USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 645 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 401 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 414 THR OG1 : rot 180:sc= -0.985 USER MOD Set 2.1: A 390 ASN : amide:sc= -2.5! C(o=-8!,f=-17!) USER MOD Set 2.2: A 393 THR OG1 : rot -178:sc= -5.45! USER MOD Set 3.1: A 369 ASN : amide:sc= -8.43 K(o=-13,f=-20!) USER MOD Set 3.2: A 436 GLN : amide:sc= -4.51 K(o=-13,f=-10) USER MOD Single : A 361 SER OG : rot -20:sc= 0.341 USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 366 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 371 SER OG : rot -49:sc= 0.0364 USER MOD Single : A 373 THR OG1 : rot 126:sc= -1.72 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 GLN : amide:sc= -0.0948 K(o=-0.095,f=-2.3!) USER MOD Single : A 384 CYS SG : rot -110:sc= -2.13 USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 MET CE :methyl -174:sc= -2.22 (180deg=-2.69) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 395 GLN : amide:sc= 0.0147 X(o=0.015,f=0) USER MOD Single : A 397 MET CE :methyl -151:sc=-0.00726 (180deg=-0.148) USER MOD Single : A 399 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 404 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.328) USER MOD Single : A 406 THR OG1 : rot -120:sc= -0.418 USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 410 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 417 TYR OH : rot 16:sc= -2.01! USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 433 LYS NZ :NH3+ 144:sc= 0.392 (180deg=-0.862) USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 439 LYS NZ :NH3+ -113:sc= -1.32 (180deg=-3.46!) USER MOD Single : A 441 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 SER OG : rot 5:sc= 0.182! USER MOD ----------------------------------------------------------------- ATOM 168 N SER A 361 0.643 8.339 1.447 1.00 0.00 N ATOM 169 CA SER A 361 0.838 8.104 0.021 1.00 0.00 C ATOM 170 C SER A 361 1.466 6.736 -0.223 1.00 0.00 C ATOM 171 O SER A 361 1.826 6.398 -1.350 1.00 0.00 O ATOM 172 CB SER A 361 1.722 9.198 -0.580 1.00 0.00 C ATOM 173 OG SER A 361 2.795 9.523 0.287 1.00 0.00 O ATOM 0 HA SER A 361 -0.138 8.128 -0.463 1.00 0.00 H new ATOM 0 HB2 SER A 361 2.115 8.865 -1.541 1.00 0.00 H new ATOM 0 HB3 SER A 361 1.123 10.088 -0.772 1.00 0.00 H new ATOM 0 HG SER A 361 2.582 9.226 1.196 1.00 0.00 H new ATOM 179 N ALA A 362 1.596 5.952 0.843 1.00 0.00 N ATOM 180 CA ALA A 362 2.178 4.620 0.745 1.00 0.00 C ATOM 181 C ALA A 362 1.116 3.541 0.929 1.00 0.00 C ATOM 182 O ALA A 362 0.054 3.793 1.500 1.00 0.00 O ATOM 183 CB ALA A 362 3.287 4.452 1.773 1.00 0.00 C ATOM 0 H ALA A 362 1.306 6.217 1.784 1.00 0.00 H new ATOM 0 HA ALA A 362 2.602 4.509 -0.253 1.00 0.00 H new ATOM 0 HB1 ALA A 362 3.713 3.452 1.689 1.00 0.00 H new ATOM 0 HB2 ALA A 362 4.065 5.194 1.594 1.00 0.00 H new ATOM 0 HB3 ALA A 362 2.879 4.589 2.774 1.00 0.00 H new ATOM 189 N ILE A 363 1.408 2.341 0.442 1.00 0.00 N ATOM 190 CA ILE A 363 0.476 1.224 0.553 1.00 0.00 C ATOM 191 C ILE A 363 1.141 0.017 1.207 1.00 0.00 C ATOM 192 O ILE A 363 2.316 -0.264 0.965 1.00 0.00 O ATOM 193 CB ILE A 363 -0.074 0.810 -0.824 1.00 0.00 C ATOM 194 CG1 ILE A 363 1.063 0.331 -1.729 1.00 0.00 C ATOM 195 CG2 ILE A 363 -0.818 1.970 -1.468 1.00 0.00 C ATOM 196 CD1 ILE A 363 0.589 -0.465 -2.924 1.00 0.00 C ATOM 0 H ILE A 363 2.282 2.116 -0.033 1.00 0.00 H new ATOM 0 HA ILE A 363 -0.351 1.563 1.177 1.00 0.00 H new ATOM 0 HB ILE A 363 -0.775 -0.014 -0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 363 1.627 1.196 -2.079 1.00 0.00 H new ATOM 0 HG13 ILE A 363 1.749 -0.281 -1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 363 -1.201 1.662 -2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 363 -1.649 2.269 -0.829 1.00 0.00 H new ATOM 0 HG23 ILE A 363 -0.138 2.812 -1.596 1.00 0.00 H new ATOM 0 HD11 ILE A 363 1.448 -0.772 -3.521 1.00 0.00 H new ATOM 0 HD12 ILE A 363 0.050 -1.349 -2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 363 -0.074 0.151 -3.532 1.00 0.00 H new ATOM 208 N TYR A 364 0.383 -0.693 2.034 1.00 0.00 N ATOM 209 CA TYR A 364 0.899 -1.871 2.723 1.00 0.00 C ATOM 210 C TYR A 364 0.397 -3.152 2.063 1.00 0.00 C ATOM 211 O TYR A 364 -0.803 -3.426 2.046 1.00 0.00 O ATOM 212 CB TYR A 364 0.487 -1.847 4.196 1.00 0.00 C ATOM 213 CG TYR A 364 1.443 -2.585 5.104 1.00 0.00 C ATOM 214 CD1 TYR A 364 1.391 -3.967 5.225 1.00 0.00 C ATOM 215 CD2 TYR A 364 2.401 -1.899 5.840 1.00 0.00 C ATOM 216 CE1 TYR A 364 2.263 -4.645 6.056 1.00 0.00 C ATOM 217 CE2 TYR A 364 3.279 -2.568 6.671 1.00 0.00 C ATOM 218 CZ TYR A 364 3.205 -3.941 6.776 1.00 0.00 C ATOM 219 OH TYR A 364 4.076 -4.613 7.602 1.00 0.00 O ATOM 0 H TYR A 364 -0.591 -0.474 2.244 1.00 0.00 H new ATOM 0 HA TYR A 364 1.987 -1.852 2.657 1.00 0.00 H new ATOM 0 HB2 TYR A 364 0.412 -0.811 4.527 1.00 0.00 H new ATOM 0 HB3 TYR A 364 -0.506 -2.286 4.294 1.00 0.00 H new ATOM 0 HD1 TYR A 364 0.657 -4.522 4.660 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.461 -0.824 5.761 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.207 -5.720 6.141 1.00 0.00 H new ATOM 0 HE2 TYR A 364 4.019 -2.019 7.235 1.00 0.00 H new ATOM 0 HH TYR A 364 4.676 -3.971 8.036 1.00 0.00 H new ATOM 229 N VAL A 365 1.326 -3.933 1.521 1.00 0.00 N ATOM 230 CA VAL A 365 0.980 -5.186 0.861 1.00 0.00 C ATOM 231 C VAL A 365 1.267 -6.380 1.764 1.00 0.00 C ATOM 232 O VAL A 365 2.239 -6.381 2.519 1.00 0.00 O ATOM 233 CB VAL A 365 1.754 -5.358 -0.460 1.00 0.00 C ATOM 234 CG1 VAL A 365 1.163 -6.492 -1.282 1.00 0.00 C ATOM 235 CG2 VAL A 365 1.752 -4.058 -1.250 1.00 0.00 C ATOM 0 H VAL A 365 2.324 -3.720 1.526 1.00 0.00 H new ATOM 0 HA VAL A 365 -0.088 -5.145 0.645 1.00 0.00 H new ATOM 0 HB VAL A 365 2.787 -5.613 -0.225 1.00 0.00 H new ATOM 0 HG11 VAL A 365 1.723 -6.598 -2.211 1.00 0.00 H new ATOM 0 HG12 VAL A 365 1.221 -7.421 -0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 365 0.120 -6.271 -1.510 1.00 0.00 H new ATOM 0 HG21 VAL A 365 2.303 -4.197 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 365 0.725 -3.771 -1.476 1.00 0.00 H new ATOM 0 HG23 VAL A 365 2.227 -3.273 -0.661 1.00 0.00 H new ATOM 245 N GLN A 366 0.414 -7.397 1.680 1.00 0.00 N ATOM 246 CA GLN A 366 0.576 -8.598 2.491 1.00 0.00 C ATOM 247 C GLN A 366 0.044 -9.825 1.759 1.00 0.00 C ATOM 248 O GLN A 366 -1.135 -9.890 1.413 1.00 0.00 O ATOM 249 CB GLN A 366 -0.143 -8.436 3.832 1.00 0.00 C ATOM 250 CG GLN A 366 0.724 -7.820 4.917 1.00 0.00 C ATOM 251 CD GLN A 366 0.152 -8.022 6.307 1.00 0.00 C ATOM 252 OE1 GLN A 366 0.180 -9.128 6.847 1.00 0.00 O ATOM 253 NE2 GLN A 366 -0.372 -6.953 6.893 1.00 0.00 N ATOM 0 H GLN A 366 -0.395 -7.413 1.059 1.00 0.00 H new ATOM 0 HA GLN A 366 1.641 -8.741 2.674 1.00 0.00 H new ATOM 0 HB2 GLN A 366 -1.027 -7.814 3.688 1.00 0.00 H new ATOM 0 HB3 GLN A 366 -0.492 -9.413 4.168 1.00 0.00 H new ATOM 0 HG2 GLN A 366 1.721 -8.257 4.872 1.00 0.00 H new ATOM 0 HG3 GLN A 366 0.835 -6.753 4.726 1.00 0.00 H new ATOM 0 HE21 GLN A 366 -0.374 -6.055 6.409 1.00 0.00 H new ATOM 0 HE22 GLN A 366 -0.773 -7.029 7.828 1.00 0.00 H new ATOM 262 N GLY A 367 0.921 -10.797 1.527 1.00 0.00 N ATOM 263 CA GLY A 367 0.519 -12.009 0.837 1.00 0.00 C ATOM 264 C GLY A 367 1.450 -12.360 -0.307 1.00 0.00 C ATOM 265 O GLY A 367 1.079 -13.109 -1.212 1.00 0.00 O ATOM 0 H GLY A 367 1.902 -10.767 1.804 1.00 0.00 H new ATOM 0 HA2 GLY A 367 0.492 -12.836 1.547 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -0.494 -11.886 0.453 1.00 0.00 H new ATOM 269 N LEU A 368 2.662 -11.818 -0.269 1.00 0.00 N ATOM 270 CA LEU A 368 3.649 -12.078 -1.311 1.00 0.00 C ATOM 271 C LEU A 368 4.327 -13.427 -1.096 1.00 0.00 C ATOM 272 O LEU A 368 4.400 -13.924 0.028 1.00 0.00 O ATOM 273 CB LEU A 368 4.699 -10.966 -1.335 1.00 0.00 C ATOM 274 CG LEU A 368 4.196 -9.577 -1.730 1.00 0.00 C ATOM 275 CD1 LEU A 368 5.276 -8.532 -1.498 1.00 0.00 C ATOM 276 CD2 LEU A 368 3.743 -9.566 -3.183 1.00 0.00 C ATOM 0 H LEU A 368 2.985 -11.196 0.472 1.00 0.00 H new ATOM 0 HA LEU A 368 3.130 -12.102 -2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 368 5.151 -10.899 -0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 368 5.489 -11.255 -2.028 1.00 0.00 H new ATOM 0 HG LEU A 368 3.340 -9.330 -1.102 1.00 0.00 H new ATOM 0 HD11 LEU A 368 4.900 -7.550 -1.785 1.00 0.00 H new ATOM 0 HD12 LEU A 368 5.551 -8.521 -0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 368 6.152 -8.775 -2.099 1.00 0.00 H new ATOM 0 HD21 LEU A 368 3.388 -8.569 -3.446 1.00 0.00 H new ATOM 0 HD22 LEU A 368 4.580 -9.835 -3.827 1.00 0.00 H new ATOM 0 HD23 LEU A 368 2.936 -10.286 -3.318 1.00 0.00 H new ATOM 288 N ASN A 369 4.824 -14.014 -2.180 1.00 0.00 N ATOM 289 CA ASN A 369 5.497 -15.306 -2.109 1.00 0.00 C ATOM 290 C ASN A 369 6.917 -15.150 -1.572 1.00 0.00 C ATOM 291 O ASN A 369 7.348 -14.046 -1.239 1.00 0.00 O ATOM 292 CB ASN A 369 5.532 -15.963 -3.490 1.00 0.00 C ATOM 293 CG ASN A 369 6.185 -15.079 -4.535 1.00 0.00 C ATOM 294 OD1 ASN A 369 7.411 -15.034 -4.648 1.00 0.00 O ATOM 295 ND2 ASN A 369 5.368 -14.370 -5.305 1.00 0.00 N ATOM 0 H ASN A 369 4.773 -13.616 -3.118 1.00 0.00 H new ATOM 0 HA ASN A 369 4.936 -15.943 -1.425 1.00 0.00 H new ATOM 0 HB2 ASN A 369 6.074 -16.907 -3.427 1.00 0.00 H new ATOM 0 HB3 ASN A 369 4.515 -16.200 -3.803 1.00 0.00 H new ATOM 0 HD21 ASN A 369 5.750 -13.757 -6.025 1.00 0.00 H new ATOM 0 HD22 ASN A 369 4.358 -14.438 -5.176 1.00 0.00 H new ATOM 302 N ASP A 370 7.639 -16.263 -1.492 1.00 0.00 N ATOM 303 CA ASP A 370 9.010 -16.251 -0.996 1.00 0.00 C ATOM 304 C ASP A 370 9.998 -16.024 -2.137 1.00 0.00 C ATOM 305 O ASP A 370 11.212 -16.045 -1.935 