USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=7 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= -0.52 X(o=-0.52,f=-0.41) USER MOD Single : A 26 ASN : amide:sc= -3.67! C(o=-3.7!,f=-7.3!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.606 X(o=-0.61,f=-0.99) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 170:sc= -3.87! USER MOD Single : A 61 ASN : amide:sc= -0.0247 X(o=-0.025,f=-0.0034) USER MOD Single : A 65 TYR OH : rot 30:sc= 0.417 USER MOD Single : A 66 SER OG : rot 180:sc= 0 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 -140:sc= -3.65! USER MOD Single : A 85 ASN : amide:sc= -0.0546 X(o=-0.055,f=-0.055) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.0346 X(o=-0.035,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 312 N THR A 21 12.738 36.562 35.069 1.00 0.00 N ATOM 313 CA THR A 21 12.968 37.957 35.405 1.00 0.00 C ATOM 314 C THR A 21 13.073 38.802 34.133 1.00 0.00 C ATOM 315 O THR A 21 12.211 39.638 33.866 1.00 0.00 O ATOM 316 CB THR A 21 14.214 38.031 36.288 1.00 0.00 C ATOM 317 OG1 THR A 21 13.697 38.108 37.614 1.00 0.00 O ATOM 318 CG2 THR A 21 14.980 39.344 36.111 1.00 0.00 C ATOM 0 HA THR A 21 12.130 38.372 35.965 1.00 0.00 H new ATOM 0 HB THR A 21 14.871 37.193 36.058 1.00 0.00 H new ATOM 0 HG1 THR A 21 14.439 38.157 38.252 1.00 0.00 H new ATOM 0 HG21 THR A 21 15.855 39.345 36.760 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.298 39.443 35.073 1.00 0.00 H new ATOM 0 HG23 THR A 21 14.333 40.181 36.373 1.00 0.00 H new ATOM 326 N HIS A 22 14.136 38.552 33.382 1.00 0.00 N ATOM 327 CA HIS A 22 14.365 39.280 32.145 1.00 0.00 C ATOM 328 C HIS A 22 13.043 39.444 31.394 1.00 0.00 C ATOM 329 O HIS A 22 12.813 40.467 30.751 1.00 0.00 O ATOM 330 CB HIS A 22 15.444 38.594 31.305 1.00 0.00 C ATOM 331 CG HIS A 22 16.808 39.231 31.419 1.00 0.00 C ATOM 332 ND1 HIS A 22 17.577 39.155 32.568 1.00 0.00 N ATOM 333 CD2 HIS A 22 17.533 39.953 30.518 1.00 0.00 C ATOM 334 CE1 HIS A 22 18.711 39.806 32.356 1.00 0.00 C ATOM 335 NE2 HIS A 22 18.682 40.301 31.085 1.00 0.00 N ATOM 0 H HIS A 22 14.847 37.856 33.606 1.00 0.00 H new ATOM 0 HA HIS A 22 14.741 40.278 32.369 1.00 0.00 H new ATOM 0 HB2 HIS A 22 15.516 37.549 31.607 1.00 0.00 H new ATOM 0 HB3 HIS A 22 15.136 38.603 30.259 1.00 0.00 H new ATOM 0 HD2 HIS A 22 17.225 40.200 29.513 1.00 0.00 H new ATOM 0 HE1 HIS A 22 19.517 39.924 33.065 1.00 0.00 H new ATOM 0 HE2 HIS A 22 19.421 40.848 30.643 1.00 0.00 H new ATOM 343 N HIS A 23 12.207 38.421 31.501 1.00 0.00 N ATOM 344 CA HIS A 23 10.913 38.439 30.839 1.00 0.00 C ATOM 345 C HIS A 23 10.052 39.559 31.426 1.00 0.00 C ATOM 346 O HIS A 23 9.488 40.365 30.689 1.00 0.00 O ATOM 347 CB HIS A 23 10.241 37.067 30.924 1.00 0.00 C ATOM 348 CG HIS A 23 10.829 36.036 29.991 1.00 0.00 C ATOM 349 ND1 HIS A 23 11.654 36.369 28.931 1.00 0.00 N ATOM 350 CD2 HIS A 23 10.701 34.679 29.968 1.00 0.00 C ATOM 351 CE1 HIS A 23 12.002 35.254 28.305 1.00 0.00 C ATOM 352 NE2 HIS A 23 11.410 34.207 28.949 1.00 0.00 N ATOM 0 H HIS A 23 12.401 37.574 32.036 1.00 0.00 H new ATOM 0 HA HIS A 23 11.046 38.649 29.778 1.00 0.00 H new ATOM 0 HB2 HIS A 23 10.316 36.700 31.948 1.00 0.00 H new ATOM 0 HB3 HIS A 23 9.180 37.179 30.702 1.00 0.00 H new ATOM 0 HD2 HIS A 23 10.121 34.088 30.661 1.00 0.00 H new ATOM 0 HE1 HIS A 23 12.642 35.186 27.438 1.00 0.00 H new ATOM 0 HE2 HIS A 23 11.497 33.224 28.691 1.00 0.00 H new ATOM 360 N TRP A 24 9.978 39.574 32.750 1.00 0.00 N ATOM 361 CA TRP A 24 9.195 40.581 33.444 1.00 0.00 C ATOM 362 C TRP A 24 9.910 41.925 33.288 1.00 0.00 C ATOM 363 O TRP A 24 9.274 42.942 33.019 1.00 0.00 O ATOM 364 CB TRP A 24 8.970 40.189 34.906 1.00 0.00 C ATOM 365 CG TRP A 24 8.394 41.312 35.770 1.00 0.00 C ATOM 366 CD1 TRP A 24 8.906 41.836 36.892 1.00 0.00 C ATOM 367 CD2 TRP A 24 7.166 42.034 35.535 1.00 0.00 C ATOM 368 NE1 TRP A 24 8.102 42.838 37.395 1.00 0.00 N ATOM 369 CE2 TRP A 24 7.010 42.962 36.544 1.00 0.00 C ATOM 370 CE3 TRP A 24 6.219 41.906 34.504 1.00 0.00 C ATOM 371 CZ2 TRP A 24 5.918 43.833 36.621 1.00 0.00 C ATOM 372 CZ3 TRP A 24 5.133 42.785 34.595 1.00 0.00 C ATOM 373 CH2 TRP A 24 4.961 43.725 35.604 1.00 0.00 C ATOM 0 H TRP A 24 10.448 38.904 33.359 1.00 0.00 H new ATOM 0 HA TRP A 24 8.199 40.664 33.009 1.00 0.00 H new ATOM 0 HB2 TRP A 24 8.295 39.334 34.942 1.00 0.00 H new ATOM 0 HB3 TRP A 24 9.918 39.865 35.335 1.00 0.00 H new ATOM 0 HD1 TRP A 24 9.832 41.514 37.346 1.00 0.00 H new ATOM 0 HE1 TRP A 24 8.277 43.387 38.237 1.00 0.00 H new ATOM 0 HE3 TRP A 24 6.321 41.187 33.705 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 5.818 44.551 37.422 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 4.376 42.729 33.827 1.00 0.00 H new ATOM 0 HH2 TRP A 24 4.094 44.369 35.604 1.00 0.00 H new ATOM 384 N LEU A 25 11.222 41.885 33.466 1.00 0.00 N ATOM 385 CA LEU A 25 12.031 43.087 33.349 1.00 0.00 C ATOM 386 C LEU A 25 11.755 43.751 31.998 1.00 0.00 C ATOM 387 O LEU A 25 11.893 44.966 31.860 1.00 0.00 O ATOM 388 CB LEU A 25 13.507 42.766 33.586 1.00 0.00 C ATOM 389 CG LEU A 25 14.387 43.938 34.025 1.00 0.00 C ATOM 390 CD1 LEU A 25 13.711 44.744 35.137 1.00 0.00 C ATOM 391 CD2 LEU A 25 15.779 43.456 34.433 1.00 0.00 C ATOM 0 H LEU A 25 11.746 41.039 33.690 1.00 0.00 H new ATOM 0 HA LEU A 25 11.758 43.806 34.121 1.00 0.00 H new ATOM 0 HB2 LEU A 25 13.571 41.986 34.344 1.00 0.00 H new ATOM 0 HB3 LEU A 25 13.920 42.352 32.666 1.00 0.00 H new ATOM 0 HG LEU A 25 14.515 44.607 33.174 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.357 45.571 35.431 1.00 0.00 H new ATOM 0 HD12 LEU A 25 12.761 45.137 34.775 1.00 0.00 H new ATOM 0 HD13 LEU A 25 13.533 44.099 35.997 1.00 0.00 H new ATOM 0 HD21 LEU A 25 16.384 44.309 34.741 1.00 0.00 H new ATOM 0 HD22 LEU A 25 15.692 42.755 35.263 1.00 0.00 H new ATOM 0 HD23 LEU A 25 16.255 42.960 33.587 1.00 0.00 H new ATOM 403 N ASN A 26 11.371 42.926 31.036 1.00 0.00 N ATOM 404 CA ASN A 26 11.075 43.418 29.701 1.00 0.00 C ATOM 405 C ASN A 26 9.770 44.215 29.734 1.00 0.00 C ATOM 406 O ASN A 26 9.495 45.000 28.827 1.00 0.00 O ATOM 407 CB ASN A 26 10.899 42.261 28.714 1.00 0.00 C ATOM 408 CG ASN A 26 10.769 42.780 27.281 1.00 0.00 C ATOM 409 OD1 ASN A 26 9.714 42.735 26.670 1.00 0.00 O ATOM 410 ND2 ASN A 26 11.898 43.273 26.780 1.00 0.00 N ATOM 0 H