3.183 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -10.133 8.168 2.398 1.00 0.00 H new ATOM 400 N ALA A 233 -7.572 4.514 -0.204 1.00 0.00 N ATOM 401 CA ALA A 233 -6.580 3.447 -0.158 1.00 0.00 C ATOM 402 C ALA A 233 -5.164 4.012 -0.158 1.00 0.00 C ATOM 403 O ALA A 233 -4.222 3.351 0.281 1.00 0.00 O ATOM 404 CB ALA A 233 -6.772 2.498 -1.331 1.00 0.00 C ATOM 0 H ALA A 233 -8.212 4.461 -0.996 1.00 0.00 H new ATOM 0 HA ALA A 233 -6.721 2.893 0.770 1.00 0.00 H new ATOM 0 HB1 ALA A 233 -6.025 1.706 -1.284 1.00 0.00 H new ATOM 0 HB2 ALA A 233 -7.769 2.059 -1.285 1.00 0.00 H new ATOM 0 HB3 ALA A 233 -6.660 3.048 -2.266 1.00 0.00 H new ATOM 410 N ILE A 234 -5.021 5.236 -0.653 1.00 0.00 N ATOM 411 CA ILE A 234 -3.719 5.890 -0.709 1.00 0.00 C ATOM 412 C ILE A 234 -3.553 6.884 0.435 1.00 0.00 C ATOM 413 O ILE A 234 -2.458 7.388 0.679 1.00 0.00 O ATOM 414 CB ILE A 234 -3.516 6.625 -2.047 1.00 0.00 C ATOM 415 CG1 ILE A 234 -3.650 5.648 -3.217 1.00 0.00 C ATOM 416 CG2 ILE A 234 -2.157 7.310 -2.074 1.00 0.00 C ATOM 417 CD1 ILE A 234 -3.346 6.271 -4.562 1.00 0.00 C ATOM 0 H ILE A 234 -5.790 5.795 -1.021 1.00 0.00 H new ATOM 0 HA ILE A 234 -2.968 5.106 -0.617 1.00 0.00 H new ATOM 0 HB ILE A 234 -4.288 7.388 -2.146 1.00 0.00 H new ATOM 0 HG12 ILE A 234 -2.977 4.806 -3.055 1.00 0.00 H new ATOM 0 HG13 ILE A 234 -4.664 5.248 -3.232 1.00 0.00 H new ATOM 0 HG21 ILE A 234 -2.028 7.825 -3.026 1.00 0.00 H new ATOM 0 HG22 ILE A 234 -2.097 8.032 -1.260 1.00 0.00 H new ATOM 0 HG23 ILE A 234 -1.371 6.564 -1.956 1.00 0.00 H new ATOM 0 HD11 ILE A 234 -3.461 5.521 -5.345 1.00 0.00 H new ATOM 0 HD12 ILE A 234 -4.035 7.095 -4.745 1.00 0.00 H new ATOM 0 HD13 ILE A 234 -2.323 6.646 -4.566 1.00 0.00 H new ATOM 429 N GLY A 235 -4.648 7.159 1.136 1.00 0.00 N ATOM 430 CA GLY A 235 -4.603 8.091 2.248 1.00 0.00 C ATOM 431 C GLY A 235 -4.372 9.520 1.799 1.00 0.00 C ATOM 432 O GLY A 235 -4.646 9.870 0.650 1.00 0.00 O ATOM 0 H GLY A 235 -5.566 6.753 0.954 1.00 0.00 H new ATOM 0 HA2 GLY A 235 -5.539 8.035 2.803 1.00 0.00 H new ATOM 0 HA3 GLY A 235 -3.808 7.796 2.933 1.00 0.00 H new ATOM 436 N THR A 236 -3.868 10.350 2.706 1.00 0.00 N ATOM 437 CA THR A 236 -3.604 11.750 2.398 1.00 0.00 C ATOM 438 C THR A 236 -2.195 11.935 1.847 1.00 0.00 C ATOM 439 O THR A 236 -1.269 11.217 2.227 1.00 0.00 O ATOM 440 CB THR A 236 -3.778 12.642 3.642 1.00 0.00 C ATOM 441 OG1 THR A 236 -3.692 14.022 3.271 1.00 0.00 O ATOM 442 CG2 THR A 236 -2.719 12.325 4.687 1.00 0.00 C ATOM 0 H THR A 236 -3.634 10.077 3.661 1.00 0.00 H new ATOM 0 HA THR A 236 -4.329 12.049 1.642 1.00 0.00 H new ATOM 0 HB THR A 236 -4.760 12.442 4.071 1.00 0.00 H new ATOM 0 HG1 THR A 236 -3.805 14.582 4.067 1.00 0.00 H new ATOM 0 HG21 THR A 236 -2.862 12.967 5.556 1.00 0.00 H new ATOM 0 HG22 THR A 236 -2.806 11.281 4.989 1.00 0.00 H new ATOM 0 HG23 THR A 236 -1.729 12.499 4.266 1.00 0.00 H new ATOM 450 N HIS A 237 -2.037 12.904 0.951 1.00 0.00 N ATOM 451 CA HIS A 237 -0.738 13.184 0.348 1.00 0.00 C ATOM 452 C HIS A 237 0.054 11.897 0.141 1.00 0.00 C ATOM 453 O HIS A 237 1.280 11.888 0.237 1.00 0.00 O ATOM 454 CB HIS A 237 0.057 14.150 1.227 1.00 0.00 C ATOM 455 CG HIS A 237 -0.552 15.515 1.321 1.00 0.00 C ATOM 456 ND1 HIS A 237 -0.639 16.375 0.247 1.00 0.00 N ATOM 457 CD2 HIS A 237 -1.108 16.167 2.369 1.00 0.00 C ATOM 458 CE1 HIS A 237 -1.221 17.498 0.631 1.00 0.00 C ATOM 459 NE2 HIS A 237 -1.515 17.397 1.914 1.00 0.00 N ATOM 0 H HIS A 237 -2.792 13.508 0.626 1.00 0.00 H new ATOM 0 HA HIS A 237 -0.908 13.645 -0.625 1.00 0.00 H new ATOM 0 HB2 HIS A 237 0.142 13.730 2.229 1.00 0.00 H new ATOM 0 HB3 HIS A 237 1.069 14.239 0.831 1.00 0.00 H new ATOM 0 HD2 HIS A 237 -1.212 15.790 3.376 1.00 0.00 H new ATOM 0 HE1 HIS A 237 -1.422 18.353 0.002 1.00 0.00 H new ATOM 0 HE2 HIS A 237 -1.971 18.116 2.476 1.00 0.00 H new ATOM 467 N GLY A 238 -0.657 10.810 -0.144 1.00 0.00 N ATOM 468 CA GLY A 238 -0.004 9.532 -0.360 1.00 0.00 C ATOM 469 C GLY A 238 0.682 9.013 0.889 1.00 0.00 C ATOM 470 O GLY A 238 1.845 8.613 0.846 1.00 0.00 O ATOM 0 H GLY A 238 -1.673 10.792 -0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 238 -0.741 8.803 -0.695 1.00 0.00 H new ATOM 0 HA3 GLY A 238 0.731 9.633 -1.159 1.00 0.00 H new ATOM 474 N SER A 239 -0.040 9.021 2.005 1.00 0.00 N ATOM 475 CA SER A 239 0.508 8.553 3.273 1.00 0.00 C ATOM 476 C SER A 239 0.537 7.028 3.322 1.00 0.00 C ATOM 477 O SER A 239 1.553 6.427 3.667 1.00 0.00 O ATOM 478 CB SER A 239 -0.317 9.097 4.441 1.00 0.00 C ATOM 479 OG SER A 239 0.448 9.130 5.634 1.00 0.00 O ATOM 0 H SER A 239 -1.005 9.346 2.057 1.00 0.00 H new ATOM 0 HA SER A 239 1.530 8.921 3.357 1.00 0.00 H new ATOM 0 HB2 SER A 239 -0.671 10.100 4.204 1.00 0.00 H new ATOM 0 HB3 SER A 239 -1.199 8.474 4.588 1.00 0.00 H new ATOM 0 HG SER A 239 -0.101 9.483 6.365 1.00 0.00 H new ATOM 485 N ASN A 240 -0.587 6.410 2.975 1.00 0.00 N ATOM 486 CA ASN A 240 -0.693 4.956 2.980 1.00 0.00 C ATOM 487 C ASN A 240 0.424 4.327 2.153 1.00 0.00 C ATOM 488 O ASN A 240 1.169 3.477 2.643 1.00 0.00 O ATOM 489 CB ASN A 240 -2.054 4.520 2.434 1.00 0.00 