USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 448 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 297 TYR OH : rot 165:sc= 0.482 USER MOD Set 1.2: A 306 SER OG : rot 112:sc= 0.534 USER MOD Set 2.1: A 283 MET CE :methyl -170:sc= -2.36! (180deg=-2.9!) USER MOD Set 2.2: A 288 GLN :FLIP amide:sc= -2.17! F(o=-6.1,f=-5!) USER MOD Set 2.3: A 291 THR OG1 : rot 115:sc= -0.51 USER MOD Single : A 258 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 263 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 TYR OH : rot 180:sc= 0 USER MOD Single : A 266 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 269 ASN : amide:sc= -1.87 X(o=-1.9,f=-1.9) USER MOD Single : A 284 SER OG : rot 180:sc= -0.102 USER MOD Single : A 286 MET CE :methyl 171:sc= 0 (180deg=-0.0444) USER MOD Single : A 289 THR OG1 : rot 43:sc= 0.0381 USER MOD Single : A 290 SER OG : rot 180:sc= 0 USER MOD Single : A 292 SER OG : rot 180:sc= 0 USER MOD Single : A 299 THR OG1 : rot 180:sc= 0 USER MOD Single : A 300 SER OG : rot -47:sc= 1.17 USER MOD Single : A 302 THR OG1 : rot 180:sc= -0.053 USER MOD Single : A 303 THR OG1 : rot 180:sc= -0.496 USER MOD Single : A 305 CYS SG : rot 180:sc= -0.216 USER MOD Single : A 312 ASN : amide:sc=-0.000534 K(o=-0.00053,f=-1.6) USER MOD Single : A 313 TYR OH : rot 180:sc= 0 USER MOD Single : A 315 THR OG1 : rot 180:sc= 0 USER MOD Single : A 316 LYS NZ :NH3+ 154:sc= 0.0412 (180deg=-0.0131) USER MOD ----------------------------------------------------------------- ATOM 217 N GLU A 257 5.788 0.816 -3.513 1.00 0.00 N ATOM 218 CA GLU A 257 5.459 1.769 -4.566 1.00 0.00 C ATOM 219 C GLU A 257 4.394 2.756 -4.094 1.00 0.00 C ATOM 220 O GLU A 257 3.610 2.457 -3.194 1.00 0.00 O ATOM 221 CB GLU A 257 4.971 1.034 -5.816 1.00 0.00 C ATOM 222 CG GLU A 257 3.769 0.140 -5.566 1.00 0.00 C ATOM 223 CD GLU A 257 3.418 -0.716 -6.767 1.00 0.00 C ATOM 224 OE1 GLU A 257 4.338 -1.070 -7.534 1.00 0.00 O ATOM 225 OE2 GLU A 257 2.222 -1.032 -6.941 1.00 0.00 O ATOM 0 HA GLU A 257 6.363 2.326 -4.811 1.00 0.00 H new ATOM 0 HB2 GLU A 257 4.715 1.767 -6.581 1.00 0.00 H new ATOM 0 HB3 GLU A 257 5.786 0.430 -6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 257 3.973 -0.506 -4.712 1.00 0.00 H new ATOM 0 HG3 GLU A 257 2.911 0.757 -5.301 1.00 0.00 H new ATOM 232 N THR A 258 4.374 3.934 -4.710 1.00 0.00 N ATOM 233 CA THR A 258 3.408 4.965 -4.353 1.00 0.00 C ATOM 234 C THR A 258 2.469 5.266 -5.516 1.00 0.00 C ATOM 235 O THR A 258 2.901 5.369 -6.665 1.00 0.00 O ATOM 236 CB THR A 258 4.109 6.268 -3.924 1.00 0.00 C ATOM 237 OG1 THR A 258 5.129 5.981 -2.961 1.00 0.00 O ATOM 238 CG2 THR A 258 3.110 7.252 -3.334 1.00 0.00 C ATOM 0 H THR A 258 5.016 4.197 -5.458 1.00 0.00 H new ATOM 0 HA THR A 258 2.830 4.579 -3.514 1.00 0.00 H new ATOM 0 HB THR A 258 4.560 6.719 -4.808 1.00 0.00 H new ATOM 0 HG1 THR A 258 5.571 6.814 -2.694 1.00 0.00 H new ATOM 0 HG21 THR A 258 3.629 8.164 -3.039 1.00 0.00 H new ATOM 0 HG22 THR A 258 2.351 7.491 -4.079 1.00 0.00 H new ATOM 0 HG23 THR A 258 2.633 6.807 -2.461 1.00 0.00 H new ATOM 246 N LEU A 259 1.184 5.406 -5.212 1.00 0.00 N ATOM 247 CA LEU A 259 0.183 5.696 -6.233 1.00 0.00 C ATOM 248 C LEU A 259 -0.754 6.810 -5.776 1.00 0.00 C ATOM 249 O LEU A 259 -0.999 6.975 -4.581 1.00 0.00 O ATOM 250 CB LEU A 259 -0.622 4.437 -6.558 1.00 0.00 C ATOM 251 CG LEU A 259 0.173 3.134 -6.638 1.00 0.00 C ATOM 252 CD1 LEU A 259 -0.763 1.936 -6.627 1.00 0.00 C ATOM 253 CD2 LEU A 259 1.048 3.119 -7.884 1.00 0.00 C ATOM 0 H LEU A 259 0.810 5.323 -4.267 1.00 0.00 H new ATOM 0 HA LEU A 259 0.702 6.029 -7.132 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -1.397 4.320 -5.801 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -1.128 4.590 -7.511 1.00 0.00 H new ATOM 0 HG LEU A 259 0.820 3.071 -5.763 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -0.179 1.017 -6.685 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -1.346 1.938 -5.706 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.436 1.992 -7.483 1.00 0.00 H new ATOM 0 HD21 LEU A 259 1.607 2.184 -7.925 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.420 3.205 -8.771 1.00 0.00 H new ATOM 0 HD23 LEU A 259 1.744 3.957 -7.850 1.00 0.00 H new ATOM 265 N GLN A 260 -1.276 7.567 -6.735 1.00 0.00 N ATOM 266 CA GLN A 260 -2.188 8.664 -6.430 1.00 0.00 C ATOM 267 C GLN A 260 -3.611 8.324 -6.860 1.00 0.00 C ATOM 268 O GLN A 260 -3.838 7.854 -7.975 1.00 0.00 O ATOM 269 CB GLN A 260 -1.726 9.947 -7.122 1.00 0.00 C ATOM 270 CG GLN A 260 -2.264 11.214 -6.477 1.00 0.00 C ATOM 271 CD GLN A 260 -2.234 12.404 -7.415 1.00 0.00 C ATOM 272 OE1 GLN A 260 -1.200 12.718 -8.006 1.00 0.00 O ATOM 273 NE2 GLN A 260 -3.371 13.075 -7.556 1.00 0.00 N ATOM 0 H GLN A 260 -1.084 7.442 -7.729 1.00 0.00 H new ATOM 0 HA GLN A 260 -2.181 8.819 -5.351 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -0.637 9.981 -7.116 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -2.039 9.920 -8.166 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -3.288 11.042 -6.147 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -1.676 11.442 -5.588 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -4.204 12.780 -7.047 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -3.411 13.886 -8.173 1.00 0.00 H new ATOM 282 N VAL A 261 -4.567 8.564 -5.969 1.00 0.00 N ATOM 283 CA VAL A 261 -5.969 8.283 -6.257 1.00 0.00 C ATOM 284 C VAL A 261 -6.497 9.197 -7.357 1.00 0.00 C ATOM 285 O VAL A 261 -6.335 10.416 -7.297 1.00 0.00 O ATOM 286 CB VAL A 261 -6.845 8.452 -5.001 1.00 0.00 C ATOM 287 CG1 VAL A 261 -8.296 8.122 -5.313 1.00 0.00 C ATOM 288 CG2 VAL A 261 -6.323 7.581 -3.867 1.00 0.00 C ATOM 0 H VAL A 261 -4.397 8.952 -5.041 1.00 0.00 H new ATOM 0 HA VAL A 261 -6.022 7.247 -6.591 1.00 0.00 H new ATOM 0 HB VAL A 261 -6.795 9.493 -4.682 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.899 8.247 -4.414 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.662 8.791 -6.091 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -8.369 7.091 -5.658 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -6.953 7.713 -2.987 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.341 6.535 -4.173 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -5.300 7.871 -3.627 1.00 0.00 H new ATOM 298 N ILE A 262 -7.130 8.599 -8.361 1.00 0.00 N ATOM 299 CA ILE A 262 -7.683 9.359 -9.475 1.00 0.00 C ATOM 300 C ILE A 262 -9.206 9.408 -9.404 1.00 0.00 C ATOM 301 O ILE A 262 -9.843 10.214 -10.082 1.00 0.00 O ATOM 302 CB ILE A 262 -7.263 8.759 -10.830 1.00 0.00 C ATOM 303 CG1 ILE A 262 -7.219 7.232 -10.745 1.00 0.00 C ATOM 304 CG2 ILE A 262 -5.910 9.310 -11.256 1.00 0.00 C ATOM 305 CD1 ILE A 262 -7.091 6.555 -12.092 1.00 0.00 C ATOM 0 H ILE A 262 -7.272 7.591 -8.426 1.00 0.00 H new ATOM 0 HA ILE A 262 -7.284 10.370 -9.396 1.00 0.00 H new ATOM 0 HB ILE A 262 -8.002 9.041 -11.580 1.00 0.00 H new ATOM 0 HG12 ILE A 262 -6.379 6.935 -10.117 1.00 0.00 H new ATOM 0 