USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 706 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: B 367 THR OG1 : rot 180:sc= -0.931! USER MOD Set 1.2: B 379 SER OG : rot 88:sc= 0.533! USER MOD Set 2.1: B 362 SER OG : rot 49:sc= -0.408! USER MOD Set 2.2: B 365 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 352 SER OG : rot -83:sc= -2.63! USER MOD Set 3.2: B 355 ASN :FLIP amide:sc= -4.39! C(o=-12!,f=-7!) USER MOD Set 4.1: B 333 THR OG1 : rot -145:sc= -2.44! USER MOD Set 4.2: B 336 CYS SG : rot 180:sc= -0.926! USER MOD Set 4.3: B 338 MET CE :methyl -135:sc= -1.09 (180deg=-2.8!) USER MOD Set 5.1: B 311 SER OG : rot -120:sc= -0.396 USER MOD Set 5.2: B 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 334 LYS NZ :NH3+ 150:sc= -0.127 (180deg=-0.846) USER MOD Single : B 343 LYS NZ :NH3+ 153:sc= -0.377 (180deg=-1.68!) USER MOD Single : B 344 THR OG1 : rot -59:sc= -4.88! USER MOD Single : B 345 LYS NZ :NH3+ 155:sc= -0.0375 (180deg=-0.249) USER MOD Single : B 349 GLN :FLIP amide:sc= -0.2 F(o=-0.88,f=-0.2) USER MOD Single : B 354 THR OG1 : rot -47:sc= -0.241 USER MOD Single : B 357 LYS NZ :NH3+ 163:sc= -1.53 (180deg=-1.94) USER MOD Single : B 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 373 TYR OH : rot 180:sc= 0 USER MOD Single : B 374 GLN : amide:sc= -0.193 K(o=-0.19,f=-1.6) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.16! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 381 GLN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : B 382 THR OG1 : rot 180:sc= 0.607 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0663 USER MOD Single : B 387 GLN : amide:sc= -0.0236 X(o=-0.024,f=-0.24) USER MOD Single : B 390 GLN : amide:sc= -7.64! C(o=-7.6!,f=-15!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.161 11.896 1.981 1.00 0.00 N ATOM 126 CA LEU A 15 0.481 10.645 1.642 1.00 0.00 C ATOM 127 C LEU A 15 -0.777 10.505 2.495 1.00 0.00 C ATOM 128 O LEU A 15 -1.816 10.051 2.023 1.00 0.00 O ATOM 129 CB LEU A 15 1.403 9.438 1.901 1.00 0.00 C ATOM 130 CG LEU A 15 2.368 9.164 0.724 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.605 8.870 -0.570 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.282 10.364 0.492 1.00 0.00 C ATOM 0 HA LEU A 15 0.218 10.667 0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.982 9.616 2.807 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.794 8.552 2.081 1.00 0.00 H new ATOM 0 HG LEU A 15 2.961 8.290 0.992 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.314 8.682 -1.376 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.975 7.992 -0.429 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.982 9.726 -0.827 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.954 10.154 -0.340 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.679 11.241 0.258 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.867 10.555 1.392 1.00 0.00 H new ATOM 144 N LEU A 16 -0.682 10.912 3.753 1.00 0.00 N ATOM 145 CA LEU A 16 -1.829 10.840 4.645 1.00 0.00 C ATOM 146 C LEU A 16 -2.964 11.692 4.084 1.00 0.00 C ATOM 147 O LEU A 16 -4.128 11.292 4.102 1.00 0.00 O ATOM 148 CB LEU A 16 -1.435 11.333 6.042 1.00 0.00 C ATOM 149 CG LEU A 16 -1.717 10.251 7.092 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.205 9.896 7.081 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.882 8.997 6.790 1.00 0.00 C ATOM 0 H LEU A 16 0.166 11.291 4.174 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.165 9.806 4.722 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.377 11.596 6.057 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.992 12.238 6.285 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.445 10.631 8.077 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.401 9.127 7.828 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.793 10.785 7.312 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.483 9.523 6.095 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.088 8.233 7.540 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.143 8.615 5.803 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.178 9.251 6.813 1.00 0.00 H new ATOM 163 N GLY A 17 -2.613 12.859 3.554 1.00 0.00 N ATOM 164 CA GLY A 17 -3.612 13.736 2.956 1.00 0.00 C ATOM 165 C GLY A 17 -4.265 13.030 1.776 1.00 0.00 C ATOM 166 O GLY A 17 -5.470 13.139 1.556 1.00 0.00 O ATOM 0 H GLY A 17 -1.658 13.216 3.526 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.366 14.004 3.696 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.146 14.664 2.626 1.00 0.00 H new ATOM 170 N GLU A 18 -3.451 12.289 1.033 1.00 0.00 N ATOM 171 CA GLU A 18 -3.933 11.537 -0.113 1.00 0.00 C ATOM 172 C GLU A 18 -4.801 10.380 0.358 1.00 0.00 C ATOM 173 O GLU A 18 -5.813 10.066 -0.255 1.00 0.00 O ATOM 174 CB GLU A 18 -2.732 11.015 -0.907 1.00 0.00 C ATOM 175 CG GLU A 18 -2.115 12.162 -1.708 1.00 0.00 C ATOM 176 CD GLU A 18 -1.006 11.630 -2.610 1.00 0.00 C ATOM 177 OE1 GLU A 18 -0.615 10.490 -2.425 1.00 0.00 O ATOM 178 OE2 GLU A 18 -0.564 12.372 -3.473 1.00 0.00 O1- ATOM 0 H GLU A 18 -2.450 12.195 1.207 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.535 12.182 -0.753 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.991 10.590 -0.230 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.046 10.216 -1.578 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.882 12.650 -2.310 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.714 12.915 -1.030 1.00 0.00 H new ATOM 394 N VAL B 310 9.408 -12.650 0.631 1.00 0.00 N ATOM 395 CA VAL B 310 8.129 -11.980 0.427 1.00 0.00 C ATOM 396 C VAL B 310 7.375 -11.839 1.748 1.00 0.00 C ATOM 397 O VAL B 310 7.273 -12.793 2.519 1.00 0.00 O ATOM 398 CB VAL B 310 7.280 -12.775 -0.566 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.882 -12.166 -0.643 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.931 -12.722 -1.948 1.00 0.00 C ATOM 0 HA VAL B 310 8.322 -10.984 0.028 1.00 0.00 H new ATOM 0 HB VAL B 310 7.209 -13.811 -0.234 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.277 -12.733 -1.351 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.416 -12.200 0.342 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.954 -11.130 -0.975 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.327 -13.288 -2.657 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.001 -11.685 -2.278 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.930 -13.154 -1.896 1.00 0.00 H new ATOM 410 N SER B 311 6.850 -10.643 1.997 1.00 0.00 N ATOM 411 CA SER B 311 6.106 -10.376 3.220 1.00 0.00 C ATOM 412 C SER B 311 4.627 -10.201 2.905 1.00 0.00 C ATOM 413 O SER B 311 4.276 -9.835 1.793 1.00 0.00 O ATOM 414 CB SER B 311 6.636 -9.111 3.873 1.00 0.00 C ATOM 415 OG SER B 311 7.779 -8.662 3.160 1.00 0.00 O ATOM 0 H SER B 311 6.927 -9.844 1.367 1.00 0.00 H new ATOM 0 HA SER B 311 6.229 -11.219 3.900 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.867 -8.339 3.875 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.895 -9.306 4.914 1.00 0.00 H new ATOM 0 HG SER B 311 8.553 -8.642 3.761 1.00 0.00 H new ATOM 421 N PHE B 312 3.768 -10.494 3.877 1.00 0.00 N ATOM 422 CA PHE B 312 2.325 -10.399 3.678 1.00 0.00 C ATOM 423 C PHE B 312 1.658 -9.591 4.795 1.00 0.00 C ATOM 424 O PHE B 312 1.963 -9.802 5.969 1.00 0.00 O ATOM 425 CB PHE B 312 1.767 -11.819 3.689 1.00 0.00 C ATOM 426 CG PHE B 312 2.092 -12.507 2.381 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.515 -12.057 1.188 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.976 -13.594 2.363 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.820 -12.692 -0.022 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.281 -14.228 1.153 1.00 0.00 C ATOM 431 CZ PHE B 312 2.702 -13.778 -0.039 1.00 0.00 C ATOM 0 H PHE B 312 4.046 -10.799 4.810 1.00 0.00 H new ATOM 0 HA PHE B 312 2.123 -9.893 2.734 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.192 -12.380 4.521 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.688 -11.794 3.839 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.834 -11.219 1.201 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.422 -13.943 3.283 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.375 -12.344 -0.942 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.964 -15.065 1.139 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.936 -14.269 -0.972 1.00 0.00 H new ATOM 441 N PHE B 313 0.732 -8.679 4.444 1.00 0.00 N ATOM 442 CA PHE B 313 0.050 -7.901 5.469 1.00 0.00 C ATOM 443 C PHE B 313 -1.421 -7.756 5.139 1.00 0.00 C ATOM 444 O PHE B 313 -1.786 -7.343 4.041 1.00 0.00 O ATOM 445 CB PHE B 313 0.661 -6.513 5.587 1.00 0.00 C ATOM 446 CG PHE B 313 1.975 -6.594 6.318 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.144 -6.926 5.626 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.024 -6.321 7.689 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.365 -6.988 6.307 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.246 -6.382 8.370 1.00 0.00 C ATOM 451 CZ PHE B 313 4.417 -6.715 7.677 1.00 0.00 C ATOM 0 H PHE B 313 0.452 -8.474 3.485 1.00 0.00 H new ATOM 0 HA PHE B 313 0.163 -8.432 6.414 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.812 -6.087 4.595 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.021 -5.850 6.119 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.105 -7.134 4.567 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.120 -6.063 8.222 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.268 -7.247 5.774 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.286 -6.172 9.429 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.360 -6.761 8.201 1.00 0.00 H new ATOM 461 N LEU B 314 -2.256 -8.067 6.109 1.00 0.00 N ATOM 462 CA LEU B 314 -3.682 -7.937 5.931 1.00 0.00 C ATOM 463 C LEU B 314 -4.089 -6.502 6.171 1.00 0.00 C ATOM 464 O LEU B 314 -4.090 -5.968 7.270 1.00 0.00 O ATOM 465 CB LEU B 314 -4.458 -8.979 6.765 1.00 0.00 C ATOM 466 CG LEU B 314 -4.952 -8.486 8.140 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.818 -7.847 8.944 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.131 -7.509 7.987 1.00 0.00 C ATOM 0 H LEU B 314 -1.970 -8.411 7.026 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.953 -8.168 4.901 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.319 -9.315 6.187 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.818 -9.848 6.917 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.303 -9.357 8.693 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.200 -7.510 9.908 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.027 -8.580 9.103 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.418 -6.995 8.395 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.459 -7.177 8.972 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.815 -6.646 7.400 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.955 -8.010 7.480 1.00 0.00 H new ATOM 480 N VAL B 315 -4.346 -5.867 5.071 1.00 0.00 N ATOM 481 CA VAL B 315 -4.691 -4.463 5.053 1.00 0.00 C ATOM 482 C VAL B 315 -6.120 -4.280 4.545 1.00 0.00 C ATOM 483 O VAL B 315 -6.648 -5.172 3.909 1.00 0.00 O ATOM 484 CB VAL B 315 -3.707 -3.763 4.129 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.277 -3.958 4.638 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.845 -4.347 2.711 1.00 0.00 C ATOM 0 H VAL B 315 -4.325 -6.303 4.149 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.637 -4.040 6.056 