C ATOM 490 CG ASN A 240 -3.182 4.792 3.410 1.00 0.00 C ATOM 491 OD1 ASN A 240 -3.217 5.837 4.060 1.00 0.00 O ATOM 492 ND2 ASN A 240 -4.112 3.849 3.517 1.00 0.00 N ATOM 0 H ASN A 240 -1.437 6.894 2.687 1.00 0.00 H new ATOM 0 HA ASN A 240 -0.596 4.613 4.010 1.00 0.00 H new ATOM 0 HB2 ASN A 240 -2.252 5.044 1.499 1.00 0.00 H new ATOM 0 HB3 ASN A 240 -2.026 3.455 2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 240 -4.895 3.976 4.158 1.00 0.00 H new ATOM 0 HD22 ASN A 240 -4.042 2.998 2.958 1.00 0.00 H new ATOM 499 N ILE A 241 0.535 4.750 0.899 1.00 0.00 N ATOM 500 CA ILE A 241 1.562 4.230 0.005 1.00 0.00 C ATOM 501 C ILE A 241 2.932 4.244 0.674 1.00 0.00 C ATOM 502 O ILE A 241 3.678 3.268 0.602 1.00 0.00 O ATOM 503 CB ILE A 241 1.633 5.040 -1.303 1.00 0.00 C ATOM 504 CG1 ILE A 241 0.441 4.705 -2.202 1.00 0.00 C ATOM 505 CG2 ILE A 241 2.942 4.764 -2.026 1.00 0.00 C ATOM 506 CD1 ILE A 241 0.323 5.607 -3.410 1.00 0.00 C ATOM 0 H ILE A 241 -0.074 5.452 0.479 1.00 0.00 H new ATOM 0 HA ILE A 241 1.285 3.202 -0.229 1.00 0.00 H new ATOM 0 HB ILE A 241 1.592 6.101 -1.058 1.00 0.00 H new ATOM 0 HG12 ILE A 241 0.528 3.672 -2.537 1.00 0.00 H new ATOM 0 HG13 ILE A 241 -0.476 4.774 -1.617 1.00 0.00 H new ATOM 0 HG21 ILE A 241 2.977 5.344 -2.948 1.00 0.00 H new ATOM 0 HG22 ILE A 241 3.778 5.048 -1.387 1.00 0.00 H new ATOM 0 HG23 ILE A 241 3.010 3.702 -2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 241 -0.544 5.312 -4.001 1.00 0.00 H new ATOM 0 HD12 ILE A 241 0.204 6.640 -3.083 1.00 0.00 H new ATOM 0 HD13 ILE A 241 1.224 5.521 -4.018 1.00 0.00 H new ATOM 518 N GLN A 242 3.254 5.357 1.325 1.00 0.00 N ATOM 519 CA GLN A 242 4.535 5.498 2.008 1.00 0.00 C ATOM 520 C GLN A 242 4.748 4.362 3.004 1.00 0.00 C ATOM 521 O GLN A 242 5.688 3.579 2.874 1.00 0.00 O ATOM 522 CB GLN A 242 4.607 6.845 2.730 1.00 0.00 C ATOM 523 CG GLN A 242 5.135 7.974 1.859 1.00 0.00 C ATOM 524 CD GLN A 242 6.638 7.913 1.672 1.00 0.00 C ATOM 525 OE1 GLN A 242 7.287 6.950 2.082 1.00 0.00 O ATOM 526 NE2 GLN A 242 7.200 8.943 1.051 1.00 0.00 N ATOM 0 H GLN A 242 2.647 6.173 1.394 1.00 0.00 H new ATOM 0 HA GLN A 242 5.325 5.453 1.258 1.00 0.00 H new ATOM 0 HB2 GLN A 242 3.612 7.109 3.089 1.00 0.00 H new ATOM 0 HB3 GLN A 242 5.246 6.744 3.607 1.00 0.00 H new ATOM 0 HG2 GLN A 242 4.649 7.933 0.884 1.00 0.00 H new ATOM 0 HG3 GLN A 242 4.867 8.930 2.308 1.00 0.00 H new ATOM 0 HE21 GLN A 242 6.624 9.720 0.728 1.00 0.00 H new ATOM 0 HE22 GLN A 242 8.208 8.957 0.897 1.00 0.00 H new ATOM 535 N GLN A 243 3.869 4.281 3.998 1.00 0.00 N ATOM 536 CA GLN A 243 3.963 3.241 5.016 1.00 0.00 C ATOM 537 C GLN A 243 4.270 1.887 4.385 1.00 0.00 C ATOM 538 O GLN A 243 5.172 1.176 4.827 1.00 0.00 O ATOM 539 CB GLN A 243 2.661 3.162 5.815 1.00 0.00 C ATOM 540 CG GLN A 243 2.460 4.329 6.768 1.00 0.00 C ATOM 541 CD GLN A 243 1.255 4.145 7.670 1.00 0.00 C ATOM 542 OE1 GLN A 243 0.125 4.020 7.198 1.00 0.00 O ATOM 543 NE2 GLN A 243 1.491 4.128 8.977 1.00 0.00 N ATOM 0 H GLN A 243 3.085 4.922 4.120 1.00 0.00 H new ATOM 0 HA GLN A 243 4.780 3.500 5.690 1.00 0.00 H new ATOM 0 HB2 GLN A 243 1.821 3.121 5.122 1.00 0.00 H new ATOM 0 HB3 GLN A 243 2.650 2.233 6.384 1.00 0.00 H new ATOM 0 HG2 GLN A 243 3.353 4.450 7.381 1.00 0.00 H new ATOM 0 HG3 GLN A 243 2.341 5.247 6.192 1.00 0.00 H new ATOM 0 HE21 GLN A 243 2.444 4.235 9.325 1.00 0.00 H new ATOM 0 HE22 GLN A 243 0.719 4.008 9.633 1.00 0.00 H new ATOM 552 N ALA A 244 3.512 1.537 3.351 1.00 0.00 N ATOM 553 CA ALA A 244 3.704 0.269 2.658 1.00 0.00 C ATOM 554 C ALA A 244 5.115 0.163 2.088 1.00 0.00 C ATOM 555 O ALA A 244 5.762 -0.879 2.198 1.00 0.00 O ATOM 556 CB ALA A 244 2.672 0.110 1.552 1.00 0.00 C ATOM 0 H ALA A 244 2.759 2.114 2.975 1.00 0.00 H new ATOM 0 HA ALA A 244 3.571 -0.536 3.381 1.00 0.00 H new ATOM 0 HB1 ALA A 244 2.828 -0.841 1.043 1.00 0.00 H new ATOM 0 HB2 ALA A 244 1.671 0.132 1.983 1.00 0.00 H new ATOM 0 HB3 ALA A 244 2.777 0.926 0.836 1.00 0.00 H new ATOM 562 N ARG A 245 5.584 1.246 1.478 1.00 0.00 N ATOM 563 CA ARG A 245 6.917 1.274 0.889 1.00 0.00 C ATOM 564 C ARG A 245 7.990 1.345 1.972 1.00 0.00 C ATOM 565 O ARG A 245 9.159 1.050 1.725 1.00 0.00 O ATOM 566 CB ARG A 245 7.055 2.467 -0.058 1.00 0.00 C ATOM 567 CG ARG A 245 8.482 2.720 -0.516 1.00 0.00 C ATOM 568 CD ARG A 245 8.596 4.024 -1.291 1.00 0.00 C ATOM 569 NE ARG A 245 8.384 3.830 -2.722 1.00 0.00 N ATOM 570 CZ ARG A 245 8.301 4.829 -3.595 1.00 0.00 C ATOM 571 NH1 ARG A 245 8.411 6.084 -3.183 1.00 0.00 N ATOM 572 NH2 ARG A 245 8.107 4.572 -4.882 1.00 0.00 N ATOM 0 H ARG A 245 5.061 2.116 1.379 1.00 0.00 H new ATOM 0 HA ARG A 245 7.055 0.352 0.324 1.00 0.00 H new ATOM 0 HB2 ARG A 245 6.426 2.300 -0.932 1.00 0.00 H new ATOM 0 HB3 ARG A 245 6.678 3.361 0.440 1.00 0.00 H new ATOM 0 HG2 ARG A 245 9.143 2.751 0.350 1.00 0.00 H new ATOM 0 HG3 ARG A 245 8.816 1.893 -1.142 1.00 0.00 H new ATOM 0 HD2 ARG A 245 7.865 4.737 -0.910 1.00 0.00 H new ATOM 0 HD3 ARG A 245 9.582 4.459 -1.126 1.00 0.00 H new ATOM 0 HE ARG A 245 8.295 2.876 -3.071 1.00 0.00 H new ATOM 0 HH11 ARG A 245 8.560 6.285 -2.194 