HG13 ILE A 262 -8.125 6.877 -10.254 1.00 0.00 H new ATOM 0 HG21 ILE A 262 -5.626 8.877 -12.215 1.00 0.00 H new ATOM 0 HG22 ILE A 262 -5.972 10.394 -11.352 1.00 0.00 H new ATOM 0 HG23 ILE A 262 -5.161 9.054 -10.507 1.00 0.00 H new ATOM 0 HD11 ILE A 262 -7.066 5.474 -11.955 1.00 0.00 H new ATOM 0 HD12 ILE A 262 -7.944 6.822 -12.716 1.00 0.00 H new ATOM 0 HD13 ILE A 262 -6.171 6.881 -12.577 1.00 0.00 H new ATOM 317 N TYR A 263 -9.782 8.542 -8.579 1.00 0.00 N ATOM 318 CA TYR A 263 -11.230 8.486 -8.419 1.00 0.00 C ATOM 319 C TYR A 263 -11.608 7.813 -7.103 1.00 0.00 C ATOM 320 O TYR A 263 -10.964 6.864 -6.654 1.00 0.00 O ATOM 321 CB TYR A 263 -11.865 7.733 -9.590 1.00 0.00 C ATOM 322 CG TYR A 263 -11.542 8.332 -10.941 1.00 0.00 C ATOM 323 CD1 TYR A 263 -12.266 9.409 -11.436 1.00 0.00 C ATOM 324 CD2 TYR A 263 -10.513 7.821 -11.721 1.00 0.00 C ATOM 325 CE1 TYR A 263 -11.976 9.959 -12.669 1.00 0.00 C ATOM 326 CE2 TYR A 263 -10.214 8.365 -12.955 1.00 0.00 C ATOM 327 CZ TYR A 263 -10.949 9.433 -13.425 1.00 0.00 C ATOM 328 OH TYR A 263 -10.655 9.979 -14.654 1.00 0.00 O ATOM 0 H TYR A 263 -9.269 7.869 -8.010 1.00 0.00 H new ATOM 0 HA TYR A 263 -11.608 9.508 -8.405 1.00 0.00 H new ATOM 0 HB2 TYR A 263 -11.527 6.697 -9.571 1.00 0.00 H new ATOM 0 HB3 TYR A 263 -12.947 7.718 -9.458 1.00 0.00 H new ATOM 0 HD1 TYR A 263 -13.070 9.824 -10.846 1.00 0.00 H new ATOM 0 HD2 TYR A 263 -9.936 6.984 -11.356 1.00 0.00 H new ATOM 0 HE1 TYR A 263 -12.550 10.796 -13.039 1.00 0.00 H new ATOM 0 HE2 TYR A 263 -9.409 7.956 -13.548 1.00 0.00 H new ATOM 0 HH TYR A 263 -9.905 9.494 -15.057 1.00 0.00 H new ATOM 338 N PRO A 264 -12.677 8.315 -6.468 1.00 0.00 N ATOM 339 CA PRO A 264 -13.167 7.777 -5.195 1.00 0.00 C ATOM 340 C PRO A 264 -13.786 6.393 -5.350 1.00 0.00 C ATOM 341 O PRO A 264 -14.172 5.994 -6.450 1.00 0.00 O ATOM 342 CB PRO A 264 -14.229 8.793 -4.767 1.00 0.00 C ATOM 343 CG PRO A 264 -14.691 9.418 -6.038 1.00 0.00 C ATOM 344 CD PRO A 264 -13.492 9.445 -6.945 1.00 0.00 C ATOM 0 HA PRO A 264 -12.363 7.648 -4.470 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -15.052 8.308 -4.243 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -13.813 9.538 -4.088 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -15.504 8.844 -6.482 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -15.071 10.425 -5.863 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -13.776 9.322 -7.990 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -12.953 10.389 -6.870 1.00 0.00 H new ATOM 352 N TYR A 265 -13.879 5.664 -4.244 1.00 0.00 N ATOM 353 CA TYR A 265 -14.450 4.323 -4.257 1.00 0.00 C ATOM 354 C TYR A 265 -15.012 3.956 -2.887 1.00 0.00 C ATOM 355 O TYR A 265 -14.320 4.050 -1.873 1.00 0.00 O ATOM 356 CB TYR A 265 -13.394 3.300 -4.678 1.00 0.00 C ATOM 357 CG TYR A 265 -13.782 1.870 -4.379 1.00 0.00 C ATOM 358 CD1 TYR A 265 -14.725 1.209 -5.156 1.00 0.00 C ATOM 359 CD2 TYR A 265 -13.207 1.180 -3.319 1.00 0.00 C ATOM 360 CE1 TYR A 265 -15.084 -0.098 -4.886 1.00 0.00 C ATOM 361 CE2 TYR A 265 -13.558 -0.127 -3.043 1.00 0.00 C ATOM 362 CZ TYR A 265 -14.497 -0.762 -3.829 1.00 0.00 C ATOM 363 OH TYR A 265 -14.851 -2.063 -3.556 1.00 0.00 O ATOM 0 H TYR A 265 -13.566 5.980 -3.326 1.00 0.00 H new ATOM 0 HA TYR A 265 -15.266 4.311 -4.979 1.00 0.00 H new ATOM 0 HB2 TYR A 265 -13.209 3.401 -5.747 1.00 0.00 H new ATOM 0 HB3 TYR A 265 -12.457 3.527 -4.169 1.00 0.00 H new ATOM 0 HD1 TYR A 265 -15.185 1.725 -5.985 1.00 0.00 H new ATOM 0 HD2 TYR A 265 -12.473 1.674 -2.700 1.00 0.00 H new ATOM 0 HE1 TYR A 265 -15.820 -0.597 -5.499 1.00 0.00 H new ATOM 0 HE2 TYR A 265 -13.100 -0.649 -2.216 1.00 0.00 H new ATOM 0 HH TYR A 265 -14.345 -2.384 -2.781 1.00 0.00 H new ATOM 373 N THR A 266 -16.273 3.535 -2.865 1.00 0.00 N ATOM 374 CA THR A 266 -16.930 3.154 -1.621 1.00 0.00 C ATOM 375 C THR A 266 -16.855 1.648 -1.399 1.00 0.00 C ATOM 376 O THR A 266 -17.500 0.861 -2.092 1.00 0.00 O ATOM 377 CB THR A 266 -18.408 3.590 -1.610 1.00 0.00 C ATOM 378 OG1 THR A 266 -18.526 4.933 -2.092 1.00 0.00 O ATOM 379 CG2 THR A 266 -18.989 3.496 -0.207 1.00 0.00 C ATOM 0 H THR A 266 -16.860 3.449 -3.695 1.00 0.00 H new ATOM 0 HA THR A 266 -16.402 3.664 -0.815 1.00 0.00 H new ATOM 0 HB THR A 266 -18.967 2.920 -2.263 1.00 0.00 H new ATOM 0 HG1 THR A 266 -19.468 5.202 -2.084 1.00 0.00 H new ATOM 0 HG21 THR A 266 -20.033 3.809 -0.224 1.00 0.00 H new ATOM 0 HG22 THR A 266 -18.924 2.467 0.145 1.00 0.00 H new ATOM 0 HG23 THR A 266 -18.427 4.145 0.464 1.00 0.00 H new ATOM 387 N PRO A 267 -16.050 1.235 -0.409 1.00 0.00 N ATOM 388 CA PRO A 267 -15.872 -0.180 -0.071 1.00 0.00 C ATOM 389 C PRO A 267 -17.121 -0.787 0.559 1.00 0.00 C ATOM 390 O PRO A 267 -18.077 -0.078 0.868 1.00 0.00 O ATOM 391 CB PRO A 267 -14.719 -0.163 0.936 1.00 0.00 C ATOM 392 CG PRO A 267 -14.767 1.197 1.543 1.00 0.00 C ATOM 393 CD PRO A 267 -15.251 2.118 0.458 1.00 0.00 C ATOM 0 HA PRO A 267 -15.675 -0.788 -0.954 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.842 -0.939 1.692 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -13.762 -0.344 0.446 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.439 1.218 2.401 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -13.783 1.499 1.901 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -15.850 2.934 0.862 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.421 2.570 -0.085 1.00 0.00 H new ATOM 401 N GLN A 268 -17.103 -2.103 0.747 1.00 0.00 N ATOM 402 CA GLN A 268 -18.236 -2.804 1.340 1.00 0.00 C ATOM 403 C GLN A 268 -17.802 -3.595 2.570 1.00 0.00 C ATOM 404 O GLN A 268 -18.635 -4.038 3.360 1.00 0.00 O ATOM 405 CB GLN A 268 -18.876 -3.742 0.316 1.00 0.00 C ATOM 406 CG GLN A 268 -19.135 -3.087 -1.031 1.00 0.00 C ATOM 407 CD GLN A 268 -20.482 -2.393 -1.092 1.00 0.00 C ATOM 408 OE1 GLN A 268 -21.526 -3.022 -0.918 1.00 0.00 O ATOM 409 NE2 GLN A 268 -20.465 -1.089 -1.340 1.00 0.00 N ATOM 0 H GLN A 268 -16.318 -2.704 0.498 1.00 0.00 H new ATOM 0 HA GLN A 268 -18.970 -2.060 1.648 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -18.227 -4.606 0.172 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -19.819 -4.115 0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -18.347 -2.362 -1.236 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -19.084 -3.843 -1.814 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -19.576 -0.608 -1.478 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -21.341 -0.568 -1.393 1.00 0.00 H new ATOM 418 N ASN A 269 -16.494 -3.767 2.726 1.00 0.00 N ATOM 419 CA ASN A 269 -15.949 -4.505 3.860 1.00 0.00 C ATOM 420 C ASN A 269 -14.466 -4.200 4.046 1.00 0.00 C ATOM 421 O ASN A 269 -13.893 -3.386 3.322 1.00 0.00 O ATOM 422 CB ASN A 269 -16.151 -6.008 3.661 1.00 0.00 C ATOM 423 CG ASN A 269 -17.570 -6.447 3.970 1.00 0.00 C ATOM 424 OD1 ASN A 269 -17.999 -6.431 5.124 1.00 0.00 O ATOM 425 ND2 ASN A 269 -18.305 -6.842 2.937 1.00 0.00 N ATOM 0 H ASN A 269 -15.791 -3.405 2.081 1.00 