1.00 0.00 O ATOM 306 CB ASP A 370 9.330 -17.564 -0.283 1.00 0.00 C ATOM 307 CG ASP A 370 8.646 -18.754 -0.927 1.00 0.00 C ATOM 308 OD1 ASP A 370 8.768 -18.914 -2.159 1.00 0.00 O ATOM 309 OD2 ASP A 370 7.988 -19.526 -0.198 1.00 0.00 O ATOM 0 H ASP A 370 7.297 -17.185 -1.764 1.00 0.00 H new ATOM 0 HA ASP A 370 9.106 -15.429 -0.286 1.00 0.00 H new ATOM 0 HB2 ASP A 370 10.408 -17.723 -0.287 1.00 0.00 H new ATOM 0 HB3 ASP A 370 9.022 -17.492 0.760 1.00 0.00 H new ATOM 314 N SER A 371 9.467 -15.808 -3.337 1.00 0.00 N ATOM 315 CA SER A 371 10.302 -15.583 -4.512 1.00 0.00 C ATOM 316 C SER A 371 10.037 -14.205 -5.111 1.00 0.00 C ATOM 317 O SER A 371 10.412 -13.927 -6.250 1.00 0.00 O ATOM 318 CB SER A 371 10.045 -16.666 -5.562 1.00 0.00 C ATOM 319 OG SER A 371 11.155 -16.806 -6.432 1.00 0.00 O ATOM 0 H SER A 371 8.464 -15.784 -3.521 1.00 0.00 H new ATOM 0 HA SER A 371 11.345 -15.630 -4.200 1.00 0.00 H new ATOM 0 HB2 SER A 371 9.844 -17.616 -5.067 1.00 0.00 H new ATOM 0 HB3 SER A 371 9.156 -16.413 -6.140 1.00 0.00 H new ATOM 0 HG SER A 371 11.428 -15.923 -6.759 1.00 0.00 H new ATOM 325 N VAL A 372 9.386 -13.344 -4.334 1.00 0.00 N ATOM 326 CA VAL A 372 9.070 -11.995 -4.786 1.00 0.00 C ATOM 327 C VAL A 372 10.298 -11.094 -4.725 1.00 0.00 C ATOM 328 O VAL A 372 11.048 -11.112 -3.749 1.00 0.00 O ATOM 329 CB VAL A 372 7.945 -11.369 -3.939 1.00 0.00 C ATOM 330 CG1 VAL A 372 8.448 -11.039 -2.542 1.00 0.00 C ATOM 331 CG2 VAL A 372 7.392 -10.127 -4.623 1.00 0.00 C ATOM 0 H VAL A 372 9.068 -13.558 -3.389 1.00 0.00 H new ATOM 0 HA VAL A 372 8.734 -12.077 -5.820 1.00 0.00 H new ATOM 0 HB VAL A 372 7.137 -12.095 -3.846 1.00 0.00 H new ATOM 0 HG11 VAL A 372 7.640 -10.598 -1.959 1.00 0.00 H new ATOM 0 HG12 VAL A 372 8.791 -11.951 -2.054 1.00 0.00 H new ATOM 0 HG13 VAL A 372 9.274 -10.331 -2.610 1.00 0.00 H new ATOM 0 HG21 VAL A 372 6.599 -9.698 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 372 8.190 -9.395 -4.749 1.00 0.00 H new ATOM 0 HG23 VAL A 372 6.991 -10.398 -5.600 1.00 0.00 H new ATOM 341 N THR A 373 10.497 -10.304 -5.776 1.00 0.00 N ATOM 342 CA THR A 373 11.635 -9.395 -5.844 1.00 0.00 C ATOM 343 C THR A 373 11.176 -7.951 -6.010 1.00 0.00 C ATOM 344 O THR A 373 10.068 -7.691 -6.480 1.00 0.00 O ATOM 345 CB THR A 373 12.577 -9.760 -7.008 1.00 0.00 C ATOM 346 OG1 THR A 373 11.831 -9.867 -8.226 1.00 0.00 O ATOM 347 CG2 THR A 373 13.297 -11.071 -6.730 1.00 0.00 C ATOM 0 H THR A 373 9.885 -10.275 -6.591 1.00 0.00 H new ATOM 0 HA THR A 373 12.176 -9.495 -4.903 1.00 0.00 H new ATOM 0 HB THR A 373 13.321 -8.970 -7.107 1.00 0.00 H new ATOM 0 HG1 THR A 373 12.233 -9.289 -8.908 1.00 0.00 H new ATOM 0 HG21 THR A 373 13.956 -11.308 -7.565 1.00 0.00 H new ATOM 0 HG22 THR A 373 13.886 -10.976 -5.818 1.00 0.00 H new ATOM 0 HG23 THR A 373 12.565 -11.869 -6.607 1.00 0.00 H new ATOM 355 N LEU A 374 12.034 -7.014 -5.623 1.00 0.00 N ATOM 356 CA LEU A 374 11.717 -5.595 -5.729 1.00 0.00 C ATOM 357 C LEU A 374 11.298 -5.236 -7.152 1.00 0.00 C ATOM 358 O LEU A 374 10.149 -4.868 -7.397 1.00 0.00 O ATOM 359 CB LEU A 374 12.922 -4.749 -5.312 1.00 0.00 C ATOM 360 CG LEU A 374 12.843 -3.258 -5.641 1.00 0.00 C ATOM 361 CD1 LEU A 374 11.833 -2.566 -4.740 1.00 0.00 C ATOM 362 CD2 LEU A 374 14.213 -2.610 -5.508 1.00 0.00 C ATOM 0 H LEU A 374 12.955 -7.212 -5.233 1.00 0.00 H new ATOM 0 HA LEU A 374 10.884 -5.384 -5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 374 13.061 -4.856 -4.236 1.00 0.00 H new ATOM 0 HB3 LEU A 374 13.811 -5.159 -5.790 1.00 0.00 H new ATOM 0 HG LEU A 374 12.511 -3.150 -6.674 1.00 0.00 H new ATOM 0 HD11 LEU A 374 11.790 -1.506 -4.989 1.00 0.00 H new ATOM 0 HD12 LEU A 374 10.849 -3.013 -4.886 1.00 0.00 H new ATOM 0 HD13 LEU A 374 12.134 -2.683 -3.699 1.00 0.00 H new ATOM 0 HD21 LEU A 374 14.138 -1.549 -5.746 1.00 0.00 H new ATOM 0 HD22 LEU A 374 14.574 -2.728 -4.486 1.00 0.00 H new ATOM 0 HD23 LEU A 374 14.910 -3.088 -6.197 1.00 0.00 H new ATOM 374 N ASP A 375 12.237 -5.347 -8.085 1.00 0.00 N ATOM 375 CA ASP A 375 11.965 -5.037 -9.483 1.00 0.00 C ATOM 376 C ASP A 375 10.645 -5.658 -9.931 1.00 0.00 C ATOM 377 O ASP A 375 9.938 -5.100 -10.770 1.00 0.00 O ATOM 378 CB ASP A 375 13.106 -5.538 -10.371 1.00 0.00 C ATOM 379 CG ASP A 375 13.088 -4.908 -11.748 1.00 0.00 C ATOM 380 OD1 ASP A 375 13.405 -3.705 -11.855 1.00 0.00 O ATOM 381 OD2 ASP A 375 12.756 -5.617 -12.723 1.00 0.00 O ATOM 0 H ASP A 375 13.193 -5.649 -7.898 1.00 0.00 H new ATOM 0 HA ASP A 375 11.888 -3.954 -9.580 1.00 0.00 H new ATOM 0 HB2 ASP A 375 14.059 -5.322 -9.889 1.00 0.00 H new ATOM 0 HB3 ASP A 375 13.037 -6.621 -10.470 1.00 0.00 H new ATOM 386 N ASP A 376 10.321 -6.815 -9.365 1.00 0.00 N ATOM 387 CA ASP A 376 9.086 -7.513 -9.705 1.00 0.00 C ATOM 388 C ASP A 376 7.877 -6.804 -9.102 1.00 0.00 C ATOM 389 O ASP A 376 6.788 -6.813 -9.677 1.00 0.00 O ATOM 390 CB ASP A 376 9.141 -8.960 -9.216 1.00 0.00 C ATOM 391 CG ASP A 376 9.893 -9.867 -10.171 1.00 0.00 C ATOM 392 OD1 ASP A 376 11.000 -9.484 -10.604 1.00 0.00 O ATOM 393 OD2 ASP A 376 9.375 -10.958 -10.484 1.00 0.00 O ATOM 0 H ASP A 376 10.896 -7.290 -8.669 1.00 0.00 H new ATOM 0 HA ASP A 376 8.983 -7.509 -10.790 1.00 0.00 H new ATOM 0 HB2 ASP A 376 9.620 -8.991 -8.237 1.00 0.00 H new ATOM 0 HB3 ASP A 376 8.126 -9.335 -9.087 1.00 0.00 H new ATOM 398 N LEU A 377 8.077 -6.192 -7.940 1.00 0.00 N ATOM 399 CA LEU A 377 7.003 -5.478 -7.257 1.00 0.00 C ATOM 400 C LEU A 377 6.839 -4.072 -7.822 1.00 0.00 C ATOM 401 O LEU A 377 5.736 -3.525 -7.841 1.00 0.00 O ATOM 402 CB LEU A 377 7.286 -5.408 -5.755 1.00 0.00 C ATOM 403 CG LEU A 377 7.043 -6.694 -4.965 1.00 0.00 C ATOM 404 CD1 LEU A 377 7.292 -6.465 -3.482 1.00 0.00 C ATOM 405 CD2 LEU A 377 5.627 -7.202 -5.197 1.00 0.00 C ATOM 0 H LEU A 377 8.972 -6.176 -7.451 1.00 0.00 H new ATOM 0 HA LEU A 377 6.074 -6.025 -7.420 1.00 0.00 H new ATOM 0 HB2 LEU A 377 8.325 -5.110 -5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 377 6.668 -4.619 -5.326 1.00 0.00 H new ATOM 0 HG LEU A 377 7.743 -7.452 -5.317 1.00 0.00 H new ATOM 0 HD11 LEU A 377 7.114 -7.391 -2.936 1.00 0.00 H new ATOM 0 HD12 LEU A 377 8.324 -6.147 -3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 377 6.617 -5.692 -3.115 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.471 -8.118 -4.627 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.912 -6.446 -4.872 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.483 -7.406 -6.258 1.00 0.00 H new ATOM 417 N ALA A 378 7.942 -3.491 -8.283 1.00 0.00 N ATOM 418 CA ALA A 378 7.920 -2.150 -8.853 1.00 0.00 C ATOM 419 C ALA A 378 7.222 -2.141 -10.209 1.00 0.00 C ATOM 420 O ALA A 378 6.401 -1.268 -10.489 1.00 0.00 O ATOM 421 CB ALA A 378 9.335 -1.607 -8.981 1.00 0.00 C ATOM 0 H ALA A 378 8.863 -3.929 -8.273 1.00 0.00 H new ATOM 0 HA ALA A 378 7.356 -1.505 -8.179 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.303 -0.605 -9.408 1.00 0.00 H new ATOM 0 HB2 ALA A 378 9.800 -1.567 -7.996 1.00 0.00 H new ATOM 0 HB3 ALA A 378 9.918 -2.260 -9.631 1.00 0.00 H new ATOM 427 N ASP A 379 7.555 -3.118 -11.046 1.00 0.00 N ATOM 428 CA ASP A 379 6.960 -3.222 -12.374 1.00 0.00 C ATOM 429 C ASP A 379 5.510 -3.685 -12.284 1.00 0.00 C ATOM 430 O ASP A 379 4.734 -3.516 -13.226 1.00 0.00 O ATOM 431 CB ASP A 379 7.765 -4.191 -13.241 1.00 0.00 C ATOM 432 CG ASP A 379 7.480 -4.017 -14.720 1.00 0.00 C ATOM 433 OD1 ASP A 379 6.437 -3.420 -15.057 1.00 0.00 O ATOM 434 OD2 ASP A 379 8.300 -4.479 -15.541 1.00 0.00 O ATOM 0 H ASP A 379 8.233 -3.848 -10.829 1.00 0.00 H new ATOM 0 HA ASP A 379 6.979 -2.234 -12.833 1.00 0.00 H new ATOM 0 HB2 ASP A 379 8.829 -4.039 -13.059 1.00 0.00 H new ATOM 0 HB3 ASP A 379 7.534 -5.215 -12.947 1.00 0.00 H new ATOM 439 N PHE A 380 5.150 -4.270 -11.147 1.00 0.00 N ATOM 440 CA PHE A 380 3.793 -4.760 -10.935 1.00 0.00 C ATOM 441 C PHE A 380 2.929 -3.697 -10.263 1.00 0.00 C ATOM 442 O PHE A 380 1.768 -3.504 -10.624 1.00 0.00 O ATOM 443 CB PHE A 380 3.813 -6.030 -10.081 1.00 0.00 C ATOM 444 CG PHE A 380 2.448 -6.490 -9.658 1.00 0.00 C ATOM 445 CD1 PHE A 380 1.544 -6.973 -10.590 1.00 0.00 C ATOM 446 CD2 PHE A 380 2.068 -6.439 -8.326 1.00 0.00 C ATOM 447 CE1 PHE A 380 0.287 -7.397 -10.203 1.00 0.00 C ATOM 448 CE2 PHE A 380 0.812 -6.861 -7.933 1.00 0.00 C ATOM 449 CZ PHE A 380 -0.080 -7.340 -8.872 1.00 0.00 C ATOM 0 H PHE A 380 5.779 -4.417 -10.358 1.00 0.00 H new ATOM 0 HA PHE A 380 3.362 -4.992 -11.909 1.00 0.00 H new ATOM 0 HB2 PHE A 380 4.299 -6.828 -10.643 1.00 0.00 H new ATOM 0 HB3 PHE A 380 4.419 -5.851 -9.193 1.00 0.00 H new ATOM 0 HD1 PHE A 380 1.825 -7.019 -11.632 1.00 0.00 H new ATOM 0 HD2 PHE A 380 2.761 -6.065 -7.587 1.00 0.00 H new ATOM 0 HE1 PHE A 380 -0.408 -7.772 -10.940 1.00 0.00 H new ATOM 0 HE2 PHE A 380 0.528 -6.816 -6.892 1.00 0.00 H new ATOM 0 HZ PHE A 380 -1.062 -7.669 -8.567 1.00 0.00 H new ATOM 459 N PHE A 381 3.505 -3.008 -9.282 1.00 0.00 N ATOM 460 CA PHE A 381 2.789 -1.965 -8.558 1.00 0.00 C ATOM 461 C PHE A 381 2.630 -0.716 -9.420 1.00 0.00 C ATOM 462 O PHE A 381 1.713 0.081 -9.218 1.00 0.00 O ATOM 463 CB PHE A 381 3.525 -1.615 -7.264 1.00 0.00 C ATOM 464 CG PHE A 381 3.264 -2.583 -6.145 1.00 0.00 C ATOM 465 CD1 PHE A 381 1.968 -2.890 -5.766 1.00 0.00 C ATOM 466 CD2 PHE A 381 4.315 -3.185 -5.472 1.00 0.00 C ATOM 467 CE1 PHE A 381 1.723 -3.780 -4.736 1.00 0.00 C ATOM 468 CE2 PHE A 381 4.077 -4.076 -4.443 1.00 0.00 C ATOM 469 CZ PHE A 381 2.780 -4.373 -4.073 1.00 0.00 C ATOM 0 H PHE A 381 4.465 -3.154 -8.971 1.00 0.00 H new ATOM 0 HA PHE A 381 1.797 -2.344 -8.312 1.00 0.00 H new ATOM 0 HB2 PHE A 381 4.596 -1.582 -7.462 1.00 0.00 H new ATOM 0 HB3 PHE A 381 3.229 -0.616 -6.946 1.00 0.00 H new ATOM 0 HD1 PHE A 381 1.138 -2.429 -6.281 1.00 0.00 H new ATOM 0 HD2 PHE A 381 5.332 -2.955 -5.755 1.00 0.00 H new ATOM 0 HE1 PHE A 381 0.707 -4.011 -4.451 1.00 0.00 H new ATOM 0 HE2 PHE A 381 4.905 -4.540 -3.928 1.00 0.00 H new ATOM 0 HZ PHE A 381 2.593 -5.067 -3.267 1.00 0.00 H new ATOM 479 N LYS A 382 3.532 -0.549 -10.382 1.00 0.00 N ATOM 480 CA LYS A 382 3.493 0.601 -11.276 1.00 0.00 C ATOM 481 C LYS A 382 2.266 0.549 -12.179 1.00 0.00 C ATOM 482 O LYS A 382 1.984 1.494 -12.915 1.00 0.00 O ATOM 483 CB LYS A 382 4.764 0.653 -12.128 1.00 0.00 C ATOM 484 CG LYS A 382 4.829 -0.431 -13.188 1.00 0.00 C ATOM 485 CD LYS A 382 5.788 -0.061 -14.308 1.00 0.00 C ATOM 486 CE LYS A 382 7.148 0.348 -13.763 1.00 0.00 C ATOM 487 NZ LYS A 382 8.241 0.075 -14.736 1.00 0.00 N ATOM 0 H LYS A 382 4.299 -1.197 -10.562 1.00 0.00 H new ATOM 0 HA LYS A 382 3.434 1.502 -10.665 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.827 1.627 -12.612 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.633 0.564 -11.476 1.00 0.00 H new ATOM 0 HG2 LYS A 382 5.146 -1.369 -12.732 1.00 0.00 H new ATOM 0 HG3 LYS A 382 3.834 -0.598 -13.600 1.00 0.00 H new ATOM 0 HD2 LYS A 382 5.905 -0.909 -14.983 1.00 0.00 H new ATOM 0 HD3 LYS A 382 5.368 0.757 -14.893 1.00 0.00 H new ATOM 0 HE2 LYS A 382 7.137 1.410 -13.518 1.00 0.00 H new ATOM 0 HE3 LYS A 382 7.344 -0.190 -12.