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.925 -2.695 4.108 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.581 -3.453 3.969 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.187 -3.538 5.640 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.044 -5.022 4.668 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.142 -3.850 2.043 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.629 -5.415 2.735 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.862 -4.190 2.350 1.00 0.00 H new ATOM 496 N LYS B 316 -6.747 -3.128 4.816 1.00 0.00 N ATOM 497 CA LYS B 316 -8.102 -2.895 4.344 1.00 0.00 C ATOM 498 C LYS B 316 -8.073 -1.956 3.156 1.00 0.00 C ATOM 499 O LYS B 316 -7.241 -1.058 3.082 1.00 0.00 O ATOM 500 CB LYS B 316 -8.968 -2.289 5.438 1.00 0.00 C ATOM 501 CG LYS B 316 -8.691 -2.976 6.778 1.00 0.00 C ATOM 502 CD LYS B 316 -9.542 -2.328 7.874 1.00 0.00 C ATOM 503 CE LYS B 316 -8.871 -2.539 9.232 1.00 0.00 C ATOM 504 NZ LYS B 316 -9.821 -2.163 10.317 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.340 -2.360 5.350 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.529 -3.855 4.054 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.766 -1.221 5.521 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.021 -2.395 5.178 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.920 -4.039 6.707 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.633 -2.894 7.028 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -9.659 -1.263 7.676 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.541 -2.763 7.879 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -8.569 -3.580 9.343 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -7.966 -1.935 9.301 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -9.366 -2.306 11.241 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -10.088 -1.163 10.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -10.672 -2.757 10.254 1.00 0.00 H new ATOM 518 N GLU B 317 -8.970 -2.192 2.221 1.00 0.00 N ATOM 519 CA GLU B 317 -9.026 -1.392 1.010 1.00 0.00 C ATOM 520 C GLU B 317 -10.430 -0.935 0.674 1.00 0.00 C ATOM 521 O GLU B 317 -11.419 -1.575 1.006 1.00 0.00 O ATOM 522 CB GLU B 317 -8.507 -2.214 -0.152 1.00 0.00 C ATOM 523 CG GLU B 317 -8.137 -1.291 -1.323 1.00 0.00 C ATOM 524 CD GLU B 317 -7.439 -2.086 -2.421 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.427 -2.700 -2.127 1.00 0.00 O ATOM 526 OE2 GLU B 317 -7.922 -2.062 -3.541 1.00 0.00 O1- ATOM 0 H GLU B 317 -9.671 -2.931 2.274 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.415 -0.506 1.184 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.634 -2.789 0.159 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.265 -2.931 -0.468 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -9.035 -0.819 -1.721 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.485 -0.491 -0.973 1.00 0.00 H new ATOM 678 N VAL B 326 -12.443 -2.748 2.842 1.00 0.00 N ATOM 679 CA VAL B 326 -12.621 -4.176 2.858 1.00 0.00 C ATOM 680 C VAL B 326 -11.323 -4.859 3.261 1.00 0.00 C ATOM 681 O VAL B 326 -10.296 -4.613 2.630 1.00 0.00 O ATOM 682 CB VAL B 326 -12.997 -4.605 1.452 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.723 -6.092 1.273 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.472 -4.301 1.218 1.00 0.00 C ATOM 0 HA VAL B 326 -13.396 -4.453 3.573 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.398 -4.057 0.725 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -12.995 -6.393 0.261 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.664 -6.289 1.438 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.314 -6.660 1.992 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.751 -4.606 0.209 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.076 -4.848 1.943 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.646 -3.231 1.334 1.00 0.00 H new ATOM 694 N PRO B 327 -11.317 -5.715 4.264 1.00 0.00 N ATOM 695 CA PRO B 327 -10.071 -6.411 4.649 1.00 0.00 C ATOM 696 C PRO B 327 -9.391 -6.893 3.385 1.00 0.00 C ATOM 697 O PRO B 327 -10.064 -7.228 2.413 1.00 0.00 O ATOM 698 CB PRO B 327 -10.547 -7.572 5.522 1.00 0.00 C ATOM 699 CG PRO B 327 -11.852 -7.125 6.098 1.00 0.00 C ATOM 700 CD PRO B 327 -12.452 -6.108 5.120 1.00 0.00 C ATOM 0 HA PRO B 327 -9.351 -5.791 5.184 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.668 -8.482 4.934 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.826 -7.794 6.308 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.524 -7.973 6.233 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.706 -6.675 7.080 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.259 -6.548 4.534 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.870 -5.249 5.645 1.00 0.00 H new ATOM 708 N ARG B 328 -8.078 -6.889 3.362 1.00 0.00 N ATOM 709 CA ARG B 328 -7.388 -7.282 2.167 1.00 0.00 C ATOM 710 C ARG B 328 -6.072 -7.888 2.547 1.00 0.00 C ATOM 711 O ARG B 328 -5.819 -8.135 3.723 1.00 0.00 O ATOM 712 CB ARG B 328 -7.199 -6.074 1.234 1.00 0.00 C ATOM 713 CG ARG B 328 -6.760 -6.539 -0.158 1.00 0.00 C ATOM 714 CD ARG B 328 -7.465 -5.699 -1.225 1.00 0.00 C ATOM 715 NE ARG B 328 -8.912 -5.837 -1.104 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.523 -6.974 -1.421 1.00 0.00 C ATOM 717 NH1 ARG B 328 -8.826 -7.989 -1.853 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.818 -7.075 -1.301 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.480 -6.622 4.144 1.00 0.00 H new ATOM 0 HA ARG B 328 -7.976 -8.022 1.625 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.131 -5.514 1.160 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.453 -5.398 1.651 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.679 -6.443 -0.261 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -7.001 -7.593 -0.293 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.183 -4.652 -1.118 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -7.144 -6.016 -2.217 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.465 -5.047 -0.770 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -7.813 -7.909 -1.947 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.294 -8.862 -2.097 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.362 -6.281 -0.964 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.286 -7.948 -1.544 1.00 0.00 H new ATOM 732 N LEU B 329 -5.256 -8.176 1.566 1.00 0.00 N ATOM 733 CA LEU B 329 -4.010 -8.815 1.836 1.00 0.00 C ATOM 734 C LEU B 329 -2.961 -8.280 0.889 1.00 0.00 C ATOM 735 O LEU B 329 -3.118 -8.338 -0.314 1.00 0.00 O ATOM 736 CB LEU B 329 -4.273 -10.318 1.691 1.00 0.00 C ATOM 737 CG LEU B 329 -3.163 -11.206 2.286 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.116 -12.533 1.520 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.784 -10.552 2.196 1.00 0.00 C ATOM 0 H LEU B 329 -5.437 -7.977 0.582 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.624 -8.619 2.836 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.218 -10.560 2.177 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.388 -10.557 0.634 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.400 -11.360 3.339 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.332 -13.166 1.936 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.077 -13.039 1.610 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.905 -12.339 0.468 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.037 -11.217 2.628 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.539 -10.362 1.151 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.792 -9.610 2.744 1.00 0.00 H new ATOM 751 N LEU B 330 -1.902 -7.730 1.455 1.00 0.00 N ATOM 752 CA LEU B 330 -0.832 -7.156 0.679 1.00 0.00 C ATOM 753 C LEU B 330 0.315 -8.128 0.635 1.00 0.00 C ATOM 754 O LEU B 330 0.442 -8.962 1.522 1.00 0.00 O ATOM 755 CB LEU B 330 -0.413 -5.850 1.358 1.00 0.00 C ATOM 756 CG LEU B 330 0.920 -5.318 0.813 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.746 -4.872 -0.633 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.344 -4.135 1.673 1.00 0.00 C ATOM 0 H LEU B 330 -1.765 -7.672 2.464 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.147 -6.951 -0.344 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.190 -5.100 1.211 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.326 -6.012 2.432 1.00 0.00 H new ATOM 0 HG LEU B 330 1.680 -6.099 0.845 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.695 -4.495 -1.014 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.422 -5.719 -1.238 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.004 -4.082 -0.682 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.290 -3.739 1.305 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.581 -3.358 1.624 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.464 -4.461 2.706 1.00 0.00 H new ATOM 770 N GLY B 331 1.173 -7.988 -0.363 1.00 0.00 N ATOM 771 CA GLY B 331 2.317 -8.839 -0.447 1.00 0.00 C ATOM 772 C GLY B 331 3.521 -8.056 -0.928 1.00 0.00 C ATOM 773 O GLY B 331 3.632 -7.716 -2.101 1.00 0.00 O ATOM 0 H GLY B 331 1.089 -7.299 -1.110 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.526 -9.276 0.529 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.115 -9.664 -1.130 1.00 0.00 H new ATOM 777 N ILE B 332 4.440 -7.805 -0.020 1.00 0.00 N ATOM 778 CA ILE B 332 5.659 -7.118 -0.378 1.00 0.00 C ATOM 779 C ILE B 332 6.665 -8.148 -0.821 1.00 0.00 C ATOM 780 O ILE B 332 6.981 -9.077 -0.086 1.00 0.00 O ATOM 781 CB ILE B 332 6.239 -6.359 0.808 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.173 -5.452 1.421 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.437 -5.523 0.342 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.541 -4.586 0.329 1.00 0.00 C ATOM 0 H ILE B 332 4.366 -8.065 0.964 1.00 0.00 H new ATOM 0 HA ILE B 332 5.438 -6.403 -1.170 1.00 0.00 H new ATOM 0 HB ILE B 332 6.569 -7.070 1.565 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.407 -6.054 1.910 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.618 -4.819 2.188 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.853 -4.979 1.190 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.199 -6.181 -0.076 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.112 -4.814 -0.419 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.781 -3.941 0.770 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.310 -3.973 -0.140 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.080 -5.227 -0.423 1.00 0.00 H new ATOM 796 N THR B 333 7.161 -7.965 -2.017 1.00 0.00 N ATOM 797 CA THR B 333 8.125 -8.855 -2.583 1.00 0.00 C ATOM 798 C THR B 333 9.390 -8.081 -2.841 1.00 0.00 C ATOM 799 O THR B 333 9.340 -6.950 -3.311 1.00 0.00 O ATOM 800 CB THR B 333 7.562 -9.416 -3.884 1.00 0.00 C ATOM 801 OG1 THR B 333 7.803 -8.505 -4.940 1.00 0.00 O ATOM 802 CG2 THR B 333 6.056 -9.626 -3.722 1.00 0.00 C ATOM 0 H THR B 333 6.902 -7.188 -2.625 1.00 0.00 H new ATOM 0 HA THR B 333 8.344 -9.682 -1.907 1.00 0.00 H new ATOM 0 HB THR B 333 8.045 -10.365 -4.115 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.052 -8.528 -5.570 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.643 -10.027 -4.647 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.872 -10.327 -2.908 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.578 -8.673 -3.495 1.00 0.00 H new ATOM 810 N LYS B 334 10.518 -8.678 -2.531 1.00 0.00 N ATOM 811 CA LYS B 334 11.800 -8.008 -2.733 1.00 0.00 C ATOM 812 C LYS B 334 11.990 -7.579 -4.183 1.00 0.00 C ATOM 813 O LYS B 334 13.082 -7.223 -4.593 1.00 0.00 O ATOM 814 CB LYS B 334 12.932 -8.935 -2.326 1.00 0.00 C ATOM 815 CG LYS B 334 13.096 -10.042 -3.368 1.00 0.00 C ATOM 816 CD LYS B 334 13.466 -11.348 -2.664 1.00 0.00 C ATOM 817 CE LYS B 334 14.103 -12.308 -3.669 1.00 0.00 C ATOM 818 NZ LYS B 334 15.419 -11.766 -4.108 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.584 -9.618 -2.141 1.00 0.00 H new ATOM 0 HA LYS B 334 11.809 -7.112 -2.113 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.860 -8.371 -2.232 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.724 -9.371 -1.349 1.00 0.00 H new ATOM 0 HG2 LYS B 334 12.171 -10.168 -3.930 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.870 -9.770 -4.085 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.159 -11.149 -1.846 1.00 0.00 H new ATOM 0 HD3 LYS B 334 12.577 -11.801 -2.225 1.00 0.00 H new ATOM 0 HE2 LYS B 334 14.235 -13.291 -3.216 1.00 0.00 H new ATOM 0 HE3 LYS B 334 13.446 -12.439 -4.529 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 16.056 -12.553 -4.