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 -12:sc= 0.284 USER MOD Set 1.2: A 303 THR OG1 : rot 180:sc= -0.922 USER MOD Set 2.1: A 297 TYR OH : rot 180:sc= 0.651 USER MOD Set 2.2: A 306 SER OG : rot 113:sc= 0.725 USER MOD Set 3.1: A 289 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 290 SER OG : rot 180:sc= 0 USER MOD Single : A 258 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= -1.56 K(o=-1.6,f=-4.8!) USER MOD Single : A 263 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 TYR OH : rot 130:sc= -0.0518 USER MOD Single : A 266 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 269 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.25) USER MOD Single : A 283 MET CE :methyl -135:sc= -0.123 (180deg=-0.671) USER MOD Single : A 284 SER OG : rot 180:sc= -0.259 USER MOD Single : A 286 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 288 GLN : amide:sc= -4.59! C(o=-4.6!,f=-5.1!) USER MOD Single : A 291 THR OG1 : rot 130:sc= -0.528 USER MOD Single : A 292 SER OG : rot 180:sc= 0 USER MOD Single : A 299 THR OG1 : rot 180:sc= -0.975 USER MOD Single : A 302 THR OG1 : rot 70:sc= 0.623 USER MOD Single : A 305 CYS SG : rot 180:sc= 0 USER MOD Single : A 312 ASN : amide:sc= -0.109 K(o=-0.11,f=-2.1!) USER MOD Single : A 313 TYR OH : rot 180:sc= 0 USER MOD Single : A 315 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N GLU A 257 5.634 0.806 -3.492 1.00 0.00 N ATOM 218 CA GLU A 257 5.254 1.673 -4.601 1.00 0.00 C ATOM 219 C GLU A 257 4.285 2.757 -4.138 1.00 0.00 C ATOM 220 O GLU A 257 3.534 2.567 -3.181 1.00 0.00 O ATOM 221 CB GLU A 257 4.619 0.852 -5.725 1.00 0.00 C ATOM 222 CG GLU A 257 5.603 -0.048 -6.453 1.00 0.00 C ATOM 223 CD GLU A 257 6.096 -1.193 -5.589 1.00 0.00 C ATOM 224 OE1 GLU A 257 5.278 -1.766 -4.840 1.00 0.00 O ATOM 225 OE2 GLU A 257 7.300 -1.514 -5.662 1.00 0.00 O ATOM 0 HA GLU A 257 6.157 2.154 -4.978 1.00 0.00 H new ATOM 0 HB2 GLU A 257 3.819 0.240 -5.309 1.00 0.00 H new ATOM 0 HB3 GLU A 257 4.160 1.530 -6.444 1.00 0.00 H new ATOM 0 HG2 GLU A 257 5.128 -0.451 -7.347 1.00 0.00 H new ATOM 0 HG3 GLU A 257 6.455 0.545 -6.785 1.00 0.00 H new ATOM 232 N THR A 258 4.308 3.896 -4.823 1.00 0.00 N ATOM 233 CA THR A 258 3.434 5.011 -4.482 1.00 0.00 C ATOM 234 C THR A 258 2.481 5.333 -5.627 1.00 0.00 C ATOM 235 O THR A 258 2.896 5.446 -6.781 1.00 0.00 O ATOM 236 CB THR A 258 4.245 6.274 -4.134 1.00 0.00 C ATOM 237 OG1 THR A 258 5.425 5.914 -3.408 1.00 0.00 O ATOM 238 CG2 THR A 258 3.411 7.242 -3.308 1.00 0.00 C ATOM 0 H THR A 258 4.923 4.070 -5.618 1.00 0.00 H new ATOM 0 HA THR A 258 2.858 4.705 -3.609 1.00 0.00 H new ATOM 0 HB THR A 258 4.528 6.765 -5.065 1.00 0.00 H new ATOM 0 HG1 THR A 258 5.936 6.722 -3.192 1.00 0.00 H new ATOM 0 HG21 THR A 258 4.005 8.126 -3.074 1.00 0.00 H new ATOM 0 HG22 THR A 258 2.528 7.537 -3.875 1.00 0.00 H new ATOM 0 HG23 THR A 258 3.102 6.757 -2.382 1.00 0.00 H new ATOM 246 N LEU A 259 1.202 5.480 -5.302 1.00 0.00 N ATOM 247 CA LEU A 259 0.188 5.790 -6.304 1.00 0.00 C ATOM 248 C LEU A 259 -0.748 6.889 -5.810 1.00 0.00 C ATOM 249 O LEU A 259 -0.975 7.029 -4.609 1.00 0.00 O ATOM 250 CB LEU A 259 -0.616 4.536 -6.649 1.00 0.00 C ATOM 251 CG LEU A 259 0.191 3.250 -6.834 1.00 0.00 C ATOM 252 CD1 LEU A 259 -0.726 2.037 -6.817 1.00 0.00 C ATOM 253 CD2 LEU A 259 0.987 3.302 -8.129 1.00 0.00 C ATOM 0 H LEU A 259 0.842 5.390 -4.352 1.00 0.00 H new ATOM 0 HA LEU A 259 0.695 6.147 -7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -1.349 4.370 -5.860 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -1.173 4.727 -7.566 1.00 0.00 H new ATOM 0 HG LEU A 259 0.892 3.161 -6.004 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -0.134 1.131 -6.950 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -1.250 1.991 -5.863 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.452 2.118 -7.626 1.00 0.00 H new ATOM 0 HD21 LEU A 259 1.555 2.379 -8.244 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.305 3.416 -8.971 1.00 0.00 H new ATOM 0 HD23 LEU A 259 1.673 4.149 -8.101 1.00 0.00 H new ATOM 265 N GLN A 260 -1.290 7.662 -6.745 1.00 0.00 N ATOM 266 CA GLN A 260 -2.203 8.747 -6.404 1.00 0.00 C ATOM 267 C GLN A 260 -3.631 8.406 -6.817 1.00 0.00 C ATOM 268 O GLN A 260 -3.876 7.973 -7.943 1.00 0.00 O ATOM 269 CB GLN A 260 -1.760 10.046 -7.080 1.00 0.00 C ATOM 270 CG GLN A 260 -2.522 11.271 -6.602 1.00 0.00 C ATOM 271 CD GLN A 260 -3.766 11.542 -7.425 1.00 0.00 C ATOM 272 OE1 GLN A 260 -4.055 10.831 -8.388 1.00 0.00 O ATOM 273 NE2 GLN A 260 -4.511 12.575 -7.050 1.00 0.00 N ATOM 0 H GLN A 260 -1.113 7.558 -7.744 1.00 0.00 H new ATOM 0 HA GLN A 260 -2.179 8.882 -5.323 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -0.696 10.196 -6.898 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -1.888 9.947 -8.158 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -2.804 11.134 -5.558 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -1.867 12.141 -6.644 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -4.234 13.138 -6.246 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -5.360 12.806 -7.566 1.00 0.00 H new ATOM 282 N VAL A 261 -4.570 8.605 -5.898 1.00 0.00 N ATOM 283 CA VAL A 261 -5.975 8.319 -6.167 1.00 0.00 C ATOM 284 C VAL A 261 -6.521 9.230 -7.260 1.00 0.00 C ATOM 285 O VAL A 261 -6.414 10.454 -7.174 1.00 0.00 O ATOM 286 CB VAL A 261 -6.834 8.486 -4.899 1.00 0.00 C ATOM 287 CG1 VAL A 261 -8.298 8.209 -5.206 1.00 0.00 C ATOM 288 CG2 VAL A 261 -6.331 7.572 -3.792 1.00 0.00 C ATOM 0 H VAL A 261 -4.384 8.963 -4.961 1.00 0.00 H new ATOM 0 HA VAL A 261 -6.029 7.283 -6.500 1.00 0.00 H new ATOM 0 HB VAL A 261 -6.748 9.517 -4.555 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.890 8.332 -4.299 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.649 8.908 -5.965 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -8.406 7.189 -5.574 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -6.949 7.703 -2.904 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.386 6.535 -4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -5.297 7.823 -3.555 1.00 0.00 H new ATOM 298 N ILE A 262 -7.107 8.625 -8.288 1.00 0.00 N ATOM 299 CA ILE A 262 -7.672 9.382 -9.398 1.00 0.00 C ATOM 300 C ILE A 262 -9.191 9.462 -9.292 1.00 0.00 C ATOM 301 O ILE A 262 -9.824 10.312 -9.921 1.00 0.00 O ATOM 302 CB ILE A 262 -7.296 8.757 -10.755 1.00 0.00 C ATOM 303 CG1 ILE A 262 -7.236 7.233 -10.640 1.00 0.00 C ATOM 304 CG2 ILE A 262 -5.964 9.310 -11.241 1.00 0.00 C ATOM 305 CD1 ILE A 262 -7.010 6.535 -11.963 1.00 0.00 C ATOM 0 H ILE A 262 -7.203 7.613 -8.375 1.00 0.00 H new ATOM 0 HA ILE A 262 -7.252 10.386 -9.341 1.00 0.00 H new ATOM 0 HB ILE A 262 -8.063 9.017 -11.484 1.00 0.00 H new ATOM 0 HG12 ILE A 262 -6.435 6.960 -9.953 1.00 0.00 H new ATOM 0 HG13 ILE A 262 -8.167 6.873 -10.203 1.00 0.00 H new ATOM 0 HG21 ILE A 262 -5.711 8.859 -12.201 1.00 0.00 H new ATOM 0 HG22 ILE A 262 -6.039 10.391 -11.356 1.00 0.00 H new ATOM 0 HG23 ILE A 262 -5.186 9.076 -10.514 1.00 0.00 H new ATOM 0 HD11 ILE A 262 -6.979 5.457 -11.805 1.00 0.00 H new ATOM 0 HD12 ILE A 262 -7.824 6.778 -12.646 1.00 0.00 H new ATOM 0 HD13 ILE A 262 -6.065 6.866 -12.392 1.00 0.00 H new ATOM 317 N TYR A 263 -9.771 8.574 -8.492 1.00 0.00 N ATOM 318 CA TYR A 263 -11.216 8.544 -8.304 1.00 0.00 C ATOM 319 C TYR A 263 -11.581 7.846 -6.997 1.00 0.00 C ATOM 320 O TYR A 263 -10.940 6.881 -6.579 1.00 0.00 O ATOM 321 CB TYR A 263 -11.890 7.835 -9.480 1.00 0.00 C ATOM 322 CG TYR A 263 -11.525 8.416 -10.827 1.00 0.00 C ATOM 323 CD1 TYR A 263 -12.153 9.559 -11.306 1.00 0.00 C ATOM 324 CD2 TYR A 263 -10.552 7.822 -11.621 1.00 0.00 C ATOM 325 CE1 TYR A 263 -11.823 10.092 -12.537 1.00 0.00 C ATOM 326 CE2 TYR A 263 -10.214 8.349 -12.852 1.00 0.00 C ATOM 327 CZ TYR A 263 -10.853 9.484 -13.306 1.00 0.00 C ATOM 328 OH TYR A 263 -10.521 10.013 -14.532 1.00 0.00 O ATOM 0 H TYR A 263 -9.262 7.865 -7.963 1.00 0.00 H new ATOM 0 HA TYR A 263 -11.572 9.573 -8.257 1.00 0.00 H new ATOM 0 HB2 TYR A 263 -11.616 6.780 -9.463 1.00 0.00 H new ATOM 0 HB3 TYR A 263 -12.971 7.886 -9.353 1.00 0.00 H new ATOM 0 HD1 TYR A 263 -12.912 10.039 -10.706 1.00 0.00 H new ATOM 0 HD2 TYR A 263 -10.051 6.932 -11.269 1.00 0.00 H new ATOM 0 HE1 TYR A 263 -12.322 10.980 -12.895 1.00 0.00 H new ATOM 0 HE2 TYR A 263 -9.454 7.875 -13.456 1.00 0.00 H new ATOM 0 HH TYR A 263 -9.820 9.467 -14.945 1.00 0.00 H new ATOM 338 N PRO A 264 -12.636 8.343 -6.336 1.00 0.00 N ATOM 339 CA PRO A 264 -13.112 7.783 -5.068 1.00 0.00 C ATOM 340 C PRO A 264 -13.747 6.407 -5.244 1.00 0.00 C ATOM 341 O PRO A 264 -14.180 6.049 -6.339 1.00 0.00 O ATOM 342 CB PRO A 264 -14.158 8.798 -4.602 1.00 0.00 C ATOM 343 CG PRO A 264 -14.632 9.455 -5.852 1.00 0.00 C ATOM 344 CD PRO A 264 -13.447 9.491 -6.776 1.00 0.00 C ATOM 0 HA PRO A 264 -12.298 7.632 -4.358 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -14.978 8.308 -4.077 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -13.726 9.524 -3.913 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -15.457 8.898 -6.297 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -14.999 10.461 -5.649 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -13.748 9.394 -7.819 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -12.898 10.428 -6.688 1.00 0.00 H new ATOM 352 N TYR A 265 -13.798 5.642 -4.160 1.00 0.00 N ATOM 353 CA TYR A 265 -14.378 4.305 -4.195 1.00 0.00 C ATOM 354 C TYR A 265 -14.975 3.933 -2.841 1.00 0.00 C ATOM 355 O TYR A 265 -14.346 4.121 -1.799 1.00 0.00 O ATOM 356 CB TYR A 265 -13.319 3.277 -4.598 1.00 0.00 C ATOM 357 CG TYR A 265 -13.664 1.862 -4.192 1.00 0.00 C ATOM 358 CD1 TYR A 265 -14.490 1.073 -4.983 1.00 0.00 C ATOM 359 CD2 TYR A 265 -13.165 1.313 -3.017 1.00 0.00 C ATOM 360 CE1 TYR A 265 -14.809 -0.220 -4.617 1.00 0.00 C ATOM 361 CE2 TYR A 265 -13.476 0.021 -2.643 1.00 0.00 C ATOM 362 CZ TYR A 265 -14.299 -0.742 -3.446 1.00 0.00 C ATOM 363 OH TYR A 265 -14.613 -2.030 -3.076 1.00 0.00 O ATOM 0 H TYR A 265 -13.445 5.925 -3.246 1.00 0.00 H new ATOM 0 HA TYR A 265 -15.177 4.303 -4.936 1.00 0.00 H new ATOM 0 HB2 TYR A 265 -13.182 3.313 -5.679 1.00 0.00 H new ATOM 0 HB3 TYR A 265 -12.366 3.553 -4.147 1.00 0.00 H new ATOM 0 HD1 TYR A 265 -14.890 1.478 -5.901 1.00 0.00 H new ATOM 0 HD2 TYR A 265 -12.522 1.908 -2.385 1.00 0.00 H new ATOM 0 HE1 TYR A 265 -15.454 -0.819 -5.243 1.00 0.00 H new ATOM 0 HE2 TYR A 265 -13.078 -0.390 -1.727 1.00 0.00 H new ATOM 0 HH TYR A 265 -13.792 -2.516 -2.852 1.00 0.00 H new ATOM 373 N THR A 266 -16.195 3.404 -2.864 1.00 0.00 N ATOM 374 CA THR A 266 -16.878 3.007 -1.640 1.00 0.00 C ATOM 375 C THR A 266 -16.825 1.496 -1.447 1.00 0.00 C ATOM 376 O THR A 266 -17.504 0.733 -2.135 1.00 0.00 O ATOM 377 CB THR A 266 -18.350 3.461 -1.645 1.00 0.00 C ATOM 378 OG1 THR A 266 -18.440 4.827 -2.064 1.00 0.00 O ATOM 379 CG2 THR A 266 -18.969 3.307 -0.264 1.00 0.00 C ATOM 0 H THR A 266 -16.730 3.241 -3.717 1.00 0.00 H new ATOM 0 HA THR A 266 -16.358 3.495 -0.815 1.00 0.00 H new ATOM 0 HB THR A 266 -18.899 2.830 -2.344 1.00 0.00 H new ATOM 0 HG1 THR A 266 -19.379 5.107 -2.066 1.00 0.00 H new ATOM 0 HG21 THR A 266 -20.008 3.634 -0.293 1.00 0.00 H new ATOM 0 HG22 THR A 266 -18.926 2.261 0.040 1.00 0.00 H new ATOM 0 HG23 THR A 266 -18.417 3.916 0.452 1.00 0.00 H new ATOM 387 N PRO A 267 -16.000 1.049 -0.488 1.00 0.00 N ATOM 388 CA PRO A 267 -15.840 -0.375 -0.181 1.00 0.00 C ATOM 389 C PRO A 267 -17.082 -0.970 0.474 1.00 0.00 C ATOM 390 O PRO A 267 -18.007 -0.247 0.843 1.00 0.00 O ATOM 391 CB PRO A 267 -14.660 -0.398 0.793 1.00 0.00 C ATOM 392 CG PRO A 267 -14.665 0.951 1.426 1.00 0.00 C ATOM 393 CD PRO A 267 -15.161 1.901 0.372 1.00 0.00 C ATOM 0 HA PRO A 267 -15.680 -0.970 -1.080 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.777 -1.185 1.538 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -13.721 -0.588 0.273 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.312 0.968 2.303 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -13.666 1.228 1.762 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -15.733 2.720 0.807 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.338 2.348 -0.186 1.00 0.00 H new ATOM 401 N GLN A 268 -17.096 -2.292 0.615 1.00 0.00 N ATOM 402 CA GLN A 268 -18.225 -2.983 1.225 1.00 0.00 C ATOM 403 C GLN A 268 -17.767 -3.848 2.395 1.00 0.00 C ATOM 404 O GLN A 268 -18.577 -4.285 3.211 1.00 0.00 O ATOM 405 CB GLN A 268 -18.943 -3.847 0.187 1.00 0.00 C ATOM 406 CG GLN A 268 -19.250 -3.113 -1.108 1.00 0.00 C ATOM 407 CD GLN A 268 -20.582 -2.389 -1.066 1.00 0.00 C ATOM 408 OE1 GLN A 268 -21.629 -3.003 -0.857 1.00 0.00 O ATOM 409 NE2 GLN A 268 -20.549 -1.077 -1.265 1.00 0.00 N ATOM 0 H GLN A 268 -16.338 -2.905 0.315 1.00 0.00 H new ATOM 0 HA GLN A 268 -18.917 -2.231 1.603 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -18.328 -4.719 -0.036 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -19.875 -4.216 0.616 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -18.456 -2.394 -1.311 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -19.254 -3.825 -1.933 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -19.659 -0.609 -1.435 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -21.414 -0.537 -1.248 1.00 0.00 H new ATOM 418 N ASN A 269 -16.462 -4.090 2.470 1.00 0.00 N ATOM 419 CA ASN A 269 -15.896 -4.903 3.539 1.00 0.00 C ATOM 420 C ASN A 269 -14.465 -4.473 3.851 1.00 0.00 C ATOM 421 O ASN A 269 -13.962 -3.501 3.288 1.00 0.00 O ATOM 422 CB ASN A 269 -15.922 -6.383 3.152 1.00 0.00 C ATOM 423 CG ASN A 269 -17.306 -6.990 3.277 1.00 0.00 C ATOM 424 OD1 ASN A 269 -17.857 -7.083 4.374 1.00 0.00 O ATOM 425 ND2 ASN A 269 -17.874 -7.405 2.151 1.00 0.00 N ATOM 0 H ASN A 269 -15.777 -3.734 1.803 1.00 0.00 H new ATOM 0 HA ASN A 269 -16.504 -4.757 4.432 1.00 0.00 H new ATOM 0 HB2 ASN A 269 -15.571 -6.493 2.126 1.00 0.00 H new ATOM 0 HB3 ASN A 269 -15.228 -6.934 3.787 1.00 0.00 H new ATOM 0 HD21 ASN A 269 -18.805 -7.821 2.173 1.00 0.00 H new ATOM 0 HD22 ASN A 269 -17.379 -7.308 1.264 1.00 0.00 H new ATOM 432 N ASP A 270 -13.817 -5.204 4.751 1.00 0.00 N ATOM 433 CA ASP A 270 -12.444 -4.899 5.137 1.00 0.00 C ATOM 434 C ASP A 270 -11.474 -5.244 4.012 1.00 0.00 C ATOM 435 O ASP A 270 -10.529 -4.501 3.743 1.00 0.00 O ATOM 436 CB ASP A 270 -12.066 -5.666 6.406 1.00 0.00 C ATOM 437 CG ASP A 270 -12.451 -4.921 7.669 1.00 0.00 C ATOM 438 OD1 ASP A 270 -13.415 -4.128 7.620 1.00 0.00 O ATOM 439 OD2 ASP A 270 -11.789 -5.131 8.706 1.00 0.00 O ATOM 0 H ASP A 270 -14.220 -6.011 5.227 1.00 0.00 H new ATOM 0 HA ASP A 270 -12.377 -3.829 5.335 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -12.556 -6.640 6.398 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -10.992 -5.850 6.409 1.00 0.00 H new ATOM 444 N ASP A 271 -11.713 -6.375 3.358 1.00 0.00 N ATOM 445 CA ASP A 271 -10.860 -6.819 2.261 1.00 0.00 C ATOM 446 C ASP A 271 -10.418 -5.637 1.404 1.00 0.00 C ATOM 447 O ASP A 271 -9.260 -5.553 0.996 1.00 0.00 O ATOM 448 CB ASP A 271 -11.596 -7.845 1.398 1.00 0.00 C ATOM 449 CG ASP A 271 -10.700 -8.464 0.344 1.00 0.00 C ATOM 450 OD1 ASP A 271 -9.656 -9.040 0.716 1.00 0.00 O ATOM 451 OD2 ASP A 271 -11.043 -8.375 -0.854 1.00 0.00 O ATOM 0 H ASP A 271 -12.490 -7.001 3.568 1.00 0.00 H new ATOM 0 HA ASP A 271 -9.973 -7.286 2.689 1.00 0.00 H new ATOM 0 HB2 ASP A 271 -11.997 -8.632 2.037 1.00 0.00 H new ATOM 0 HB3 ASP A 271 -12.445 -7.364 0.912 1.00 0.00 H new ATOM 456 N GLU A 272 -11.350 -4.728 1.133 1.00 0.00 N ATOM 457 CA GLU A 272 -11.056 -3.552 0.322 1.00 0.00 C ATOM 458 C GLU A 272 -10.819 -2.329 1.204 1.00 0.00 C ATOM 459 O GLU A 272 -11.044 -2.369 2.414 1.00 0.00 O ATOM 460 CB GLU A 272 -12.203 -3.278 -0.652 1.00 0.00 C ATOM 461 CG GLU A 272 -13.536 -3.026 0.032 1.00 0.00 C ATOM 462 CD GLU A 272 -14.330 -4.299 0.248 1.00 0.00 C ATOM 463 OE1 GLU A 272 -14.100 -4.974 1.273 1.00 0.00 O ATOM 464 OE2 GLU A 272 -15.182 -4.619 -0.607 1.00 0.00 O ATOM 0 H GLU A 272 -12.314 -4.783 1.463 1.00 0.00 H new ATOM 0 HA GLU A 272 -10.147 -3.751 -0.246 1.00 0.00 H new ATOM 0 HB2 GLU A 272 -11.949 -2.413 -1.264 1.00 0.00 H new ATOM 0 HB3 GLU A 272 -12.306 -4.127 -1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 272 -13.361 -2.544 0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 272 -14.124 -2.333 -0.570 1.00 0.00 H new ATOM 471 N LEU A 273 -10.363 -1.244 0.588 1.00 0.00 N ATOM 472 CA LEU A 273 -10.094 -0.008 1.315 1.00 0.00 C ATOM 473 C LEU A 273 -10.714 1.189 0.602 1.00 0.00 C ATOM 474 O LEU A 273 -10.862 1.187 -0.620 1.00 0.00 O ATOM 475 CB LEU A 273 -8.586 0.200 1.468 1.00 0.00 C ATOM 476 CG LEU A 273 -8.135 1.622 1.802 1.00 0.00 C ATOM 477 CD1 LEU A 273 -8.246 1.880 3.297 1.00 0.00 C ATOM 478 CD2 LEU A 273 -6.710 1.855 1.324 1.00 0.00 C ATOM 0 H LEU A 273 -10.172 -1.195 -0.413 1.00 0.00 H new ATOM 0 HA LEU A 273 -10.545 -0.092 2.304 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -8.225 -0.467 2.251 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -8.101 -0.105 0.540 1.00 0.00 H new ATOM 0 HG LEU A 273 -8.790 2.322 1.283 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -7.921 2.897 3.516 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -9.282 1.755 3.612 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -7.615 1.173 3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -6.405 2.872 1.570 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -6.041 1.147 1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -6.660 1.713 0.244 1.00 0.00 H new ATOM 490 N GLU A 274 -11.073 2.211 1.373 1.00 0.00 N ATOM 491 CA GLU A 274 -11.675 3.415 0.814 1.00 0.00 C ATOM 492 C GLU A 274 -10.659 4.197 -0.015 1.00 0.00 C ATOM 493 O GLU A 274 -9.458 4.152 0.251 1.00 0.00 O ATOM 494 CB GLU A 274 -12.229 4.302 1.931 1.00 0.00 C ATOM 495 CG GLU A 274 -13.139 5.411 1.433 1.00 0.00 C ATOM 496 CD GLU A 274 -13.707 6.251 2.561 1.00 0.00 C ATOM 497 OE1 GLU A 274 -13.007 7.180 3.018 1.00 0.00 O ATOM 498 OE2 GLU A 274 -14.849 5.980 2.987 1.00 0.00 O ATOM 0 H GLU A 274 -10.957 2.229 2.386 1.00 0.00 H new ATOM 0 HA GLU A 274 -12.494 3.111 0.162 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -12.780 3.681 2.637 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -11.397 4.745 2.478 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -12.582 6.054 0.751 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -13.958 4.974 0.862 1.00 0.00 H new ATOM 505 N LEU A 275 -11.151 4.913 -1.020 1.00 0.00 N ATOM 506 CA LEU A 275 -10.287 5.705 -1.889 1.00 0.00 C ATOM 507 C LEU A 275 -10.659 7.182 -1.826 1.00 0.00 C ATOM 508 O LEU A 275 -11.829 7.545 -1.956 1.00 0.00 O ATOM 509 CB LEU A 275 -10.384 5.204 -3.332 1.00 0.00 C ATOM 510 CG LEU A 275 -9.858 3.791 -3.588 1.00 0.00 C ATOM 511 CD1 LEU A 275 -9.549 3.597 -5.065 1.00 0.00 C ATOM 512 CD2 LEU A 275 -8.621 3.521 -2.743 1.00 0.00 C ATOM 0 H LEU A 275 -12.143 4.962 -1.253 1.00 0.00 H new ATOM 0 HA LEU A 275 -9.261 5.592 -1.540 1.00 0.00 H new ATOM 0 HB2 LEU A 275 -11.429 5.242 -3.639 1.00 0.00 H new ATOM 0 HB3 LEU A 275 -9.837 5.895 -3.973 1.00 0.00 H new ATOM 0 HG LEU A 275 -10.632 3.078 -3.302 1.00 0.00 H new ATOM 0 HD11 LEU A 275 -9.176 2.586 -5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 275 -10.457 3.748 -5.649 1.00 0.00 H new ATOM 0 HD13 LEU A 275 -8.793 4.318 -5.376 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -8.260 2.511 -2.938 1.00 0.00 H new ATOM 0 HD22 LEU A 275 -7.842 4.240 -2.998 1.00 0.00 H new ATOM 0 HD23 LEU A 275 -8.873 3.619 -1.687 1.00 0.00 H new ATOM 524 N VAL A 276 -9.656 8.032 -1.629 1.00 0.00 N ATOM 525 CA VAL A 276 -9.877 9.471 -1.552 1.00 0.00 C ATOM 526 C VAL A 276 -9.056 10.210 -2.602 1.00 0.00 C ATOM 527 O VAL A 276 -7.848 10.011 -2.735 1.00 0.00 O ATOM 528 CB VAL A 276 -9.520 10.020 -0.158 1.00 0.00 C ATOM 529 CG1 VAL A 276 -9.695 11.531 -0.118 1.00 0.00 C ATOM 530 CG2 VAL A 276 -10.367 9.348 0.912 1.00 0.00 C ATOM 0 H VAL A 276 -8.682 7.749 -1.520 1.00 0.00 H new ATOM 0 HA VAL A 276 -10.938 9.639 -1.740 1.00 0.00 H new ATOM 0 HB VAL A 276 -8.473 9.794 0.045 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -9.438 11.901 0.875 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -9.041 11.993 -0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -10.731 11.783 -0.342 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -10.101 9.748 1.891 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -11.422 9.541 0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -10.186 8.273 0.898 1.00 0.00 H new ATOM 540 N PRO A 277 -9.725 11.085 -3.369 1.00 0.00 N ATOM 541 CA PRO A 277 -9.076 11.872 -4.421 1.00 0.00 C ATOM 542 C PRO A 277 -8.139 12.934 -3.856 1.00 0.00 C ATOM 543 O PRO A 277 -8.577 13.876 -3.197 1.00 0.00 O ATOM 544 CB PRO A 277 -10.252 12.529 -5.148 1.00 0.00 C ATOM 545 CG PRO A 277 -11.340 12.589 -4.132 1.00 0.00 C ATOM 546 CD PRO A 277 -11.165 11.372 -3.266 1.00 0.00 C ATOM 0 HA PRO A 277 -8.450 11.254 -5.065 1.00 0.00 H new ATOM 0 HB2 PRO A 277 -9.990 13.524 -5.506 1.00 0.00 H new ATOM 0 HB3 PRO A 277 -10.555 11.947 -6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 277 -11.272 13.502 -3.541 1.00 0.00 H new ATOM 0 HG3 PRO A 277 -12.320 12.591 -4.609 1.00 0.00 H new ATOM 0 HD2 PRO A 277 -11.464 11.566 -2.236 1.00 0.00 H new ATOM 0 HD3 PRO A 277 -11.768 10.536 -3.621 1.00 0.00 H new ATOM 554 N GLY A 278 -6.845 12.776 -4.120 1.00 0.00 N ATOM 555 CA GLY A 278 -5.867 13.729 -3.630 1.00 0.00 C ATOM 556 C GLY A 278 -4.913 13.116 -2.625 1.00 0.00 C ATOM 557 O GLY A 278 -4.026 13.795 -2.106 1.00 0.00 O ATOM 0 H GLY A 278 -6.457 12.005 -4.664 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -5.298 14.126 -4.471 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -6.384 14.571 -3.169 1.00 0.00 H new ATOM 561 N ASP A 279 -5.095 11.830 -2.346 1.00 0.00 N ATOM 562 CA ASP A 279 -4.244 11.125 -1.395 1.00 0.00 C ATOM 563 C ASP A 279 -3.354 10.112 -2.109 1.00 0.00 C ATOM 564 O ASP A 279 -3.539 9.834 -3.294 1.00 0.00 O ATOM 565 CB ASP A 279 -5.097 10.419 -0.340 1.00 0.00 C ATOM 566 CG ASP A 279 -4.387 10.299 0.994 1.00 0.00 C ATOM 567 OD1 ASP A 279 -3.462 11.099 1.247 1.00 0.00 O ATOM 568 OD2 ASP A 279 -4.755 9.404 1.784 1.00 0.00 O ATOM 0 H ASP A 279 -5.825 11.254 -2.765 1.00 0.00 H new ATOM 0 HA ASP A 279 -3.606 11.859 -0.903 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -6.029 10.968 -0.204 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -5.362 9.424 -0.698 1.00 0.00 H new ATOM 573 N PHE A 280 -2.387 9.565 -1.380 1.00 0.00 N ATOM 574 CA PHE A 280 -1.467 8.584 -1.944 1.00 0.00 C ATOM 575 C PHE A 280 -1.748 7.191 -1.388 1.00 0.00 C ATOM 576 O PHE A 280 -2.470 7.039 -0.402 1.00 0.00 O ATOM 577 CB PHE A 280 -0.020 8.981 -1.646 1.00 0.00 C ATOM 578 CG PHE A 280 0.532 10.000 -2.602 1.00 0.00 C ATOM 579 CD1 PHE A 280 0.703 9.690 -3.942 1.00 0.00 C ATOM 580 CD2 PHE A 280 0.878 11.267 -2.162 1.00 0.00 C ATOM 581 CE1 PHE A 280 1.211 10.625 -4.824 1.00 0.00 C ATOM 582 CE2 PHE A 280 1.386 12.207 -3.040 1.00 0.00 C ATOM 583 CZ PHE A 280 1.551 11.885 -4.373 1.00 0.00 C ATOM 0 H PHE A 280 -2.220 9.784 -0.398 1.00 0.00 H new ATOM 0 HA PHE A 280 -1.616 8.562 -3.023 1.00 0.00 H new ATOM 0 HB2 PHE A 280 0.038 9.377 -0.632 1.00 0.00 H new ATOM 0 HB3 PHE A 280 0.606 8.089 -1.676 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.436 8.707 -4.301 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.750 11.524 -1.121 1.00 0.00 H new ATOM 0 HE1 PHE A 280 1.342 10.370 -5.865 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.653 13.191 -2.684 1.00 0.00 H new ATOM 0 HZ PHE A 280 1.945 12.618 -5.062 1.00 0.00 H new ATOM 593 N ILE A 281 -1.174 6.178 -2.028 1.00 0.00 N ATOM 594 CA ILE A 281 -1.363 4.798 -1.598 1.00 0.00 C ATOM 595 C ILE A 281 -0.079 3.992 -1.759 1.00 0.00 C ATOM 596 O ILE A 281 0.495 3.928 -2.846 1.00 0.00 O ATOM 597 CB ILE A 281 -2.490 4.111 -2.391 1.00 0.00 C ATOM 598 CG1 ILE A 281 -3.776 4.936 -2.312 1.00 0.00 C ATOM 599 CG2 ILE A 281 -2.725 2.703 -1.864 1.00 0.00 C ATOM 600 CD1 ILE A 281 -4.421 4.920 -0.944 1.00 0.00 C ATOM 0 H ILE A 281 -0.574 6.287 -2.846 1.00 0.00 H new ATOM 0 HA ILE A 281 -1.639 4.830 -0.544 1.00 0.00 H new ATOM 0 HB ILE A 281 -2.189 4.042 -3.436 1.00 0.00 H new ATOM 0 HG12 ILE A 281 -3.554 5.967 -2.588 1.00 0.00 H new ATOM 0 HG13 ILE A 281 -4.488 4.556 -3.045 1.00 0.00 H new ATOM 0 HG21 ILE A 281 -3.524 2.230 -2.434 1.00 0.00 H new ATOM 0 HG22 ILE A 281 -1.811 2.119 -1.967 1.00 0.00 H new ATOM 0 HG23 ILE A 281 -3.008 2.751 -0.813 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -5.327 5.525 -0.962 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -4.674 3.895 -0.673 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -3.727 5.328 -0.210 1.00 0.00 H new ATOM 612 N PHE A 282 0.367 3.376 -0.669 1.00 0.00 N ATOM 613 CA PHE A 282 1.583 2.572 -0.688 1.00 0.00 C ATOM 614 C PHE A 282 1.268 1.116 -1.016 1.00 0.00 C ATOM 615 O PHE A 282 0.597 0.427 -0.248 1.00 0.00 O ATOM 616 CB PHE A 282 2.299 2.659 0.661 1.00 0.00 C ATOM 617 CG PHE A 282 2.843 4.026 0.964 1.00 0.00 C ATOM 618 CD1 PHE A 282 3.520 4.748 -0.005 1.00 0.00 C ATOM 619 CD2 PHE A 282 2.677 4.589 2.220 1.00 0.00 C ATOM 620 CE1 PHE A 282 4.021 6.006 0.270 1.00 0.00 C ATOM 621 CE2 PHE A 282 3.175 5.847 2.501 1.00 0.00 C ATOM 622 CZ PHE A 282 3.849 6.556 1.525 1.00 0.00 C ATOM 0 H PHE A 282 -0.096 3.418 0.239 1.00 0.00 H new ATOM 0 HA PHE A 282 2.237 2.968 -1.465 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.606 2.369 1.451 1.00 0.00 H new ATOM 0 HB3 PHE A 282 3.118 1.939 0.676 1.00 0.00 H new ATOM 0 HD1 PHE A 282 3.658 4.322 -0.988 1.00 0.00 H new ATOM 0 HD2 PHE A 282 2.153 4.038 2.987 1.00 0.00 H new ATOM 0 HE1 PHE A 282 4.546 6.558 -0.495 1.00 0.00 H new ATOM 0 HE2 PHE A 282 3.038 6.276 3.483 1.00 0.00 H new ATOM 0 HZ PHE A 282 4.241 7.539 1.743 1.00 0.00 H new ATOM 632 N MET A 283 1.756 0.655 -2.163 1.00 0.00 N ATOM 633 CA MET A 283 1.527 -0.720 -2.593 1.00 0.00 C ATOM 634 C MET A 283 2.747 -1.590 -2.306 1.00 0.00 C ATOM 635 O MET A 283 3.886 -1.149 -2.458 1.00 0.00 O ATOM 636 CB MET A 283 1.197 -0.761 -4.087 1.00 0.00 C ATOM 637 CG MET A 283 0.265 -1.899 -4.472 1.00 0.00 C ATOM 638 SD MET A 283 1.011 -3.522 -4.222 1.00 0.00 S ATOM 639 CE MET A 283 2.336 -3.474 -5.426 1.00 0.00 C ATOM 0 H MET A 283 2.312 1.213 -2.811 1.00 0.00 H new ATOM 0 HA MET A 283 0.681 -1.114 -2.030 1.00 0.00 H new ATOM 0 HB2 MET A 283 0.740 0.186 -4.376 1.00 0.00 H new ATOM 0 HB3 MET A 283 2.124 -0.854 -4.653 1.00 0.00 H new ATOM 0 HG2 MET A 283 -0.650 -1.829 -3.883 1.00 0.00 H new ATOM 0 HG3 MET A 283 -0.020 -1.792 -5.519 1.00 0.00 H new ATOM 0 HE1 MET A 283 2.363 -4.415 -5.975 1.00 0.00 H new ATOM 0 HE2 MET A 283 2.166 -2.653 -6.122 1.00 0.00 H new ATOM 0 HE3 MET A 283 3.287 -3.325 -4.915 1.00 0.00 H new ATOM 649 N SER A 284 2.500 -2.828 -1.889 1.00 0.00 N ATOM 650 CA SER A 284 3.578 -3.758 -1.576 1.00 0.00 C ATOM 651 C SER A 284 3.231 -5.169 -2.042 1.00 0.00 C ATOM 652 O SER A 284 2.101 -5.637 -1.900 1.00 0.00 O ATOM 653 CB SER A 284 3.858 -3.760 -0.072 1.00 0.00 C ATOM 654 OG SER A 284 5.217 -4.063 0.193 1.00 0.00 O ATOM 0 H SER A 284 1.563 -3.210 -1.760 1.00 0.00 H new ATOM 0 HA SER A 284 4.473 -3.429 -2.105 1.00 0.00 H new ATOM 0 HB2 SER A 284 3.611 -2.785 0.348 1.00 0.00 H new ATOM 0 HB3 SER A 284 3.216 -4.491 0.420 1.00 0.00 H new ATOM 0 HG SER A 284 5.371 -4.056 1.161 1.00 0.00 H new ATOM 660 N PRO A 285 4.226 -5.864 -2.614 1.00 0.00 N ATOM 661 CA PRO A 285 4.051 -7.231 -3.113 1.00 0.00 C ATOM 662 C PRO A 285 3.863 -8.240 -1.985 1.00 0.00 C ATOM 663 O PRO A 285 3.374 -9.348 -2.206 1.00 0.00 O ATOM 664 CB PRO A 285 5.358 -7.505 -3.862 1.00 0.00 C ATOM 665 CG PRO A 