USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 547 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 Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.363 K(o=-0.36,f=-1.2) USER MOD Single : A 26 ASN : amide:sc= -4.74! C(o=-4.7!,f=-4.7!) USER MOD Single : A 29 GLN : amide:sc=-0.000685 X(o=-0.00069,f=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.156 K(o=-0.16,f=-2.5!) USER MOD Single : A 45 GLN : amide:sc= -1.6 K(o=-1.6,f=-5.8!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -159:sc= -0.0545 (180deg=-0.406) USER MOD Single : A 56 THR OG1 : rot 170:sc= -3.83! USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 TYR OH : rot 50:sc= -2.97! USER MOD Single : A 66 SER OG : rot 180:sc= -0.199 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 30:sc= -0.297 USER MOD Single : A 85 ASN : amide:sc= -4.98! C(o=-5!,f=-12!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -1.53 K(o=-1.5,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 312 N THR A 21 11.899 36.775 35.716 1.00 0.00 N ATOM 313 CA THR A 21 12.158 38.178 35.994 1.00 0.00 C ATOM 314 C THR A 21 12.565 38.909 34.714 1.00 0.00 C ATOM 315 O THR A 21 12.177 40.057 34.499 1.00 0.00 O ATOM 316 CB THR A 21 13.213 38.254 37.099 1.00 0.00 C ATOM 317 OG1 THR A 21 12.462 38.528 38.278 1.00 0.00 O ATOM 318 CG2 THR A 21 14.131 39.469 36.950 1.00 0.00 C ATOM 0 HA THR A 21 11.259 38.684 36.347 1.00 0.00 H new ATOM 0 HB THR A 21 13.813 37.344 37.091 1.00 0.00 H new ATOM 0 HG1 THR A 21 13.069 38.592 39.045 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.861 39.475 37.760 1.00 0.00 H new ATOM 0 HG22 THR A 21 14.651 39.417 35.993 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.536 40.382 36.991 1.00 0.00 H new ATOM 326 N HIS A 22 13.343 38.215 33.896 1.00 0.00 N ATOM 327 CA HIS A 22 13.807 38.785 32.642 1.00 0.00 C ATOM 328 C HIS A 22 12.606 39.128 31.759 1.00 0.00 C ATOM 329 O HIS A 22 12.515 40.236 31.232 1.00 0.00 O ATOM 330 CB HIS A 22 14.799 37.845 31.954 1.00 0.00 C ATOM 331 CG HIS A 22 16.196 37.903 32.524 1.00 0.00 C ATOM 332 ND1 HIS A 22 16.708 36.919 33.352 1.00 0.00 N ATOM 333 CD2 HIS A 22 17.182 38.834 32.378 1.00 0.00 C ATOM 334 CE1 HIS A 22 17.947 37.254 33.684 1.00 0.00 C ATOM 335 NE2 HIS A 22 18.238 38.442 33.078 1.00 0.00 N ATOM 0 H HIS A 22 13.664 37.264 34.077 1.00 0.00 H new ATOM 0 HA HIS A 22 14.347 39.712 32.836 1.00 0.00 H new ATOM 0 HB2 HIS A 22 14.428 36.823 32.031 1.00 0.00 H new ATOM 0 HB3 HIS A 22 14.840 38.090 30.893 1.00 0.00 H new ATOM 0 HD2 HIS A 22 17.114 39.738 31.791 1.00 0.00 H new ATOM 0 HE1 HIS A 22 18.609 36.687 34.321 1.00 0.00 H new ATOM 0 HE2 HIS A 22 19.122 38.945 33.151 1.00 0.00 H new ATOM 343 N HIS A 23 11.714 38.159 31.624 1.00 0.00 N ATOM 344 CA HIS A 23 10.522 38.345 30.813 1.00 0.00 C ATOM 345 C HIS A 23 9.718 39.530 31.349 1.00 0.00 C ATOM 346 O HIS A 23 9.200 40.335 30.576 1.00 0.00 O ATOM 347 CB HIS A 23 9.703 37.054 30.747 1.00 0.00 C ATOM 348 CG HIS A 23 10.093 36.138 29.612 1.00 0.00 C ATOM 349 ND1 HIS A 23 9.589 36.275 28.330 1.00 0.00 N ATOM 350 CD2 HIS A 23 10.943 35.072 29.579 1.00 0.00 C ATOM 351 CE1 HIS A 23 10.118 35.328 27.569 1.00 0.00 C ATOM 352 NE2 HIS A 23 10.957 34.583 28.345 1.00 0.00 N ATOM 0 H HIS A 23 11.792 37.241 32.063 1.00 0.00 H new ATOM 0 HA HIS A 23 10.808 38.578 29.787 1.00 0.00 H new ATOM 0 HB2 HIS A 23 9.814 36.517 31.689 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.648 37.310 30.648 1.00 0.00 H new ATOM 0 HD2 HIS A 23 11.509 34.690 30.416 1.00 0.00 H new ATOM 0 HE1 HIS A 23 9.920 35.173 26.519 1.00 0.00 H new ATOM 0 HE2 HIS A 23 11.505 33.782 28.029 1.00 0.00 H new ATOM 360 N TRP A 24 9.637 39.601 32.670 1.00 0.00 N ATOM 361 CA TRP A 24 8.904 40.675 33.318 1.00 0.00 C ATOM 362 C TRP A 24 9.694 41.971 33.125 1.00 0.00 C ATOM 363 O TRP A 24 9.118 43.011 32.807 1.00 0.00 O ATOM 364 CB TRP A 24 8.643 40.350 34.791 1.00 0.00 C ATOM 365 CG TRP A 24 8.103 41.529 35.603 1.00 0.00 C ATOM 366 CD1 TRP A 24 8.605 42.052 36.730 1.00 0.00 C ATOM 367 CD2 TRP A 24 6.931 42.316 35.302 1.00 0.00 C ATOM 368 NE1 TRP A 24 7.845 43.114 37.176 1.00 0.00 N ATOM 369 CE2 TRP A 24 6.796 43.279 36.280 1.00 0.00 C ATOM 370 CE3 TRP A 24 6.017 42.217 34.239 1.00 0.00 C ATOM 371 CZ2 TRP A 24 5.756 44.218 36.293 1.00 0.00 C ATOM 372 CZ3 TRP A 24 4.985 43.161 34.265 1.00 0.00 C ATOM 373 CH2 TRP A 24 4.833 44.139 35.243 1.00 0.00 C ATOM 0 H TRP A 24 10.067 38.932 33.309 1.00 0.00 H new ATOM 0 HA TRP A 24 7.919 40.796 32.866 1.00 0.00 H new ATOM 0 HB2 TRP A 24 7.932 39.526 34.850 1.00 0.00 H new ATOM 0 HB3 TRP A 24 9.571 40.004 35.246 1.00 0.00 H new ATOM 0 HD1 TRP A 24 9.492 41.688 37.227 1.00 0.00 H new ATOM 0 HE1 TRP A 24 8.021 43.675 38.010 1.00 0.00 H new ATOM 0 HE3 TRP A 24 6.104 41.471 33.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 5.671 44.962 37.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 4.255 43.128 33.470 1.00 0.00 H new ATOM 0 HH2 TRP A 24 4.007 44.834 35.193 1.00 0.00 H new ATOM 384 N LEU A 25 11.000 41.867 33.322 1.00 0.00 N ATOM 385 CA LEU A 25 11.874 43.018 33.173 1.00 0.00 C ATOM 386 C LEU A 25 11.636 43.658 31.804 1.00 0.00 C ATOM 387 O LEU A 25 11.809 44.865 31.641 1.00 0.00 O ATOM 388 CB LEU A 25 13.330 42.620 33.423 1.00 0.00 C ATOM 389 CG LEU A 25 14.276 43.755 33.821 1.00 0.00 C ATOM 390 CD1 LEU A 25 13.576 44.754 34.743 1.00 0.00 C ATOM 391 CD2 LEU A 25 15.561 43.204 34.443 1.00 0.00 C ATOM 0 H LEU A 25 11.474 41.003 33.584 1.00 0.00 H new ATOM 0 HA LEU A 25 11.642 43.774 33.923 1.00 0.00 H new ATOM 0 HB2 LEU A 25 13.350 41.865 34.209 1.00 0.00 H new ATOM 0 HB3 LEU A 25 13.718 42.150 32.519 1.00 0.00 H new ATOM 0 HG LEU A 25 14.561 44.295 32.918 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.270 45.550 35.011 1.00 0.00 H new ATOM 0 HD12 LEU A 25 12.715 45.181 34.230 1.00 0.00 H new ATOM 0 HD13 LEU A 25 13.243 44.244 35.647 1.00 0.00 H new ATOM 0 HD21 LEU A 25 16.216 44.031 34.717 1.00 0.00 H new ATOM 0 HD22 LEU A 25 15.315 42.625 35.333 1.00 0.00 H new ATOM 0 HD23 LEU A 25 16.068 42.563 33.722 1.00 0.00 H new ATOM 403 N ASN A 26 11.245 42.821 30.854 1.00 0.00 N ATOM 404 CA ASN A 26 10.982 43.291 29.505 1.00 0.00 C ATOM 405 C ASN A 26 9.744 44.189 29.513 1.00 0.00 C ATOM 406 O ASN A 26 9.582 45.038 28.638 1.00 0.00 O ATOM 407 CB ASN A 26 10.710 42.120 28.558 1.00 0.00 C ATOM 408 CG ASN A 26 10.510 42.612 27.122 1.00 0.00 C ATOM 409 OD1 ASN A 26 11.250 43.436 26.613 1.00 0.00 O ATOM 410 ND2 ASN A 26 9.472 42.060 26.501 1.00 0.00 N ATOM 0 H ASN A 26 11.104 41.820 30.992 1.00 0.00 H new ATOM 0 HA ASN A 26 11.860 43.838 29.162 1.00 0.00 H new ATOM 0 HB2 ASN A 26 11.543 41.418 28.593 1.00 0.00 H new ATOM 0 HB3 ASN A 26 9.823 41.579 28.888 1.00 0.00 H new ATOM 0 HD21 ASN A 26 9.255 42.321 25.539 1.00 0.00 H new ATOM 0 HD22 ASN A 26 8.892 41.375 26.986 1.00 0.00 H new ATOM 417 N PHE A 27 8.901 43.972 30.514 1.00 0.00 N ATOM 418 CA PHE A 27 7.682 44.751 30.647 1.00 0.00 C ATOM 419 C PHE A 27 7.888 45.929 31.603 1.00 0.00 C ATOM 420 O PHE A 27 7.346 47.012 31.385 1.00 0.00 O ATOM 421 CB PHE A 27 6.617 43.820 31.227 1.00 0.00 C ATOM 422 CG PHE A 27 5.182 44.231 30.892 1.00 0.00 C ATOM 423 CD1 PHE A 27 4.723 45.458 31.255 1.00 0.00 C ATOM 424 CD2 PHE A 27 4.364 43.368 30.229 1.00 0.00 C ATOM 425 CE1 PHE A 27 3.391 45.839 30.944 1.00 0.00 C ATOM 426 CE2 PHE A 27 3.033 43.750 29.918 1.00 0.00 C ATOM 427 CZ PHE A 27 2.574 44.977 30.282 1.00 0.00 C ATOM 0 H PHE A 27 9.039 43.268 31.239 1.00 0.00 H new ATOM 0 HA PHE A 27 7.387 45.151 29.677 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.791 42.810 30.856 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.731 43.785 32.311 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.372 46.143 31.780 1.00 0.00 H new ATOM 0 HD2 PHE A 27 4.728 42.393 29.940 1.00 0.00 H new ATOM 0 HE1 PHE A 27 3.027 46.814 31.233 1.00 0.00 H new ATOM 0 HE2 PHE A 27 2.384 43.066 29.392 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.561 45.267 30.045 1.00 0.00 H new ATOM 437 N LEU A 28 8.671 45.678 32.641 1.00 0.00 N ATOM 438 CA LEU A 28 8.954 46.703 33.631 1.00 0.00 C ATOM 439 C LEU A 28 9.833 47.785 33.000 1.00 0.00 C ATOM 440 O LEU A 28 9.824 48.933 