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 15.285 -11.163 -4.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 15.836 -11.203 -3.340 1.00 0.00 H new ATOM 832 N GLU B 335 10.917 -7.628 -4.937 1.00 0.00 N ATOM 833 CA GLU B 335 10.922 -7.226 -6.335 1.00 0.00 C ATOM 834 C GLU B 335 9.608 -6.550 -6.706 1.00 0.00 C ATOM 835 O GLU B 335 9.423 -6.138 -7.852 1.00 0.00 O ATOM 836 CB GLU B 335 11.137 -8.445 -7.229 1.00 0.00 C ATOM 837 CG GLU B 335 10.131 -9.534 -6.851 1.00 0.00 C ATOM 838 CD GLU B 335 10.330 -10.763 -7.731 1.00 0.00 C ATOM 839 OE1 GLU B 335 11.462 -11.198 -7.863 1.00 0.00 O1- ATOM 840 OE2 GLU B 335 9.345 -11.254 -8.261 1.00 0.00 O ATOM 0 H GLU B 335 10.009 -7.949 -4.602 1.00 0.00 H new ATOM 0 HA GLU B 335 11.737 -6.517 -6.483 1.00 0.00 H new ATOM 0 HB2 GLU B 335 11.014 -8.168 -8.276 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.155 -8.819 -7.115 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.254 -9.805 -5.802 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.115 -9.156 -6.966 1.00 0.00 H new ATOM 847 N CYS B 336 8.670 -6.476 -5.759 1.00 0.00 N ATOM 848 CA CYS B 336 7.374 -5.895 -6.065 1.00 0.00 C ATOM 849 C CYS B 336 6.478 -5.755 -4.854 1.00 0.00 C ATOM 850 O CYS B 336 6.841 -6.081 -3.726 1.00 0.00 O ATOM 851 CB CYS B 336 6.658 -6.736 -7.124 1.00 0.00 C ATOM 852 SG CYS B 336 5.344 -7.704 -6.346 1.00 0.00 S ATOM 0 H CYS B 336 8.784 -6.804 -4.800 1.00 0.00 H new ATOM 0 HA CYS B 336 7.571 -4.890 -6.439 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.239 -6.089 -7.894 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.369 -7.399 -7.617 1.00 0.00 H new ATOM 0 HG CYS B 336 4.737 -8.416 -7.249 1.00 0.00 H new ATOM 858 N VAL B 337 5.296 -5.241 -5.137 1.00 0.00 N ATOM 859 CA VAL B 337 4.278 -5.001 -4.139 1.00 0.00 C ATOM 860 C VAL B 337 2.973 -5.430 -4.732 1.00 0.00 C ATOM 861 O VAL B 337 2.805 -5.288 -5.936 1.00 0.00 O ATOM 862 CB VAL B 337 4.239 -3.517 -3.847 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.389 -3.247 -2.611 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.669 -3.055 -3.623 1.00 0.00 C ATOM 0 H VAL B 337 5.015 -4.976 -6.081 1.00 0.00 H new ATOM 0 HA VAL B 337 4.478 -5.546 -3.217 1.00 0.00 H new ATOM 0 HB VAL B 337 3.794 -2.973 -4.680 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.368 -2.176 -2.411 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.373 -3.604 -2.783 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.817 -3.768 -1.754 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.677 -1.986 -3.409 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.099 -3.597 -2.780 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.259 -3.250 -4.518 1.00 0.00 H new ATOM 874 N MET B 338 2.060 -5.981 -3.949 1.00 0.00 N ATOM 875 CA MET B 338 0.832 -6.432 -4.578 1.00 0.00 C ATOM 876 C MET B 338 -0.372 -6.443 -3.660 1.00 0.00 C ATOM 877 O MET B 338 -0.261 -6.685 -2.461 1.00 0.00 O ATOM 878 CB MET B 338 1.045 -7.839 -5.091 1.00 0.00 C ATOM 879 CG MET B 338 1.924 -8.601 -4.099 1.00 0.00 C ATOM 880 SD MET B 338 1.901 -10.372 -4.471 1.00 0.00 S ATOM 881 CE MET B 338 2.970 -10.354 -5.934 1.00 0.00 C ATOM 0 H MET B 338 2.134 -6.121 -2.941 1.00 0.00 H new ATOM 0 HA MET B 338 0.614 -5.720 -5.374 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.087 -8.345 -5.212 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.518 -7.815 -6.072 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.946 -8.226 -4.146 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.568 -8.431 -3.083 1.00 0.00 H new ATOM 0 HE1 MET B 338 2.529 -10.974 -6.715 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.073 -9.331 -6.297 1.00 0.00 H new ATOM 0 HE3 MET B 338 3.953 -10.746 -5.672 1.00 0.00 H new ATOM 891 N ARG B 339 -1.538 -6.260 -4.268 1.00 0.00 N ATOM 892 CA ARG B 339 -2.790 -6.320 -3.539 1.00 0.00 C ATOM 893 C ARG B 339 -3.367 -7.712 -3.687 1.00 0.00 C ATOM 894 O ARG B 339 -3.818 -8.096 -4.767 1.00 0.00 O ATOM 895 CB ARG B 339 -3.782 -5.301 -4.084 1.00 0.00 C ATOM 896 CG ARG B 339 -3.144 -3.911 -4.066 1.00 0.00 C ATOM 897 CD ARG B 339 -4.128 -2.886 -4.639 1.00 0.00 C ATOM 898 NE ARG B 339 -4.793 -3.425 -5.819 1.00 0.00 N ATOM 899 CZ ARG B 339 -5.972 -2.960 -6.219 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.553 -1.999 -5.556 1.00 0.00 N ATOM 901 NH2 ARG B 339 -6.550 -3.466 -7.275 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.638 -6.069 -5.265 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.605 -6.091 -2.489 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.072 -5.567 -5.101 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.691 -5.304 -3.482 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -2.872 -3.638 -3.046 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.225 -3.914 -4.652 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.869 -2.623 -3.884 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.598 -1.970 -4.899 1.00 0.00 H new ATOM 0 HE ARG B 339 -4.345 -4.173 -6.348 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -6.103 -1.604 -4.730 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -7.458 -1.642 -5.863 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -6.097 -4.218 -7.793 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -7.455 -3.109 -7.582 1.00 0.00 H new ATOM 915 N VAL B 340 -3.306 -8.465 -2.605 1.00 0.00 N ATOM 916 CA VAL B 340 -3.786 -9.828 -2.592 1.00 0.00 C ATOM 917 C VAL B 340 -5.169 -9.923 -1.974 1.00 0.00 C ATOM 918 O VAL B 340 -5.533 -9.130 -1.112 1.00 0.00 O ATOM 919 CB VAL B 340 -2.792 -10.715 -1.852 1.00 0.00 C ATOM 920 CG1 VAL B 340 -3.035 -12.157 -2.234 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.382 -10.325 -2.249 1.00 0.00 C ATOM 0 H VAL B 340 -2.923 -8.148 -1.715 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.871 -10.176 -3.622 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.918 -10.592 -0.776 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.327 -12.797 -1.708 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -4.052 -12.439 -1.961 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.902 -12.276 -3.309 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.668 -10.957 -1.722 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.258 -10.455 -3.324 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.206 -9.282 -1.987 1.00 0.00 H new ATOM 931 N ASP B 341 -5.944 -10.891 -2.451 1.00 0.00 N ATOM 932 CA ASP B 341 -7.304 -11.081 -1.978 1.00 0.00 C ATOM 933 C ASP B 341 -7.336 -12.004 -0.773 1.00 0.00 C ATOM 934 O ASP B 341 -7.457 -13.212 -0.911 1.00 0.00 O ATOM 935 CB ASP B 341 -8.168 -11.664 -3.095 1.00 0.00 C ATOM 936 CG ASP B 341 -9.645 -11.537 -2.734 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.931 -11.047 -1.653 1.00 0.00 O ATOM 938 OD2 ASP B 341 -10.468 -11.932 -3.543 1.00 0.00 O1- ATOM 0 H ASP B 341 -5.650 -11.556 -3.166 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.700 -10.110 -1.680 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.968 -11.142 -4.031 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.913 -12.712 -3.254 1.00 0.00 H new ATOM 943 N GLU B 342 -7.238 -11.407 0.401 1.00 0.00 N ATOM 944 CA GLU B 342 -7.264 -12.147 1.660 1.00 0.00 C ATOM 945 C GLU B 342 -8.215 -13.328 1.568 1.00 0.00 C ATOM 946 O GLU B 342 -8.043 -14.344 2.241 1.00 0.00 O ATOM 947 CB GLU B 342 -7.752 -11.196 2.762 1.00 0.00 C ATOM 948 CG GLU B 342 -7.079 -11.499 4.100 1.00 0.00 C ATOM 949 CD GLU B 342 -8.106 -11.412 5.225 1.00 0.00 C ATOM 950 OE1 GLU B 342 -8.596 -10.322 5.469 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.387 -12.437 5.824 1.00 0.00 O ATOM 0 H GLU B 342 -7.138 -10.398 0.514 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.265 -12.523 1.881 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.544 -10.166 2.474 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.833 -11.285 2.869 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.634 -12.494 4.077 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.269 -10.792 4.279 1.00 0.00 H new ATOM 958 N LYS B 343 -9.215 -13.172 0.728 1.00 0.00 N ATOM 959 CA LYS B 343 -10.214 -14.204 0.524 1.00 0.00 C ATOM 960 C LYS B 343 -9.625 -15.417 -0.188 1.00 0.00 C ATOM 961 O LYS B 343 -9.915 -16.558 0.172 1.00 0.00 O ATOM 962 CB LYS B 343 -11.351 -13.641 -0.322 1.00 0.00 C ATOM 963 CG LYS B 343 -12.058 -12.529 0.450 1.00 0.00 C ATOM 964 CD LYS B 343 -12.915 -11.708 -0.514 1.00 0.00 C ATOM 965 CE LYS B 343 -14.093 -11.092 0.244 1.00 0.00 C ATOM 966 NZ LYS B 343 -13.689 -10.816 1.652 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.360 -12.331 0.169 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.579 -14.520 1.501 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -10.961 -13.254 -1.263 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -12.059 -14.432 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.682 -12.956 1.235 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.325 -11.888 0.939 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.314 -10.923 -0.972 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.281 -12.342 -1.322 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.409 -10.169 -0.242 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.946 -11.771 0.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.256 -10.029 2.