USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=19 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 300 SER OG : rot -146:sc= 0.123 USER MOD Set 1.2: A 303 THR OG1 : rot 180:sc= -1 USER MOD Set 1.3: A 305 CYS SG : rot 180:sc= 0 USER MOD Set 2.1: A 297 TYR OH : rot 123:sc= 0.678 USER MOD Set 2.2: A 306 SER OG : rot 113:sc= 0.0463 USER MOD Set 3.1: A 288 GLN : amide:sc= -0.045 X(o=-0.33,f=-0.82) USER MOD Set 3.2: A 291 THR OG1 : rot 110:sc= -0.288 USER MOD Single : A 258 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= -0.101 K(o=-0.1,f=-1.4) USER MOD Single : A 263 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 TYR OH : rot 150: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=-0.088) USER MOD Single : A 269 ASN : amide:sc= -1.81 K(o=-1.8,f=-2.3) USER MOD Single : A 283 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 284 SER OG : rot -170:sc= 0 USER MOD Single : A 286 MET CE :methyl 169:sc= -2.3 (180deg=-2.38) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0 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 302 THR OG1 : rot 25:sc= -0.109 USER MOD Single : A 312 ASN : amide:sc= 0 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N GLU A 257 5.721 0.830 -3.245 1.00 0.00 N ATOM 218 CA GLU A 257 5.538 1.850 -4.271 1.00 0.00 C ATOM 219 C GLU A 257 4.581 2.938 -3.793 1.00 0.00 C ATOM 220 O GLU A 257 4.010 2.846 -2.706 1.00 0.00 O ATOM 221 CB GLU A 257 5.007 1.218 -5.560 1.00 0.00 C ATOM 222 CG GLU A 257 6.096 0.642 -6.449 1.00 0.00 C ATOM 223 CD GLU A 257 7.116 1.682 -6.872 1.00 0.00 C ATOM 224 OE1 GLU A 257 6.750 2.588 -7.650 1.00 0.00 O ATOM 225 OE2 GLU A 257 8.278 1.589 -6.425 1.00 0.00 O ATOM 0 HA GLU A 257 6.508 2.306 -4.471 1.00 0.00 H new ATOM 0 HB2 GLU A 257 4.303 0.427 -5.303 1.00 0.00 H new ATOM 0 HB3 GLU A 257 4.451 1.969 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU A 257 6.603 -0.164 -5.919 1.00 0.00 H new ATOM 0 HG3 GLU A 257 5.641 0.203 -7.337 1.00 0.00 H new ATOM 232 N THR A 258 4.411 3.970 -4.614 1.00 0.00 N ATOM 233 CA THR A 258 3.525 5.078 -4.275 1.00 0.00 C ATOM 234 C THR A 258 2.616 5.432 -5.446 1.00 0.00 C ATOM 235 O THR A 258 3.085 5.669 -6.560 1.00 0.00 O ATOM 236 CB THR A 258 4.323 6.329 -3.863 1.00 0.00 C ATOM 237 OG1 THR A 258 5.488 5.946 -3.123 1.00 0.00 O ATOM 238 CG2 THR A 258 3.467 7.264 -3.022 1.00 0.00 C ATOM 0 H THR A 258 4.875 4.062 -5.518 1.00 0.00 H new ATOM 0 HA THR A 258 2.917 4.750 -3.432 1.00 0.00 H new ATOM 0 HB THR A 258 4.625 6.854 -4.769 1.00 0.00 H new ATOM 0 HG1 THR A 258 5.991 6.747 -2.866 1.00 0.00 H new ATOM 0 HG21 THR A 258 4.052 8.140 -2.743 1.00 0.00 H new ATOM 0 HG22 THR A 258 2.596 7.577 -3.598 1.00 0.00 H new ATOM 0 HG23 THR A 258 3.138 6.745 -2.121 1.00 0.00 H new ATOM 246 N LEU A 259 1.313 5.466 -5.188 1.00 0.00 N ATOM 247 CA LEU A 259 0.337 5.793 -6.221 1.00 0.00 C ATOM 248 C LEU A 259 -0.625 6.874 -5.739 1.00 0.00 C ATOM 249 O LEU A 259 -0.893 6.991 -4.543 1.00 0.00 O ATOM 250 CB LEU A 259 -0.445 4.542 -6.625 1.00 0.00 C ATOM 251 CG LEU A 259 0.369 3.254 -6.753 1.00 0.00 C ATOM 252 CD1 LEU A 259 -0.551 2.057 -6.940 1.00 0.00 C ATOM 253 CD2 LEU A 259 1.353 3.358 -7.909 1.00 0.00 C ATOM 0 H LEU A 259 0.908 5.271 -4.272 1.00 0.00 H new ATOM 0 HA LEU A 259 0.876 6.173 -7.088 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -1.234 4.378 -5.891 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -0.934 4.736 -7.580 1.00 0.00 H new ATOM 0 HG LEU A 259 0.934 3.111 -5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 259 0.046 1.150 -7.029 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -1.215 1.971 -6.080 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.144 2.192 -7.845 1.00 0.00 H new ATOM 0 HD21 LEU A 259 1.924 2.433 -7.985 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.807 3.525 -8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 259 2.034 4.191 -7.733 1.00 0.00 H new ATOM 265 N GLN A 260 -1.143 7.660 -6.678 1.00 0.00 N ATOM 266 CA GLN A 260 -2.077 8.730 -6.348 1.00 0.00 C ATOM 267 C GLN A 260 -3.487 8.386 -6.815 1.00 0.00 C ATOM 268 O GLN A 260 -3.686 7.937 -7.944 1.00 0.00 O ATOM 269 CB GLN A 260 -1.623 10.045 -6.984 1.00 0.00 C ATOM 270 CG GLN A 260 -2.353 11.265 -6.446 1.00 0.00 C ATOM 271 CD GLN A 260 -2.473 12.374 -7.473 1.00 0.00 C ATOM 272 OE1 GLN A 260 -1.833 12.333 -8.525 1.00 0.00 O ATOM 273 NE2 GLN A 260 -3.295 13.373 -7.173 1.00 0.00 N ATOM 0 H GLN A 260 -0.932 7.576 -7.672 1.00 0.00 H new ATOM 0 HA GLN A 260 -2.091 8.844 -5.264 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -0.553 10.169 -6.817 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -1.773 9.988 -8.062 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -3.349 10.971 -6.116 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -1.826 11.642 -5.570 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -3.805 13.366 -6.290 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -3.416 14.147 -7.826 1.00 0.00 H new ATOM 282 N VAL A 261 -4.464 8.598 -5.939 1.00 0.00 N ATOM 283 CA VAL A 261 -5.856 8.311 -6.262 1.00 0.00 C ATOM 284 C VAL A 261 -6.355 9.208 -7.389 1.00 0.00 C ATOM 285 O VAL A 261 -5.993 10.382 -7.468 1.00 0.00 O ATOM 286 CB VAL A 261 -6.767 8.493 -5.033 1.00 0.00 C ATOM 287 CG1 VAL A 261 -8.229 8.349 -5.426 1.00 0.00 C ATOM 288 CG2 VAL A 261 -6.398 7.497 -3.944 1.00 0.00 C ATOM 0 H VAL A 261 -4.317 8.968 -5.000 1.00 0.00 H new ATOM 0 HA VAL A 261 -5.898 7.271 -6.584 1.00 0.00 H new ATOM 0 HB VAL A 261 -6.619 9.498 -4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.857 8.481 -4.545 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.482 9.106 -6.169 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -8.397 7.357 -5.846 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -7.052 7.640 -3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.515 6.482 -4.324 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -5.362 7.654 -3.643 1.00 0.00 H new ATOM 298 N ILE A 262 -7.189 8.648 -8.259 1.00 0.00 N ATOM 299 CA ILE A 262 -7.740 9.398 -9.381 1.00 0.00 C ATOM 300 C ILE A 262 -9.263 9.445 -9.317 1.00 0.00 C ATOM 301 O ILE A 262 -9.899 10.240 -10.007 1.00 0.00 O ATOM 302 CB ILE A 262 -7.312 8.789 -10.729 1.00 0.00 C ATOM 303 CG1 ILE A 262 -7.188 7.268 -10.610 1.00 0.00 C ATOM 304 CG2 ILE A 262 -5.998 9.398 -11.193 1.00 0.00 C ATOM 305 CD1 ILE A 262 -7.115 6.562 -11.946 1.00 0.00 C ATOM 0 H ILE A 262 -7.498 7.677 -8.208 1.00 0.00 H new ATOM 0 HA ILE A 262 -7.345 10.411 -9.308 1.00 0.00 H new ATOM 0 HB ILE A 262 -8.077 9.016 -11.472 1.00 0.00 H new ATOM 0 HG12 ILE A 262 -6.295 7.028 -10.032 1.00 0.00 H new ATOM 0 HG13 ILE A 262 -8.042 6.884 -10.051 1.00 0.00 H new ATOM 0 HG21 ILE A 262 -5.709 8.957 -12.147 1.00 0.00 H new ATOM 0 HG22 ILE A 262 -6.118 10.475 -11.313 1.00 0.00 H new ATOM 0 HG23 ILE A 262 -5.223 9.199 -10.452 1.00 0.00 H new ATOM 0 HD11 ILE A 262 -7.028 