ASN A 26 11.258 41.919 31.154 1.00 0.00 H new ATOM 0 HA ASN A 26 11.908 44.043 29.379 1.00 0.00 H new ATOM 0 HB2 ASN A 26 11.751 41.585 28.784 1.00 0.00 H new ATOM 0 HB3 ASN A 26 10.012 41.684 28.978 1.00 0.00 H new ATOM 0 HD21 ASN A 26 11.915 43.644 25.830 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.747 43.281 27.346 1.00 0.00 H new ATOM 417 N PHE A 27 9.000 43.986 30.787 1.00 0.00 N ATOM 418 CA PHE A 27 7.730 44.673 30.950 1.00 0.00 C ATOM 419 C PHE A 27 7.859 45.837 31.934 1.00 0.00 C ATOM 420 O PHE A 27 7.201 46.865 31.776 1.00 0.00 O ATOM 421 CB PHE A 27 6.738 43.653 31.512 1.00 0.00 C ATOM 422 CG PHE A 27 5.278 43.951 31.169 1.00 0.00 C ATOM 423 CD1 PHE A 27 4.933 45.162 30.655 1.00 0.00 C ATOM 424 CD2 PHE A 27 4.323 43.005 31.378 1.00 0.00 C ATOM 425 CE1 PHE A 27 3.577 45.439 30.336 1.00 0.00 C ATOM 426 CE2 PHE A 27 2.966 43.282 31.060 1.00 0.00 C ATOM 427 CZ PHE A 27 2.623 44.493 30.546 1.00 0.00 C ATOM 0 H PHE A 27 9.231 43.334 31.536 1.00 0.00 H new ATOM 0 HA PHE A 27 7.400 45.076 29.993 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.995 42.664 31.132 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.846 43.616 32.596 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.691 45.914 30.489 1.00 0.00 H new ATOM 0 HD2 PHE A 27 4.596 42.043 31.786 1.00 0.00 H new ATOM 0 HE1 PHE A 27 3.304 46.400 29.927 1.00 0.00 H new ATOM 0 HE2 PHE A 27 2.208 42.531 31.226 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.592 44.704 30.304 1.00 0.00 H new ATOM 437 N LEU A 28 8.710 45.638 32.930 1.00 0.00 N ATOM 438 CA LEU A 28 8.933 46.658 33.940 1.00 0.00 C ATOM 439 C LEU A 28 9.776 47.786 33.341 1.00 0.00 C ATOM 440 O LEU A 28 9.762 48.910 33.842 1.00 0.00 O ATOM 441 CB LEU A 28 9.539 46.039 35.201 1.00 0.00 C ATOM 442 CG LEU A 28 9.446 46.884 36.473 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.001 47.302 36.749 1.00 0.00 C ATOM 444 CD2 LEU A 28 10.068 46.152 37.664 1.00 0.00 C ATOM 0 H LEU A 28 9.254 44.785 33.059 1.00 0.00 H new ATOM 0 HA LEU A 28 7.987 47.099 34.253 1.00 0.00 H new ATOM 0 HB2 LEU A 28 9.047 45.084 35.386 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.590 45.824 35.007 1.00 0.00 H new ATOM 0 HG LEU A 28 10.022 47.797 36.319 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.963 47.901 37.659 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.626 47.890 35.911 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.383 46.413 36.874 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.989 46.774 38.555 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.541 45.212 37.829 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.118 45.947 37.457 1.00 0.00 H new ATOM 456 N GLN A 29 10.492 47.447 32.279 1.00 0.00 N ATOM 457 CA GLN A 29 11.339 48.417 31.607 1.00 0.00 C ATOM 458 C GLN A 29 10.488 49.391 30.790 1.00 0.00 C ATOM 459 O GLN A 29 10.539 50.601 31.009 1.00 0.00 O ATOM 460 CB GLN A 29 12.375 47.720 30.723 1.00 0.00 C ATOM 461 CG GLN A 29 13.754 47.728 31.384 1.00 0.00 C ATOM 462 CD GLN A 29 14.783 46.997 30.518 1.00 0.00 C ATOM 463 OE1 GLN A 29 14.485 46.025 29.844 1.00 0.00 O ATOM 464 NE2 GLN A 29 16.005 47.519 30.573 1.00 0.00 N ATOM 0 H GLN A 29 10.503 46.514 31.867 1.00 0.00 H new ATOM 0 HA GLN A 29 11.879 48.985 32.365 1.00 0.00 H new ATOM 0 HB2 GLN A 29 12.064 46.692 30.534 1.00 0.00 H new ATOM 0 HB3 GLN A 29 12.428 48.220 29.756 1.00 0.00 H new ATOM 0 HG2 GLN A 29 14.076 48.756 31.548 1.00 0.00 H new ATOM 0 HG3 GLN A 29 13.694 47.253 32.363 1.00 0.00 H new ATOM 0 HE21 GLN A 29 16.185 48.334 31.159 1.00 0.00 H new ATOM 0 HE22 GLN A 29 16.762 47.104 30.030 1.00 0.00 H new ATOM 473 N ALA A 30 9.722 48.828 29.867 1.00 0.00 N ATOM 474 CA ALA A 30 8.860 49.631 29.017 1.00 0.00 C ATOM 475 C ALA A 30 7.953 50.499 29.892 1.00 0.00 C ATOM 476 O ALA A 30 7.647 51.636 29.538 1.00 0.00 O ATOM 477 CB ALA A 30 8.068 48.715 28.083 1.00 0.00 C ATOM 0 H ALA A 30 9.681 47.824 29.689 1.00 0.00 H new ATOM 0 HA ALA A 30 9.452 50.300 28.392 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.421 49.317 27.445 1.00 0.00 H new ATOM 0 HB2 ALA A 30 8.758 48.143 27.463 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.459 48.031 28.674 1.00 0.00 H new ATOM 483 N ALA A 31 7.550 49.929 31.018 1.00 0.00 N ATOM 484 CA ALA A 31 6.685 50.636 31.946 1.00 0.00 C ATOM 485 C ALA A 31 7.480 51.747 32.633 1.00 0.00 C ATOM 486 O ALA A 31 6.902 52.712 33.130 1.00 0.00 O ATOM 487 CB ALA A 31 6.087 49.642 32.945 1.00 0.00 C ATOM 0 H ALA A 31 7.807 48.986 31.308 1.00 0.00 H new ATOM 0 HA ALA A 31 5.856 51.105 31.416 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.438 50.172 33.642 1.00 0.00 H new ATOM 0 HB2 ALA A 31 5.507 48.891 32.408 1.00 0.00 H new ATOM 0 HB3 ALA A 31 6.890 49.154 33.497 1.00 0.00 H new ATOM 493 N TYR A 32 8.794 51.573 32.640 1.00 0.00 N ATOM 494 CA TYR A 32 9.675 52.550 33.257 1.00 0.00 C ATOM 495 C TYR A 32 10.025 53.671 32.276 1.00 0.00 C ATOM 496 O TYR A 32 10.393 54.769 32.689 1.00 0.00 O ATOM 497 CB TYR A 32 10.951 51.792 33.626 1.00 0.00 C ATOM 498 CG TYR A 32 11.307 51.858 35.112 1.00 0.00 C ATOM 499 CD1 TYR A 32 11.383 53.078 35.751 1.00 0.00 C ATOM 500 CD2 TYR A 32 11.551 50.695 35.815 1.00 0.00 C ATOM 501 CE1 TYR A 32 11.717 53.140 37.150 1.00 0.00 C ATOM 502 CE2 TYR A 32 11.886 50.756 37.214 1.00 0.00 C ATOM 503 CZ TYR A 32 11.952 51.976 37.813 1.00 0.00 C ATOM 504 OH TYR A 32 12.268 52.034 39.134 1.00 0.00 O ATOM 0 H TYR A 32 9.269 50.770 32.228 1.00 0.00 H new ATOM 0 HA TYR A 32 9.195 53.007 34.123 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.837 50.747 33.336 1.00 0.00 H new ATOM 0 HB3 TYR A 32 11.781 52.195 33.046 1.00 0.00 H new ATOM 0 HD1 TYR A 32 11.192 53.988 35.201 1.00 0.00 H new ATOM 0 HD2 TYR A 32 11.491 49.739 35.315 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.780 54.089 37.661 1.00 0.00 H new ATOM 0 HE2 TYR A 32 12.080 49.854 37.775 1.00 0.00 H new ATOM 0 HH TYR A 32 12.408 51.127 39.477 1.00 0.00 H new ATOM 514 N ARG A 33 9.898 53.353 30.996 1.00 0.00 N ATOM 515 CA ARG A 33 10.198 54.319 29.953 1.00 0.00 C ATOM 516 C ARG A 33 9.004 55.252 29.735 1.00 0.00 C ATOM 517 O ARG A 33 9.106 56.235 29.002 1.00 0.00 O ATOM 518 CB ARG A 33 10.536 53.620 28.635 1.00 0.00 C ATOM 519 CG ARG A 33 10.838 54.639 27.535 1.00 0.00 