33.442 1.00 0.00 O ATOM 441 CB LEU A 28 9.556 46.080 34.892 1.00 0.00 C ATOM 442 CG LEU A 28 9.726 47.016 36.089 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.472 47.868 36.301 1.00 0.00 C ATOM 444 CD2 LEU A 28 10.108 46.236 37.348 1.00 0.00 C ATOM 0 H LEU A 28 9.119 44.779 32.818 1.00 0.00 H new ATOM 0 HA LEU A 28 8.032 47.187 33.953 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.926 45.245 35.197 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.532 45.667 34.638 1.00 0.00 H new ATOM 0 HG LEU A 28 10.548 47.699 35.873 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.619 48.525 37.158 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.286 48.469 35.411 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.617 47.217 36.485 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.222 46.927 38.183 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.326 45.513 37.579 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.049 45.711 37.180 1.00 0.00 H new ATOM 456 N GLN A 29 10.572 47.381 31.978 1.00 0.00 N ATOM 457 CA GLN A 29 11.455 48.302 31.282 1.00 0.00 C ATOM 458 C GLN A 29 10.638 49.323 30.488 1.00 0.00 C ATOM 459 O GLN A 29 10.773 50.528 30.695 1.00 0.00 O ATOM 460 CB GLN A 29 12.425 47.548 30.371 1.00 0.00 C ATOM 461 CG GLN A 29 13.768 47.321 31.068 1.00 0.00 C ATOM 462 CD GLN A 29 14.732 46.549 30.164 1.00 0.00 C ATOM 463 OE1 GLN A 29 14.642 45.342 30.006 1.00 0.00 O ATOM 464 NE2 GLN A 29 15.655 47.309 29.583 1.00 0.00 N ATOM 0 H GLN A 29 10.578 46.428 31.615 1.00 0.00 H new ATOM 0 HA GLN A 29 12.047 48.838 32.024 1.00 0.00 H new ATOM 0 HB2 GLN A 29 11.992 46.589 30.087 1.00 0.00 H new ATOM 0 HB3 GLN A 29 12.579 48.113 29.451 1.00 0.00 H new ATOM 0 HG2 GLN A 29 14.208 48.281 31.339 1.00 0.00 H new ATOM 0 HG3 GLN A 29 13.612 46.769 31.995 1.00 0.00 H new ATOM 0 HE21 GLN A 29 15.673 48.314 29.759 1.00 0.00 H new ATOM 0 HE22 GLN A 29 16.345 46.888 28.961 1.00 0.00 H new ATOM 473 N ALA A 30 9.808 48.804 29.595 1.00 0.00 N ATOM 474 CA ALA A 30 8.969 49.655 28.769 1.00 0.00 C ATOM 475 C ALA A 30 8.111 50.547 29.670 1.00 0.00 C ATOM 476 O ALA A 30 7.865 51.708 29.346 1.00 0.00 O ATOM 477 CB ALA A 30 8.125 48.787 27.833 1.00 0.00 C ATOM 0 H ALA A 30 9.699 47.804 29.426 1.00 0.00 H new ATOM 0 HA ALA A 30 9.580 50.307 28.145 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.496 49.426 27.213 1.00 0.00 H new ATOM 0 HB2 ALA A 30 8.781 48.195 27.195 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.496 48.121 28.423 1.00 0.00 H new ATOM 483 N ALA A 31 7.681 49.970 30.781 1.00 0.00 N ATOM 484 CA ALA A 31 6.855 50.698 31.730 1.00 0.00 C ATOM 485 C ALA A 31 7.664 51.855 32.319 1.00 0.00 C ATOM 486 O ALA A 31 7.123 52.931 32.570 1.00 0.00 O ATOM 487 CB ALA A 31 6.346 49.736 32.806 1.00 0.00 C ATOM 0 H ALA A 31 7.888 49.007 31.046 1.00 0.00 H new ATOM 0 HA ALA A 31 5.983 51.124 31.234 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.727 50.281 33.518 1.00 0.00 H new ATOM 0 HB2 ALA A 31 5.755 48.948 32.339 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.194 49.292 33.328 1.00 0.00 H new ATOM 493 N TYR A 32 8.947 51.596 32.523 1.00 0.00 N ATOM 494 CA TYR A 32 9.836 52.603 33.078 1.00 0.00 C ATOM 495 C TYR A 32 10.165 53.676 32.037 1.00 0.00 C ATOM 496 O TYR A 32 10.648 54.753 32.383 1.00 0.00 O ATOM 497 CB TYR A 32 11.122 51.867 33.459 1.00 0.00 C ATOM 498 CG TYR A 32 11.688 52.270 34.822 1.00 0.00 C ATOM 499 CD1 TYR A 32 11.141 51.747 35.978 1.00 0.00 C ATOM 500 CD2 TYR A 32 12.745 53.154 34.897 1.00 0.00 C ATOM 501 CE1 TYR A 32 11.673 52.126 37.261 1.00 0.00 C ATOM 502 CE2 TYR A 32 13.277 53.531 36.181 1.00 0.00 C ATOM 503 CZ TYR A 32 12.716 53.000 37.299 1.00 0.00 C ATOM 504 OH TYR A 32 13.219 53.357 38.511 1.00 0.00 O ATOM 0 H TYR A 32 9.393 50.703 32.314 1.00 0.00 H new ATOM 0 HA TYR A 32 9.371 53.099 33.930 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.928 50.794 33.460 1.00 0.00 H new ATOM 0 HB3 TYR A 32 11.876 52.054 32.694 1.00 0.00 H new ATOM 0 HD1 TYR A 32 10.315 51.054 35.919 1.00 0.00 H new ATOM 0 HD2 TYR A 32 13.173 53.563 33.994 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.254 51.726 38.173 1.00 0.00 H new ATOM 0 HE2 TYR A 32 14.104 54.221 36.254 1.00 0.00 H new ATOM 0 HH TYR A 32 13.961 53.985 38.385 1.00 0.00 H new ATOM 514 N ARG A 33 9.891 53.343 30.785 1.00 0.00 N ATOM 515 CA ARG A 33 10.153 54.265 29.692 1.00 0.00 C ATOM 516 C ARG A 33 8.958 55.198 29.486 1.00 0.00 C ATOM 517 O ARG A 33 9.050 56.179 28.750 1.00 0.00 O ATOM 518 CB ARG A 33 10.432 53.511 28.390 1.00 0.00 C ATOM 519 CG ARG A 33 11.663 54.080 27.680 1.00 0.00 C ATOM 520 CD ARG A 33 11.267 55.183 26.697 1.00 0.00 C ATOM 521 NE ARG A 33 10.878 54.589 25.399 1.00 0.00 N ATOM 522 CZ ARG A 33 10.066 55.191 24.504 1.00 0.00 C ATOM 523 NH1 ARG A 33 9.549 56.411 24.760 1.00 0.00 N ATOM 524 NH2 ARG A 33 9.785 54.568 23.375 1.00 0.00 N ATOM 0 H ARG A 33 9.491 52.448 30.502 1.00 0.00 H new ATOM 0 HA ARG A 33 11.034 54.850 29.956 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.587 52.454 28.604 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.565 53.579 27.733 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.361 54.478 28.417 1.00 0.00 H new ATOM 0 HG3 ARG A 33 12.182 53.282 27.148 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.439 55.763 27.103 1.00 0.00 H new ATOM 0 HD3 ARG A 33 12.100 55.872 26.556 1.00 0.00 H new ATOM 0 HE ARG A 33 11.246 53.667 25.166 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.771 56.886 25.635 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.936 56.859 24.078 1.00 0.00 H new ATOM 0 HH21 ARG A 33 10.180 53.646 23.189 1.00 0.00 H new ATOM 0 HH22 ARG A 33 9.173 55.009 22.688 1.00 0.00 H new ATOM 537 N LEU A 34 7.862 54.858 30.150 1.00 0.00 N ATOM 538 CA LEU A 34 6.650 55.653 30.050 1.00 0.00 C ATOM 539 C LEU A 34 6.549 56.578 31.264 1.00 0.00 C ATOM 540 O LEU A 34 6.862 57.765 31.174 1.00 0.00 O ATOM 541 CB LEU A 34 5.430 54.749 29.863 1.00 0.00 C ATOM 542 CG LEU A 34 5.496 53.768 28.690 1.00 0.00 C ATOM 543 CD1 LEU A 34 4.424 52.684 28.822 1.00 0.00 C ATOM 544 CD2 LEU A 34 5.404 54.506 27.353 1.00 0.00 C ATOM 0 H LEU A 34 7.789 54.043 30.759 1.00 0.00 H new ATOM 0 HA LEU A 34 6.685 56.290 29.166 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.281 54.179 30.780 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.551 55.380 29.734 1.00 0.00 H new ATOM 0 HG LEU A 34 6.464 53.268 28.716 1.00 0.00 H new ATOM 0 HD11 LEU A 34 4.492 52.000 27.976 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.577 52.131 29.749 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.438 53.147 28.835 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.453 53.786 26.536 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.460 55.049 27.302 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.233 55.209 27.268 1.00 0.00 H new ATOM 665 N PHE A 43 1.178 49.870 38.794 1.00 0.00 N ATOM 666 CA PHE A 43 1.372 48.444 38.595 1.00 0.00 C ATOM 667 C PHE A 43 0.066 47.676 38.817 1.00 0.00 C ATOM 668 O PHE A 43 0.021 46.458 38.650 1.00 0.00 O ATOM 669 CB PHE A 43 2.401 47.983 39.630 1.00 0.00 C ATOM 670 CG PHE A 43 3.834 48.413 39.315 1.00 0.00 C ATOM 671 CD1 PHE A 43 4.071 49.332 38.341 1.00 0.00 C ATOM 672 CD2 PHE A 43 4.874 47.876 40.009 1.00 0.00 C ATOM 673 CE1 PHE A 43 5.402 49.731 38.048 1.00 0.00 C ATOM 674 CE2 PHE A 43 6.205 48.275 39.716 1.00 0.00 C ATOM 675 CZ PHE A 43 6.441 49.193 38.742 1.00 0.00 C ATOM 0 HA PHE A 43 1.706 48.254 37.575 1.00 0.00 H new ATOM 0 HB2 PHE A 43 2.121 48.377 40.607 1.00 0.00 H new ATOM 0 HB3 PHE A 43 2.366 46.896 39.703 1.00 0.00 H new ATOM 0 HD1 PHE A 43 3.246 49.759 37.790 1.00 0.00 H new ATOM 0 HD2 PHE A 43 4.687 47.146 40.783 1.00 0.00 H new ATOM 0 HE1 PHE A 43 5.589 50.461 37.275 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.030 47.849 40.267 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.454 49.495 38.519 1.00 0.00 H new ATOM 685 N GLN A 44 -0.965 48.421 39.189 1.00 0.00 N ATOM 686 CA GLN A 44 -2.268 47.827 39.434 1.00 0.00 C ATOM 687 C GLN A 44 -2.879 47.329 38.124 1.00 0.00 C ATOM 688 O GLN A 44 -3.217 46.154 38.000 1.00 0.00 O ATOM 689 CB GLN A 44 -3.200 48.820 40.132 1.00 0.00 C ATOM 690 CG GLN A 44 -4.458 48.119 40.650 1.00 0.00 C ATOM 691 CD GLN A 44 -4.212 47.495 42.024 1.00 0.00 C ATOM 692 OE1 GLN A 44 -3.334 46.670 42.212 1.00 0.00 O ATOM 693 NE2 GLN A 44 -5.036 47.934 42.973 1.00 0.00 N ATOM 0 H GLN A 44 -0.924 49.431 39.327 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.138 46.973 40.098 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -2.676 49.295 40.962 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -3.480 49.612 39.437 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -5.277 48.835 40.713 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -4.764 47.346 39.945 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -5.750 48.627 42.748 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -4.953 47.578 43.925 1.00 0.00 H new ATOM 702 N GLN A 45 -3.004 48.250 37.178 1.00 0.00 N ATOM 703 CA GLN A 45 -3.570 47.919 35.881 1.00 0.00 C ATOM 704 C GLN A 45 -2.738 46.828 35.203 1.00 0.00 C ATOM 705 O GLN A 45 -3.208 46.172 34.274 1.00 0.00 O ATOM 706 CB GLN A 45 -3.673 49.161 34.995 1.00 0.00 C ATOM 707 CG GLN A 45 -5.105 49.700 34.970 1.00 0.00 C ATOM 708 CD GLN A 45 -6.035 48.747 34.214 1.00 0.00 C ATOM 709 OE1 GLN A 45 -5.983 47.538 34.366 1.00 0.00 O ATOM 710 NE2 GLN A 45 -6.885 49.359 33.395 1.00 0.00 N ATOM 0 H GLN A 45 -2.723 49.225 37.284 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.580 47.537 36.033 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -2.997 49.932 35.364 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.355 48.916 33.982 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.465 49.833 35.990 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -5.120 50.681 34.496 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.875 50.376 33.316 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.548 48.812 32.846 1.00 0.00 H new ATOM 719 N LEU A 46 -1.518 46.669 35.693 1.00 0.00 N ATOM 720 CA LEU A 46 -0.616 45.669 35.145 1.00 0.00 C ATOM 721 C LEU A 46 -0.897 44.318 35.807 1.00 0.00 C ATOM 722 O LEU A 46 -1.178 43.334 35.124 1.00 0.00 O ATOM 723 CB LEU A 46 0.837 46.128 35.277 1.00 0.00 C ATOM 724 CG LEU A 46 1.626 46.240 33.970 1.00 0.00 C ATOM 725 CD1 LEU A 46 2.916 47.036 34.176 1.00 0.00 C ATOM 726 CD2 LEU A 46 1.895 44.858 33.372 1.00 0.00 C ATOM 0 H LEU A 46 -1.132 47.215 36.463 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.790 45.544 34.076 1.00 0.00 H new ATOM 0 HB2 LEU A 46 0.847 47.101 35.769 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.359 45.433 35.935 1.00 0.00 H new ATOM 0 HG LEU A 46 1.019 46.790 33.250 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.458 47.101 33.233 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.672 48.040 34.524 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.538 46.535 34.918 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.457 44.966 32.444 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.472 44.262 34.079 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.948 44.360 33.166 1.00 0.00 H new ATOM 738 N ARG A 47 -0.810 44.314 37.129 1.00 0.00 N ATOM 739 CA ARG A 47 -1.051 43.100 37.891 1.00 0.00 C ATOM 740 C ARG A 47 -2.411 42.504 37.523 1.00 0.00 C ATOM 741 O ARG A 47 -2.650 41.316 37.735 1.00 0.00 O ATOM 742 CB ARG A 47 -1.013 43.377 39.395 1.00 0.00 C ATOM 743 CG ARG A 47 -0.558 42.138 40.170 1.00 0.00 C ATOM 744 CD ARG A 47 -1.524 41.822 41.314 1.00 0.00 C ATOM 745 NE ARG A 47 -1.269 42.729 42.455 1.00 0.00 N ATOM 746 CZ ARG A 47 -1.902 42.644 43.645 1.00 0.00 C ATOM 747 NH1 ARG A 47 -2.833 41.689 43.860 1.00 0.00 N ATOM 748 NH2 ARG A 47 -1.597 43.508 44.595 1.00 0.00 N ATOM 0 H ARG A 47 -0.576 45.132 37.692 1.00 0.00 H new ATOM 0 HA ARG A 47 -0.261 42.391 37.644 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.336 44.207 39.599 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -2.002 43.682 39.737 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -0.497 41.285 39.495 1.00 0.00 H new ATOM 0 HG3 ARG A 47 0.443 42.301 40.569 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -2.553 41.933 40.973 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -1.402 40.785 41.628 1.00 0.00 H new ATOM 0 HE ARG A 47 -0.572 43.464 42.335 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -3.063 41.025 43.121 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.306 41.632 44.762 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -0.893 44.226 44.425 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -2.066 43.458 45.500 1.00 0.00 H new ATOM 761 N ARG A 48 -3.266 43.355 36.977 1.00 0.00 N ATOM 762 CA ARG A 48 -4.597 42.927 36.578 1.00 0.00 C ATOM 763 C ARG A 48 -4.519 42.060 35.320 1.00 0.00 C ATOM 764 O ARG A 48 -5.275 41.101 35.175 1.00 0.00 O ATOM 765 CB ARG A 48 -5.504 44.129 36.306 1.00 0.00 C ATOM 766 CG ARG A 48 -6.973 43.706 36.256 1.00 0.00 C ATOM 767 CD ARG A 48 -7.897 44.920 36.376 1.00 0.00 C ATOM 768 NE ARG A 48 -9.308 44.479 36.417 1.00 0.00 N ATOM 769 CZ ARG A 48 -10.355 45.256 36.063 1.00 0.00 C ATOM 770 NH1 ARG A 48 -10.155 46.522 35.639 1.00 0.00 N ATOM 771 NH2 ARG A 48 -11.576 44.759 36.138 1.00 0.00 N ATOM 0 H ARG A 48 -3.064 44.339 36.801 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.019 42.347 37.398 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.364 44.879 37.085 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -5.223 44.595 35.361 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.173 43.183 35.321 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.181 43.005 37.064 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -7.657 45.483 37.278 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.741 45.591 35.531 1.00 0.00 H new ATOM 0 HE ARG A 48 -9.503 43.529 36.732 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.208 46.898 35.584 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.950 47.103 35.373 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.718 43.801 36.460 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.377 45.333 35.874 1.00 0.00 H new ATOM 784 N PHE A 49 -3.599 42.430 34.440 1.00 0.00 N ATOM 785 CA PHE A 49 -3.414 41.698 33.199 1.00 0.00 C ATOM 786 C PHE A 49 -2.507 40.483 33.409 1.00 0.00 C ATOM 787 O PHE A 49 -2.698 39.446 32.776 1.00 0.00 O ATOM 788 CB PHE A 49 -2.744 42.654 32.211 1.00 0.00 C ATOM 789 CG PHE A 49 -2.177 41.968 30.966 1.00 0.00 C ATOM 790 CD1 PHE A 49 -3.011 41.318 30.110 1.00 0.00 C ATOM 791 CD2 PHE A 49 -0.841 42.008 30.717 1.00 0.00 C ATOM 792 CE1 PHE A 49 -2.486 40.682 28.955 1.00 0.00 C ATOM 793 CE2 PHE A 49 -0.317 41.371 29.560 1.00 0.00 C ATOM 794 CZ PHE A 49 -1.150 40.721 28.705 1.00 0.00 C ATOM 0 H PHE A 49 -2.974 43.227 34.562 1.00 0.00 H new ATOM 0 HA PHE A 49 -4.376 41.341 32.831 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.470 43.406 31.900 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -1.938 43.181 32.721 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.072 41.286 30.309 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.179 42.523 31.397 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.148 40.167 28.274 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.744 41.403 29.360 1.00 0.00 H new ATOM 0 HZ PHE A 49 -0.751 40.235 27.827 1.00 0.00 H new ATOM 804 N LEU A 50 -1.542 40.652 34.300 1.00 0.00 N ATOM 805 CA LEU A 50 -0.606 39.583 34.601 1.00 0.00 C ATOM 806 C LEU A 50 -1.335 38.470 35.356 1.00 0.00 C ATOM 807 O LEU A 50 -1.333 37.317 34.924 1.00 0.00 O ATOM 808 CB LEU A 50 0.614 40.131 35.344 1.00 0.00 C ATOM 809 CG LEU A 50 1.457 41.159 34.584 1.00 0.00 C ATOM 810 CD1 LEU A 50 2.101 42.159 35.545 1.00 0.00 C ATOM 811 CD2 LEU A 50 2.494 40.467 33.696 1.00 0.00 C ATOM 0 H LEU A 50 -1.388 41.514 34.824 1.00 0.00 H new ATOM 0 HA LEU A 50 -0.220 39.146 33.680 1.00 0.00 H new ATOM 0 HB2 LEU A 50 0.274 40.586 36.274 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.256 39.293 35.615 1.00 0.00 H new ATOM 0 HG LEU A 50 0.796 41.725 33.927 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.694 42.878 34.979 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.323 42.686 36.097 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.746 