285 6.356 -6.601 -3.225 1.00 0.00 C ATOM 666 CD PRO A 285 5.598 -5.368 -2.816 1.00 0.00 C ATOM 0 HA PRO A 285 3.160 -7.328 -3.733 1.00 0.00 H new ATOM 0 HB2 PRO A 285 5.655 -8.550 -3.771 1.00 0.00 H new ATOM 0 HB3 PRO A 285 5.256 -7.295 -4.927 1.00 0.00 H new ATOM 0 HG2 PRO A 285 6.819 -7.078 -2.362 1.00 0.00 H new ATOM 0 HG3 PRO A 285 7.158 -6.353 -3.921 1.00 0.00 H new ATOM 0 HD2 PRO A 285 6.005 -4.929 -1.905 1.00 0.00 H new ATOM 0 HD3 PRO A 285 5.638 -4.598 -3.586 1.00 0.00 H new ATOM 674 N MET A 286 4.253 -7.849 -0.776 1.00 0.00 N ATOM 675 CA MET A 286 4.124 -8.720 0.387 1.00 0.00 C ATOM 676 C MET A 286 2.658 -9.015 0.686 1.00 0.00 C ATOM 677 O MET A 286 2.321 -10.090 1.180 1.00 0.00 O ATOM 678 CB MET A 286 4.787 -8.078 1.607 1.00 0.00 C ATOM 679 CG MET A 286 6.301 -7.993 1.503 1.00 0.00 C ATOM 680 SD MET A 286 7.107 -7.952 3.115 1.00 0.00 S ATOM 681 CE MET A 286 7.799 -9.602 3.189 1.00 0.00 C ATOM 0 H MET A 286 4.661 -6.936 -0.576 1.00 0.00 H new ATOM 0 HA MET A 286 4.626 -9.661 0.163 1.00 0.00 H new ATOM 0 HB2 MET A 286 4.384 -7.075 1.743 1.00 0.00 H new ATOM 0 HB3 MET A 286 4.524 -8.651 2.496 1.00 0.00 H new ATOM 0 HG2 MET A 286 6.671 -8.848 0.938 1.00 0.00 H new ATOM 0 HG3 MET A 286 6.573 -7.099 0.942 1.00 0.00 H new ATOM 0 HE1 MET A 286 8.331 -9.731 4.131 1.00 0.00 H new ATOM 0 HE2 MET A 286 6.996 -10.336 3.121 1.00 0.00 H new ATOM 0 HE3 MET A 286 8.491 -9.744 2.359 1.00 0.00 H new ATOM 691 N GLU A 287 1.792 -8.053 0.383 1.00 0.00 N ATOM 692 CA GLU A 287 0.362 -8.212 0.621 1.00 0.00 C ATOM 693 C GLU A 287 -0.429 -8.023 -0.670 1.00 0.00 C ATOM 694 O GLU A 287 -1.482 -7.386 -0.677 1.00 0.00 O ATOM 695 CB GLU A 287 -0.116 -7.211 1.675 1.00 0.00 C ATOM 696 CG GLU A 287 0.793 -7.124 2.889 1.00 0.00 C ATOM 697 CD GLU A 287 0.088 -6.562 4.108 1.00 0.00 C ATOM 698 OE1 GLU A 287 -0.600 -7.337 4.805 1.00 0.00 O ATOM 699 OE2 GLU A 287 0.223 -5.347 4.364 1.00 0.00 O ATOM 0 H GLU A 287 2.055 -7.157 -0.027 1.00 0.00 H new ATOM 0 HA GLU A 287 0.191 -9.224 0.987 1.00 0.00 H new ATOM 0 HB2 GLU A 287 -0.193 -6.224 1.218 1.00 0.00 H new ATOM 0 HB3 GLU A 287 -1.118 -7.490 2.001 1.00 0.00 H new ATOM 0 HG2 GLU A 287 1.177 -8.117 3.122 1.00 0.00 H new ATOM 0 HG3 GLU A 287 1.652 -6.498 2.650 1.00 0.00 H new ATOM 706 N GLN A 288 0.087 -8.582 -1.760 1.00 0.00 N ATOM 707 CA GLN A 288 -0.570 -8.475 -3.057 1.00 0.00 C ATOM 708 C GLN A 288 -1.516 -9.648 -3.287 1.00 0.00 C ATOM 709 O GLN A 288 -1.285 -10.485 -4.161 1.00 0.00 O ATOM 710 CB GLN A 288 0.471 -8.417 -4.177 1.00 0.00 C ATOM 711 CG GLN A 288 1.248 -9.712 -4.352 1.00 0.00 C ATOM 712 CD GLN A 288 2.654 -9.483 -4.870 1.00 0.00 C ATOM 713 OE1 GLN A 288 2.910 -8.526 -5.602 1.00 0.00 O ATOM 714 NE2 GLN A 288 3.575 -10.362 -4.493 1.00 0.00 N ATOM 0 H GLN A 288 0.958 -9.113 -1.771 1.00 0.00 H new ATOM 0 HA GLN A 288 -1.154 -7.554 -3.065 1.00 0.00 H new ATOM 0 HB2 GLN A 288 -0.029 -8.173 -5.114 1.00 0.00 H new ATOM 0 HB3 GLN A 288 1.171 -7.608 -3.970 1.00 0.00 H new ATOM 0 HG2 GLN A 288 1.297 -10.234 -3.396 1.00 0.00 H new ATOM 0 HG3 GLN A 288 0.712 -10.363 -5.043 1.00 0.00 H new ATOM 0 HE21 GLN A 288 3.319 -11.140 -3.885 1.00 0.00 H new ATOM 0 HE22 GLN A 288 4.539 -10.259 -4.811 1.00 0.00 H new ATOM 723 N THR A 289 -2.584 -9.705 -2.496 1.00 0.00 N ATOM 724 CA THR A 289 -3.565 -10.777 -2.612 1.00 0.00 C ATOM 725 C THR A 289 -4.717 -10.371 -3.524 1.00 0.00 C ATOM 726 O THR A 289 -5.154 -9.221 -3.513 1.00 0.00 O ATOM 727 CB THR A 289 -4.130 -11.172 -1.235 1.00 0.00 C ATOM 728 OG1 THR A 289 -5.297 -11.985 -1.399 1.00 0.00 O ATOM 729 CG2 THR A 289 -4.476 -9.937 -0.417 1.00 0.00 C ATOM 0 H THR A 289 -2.791 -9.021 -1.768 1.00 0.00 H new ATOM 0 HA THR A 289 -3.048 -11.634 -3.044 1.00 0.00 H new ATOM 0 HB THR A 289 -3.366 -11.738 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 289 -5.649 -12.233 -0.519 1.00 0.00 H new ATOM 0 HG21 THR A 289 -4.873 -10.241 0.551 1.00 0.00 H new ATOM 0 HG22 THR A 289 -3.579 -9.336 -0.269 1.00 0.00 H new ATOM 0 HG23 THR A 289 -5.224 -9.347 -0.947 1.00 0.00 H new ATOM 737 N SER A 290 -5.205 -11.324 -4.313 1.00 0.00 N ATOM 738 CA SER A 290 -6.305 -11.065 -5.234 1.00 0.00 C ATOM 739 C SER A 290 -6.082 -9.760 -5.993 1.00 0.00 C ATOM 740 O SER A 290 -7.031 -9.125 -6.454 1.00 0.00 O ATOM 741 CB SER A 290 -7.631 -11.005 -4.474 1.00 0.00 C ATOM 742 OG SER A 290 -7.737 -12.073 -3.549 1.00 0.00 O ATOM 0 H SER A 290 -4.856 -12.282 -4.332 1.00 0.00 H new ATOM 0 HA SER A 290 -6.343 -11.882 -5.954 1.00 0.00 H new ATOM 0 HB2 SER A 290 -7.709 -10.054 -3.947 1.00 0.00 H new ATOM 0 HB3 SER A 290 -8.461 -11.047 -5.180 1.00 0.00 H new ATOM 0 HG SER A 290 -8.592 -12.011 -3.075 1.00 0.00 H new ATOM 748 N THR A 291 -4.818 -9.366 -6.121 1.00 0.00 N ATOM 749 CA THR A 291 -4.469 -8.137 -6.823 1.00 0.00 C ATOM 750 C THR A 291 -4.198 -8.405 -8.299 1.00 0.00 C ATOM 751 O THR A 291 -4.852 -7.836 -9.173 1.00 0.00 O ATOM 752 CB THR A 291 -3.230 -7.468 -6.199 1.00 0.00 C ATOM 753 OG1 THR A 291 -2.070 -8.276 -6.425 1.00 0.00 O ATOM 754 CG2 THR A 291 -3.423 -7.256 -4.705 1.00 0.00 C ATOM 0 H THR A 291 -4.020 -9.880 -5.748 1.00 0.00 H new ATOM 0 HA THR A 291 -5.322 -7.465 -6.729 1.00 0.00 H new ATOM 0 HB THR A 291 -3.093 -6.496 -6.673 1.00 0.00 H new ATOM 0 HG1 THR A 291 -1.352 -7.721 -6.795 1.00 0.00 H new ATOM 0 HG21 THR A 291 -2.535 -6.782 -4.287 1.00 0.00 H new ATOM 0 HG22 THR A 291 -4.289 -6.616 -4.537 1.00 0.00 H new ATOM 0 HG23 THR A 291 -3.584 -8.218 -4.219 1.00 0.00 H new ATOM 762 N SER A 292 -3.231 -9.276 -8.570 1.00 0.00 N ATOM 763 CA SER A 292 -2.872 -9.617 -9.942 1.00 0.00 C ATOM 764 C SER A 292 -4.109 -9.651 -10.834 1.00 0.00 C ATOM 765 O SER A 292 -4.066 -9.227 -11.989 1.00 0.00 O ATOM 766 CB SER A 292 -2.162 -10.971 -9.984 1.00 0.00 C ATOM 767 OG SER A 292 -0.838 -10.868 -9.490 1.00 0.00 O ATOM 0 H SER A 292 -2.682 -9.758 -7.858 1.00 0.00 H new ATOM 0 HA SER A 292 -2.196 -8.848 -10.317 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.719 -11.696 -9.391 1.00 0.00 H new ATOM 0 HB3 SER A 292 -2.143 -11.344 -11.008 1.00 0.00 H new ATOM 0 HG SER A 292 -0.406 -11.747 -9.526 1.00 0.00 H new ATOM 773 N GLU A 293 -5.211 -10.159 -10.290 1.00 0.00 N ATOM 774 CA GLU A 293 -6.460 -10.249 -11.037 1.00 0.00 C ATOM 775 C GLU A 293 -6.897 -8.874 -11.533 1.00 0.00 C ATOM 776 O GLU A 293 -7.267 -8.710 -12.695 1.00 0.00 O ATOM 777 CB GLU A 293 -7.558 -10.862 -10.165 1.00 0.00 C ATOM 778 CG GLU A 293 -8.652 -11.553 -10.962 1.00 0.00 C ATOM 779 CD GLU A 293 -8.194 -12.868 -11.562 1.00 0.00 C ATOM 780 OE1 GLU A 293 -7.932 -13.814 -10.789 1.00 0.00 O ATOM 781 OE2 GLU A 293 -8.097 -12.952 -12.804 1.00 0.00 O ATOM 0 H GLU A 293 -5.264 -10.514 -9.335 1.00 0.00 H new ATOM 0 HA GLU A 293 -6.292 -10.891 -11.901 1.00 0.00 H new ATOM 0 HB2 GLU A 293 -7.108 -11.582 -9.481 1.00 0.00 H new ATOM 0 HB3 GLU A 293 -8.005 -10.078 -9.554 1.00 0.00 H new ATOM 0 HG2 GLU A 293 -9.510 -11.733 -10.314 1.00 0.00 