C ATOM 520 CD ARG A 33 11.834 55.694 28.023 1.00 0.00 C ATOM 521 NE ARG A 33 12.783 56.034 26.938 1.00 0.00 N ATOM 522 CZ ARG A 33 12.424 56.608 25.771 1.00 0.00 C ATOM 523 NH1 ARG A 33 11.130 56.912 25.526 1.00 0.00 N ATOM 524 NH2 ARG A 33 13.354 56.868 24.872 1.00 0.00 N ATOM 0 H ARG A 33 9.592 52.441 30.658 1.00 0.00 H new ATOM 0 HA ARG A 33 11.063 54.898 30.276 1.00 0.00 H new ATOM 0 HB2 ARG A 33 11.397 52.966 28.776 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.702 52.987 28.331 1.00 0.00 H new ATOM 0 HG2 ARG A 33 11.243 54.128 26.662 1.00 0.00 H new ATOM 0 HG3 ARG A 33 9.914 55.124 27.220 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.301 56.589 28.345 1.00 0.00 H new ATOM 0 HD3 ARG A 33 12.379 55.319 28.890 1.00 0.00 H new ATOM 0 HE ARG A 33 13.770 55.821 27.082 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.417 56.708 26.226 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.867 57.346 24.641 1.00 0.00 H new ATOM 0 HH21 ARG A 33 14.328 56.635 25.064 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.099 57.302 23.985 1.00 0.00 H new ATOM 537 N LEU A 34 7.902 54.912 30.387 1.00 0.00 N ATOM 538 CA LEU A 34 6.691 55.707 30.274 1.00 0.00 C ATOM 539 C LEU A 34 6.618 56.687 31.446 1.00 0.00 C ATOM 540 O LEU A 34 7.361 57.666 31.491 1.00 0.00 O ATOM 541 CB LEU A 34 5.465 54.801 30.152 1.00 0.00 C ATOM 542 CG LEU A 34 5.429 53.880 28.930 1.00 0.00 C ATOM 543 CD1 LEU A 34 4.251 52.909 29.010 1.00 0.00 C ATOM 544 CD2 LEU A 34 5.416 54.691 27.634 1.00 0.00 C ATOM 0 H LEU A 34 7.822 54.097 30.995 1.00 0.00 H new ATOM 0 HA LEU A 34 6.710 56.303 29.361 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.403 54.184 31.049 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.574 55.429 30.135 1.00 0.00 H new ATOM 0 HG LEU A 34 6.340 53.281 28.926 1.00 0.00 H new ATOM 0 HD11 LEU A 34 4.249 52.266 28.130 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.345 52.296 29.906 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.318 53.471 29.051 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.390 54.013 26.781 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.535 55.332 27.615 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.314 55.307 27.581 1.00 0.00 H new ATOM 665 N PHE A 43 2.005 49.980 37.778 1.00 0.00 N ATOM 666 CA PHE A 43 2.240 48.584 38.108 1.00 0.00 C ATOM 667 C PHE A 43 0.962 47.919 38.623 1.00 0.00 C ATOM 668 O PHE A 43 0.913 46.700 38.781 1.00 0.00 O ATOM 669 CB PHE A 43 3.296 48.558 39.213 1.00 0.00 C ATOM 670 CG PHE A 43 4.582 49.311 38.865 1.00 0.00 C ATOM 671 CD1 PHE A 43 4.878 49.584 37.566 1.00 0.00 C ATOM 672 CD2 PHE A 43 5.429 49.704 39.853 1.00 0.00 C ATOM 673 CE1 PHE A 43 6.071 50.284 37.243 1.00 0.00 C ATOM 674 CE2 PHE A 43 6.622 50.402 39.529 1.00 0.00 C ATOM 675 CZ PHE A 43 6.919 50.677 38.231 1.00 0.00 C ATOM 0 HA PHE A 43 2.566 48.042 37.221 1.00 0.00 H new ATOM 0 HB2 PHE A 43 2.869 48.988 40.119 1.00 0.00 H new ATOM 0 HB3 PHE A 43 3.545 47.521 39.439 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.207 49.269 36.781 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.194 49.485 40.884 1.00 0.00 H new ATOM 0 HE1 PHE A 43 6.305 50.504 36.212 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.294 50.715 40.314 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.827 51.207 37.985 1.00 0.00 H new ATOM 685 N GLN A 44 -0.040 48.749 38.871 1.00 0.00 N ATOM 686 CA GLN A 44 -1.315 48.257 39.365 1.00 0.00 C ATOM 687 C GLN A 44 -2.138 47.669 38.218 1.00 0.00 C ATOM 688 O GLN A 44 -2.417 46.471 38.199 1.00 0.00 O ATOM 689 CB GLN A 44 -2.088 49.364 40.083 1.00 0.00 C ATOM 690 CG GLN A 44 -3.191 48.777 40.968 1.00 0.00 C ATOM 691 CD GLN A 44 -2.622 47.737 41.935 1.00 0.00 C ATOM 692 OE1 GLN A 44 -2.603 46.547 41.668 1.00 0.00 O ATOM 693 NE2 GLN A 44 -2.162 48.252 43.072 1.00 0.00 N ATOM 0 H GLN A 44 0.005 49.759 38.739 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.121 47.466 40.089 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -1.403 49.954 40.692 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -2.527 50.041 39.350 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -3.675 49.576 41.530 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -3.957 48.318 40.344 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.208 49.258 43.232 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -1.763 47.641 43.784 1.00 0.00 H new ATOM 702 N GLN A 45 -2.503 48.539 37.287 1.00 0.00 N ATOM 703 CA GLN A 45 -3.288 48.121 36.138 1.00 0.00 C ATOM 704 C GLN A 45 -2.505 47.110 35.299 1.00 0.00 C ATOM 705 O GLN A 45 -3.067 46.461 34.418 1.00 0.00 O ATOM 706 CB GLN A 45 -3.709 49.326 35.294 1.00 0.00 C ATOM 707 CG GLN A 45 -5.228 49.517 35.330 1.00 0.00 C ATOM 708 CD GLN A 45 -5.590 50.994 35.486 1.00 0.00 C ATOM 709 OE1 GLN A 45 -5.802 51.714 34.524 1.00 0.00 O ATOM 710 NE2 GLN A 45 -5.650 51.406 36.750 1.00 0.00 N ATOM 0 H GLN A 45 -2.269 49.532 37.305 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.196 47.637 36.499 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -3.217 50.225 35.666 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.381 49.186 34.264 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.669 49.125 34.413 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -5.651 48.946 36.157 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -5.461 50.752 37.509 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -5.885 52.376 36.960 1.00 0.00 H new ATOM 719 N LEU A 46 -1.219 47.007 35.602 1.00 0.00 N ATOM 720 CA LEU A 46 -0.353 46.087 34.886 1.00 0.00 C ATOM 721 C LEU A 46 -0.389 44.721 35.573 1.00 0.00 C ATOM 722 O LEU A 46 -0.422 43.687 34.907 1.00 0.00 O ATOM 723 CB LEU A 46 1.056 46.671 34.752 1.00 0.00 C ATOM 724 CG LEU A 46 1.957 46.014 33.705 1.00 0.00 C ATOM 725 CD1 LEU A 46 3.407 46.476 33.863 1.00 0.00 C ATOM 726 CD2 LEU A 46 1.832 44.490 33.753 1.00 0.00 C ATOM 0 H LEU A 46 -0.756 47.546 36.334 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.711 45.942 33.867 1.00 0.00 H new ATOM 0 HB2 LEU A 46 0.967 47.731 34.513 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.550 46.603 35.721 1.00 0.00 H new ATOM 0 HG LEU A 46 1.623 46.333 32.718 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.027 45.994 33.107 