USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=20 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 45:sc= 1.16 USER MOD Set 1.2: A 303 THR OG1 : rot -63:sc= -0.1 USER MOD Set 2.1: A 299 THR OG1 : rot 180:sc= 1.03 USER MOD Set 2.2: A 306 SER OG : rot -70:sc= 1.07 USER MOD Set 3.1: A 288 GLN : amide:sc= 0.111 K(o=-0.076,f=-0.79) USER MOD Set 3.2: A 291 THR OG1 : rot 149:sc= -0.186 USER MOD Single : A 258 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 263 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 TYR OH : rot 180:sc= 0 USER MOD Single : A 266 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 269 ASN : amide:sc= -1.86! C(o=-1.9!,f=-1.9!) USER MOD Single : A 283 MET CE :methyl -137:sc= -0.21 (180deg=-0.904) USER MOD Single : A 284 SER OG : rot 180:sc= -0.798 USER MOD Single : A 286 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 289 THR OG1 : rot -65:sc= 0.472 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 297 TYR OH : rot 180:sc= 0 USER MOD Single : A 302 THR OG1 : rot 71:sc= 0.689 USER MOD Single : A 305 CYS SG : rot 180:sc= 0 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+ -163:sc= -0.0301 (180deg=-0.301) USER MOD ----------------------------------------------------------------- ATOM 217 N GLU A 257 5.708 0.775 -3.429 1.00 0.00 N ATOM 218 CA GLU A 257 5.397 1.725 -4.490 1.00 0.00 C ATOM 219 C GLU A 257 4.419 2.789 -3.999 1.00 0.00 C ATOM 220 O GLU A 257 3.733 2.602 -2.994 1.00 0.00 O ATOM 221 CB GLU A 257 4.809 0.997 -5.701 1.00 0.00 C ATOM 222 CG GLU A 257 5.859 0.361 -6.597 1.00 0.00 C ATOM 223 CD GLU A 257 6.267 -1.021 -6.127 1.00 0.00 C ATOM 224 OE1 GLU A 257 6.215 -1.271 -4.904 1.00 0.00 O ATOM 225 OE2 GLU A 257 6.639 -1.853 -6.981 1.00 0.00 O ATOM 0 HA GLU A 257 6.324 2.217 -4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 257 4.124 0.224 -5.352 1.00 0.00 H new ATOM 0 HB3 GLU A 257 4.221 1.702 -6.288 1.00 0.00 H new ATOM 0 HG2 GLU A 257 5.472 0.295 -7.614 1.00 0.00 H new ATOM 0 HG3 GLU A 257 6.739 1.003 -6.632 1.00 0.00 H new ATOM 232 N THR A 258 4.362 3.907 -4.716 1.00 0.00 N ATOM 233 CA THR A 258 3.471 5.002 -4.353 1.00 0.00 C ATOM 234 C THR A 258 2.536 5.354 -5.504 1.00 0.00 C ATOM 235 O THR A 258 2.983 5.632 -6.618 1.00 0.00 O ATOM 236 CB THR A 258 4.262 6.259 -3.947 1.00 0.00 C ATOM 237 OG1 THR A 258 5.354 5.897 -3.094 1.00 0.00 O ATOM 238 CG2 THR A 258 3.364 7.257 -3.232 1.00 0.00 C ATOM 0 H THR A 258 4.922 4.078 -5.551 1.00 0.00 H new ATOM 0 HA THR A 258 2.883 4.661 -3.501 1.00 0.00 H new ATOM 0 HB THR A 258 4.648 6.726 -4.853 1.00 0.00 H new ATOM 0 HG1 THR A 258 5.853 6.702 -2.842 1.00 0.00 H new ATOM 0 HG21 THR A 258 3.945 8.136 -2.955 1.00 0.00 H new ATOM 0 HG22 THR A 258 2.550 7.554 -3.894 1.00 0.00 H new ATOM 0 HG23 THR A 258 2.952 6.797 -2.334 1.00 0.00 H new ATOM 246 N LEU A 259 1.236 5.341 -5.230 1.00 0.00 N ATOM 247 CA LEU A 259 0.237 5.661 -6.243 1.00 0.00 C ATOM 248 C LEU A 259 -0.693 6.769 -5.761 1.00 0.00 C ATOM 249 O LEU A 259 -0.949 6.900 -4.564 1.00 0.00 O ATOM 250 CB LEU A 259 -0.577 4.414 -6.596 1.00 0.00 C ATOM 251 CG LEU A 259 0.215 3.114 -6.739 1.00 0.00 C ATOM 252 CD1 LEU A 259 -0.726 1.922 -6.819 1.00 0.00 C ATOM 253 CD2 LEU A 259 1.115 3.169 -7.964 1.00 0.00 C ATOM 0 H LEU A 259 0.849 5.112 -4.314 1.00 0.00 H new ATOM 0 HA LEU A 259 0.758 6.012 -7.134 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -1.336 4.271 -5.827 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -1.103 4.601 -7.532 1.00 0.00 H new ATOM 0 HG LEU A 259 0.844 2.996 -5.857 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -0.145 1.006 -6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -1.327 1.872 -5.911 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.382 2.033 -7.683 1.00 0.00 H new ATOM 0 HD21 LEU A 259 1.671 2.235 -8.049 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.506 3.312 -8.857 1.00 0.00 H new ATOM 0 HD23 LEU A 259 1.814 3.999 -7.865 1.00 0.00 H new ATOM 265 N GLN A 260 -1.198 7.562 -6.701 1.00 0.00 N ATOM 266 CA GLN A 260 -2.101 8.659 -6.371 1.00 0.00 C ATOM 267 C GLN A 260 -3.523 8.348 -6.826 1.00 0.00 C ATOM 268 O GLN A 260 -3.747 7.948 -7.968 1.00 0.00 O ATOM 269 CB GLN A 260 -1.618 9.958 -7.018 1.00 0.00 C ATOM 270 CG GLN A 260 -2.057 11.208 -6.274 1.00 0.00 C ATOM 271 CD GLN A 260 -1.871 12.470 -7.093 1.00 0.00 C ATOM 272 OE1 GLN A 260 -0.768 13.011 -7.179 1.00 0.00 O ATOM 273 NE2 GLN A 260 -2.952 12.947 -7.700 1.00 0.00 N ATOM 0 H GLN A 260 -0.997 7.465 -7.696 1.00 0.00 H new ATOM 0 HA GLN A 260 -2.104 8.781 -5.288 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -0.530 9.943 -7.075 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -1.990 10.005 -8.041 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -3.107 11.111 -5.996 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -1.489 11.293 -5.348 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -3.846 12.466 -7.601 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -2.888 13.794 -8.265 1.00 0.00 H new ATOM 282 N VAL A 261 -4.481 8.534 -5.924 1.00 0.00 N ATOM 283 CA VAL A 261 -5.882 8.274 -6.232 1.00 0.00 C ATOM 284 C VAL A 261 -6.367 9.161 -7.373 1.00 0.00 C ATOM 285 O VAL A 261 -5.960 10.317 -7.490 1.00 0.00 O ATOM 286 CB VAL A 261 -6.780 8.502 -5.002 1.00 0.00 C ATOM 287 CG1 VAL A 261 -8.243 8.298 -5.363 1.00 0.00 C ATOM 288 CG2 VAL A 261 -6.369 7.580 -3.864 1.00 0.00 C ATOM 0 H VAL A 261 -4.312 8.864 -4.974 1.00 0.00 H new ATOM 0 HA VAL A 261 -5.951 7.229 -6.533 1.00 0.00 H new ATOM 0 HB VAL A 261 -6.654 9.532 -4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 261 -8.862 8.463 -4.481 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -8.527 9.004 -6.143 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -8.390 7.280 -5.724 1.00 0.00 H new ATOM 0 HG21 VAL A 261 -7.014 7.755 -3.003 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -6.464 6.542 -4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -5.334 7.781 -3.588 1.00 0.00 H new ATOM 298 N ILE A 262 -7.239 8.613 -8.212 1.00 0.00 N ATOM 299 CA ILE A 262 -7.781 9.355 -9.344 1.00 0.00 C ATOM 300 C ILE A 262 -9.303 9.431 -9.274 1.00 0.00 C ATOM 301 O ILE A 262 -9.928 10.228 -9.973 1.00 0.00 O ATOM 302 CB ILE A 262 -7.371 8.717 -10.684 1.00 0.00 C ATOM 303 CG1 ILE A 262 -7.263 7.198 -10.539 1.00 0.00 C ATOM 304 CG2 ILE A 262 -6.054 9.304 -11.169 1.00 0.00 C ATOM 305 CD1 ILE A 262 -7.115 6.474 -11.859 1.00 0.00 C ATOM 0 H ILE A 262 -7.586 7.657 -8.129 1.00 0.00 H new ATOM 0 HA ILE A 262 -7.366 10.362 -9.289 1.00 0.00 H new ATOM 0 HB ILE A 262 -8.139 8.938 -11.425 1.00 0.00 H new ATOM 0 HG12 ILE A 262 -6.408 6.961 -9.906 1.00 0.00 H new ATOM 0 HG13 ILE A 262 -8.151 6.826 -10.027 1.00 0.00 H new ATOM 0 HG21 ILE A 262 -5.777 8.843 -12.117 1.00 0.00 H new ATOM 0 HG22 ILE A 262 -6.164 10.380 -11.307 1.00 0.00 H new ATOM 0 HG23 ILE A 262 -5.276 9.111 -10.431 1.00 0.00 H new ATOM 0 HD11 ILE A 262 -7.044 5.401 -11.680 1.00 0.00 H new ATOM 0 HD12 ILE A 262 -7.982 6.680 -12.486 1.00 0.00 H new ATOM 0 HD13 ILE A 262 -6.212 6.818 -12.363 1.00 0.00 H new ATOM 317 N TYR A 263 -9.892 8.598 -8.424 1.00 0.00 N ATOM 318 CA TYR A 263 -11.341 8.569 -8.262 1.00 0.00 C ATOM 319 C TYR A 263 -11.730 7.891 -6.952 1.00 0.00 C ATOM 320 O TYR A 263 -11.078 6.954 -6.491 1.00 0.00 O ATOM 321 CB TYR A 263 -11.992 7.841 -9.439 1.00 0.00 C ATOM 322 CG TYR A 263 -11.608 8.405 -10.788 1.00 0.00 C ATOM 323 CD1 TYR A 263 -12.266 9.510 -11.314 1.00 0.00 C ATOM 324 CD2 TYR A 263 -10.586 7.834 -11.536 1.00 0.00 C ATOM 325 CE1 TYR A 263 -11.919 10.029 -12.546 1.00 0.00 C ATOM 326 CE2 TYR A 263 -10.232 8.347 -12.769 1.00 0.00 C ATOM 327 CZ TYR A 263 -10.901 9.444 -13.270 1.00 0.00 C ATOM 328 OH TYR A 263 -10.551 9.958 -14.497 1.00 0.00 O ATOM 0 H TYR A 263 -9.389 7.934 -7.836 1.00 0.00 H new ATOM 0 HA TYR A 263 -11.699 9.598 -8.237 1.00 0.00 H new ATOM 0 HB2 TYR A 263 -11.714 6.788 -9.403 1.00 0.00 H new ATOM 0 HB3 TYR A 263 -13.076 7.888 -9.330 1.00 0.00 H new ATOM 0 HD1 TYR A 263 -13.063 9.971 -10.749 1.00 0.00 H new ATOM 0 HD2 TYR A 263 -10.060 6.975 -11.147 1.00 0.00 H new ATOM 0 HE1 TYR A 263 -12.442 10.888 -12.940 1.00 0.00 H new ATOM 0 HE2 TYR A 263 -9.435 7.891 -13.338 1.00 0.00 H new ATOM 0 HH TYR A 263 -9.816 9.431 -14.875 1.00 0.00 H new ATOM 338 N PRO A 264 -12.819 8.376 -6.336 1.00 0.00 N ATOM 339 CA PRO A 264 -13.321 7.832 -5.071 1.00 0.00 C ATOM 340 C PRO A 264 -13.914 6.437 -5.235 1.00 0.00 C ATOM 341 O PRO A 264 -14.211 6.005 -6.349 1.00 0.00 O ATOM 342 CB PRO A 264 -14.407 8.830 -4.662 1.00 0.00 C ATOM 343 CG PRO A 264 -14.857 9.446 -5.942 1.00 0.00 C ATOM 344 CD PRO A 264 -13.644 9.492 -6.829 1.00 0.00 C ATOM 0 HA PRO A 264 -12.527 7.718 -4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -15.231 8.331 -4.151 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -14.016 9.582 -3.977 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -15.653 8.858 -6.399 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -15.256 10.446 -5.774 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -13.908 9.363 -7.879 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -13.122 10.445 -6.746 1.00 0.00 H new ATOM 352 N TYR A 265 -14.085 5.737 -4.119 1.00 0.00 N ATOM 353 CA TYR A 265 -14.641 4.389 -4.139 1.00 0.00 C ATOM 354 C TYR A 265 -15.167 3.997 -2.762 1.00 0.00 C ATOM 355 O TYR A 265 -14.461 4.106 -1.759 1.00 0.00 O ATOM 356 CB TYR A 265 -13.583 3.385 -4.598 1.00 0.00 C ATOM 357 CG TYR A 265 -13.983 1.943 -4.384 1.00 0.00 C ATOM 358 CD1 TYR A 265 -14.987 1.359 -5.147 1.00 0.00 C ATOM 359 CD2 TYR A 265 -13.359 1.164 -3.418 1.00 0.00 C ATOM 360 CE1 TYR A 265 -15.356 0.042 -4.955 1.00 0.00 C ATOM 361 CE2 TYR A 265 -13.721 -0.154 -3.219 1.00 0.00 C ATOM 362 CZ TYR A 265 -14.720 -0.710 -3.990 1.00 0.00 C ATOM 363 OH TYR A 265 -15.085 -2.023 -3.794 1.00 0.00 O ATOM 0 H TYR A 265 -13.846 6.081 -3.189 1.00 0.00 H new ATOM 0 HA TYR A 265 -15.473 4.377 -4.843 1.00 0.00 H new ATOM 0 HB2 TYR A 265 -13.379 3.543 -5.657 1.00 0.00 H new ATOM 0 HB3 TYR A 265 -12.654 3.579 -4.062 1.00 0.00 H new ATOM 0 HD1 TYR A 265 -15.488 1.945 -5.903 1.00 0.00 H new ATOM 0 HD2 TYR A 265 -12.577 1.597 -2.812 1.00 0.00 H new ATOM 0 HE1 TYR A 265 -16.138 -0.396 -5.557 1.00 0.00 H new ATOM 0 HE2 TYR A 265 -13.225 -0.746 -2.464 1.00 0.00 H new ATOM 0 HH TYR A 265 -14.539 -2.411 -3.078 1.00 0.00 H new ATOM 373 N THR A 266 -16.414 3.537 -2.721 1.00 0.00 N ATOM 374 CA THR A 266 -17.037 3.128 -1.469 1.00 0.00 C ATOM 375 C THR A 266 -16.956 1.617 -1.282 1.00 0.00 C ATOM 376 O THR A 266 -17.628 0.846 -1.967 1.00 0.00 O ATOM 377 CB THR A 266 -18.514 3.563 -1.408 1.00 0.00 C ATOM 378 OG1 THR A 266 -18.640 4.929 -1.817 1.00 0.00 O ATOM 379 CG2 THR A 266 -19.069 3.395 -0.002 1.00 0.00 C ATOM 0 H THR A 266 -17.012 3.439 -3.541 1.00 0.00 H new ATOM 0 HA THR A 266 -16.487 3.620 -0.667 1.00 0.00 H new ATOM 0 HB THR A 266 -19.085 2.928 -2.085 1.00 0.00 H new ATOM 0 HG1 THR A 266 -19.582 5.197 -1.777 1.00 0.00 H new ATOM 0 HG21 THR A 266 -20.113 3.708 0.017 1.00 0.00 H new ATOM 0 HG22 THR A 266 -18.999 2.348 0.294 1.00 0.00 H new ATOM 0 HG23 THR A 266 -18.494 4.008 0.692 1.00 0.00 H new ATOM 387 N PRO A 267 -16.114 1.182 -0.333 1.00 0.00 N ATOM 388 CA PRO A 267 -15.926 -0.241 -0.034 1.00 0.00 C ATOM 389 C PRO A 267 -17.150 -0.860 0.631 1.00 0.00 C ATOM 390 O PRO A 267 -18.035 -0.149 1.107 1.00 0.00 O ATOM 391 CB PRO A 267 -14.735 -0.246 0.928 1.00 0.00 C ATOM 392 CG PRO A 267 -14.757 1.100 1.566 1.00 0.00 C ATOM 393 CD PRO A 267 -15.281 2.045 0.521 1.00 0.00 C ATOM 0 HA PRO A 267 -15.765 -0.830 -0.937 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.830 -1.038 1.671 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -13.798 -0.417 0.397 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.395 1.103 2.450 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -13.759 1.393 1.892 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -15.863 2.853 0.965 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.472 2.508 -0.044 1.00 0.00 H new ATOM 401 N GLN A 268 -17.194 -2.188 0.660 1.00 0.00 N ATOM 402 CA GLN A 268 -18.311 -2.902 1.267 1.00 0.00 C ATOM 403 C GLN A 268 -17.861 -3.663 2.509 1.00 0.00 C ATOM 404 O GLN A 268 -18.670 -3.989 3.377 1.00 0.00 O ATOM 405 CB GLN A 268 -18.933 -3.870 0.259 1.00 0.00 C ATOM 406 CG GLN A 268 -19.396 -3.199 -1.024 1.00 0.00 C ATOM 407 CD GLN A 268 -20.746 -2.526 -0.876 1.00 0.00 C ATOM 408 OE1 GLN A 268 -21.750 -3.178 -0.588 1.00 0.00 O ATOM 409 NE2 GLN A 268 -20.778 -1.213 -1.073 1.00 0.00 N ATOM 0 H GLN A 268 -16.469 -2.791 0.270 1.00 0.00 H new ATOM 0 HA GLN A 268 -19.059 -2.168 1.565 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -18.204 -4.642 0.013 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -19.782 -4.370 0.725 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -18.657 -2.459 -1.330 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -19.450 -3.942 -1.819 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -19.922 -0.712 -1.310 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -21.659 -0.706 -0.987 1.00 0.00 H new ATOM 418 N ASN A 269 -16.564 -3.943 2.588 1.00 0.00 N ATOM 419 CA ASN A 269 -16.006 -4.666 3.724 1.00 0.00 C ATOM 420 C ASN A 269 -14.532 -4.321 3.919 1.00 0.00 C ATOM 421 O ASN A 269 -13.971 -3.513 3.179 1.00 0.00 O ATOM 422 CB ASN A 269 -16.165 -6.175 3.523 1.00 0.00 C ATOM 423 CG ASN A 269 -17.569 -6.556 3.098 1.00 0.00 C ATOM 424 OD1 ASN A 269 -17.859 -6.675 1.907 1.00 0.00 O ATOM 425 ND2 ASN A 269 -18.450 -6.750 4.072 1.00 0.00 N ATOM 0 H ASN A 269 -15.880 -3.680 1.878 1.00 0.00 H new ATOM 0 HA ASN A 269 -16.553 -4.365 4.618 1.00 0.00 H new ATOM 0 HB2 ASN A 269 -15.455 -6.515 2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 