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 9.151 0.368 -14.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 8.269 -0.942 -14.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 8.068 0.609 -15.612 1.00 0.00 H new ATOM 501 N GLN A 383 1.536 -0.561 -12.114 1.00 0.00 N ATOM 502 CA GLN A 383 0.337 -0.735 -12.926 1.00 0.00 C ATOM 503 C GLN A 383 -0.652 0.401 -12.686 1.00 0.00 C ATOM 504 O GLN A 383 -1.006 1.135 -13.608 1.00 0.00 O ATOM 505 CB GLN A 383 -0.324 -2.078 -12.615 1.00 0.00 C ATOM 506 CG GLN A 383 0.257 -3.239 -13.407 1.00 0.00 C ATOM 507 CD GLN A 383 -0.706 -4.405 -13.522 1.00 0.00 C ATOM 508 OE1 GLN A 383 -1.880 -4.292 -13.172 1.00 0.00 O ATOM 509 NE2 GLN A 383 -0.212 -5.534 -14.018 1.00 0.00 N ATOM 0 H GLN A 383 1.754 -1.352 -11.508 1.00 0.00 H new ATOM 0 HA GLN A 383 0.633 -0.719 -13.975 1.00 0.00 H new ATOM 0 HB2 GLN A 383 -0.220 -2.287 -11.550 1.00 0.00 H new ATOM 0 HB3 GLN A 383 -1.392 -2.005 -12.823 1.00 0.00 H new ATOM 0 HG2 GLN A 383 0.526 -2.895 -14.406 1.00 0.00 H new ATOM 0 HG3 GLN A 383 1.176 -3.577 -12.928 1.00 0.00 H new ATOM 0 HE21 GLN A 383 0.768 -5.583 -14.296 1.00 0.00 H new ATOM 0 HE22 GLN A 383 -0.813 -6.352 -14.121 1.00 0.00 H new ATOM 518 N CYS A 384 -1.095 0.538 -11.441 1.00 0.00 N ATOM 519 CA CYS A 384 -2.046 1.584 -11.079 1.00 0.00 C ATOM 520 C CYS A 384 -1.588 2.941 -11.603 1.00 0.00 C ATOM 521 O CYS A 384 -2.245 3.545 -12.450 1.00 0.00 O ATOM 522 CB CYS A 384 -2.217 1.642 -9.560 1.00 0.00 C ATOM 523 SG CYS A 384 -3.238 3.020 -8.985 1.00 0.00 S ATOM 0 H CYS A 384 -0.811 -0.061 -10.666 1.00 0.00 H new ATOM 0 HA CYS A 384 -3.005 1.343 -11.537 1.00 0.00 H new ATOM 0 HB2 CYS A 384 -2.662 0.707 -9.219 1.00 0.00 H new ATOM 0 HB3 CYS A 384 -1.233 1.715 -9.097 1.00 0.00 H new ATOM 0 HG CYS A 384 -2.490 3.886 -8.369 1.00 0.00 H new ATOM 529 N GLY A 385 -0.455 3.415 -11.092 1.00 0.00 N ATOM 530 CA GLY A 385 0.071 4.699 -11.521 1.00 0.00 C ATOM 531 C GLY A 385 1.585 4.712 -11.585 1.00 0.00 C ATOM 532 O GLY A 385 2.191 3.906 -12.291 1.00 0.00 O ATOM 0 H GLY A 385 0.107 2.934 -10.390 1.00 0.00 H new ATOM 0 HA2 GLY A 385 -0.333 4.944 -12.503 1.00 0.00 H new ATOM 0 HA3 GLY A 385 -0.267 5.475 -10.834 1.00 0.00 H new ATOM 536 N VAL A 386 2.200 5.631 -10.848 1.00 0.00 N ATOM 537 CA VAL A 386 3.653 5.747 -10.825 1.00 0.00 C ATOM 538 C VAL A 386 4.195 5.588 -9.408 1.00 0.00 C ATOM 539 O VAL A 386 3.826 6.337 -8.504 1.00 0.00 O ATOM 540 CB VAL A 386 4.118 7.101 -11.392 1.00 0.00 C ATOM 541 CG1 VAL A 386 5.618 7.269 -11.213 1.00 0.00 C ATOM 542 CG2 VAL A 386 3.730 7.226 -12.858 1.00 0.00 C ATOM 0 H VAL A 386 1.714 6.307 -10.258 1.00 0.00 H new ATOM 0 HA VAL A 386 4.044 4.946 -11.453 1.00 0.00 H new ATOM 0 HB VAL A 386 3.620 7.897 -10.839 1.00 0.00 H new ATOM 0 HG11 VAL A 386 5.927 8.232 -11.620 1.00 0.00 H new ATOM 0 HG12 VAL A 386 5.865 7.227 -10.152 1.00 0.00 H new ATOM 0 HG13 VAL A 386 6.139 6.469 -11.739 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.066 8.189 -13.243 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.199 6.424 -13.428 1.00 0.00 H new ATOM 0 HG23 VAL A 386 2.647 7.155 -12.955 1.00 0.00 H new ATOM 552 N VAL A 387 5.074 4.609 -9.224 1.00 0.00 N ATOM 553 CA VAL A 387 5.670 4.354 -7.918 1.00 0.00 C ATOM 554 C VAL A 387 6.769 5.362 -7.607 1.00 0.00 C ATOM 555 O VAL A 387 7.686 5.564 -8.404 1.00 0.00 O ATOM 556 CB VAL A 387 6.255 2.932 -7.836 1.00 0.00 C ATOM 557 CG1 VAL A 387 6.892 2.692 -6.476 1.00 0.00 C ATOM 558 CG2 VAL A 387 5.177 1.895 -8.118 1.00 0.00 C ATOM 0 H VAL A 387 5.389 3.980 -9.962 1.00 0.00 H new ATOM 0 HA VAL A 387 4.872 4.454 -7.182 1.00 0.00 H new ATOM 0 HB VAL A 387 7.030 2.834 -8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 387 7.299 1.682 -6.438 1.00 0.00 H new ATOM 0 HG12 VAL A 387 7.694 3.413 -6.318 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.140 2.809 -5.696 1.00 0.00 H new ATOM 0 HG21 VAL A 387 5.608 0.896 -8.056 1.00 0.00 H new ATOM 0 HG22 VAL A 387 4.378 1.992 -7.383 1.00 0.00 H new ATOM 0 HG23 VAL A 387 4.772 2.054 -9.117 1.00 0.00 H new ATOM 568 N LYS A 388 6.673 5.995 -6.443 1.00 0.00 N ATOM 569 CA LYS A 388 7.661 6.983 -6.025 1.00 0.00 C ATOM 570 C LYS A 388 9.078 6.471 -6.263 1.00 0.00 C ATOM 571 O LYS A 388 9.580 5.636 -5.513 1.00 0.00 O ATOM 572 CB LYS A 388 7.473 7.326 -4.544 1.00 0.00 C ATOM 573 CG LYS A 388 8.328 8.492 -4.078 1.00 0.00 C ATOM 574 CD LYS A 388 7.592 9.814 -4.220 1.00 0.00 C ATOM 575 CE LYS A 388 8.446 10.981 -3.748 1.00 0.00 C ATOM 576 NZ LYS A 388 7.697 12.268 -3.788 1.00 0.00 N ATOM 0 H LYS A 388 5.921 5.841 -5.772 1.00 0.00 H new ATOM 0 HA LYS A 388 7.514 7.883 -6.623 1.00 0.00 H new ATOM 0 HB2 LYS A 388 6.424 7.561 -4.364 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.711 6.448 -3.943 1.00 0.00 H new ATOM 0 HG2 LYS A 388 8.612 8.343 -3.036 1.00 0.00 H new ATOM 0 HG3 LYS A 388 9.250 8.523 -4.659 1.00 0.00 H new ATOM 0 HD2 LYS A 388 7.311 9.965 -5.262 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.668 9.781 -3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 388 8.789 10.792 -2.731 1.00 0.00 H new ATOM 0 HE3 LYS A 388 9.334 11.058 -4.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 8.313 13.039 -3.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 7.391 12.461 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 6.863 12.204 -3.170 1.00 0.00 H new ATOM 590 N MET A 389 9.716 6.979 -7.312 1.00 0.00 N ATOM 591 CA MET A 389 11.077 6.574 -7.648 1.00 0.00 C ATOM 592 C MET A 389 12.080 7.646 -7.233 1.00 0.00 C ATOM 593 O MET A 389 11.947 8.810 -7.606 1.00 0.00 O ATOM 594 CB MET A 389 11.195 6.302 -9.148 1.00 0.00 C ATOM 595 CG MET A 389 10.621 4.958 -9.569 1.00 0.00 C ATOM 596 SD MET A 389 11.634 3.569 -9.026 1.00 0.00 S ATOM 597 CE MET A 389 13.147 3.877 -9.934 1.00 0.00 C ATOM 0 H MET A 389 9.313 7.671 -7.944 1.00 0.00 H new ATOM 0 HA MET A 389 11.303 5.658 -7.102 1.00 0.00 H new ATOM 0 HB2 MET A 389 10.682 7.094 -9.694 1.00 0.00 H new ATOM 0 HB3 MET A 389 12.246 6.345 -9.435 1.00 0.00 H new ATOM 0 HG2 MET A 389 9.616 4.852 -9.159 1.00 0.00 H new ATOM 0 HG3 MET A 389 10.527 4.932 -10.655 1.00 0.00 H new ATOM 0 HE1 MET A 389 13.835 3.045 -9.787 1.00 0.00 H new ATOM 0 HE2 MET A 389 12.920 3.977 -10.995 1.00 0.00 H new ATOM 0 HE3 MET A 389 13.607 4.797 -9.573 1.00 0.00 H new ATOM 607 N ASN A 390 13.083 7.243 -6.459 1.00 0.00 N ATOM 608 CA ASN A 390 14.109 8.169 -5.994 1.00 0.00 C ATOM 609 C ASN A 390 14.700 8.957 -7.159 1.00 0.00 C ATOM 610 O ASN A 390 14.830 8.441 -8.270 1.00 0.00 O ATOM 611 CB ASN A 390 15.217 7.410 -5.263 1.00 0.00 C ATOM 612 CG ASN A 390 15.997 8.298 -4.313 1.00 0.00 C ATOM 613 OD1 ASN A 390 16.343 9.432 -4.648 1.00 0.00 O ATOM 614 ND2 ASN A 390 16.278 7.786 -3.121 1.00 0.00 N ATOM 0 H ASN A 390 13.207 6.282 -6.141 1.00 0.00 H new ATOM 0 HA ASN A 390 13.642 8.871 -5.303 1.00 0.00 H new ATOM 0 HB2 ASN A 390 14.779 6.582 -4.705 1.00 0.00 H new ATOM 0 HB3 ASN A 390 15.900 6.976 -5.994 1.00 0.00 H new ATOM 0 HD21 ASN A 390 16.801 8.337 -2.440 1.00 0.00 H new ATOM 0 HD22 ASN A 390 15.971 6.842 -2.886 1.00 0.00 H new ATOM 621 N LYS A 391 15.056 10.210 -6.899 1.00 0.00 N ATOM 622 CA LYS A 391 15.636 11.070 -7.924 1.00 0.00 C ATOM 623 C LYS A 391 17.160 11.032 -7.869 1.00 0.00 C ATOM 624 O LYS A 391 17.834 11.361 -8.846 1.00 0.00 O ATOM 625 CB LYS A 391 15.144 12.509 -7.749 1.00 0.00 C ATOM 626 CG LYS A 391 15.668 13.182 -6.492 1.00 0.00 C ATOM 627 CD LYS A 391 15.706 14.693 -6.642 1.00 0.00 C ATOM 628 CE LYS A 391 16.890 15.139 -7.487 1.00 0.00 C ATOM 629 NZ LYS A 391 18.146 15.206 -6.689 1.00 0.00 N ATOM 0 H LYS A 391 14.953 10.653 -5.986 1.00 0.00 H new ATOM 0 HA LYS A 391 15.317 10.699 -8.898 1.00 0.00 H new ATOM 0 HB2 LYS A 391 15.445 13.095 -8.617 1.00 0.00 H new ATOM 0 HB3 LYS A 391 14.054 12.511 -7.725 1.00 0.00 H new ATOM 0 HG2 LYS A 391 15.036 12.916 -5.645 1.00 0.00 H new ATOM 0 HG3 LYS A 391 16.669 12.812 -6.271 1.00 0.00 H new ATOM 0 HD2 LYS A 391 14.779 15.038 -7.101 1.00 0.00 H new ATOM 0 HD3 LYS A 391 15.765 15.156 -5.657 1.00 0.00 H new ATOM 0 HE2 LYS A 391 17.024 14.447 -8.318 1.00 0.00 H new ATOM 0 HE3 LYS A 391 16.681 16.118 -7.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 18.929 15.514 -7.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 18.027 15.885 -5.