H new ATOM 0 HG3 GLU A 293 -8.988 -10.891 -11.760 1.00 0.00 H new ATOM 788 N GLY A 294 -6.852 -7.887 -10.643 1.00 0.00 N ATOM 789 CA GLY A 294 -7.247 -6.540 -11.008 1.00 0.00 C ATOM 790 C GLY A 294 -7.157 -5.573 -9.844 1.00 0.00 C ATOM 791 O GLY A 294 -6.971 -4.372 -10.038 1.00 0.00 O ATOM 0 H GLY A 294 -6.549 -7.997 -9.675 1.00 0.00 H new ATOM 0 HA2 GLY A 294 -6.612 -6.186 -11.820 1.00 0.00 H new ATOM 0 HA3 GLY A 294 -8.269 -6.554 -11.386 1.00 0.00 H new ATOM 795 N TRP A 295 -7.292 -6.098 -8.631 1.00 0.00 N ATOM 796 CA TRP A 295 -7.227 -5.272 -7.430 1.00 0.00 C ATOM 797 C TRP A 295 -5.780 -5.033 -7.012 1.00 0.00 C ATOM 798 O TRP A 295 -4.850 -5.512 -7.661 1.00 0.00 O ATOM 799 CB TRP A 295 -7.998 -5.935 -6.288 1.00 0.00 C ATOM 800 CG TRP A 295 -9.438 -6.192 -6.614 1.00 0.00 C ATOM 801 CD1 TRP A 295 -9.941 -7.236 -7.338 1.00 0.00 C ATOM 802 CD2 TRP A 295 -10.560 -5.390 -6.229 1.00 0.00 C ATOM 803 NE1 TRP A 295 -11.308 -7.131 -7.426 1.00 0.00 N ATOM 804 CE2 TRP A 295 -11.712 -6.008 -6.754 1.00 0.00 C ATOM 805 CE3 TRP A 295 -10.703 -4.212 -5.492 1.00 0.00 C ATOM 806 CZ2 TRP A 295 -12.989 -5.484 -6.564 1.00 0.00 C ATOM 807 CZ3 TRP A 295 -11.971 -3.694 -5.304 1.00 0.00 C ATOM 808 CH2 TRP A 295 -13.100 -4.330 -5.838 1.00 0.00 C ATOM 0 H TRP A 295 -7.447 -7.090 -8.453 1.00 0.00 H new ATOM 0 HA TRP A 295 -7.684 -4.309 -7.656 1.00 0.00 H new ATOM 0 HB2 TRP A 295 -7.516 -6.879 -6.034 1.00 0.00 H new ATOM 0 HB3 TRP A 295 -7.941 -5.300 -5.404 1.00 0.00 H new ATOM 0 HD1 TRP A 295 -9.351 -8.027 -7.776 1.00 0.00 H new ATOM 0 HE1 TRP A 295 -11.922 -7.784 -7.913 1.00 0.00 H new ATOM 0 HE3 TRP A 295 -9.839 -3.715 -5.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 295 -13.860 -5.972 -6.975 1.00 0.00 H new ATOM 0 HZ3 TRP A 295 -12.094 -2.784 -4.736 1.00 0.00 H new ATOM 0 HH2 TRP A 295 -14.077 -3.900 -5.673 1.00 0.00 H new ATOM 819 N ILE A 296 -5.598 -4.290 -5.925 1.00 0.00 N ATOM 820 CA ILE A 296 -4.264 -3.989 -5.421 1.00 0.00 C ATOM 821 C ILE A 296 -4.304 -3.632 -3.939 1.00 0.00 C ATOM 822 O ILE A 296 -5.174 -2.882 -3.494 1.00 0.00 O ATOM 823 CB ILE A 296 -3.616 -2.830 -6.200 1.00 0.00 C ATOM 824 CG1 ILE A 296 -4.672 -1.791 -6.584 1.00 0.00 C ATOM 825 CG2 ILE A 296 -2.907 -3.356 -7.439 1.00 0.00 C ATOM 826 CD1 ILE A 296 -4.123 -0.386 -6.700 1.00 0.00 C ATOM 0 H ILE A 296 -6.357 -3.886 -5.377 1.00 0.00 H new ATOM 0 HA ILE A 296 -3.664 -4.888 -5.559 1.00 0.00 H new ATOM 0 HB ILE A 296 -2.877 -2.349 -5.559 1.00 0.00 H new ATOM 0 HG12 ILE A 296 -5.122 -2.076 -7.535 1.00 0.00 H new ATOM 0 HG13 ILE A 296 -5.468 -1.801 -5.839 1.00 0.00 H new ATOM 0 HG21 ILE A 296 -2.454 -2.525 -7.979 1.00 0.00 H new ATOM 0 HG22 ILE A 296 -2.131 -4.062 -7.142 1.00 0.00 H new ATOM 0 HG23 ILE A 296 -3.627 -3.859 -8.084 1.00 0.00 H new ATOM 0 HD11 ILE A 296 -4.927 0.297 -6.975 1.00 0.00 H new ATOM 0 HD12 ILE A 296 -3.699 -0.081 -5.743 1.00 0.00 H new ATOM 0 HD13 ILE A 296 -3.347 -0.360 -7.466 1.00 0.00 H new ATOM 838 N TYR A 297 -3.357 -4.171 -3.180 1.00 0.00 N ATOM 839 CA TYR A 297 -3.284 -3.909 -1.747 1.00 0.00 C ATOM 840 C TYR A 297 -2.428 -2.679 -1.461 1.00 0.00 C ATOM 841 O TYR A 297 -1.215 -2.693 -1.661 1.00 0.00 O ATOM 842 CB TYR A 297 -2.712 -5.124 -1.014 1.00 0.00 C ATOM 843 CG TYR A 297 -2.886 -5.063 0.486 1.00 0.00 C ATOM 844 CD1 TYR A 297 -1.919 -4.476 1.294 1.00 0.00 C ATOM 845 CD2 TYR A 297 -4.016 -5.592 1.097 1.00 0.00 C ATOM 846 CE1 TYR A 297 -2.073 -4.418 2.665 1.00 0.00 C ATOM 847 CE2 TYR A 297 -4.179 -5.537 2.468 1.00 0.00 C ATOM 848 CZ TYR A 297 -3.205 -4.950 3.248 1.00 0.00 C ATOM 849 OH TYR A 297 -3.363 -4.894 4.613 1.00 0.00 O ATOM 0 H TYR A 297 -2.629 -4.792 -3.533 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.295 -3.718 -1.386 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -3.195 -6.026 -1.391 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.650 -5.211 -1.245 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -1.032 -4.058 0.842 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -4.780 -6.054 0.490 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -1.312 -3.959 3.278 1.00 0.00 H new ATOM 0 HE2 TYR A 297 -5.065 -5.952 2.926 1.00 0.00 H new ATOM 0 HH TYR A 297 -4.214 -5.312 4.861 1.00 0.00 H new ATOM 859 N GLY A 298 -3.072 -1.615 -0.990 1.00 0.00 N ATOM 860 CA GLY A 298 -2.356 -0.391 -0.683 1.00 0.00 C ATOM 861 C GLY A 298 -2.724 0.171 0.676 1.00 0.00 C ATOM 862 O GLY A 298 -3.699 -0.261 1.292 1.00 0.00 O ATOM 0 H GLY A 298 -4.076 -1.579 -0.816 1.00 0.00 H new ATOM 0 HA2 GLY A 298 -1.284 -0.583 -0.715 1.00 0.00 H new ATOM 0 HA3 GLY A 298 -2.569 0.353 -1.450 1.00 0.00 H new ATOM 866 N THR A 299 -1.942 1.138 1.147 1.00 0.00 N ATOM 867 CA THR A 299 -2.190 1.758 2.442 1.00 0.00 C ATOM 868 C THR A 299 -2.285 3.274 2.317 1.00 0.00 C ATOM 869 O THR A 299 -1.316 3.937 1.947 1.00 0.00 O ATOM 870 CB THR A 299 -1.083 1.406 3.454 1.00 0.00 C ATOM 871 OG1 THR A 299 -1.017 -0.013 3.634 1.00 0.00 O ATOM 872 CG2 THR A 299 -1.339 2.081 4.793 1.00 0.00 C ATOM 0 H THR A 299 -1.132 1.508 0.650 1.00 0.00 H new ATOM 0 HA THR A 299 -3.141 1.366 2.803 1.00 0.00 H new ATOM 0 HB THR A 299 -0.133 1.766 3.060 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.310 -0.229 4.277 1.00 0.00 H new ATOM 0 HG21 THR A 299 -0.544 1.818 5.491 1.00 0.00 H new ATOM 0 HG22 THR A 299 -1.359 3.162 4.657 1.00 0.00 H new ATOM 0 HG23 THR A 299 -2.297 1.747 5.191 1.00 0.00 H new ATOM 880 N SER A 300 -3.457 3.817 2.629 1.00 0.00 N ATOM 881 CA SER A 300 -3.679 5.255 2.548 1.00 0.00 C ATOM 882 C SER A 300 -2.647 6.012 3.378 1.00 0.00 C ATOM 883 O SER A 300 -2.185 5.524 4.411 1.00 0.00 O ATOM 884 CB SER A 300 -5.090 5.603 3.027 1.00 0.00 C ATOM 885 OG SER A 300 -5.463 6.905 2.611 1.00 0.00 O ATOM 0 H SER A 300 -4.268 3.282 2.940 1.00 0.00 H new ATOM 0 HA SER A 300 -3.573 5.555 1.506 1.00 0.00 H new ATOM 0 HB2 SER A 300 -5.800 4.875 2.635 1.00 0.00 H new ATOM 0 HB3 SER A 300 -5.135 5.538 4.114 1.00 0.00 H new ATOM 0 HG SER A 300 -4.674 7.379 2.274 1.00 0.00 H new ATOM 891 N LEU A 301 -2.289 7.207 2.921 1.00 0.00 N ATOM 892 CA LEU A 301 -1.311 8.033 3.621 1.00 0.00 C ATOM 893 C LEU A 301 -1.993 8.930 4.649 1.00 0.00 C ATOM 894 O LEU A 301 -1.513 9.081 5.773 1.00 0.00 O ATOM 895 CB LEU A 301 -0.527 8.886 2.622 1.00 0.00 C ATOM 896 CG LEU A 301 0.816 9.427 3.112 1.00 0.00 C ATOM 897 CD1 LEU A 301 1.876 8.337 3.076 1.00 0.00 C ATOM 898 CD2 LEU A 301 1.248 10.621 2.272 1.00 0.00 C ATOM 0 H LEU A 301 -2.661 7.626 2.069 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.621 7.372 4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.351 8.291 1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.151 9.730 2.327 1.00 0.00 H new ATOM 0 HG LEU A 301 0.698 9.757 4.144 1.00 0.00 H new ATOM 0 HD11 LEU A 301 2.825 8.741 3.428 1.00 0.00 H new ATOM 0 HD12 LEU A 301 1.571 7.512 3.720 1.00 0.00 H new ATOM 0 HD13 LEU A 301 1.992 7.976 2.054 1.00 0.00 H new