1.00 0.00 H new ATOM 0 HH12 ARG A 245 8.347 6.849 -3.855 1.00 0.00 H new ATOM 0 HH21 ARG A 245 8.021 3.607 -5.202 1.00 0.00 H new ATOM 0 HH22 ARG A 245 8.043 5.339 -5.551 1.00 0.00 H new ATOM 586 N LYS A 246 7.583 1.739 3.175 1.00 0.00 N ATOM 587 CA LYS A 246 8.507 1.848 4.297 1.00 0.00 C ATOM 588 C LYS A 246 8.572 0.540 5.078 1.00 0.00 C ATOM 589 O LYS A 246 9.068 0.501 6.204 1.00 0.00 O ATOM 590 CB LYS A 246 8.081 2.988 5.226 1.00 0.00 C ATOM 591 CG LYS A 246 8.278 4.368 4.623 1.00 0.00 C ATOM 592 CD LYS A 246 8.444 5.428 5.700 1.00 0.00 C ATOM 593 CE LYS A 246 8.158 6.821 5.160 1.00 0.00 C ATOM 594 NZ LYS A 246 7.933 7.805 6.255 1.00 0.00 N ATOM 0 H LYS A 246 6.619 1.988 3.397 1.00 0.00 H new ATOM 0 HA LYS A 246 9.499 2.062 3.899 1.00 0.00 H new ATOM 0 HB2 LYS A 246 7.030 2.861 5.486 1.00 0.00 H new ATOM 0 HB3 LYS A 246 8.649 2.921 6.154 1.00 0.00 H new ATOM 0 HG2 LYS A 246 9.157 4.362 3.978 1.00 0.00 H new ATOM 0 HG3 LYS A 246 7.423 4.617 3.995 1.00 0.00 H new ATOM 0 HD2 LYS A 246 7.771 5.213 6.530 1.00 0.00 H new ATOM 0 HD3 LYS A 246 9.459 5.391 6.095 1.00 0.00 H new ATOM 0 HE2 LYS A 246 8.994 7.150 4.542 1.00 0.00 H new ATOM 0 HE3 LYS A 246 7.279 6.787 4.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 246 7.741 8.742 5.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 246 7.120 7.505 6.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 246 8.781 7.856 6.855 1.00 0.00 H new ATOM 608 N VAL A 247 8.069 -0.532 4.472 1.00 0.00 N ATOM 609 CA VAL A 247 8.073 -1.843 5.110 1.00 0.00 C ATOM 610 C VAL A 247 9.300 -2.649 4.702 1.00 0.00 C ATOM 611 O VAL A 247 9.709 -2.659 3.540 1.00 0.00 O ATOM 612 CB VAL A 247 6.805 -2.643 4.756 1.00 0.00 C ATOM 613 CG1 VAL A 247 6.870 -4.039 5.355 1.00 0.00 C ATOM 614 CG2 VAL A 247 5.561 -1.907 5.230 1.00 0.00 C ATOM 0 H VAL A 247 7.654 -0.518 3.540 1.00 0.00 H new ATOM 0 HA VAL A 247 8.097 -1.671 6.186 1.00 0.00 H new ATOM 0 HB VAL A 247 6.749 -2.742 3.672 1.00 0.00 H new ATOM 0 HG11 VAL A 247 5.966 -4.589 5.094 1.00 0.00 H new ATOM 0 HG12 VAL A 247 7.740 -4.564 4.961 1.00 0.00 H new ATOM 0 HG13 VAL A 247 6.950 -3.966 6.440 1.00 0.00 H new ATOM 0 HG21 VAL A 247 4.675 -2.487 4.972 1.00 0.00 H new ATOM 0 HG22 VAL A 247 5.606 -1.775 6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 247 5.510 -0.931 4.747 1.00 0.00 H new ATOM 624 N PRO A 248 9.904 -3.343 5.678 1.00 0.00 N ATOM 625 CA PRO A 248 11.093 -4.168 5.444 1.00 0.00 C ATOM 626 C PRO A 248 10.784 -5.411 4.617 1.00 0.00 C ATOM 627 O PRO A 248 9.864 -6.164 4.932 1.00 0.00 O ATOM 628 CB PRO A 248 11.536 -4.561 6.856 1.00 0.00 C ATOM 629 CG PRO A 248 10.294 -4.490 7.675 1.00 0.00 C ATOM 630 CD PRO A 248 9.471 -3.378 7.085 1.00 0.00 C ATOM 0 HA PRO A 248 11.855 -3.633 4.877 1.00 0.00 H new ATOM 0 HB2 PRO A 248 11.964 -5.563 6.872 1.00 0.00 H new ATOM 0 HB3 PRO A 248 12.300 -3.882 7.235 1.00 0.00 H new ATOM 0 HG2 PRO A 248 9.752 -5.435 7.644 1.00 0.00 H new ATOM 0 HG3 PRO A 248 10.527 -4.290 8.721 1.00 0.00 H new ATOM 0 HD2 PRO A 248 8.403 -3.579 7.172 1.00 0.00 H new ATOM 0 HD3 PRO A 248 9.659 -2.429 7.587 1.00 0.00 H new ATOM 638 N GLY A 249 11.560 -5.620 3.558 1.00 0.00 N ATOM 639 CA GLY A 249 11.352 -6.773 2.702 1.00 0.00 C ATOM 640 C GLY A 249 10.668 -6.413 1.399 1.00 0.00 C ATOM 641 O GLY A 249 10.546 -7.247 0.502 1.00 0.00 O ATOM 0 H GLY A 249 12.329 -5.011 3.278 1.00 0.00 H new ATOM 0 HA2 GLY A 249 12.313 -7.240 2.487 1.00 0.00 H new ATOM 0 HA3 GLY A 249 10.751 -7.511 3.232 1.00 0.00 H new ATOM 645 N VAL A 250 10.218 -5.167 1.293 1.00 0.00 N ATOM 646 CA VAL A 250 9.541 -4.698 0.090 1.00 0.00 C ATOM 647 C VAL A 250 10.508 -3.968 -0.836 1.00 0.00 C ATOM 648 O VAL A 250 10.867 -2.816 -0.594 1.00 0.00 O ATOM 649 CB VAL A 250 8.370 -3.758 0.435 1.00 0.00 C ATOM 650 CG1 VAL A 250 7.758 -3.180 -0.832 1.00 0.00 C ATOM 651 CG2 VAL A 250 7.321 -4.493 1.256 1.00 0.00 C ATOM 0 H VAL A 250 10.310 -4.464 2.026 1.00 0.00 H new ATOM 0 HA VAL A 250 9.152 -5.580 -0.418 1.00 0.00 H new ATOM 0 HB VAL A 250 8.754 -2.932 1.034 1.00 0.00 H new ATOM 0 HG11 VAL A 250 6.933 -2.519 -0.568 1.00 0.00 H new ATOM 0 HG12 VAL A 250 8.515 -2.616 -1.377 1.00 0.00 H new ATOM 0 HG13 VAL A 250 7.387 -3.990 -1.460 1.00 0.00 H new ATOM 0 HG21 VAL A 250 6.501 -3.814 1.491 1.00 0.00 H new ATOM 0 HG22 VAL A 250 6.939 -5.339 0.685 1.00 0.00 H new ATOM 0 HG23 VAL A 250 7.770 -4.853 2.182 1.00 0.00 H new ATOM 661 N THR A 251 10.927 -4.648 -1.899 1.00 0.00 N ATOM 662 CA THR A 251 11.853 -4.066 -2.862 1.00 0.00 C ATOM 663 C THR A 251 11.331 -2.735 -3.392 1.00 0.00 C ATOM 664 O THR A 251 11.996 -1.706 -3.276 1.00 0.00 O ATOM 665 CB THR A 251 12.101 -5.016 -4.049 1.00 0.00 C ATOM 666 OG1 THR A 251 10.865 -5.302 -4.714 1.00 0.00 O ATOM 667 CG2 THR A 251 12.741 -6.313 -3.578 1.00 0.00 C ATOM 0 H THR A 251 10.639 -5.603 -2.114 1.00 0.00 H new ATOM 0 HA THR A 251 12.793 -3.901 -2.336 1.00 0.00 H new ATOM 0 HB THR A 251 12.782 -4.524 -4.744 1.00 0.00 H new ATOM 0 HG1 THR A 251 10.913 -4.991 -5.642 1.00 0.00 H new ATOM 0 HG21 THR A 251 12.907 -6.968 -4.433 1.00 0.00 H new ATOM 0 HG22 