41.628 36.245 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.080 41.219 33.167 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.156 39.860 34.314 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.986 39.828 32.973 1.00 0.00 H new ATOM 823 N LYS A 51 -1.942 38.852 36.469 1.00 0.00 N ATOM 824 CA LYS A 51 -2.674 37.901 37.288 1.00 0.00 C ATOM 825 C LYS A 51 -3.721 37.191 36.425 1.00 0.00 C ATOM 826 O LYS A 51 -4.077 36.045 36.694 1.00 0.00 O ATOM 827 CB LYS A 51 -3.261 38.593 38.519 1.00 0.00 C ATOM 828 CG LYS A 51 -3.992 37.592 39.416 1.00 0.00 C ATOM 829 CD LYS A 51 -3.206 37.333 40.703 1.00 0.00 C ATOM 830 CE LYS A 51 -2.051 36.361 40.454 1.00 0.00 C ATOM 831 NZ LYS A 51 -0.763 36.974 40.851 1.00 0.00 N ATOM 0 H LYS A 51 -1.942 39.808 36.824 1.00 0.00 H new ATOM 0 HA LYS A 51 -2.002 37.134 37.672 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.464 39.077 39.083 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -3.951 39.377 38.205 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.983 37.974 39.661 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.136 36.655 38.879 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -2.817 38.274 41.091 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.871 36.925 41.464 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.213 35.443 41.018 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.020 36.086 39.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 0.010 36.301 40.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -0.603 37.838 40.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -0.790 37.214 41.863 1.00 0.00 H new ATOM 844 N LEU A 52 -4.181 37.902 35.406 1.00 0.00 N ATOM 845 CA LEU A 52 -5.178 37.354 34.502 1.00 0.00 C ATOM 846 C LEU A 52 -4.575 36.172 33.740 1.00 0.00 C ATOM 847 O LEU A 52 -5.152 35.087 33.715 1.00 0.00 O ATOM 848 CB LEU A 52 -5.738 38.451 33.594 1.00 0.00 C ATOM 849 CG LEU A 52 -6.521 37.973 32.370 1.00 0.00 C ATOM 850 CD1 LEU A 52 -7.444 39.075 31.845 1.00 0.00 C ATOM 851 CD2 LEU A 52 -5.577 37.450 31.285 1.00 0.00 C ATOM 0 H LEU A 52 -3.882 38.852 35.186 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.031 36.970 35.062 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.389 39.091 34.190 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.909 39.070 33.251 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.155 37.140 32.674 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.989 38.709 30.975 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.152 39.358 32.624 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.849 39.944 31.562 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.159 37.116 30.426 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.900 38.247 30.977 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.999 36.614 31.678 1.00 0.00 H new ATOM 863 N ALA A 53 -3.423 36.425 33.136 1.00 0.00 N ATOM 864 CA ALA A 53 -2.736 35.395 32.375 1.00 0.00 C ATOM 865 C ALA A 53 -2.477 34.187 33.278 1.00 0.00 C ATOM 866 O ALA A 53 -2.475 33.049 32.812 1.00 0.00 O ATOM 867 CB ALA A 53 -1.446 35.971 31.787 1.00 0.00 C ATOM 0 H ALA A 53 -2.948 37.328 33.158 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.352 35.057 31.542 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.930 35.199 31.216 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.687 36.808 31.131 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.801 36.317 32.595 1.00 0.00 H new ATOM 873 N LEU A 54 -2.264 34.476 34.554 1.00 0.00 N ATOM 874 CA LEU A 54 -2.005 33.428 35.525 1.00 0.00 C ATOM 875 C LEU A 54 -3.223 32.506 35.612 1.00 0.00 C ATOM 876 O LEU A 54 -3.140 31.413 36.172 1.00 0.00 O ATOM 877 CB LEU A 54 -1.595 34.033 36.869 1.00 0.00 C ATOM 878 CG LEU A 54 -0.309 33.480 37.489 1.00 0.00 C ATOM 879 CD1 LEU A 54 0.800 33.368 36.442 1.00 0.00 C ATOM 880 CD2 LEU A 54 0.122 34.319 38.694 1.00 0.00 C ATOM 0 H LEU A 54 -2.266 35.421 34.937 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.162 32.814 35.207 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.479 35.109 36.740 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.410 33.882 37.577 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.510 32.472 37.853 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.702 32.973 36.909 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.481 32.698 35.644 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.009 34.354 36.026 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.038 33.906 39.116 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.300 35.346 38.377 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.665 34.303 39.448 1.00 0.00 H new ATOM 892 N LYS A 55 -4.325 32.979 35.049 1.00 0.00 N ATOM 893 CA LYS A 55 -5.557 32.211 35.055 1.00 0.00 C ATOM 894 C LYS A 55 -5.451 31.074 34.037 1.00 0.00 C ATOM 895 O LYS A 55 -6.362 30.257 33.916 1.00 0.00 O ATOM 896 CB LYS A 55 -6.761 33.128 34.829 1.00 0.00 C ATOM 897 CG LYS A 55 -8.069 32.416 35.185 1.00 0.00 C ATOM 898 CD LYS A 55 -8.345 32.498 36.688 1.00 0.00 C ATOM 899 CE LYS A 55 -9.783 32.080 37.003 1.00 0.00 C ATOM 900 NZ LYS A 55 -10.739 33.083 36.483 1.00 0.00 N ATOM 0 H LYS A 55 -4.390 33.885 34.585 1.00 0.00 H new ATOM 0 HA LYS A 55 -5.714 31.751 36.031 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -6.656 34.028 35.435 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.789 33.447 33.787 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -8.895 32.867 34.635 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.014 31.372 34.878 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -7.649 31.854 37.225 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -8.173 33.516 37.038 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -9.991 31.106 36.559 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -9.909 31.973 38.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.644 32.994 36.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.354 34.038 36.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -10.891 32.923 35.467 1.00 0.00 H new ATOM 913 N THR A 56 -4.329 31.058 33.331 1.00 0.00 N ATOM 914 CA THR A 56 -4.091 30.034 32.328 1.00 0.00 C ATOM 915 C THR A 56 -2.592 29.771 32.180 1.00 0.00 C ATOM 916 O THR A 56 -1.900 30.487 31.458 1.00 0.00 O ATOM 917 CB THR A 56 -4.760 30.484 31.027 1.00 0.00 C ATOM 918 OG1 THR A 56 -4.613 29.364 30.157 1.00 0.00 O ATOM 919 CG2 THR A 56 -3.988 31.604 30.327 1.00 0.00 C ATOM 0 H THR A 56 -3.575 31.738 33.434 1.00 0.00 H new ATOM 0 HA THR A 56 -4.529 29.081 32.624 1.00 0.00 H new ATOM 0 HB THR A 56 -5.775 30.821 31.238 1.00 0.00 H new ATOM 0 HG1 THR A 56 -5.154 29.502 29.352 1.00 0.00 H new ATOM 0 HG21 THR A 56 -4.506 31.885 29.410 1.00 0.00 H new ATOM 0 HG22 THR A 56 -3.923 32.469 30.987 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.984 31.257 30.084 1.00 0.00 H new ATOM 927 N PRO A 57 -2.120 28.714 32.895 1.00 0.00 N ATOM 928 CA PRO A 57 -0.715 28.347 32.850 1.00 0.00 C ATOM 929 C PRO A 57 -0.372 27.653 31.531 1.00 0.00 C ATOM 930 O PRO A 57 -0.064 26.462 31.514 1.00 0.00 O ATOM 931 CB PRO A 57 -0.503 27.456 34.064 1.00 0.00 C ATOM 932 CG PRO A 57 -1.885 26.980 34.478 1.00 0.00 C ATOM 933 CD PRO A 57 -2.911 27.844 33.760 1.00 0.00 C ATOM 0 HA PRO A 57 -0.052 29.212 32.886 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.144 26.613 33.821 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.021 28.006 34.872 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.021 25.930 34.218 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.008 27.059 35.558 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.606 27.236 33.181 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.506 28.423 34.467 1.00 0.00 H new ATOM 941 N ILE A 58 -0.436 28.427 30.458 1.00 0.00 N ATOM 942 CA ILE A 58 -0.135 27.901 29.137 1.00 0.00 C ATOM 943 C ILE A 58 1.064 28.653 28.554 1.00 0.00 C ATOM 944 O ILE A 58 1.735 28.154 27.652 1.00 0.00 O ATOM 945 CB ILE A 58 -1.378 27.943 28.247 1.00 0.00 C ATOM 946 CG1 ILE A 58 -1.016 28.345 26.816 1.00 0.00 C ATOM 947 CG2 ILE A 58 -2.449 28.857 28.845 1.00 0.00 C ATOM 948 CD1 ILE A 58 -0.158 27.270 26.145 1.00 