269 -15.916 -6.691 4.451 1.00 0.00 H new ATOM 0 HD21 ASN A 269 -19.411 -7.009 3.847 1.00 0.00 H new ATOM 0 HD22 ASN A 269 -18.166 -6.641 5.046 1.00 0.00 H new ATOM 432 N ASP A 270 -13.913 -4.937 4.919 1.00 0.00 N ATOM 433 CA ASP A 270 -12.504 -4.697 5.211 1.00 0.00 C ATOM 434 C ASP A 270 -11.624 -5.149 4.050 1.00 0.00 C ATOM 435 O ASP A 270 -10.579 -4.555 3.782 1.00 0.00 O ATOM 436 CB ASP A 270 -12.095 -5.426 6.491 1.00 0.00 C ATOM 437 CG ASP A 270 -12.720 -4.815 7.730 1.00 0.00 C ATOM 438 OD1 ASP A 270 -13.906 -4.429 7.668 1.00 0.00 O ATOM 439 OD2 ASP A 270 -12.023 -4.725 8.762 1.00 0.00 O ATOM 0 H ASP A 270 -14.364 -5.607 5.542 1.00 0.00 H new ATOM 0 HA ASP A 270 -12.365 -3.625 5.353 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -12.388 -6.473 6.419 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -11.009 -5.405 6.587 1.00 0.00 H new ATOM 444 N ASP A 271 -12.053 -6.202 3.364 1.00 0.00 N ATOM 445 CA ASP A 271 -11.304 -6.734 2.231 1.00 0.00 C ATOM 446 C ASP A 271 -10.710 -5.605 1.395 1.00 0.00 C ATOM 447 O ASP A 271 -9.545 -5.659 1.003 1.00 0.00 O ATOM 448 CB ASP A 271 -12.208 -7.609 1.361 1.00 0.00 C ATOM 449 CG ASP A 271 -13.303 -8.286 2.161 1.00 0.00 C ATOM 450 OD1 ASP A 271 -12.985 -8.899 3.201 1.00 0.00 O ATOM 451 OD2 ASP A 271 -14.479 -8.203 1.747 1.00 0.00 O ATOM 0 H ASP A 271 -12.916 -6.705 3.572 1.00 0.00 H new ATOM 0 HA ASP A 271 -10.487 -7.343 2.619 1.00 0.00 H new ATOM 0 HB2 ASP A 271 -12.659 -6.997 0.580 1.00 0.00 H new ATOM 0 HB3 ASP A 271 -11.604 -8.368 0.863 1.00 0.00 H new ATOM 456 N GLU A 272 -11.519 -4.586 1.125 1.00 0.00 N ATOM 457 CA GLU A 272 -11.073 -3.446 0.333 1.00 0.00 C ATOM 458 C GLU A 272 -10.828 -2.229 1.221 1.00 0.00 C ATOM 459 O GLU A 272 -11.026 -2.283 2.436 1.00 0.00 O ATOM 460 CB GLU A 272 -12.108 -3.107 -0.742 1.00 0.00 C ATOM 461 CG GLU A 272 -13.477 -2.762 -0.181 1.00 0.00 C ATOM 462 CD GLU A 272 -14.374 -3.976 -0.044 1.00 0.00 C ATOM 463 OE1 GLU A 272 -14.115 -4.806 0.853 1.00 0.00 O ATOM 464 OE2 GLU A 272 -15.334 -4.098 -0.832 1.00 0.00 O ATOM 0 H GLU A 272 -12.486 -4.526 1.443 1.00 0.00 H new ATOM 0 HA GLU A 272 -10.134 -3.717 -0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 272 -11.744 -2.266 -1.332 1.00 0.00 H new ATOM 0 HB3 GLU A 272 -12.206 -3.954 -1.421 1.00 0.00 H new ATOM 0 HG2 GLU A 272 -13.357 -2.291 0.795 1.00 0.00 H new ATOM 0 HG3 GLU A 272 -13.958 -2.031 -0.831 1.00 0.00 H new ATOM 471 N LEU A 273 -10.396 -1.133 0.607 1.00 0.00 N ATOM 472 CA LEU A 273 -10.123 0.098 1.340 1.00 0.00 C ATOM 473 C LEU A 273 -10.763 1.297 0.648 1.00 0.00 C ATOM 474 O LEU A 273 -10.947 1.297 -0.568 1.00 0.00 O ATOM 475 CB LEU A 273 -8.614 0.314 1.470 1.00 0.00 C ATOM 476 CG LEU A 273 -8.172 1.708 1.916 1.00 0.00 C ATOM 477 CD1 LEU A 273 -8.232 1.828 3.430 1.00 0.00 C ATOM 478 CD2 LEU A 273 -6.768 2.009 1.411 1.00 0.00 C ATOM 0 H LEU A 273 -10.227 -1.072 -0.397 1.00 0.00 H new ATOM 0 HA LEU A 273 -10.557 0.003 2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -8.223 -0.414 2.181 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -8.152 0.099 0.506 1.00 0.00 H new ATOM 0 HG LEU A 273 -8.856 2.440 1.487 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -7.914 2.827 3.729 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -9.254 1.656 3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -7.571 1.087 3.880 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -6.470 3.005 1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -6.072 1.272 1.811 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -6.756 1.966 0.322 1.00 0.00 H new ATOM 490 N GLU A 274 -11.097 2.318 1.432 1.00 0.00 N ATOM 491 CA GLU A 274 -11.714 3.524 0.893 1.00 0.00 C ATOM 492 C GLU A 274 -10.755 4.255 -0.041 1.00 0.00 C ATOM 493 O GLU A 274 -9.536 4.108 0.062 1.00 0.00 O ATOM 494 CB GLU A 274 -12.146 4.454 2.029 1.00 0.00 C ATOM 495 CG GLU A 274 -13.033 5.600 1.574 1.00 0.00 C ATOM 496 CD GLU A 274 -13.577 6.412 2.733 1.00 0.00 C ATOM 497 OE1 GLU A 274 -14.566 5.971 3.355 1.00 0.00 O ATOM 498 OE2 GLU A 274 -13.014 7.490 3.018 1.00 0.00 O ATOM 0 H GLU A 274 -10.951 2.334 2.441 1.00 0.00 H new ATOM 0 HA GLU A 274 -12.594 3.227 0.322 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -12.677 3.872 2.782 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -11.258 4.863 2.510 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -12.465 6.254 0.912 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -13.864 5.202 0.992 1.00 0.00 H new ATOM 505 N LEU A 275 -11.313 5.043 -0.953 1.00 0.00 N ATOM 506 CA LEU A 275 -10.509 5.798 -1.908 1.00 0.00 C ATOM 507 C LEU A 275 -10.779 7.294 -1.784 1.00 0.00 C ATOM 508 O LEU A 275 -11.931 7.728 -1.758 1.00 0.00 O ATOM 509 CB LEU A 275 -10.802 5.331 -3.334 1.00 0.00 C ATOM 510 CG LEU A 275 -10.272 3.947 -3.710 1.00 0.00 C ATOM 511 CD1 LEU A 275 -8.774 4.002 -3.971 1.00 0.00 C ATOM 512 CD2 LEU A 275 -10.588 2.939 -2.615 1.00 0.00 C ATOM 0 H LEU A 275 -12.319 5.176 -1.052 1.00 0.00 H new ATOM 0 HA LEU A 275 -9.458 5.618 -1.683 1.00 0.00 H new ATOM 0 HB2 LEU A 275 -11.882 5.337 -3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 275 -10.381 6.060 -4.027 1.00 0.00 H new ATOM 0 HG LEU A 275 -10.768 3.625 -4.626 1.00 0.00 H new ATOM 0 HD11 LEU A 275 -8.414 3.008 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 275 -8.573 4.692 -4.790 1.00 0.00 H new ATOM 0 HD13 LEU A 275 -8.261 4.345 -3.073 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -10.203 1.960 -2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 275 -10.120 3.256 -1.683 1.00 0.00 H new ATOM 0 HD23 LEU A 275 -11.667 2.879 -2.477 1.00 0.00 H new ATOM 524 N VAL A 276 -9.709 8.080 -1.711 1.00 0.00 N ATOM 525 CA VAL A 276 -9.830 9.528 -1.594 1.00 0.00 C ATOM 526 C VAL A 276 -9.055 10.235 -2.700 1.00 0.00 C ATOM 527 O VAL A 276 -7.863 10.003 -2.904 1.00 0.00 O ATOM 528 CB VAL A 276 -9.322 10.025 -0.228 1.00 0.00 C ATOM 529 CG1 VAL A 276 -9.541 11.524 -0.090 1.00 0.00 C ATOM 530 CG2 VAL A 276 -10.008 9.272 0.901 1.00 0.00 C ATOM 0 H VAL A 276 -8.748 7.738 -1.731 1.00 0.00 H new ATOM 0 HA VAL A 276 -10.890 9.766 -1.688 1.00 0.00 H new ATOM 0 HB VAL A 276 -8.251 9.831 -0.166 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -9.176 11.857 0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -8.999 12.045 -0.879 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -10.605 11.745 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -9.637 9.636 1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -11.085 9.433 0.844 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -9.795 8.207 0.810 1.00 0.00 H new ATOM 540 N PRO A 277 -9.747 11.120 -3.434 1.00 0.00 N ATOM 541 CA PRO A 277 -9.143 11.881 -4.532 1.00 0.00 C ATOM 542 C PRO A 277 -8.146 12.923 -4.036 1.00 0.00 C ATOM 543 O PRO A 277 -8.524 13.904 -3.396 1.00 0.00 O ATOM 544 CB PRO A 277 -10.344 12.563 -5.193 1.00 0.00 C ATOM 545 CG PRO A 277 -11.366 12.660 -4.114 1.00 0.00 C ATOM 546 CD PRO A 277 -11.170 11.447 -3.247 1.00 0.00 C ATOM 0 HA PRO A 277 -8.574 11.241 -5.206 1.00 0.00 H new ATOM 0 HB2 PRO A 277 -10.078 13.548 -5.576 1.00 0.00 H new ATOM 0 HB3 PRO A 277 -10.714 11.982 -6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 277 -11.239 13.576 -3.537 1.00 0.00 H new ATOM 0 HG3 PRO A 277 -12.373 12.683 -4.531 1.00 0.00 H new ATOM 0 HD2 PRO A 277 -11.400 11.658 -2.203 1.00 0.00 H new ATOM 0 HD3 PRO A 277 -11.815 10.624 -3.555 1.00 0.00 H new ATOM 554 N GLY A 278 -6.869 12.704 -4.336 1.00 0.00 N ATOM 555 CA GLY A 278 -5.838 13.633 -3.913 1.00 0.00 C ATOM 556 C GLY A 278 -4.920 13.041 -2.861 1.00 0.00 C ATOM 557 O GLY A 278 -4.108 13.749 -2.266 1.00 0.00 O ATOM 0 H GLY A 278 -6.531 11.900 -4.864 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -5.247 13.934 -4.778 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -6.306 14.534 -3.517 1.00 0.00 H new ATOM 561 N ASP A 279 -5.051 11.739 -2.629 1.00 0.00 N ATOM 562 CA ASP A 279 -4.227 11.052 -1.641 1.00 0.00 C ATOM 563 C ASP A 279 -3.280 10.065 -2.316 1.00 0.00 C ATOM 564 O ASP A 279 -3.293 9.911 -3.537 1.00 0.00 O ATOM 565 CB ASP A 279 -5.111 10.320 -0.630 1.00 0.00 C ATOM 566 CG ASP A 279 -4.444 10.177 0.724 1.00 0.00 C ATOM 567 OD1 ASP A 279 -3.567 11.007 1.044 1.00 0.00 O ATOM 568 OD2 ASP A 279 -4.798 9.235 1.464 1.00 0.00 O ATOM 0 H ASP A 279 -5.720 11.139 -3.112 1.00 0.00 H new ATOM 0 HA ASP A 279 -3.631 11.799 -1.117 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -6.050 10.861 -0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -5.358 9.331 -1.016 1.00 0.00 H new ATOM 573 N PHE A 280 -2.458 9.398 -1.512 1.00 0.00 N ATOM 574 CA PHE A 280 -1.502 8.427 -2.031 1.00 0.00 C ATOM 575 C PHE A 280 -1.801 7.030 -1.497 1.00 0.00 C ATOM 576 O PHE A 280 -2.617 6.863 -0.590 1.00 0.00 O ATOM 577 CB PHE A 280 -0.075 8.834 -1.657 1.00 0.00 C ATOM 578 CG PHE A 280 0.493 9.909 -2.539 1.00 0.00 C ATOM 579 CD1 PHE A 280 0.712 9.673 -3.887 1.00 0.00 C ATOM 580 CD2 PHE A 280 0.808 11.154 -2.021 1.00 0.00 C ATOM 581 CE1 PHE A 280 1.236 10.660 -4.701 1.00 0.00 C ATOM 582 CE2 PHE A 280 1.331 12.145 -2.830 1.00 0.00 C ATOM 583 CZ PHE A 280 1.544 11.898 -4.172 1.00 0.00 C ATOM 0 H PHE A 280 -2.435 9.512 -0.499 1.00 0.00 H new ATOM 0 HA PHE A 280 -1.594 8.409 -3.117 1.00 0.00 H new ATOM 0 HB2 PHE A 280 -0.064 9.180 -0.623 1.00 0.00 H new ATOM 0 HB3 PHE A 280 0.569 7.956 -1.707 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.471 8.707 -4.306 1.00 0.00 H new ATOM 0 HD2 PHE A 280 0.643 11.353 -0.972 1.00 0.00 H new ATOM 0 HE1 PHE A 280 1.404 10.463 -5.749 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.573 13.112 -2.413 1.00 0.00 H new ATOM 0 HZ PHE A 280 1.951 12.672 -4.807 1.00 0.00 H new ATOM 593 N ILE A 281 -1.136 6.030 -2.065 1.00 0.00 N ATOM 594 CA ILE A 281 -1.330 4.648 -1.646 1.00 0.00 C ATOM 595 C ILE A 281 -0.033 3.853 -1.755 1.00 0.00 C ATOM 596 O ILE A 281 0.593 3.807 -2.814 1.00 0.00 O ATOM 597 CB ILE A 281 -2.417 3.952 -2.486 1.00 0.00 C ATOM 598 CG1 ILE A 281 -3.720 4.752 -2.437 1.00 0.00 C ATOM 599 CG2 ILE A 281 -2.642 2.532 -1.989 1.00 0.00 C ATOM 600 CD1 ILE A 281 -4.436 4.661 -1.108 1.00 0.00 C ATOM 0 H ILE A 281 -0.458 6.151 -2.817 1.00 0.00 H new ATOM 0 HA ILE A 281 -1.650 4.676 -0.604 1.00 0.00 H new ATOM 0 HB ILE A 281 -2.080 3.905 -3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 281 -3.503 5.798 -2.652 1.00 0.00 H new ATOM 0 HG13 ILE A 281 -4.385 4.396 -3.224 1.00 0.00 H new ATOM 0 HG21 ILE A 281 -3.413 2.053 -2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 281 -1.714 1.967 -2.071 1.00 0.00 H new ATOM 0 HG23 ILE A 281 -2.961 2.557 -0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -5.351 5.252 -1.146 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -4.685 3.621 -0.899 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -3.789 5.044 -0.319 1.00 0.00 H new ATOM 612 N PHE A 282 0.365 3.226 -0.653 1.00 0.00 N ATOM 613 CA PHE A 282 1.587 2.432 -0.624 1.00 0.00 C ATOM 614 C PHE A 282 1.295 0.972 -0.960 1.00 0.00 C ATOM 615 O PHE A 282 0.631 0.270 -0.199 1.00 0.00 O ATOM 616 CB PHE A 282 2.250 2.527 0.752 1.00 0.00 C ATOM 617 CG PHE A 282 2.795 3.892 1.062 1.00 0.00 C ATOM 618 CD1 PHE A 282 3.572 4.568 0.135 1.00 0.00 C ATOM 619 CD2 PHE A 282 2.531 4.498 2.279 1.00 0.00 C ATOM 620 CE1 PHE A 282 4.075 5.824 0.417 1.00 0.00 C ATOM 621 CE2 PHE A 282 3.032 5.754 2.567 1.00 0.00 C ATOM 622 CZ PHE A 282 3.805 6.417 1.635 1.00 0.00 C ATOM 0 H PHE A 282 -0.141 3.253 0.232 1.00 0.00 H new ATOM 0 HA PHE A 282 2.268 2.831 -1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.523 2.253 1.516 1.00 0.00 H new ATOM 0 HB3 PHE A 282 3.060 1.800 0.807 1.00 0.00 H new ATOM 0 HD1 PHE A 282 3.787 4.108 -0.818 1.00 0.00 H new ATOM 0 HD2 PHE A 282 1.927 3.983 3.012 1.00 0.00 H new ATOM 0 HE1 PHE A 282 4.679 6.341 -0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.819 6.216 3.520 1.00 0.00 H new ATOM 0 HZ PHE A 282 4.198 7.398 1.858 1.00 0.00 H new ATOM 632 N MET A 283 1.796 0.524 -2.107 1.00 0.00 N ATOM 633 CA MET A 283 1.590 -0.851 -2.545 1.00 0.00 C ATOM 634 C MET A 283 2.811 -1.710 -2.232 1.00 0.00 C ATOM 635 O MET A 283 3.948 -1.297 -2.462 1.00 0.00 O ATOM 636 CB MET A 283 1.294 -0.893 -4.045 1.00 0.00 C ATOM 637 CG MET A 283 0.401 -2.052 -4.457 1.00 0.00 C ATOM 638 SD MET A 283 1.124 -3.657 -4.068 1.00 0.00 S ATOM 639 CE MET A 283 2.626 -3.597 -5.043 1.00 0.00 C ATOM 0 H MET A 283 2.347 1.093 -2.749 1.00 0.00 H new ATOM 0 HA MET A 283 0.735 -1.254 -2.002 1.00 0.00 H new ATOM 0 HB2 MET A 283 0.819 0.043 -4.339 1.00 0.00 H new ATOM 0 HB3 MET A 283 2.235 -0.959 -4.591 1.00 0.00 H new ATOM 0 HG2 MET A 283 -0.562 -1.960 -3.955 1.00 0.00 H new ATOM 0 HG3 MET A 283 0.208 -1.994 -5.528 1.00 0.00 H new ATOM 0 HE1 MET A 283 2.776 -4.556 -5.539 1.00 0.00 H new ATOM 0 HE2 MET A 283 2.542 -2.810 -5.792 1.00 0.00 H new ATOM 0 HE3 MET A 283 3.475 -3.389 -4.391 1.00 0.00 H new ATOM 649 N SER A 284 2.569 -2.907 -1.706 1.00 0.00 N ATOM 650 CA SER A 284 3.649 -3.822 -1.358 1.00 0.00 C ATOM 651 C SER A 284 3.412 -5.199 -1.969 1.00 0.00 C ATOM 652 O SER A 284 2.285 -5.689 -2.043 1.00 0.00 O ATOM 653 CB SER A 284 3.775 -3.941 0.162 1.00 0.00 C ATOM 654 OG SER A 284 4.889 -4.740 0.521 1.00 0.00 O ATOM 0 H SER A 284 1.634 -3.265 -1.512 1.00 0.00 H new ATOM 0 HA SER A 284 4.578 -3.419 -1.762 1.00 0.00 H new ATOM 0 HB2 SER A 284 3.879 -2.948 0.600 1.00 0.00 H new ATOM 0 HB3 SER A 284 2.864 -4.376 0.572 1.00 0.00 H new ATOM 0 HG SER A 284 4.948 -4.799 1.497 1.00 0.00 H new ATOM 660 N PRO A 285 4.501 -5.841 -2.419 1.00 0.00 N ATOM 661 CA PRO A 285 4.439 -7.171 -3.032 1.00 0.00 C ATOM 662 C PRO A 285 4.095 -8.260 -2.021 1.00 0.00 C ATOM 663 O PRO A 285 3.468 -9.262 -2.363 1.00 0.00 O ATOM 664 CB PRO A 285 5.854 -7.377 -3.578 1.00 0.00 C ATOM 665 CG PRO A 285 6.718 -6.509 -2.728 1.00 0.00 C ATOM 666 CD PRO A 285 5.876 -5.318 -2.364 1.00 0.00 C ATOM 0 HA PRO A 285 3.661 -7.233 -3.793 1.00 0.00 H new ATOM 0 HB2 PRO A 285 6.156 -8.422 -3.512 1.00 0.00 H new ATOM 0 HB3 PRO A 285 5.918 -7.093 -4.628 1.00 0.00 H new ATOM 0 HG2 PRO A 285 7.048 -7.041 -1.836 1.00 0.00 H new ATOM 0 HG3 PRO A 285 7.615 -6.203 -3.267 1.00 0.00 H new ATOM 0 HD2 PRO A 285 6.123 -4.940 -1.372 1.00 0.00 H new ATOM 0 HD3 PRO A 285 6.021 -4.495 -3.064 1.00 0.00 H new ATOM 674 N MET A 286 4.509 -8.056 -0.775 1.00 0.00 N ATOM 675 CA MET A 286 4.242 -9.020 0.286 1.00 0.00 C ATOM 676 C MET A 286 2.798 -8.914 0.767 1.00 0.00 C ATOM 677 O MET A 286 2.400 -9.589 1.716 1.00 0.00 O ATOM 678 CB MET A 286 5.200 -8.799 1.458 1.00 0.00 C ATOM 679 CG MET A 286 6.658 -8.697 1.040 1.00 0.00 C ATOM 680 SD MET A 286 7.781 -8.623 2.449 1.00 0.00 S ATOM 681 CE MET A 286 7.995 -10.366 2.804 1.00 0.00 C ATOM 0 H MET A 286 5.030 -7.232 -0.475 1.00 0.00 H new ATOM 0 HA MET A 286 4.399 -10.020 -0.118 1.00 0.00 H new ATOM 0 HB2 MET A 286 4.916 -7.886 1.982 1.00 0.00 H new ATOM 0 HB3 MET A 286 5.090 -9.620 2.166 1.00 0.00 H new ATOM 0 HG2 MET A 286 6.915 -9.556 0.420 1.00 0.00 H new ATOM 0 HG3 MET A 286 6.794 -7.808 0.425 1.00 0.00 H new ATOM 0 HE1 MET A 286 8.666 -10.484 3.654 1.00 0.00 H new ATOM 0 HE2 MET A 286 7.028 -10.811 3.040 1.00 0.00 H new ATOM 0 HE3 MET A 286 8.421 -10.865 1.933 1.00 0.00 H new ATOM 691 N GLU A 287 2.020 -8.062 0.107 1.00 0.00 N ATOM 692 CA GLU A 287 0.621 -7.867 0.469 1.00 0.00 C ATOM 693 C GLU A 287 -0.285 -8.040 -0.746 1.00 0.00 C ATOM 694 O GLU A 287 -1.505 -7.923 -0.644 1.00 0.00 O ATOM 695 CB GLU A 287 0.417 -6.479 1.078 1.00 0.00 C ATOM 696 CG GLU A 287 1.163 -6.272 2.386 1.00 0.00 C ATOM 697 CD GLU A 287 0.775 -7.286 3.445 1.00 0.00 C ATOM 698 OE1 GLU A 287 -0.417 -7.334 3.813 1.00 0.00 O ATOM 699 OE2 GLU A 287 1.665 -8.033 3.904 1.00 0.00 O ATOM 0 H GLU A 287 2.335 -7.496 -0.681 1.00 0.00 H new ATOM 0 HA GLU A 287 0.355 -8.622 1.209 1.00 0.00 H new ATOM 0 HB2 GLU A 287 0.742 -5.725 0.361 1.00 0.00 H new ATOM 0 HB3 GLU A 287 -0.648 -6.319 1.248 1.00 0.00 H new ATOM 0 HG2 GLU A 287 2.236 -6.336 2.202 1.00 0.00 H new ATOM 0 HG3 GLU A 287 0.963 -5.268 2.759 1.00 0.00 H new ATOM 706 N GLN A 288 0.323 -8.318 -1.895 1.00 0.00 N ATOM 707 CA GLN A 288 -0.429 -8.505 -3.131 1.00 0.00 C ATOM 708 C GLN A 288 -1.434 -9.643 -2.989 1.00 0.00 C ATOM 709 O GLN A 288 -1.149 -10.787 -3.345 1.00 0.00 O ATOM 710 CB GLN A 288 0.523 -8.792 -4.293 1.00 0.00 C ATOM 711 CG GLN A 288 0.994 -7.541 -5.017 1.00 0.00 C ATOM 712 CD GLN A 288 1.598 -7.844 -6.374 1.00 0.00 C ATOM 713 OE1 GLN A 288 1.140 -7.334 -7.397 1.00 0.00 O ATOM 714 NE2 GLN A 288 2.631 -8.677 -6.390 1.00 0.00 N ATOM 0 H GLN A 288 1.333 -8.419 -1.996 1.00 0.00 H new ATOM 0 HA GLN A 288 -0.976 -7.585 -3.337 1.00 0.00 H new ATOM 0 HB2 GLN A 288 1.391 -9.332 -3.915 1.00 0.00 H new ATOM 0 HB3 GLN A 288 0.025 -9.449 -5.006 1.00 0.00 H new ATOM 0 HG2 GLN A 288 0.152 -6.860 -5.142 1.00 0.00 H new ATOM 0 HG3 GLN A 288 1.732 -7.026 -4.402 1.00 0.00 H new ATOM 0 HE21 GLN A 288 2.978 -9.076 -5.518 1.00 0.00 H new ATOM 0 HE22 GLN A 288 3.078 -8.918 -7.274 1.00 0.00 H new ATOM 723 N THR A 289 -2.614 -9.322 -2.466 1.00 0.00 N ATOM 724 CA THR A 289 -3.662 -10.317 -2.276 1.00 0.00 C ATOM 725 C THR A 289 -4.811 -10.098 -3.252 1.00 0.00 C ATOM 726 O THR A 289 -5.583 -9.149 -3.115 1.00 0.00 O ATOM 727 CB THR A 289 -4.212 -10.285 -0.837 1.00 0.00 C ATOM 728 OG1 THR A 289 -4.249 -8.937 -0.357 1.00 0.00 O ATOM 729 CG2 THR A 289 -3.355 -11.135 0.089 1.00 0.00 C ATOM 0 H THR A 289 -2.867 -8.380 -2.167 1.00 0.00 H new ATOM 0 HA THR A 289 -3.211 -11.291 -2.463 1.00 0.00 H new ATOM 0 HB THR A 289 -5.222 -10.694 -0.848 1.00 0.00 H new ATOM 0 HG1 THR A 289 -3.336 -8.588 -0.290 1.00 0.00 H new ATOM 0 HG21 THR A 289 -3.763 -11.097 1.099 1.00 0.00 H new ATOM 0 HG22 THR A 289 -3.352 -12.167 -0.263 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.335 -10.751 0.095 1.00 0.00 H new ATOM 737 N SER A 290 -4.921 -10.982 -4.238 1.00 0.00 N ATOM 738 CA SER A 290 -5.975 -10.884 -5.240 1.00 0.00 C ATOM 739 C SER A 290 -5.783 -9.647 -6.112 1.00 0.00 C ATOM 740 O SER A 290 -6.745 -9.088 -6.640 1.00 0.00 O ATOM 741 CB SER A 290 -7.347 -10.837 -4.565 1.00 0.00 C ATOM 742 OG SER A 290 -7.488 -11.887 -3.623 1.00 0.00 O ATOM 0 H SER A 290 -4.292 -11.775 -4.364 1.00 0.00 H new ATOM 0 HA SER A 290 -5.920 -11.768 -5.876 1.00 0.00 H new ATOM 0 HB2 SER A 290 -7.478 -9.877 -4.066 1.00 0.00 H new ATOM 0 HB3 SER A 290 -8.130 -10.913 -5.320 1.00 0.00 H new ATOM 0 HG SER A 290 -8.372 -11.834 -3.204 1.00 0.00 H new ATOM 748 N THR A 291 -4.531 -9.222 -6.258 1.00 0.00 N ATOM 749 CA THR A 291 -4.211 -8.051 -7.064 1.00 0.00 C ATOM 750 C THR A 291 -3.985 -8.432 -8.522 1.00 0.00 C ATOM 751 O THR A 291 -4.531 -7.804 -9.430 1.00 0.00 O ATOM 752 CB THR A 291 -2.956 -7.331 -6.534 1.00 0.00 C ATOM 753 OG1 THR A 291 -1.788 -8.108 -6.818 1.00 0.00 O ATOM 754 CG2 THR A 291 -3.061 -7.094 -5.035 1.00 0.00 C ATOM 0 H THR A 291 -3.723 -9.672 -5.828 1.00 0.00 H new ATOM 0 HA THR A 291 -5.065 -7.377 -6.995 1.00 0.00 H new ATOM 0 HB THR A 291 -2.880 -6.366 -7.035 1.00 0.00 H new ATOM 0 HG1 THR A 291 -1.022 -7.511 -6.952 1.00 0.00 H new ATOM 0 HG21 THR A 291 -2.164 -6.585 -4.683 1.00 0.00 H new ATOM 0 HG22 THR A 291 -3.935 -6.477 -4.824 1.00 0.00 H new ATOM 0 HG23 THR A 291 -3.160 -8.050 -4.521 1.00 0.00 H new ATOM 762 N SER A 292 -3.178 -9.465 -8.741 1.00 0.00 N ATOM 763 CA SER A 292 -2.878 -9.928 -10.091 1.00 0.00 C ATOM 764 C SER A 292 -4.123 -9.881 -10.971 1.00 0.00 C ATOM 765 O SER A 292 -4.053 -9.518 -12.145 1.00 0.00 O ATOM 766 CB SER A 292 -2.320 -11.352 -10.053 1.00 0.00 C ATOM 767 OG SER A 292 -3.256 -12.251 -9.483 1.00 0.00 O ATOM 0 H SER A 292 -2.720 -9.997 -8.001 1.00 0.00 H new ATOM 0 HA SER A 292 -2.127 -9.263 -10.518 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.070 -11.675 -11.063 1.00 0.00 H new ATOM 0 HB3 SER A 292 -1.396 -11.369 -9.475 1.00 0.00 H new ATOM 0 HG SER A 292 -2.877 -13.155 -9.472 1.00 0.00 H new ATOM 773 N GLU A 293 -5.262 -10.251 -10.394 1.00 0.00 N ATOM 774 CA GLU A 293 -6.524 -10.251 -11.126 1.00 0.00 C ATOM 775 C GLU A 293 -6.849 -8.856 -11.650 1.00 0.00 C ATOM 776 O GLU A 293 -7.250 -8.691 -12.801 1.00 0.00 O ATOM 777 CB GLU A 293 -7.659 -10.749 -10.229 1.00 0.00 C ATOM 778 CG GLU A 293 -8.947 -11.038 -10.981 1.00 0.00 C ATOM 779 CD GLU A 293 -8.749 -12.014 -12.124 1.00 0.00 C ATOM 780 OE1 GLU A 293 -7.892 -12.914 -11.993 1.00 0.00 O ATOM 781 OE2 GLU A 293 -9.449 -11.878 -13.149 1.00 0.00 O ATOM 0 H GLU A 293 -5.337 -10.554 -9.423 1.00 0.00 H new ATOM 0 HA GLU A 293 -6.421 -10.924 -11.977 1.00 0.00 H new ATOM 0 HB2 GLU A 293 -7.335 -11.656 -9.718 1.00 0.00 H new ATOM 0 HB3 GLU A 293 -7.857 -10.003 -9.460 1.00 