5.487 -11.785 1.00 0.00 H new ATOM 0 HD12 ILE A 262 -8.019 6.772 -12.518 1.00 0.00 H new ATOM 0 HD13 ILE A 262 -6.245 6.918 -12.498 1.00 0.00 H new ATOM 317 N TYR A 263 -9.840 8.588 -8.482 1.00 0.00 N ATOM 318 CA TYR A 263 -11.289 8.531 -8.327 1.00 0.00 C ATOM 319 C TYR A 263 -11.670 7.896 -6.993 1.00 0.00 C ATOM 320 O TYR A 263 -11.020 6.970 -6.509 1.00 0.00 O ATOM 321 CB TYR A 263 -11.915 7.741 -9.477 1.00 0.00 C ATOM 322 CG TYR A 263 -11.544 8.267 -10.846 1.00 0.00 C ATOM 323 CD1 TYR A 263 -12.233 9.332 -11.412 1.00 0.00 C ATOM 324 CD2 TYR A 263 -10.504 7.699 -11.571 1.00 0.00 C ATOM 325 CE1 TYR A 263 -11.899 9.815 -12.662 1.00 0.00 C ATOM 326 CE2 TYR A 263 -10.162 8.177 -12.822 1.00 0.00 C ATOM 327 CZ TYR A 263 -10.862 9.235 -13.363 1.00 0.00 C ATOM 328 OH TYR A 263 -10.525 9.714 -14.608 1.00 0.00 O ATOM 0 H TYR A 263 -9.327 7.924 -7.902 1.00 0.00 H new ATOM 0 HA TYR A 263 -11.671 9.552 -8.345 1.00 0.00 H new ATOM 0 HB2 TYR A 263 -11.605 6.699 -9.401 1.00 0.00 H new ATOM 0 HB3 TYR A 263 -13.000 7.760 -9.371 1.00 0.00 H new ATOM 0 HD1 TYR A 263 -13.044 9.790 -10.865 1.00 0.00 H new ATOM 0 HD2 TYR A 263 -9.954 6.870 -11.150 1.00 0.00 H new ATOM 0 HE1 TYR A 263 -12.447 10.642 -13.088 1.00 0.00 H new ATOM 0 HE2 TYR A 263 -9.351 7.724 -13.373 1.00 0.00 H new ATOM 0 HH TYR A 263 -9.773 9.196 -14.965 1.00 0.00 H new ATOM 338 N PRO A 264 -12.751 8.406 -6.383 1.00 0.00 N ATOM 339 CA PRO A 264 -13.245 7.905 -5.098 1.00 0.00 C ATOM 340 C PRO A 264 -13.847 6.509 -5.213 1.00 0.00 C ATOM 341 O PRO A 264 -14.345 6.122 -6.270 1.00 0.00 O ATOM 342 CB PRO A 264 -14.321 8.922 -4.710 1.00 0.00 C ATOM 343 CG PRO A 264 -14.779 9.500 -6.005 1.00 0.00 C ATOM 344 CD PRO A 264 -13.574 9.511 -6.903 1.00 0.00 C ATOM 0 HA PRO A 264 -12.446 7.810 -4.363 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -15.143 8.445 -4.176 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -13.919 9.693 -4.052 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -15.582 8.902 -6.437 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -15.171 10.507 -5.866 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -13.848 9.351 -7.946 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -13.045 10.463 -6.855 1.00 0.00 H new ATOM 352 N TYR A 265 -13.799 5.757 -4.118 1.00 0.00 N ATOM 353 CA TYR A 265 -14.339 4.403 -4.098 1.00 0.00 C ATOM 354 C TYR A 265 -15.093 4.137 -2.798 1.00 0.00 C ATOM 355 O TYR A 265 -14.714 4.626 -1.734 1.00 0.00 O ATOM 356 CB TYR A 265 -13.214 3.380 -4.265 1.00 0.00 C ATOM 357 CG TYR A 265 -13.650 1.954 -4.019 1.00 0.00 C ATOM 358 CD1 TYR A 265 -14.593 1.344 -4.838 1.00 0.00 C ATOM 359 CD2 TYR A 265 -13.121 1.216 -2.968 1.00 0.00 C ATOM 360 CE1 TYR A 265 -14.996 0.041 -4.616 1.00 0.00 C ATOM 361 CE2 TYR A 265 -13.516 -0.088 -2.740 1.00 0.00 C ATOM 362 CZ TYR A 265 -14.454 -0.671 -3.566 1.00 0.00 C ATOM 363 OH TYR A 265 -14.851 -1.969 -3.341 1.00 0.00 O ATOM 0 H TYR A 265 -13.392 6.062 -3.234 1.00 0.00 H new ATOM 0 HA TYR A 265 -15.037 4.305 -4.930 1.00 0.00 H new ATOM 0 HB2 TYR A 265 -12.810 3.458 -5.274 1.00 0.00 H new ATOM 0 HB3 TYR A 265 -12.405 3.627 -3.578 1.00 0.00 H new ATOM 0 HD1 TYR A 265 -15.018 1.898 -5.662 1.00 0.00 H new ATOM 0 HD2 TYR A 265 -12.388 1.670 -2.317 1.00 0.00 H new ATOM 0 HE1 TYR A 265 -15.731 -0.417 -5.261 1.00 0.00 H new ATOM 0 HE2 TYR A 265 -13.093 -0.648 -1.919 1.00 0.00 H new ATOM 0 HH TYR A 265 -14.113 -2.472 -2.938 1.00 0.00 H new ATOM 373 N THR A 266 -16.166 3.357 -2.893 1.00 0.00 N ATOM 374 CA THR A 266 -16.975 3.025 -1.728 1.00 0.00 C ATOM 375 C THR A 266 -16.919 1.532 -1.426 1.00 0.00 C ATOM 376 O THR A 266 -17.633 0.726 -2.024 1.00 0.00 O ATOM 377 CB THR A 266 -18.445 3.442 -1.927 1.00 0.00 C ATOM 378 OG1 THR A 266 -18.510 4.782 -2.428 1.00 0.00 O ATOM 379 CG2 THR A 266 -19.216 3.346 -0.619 1.00 0.00 C ATOM 0 H THR A 266 -16.494 2.944 -3.766 1.00 0.00 H new ATOM 0 HA THR A 266 -16.558 3.579 -0.887 1.00 0.00 H new ATOM 0 HB THR A 266 -18.899 2.762 -2.648 1.00 0.00 H new ATOM 0 HG1 THR A 266 -19.447 5.039 -2.554 1.00 0.00 H new ATOM 0 HG21 THR A 266 -20.251 3.645 -0.784 1.00 0.00 H new ATOM 0 HG22 THR A 266 -19.189 2.319 -0.255 1.00 0.00 H new ATOM 0 HG23 THR A 266 -18.761 4.005 0.121 1.00 0.00 H new ATOM 387 N PRO A 267 -16.051 1.152 -0.477 1.00 0.00 N ATOM 388 CA PRO A 267 -15.882 -0.248 -0.073 1.00 0.00 C ATOM 389 C PRO A 267 -17.094 -0.784 0.681 1.00 0.00 C ATOM 390 O PRO A 267 -18.003 -0.030 1.028 1.00 0.00 O ATOM 391 CB PRO A 267 -14.657 -0.207 0.843 1.00 0.00 C ATOM 392 CG PRO A 267 -14.627 1.184 1.374 1.00 0.00 C ATOM 393 CD PRO A 267 -15.169 2.058 0.277 1.00 0.00 C ATOM 0 HA PRO A 267 -15.767 -0.909 -0.932 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.741 -0.936 1.649 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -13.745 -0.441 0.294 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.232 1.270 2.277 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -13.612 1.478 1.641 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -15.717 2.911 0.677 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.372 2.457 -0.350 1.00 0.00 H new ATOM 401 N GLN A 268 -17.100 -2.089 0.931 1.00 0.00 N ATOM 402 CA GLN A 268 -18.201 -2.725 1.645 1.00 0.00 C ATOM 403 C GLN A 268 -17.689 -3.506 2.851 1.00 0.00 C ATOM 404 O GLN A 268 -18.465 -3.912 3.714 1.00 0.00 O ATOM 405 CB GLN A 268 -18.972 -3.657 0.709 1.00 0.00 C ATOM 406 CG GLN A 268 -19.345 -3.014 -0.618 1.00 0.00 C ATOM 407 CD GLN A 268 -20.692 -2.320 -0.572 1.00 0.00 C ATOM 408 OE1 GLN A 268 -21.708 -2.933 -0.242 1.00 0.00 O ATOM 409 NE2 GLN A 268 -20.708 -1.035 -0.904 1.00 0.00 N ATOM 0 H GLN A 268 -16.355 -2.727 0.650 1.00 0.00 H new ATOM 0 HA GLN A 268 -18.871 -1.942 2.000 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -18.370 -4.545 0.517 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -19.881 -3.991 1.210 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -18.578 -2.291 -0.896 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -19.360 -3.778 -1.396 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -19.842 -0.566 -1.171 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -21.586 -0.516 -0.892 1.00 0.00 H new ATOM 418 N ASN A 269 -16.377 -3.714 2.902 1.00 0.00 N ATOM 419 CA ASN A 269 -15.762 -4.448 4.002 1.00 0.00 C ATOM 420 C ASN A 269 -14.286 -4.086 4.139 1.00 0.00 C ATOM 421 O ASN A 269 -13.765 -3.264 3.385 1.00 0.00 O ATOM 422 CB ASN A 269 -15.910 -5.955 3.783 1.00 0.00 C ATOM 423 CG ASN A 269 -17.345 -6.422 3.929 1.00 0.00 C ATOM 424 OD1 ASN A 269 -17.990 -6.173 4.948 1.00 0.00 O ATOM 425 ND2 ASN A 269 -17.853 -7.104 2.909 1.00 0.00 N ATOM 0 H ASN A 269 -15.720 -3.385 2.195 1.00 0.00 H new ATOM 0 HA ASN A 269 -16.274 -4.169 4.923 1.00 0.00 H new ATOM 0 HB2 ASN A 269 -15.546 -6.212 2.788 1.00 0.00 H new ATOM 0 HB3 ASN A 269 -15.283 -6.487 4.499 1.00 0.00 H new ATOM 0 HD21 ASN A 