0.00 C ATOM 0 H ILE A 58 -0.692 29.414 30.476 1.00 0.00 H new ATOM 0 HA ILE A 58 0.147 26.850 29.201 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.799 26.939 28.202 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.926 28.503 26.237 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.477 29.292 26.826 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.322 28.869 28.193 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.736 28.486 29.829 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.053 29.868 28.940 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.085 27.581 25.129 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.762 27.132 26.713 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.710 26.330 26.115 1.00 0.00 H new ATOM 960 N TRP A 59 1.295 29.840 29.093 1.00 0.00 N ATOM 961 CA TRP A 59 2.401 30.667 28.638 1.00 0.00 C ATOM 962 C TRP A 59 3.584 30.432 29.578 1.00 0.00 C ATOM 963 O TRP A 59 4.730 30.703 29.221 1.00 0.00 O ATOM 964 CB TRP A 59 1.987 32.137 28.552 1.00 0.00 C ATOM 965 CG TRP A 59 1.162 32.622 29.745 1.00 0.00 C ATOM 966 CD1 TRP A 59 -0.144 32.428 29.977 1.00 0.00 C ATOM 967 CD2 TRP A 59 1.640 33.395 30.866 1.00 0.00 C ATOM 968 NE1 TRP A 59 -0.540 33.017 31.161 1.00 0.00 N ATOM 969 CE2 TRP A 59 0.579 33.623 31.718 1.00 0.00 C ATOM 970 CE3 TRP A 59 2.927 33.885 31.149 1.00 0.00 C ATOM 971 CZ2 TRP A 59 0.697 34.346 32.911 1.00 0.00 C ATOM 972 CZ3 TRP A 59 3.028 34.606 32.345 1.00 0.00 C ATOM 973 CH2 TRP A 59 1.970 34.844 33.215 1.00 0.00 C ATOM 0 H TRP A 59 0.736 30.250 29.841 1.00 0.00 H new ATOM 0 HA TRP A 59 2.700 30.390 27.627 1.00 0.00 H new ATOM 0 HB2 TRP A 59 2.883 32.752 28.469 1.00 0.00 H new ATOM 0 HB3 TRP A 59 1.411 32.289 27.639 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -0.803 31.880 29.320 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -1.481 33.009 31.554 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.771 33.718 30.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -0.149 34.511 33.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 3.996 35.005 32.610 1.00 0.00 H new ATOM 0 HH2 TRP A 59 2.129 35.410 34.121 1.00 0.00 H new ATOM 984 N LEU A 60 3.268 29.931 30.763 1.00 0.00 N ATOM 985 CA LEU A 60 4.291 29.657 31.758 1.00 0.00 C ATOM 986 C LEU A 60 5.128 28.459 31.305 1.00 0.00 C ATOM 987 O LEU A 60 6.348 28.559 31.187 1.00 0.00 O ATOM 988 CB LEU A 60 3.660 29.479 33.141 1.00 0.00 C ATOM 989 CG LEU A 60 4.018 30.540 34.183 1.00 0.00 C ATOM 990 CD1 LEU A 60 4.143 31.923 33.538 1.00 0.00 C ATOM 991 CD2 LEU A 60 3.017 30.535 35.339 1.00 0.00 C ATOM 0 H LEU A 60 2.317 29.707 31.057 1.00 0.00 H new ATOM 0 HA LEU A 60 4.970 30.505 31.850 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.576 29.464 33.025 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.953 28.504 33.529 1.00 0.00 H new ATOM 0 HG LEU A 60 4.993 30.291 34.602 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.398 32.659 34.301 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.925 31.901 32.779 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.195 32.195 33.074 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.296 31.299 36.065 1.00 0.00 H new ATOM 0 HD22 LEU A 60 2.018 30.745 34.956 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.023 29.557 35.821 1.00 0.00 H new ATOM 1003 N ASN A 61 4.439 27.353 31.067 1.00 0.00 N ATOM 1004 CA ASN A 61 5.104 26.137 30.630 1.00 0.00 C ATOM 1005 C ASN A 61 6.118 26.479 29.537 1.00 0.00 C ATOM 1006 O ASN A 61 7.311 26.218 29.688 1.00 0.00 O ATOM 1007 CB ASN A 61 4.101 25.139 30.048 1.00 0.00 C ATOM 1008 CG ASN A 61 4.068 23.851 30.872 1.00 0.00 C ATOM 1009 OD1 ASN A 61 4.761 22.887 30.593 1.00 0.00 O ATOM 1010 ND2 ASN A 61 3.225 23.888 31.900 1.00 0.00 N ATOM 0 H ASN A 61 3.427 27.273 31.168 1.00 0.00 H new ATOM 0 HA ASN A 61 5.595 25.692 31.496 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.108 25.587 30.027 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.369 24.908 29.017 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.130 23.077 32.511 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.674 24.728 32.078 1.00 0.00 H new ATOM 1017 N PRO A 62 5.594 27.074 28.432 1.00 0.00 N ATOM 1018 CA PRO A 62 6.440 27.455 27.313 1.00 0.00 C ATOM 1019 C PRO A 62 7.253 28.708 27.644 1.00 0.00 C ATOM 1020 O PRO A 62 8.208 29.036 26.941 1.00 0.00 O ATOM 1021 CB PRO A 62 5.485 27.658 26.149 1.00 0.00 C ATOM 1022 CG PRO A 62 4.107 27.837 26.766 1.00 0.00 C ATOM 1023 CD PRO A 62 4.186 27.398 28.218 1.00 0.00 C ATOM 0 HA PRO A 62 7.185 26.697 27.072 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.766 28.532 25.561 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.503 26.801 25.475 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.791 28.878 26.699 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.368 27.244 26.228 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.856 28.190 28.890 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.548 26.534 28.406 1.00 0.00 H new ATOM 1031 N ILE A 63 6.845 29.375 28.714 1.00 0.00 N ATOM 1032 CA ILE A 63 7.525 30.584 29.146 1.00 0.00 C ATOM 1033 C ILE A 63 7.923 31.406 27.919 1.00 0.00 C ATOM 1034 O ILE A 63 9.001 31.212 27.361 1.00 0.00 O ATOM 1035 CB ILE A 63 8.700 30.240 30.064 1.00 0.00 C ATOM 1036 CG1 ILE A 63 9.335 31.507 30.641 1.00 0.00 C ATOM 1037 CG2 ILE A 63 9.725 29.366 29.337 1.00 0.00 C ATOM 1038 CD1 ILE A 63 8.266 32.446 31.206 1.00 0.00 C ATOM 0 H ILE A 63 6.052 29.101 29.294 1.00 0.00 H new ATOM 0 HA ILE A 63 6.856 31.204 29.743 1.00 0.00 H new ATOM 0 HB ILE A 63 8.319 29.660 30.904 1.00 0.00 H new ATOM 0 HG12 ILE A 63 10.041 31.239 31.427 1.00 0.00 H new ATOM 0 HG13 ILE A 63 9.902 32.020 29.864 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.550 29.136 30.011 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.250 28.439 29.015 1.00 0.00 H new ATOM 0 HG23 ILE A 63 10.106 29.900 28.466 1.00 0.00 H new ATOM 0 HD11 ILE A 63 8.743 33.339 31.610 1.00 0.00 H new ATOM 0 HD12 ILE A 63 7.576 32.731 30.412 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.717 31.937 31.999 1.00 0.00 H new ATOM 1050 N ASP A 64 7.031 32.308 27.536 1.00 0.00 N ATOM 1051 CA ASP A 64 7.276 33.160 26.385 1.00 0.00 C ATOM 1052 C ASP A 64 6.265 34.309 26.382 1.00 0.00 C ATOM 1053 O ASP A 64 5.068 34.086 26.203 1.00 0.00 O ATOM 1054 CB ASP A 64 7.111 32.383 25.077 1.00 0.00 C ATOM 1055 CG ASP A 64 6.711 30.916 25.244 1.00 0.00 C ATOM 1056 OD1 ASP A 64 7.441 30.002 24.831 1.00 0.00 O ATOM 1057 OD2 ASP A 64 5.580 30.723 25.835 1.00 0.00 O ATOM 0 H ASP A 64 6.138 32.467 28.002 1.00 0.00 H new ATOM 0 HA ASP A 64 8.297 33.534 26.455 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.358 32.882 24.468 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.049 32.428 24.524 1.00 0.00 H new ATOM 1063 N TYR A 65 6.782 35.512 26.582 1.00 0.00 N ATOM 1064 CA TYR A 65 5.939 36.694 26.605 1.00 0.00 C ATOM 1065 C TYR A 65 5.181 36.853 25.286 1.00 0.00 C ATOM 1066 O TYR A 65 4.234 37.633 25.200 1.00 0.00 O ATOM 1067 CB TYR A 65 6.886 37.883 26.781 1.00 0.00 C ATOM 1068 CG TYR A 65 6.494 39.117 25.966 1.00 0.00 C ATOM 1069 CD1 TYR A 65 6.604 39.099 24.590 1.00 0.00 C ATOM 1070 CD2 TYR A 65 6.030 40.249 26.606 1.00 0.00 C ATOM 1071 CE1 TYR A 65 6.235 40.261 23.823 1.00 0.00 C ATOM 1072 CE2 TYR A 65 5.661 41.410 25.839 1.00 0.00 C ATOM 1073 CZ TYR A 65 5.782 41.359 24.485 1.00 0.00 C ATOM 1074 OH TYR A 65 5.433 42.455 23.760 1.00 0.00 O ATOM 0 H TYR A 65 7.775 35.693 26.730 1.00 0.00 H new ATOM 0 HA TYR A 65 5.202 36.624 27.405 1.00 0.00 H new ATOM 0 HB2 TYR A 65 6.921 38.153 27.836 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.893 37.577 26.497 1.00 0.00 H new ATOM 0 HD1 TYR A 65 6.967 38.214 24.089 1.00 0.00 H new ATOM 0 HD2 TYR A 65 5.944 40.263 27.682 1.00 0.00 H new ATOM 0 HE1 TYR A 65 6.316 40.260 22.746 1.00 0.00 H new ATOM 0 HE2 TYR A 65 5.296 42.301 26.328 1.00 0.00 H new ATOM 0 HH TYR A 65 4.830 42.189 23.035 1.00 0.00 H new ATOM 1084 N SER A 66 5.626 36.100 24.290 1.00 0.00 N ATOM 1085 CA SER A 66 5.002 36.148 22.979 1.00 0.00 C ATOM 1086 C SER A 66 3.526 35.757 23.088 1.00 0.00 C ATOM 1087 O SER A 66 