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.460 47.558 33.740 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.769 46.205 34.855 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.483 44.048 32.999 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.125 44.132 34.740 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.799 44.203 33.555 1.00 0.00 H new ATOM 738 N ARG A 47 -0.382 44.760 36.898 1.00 0.00 N ATOM 739 CA ARG A 47 -0.413 43.537 37.683 1.00 0.00 C ATOM 740 C ARG A 47 -1.716 42.777 37.429 1.00 0.00 C ATOM 741 O ARG A 47 -1.789 41.570 37.655 1.00 0.00 O ATOM 742 CB ARG A 47 -0.290 43.839 39.178 1.00 0.00 C ATOM 743 CG ARG A 47 0.118 42.589 39.958 1.00 0.00 C ATOM 744 CD ARG A 47 0.213 42.883 41.457 1.00 0.00 C ATOM 745 NE ARG A 47 1.002 41.829 42.131 1.00 0.00 N ATOM 746 CZ ARG A 47 0.956 41.581 43.457 1.00 0.00 C ATOM 747 NH1 ARG A 47 0.156 42.310 44.264 1.00 0.00 N ATOM 748 NH2 ARG A 47 1.705 40.614 43.954 1.00 0.00 N ATOM 0 H ARG A 47 -0.355 45.619 37.447 1.00 0.00 H new ATOM 0 HA ARG A 47 0.435 42.924 37.377 1.00 0.00 H new ATOM 0 HB2 ARG A 47 0.448 44.626 39.334 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.241 44.214 39.556 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -0.609 41.795 39.785 1.00 0.00 H new ATOM 0 HG3 ARG A 47 1.079 42.226 39.593 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.679 43.855 41.616 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -0.786 42.934 41.890 1.00 0.00 H new ATOM 0 HE ARG A 47 1.619 41.254 41.558 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -0.420 43.055 43.873 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.128 42.115 45.265 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.307 40.067 43.338 1.00 0.00 H new ATOM 0 HH22 ARG A 47 1.682 40.414 44.954 1.00 0.00 H new ATOM 761 N ARG A 48 -2.713 43.515 36.962 1.00 0.00 N ATOM 762 CA ARG A 48 -4.010 42.926 36.675 1.00 0.00 C ATOM 763 C ARG A 48 -3.928 42.044 35.427 1.00 0.00 C ATOM 764 O ARG A 48 -4.610 41.025 35.337 1.00 0.00 O ATOM 765 CB ARG A 48 -5.071 44.006 36.459 1.00 0.00 C ATOM 766 CG ARG A 48 -6.336 43.415 35.833 1.00 0.00 C ATOM 767 CD ARG A 48 -6.966 42.368 36.755 1.00 0.00 C ATOM 768 NE ARG A 48 -7.127 42.924 38.116 1.00 0.00 N ATOM 769 CZ ARG A 48 -8.032 43.870 38.446 1.00 0.00 C ATOM 770 NH1 ARG A 48 -8.867 44.374 37.513 1.00 0.00 N ATOM 771 NH2 ARG A 48 -8.088 44.295 39.695 1.00 0.00 N ATOM 0 H ARG A 48 -2.648 44.516 36.775 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.296 42.320 37.535 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.317 44.474 37.412 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.673 44.788 35.813 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.054 44.211 35.636 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.093 42.960 34.873 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -7.935 42.061 36.362 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -6.339 41.477 36.789 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.516 42.570 38.852 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -8.817 44.040 36.550 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.548 45.088 37.771 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.453 43.909 40.394 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.766 45.009 39.961 1.00 0.00 H new ATOM 784 N PHE A 49 -3.086 42.469 34.496 1.00 0.00 N ATOM 785 CA PHE A 49 -2.906 41.731 33.257 1.00 0.00 C ATOM 786 C PHE A 49 -2.101 40.453 33.493 1.00 0.00 C ATOM 787 O PHE A 49 -2.345 39.433 32.849 1.00 0.00 O ATOM 788 CB PHE A 49 -2.128 42.641 32.304 1.00 0.00 C ATOM 789 CG PHE A 49 -1.869 42.025 30.928 1.00 0.00 C ATOM 790 CD1 PHE A 49 -2.904 41.524 30.201 1.00 0.00 C ATOM 791 CD2 PHE A 49 -0.604 41.977 30.431 1.00 0.00 C ATOM 792 CE1 PHE A 49 -2.664 40.951 28.924 1.00 0.00 C ATOM 793 CE2 PHE A 49 -0.364 41.405 29.154 1.00 0.00 C ATOM 794 CZ PHE A 49 -1.399 40.904 28.427 1.00 0.00 C ATOM 0 H PHE A 49 -2.521 43.315 34.575 1.00 0.00 H new ATOM 0 HA PHE A 49 -3.876 41.447 32.848 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.680 43.572 32.176 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -1.172 42.897 32.762 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.909 41.562 30.595 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.218 42.374 31.008 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.486 40.553 28.348 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.641 41.368 28.760 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.216 40.469 27.455 1.00 0.00 H new ATOM 804 N LEU A 50 -1.157 40.548 34.418 1.00 0.00 N ATOM 805 CA LEU A 50 -0.314 39.410 34.747 1.00 0.00 C ATOM 806 C LEU A 50 -1.145 38.364 35.493 1.00 0.00 C ATOM 807 O LEU A 50 -1.240 37.217 35.058 1.00 0.00 O ATOM 808 CB LEU A 50 0.929 39.868 35.512 1.00 0.00 C ATOM 809 CG LEU A 50 1.828 40.876 34.792 1.00 0.00 C ATOM 810 CD1 LEU A 50 2.780 41.560 35.774 1.00 0.00 C ATOM 811 CD2 LEU A 50 2.574 40.213 33.633 1.00 0.00 C ATOM 0 H LEU A 50 -0.957 41.395 34.950 1.00 0.00 H new ATOM 0 HA LEU A 50 0.056 38.935 33.839 1.00 0.00 H new ATOM 0 HB2 LEU A 50 0.608 40.307 36.457 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.525 38.989 35.756 1.00 0.00 H new ATOM 0 HG LEU A 50 1.197 41.654 34.364 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.408 42.271 35.237 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.202 42.087 36.533 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.410 40.810 36.253 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.206 40.950 33.138 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.194 39.402 34.016 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.855 39.813 32.918 1.00 0.00 H new ATOM 823 N LYS A 51 -1.726 38.797 36.602 1.00 0.00 N ATOM 824 CA LYS A 51 -2.545 37.912 37.412 1.00 0.00 C ATOM 825 C LYS A 51 -3.634 37.288 36.537 1.00 0.00 C ATOM 826 O LYS A 51 -4.121 36.197 36.828 1.00 0.00 O ATOM 827 CB LYS A 51 -3.090 38.655 38.634 1.00 0.00 C ATOM 828 CG LYS A 51 -3.774 37.688 39.603 1.00 0.00 C ATOM 829 CD LYS A 51 -5.293 37.870 39.578 1.00 0.00 C ATOM 830 CE LYS A 51 -5.997 36.552 39.252 1.00 0.00 C ATOM 831 NZ LYS A 51 -7.086 36.773 38.275 1.00 0.00 N ATOM 0 H LYS A 51 -1.646 39.749 36.959 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.944 37.093 37.807 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.276 39.171 39.143 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -3.800 39.418 38.314 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.523 36.662 39.336 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.401 37.855 40.613 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.635 38.240 40.545 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.561 38.623 38.836 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.278 35.839 38.849 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.402 36.114 40.