269 -18.814 -7.444 2.951 1.00 0.00 H new ATOM 0 HD22 ASN A 269 -17.282 -7.288 2.084 1.00 0.00 H new ATOM 432 N ASP A 270 -13.619 -4.704 5.107 1.00 0.00 N ATOM 433 CA ASP A 270 -12.203 -4.448 5.343 1.00 0.00 C ATOM 434 C ASP A 270 -11.358 -4.950 4.177 1.00 0.00 C ATOM 435 O ASP A 270 -10.382 -4.311 3.784 1.00 0.00 O ATOM 436 CB ASP A 270 -11.751 -5.118 6.642 1.00 0.00 C ATOM 437 CG ASP A 270 -11.660 -6.626 6.514 1.00 0.00 C ATOM 438 OD1 ASP A 270 -10.684 -7.112 5.905 1.00 0.00 O ATOM 439 OD2 ASP A 270 -12.564 -7.320 7.024 1.00 0.00 O ATOM 0 H ASP A 270 -14.036 -5.386 5.741 1.00 0.00 H new ATOM 0 HA ASP A 270 -12.064 -3.371 5.431 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -10.778 -4.722 6.933 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -12.449 -4.865 7.440 1.00 0.00 H new ATOM 444 N ASP A 271 -11.739 -6.099 3.629 1.00 0.00 N ATOM 445 CA ASP A 271 -11.017 -6.687 2.507 1.00 0.00 C ATOM 446 C ASP A 271 -10.492 -5.604 1.570 1.00 0.00 C ATOM 447 O ASP A 271 -9.387 -5.712 1.040 1.00 0.00 O ATOM 448 CB ASP A 271 -11.923 -7.649 1.737 1.00 0.00 C ATOM 449 CG ASP A 271 -12.963 -8.303 2.627 1.00 0.00 C ATOM 450 OD1 ASP A 271 -12.570 -9.050 3.547 1.00 0.00 O ATOM 451 OD2 ASP A 271 -14.169 -8.067 2.403 1.00 0.00 O ATOM 0 H ASP A 271 -12.544 -6.641 3.944 1.00 0.00 H new ATOM 0 HA ASP A 271 -10.167 -7.241 2.905 1.00 0.00 H new ATOM 0 HB2 ASP A 271 -12.424 -7.108 0.935 1.00 0.00 H new ATOM 0 HB3 ASP A 271 -11.313 -8.421 1.268 1.00 0.00 H new ATOM 456 N GLU A 272 -11.293 -4.562 1.370 1.00 0.00 N ATOM 457 CA GLU A 272 -10.909 -3.460 0.496 1.00 0.00 C ATOM 458 C GLU A 272 -10.665 -2.187 1.300 1.00 0.00 C ATOM 459 O GLU A 272 -10.921 -2.140 2.504 1.00 0.00 O ATOM 460 CB GLU A 272 -11.992 -3.213 -0.556 1.00 0.00 C ATOM 461 CG GLU A 272 -13.368 -2.956 0.036 1.00 0.00 C ATOM 462 CD GLU A 272 -14.150 -4.234 0.271 1.00 0.00 C ATOM 463 OE1 GLU A 272 -13.542 -5.323 0.199 1.00 0.00 O ATOM 464 OE2 GLU A 272 -15.369 -4.146 0.526 1.00 0.00 O ATOM 0 H GLU A 272 -12.211 -4.458 1.801 1.00 0.00 H new ATOM 0 HA GLU A 272 -9.981 -3.735 -0.006 1.00 0.00 H new ATOM 0 HB2 GLU A 272 -11.704 -2.359 -1.168 1.00 0.00 H new ATOM 0 HB3 GLU A 272 -12.046 -4.076 -1.219 1.00 0.00 H new ATOM 0 HG2 GLU A 272 -13.259 -2.422 0.980 1.00 0.00 H new ATOM 0 HG3 GLU A 272 -13.932 -2.307 -0.634 1.00 0.00 H new ATOM 471 N LEU A 273 -10.168 -1.155 0.626 1.00 0.00 N ATOM 472 CA LEU A 273 -9.889 0.120 1.277 1.00 0.00 C ATOM 473 C LEU A 273 -10.523 1.275 0.508 1.00 0.00 C ATOM 474 O LEU A 273 -10.571 1.261 -0.722 1.00 0.00 O ATOM 475 CB LEU A 273 -8.379 0.337 1.391 1.00 0.00 C ATOM 476 CG LEU A 273 -7.926 1.768 1.682 1.00 0.00 C ATOM 477 CD1 LEU A 273 -7.947 2.041 3.178 1.00 0.00 C ATOM 478 CD2 LEU A 273 -6.537 2.015 1.112 1.00 0.00 C ATOM 0 H LEU A 273 -9.950 -1.177 -0.370 1.00 0.00 H new ATOM 0 HA LEU A 273 -10.323 0.092 2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -7.998 -0.311 2.180 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -7.914 0.012 0.460 1.00 0.00 H new ATOM 0 HG LEU A 273 -8.622 2.454 1.199 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -7.622 3.064 3.366 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -8.960 1.907 3.558 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -7.275 1.348 3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -6.231 3.039 1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -5.829 1.321 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -6.554 1.862 0.033 1.00 0.00 H new ATOM 490 N GLU A 274 -11.007 2.272 1.241 1.00 0.00 N ATOM 491 CA GLU A 274 -11.637 3.435 0.626 1.00 0.00 C ATOM 492 C GLU A 274 -10.626 4.233 -0.191 1.00 0.00 C ATOM 493 O GLU A 274 -9.435 4.252 0.121 1.00 0.00 O ATOM 494 CB GLU A 274 -12.263 4.330 1.698 1.00 0.00 C ATOM 495 CG GLU A 274 -13.130 5.442 1.132 1.00 0.00 C ATOM 496 CD GLU A 274 -13.165 6.666 2.026 1.00 0.00 C ATOM 497 OE1 GLU A 274 -14.025 6.717 2.930 1.00 0.00 O ATOM 498 OE2 GLU A 274 -12.332 7.574 1.822 1.00 0.00 O ATOM 0 H GLU A 274 -10.975 2.298 2.260 1.00 0.00 H new ATOM 0 HA GLU A 274 -12.420 3.080 -0.044 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -12.866 3.715 2.366 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -11.469 4.771 2.300 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -12.755 5.725 0.149 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -14.145 5.070 0.991 1.00 0.00 H new ATOM 505 N LEU A 275 -11.109 4.891 -1.240 1.00 0.00 N ATOM 506 CA LEU A 275 -10.248 5.691 -2.104 1.00 0.00 C ATOM 507 C LEU A 275 -10.654 7.161 -2.066 1.00 0.00 C ATOM 508 O LEU A 275 -11.816 7.501 -2.286 1.00 0.00 O ATOM 509 CB LEU A 275 -10.309 5.170 -3.541 1.00 0.00 C ATOM 510 CG LEU A 275 -9.865 3.722 -3.750 1.00 0.00 C ATOM 511 CD1 LEU A 275 -10.415 3.179 -5.060 1.00 0.00 C ATOM 512 CD2 LEU A 275 -8.347 3.621 -3.723 1.00 0.00 C ATOM 0 H LEU A 275 -12.092 4.886 -1.512 1.00 0.00 H new ATOM 0 HA LEU A 275 -9.225 5.606 -1.736 1.00 0.00 H new ATOM 0 HB2 LEU A 275 -11.334 5.270 -3.899 1.00 0.00 H new ATOM 0 HB3 LEU A 275 -9.689 5.813 -4.166 1.00 0.00 H new ATOM 0 HG LEU A 275 -10.264 3.118 -2.935 1.00 0.00 H new ATOM 0 HD11 LEU A 275 -10.089 2.147 -5.192 1.00 0.00 H new ATOM 0 HD12 LEU A 275 -11.504 3.215 -5.040 1.00 0.00 H new ATOM 0 HD13 LEU A 275 -10.047 3.785 -5.888 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -8.049 2.583 -3.873 1.00 0.00 H new ATOM 0 HD22 LEU A 275 -7.927 4.238 -4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 275 -7.976 3.969 -2.759 1.00 0.00 H new ATOM 524 N VAL A 276 -9.687 8.029 -1.787 1.00 0.00 N ATOM 525 CA VAL A 276 -9.942 9.463 -1.723 1.00 0.00 C ATOM 526 C VAL A 276 -9.123 10.214 -2.767 1.00 0.00 C ATOM 527 O VAL A 276 -7.920 10.002 -2.919 1.00 0.00 O ATOM 528 CB VAL A 276 -9.618 10.030 -0.328 1.00 0.00 C ATOM 529 CG1 VAL A 276 -9.817 11.538 -0.304 1.00 0.00 C ATOM 530 CG2 VAL A 276 -10.473 9.354 0.733 1.00 0.00 C ATOM 0 H VAL A 276 -8.720 7.764 -1.602 1.00 0.00 H new ATOM 0 HA VAL A 276 -11.003 9.604 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 276 -8.571 9.823 -0.105 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -9.583 11.920 0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -9.157 12.004 -1.036 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -10.853 11.772 -0.548 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -10.231 9.767 1.712 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -11.527 9.528 0.516 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -10.275 8.282 0.732 1.00 0.00 H new ATOM 540 N PRO A 277 -9.788 11.115 -3.505 1.00 0.00 N ATOM 541 CA PRO A 277 -9.142 11.917 -4.548 1.00 0.00 C ATOM 542 C PRO A 277 -8.182 12.953 -3.971 1.00 0.00 C ATOM 543 O PRO A 277 -8.605 13.920 -3.339 1.00 0.00 O ATOM 544 CB PRO A 277 -10.317 12.606 -5.245 1.00 0.00 C ATOM 545 CG PRO A 277 -11.391 12.658 -4.215 1.00 0.00 C ATOM 546 CD PRO A 277 -11.223 11.420 -3.379 1.00 0.00 C ATOM 0 HA PRO A 277 -8.533 11.306 -5.214 1.00 0.00 H new ATOM 0 HB2 PRO A 277 -10.045 13.606 -5.584 1.00 0.00 H new ATOM 0 HB3 PRO A 277 -10.638 12.048 -6.124 1.00 0.00 H new ATOM 0 HG2 PRO A 277 -11.303 13.556 -3.604 1.00 0.00 H new ATOM 0 HG3 PRO A 277 -12.377 12.684 -4.680 1.00 0.00 H new ATOM 0 HD2 PRO A 277 -11.507 11.594 -2.341 1.00 0.00 H new ATOM 0 HD3 PRO A 277 -11.842 10.601 -3.745 1.00 0.00 H new ATOM 554 N GLY A 278 -6.888 12.743 -4.194 1.00 0.00 N ATOM 555 CA GLY A 278 -5.890 13.668 -3.690 1.00 0.00 C ATOM 556 C GLY A 278 -4.982 13.033 -2.654 1.00 0.00 C ATOM 557 O GLY A 278 -4.136 13.706 -2.065 1.00 0.00 O ATOM 0 H GLY A 278 -6.514 11.950 -4.714 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -5.287 14.036 -4.521 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -6.389 14.532 -3.251 1.00 0.00 H new ATOM 561 N ASP A 279 -5.159 11.736 -2.431 1.00 0.00 N ATOM 562 CA ASP A 279 -4.350 11.010 -1.459 1.00 0.00 C ATOM 563 C ASP A 279 -3.412 10.030 -2.156 1.00 0.00 C ATOM 564 O ASP A 279 -3.507 9.817 -3.365 1.00 0.00 O ATOM 565 CB ASP A 279 -5.248 10.262 -0.472 1.00 0.00 C ATOM 566 CG ASP A 279 -4.569 10.020 0.861 1.00 0.00 C ATOM 567 OD1 ASP A 279 -3.565 10.706 1.148 1.00 0.00 O ATOM 568 OD2 ASP A 279 -5.040 9.145 1.618 1.00 0.00 O ATOM 0 H ASP A 279 -5.856 11.165 -2.910 1.00 0.00 H new ATOM 0 HA ASP A 279 -3.747 11.735 -0.912 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -6.162 10.834 -0.312 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -5.542 9.306 -0.905 1.00 0.00 H new ATOM 573 N PHE A 280 -2.506 9.436 -1.386 1.00 0.00 N ATOM 574 CA PHE A 280 -1.549 8.480 -1.930 1.00 0.00 C ATOM 575 C PHE A 280 -1.818 7.077 -1.394 1.00 0.00 C ATOM 576 O PHE A 280 -2.590 6.898 -0.452 1.00 0.00 O ATOM 577 CB PHE A 280 -0.120 8.904 -1.587 1.00 0.00 C ATOM 578 CG PHE A 280 0.422 9.973 -2.493 1.00 0.00 C ATOM 579 CD1 PHE A 280 0.636 9.716 -3.837 1.00 0.00 C ATOM 580 CD2 PHE A 280 0.718 11.233 -2.000 1.00 0.00 C ATOM 581 CE1 PHE A 280 1.135 10.697 -4.673 1.00 0.00 C ATOM 582 CE2 PHE A 280 1.218 12.218 -2.831 1.00 0.00 C ATOM 583 CZ PHE A 280 1.426 11.950 -4.169 1.00 0.00 C ATOM 0 H PHE A 280 -2.415 9.600 -0.383 1.00 0.00 H new ATOM 0 HA PHE A 280 -1.665 8.465 -3.014 1.00 0.00 H new ATOM 0 HB2 PHE A 280 -0.093 9.263 -0.558 1.00 0.00 H new ATOM 0 HB3 PHE A 280 0.531 8.031 -1.637 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.410 8.738 -4.236 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.556 11.448 -0.954 1.00 0.00 H new ATOM 0 HE1 PHE A 280 1.297 10.484 -5.719 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.446 13.196 -2.434 1.00 0.00 H new ATOM 0 HZ PHE A 280 1.815 12.718 -4.821 1.00 0.00 H new ATOM 593 N ILE A 281 -1.175 6.085 -2.002 1.00 0.00 N ATOM 594 CA ILE A 281 -1.344 4.698 -1.585 1.00 0.00 C ATOM 595 C ILE A 281 -0.042 3.917 -1.734 1.00 0.00 C ATOM 596 O ILE A 281 0.608 3.966 -2.779 1.00 0.00 O ATOM 597 CB ILE A 281 -2.446 3.996 -2.400 1.00 0.00 C ATOM 598 CG1 ILE A 281 -3.677 4.898 -2.518 1.00 0.00 C ATOM 599 CG2 ILE A 281 -2.816 2.668 -1.756 1.00 0.00 C ATOM 600 CD1 ILE A 281 -4.403 5.104 -1.207 1.00 0.00 C ATOM 0 H ILE A 281 -0.533 6.216 -2.784 1.00 0.00 H new ATOM 0 HA ILE A 281 -1.636 4.717 -0.535 1.00 0.00 H new ATOM 0 HB ILE A 281 -2.066 3.799 -3.402 1.00 0.00 H new ATOM 0 HG12 ILE A 281 -3.371 5.868 -2.911 1.00 0.00 H new ATOM 0 HG13 ILE A 281 -4.367 4.465 -3.242 1.00 0.00 H new ATOM 0 HG21 ILE A 281 -3.596 2.184 -2.343 1.00 0.00 H new ATOM 0 HG22 ILE A 281 -1.937 2.024 -1.719 1.00 0.00 H new ATOM 0 HG23 ILE A 281 -3.180 2.843 -0.744 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -5.264 5.753 -1.366 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -4.740 4.141 -0.823 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -3.728 5.566 -0.486 1.00 0.00 H new ATOM 612 N PHE A 282 0.332 3.196 -0.683 1.00 0.00 N ATOM 613 CA PHE A 282 1.556 2.403 -0.696 1.00 0.00 C ATOM 614 C PHE A 282 1.276 0.979 -1.168 1.00 0.00 C ATOM 615 O PHE A 282 0.489 0.255 -0.559 1.00 0.00 O ATOM 616 CB PHE A 282 2.186 2.376 0.698 1.00 0.00 C ATOM 617 CG PHE A 282 2.743 3.702 1.130 1.00 0.00 C ATOM 618 CD1 PHE A 282 3.703 4.347 0.367 1.00 0.00 C ATOM 619 CD2 PHE A 282 2.307 4.303 2.300 1.00 0.00 C ATOM 620 CE1 PHE A 282 4.218 5.567 0.762 1.00 0.00 C ATOM 621 CE2 PHE A 282 2.818 5.524 2.699 1.00 0.00 C ATOM 622 CZ PHE A 282 3.775 6.156 1.930 1.00 0.00 C ATOM 0 H PHE A 282 -0.195 3.144 0.189 1.00 0.00 H new ATOM 0 HA PHE A 282 2.253 2.868 -1.393 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.436 2.053 1.420 1.00 0.00 H new ATOM 0 HB3 PHE A 282 2.984 1.634 0.713 1.00 0.00 H new ATOM 0 HD1 PHE A 282 4.053 3.891 -0.547 1.00 0.00 H new ATOM 0 HD2 PHE A 282 1.560 3.812 2.907 1.00 0.00 H new ATOM 0 HE1 PHE A 282 4.966 6.059 0.158 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.469 5.983 3.612 1.00 0.00 H new ATOM 0 HZ PHE A 282 4.176 7.109 2.241 1.00 0.00 H new ATOM 632 N MET A 283 1.926 0.586 -2.258 1.00 0.00 N ATOM 633 CA MET A 283 1.749 -0.752 -2.812 1.00 0.00 C ATOM 634 C MET A 283 2.895 -1.668 -2.398 1.00 0.00 C ATOM 635 O MET A 283 4.066 -1.330 -2.571 1.00 0.00 O ATOM 636 CB MET A 283 1.658 -0.687 -4.338 1.00 0.00 C ATOM 637 CG MET A 283 0.821 -1.801 -4.945 1.00 0.00 C ATOM 638 SD MET A 283 1.363 -3.440 -4.422 1.00 0.00 S ATOM 639 CE MET A 283 2.701 -3.738 -5.575 1.00 0.00 C ATOM 0 H MET A 283 2.580 1.174 -2.775 1.00 0.00 H new ATOM 0 HA MET A 283 0.820 -1.162 -2.417 1.00 0.00 H new ATOM 0 HB2 MET A 283 1.234 0.274 -4.628 1.00 0.00 H new ATOM 0 HB3 MET A 283 2.664 -0.730 -4.756 1.00 0.00 H new ATOM 0 HG2 MET A 283 -0.223 -1.661 -4.664 1.00 0.00 H new ATOM 0 HG3 MET A 283 0.870 -1.736 -6.032 1.00 0.00 H new ATOM 0 HE1 MET A 283 3.139 -4.716 -5.379 1.00 0.00 H new ATOM 0 HE2 MET A 283 2.316 -3.711 -6.594 1.00 0.00 H new ATOM 0 HE3 MET A 283 3.463 -2.968 -5.455 1.00 0.00 H new ATOM 649 N SER A 284 2.551 -2.829 -1.851 1.00 0.00 N ATOM 650 CA SER A 284 3.552 -3.793 -1.408 1.00 0.00 C ATOM 651 C SER A 284 3.297 -5.164 -2.027 1.00 0.00 C ATOM 652 O SER A 284 2.186 -5.693 -1.991 1.00 0.00 O ATOM 653 CB SER A 284 3.547 -3.901 0.118 1.00 0.00 C ATOM 654 OG SER A 284 2.246 -4.184 0.605 1.00 0.00 O ATOM 0 H SER A 284 1.586 -3.125 -1.704 1.00 0.00 H new ATOM 0 HA SER A 284 4.530 -3.441 -1.737 1.00 0.00 H new ATOM 0 HB2 SER A 284 4.235 -4.686 0.432 1.00 0.00 H new ATOM 0 HB3 SER A 284 3.907 -2.969 0.553 1.00 0.00 H new ATOM 0 HG SER A 284 2.235 -4.093 1.581 1.00 0.00 H new ATOM 660 N PRO A 285 4.351 -5.754 -2.610 1.00 0.00 N ATOM 661 CA PRO A 285 4.269 -7.071 -3.248 1.00 0.00 C ATOM 662 C PRO A 285 4.075 -8.195 -2.236 1.00 0.00 C ATOM 663 O PRO A 285 3.751 -9.324 -2.603 1.00 0.00 O ATOM 664 CB PRO A 285 5.622 -7.211 -3.950 1.00 0.00 C ATOM 665 CG PRO A 285 6.542 -6.332 -3.176 1.00 0.00 C ATOM 666 CD PRO A 285 5.706 -5.181 -2.690 1.00 0.00 C ATOM 