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 18.360 14.266 -6.299 1.00 0.00 H new ATOM 643 N ARG A 392 17.696 10.628 -6.722 1.00 0.00 N ATOM 644 CA ARG A 392 19.141 10.546 -6.541 1.00 0.00 C ATOM 645 C ARG A 392 19.637 9.121 -6.764 1.00 0.00 C ATOM 646 O ARG A 392 20.637 8.899 -7.449 1.00 0.00 O ATOM 647 CB ARG A 392 19.527 11.018 -5.138 1.00 0.00 C ATOM 648 CG ARG A 392 21.016 10.914 -4.849 1.00 0.00 C ATOM 649 CD ARG A 392 21.283 10.718 -3.365 1.00 0.00 C ATOM 650 NE ARG A 392 22.590 11.239 -2.972 1.00 0.00 N ATOM 651 CZ ARG A 392 23.169 10.964 -1.808 1.00 0.00 C ATOM 652 NH1 ARG A 392 22.562 10.177 -0.930 1.00 0.00 N ATOM 653 NH2 ARG A 392 24.360 11.474 -1.521 1.00 0.00 N ATOM 0 H ARG A 392 17.152 10.352 -5.904 1.00 0.00 H new ATOM 0 HA ARG A 392 19.612 11.196 -7.279 1.00 0.00 H new ATOM 0 HB2 ARG A 392 19.213 12.054 -5.013 1.00 0.00 H new ATOM 0 HB3 ARG A 392 18.980 10.428 -4.402 1.00 0.00 H new ATOM 0 HG2 ARG A 392 21.439 10.080 -5.409 1.00 0.00 H new ATOM 0 HG3 ARG A 392 21.519 11.818 -5.194 1.00 0.00 H new ATOM 0 HD2 ARG A 392 20.505 11.217 -2.787 1.00 0.00 H new ATOM 0 HD3 ARG A 392 21.228 9.656 -3.124 1.00 0.00 H new ATOM 0 HE ARG A 392 23.084 11.846 -3.626 1.00 0.00 H new ATOM 0 HH11 ARG A 392 21.648 9.781 -1.147 1.00 0.00 H new ATOM 0 HH12 ARG A 392 23.010 9.968 -0.038 1.00 0.00 H new ATOM 0 HH21 ARG A 392 24.832 12.078 -2.194 1.00 0.00 H new ATOM 0 HH22 ARG A 392 24.804 11.262 -0.627 1.00 0.00 H new ATOM 667 N THR A 393 18.932 8.155 -6.182 1.00 0.00 N ATOM 668 CA THR A 393 19.301 6.752 -6.316 1.00 0.00 C ATOM 669 C THR A 393 18.611 6.114 -7.516 1.00 0.00 C ATOM 670 O THR A 393 19.101 5.135 -8.078 1.00 0.00 O ATOM 671 CB THR A 393 18.943 5.954 -5.048 1.00 0.00 C ATOM 672 OG1 THR A 393 17.584 6.208 -4.677 1.00 0.00 O ATOM 673 CG2 THR A 393 19.867 6.323 -3.897 1.00 0.00 C ATOM 0 H THR A 393 18.102 8.320 -5.613 1.00 0.00 H new ATOM 0 HA THR A 393 20.381 6.722 -6.463 1.00 0.00 H new ATOM 0 HB THR A 393 19.067 4.893 -5.266 1.00 0.00 H new ATOM 0 HG1 THR A 393 17.374 5.721 -3.853 1.00 0.00 H new ATOM 0 HG21 THR A 393 19.595 5.747 -3.013 1.00 0.00 H new ATOM 0 HG22 THR A 393 20.898 6.100 -4.172 1.00 0.00 H new ATOM 0 HG23 THR A 393 19.771 7.387 -3.680 1.00 0.00 H new ATOM 681 N GLY A 394 17.470 6.676 -7.905 1.00 0.00 N ATOM 682 CA GLY A 394 16.732 6.148 -9.037 1.00 0.00 C ATOM 683 C GLY A 394 16.123 4.790 -8.751 1.00 0.00 C ATOM 684 O GLY A 394 15.952 3.975 -9.658 1.00 0.00 O ATOM 0 H GLY A 394 17.044 7.487 -7.456 1.00 0.00 H new ATOM 0 HA2 GLY A 394 15.941 6.847 -9.309 1.00 0.00 H new ATOM 0 HA3 GLY A 394 17.398 6.070 -9.896 1.00 0.00 H new ATOM 688 N GLN A 395 15.797 4.544 -7.486 1.00 0.00 N ATOM 689 CA GLN A 395 15.206 3.274 -7.082 1.00 0.00 C ATOM 690 C GLN A 395 13.810 3.482 -6.505 1.00 0.00 C ATOM 691 O GLN A 395 13.480 4.545 -5.981 1.00 0.00 O ATOM 692 CB GLN A 395 16.098 2.577 -6.053 1.00 0.00 C ATOM 693 CG GLN A 395 16.396 3.429 -4.829 1.00 0.00 C ATOM 694 CD GLN A 395 16.607 2.599 -3.578 1.00 0.00 C ATOM 695 OE1 GLN A 395 17.719 2.513 -3.057 1.00 0.00 O ATOM 696 NE2 GLN A 395 15.537 1.983 -3.089 1.00 0.00 N ATOM 0 H GLN A 395 15.932 5.208 -6.723 1.00 0.00 H new ATOM 0 HA GLN A 395 15.123 2.643 -7.967 1.00 0.00 H new ATOM 0 HB2 GLN A 395 15.616 1.653 -5.734 1.00 0.00 H new ATOM 0 HB3 GLN A 395 17.038 2.298 -6.529 1.00 0.00 H new ATOM 0 HG2 GLN A 395 17.286 4.029 -5.017 1.00 0.00 H new ATOM 0 HG3 GLN A 395 15.572 4.124 -4.665 1.00 0.00 H new ATOM 0 HE21 GLN A 395 14.634 2.082 -3.554 1.00 0.00 H new ATOM 0 HE22 GLN A 395 15.618 1.411 -2.249 1.00 0.00 H new ATOM 705 N PRO A 396 12.968 2.442 -6.603 1.00 0.00 N ATOM 706 CA PRO A 396 11.594 2.486 -6.096 1.00 0.00 C ATOM 707 C PRO A 396 11.538 2.514 -4.573 1.00 0.00 C ATOM 708 O PRO A 396 12.354 1.883 -3.901 1.00 0.00 O ATOM 709 CB PRO A 396 10.976 1.191 -6.631 1.00 0.00 C ATOM 710 CG PRO A 396 12.133 0.272 -6.823 1.00 0.00 C ATOM 711 CD PRO A 396 13.294 1.142 -7.216 1.00 0.00 C ATOM 0 HA PRO A 396 11.071 3.387 -6.415 1.00 0.00 H new ATOM 0 HB2 PRO A 396 10.254 0.777 -5.928 1.00 0.00 H new ATOM 0 HB3 PRO A 396 10.446 1.362 -7.568 1.00 0.00 H new ATOM 0 HG2 PRO A 396 12.350 -0.278 -5.907 1.00 0.00 H new ATOM 0 HG3 PRO A 396 11.920 -0.467 -7.596 1.00 0.00 H new ATOM 0 HD2 PRO A 396 14.238 0.746 -6.841 1.00 0.00 H new ATOM 0 HD3 PRO A 396 13.389 1.221 -8.299 1.00 0.00 H new ATOM 719 N MET A 397 10.570 3.247 -4.033 1.00 0.00 N ATOM 720 CA MET A 397 10.408 3.354 -2.588 1.00 0.00 C ATOM 721 C MET A 397 9.645 2.154 -2.036 1.00 0.00 C ATOM 722 O MET A 397 8.799 2.297 -1.153 1.00 0.00 O ATOM 723 CB MET A 397 9.673 4.647 -2.231 1.00 0.00 C ATOM 724 CG MET A 397 10.395 5.903 -2.690 1.00 0.00 C ATOM 725 SD MET A 397 11.539 6.540 -1.450 1.00 0.00 S ATOM 726 CE MET A 397 13.112 6.084 -2.174 1.00 0.00 C ATOM 0 H MET A 397 9.886 3.776 -4.574 1.00 0.00 H new ATOM 0 HA MET A 397 11.400 3.371 -2.136 1.00 0.00 H new ATOM 0 HB2 MET A 397 8.679 4.625 -2.678 1.00 0.00 H new ATOM 0 HB3 MET A 397 9.536 4.691 -1.151 1.00 0.00 H new ATOM 0 HG2 MET A 397 10.943 5.688 -3.607 1.00 0.00 H new ATOM 0 HG3 MET A 397 9.661 6.672 -2.930 1.00 0.00 H new ATOM 0 HE1 MET A 397 13.844 5.922 -1.382 1.00 0.00 H new ATOM 0 HE2 MET A 397 12.994 5.168 -2.752 1.00 0.00 H new ATOM 0 HE3 MET A 397 13.457 6.884 -2.829 1.00 0.00 H new ATOM 736 N ILE A 398 9.951 0.972 -2.561 1.00 0.00 N ATOM 737 CA ILE A 398 9.295 -0.252 -2.119 1.00 0.00 C ATOM 738 C ILE A 398 10.128 -0.973 -1.064 1.00 0.00 C ATOM 739 O ILE A 398 11.356 -1.016 -1.150 1.00 0.00 O ATOM 740 CB ILE A 398 9.040 -1.211 -3.297 1.00 0.00 C ATOM 741 CG1 ILE A 398 8.027 -0.601 -4.269 1.00 0.00 C ATOM 742 CG2 ILE A 398 8.549 -2.557 -2.788 1.00 0.00 C ATOM 743 CD1 ILE A 398 7.861 -1.395 -5.545 1.00 0.00 C ATOM 0 H ILE A 398 10.649 0.836 -3.293 1.00 0.00 H new ATOM 0 HA ILE A 398 8.339 0.042 -1.686 1.00 0.00 H new ATOM 0 HB ILE A 398 9.978 -1.367 -3.829 1.00 0.00 H new ATOM 0 HG12 ILE A 398 7.060 -0.522 -3.771 1.00 0.00 H new ATOM 0 HG13 ILE A 398 8.341 0.412 -4.519 1.00 0.00 H new ATOM 0 HG21 ILE A 398 8.373 -3.223 -3.633 1.00 0.00 H new ATOM 0 HG22 ILE A 398 9.301 -2.994 -2.131 1.00 0.00 H new ATOM 0 HG23 ILE A 398 7.620 -2.420 -2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 398 7.129 -0.905 -6.186 1.00 0.00 H new ATOM 0 HD12 ILE A 398 8.817 -1.453 -6.065 1.00 0.00 H new ATOM 0 HD13 ILE A 398 7.517 -2.401 -5.305 1.00 0.00 H new ATOM 755 N HIS A 399 9.452 -1.539 -0.069 1.00 0.00 N ATOM 756 CA HIS A 399 10.130 -2.260 1.001 1.00 0.00 C ATOM 757 C HIS A 399 9.633 -3.701 1.085 1.00 0.00 C ATOM 758 O HIS A 399 8.439 -3.966 0.945 1.00 0.00 O ATOM 759 CB HIS A 399 9.909 -1.555 2.340 1.00 0.00 C ATOM 760 CG HIS A 399 11.044 -1.726 3.301 1.00 0.00 C ATOM 761 ND1 HIS A 399 12.235 -1.038 3.191 1.00 0.00 N ATOM 762 CD2 HIS A 399 11.165 -2.512 4.397 1.00 0.00 C ATOM 763 CE1 HIS A 399 13.038 -1.395 4.177 1.00 0.00 C ATOM 764 NE2 HIS A 399 12.414 -2.287 4.923 1.00 0.00 N ATOM 0 H HIS A 399 8.436 -1.512 0.018 1.00 0.00 H new ATOM 0 HA HIS A 399 11.197 -2.273 0.777 1.00 0.00 H new ATOM 0 HB2 HIS A 399 9.753 -0.491 2.160 1.00 0.00 H new ATOM 0 HB3 HIS A 399 8.996 -1.938 2.797 1.00 0.00 H new ATOM 0 HD2 HIS A 399 10.419 -3.189 4.785 1.00 0.00 H new ATOM 0 HE1 HIS A 399 14.037 -1.020 4.345 1.00 0.00 H new ATOM 0 HE2 HIS A 399 12.797 -2.736 5.755 1.00 0.00 H new ATOM 772 N ILE A 400 10.558 -4.628 1.313 1.00 0.00 N ATOM 773 CA ILE A 400 10.215 -6.041 1.415 1.00 0.00 C ATOM 774 C ILE A 400 10.857 -6.675 2.644 1.00 0.00 C ATOM 775 O ILE A 400 12.006 -7.115 2.598 1.00 0.00 O ATOM 776 CB ILE A 400 10.652 -6.819 0.161 1.00 0.00 C ATOM 777 CG1 ILE A 400 9.984 -6.236 -1.086 1.00 0.00 C ATOM 778 CG2 ILE A 400 10.315 -8.295 0.308 1.00 0.00 C ATOM 779 CD1 ILE A 400 10.367 -6.948 -2.365 1.00 0.00 C ATOM 0 H ILE A 400 11.551 -4.425 1.431 1.00 0.00 H new ATOM 0 HA ILE A 400 9.130 -6.096 1.506 1.00 0.00 H new ATOM 0 HB ILE A 400 11.732 -6.723 0.050 1.00 0.00 H new ATOM 0 HG12 ILE A 400 8.902 -6.282 -0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 400 10.250 -5.183 -1.172 1.00 0.00 H new ATOM 0 HG21 ILE A 400 10.630 -8.831 -0.587 1.00 0.00 H new ATOM 0 HG22 ILE A 400 10.833 -8.702 1.176 1.00 0.00 H new ATOM 0 HG23 ILE A 400 9.239 -8.411 0.440 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.857 -6.482 -3.208 1.00 0.00 H new ATOM 0 HD12 ILE A 400 11.445 -6.880 -2.511 1.00 0.00 H new ATOM 0 HD13 ILE A 400 10.076 -7.996 -2.299 1.00 0.00 H new ATOM 791 N TYR A 401 10.108 -6.722 3.740 1.00 0.00 N ATOM 792 CA TYR A 401 10.604 -7.303 4.981 1.00 0.00 C ATOM 793 C TYR A 401 10.948 -8.778 4.793 1.00 0.00 C ATOM 794 O TYR A 401 10.145 -9.553 4.271 1.00 0.00 O ATOM 795 CB TYR A 401 9.565 -7.148 6.093 1.00 0.00 C ATOM 796 CG TYR A 401 8.917 -5.782 6.130 1.00 0.00 C ATOM 797 CD1 TYR A 401 7.859 -5.471 5.286 1.00 0.00 C ATOM 798 CD2 TYR A 401 9.365 -4.802 7.008 1.00 0.00 C ATOM 799 CE1 TYR A 401 7.264 -4.224 5.315 1.00 0.00 C ATOM 800 CE2 TYR A 401 8.775 -3.553 7.045 1.00 0.00 C ATOM 801 CZ TYR A 401 7.726 -3.269 6.196 1.00 0.00 C ATOM 802 OH TYR A 401 7.137 -2.026 6.229 1.00 0.00 O ATOM 0 H TYR A 401 9.154 -6.364 3.794 1.00 0.00 H new ATOM 0 HA TYR A 401 11.512 -6.770 5.264 1.00 0.00 H new ATOM 0 HB2 TYR A 401 8.791 -7.905 5.964 1.00 0.00 H new ATOM 0 HB3 TYR A 401 10.042 -7.341 7.054 1.00 0.00 H new ATOM 0 HD1 TYR A 401 7.495 -6.217 4.595 1.00 0.00 H new ATOM 0 HD2 TYR A 401 10.188 -5.020 7.672 1.00 0.00 H new ATOM 0 HE1 TYR A 401 6.442 -3.999 4.652 1.00 0.00 H new ATOM 0 HE2 TYR A 401 9.133 -2.803 7.735 1.00 0.00 H new ATOM 0 HH TYR A 401 7.580 -1.472 6.905 1.00 0.00 H new ATOM 812 N LEU A 402 12.145 -9.159 