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.848 -11.665 2.231 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -12.681 -10.561 1.680 1.00 0.00 H new ATOM 980 N THR B 344 -8.829 -15.159 -1.222 1.00 0.00 N ATOM 981 CA THR B 344 -8.241 -16.235 -2.009 1.00 0.00 C ATOM 982 C THR B 344 -6.723 -16.265 -1.906 1.00 0.00 C ATOM 983 O THR B 344 -6.102 -17.262 -2.269 1.00 0.00 O ATOM 984 CB THR B 344 -8.633 -16.057 -3.469 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.587 -15.393 -4.156 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.918 -15.233 -3.561 1.00 0.00 C ATOM 0 H THR B 344 -8.578 -14.220 -1.532 1.00 0.00 H new ATOM 0 HA THR B 344 -8.620 -17.177 -1.613 1.00 0.00 H new ATOM 0 HB THR B 344 -8.804 -17.033 -3.923 1.00 0.00 H new ATOM 0 HG1 THR B 344 -7.424 -14.521 -3.739 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.196 -15.108 -4.608 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.720 -15.749 -3.032 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.756 -14.255 -3.109 1.00 0.00 H new ATOM 994 N LYS B 345 -6.125 -15.177 -1.434 1.00 0.00 N ATOM 995 CA LYS B 345 -4.682 -15.115 -1.319 1.00 0.00 C ATOM 996 C LYS B 345 -4.059 -14.872 -2.690 1.00 0.00 C ATOM 997 O LYS B 345 -2.841 -14.751 -2.813 1.00 0.00 O ATOM 998 CB LYS B 345 -4.151 -16.417 -0.737 1.00 0.00 C ATOM 999 CG LYS B 345 -2.883 -16.145 0.077 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.351 -17.462 0.649 1.00 0.00 C ATOM 1001 CE LYS B 345 -2.098 -17.303 2.149 1.00 0.00 C ATOM 1002 NZ LYS B 345 -3.399 -17.140 2.860 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.615 -14.336 -1.129 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.416 -14.292 -0.656 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.909 -16.878 -0.103 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -3.934 -17.122 -1.539 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -2.126 -15.678 -0.554 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -3.100 -15.446 0.885 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -3.069 -18.263 0.474 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.428 -17.744 0.142 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -1.568 -18.175 2.533 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -1.461 -16.437 2.331 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -3.296 -17.449 3.848 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -3.684 -16.140 2.838 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -4.126 -17.717 2.391 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.903 -14.778 -3.717 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.412 -14.516 -5.055 1.00 0.00 C ATOM 1018 C GLU B 346 -4.132 -13.039 -5.213 1.00 0.00 C ATOM 1019 O GLU B 346 -4.659 -12.212 -4.470 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.432 -14.934 -6.099 1.00 0.00 C ATOM 1021 CG GLU B 346 -6.562 -13.906 -6.137 1.00 0.00 C ATOM 1022 CD GLU B 346 -7.850 -14.557 -6.630 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -7.770 -15.645 -7.177 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -8.898 -13.957 -6.456 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.915 -14.879 -3.643 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.498 -15.093 -5.200 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -4.959 -15.008 -7.078 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -5.830 -15.921 -5.862 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -6.715 -13.487 -5.143 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.289 -13.079 -6.793 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.290 -12.721 -6.166 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.921 -11.333 -6.399 1.00 0.00 C ATOM 1033 C VAL B 347 -3.858 -10.641 -7.362 1.00 0.00 C ATOM 1034 O VAL B 347 -4.180 -11.159 -8.432 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.492 -11.226 -6.903 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.170 -9.753 -7.189 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.570 -11.736 -5.809 1.00 0.00 C ATOM 0 H VAL B 347 -2.847 -13.393 -6.792 1.00 0.00 H new ATOM 0 HA VAL B 347 -3.001 -10.827 -5.437 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.362 -11.809 -7.815 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.145 -9.668 -7.551 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.855 -9.371 -7.946 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.280 -9.172 -6.273 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.465 -11.670 -6.145 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.699 -11.130 -4.912 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.813 -12.774 -5.583 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.261 -9.442 -6.974 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.129 -8.634 -7.801 1.00 0.00 C ATOM 1049 C ILE B 348 -4.287 -7.572 -8.479 1.00 0.00 C ATOM 1050 O ILE B 348 -4.608 -7.108 -9.572 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.213 -7.972 -6.948 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -7.029 -9.051 -6.233 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.136 -7.143 -7.842 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.807 -8.417 -5.078 1.00 0.00 C ATOM 0 H ILE B 348 -3.998 -9.010 -6.088 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.618 -9.262 -8.546 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.745 -7.321 -6.210 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.717 -9.526 -6.933 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.369 -9.832 -5.856 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -7.907 -6.673 -7.232 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.555 -6.373 -8.350 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.604 -7.792 -8.582 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.389 -9.184 -4.567 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.109 -7.963 -4.375 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.478 -7.652 -5.468 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.205 -7.177 -7.808 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.338 -6.159 -8.351 1.00 0.00 C ATOM 1068 C GLN B 349 -0.883 -6.430 -8.038 1.00 0.00 C ATOM 1069 O GLN B 349 -0.552 -7.112 -7.071 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.704 -4.843 -7.731 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.830 -3.734 -8.304 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.525 -2.385 -8.150 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -2.442 -1.743 -7.015 1.00 0.00 O flip ATOM 1074 NE2 GLN B 349 -3.162 -1.902 -9.086 1.00 0.00 N flip ATOM 0 H GLN B 349 -2.920 -7.547 -6.901 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.465 -6.151 -9.434 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.755 -4.623 -7.920 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.578 -4.894 -6.649 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -0.868 -3.717 -7.791 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.626 -3.929 -9.357 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -3.226 -2.404 -9.972 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -3.625 -1.000 -8.976 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.022 -5.841 -8.849 1.00 0.00 N ATOM 1084 CA GLU B 350 1.413 -5.964 -8.653 1.00 0.00 C ATOM 1085 C GLU B 350 2.127 -4.695 -9.064 1.00 0.00 C ATOM 1086 O GLU B 350 1.715 -4.000 -9.993 1.00 0.00 O ATOM 1087 CB GLU B 350 2.021 -7.090 -9.478 1.00 0.00 C ATOM 1088 CG GLU B 350 1.432 -8.434 -9.074 1.00 0.00 C ATOM 1089 CD GLU B 350 1.880 -9.521 -10.044 1.00 0.00 C ATOM 1090 OE1 GLU B 350 2.982 -10.015 -9.882 1.00 0.00 O ATOM 1091 OE2 GLU B 350 1.110 -9.844 -10.935 1.00 0.00 O1- ATOM 0 H GLU B 350 -0.292 -5.272 -9.651 1.00 0.00 H new ATOM 0 HA GLU B 350 1.543 -6.170 -7.591 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.837 -6.911 -10.537 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.102 -7.105 -9.340 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.748 -8.688 -8.062 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.344 -8.373 -9.063 1.00 0.00 H new ATOM 1098 N TRP B 351 3.231 -4.438 -8.395 1.00 0.00 N ATOM 1099 CA TRP B 351 4.056 -3.282 -8.717 1.00 0.00 C ATOM 1100 C TRP B 351 5.449 -3.441 -8.162 1.00 0.00 C ATOM 1101 O TRP B 351 5.622 -3.867 -7.038 1.00 0.00 O ATOM 1102 CB TRP B 351 3.459 -2.006 -8.177 1.00 0.00 C ATOM 1103 CG TRP B 351 4.263 -0.886 -8.720 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.213 -0.223 -8.041 1.00 0.00 C ATOM 1105 CD2 TRP B 351 4.234 -0.313 -10.055 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.754 0.740 -8.865 1.00 0.00 N ATOM 1107 CE2 TRP B 351 5.183 0.729 -10.115 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.475 -0.589 -11.198 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 5.378 1.482 -11.271 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.665 0.168 -12.373 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.616 1.204 -12.404 1.00 0.00 C ATOM 0 H TRP B 351 3.581 -5.009 -7.626 1.00 0.00 H new ATOM 0 HA TRP B 351 4.100 -3.221 -9.804 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.415 -1.912 -8.477 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.479 -2.002 -7.087 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.505 -0.413 -7.019 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.491 1.385 -8.581 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.743 -1.383 -11.180 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 6.113 2.273 -11.289 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 3.078 -0.049 -13.253 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.755 1.783 -13.305 1.00 0.00 H new ATOM 1122 N SER B 352 6.437 -3.090 -8.969 1.00 0.00 N ATOM 1123 CA SER B 352 7.822 -3.205 -8.569 1.00 0.00 C ATOM 1124 C SER B 352 8.093 -2.456 -7.285 1.00 0.00 C ATOM 1125 O SER B 352 7.648 -1.327 -7.094 1.00 0.00 O ATOM 1126 CB SER B 352 8.738 -2.660 -9.651 1.00 0.00 C ATOM 1127 OG SER B 352 7.957 -2.026 -10.655 1.00 0.00 O ATOM 0 H SER B 352 6.300 -2.721 -9.910 1.00 0.00 H new ATOM 0 HA SER B 352 8.021 -4.265 -8.411 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.444 -1.950 -9.221 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.325 -3.468 -10.087 1.00 0.00 H new ATOM 0 HG SER B 352 7.622 -2.700 -11.283 1.00 0.00 H new ATOM 1133 N LEU B 353 8.866 -3.086 -6.427 1.00 0.00 N ATOM 1134 CA LEU B 353 9.251 -2.488 -5.185 1.00 0.00 C ATOM 1135 C LEU B 353 10.371 -1.511 -5.500 1.00 0.00 C ATOM 1136 O LEU B 353 10.455 -0.418 -4.940 1.00 0.00 O ATOM 1137 CB LEU B 353 9.715 -3.609 -4.253 1.00 0.00 C ATOM 1138 CG LEU B 353 9.379 -3.302 -2.798 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.539 -4.560 -1.976 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.342 -2.270 -2.265 1.00 0.00 C ATOM 0 H LEU B 353 9.240 -4.023 -6.578 1.00 0.00 H new ATOM 0 HA LEU B 353 8.438 -1.953 -4.694 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.242 -4.546 -4.546 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.791 -3.748 -4.357 1.00 0.00 H new ATOM 0 HG LEU B 353 8.356 -2.931 -2.737 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.300 -4.347 -0.934 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.865 -5.329 -2.353 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.568 -4.913 -2.047 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.101 -2.051 -1.225 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.360 -2.655 -2.329 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.261 -1.358 -2.856 1.00 0.00 H new ATOM 1152 N THR B 354 11.192 -1.900 -6.469 1.00 0.00 N ATOM 1153 CA THR B 354 12.277 -1.041 -6.924 1.00 0.00 C ATOM 1154 C THR B 354 11.722 0.079 -7.785 1.00 0.00 C ATOM 1155 O THR B 354 12.477 0.812 -8.424 1.00 0.00 O ATOM 1156 CB THR B 354 13.301 -1.855 -7.720 1.00 0.00 C ATOM 1157 OG1 THR B 354 14.524 -1.135 -7.795 1.00 0.00 O ATOM 1158 CG2 THR B 354 12.770 -2.107 -9.130 1.00 0.00 C ATOM 0 H THR B 354 11.128 -2.797 -6.951 1.00 0.00 H new ATOM 0 HA THR B 354 12.773 -0.611 -6.054 1.00 0.00 H new ATOM 0 HB THR B 354 13.471 -2.809 -7.222 1.00 0.00 H new ATOM 0 HG1 THR B 354 14.342 -0.206 -8.050 1.00 0.00 H new ATOM 0 HG21 THR B 354 13.500 -2.686 -9.695 1.00 0.00 H new ATOM 0 HG22 THR B 354 11.833 -2.661 -9.072 