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.553 35.868 38.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.780 37.437 38.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.691 37.170 37.399 1.00 0.00 H new ATOM 844 N LEU A 52 -3.982 38.007 35.480 1.00 0.00 N ATOM 845 CA LEU A 52 -5.004 37.537 34.559 1.00 0.00 C ATOM 846 C LEU A 52 -4.473 36.325 33.790 1.00 0.00 C ATOM 847 O LEU A 52 -5.082 35.256 33.813 1.00 0.00 O ATOM 848 CB LEU A 52 -5.478 38.678 33.656 1.00 0.00 C ATOM 849 CG LEU A 52 -6.328 38.272 32.451 1.00 0.00 C ATOM 850 CD1 LEU A 52 -7.302 39.386 32.066 1.00 0.00 C ATOM 851 CD2 LEU A 52 -5.445 37.849 31.274 1.00 0.00 C ATOM 0 H LEU A 52 -3.575 38.911 35.241 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.887 37.207 35.106 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.053 39.379 34.261 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.602 39.215 33.293 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.926 37.405 32.732 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.894 39.071 31.207 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.965 39.596 32.906 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.743 40.286 31.811 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.074 37.565 30.431 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.803 38.680 30.984 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.829 37.000 31.568 1.00 0.00 H new ATOM 863 N ALA A 53 -3.345 36.532 33.127 1.00 0.00 N ATOM 864 CA ALA A 53 -2.726 35.469 32.353 1.00 0.00 C ATOM 865 C ALA A 53 -2.510 34.249 33.251 1.00 0.00 C ATOM 866 O ALA A 53 -2.540 33.114 32.779 1.00 0.00 O ATOM 867 CB ALA A 53 -1.421 35.980 31.739 1.00 0.00 C ATOM 0 H ALA A 53 -2.843 37.420 33.110 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.375 35.163 31.533 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.956 35.184 31.158 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.633 36.828 31.088 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.743 36.293 32.533 1.00 0.00 H new ATOM 873 N LEU A 54 -2.298 34.526 34.530 1.00 0.00 N ATOM 874 CA LEU A 54 -2.077 33.465 35.498 1.00 0.00 C ATOM 875 C LEU A 54 -3.325 32.583 35.574 1.00 0.00 C ATOM 876 O LEU A 54 -3.281 31.487 36.132 1.00 0.00 O ATOM 877 CB LEU A 54 -1.654 34.051 36.846 1.00 0.00 C ATOM 878 CG LEU A 54 -0.347 33.510 37.432 1.00 0.00 C ATOM 879 CD1 LEU A 54 0.738 33.416 36.357 1.00 0.00 C ATOM 880 CD2 LEU A 54 0.103 34.347 38.630 1.00 0.00 C ATOM 0 H LEU A 54 -2.275 35.469 34.918 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.253 32.825 35.182 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.560 35.131 36.737 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.453 33.871 37.565 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.527 32.498 37.796 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.656 33.029 36.799 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.407 32.746 35.564 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.925 34.406 35.941 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.033 33.942 39.028 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.262 35.378 38.314 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.665 34.318 39.403 1.00 0.00 H new ATOM 892 N LYS A 55 -4.407 33.093 35.006 1.00 0.00 N ATOM 893 CA LYS A 55 -5.664 32.364 35.002 1.00 0.00 C ATOM 894 C LYS A 55 -5.586 31.226 33.982 1.00 0.00 C ATOM 895 O LYS A 55 -6.523 30.440 33.852 1.00 0.00 O ATOM 896 CB LYS A 55 -6.836 33.320 34.768 1.00 0.00 C ATOM 897 CG LYS A 55 -8.170 32.634 35.068 1.00 0.00 C ATOM 898 CD LYS A 55 -9.347 33.508 34.628 1.00 0.00 C ATOM 899 CE LYS A 55 -10.650 33.039 35.276 1.00 0.00 C ATOM 900 NZ LYS A 55 -11.804 33.782 34.720 1.00 0.00 N ATOM 0 H LYS A 55 -4.440 34.002 34.545 1.00 0.00 H new ATOM 0 HA LYS A 55 -5.843 31.908 35.976 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -6.725 34.200 35.402 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.826 33.668 33.735 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -8.213 31.674 34.554 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.245 32.427 36.136 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -9.155 34.546 34.899 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.444 33.475 33.543 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -10.783 31.970 35.107 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -10.600 33.187 36.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -12.680 33.451 35.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -11.683 34.799 34.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -11.860 33.619 33.694 1.00 0.00 H new ATOM 913 N THR A 56 -4.461 31.174 33.286 1.00 0.00 N ATOM 914 CA THR A 56 -4.248 30.145 32.281 1.00 0.00 C ATOM 915 C THR A 56 -2.758 29.824 32.155 1.00 0.00 C ATOM 916 O THR A 56 -2.032 30.502 31.431 1.00 0.00 O ATOM 917 CB THR A 56 -4.880 30.625 30.973 1.00 0.00 C ATOM 918 OG1 THR A 56 -4.762 29.504 30.100 1.00 0.00 O ATOM 919 CG2 THR A 56 -4.056 31.717 30.290 1.00 0.00 C ATOM 0 H THR A 56 -3.686 31.828 33.397 1.00 0.00 H new ATOM 0 HA THR A 56 -4.727 29.208 32.565 1.00 0.00 H new ATOM 0 HB THR A 56 -5.884 30.999 31.171 1.00 0.00 H new ATOM 0 HG1 THR A 56 -5.285 29.666 29.287 1.00 0.00 H new ATOM 0 HG21 THR A 56 -4.549 32.021 29.367 1.00 0.00 H new ATOM 0 HG22 THR A 56 -3.968 32.576 30.955 1.00 0.00 H new ATOM 0 HG23 THR A 56 -3.062 31.333 30.061 1.00 0.00 H new ATOM 927 N PRO A 57 -2.337 28.758 32.889 1.00 0.00 N ATOM 928 CA PRO A 57 -0.946 28.338 32.866 1.00 0.00 C ATOM 929 C PRO A 57 -0.614 27.613 31.559 1.00 0.00 C ATOM 930 O PRO A 57 -0.354 26.411 31.562 1.00 0.00 O ATOM 931 CB PRO A 57 -0.781 27.456 34.092 1.00 0.00 C ATOM 932 CG PRO A 57 -2.186 27.039 34.497 1.00 0.00 C ATOM 933 CD PRO A 57 -3.169 27.930 33.756 1.00 0.00 C ATOM 0 HA PRO A 57 -0.252 29.178 32.900 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.165 26.586 33.867 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.286 27.997 34.899 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.359 25.992 34.250 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.318 27.139 35.574 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.880 27.340 33.177 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.750 28.540 34.448 1.00 0.00 H new ATOM 941 N ILE A 58 -0.635 28.375 30.476 1.00 0.00 N ATOM 942 CA ILE A 58 -0.339 27.820 29.165 1.00 0.00 C ATOM 943 C ILE A 58 0.880 28.534 28.577 1.00 0.00 C ATOM 944 O ILE A 58 1.553 27.998 27.697 1.00 0.00 O ATOM 945 CB ILE A 58 -1.577 27.876 28.268 1.00 0.00 C ATOM 946 CG1 ILE A 58 -1.197 28.242 26.832 1.00 0.00 C ATOM 947 CG2 ILE A 58 -2.628 28.827 28.843 1.00 0.00 C ATOM 948 CD1 ILE A 58 -0.343 27.146 26.194 1.00 0.00 C ATOM 0 H ILE A 58 -0.852 29.372 30.478 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.081 26.764 29.247 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.024 26.882 28.240 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.100 28.394 26.241 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.649 29.184 26.826 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.498 28.848 28.186 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.929 28.482 29.832 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.208 29.830 28.921 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.087 27.432 25.174 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.571 27.013 26.774 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.903 26.211 26.179 1.00 0.00 H new ATOM 960 N TRP A 59 1.127 29.732 29.086 1.00 0.00 N ATOM 961 CA TRP A 59 2.253 30.525 28.622 1.00 0.00 C ATOM 962 C TRP A 59 3.431 30.269 29.564 1.00 0.00 C ATOM 963 O TRP A 59 4.585 30.469 29.190 1.00 0.00 O ATOM 964 CB TRP A 59 1.877 32.004 28.522 1.00 0.00 C ATOM 965 CG TRP A 59 1.070 32.524 29.713 1.00 0.00 C ATOM 966 CD1 TRP A 59 -0.239 32.368 29.954 1.00 0.00 C ATOM 967 CD2 TRP A 59 1.576 33.293 30.824 1.00 0.00 C ATOM 968 NE1 TRP A 59 -0.613 32.980 31.133 1.00 0.00 N ATOM 969 CE2 TRP A 59 0.526 33.560 31.680 1.00 0.00 C ATOM 970 CE3 TRP A 59 2.877 33.750 31.097 1.00 0.00 C ATOM 971 CZ2 TRP A 59 0.669 34.291 32.864 1.00 0.00 C ATOM 972 CZ3 TRP A 59 3.004 34.479 32.286 1.00 0.00 C ATOM 973 CH2 TRP A 59 1.957 34.756 33.158 1.00 0.00 C ATOM 0 H TRP A 59 0.567 30.173 29.815 1.00 0.00 H new ATOM 0 HA TRP A 59 2.544 30.230 27.614 1.00 0.00 H new ATOM 0 HB2 TRP A 59 2.789 32.594 28.429 1.00 0.00 H new ATOM 0 HB3 TRP A 59 1.301 32.161 27.610 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -0.916 31.831 29.307 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -1.552 33.003 31.530 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.713 33.554 30.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -0.169 34.486 33.517 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 3.984 34.852 32.544 1.00 0.00 H new ATOM 0 HH2 TRP A 59 2.136 35.327 34.057 1.00 0.00 H new ATOM 984 N LEU A 60 3.098 29.832 30.770 1.00 0.00 N ATOM 985 CA LEU A 60 4.114 29.547 31.769 1.00 0.00 C ATOM 986 C LEU A 60 4.930 28.329 31.329 1.00 0.00 C ATOM 987 O LEU A 60 6.153 28.401 31.225 1.00 0.00 O ATOM 988 CB LEU A 60 3.479 29.393 33.152 1.00 0.00 C ATOM 989 CG LEU A 60 3.895 30.428 34.200 1.00 0.00 C ATOM 990 CD1 LEU A 60 4.088 31.806 33.565 1.00 0.00 C ATOM 991 CD2 LEU A 60 2.898 30.465 35.360 1.00 0.00 C ATOM 0 H LEU A 60 2.139 29.668 31.078 1.00 0.00 H new ATOM 0 HA LEU A 60 4.808 30.383 31.854 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.396 29.435 33.039 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.722 28.401 33.533 1.00 0.00 H new ATOM 0 HG LEU A 60 4.858 30.127 34.613 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.383 32.522 34.332 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.865 31.750 32.803 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.153 32.130 33.107 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.217 31.208 36.090 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.910 30.728 34.982 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.856 29.485 35.835 1.00 0.00 H new ATOM 1003 N ASN A 61 4.218 27.238 31.082 1.00 0.00 N ATOM 1004 CA ASN A 61 4.860 26.007 30.655 1.00 0.00 C ATOM 1005 C ASN A 61 5.882 26.323 29.562 1.00 0.00 C ATOM 1006 O ASN A 61 7.072 26.055 29.723 1.00 0.00 O ATOM 1007 CB ASN A 61 3.839 25.025 30.078 1.00 0.00 C ATOM 1008 CG ASN A 61 3.764 23.752 30.924 1.00 0.00 C ATOM 1009 OD1 ASN A 61 3.467 23.778 32.108 1.00 0.00 O ATOM 1010 ND2 ASN A 61 4.051 22.639 30.253 1.00 0.00 N ATOM 0 H ASN A 61 3.203 27.182 31.170 1.00 0.00 H new ATOM 0 HA ASN A 61 5.341 25.558 31.524 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.857 25.497 30.037 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.113 24.770 29.054 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.030 21.737 30.729 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.292 22.688 29.263 1.00 0.00 H new ATOM 1017 N PRO A 62 5.368 26.901 28.444 1.00 0.00 N ATOM 1018 CA PRO A 62 6.223 27.255 27.322 1.00 0.00 C ATOM 1019 C PRO A 62 7.045 28.508 27.635 1.00 0.00 C ATOM 1020 O PRO A 62 7.981 28.837 26.907 1.00 0.00 O ATOM 1021 CB PRO A 62 5.276 27.443 26.149 1.00 0.00 C ATOM 1022 CG PRO A 62 3.896 27.645 26.755 1.00 0.00 C ATOM 1023 CD PRO A 62 3.964 27.232 28.217 1.00 0.00 C ATOM 0 HA PRO A 62 6.964 26.487 27.098 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.567 28.303 25.546 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.291 26.573 25.492 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.589 28.687 26.667 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.155 27.048 26.224 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.637 28.039 28.872 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.318 26.377 28.417 1.00 0.00 H new ATOM 1031 N ILE A 63 6.665 29.171 28.717 1.00 0.00 N ATOM 1032 CA ILE A 63 7.355 30.380 29.134 