0.00 H new ATOM 0 HA ASN A 269 -16.482 -4.189 4.757 1.00 0.00 H new ATOM 0 HB2 ASN A 269 -15.908 -6.271 2.631 1.00 0.00 H new ATOM 0 HB3 ASN A 269 -15.457 -6.553 4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 269 -19.267 -7.149 3.083 1.00 0.00 H new ATOM 0 HD22 ASN A 269 -17.908 -6.839 1.998 1.00 0.00 H new ATOM 432 N ASP A 270 -13.850 -4.859 5.021 1.00 0.00 N ATOM 433 CA ASP A 270 -12.433 -4.661 5.302 1.00 0.00 C ATOM 434 C ASP A 270 -11.577 -5.107 4.121 1.00 0.00 C ATOM 435 O ASP A 270 -10.554 -4.493 3.816 1.00 0.00 O ATOM 436 CB ASP A 270 -12.028 -5.429 6.561 1.00 0.00 C ATOM 437 CG ASP A 270 -12.150 -6.931 6.387 1.00 0.00 C ATOM 438 OD1 ASP A 270 -13.142 -7.377 5.774 1.00 0.00 O ATOM 439 OD2 ASP A 270 -11.255 -7.658 6.865 1.00 0.00 O ATOM 0 H ASP A 270 -14.310 -5.535 5.630 1.00 0.00 H new ATOM 0 HA ASP A 270 -12.266 -3.596 5.467 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -10.999 -5.179 6.821 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -12.654 -5.111 7.395 1.00 0.00 H new ATOM 444 N ASP A 271 -12.001 -6.180 3.462 1.00 0.00 N ATOM 445 CA ASP A 271 -11.274 -6.709 2.314 1.00 0.00 C ATOM 446 C ASP A 271 -10.716 -5.578 1.456 1.00 0.00 C ATOM 447 O ASP A 271 -9.574 -5.636 1.002 1.00 0.00 O ATOM 448 CB ASP A 271 -12.187 -7.602 1.472 1.00 0.00 C ATOM 449 CG ASP A 271 -13.252 -8.288 2.304 1.00 0.00 C ATOM 450 OD1 ASP A 271 -12.902 -9.202 3.080 1.00 0.00 O ATOM 451 OD2 ASP A 271 -14.437 -7.913 2.178 1.00 0.00 O ATOM 0 H ASP A 271 -12.844 -6.700 3.703 1.00 0.00 H new ATOM 0 HA ASP A 271 -10.440 -7.304 2.686 1.00 0.00 H new ATOM 0 HB2 ASP A 271 -12.665 -7.001 0.698 1.00 0.00 H new ATOM 0 HB3 ASP A 271 -11.585 -8.356 0.964 1.00 0.00 H new ATOM 456 N GLU A 272 -11.531 -4.550 1.237 1.00 0.00 N ATOM 457 CA GLU A 272 -11.118 -3.407 0.431 1.00 0.00 C ATOM 458 C GLU A 272 -10.817 -2.199 1.314 1.00 0.00 C ATOM 459 O GLU A 272 -11.018 -2.239 2.529 1.00 0.00 O ATOM 460 CB GLU A 272 -12.206 -3.052 -0.585 1.00 0.00 C ATOM 461 CG GLU A 272 -13.548 -2.727 0.049 1.00 0.00 C ATOM 462 CD GLU A 272 -14.408 -3.958 0.257 1.00 0.00 C ATOM 463 OE1 GLU A 272 -14.243 -4.627 1.299 1.00 0.00 O ATOM 464 OE2 GLU A 272 -15.246 -4.252 -0.621 1.00 0.00 O ATOM 0 H GLU A 272 -12.480 -4.486 1.606 1.00 0.00 H new ATOM 0 HA GLU A 272 -10.208 -3.681 -0.103 1.00 0.00 H new ATOM 0 HB2 GLU A 272 -11.876 -2.197 -1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 272 -12.332 -3.886 -1.276 1.00 0.00 H new ATOM 0 HG2 GLU A 272 -13.383 -2.237 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 272 -14.082 -2.018 -0.583 1.00 0.00 H new ATOM 471 N LEU A 273 -10.334 -1.128 0.695 1.00 0.00 N ATOM 472 CA LEU A 273 -10.005 0.092 1.424 1.00 0.00 C ATOM 473 C LEU A 273 -10.622 1.313 0.749 1.00 0.00 C ATOM 474 O LEU A 273 -10.686 1.389 -0.478 1.00 0.00 O ATOM 475 CB LEU A 273 -8.487 0.260 1.517 1.00 0.00 C ATOM 476 CG LEU A 273 -7.986 1.664 1.858 1.00 0.00 C ATOM 477 CD1 LEU A 273 -7.996 1.883 3.363 1.00 0.00 C ATOM 478 CD2 LEU A 273 -6.590 1.884 1.294 1.00 0.00 C ATOM 0 H LEU A 273 -10.161 -1.079 -0.309 1.00 0.00 H new ATOM 0 HA LEU A 273 -10.418 0.008 2.429 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -8.111 -0.431 2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -8.050 -0.039 0.564 1.00 0.00 H new ATOM 0 HG LEU A 273 -8.659 2.390 1.401 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -7.636 2.887 3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -9.012 1.769 3.741 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -7.347 1.150 3.842 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -6.250 2.888 1.546 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -5.905 1.151 1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -6.613 1.771 0.210 1.00 0.00 H new ATOM 490 N GLU A 274 -11.072 2.267 1.559 1.00 0.00 N ATOM 491 CA GLU A 274 -11.682 3.484 1.039 1.00 0.00 C ATOM 492 C GLU A 274 -10.682 4.282 0.206 1.00 0.00 C ATOM 493 O GLU A 274 -9.491 4.325 0.519 1.00 0.00 O ATOM 494 CB GLU A 274 -12.210 4.348 2.187 1.00 0.00 C ATOM 495 CG GLU A 274 -13.132 5.466 1.733 1.00 0.00 C ATOM 496 CD GLU A 274 -13.841 6.143 2.890 1.00 0.00 C ATOM 497 OE1 GLU A 274 -14.104 5.464 3.904 1.00 0.00 O ATOM 498 OE2 GLU A 274 -14.133 7.353 2.780 1.00 0.00 O ATOM 0 H GLU A 274 -11.025 2.220 2.577 1.00 0.00 H new ATOM 0 HA GLU A 274 -12.515 3.196 0.398 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -12.744 3.712 2.893 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -11.365 4.780 2.723 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -12.554 6.208 1.182 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -13.873 5.063 1.043 1.00 0.00 H new ATOM 505 N LEU A 275 -11.174 4.911 -0.855 1.00 0.00 N ATOM 506 CA LEU A 275 -10.324 5.707 -1.734 1.00 0.00 C ATOM 507 C LEU A 275 -10.672 7.189 -1.633 1.00 0.00 C ATOM 508 O LEU A 275 -11.840 7.555 -1.505 1.00 0.00 O ATOM 509 CB LEU A 275 -10.470 5.235 -3.182 1.00 0.00 C ATOM 510 CG LEU A 275 -9.907 3.849 -3.496 1.00 0.00 C ATOM 511 CD1 LEU A 275 -9.549 3.740 -4.970 1.00 0.00 C ATOM 512 CD2 LEU A 275 -8.693 3.556 -2.627 1.00 0.00 C ATOM 0 H LEU A 275 -12.157 4.886 -1.128 1.00 0.00 H new ATOM 0 HA LEU A 275 -9.290 5.573 -1.417 1.00 0.00 H new ATOM 0 HB2 LEU A 275 -11.529 5.242 -3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 275 -9.979 5.960 -3.831 1.00 0.00 H new ATOM 0 HG LEU A 275 -10.674 3.108 -3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 275 -9.150 2.747 -5.175 1.00 0.00 H new ATOM 0 HD12 LEU A 275 -10.441 3.904 -5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 275 -8.799 4.491 -5.219 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -8.306 2.565 -2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 275 -7.921 4.302 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 275 -8.981 3.591 -1.576 1.00 0.00 H new ATOM 524 N VAL A 276 -9.650 8.037 -1.692 1.00 0.00 N ATOM 525 CA VAL A 276 -9.847 9.479 -1.610 1.00 0.00 C ATOM 526 C VAL A 276 -9.036 10.206 -2.676 1.00 0.00 C ATOM 527 O VAL A 276 -7.830 10.004 -2.819 1.00 0.00 O ATOM 528 CB VAL A 276 -9.455 10.021 -0.223 1.00 0.00 C ATOM 529 CG1 VAL A 276 -9.345 11.538 -0.254 1.00 0.00 C ATOM 530 CG2 VAL A 276 -10.461 9.573 0.828 1.00 0.00 C ATOM 0 H VAL A 276 -8.677 7.750 -1.796 1.00 0.00 H new ATOM 0 HA VAL A 276 -10.908 9.663 -1.777 1.00 0.00 H new ATOM 0 HB VAL A 276 -8.479 9.615 0.044 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -9.067 11.903 0.735 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -8.584 11.833 -0.977 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -10.305 11.967 -0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -10.168 9.965 1.802 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -11.451 9.949 0.568 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -10.485 8.484 0.868 1.00 0.00 H new ATOM 540 N PRO A 277 -9.710 11.075 -3.443 1.00 0.00 N ATOM 541 CA PRO A 277 -9.071 11.852 -4.509 1.00 0.00 C ATOM 