5.224 1.00 0.00 N ATOM 813 CA LEU A 402 12.597 -10.541 5.105 1.00 0.00 C ATOM 814 C LEU A 402 12.771 -11.176 6.481 1.00 0.00 C ATOM 815 O LEU A 402 13.311 -10.559 7.398 1.00 0.00 O ATOM 816 CB LEU A 402 13.916 -10.603 4.332 1.00 0.00 C ATOM 817 CG LEU A 402 13.951 -9.844 3.004 1.00 0.00 C ATOM 818 CD1 LEU A 402 15.351 -9.873 2.411 1.00 0.00 C ATOM 819 CD2 LEU A 402 12.943 -10.432 2.028 1.00 0.00 C ATOM 0 H LEU A 402 12.820 -8.531 5.659 1.00 0.00 H new ATOM 0 HA LEU A 402 11.837 -11.100 4.559 1.00 0.00 H new ATOM 0 HB2 LEU A 402 14.708 -10.213 4.972 1.00 0.00 H new ATOM 0 HB3 LEU A 402 14.151 -11.649 4.136 1.00 0.00 H new ATOM 0 HG LEU A 402 13.680 -8.805 3.192 1.00 0.00 H new ATOM 0 HD11 LEU A 402 15.358 -9.328 1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 402 16.050 -9.405 3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 402 15.651 -10.906 2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 402 12.981 -9.880 1.089 1.00 0.00 H new ATOM 0 HD22 LEU A 402 13.183 -11.479 1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 402 11.941 -10.359 2.451 1.00 0.00 H new ATOM 831 N ASP A 403 12.312 -12.416 6.615 1.00 0.00 N ATOM 832 CA ASP A 403 12.419 -13.139 7.878 1.00 0.00 C ATOM 833 C ASP A 403 13.873 -13.220 8.335 1.00 0.00 C ATOM 834 O ASP A 403 14.745 -13.662 7.588 1.00 0.00 O ATOM 835 CB ASP A 403 11.835 -14.544 7.737 1.00 0.00 C ATOM 836 CG ASP A 403 11.239 -15.057 9.033 1.00 0.00 C ATOM 837 OD1 ASP A 403 11.741 -14.673 10.111 1.00 0.00 O ATOM 838 OD2 ASP A 403 10.269 -15.840 8.971 1.00 0.00 O ATOM 0 H ASP A 403 11.862 -12.941 5.865 1.00 0.00 H new ATOM 0 HA ASP A 403 11.850 -12.593 8.631 1.00 0.00 H new ATOM 0 HB2 ASP A 403 11.066 -14.539 6.964 1.00 0.00 H new ATOM 0 HB3 ASP A 403 12.616 -15.227 7.405 1.00 0.00 H new ATOM 843 N LYS A 404 14.125 -12.790 9.567 1.00 0.00 N ATOM 844 CA LYS A 404 15.471 -12.815 10.125 1.00 0.00 C ATOM 845 C LYS A 404 15.890 -14.240 10.475 1.00 0.00 C ATOM 846 O LYS A 404 17.005 -14.472 10.939 1.00 0.00 O ATOM 847 CB LYS A 404 15.546 -11.930 11.371 1.00 0.00 C ATOM 848 CG LYS A 404 14.618 -12.375 12.489 1.00 0.00 C ATOM 849 CD LYS A 404 15.053 -11.812 13.831 1.00 0.00 C ATOM 850 CE LYS A 404 14.497 -10.415 14.057 1.00 0.00 C ATOM 851 NZ LYS A 404 15.390 -9.364 13.490 1.00 0.00 N ATOM 0 H LYS A 404 13.414 -12.420 10.198 1.00 0.00 H new ATOM 0 HA LYS A 404 16.156 -12.429 9.370 1.00 0.00 H new ATOM 0 HB2 LYS A 404 16.571 -11.924 11.741 1.00 0.00 H new ATOM 0 HB3 LYS A 404 15.302 -10.905 11.094 1.00 0.00 H new ATOM 0 HG2 LYS A 404 13.601 -12.051 12.270 1.00 0.00 H new ATOM 0 HG3 LYS A 404 14.602 -13.464 12.538 1.00 0.00 H new ATOM 0 HD2 LYS A 404 14.716 -12.472 14.630 1.00 0.00 H new ATOM 0 HD3 LYS A 404 16.142 -11.783 13.879 1.00 0.00 H new ATOM 0 HE2 LYS A 404 13.510 -10.338 13.600 1.00 0.00 H new ATOM 0 HE3 LYS A 404 14.368 -10.244 15.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 15.457 -8.569 14.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 16.337 -9.763 13.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 14.999 -9.027 12.587 1.00 0.00 H new ATOM 865 N GLU A 405 14.987 -15.190 10.247 1.00 0.00 N ATOM 866 CA GLU A 405 15.264 -16.592 10.539 1.00 0.00 C ATOM 867 C GLU A 405 15.836 -17.299 9.313 1.00 0.00 C ATOM 868 O GLU A 405 16.707 -18.160 9.428 1.00 0.00 O ATOM 869 CB GLU A 405 13.991 -17.300 11.003 1.00 0.00 C ATOM 870 CG GLU A 405 13.284 -16.594 12.148 1.00 0.00 C ATOM 871 CD GLU A 405 12.550 -17.555 13.062 1.00 0.00 C ATOM 872 OE1 GLU A 405 11.970 -18.536 12.551 1.00 0.00 O ATOM 873 OE2 GLU A 405 12.558 -17.328 14.290 1.00 0.00 O ATOM 0 H GLU A 405 14.059 -15.014 9.862 1.00 0.00 H new ATOM 0 HA GLU A 405 16.004 -16.632 11.338 1.00 0.00 H new ATOM 0 HB2 GLU A 405 13.305 -17.384 10.160 1.00 0.00 H new ATOM 0 HB3 GLU A 405 14.242 -18.315 11.313 1.00 0.00 H new ATOM 0 HG2 GLU A 405 14.015 -16.032 12.730 1.00 0.00 H new ATOM 0 HG3 GLU A 405 12.576 -15.872 11.742 1.00 0.00 H new ATOM 880 N THR A 406 15.337 -16.929 8.138 1.00 0.00 N ATOM 881 CA THR A 406 15.794 -17.528 6.890 1.00 0.00 C ATOM 882 C THR A 406 16.305 -16.465 5.924 1.00 0.00 C ATOM 883 O THR A 406 17.235 -16.706 5.156 1.00 0.00 O ATOM 884 CB THR A 406 14.670 -18.330 6.207 1.00 0.00 C ATOM 885 OG1 THR A 406 13.663 -17.439 5.715 1.00 0.00 O ATOM 886 CG2 THR A 406 14.048 -19.323 7.175 1.00 0.00 C ATOM 0 H THR A 406 14.616 -16.217 8.024 1.00 0.00 H new ATOM 0 HA THR A 406 16.610 -18.205 7.144 1.00 0.00 H new ATOM 0 HB THR A 406 15.103 -18.884 5.374 1.00 0.00 H new ATOM 0 HG1 THR A 406 12.805 -17.649 6.139 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.257 -19.877 6.670 1.00 0.00 H new ATOM 0 HG22 THR A 406 14.812 -20.018 7.524 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.628 -18.787 8.026 1.00 0.00 H new ATOM 894 N GLY A 407 15.690 -15.287 5.968 1.00 0.00 N ATOM 895 CA GLY A 407 16.096 -14.204 5.092 1.00 0.00 C ATOM 896 C GLY A 407 15.166 -14.036 3.907 1.00 0.00 C ATOM 897 O GLY A 407 15.355 -13.143 3.081 1.00 0.00 O ATOM 0 H GLY A 407 14.917 -15.064 6.595 1.00 0.00 H new ATOM 0 HA2 GLY A 407 16.127 -13.274 5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 407 17.108 -14.392 4.732 1.00 0.00 H new ATOM 901 N LYS A 408 14.158 -14.898 3.821 1.00 0.00 N ATOM 902 CA LYS A 408 13.194 -14.843 2.729 1.00 0.00 C ATOM 903 C LYS A 408 12.089 -13.835 3.029 1.00 0.00 C ATOM 904 O LYS A 408 11.767 -13.555 4.184 1.00 0.00 O ATOM 905 CB LYS A 408 12.585 -16.226 2.488 1.00 0.00 C ATOM 906 CG LYS A 408 11.584 -16.644 3.552 1.00 0.00 C ATOM 907 CD LYS A 408 11.304 -18.137 3.500 1.00 0.00 C ATOM 908 CE LYS A 408 10.363 -18.566 4.614 1.00 0.00 C ATOM 909 NZ LYS A 408 10.014 -20.011 4.519 1.00 0.00 N ATOM 0 H LYS A 408 13.988 -15.644 4.496 1.00 0.00 H new ATOM 0 HA LYS A 408 13.720 -14.523 1.830 1.00 0.00 H new ATOM 0 HB2 LYS A 408 12.093 -16.233 1.515 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.386 -16.964 2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 408 11.967 -16.379 4.537 1.00 0.00 H new ATOM 0 HG3 LYS A 408 10.653 -16.094 3.413 1.00 0.00 H new ATOM 0 HD2 LYS A 408 10.867 -18.393 2.535 1.00 0.00 H new ATOM 0 HD3 LYS A 408 12.241 -18.687 3.582 1.00 0.00 H new ATOM 0 HE2 LYS A 408 10.829 -18.367 5.579 1.00 0.00 H new ATOM 0 HE3 LYS A 408 9.452 -17.969 4.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 9.371 -20.265 5.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 9.547 -20.196 3.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 10.880 -20.583 4.586 1.00 0.00 H new ATOM 923 N PRO A 409 11.492 -13.276 1.966 1.00 0.00 N ATOM 924 CA PRO A 409 10.412 -12.291 2.091 1.00 0.00 C ATOM 925 C PRO A 409 9.121 -12.911 2.614 1.00 0.00 C ATOM 926 O PRO A 409 8.303 -13.412 1.842 1.00 0.00 O ATOM 927 CB PRO A 409 10.222 -11.790 0.657 1.00 0.00 C ATOM 928 CG PRO A 409 10.706 -12.907 -0.202 1.00 0.00 C ATOM 929 CD PRO A 409 11.824 -13.562 0.560 1.00 0.00 C ATOM 0 HA PRO A 409 10.658 -11.503 2.803 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.176 -11.559 0.454 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.791 -10.878 0.478 1.00 0.00 H new ATOM 0 HG2 PRO A 409 9.905 -13.617 -0.406 1.00 0.00 H new ATOM 0 HG3 PRO A 409 11.056 -12.535 -1.165 1.00 0.00 H new ATOM 0 HD2 PRO A 409 11.867 -14.634 0.367 1.00 0.00 H new ATOM 0 HD3 PRO A 409 12.794 -13.149 0.284 1.00 0.00 H new ATOM 937 N LYS A 410 8.942 -12.873 3.929 1.00 0.00 N ATOM 938 CA LYS A 410 7.749 -13.429 4.557 1.00 0.00 C ATOM 939 C LYS A 410 6.539 -13.298 3.637 1.00 0.00 C ATOM 940 O LYS A 410 5.840 -14.275 3.373 1.00 0.00 O ATOM 941 CB LYS A 410 7.471 -12.723 5.886 1.00 0.00 C ATOM 942 CG LYS A 410 7.757 -11.231 5.855 1.00 0.00 C ATOM 943 CD LYS A 410 8.070 -10.694 7.241 1.00 0.00 C ATOM 944 CE LYS A 410 6.832 -10.675 8.123 1.00 0.00 C ATOM 945 NZ LYS A 410 7.042 -9.866 9.356 1.00 0.00 N ATOM 0 H LYS A 410 9.609 -12.462 4.582 1.00 0.00 H new ATOM 0 HA LYS A 410 7.928 -14.488 4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 410 6.427 -12.879 6.159 1.00 0.00 H new ATOM 0 HB3 LYS A 410 8.077 -13.184 6.666 1.00 0.00 H new ATOM 0 HG2 LYS A 410 8.598 -11.035 5.189 1.00 0.00 H new ATOM 0 HG3 LYS A 410 6.896 -10.703 5.445 1.00 0.00 H new ATOM 0 HD2 LYS A 410 8.840 -11.310 7.706 1.00 0.00 H new ATOM 0 HD3 LYS A 410 8.475 -9.685 7.159 1.00 0.00 H new ATOM 0 HE2 LYS A 410 5.992 -10.268 7.561 1.00 0.00 H new ATOM 0 HE3 LYS A 410 6.567 -11.696 8.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 6.175 -9.878 9.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 7.828 -10.269 9.