THR A 251 13.695 -6.095 -3.098 1.00 0.00 H new ATOM 0 HG23 THR A 251 12.081 -6.807 -2.865 1.00 0.00 H new ATOM 675 N ALA A 252 10.136 -2.762 -3.972 1.00 0.00 N ATOM 676 CA ALA A 252 9.523 -1.557 -4.517 1.00 0.00 C ATOM 677 C ALA A 252 8.004 -1.683 -4.557 1.00 0.00 C ATOM 678 O ALA A 252 7.452 -2.741 -4.254 1.00 0.00 O ATOM 679 CB ALA A 252 10.068 -1.271 -5.908 1.00 0.00 C ATOM 0 H ALA A 252 9.573 -3.606 -4.077 1.00 0.00 H new ATOM 0 HA ALA A 252 9.774 -0.723 -3.862 1.00 0.00 H new ATOM 0 HB1 ALA A 252 9.602 -0.368 -6.303 1.00 0.00 H new ATOM 0 HB2 ALA A 252 11.147 -1.128 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA A 252 9.846 -2.112 -6.566 1.00 0.00 H new ATOM 685 N ILE A 253 7.335 -0.599 -4.933 1.00 0.00 N ATOM 686 CA ILE A 253 5.880 -0.589 -5.013 1.00 0.00 C ATOM 687 C ILE A 253 5.399 0.246 -6.195 1.00 0.00 C ATOM 688 O ILE A 253 5.493 1.473 -6.179 1.00 0.00 O ATOM 689 CB ILE A 253 5.248 -0.040 -3.721 1.00 0.00 C ATOM 690 CG1 ILE A 253 5.598 -0.939 -2.534 1.00 0.00 C ATOM 691 CG2 ILE A 253 3.739 0.077 -3.877 1.00 0.00 C ATOM 692 CD1 ILE A 253 5.067 -0.430 -1.212 1.00 0.00 C ATOM 0 H ILE A 253 7.777 0.284 -5.187 1.00 0.00 H new ATOM 0 HA ILE A 253 5.566 -1.624 -5.150 1.00 0.00 H new ATOM 0 HB ILE A 253 5.652 0.954 -3.531 1.00 0.00 H new ATOM 0 HG12 ILE A 253 5.200 -1.938 -2.716 1.00 0.00 H new ATOM 0 HG13 ILE A 253 6.682 -1.034 -2.468 1.00 0.00 H new ATOM 0 HG21 ILE A 253 3.307 0.466 -2.955 1.00 0.00 H new ATOM 0 HG22 ILE A 253 3.510 0.754 -4.700 1.00 0.00 H new ATOM 0 HG23 ILE A 253 3.318 -0.906 -4.088 1.00 0.00 H new ATOM 0 HD11 ILE A 253 5.353 -1.117 -0.416 1.00 0.00 H new ATOM 0 HD12 ILE A 253 5.484 0.556 -1.008 1.00 0.00 H new ATOM 0 HD13 ILE A 253 3.980 -0.361 -1.259 1.00 0.00 H new ATOM 704 N GLU A 254 4.884 -0.428 -7.219 1.00 0.00 N ATOM 705 CA GLU A 254 4.388 0.253 -8.409 1.00 0.00 C ATOM 706 C GLU A 254 2.862 0.260 -8.436 1.00 0.00 C ATOM 707 O GLU A 254 2.215 -0.597 -7.833 1.00 0.00 O ATOM 708 CB GLU A 254 4.928 -0.421 -9.672 1.00 0.00 C ATOM 709 CG GLU A 254 6.365 -0.047 -9.995 1.00 0.00 C ATOM 710 CD GLU A 254 6.568 1.453 -10.097 1.00 0.00 C ATOM 711 OE1 GLU A 254 6.795 2.093 -9.049 1.00 0.00 O ATOM 712 OE2 GLU A 254 6.501 1.985 -11.224 1.00 0.00 O ATOM 0 H GLU A 254 4.800 -1.444 -7.248 1.00 0.00 H new ATOM 0 HA GLU A 254 4.738 1.285 -8.378 1.00 0.00 H new ATOM 0 HB2 GLU A 254 4.861 -1.502 -9.553 1.00 0.00 H new ATOM 0 HB3 GLU A 254 4.293 -0.153 -10.516 1.00 0.00 H new ATOM 0 HG2 GLU A 254 7.023 -0.447 -9.224 1.00 0.00 H new ATOM 0 HG3 GLU A 254 6.656 -0.514 -10.936 1.00 0.00 H new ATOM 719 N LEU A 255 2.293 1.234 -9.138 1.00 0.00 N ATOM 720 CA LEU A 255 0.843 1.354 -9.244 1.00 0.00 C ATOM 721 C LEU A 255 0.433 1.776 -10.651 1.00 0.00 C ATOM 722 O LEU A 255 1.007 2.702 -11.224 1.00 0.00 O ATOM 723 CB LEU A 255 0.320 2.366 -8.223 1.00 0.00 C ATOM 724 CG LEU A 255 -1.047 2.980 -8.527 1.00 0.00 C ATOM 725 CD1 LEU A 255 -2.153 1.963 -8.293 1.00 0.00 C ATOM 726 CD2 LEU A 255 -1.274 4.223 -7.679 1.00 0.00 C ATOM 0 H LEU A 255 2.813 1.952 -9.642 1.00 0.00 H new ATOM 0 HA LEU A 255 0.406 0.377 -9.036 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.268 1.877 -7.250 1.00 0.00 H new ATOM 0 HB3 LEU A 255 1.047 3.173 -8.136 1.00 0.00 H new ATOM 0 HG LEU A 255 -1.067 3.272 -9.577 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -3.118 2.418 -8.514 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -2.000 1.102 -8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -2.135 1.639 -7.253 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -2.252 4.647 -7.909 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -1.233 3.955 -6.623 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -0.500 4.959 -7.897 1.00 0.00 H new ATOM 738 N ASP A 256 -0.564 1.092 -11.201 1.00 0.00 N ATOM 739 CA ASP A 256 -1.053 1.398 -12.541 1.00 0.00 C ATOM 740 C ASP A 256 -2.334 2.223 -12.475 1.00 0.00 C ATOM 741 O ASP A 256 -3.335 1.788 -11.907 1.00 0.00 O ATOM 742 CB ASP A 256 -1.303 0.107 -13.323 1.00 0.00 C ATOM 743 CG ASP A 256 -0.066 -0.374 -14.056 1.00 0.00 C ATOM 744 OD1 ASP A 256 0.847 -0.910 -13.393 1.00 0.00 O ATOM 745 OD2 ASP A 256 -0.011 -0.215 -15.293 1.00 0.00 O ATOM 0 H ASP A 256 -1.049 0.322 -10.740 1.00 0.00 H new ATOM 0 HA ASP A 256 -0.291 1.983 -13.055 1.00 0.00 H new ATOM 0 HB2 ASP A 256 -1.641 -0.670 -12.637 1.00 0.00 H new ATOM 0 HB3 ASP A 256 -2.107 0.270 -14.041 1.00 0.00 H new ATOM 750 N GLU A 257 -2.294 3.416 -13.060 1.00 0.00 N ATOM 751 CA GLU A 257 -3.452 4.303 -13.066 1.00 0.00 C ATOM 752 C GLU A 257 -4.384 3.972 -14.228 1.00 0.00 C ATOM 753 O GLU A 257 -5.588 4.219 -14.161 1.00 0.00 O ATOM 754 CB GLU A 257 -3.003 5.763 -13.158 1.00 0.00 C ATOM 755 CG GLU A 257 -2.514 6.333 -11.837 1.00 0.00 C ATOM 756 CD GLU A 257 -2.605 7.846 -11.785 1.00 0.00 C ATOM 757 OE1 GLU A 257 -3.690 8.365 -11.448 1.00 0.00 O ATOM 758 OE2 GLU A 257 -1.591 8.511 -12.082 1.00 0.00 O ATOM 0 H GLU A 257 -1.473 3.791 -13.536 1.00 0.00 H new ATOM 0 HA GLU A 257 -3.996 4.156 -12.133 1.00 0.00 H new ATOM 0 HB2 GLU A 257 -2.205 5.843 -13.896 