542 C PRO A 277 -8.126 12.917 -3.964 1.00 0.00 C ATOM 543 O PRO A 277 -8.564 13.954 -3.468 1.00 0.00 O ATOM 544 CB PRO A 277 -10.254 12.504 -5.230 1.00 0.00 C ATOM 545 CG PRO A 277 -11.331 12.575 -4.204 1.00 0.00 C ATOM 546 CD PRO A 277 -11.149 11.366 -3.329 1.00 0.00 C ATOM 0 HA PRO A 277 -8.453 11.228 -5.154 1.00 0.00 H new ATOM 0 HB2 PRO A 277 -9.994 13.496 -5.600 1.00 0.00 H new ATOM 0 HB3 PRO A 277 -10.566 11.914 -6.092 1.00 0.00 H new ATOM 0 HG2 PRO A 277 -11.255 13.493 -3.622 1.00 0.00 H new ATOM 0 HG3 PRO A 277 -12.316 12.574 -4.671 1.00 0.00 H new ATOM 0 HD2 PRO A 277 -11.437 11.569 -2.298 1.00 0.00 H new ATOM 0 HD3 PRO A 277 -11.757 10.528 -3.670 1.00 0.00 H new ATOM 554 N GLY A 278 -6.826 12.654 -4.059 1.00 0.00 N ATOM 555 CA GLY A 278 -5.840 13.600 -3.572 1.00 0.00 C ATOM 556 C GLY A 278 -4.911 12.989 -2.542 1.00 0.00 C ATOM 557 O GLY A 278 -4.078 13.683 -1.958 1.00 0.00 O ATOM 0 H GLY A 278 -6.438 11.802 -4.465 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -5.253 13.972 -4.411 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -6.350 14.458 -3.134 1.00 0.00 H new ATOM 561 N ASP A 279 -5.053 11.688 -2.316 1.00 0.00 N ATOM 562 CA ASP A 279 -4.220 10.983 -1.349 1.00 0.00 C ATOM 563 C ASP A 279 -3.293 9.994 -2.048 1.00 0.00 C ATOM 564 O ASP A 279 -3.418 9.753 -3.249 1.00 0.00 O ATOM 565 CB ASP A 279 -5.093 10.250 -0.329 1.00 0.00 C ATOM 566 CG ASP A 279 -4.377 10.019 0.987 1.00 0.00 C ATOM 567 OD1 ASP A 279 -3.490 10.829 1.329 1.00 0.00 O ATOM 568 OD2 ASP A 279 -4.703 9.028 1.674 1.00 0.00 O ATOM 0 H ASP A 279 -5.738 11.099 -2.790 1.00 0.00 H new ATOM 0 HA ASP A 279 -3.609 11.720 -0.829 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -6.000 10.828 -0.149 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -5.403 9.291 -0.744 1.00 0.00 H new ATOM 573 N PHE A 280 -2.364 9.424 -1.289 1.00 0.00 N ATOM 574 CA PHE A 280 -1.414 8.462 -1.836 1.00 0.00 C ATOM 575 C PHE A 280 -1.693 7.059 -1.304 1.00 0.00 C ATOM 576 O PHE A 280 -2.380 6.892 -0.296 1.00 0.00 O ATOM 577 CB PHE A 280 0.019 8.875 -1.492 1.00 0.00 C ATOM 578 CG PHE A 280 0.604 9.867 -2.456 1.00 0.00 C ATOM 579 CD1 PHE A 280 0.784 9.534 -3.789 1.00 0.00 C ATOM 580 CD2 PHE A 280 0.974 11.132 -2.029 1.00 0.00 C ATOM 581 CE1 PHE A 280 1.324 10.445 -4.678 1.00 0.00 C ATOM 582 CE2 PHE A 280 1.514 12.047 -2.913 1.00 0.00 C ATOM 583 CZ PHE A 280 1.688 11.703 -4.240 1.00 0.00 C ATOM 0 H PHE A 280 -2.248 9.611 -0.293 1.00 0.00 H new ATOM 0 HA PHE A 280 -1.531 8.450 -2.920 1.00 0.00 H new ATOM 0 HB2 PHE A 280 0.035 9.302 -0.489 1.00 0.00 H new ATOM 0 HB3 PHE A 280 0.650 7.986 -1.470 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.499 8.552 -4.137 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.839 11.406 -0.993 1.00 0.00 H new ATOM 0 HE1 PHE A 280 1.461 10.173 -5.714 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.800 13.029 -2.567 1.00 0.00 H new ATOM 0 HZ PHE A 280 2.108 12.417 -4.933 1.00 0.00 H new ATOM 593 N ILE A 281 -1.156 6.055 -1.989 1.00 0.00 N ATOM 594 CA ILE A 281 -1.346 4.668 -1.585 1.00 0.00 C ATOM 595 C ILE A 281 -0.034 3.893 -1.644 1.00 0.00 C ATOM 596 O ILE A 281 0.697 3.963 -2.633 1.00 0.00 O ATOM 597 CB ILE A 281 -2.387 3.961 -2.473 1.00 0.00 C ATOM 598 CG1 ILE A 281 -3.675 4.783 -2.540 1.00 0.00 C ATOM 599 CG2 ILE A 281 -2.672 2.563 -1.944 1.00 0.00 C ATOM 600 CD1 ILE A 281 -4.460 4.784 -1.247 1.00 0.00 C ATOM 0 H ILE A 281 -0.586 6.176 -2.826 1.00 0.00 H new ATOM 0 HA ILE A 281 -1.709 4.686 -0.557 1.00 0.00 H new ATOM 0 HB ILE A 281 -1.982 3.872 -3.481 1.00 0.00 H new ATOM 0 HG12 ILE A 281 -3.427 5.811 -2.806 1.00 0.00 H new ATOM 0 HG13 ILE A 281 -4.306 4.391 -3.338 1.00 0.00 H new ATOM 0 HG21 ILE A 281 -3.410 2.076 -2.582 1.00 0.00 H new ATOM 0 HG22 ILE A 281 -1.751 1.980 -1.943 1.00 0.00 H new ATOM 0 HG23 ILE A 281 -3.060 2.631 -0.928 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -5.360 5.386 -1.368 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -4.739 3.762 -0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -3.847 5.204 -0.450 1.00 0.00 H new ATOM 612 N PHE A 282 0.259 3.153 -0.580 1.00 0.00 N ATOM 613 CA PHE A 282 1.483 2.364 -0.510 1.00 0.00 C ATOM 614 C PHE A 282 1.207 0.901 -0.845 1.00 0.00 C ATOM 615 O PHE A 282 0.627 0.169 -0.043 1.00 0.00 O ATOM 616 CB PHE A 282 2.106 2.471 0.883 1.00 0.00 C ATOM 617 CG PHE A 282 2.702 3.820 1.171 1.00 0.00 C ATOM 618 CD1 PHE A 282 3.585 4.407 0.278 1.00 0.00 C ATOM 619 CD2 PHE A 282 2.379 4.500 2.334 1.00 0.00 C ATOM 620 CE1 PHE A 282 4.134 5.648 0.540 1.00 0.00 C ATOM 621 CE2 PHE A 282 2.925 5.742 2.600 1.00 0.00 C ATOM 622 CZ PHE A 282 3.805 6.316 1.703 1.00 0.00 C ATOM 0 H PHE A 282 -0.335 3.083 0.246 1.00 0.00 H new ATOM 0 HA PHE A 282 2.183 2.761 -1.245 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.344 2.252 1.631 1.00 0.00 H new ATOM 0 HB3 PHE A 282 2.881 1.711 0.985 1.00 0.00 H new ATOM 0 HD1 PHE A 282 3.847 3.889 -0.633 1.00 0.00 H new ATOM 0 HD2 PHE A 282 1.694 4.055 3.040 1.00 0.00 H new ATOM 0 HE1 PHE A 282 4.820 6.095 -0.164 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.664 6.263 3.509 1.00 0.00 H new ATOM 0 HZ PHE A 282 4.235 7.285 1.911 1.00 0.00 H new ATOM 632 N MET A 283 1.625 0.483 -2.035 1.00 0.00 N ATOM 633 CA MET A 283 1.423 -0.893 -2.475 1.00 0.00 C ATOM 634 C MET A 283 2.688 -1.721 -2.269 1.00 0.00 C ATOM 635 O MET A 283 3.789 -1.283 -2.603 1.00 0.00 O ATOM 636 CB MET A 283 1.014 -0.924 -3.949 1.00 0.00 C ATOM 637 CG MET A 283 0.111 -2.094 -4.304 1.00 0.00 C ATOM 638 SD MET A 283 0.843 -3.688 -3.884 1.00 0.00 S ATOM 639 CE MET A 283 2.374 -3.613 -4.810 1.00 0.00 C ATOM 0 H MET A 283 2.105 1.076 -2.712 1.00 0.00 H new ATOM 0 HA MET A 283 0.624 -1.327 -1.874 1.00 0.00 H new ATOM 0 HB2 MET A 283 0.503 0.007 -4.196 1.00 0.00 H new ATOM 0 HB3 MET A 283 1.912 -0.968 -4.566 1.00 0.00 H new ATOM 0 HG2 MET A 283 -0.840 -1.986 -3.782 1.00 0.00 H new ATOM 0 HG3 MET A 283 -0.107 -2.069 -5.372 1.00 0.00 H new ATOM 0 HE1 MET A 283 2.855 -4.591 -4.798 1.00 0.00 H new ATOM 0 HE2 MET A 283 2.163 -3.326 -5.840 1.00 0.00 H new ATOM 0 HE3 MET A 283 3.038 -2.877 -4.357 1.00 0.00 H new ATOM 649 N SER A 284 2.522 -2.918 -1.717 1.00 0.00 N ATOM 650 CA SER A 284 3.651 -3.806 -1.462 1.00 0.00 C ATOM 651 C SER A 284 3.419 -5.175 -2.093 1.00 0.00 C ATOM 652 O SER A 284 2.302 -5.693 -2.121 1.00 0.00 O ATOM 653 CB SER A 284 3.879 -3.957 0.043 1.00 0.00 C ATOM 654 OG SER A 284 2.656 -4.179 0.724 1.00 0.00 O ATOM 0 H SER A 284 1.617 -3.296 -1.437 1.00 0.00 H new ATOM 0 HA SER A 284 4.539 -3.363 -1.914 1.00 0.00 H new ATOM 0 HB2 SER A 284 4.559 -4.788 0.229 1.00 0.00 H new ATOM 0 HB3 SER A 284 4.359 -3.059 0.433 1.00 0.00 H new ATOM 0 HG SER A 284 2.829 -4.274 1.684 1.00 0.00 H new ATOM 660 N PRO A 285 4.499 -5.777 -2.613 1.00 0.00 N ATOM 661 CA PRO A 285 4.439 -7.095 -3.253 1.00 0.00 C ATOM 662 C PRO A 285 4.176 -8.214 -2.252 1.00 0.00 C ATOM 663 O PRO A 285 3.661 -9.272 -2.611 1.00 0.00 O ATOM 664 CB PRO A 285 5.829 -7.250 -3.875 1.00 0.00 C ATOM 665 CG PRO A 285 6.713 -6.379 -3.050 1.00 0.00 C ATOM 666 CD PRO A 285 5.861 -5.218 -2.615 1.00 0.00 C ATOM 0 HA PRO A 285 3.624 -7.162 -3.974 1.00 0.00 H new ATOM 0 HB2 PRO A 285 6.161 -8.288 -3.849 1.00 0.00 H new ATOM 0 HB3 PRO A 285 5.832 -6.940 -4.920 1.00 0.00 H new ATOM 0 HG2 PRO A 285 7.102 -6.922 -2.189 1.00 0.00 H new ATOM 0 HG3 PRO A 285 7.573 -6.038 -3.627 1.00 0.00 H new ATOM 0 HD2 PRO A 285 6.148 -4.856 -1.628 1.00 0.00 H new ATOM 0 HD3 PRO A 285 5.949 -4.376 -3.301 1.00 0.00 H new ATOM 674 N MET A 286 4.532 -7.973 -0.994 1.00 0.00 N ATOM 675 CA MET A 286 4.332 -8.962 0.059 1.00 0.00 C ATOM 676 C MET A 286 2.895 -8.928 0.571 1.00 0.00 C ATOM 677 O MET A 286 2.512 -9.728 1.423 1.00 0.00 O ATOM 678 CB MET A 286 5.303 -8.711 1.214 1.00 0.00 C ATOM 679 CG MET A 286 6.764 -8.715 0.792 1.00 0.00 C ATOM 680 SD MET A 286 7.886 -8.987 2.176 1.00 0.00 S ATOM 681 CE MET A 286 7.735 -10.759 2.392 1.00 0.00 C ATOM 0 H MET A 286 4.960 -7.102 -0.679 1.00 0.00 H new ATOM 0 HA MET A 286 4.526 -9.949 -0.362 1.00 0.00 H new ATOM 0 HB2 MET A 286 5.068 -7.750 1.673 1.00 0.00 H new ATOM 0 HB3 MET A 286 5.152 -9.474 1.977 1.00 0.00 H new ATOM 0 HG2 MET A 286 6.920 -9.493 0.045 1.00 0.00 H new ATOM 0 HG3 MET A 286 7.003 -7.764 0.317 1.00 0.00 H new ATOM 0 HE1 MET A 286 8.486 -11.104 3.103 1.00 0.00 H new ATOM 0 HE2 MET A 286 6.741 -10.996 2.770 1.00 0.00 H new ATOM 0 HE3 MET A 286 7.887 -11.257 1.434 1.00 0.00 H new ATOM 691 N GLU A 287 2.107 -7.995 0.045 1.00 0.00 N ATOM 692 CA GLU A 287 0.713 -7.858 0.451 1.00 0.00 C ATOM 693 C GLU A 287 -0.213 -7.892 -0.761 1.00 0.00 C ATOM 694 O GLU A 287 -1.407 -7.614 -0.651 1.00 0.00 O ATOM 695 CB GLU A 287 0.510 -6.553 1.225 1.00 0.00 C ATOM 696 CG GLU A 287 1.368 -6.447 2.474 1.00 0.00 C ATOM 697 CD GLU A 287 1.139 -7.594 3.439 1.00 0.00 C ATOM 698 OE1 GLU A 287 -0.024 -7.810 3.840 1.00 0.00 O ATOM 699 OE2 GLU A 287 2.123 -8.278 3.792 1.00 0.00 O ATOM 0 H GLU A 287 2.409 -7.324 -0.662 1.00 0.00 H new ATOM 0 HA GLU A 287 0.466 -8.699 1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 287 0.734 -5.712 0.568 1.00 0.00 H new ATOM 0 HB3 GLU A 287 -0.539 -6.467 1.507 1.00 0.00 H new ATOM 0 HG2 GLU A 287 2.419 -6.423 2.187 1.00 0.00 H new ATOM 0 HG3 GLU A 287 1.154 -5.505 2.978 1.00 0.00 H new ATOM 706 N GLN A 288 0.348 -8.233 -1.917 1.00 0.00 N ATOM 707 CA GLN A 288 -0.427 -8.302 -3.151 1.00 0.00 C ATOM 708 C GLN A 288 -1.405 -9.471 -3.114 1.00 0.00 C ATOM 709 O GLN A 288 -1.094 -10.570 -3.574 1.00 0.00 O ATOM 710 CB GLN A 288 0.505 -8.439 -4.356 1.00 0.00 C ATOM 711 CG GLN A 288 0.922 -7.106 -4.957 1.00 0.00 C ATOM 712 CD GLN A 288 1.310 -7.221 -6.418 1.00 0.00 C ATOM 713 OE1 GLN A 288 1.847 -6.142 -6.975 1.00 0.00 O flip ATOM 714 NE2 GLN A 288 1.129 -8.268 -7.040 1.00 0.00 N flip ATOM 0 H GLN A 288 1.335 -8.466 -2.025 1.00 0.00 H new ATOM 0 HA GLN A 288 -0.997 -7.378 -3.245 1.00 0.00 H new ATOM 0 HB2 GLN A 288 1.397 -8.987 -4.054 1.00 0.00 H new ATOM 0 HB3 GLN A 288 0.009 -9.035 -5.123 1.00 0.00 H new ATOM 0 HG2 GLN A 288 0.102 -6.395 -4.858 1.00 0.00 H new ATOM 0 HG3 GLN A 288 1.763 -6.704 -4.392 1.00 0.00 H new ATOM 0 HE21 GLN A 288 0.713 -9.074 -6.573 1.00 0.00 H new ATOM 0 HE22 GLN A 288 1.395 -8.330 -8.023 1.00 0.00 H new ATOM 723 N THR A 289 -2.591 -9.227 -2.563 1.00 0.00 N ATOM 724 CA THR A 289 -3.615 -10.260 -2.465 1.00 0.00 C ATOM 725 C THR A 289 -4.720 -10.037 -3.491 1.00 0.00 C ATOM 726 O THR A 289 -5.276 -8.944 -3.592 1.00 0.00 O ATOM 727 CB THR A 289 -4.238 -10.301 -1.057 1.00 0.00 C ATOM 728 OG1 THR A 289 -4.598 -8.979 -0.642 1.00 0.00 O ATOM 729 CG2 THR A 289 -3.268 -10.907 -0.054 1.00 0.00 C ATOM 0 H THR A 289 -2.865 -8.323 -2.178 1.00 0.00 H new ATOM 0 HA THR A 289 -3.124 -11.212 -2.665 1.00 0.00 H new ATOM 0 HB THR A 289 -5.131 -10.924 -1.097 1.00 0.00 H new ATOM 0 HG1 THR A 289 -5.016 -8.504 -1.390 1.00 0.00 H new ATOM 0 HG21 THR A 289 -3.730 -10.926 0.933 1.00 0.00 H new ATOM 0 HG22 THR A 289 -3.019 -11.924 -0.357 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.359 -10.306 -0.018 1.00 0.00 H new ATOM 737 N SER A 290 -5.035 -11.082 -4.251 1.00 0.00 N ATOM 738 CA SER A 290 -6.073 -10.999 -5.272 1.00 0.00 C ATOM 739 C SER A 290 -5.886 -9.756 -6.137 1.00 0.00 C ATOM 740 O SER A 290 -6.843 -9.231 -6.707 1.00 0.00 O ATOM 741 CB SER A 290 -7.457 -10.978 -4.621 1.00 0.00 C ATOM 742 OG SER A 290 -7.629 -12.082 -3.751 1.00 0.00 O ATOM 0 H SER A 290 -4.586 -11.995 -4.179 1.00 0.00 H new ATOM 0 HA SER A 290 -5.993 -11.879 -5.910 1.00 0.00 H new ATOM 0 HB2 SER A 290 -7.586 -10.049 -4.065 1.00 0.00 H new ATOM 0 HB3 SER A 290 -8.226 -10.997 -5.393 1.00 0.00 H new ATOM 0 HG SER A 290 -8.521 -12.044 -3.347 1.00 0.00 H new ATOM 748 N THR A 291 -4.644 -9.289 -6.231 1.00 0.00 N ATOM 749 CA THR A 291 -4.330 -8.108 -7.024 1.00 0.00 C ATOM 750 C THR A 291 -4.083 -8.476 -8.483 1.00 0.00 C ATOM 751 O THR A 291 -4.714 -7.928 -9.387 1.00 0.00 O ATOM 752 CB THR A 291 -3.092 -7.375 -6.475 1.00 0.00 C ATOM 753 OG1 THR A 291 -1.913 -8.149 -6.725 1.00 0.00 O ATOM 754 CG2 THR A 291 -3.231 -7.123 -4.981 1.00 0.00 C ATOM 0 H THR A 291 -3.840 -9.712 -5.767 1.00 0.00 H new ATOM 0 HA THR A 291 -5.193 -7.445 -6.960 1.00 0.00 H new ATOM 0 HB THR A 291 -3.011 -6.415 -6.984 1.00 0.00 H new ATOM 0 HG1 THR A 291 -1.330 -7.665 -7.347 1.00 0.00 H new ATOM 0 HG21 THR A 291 -2.345 -6.604 -4.616 1.00 0.00 H new ATOM 0 HG22 THR A 291 -4.113 -6.509 -4.796 1.00 0.00 H new ATOM 0 HG23 THR A 291 -3.335 -8.075 -4.460 1.00 0.00 H new ATOM 762 N SER A 292 -3.161 -9.407 -8.706 1.00 0.00 N ATOM 763 CA SER A 292 -2.828 -9.845 -10.056 1.00 0.00 C ATOM 764 C SER A 292 -4.068 -9.852 -10.946 1.00 0.00 C ATOM 765 O SER A 292 -3.994 -9.537 -12.133 1.00 0.00 O ATOM 766 CB SER A 292 -2.203 -11.241 -10.022 1.00 0.00 C ATOM 767 OG SER A 292 -1.376 -11.458 -11.153 1.00 0.00 O ATOM 0 H SER A 292 -2.631 -9.872 -7.969 1.00 0.00 H new ATOM 0 HA SER A 292 -2.107 -9.142 -10.472 1.00 0.00 H new ATOM 0 HB2 SER A 292 -1.616 -11.358 -9.111 1.00 0.00 H new ATOM 0 HB3 SER A 292 -2.990 -11.995 -9.993 1.00 0.00 H new ATOM 0 HG SER A 292 -0.987 -12.357 -11.107 1.00 0.00 H new ATOM 773 N GLU A 293 -5.206 -10.214 -10.362 1.00 0.00 N ATOM 774 CA GLU A 293 -6.461 -10.263 -11.102 1.00 0.00 C ATOM 775 C GLU A 293 -6.845 -8.878 -11.614 1.00 0.00 C ATOM 776 O GLU A 293 -7.196 -8.711 -12.781 1.00 0.00 O ATOM 777 CB GLU A 293 -7.579 -10.820 -10.217 1.00 0.00 C ATOM 778 CG GLU A 293 -8.925 -10.904 -10.918 1.00 0.00 C ATOM 779 CD GLU A 293 -8.905 -11.841 -12.109 1.00 0.00 C ATOM 780 OE1 GLU A 293 -8.571 -13.030 -11.922 1.00 0.00 O ATOM 781 OE2 GLU A 293 -9.223 -11.387 -13.228 1.00 0.00 O ATOM 0 H GLU A 293 -5.284 -10.477 -9.380 1.00 0.00 H new ATOM 0 HA GLU A 293 -6.323 -10.923 -11.959 1.00 0.00 H new ATOM 0 HB2 GLU A 293 -7.296 -11.814 -9.871 1.00 0.00 H new ATOM 0 HB3 GLU A 293 -7.678 -10.191 -9.332 1.00 0.00 H new ATOM 0 HG2 GLU A 293 -9.680 -11.241 -10.208 1.00 0.00 H new ATOM 0 HG3 GLU A 293 -9.221 -9.908 -11.249 1.00 0.00 H new ATOM 788 N GLY A 294 -6.776 -7.887 -10.731 1.00 0.00 N ATOM 789 CA GLY A 294 -7.120 -6.529 -11.111 1.00 0.00 C ATOM 790 C GLY A 294 -7.042 -5.563 -9.946 1.00 0.00 C ATOM 791 O GLY A 294 -6.827 -4.366 -10.137 1.00 0.00 O ATOM 0 H GLY A 294 -6.488 -8.000 -9.759 1.00 0.00 H new ATOM 0 HA2 GLY A 294 -6.448 -6.195 -11.901 1.00 0.00 H new ATOM 0 HA3 GLY A 294 -8.129 -6.515 -11.523 1.00 0.00 H new ATOM 795 N TRP A 295 -7.219 -6.082 -8.736 1.00 0.00 N ATOM 796 CA TRP A 295 -7.169 -5.256 -7.535 1.00 0.00 C ATOM 797 C TRP A 295 -5.727 -4.979 -7.125 1.00 0.00 C ATOM 798 O TRP A 295 -4.788 -5.429 -7.782 1.00 0.00 O ATOM 799 CB TRP A 295 -7.915 -5.941 -6.389 1.00 0.00 C ATOM 800 CG TRP A 295 -9.358 -6.207 -6.695 1.00 0.00 C ATOM 801 CD1 TRP A 295 -9.862 -7.233 -7.442 1.00 0.00 C ATOM 802 CD2 TRP A 295 -10.483 -5.433 -6.264 1.00 0.00 C ATOM 803 NE1 TRP A 295 -11.232 -7.144 -7.501 1.00 0.00 N ATOM 804 CE2 TRP A 295 -11.637 -6.049 -6.785 1.00 0.00 C ATOM 805 CE3 TRP A 295 -10.627 -4.281 -5.486 1.00 0.00 C ATOM 806 CZ2 TRP A 295 -12.916 -5.550 -6.554 1.00 0.00 C ATOM 807 CZ3 TRP A 295 -11.897 -3.787 -5.257 1.00 0.00 C ATOM 808 CH2 TRP A 295 -13.028 -4.420 -5.789 1.00 0.00 C ATOM 0 H TRP A 295 -7.398 -7.071 -8.561 1.00 0.00 H new ATOM 0 HA TRP A 295 -7.653 -4.305 -7.757 1.00 0.00 H new ATOM 0 HB2 TRP A 295 -7.421 -6.884 -6.155 1.00 0.00 H new ATOM 0 HB3 TRP A 295 -7.849 -5.317 -5.498 1.00 0.00 H new ATOM 0 HD1 TRP A 295 -9.271 -8.002 -7.917 1.00 0.00 H new ATOM 0 HE1 TRP A 295 -11.847 -7.789 -7.997 1.00 0.00 H new ATOM 0 HE3 TRP A 295 -9.761 -3.786 -5.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 295 -13.789 -6.037 -6.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 295 -12.020 -2.897 -4.657 1.00 0.00 H new ATOM 0 HH2 TRP A 295 -14.007 -4.009 -5.592 1.00 0.00 H new ATOM 819 N ILE A 296 -5.558 -4.236 -6.036 1.00 0.00 N ATOM 820 CA ILE A 296 -4.230 -3.901 -5.539 1.00 0.00 C ATOM 821 C ILE A 296 -4.269 -3.562 -4.052 1.00 0.00 C ATOM 822 O ILE A 296 -5.023 -2.688 -3.624 1.00 0.00 O ATOM 823 CB ILE A 296 -3.623 -2.713 -6.309 1.00 0.00 C ATOM 824 CG1 ILE A 296 -4.710 -1.694 -6.656 1.00 0.00 C ATOM 825 CG2 ILE A 296 -2.925 -3.201 -7.570 1.00 0.00 C ATOM 826 CD1 ILE A 296 -4.195 -0.277 -6.773 1.00 0.00 C ATOM 0 H ILE A 296 -6.325 -3.855 -5.481 1.00 0.00 H new ATOM 0 HA ILE A 296 -3.605 -4.780 -5.693 1.00 0.00 H new ATOM 0 HB ILE A 296 -2.884 -2.226 -5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 296 -5.178 -1.981 -7.598 1.00 0.00 H new ATOM 0 HG13 ILE A 296 -5.486 -1.728 -5.891 1.00 0.00 H new ATOM 0 HG21 ILE A 296 -2.501 -2.350 -8.104 1.00 0.00 H new ATOM 0 HG22 ILE A 296 -2.128 -3.894 -7.300 1.00 0.00 H new ATOM 0 HG23 ILE A 296 -3.645 -3.709 -8.211 1.00 0.00 H new ATOM 0 HD11 ILE A 296 -5.020 0.391 -7.021 1.00 0.00 H new ATOM 0 HD12 ILE A 296 -3.753 0.029 -5.825 1.00 0.00 H new ATOM 0 HD13 ILE A 296 -3.440 -0.228 -7.558 1.00 0.00 H new ATOM 838 N TYR A 297 -3.450 -4.258 -3.271 1.00 0.00 N ATOM 839 CA TYR A 297 -3.391 -4.031 -1.832 1.00 0.00 C ATOM 840 C TYR A 297 -2.457 -2.871 -1.501 1.00 0.00 C ATOM 841 O TYR A 297 -1.242 -2.971 -1.666 1.00 0.00 O ATOM 842 CB TYR A 297 -2.923 -5.298 -1.114 1.00 0.00 C ATOM 843 CG TYR A 297 -3.177 -5.278 0.377 1.00 0.00 C ATOM 844 CD1 TYR A 297 -4.397 -5.690 0.899 1.00 0.00 C ATOM 845 CD2 TYR A 297 -2.197 -4.848 1.262 1.00 0.00 C ATOM 846 CE1 TYR A 297 -4.633 -5.673 2.260 1.00 0.00 C ATOM 847 CE2 TYR A 297 -2.424 -4.828 2.625 1.00 0.00 C ATOM 848 CZ TYR A 297 -3.644 -5.241 3.119 1.00 0.00 C ATOM 849 OH TYR A 297 -3.875 -5.224 4.475 1.00 0.00 O ATOM 0 H TYR A 297 -2.818 -4.984 -3.610 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.393 -3.776 -1.489 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -3.429 -6.160 -1.549 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.856 -5.432 -1.291 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -5.174 -6.029 0.230 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -1.241 -4.524 0.878 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -5.587 -5.996 2.649 1.00 0.00 H new ATOM 0 HE2 TYR A 297 -1.651 -4.491 3.300 1.00 0.00 H new ATOM 0 HH TYR A 297 -3.024 -5.129 4.951 1.00 0.00 H new ATOM 859 N GLY A 298 -3.035 -1.770 -1.032 1.00 0.00 N ATOM 860 CA GLY A 298 -2.241 -0.606 -0.684 1.00 0.00 C ATOM 861 C GLY A 298 -2.638 -0.011 0.653 1.00 0.00 C ATOM 862 O GLY A 298 -3.516 -0.536 1.339 1.00 0.00 O ATOM 0 H GLY A 298 -4.039 -1.663 -0.887 1.00 0.00 H new ATOM 0 HA2 GLY A 298 -1.187 -0.884 -0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 298 -2.350 0.150 -1.461 1.00 0.00 H new ATOM 866 N THR A 299 -1.989 1.088 1.026 1.00 0.00 N ATOM 867 CA THR A 299 -2.277 1.753 2.291 1.00 0.00 C ATOM 868 C THR A 299 -2.427 3.257 2.099 1.00 0.00 C ATOM 869 O THR A 299 -1.573 3.903 1.492 1.00 0.00 O ATOM 870 CB THR A 299 -1.172 1.486 3.330 1.00 0.00 C ATOM 871 OG1 THR A 299 -1.072 0.082 3.590 1.00 0.00 O ATOM 872 CG2 THR A 299 -1.458 2.228 4.627 1.00 0.00 C ATOM 0 H THR A 299 -1.261 1.536 0.470 1.00 0.00 H new ATOM 0 HA THR A 299 -3.217 1.341 2.658 1.00 0.00 H new ATOM 0 HB THR A 299 -0.227 1.847 2.924 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.366 -0.079 4.250 1.00 0.00 H new ATOM 0 HG21 THR A 299 -0.664 2.024 5.345 1.00 0.00 H new ATOM 0 HG22 THR A 299 -1.504 3.299 4.431 1.00 0.00 H new ATOM 0 HG23 THR A 299 -2.412 1.893 5.035 1.00 0.00 H new ATOM 880 N SER A 300 -3.517 3.810 2.621 1.00 0.00 N ATOM 881 CA SER A 300 -3.780 5.240 2.504 1.00 0.00 C ATOM 882 C SER A 300 -2.746 6.048 3.283 1.00 0.00 C ATOM 883 O SER A 300 -2.147 5.554 4.239 1.00 0.00 O ATOM 884 CB SER A 300 -5.186 5.565 3.013 1.00 0.00 C ATOM 885 OG SER A 300 -5.678 6.756 2.425 1.00 0.00 O ATOM 0 H SER A 300 -4.232 3.290 3.129 1.00 0.00 H new ATOM 0 HA SER A 300 -3.710 5.512 1.451 1.00 0.00 H new ATOM 0 HB2 SER A 300 -5.859 4.738 2.785 1.00 0.00 H new ATOM 0 HB3 SER A 300 -5.168 5.672 4.098 1.00 0.00 H new ATOM 0 HG SER A 300 -4.988 7.451 2.466 1.00 0.00 H new ATOM 891 N LEU A 301 -2.541 7.292 2.866 1.00 0.00 N ATOM 892 CA LEU A 301 -1.579 8.171 3.523 1.00 0.00 C ATOM 893 C LEU A 301 -2.283 9.132 4.476 1.00 0.00 C ATOM 894 O LEU A 301 -1.715 9.549 5.486 1.00 0.00 O ATOM 895 CB LEU A 301 -0.784 8.959 2.481 1.00 0.00 C ATOM 896 CG LEU A 301 0.547 9.544 2.955 1.00 0.00 C ATOM 897 CD1 LEU A 301 1.623 8.471 2.982 1.00 0.00 C ATOM 898 CD2 LEU A 301 0.968 10.702 2.061 1.00 0.00 C ATOM 0 H LEU A 301 -3.028 7.715 2.076 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.893 7.552 4.101 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.589 8.305 1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.408 9.775 2.118 1.00 0.00 H new ATOM 0 HG LEU A 301 0.415 9.922 3.969 1.00 0.00 H new ATOM 0 HD11 LEU A 301 2.563 8.906 3.322 1.00 0.00 H new ATOM 