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 7.270 -8.886 9.093 1.00 0.00 H new ATOM 959 N GLY A 411 6.300 -12.084 3.150 1.00 0.00 N ATOM 960 CA GLY A 411 5.176 -11.848 2.264 1.00 0.00 C ATOM 961 C GLY A 411 4.655 -10.429 2.353 1.00 0.00 C ATOM 962 O GLY A 411 3.907 -9.979 1.485 1.00 0.00 O ATOM 0 H GLY A 411 6.865 -11.260 3.354 1.00 0.00 H new ATOM 0 HA2 GLY A 411 5.477 -12.057 1.237 1.00 0.00 H new ATOM 0 HA3 GLY A 411 4.372 -12.543 2.509 1.00 0.00 H new ATOM 966 N ASP A 412 5.048 -9.720 3.406 1.00 0.00 N ATOM 967 CA ASP A 412 4.615 -8.343 3.606 1.00 0.00 C ATOM 968 C ASP A 412 5.561 -7.369 2.910 1.00 0.00 C ATOM 969 O ASP A 412 6.746 -7.654 2.741 1.00 0.00 O ATOM 970 CB ASP A 412 4.540 -8.021 5.099 1.00 0.00 C ATOM 971 CG ASP A 412 5.898 -8.071 5.771 1.00 0.00 C ATOM 972 OD1 ASP A 412 6.860 -8.543 5.130 1.00 0.00 O ATOM 973 OD2 ASP A 412 5.999 -7.640 6.939 1.00 0.00 O ATOM 0 H ASP A 412 5.666 -10.077 4.134 1.00 0.00 H new ATOM 0 HA ASP A 412 3.623 -8.233 3.168 1.00 0.00 H new ATOM 0 HB2 ASP A 412 4.108 -7.029 5.233 1.00 0.00 H new ATOM 0 HB3 ASP A 412 3.870 -8.729 5.587 1.00 0.00 H new ATOM 978 N ALA A 413 5.029 -6.220 2.509 1.00 0.00 N ATOM 979 CA ALA A 413 5.826 -5.203 1.832 1.00 0.00 C ATOM 980 C ALA A 413 5.108 -3.859 1.823 1.00 0.00 C ATOM 981 O ALA A 413 3.943 -3.762 2.212 1.00 0.00 O ATOM 982 CB ALA A 413 6.146 -5.643 0.411 1.00 0.00 C ATOM 0 H ALA A 413 4.049 -5.969 2.641 1.00 0.00 H new ATOM 0 HA ALA A 413 6.759 -5.082 2.382 1.00 0.00 H new ATOM 0 HB1 ALA A 413 6.741 -4.875 -0.082 1.00 0.00 H new ATOM 0 HB2 ALA A 413 6.708 -6.576 0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 413 5.218 -5.794 -0.141 1.00 0.00 H new ATOM 988 N THR A 414 5.809 -2.820 1.378 1.00 0.00 N ATOM 989 CA THR A 414 5.239 -1.480 1.320 1.00 0.00 C ATOM 990 C THR A 414 5.669 -0.755 0.051 1.00 0.00 C ATOM 991 O THR A 414 6.813 -0.875 -0.388 1.00 0.00 O ATOM 992 CB THR A 414 5.654 -0.641 2.544 1.00 0.00 C ATOM 993 OG1 THR A 414 6.980 -0.991 2.953 1.00 0.00 O ATOM 994 CG2 THR A 414 4.688 -0.856 3.700 1.00 0.00 C ATOM 0 H THR A 414 6.774 -2.882 1.052 1.00 0.00 H new ATOM 0 HA THR A 414 4.155 -1.596 1.319 1.00 0.00 H new ATOM 0 HB THR A 414 5.629 0.411 2.260 1.00 0.00 H new ATOM 0 HG1 THR A 414 7.236 -0.452 3.730 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.001 -0.254 4.553 1.00 0.00 H new ATOM 0 HG22 THR A 414 3.684 -0.560 3.395 1.00 0.00 H new ATOM 0 HG23 THR A 414 4.686 -1.909 3.981 1.00 0.00 H new ATOM 1002 N VAL A 415 4.746 0.001 -0.534 1.00 0.00 N ATOM 1003 CA VAL A 415 5.031 0.749 -1.754 1.00 0.00 C ATOM 1004 C VAL A 415 4.641 2.215 -1.602 1.00 0.00 C ATOM 1005 O VAL A 415 3.462 2.545 -1.475 1.00 0.00 O ATOM 1006 CB VAL A 415 4.287 0.154 -2.964 1.00 0.00 C ATOM 1007 CG1 VAL A 415 4.605 0.940 -4.226 1.00 0.00 C ATOM 1008 CG2 VAL A 415 4.641 -1.315 -3.137 1.00 0.00 C ATOM 0 H VAL A 415 3.795 0.112 -0.184 1.00 0.00 H new ATOM 0 HA VAL A 415 6.105 0.677 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 415 3.215 0.226 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 415 4.070 0.505 -5.070 1.00 0.00 H new ATOM 0 HG12 VAL A 415 4.296 1.977 -4.096 1.00 0.00 H new ATOM 0 HG13 VAL A 415 5.677 0.902 -4.417 1.00 0.00 H new ATOM 0 HG21 VAL A 415 4.106 -1.719 -3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 415 5.714 -1.414 -3.298 1.00 0.00 H new ATOM 0 HG23 VAL A 415 4.356 -1.866 -2.241 1.00 0.00 H new ATOM 1018 N SER A 416 5.640 3.091 -1.617 1.00 0.00 N ATOM 1019 CA SER A 416 5.402 4.524 -1.479 1.00 0.00 C ATOM 1020 C SER A 416 5.129 5.163 -2.837 1.00 0.00 C ATOM 1021 O SER A 416 5.973 5.128 -3.733 1.00 0.00 O ATOM 1022 CB SER A 416 6.605 5.199 -0.816 1.00 0.00 C ATOM 1023 OG SER A 416 6.474 5.201 0.595 1.00 0.00 O ATOM 0 H SER A 416 6.622 2.835 -1.723 1.00 0.00 H new ATOM 0 HA SER A 416 4.523 4.663 -0.850 1.00 0.00 H new ATOM 0 HB2 SER A 416 7.520 4.678 -1.099 1.00 0.00 H new ATOM 0 HB3 SER A 416 6.696 6.223 -1.178 1.00 0.00 H new ATOM 0 HG SER A 416 7.256 5.636 0.995 1.00 0.00 H new ATOM 1029 N TYR A 417 3.945 5.747 -2.982 1.00 0.00 N ATOM 1030 CA TYR A 417 3.558 6.393 -4.230 1.00 0.00 C ATOM 1031 C TYR A 417 3.928 7.873 -4.216 1.00 0.00 C ATOM 1032 O TYR A 417 4.115 8.466 -3.154 1.00 0.00 O ATOM 1033 CB TYR A 417 2.056 6.234 -4.467 1.00 0.00 C ATOM 1034 CG TYR A 417 1.673 4.886 -5.036 1.00 0.00 C ATOM 1035 CD1 TYR A 417 1.925 4.575 -6.368 1.00 0.00 C ATOM 1036 CD2 TYR A 417 1.059 3.924 -4.244 1.00 0.00 C ATOM 1037 CE1 TYR A 417 1.575 3.345 -6.892 1.00 0.00 C ATOM 1038 CE2 TYR A 417 0.707 2.691 -4.759 1.00 0.00 C ATOM 1039 CZ TYR A 417 0.967 2.407 -6.084 1.00 0.00 C ATOM 1040 OH TYR A 417 0.619 1.181 -6.602 1.00 0.00 O ATOM 0 H TYR A 417 3.236 5.786 -2.250 1.00 0.00 H new ATOM 0 HA TYR A 417 4.100 5.909 -5.042 1.00 0.00 H new ATOM 0 HB2 TYR A 417 1.530 6.384 -3.524 1.00 0.00 H new ATOM 0 HB3 TYR A 417 1.719 7.016 -5.148 1.00 0.00 H new ATOM 0 HD1 TYR A 417 2.402 5.307 -7.003 1.00 0.00 H new ATOM 0 HD2 TYR A 417 0.853 4.144 -3.207 1.00 0.00 H new ATOM 0 HE1 TYR A 417 1.777 3.119 -7.929 1.00 0.00 H new ATOM 0 HE2 TYR A 417 0.231 1.954 -4.128 1.00 0.00 H new ATOM 0 HH TYR A 417 1.091 1.038 -7.449 1.00 0.00 H new ATOM 1050 N GLU A 418 4.032 8.463 -5.402 1.00 0.00 N ATOM 1051 CA GLU A 418 4.379 9.873 -5.526 1.00 0.00 C ATOM 1052 C GLU A 418 3.374 10.748 -4.781 1.00 0.00 C ATOM 1053 O GLU A 418 3.734 11.471 -3.852 1.00 0.00 O ATOM 1054 CB GLU A 418 4.432 10.280 -7.000 1.00 0.00 C ATOM 1055 CG GLU A 418 5.538 9.593 -7.782 1.00 0.00 C ATOM 1056 CD GLU A 418 6.831 10.386 -7.783 1.00 0.00 C ATOM 1057 OE1 GLU A 418 6.767 11.627 -7.911 1.00 0.00 O ATOM 1058 OE2 GLU A 418 7.907 9.765 -7.657 1.00 0.00 O ATOM 0 H GLU A 418 3.881 7.986 -6.291 1.00 0.00 H new ATOM 0 HA GLU A 418 5.363 10.020 -5.080 1.00 0.00 H new ATOM 0 HB2 GLU A 418 3.473 10.052 -7.466 1.00 0.00 H new ATOM 0 HB3 GLU A 418 4.569 11.359 -7.065 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.721 8.607 -7.355 1.00 0.00 H new ATOM 0 HG3 GLU A 418 5.210 9.439 -8.810 1.00 0.00 H new ATOM 1065 N ASP A 419 2.115 10.677 -5.196 1.00 0.00 N ATOM 1066 CA ASP A 419 1.057 11.461 -4.569 1.00 0.00 C ATOM 1067 C ASP A 419 0.058 10.555 -3.856 1.00 0.00 C ATOM 1068 O ASP A 419 -0.079 9.374 -4.171 1.00 0.00 O ATOM 1069 CB ASP A 419 0.336 12.314 -5.615 1.00 0.00 C ATOM 1070 CG ASP A 419 1.291 12.931 -6.617 1.00 0.00 C ATOM 1071 OD1 ASP A 419 2.454 13.194 -6.245 1.00 0.00 O ATOM 1072 OD2 ASP A 419 0.877 13.153 -7.774 1.00 0.00 O ATOM 0 H ASP A 419 1.801 10.084 -5.965 1.00 0.00 H new ATOM 0 HA ASP A 419 1.515 12.118 -3.830 1.00 0.00 H new ATOM 0 HB2 ASP A 419 -0.392 11.698 -6.143 1.00 0.00 H new ATOM 0 HB3 ASP A 419 -0.221 13.105 -5.113 1.00 0.00 H new ATOM 1077 N PRO A 420 -0.656 11.121 -2.872 1.00 0.00 N ATOM 1078 CA PRO A 420 -1.654 10.381 -2.093 1.00 0.00 C ATOM 1079 C PRO A 420 -2.732 9.760 -2.974 1.00 0.00 C ATOM 1080 O PRO A 420 -3.136 8.612 -2.785 1.00 0.00 O ATOM 1081 CB PRO A 420 -2.261 11.454 -1.185 1.00 0.00 C ATOM 1082 CG PRO A 420 -1.236 12.535 -1.138 1.00 0.00 C ATOM 1083 CD PRO A 420 -0.543 12.525 -2.443 1.00 0.00 C ATOM 0 HA PRO A 420 -1.211 9.545 -1.552 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -3.206 11.822 -1.584 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -2.467 11.060 -0.190 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -1.703 13.503 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -0.531 12.364 -0.325 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -1.014 13.203 -3.155 1.00 0.00 H new ATOM 0 HD3 PRO A 420 0.498 12.835 -2.349 1.00 0.00 H new ATOM 1091 N PRO A 421 -3.209 10.532 -3.962 1.00 0.00 N ATOM 1092 CA PRO A 421 -4.245 10.077 -4.893 1.00 0.00 C ATOM 1093 C PRO A 421 -3.892 8.745 -5.548 1.00 0.00 C ATOM 1094 O PRO A 421 -4.743 7.867 -5.692 1.00 0.00 O ATOM 1095 CB PRO A 421 -4.296 11.191 -5.940 1.00 0.00 C ATOM 1096 CG PRO A 421 -3.770 12.395 -5.239 1.00 0.00 C ATOM 1097 CD PRO A 421 -2.773 11.910 -4.245 1.00 0.00 C ATOM 0 HA PRO A 421 -5.196 9.903 -4.390 1.00 0.00 H new ATOM 0 HB2 PRO A 421 -3.689 10.944 -6.811 1.00 0.00 H new ATOM 0 HB3 PRO A 421 -5.313 11.353 -6.296 1.00 0.00 H new ATOM 0 HG2 PRO A 421 -3.308 13.084 -5.946 1.00 0.00 H new ATOM 0 HG3 PRO A 421 -4.576 12.938 -4.745 1.00 0.00 H new ATOM 0 HD2 PRO A 421 -1.760 11.936 -4.648 1.00 0.00 H new ATOM 0 HD3 PRO A 421 -2.774 12.524 -3.344 1.00 0.00 H new ATOM 1105 N THR A 422 -2.630 8.601 -5.942 1.00 0.00 N ATOM 1106 CA THR A 422 -2.164 7.378 -6.582 1.00 0.00 C ATOM 1107 C THR A 422 -2.180 6.207 -5.608 1.00 0.00 C ATOM 1108 O THR A 422 -2.556 5.092 -5.966 1.00 0.00 O ATOM 1109 CB THR A 422 -0.740 7.545 -7.144 1.00 0.00 C ATOM 1110 OG1 THR A 422 -0.687 8.681 -8.014 1.00 0.00 O ATOM 1111 CG2 THR A 422 -0.308 6.299 -7.902 1.00 0.00 C ATOM 0 H THR A 422 -1.913 9.317 -5.829 1.00 0.00 H new ATOM 0 HA THR A 422 -2.849 7.172 -7.404 1.00 0.00 H new ATOM 0 HB THR A 422 -0.058 7.697 -6.307 1.00 0.00 H new ATOM 0 HG1 THR A 422 0.222 8.781 -8.366 1.00 0.00 H new ATOM 0 HG21 THR A 422 0.701 6.440 -8.290 1.00 0.00 H new ATOM 0 HG22 THR A 422 -0.321 5.441 -7.230 1.00 0.00 H new ATOM 0 HG23 THR A 422 -0.993 6.121 -8.731 1.00 0.00 H new ATOM 1119 N ALA A 423 -1.768 6.467 -4.370 1.00 0.00 N ATOM 1120 CA ALA A 423 -1.737 5.435 -3.342 1.00 0.00 C ATOM 1121 C ALA A 423 -3.137 4.898 -3.062 1.00 0.00 C ATOM 1122 O ALA A 423 -3.356 3.686 -3.046 1.00 0.00 O ATOM 1123 CB ALA A 423 -1.114 5.980 -2.066 1.00 0.00 C ATOM 0 H ALA A 423 -1.451 7.384 -4.056 1.00 0.00 H new ATOM 0 HA ALA A 423 -1.126 4.610 -3.708 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -1.097 5.198 -1.307 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.095 6.309 -2.270 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.702 6.824 -1.705 1.00 0.00 H new ATOM 1129 N LYS A 424 -4.081 5.806 -2.840 1.00 0.00 N ATOM 1130 CA LYS A 424 -5.460 5.424 -2.560 1.00 0.00 C ATOM 1131 C LYS A 424 -6.050 4.629 -3.719 1.00 0.00 C ATOM 1132 O LYS A 424 -6.831 3.700 -3.514 1.00 0.00 O ATOM 1133 CB LYS A 424 -6.311 6.668 -2.296 1.00 0.00 C ATOM 1134 CG LYS A 424 -5.796 7.526 -1.154 1.00 0.00 C ATOM 1135 CD LYS A 424 -6.411 8.915 -1.179 1.00 0.00 C ATOM 1136 CE LYS A 424 -7.778 8.932 -0.513 1.00 0.00 C ATOM 1137 NZ LYS A 424 -8.372 10.297 -0.499 1.00 0.00 N ATOM 0 H LYS A 424 -3.916 6.813 -2.849 1.00 0.00 H new ATOM 0 HA LYS A 424 -5.463 4.793 -1.671 1.00 0.00 H new ATOM 0 HB2 LYS A 424 -6.350 7.271 -3.203 1.00 0.00 H new ATOM 0 HB3 LYS A 424 -7.333 6.359 -2.075 1.00 0.00 H new ATOM 0 HG2 LYS A 424 -6.024 7.043 -0.204 1.00 0.00 H new ATOM 0 HG3 LYS A 424 -4.711 7.606 -1.219 1.00 0.00 H new ATOM 0 HD2 LYS A 424 -5.749 9.616 -0.671 1.00 0.00 H new ATOM 0 HD3 LYS A 424 -6.504 9.254 -2.211 1.00 0.00 H new ATOM 0 HE2 LYS A 424 -8.447 8.251 -1.039 1.00 0.00 H new ATOM 0 HE3 LYS A 424 -7.688 8.565 0.