2.717 36.133 22.241 1.00 0.00 O ATOM 1088 CB SER A 66 5.722 35.228 21.992 1.00 0.00 C ATOM 1089 OG SER A 66 5.631 33.857 22.374 1.00 0.00 O ATOM 0 H SER A 66 6.411 35.453 24.365 1.00 0.00 H new ATOM 0 HA SER A 66 5.075 37.168 22.603 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.293 35.356 20.998 1.00 0.00 H new ATOM 0 HB3 SER A 66 6.771 35.517 21.926 1.00 0.00 H new ATOM 0 HG SER A 66 6.102 33.302 21.717 1.00 0.00 H new ATOM 1095 N LEU A 67 3.221 35.007 24.137 1.00 0.00 N ATOM 1096 CA LEU A 67 1.858 34.562 24.368 1.00 0.00 C ATOM 1097 C LEU A 67 1.135 35.582 25.250 1.00 0.00 C ATOM 1098 O LEU A 67 -0.095 35.595 25.311 1.00 0.00 O ATOM 1099 CB LEU A 67 1.847 33.141 24.936 1.00 0.00 C ATOM 1100 CG LEU A 67 0.468 32.512 25.142 1.00 0.00 C ATOM 1101 CD1 LEU A 67 0.583 31.004 25.379 1.00 0.00 C ATOM 1102 CD2 LEU A 67 -0.293 33.213 26.270 1.00 0.00 C ATOM 0 H LEU A 67 3.895 34.696 24.837 1.00 0.00 H new ATOM 0 HA LEU A 67 1.310 34.509 23.427 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.421 32.499 24.267 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.367 33.150 25.894 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.110 32.652 24.229 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.411 30.581 25.523 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.055 30.535 24.516 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.187 30.820 26.268 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.270 32.746 26.395 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.272 33.127 27.198 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.424 34.266 26.021 1.00 0.00 H new ATOM 1114 N LEU A 68 1.927 36.412 25.912 1.00 0.00 N ATOM 1115 CA LEU A 68 1.378 37.434 26.788 1.00 0.00 C ATOM 1116 C LEU A 68 0.648 38.482 25.946 1.00 0.00 C ATOM 1117 O LEU A 68 -0.558 38.672 26.094 1.00 0.00 O ATOM 1118 CB LEU A 68 2.473 38.017 27.683 1.00 0.00 C ATOM 1119 CG LEU A 68 2.502 37.510 29.126 1.00 0.00 C ATOM 1120 CD1 LEU A 68 3.484 38.321 29.973 1.00 0.00 C ATOM 1121 CD2 LEU A 68 1.097 37.499 29.730 1.00 0.00 C ATOM 0 H LEU A 68 2.946 36.398 25.860 1.00 0.00 H new ATOM 0 HA LEU A 68 0.643 37.001 27.466 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.439 37.805 27.225 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.360 39.101 27.702 1.00 0.00 H new ATOM 0 HG LEU A 68 2.858 36.480 29.119 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.485 37.940 30.994 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.486 38.234 29.552 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.182 39.368 29.977 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.145 37.135 30.756 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.690 38.510 29.723 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.453 36.844 29.142 1.00 0.00 H new ATOM 1133 N ALA A 69 1.410 39.135 25.080 1.00 0.00 N ATOM 1134 CA ALA A 69 0.850 40.160 24.215 1.00 0.00 C ATOM 1135 C ALA A 69 -0.355 39.587 23.467 1.00 0.00 C ATOM 1136 O ALA A 69 -1.206 40.335 22.988 1.00 0.00 O ATOM 1137 CB ALA A 69 1.934 40.676 23.267 1.00 0.00 C ATOM 0 H ALA A 69 2.410 38.974 24.959 1.00 0.00 H new ATOM 0 HA ALA A 69 0.500 41.009 24.802 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.514 41.445 22.618 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.754 41.099 23.848 1.00 0.00 H new ATOM 0 HB3 ALA A 69 2.308 39.852 22.659 1.00 0.00 H new ATOM 1143 N SER A 70 -0.389 38.265 23.390 1.00 0.00 N ATOM 1144 CA SER A 70 -1.476 37.583 22.709 1.00 0.00 C ATOM 1145 C SER A 70 -2.731 37.592 23.584 1.00 0.00 C ATOM 1146 O SER A 70 -3.843 37.737 23.079 1.00 0.00 O ATOM 1147 CB SER A 70 -1.088 36.146 22.352 1.00 0.00 C ATOM 1148 OG SER A 70 -2.122 35.475 21.638 1.00 0.00 O ATOM 0 H SER A 70 0.319 37.648 23.788 1.00 0.00 H new ATOM 0 HA SER A 70 -1.684 38.116 21.781 1.00 0.00 H new ATOM 0 HB2 SER A 70 -0.179 36.155 21.750 1.00 0.00 H new ATOM 0 HB3 SER A 70 -0.861 35.595 23.264 1.00 0.00 H new ATOM 0 HG SER A 70 -1.835 34.562 21.428 1.00 0.00 H new ATOM 1154 N LEU A 71 -2.510 37.434 24.880 1.00 0.00 N ATOM 1155 CA LEU A 71 -3.609 37.423 25.831 1.00 0.00 C ATOM 1156 C LEU A 71 -4.408 38.721 25.696 1.00 0.00 C ATOM 1157 O LEU A 71 -5.637 38.704 25.727 1.00 0.00 O ATOM 1158 CB LEU A 71 -3.091 37.164 27.246 1.00 0.00 C ATOM 1159 CG LEU A 71 -3.509 35.837 27.882 1.00 0.00 C ATOM 1160 CD1 LEU A 71 -2.320 34.880 27.986 1.00 0.00 C ATOM 1161 CD2 LEU A 71 -4.180 36.065 29.238 1.00 0.00 C ATOM 0 H LEU A 71 -1.586 37.312 25.295 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.293 36.603 25.613 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.002 37.207 27.226 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.431 37.975 27.890 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.247 35.366 27.233 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.645 33.944 28.442 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.925 34.681 26.990 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.542 35.332 28.601 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.467 35.105 29.668 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.484 36.569 29.908 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.068 36.683 29.105 1.00 0.00 H new ATOM 1173 N ILE A 72 -3.676 39.816 25.550 1.00 0.00 N ATOM 1174 CA ILE A 72 -4.301 41.120 25.410 1.00 0.00 C ATOM 1175 C ILE A 72 -5.359 41.059 24.307 1.00 0.00 C ATOM 1176 O ILE A 72 -5.057 40.693 23.173 1.00 0.00 O ATOM 1177 CB ILE A 72 -3.242 42.201 25.187 1.00 0.00 C ATOM 1178 CG1 ILE A 72 -2.291 42.292 26.383 1.00 0.00 C ATOM 1179 CG2 ILE A 72 -3.892 43.549 24.868 1.00 0.00 C ATOM 1180 CD1 ILE A 72 -1.241 43.384 26.166 1.00 0.00 C ATOM 0 H ILE A 72 -2.656 39.827 25.526 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.816 41.396 26.330 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.644 41.919 24.320 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.859 42.504 27.289 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.797 41.332 26.533 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.117 44.299 24.714 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.494 43.458 23.964 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.530 43.851 25.699 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.578 43.428 27.030 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.659 43.157 25.273 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.737 44.346 26.040 1.00 0.00 H new ATOM 1192 N PRO A 73 -6.609 41.432 24.688 1.00 0.00 N ATOM 1193 CA PRO A 73 -7.714 41.423 23.744 1.00 0.00 C ATOM 1194 C PRO A 73 -7.619 42.604 22.777 1.00 0.00 C ATOM 1195 O PRO A 73 -8.597 43.322 22.570 1.00 0.00 O ATOM 1196 CB PRO A 73 -8.967 41.458 24.604 1.00 0.00 C ATOM 1197 CG PRO A 73 -8.521 41.953 25.970 1.00 0.00 C ATOM 1198 CD PRO A 73 -7.005 41.871 26.024 1.00 0.00 C ATOM 0 HA PRO A 73 -7.712 40.542 23.103 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -9.717 42.121 24.174 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -9.419 40.469 24.676 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.854 42.978 26.132 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -8.964 41.346 26.759 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -6.565 42.837 26.270 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.674 41.166 26.787 1.00 0.00 H new ATOM 1206 N LYS A 74 -6.433 42.771 22.211 1.00 0.00 N ATOM 1207 CA LYS A 74 -6.197 43.854 21.271 1.00 0.00 C ATOM 1208 C LYS A 74 -7.259 44.937 21.473 1.00 0.00 C ATOM 1209 O LYS A 74 -8.330 44.879 20.872 1.00 0.00 O ATOM 1210 CB LYS A 74 -6.129 43.316 19.841 1.00 0.00 C ATOM 1211 CG LYS A 74 -4.792 42.621 19.579 1.00 0.00 C ATOM 1212 CD LYS A 74 -5.005 41.228 18.983 1.00 0.00 C ATOM 1213 CE LYS A 74 -5.160 41.300 17.462 1.00 0.00 C ATOM 1214 NZ LYS A 74 -6.312 40.483 17.019 1.00 0.00 N ATOM 0 H LYS A 74 -5.624 42.174 22.385 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.229 44.318 21.457 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -6.946 42.615 19.673 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.262 44.135 19.134 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -4.192 43.224 18.897 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.232 42.540 20.510 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.160 40.587 19.236 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -5.893 40.773 19.421 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -5.301 42.336 17.154 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.249 40.946 16.