1.00 0.00 H new ATOM 0 HG23 THR B 354 12.598 -1.154 -9.630 1.00 0.00 H new ATOM 1166 N ASN B 355 10.398 0.219 -7.777 1.00 0.00 N ATOM 1167 CA ASN B 355 9.754 1.279 -8.548 1.00 0.00 C ATOM 1168 C ASN B 355 9.073 2.264 -7.620 1.00 0.00 C ATOM 1169 O ASN B 355 8.519 3.269 -8.067 1.00 0.00 O ATOM 1170 CB ASN B 355 8.715 0.705 -9.504 1.00 0.00 C ATOM 1171 CG ASN B 355 9.398 0.148 -10.747 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.590 -0.376 -10.647 1.00 0.00 O flip ATOM 1173 ND2 ASN B 355 8.833 0.190 -11.840 1.00 0.00 N flip ATOM 0 H ASN B 355 9.758 -0.379 -7.253 1.00 0.00 H new ATOM 0 HA ASN B 355 10.528 1.786 -9.124 1.00 0.00 H new ATOM 0 HB2 ASN B 355 8.148 -0.083 -9.007 1.00 0.00 H new ATOM 0 HB3 ASN B 355 8.003 1.480 -9.787 1.00 0.00 H new ATOM 0 HD21 ASN B 355 7.902 0.599 -11.917 1.00 0.00 H new ATOM 0 HD22 ASN B 355 9.296 -0.185 -12.668 1.00 0.00 H new ATOM 1180 N ILE B 356 9.104 1.973 -6.328 1.00 0.00 N ATOM 1181 CA ILE B 356 8.468 2.852 -5.372 1.00 0.00 C ATOM 1182 C ILE B 356 9.060 4.257 -5.448 1.00 0.00 C ATOM 1183 O ILE B 356 10.239 4.423 -5.760 1.00 0.00 O ATOM 1184 CB ILE B 356 8.640 2.266 -3.986 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.771 1.010 -3.877 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.198 3.294 -2.958 1.00 0.00 C ATOM 1187 CD1 ILE B 356 8.038 0.294 -2.553 1.00 0.00 C ATOM 0 H ILE B 356 9.555 1.150 -5.928 1.00 0.00 H new ATOM 0 HA ILE B 356 7.406 2.936 -5.602 1.00 0.00 H new ATOM 0 HB ILE B 356 9.683 2.005 -3.806 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.718 1.281 -3.946 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.983 0.340 -4.710 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.318 2.882 -1.956 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.808 4.192 -3.056 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.151 3.547 -3.123 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.414 -0.597 -2.489 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.088 0.006 -2.500 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.803 0.962 -1.724 1.00 0.00 H new ATOM 1199 N LYS B 357 8.236 5.267 -5.157 1.00 0.00 N ATOM 1200 CA LYS B 357 8.700 6.653 -5.195 1.00 0.00 C ATOM 1201 C LYS B 357 8.837 7.165 -3.770 1.00 0.00 C ATOM 1202 O LYS B 357 9.852 7.753 -3.395 1.00 0.00 O ATOM 1203 CB LYS B 357 7.717 7.517 -6.000 1.00 0.00 C ATOM 1204 CG LYS B 357 8.467 8.686 -6.641 1.00 0.00 C ATOM 1205 CD LYS B 357 7.492 9.836 -6.905 1.00 0.00 C ATOM 1206 CE LYS B 357 7.931 10.602 -8.155 1.00 0.00 C ATOM 1207 NZ LYS B 357 7.398 9.917 -9.366 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.257 5.152 -4.896 1.00 0.00 H new ATOM 0 HA LYS B 357 9.671 6.708 -5.687 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.235 6.915 -6.770 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.928 7.892 -5.348 1.00 0.00 H new ATOM 0 HG2 LYS B 357 9.270 9.020 -5.984 1.00 0.00 H new ATOM 0 HG3 LYS B 357 8.930 8.366 -7.575 1.00 0.00 H new ATOM 0 HD2 LYS B 357 6.483 9.447 -7.040 1.00 0.00 H new ATOM 0 HD3 LYS B 357 7.463 10.507 -6.046 1.00 0.00 H new ATOM 0 HE2 LYS B 357 7.566 11.628 -8.113 1.00 0.00 H new ATOM 0 HE3 LYS B 357 9.019 10.652 -8.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 7.439 10.566 -10.178 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 7.971 9.073 -9.568 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 6.411 9.634 -9.199 1.00 0.00 H new ATOM 1221 N ARG B 358 7.820 6.876 -2.971 1.00 0.00 N ATOM 1222 CA ARG B 358 7.814 7.236 -1.567 1.00 0.00 C ATOM 1223 C ARG B 358 6.563 6.645 -0.920 1.00 0.00 C ATOM 1224 O ARG B 358 5.484 6.677 -1.493 1.00 0.00 O ATOM 1225 CB ARG B 358 7.848 8.753 -1.389 1.00 0.00 C ATOM 1226 CG ARG B 358 6.846 9.417 -2.323 1.00 0.00 C ATOM 1227 CD ARG B 358 7.092 10.918 -2.353 1.00 0.00 C ATOM 1228 NE ARG B 358 5.825 11.636 -2.285 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.690 12.849 -2.814 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.706 13.429 -3.392 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.538 13.461 -2.749 1.00 0.00 N1+ ATOM 0 H ARG B 358 6.980 6.387 -3.280 1.00 0.00 H new ATOM 0 HA ARG B 358 8.705 6.834 -1.085 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.617 9.010 -0.355 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.851 9.128 -1.594 1.00 0.00 H new ATOM 0 HG2 ARG B 358 6.940 9.003 -3.327 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.830 9.212 -1.987 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.728 11.207 -1.516 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.624 11.189 -3.265 1.00 0.00 H new ATOM 0 HE ARG B 358 5.027 11.200 -1.823 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.606 12.952 -3.439 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.600 14.359 -3.797 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.745 13.009 -2.294 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.431 14.391 -3.154 1.00 0.00 H new ATOM 1245 N TRP B 359 6.722 6.074 0.254 1.00 0.00 N ATOM 1246 CA TRP B 359 5.614 5.446 0.946 1.00 0.00 C ATOM 1247 C TRP B 359 5.367 6.134 2.273 1.00 0.00 C ATOM 1248 O TRP B 359 6.099 7.053 2.640 1.00 0.00 O ATOM 1249 CB TRP B 359 5.920 3.960 1.131 1.00 0.00 C ATOM 1250 CG TRP B 359 7.227 3.776 1.823 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.376 3.330 3.081 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.559 4.021 1.315 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.725 3.275 3.383 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.496 3.712 2.327 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.036 4.486 0.088 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.867 3.866 2.122 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.411 4.644 -0.125 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.326 4.339 0.894 1.00 0.00 C ATOM 0 H TRP B 359 7.611 6.031 0.752 1.00 0.00 H new ATOM 0 HA TRP B 359 4.703 5.542 0.356 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.126 3.489 1.711 1.00 0.00 H new ATOM 0 HB3 TRP B 359 5.943 3.464 0.161 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.572 3.058 3.749 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.102 2.952 4.274 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.340 4.725 -0.702 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.566 3.621 2.908 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.769 5.003 -1.079 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.385 4.471 0.727 1.00 0.00 H new ATOM 1269 N ALA B 360 4.320 5.727 2.981 1.00 0.00 N ATOM 1270 CA ALA B 360 4.013 6.384 4.241 1.00 0.00 C ATOM 1271 C ALA B 360 3.189 5.499 5.154 1.00 0.00 C ATOM 1272 O ALA B 360 1.966 5.421 5.043 1.00 0.00 O ATOM 1273 CB ALA B 360 3.258 7.681 3.979 1.00 0.00 C ATOM 0 H ALA B 360 3.689 4.971 2.715 1.00 0.00 H new ATOM 0 HA ALA B 360 4.959 6.595 4.739 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.031 8.168 4.927 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.873 8.343 3.369 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.329 7.461 3.453 1.00 0.00 H new ATOM 1279 N ALA B 361 3.879 4.854 6.067 1.00 0.00 N ATOM 1280 CA ALA B 361 3.242 3.984 7.029 1.00 0.00 C ATOM 1281 C ALA B 361 2.649 4.791 8.179 1.00 0.00 C ATOM 1282 O ALA B 361 3.239 5.779 8.619 1.00 0.00 O ATOM 1283 CB ALA B 361 4.251 2.991 7.577 1.00 0.00 C ATOM 0 H ALA B 361 4.892 4.917 6.164 1.00 0.00 H new ATOM 0 HA ALA B 361 2.438 3.448 6.525 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.763 2.339 8.301 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.651 2.391 6.760 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.064 3.530 8.064 1.00 0.00 H new ATOM 1289 N SER B 362 1.485 4.367 8.664 1.00 0.00 N ATOM 1290 CA SER B 362 0.826 5.051 9.760 1.00 0.00 C ATOM 1291 C SER B 362 0.436 4.038 10.839 1.00 0.00 C ATOM 1292 O SER B 362 0.603 2.834 10.647 1.00 0.00 O ATOM 1293 CB SER B 362 -0.407 5.772 9.223 1.00 0.00 C ATOM 1294 OG SER B 362 -0.395 5.727 7.802 1.00 0.00 O ATOM 0 H SER B 362 0.983 3.552 8.312 1.00 0.00 H new ATOM 0 HA SER B 362 1.500 5.783 10.206 1.00 0.00 H new ATOM 0 HB2 SER B 362 -1.313 5.302 9.606 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.416 6.807 9.566 1.00 0.00 H new ATOM 0 HG SER B 362 -0.230 4.808 7.505 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.067 4.486 11.964 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.464 3.575 13.073 1.00 0.00 C ATOM 1302 C PRO B 363 -1.796 2.890 12.803 1.00 0.00 C ATOM 1303 O PRO B 363 -2.211 2.002 13.542 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.582 4.491 14.287 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.763 5.880 13.762 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.317 5.896 12.298 1.00 0.00 C ATOM 0 HA PRO B 363 0.260 2.771 13.206 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.427 4.200 14.911 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.311 4.426 14.909 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.806 6.186 13.846 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.175 6.588 14.347 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.086 6.324 11.655 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.581 6.499 12.165 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.460 3.329 11.747 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.758 2.782 11.372 1.00 0.00 C ATOM 1316 C LYS B 364 -3.786 2.420 9.903 1.00 0.00 C ATOM 1317 O LYS B 364 -4.610 1.623 9.465 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.849 3.809 11.628 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.658 4.414 13.015 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.880 5.258 13.381 1.00 0.00 C ATOM 1321 CE LYS B 364 -6.848 4.421 14.221 1.00 0.00 C ATOM 1322 NZ LYS B 364 -8.108 5.188 14.436 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.121 4.067 11.130 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.928 1.888 11.972 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.813 4.591 10.870 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.830 3.340 11.556 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.517 3.623 13.751 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.759 5.031 13.033 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -5.570 6.142 13.938 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.377 5.609 12.476 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -7.064 3.479 13.716 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -6.393 4.172 15.180 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -8.767 4.621 15.