0 HA PRO A 285 3.415 -7.145 -3.921 1.00 0.00 H new ATOM 0 HB2 PRO A 285 5.965 -8.245 -3.945 1.00 0.00 H new ATOM 0 HB3 PRO A 285 5.561 -6.900 -4.993 1.00 0.00 H new ATOM 0 HG2 PRO A 285 6.986 -6.872 -2.340 1.00 0.00 H new ATOM 0 HG3 PRO A 285 7.363 -5.981 -3.801 1.00 0.00 H new ATOM 0 HD2 PRO A 285 6.047 -4.818 -1.720 1.00 0.00 H new ATOM 0 HD3 PRO A 285 5.745 -4.337 -3.378 1.00 0.00 H new ATOM 674 N MET A 286 4.276 -7.877 -0.961 1.00 0.00 N ATOM 675 CA MET A 286 4.121 -8.861 0.104 1.00 0.00 C ATOM 676 C MET A 286 2.654 -9.017 0.492 1.00 0.00 C ATOM 677 O MET A 286 2.255 -10.042 1.044 1.00 0.00 O ATOM 678 CB MET A 286 4.944 -8.452 1.328 1.00 0.00 C ATOM 679 CG MET A 286 6.441 -8.417 1.070 1.00 0.00 C ATOM 680 SD MET A 286 7.046 -9.922 0.284 1.00 0.00 S ATOM 681 CE MET A 286 7.312 -9.346 -1.391 1.00 0.00 C ATOM 0 H MET A 286 4.546 -6.947 -0.641 1.00 0.00 H new ATOM 0 HA MET A 286 4.484 -9.820 -0.266 1.00 0.00 H new ATOM 0 HB2 MET A 286 4.618 -7.467 1.662 1.00 0.00 H new ATOM 0 HB3 MET A 286 4.740 -9.148 2.142 1.00 0.00 H new ATOM 0 HG2 MET A 286 6.677 -7.561 0.437 1.00 0.00 H new ATOM 0 HG3 MET A 286 6.965 -8.269 2.014 1.00 0.00 H new ATOM 0 HE1 MET A 286 7.866 -10.099 -1.951 1.00 0.00 H new ATOM 0 HE2 MET A 286 6.350 -9.170 -1.872 1.00 0.00 H new ATOM 0 HE3 MET A 286 7.882 -8.417 -1.370 1.00 0.00 H new ATOM 691 N GLU A 287 1.857 -7.995 0.198 1.00 0.00 N ATOM 692 CA GLU A 287 0.435 -8.020 0.518 1.00 0.00 C ATOM 693 C GLU A 287 -0.408 -8.074 -0.753 1.00 0.00 C ATOM 694 O GLU A 287 -1.483 -7.479 -0.823 1.00 0.00 O ATOM 695 CB GLU A 287 0.053 -6.789 1.343 1.00 0.00 C ATOM 696 CG GLU A 287 0.823 -6.668 2.648 1.00 0.00 C ATOM 697 CD GLU A 287 0.048 -5.923 3.716 1.00 0.00 C ATOM 698 OE1 GLU A 287 -1.077 -6.356 4.043 1.00 0.00 O ATOM 699 OE2 GLU A 287 0.565 -4.907 4.226 1.00 0.00 O ATOM 0 H GLU A 287 2.172 -7.140 -0.261 1.00 0.00 H new ATOM 0 HA GLU A 287 0.237 -8.918 1.104 1.00 0.00 H new ATOM 0 HB2 GLU A 287 0.225 -5.894 0.745 1.00 0.00 H new ATOM 0 HB3 GLU A 287 -1.014 -6.826 1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 287 1.071 -7.665 3.013 1.00 0.00 H new ATOM 0 HG3 GLU A 287 1.766 -6.153 2.463 1.00 0.00 H new ATOM 706 N GLN A 288 0.090 -8.791 -1.755 1.00 0.00 N ATOM 707 CA GLN A 288 -0.616 -8.922 -3.025 1.00 0.00 C ATOM 708 C GLN A 288 -1.655 -10.037 -2.957 1.00 0.00 C ATOM 709 O GLN A 288 -1.377 -11.182 -3.315 1.00 0.00 O ATOM 710 CB GLN A 288 0.374 -9.199 -4.157 1.00 0.00 C ATOM 711 CG GLN A 288 1.301 -8.031 -4.454 1.00 0.00 C ATOM 712 CD GLN A 288 0.719 -7.069 -5.471 1.00 0.00 C ATOM 713 OE1 GLN A 288 -0.036 -6.161 -5.122 1.00 0.00 O ATOM 714 NE2 GLN A 288 1.068 -7.263 -6.737 1.00 0.00 N ATOM 0 H GLN A 288 0.979 -9.290 -1.713 1.00 0.00 H new ATOM 0 HA GLN A 288 -1.131 -7.982 -3.225 1.00 0.00 H new ATOM 0 HB2 GLN A 288 0.974 -10.072 -3.898 1.00 0.00 H new ATOM 0 HB3 GLN A 288 -0.181 -9.450 -5.061 1.00 0.00 H new ATOM 0 HG2 GLN A 288 1.510 -7.494 -3.529 1.00 0.00 H new ATOM 0 HG3 GLN A 288 2.253 -8.412 -4.823 1.00 0.00 H new ATOM 0 HE21 GLN A 288 1.697 -8.028 -6.981 1.00 0.00 H new ATOM 0 HE22 GLN A 288 0.708 -6.647 -7.466 1.00 0.00 H new ATOM 723 N THR A 289 -2.853 -9.696 -2.495 1.00 0.00 N ATOM 724 CA THR A 289 -3.933 -10.668 -2.379 1.00 0.00 C ATOM 725 C THR A 289 -5.038 -10.385 -3.391 1.00 0.00 C ATOM 726 O THR A 289 -5.782 -9.413 -3.257 1.00 0.00 O ATOM 727 CB THR A 289 -4.538 -10.669 -0.962 1.00 0.00 C ATOM 728 OG1 THR A 289 -4.775 -9.325 -0.530 1.00 0.00 O ATOM 729 CG2 THR A 289 -3.611 -11.368 0.021 1.00 0.00 C ATOM 0 H THR A 289 -3.100 -8.753 -2.195 1.00 0.00 H new ATOM 0 HA THR A 289 -3.500 -11.648 -2.582 1.00 0.00 H new ATOM 0 HB THR A 289 -5.483 -11.211 -0.994 1.00 0.00 H new ATOM 0 HG1 THR A 289 -5.161 -9.334 0.371 1.00 0.00 H new ATOM 0 HG21 THR A 289 -4.059 -11.356 1.015 1.00 0.00 H new ATOM 0 HG22 THR A 289 -3.456 -12.400 -0.295 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.653 -10.850 0.049 1.00 0.00 H new ATOM 737 N SER A 290 -5.141 -11.241 -4.402 1.00 0.00 N ATOM 738 CA SER A 290 -6.154 -11.081 -5.439 1.00 0.00 C ATOM 739 C SER A 290 -5.962 -9.766 -6.188 1.00 0.00 C ATOM 740 O SER A 290 -6.924 -9.163 -6.665 1.00 0.00 O ATOM 741 CB SER A 290 -7.555 -11.132 -4.825 1.00 0.00 C ATOM 742 OG SER A 290 -7.682 -12.229 -3.937 1.00 0.00 O ATOM 0 H SER A 290 -4.536 -12.053 -4.525 1.00 0.00 H new ATOM 0 HA SER A 290 -6.046 -11.902 -6.148 1.00 0.00 H new ATOM 0 HB2 SER A 290 -7.756 -10.203 -4.292 1.00 0.00 H new ATOM 0 HB3 SER A 290 -8.300 -11.213 -5.617 1.00 0.00 H new ATOM 0 HG SER A 290 -8.585 -12.239 -3.556 1.00 0.00 H new ATOM 748 N THR A 291 -4.712 -9.325 -6.287 1.00 0.00 N ATOM 749 CA THR A 291 -4.392 -8.082 -6.976 1.00 0.00 C ATOM 750 C THR A 291 -4.054 -8.336 -8.440 1.00 0.00 C ATOM 751 O THR A 291 -4.714 -7.814 -9.339 1.00 0.00 O ATOM 752 CB THR A 291 -3.210 -7.356 -6.306 1.00 0.00 C ATOM 753 OG1 THR A 291 -2.009 -8.118 -6.473 1.00 0.00 O ATOM 754 CG2 THR A 291 -3.477 -7.140 -4.824 1.00 0.00 C ATOM 0 H THR A 291 -3.904 -9.811 -5.898 1.00 0.00 H new ATOM 0 HA THR A 291 -5.278 -7.450 -6.915 1.00 0.00 H new ATOM 0 HB THR A 291 -3.092 -6.383 -6.783 1.00 0.00 H new ATOM 0 HG1 THR A 291 -1.411 -7.654 -7.095 1.00 0.00 H new ATOM 0 HG21 THR A 291 -2.629 -6.626 -4.373 1.00 0.00 H new ATOM 0 HG22 THR A 291 -4.375 -6.535 -4.701 1.00 0.00 H new ATOM 0 HG23 THR A 291 -3.619 -8.104 -4.336 1.00 0.00 H new ATOM 762 N SER A 292 -3.022 -9.141 -8.674 1.00 0.00 N ATOM 763 CA SER A 292 -2.595 -9.462 -10.030 1.00 0.00 C ATOM 764 C SER A 292 -3.791 -9.531 -10.975 1.00 0.00 C ATOM 765 O SER A 292 -3.690 -9.170 -12.147 1.00 0.00 O ATOM 766 CB SER A 292 -1.838 -10.791 -10.048 1.00 0.00 C ATOM 767 OG SER A 292 -0.460 -10.598 -9.782 1.00 0.00 O ATOM 0 H SER A 292 -2.466 -9.583 -7.941 1.00 0.00 H new ATOM 0 HA SER A 292 -1.930 -8.669 -10.372 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.264 -11.465 -9.305 1.00 0.00 H new ATOM 0 HB3 SER A 292 -1.960 -11.269 -11.020 1.00 0.00 H new ATOM 0 HG SER A 292 0.000 -11.463 -9.798 1.00 0.00 H new ATOM 773 N GLU A 293 -4.921 -9.998 -10.455 1.00 0.00 N ATOM 774 CA GLU A 293 -6.137 -10.116 -11.252 1.00 0.00 C ATOM 775 C GLU A 293 -6.617 -8.744 -11.717 1.00 0.00 C ATOM 776 O GLU A 293 -6.904 -8.542 -12.896 1.00 0.00 O ATOM 777 CB GLU A 293 -7.238 -10.807 -10.445 1.00 0.00 C ATOM 778 CG GLU A 293 -8.585 -10.829 -11.147 1.00 0.00 C ATOM 779 CD GLU A 293 -8.473 -11.204 -12.612 1.00 0.00 C ATOM 780 OE1 GLU A 293 -8.078 -12.353 -12.901 1.00 0.00 O ATOM 781 OE2 GLU A 293 -8.780 -10.349 -13.469 1.00 0.00 O ATOM 0 H GLU A 293 -5.020 -10.301 -9.486 1.00 0.00 H new ATOM 0 HA GLU A 293 -5.908 -10.719 -12.130 1.00 0.00 H new ATOM 0 HB2 GLU A 293 -6.932 -11.831 -10.232 1.00 0.00 H new ATOM 0 HB3 GLU A 293 -7.346 -10.301 -9.486 1.00 0.00 H new ATOM 0 HG2 GLU A 293 -9.241 -11.539 -10.643 1.00 0.00 H new ATOM 0 HG3 GLU A 293 -9.051 -9.847 -11.062 1.00 