1.00 0.00 H new ATOM 0 HB3 GLU A 257 -3.834 6.368 -13.520 1.00 0.00 H new ATOM 0 HG2 GLU A 257 -3.102 5.909 -11.023 1.00 0.00 H new ATOM 0 HG3 GLU A 257 -1.480 6.029 -11.675 1.00 0.00 H new ATOM 765 N ASP A 258 -3.818 3.414 -15.292 1.00 0.00 N ATOM 766 CA ASP A 258 -4.598 3.049 -16.469 1.00 0.00 C ATOM 767 C ASP A 258 -5.842 2.260 -16.074 1.00 0.00 C ATOM 768 O ASP A 258 -6.920 2.456 -16.636 1.00 0.00 O ATOM 769 CB ASP A 258 -3.745 2.227 -17.438 1.00 0.00 C ATOM 770 CG ASP A 258 -2.605 3.032 -18.031 1.00 0.00 C ATOM 771 OD1 ASP A 258 -1.899 3.717 -17.261 1.00 0.00 O ATOM 772 OD2 ASP A 258 -2.420 2.978 -19.265 1.00 0.00 O ATOM 0 H ASP A 258 -2.822 3.204 -15.364 1.00 0.00 H new ATOM 0 HA ASP A 258 -4.914 3.968 -16.963 1.00 0.00 H new ATOM 0 HB2 ASP A 258 -3.341 1.360 -16.916 1.00 0.00 H new ATOM 0 HB3 ASP A 258 -4.376 1.849 -18.242 1.00 0.00 H new ATOM 777 N THR A 259 -5.686 1.366 -15.102 1.00 0.00 N ATOM 778 CA THR A 259 -6.796 0.546 -14.633 1.00 0.00 C ATOM 779 C THR A 259 -6.953 0.647 -13.120 1.00 0.00 C ATOM 780 O THR A 259 -8.051 0.487 -12.588 1.00 0.00 O ATOM 781 CB THR A 259 -6.604 -0.933 -15.020 1.00 0.00 C ATOM 782 OG1 THR A 259 -5.316 -1.389 -14.592 1.00 0.00 O ATOM 783 CG2 THR A 259 -6.741 -1.121 -16.523 1.00 0.00 C ATOM 0 H THR A 259 -4.802 1.192 -14.625 1.00 0.00 H new ATOM 0 HA THR A 259 -7.696 0.927 -15.115 1.00 0.00 H new ATOM 0 HB THR A 259 -7.378 -1.519 -14.525 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.203 -2.330 -14.840 1.00 0.00 H new ATOM 0 HG21 THR A 259 -6.602 -2.173 -16.772 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.733 -0.801 -16.841 1.00 0.00 H new ATOM 0 HG23 THR A 259 -5.986 -0.524 -17.035 1.00 0.00 H new ATOM 791 N GLY A 260 -5.847 0.915 -12.431 1.00 0.00 N ATOM 792 CA GLY A 260 -5.885 1.034 -10.986 1.00 0.00 C ATOM 793 C GLY A 260 -5.443 -0.237 -10.288 1.00 0.00 C ATOM 794 O GLY A 260 -6.171 -0.784 -9.458 1.00 0.00 O ATOM 0 H GLY A 260 -4.926 1.052 -12.848 1.00 0.00 H new ATOM 0 HA2 GLY A 260 -5.242 1.858 -10.675 1.00 0.00 H new ATOM 0 HA3 GLY A 260 -6.898 1.284 -10.672 1.00 0.00 H new ATOM 798 N THR A 261 -4.248 -0.711 -10.624 1.00 0.00 N ATOM 799 CA THR A 261 -3.711 -1.927 -10.027 1.00 0.00 C ATOM 800 C THR A 261 -2.451 -1.634 -9.221 1.00 0.00 C ATOM 801 O THR A 261 -1.484 -1.076 -9.742 1.00 0.00 O ATOM 802 CB THR A 261 -3.387 -2.984 -11.099 1.00 0.00 C ATOM 803 OG1 THR A 261 -4.594 -3.605 -11.555 1.00 0.00 O ATOM 804 CG2 THR A 261 -2.444 -4.043 -10.547 1.00 0.00 C ATOM 0 H THR A 261 -3.633 -0.270 -11.308 1.00 0.00 H new ATOM 0 HA THR A 261 -4.481 -2.319 -9.362 1.00 0.00 H new ATOM 0 HB THR A 261 -2.898 -2.484 -11.935 1.00 0.00 H new ATOM 0 HG1 THR A 261 -4.380 -4.275 -12.238 1.00 0.00 H new ATOM 0 HG21 THR A 261 -2.229 -4.779 -11.322 1.00 0.00 H new ATOM 0 HG22 THR A 261 -1.515 -3.572 -10.227 1.00 0.00 H new ATOM 0 HG23 THR A 261 -2.911 -4.538 -9.696 1.00 0.00 H new ATOM 812 N PHE A 262 -2.466 -2.013 -7.948 1.00 0.00 N ATOM 813 CA PHE A 262 -1.324 -1.791 -7.069 1.00 0.00 C ATOM 814 C PHE A 262 -0.397 -3.003 -7.065 1.00 0.00 C ATOM 815 O PHE A 262 -0.761 -4.074 -6.581 1.00 0.00 O ATOM 816 CB PHE A 262 -1.798 -1.492 -5.646 1.00 0.00 C ATOM 817 CG PHE A 262 -2.028 -0.031 -5.384 1.00 0.00 C ATOM 818 CD1 PHE A 262 -0.959 0.846 -5.293 1.00 0.00 C ATOM 819 CD2 PHE A 262 -3.312 0.465 -5.230 1.00 0.00 C ATOM 820 CE1 PHE A 262 -1.168 2.191 -5.052 1.00 0.00 C ATOM 821 CE2 PHE A 262 -3.527 1.809 -4.989 1.00 0.00 C ATOM 822 CZ PHE A 262 -2.453 2.673 -4.901 1.00 0.00 C ATOM 0 H PHE A 262 -3.257 -2.476 -7.501 1.00 0.00 H new ATOM 0 HA PHE A 262 -0.769 -0.932 -7.447 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -2.723 -2.036 -5.458 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -1.058 -1.867 -4.939 1.00 0.00 H new ATOM 0 HD1 PHE A 262 0.048 0.475 -5.412 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -4.155 -0.206 -5.299 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -0.327 2.864 -4.982 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -4.533 2.183 -4.870 1.00 0.00 H new ATOM 0 HZ PHE A 262 -2.618 3.724 -4.714 1.00 0.00 H new ATOM 832 N ARG A 263 0.803 -2.824 -7.608 1.00 0.00 N ATOM 833 CA ARG A 263 1.782 -3.903 -7.669 1.00 0.00 C ATOM 834 C ARG A 263 2.859 -3.720 -6.604 1.00 0.00 C ATOM 835 O ARG A 263 3.563 -2.710 -6.586 1.00 0.00 O ATOM 836 CB ARG A 263 2.425 -3.959 -9.056 1.00 0.00 C ATOM 837 CG ARG A 263 1.446 -4.295 -10.168 1.00 0.00 C ATOM 838 CD ARG A 263 2.052 -4.042 -11.540 1.00 0.00 C ATOM 839 NE ARG A 263 2.875 -5.162 -11.989 1.00 0.00 N ATOM 840 CZ ARG A 263 2.381 -6.349 -12.322 1.00 0.00 C ATOM 841 NH1 ARG A 263 1.076 -6.570 -12.256 1.00 0.00 N ATOM 842 NH2 ARG A 263 3.194 -7.319 -12.722 1.00 0.00 N ATOM 0 H ARG A 263 1.120 -1.943 -8.012 1.00 0.00 H new ATOM 0 HA ARG A 263 1.263 -4.842 -7.479 1.00 0.00 H new ATOM 0 HB2 ARG A 263 2.889 -2.997 -9.271 1.00 0.00 H new ATOM 0 HB3 ARG A 263 3.222 -4.703 -9.048 1.00 0.00 H new ATOM 0 HG2 ARG A 263 1.148 -5.340 -10.088 1.00 0.00 H new ATOM 0 HG3 ARG A 263 0.543 -3.696 -10.052 1.00 0.00 H new ATOM 0 HD2 ARG A 263 