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -7.894 6.075 14.935 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -8.544 5.404 13.517 1.00 0.00 H new ATOM 1336 N SER B 365 -2.899 3.029 9.141 1.00 0.00 N ATOM 1337 CA SER B 365 -2.859 2.782 7.714 1.00 0.00 C ATOM 1338 C SER B 365 -1.468 2.929 7.162 1.00 0.00 C ATOM 1339 O SER B 365 -0.557 3.400 7.836 1.00 0.00 O ATOM 1340 CB SER B 365 -3.789 3.746 6.991 1.00 0.00 C ATOM 1341 OG SER B 365 -3.357 5.082 7.222 1.00 0.00 O ATOM 0 H SER B 365 -2.203 3.692 9.482 1.00 0.00 H new ATOM 0 HA SER B 365 -3.185 1.755 7.551 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.792 3.533 5.922 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.812 3.616 7.345 1.00 0.00 H new ATOM 0 HG SER B 365 -3.954 5.704 6.756 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.317 2.515 5.920 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.035 2.605 5.261 1.00 0.00 C ATOM 1349 C PHE B 366 -0.254 2.976 3.816 1.00 0.00 C ATOM 1350 O PHE B 366 -1.358 2.814 3.296 1.00 0.00 O ATOM 1351 CB PHE B 366 0.715 1.292 5.436 1.00 0.00 C ATOM 1352 CG PHE B 366 1.473 0.918 4.199 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.755 1.431 3.983 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.909 0.017 3.292 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.476 1.036 2.849 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.622 -0.369 2.158 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.904 0.135 1.937 1.00 0.00 C ATOM 0 H PHE B 366 -2.063 2.115 5.351 1.00 0.00 H new ATOM 0 HA PHE B 366 0.585 3.384 5.705 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.406 1.377 6.275 1.00 0.00 H new ATOM 0 HB3 PHE B 366 0.009 0.500 5.684 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.187 2.128 4.686 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.079 -0.380 3.470 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.469 1.424 2.677 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.182 -1.057 1.451 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.458 -0.169 1.061 1.00 0.00 H new ATOM 1367 N THR B 367 0.753 3.560 3.190 1.00 0.00 N ATOM 1368 CA THR B 367 0.562 4.038 1.837 1.00 0.00 C ATOM 1369 C THR B 367 1.820 3.950 1.004 1.00 0.00 C ATOM 1370 O THR B 367 2.928 3.910 1.524 1.00 0.00 O ATOM 1371 CB THR B 367 0.090 5.485 1.901 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.205 5.537 2.482 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.056 6.079 0.499 1.00 0.00 C ATOM 0 H THR B 367 1.682 3.710 3.583 1.00 0.00 H new ATOM 0 HA THR B 367 -0.180 3.402 1.355 1.00 0.00 H new ATOM 0 HB THR B 367 0.781 6.064 2.514 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.508 6.468 2.524 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.282 7.114 0.550 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.055 6.045 0.065 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.630 5.504 -0.123 1.00 0.00 H new ATOM 1381 N LEU B 368 1.611 3.903 -0.300 1.00 0.00 N ATOM 1382 CA LEU B 368 2.690 3.795 -1.255 1.00 0.00 C ATOM 1383 C LEU B 368 2.570 4.834 -2.346 1.00 0.00 C ATOM 1384 O LEU B 368 1.470 5.074 -2.819 1.00 0.00 O ATOM 1385 CB LEU B 368 2.571 2.452 -1.924 1.00 0.00 C ATOM 1386 CG LEU B 368 3.392 1.447 -1.166 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.850 0.049 -1.459 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.855 1.556 -1.585 1.00 0.00 C ATOM 0 H LEU B 368 0.684 3.939 -0.724 1.00 0.00 H new ATOM 0 HA LEU B 368 3.634 3.931 -0.728 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.527 2.139 -1.954 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.914 2.515 -2.957 1.00 0.00 H new ATOM 0 HG LEU B 368 3.328 1.640 -0.095 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.437 -0.690 -0.915 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.808 -0.011 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.917 -0.150 -2.529 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.447 0.826 -1.033 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.943 1.361 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.222 2.559 -1.368 1.00 0.00 H new ATOM 1400 N ASP B 369 3.696 5.393 -2.804 1.00 0.00 N ATOM 1401 CA ASP B 369 3.638 6.339 -3.907 1.00 0.00 C ATOM 1402 C ASP B 369 4.437 5.832 -5.092 1.00 0.00 C ATOM 1403 O ASP B 369 5.646 6.044 -5.186 1.00 0.00 O ATOM 1404 CB ASP B 369 4.202 7.693 -3.508 1.00 0.00 C ATOM 1405 CG ASP B 369 3.773 8.759 -4.505 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.770 8.465 -5.688 1.00 0.00 O ATOM 1407 OD2 ASP B 369 3.456 9.856 -4.073 1.00 0.00 O1- ATOM 0 H ASP B 369 4.630 5.210 -2.436 1.00 0.00 H new ATOM 0 HA ASP B 369 2.587 6.444 -4.175 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.855 7.959 -2.509 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.290 7.643 -3.465 1.00 0.00 H new ATOM 1412 N PHE B 370 3.738 5.197 -6.004 1.00 0.00 N ATOM 1413 CA PHE B 370 4.369 4.708 -7.236 1.00 0.00 C ATOM 1414 C PHE B 370 3.508 5.008 -8.452 1.00 0.00 C ATOM 1415 O PHE B 370 2.632 4.222 -8.810 1.00 0.00 O ATOM 1416 CB PHE B 370 4.614 3.205 -7.195 1.00 0.00 C ATOM 1417 CG PHE B 370 3.324 2.481 -6.926 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.793 2.530 -5.654 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.682 1.750 -7.931 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.608 1.849 -5.355 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.491 1.069 -7.647 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.952 1.117 -6.354 1.00 0.00 C ATOM 0 H PHE B 370 2.740 5.002 -5.930 1.00 0.00 H new ATOM 0 HA PHE B 370 5.323 5.229 -7.311 1.00 0.00 H new ATOM 0 HB2 PHE B 370 5.037 2.871 -8.142 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.342 2.968 -6.419 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.295 3.097 -4.884 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.104 1.711 -8.924 1.00 0.00 H new ATOM 0 HE1 PHE B 370 1.199 1.887 -4.356 1.00 0.00 H new ATOM 0 HE2 PHE B 370 0.990 0.509 -8.422 1.00 0.00 H new ATOM 0 HZ PHE B 370 0.035 0.592 -6.129 1.00 0.00 H new ATOM 1432 N GLY B 371 3.777 6.138 -9.094 1.00 0.00 N ATOM 1433 CA GLY B 371 3.024 6.518 -10.288 1.00 0.00 C ATOM 1434 C GLY B 371 2.581 7.966 -10.212 1.00 0.00 C ATOM 1435 O GLY B 371 1.748 8.417 -10.991 1.00 0.00 O ATOM 0 H GLY B 371 4.500 6.801 -8.815 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.641 6.369 -11.174 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.152 5.872 -10.394 1.00 0.00 H new ATOM 1439 N ASP B 372 3.135 8.672 -9.249 1.00 0.00 N ATOM 1440 CA ASP B 372 2.802 10.074 -9.035 1.00 0.00 C ATOM 1441 C ASP B 372 2.693 10.837 -10.347 1.00 0.00 C ATOM 1442 O ASP B 372 2.131 11.932 -10.384 1.00 0.00 O ATOM 1443 CB ASP B 372 3.876 10.723 -8.162 1.00 0.00 C ATOM 1444 CG ASP B 372 3.362 12.021 -7.548 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.878 12.855 -8.295 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.463 12.163 -6.341 1.00 0.00 O1- ATOM 0 H ASP B 372 3.823 8.299 -8.595 1.00 0.00 H new ATOM 0 HA ASP B 372 1.832 10.115 -8.540 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.174 10.034 -7.371 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.764 10.925 -8.760 1.00 0.00 H new ATOM 1451 N TYR B 373 3.204 10.261 -11.424 1.00 0.00 N ATOM 1452 CA TYR B 373 3.114 10.921 -12.709 1.00 0.00 C ATOM 1453 C TYR B 373 1.661 11.235 -12.978 1.00 0.00 C ATOM 1454 O TYR B 373 1.307 12.296 -13.493 1.00 0.00 O ATOM 1455 CB TYR B 373 3.682 10.011 -13.791 1.00 0.00 C ATOM 1456 CG TYR B 373 4.786 9.183 -13.184 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.922 9.815 -12.675 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.678 7.791 -13.134 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.956 9.058 -12.115 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.715 7.029 -12.575 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.854 7.664 -12.066 1.00 0.00 C ATOM 1462 OH TYR B 373 7.875 6.917 -11.515 1.00 0.00 O ATOM 0 H TYR B 373 3.675 9.357 -11.432 1.00 0.00 H new ATOM 0 HA TYR B 373 3.690 11.846 -12.709 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.901 9.366 -14.193 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.065 10.603 -14.622 1.00 0.00 H new ATOM 0 HD1 TYR B 373 6.003 10.891 -12.714 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.798 7.302 -13.525 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.833 9.550 -11.721 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.635 5.953 -12.537 1.00 0.00 H new ATOM 0 HH TYR B 373 7.645 5.965 -11.559 1.00 0.00 H new ATOM 1472 N GLN B 374 0.830 10.310 -12.546 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.604 10.452 -12.638 1.00 0.00 C ATOM 1474 C GLN B 374 -1.152 10.239 -11.242 1.00 0.00 C ATOM 1475 O GLN B 374 -1.147 11.150 -10.413 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.181 9.406 -13.591 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.356 8.120 -13.500 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.242 6.913 -13.798 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -2.366 6.830 -13.303 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -0.801 5.970 -14.584 1.00 0.00 N ATOM 0 H GLN B 374 1.134 9.435 -12.119 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.874 11.435 -13.023 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.221 9.202 -13.337 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.171 9.785 -14.613 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.472 8.158 -14.208 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.079 8.026 -12.505 1.00 0.00 H new ATOM 0 HE21 GLN B 374 0.131 6.041 -14.993 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -1.388 5.162 -14.790 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.521 9.000 -10.963 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.955 8.627 -9.640 1.00 0.00 C ATOM 1491 C ASP B 375 -1.171 7.400 -9.215 1.00 0.00 C ATOM 1492 O ASP B 375 -1.511 6.270 -9.568 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.446 8.313 -9.641 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.029 8.507 -8.245 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.419 8.037 -7.298 1.00 0.00 O ATOM 1496 OD2 ASP B 375 -5.078 9.122 -8.143 1.00 0.00 O1- ATOM 0 H ASP B 375 -1.526 8.238 -11.641 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.780 9.449 -8.946 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.960 8.961 -10.351 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.608 7.287 -9.971 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.116 7.634 -8.475 1.00 0.00 N ATOM 1502 CA GLY B 376 0.733 6.545 -8.012 1.00 0.00 C ATOM 1503 C GLY B 376 0.453 6.170 -6.571 1.00 0.00 C ATOM 1504 O GLY B 376 1.114 5.298 -6.009 1.00 0.00 O ATOM 0 H GLY B 376 0.182 8.563 -8.177 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.581 5.673 -8.648 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.779 6.835 -8.113 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.460 6.884 -5.955 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.739 6.669 -4.548 1.00 0.00 C ATOM 1510 C TYR B 377 -1.751 5.579 -4.283 1.00 0.00 C ATOM 1511 O TYR B 377 -2.956 5.782 -4.433 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.218 7.959 -3.916 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.674 9.108 -4.717 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.657 9.083 -5.144 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.498 10.184 -5.049 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.165 10.135 -5.904 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -0.991 11.242 -5.808 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.341 11.220 -6.236 1.00 0.00 C ATOM 1519 OH TYR B 377 0.838 12.264 -6.987 1.00 0.00 O ATOM 0 H TYR B 377 -1.019 7.613 -6.398 1.00 0.00 H new ATOM 0 HA TYR B 377 0.199 6.340 -4.102 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.307 7.991 -3.898 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.880 8.023 -2.882 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.292 8.248 -4.885 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.526 10.199 -4.720 