0.00 H new ATOM 788 N GLY A 294 -6.703 -7.804 -10.781 1.00 0.00 N ATOM 789 CA GLY A 294 -7.149 -6.464 -11.113 1.00 0.00 C ATOM 790 C GLY A 294 -7.052 -5.512 -9.938 1.00 0.00 C ATOM 791 O GLY A 294 -6.846 -4.312 -10.119 1.00 0.00 O ATOM 0 H GLY A 294 -6.472 -7.947 -9.798 1.00 0.00 H new ATOM 0 HA2 GLY A 294 -6.550 -6.079 -11.938 1.00 0.00 H new ATOM 0 HA3 GLY A 294 -8.182 -6.504 -11.460 1.00 0.00 H new ATOM 795 N TRP A 295 -7.201 -6.047 -8.732 1.00 0.00 N ATOM 796 CA TRP A 295 -7.130 -5.236 -7.522 1.00 0.00 C ATOM 797 C TRP A 295 -5.681 -4.960 -7.135 1.00 0.00 C ATOM 798 O TRP A 295 -4.753 -5.403 -7.813 1.00 0.00 O ATOM 799 CB TRP A 295 -7.853 -5.935 -6.370 1.00 0.00 C ATOM 800 CG TRP A 295 -9.307 -6.179 -6.643 1.00 0.00 C ATOM 801 CD1 TRP A 295 -9.842 -7.187 -7.393 1.00 0.00 C ATOM 802 CD2 TRP A 295 -10.410 -5.399 -6.170 1.00 0.00 C ATOM 803 NE1 TRP A 295 -11.212 -7.080 -7.414 1.00 0.00 N ATOM 804 CE2 TRP A 295 -11.585 -5.992 -6.671 1.00 0.00 C ATOM 805 CE3 TRP A 295 -10.520 -4.258 -5.370 1.00 0.00 C ATOM 806 CZ2 TRP A 295 -12.851 -5.481 -6.398 1.00 0.00 C ATOM 807 CZ3 TRP A 295 -11.777 -3.752 -5.100 1.00 0.00 C ATOM 808 CH2 TRP A 295 -12.929 -4.363 -5.612 1.00 0.00 C ATOM 0 H TRP A 295 -7.372 -7.039 -8.566 1.00 0.00 H new ATOM 0 HA TRP A 295 -7.620 -4.284 -7.725 1.00 0.00 H new ATOM 0 HB2 TRP A 295 -7.364 -6.888 -6.168 1.00 0.00 H new ATOM 0 HB3 TRP A 295 -7.756 -5.329 -5.469 1.00 0.00 H new ATOM 0 HD1 TRP A 295 -9.273 -7.955 -7.895 1.00 0.00 H new ATOM 0 HE1 TRP A 295 -11.848 -7.709 -7.904 1.00 0.00 H new ATOM 0 HE3 TRP A 295 -9.638 -3.780 -4.970 1.00 0.00 H new ATOM 0 HZ2 TRP A 295 -13.740 -5.950 -6.792 1.00 0.00 H new ATOM 0 HZ3 TRP A 295 -11.873 -2.870 -4.484 1.00 0.00 H new ATOM 0 HH2 TRP A 295 -13.897 -3.944 -5.382 1.00 0.00 H new ATOM 819 N ILE A 296 -5.493 -4.227 -6.043 1.00 0.00 N ATOM 820 CA ILE A 296 -4.156 -3.895 -5.567 1.00 0.00 C ATOM 821 C ILE A 296 -4.176 -3.525 -4.088 1.00 0.00 C ATOM 822 O ILE A 296 -4.861 -2.587 -3.681 1.00 0.00 O ATOM 823 CB ILE A 296 -3.547 -2.730 -6.368 1.00 0.00 C ATOM 824 CG1 ILE A 296 -4.623 -1.696 -6.705 1.00 0.00 C ATOM 825 CG2 ILE A 296 -2.886 -3.248 -7.637 1.00 0.00 C ATOM 826 CD1 ILE A 296 -4.093 -0.283 -6.808 1.00 0.00 C ATOM 0 H ILE A 296 -6.250 -3.852 -5.471 1.00 0.00 H new ATOM 0 HA ILE A 296 -3.540 -4.783 -5.709 1.00 0.00 H new ATOM 0 HB ILE A 296 -2.785 -2.247 -5.756 1.00 0.00 H new ATOM 0 HG12 ILE A 296 -5.094 -1.968 -7.650 1.00 0.00 H new ATOM 0 HG13 ILE A 296 -5.399 -1.729 -5.941 1.00 0.00 H new ATOM 0 HG21 ILE A 296 -2.460 -2.412 -8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 296 -2.095 -3.950 -7.375 1.00 0.00 H new ATOM 0 HG23 ILE A 296 -3.629 -3.753 -8.254 1.00 0.00 H new ATOM 0 HD11 ILE A 296 -4.911 0.396 -7.049 1.00 0.00 H new ATOM 0 HD12 ILE A 296 -3.648 0.009 -5.857 1.00 0.00 H new ATOM 0 HD13 ILE A 296 -3.338 -0.234 -7.592 1.00 0.00 H new ATOM 838 N TYR A 297 -3.418 -4.267 -3.288 1.00 0.00 N ATOM 839 CA TYR A 297 -3.348 -4.017 -1.853 1.00 0.00 C ATOM 840 C TYR A 297 -2.549 -2.751 -1.559 1.00 0.00 C ATOM 841 O TYR A 297 -1.335 -2.709 -1.752 1.00 0.00 O ATOM 842 CB TYR A 297 -2.714 -5.211 -1.137 1.00 0.00 C ATOM 843 CG TYR A 297 -2.888 -5.178 0.365 1.00 0.00 C ATOM 844 CD1 TYR A 297 -4.004 -5.744 0.968 1.00 0.00 C ATOM 845 CD2 TYR A 297 -1.934 -4.581 1.181 1.00 0.00 C ATOM 846 CE1 TYR A 297 -4.167 -5.715 2.339 1.00 0.00 C ATOM 847 CE2 TYR A 297 -2.088 -4.549 2.553 1.00 0.00 C ATOM 848 CZ TYR A 297 -3.206 -5.117 3.128 1.00 0.00 C ATOM 849 OH TYR A 297 -3.364 -5.087 4.494 1.00 0.00 O ATOM 0 H TYR A 297 -2.843 -5.046 -3.609 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.364 -3.878 -1.484 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -3.151 -6.131 -1.525 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.650 -5.241 -1.371 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -4.757 -6.215 0.354 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -1.058 -4.135 0.735 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -5.042 -6.158 2.791 1.00 0.00 H new ATOM 0 HE2 TYR A 297 -1.337 -4.082 3.173 1.00 0.00 H new ATOM 0 HH TYR A 297 -2.589 -5.506 4.922 1.00 0.00 H new ATOM 859 N GLY A 298 -3.242 -1.718 -1.088 1.00 0.00 N ATOM 860 CA GLY A 298 -2.583 -0.464 -0.773 1.00 0.00 C ATOM 861 C GLY A 298 -2.916 0.032 0.620 1.00 0.00 C ATOM 862 O GLY A 298 -3.846 -0.462 1.258 1.00 0.00 O ATOM 0 H GLY A 298 -4.248 -1.728 -0.919 1.00 0.00 H new ATOM 0 HA2 GLY A 298 -1.504 -0.592 -0.862 1.00 0.00 H new ATOM 0 HA3 GLY A 298 -2.876 0.290 -1.503 1.00 0.00 H new ATOM 866 N THR A 299 -2.153 1.011 1.096 1.00 0.00 N ATOM 867 CA THR A 299 -2.369 1.572 2.423 1.00 0.00 C ATOM 868 C THR A 299 -2.536 3.086 2.360 1.00 0.00 C ATOM 869 O THR A 299 -1.591 3.812 2.053 1.00 0.00 O ATOM 870 CB THR A 299 -1.203 1.235 3.372 1.00 0.00 C ATOM 871 OG1 THR A 299 -1.072 -0.184 3.503 1.00 0.00 O ATOM 872 CG2 THR A 299 -1.424 1.857 4.743 1.00 0.00 C ATOM 0 H THR A 299 -1.379 1.432 0.581 1.00 0.00 H new ATOM 0 HA THR A 299 -3.284 1.124 2.810 1.00 0.00 H new ATOM 0 HB THR A 299 -0.288 1.646 2.947 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.328 -0.389 4.106 1.00 0.00 H new ATOM 0 HG21 THR A 299 -0.588 1.605 5.396 1.00 0.00 H new ATOM 0 HG22 THR A 299 -1.494 2.940 4.644 1.00 0.00 H new ATOM 0 HG23 THR A 299 -2.349 1.471 5.173 1.00 0.00 H new ATOM 880 N SER A 300 -3.745 3.556 2.652 1.00 0.00 N ATOM 881 CA SER A 300 -4.037 4.984 2.625 1.00 0.00 C ATOM 882 C SER A 300 -2.966 5.772 3.374 1.00 0.00 C ATOM 883 O SER A 300 -2.393 5.289 4.352 1.00 0.00 O ATOM 884 CB SER A 300 -5.410 5.257 3.241 1.00 0.00 C ATOM 885 OG SER A 300 -5.803 6.603 3.035 1.00 0.00 O ATOM 0 H SER A 300 -4.538 2.968 2.910 1.00 0.00 H new ATOM 0 HA SER A 300 -4.042 5.309 1.585 1.00 0.00 H new ATOM 0 HB2 SER A 300 -6.149 4.588 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 300 -5.382 5.043 4.309 1.00 0.00 H new ATOM 0 HG SER A 300 -6.325 6.913 3.804 1.00 0.00 H new ATOM 891 N LEU A 301 -2.700 6.987 2.908 1.00 0.00 N ATOM 892 CA LEU A 301 -1.698 7.844 3.532 1.00 0.00 C ATOM 893 C LEU A 301 -2.348 8.826 4.501 1.00 0.00 C ATOM 894 O LEU A 301 -1.873 9.017 5.621 1.00 0.00 O ATOM 895 CB LEU A 301 -0.914 8.608 2.463 1.00 0.00 C ATOM 896 CG LEU A 301 0.443 9.165 2.895 1.00 0.00 C ATOM 897 CD1 LEU A 301 1.488 8.060 2.925 1.00 0.00 C ATOM 898 CD2 LEU A 301 0.878 10.289 1.966 1.00 0.00 C ATOM 0 H LEU A 301 -3.164 7.401 2.100 1.00 0.00 H new ATOM 0 HA LEU A 301 -1.012 7.209 4.093 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.758 7.945 1.612 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.529 9.437 2.112 1.00 0.00 H new ATOM 0 HG LEU A 301 0.345 9.571 3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 301 2.447 8.475 3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 301 1.181 7.288 3.631 1.00 0.00 H new ATOM 0 HD13 LEU A 301 1.585 7.624 