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 -9.303 10.266 -0.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 -7.747 10.942 0.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 -8.482 10.638 -1.475 1.00 0.00 H new ATOM 1151 N ALA A 425 -5.671 4.997 -4.939 1.00 0.00 N ATOM 1152 CA ALA A 425 -6.159 4.316 -6.131 1.00 0.00 C ATOM 1153 C ALA A 425 -5.456 2.976 -6.325 1.00 0.00 C ATOM 1154 O ALA A 425 -6.049 2.020 -6.823 1.00 0.00 O ATOM 1155 CB ALA A 425 -5.969 5.196 -7.357 1.00 0.00 C ATOM 0 H ALA A 425 -5.026 5.765 -5.127 1.00 0.00 H new ATOM 0 HA ALA A 425 -7.223 4.122 -5.998 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -6.338 4.674 -8.240 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -6.523 6.126 -7.227 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -4.910 5.419 -7.484 1.00 0.00 H new ATOM 1161 N ALA A 426 -4.189 2.916 -5.927 1.00 0.00 N ATOM 1162 CA ALA A 426 -3.406 1.693 -6.056 1.00 0.00 C ATOM 1163 C ALA A 426 -3.856 0.644 -5.045 1.00 0.00 C ATOM 1164 O ALA A 426 -3.816 -0.555 -5.321 1.00 0.00 O ATOM 1165 CB ALA A 426 -1.925 1.994 -5.882 1.00 0.00 C ATOM 0 H ALA A 426 -3.684 3.699 -5.513 1.00 0.00 H new ATOM 0 HA ALA A 426 -3.569 1.290 -7.056 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -1.352 1.072 -5.981 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -1.606 2.703 -6.646 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -1.754 2.423 -4.895 1.00 0.00 H new ATOM 1171 N VAL A 427 -4.285 1.102 -3.873 1.00 0.00 N ATOM 1172 CA VAL A 427 -4.744 0.202 -2.822 1.00 0.00 C ATOM 1173 C VAL A 427 -5.889 -0.677 -3.311 1.00 0.00 C ATOM 1174 O VAL A 427 -5.771 -1.901 -3.353 1.00 0.00 O ATOM 1175 CB VAL A 427 -5.205 0.984 -1.577 1.00 0.00 C ATOM 1176 CG1 VAL A 427 -5.734 0.032 -0.515 1.00 0.00 C ATOM 1177 CG2 VAL A 427 -4.067 1.830 -1.027 1.00 0.00 C ATOM 0 H VAL A 427 -4.324 2.091 -3.628 1.00 0.00 H new ATOM 0 HA VAL A 427 -3.897 -0.429 -2.553 1.00 0.00 H new ATOM 0 HB VAL A 427 -6.015 1.652 -1.869 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -6.055 0.602 0.357 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.580 -0.526 -0.916 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -4.946 -0.663 -0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.411 2.375 -0.148 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -3.234 1.184 -0.750 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -3.739 2.538 -1.788 1.00 0.00 H new ATOM 1187 N GLU A 428 -6.998 -0.043 -3.682 1.00 0.00 N ATOM 1188 CA GLU A 428 -8.165 -0.768 -4.169 1.00 0.00 C ATOM 1189 C GLU A 428 -7.880 -1.412 -5.521 1.00 0.00 C ATOM 1190 O GLU A 428 -8.658 -2.236 -6.004 1.00 0.00 O ATOM 1191 CB GLU A 428 -9.366 0.173 -4.282 1.00 0.00 C ATOM 1192 CG GLU A 428 -9.770 0.807 -2.961 1.00 0.00 C ATOM 1193 CD GLU A 428 -11.228 1.224 -2.935 1.00 0.00 C ATOM 1194 OE1 GLU A 428 -11.643 1.986 -3.833 1.00 0.00 O ATOM 1195 OE2 GLU A 428 -11.953 0.787 -2.017 1.00 0.00 O ATOM 0 H GLU A 428 -7.112 0.970 -3.654 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.396 -1.556 -3.453 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -9.133 0.962 -4.997 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -10.214 -0.381 -4.684 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -9.583 0.101 -2.152 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -9.143 1.679 -2.774 1.00 0.00 H new ATOM 1202 N TRP A 429 -6.761 -1.032 -6.127 1.00 0.00 N ATOM 1203 CA TRP A 429 -6.374 -1.572 -7.425 1.00 0.00 C ATOM 1204 C TRP A 429 -5.745 -2.952 -7.275 1.00 0.00 C ATOM 1205 O TRP A 429 -6.187 -3.918 -7.897 1.00 0.00 O ATOM 1206 CB TRP A 429 -5.396 -0.625 -8.123 1.00 0.00 C ATOM 1207 CG TRP A 429 -4.736 -1.232 -9.325 1.00 0.00 C ATOM 1208 CD1 TRP A 429 -3.971 -2.362 -9.358 1.00 0.00 C ATOM 1209 CD2 TRP A 429 -4.785 -0.739 -10.669 1.00 0.00 C ATOM 1210 NE1 TRP A 429 -3.540 -2.601 -10.640 1.00 0.00 N ATOM 1211 CE2 TRP A 429 -4.026 -1.620 -11.463 1.00 0.00 C ATOM 1212 CE3 TRP A 429 -5.396 0.361 -11.278 1.00 0.00 C ATOM 1213 CZ2 TRP A 429 -3.863 -1.434 -12.833 1.00 0.00 C ATOM 1214 CZ3 TRP A 429 -5.233 0.544 -12.638 1.00 0.00 C ATOM 1215 CH2 TRP A 429 -4.474 -0.350 -13.403 1.00 0.00 C ATOM 0 H TRP A 429 -6.106 -0.352 -5.740 1.00 0.00 H new ATOM 0 HA TRP A 429 -7.273 -1.668 -8.034 1.00 0.00 H new ATOM 0 HB2 TRP A 429 -5.928 0.277 -8.426 1.00 0.00 H new ATOM 0 HB3 TRP A 429 -4.629 -0.318 -7.412 1.00 0.00 H new ATOM 0 HD1 TRP A 429 -3.739 -2.978 -8.502 1.00 0.00 H new ATOM 0 HE1 TRP A 429 -2.953 -3.382 -10.932 1.00 0.00 H new ATOM 0 HE3 TRP A 429 -5.985 1.055 -10.696 1.00 0.00 H new ATOM 0 HZ2 TRP A 429 -3.276 -2.120 -13.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 429 -5.699 1.391 -13.119 1.00 0.00 H new ATOM 0 HH2 TRP A 429 -4.369 -0.181 -14.464 1.00 0.00 H new ATOM 1226 N PHE A 430 -4.710 -3.039 -6.445 1.00 0.00 N ATOM 1227 CA PHE A 430 -4.020 -4.303 -6.213 1.00 0.00 C ATOM 1228 C PHE A 430 -4.684 -5.087 -5.086 1.00 0.00 C ATOM 1229 O PHE A 430 -4.500 -6.298 -4.965 1.00 0.00 O ATOM 1230 CB PHE A 430 -2.549 -4.050 -5.876 1.00 0.00 C ATOM 1231 CG PHE A 430 -1.802 -3.323 -6.957 1.00 0.00 C ATOM 1232 CD1 PHE A 430 -1.342 -4.001 -8.075 1.00 0.00 C ATOM 1233 CD2 PHE A 430 -1.560 -1.962 -6.857 1.00 0.00 C ATOM 1234 CE1 PHE A 430 -0.655 -3.335 -9.073 1.00 0.00 C ATOM 1235 CE2 PHE A 430 -0.875 -1.292 -7.851 1.00 0.00 C ATOM 1236 CZ PHE A 430 -0.420 -1.978 -8.960 1.00 0.00 C ATOM 0 H PHE A 430 -4.331 -2.249 -5.922 1.00 0.00 H new ATOM 0 HA PHE A 430 -4.080 -4.894 -7.127 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.490 -3.472 -4.954 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -2.059 -5.005 -5.686 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.522 -5.062 -8.168 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -1.911 -1.419 -5.992 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.303 -3.875 -9.940 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -0.695 -0.231 -7.761 1.00 0.00 H new ATOM 0 HZ PHE A 430 0.118 -1.455 -9.737 1.00 0.00 H new ATOM 1246 N ASP A 431 -5.456 -4.387 -4.261 1.00 0.00 N ATOM 1247 CA ASP A 431 -6.149 -5.016 -3.143 1.00 0.00 C ATOM 1248 C ASP A 431 -6.994 -6.193 -3.620 1.00 0.00 C ATOM 1249 O ASP A 431 -8.167 -6.032 -3.956 1.00 0.00 O ATOM 1250 CB ASP A 431 -7.033 -3.996 -2.424 1.00 0.00 C ATOM 1251 CG ASP A 431 -8.181 -4.647 -1.679 1.00 0.00 C ATOM 1252 OD1 ASP A 431 -7.959 -5.709 -1.058 1.00 0.00 O ATOM 1253 OD2 ASP A 431 -9.301 -4.097 -1.716 1.00 0.00 O ATOM 0 H ASP A 431 -5.617 -3.383 -4.346 1.00 0.00 H new ATOM 0 HA ASP A 431 -5.398 -5.390 -2.446 1.00 0.00 H new ATOM 0 HB2 ASP A 431 -6.426 -3.425 -1.722 1.00 0.00 H new ATOM 0 HB3 ASP A 431 -7.431 -3.288 -3.151 1.00 0.00 H new ATOM 1258 N GLY A 432 -6.390 -7.377 -3.650 1.00 0.00 N ATOM 1259 CA GLY A 432 -7.101 -8.562 -4.089 1.00 0.00 C ATOM 1260 C GLY A 432 -6.507 -9.163 -5.348 1.00 0.00 C ATOM 1261 O GLY A 432 -7.128 -10.005 -5.996 1.00 0.00 O ATOM 0 H GLY A 432 -5.420 -7.536 -3.378 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -7.086 -9.306 -3.293 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -8.146 -8.309 -4.269 1.00 0.00 H new ATOM 1265 N LYS A 433 -5.301 -8.728 -5.696 1.00 0.00 N ATOM 1266 CA LYS A 433 -4.622 -9.226 -6.886 1.00 0.00 C ATOM 1267 C LYS A 433 -3.985 -10.586 -6.620 1.00 0.00 C ATOM 1268 O LYS A 433 -4.020 -11.090 -5.496 1.00 0.00 O ATOM 1269 CB LYS A 433 -3.552 -8.231 -7.342 1.00 0.00 C ATOM 1270 CG LYS A 433 -4.108 -7.060 -8.133 1.00 0.00 C ATOM 1271 CD LYS A 433 -4.605 -7.497 -9.501 1.00 0.00 C ATOM 1272 CE LYS A 433 -3.509 -7.393 -10.551 1.00 0.00 C ATOM 1273 NZ LYS A 433 -2.734 -8.660 -10.671 1.00 0.00 N ATOM 0 H LYS A 433 -4.773 -8.031 -5.170 1.00 0.00 H new ATOM 0 HA LYS A 433 -5.364 -9.340 -7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -3.025 -7.850 -6.467 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -2.817 -8.755 -7.953 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -4.925 -6.600 -7.578 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -3.336 -6.300 -8.251 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -4.963 -8.525 -9.448 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -5.453 -6.879 -9.796 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -3.952 -7.146 -11.516 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -2.834 -6.577 -10.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -2.471 -8.813 -11.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -1.873 -8.597 -10.