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.192 10.115 -6.237 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.627 12.076 -6.064 1.00 0.00 H new ATOM 0 HH TYR B 377 0.134 12.931 -7.126 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.247 4.448 -3.810 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.123 3.343 -3.430 1.00 0.00 C ATOM 1531 C TYR B 378 -1.965 3.088 -1.941 1.00 0.00 C ATOM 1532 O TYR B 378 -0.849 2.935 -1.447 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.800 2.085 -4.219 1.00 0.00 C ATOM 1534 CG TYR B 378 -3.005 1.704 -5.037 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.086 1.054 -4.431 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.042 2.011 -6.398 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.209 0.708 -5.194 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.163 1.666 -7.163 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.247 1.013 -6.561 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.355 0.674 -7.311 1.00 0.00 O ATOM 0 H TYR B 378 -0.251 4.270 -3.680 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.155 3.612 -3.656 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.942 2.257 -4.868 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.531 1.274 -3.543 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.055 0.820 -3.377 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.206 2.515 -6.861 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.045 0.207 -4.729 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.192 1.903 -8.216 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.221 0.957 -8.240 1.00 0.00 H new ATOM 1550 N SER B 379 -3.081 3.100 -1.220 1.00 0.00 N ATOM 1551 CA SER B 379 -3.034 2.922 0.222 1.00 0.00 C ATOM 1552 C SER B 379 -4.131 2.019 0.727 1.00 0.00 C ATOM 1553 O SER B 379 -5.121 1.761 0.041 1.00 0.00 O ATOM 1554 CB SER B 379 -3.168 4.269 0.915 1.00 0.00 C ATOM 1555 OG SER B 379 -3.061 4.084 2.315 1.00 0.00 O ATOM 0 H SER B 379 -4.016 3.229 -1.606 1.00 0.00 H new ATOM 0 HA SER B 379 -2.074 2.459 0.450 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.392 4.950 0.566 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.127 4.725 0.668 1.00 0.00 H new ATOM 0 HG SER B 379 -2.119 4.133 2.580 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.944 1.563 1.954 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.906 0.701 2.591 1.00 0.00 C ATOM 1563 C VAL B 380 -4.870 0.911 4.102 1.00 0.00 C ATOM 1564 O VAL B 380 -4.011 1.636 4.601 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.540 -0.728 2.275 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -5.056 -1.121 0.898 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -3.017 -0.848 2.306 1.00 0.00 C ATOM 0 H VAL B 380 -3.128 1.781 2.526 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.908 0.928 2.228 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.992 -1.393 3.010 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.782 -2.155 0.688 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.141 -1.021 0.874 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.615 -0.469 0.144 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.728 -1.874 2.080 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.584 -0.177 1.564 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.651 -0.578 3.296 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.789 0.273 4.832 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.807 0.423 6.283 1.00 0.00 C ATOM 1579 C GLN B 381 -5.173 -0.771 6.961 1.00 0.00 C ATOM 1580 O GLN B 381 -5.549 -1.920 6.740 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.227 0.581 6.781 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.324 1.743 7.766 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.782 1.997 8.127 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.424 1.153 8.753 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.349 3.115 7.766 1.00 0.00 N ATOM 0 H GLN B 381 -6.512 -0.337 4.451 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.232 1.316 6.529 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.897 0.754 5.939 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.554 -0.340 7.263 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.752 1.517 8.666 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.887 2.640 7.327 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.816 3.813 7.248 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.326 3.291 8.002 1.00 0.00 H new ATOM 1594 N THR B 382 -4.215 -0.463 7.794 1.00 0.00 N ATOM 1595 CA THR B 382 -3.494 -1.469 8.556 1.00 0.00 C ATOM 1596 C THR B 382 -2.932 -0.840 9.815 1.00 0.00 C ATOM 1597 O THR B 382 -2.379 0.256 9.764 1.00 0.00 O ATOM 1598 CB THR B 382 -2.363 -2.063 7.724 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.366 -2.584 8.591 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.753 -0.985 6.834 1.00 0.00 C ATOM 0 H THR B 382 -3.906 0.493 7.970 1.00 0.00 H new ATOM 0 HA THR B 382 -4.183 -2.270 8.823 1.00 0.00 H new ATOM 0 HB THR B 382 -2.757 -2.862 7.097 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.638 -2.968 8.059 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.945 -1.416 6.242 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.519 -0.587 6.168 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.358 -0.181 7.455 1.00 0.00 H new ATOM 1608 N THR B 383 -3.049 -1.522 10.938 1.00 0.00 N ATOM 1609 CA THR B 383 -2.521 -0.966 12.169 1.00 0.00 C ATOM 1610 C THR B 383 -1.061 -1.321 12.346 1.00 0.00 C ATOM 1611 O THR B 383 -0.481 -1.133 13.416 1.00 0.00 O ATOM 1612 CB THR B 383 -3.361 -1.392 13.359 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.951 -2.660 13.104 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.444 -0.334 13.535 1.00 0.00 C ATOM 0 H THR B 383 -3.492 -2.437 11.025 1.00 0.00 H new ATOM 0 HA THR B 383 -2.578 0.121 12.106 1.00 0.00 H new ATOM 0 HB THR B 383 -2.753 -1.480 14.260 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.491 -2.931 13.876 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.076 -0.598 14.383 1.00 0.00 H new ATOM 0 HG22 THR B 383 -3.980 0.635 13.717 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.052 -0.282 12.632 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.453 -1.742 11.250 1.00 0.00 N ATOM 1623 CA GLU B 384 0.973 -2.015 11.244 1.00 0.00 C ATOM 1624 C GLU B 384 1.555 -1.598 9.900 1.00 0.00 C ATOM 1625 O GLU B 384 1.741 -2.405 8.990 1.00 0.00 O ATOM 1626 CB GLU B 384 1.260 -3.502 11.503 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.024 -4.214 11.939 1.00 0.00 C ATOM 1628 CD GLU B 384 0.247 -5.701 12.149 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.671 -6.058 13.235 1.00 0.00 O ATOM 1630 OE2 GLU B 384 0.026 -6.458 11.218 1.00 0.00 O1- ATOM 0 H GLU B 384 -0.922 -1.901 10.358 1.00 0.00 H new ATOM 0 HA GLU B 384 1.440 -1.443 12.046 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.655 -3.967 10.600 1.00 0.00 H new ATOM 0 HB3 GLU B 384 2.023 -3.605 12.275 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.400 -3.771 12.861 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.798 -4.081 11.183 1.00 0.00 H new ATOM 1637 N GLY B 385 1.870 -0.320 9.806 1.00 0.00 N ATOM 1638 CA GLY B 385 2.471 0.227 8.608 1.00 0.00 C ATOM 1639 C GLY B 385 3.976 0.050 8.656 1.00 0.00 C ATOM 1640 O GLY B 385 4.575 -0.570 7.788 1.00 0.00 O ATOM 0 H GLY B 385 1.718 0.361 10.550 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.066 -0.272 7.728 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.224 1.285 8.517 1.00 0.00 H new ATOM 1644 N GLU B 386 4.567 0.629 9.690 1.00 0.00 N ATOM 1645 CA GLU B 386 6.008 0.579 9.888 1.00 0.00 C ATOM 1646 C GLU B 386 6.541 -0.809 9.636 1.00 0.00 C ATOM 1647 O GLU B 386 7.714 -0.992 9.365 1.00 0.00 O ATOM 1648 CB GLU B 386 6.331 0.988 11.316 1.00 0.00 C ATOM 1649 CG GLU B 386 5.424 0.220 12.275 1.00 0.00 C ATOM 1650 CD GLU B 386 5.785 0.564 13.716 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.716 1.330 13.905 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 5.125 0.059 14.609 1.00 0.00 O ATOM 0 H GLU B 386 4.064 1.145 10.413 1.00 0.00 H new ATOM 0 HA GLU B 386 6.479 1.263 9.182 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.377 0.778 11.539 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.187 2.061 11.441 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.381 0.470 12.082 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.530 -0.852 12.110 1.00 0.00 H new ATOM 1659 N GLN B 387 5.670 -1.777 9.710 1.00 0.00 N ATOM 1660 CA GLN B 387 6.077 -3.154 9.474 1.00 0.00 C ATOM 1661 C GLN B 387 6.097 -3.418 7.988 1.00 0.00 C ATOM 1662 O GLN B 387 6.985 -4.084 7.469 1.00 0.00 O ATOM 1663 CB GLN B 387 5.120 -4.122 10.169 1.00 0.00 C ATOM 1664 CG GLN B 387 5.295 -4.025 11.686 1.00 0.00 C ATOM 1665 CD GLN B 387 5.864 -5.332 12.227 1.00 0.00 C ATOM 1666 OE1 GLN B 387 6.780 -5.904 11.636 1.00 0.00 O ATOM 1667 NE2 GLN B 387 5.373 -5.844 13.323 1.00 0.00 N ATOM 0 H GLN B 387 4.682 -1.651 9.929 1.00 0.00 H new ATOM 0 HA GLN B 387 7.075 -3.308 9.885 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.091 -3.888 9.897 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.314 -5.142 9.836 1.00 0.00 H new ATOM 0 HG2 GLN B 387 5.962 -3.199 11.932 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.336 -3.812 12.159 1.00 0.00 H new ATOM 0 HE21 GLN B 387 4.614 -5.370 13.812 1.00 0.00 H new ATOM 0 HE22 GLN B 387 5.748 -6.718 13.690 1.00 0.00 H new ATOM 1676 N ILE B 388 5.120 -2.854 7.317 1.00 0.00 N ATOM 1677 CA ILE B 388 5.015 -2.973 5.876 1.00 0.00 C ATOM 1678 C ILE B 388 6.015 -2.033 5.213 1.00 0.00 C ATOM 1679 O ILE B 388 6.653 -2.365 4.216 1.00 0.00 O ATOM 1680 CB ILE B 388 3.616 -2.544 5.459 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.600 -3.618 5.823 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.577 -2.306 3.954 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.203 -2.995 5.822 1.00 0.00 C ATOM 0 H ILE B 388 4.378 -2.302 7.748 1.00 0.00 H new ATOM 0 HA ILE B 388 5.215 -4.002 5.577 1.00 0.00 H new ATOM 0 HB ILE B 388 3.365 -1.623 5.985 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.647 -4.440 5.109 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.827 -4.035 6.804 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.573 -1.999 3.660 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.288 -1.523 3.691 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.842 -3.226 3.433 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.466 -3.755 6.081 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.164 -2.187 6.553 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.982 -2.599 4.831 1.00 0.00 H new ATOM 1695 N ALA B 389 6.084 -0.838 5.774 1.00 0.00 N ATOM 1696 CA ALA B 389 6.934 0.229 5.264 1.00 0.00 C ATOM 1697 C ALA B 389 8.413 0.014 5.537 1.00 0.00 C ATOM 1698 O ALA B 389 9.239 0.278 4.673 1.00 0.00 O ATOM 1699 CB ALA B 389 6.509 1.531 5.915 1.00 0.00 C ATOM 0 H ALA B 389 5.549 -0.577 6.602 1.00 0.00 H new ATOM 0 HA ALA B 389 6.810 0.247 4.181 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.135 2.344 5.546 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.466 1.736 5.672 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.620 1.450 6.996 1.00 0.00 H new ATOM 1705 N GLN B 390 8.760 -0.425 6.737 1.00 0.00 N ATOM 1706 CA GLN