ATOM 0 HD21 LEU A 301 2.206 10.993 2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 301 1.348 10.316 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 301 0.500 11.410 2.349 1.00 0.00 H new ATOM 910 N THR A 302 -3.116 9.523 4.257 1.00 0.00 N ATOM 911 CA THR A 302 -3.865 10.405 5.144 1.00 0.00 C ATOM 912 C THR A 302 -4.427 9.638 6.335 1.00 0.00 C ATOM 913 O THR A 302 -4.097 9.928 7.486 1.00 0.00 O ATOM 914 CB THR A 302 -5.023 11.098 4.401 1.00 0.00 C ATOM 915 OG1 THR A 302 -4.515 12.151 3.575 1.00 0.00 O ATOM 916 CG2 THR A 302 -6.036 11.662 5.386 1.00 0.00 C ATOM 0 H THR A 302 -3.527 9.409 3.331 1.00 0.00 H new ATOM 0 HA THR A 302 -3.167 11.163 5.500 1.00 0.00 H new ATOM 0 HB THR A 302 -5.521 10.356 3.776 1.00 0.00 H new ATOM 0 HG1 THR A 302 -4.016 11.766 2.824 1.00 0.00 H new ATOM 0 HG21 THR A 302 -6.845 12.147 4.839 1.00 0.00 H new ATOM 0 HG22 THR A 302 -6.442 10.853 5.993 1.00 0.00 H new ATOM 0 HG23 THR A 302 -5.548 12.391 6.033 1.00 0.00 H new ATOM 924 N THR A 303 -5.278 8.656 6.054 1.00 0.00 N ATOM 925 CA THR A 303 -5.886 7.847 7.102 1.00 0.00 C ATOM 926 C THR A 303 -4.888 6.846 7.673 1.00 0.00 C ATOM 927 O THR A 303 -4.717 6.749 8.887 1.00 0.00 O ATOM 928 CB THR A 303 -7.119 7.086 6.580 1.00 0.00 C ATOM 929 OG1 THR A 303 -6.711 6.055 5.674 1.00 0.00 O ATOM 930 CG2 THR A 303 -8.083 8.031 5.880 1.00 0.00 C ATOM 0 H THR A 303 -5.562 8.402 5.108 1.00 0.00 H new ATOM 0 HA THR A 303 -6.199 8.533 7.889 1.00 0.00 H new ATOM 0 HB THR A 303 -7.630 6.639 7.433 1.00 0.00 H new ATOM 0 HG1 THR A 303 -7.501 5.575 5.348 1.00 0.00 H new ATOM 0 HG21 THR A 303 -8.946 7.470 5.520 1.00 0.00 H new ATOM 0 HG22 THR A 303 -8.415 8.797 6.581 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.580 8.504 5.036 1.00 0.00 H new ATOM 938 N GLY A 304 -4.231 6.103 6.788 1.00 0.00 N ATOM 939 CA GLY A 304 -3.257 5.118 7.224 1.00 0.00 C ATOM 940 C GLY A 304 -3.804 3.705 7.184 1.00 0.00 C ATOM 941 O GLY A 304 -3.173 2.774 7.686 1.00 0.00 O ATOM 0 H GLY A 304 -4.355 6.165 5.777 1.00 0.00 H new ATOM 0 HA2 GLY A 304 -2.373 5.180 6.589 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -2.938 5.352 8.240 1.00 0.00 H new ATOM 945 N CYS A 305 -4.980 3.544 6.588 1.00 0.00 N ATOM 946 CA CYS A 305 -5.613 2.234 6.488 1.00 0.00 C ATOM 947 C CYS A 305 -5.077 1.462 5.287 1.00 0.00 C ATOM 948 O CYS A 305 -4.628 2.054 4.305 1.00 0.00 O ATOM 949 CB CYS A 305 -7.131 2.385 6.375 1.00 0.00 C ATOM 950 SG CYS A 305 -7.918 3.058 7.858 1.00 0.00 S ATOM 0 H CYS A 305 -5.514 4.304 6.167 1.00 0.00 H new ATOM 0 HA CYS A 305 -5.377 1.674 7.393 1.00 0.00 H new ATOM 0 HB2 CYS A 305 -7.359 3.034 5.529 1.00 0.00 H new ATOM 0 HB3 CYS A 305 -7.567 1.410 6.156 1.00 0.00 H new ATOM 0 HG CYS A 305 -9.200 3.150 7.665 1.00 0.00 H new ATOM 956 N SER A 306 -5.124 0.136 5.373 1.00 0.00 N ATOM 957 CA SER A 306 -4.638 -0.718 4.296 1.00 0.00 C ATOM 958 C SER A 306 -5.721 -1.693 3.844 1.00 0.00 C ATOM 959 O SER A 306 -6.435 -2.268 4.665 1.00 0.00 O ATOM 960 CB SER A 306 -3.397 -1.490 4.749 1.00 0.00 C ATOM 961 OG SER A 306 -3.689 -2.314 5.864 1.00 0.00 O ATOM 0 H SER A 306 -5.494 -0.370 6.178 1.00 0.00 H new ATOM 0 HA SER A 306 -4.373 -0.081 3.452 1.00 0.00 H new ATOM 0 HB2 SER A 306 -3.026 -2.102 3.927 1.00 0.00 H new ATOM 0 HB3 SER A 306 -2.603 -0.789 5.008 1.00 0.00 H new ATOM 0 HG SER A 306 -3.622 -3.256 5.601 1.00 0.00 H new ATOM 967 N GLY A 307 -5.836 -1.874 2.532 1.00 0.00 N ATOM 968 CA GLY A 307 -6.834 -2.780 1.993 1.00 0.00 C ATOM 969 C GLY A 307 -6.729 -2.928 0.488 1.00 0.00 C ATOM 970 O GLY A 307 -5.796 -2.415 -0.130 1.00 0.00 O ATOM 0 H GLY A 307 -5.256 -1.410 1.833 1.00 0.00 H new ATOM 0 HA2 GLY A 307 -6.722 -3.759 2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 307 -7.828 -2.416 2.251 1.00 0.00 H new ATOM 974 N LEU A 308 -7.688 -3.632 -0.103 1.00 0.00 N ATOM 975 CA LEU A 308 -7.699 -3.849 -1.546 1.00 0.00 C ATOM 976 C LEU A 308 -8.490 -2.754 -2.254 1.00 0.00 C ATOM 977 O LEU A 308 -9.531 -2.310 -1.767 1.00 0.00 O ATOM 978 CB LEU A 308 -8.298 -5.218 -1.871 1.00 0.00 C ATOM 979 CG LEU A 308 -7.346 -6.410 -1.763 1.00 0.00 C ATOM 980 CD1 LEU A 308 -8.123 -7.717 -1.787 1.00 0.00 C ATOM 981 CD2 LEU A 308 -6.320 -6.377 -2.885 1.00 0.00 C ATOM 0 H LEU A 308 -8.468 -4.062 0.394 1.00 0.00 H new ATOM 0 HA LEU A 308 -6.669 -3.816 -1.902 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -9.142 -5.391 -1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -8.696 -5.187 -2.885 1.00 0.00 H new ATOM 0 HG LEU A 308 -6.817 -6.343 -0.812 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.429 -8.554 -1.709 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.818 -7.743 -0.948 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -8.679 -7.792 -2.721 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -5.651 -7.233 -2.792 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.831 -6.419 -3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -5.741 -5.456 -2.822 1.00 0.00 H new ATOM 993 N LEU A 309 -7.991 -2.323 -3.408 1.00 0.00 N ATOM 994 CA LEU A 309 -8.652 -1.281 -4.186 1.00 0.00 C ATOM 995 C LEU A 309 -8.505 -1.543 -5.681 1.00 0.00 C ATOM 996 O LEU A 309 -7.582 -2.222 -6.130 1.00 0.00 O ATOM 997 CB LEU A 309 -8.070 0.090 -3.837 1.00 0.00 C ATOM 998 CG LEU A 309 -6.555 0.144 -3.633 1.00 0.00 C ATOM 999 CD1 LEU A 309 -6.044 1.566 -3.802 1.00 0.00 C ATOM 1000 CD2 LEU A 309 -6.183 -0.399 -2.261 1.00 0.00 C ATOM 0 H LEU A 309 -7.131 -2.679 -3.825 1.00 0.00 H new ATOM 0 HA LEU A 309 -9.713 -1.293 -3.936 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -8.335 0.788 -4.632 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -8.552 0.446 -2.927 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.083 -0.482 -4.390 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -4.964 1.585 -3.653 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.278 1.920 -4.806 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.523 2.214 -3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -5.102 -0.353 -2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.666 0.201 -1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.515 -1.434 -2.177 1.00 0.00 H new ATOM 1012 N PRO A 310 -9.437 -0.991 -6.473 1.00 0.00 N ATOM 1013 CA PRO A 310 -9.432 -1.148 -7.930 1.00 0.00 C ATOM 1014 C PRO A 310 -8.283 -0.394 -8.591 1.00 0.00 C ATOM 1015 O PRO A 310 -8.204 0.831 -8.507 1.00 0.00 O ATOM 1016 CB PRO A 310 -10.777 -0.554 -8.356 1.00 0.00 C ATOM 1017 CG PRO A 310 -11.123 0.413 -7.276 1.00 0.00 C ATOM 1018 CD PRO A 310 -10.567 -0.170 -6.006 1.00 0.00 C ATOM 0 HA PRO A 310 -9.297 -2.188 -8.227 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -10.702 -0.057 -9.323 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -11.538 -1.328 -8.454 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -10.692 1.394 -7.477 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -12.202 0.548 -7.204 