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -3.316 -9.456 -10.340 1.00 0.00 H new ATOM 1287 N ASP A 434 -3.403 -11.176 -7.658 1.00 0.00 N ATOM 1288 CA ASP A 434 -2.757 -12.477 -7.535 1.00 0.00 C ATOM 1289 C ASP A 434 -1.286 -12.393 -7.931 1.00 0.00 C ATOM 1290 O ASP A 434 -0.951 -11.915 -9.016 1.00 0.00 O ATOM 1291 CB ASP A 434 -3.474 -13.511 -8.405 1.00 0.00 C ATOM 1292 CG ASP A 434 -3.391 -14.910 -7.828 1.00 0.00 C ATOM 1293 OD1 ASP A 434 -4.225 -15.245 -6.961 1.00 0.00 O ATOM 1294 OD2 ASP A 434 -2.492 -15.672 -8.243 1.00 0.00 O ATOM 0 H ASP A 434 -3.365 -10.774 -8.595 1.00 0.00 H new ATOM 0 HA ASP A 434 -2.817 -12.787 -6.492 1.00 0.00 H new ATOM 0 HB2 ASP A 434 -4.521 -13.227 -8.513 1.00 0.00 H new ATOM 0 HB3 ASP A 434 -3.038 -13.507 -9.404 1.00 0.00 H new ATOM 1299 N PHE A 435 -0.412 -12.859 -7.045 1.00 0.00 N ATOM 1300 CA PHE A 435 1.023 -12.834 -7.302 1.00 0.00 C ATOM 1301 C PHE A 435 1.631 -14.223 -7.128 1.00 0.00 C ATOM 1302 O PHE A 435 1.798 -14.701 -6.007 1.00 0.00 O ATOM 1303 CB PHE A 435 1.714 -11.842 -6.364 1.00 0.00 C ATOM 1304 CG PHE A 435 2.939 -11.208 -6.957 1.00 0.00 C ATOM 1305 CD1 PHE A 435 2.827 -10.148 -7.843 1.00 0.00 C ATOM 1306 CD2 PHE A 435 4.203 -11.671 -6.629 1.00 0.00 C ATOM 1307 CE1 PHE A 435 3.952 -9.563 -8.392 1.00 0.00 C ATOM 1308 CE2 PHE A 435 5.332 -11.090 -7.175 1.00 0.00 C ATOM 1309 CZ PHE A 435 5.207 -10.034 -8.056 1.00 0.00 C ATOM 0 H PHE A 435 -0.672 -13.258 -6.143 1.00 0.00 H new ATOM 0 HA PHE A 435 1.176 -12.516 -8.333 1.00 0.00 H new ATOM 0 HB2 PHE A 435 1.006 -11.059 -6.091 1.00 0.00 H new ATOM 0 HB3 PHE A 435 1.991 -12.357 -5.444 1.00 0.00 H new ATOM 0 HD1 PHE A 435 1.849 -9.775 -8.107 1.00 0.00 H new ATOM 0 HD2 PHE A 435 4.307 -12.495 -5.939 1.00 0.00 H new ATOM 0 HE1 PHE A 435 3.851 -8.739 -9.083 1.00 0.00 H new ATOM 0 HE2 PHE A 435 6.312 -11.462 -6.913 1.00 0.00 H new ATOM 0 HZ PHE A 435 6.088 -9.577 -8.482 1.00 0.00 H new ATOM 1319 N GLN A 436 1.957 -14.863 -8.245 1.00 0.00 N ATOM 1320 CA GLN A 436 2.545 -16.198 -8.217 1.00 0.00 C ATOM 1321 C GLN A 436 1.581 -17.204 -7.596 1.00 0.00 C ATOM 1322 O GLN A 436 2.001 -18.177 -6.971 1.00 0.00 O ATOM 1323 CB GLN A 436 3.859 -16.183 -7.434 1.00 0.00 C ATOM 1324 CG GLN A 436 5.050 -15.713 -8.253 1.00 0.00 C ATOM 1325 CD GLN A 436 6.367 -15.887 -7.522 1.00 0.00 C ATOM 1326 OE1 GLN A 436 6.709 -16.990 -7.093 1.00 0.00 O ATOM 1327 NE2 GLN A 436 7.113 -14.799 -7.377 1.00 0.00 N ATOM 0 H GLN A 436 1.824 -14.480 -9.181 1.00 0.00 H new ATOM 0 HA GLN A 436 2.746 -16.501 -9.245 1.00 0.00 H new ATOM 0 HB2 GLN A 436 3.747 -15.534 -6.565 1.00 0.00 H new ATOM 0 HB3 GLN A 436 4.060 -17.186 -7.059 1.00 0.00 H new ATOM 0 HG2 GLN A 436 5.083 -16.268 -9.190 1.00 0.00 H new ATOM 0 HG3 GLN A 436 4.917 -14.662 -8.510 1.00 0.00 H new ATOM 0 HE21 GLN A 436 6.790 -13.906 -7.749 1.00 0.00 H new ATOM 0 HE22 GLN A 436 8.010 -14.856 -6.894 1.00 0.00 H new ATOM 1336 N GLY A 437 0.285 -16.962 -7.775 1.00 0.00 N ATOM 1337 CA GLY A 437 -0.718 -17.856 -7.225 1.00 0.00 C ATOM 1338 C GLY A 437 -1.035 -17.551 -5.774 1.00 0.00 C ATOM 1339 O GLY A 437 -1.589 -18.389 -5.064 1.00 0.00 O ATOM 0 H GLY A 437 -0.087 -16.164 -8.290 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -1.631 -17.781 -7.816 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -0.368 -18.885 -7.309 1.00 0.00 H new ATOM 1343 N SER A 438 -0.681 -16.347 -5.334 1.00 0.00 N ATOM 1344 CA SER A 438 -0.926 -15.935 -3.957 1.00 0.00 C ATOM 1345 C SER A 438 -1.643 -14.590 -3.912 1.00 0.00 C ATOM 1346 O SER A 438 -1.193 -13.612 -4.509 1.00 0.00 O ATOM 1347 CB SER A 438 0.392 -15.850 -3.185 1.00 0.00 C ATOM 1348 OG SER A 438 1.120 -17.062 -3.283 1.00 0.00 O ATOM 0 H SER A 438 -0.224 -15.641 -5.911 1.00 0.00 H new ATOM 0 HA SER A 438 -1.565 -16.683 -3.488 1.00 0.00 H new ATOM 0 HB2 SER A 438 0.993 -15.029 -3.575 1.00 0.00 H new ATOM 0 HB3 SER A 438 0.190 -15.627 -2.137 1.00 0.00 H new ATOM 0 HG SER A 438 1.959 -16.981 -2.783 1.00 0.00 H new ATOM 1354 N LYS A 439 -2.764 -14.547 -3.198 1.00 0.00 N ATOM 1355 CA LYS A 439 -3.545 -13.322 -3.072 1.00 0.00 C ATOM 1356 C LYS A 439 -2.787 -12.275 -2.263 1.00 0.00 C ATOM 1357 O LYS A 439 -2.165 -12.589 -1.247 1.00 0.00 O ATOM 1358 CB LYS A 439 -4.891 -13.618 -2.408 1.00 0.00 C ATOM 1359 CG LYS A 439 -5.913 -12.508 -2.583 1.00 0.00 C ATOM 1360 CD LYS A 439 -5.817 -11.481 -1.468 1.00 0.00 C ATOM 1361 CE LYS A 439 -6.337 -12.037 -0.152 1.00 0.00 C ATOM 1362 NZ LYS A 439 -5.259 -12.696 0.637 1.00 0.00 N ATOM 0 H LYS A 439 -3.152 -15.347 -2.698 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.719 -12.927 -4.073 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.296 -14.541 -2.822 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -4.732 -13.789 -1.343 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.758 -12.018 -3.544 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.916 -12.935 -2.600 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -4.780 -11.169 -1.348 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -6.388 -10.593 -1.740 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -6.775 -11.230 0.435 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -7.133 -12.755 -0.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -5.444 -13.718 0.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -4.342 -12.535 0.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -5.237 -12.296 1.597 1.00 0.00 H new ATOM 1376 N LEU A 440 -2.842 -11.028 -2.718 1.00 0.00 N ATOM 1377 CA LEU A 440 -2.162 -9.932 -2.037 1.00 0.00 C ATOM 1378 C LEU A 440 -3.166 -9.006 -1.359 1.00 0.00 C ATOM 1379 O LEU A 440 -4.281 -8.816 -1.847 1.00 0.00 O ATOM 1380 CB LEU A 440 -1.307 -9.140 -3.028 1.00 0.00 C ATOM 1381 CG LEU A 440 -0.452 -9.969 -3.988 1.00 0.00 C ATOM 1382 CD1 LEU A 440 0.580 -9.089 -4.677 1.00 0.00 C ATOM 1383 CD2 LEU A 440 0.228 -11.111 -3.246 1.00 0.00 C ATOM 0 H LEU A 440 -3.351 -10.751 -3.557 1.00 0.00 H new ATOM 0 HA LEU A 440 -1.515 -10.359 -1.271 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -1.966 -8.503 -3.618 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -0.648 -8.481 -2.463 1.00 0.00 H new ATOM 0 HG LEU A 440 -1.104 -10.395 -4.750 1.00 0.00 H new ATOM 0 HD11 LEU A 440 1.180 -9.695 -5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 440 0.072 -8.306 -5.241 1.00 0.00 H new ATOM 0 HD13 LEU A 440 1.229 -8.634 -3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 440 0.832 -11.690 -3.944 1.00 0.00 H new ATOM 0 HD22 LEU A 440 0.868 -10.706 -2.462 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -0.528 -11.756 -2.799 1.00 0.00 H new ATOM 1395 N LYS A 441 -2.764 -8.427 -0.233 1.00 0.00 N ATOM 1396 CA LYS A 441 -3.626 -7.517 0.511 1.00 0.00 C ATOM 1397 C LYS A 441 -2.995 -6.132 0.612 1.00 0.00 C ATOM 1398 O LYS A 441 -2.018 -5.934 1.333 1.00 0.00 O ATOM 1399 CB LYS A 441 -3.897 -8.068 1.913 1.00 0.00 C ATOM 1400 CG LYS A 441 -5.126 -8.958 1.989 1.00 0.00 C ATOM 1401 CD LYS A 441 -6.381 -8.152 2.278 1.00 0.00 C ATOM 1402 CE LYS A 441 -7.637 -8.924 1.904 1.00 0.00 C ATOM 1403 NZ LYS A 441 -8.850 -8.061 1.942 1.00 0.00 N ATOM 0 H LYS A 441 -1.845 -8.572 0.185 1.00 0.00 H new ATOM 0 HA LYS A 441 -4.570 -7.430 -0.027 1.00 0.00 H new ATOM 0 HB2 LYS A 441 -3.027 -8.634 2.246 1.00 0.00 H new ATOM 0 HB3 LYS A 441 -4.019 -7.234 2.605 1.00 0.00 H new ATOM 0 HG2 LYS A 441 -5.246 -9.495 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 441 -4.986 -9.707 2.768 1.00 0.00 H new ATOM 0 HD2 LYS A 441 -6.413 -7.893 3.336 1.00 0.00 H new ATOM 0 HD3 LYS A 441 -6.349 -7.215 1.722 1.00 0.00 H new ATOM 0 HE2 LYS A 441 -7.521 -9.344 0.905 1.00 0.00 H new ATOM 0 HE3 LYS A 441 -7.766 -9.762 2.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 441 -9.685 -8.624 1.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 441 -8.975 -7.680 2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 441 -8.738 -7.275 1.270 1.00 0.00 H new ATOM 1417 N VAL A 442 -3.563 -5.174 -0.115 1.00 0.00 N ATOM 1418 CA VAL A 442 -3.058 -3.806 -0.105 1.00 0.00 C ATOM 1419 C VAL A 442 -3.908 -2.913 0.792 1.00 0.00 C ATOM 1420 O VAL A 442 -5.136 -2.922 0.710 1.00 0.00 O ATOM 1421 CB VAL A 442 -3.028 -3.209 -1.525 1.00 0.00 C ATOM 1422 CG1 VAL A 442 -2.250 -1.902 -1.537 1.00 0.00 C ATOM 1423 CG2 VAL A 442 -2.431 -4.203 -2.508 1.00 0.00 C ATOM 0 H VAL A 442 -4.373 -5.320 -0.718 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.041 -3.846 0.286 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.052 -2.998 -1.834 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.239 -1.494 -2.548 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.726 -1.189 -0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.227 -2.085 -1.208 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.418 -3.765 -3.506 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.413 -4.447 -2.205 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -3.034 -5.111 -2.519 1.00 0.00 H new ATOM 1433 N SER A 443 -3.245 -2.142 1.648 1.00 0.00 N ATOM 1434 CA SER A 443 -3.940 -1.245 2.565 1.00 0.00 C ATOM 1435 C SER A 443 -3.070 -0.039 2.907 1.00 0.00 C ATOM 1436 O SER A 443 -1.919 -0.185 3.322 1.00 0.00 O ATOM 1437 CB SER A 443 -4.327 -1.988 3.844 1.00 0.00 C ATOM 1438 OG SER A 443 -3.251 -2.011 4.767 1.00 0.00 O ATOM 0 H SER A 443 -2.228 -2.120 1.726 1.00 0.00 H new ATOM 0 HA SER A 443 -4.845 -0.891 2.072 1.00 0.00 H new ATOM 0 HB2 SER A 443 -5.192 -1.506 4.301 1.00 0.00 H new ATOM 0 HB3 SER A 443 -4.623 -3.008 3.600 1.00 0.00 H new ATOM 0 HG SER A 443 -2.508 -1.476 4.417 1.00 0.00 H new ATOM 1444 N LEU A 444 -3.628 1.154 2.729 1.00 0.00 N ATOM 1445 CA LEU A 444 -2.905 2.388 3.019 1.00 0.00 C ATOM 1446 C LEU A 444 -2.191 2.297 4.365 1.00 0.00 C ATOM 1447 O LEU A 444 -2.831 2.221 5.413 1.00 0.00 O ATOM 1448 CB LEU A 444 -3.866 3.577 3.017 1.00 0.00 C ATOM 1449 CG LEU A 444 -4.175 4.188 1.650 1.00 0.00 C ATOM 1450 CD1 LEU A 444 -5.146 5.351 1.791 1.00 0.00 C ATOM 1451 CD2 LEU A 444 -2.894 4.641 0.966 1.00 0.00 C ATOM 0 H LEU A 444 -4.578 1.293 2.385 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.156 2.534 2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -4.805 3.261 3.472 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -3.449 4.356 3.655 1.00 0.00 H new ATOM 0 HG LEU A 444 -4.644 3.424 1.030 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -5.354 5.773 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.075 4.997 2.238 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -4.706 6.117 2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -3.134 5.073 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -2.397 5.389 1.583 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -2.232 3.786 0.829 1.00 0.00 H new