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -6.403 40.543 15.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -6.162 39.492 17.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -7.182 40.839 17.464 1.00 0.00 H new ATOM 1227 N GLY A 75 -6.923 45.901 22.318 1.00 0.00 N ATOM 1228 CA GLY A 75 -7.833 46.995 22.605 1.00 0.00 C ATOM 1229 C GLY A 75 -7.765 47.393 24.080 1.00 0.00 C ATOM 1230 O GLY A 75 -8.312 48.420 24.477 1.00 0.00 O ATOM 0 H GLY A 75 -6.032 45.946 22.813 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -7.583 47.853 21.981 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -8.851 46.702 22.351 1.00 0.00 H new ATOM 1234 N TYR A 76 -7.087 46.557 24.855 1.00 0.00 N ATOM 1235 CA TYR A 76 -6.940 46.809 26.278 1.00 0.00 C ATOM 1236 C TYR A 76 -6.562 48.268 26.541 1.00 0.00 C ATOM 1237 O TYR A 76 -6.074 48.958 25.647 1.00 0.00 O ATOM 1238 CB TYR A 76 -5.799 45.906 26.751 1.00 0.00 C ATOM 1239 CG TYR A 76 -6.213 44.880 27.807 1.00 0.00 C ATOM 1240 CD1 TYR A 76 -7.485 44.346 27.790 1.00 0.00 C ATOM 1241 CD2 TYR A 76 -5.314 44.490 28.779 1.00 0.00 C ATOM 1242 CE1 TYR A 76 -7.875 43.381 28.785 1.00 0.00 C ATOM 1243 CE2 TYR A 76 -5.703 43.524 29.773 1.00 0.00 C ATOM 1244 CZ TYR A 76 -6.965 43.018 29.728 1.00 0.00 C ATOM 1245 OH TYR A 76 -7.333 42.106 30.667 1.00 0.00 O ATOM 0 H TYR A 76 -6.634 45.705 24.524 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.875 46.610 26.801 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.386 45.380 25.891 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.002 46.528 27.157 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -8.189 44.652 27.030 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.319 44.909 28.794 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.868 42.955 28.782 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.008 43.208 30.537 1.00 0.00 H new ATOM 0 HH TYR A 76 -8.001 41.498 30.288 1.00 0.00 H new ATOM 1255 N PRO A 77 -6.809 48.707 27.804 1.00 0.00 N ATOM 1256 CA PRO A 77 -6.501 50.072 28.196 1.00 0.00 C ATOM 1257 C PRO A 77 -4.994 50.260 28.389 1.00 0.00 C ATOM 1258 O PRO A 77 -4.238 49.289 28.383 1.00 0.00 O ATOM 1259 CB PRO A 77 -7.296 50.305 29.471 1.00 0.00 C ATOM 1260 CG PRO A 77 -7.651 48.924 29.998 1.00 0.00 C ATOM 1261 CD PRO A 77 -7.388 47.919 28.889 1.00 0.00 C ATOM 0 HA PRO A 77 -6.775 50.800 27.433 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -6.709 50.863 30.201 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -8.194 50.889 29.270 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -7.053 48.686 30.878 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -8.697 48.890 30.304 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -6.705 47.136 29.218 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.308 47.427 28.574 1.00 0.00 H new ATOM 1269 N GLY A 78 -4.603 51.514 28.554 1.00 0.00 N ATOM 1270 CA GLY A 78 -3.201 51.842 28.748 1.00 0.00 C ATOM 1271 C GLY A 78 -2.657 51.191 30.022 1.00 0.00 C ATOM 1272 O GLY A 78 -3.397 50.536 30.753 1.00 0.00 O ATOM 0 H GLY A 78 -5.233 52.316 28.557 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -2.623 51.505 27.888 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -3.082 52.924 28.809 1.00 0.00 H new ATOM 1276 N ARG A 79 -1.367 51.394 30.247 1.00 0.00 N ATOM 1277 CA ARG A 79 -0.715 50.836 31.419 1.00 0.00 C ATOM 1278 C ARG A 79 -0.312 49.382 31.160 1.00 0.00 C ATOM 1279 O ARG A 79 0.350 48.760 31.989 1.00 0.00 O ATOM 1280 CB ARG A 79 -1.635 50.892 32.640 1.00 0.00 C ATOM 1281 CG ARG A 79 -0.857 51.300 33.893 1.00 0.00 C ATOM 1282 CD ARG A 79 -1.158 52.750 34.277 1.00 0.00 C ATOM 1283 NE ARG A 79 -1.909 52.790 35.553 1.00 0.00 N ATOM 1284 CZ ARG A 79 -3.256 52.763 35.639 1.00 0.00 C ATOM 1285 NH1 ARG A 79 -4.013 52.696 34.523 1.00 0.00 N ATOM 1286 NH2 ARG A 79 -3.822 52.804 36.831 1.00 0.00 N ATOM 0 H ARG A 79 -0.756 51.937 29.637 1.00 0.00 H new ATOM 0 HA ARG A 79 0.174 51.434 31.620 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -2.441 51.603 32.460 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -2.098 49.918 32.796 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -1.119 50.639 34.719 1.00 0.00 H new ATOM 0 HG3 ARG A 79 0.212 51.181 33.716 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -0.228 53.310 34.375 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -1.738 53.231 33.489 1.00 0.00 H new ATOM 0 HE ARG A 79 -1.375 52.841 36.421 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -3.568 52.665 33.606 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -5.030 52.676 34.597 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -3.243 52.855 37.669 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -4.838 52.784 36.914 1.00 0.00 H new ATOM 1299 N VAL A 80 -0.728 48.883 30.006 1.00 0.00 N ATOM 1300 CA VAL A 80 -0.418 47.515 29.626 1.00 0.00 C ATOM 1301 C VAL A 80 0.128 47.497 28.198 1.00 0.00 C ATOM 1302 O VAL A 80 1.341 47.465 27.993 1.00 0.00 O ATOM 1303 CB VAL A 80 -1.654 46.630 29.805 1.00 0.00 C ATOM 1304 CG1 VAL A 80 -1.498 45.312 29.045 1.00 0.00 C ATOM 1305 CG2 VAL A 80 -1.939 46.378 31.287 1.00 0.00 C ATOM 0 H VAL A 80 -1.278 49.402 29.321 1.00 0.00 H new ATOM 0 HA VAL A 80 0.356 47.105 30.274 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.509 47.160 29.386 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -2.390 44.702 29.189 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.366 45.518 27.983 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.627 44.776 29.421 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.822 45.747 31.385 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.084 45.879 31.742 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.115 47.329 31.791 1.00 0.00 H new ATOM 1315 N VAL A 81 -0.793 47.518 27.245 1.00 0.00 N ATOM 1316 CA VAL A 81 -0.419 47.504 25.842 1.00 0.00 C ATOM 1317 C VAL A 81 0.499 48.694 25.551 1.00 0.00 C ATOM 1318 O VAL A 81 1.457 48.573 24.790 1.00 0.00 O ATOM 1319 CB VAL A 81 -1.673 47.489 24.966 1.00 0.00 C ATOM 1320 CG1 VAL A 81 -1.328 47.125 23.520 1.00 0.00 C ATOM 1321 CG2 VAL A 81 -2.727 46.537 25.534 1.00 0.00 C ATOM 0 H VAL A 81 -1.798 47.545 27.418 1.00 0.00 H new ATOM 0 HA VAL A 81 0.138 46.598 25.605 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.094 48.494 24.967 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.237 47.122 22.919 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.629 47.858 23.117 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.871 46.136 23.493 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.608 46.545 24.892 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.319 45.527 25.578 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -3.006 46.859 26.537 1.00 0.00 H new ATOM 1331 N GLU A 82 0.173 49.818 26.174 1.00 0.00 N ATOM 1332 CA GLU A 82 0.956 51.027 25.992 1.00 0.00 C ATOM 1333 C GLU A 82 2.421 50.771 26.350 1.00 0.00 C ATOM 1334 O GLU A 82 3.301 51.542 25.969 1.00 0.00 O ATOM 1335 CB GLU A 82 0.383 52.181 26.820 1.00 0.00 C ATOM 1336 CG GLU A 82 1.077 53.500 26.475 1.00 0.00 C ATOM 1337 CD GLU A 82 0.338 54.686 27.097 1.00 0.00 C ATOM 1338 OE1 GLU A 82 0.419 54.897 28.316 1.00 0.00 O ATOM 1339 OE2 GLU A 82 -0.339 55.405 26.266 1.00 0.00 O ATOM 0 H GLU A 82 -0.623 49.916 26.805 1.00 0.00 H new ATOM 0 HA GLU A 82 0.904 51.315 24.942 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.687 52.270 26.635 1.00 0.00 H new ATOM 0 HB3 GLU A 82 0.506 51.968 27.882 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.106 53.479 26.834 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.120 53.621 25.393 1.00 0.00 H new ATOM 1347 N ILE A 83 2.638 49.686 27.078 1.00 0.00 N ATOM 1348 CA ILE A 83 3.981 49.318 27.492 1.00 0.00 C ATOM 1349 C ILE A 83 4.493 48.185 26.598 1.00 0.00 C ATOM 1350 O ILE A 83 5.671 