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -10.240 0.608 -5.316 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -11.310 -0.770 -5.481 1.00 0.00 H new ATOM 1026 N GLU A 311 -7.395 -1.134 -9.247 1.00 0.00 N ATOM 1027 CA GLU A 311 -6.250 -0.533 -9.922 1.00 0.00 C ATOM 1028 C GLU A 311 -6.701 0.540 -10.909 1.00 0.00 C ATOM 1029 O GLU A 311 -5.896 1.339 -11.384 1.00 0.00 O ATOM 1030 CB GLU A 311 -5.440 -1.606 -10.653 1.00 0.00 C ATOM 1031 CG GLU A 311 -5.991 -1.955 -12.025 1.00 0.00 C ATOM 1032 CD GLU A 311 -5.059 -2.851 -12.817 1.00 0.00 C ATOM 1033 OE1 GLU A 311 -3.867 -2.502 -12.944 1.00 0.00 O ATOM 1034 OE2 GLU A 311 -5.522 -3.901 -13.310 1.00 0.00 O ATOM 0 H GLU A 311 -7.446 -2.150 -9.326 1.00 0.00 H new ATOM 0 HA GLU A 311 -5.620 -0.064 -9.166 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -4.411 -1.262 -10.761 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -5.412 -2.508 -10.042 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -6.955 -2.451 -11.910 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -6.169 -1.037 -12.585 1.00 0.00 H new ATOM 1041 N ASN A 312 -7.995 0.549 -11.213 1.00 0.00 N ATOM 1042 CA ASN A 312 -8.555 1.522 -12.144 1.00 0.00 C ATOM 1043 C ASN A 312 -9.022 2.774 -11.407 1.00 0.00 C ATOM 1044 O ASN A 312 -9.850 3.531 -11.912 1.00 0.00 O ATOM 1045 CB ASN A 312 -9.723 0.907 -12.917 1.00 0.00 C ATOM 1046 CG ASN A 312 -9.264 0.131 -14.137 1.00 0.00 C ATOM 1047 OD1 ASN A 312 -8.099 0.203 -14.530 1.00 0.00 O ATOM 1048 ND2 ASN A 312 -10.179 -0.616 -14.742 1.00 0.00 N ATOM 0 H ASN A 312 -8.675 -0.106 -10.828 1.00 0.00 H new ATOM 0 HA ASN A 312 -7.772 1.806 -12.847 1.00 0.00 H new ATOM 0 HB2 ASN A 312 -10.283 0.244 -12.257 1.00 0.00 H new ATOM 0 HB3 ASN A 312 -10.406 1.698 -13.228 1.00 0.00 H new ATOM 0 HD21 ASN A 312 -9.928 -1.160 -15.567 1.00 0.00 H new ATOM 0 HD22 ASN A 312 -11.133 -0.646 -14.382 1.00 0.00 H new ATOM 1055 N TYR A 313 -8.484 2.985 -10.211 1.00 0.00 N ATOM 1056 CA TYR A 313 -8.846 4.143 -9.403 1.00 0.00 C ATOM 1057 C TYR A 313 -7.601 4.871 -8.904 1.00 0.00 C ATOM 1058 O TYR A 313 -7.695 5.933 -8.288 1.00 0.00 O ATOM 1059 CB TYR A 313 -9.710 3.714 -8.216 1.00 0.00 C ATOM 1060 CG TYR A 313 -11.150 3.436 -8.584 1.00 0.00 C ATOM 1061 CD1 TYR A 313 -11.472 2.459 -9.518 1.00 0.00 C ATOM 1062 CD2 TYR A 313 -12.188 4.150 -7.999 1.00 0.00 C ATOM 1063 CE1 TYR A 313 -12.786 2.201 -9.857 1.00 0.00 C ATOM 1064 CE2 TYR A 313 -13.505 3.899 -8.331 1.00 0.00 C ATOM 1065 CZ TYR A 313 -13.799 2.924 -9.261 1.00 0.00 C ATOM 1066 OH TYR A 313 -15.109 2.671 -9.596 1.00 0.00 O ATOM 0 H TYR A 313 -7.795 2.369 -9.780 1.00 0.00 H new ATOM 0 HA TYR A 313 -9.417 4.827 -10.031 1.00 0.00 H new ATOM 0 HB2 TYR A 313 -9.279 2.818 -7.768 1.00 0.00 H new ATOM 0 HB3 TYR A 313 -9.682 4.495 -7.456 1.00 0.00 H new ATOM 0 HD1 TYR A 313 -10.682 1.892 -9.987 1.00 0.00 H new ATOM 0 HD2 TYR A 313 -11.961 4.915 -7.271 1.00 0.00 H new ATOM 0 HE1 TYR A 313 -13.019 1.438 -10.585 1.00 0.00 H new ATOM 0 HE2 TYR A 313 -14.300 4.463 -7.865 1.00 0.00 H new ATOM 0 HH TYR A 313 -15.698 3.265 -9.086 1.00 0.00 H new ATOM 1076 N ILE A 314 -6.437 4.291 -9.175 1.00 0.00 N ATOM 1077 CA ILE A 314 -5.173 4.883 -8.756 1.00 0.00 C ATOM 1078 C ILE A 314 -4.225 5.050 -9.939 1.00 0.00 C ATOM 1079 O ILE A 314 -4.477 4.536 -11.029 1.00 0.00 O ATOM 1080 CB ILE A 314 -4.483 4.031 -7.675 1.00 0.00 C ATOM 1081 CG1 ILE A 314 -4.331 2.586 -8.154 1.00 0.00 C ATOM 1082 CG2 ILE A 314 -5.271 4.084 -6.375 1.00 0.00 C ATOM 1083 CD1 ILE A 314 -3.089 2.351 -8.985 1.00 0.00 C ATOM 0 H ILE A 314 -6.343 3.411 -9.683 1.00 0.00 H new ATOM 0 HA ILE A 314 -5.406 5.863 -8.340 1.00 0.00 H new ATOM 0 HB ILE A 314 -3.489 4.439 -7.491 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -4.309 1.925 -7.287 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -5.208 2.312 -8.741 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -4.770 3.477 -5.621 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -5.332 5.116 -6.028 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -6.276 3.698 -6.543 1.00 0.00 H new ATOM 0 HD11 ILE A 314 -3.047 1.305 -9.289 1.00 0.00 H new ATOM 0 HD12 ILE A 314 -3.118 2.986 -9.871 1.00 0.00 H new ATOM 0 HD13 ILE A 314 -2.205 2.593 -8.395 1.00 0.00 H new ATOM 1095 N THR A 315 -3.130 5.771 -9.716 1.00 0.00 N ATOM 1096 CA THR A 315 -2.143 6.005 -10.762 1.00 0.00 C ATOM 1097 C THR A 315 -0.747 6.173 -10.173 1.00 0.00 C ATOM 1098 O THR A 315 -0.587 6.334 -8.963 1.00 0.00 O ATOM 1099 CB THR A 315 -2.491 7.255 -11.593 1.00 0.00 C ATOM 1100 OG1 THR A 315 -1.650 7.324 -12.749 1.00 0.00 O ATOM 1101 CG2 THR A 315 -2.326 8.519 -10.763 1.00 0.00 C ATOM 0 H THR A 315 -2.905 6.203 -8.820 1.00 0.00 H new ATOM 0 HA THR A 315 -2.157 5.130 -11.412 1.00 0.00 H new ATOM 0 HB THR A 315 -3.532 7.178 -11.906 1.00 0.00 H new ATOM 0 HG1 THR A 315 -1.879 8.120 -13.273 1.00 0.00 H new ATOM 0 HG21 THR A 315 -2.577 9.389 -11.370 1.00 0.00 H new ATOM 0 HG22 THR A 315 -2.989 8.476 -9.899 1.00 0.00 H new ATOM 0 HG23 THR A 315 -1.293 8.599 -10.424 1.00 0.00 H new ATOM 1109 N LYS A 316 0.262 6.134 -11.036 1.00 0.00 N ATOM 1110 CA LYS A 316 1.646 6.284 -10.603 1.00 0.00 C ATOM 1111 C LYS A 316 1.952 7.736 -10.250 1.00 0.00 C ATOM 1112 O LYS A 316 1.451 8.659 -10.891 1.00 0.00 O ATOM 1113 CB LYS A 316 2.600 5.803 -11.698 1.00 0.00 C ATOM 1114 CG LYS A 316 2.921 4.320 -11.618 1.00 0.00 C ATOM 1115 CD LYS A 316 1.672 3.492 -11.369 1.00 0.00 C ATOM 1116 CE LYS A 316 0.810 3.394 -12.619 1.00 0.00 C ATOM 1117 NZ LYS A 316 0.049 2.116 -12.669 1.00 0.00 N ATOM 0 H LYS A 316 0.147 6.000 -12.041 1.00 0.00 H new ATOM 0 HA LYS A 316 1.789 5.674 -9.711 1.00 0.00 H new ATOM 0 HB2 LYS A 316 2.160 6.019 -12.672 1.00 0.00 H new ATOM 0 HB3 LYS A 316 3.528 6.371 -11.635 1.00 0.00 H new ATOM 0 HG2 LYS A 316 3.393 3.998 -12.546 1.00 0.00 H new ATOM 0 HG3 LYS A 316 3.640 4.145 -10.818 1.00 0.00 H new ATOM 0 HD2 LYS A 316 1.956 2.492 -11.042 1.00 0.00 H new ATOM 0 HD3 LYS A 316 1.093 3.939 -10.561 1.00 0.00 H new ATOM 0 HE2 LYS A 316 0.114 4.232 -12.647 1.00 0.00 H new ATOM 0 HE3 LYS A 316 1.442 3.475 -13.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 -0.526 2.088 -13.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 0.714 1.316 -12.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 -0.573 2.050 -11.838 1.00 0.00 H new ATOM 1131 N ALA A 317 2.778 7.930 -9.227 1.00 0.00 N ATOM 1132 CA ALA A 317 3.153 9.270 -8.791 1.00 0.00 C ATOM 1133 C ALA A 317 3.867 10.029 -9.904 1.00 0.00 C ATOM 1134 O ALA A 317 5.073 9.876 -10.097 1.00 0.00 O ATOM 1135 CB ALA A 317 4.032 9.195 -7.552 1.00 0.00 C ATOM 0 H ALA A 317 3.200 7.176 -8.685 1.00 0.00 H new ATOM 0 HA ALA A 317 2.241 9.814 -8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 317 4.304 10.203 -7.238 1.00 0.00 H new ATOM 0 HB2 ALA A 317 3.487 8.699 -6.749 1.00 0.00 H new ATOM 0 HB3 ALA A 317 4.935 8.630 -7.780 1.00 0.00 H new