1.254 -3.866 -12.262 1.00 0.00 H new ATOM 0 HD3 ARG A 263 2.658 -3.137 -11.507 1.00 0.00 H new ATOM 0 HE ARG A 263 3.884 -5.025 -12.050 1.00 0.00 H new ATOM 0 HH11 ARG A 263 0.448 -5.827 -11.949 1.00 0.00 H new ATOM 0 HH12 ARG A 263 0.700 -7.483 -12.512 1.00 0.00 H new ATOM 0 HH21 ARG A 263 4.199 -7.153 -12.774 1.00 0.00 H new ATOM 0 HH22 ARG A 263 2.814 -8.230 -12.978 1.00 0.00 H new ATOM 856 N ILE A 264 2.981 -4.703 -5.718 1.00 0.00 N ATOM 857 CA ILE A 264 3.972 -4.651 -4.651 1.00 0.00 C ATOM 858 C ILE A 264 5.071 -5.685 -4.869 1.00 0.00 C ATOM 859 O ILE A 264 4.797 -6.830 -5.231 1.00 0.00 O ATOM 860 CB ILE A 264 3.328 -4.887 -3.272 1.00 0.00 C ATOM 861 CG1 ILE A 264 2.009 -4.119 -3.163 1.00 0.00 C ATOM 862 CG2 ILE A 264 4.283 -4.471 -2.163 1.00 0.00 C ATOM 863 CD1 ILE A 264 1.348 -4.242 -1.808 1.00 0.00 C ATOM 0 H ILE A 264 2.405 -5.545 -5.718 1.00 0.00 H new ATOM 0 HA ILE A 264 4.407 -3.652 -4.674 1.00 0.00 H new ATOM 0 HB ILE A 264 3.117 -5.951 -3.163 1.00 0.00 H new ATOM 0 HG12 ILE A 264 2.193 -3.066 -3.374 1.00 0.00 H new ATOM 0 HG13 ILE A 264 1.322 -4.482 -3.928 1.00 0.00 H new ATOM 0 HG21 ILE A 264 3.813 -4.644 -1.195 1.00 0.00 H new ATOM 0 HG22 ILE A 264 5.199 -5.058 -2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 264 4.522 -3.413 -2.267 1.00 0.00 H new ATOM 0 HD11 ILE A 264 0.419 -3.673 -1.804 1.00 0.00 H new ATOM 0 HD12 ILE A 264 1.132 -5.290 -1.602 1.00 0.00 H new ATOM 0 HD13 ILE A 264 2.016 -3.852 -1.040 1.00 0.00 H new ATOM 875 N TYR A 265 6.314 -5.275 -4.646 1.00 0.00 N ATOM 876 CA TYR A 265 7.456 -6.166 -4.819 1.00 0.00 C ATOM 877 C TYR A 265 8.182 -6.385 -3.495 1.00 0.00 C ATOM 878 O TYR A 265 8.678 -5.441 -2.883 1.00 0.00 O ATOM 879 CB TYR A 265 8.424 -5.594 -5.856 1.00 0.00 C ATOM 880 CG TYR A 265 7.800 -5.389 -7.218 1.00 0.00 C ATOM 881 CD1 TYR A 265 7.769 -6.417 -8.152 1.00 0.00 C ATOM 882 CD2 TYR A 265 7.241 -4.166 -7.571 1.00 0.00 C ATOM 883 CE1 TYR A 265 7.201 -6.234 -9.398 1.00 0.00 C ATOM 884 CE2 TYR A 265 6.670 -3.975 -8.814 1.00 0.00 C ATOM 885 CZ TYR A 265 6.653 -5.011 -9.724 1.00 0.00 C ATOM 886 OH TYR A 265 6.085 -4.825 -10.964 1.00 0.00 O ATOM 0 H TYR A 265 6.557 -4.331 -4.345 1.00 0.00 H new ATOM 0 HA TYR A 265 7.083 -7.128 -5.172 1.00 0.00 H new ATOM 0 HB2 TYR A 265 8.809 -4.640 -5.495 1.00 0.00 H new ATOM 0 HB3 TYR A 265 9.277 -6.265 -5.954 1.00 0.00 H new ATOM 0 HD1 TYR A 265 8.196 -7.376 -7.900 1.00 0.00 H new ATOM 0 HD2 TYR A 265 7.253 -3.352 -6.862 1.00 0.00 H new ATOM 0 HE1 TYR A 265 7.186 -7.044 -10.112 1.00 0.00 H new ATOM 0 HE2 TYR A 265 6.239 -3.019 -9.072 1.00 0.00 H new ATOM 0 HH TYR A 265 5.744 -3.909 -11.034 1.00 0.00 H new ATOM 896 N GLY A 266 8.239 -7.640 -3.060 1.00 0.00 N ATOM 897 CA GLY A 266 8.907 -7.962 -1.812 1.00 0.00 C ATOM 898 C GLY A 266 9.678 -9.265 -1.887 1.00 0.00 C ATOM 899 O GLY A 266 9.269 -10.196 -2.580 1.00 0.00 O ATOM 0 H GLY A 266 7.835 -8.439 -3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 266 9.590 -7.154 -1.550 1.00 0.00 H new ATOM 0 HA3 GLY A 266 8.168 -8.026 -1.014 1.00 0.00 H new ATOM 903 N GLU A 267 10.796 -9.331 -1.171 1.00 0.00 N ATOM 904 CA GLU A 267 11.627 -10.530 -1.162 1.00 0.00 C ATOM 905 C GLU A 267 10.912 -11.681 -0.461 1.00 0.00 C ATOM 906 O GLU A 267 11.151 -12.850 -0.764 1.00 0.00 O ATOM 907 CB GLU A 267 12.962 -10.246 -0.470 1.00 0.00 C ATOM 908 CG GLU A 267 14.012 -9.652 -1.393 1.00 0.00 C ATOM 909 CD GLU A 267 15.425 -9.890 -0.900 1.00 0.00 C ATOM 910 OE1 GLU A 267 15.773 -9.364 0.179 1.00 0.00 O ATOM 911 OE2 GLU A 267 16.184 -10.601 -1.591 1.00 0.00 O ATOM 0 H GLU A 267 11.147 -8.570 -0.590 1.00 0.00 H new ATOM 0 HA GLU A 267 11.816 -10.819 -2.196 1.00 0.00 H new ATOM 0 HB2 GLU A 267 12.792 -9.562 0.361 1.00 0.00 H new ATOM 0 HB3 GLU A 267 13.346 -11.174 -0.046 1.00 0.00 H new ATOM 0 HG2 GLU A 267 13.901 -10.083 -2.388 1.00 0.00 H new ATOM 0 HG3 GLU A 267 13.841 -8.580 -1.489 1.00 0.00 H new ATOM 918 N SER A 268 10.035 -11.342 0.478 1.00 0.00 N ATOM 919 CA SER A 268 9.289 -12.347 1.226 1.00 0.00 C ATOM 920 C SER A 268 7.797 -12.025 1.229 1.00 0.00 C ATOM 921 O SER A 268 7.394 -10.900 1.520 1.00 0.00 O ATOM 922 CB SER A 268 9.806 -12.432 2.664 1.00 0.00 C ATOM 923 OG SER A 268 9.863 -11.149 3.262 1.00 0.00 O ATOM 0 H SER A 268 9.823 -10.379 0.739 1.00 0.00 H new ATOM 0 HA SER A 268 9.435 -13.310 0.737 1.00 0.00 H new ATOM 0 HB2 SER A 268 9.155 -13.081 3.250 1.00 0.00 H new ATOM 0 HB3 SER A 268 10.798 -12.884 2.671 1.00 0.00 H new ATOM 0 HG SER A 268 9.176 -10.573 2.867 1.00 0.00 H new ATOM 929 N ALA A 269 6.983 -13.023 0.902 1.00 0.00 N ATOM 930 CA ALA A 269 5.536 -12.849 0.868 1.00 0.00 C ATOM 931 C ALA A 269 5.049 -12.069 2.084 1.00 0.00 C ATOM 932 O ALA A 269 4.052 -11.350 2.014 1.00 0.00 O ATOM 933 CB ALA A 269 4.843 -14.201 0.792 1.00 0.00 C ATOM 0 H ALA A 269 7.301 -13.961 0.657 1.00 0.00 H new ATOM 0 HA ALA A 269 5.284 -12.275 -0.024 1.00 0.00 H new ATOM 0 HB1 ALA A 269 3.763 -14.055 0.767 1.00 0.00 H new ATOM 0 HB2 ALA A 269 5.160 -14.722 -0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 269 5.109 -14.796 1.666 1.00 