48.153 26.246 1.00 0.00 O ATOM 1351 CB ILE A 83 4.010 48.985 28.985 1.00 0.00 C ATOM 1352 CG1 ILE A 83 3.471 50.150 29.817 1.00 0.00 C ATOM 1353 CG2 ILE A 83 5.414 48.566 29.426 1.00 0.00 C ATOM 1354 CD1 ILE A 83 2.543 49.648 30.925 1.00 0.00 C ATOM 0 H ILE A 83 1.906 49.049 27.392 1.00 0.00 H new ATOM 0 HA ILE A 83 4.663 50.159 27.364 1.00 0.00 H new ATOM 0 HB ILE A 83 3.351 48.134 29.158 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.301 50.703 30.256 1.00 0.00 H new ATOM 0 HG13 ILE A 83 2.931 50.843 29.172 1.00 0.00 H new ATOM 0 HG21 ILE A 83 5.407 48.335 30.491 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.723 47.684 28.865 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.113 49.380 29.236 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.173 50.496 31.502 1.00 0.00 H new ATOM 0 HD12 ILE A 83 1.701 49.116 30.481 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.092 48.974 31.582 1.00 0.00 H new ATOM 1366 N ILE A 84 3.582 47.285 26.259 1.00 0.00 N ATOM 1367 CA ILE A 84 3.926 46.154 25.414 1.00 0.00 C ATOM 1368 C ILE A 84 4.180 46.647 23.989 1.00 0.00 C ATOM 1369 O ILE A 84 5.099 46.177 23.319 1.00 0.00 O ATOM 1370 CB ILE A 84 2.852 45.069 25.508 1.00 0.00 C ATOM 1371 CG1 ILE A 84 2.581 44.689 26.966 1.00 0.00 C ATOM 1372 CG2 ILE A 84 3.228 43.852 24.660 1.00 0.00 C ATOM 1373 CD1 ILE A 84 1.920 43.313 27.061 1.00 0.00 C ATOM 0 H ILE A 84 2.606 47.316 26.554 1.00 0.00 H new ATOM 0 HA ILE A 84 4.848 45.687 25.759 1.00 0.00 H new ATOM 0 HB ILE A 84 1.924 45.471 25.102 1.00 0.00 H new ATOM 0 HG12 ILE A 84 3.517 44.686 27.525 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.937 45.438 27.427 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.448 43.095 24.744 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.331 44.153 23.617 1.00 0.00 H new ATOM 0 HG23 ILE A 84 4.173 43.440 25.014 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.739 43.068 28.108 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.973 43.326 26.522 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.577 42.563 26.621 1.00 0.00 H new ATOM 1385 N ASN A 85 3.349 47.587 23.565 1.00 0.00 N ATOM 1386 CA ASN A 85 3.470 48.149 22.231 1.00 0.00 C ATOM 1387 C ASN A 85 4.905 48.637 22.017 1.00 0.00 C ATOM 1388 O ASN A 85 5.366 48.744 20.882 1.00 0.00 O ATOM 1389 CB ASN A 85 2.533 49.343 22.047 1.00 0.00 C ATOM 1390 CG ASN A 85 2.942 50.506 22.954 1.00 0.00 C ATOM 1391 OD1 ASN A 85 3.678 50.349 23.913 1.00 0.00 O ATOM 1392 ND2 ASN A 85 2.424 51.678 22.596 1.00 0.00 N ATOM 0 H ASN A 85 2.588 47.974 24.123 1.00 0.00 H new ATOM 0 HA ASN A 85 3.207 47.372 21.513 1.00 0.00 H new ATOM 0 HB2 ASN A 85 2.550 49.666 21.006 1.00 0.00 H new ATOM 0 HB3 ASN A 85 1.509 49.044 22.272 1.00 0.00 H new ATOM 0 HD21 ASN A 85 2.637 52.516 23.137 1.00 0.00 H new ATOM 0 HD22 ASN A 85 1.814 51.738 21.781 1.00 0.00 H new ATOM 1399 N ILE A 86 5.571 48.920 23.126 1.00 0.00 N ATOM 1400 CA ILE A 86 6.943 49.395 23.075 1.00 0.00 C ATOM 1401 C ILE A 86 7.878 48.211 22.815 1.00 0.00 C ATOM 1402 O ILE A 86 8.901 48.359 22.148 1.00 0.00 O ATOM 1403 CB ILE A 86 7.286 50.182 24.341 1.00 0.00 C ATOM 1404 CG1 ILE A 86 6.609 51.555 24.333 1.00 0.00 C ATOM 1405 CG2 ILE A 86 8.801 50.290 24.526 1.00 0.00 C ATOM 1406 CD1 ILE A 86 6.393 52.068 25.758 1.00 0.00 C ATOM 0 H ILE A 86 5.186 48.829 24.066 1.00 0.00 H new ATOM 0 HA ILE A 86 7.073 50.094 22.249 1.00 0.00 H new ATOM 0 HB ILE A 86 6.896 49.636 25.200 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.222 52.264 23.777 1.00 0.00 H new ATOM 0 HG13 ILE A 86 5.651 51.489 23.817 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.017 50.854 25.433 1.00 0.00 H new ATOM 0 HG22 ILE A 86 9.230 49.291 24.609 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.237 50.802 23.668 1.00 0.00 H new ATOM 0 HD11 ILE A 86 5.911 53.045 25.724 1.00 0.00 H new ATOM 0 HD12 ILE A 86 5.759 51.369 26.304 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.355 52.156 26.263 1.00 0.00 H new ATOM 1418 N LEU A 87 7.493 47.065 23.355 1.00 0.00 N ATOM 1419 CA LEU A 87 8.284 45.857 23.190 1.00 0.00 C ATOM 1420 C LEU A 87 8.211 45.400 21.731 1.00 0.00 C ATOM 1421 O LEU A 87 9.221 45.010 21.149 1.00 0.00 O ATOM 1422 CB LEU A 87 7.843 44.787 24.191 1.00 0.00 C ATOM 1423 CG LEU A 87 7.688 45.249 25.642 1.00 0.00 C ATOM 1424 CD1 LEU A 87 7.116 44.131 26.515 1.00 0.00 C ATOM 1425 CD2 LEU A 87 9.012 45.785 26.192 1.00 0.00 C ATOM 0 H LEU A 87 6.644 46.947 23.907 1.00 0.00 H new ATOM 0 HA LEU A 87 9.333 46.056 23.411 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.890 44.376 23.857 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.567 43.973 24.165 1.00 0.00 H new ATOM 0 HG LEU A 87 6.974 46.072 25.664 1.00 0.00 H new ATOM 0 HD11 LEU A 87 7.016 44.485 27.541 1.00 0.00 H new ATOM 0 HD12 LEU A 87 6.137 43.838 26.135 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.787 43.272 26.492 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.874 46.106 27.224 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.766 44.999 26.155 1.00 0.00 H new ATOM 0 HD23 LEU A 87 9.340 46.632 25.589 1.00 0.00 H new ATOM 1437 N VAL A 88 7.007 45.465 21.184 1.00 0.00 N ATOM 1438 CA VAL A 88 6.790 45.064 19.804 1.00 0.00 C ATOM 1439 C VAL A 88 7.520 46.034 18.874 1.00 0.00 C ATOM 1440 O VAL A 88 8.260 45.611 17.986 1.00 0.00 O ATOM 1441 CB VAL A 88 5.290 44.973 19.515 1.00 0.00 C ATOM 1442 CG1 VAL A 88 5.016 45.049 18.012 1.00 0.00 C ATOM 1443 CG2 VAL A 88 4.691 43.702 20.118 1.00 0.00 C ATOM 0 H VAL A 88 6.171 45.789 21.671 1.00 0.00 H new ATOM 0 HA VAL A 88 7.203 44.071 19.626 1.00 0.00 H new ATOM 0 HB VAL A 88 4.806 45.828 19.988 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.943 44.982 17.834 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.390 45.995 17.621 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.520 44.224 17.508 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.624 43.663 19.898 1.00 0.00 H new ATOM 0 HG22 VAL A 88 5.183 42.829 19.689 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.839 43.707 21.198 1.00 0.00 H new ATOM 1453 N LYS A 89 7.287 47.318 19.108 1.00 0.00 N ATOM 1454 CA LYS A 89 7.914 48.351 18.302 1.00 0.00 C ATOM 1455 C LYS A 89 9.433 48.164 18.332 1.00 0.00 C ATOM 1456 O LYS A 89 10.122 48.500 17.370 1.00 0.00 O ATOM 1457 CB LYS A 89 7.456 49.737 18.759 1.00 0.00 C ATOM 1458 CG LYS A 89 7.693 50.781 17.665 1.00 0.00 C ATOM 1459 CD LYS A 89 6.603 50.709 16.593 1.00 0.00 C ATOM 1460 CE LYS A 89 5.437 51.637 16.935 1.00 0.00 C ATOM 1461 NZ LYS A 89 4.435 51.633 15.846 1.00 0.00 N ATOM 0 H LYS A 89 6.673 47.666 19.844 1.00 0.00 H new ATOM 0 HA LYS A 89 7.603 48.264 17.261 1.00 0.00 H new ATOM 0 HB2 LYS A 89 6.397 49.708 19.016 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.995 50.023 19.662 1.00 0.00 H new ATOM 0 HG2 LYS A 89 7.709 51.778 18.106 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.669 50.619 17.208 1.00 0.00 H new ATOM 0 HD2 LYS A 89 7.021 50.986 15.625 1.00 0.00 H new ATOM 0 HD3 LYS A 89 6.243 49.684 16.504 1.00 0.00 H new ATOM 0 HE2 LYS A 89 4.971 51.317 17.867 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.806 52.650 17.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 3.650 52.268 16.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.879 51.960 14.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 4.071 50.668 15.713 1.00 0.00 H new ATOM 1474 N ASN A 90 9.910 47.630 19.448 1.00 0.00 N ATOM 1475 CA ASN A 90 11.334 47.395 19.615 1.00 0.00 C ATOM 1476 C ASN A 90 11.778 46.283 18.662 1.00 0.00 C ATOM 1477 O ASN A 90 12.898 46.308 18.153 1.00 0.00 O ATOM 1478 CB ASN A 90 11.654 46.950 21.043 1.00 0.00 C ATOM 1479 CG ASN A 90 13.165 46.877 21.269 1.00 0.00 C ATOM 1480 OD1 ASN A 90 13.942 46.617 20.365 1.00 0.00 O ATOM 1481 ND2 ASN A 90 13.537 47.121 22.522 1.00 0.00 N ATOM 0 H ASN A 90 9.336 47.354 20.244 1.00 0.00 H new ATOM 0 HA ASN A 90 11.858 48.327 19.402 1.00 0.00 H new ATOM 0 HB2 ASN A 90 11.210 47.647 21.753 1.00 0.00 H new ATOM 0 HB3 ASN A 90 11.207 45.974 21.232 1.00 0.00 H new ATOM 0 HD21 ASN A 90 14.525 47.097 22.775 1.00 0.00 H new ATOM 0 HD22 ASN A 90 12.834 47.332 23.231 1.00 0.00 H new