0.00 H new ATOM 0 HG2 GLU A 293 -9.685 -11.441 -10.288 1.00 0.00 H new ATOM 0 HG3 GLU A 293 -9.353 -10.105 -11.371 1.00 0.00 H new ATOM 788 N GLY A 294 -6.675 -7.853 -10.795 1.00 0.00 N ATOM 789 CA GLY A 294 -6.955 -6.485 -11.189 1.00 0.00 C ATOM 790 C GLY A 294 -6.889 -5.520 -10.021 1.00 0.00 C ATOM 791 O GLY A 294 -6.677 -4.322 -10.209 1.00 0.00 O ATOM 0 H GLY A 294 -6.345 -7.964 -9.836 1.00 0.00 H new ATOM 0 HA2 GLY A 294 -6.240 -6.176 -11.952 1.00 0.00 H new ATOM 0 HA3 GLY A 294 -7.945 -6.436 -11.641 1.00 0.00 H new ATOM 795 N TRP A 295 -7.072 -6.042 -8.814 1.00 0.00 N ATOM 796 CA TRP A 295 -7.034 -5.218 -7.611 1.00 0.00 C ATOM 797 C TRP A 295 -5.596 -4.931 -7.193 1.00 0.00 C ATOM 798 O TRP A 295 -4.650 -5.375 -7.845 1.00 0.00 O ATOM 799 CB TRP A 295 -7.782 -5.909 -6.470 1.00 0.00 C ATOM 800 CG TRP A 295 -9.218 -6.196 -6.789 1.00 0.00 C ATOM 801 CD1 TRP A 295 -9.698 -7.216 -7.560 1.00 0.00 C ATOM 802 CD2 TRP A 295 -10.359 -5.453 -6.347 1.00 0.00 C ATOM 803 NE1 TRP A 295 -11.069 -7.152 -7.624 1.00 0.00 N ATOM 804 CE2 TRP A 295 -11.499 -6.080 -6.887 1.00 0.00 C ATOM 805 CE3 TRP A 295 -10.529 -4.321 -5.546 1.00 0.00 C ATOM 806 CZ2 TRP A 295 -12.788 -5.610 -6.652 1.00 0.00 C ATOM 807 CZ3 TRP A 295 -11.809 -3.856 -5.314 1.00 0.00 C ATOM 808 CH2 TRP A 295 -12.925 -4.499 -5.864 1.00 0.00 C ATOM 0 H TRP A 295 -7.248 -7.032 -8.642 1.00 0.00 H new ATOM 0 HA TRP A 295 -7.524 -4.270 -7.835 1.00 0.00 H new ATOM 0 HB2 TRP A 295 -7.277 -6.844 -6.228 1.00 0.00 H new ATOM 0 HB3 TRP A 295 -7.733 -5.281 -5.580 1.00 0.00 H new ATOM 0 HD1 TRP A 295 -9.089 -7.963 -8.048 1.00 0.00 H new ATOM 0 HE1 TRP A 295 -11.669 -7.798 -8.137 1.00 0.00 H new ATOM 0 HE3 TRP A 295 -9.675 -3.819 -5.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 295 -13.649 -6.104 -7.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 295 -11.952 -2.981 -4.697 1.00 0.00 H new ATOM 0 HH2 TRP A 295 -13.913 -4.111 -5.663 1.00 0.00 H new ATOM 819 N ILE A 296 -5.438 -4.188 -6.103 1.00 0.00 N ATOM 820 CA ILE A 296 -4.114 -3.844 -5.598 1.00 0.00 C ATOM 821 C ILE A 296 -4.168 -3.482 -4.118 1.00 0.00 C ATOM 822 O ILE A 296 -4.871 -2.553 -3.720 1.00 0.00 O ATOM 823 CB ILE A 296 -3.501 -2.668 -6.381 1.00 0.00 C ATOM 824 CG1 ILE A 296 -4.575 -1.627 -6.705 1.00 0.00 C ATOM 825 CG2 ILE A 296 -2.839 -3.168 -7.656 1.00 0.00 C ATOM 826 CD1 ILE A 296 -4.035 -0.220 -6.831 1.00 0.00 C ATOM 0 H ILE A 296 -6.210 -3.813 -5.552 1.00 0.00 H new ATOM 0 HA ILE A 296 -3.486 -4.725 -5.732 1.00 0.00 H new ATOM 0 HB ILE A 296 -2.739 -2.196 -5.760 1.00 0.00 H new ATOM 0 HG12 ILE A 296 -5.067 -1.903 -7.637 1.00 0.00 H new ATOM 0 HG13 ILE A 296 -5.336 -1.647 -5.925 1.00 0.00 H new ATOM 0 HG21 ILE A 296 -2.411 -2.325 -8.198 1.00 0.00 H new ATOM 0 HG22 ILE A 296 -2.050 -3.876 -7.403 1.00 0.00 H new ATOM 0 HG23 ILE A 296 -3.582 -3.662 -8.282 1.00 0.00 H new ATOM 0 HD11 ILE A 296 -4.852 0.464 -7.061 1.00 0.00 H new ATOM 0 HD12 ILE A 296 -3.568 0.076 -5.892 1.00 0.00 H new ATOM 0 HD13 ILE A 296 -3.296 -0.184 -7.631 1.00 0.00 H new ATOM 838 N TYR A 297 -3.418 -4.221 -3.307 1.00 0.00 N ATOM 839 CA TYR A 297 -3.380 -3.978 -1.870 1.00 0.00 C ATOM 840 C TYR A 297 -2.457 -2.809 -1.539 1.00 0.00 C ATOM 841 O TYR A 297 -1.244 -2.888 -1.729 1.00 0.00 O ATOM 842 CB TYR A 297 -2.915 -5.235 -1.132 1.00 0.00 C ATOM 843 CG TYR A 297 -3.180 -5.196 0.356 1.00 0.00 C ATOM 844 CD1 TYR A 297 -2.260 -4.633 1.232 1.00 0.00 C ATOM 845 CD2 TYR A 297 -4.351 -5.724 0.887 1.00 0.00 C ATOM 846 CE1 TYR A 297 -2.498 -4.597 2.592 1.00 0.00 C ATOM 847 CE2 TYR A 297 -4.598 -5.690 2.246 1.00 0.00 C ATOM 848 CZ TYR A 297 -3.669 -5.126 3.094 1.00 0.00 C ATOM 849 OH TYR A 297 -3.910 -5.091 4.448 1.00 0.00 O ATOM 0 H TYR A 297 -2.829 -4.992 -3.620 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.388 -3.724 -1.543 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -3.416 -6.103 -1.559 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.846 -5.370 -1.299 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -1.343 -4.216 0.843 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -5.080 -6.168 0.226 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -1.771 -4.157 3.259 1.00 0.00 H new ATOM 0 HE2 TYR A 297 -5.514 -6.103 2.642 1.00 0.00 H new ATOM 0 HH TYR A 297 -4.779 -5.503 4.636 1.00 0.00 H new ATOM 859 N GLY A 298 -3.042 -1.724 -1.040 1.00 0.00 N ATOM 860 CA GLY A 298 -2.259 -0.554 -0.690 1.00 0.00 C ATOM 861 C GLY A 298 -2.629 0.005 0.670 1.00 0.00 C ATOM 862 O GLY A 298 -3.562 -0.475 1.315 1.00 0.00 O ATOM 0 H GLY A 298 -4.044 -1.635 -0.872 1.00 0.00 H new ATOM 0 HA2 GLY A 298 -1.200 -0.814 -0.697 1.00 0.00 H new ATOM 0 HA3 GLY A 298 -2.403 0.216 -1.448 1.00 0.00 H new ATOM 866 N THR A 299 -1.896 1.023 1.109 1.00 0.00 N ATOM 867 CA THR A 299 -2.149 1.646 2.402 1.00 0.00 C ATOM 868 C THR A 299 -2.361 3.149 2.256 1.00 0.00 C ATOM 869 O THR A 299 -1.582 3.833 1.592 1.00 0.00 O ATOM 870 CB THR A 299 -0.989 1.396 3.384 1.00 0.00 C ATOM 871 OG1 THR A 299 -1.004 0.032 3.821 1.00 0.00 O ATOM 872 CG2 THR A 299 -1.090 2.321 4.587 1.00 0.00 C ATOM 0 H THR A 299 -1.122 1.434 0.588 1.00 0.00 H new ATOM 0 HA THR A 299 -3.056 1.190 2.800 1.00 0.00 H new ATOM 0 HB THR A 299 -0.052 1.601 2.866 1.00 0.00 H new ATOM 0 HG1 THR A 299 -0.263 -0.120 4.444 1.00 0.00 H new ATOM 0 HG21 THR A 299 -0.260 2.126 5.266 1.00 0.00 H new ATOM 0 HG22 THR A 299 -1.050 3.358 4.253 1.00 0.00 H new ATOM 0 HG23 THR A 299 -2.032 2.143 5.105 1.00 0.00 H new ATOM 880 N SER A 300 -3.419 3.656 2.881 1.00 0.00 N ATOM 881 CA SER A 300 -3.734 5.079 2.817 1.00 0.00 C ATOM 882 C SER A 300 -2.662 5.905 3.520 1.00 0.00 C ATOM 883 O SER A 300 -2.044 5.451 4.484 1.00 0.00 O ATOM 884 CB SER A 300 -5.100 5.348 3.452 1.00 0.00 C ATOM 885 OG SER A 300 -5.325 6.739 3.606 1.00 0.00 O ATOM 0 H SER A 300 -4.072 3.104 3.437 1.00 0.00 H new ATOM 0 HA SER A 300 -3.764 5.373 1.768 1.00 0.00 H new ATOM 0 HB2 SER A 300 -5.885 4.916 2.831 1.00 0.00 H new ATOM 0 HB3 SER A 300 -5.156 4.857 4.424 1.00 0.00 H new ATOM 0 HG SER A 300 -5.063 7.206 2.785 1.00 0.00 H new ATOM 891 N LEU A 301 -2.446 7.121 3.031 1.00 0.00 N ATOM 892 CA LEU A 301 -1.448 8.013 3.611 1.00 0.00 C ATOM 893 C LEU A 301 -2.094 8.996 4.582 1.00 0.00 C ATOM 894 O LEU A 301 -1.519 9.332 5.618 1.00 0.00 O ATOM 895 CB LEU A 301 -0.714 8.776 2.507 1.00 0.00 C ATOM 896 CG LEU A 301 0.644 9.368 2.889 1.00 0.00 C ATOM 897 CD1 LEU A 301 1.686 8.269 3.021 1.00 0.00 C ATOM 898 CD2 LEU A 301 1.082 10.401 1.861 1.00 0.00 C ATOM 0 H LEU A 301 -2.949 7.512 2.234 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.731 7.405 4.163 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.570 8.103 1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.357 9.586 2.163 1.00 0.00 H new ATOM 0 HG LEU A 301 0.545 9.864 3.854 1.00 0.00 H new ATOM 0 HD11 LEU A 301 2.646 8.708 3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 