1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 301 1.846 10.674 2.288 1.00 0.00 H new ATOM 0 HD22 LEU A 301 0.960 9.908 0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 301 0.141 11.091 1.995 1.00 0.00 H new ATOM 910 N THR A 302 -3.439 9.447 4.063 1.00 0.00 N ATOM 911 CA THR A 302 -4.156 10.408 4.891 1.00 0.00 C ATOM 912 C THR A 302 -4.724 9.743 6.140 1.00 0.00 C ATOM 913 O THR A 302 -4.655 10.297 7.237 1.00 0.00 O ATOM 914 CB THR A 302 -5.304 11.076 4.111 1.00 0.00 C ATOM 915 OG1 THR A 302 -4.782 11.784 2.982 1.00 0.00 O ATOM 916 CG2 THR A 302 -6.079 12.034 5.003 1.00 0.00 C ATOM 0 H THR A 302 -3.845 9.301 3.139 1.00 0.00 H new ATOM 0 HA THR A 302 -3.435 11.171 5.185 1.00 0.00 H new ATOM 0 HB THR A 302 -5.983 10.295 3.768 1.00 0.00 H new ATOM 0 HG1 THR A 302 -3.922 11.394 2.720 1.00 0.00 H new ATOM 0 HG21 THR A 302 -6.884 12.494 4.430 1.00 0.00 H new ATOM 0 HG22 THR A 302 -6.500 11.486 5.846 1.00 0.00 H new ATOM 0 HG23 THR A 302 -5.409 12.810 5.373 1.00 0.00 H new ATOM 924 N THR A 303 -5.284 8.550 5.966 1.00 0.00 N ATOM 925 CA THR A 303 -5.865 7.809 7.079 1.00 0.00 C ATOM 926 C THR A 303 -4.876 6.793 7.638 1.00 0.00 C ATOM 927 O THR A 303 -4.601 6.774 8.837 1.00 0.00 O ATOM 928 CB THR A 303 -7.152 7.076 6.655 1.00 0.00 C ATOM 929 OG1 THR A 303 -6.834 6.010 5.753 1.00 0.00 O ATOM 930 CG2 THR A 303 -8.127 8.036 5.991 1.00 0.00 C ATOM 0 H THR A 303 -5.348 8.076 5.065 1.00 0.00 H new ATOM 0 HA THR A 303 -6.109 8.538 7.852 1.00 0.00 H new ATOM 0 HB THR A 303 -7.622 6.666 7.549 1.00 0.00 H new ATOM 0 HG1 THR A 303 -7.657 5.548 5.489 1.00 0.00 H new ATOM 0 HG21 THR A 303 -9.028 7.496 5.700 1.00 0.00 H new ATOM 0 HG22 THR A 303 -8.389 8.830 6.690 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.663 8.471 5.106 1.00 0.00 H new ATOM 938 N GLY A 304 -4.342 5.949 6.761 1.00 0.00 N ATOM 939 CA GLY A 304 -3.388 4.941 7.187 1.00 0.00 C ATOM 940 C GLY A 304 -3.950 3.536 7.099 1.00 0.00 C ATOM 941 O GLY A 304 -3.267 2.565 7.428 1.00 0.00 O ATOM 0 H GLY A 304 -4.553 5.945 5.763 1.00 0.00 H new ATOM 0 HA2 GLY A 304 -2.492 5.010 6.570 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -3.084 5.144 8.214 1.00 0.00 H new ATOM 945 N CYS A 305 -5.197 3.427 6.654 1.00 0.00 N ATOM 946 CA CYS A 305 -5.852 2.130 6.526 1.00 0.00 C ATOM 947 C CYS A 305 -5.236 1.320 5.390 1.00 0.00 C ATOM 948 O CYS A 305 -4.722 1.881 4.422 1.00 0.00 O ATOM 949 CB CYS A 305 -7.351 2.314 6.284 1.00 0.00 C ATOM 950 SG CYS A 305 -8.237 3.057 7.674 1.00 0.00 S ATOM 0 H CYS A 305 -5.774 4.221 6.376 1.00 0.00 H new ATOM 0 HA CYS A 305 -5.707 1.583 7.458 1.00 0.00 H new ATOM 0 HB2 CYS A 305 -7.492 2.938 5.402 1.00 0.00 H new ATOM 0 HB3 CYS A 305 -7.794 1.343 6.062 1.00 0.00 H new ATOM 0 HG CYS A 305 -9.496 3.174 7.373 1.00 0.00 H new ATOM 956 N SER A 306 -5.292 -0.002 5.514 1.00 0.00 N ATOM 957 CA SER A 306 -4.736 -0.890 4.500 1.00 0.00 C ATOM 958 C SER A 306 -5.793 -1.865 3.992 1.00 0.00 C ATOM 959 O SER A 306 -6.578 -2.407 4.769 1.00 0.00 O ATOM 960 CB SER A 306 -3.543 -1.662 5.067 1.00 0.00 C ATOM 961 OG SER A 306 -3.929 -2.452 6.179 1.00 0.00 O ATOM 0 H SER A 306 -5.717 -0.482 6.307 1.00 0.00 H new ATOM 0 HA SER A 306 -4.399 -0.279 3.663 1.00 0.00 H new ATOM 0 HB2 SER A 306 -3.118 -2.301 4.293 1.00 0.00 H new ATOM 0 HB3 SER A 306 -2.763 -0.963 5.367 1.00 0.00 H new ATOM 0 HG SER A 306 -3.856 -3.401 5.947 1.00 0.00 H new ATOM 967 N GLY A 307 -5.807 -2.083 2.680 1.00 0.00 N ATOM 968 CA GLY A 307 -6.771 -2.993 2.090 1.00 0.00 C ATOM 969 C GLY A 307 -6.641 -3.076 0.582 1.00 0.00 C ATOM 970 O GLY A 307 -5.740 -2.476 -0.006 1.00 0.00 O ATOM 0 H GLY A 307 -5.168 -1.646 2.016 1.00 0.00 H new ATOM 0 HA2 GLY A 307 -6.638 -3.986 2.518 1.00 0.00 H new ATOM 0 HA3 GLY A 307 -7.779 -2.667 2.348 1.00 0.00 H new ATOM 974 N LEU A 308 -7.542 -3.824 -0.047 1.00 0.00 N ATOM 975 CA LEU A 308 -7.523 -3.985 -1.497 1.00 0.00 C ATOM 976 C LEU A 308 -8.331 -2.885 -2.178 1.00 0.00 C ATOM 977 O LEU A 308 -9.351 -2.435 -1.655 1.00 0.00 O ATOM 978 CB LEU A 308 -8.081 -5.356 -1.884 1.00 0.00 C ATOM 979 CG LEU A 308 -7.078 -6.511 -1.891 1.00 0.00 C ATOM 980 CD1 LEU A 308 -7.803 -7.847 -1.920 1.00 0.00 C ATOM 981 CD2 LEU A 308 -6.133 -6.389 -3.078 1.00 0.00 C ATOM 0 H LEU A 308 -8.294 -4.328 0.424 1.00 0.00 H new ATOM 0 HA LEU A 308 -6.489 -3.911 -1.833 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -8.888 -5.606 -1.195 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -8.523 -5.279 -2.877 1.00 0.00 H new ATOM 0 HG LEU A 308 -6.488 -6.461 -0.976 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.073 -8.657 -1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.438 -7.936 -1.038 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -8.418 -7.908 -2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -5.426 -7.219 -3.067 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.707 -6.413 -4.004 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -5.588 -5.447 -3.014 1.00 0.00 H new ATOM 993 N LEU A 309 -7.869 -2.457 -3.348 1.00 0.00 N ATOM 994 CA LEU A 309 -8.550 -1.411 -4.103 1.00 0.00 C ATOM 995 C LEU A 309 -8.415 -1.647 -5.604 1.00 0.00 C ATOM 996 O LEU A 309 -7.492 -2.313 -6.072 1.00 0.00 O ATOM 997 CB LEU A 309 -7.980 -0.039 -3.737 1.00 0.00 C ATOM 998 CG LEU A 309 -6.465 0.029 -3.543 1.00 0.00 C ATOM 999 CD1 LEU A 309 -5.971 1.459 -3.696 1.00 0.00 C ATOM 1000 CD2 LEU A 309 -6.077 -0.528 -2.181 1.00 0.00 C ATOM 0 H LEU A 309 -7.026 -2.818 -3.794 1.00 0.00 H new ATOM 0 HA LEU A 309 -9.608 -1.439 -3.844 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -8.258 0.668 -4.519 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -8.459 0.298 -2.818 1.00 0.00 H new ATOM 0 HG LEU A 309 -5.991 -0.581 -4.312 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -4.891 1.488 -3.555 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.216 1.824 -4.693 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.452 2.092 -2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -4.995 -0.472 -2.060 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.561 0.056 -1.398 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.397 -1.568 -2.108 1.00 0.00 H new ATOM 1012 N PRO A 310 -9.355 -1.086 -6.378 1.00 0.00 N ATOM 1013 CA PRO A 310 -9.362 -1.219 -7.838 1.00 0.00 C ATOM 1014 C PRO A 310 -8.222 -0.448 -8.495 1.00 0.00 C ATOM 1015 O PRO A 310 -8.103 0.765 -8.326 1.00 0.00 O ATOM 1016 CB PRO A 310 -10.713 -0.623 -8.242 1.00 0.00 C ATOM 1017 CG PRO A 310 -11.054 0.323 -7.143 1.00 0.00 C ATOM 1018 CD PRO A 310 -10.485 -0.278 -5.888 1.00 0.00 C ATOM 0 HA PRO A 310 -9.225 -2.253 -8.154 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -10.648 -0.109 -9.201 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -11.472 -1.398 -8.347 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -10.629 1.309 -7.331 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -12.133 0.452 -7.060 