0.00 H new ATOM 939 N ASP A 270 5.757 -12.217 3.198 1.00 0.00 N ATOM 940 CA ASP A 270 5.396 -11.526 4.431 1.00 0.00 C ATOM 941 C ASP A 270 5.496 -10.014 4.255 1.00 0.00 C ATOM 942 O ASP A 270 4.646 -9.266 4.739 1.00 0.00 O ATOM 943 CB ASP A 270 6.300 -11.980 5.578 1.00 0.00 C ATOM 944 CG ASP A 270 5.832 -13.278 6.206 1.00 0.00 C ATOM 945 OD1 ASP A 270 6.254 -14.352 5.730 1.00 0.00 O ATOM 946 OD2 ASP A 270 5.043 -13.219 7.173 1.00 0.00 O ATOM 0 H ASP A 270 6.584 -12.809 3.273 1.00 0.00 H new ATOM 0 HA ASP A 270 4.363 -11.778 4.672 1.00 0.00 H new ATOM 0 HB2 ASP A 270 7.317 -12.105 5.207 1.00 0.00 H new ATOM 0 HB3 ASP A 270 6.333 -11.202 6.341 1.00 0.00 H new ATOM 951 N ALA A 271 6.539 -9.572 3.562 1.00 0.00 N ATOM 952 CA ALA A 271 6.749 -8.149 3.322 1.00 0.00 C ATOM 953 C ALA A 271 5.645 -7.572 2.442 1.00 0.00 C ATOM 954 O ALA A 271 4.859 -6.735 2.885 1.00 0.00 O ATOM 955 CB ALA A 271 8.111 -7.917 2.684 1.00 0.00 C ATOM 0 H ALA A 271 7.252 -10.178 3.157 1.00 0.00 H new ATOM 0 HA ALA A 271 6.718 -7.635 4.283 1.00 0.00 H new ATOM 0 HB1 ALA A 271 8.255 -6.851 2.510 1.00 0.00 H new ATOM 0 HB2 ALA A 271 8.892 -8.285 3.350 1.00 0.00 H new ATOM 0 HB3 ALA A 271 8.163 -8.449 1.734 1.00 0.00 H new ATOM 961 N VAL A 272 5.593 -8.024 1.193 1.00 0.00 N ATOM 962 CA VAL A 272 4.585 -7.553 0.251 1.00 0.00 C ATOM 963 C VAL A 272 3.194 -7.579 0.875 1.00 0.00 C ATOM 964 O VAL A 272 2.399 -6.658 0.688 1.00 0.00 O ATOM 965 CB VAL A 272 4.576 -8.403 -1.033 1.00 0.00 C ATOM 966 CG1 VAL A 272 5.587 -7.867 -2.035 1.00 0.00 C ATOM 967 CG2 VAL A 272 4.857 -9.862 -0.707 1.00 0.00 C ATOM 0 H VAL A 272 6.237 -8.716 0.810 1.00 0.00 H new ATOM 0 HA VAL A 272 4.846 -6.526 -0.004 1.00 0.00 H new ATOM 0 HB VAL A 272 3.586 -8.340 -1.484 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.567 -8.480 -2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 272 5.335 -6.838 -2.291 1.00 0.00 H new ATOM 0 HG13 VAL A 272 6.585 -7.898 -1.597 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.847 -10.449 -1.626 1.00 0.00 H new ATOM 0 HG22 VAL A 272 5.835 -9.947 -0.233 1.00 0.00 H new ATOM 0 HG23 VAL A 272 4.091 -10.237 -0.029 1.00 0.00 H new ATOM 977 N LYS A 273 2.906 -8.642 1.620 1.00 0.00 N ATOM 978 CA LYS A 273 1.612 -8.789 2.275 1.00 0.00 C ATOM 979 C LYS A 273 1.433 -7.742 3.369 1.00 0.00 C ATOM 980 O LYS A 273 0.392 -7.091 3.456 1.00 0.00 O ATOM 981 CB LYS A 273 1.475 -10.193 2.870 1.00 0.00 C ATOM 982 CG LYS A 273 1.092 -11.251 1.850 1.00 0.00 C ATOM 983 CD LYS A 273 0.768 -12.577 2.518 1.00 0.00 C ATOM 984 CE LYS A 273 -0.054 -13.474 1.605 1.00 0.00 C ATOM 985 NZ LYS A 273 0.704 -13.867 0.384 1.00 0.00 N ATOM 0 H LYS A 273 3.552 -9.414 1.785 1.00 0.00 H new ATOM 0 HA LYS A 273 0.835 -8.641 1.525 1.00 0.00 H new ATOM 0 HB2 LYS A 273 2.419 -10.475 3.336 1.00 0.00 H new ATOM 0 HB3 LYS A 273 0.724 -10.172 3.659 1.00 0.00 H new ATOM 0 HG2 LYS A 273 0.229 -10.910 1.277 1.00 0.00 H new ATOM 0 HG3 LYS A 273 1.910 -11.389 1.143 1.00 0.00 H new ATOM 0 HD2 LYS A 273 1.694 -13.084 2.791 1.00 0.00 H new ATOM 0 HD3 LYS A 273 0.219 -12.396 3.442 1.00 0.00 H new ATOM 0 HE2 LYS A 273 -0.354 -14.369 2.150 1.00 0.00 H new ATOM 0 HE3 LYS A 273 -0.968 -12.956 1.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 0.216 -13.504 -0.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 1.663 -13.467 0.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 0.763 -14.904 0.331 1.00 0.00 H new ATOM 999 N LYS A 274 2.456 -7.583 4.202 1.00 0.00 N ATOM 1000 CA LYS A 274 2.413 -6.613 5.290 1.00 0.00 C ATOM 1001 C LYS A 274 2.211 -5.200 4.751 1.00 0.00 C ATOM 1002 O LYS A 274 1.479 -4.402 5.336 1.00 0.00 O ATOM 1003 CB LYS A 274 3.705 -6.678 6.109 1.00 0.00 C ATOM 1004 CG LYS A 274 3.558 -6.133 7.519 1.00 0.00 C ATOM 1005 CD LYS A 274 3.840 -4.641 7.573 1.00 0.00 C ATOM 1006 CE LYS A 274 3.779 -4.113 8.998 1.00 0.00 C ATOM 1007 NZ LYS A 274 4.866 -4.677 9.846 1.00 0.00 N ATOM 0 H LYS A 274 3.325 -8.114 4.144 1.00 0.00 H new ATOM 0 HA LYS A 274 1.569 -6.862 5.933 1.00 0.00 H new ATOM 0 HB2 LYS A 274 4.040 -7.714 6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 274 4.483 -6.117 5.591 1.00 0.00 H new ATOM 0 HG2 LYS A 274 2.548 -6.327 7.881 1.00 0.00 H new ATOM 0 HG3 LYS A 274 4.242 -6.658 8.186 1.00 0.00 H new ATOM 0 HD2 LYS A 274 4.825 -4.440 7.152 1.00 0.00 H new ATOM 0 HD3 LYS A 274 3.115 -4.110 6.956 1.00 0.00 H new ATOM 0 HE2 LYS A 274 3.855 -3.026 8.986 1.00 0.00 H new ATOM 0 HE3 LYS A 274 2.812 -4.360 9.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 4.941 -4.127 10.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 4.649 -5.668 10.