0 HD12 LEU A 301 1.325 7.674 3.663 1.00 0.00 H new ATOM 0 HD13 LEU A 301 1.754 8.062 1.980 1.00 0.00 H new ATOM 0 HD21 LEU A 301 1.917 11.107 2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 301 1.082 10.348 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 301 0.207 11.482 2.093 1.00 0.00 H new ATOM 910 N THR A 302 -3.524 9.479 4.150 1.00 0.00 N ATOM 911 CA THR A 302 -4.305 10.390 4.977 1.00 0.00 C ATOM 912 C THR A 302 -4.755 9.713 6.266 1.00 0.00 C ATOM 913 O THR A 302 -4.533 10.229 7.362 1.00 0.00 O ATOM 914 CB THR A 302 -5.544 10.909 4.223 1.00 0.00 C ATOM 915 OG1 THR A 302 -5.154 11.891 3.257 1.00 0.00 O ATOM 916 CG2 THR A 302 -6.551 11.513 5.190 1.00 0.00 C ATOM 0 H THR A 302 -4.010 9.143 3.319 1.00 0.00 H new ATOM 0 HA THR A 302 -3.657 11.232 5.220 1.00 0.00 H new ATOM 0 HB THR A 302 -6.012 10.066 3.714 1.00 0.00 H new ATOM 0 HG1 THR A 302 -5.947 12.215 2.781 1.00 0.00 H new ATOM 0 HG21 THR A 302 -7.418 11.873 4.635 1.00 0.00 H new ATOM 0 HG22 THR A 302 -6.868 10.755 5.906 1.00 0.00 H new ATOM 0 HG23 THR A 302 -6.090 12.345 5.723 1.00 0.00 H new ATOM 924 N THR A 303 -5.389 8.552 6.130 1.00 0.00 N ATOM 925 CA THR A 303 -5.871 7.804 7.284 1.00 0.00 C ATOM 926 C THR A 303 -4.800 6.856 7.811 1.00 0.00 C ATOM 927 O THR A 303 -4.438 6.905 8.986 1.00 0.00 O ATOM 928 CB THR A 303 -7.134 6.992 6.940 1.00 0.00 C ATOM 929 OG1 THR A 303 -6.783 5.853 6.147 1.00 0.00 O ATOM 930 CG2 THR A 303 -8.141 7.850 6.188 1.00 0.00 C ATOM 0 H THR A 303 -5.580 8.110 5.231 1.00 0.00 H new ATOM 0 HA THR A 303 -6.117 8.535 8.054 1.00 0.00 H new ATOM 0 HB THR A 303 -7.590 6.658 7.872 1.00 0.00 H new ATOM 0 HG1 THR A 303 -7.591 5.341 5.934 1.00 0.00 H new ATOM 0 HG21 THR A 303 -9.024 7.255 5.956 1.00 0.00 H new ATOM 0 HG22 THR A 303 -8.428 8.700 6.807 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.693 8.210 5.262 1.00 0.00 H new ATOM 938 N GLY A 304 -4.294 5.995 6.934 1.00 0.00 N ATOM 939 CA GLY A 304 -3.268 5.048 7.331 1.00 0.00 C ATOM 940 C GLY A 304 -3.784 3.624 7.390 1.00 0.00 C ATOM 941 O GLY A 304 -3.223 2.782 8.092 1.00 0.00 O ATOM 0 H GLY A 304 -4.576 5.936 5.956 1.00 0.00 H new ATOM 0 HA2 GLY A 304 -2.437 5.101 6.627 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -2.876 5.330 8.308 1.00 0.00 H new ATOM 945 N CYS A 305 -4.857 3.355 6.654 1.00 0.00 N ATOM 946 CA CYS A 305 -5.451 2.023 6.627 1.00 0.00 C ATOM 947 C CYS A 305 -4.944 1.225 5.430 1.00 0.00 C ATOM 948 O CYS A 305 -4.346 1.781 4.509 1.00 0.00 O ATOM 949 CB CYS A 305 -6.976 2.123 6.580 1.00 0.00 C ATOM 950 SG CYS A 305 -7.830 0.577 6.970 1.00 0.00 S ATOM 0 H CYS A 305 -5.333 4.041 6.068 1.00 0.00 H new ATOM 0 HA CYS A 305 -5.156 1.502 7.538 1.00 0.00 H new ATOM 0 HB2 CYS A 305 -7.301 2.892 7.281 1.00 0.00 H new ATOM 0 HB3 CYS A 305 -7.277 2.451 5.585 1.00 0.00 H new ATOM 0 HG CYS A 305 -9.115 0.763 6.906 1.00 0.00 H new ATOM 956 N SER A 306 -5.187 -0.082 5.450 1.00 0.00 N ATOM 957 CA SER A 306 -4.750 -0.957 4.369 1.00 0.00 C ATOM 958 C SER A 306 -5.906 -1.817 3.866 1.00 0.00 C ATOM 959 O SER A 306 -6.752 -2.256 4.644 1.00 0.00 O ATOM 960 CB SER A 306 -3.602 -1.851 4.841 1.00 0.00 C ATOM 961 OG SER A 306 -4.005 -2.669 5.926 1.00 0.00 O ATOM 0 H SER A 306 -5.684 -0.558 6.203 1.00 0.00 H new ATOM 0 HA SER A 306 -4.400 -0.332 3.547 1.00 0.00 H new ATOM 0 HB2 SER A 306 -3.262 -2.477 4.016 1.00 0.00 H new ATOM 0 HB3 SER A 306 -2.756 -1.233 5.142 1.00 0.00 H new ATOM 0 HG SER A 306 -4.029 -3.605 5.638 1.00 0.00 H new ATOM 967 N GLY A 307 -5.934 -2.054 2.558 1.00 0.00 N ATOM 968 CA GLY A 307 -6.989 -2.860 1.973 1.00 0.00 C ATOM 969 C GLY A 307 -6.853 -2.989 0.469 1.00 0.00 C ATOM 970 O GLY A 307 -5.945 -2.413 -0.132 1.00 0.00 O ATOM 0 H GLY A 307 -5.245 -1.702 1.893 1.00 0.00 H new ATOM 0 HA2 GLY A 307 -6.975 -3.853 2.423 1.00 0.00 H new ATOM 0 HA3 GLY A 307 -7.956 -2.416 2.211 1.00 0.00 H new ATOM 974 N LEU A 308 -7.755 -3.749 -0.142 1.00 0.00 N ATOM 975 CA LEU A 308 -7.731 -3.955 -1.586 1.00 0.00 C ATOM 976 C LEU A 308 -8.540 -2.879 -2.303 1.00 0.00 C ATOM 977 O LEU A 308 -9.619 -2.492 -1.849 1.00 0.00 O ATOM 978 CB LEU A 308 -8.281 -5.339 -1.934 1.00 0.00 C ATOM 979 CG LEU A 308 -7.258 -6.474 -1.987 1.00 0.00 C ATOM 980 CD1 LEU A 308 -7.958 -7.824 -1.989 1.00 0.00 C ATOM 981 CD2 LEU A 308 -6.367 -6.332 -3.212 1.00 0.00 C ATOM 0 H LEU A 308 -8.512 -4.233 0.340 1.00 0.00 H new ATOM 0 HA LEU A 308 -6.696 -3.888 -1.920 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -9.045 -5.599 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -8.777 -5.278 -2.903 1.00 0.00 H new ATOM 0 HG LEU A 308 -6.631 -6.414 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.214 -8.620 -2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.553 -7.927 -1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -8.610 -7.895 -2.860 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -5.645 -7.148 -3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.979 -6.365 -4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -5.837 -5.380 -3.168 1.00 0.00 H new ATOM 993 N LEU A 309 -8.015 -2.400 -3.425 1.00 0.00 N ATOM 994 CA LEU A 309 -8.690 -1.370 -4.207 1.00 0.00 C ATOM 995 C LEU A 309 -8.512 -1.616 -5.702 1.00 0.00 C ATOM 996 O LEU A 309 -7.574 -2.284 -6.138 1.00 0.00 O ATOM 997 CB LEU A 309 -8.150 0.013 -3.838 1.00 0.00 C ATOM 998 CG LEU A 309 -6.642 0.104 -3.602 1.00 0.00 C ATOM 999 CD1 LEU A 309 -6.163 1.539 -3.756 1.00 0.00 C ATOM 1000 CD2 LEU A 309 -6.285 -0.434 -2.224 1.00 0.00 C ATOM 0 H LEU A 309 -7.124 -2.708 -3.814 1.00 0.00 H new ATOM 0 HA LEU A 309 -9.754 -1.412 -3.976 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -8.416 0.709 -4.634 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -8.660 0.351 -2.936 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.139 -0.508 -4.351 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -5.088 1.584 -3.584 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.385 1.890 -4.764 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.673 2.173 -3.030 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -5.208 -0.362 -2.073 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.799 0.151 -1.461 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.592 -1.477 -2.150 1.00 0.00 H new ATOM 1012 N PRO A 310 -9.431 -1.062 -6.507 1.00 0.00 N ATOM 1013 CA PRO A 310 -9.395 -1.206 -7.965 1.00 0.00 C ATOM 1014 C PRO A 310 -8.238 -0.438 -8.595 1.00 0.00 C ATOM 1015 O PRO A 310 -8.140 0.780 -8.452 1.00 0.00 O ATOM 1016 CB PRO A 310 -10.735 -0.616 -8.413 1.00 0.00 C ATOM 1017 CG PRO A 310 -11.109 0.337 -7.331 1.00 0.00 C ATOM 1018 CD PRO A 310 -10.575 -0.253 -6.055 1.00 0.00 C ATOM 0 HA PRO A 310 -9.247 -2.242 -8.269 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -10.643 -0.109 -9.373 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -11.489 -1.393 -8.534 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -10.681 1.323 -7.514 