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -10.156 0.490 -5.188 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -11.221 -0.890 -5.367 1.00 0.00 H new ATOM 1026 N GLU A 311 -7.387 -1.160 -9.245 1.00 0.00 N ATOM 1027 CA GLU A 311 -6.257 -0.541 -9.927 1.00 0.00 C ATOM 1028 C GLU A 311 -6.730 0.543 -10.891 1.00 0.00 C ATOM 1029 O GLU A 311 -5.929 1.316 -11.414 1.00 0.00 O ATOM 1030 CB GLU A 311 -5.450 -1.597 -10.686 1.00 0.00 C ATOM 1031 CG GLU A 311 -6.068 -1.994 -12.016 1.00 0.00 C ATOM 1032 CD GLU A 311 -5.098 -2.744 -12.909 1.00 0.00 C ATOM 1033 OE1 GLU A 311 -4.483 -3.719 -12.431 1.00 0.00 O ATOM 1034 OE2 GLU A 311 -4.955 -2.354 -14.087 1.00 0.00 O ATOM 0 H GLU A 311 -7.472 -2.165 -9.396 1.00 0.00 H new ATOM 0 HA GLU A 311 -5.620 -0.079 -9.173 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -4.444 -1.217 -10.861 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -5.351 -2.485 -10.061 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -6.944 -2.616 -11.834 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -6.415 -1.099 -12.533 1.00 0.00 H new ATOM 1041 N ASN A 312 -8.038 0.592 -11.121 1.00 0.00 N ATOM 1042 CA ASN A 312 -8.619 1.581 -12.022 1.00 0.00 C ATOM 1043 C ASN A 312 -9.089 2.810 -11.251 1.00 0.00 C ATOM 1044 O ASN A 312 -9.956 3.552 -11.714 1.00 0.00 O ATOM 1045 CB ASN A 312 -9.791 0.971 -12.794 1.00 0.00 C ATOM 1046 CG ASN A 312 -9.334 0.146 -13.982 1.00 0.00 C ATOM 1047 OD1 ASN A 312 -9.345 -1.084 -13.940 1.00 0.00 O ATOM 1048 ND2 ASN A 312 -8.927 0.822 -15.051 1.00 0.00 N ATOM 0 H ASN A 312 -8.716 -0.041 -10.696 1.00 0.00 H new ATOM 0 HA ASN A 312 -7.848 1.890 -12.728 1.00 0.00 H new ATOM 0 HB2 ASN A 312 -10.377 0.343 -12.123 1.00 0.00 H new ATOM 0 HB3 ASN A 312 -10.449 1.768 -13.140 1.00 0.00 H new ATOM 0 HD21 ASN A 312 -8.607 0.321 -15.880 1.00 0.00 H new ATOM 0 HD22 ASN A 312 -8.934 1.842 -15.043 1.00 0.00 H new ATOM 1055 N TYR A 313 -8.510 3.020 -10.074 1.00 0.00 N ATOM 1056 CA TYR A 313 -8.871 4.159 -9.238 1.00 0.00 C ATOM 1057 C TYR A 313 -7.626 4.902 -8.763 1.00 0.00 C ATOM 1058 O TYR A 313 -7.721 5.931 -8.094 1.00 0.00 O ATOM 1059 CB TYR A 313 -9.691 3.694 -8.034 1.00 0.00 C ATOM 1060 CG TYR A 313 -11.132 3.381 -8.367 1.00 0.00 C ATOM 1061 CD1 TYR A 313 -11.453 2.382 -9.279 1.00 0.00 C ATOM 1062 CD2 TYR A 313 -12.173 4.084 -7.773 1.00 0.00 C ATOM 1063 CE1 TYR A 313 -12.768 2.093 -9.587 1.00 0.00 C ATOM 1064 CE2 TYR A 313 -13.491 3.800 -8.074 1.00 0.00 C ATOM 1065 CZ TYR A 313 -13.783 2.804 -8.982 1.00 0.00 C ATOM 1066 OH TYR A 313 -15.095 2.519 -9.286 1.00 0.00 O ATOM 0 H TYR A 313 -7.789 2.417 -9.677 1.00 0.00 H new ATOM 0 HA TYR A 313 -9.473 4.842 -9.838 1.00 0.00 H new ATOM 0 HB2 TYR A 313 -9.224 2.806 -7.608 1.00 0.00 H new ATOM 0 HB3 TYR A 313 -9.664 4.467 -7.266 1.00 0.00 H new ATOM 0 HD1 TYR A 313 -10.661 1.823 -9.755 1.00 0.00 H new ATOM 0 HD2 TYR A 313 -11.948 4.866 -7.063 1.00 0.00 H new ATOM 0 HE1 TYR A 313 -13.000 1.314 -10.298 1.00 0.00 H new ATOM 0 HE2 TYR A 313 -14.288 4.355 -7.601 1.00 0.00 H new ATOM 0 HH TYR A 313 -15.685 3.110 -8.773 1.00 0.00 H new ATOM 1076 N ILE A 314 -6.459 4.372 -9.114 1.00 0.00 N ATOM 1077 CA ILE A 314 -5.194 4.985 -8.726 1.00 0.00 C ATOM 1078 C ILE A 314 -4.265 5.134 -9.926 1.00 0.00 C ATOM 1079 O ILE A 314 -4.586 4.700 -11.033 1.00 0.00 O ATOM 1080 CB ILE A 314 -4.481 4.162 -7.637 1.00 0.00 C ATOM 1081 CG1 ILE A 314 -4.358 2.700 -8.070 1.00 0.00 C ATOM 1082 CG2 ILE A 314 -5.230 4.268 -6.317 1.00 0.00 C ATOM 1083 CD1 ILE A 314 -3.106 2.409 -8.867 1.00 0.00 C ATOM 0 H ILE A 314 -6.363 3.520 -9.666 1.00 0.00 H new ATOM 0 HA ILE A 314 -5.430 5.972 -8.328 1.00 0.00 H new ATOM 0 HB ILE A 314 -3.478 4.565 -7.496 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -4.371 2.065 -7.184 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -5.230 2.432 -8.667 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -4.714 3.681 -5.558 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -5.270 5.311 -6.004 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -6.244 3.888 -6.442 1.00 0.00 H new ATOM 0 HD11 ILE A 314 -3.085 1.354 -9.140 1.00 0.00 H new ATOM 0 HD12 ILE A 314 -3.100 3.018 -9.771 1.00 0.00 H new ATOM 0 HD13 ILE A 314 -2.228 2.645 -8.265 1.00 0.00 H new ATOM 1095 N THR A 315 -3.108 5.748 -9.698 1.00 0.00 N ATOM 1096 CA THR A 315 -2.130 5.954 -10.760 1.00 0.00 C ATOM 1097 C THR A 315 -0.721 6.077 -10.192 1.00 0.00 C ATOM 1098 O THR A 315 -0.534 6.498 -9.050 1.00 0.00 O ATOM 1099 CB THR A 315 -2.452 7.216 -11.583 1.00 0.00 C ATOM 1100 OG1 THR A 315 -1.858 7.117 -12.882 1.00 0.00 O ATOM 1101 CG2 THR A 315 -1.941 8.465 -10.880 1.00 0.00 C ATOM 0 H THR A 315 -2.825 6.111 -8.788 1.00 0.00 H new ATOM 0 HA THR A 315 -2.182 5.082 -11.412 1.00 0.00 H new ATOM 0 HB THR A 315 -3.535 7.292 -11.683 1.00 0.00 H new ATOM 0 HG1 THR A 315 -2.068 7.922 -13.400 1.00 0.00 H new ATOM 0 HG21 THR A 315 -2.180 9.343 -11.480 1.00 0.00 H new ATOM 0 HG22 THR A 315 -2.416 8.553 -9.903 1.00 0.00 H new ATOM 0 HG23 THR A 315 -0.861 8.395 -10.753 1.00 0.00 H new ATOM 1109 N LYS A 316 0.270 5.707 -10.997 1.00 0.00 N ATOM 1110 CA LYS A 316 1.664 5.777 -10.576 1.00 0.00 C ATOM 1111 C LYS A 316 2.022 7.184 -10.108 1.00 0.00 C ATOM 1112 O LYS A 316 1.568 8.173 -10.683 1.00 0.00 O ATOM 1113 CB LYS A 316 2.586 5.360 -11.725 1.00 0.00 C ATOM 1114 CG LYS A 316 2.630 3.860 -11.956 1.00 0.00 C ATOM 1115 CD LYS A 316 3.982 3.416 -12.488 1.00 0.00 C ATOM 1116 CE LYS A 316 4.993 3.241 -11.366 1.00 0.00 C ATOM 1117 NZ LYS A 316 4.984 1.854 -10.823 1.00 0.00 N ATOM 0 H LYS A 316 0.133 5.356 -11.945 1.00 0.00 H new ATOM 0 HA LYS A 316 1.800 5.090 -9.741 1.00 0.00 H new ATOM 0 HB2 LYS A 316 2.256 5.851 -12.641 1.00 0.00 H new ATOM 0 HB3 LYS A 316 3.595 5.717 -11.518 1.00 0.00 H new ATOM 0 HG2 LYS A 316 2.418 3.341 -11.021 1.00 0.00 H new ATOM 0 HG3 LYS A 316 1.850 3.577 -12.662 1.00 0.00 H new ATOM 0 HD2 LYS A 316 3.870 2.476 -13.028 1.00 0.00 H new ATOM 0 HD3 LYS A 316 4.353 4.152 -13.202 1.00 0.00 H new ATOM 0 HE2 LYS A 316 5.990 3.480 -11.735 1.00 0.00 H new ATOM 0 HE3 LYS A 316 4.772 3.946 -10.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 5.687 1.775 -10.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 4.039 1.634 -10.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 5.220 1.183 -11.582 1.00 0.00 H new ATOM 1131 N ALA A 317 2.838 7.266 -9.063 1.00 0.00 N ATOM 1132 CA ALA A 317 3.259 8.552 -8.521 1.00 0.00 C ATOM 1133 C ALA A 317 3.897 9.420 -9.600 1.00 0.00 C ATOM 1134 O ALA A 317 5.110 9.379 -9.806 1.00 0.00 O ATOM 1135 CB ALA A 317 4.227 8.346 -7.365 1.00 0.00 C ATOM 0 H ALA A 317 3.221 6.457 -8.574 1.00 0.00 H new ATOM 0 HA ALA A 317 2.374 9.070 -8.151 1.00 0.00 H new ATOM 0 HB1 ALA A 317 4.533 9.315 -6.970 1.00 0.00 H new ATOM 0 HB2 ALA A 317 3.738 7.772 -6.579 1.00 0.00 H new ATOM 0 HB3 ALA A 317 5.105 7.804 -7.717 1.00 0.00 H new