B 390 10.178 -0.593 7.064 1.00 0.00 C ATOM 1707 C GLN B 390 10.810 -1.642 6.189 1.00 0.00 C ATOM 1708 O GLN B 390 11.980 -1.564 5.816 1.00 0.00 O ATOM 1709 CB GLN B 390 10.357 -1.016 8.513 1.00 0.00 C ATOM 1710 CG GLN B 390 9.781 -2.420 8.714 1.00 0.00 C ATOM 1711 CD GLN B 390 10.848 -3.468 8.418 1.00 0.00 C ATOM 1712 OE1 GLN B 390 10.615 -4.390 7.636 1.00 0.00 O ATOM 1713 NE2 GLN B 390 12.013 -3.381 9.000 1.00 0.00 N ATOM 0 H GLN B 390 8.108 -0.666 7.483 1.00 0.00 H new ATOM 0 HA GLN B 390 10.660 0.370 6.898 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.414 -1.005 8.778 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.856 -0.308 9.173 1.00 0.00 H new ATOM 0 HG2 GLN B 390 9.423 -2.532 9.737 1.00 0.00 H new ATOM 0 HG3 GLN B 390 8.923 -2.567 8.058 1.00 0.00 H new ATOM 0 HE21 GLN B 390 12.204 -2.616 9.647 1.00 0.00 H new ATOM 0 HE22 GLN B 390 12.733 -4.078 8.807 1.00 0.00 H new ATOM 1722 N LEU B 391 10.014 -2.623 5.890 1.00 0.00 N ATOM 1723 CA LEU B 391 10.436 -3.731 5.071 1.00 0.00 C ATOM 1724 C LEU B 391 10.549 -3.259 3.635 1.00 0.00 C ATOM 1725 O LEU B 391 11.609 -3.358 3.018 1.00 0.00 O ATOM 1726 CB LEU B 391 9.416 -4.847 5.292 1.00 0.00 C ATOM 1727 CG LEU B 391 8.597 -5.188 4.041 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.462 -5.931 3.013 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.435 -6.069 4.476 1.00 0.00 C ATOM 0 H LEU B 391 9.046 -2.683 6.207 1.00 0.00 H new ATOM 0 HA LEU B 391 11.420 -4.120 5.331 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.938 -5.743 5.630 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.736 -4.553 6.092 1.00 0.00 H new ATOM 0 HG LEU B 391 8.234 -4.274 3.571 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.862 -6.164 2.133 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.303 -5.302 2.723 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.836 -6.856 3.452 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.831 -6.330 3.607 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.821 -6.979 4.936 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.820 -5.530 5.197 1.00 0.00 H new ATOM 1741 N ILE B 392 9.475 -2.676 3.136 1.00 0.00 N ATOM 1742 CA ILE B 392 9.470 -2.112 1.820 1.00 0.00 C ATOM 1743 C ILE B 392 10.701 -1.263 1.738 1.00 0.00 C ATOM 1744 O ILE B 392 11.570 -1.461 0.901 1.00 0.00 O ATOM 1745 CB ILE B 392 8.226 -1.237 1.683 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.090 -2.056 1.072 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.518 -0.006 0.811 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.789 -1.263 1.143 1.00 0.00 C ATOM 0 H ILE B 392 8.591 -2.586 3.637 1.00 0.00 H new ATOM 0 HA ILE B 392 9.459 -2.868 1.035 1.00 0.00 H new ATOM 0 HB ILE B 392 7.931 -0.890 2.673 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.322 -2.301 0.035 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.981 -3.000 1.606 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.618 0.603 0.727 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.313 0.583 1.268 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.831 -0.329 -0.182 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.981 -1.850 0.706 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.555 -1.041 2.184 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.900 -0.331 0.589 1.00 0.00 H new ATOM 1760 N ALA B 393 10.758 -0.353 2.693 1.00 0.00 N ATOM 1761 CA ALA B 393 11.877 0.559 2.842 1.00 0.00 C ATOM 1762 C ALA B 393 13.187 -0.205 2.889 1.00 0.00 C ATOM 1763 O ALA B 393 14.225 0.282 2.443 1.00 0.00 O ATOM 1764 CB ALA B 393 11.742 1.310 4.146 1.00 0.00 C ATOM 0 H ALA B 393 10.025 -0.225 3.391 1.00 0.00 H new ATOM 0 HA ALA B 393 11.874 1.241 1.992 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.582 1.996 4.260 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.810 1.875 4.146 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.737 0.602 4.975 1.00 0.00 H new ATOM 1770 N GLY B 394 13.134 -1.399 3.472 1.00 0.00 N ATOM 1771 CA GLY B 394 14.332 -2.212 3.615 1.00 0.00 C ATOM 1772 C GLY B 394 14.581 -3.022 2.370 1.00 0.00 C ATOM 1773 O GLY B 394 15.680 -3.520 2.141 1.00 0.00 O ATOM 0 H GLY B 394 12.284 -1.819 3.848 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.190 -1.571 3.815 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.225 -2.877 4.472 1.00 0.00 H new ATOM 1777 N TYR B 395 13.546 -3.148 1.575 1.00 0.00 N ATOM 1778 CA TYR B 395 13.622 -3.894 0.349 1.00 0.00 C ATOM 1779 C TYR B 395 14.110 -2.982 -0.764 1.00 0.00 C ATOM 1780 O TYR B 395 14.916 -3.390 -1.593 1.00 0.00 O ATOM 1781 CB TYR B 395 12.247 -4.480 0.071 1.00 0.00 C ATOM 1782 CG TYR B 395 12.032 -5.775 0.863 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.803 -6.097 2.007 1.00 0.00 C ATOM 1784 CD2 TYR B 395 11.054 -6.678 0.428 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.583 -7.304 2.684 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.845 -7.885 1.105 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.610 -8.200 2.231 1.00 0.00 C ATOM 1788 OH TYR B 395 11.403 -9.389 2.896 1.00 0.00 O ATOM 0 H TYR B 395 12.632 -2.737 1.762 1.00 0.00 H new ATOM 0 HA TYR B 395 14.334 -4.716 0.419 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.478 -3.755 0.337 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.142 -4.680 -0.995 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.561 -5.412 2.358 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.455 -6.441 -0.439 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.168 -7.543 3.560 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.091 -8.575 0.756 1.00 0.00 H new ATOM 0 HH TYR B 395 10.690 -9.893 2.450 1.00 0.00 H new ATOM 1798 N ILE B 396 13.687 -1.726 -0.735 1.00 0.00 N ATOM 1799 CA ILE B 396 14.188 -0.774 -1.726 1.00 0.00 C ATOM 1800 C ILE B 396 15.641 -0.504 -1.463 1.00 0.00 C ATOM 1801 O ILE B 396 16.362 0.062 -2.285 1.00 0.00 O ATOM 1802 CB ILE B 396 13.436 0.554 -1.755 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.242 0.497 -0.829 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.965 0.822 -3.183 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.437 1.791 -0.944 1.00 0.00 C ATOM 0 H ILE B 396 13.021 -1.348 -0.062 1.00 0.00 H new ATOM 0 HA ILE B 396 14.033 -1.240 -2.699 1.00 0.00 H new ATOM 0 HB ILE B 396 14.098 1.354 -1.423 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.614 -0.357 -1.083 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.574 0.354 0.199 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.426 1.769 -3.217 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.828 0.872 -3.847 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.305 0.017 -3.505 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.578 1.746 -0.275 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.067 2.637 -0.669 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.092 1.915 -1.970 1.00 0.00 H new ATOM 1817 N ASP B 397 16.052 -0.931 -0.302 1.00 0.00 N ATOM 1818 CA ASP B 397 17.425 -0.743 0.132 1.00 0.00 C ATOM 1819 C ASP B 397 18.307 -1.770 -0.530 1.00 0.00 C ATOM 1820 O ASP B 397 19.523 -1.613 -0.638 1.00 0.00 O ATOM 1821 CB ASP B 397 17.501 -0.899 1.647 1.00 0.00 C ATOM 1822 CG ASP B 397 18.450 0.139 2.236 1.00 0.00 C ATOM 1823 OD1 ASP B 397 18.178 1.318 2.082 1.00 0.00 O ATOM 1824 OD2 ASP B 397 19.437 -0.261 2.833 1.00 0.00 O1- ATOM 0 H ASP B 397 15.458 -1.416 0.371 1.00 0.00 H new ATOM 0 HA ASP B 397 17.764 0.255 -0.147 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.508 -0.783 2.082 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.845 -1.902 1.900 1.00 0.00 H new ATOM 1829 N ILE B 398 17.666 -2.839 -0.934 1.00 0.00 N ATOM 1830 CA ILE B 398 18.332 -3.947 -1.556 1.00 0.00 C ATOM 1831 C ILE B 398 18.369 -3.815 -3.061 1.00 0.00 C ATOM 1832 O ILE B 398 19.426 -3.786 -3.691 1.00 0.00 O ATOM 1833 CB ILE B 398 17.540 -5.178 -1.189 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.533 -5.323 0.338 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.168 -6.391 -1.844 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.437 -6.290 0.800 1.00 0.00 C ATOM 0 H ILE B 398 16.658 -2.962 -0.838 1.00 0.00 H new ATOM 0 HA ILE B 398 19.366 -3.994 -1.214 1.00 0.00 H new ATOM 0 HB ILE B 398 16.512 -5.091 -1.541 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.505 -5.683 0.676 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.377 -4.347 0.798 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.598 -7.282 -1.581 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.163 -6.263 -2.926 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.195 -6.501 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.458 -6.371 1.887 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.464 -5.915 0.483 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.609 -7.272 0.359 1.00 0.00 H new ATOM 1848 N ILE B 399 17.175 -3.798 -3.614 1.00 0.00 N ATOM 1849 CA ILE B 399 16.976 -3.741 -5.046 1.00 0.00 C ATOM 1850 C ILE B 399 17.496 -2.448 -5.653 1.00 0.00 C ATOM 1851 O ILE B 399 17.731 -2.383 -6.860 1.00 0.00 O ATOM 1852 CB ILE B 399 15.488 -3.859 -5.306 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.823 -2.589 -4.795 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.947 -5.056 -4.528 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.383 -2.895 -4.350 1.00 0.00 C ATOM 0 H ILE B 399 16.308 -3.824 -3.077 1.00 0.00 H new ATOM 0 HA ILE B 399 17.533 -4.554 -5.511 1.00 0.00 H new ATOM 0 HB ILE B 399 15.289 -3.993 -6.369 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.392 -2.181 -3.960 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.818 -1.831 -5.578 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.876 -5.152 -4.707 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.453 -5.963 -4.858 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.125 -4.908 -3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.913 -1.982 -3.985 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.815 -3.282 -5.196 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.399 -3.638 -3.553 1.00 0.00 H new ATOM 1867 N LEU B 400 17.653 -1.408 -4.837 1.00 0.00 N ATOM 1868 CA LEU B 400 18.128 -0.134 -5.386 1.00 0.00 C ATOM 1869 C LEU B 400 19.353 -0.346 -6.272 1.00 0.00 C ATOM 1870 O LEU B 400 19.826 -1.468 -6.344 1.00 0.00 O ATOM 1871 CB LEU B 400 18.468 0.868 -4.281 1.00 0.00 C ATOM 1872 CG LEU B 400 19.254 0.183 -3.161 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.619 -0.289 -3.676 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.468 1.180 -2.022 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.801 0.620 -6.867 1.00 0.00 O ATOM 0 H LEU B 400 17.468 -1.414 -3.834 1.00 0.00 H new ATOM 0 HA LEU B 400 17.315 0.275 -5.985 1.00 0.00 H new ATOM 0 HB2 LEU B 400 19.053 1.690 -4.694 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.552 1.300 -3.879 1.00 0.00 H new ATOM 0 HG LEU B 400 18.691 -0.681 -2.809 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.165 -0.774 -2.867 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.475 -0.997 -4.492 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.188 0.568 -4.036 1.00 0.00 H new ATOM 0 HD21 LEU B 400 20.028 0.700 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU B 400 20.028 2.039 -2.391 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.502 1.512 -1.643 1.00 0.00 H new