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 5.768 -4.630 9.331 1.00 0.00 H new ATOM 1021 N ALA A 275 2.862 -4.899 3.633 1.00 0.00 N ATOM 1022 CA ALA A 275 2.750 -3.585 3.014 1.00 0.00 C ATOM 1023 C ALA A 275 1.415 -3.428 2.295 1.00 0.00 C ATOM 1024 O ALA A 275 0.878 -2.325 2.196 1.00 0.00 O ATOM 1025 CB ALA A 275 3.903 -3.357 2.047 1.00 0.00 C ATOM 0 H ALA A 275 3.473 -5.548 3.137 1.00 0.00 H new ATOM 0 HA ALA A 275 2.798 -2.834 3.803 1.00 0.00 H new ATOM 0 HB1 ALA A 275 3.807 -2.371 1.592 1.00 0.00 H new ATOM 0 HB2 ALA A 275 4.848 -3.416 2.587 1.00 0.00 H new ATOM 0 HB3 ALA A 275 3.881 -4.120 1.269 1.00 0.00 H new ATOM 1031 N ARG A 276 0.884 -4.539 1.794 1.00 0.00 N ATOM 1032 CA ARG A 276 -0.388 -4.524 1.082 1.00 0.00 C ATOM 1033 C ARG A 276 -1.520 -4.075 2.001 1.00 0.00 C ATOM 1034 O ARG A 276 -2.407 -3.328 1.590 1.00 0.00 O ATOM 1035 CB ARG A 276 -0.696 -5.912 0.516 1.00 0.00 C ATOM 1036 CG ARG A 276 -2.039 -5.997 -0.192 1.00 0.00 C ATOM 1037 CD ARG A 276 -2.154 -7.269 -1.017 1.00 0.00 C ATOM 1038 NE ARG A 276 -2.034 -8.468 -0.193 1.00 0.00 N ATOM 1039 CZ ARG A 276 -3.015 -8.937 0.570 1.00 0.00 C ATOM 1040 NH1 ARG A 276 -4.182 -8.311 0.613 1.00 0.00 N ATOM 1041 NH2 ARG A 276 -2.829 -10.035 1.291 1.00 0.00 N ATOM 0 H ARG A 276 1.315 -5.460 1.868 1.00 0.00 H new ATOM 0 HA ARG A 276 -0.307 -3.813 0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 276 0.092 -6.193 -0.183 1.00 0.00 H new ATOM 0 HB3 ARG A 276 -0.676 -6.639 1.328 1.00 0.00 H new ATOM 0 HG2 ARG A 276 -2.842 -5.966 0.544 1.00 0.00 H new ATOM 0 HG3 ARG A 276 -2.166 -5.129 -0.839 1.00 0.00 H new ATOM 0 HD2 ARG A 276 -3.113 -7.280 -1.535 1.00 0.00 H new ATOM 0 HD3 ARG A 276 -1.378 -7.276 -1.782 1.00 0.00 H new ATOM 0 HE ARG A 276 -1.148 -8.973 -0.204 1.00 0.00 H new ATOM 0 HH11 ARG A 276 -4.329 -7.467 0.059 1.00 0.00 H new ATOM 0 HH12 ARG A 276 -4.934 -8.673 1.200 1.00 0.00 H new ATOM 0 HH21 ARG A 276 -1.932 -10.520 1.260 1.00 0.00 H new ATOM 0 HH22 ARG A 276 -3.583 -10.394 1.877 1.00 0.00 H new ATOM 1055 N GLY A 277 -1.483 -4.537 3.247 1.00 0.00 N ATOM 1056 CA GLY A 277 -2.511 -4.173 4.204 1.00 0.00 C ATOM 1057 C GLY A 277 -2.673 -2.672 4.339 1.00 0.00 C ATOM 1058 O GLY A 277 -3.651 -2.194 4.914 1.00 0.00 O ATOM 0 H GLY A 277 -0.759 -5.157 3.611 1.00 0.00 H new ATOM 0 HA2 GLY A 277 -3.460 -4.611 3.897 1.00 0.00 H new ATOM 0 HA3 GLY A 277 -2.264 -4.598 5.177 1.00 0.00 H new ATOM 1062 N PHE A 278 -1.710 -1.924 3.808 1.00 0.00 N ATOM 1063 CA PHE A 278 -1.749 -0.468 3.874 1.00 0.00 C ATOM 1064 C PHE A 278 -2.388 0.116 2.617 1.00 0.00 C ATOM 1065 O PHE A 278 -2.945 1.215 2.644 1.00 0.00 O ATOM 1066 CB PHE A 278 -0.336 0.093 4.049 1.00 0.00 C ATOM 1067 CG PHE A 278 0.236 -0.140 5.418 1.00 0.00 C ATOM 1068 CD1 PHE A 278 -0.428 0.312 6.547 1.00 0.00 C ATOM 1069 CD2 PHE A 278 1.437 -0.813 5.576 1.00 0.00 C ATOM 1070 CE1 PHE A 278 0.097 0.099 7.808 1.00 0.00 C ATOM 1071 CE2 PHE A 278 1.966 -1.029 6.835 1.00 0.00 C ATOM 1072 CZ PHE A 278 1.295 -0.573 7.952 1.00 0.00 C ATOM 0 H PHE A 278 -0.894 -2.303 3.328 1.00 0.00 H new ATOM 0 HA PHE A 278 -2.355 -0.184 4.734 1.00 0.00 H new ATOM 0 HB2 PHE A 278 0.321 -0.361 3.307 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -0.351 1.164 3.848 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -1.366 0.837 6.441 1.00 0.00 H new ATOM 0 HD2 PHE A 278 1.966 -1.173 4.706 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -0.429 0.458 8.680 1.00 0.00 H new ATOM 0 HE2 PHE A 278 2.903 -1.554 6.945 1.00 0.00 H new ATOM 0 HZ PHE A 278 1.706 -0.741 8.936 1.00 0.00 H new ATOM 1082 N LEU A 279 -2.303 -0.625 1.518 1.00 0.00 N ATOM 1083 CA LEU A 279 -2.872 -0.182 0.251 1.00 0.00 C ATOM 1084 C LEU A 279 -4.275 -0.749 0.055 1.00 0.00 C ATOM 1085 O LEU A 279 -4.880 -0.582 -1.003 1.00 0.00 O ATOM 1086 CB LEU A 279 -1.972 -0.606 -0.911 1.00 0.00 C ATOM 1087 CG LEU A 279 -0.566 -0.005 -0.924 1.00 0.00 C ATOM 1088 CD1 LEU A 279 0.295 -0.685 -1.977 1.00 0.00 C ATOM 1089 CD2 LEU A 279 -0.629 1.495 -1.172 1.00 0.00 C ATOM 0 H LEU A 279 -1.845 -1.536 1.479 1.00 0.00 H new ATOM 0 HA LEU A 279 -2.940 0.906 0.273 1.00 0.00 H new ATOM 0 HB2 LEU A 279 -1.881 -1.692 -0.897 1.00 0.00 H new ATOM 0 HB3 LEU A 279 -2.468 -0.340 -1.844 1.00 0.00 H new ATOM 0 HG LEU A 279 -0.111 -0.173 0.052 1.00 0.00 H new ATOM 0 HD11 LEU A 279 1.292 -0.244 -1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 279 0.368 -1.750 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 279 -0.157 -0.549 -2.960 1.00 0.00 H new ATOM 0 HD21 LEU A 279 0.381 1.906 -1.178 1.00 0.00 H new ATOM 0 HD22 LEU A 279 -1.104 1.685 -2.135 1.00 0.00 H new ATOM 0 HD23 LEU A 279 -1.209 1.970 -0.381 1.00 0.00 H new ATOM 1101 N GLU A 280 -4.785 -1.418 1.084 1.00 0.00 N ATOM 1102 CA GLU A 280 -6.118 -2.009 1.025 1.00 0.00 C ATOM 1103 C GLU A 280 -7.166 -0.953 0.685 1.00 0.00 C ATOM 1104 O GLU A 280 -7.126 0.166 1.198 1.00 0.00 O ATOM 1105 CB GLU A 280 -6.463 -2.676 2.358 1.00 0.00 C ATOM 1106 CG GLU A 280 -5.625 -3.908 2.657 1.00 0.00 C ATOM 1107 CD GLU A 280 -5.829 -4.423 4.069 1.00 0.00 C ATOM 1108 OE1 GLU A 280 -5.670 -3.629 5.019 1.00 0.00 O ATOM 1109 OE2 GLU A 280 -6.148 -5.621 4.222 1.00 0.00 O ATOM 0 H GLU A 280 -4.297 -1.565 1.967 1.00 0.00 H new ATOM 0 HA GLU A 280 -6.119 -2.764 0.238 1.00 0.00 H new ATOM 0 HB2 GLU A 280 -6.330 -1.952 3.162 1.00 0.00 H new ATOM 0 HB3 GLU A 280 -7.516 -2.956 2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 280 -5.877 -4.696 1.947 1.00 0.00 H new ATOM 0 HG3 GLU A 280 -4.571 -3.671 2.509 1.00 0.00 H new