301 1.377 7.565 3.794 1.00 0.00 H new ATOM 0 HD13 LEU A 301 1.784 7.744 2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 301 2.050 10.812 2.148 1.00 0.00 H new ATOM 0 HD22 LEU A 301 1.164 9.928 0.882 1.00 0.00 H new ATOM 0 HD23 LEU A 301 0.346 11.204 1.815 1.00 0.00 H new ATOM 910 N THR A 302 -3.296 9.452 4.241 1.00 0.00 N ATOM 911 CA THR A 302 -4.021 10.395 5.083 1.00 0.00 C ATOM 912 C THR A 302 -4.573 9.710 6.327 1.00 0.00 C ATOM 913 O THR A 302 -4.467 10.235 7.437 1.00 0.00 O ATOM 914 CB THR A 302 -5.184 11.054 4.315 1.00 0.00 C ATOM 915 OG1 THR A 302 -4.678 12.053 3.423 1.00 0.00 O ATOM 916 CG2 THR A 302 -6.180 11.683 5.277 1.00 0.00 C ATOM 0 H THR A 302 -3.787 9.183 3.388 1.00 0.00 H new ATOM 0 HA THR A 302 -3.309 11.164 5.381 1.00 0.00 H new ATOM 0 HB THR A 302 -5.696 10.281 3.741 1.00 0.00 H new ATOM 0 HG1 THR A 302 -4.210 11.620 2.679 1.00 0.00 H new ATOM 0 HG21 THR A 302 -6.992 12.142 4.712 1.00 0.00 H new ATOM 0 HG22 THR A 302 -6.585 10.914 5.935 1.00 0.00 H new ATOM 0 HG23 THR A 302 -5.678 12.444 5.874 1.00 0.00 H new ATOM 924 N THR A 303 -5.163 8.534 6.138 1.00 0.00 N ATOM 925 CA THR A 303 -5.732 7.777 7.246 1.00 0.00 C ATOM 926 C THR A 303 -4.731 6.764 7.791 1.00 0.00 C ATOM 927 O THR A 303 -4.543 6.653 9.002 1.00 0.00 O ATOM 928 CB THR A 303 -7.014 7.036 6.820 1.00 0.00 C ATOM 929 OG1 THR A 303 -6.700 6.033 5.847 1.00 0.00 O ATOM 930 CG2 THR A 303 -8.033 8.007 6.244 1.00 0.00 C ATOM 0 H THR A 303 -5.259 8.085 5.227 1.00 0.00 H new ATOM 0 HA THR A 303 -5.979 8.496 8.027 1.00 0.00 H new ATOM 0 HB THR A 303 -7.444 6.563 7.703 1.00 0.00 H new ATOM 0 HG1 THR A 303 -6.338 6.460 5.042 1.00 0.00 H new ATOM 0 HG21 THR A 303 -8.930 7.461 5.950 1.00 0.00 H new ATOM 0 HG22 THR A 303 -8.292 8.752 6.997 1.00 0.00 H new ATOM 0 HG23 THR A 303 -7.609 8.505 5.372 1.00 0.00 H new ATOM 938 N GLY A 304 -4.089 6.028 6.889 1.00 0.00 N ATOM 939 CA GLY A 304 -3.115 5.034 7.300 1.00 0.00 C ATOM 940 C GLY A 304 -3.661 3.622 7.231 1.00 0.00 C ATOM 941 O GLY A 304 -2.981 2.667 7.607 1.00 0.00 O ATOM 0 H GLY A 304 -4.226 6.102 5.881 1.00 0.00 H new ATOM 0 HA2 GLY A 304 -2.233 5.110 6.664 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -2.793 5.246 8.319 1.00 0.00 H new ATOM 945 N CYS A 305 -4.893 3.490 6.751 1.00 0.00 N ATOM 946 CA CYS A 305 -5.532 2.183 6.637 1.00 0.00 C ATOM 947 C CYS A 305 -4.901 1.366 5.514 1.00 0.00 C ATOM 948 O CYS A 305 -4.015 1.845 4.807 1.00 0.00 O ATOM 949 CB CYS A 305 -7.032 2.347 6.384 1.00 0.00 C ATOM 950 SG CYS A 305 -7.977 2.838 7.845 1.00 0.00 S ATOM 0 H CYS A 305 -5.469 4.270 6.435 1.00 0.00 H new ATOM 0 HA CYS A 305 -5.385 1.650 7.576 1.00 0.00 H new ATOM 0 HB2 CYS A 305 -7.178 3.092 5.602 1.00 0.00 H new ATOM 0 HB3 CYS A 305 -7.431 1.406 6.006 1.00 0.00 H new ATOM 0 HG CYS A 305 -9.233 2.953 7.531 1.00 0.00 H new ATOM 956 N SER A 306 -5.362 0.129 5.359 1.00 0.00 N ATOM 957 CA SER A 306 -4.839 -0.758 4.326 1.00 0.00 C ATOM 958 C SER A 306 -5.918 -1.720 3.838 1.00 0.00 C ATOM 959 O SER A 306 -6.713 -2.229 4.626 1.00 0.00 O ATOM 960 CB SER A 306 -3.641 -1.545 4.860 1.00 0.00 C ATOM 961 OG SER A 306 -2.731 -0.694 5.536 1.00 0.00 O ATOM 0 H SER A 306 -6.096 -0.282 5.935 1.00 0.00 H new ATOM 0 HA SER A 306 -4.516 -0.145 3.484 1.00 0.00 H new ATOM 0 HB2 SER A 306 -3.987 -2.324 5.539 1.00 0.00 H new ATOM 0 HB3 SER A 306 -3.133 -2.044 4.035 1.00 0.00 H new ATOM 0 HG SER A 306 -2.284 -0.112 4.887 1.00 0.00 H new ATOM 967 N GLY A 307 -5.938 -1.963 2.531 1.00 0.00 N ATOM 968 CA GLY A 307 -6.923 -2.863 1.959 1.00 0.00 C ATOM 969 C GLY A 307 -6.779 -2.999 0.456 1.00 0.00 C ATOM 970 O GLY A 307 -5.868 -2.427 -0.143 1.00 0.00 O ATOM 0 H GLY A 307 -5.290 -1.553 1.858 1.00 0.00 H new ATOM 0 HA2 GLY A 307 -6.825 -3.845 2.421 1.00 0.00 H new ATOM 0 HA3 GLY A 307 -7.923 -2.499 2.194 1.00 0.00 H new ATOM 974 N LEU A 308 -7.680 -3.761 -0.155 1.00 0.00 N ATOM 975 CA LEU A 308 -7.649 -3.973 -1.598 1.00 0.00 C ATOM 976 C LEU A 308 -8.454 -2.899 -2.324 1.00 0.00 C ATOM 977 O LEU A 308 -9.558 -2.548 -1.907 1.00 0.00 O ATOM 978 CB LEU A 308 -8.200 -5.358 -1.942 1.00 0.00 C ATOM 979 CG LEU A 308 -7.182 -6.499 -1.963 1.00 0.00 C ATOM 980 CD1 LEU A 308 -7.889 -7.845 -1.990 1.00 0.00 C ATOM 981 CD2 LEU A 308 -6.250 -6.359 -3.158 1.00 0.00 C ATOM 0 H LEU A 308 -8.440 -4.242 0.326 1.00 0.00 H new ATOM 0 HA LEU A 308 -6.612 -3.909 -1.927 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -8.979 -5.606 -1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -8.676 -5.305 -2.921 1.00 0.00 H new ATOM 0 HG LEU A 308 -6.584 -6.445 -1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.148 -8.645 -2.005 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.514 -7.946 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -8.512 -7.911 -2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -5.532 -7.179 -3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.832 -6.387 -4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -5.717 -5.410 -3.095 1.00 0.00 H new ATOM 993 N LEU A 309 -7.894 -2.382 -3.412 1.00 0.00 N ATOM 994 CA LEU A 309 -8.560 -1.349 -4.198 1.00 0.00 C ATOM 995 C LEU A 309 -8.385 -1.604 -5.692 1.00 0.00 C ATOM 996 O LEU A 309 -7.417 -2.225 -6.131 1.00 0.00 O ATOM 997 CB LEU A 309 -8.007 0.031 -3.836 1.00 0.00 C ATOM 998 CG LEU A 309 -6.499 0.108 -3.596 1.00 0.00 C ATOM 999 CD1 LEU A 309 -6.004 1.536 -3.763 1.00 0.00 C ATOM 1000 CD2 LEU A 309 -6.152 -0.420 -2.211 1.00 0.00 C ATOM 0 H LEU A 309 -6.981 -2.661 -3.770 1.00 0.00 H new ATOM 0 HA LEU A 309 -9.624 -1.379 -3.965 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -8.263 0.724 -4.637 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -8.516 0.380 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.000 -0.517 -4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -4.929 1.571 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.219 1.880 -4.775 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.509 2.183 -3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -5.075 -0.358 -2.057 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.662 0.178 -1.455 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.471 -1.459 -2.127 1.00 0.00 H new ATOM 1012 N PRO A 310 -9.342 -1.111 -6.492 1.00 0.00 N ATOM 1013 CA PRO A 310 -9.315 -1.271 -7.949 1.00 0.00 C ATOM 1014 C PRO A 310 -8.210 -0.448 -8.602 1.00 0.00 C ATOM 1015 O PRO A 310 -8.142 0.767 -8.425 1.00 0.00 O ATOM 1016 CB PRO A 310 -10.690 -0.761 -8.387 1.00 0.00 C ATOM 1017 CG PRO A 310 -11.104 0.184 -7.312 1.00 0.00 C ATOM 1018 CD PRO A 310 -10.524 -0.361 -6.036 1.00 0.00 C ATOM 0 HA PRO A 310 -9.114 -2.301 -8.242 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -10.637 -0.261 -9.354 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -11.402 -1.580 -8.490 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -10.732 1.189 -7.512 