1.00 0.00 C ATOM 1033 C ILE A 63 7.744 31.193 27.897 1.00 0.00 C ATOM 1034 O ILE A 63 8.832 31.015 27.351 1.00 0.00 O ATOM 1035 CB ILE A 63 8.538 30.036 30.041 1.00 0.00 C ATOM 1036 CG1 ILE A 63 9.190 31.303 30.597 1.00 0.00 C ATOM 1037 CG2 ILE A 63 9.547 29.144 29.313 1.00 0.00 C ATOM 1038 CD1 ILE A 63 8.132 32.289 31.099 1.00 0.00 C ATOM 0 H ILE A 63 5.888 28.894 29.318 1.00 0.00 H new ATOM 0 HA ILE A 63 6.695 31.007 29.734 1.00 0.00 H new ATOM 0 HB ILE A 63 8.161 29.468 30.892 1.00 0.00 H new ATOM 0 HG12 ILE A 63 9.865 31.041 31.412 1.00 0.00 H new ATOM 0 HG13 ILE A 63 9.794 31.775 29.822 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.378 28.915 29.980 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.060 28.218 29.008 1.00 0.00 H new ATOM 0 HG23 ILE A 63 9.923 29.664 28.432 1.00 0.00 H new ATOM 0 HD11 ILE A 63 8.622 33.181 31.489 1.00 0.00 H new ATOM 0 HD12 ILE A 63 7.474 32.567 30.276 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.546 31.822 31.890 1.00 0.00 H new ATOM 1050 N ASP A 64 6.834 32.065 27.492 1.00 0.00 N ATOM 1051 CA ASP A 64 7.069 32.906 26.330 1.00 0.00 C ATOM 1052 C ASP A 64 6.157 34.133 26.401 1.00 0.00 C ATOM 1053 O ASP A 64 4.935 34.004 26.374 1.00 0.00 O ATOM 1054 CB ASP A 64 6.753 32.155 25.034 1.00 0.00 C ATOM 1055 CG ASP A 64 7.857 32.196 23.977 1.00 0.00 C ATOM 1056 OD1 ASP A 64 8.660 33.140 23.928 1.00 0.00 O ATOM 1057 OD2 ASP A 64 7.876 31.190 23.169 1.00 0.00 O ATOM 0 H ASP A 64 5.932 32.208 27.947 1.00 0.00 H new ATOM 0 HA ASP A 64 8.119 33.197 26.331 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.543 31.114 25.277 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.843 32.572 24.603 1.00 0.00 H new ATOM 1063 N TYR A 65 6.788 35.295 26.488 1.00 0.00 N ATOM 1064 CA TYR A 65 6.049 36.543 26.562 1.00 0.00 C ATOM 1065 C TYR A 65 5.289 36.809 25.262 1.00 0.00 C ATOM 1066 O TYR A 65 4.494 37.744 25.183 1.00 0.00 O ATOM 1067 CB TYR A 65 7.096 37.642 26.760 1.00 0.00 C ATOM 1068 CG TYR A 65 6.525 38.955 27.299 1.00 0.00 C ATOM 1069 CD1 TYR A 65 6.331 39.118 28.655 1.00 0.00 C ATOM 1070 CD2 TYR A 65 6.206 39.977 26.428 1.00 0.00 C ATOM 1071 CE1 TYR A 65 5.793 40.355 29.162 1.00 0.00 C ATOM 1072 CE2 TYR A 65 5.670 41.213 26.934 1.00 0.00 C ATOM 1073 CZ TYR A 65 5.490 41.341 28.276 1.00 0.00 C ATOM 1074 OH TYR A 65 4.982 42.509 28.754 1.00 0.00 O ATOM 0 H TYR A 65 7.803 35.398 26.509 1.00 0.00 H new ATOM 0 HA TYR A 65 5.319 36.509 27.371 1.00 0.00 H new ATOM 0 HB2 TYR A 65 7.861 37.281 27.447 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.589 37.836 25.807 1.00 0.00 H new ATOM 0 HD1 TYR A 65 6.582 38.319 29.336 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.359 39.849 25.367 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.634 40.496 30.221 1.00 0.00 H new ATOM 0 HE2 TYR A 65 5.416 42.021 26.263 1.00 0.00 H new ATOM 0 HH TYR A 65 5.331 42.673 29.655 1.00 0.00 H new ATOM 1084 N SER A 66 5.560 35.969 24.274 1.00 0.00 N ATOM 1085 CA SER A 66 4.911 36.101 22.980 1.00 0.00 C ATOM 1086 C SER A 66 3.436 35.712 23.092 1.00 0.00 C ATOM 1087 O SER A 66 2.605 36.186 22.320 1.00 0.00 O ATOM 1088 CB SER A 66 5.608 35.241 21.923 1.00 0.00 C ATOM 1089 OG SER A 66 5.472 35.789 20.615 1.00 0.00 O ATOM 0 H SER A 66 6.220 35.194 24.343 1.00 0.00 H new ATOM 0 HA SER A 66 4.983 37.143 22.667 1.00 0.00 H new ATOM 0 HB2 SER A 66 6.666 35.150 22.170 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.189 34.235 21.940 1.00 0.00 H new ATOM 0 HG SER A 66 5.931 35.212 19.969 1.00 0.00 H new ATOM 1095 N LEU A 67 3.156 34.852 24.061 1.00 0.00 N ATOM 1096 CA LEU A 67 1.795 34.393 24.285 1.00 0.00 C ATOM 1097 C LEU A 67 1.052 35.416 25.147 1.00 0.00 C ATOM 1098 O LEU A 67 -0.177 35.415 25.197 1.00 0.00 O ATOM 1099 CB LEU A 67 1.796 32.980 24.869 1.00 0.00 C ATOM 1100 CG LEU A 67 0.422 32.336 25.070 1.00 0.00 C ATOM 1101 CD1 LEU A 67 0.553 30.835 25.332 1.00 0.00 C ATOM 1102 CD2 LEU A 67 -0.358 33.046 26.178 1.00 0.00 C ATOM 0 H LEU A 67 3.848 34.461 24.700 1.00 0.00 H new ATOM 0 HA LEU A 67 1.256 34.321 23.340 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.384 32.338 24.213 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.307 33.006 25.831 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.149 32.452 24.149 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.438 30.402 25.471 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.041 30.358 24.482 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.149 30.673 26.230 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.331 32.569 26.301 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.198 32.982 27.113 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.498 34.093 25.910 1.00 0.00 H new ATOM 1114 N LEU A 68 1.830 36.263 25.806 1.00 0.00 N ATOM 1115 CA LEU A 68 1.261 37.287 26.664 1.00 0.00 C ATOM 1116 C LEU A 68 0.554 38.335 25.801 1.00 0.00 C ATOM 1117 O LEU A 68 -0.656 38.525 25.914 1.00 0.00 O ATOM 1118 CB LEU A 68 2.334 37.872 27.584 1.00 0.00 C ATOM 1119 CG LEU A 68 2.328 37.363 29.027 1.00 0.00 C ATOM 1120 CD1 LEU A 68 3.326 38.143 29.887 1.00 0.00 C ATOM 1121 CD2 LEU A 68 0.917 37.397 29.616 1.00 0.00 C ATOM 0 H LEU A 68 2.849 36.260 25.763 1.00 0.00 H new ATOM 0 HA LEU A 68 0.508 36.856 27.324 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.311 37.662 27.149 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.219 38.956 27.601 1.00 0.00 H new ATOM 0 HG LEU A 68 2.650 36.322 29.022 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.302 37.762 30.908 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.329 38.024 29.478 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.058 39.199 29.888 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.942 37.030 30.642 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.543 38.421 29.606 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.259 36.764 29.020 1.00 0.00 H new ATOM 1133 N ALA A 69 1.340 38.987 24.957 1.00 0.00 N ATOM 1134 CA ALA A 69 0.805 40.010 24.074 1.00 0.00 C ATOM 1135 C ALA A 69 -0.373 39.433 23.287 1.00 0.00 C ATOM 1136 O ALA A 69 -1.209 40.179 22.777 1.00 0.00 O ATOM 1137 CB ALA A 69 1.917 40.530 23.161 1.00 0.00 C ATOM 0 H ALA A 69 2.343 38.827 24.866 1.00 0.00 H new ATOM 0 HA ALA A 69 0.434 40.858 24.650 