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -12.190 0.464 -7.279 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -10.267 0.521 -5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -11.324 -0.863 -5.550 1.00 0.00 H new ATOM 1026 N GLU A 311 -7.365 -1.158 -9.293 1.00 0.00 N ATOM 1027 CA GLU A 311 -6.215 -0.543 -9.944 1.00 0.00 C ATOM 1028 C GLU A 311 -6.660 0.523 -10.941 1.00 0.00 C ATOM 1029 O GLU A 311 -5.847 1.301 -11.438 1.00 0.00 O ATOM 1030 CB GLU A 311 -5.375 -1.605 -10.656 1.00 0.00 C ATOM 1031 CG GLU A 311 -5.926 -2.006 -12.015 1.00 0.00 C ATOM 1032 CD GLU A 311 -4.937 -2.818 -12.828 1.00 0.00 C ATOM 1033 OE1 GLU A 311 -4.141 -2.209 -13.573 1.00 0.00 O ATOM 1034 OE2 GLU A 311 -4.959 -4.062 -12.720 1.00 0.00 O ATOM 0 H GLU A 311 -7.433 -2.168 -9.422 1.00 0.00 H new ATOM 0 HA GLU A 311 -5.607 -0.066 -9.175 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -4.360 -1.229 -10.781 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -5.311 -2.490 -10.023 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -6.839 -2.585 -11.876 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -6.199 -1.109 -12.571 1.00 0.00 H new ATOM 1041 N ASN A 312 -7.957 0.550 -11.230 1.00 0.00 N ATOM 1042 CA ASN A 312 -8.512 1.518 -12.169 1.00 0.00 C ATOM 1043 C ASN A 312 -9.007 2.762 -11.438 1.00 0.00 C ATOM 1044 O ASN A 312 -9.826 3.518 -11.962 1.00 0.00 O ATOM 1045 CB ASN A 312 -9.658 0.890 -12.965 1.00 0.00 C ATOM 1046 CG ASN A 312 -9.167 0.121 -14.176 1.00 0.00 C ATOM 1047 OD1 ASN A 312 -7.991 -0.231 -14.267 1.00 0.00 O ATOM 1048 ND2 ASN A 312 -10.069 -0.144 -15.114 1.00 0.00 N ATOM 0 H ASN A 312 -8.644 -0.088 -10.827 1.00 0.00 H new ATOM 0 HA ASN A 312 -7.720 1.813 -12.858 1.00 0.00 H new ATOM 0 HB2 ASN A 312 -10.223 0.220 -12.317 1.00 0.00 H new ATOM 0 HB3 ASN A 312 -10.344 1.673 -13.289 1.00 0.00 H new ATOM 0 HD21 ASN A 312 -9.798 -0.659 -15.952 1.00 0.00 H new ATOM 0 HD22 ASN A 312 -11.033 0.167 -14.997 1.00 0.00 H new ATOM 1055 N TYR A 313 -8.504 2.969 -10.226 1.00 0.00 N ATOM 1056 CA TYR A 313 -8.897 4.121 -9.423 1.00 0.00 C ATOM 1057 C TYR A 313 -7.671 4.874 -8.915 1.00 0.00 C ATOM 1058 O TYR A 313 -7.792 5.912 -8.264 1.00 0.00 O ATOM 1059 CB TYR A 313 -9.760 3.674 -8.241 1.00 0.00 C ATOM 1060 CG TYR A 313 -11.191 3.367 -8.619 1.00 0.00 C ATOM 1061 CD1 TYR A 313 -11.487 2.377 -9.548 1.00 0.00 C ATOM 1062 CD2 TYR A 313 -12.247 4.066 -8.048 1.00 0.00 C ATOM 1063 CE1 TYR A 313 -12.793 2.093 -9.897 1.00 0.00 C ATOM 1064 CE2 TYR A 313 -13.556 3.787 -8.390 1.00 0.00 C ATOM 1065 CZ TYR A 313 -13.824 2.800 -9.315 1.00 0.00 C ATOM 1066 OH TYR A 313 -15.127 2.521 -9.659 1.00 0.00 O ATOM 0 H TYR A 313 -7.824 2.355 -9.778 1.00 0.00 H new ATOM 0 HA TYR A 313 -9.478 4.792 -10.056 1.00 0.00 H new ATOM 0 HB2 TYR A 313 -9.314 2.787 -7.791 1.00 0.00 H new ATOM 0 HB3 TYR A 313 -9.753 4.455 -7.481 1.00 0.00 H new ATOM 0 HD1 TYR A 313 -10.682 1.820 -10.005 1.00 0.00 H new ATOM 0 HD2 TYR A 313 -12.041 4.841 -7.324 1.00 0.00 H new ATOM 0 HE1 TYR A 313 -13.006 1.321 -10.622 1.00 0.00 H new ATOM 0 HE2 TYR A 313 -14.365 4.339 -7.935 1.00 0.00 H new ATOM 0 HH TYR A 313 -15.731 3.108 -9.157 1.00 0.00 H new ATOM 1076 N ILE A 314 -6.491 4.343 -9.219 1.00 0.00 N ATOM 1077 CA ILE A 314 -5.243 4.966 -8.796 1.00 0.00 C ATOM 1078 C ILE A 314 -4.275 5.109 -9.966 1.00 0.00 C ATOM 1079 O ILE A 314 -4.570 4.687 -11.085 1.00 0.00 O ATOM 1080 CB ILE A 314 -4.561 4.156 -7.677 1.00 0.00 C ATOM 1081 CG1 ILE A 314 -4.403 2.694 -8.100 1.00 0.00 C ATOM 1082 CG2 ILE A 314 -5.361 4.257 -6.387 1.00 0.00 C ATOM 1083 CD1 ILE A 314 -3.155 2.432 -8.914 1.00 0.00 C ATOM 0 H ILE A 314 -6.373 3.484 -9.756 1.00 0.00 H new ATOM 0 HA ILE A 314 -5.497 5.955 -8.415 1.00 0.00 H new ATOM 0 HB ILE A 314 -3.569 4.572 -7.500 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -4.384 2.066 -7.209 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -5.275 2.396 -8.681 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -4.866 3.680 -5.606 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -5.426 5.301 -6.080 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -6.364 3.863 -6.549 1.00 0.00 H new ATOM 0 HD11 ILE A 314 -3.108 1.376 -9.179 1.00 0.00 H new ATOM 0 HD12 ILE A 314 -3.181 3.033 -9.823 1.00 0.00 H new ATOM 0 HD13 ILE A 314 -2.276 2.698 -8.328 1.00 0.00 H new ATOM 1095 N THR A 315 -3.117 5.705 -9.700 1.00 0.00 N ATOM 1096 CA THR A 315 -2.106 5.904 -10.730 1.00 0.00 C ATOM 1097 C THR A 315 -0.709 5.976 -10.123 1.00 0.00 C ATOM 1098 O THR A 315 -0.554 6.189 -8.921 1.00 0.00 O ATOM 1099 CB THR A 315 -2.369 7.189 -11.537 1.00 0.00 C ATOM 1100 OG1 THR A 315 -1.675 7.134 -12.788 1.00 0.00 O ATOM 1101 CG2 THR A 315 -1.924 8.418 -10.757 1.00 0.00 C ATOM 0 H THR A 315 -2.856 6.058 -8.779 1.00 0.00 H new ATOM 0 HA THR A 315 -2.165 5.046 -11.399 1.00 0.00 H new ATOM 0 HB THR A 315 -3.441 7.263 -11.721 1.00 0.00 H new ATOM 0 HG1 THR A 315 -1.849 7.954 -13.295 1.00 0.00 H new ATOM 0 HG21 THR A 315 -2.119 9.314 -11.347 1.00 0.00 H new ATOM 0 HG22 THR A 315 -2.476 8.473 -9.819 1.00 0.00 H new ATOM 0 HG23 THR A 315 -0.857 8.348 -10.546 1.00 0.00 H new ATOM 1109 N LYS A 316 0.305 5.797 -10.962 1.00 0.00 N ATOM 1110 CA LYS A 316 1.691 5.843 -10.509 1.00 0.00 C ATOM 1111 C LYS A 316 2.062 7.246 -10.039 1.00 0.00 C ATOM 1112 O LYS A 316 1.554 8.239 -10.557 1.00 0.00 O ATOM 1113 CB LYS A 316 2.632 5.405 -11.633 1.00 0.00 C ATOM 1114 CG LYS A 316 2.801 3.898 -11.731 1.00 0.00 C ATOM 1115 CD LYS A 316 3.946 3.408 -10.860 1.00 0.00 C ATOM 1116 CE LYS A 316 3.779 1.942 -10.494 1.00 0.00 C ATOM 1117 NZ LYS A 316 4.850 1.475 -9.570 1.00 0.00 N ATOM 0 H LYS A 316 0.194 5.619 -11.960 1.00 0.00 H new ATOM 0 HA LYS A 316 1.796 5.157 -9.669 1.00 0.00 H new ATOM 0 HB2 LYS A 316 2.251 5.782 -12.582 1.00 0.00 H new ATOM 0 HB3 LYS A 316 3.609 5.863 -11.477 1.00 0.00 H new ATOM 0 HG2 LYS A 316 1.876 3.407 -11.428 1.00 0.00 H new ATOM 0 HG3 LYS A 316 2.986 3.618 -12.768 1.00 0.00 H new ATOM 0 HD2 LYS A 316 4.890 3.548 -11.386 1.00 0.00 H new ATOM 0 HD3 LYS A 316 3.996 4.008 -9.951 1.00 0.00 H new ATOM 0 HE2 LYS A 316 2.806 1.793 -10.026 1.00 0.00 H new ATOM 0 HE3 LYS A 316 3.793 1.337 -11.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 4.499 0.673 -9.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 5.678 1.174 -10.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 5.122 2.251 -8.933 1.00 0.00 H new ATOM 1131 N ALA A 317 2.953 7.319 -9.055 1.00 0.00 N ATOM 1132 CA ALA A 317 3.395 8.600 -8.518 1.00 0.00 C ATOM 1133 C ALA A 317 4.249 9.354 -9.531 1.00 0.00 C ATOM 1134 O ALA A 317 5.466 9.175 -9.587 1.00 0.00 O ATOM 1135 CB ALA A 317 4.168 8.391 -7.224 1.00 0.00 C ATOM 0 H ALA A 317 3.383 6.506 -8.614 1.00 0.00 H new ATOM 0 HA ALA A 317 2.511 9.202 -8.307 1.00 0.00 H new ATOM 0 HB1 ALA A 317 4.492 9.356 -6.834 1.00 0.00 H new ATOM 0 HB2 ALA A 317 3.526 7.901 -6.492 1.00 0.00 H new ATOM 0 HB3 ALA A 317 5.040 7.767 -7.418 1.00 0.00 H new