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -12.190 0.252 -7.249 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -10.252 0.437 -5.345 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -11.233 -1.005 -5.515 1.00 0.00 H new ATOM 1026 N GLU A 311 -7.345 -1.120 -9.356 1.00 0.00 N ATOM 1027 CA GLU A 311 -6.243 -0.449 -10.035 1.00 0.00 C ATOM 1028 C GLU A 311 -6.761 0.629 -10.982 1.00 0.00 C ATOM 1029 O GLU A 311 -5.993 1.441 -11.494 1.00 0.00 O ATOM 1030 CB GLU A 311 -5.400 -1.464 -10.811 1.00 0.00 C ATOM 1031 CG GLU A 311 -5.925 -1.749 -12.208 1.00 0.00 C ATOM 1032 CD GLU A 311 -4.977 -2.606 -13.024 1.00 0.00 C ATOM 1033 OE1 GLU A 311 -4.196 -3.369 -12.419 1.00 0.00 O ATOM 1034 OE2 GLU A 311 -5.017 -2.514 -14.269 1.00 0.00 O ATOM 0 H GLU A 311 -7.386 -2.127 -9.512 1.00 0.00 H new ATOM 0 HA GLU A 311 -5.620 0.027 -9.278 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -4.377 -1.094 -10.885 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -5.361 -2.397 -10.249 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -6.890 -2.251 -12.134 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -6.095 -0.806 -12.728 1.00 0.00 H new ATOM 1041 N ASN A 312 -8.071 0.627 -11.210 1.00 0.00 N ATOM 1042 CA ASN A 312 -8.693 1.604 -12.096 1.00 0.00 C ATOM 1043 C ASN A 312 -9.174 2.821 -11.313 1.00 0.00 C ATOM 1044 O ASN A 312 -10.019 3.583 -11.784 1.00 0.00 O ATOM 1045 CB ASN A 312 -9.867 0.969 -12.845 1.00 0.00 C ATOM 1046 CG ASN A 312 -9.412 0.045 -13.957 1.00 0.00 C ATOM 1047 OD1 ASN A 312 -9.385 -1.175 -13.793 1.00 0.00 O ATOM 1048 ND2 ASN A 312 -9.051 0.623 -15.097 1.00 0.00 N ATOM 0 H ASN A 312 -8.721 -0.040 -10.794 1.00 0.00 H new ATOM 0 HA ASN A 312 -7.944 1.931 -12.817 1.00 0.00 H new ATOM 0 HB2 ASN A 312 -10.483 0.410 -12.141 1.00 0.00 H new ATOM 0 HB3 ASN A 312 -10.495 1.755 -13.264 1.00 0.00 H new ATOM 0 HD21 ASN A 312 -8.736 0.052 -15.881 1.00 0.00 H new ATOM 0 HD22 ASN A 312 -9.089 1.638 -15.189 1.00 0.00 H new ATOM 1055 N TYR A 313 -8.630 2.999 -10.114 1.00 0.00 N ATOM 1056 CA TYR A 313 -9.004 4.122 -9.263 1.00 0.00 C ATOM 1057 C TYR A 313 -7.768 4.870 -8.774 1.00 0.00 C ATOM 1058 O TYR A 313 -7.875 5.881 -8.079 1.00 0.00 O ATOM 1059 CB TYR A 313 -9.824 3.633 -8.068 1.00 0.00 C ATOM 1060 CG TYR A 313 -11.262 3.314 -8.410 1.00 0.00 C ATOM 1061 CD1 TYR A 313 -11.572 2.366 -9.377 1.00 0.00 C ATOM 1062 CD2 TYR A 313 -12.310 3.962 -7.768 1.00 0.00 C ATOM 1063 CE1 TYR A 313 -12.884 2.072 -9.694 1.00 0.00 C ATOM 1064 CE2 TYR A 313 -13.625 3.673 -8.077 1.00 0.00 C ATOM 1065 CZ TYR A 313 -13.907 2.727 -9.040 1.00 0.00 C ATOM 1066 OH TYR A 313 -15.216 2.438 -9.352 1.00 0.00 O ATOM 0 H TYR A 313 -7.928 2.379 -9.709 1.00 0.00 H new ATOM 0 HA TYR A 313 -9.611 4.807 -9.855 1.00 0.00 H new ATOM 0 HB2 TYR A 313 -9.352 2.742 -7.654 1.00 0.00 H new ATOM 0 HB3 TYR A 313 -9.805 4.395 -7.289 1.00 0.00 H new ATOM 0 HD1 TYR A 313 -10.774 1.850 -9.890 1.00 0.00 H new ATOM 0 HD2 TYR A 313 -12.093 4.704 -7.014 1.00 0.00 H new ATOM 0 HE1 TYR A 313 -13.108 1.333 -10.450 1.00 0.00 H new ATOM 0 HE2 TYR A 313 -14.428 4.185 -7.567 1.00 0.00 H new ATOM 0 HH TYR A 313 -15.812 2.986 -8.800 1.00 0.00 H new ATOM 1076 N ILE A 314 -6.595 4.367 -9.143 1.00 0.00 N ATOM 1077 CA ILE A 314 -5.338 4.987 -8.744 1.00 0.00 C ATOM 1078 C ILE A 314 -4.381 5.100 -9.925 1.00 0.00 C ATOM 1079 O ILE A 314 -4.689 4.658 -11.033 1.00 0.00 O ATOM 1080 CB ILE A 314 -4.651 4.194 -7.616 1.00 0.00 C ATOM 1081 CG1 ILE A 314 -4.503 2.724 -8.014 1.00 0.00 C ATOM 1082 CG2 ILE A 314 -5.442 4.321 -6.322 1.00 0.00 C ATOM 1083 CD1 ILE A 314 -3.245 2.437 -8.804 1.00 0.00 C ATOM 0 H ILE A 314 -6.489 3.531 -9.718 1.00 0.00 H new ATOM 0 HA ILE A 314 -5.581 5.985 -8.379 1.00 0.00 H new ATOM 0 HB ILE A 314 -3.656 4.609 -7.453 1.00 0.00 H new ATOM 0 HG12 ILE A 314 -4.505 2.110 -7.113 1.00 0.00 H new ATOM 0 HG13 ILE A 314 -5.369 2.427 -8.605 1.00 0.00 H new ATOM 0 HG21 ILE A 314 -4.944 3.755 -5.534 1.00 0.00 H new ATOM 0 HG22 ILE A 314 -5.501 5.370 -6.033 1.00 0.00 H new ATOM 0 HG23 ILE A 314 -6.448 3.928 -6.470 1.00 0.00 H new ATOM 0 HD11 ILE A 314 -3.205 1.376 -9.052 1.00 0.00 H new ATOM 0 HD12 ILE A 314 -3.250 3.025 -9.722 1.00 0.00 H new ATOM 0 HD13 ILE A 314 -2.372 2.703 -8.208 1.00 0.00 H new ATOM 1095 N THR A 315 -3.216 5.694 -9.682 1.00 0.00 N ATOM 1096 CA THR A 315 -2.213 5.864 -10.726 1.00 0.00 C ATOM 1097 C THR A 315 -0.810 5.932 -10.134 1.00 0.00 C ATOM 1098 O THR A 315 -0.638 6.223 -8.950 1.00 0.00 O ATOM 1099 CB THR A 315 -2.472 7.139 -11.551 1.00 0.00 C ATOM 1100 OG1 THR A 315 -1.815 7.042 -12.820 1.00 0.00 O ATOM 1101 CG2 THR A 315 -1.978 8.372 -10.811 1.00 0.00 C ATOM 0 H THR A 315 -2.944 6.065 -8.772 1.00 0.00 H new ATOM 0 HA THR A 315 -2.287 4.995 -11.380 1.00 0.00 H new ATOM 0 HB THR A 315 -3.547 7.234 -11.705 1.00 0.00 H new ATOM 0 HG1 THR A 315 -1.985 7.855 -13.340 1.00 0.00 H new ATOM 0 HG21 THR A 315 -2.172 9.260 -11.413 1.00 0.00 H new ATOM 0 HG22 THR A 315 -2.501 8.458 -9.858 1.00 0.00 H new ATOM 0 HG23 THR A 315 -0.907 8.283 -10.630 1.00 0.00 H new ATOM 1109 N LYS A 316 0.192 5.664 -10.964 1.00 0.00 N ATOM 1110 CA LYS A 316 1.581 5.696 -10.524 1.00 0.00 C ATOM 1111 C LYS A 316 1.922 7.044 -9.897 1.00 0.00 C ATOM 1112 O LYS A 316 1.377 8.076 -10.288 1.00 0.00 O ATOM 1113 CB LYS A 316 2.518 5.419 -11.702 1.00 0.00 C ATOM 1114 CG LYS A 316 2.836 3.946 -11.892 1.00 0.00 C ATOM 1115 CD LYS A 316 3.777 3.435 -10.814 1.00 0.00 C ATOM 1116 CE LYS A 316 5.194 3.947 -11.022 1.00 0.00 C ATOM 1117 NZ LYS A 316 5.814 3.379 -12.251 1.00 0.00 N ATOM 0 H LYS A 316 0.067 5.422 -11.947 1.00 0.00 H new ATOM 0 HA LYS A 316 1.715 4.920 -9.771 1.00 0.00 H new ATOM 0 HB2 LYS A 316 2.064 5.805 -12.615 1.00 0.00 H new ATOM 0 HB3 LYS A 316 3.448 5.967 -11.552 1.00 0.00 H new ATOM 0 HG2 LYS A 316 1.912 3.368 -11.873 1.00 0.00 H new ATOM 0 HG3 LYS A 316 3.288 3.794 -12.872 1.00 0.00 H new ATOM 0 HD2 LYS A 316 3.415 3.750 -9.835 1.00 0.00 H new ATOM 0 HD3 LYS A 316 3.779 2.345 -10.818 1.00 0.00 H new ATOM 0 HE2 LYS A 316 5.181 5.035 -11.091 1.00 0.00 H new ATOM 0 HE3 LYS A 316 5.804 3.690 -10.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 6.845 3.510 -12.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 5.596 2.364 -12.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 5.434 3.866 -13.088 1.00 0.00 H new ATOM 1131 N ALA A 317 2.827 7.028 -8.924 1.00 0.00 N ATOM 1132 CA ALA A 317 3.242 8.249 -8.246 1.00 0.00 C ATOM 1133 C ALA A 317 3.890 9.225 -9.221 1.00 0.00 C ATOM 1134 O ALA A 317 5.091 9.150 -9.484 1.00 0.00 O ATOM 1135 CB ALA A 317 4.199 7.923 -7.109 1.00 0.00 C ATOM 0 H ALA A 317 3.287 6.182 -8.588 1.00 0.00 H new ATOM 0 HA ALA A 317 2.353 8.725 -7.833 1.00 0.00 H new ATOM 0 HB1 ALA A 317 4.501 8.845 -6.612 1.00 0.00 H new ATOM 0 HB2 ALA A 317 3.703 7.269 -6.392 1.00 0.00 H new ATOM 0 HB3 ALA A 317 5.080 7.421 -7.508 1.00 0.00 H new