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.515 41.297 22.499 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.716 40.956 23.767 1.00 0.00 H new ATOM 0 HB3 ALA A 69 2.313 39.708 22.565 1.00 0.00 H new ATOM 1143 N SER A 70 -0.403 38.111 23.212 1.00 0.00 N ATOM 1144 CA SER A 70 -1.465 37.425 22.496 1.00 0.00 C ATOM 1145 C SER A 70 -2.792 37.591 23.240 1.00 0.00 C ATOM 1146 O SER A 70 -3.839 37.760 22.620 1.00 0.00 O ATOM 1147 CB SER A 70 -1.140 35.942 22.316 1.00 0.00 C ATOM 1148 OG SER A 70 -2.011 35.313 21.379 1.00 0.00 O ATOM 0 H SER A 70 0.292 37.496 23.636 1.00 0.00 H new ATOM 0 HA SER A 70 -1.553 37.873 21.506 1.00 0.00 H new ATOM 0 HB2 SER A 70 -0.109 35.835 21.980 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.216 35.435 23.278 1.00 0.00 H new ATOM 0 HG SER A 70 -1.769 34.367 21.291 1.00 0.00 H new ATOM 1154 N LEU A 71 -2.702 37.538 24.561 1.00 0.00 N ATOM 1155 CA LEU A 71 -3.882 37.681 25.398 1.00 0.00 C ATOM 1156 C LEU A 71 -4.533 39.038 25.126 1.00 0.00 C ATOM 1157 O LEU A 71 -5.752 39.131 24.994 1.00 0.00 O ATOM 1158 CB LEU A 71 -3.527 37.451 26.868 1.00 0.00 C ATOM 1159 CG LEU A 71 -4.098 36.183 27.505 1.00 0.00 C ATOM 1160 CD1 LEU A 71 -2.999 35.148 27.746 1.00 0.00 C ATOM 1161 CD2 LEU A 71 -4.865 36.513 28.788 1.00 0.00 C ATOM 0 H LEU A 71 -1.831 37.398 25.072 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.620 36.918 25.150 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.441 37.422 26.959 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.872 38.310 27.443 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.809 35.741 26.808 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.432 34.256 28.200 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -2.534 34.883 26.796 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.246 35.566 28.414 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.261 35.595 29.222 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.193 36.991 29.501 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.688 37.189 28.556 1.00 0.00 H new ATOM 1173 N ILE A 72 -3.690 40.058 25.051 1.00 0.00 N ATOM 1174 CA ILE A 72 -4.168 41.408 24.798 1.00 0.00 C ATOM 1175 C ILE A 72 -5.095 41.395 23.581 1.00 0.00 C ATOM 1176 O ILE A 72 -4.652 41.148 22.460 1.00 0.00 O ATOM 1177 CB ILE A 72 -2.992 42.376 24.666 1.00 0.00 C ATOM 1178 CG1 ILE A 72 -2.002 42.198 25.818 1.00 0.00 C ATOM 1179 CG2 ILE A 72 -3.482 43.821 24.550 1.00 0.00 C ATOM 1180 CD1 ILE A 72 -1.082 43.414 25.945 1.00 0.00 C ATOM 0 H ILE A 72 -2.679 39.977 25.161 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.755 41.770 25.642 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.459 42.141 23.745 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.547 42.051 26.751 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.404 41.301 25.653 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.626 44.489 24.457 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.117 43.920 23.670 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.053 44.084 25.440 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.388 43.261 26.772 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.521 43.544 25.020 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.681 44.305 26.134 1.00 0.00 H new ATOM 1192 N PRO A 73 -6.400 41.672 23.849 1.00 0.00 N ATOM 1193 CA PRO A 73 -7.393 41.694 22.789 1.00 0.00 C ATOM 1194 C PRO A 73 -7.262 42.963 21.942 1.00 0.00 C ATOM 1195 O PRO A 73 -8.254 43.637 21.670 1.00 0.00 O ATOM 1196 CB PRO A 73 -8.732 41.592 23.502 1.00 0.00 C ATOM 1197 CG PRO A 73 -8.466 41.982 24.947 1.00 0.00 C ATOM 1198 CD PRO A 73 -6.961 41.968 25.163 1.00 0.00 C ATOM 0 HA PRO A 73 -7.271 40.875 22.081 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -9.468 42.255 23.048 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -9.132 40.580 23.438 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.873 42.971 25.157 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -8.956 41.285 25.627 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -6.606 42.928 25.538 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.673 41.214 25.895 1.00 0.00 H new ATOM 1206 N LYS A 74 -6.029 43.249 21.550 1.00 0.00 N ATOM 1207 CA LYS A 74 -5.756 44.424 20.740 1.00 0.00 C ATOM 1208 C LYS A 74 -6.775 45.515 21.073 1.00 0.00 C ATOM 1209 O LYS A 74 -7.825 45.603 20.439 1.00 0.00 O ATOM 1210 CB LYS A 74 -5.713 44.053 19.256 1.00 0.00 C ATOM 1211 CG LYS A 74 -4.579 44.789 18.540 1.00 0.00 C ATOM 1212 CD LYS A 74 -4.896 46.279 18.398 1.00 0.00 C ATOM 1213 CE LYS A 74 -5.946 46.516 17.309 1.00 0.00 C ATOM 1214 NZ LYS A 74 -6.260 47.957 17.198 1.00 0.00 N ATOM 0 H LYS A 74 -5.208 42.688 21.778 1.00 0.00 H new ATOM 0 HA LYS A 74 -4.770 44.827 20.972 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -5.577 42.977 19.150 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.665 44.301 18.788 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -3.650 44.663 19.096 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.422 44.351 17.554 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -5.259 46.669 19.349 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -3.985 46.827 18.155 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -5.578 46.143 16.353 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -6.852 45.957 17.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -6.974 48.101 16.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -6.631 48.302 18.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.396 48.483 16.955 1.00 0.00 H new ATOM 1227 N GLY A 75 -6.429 46.321 22.066 1.00 0.00 N ATOM 1228 CA GLY A 75 -7.300 47.404 22.491 1.00 0.00 C ATOM 1229 C GLY A 75 -7.496 47.387 24.009 1.00 0.00 C ATOM 1230 O GLY A 75 -8.171 48.254 24.560 1.00 0.00 O ATOM 0 H GLY A 75 -5.557 46.246 22.589 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -6.873 48.360 22.187 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -8.266 47.314 21.995 1.00 0.00 H new ATOM 1234 N TYR A 76 -6.893 46.390 24.639 1.00 0.00 N ATOM 1235 CA TYR A 76 -6.992 46.250 26.082 1.00 0.00 C ATOM 1236 C TYR A 76 -6.973 47.616 26.769 1.00 0.00 C ATOM 1237 O TYR A 76 -6.428 48.578 26.231 1.00 0.00 O ATOM 1238 CB TYR A 76 -5.757 45.457 26.515 1.00 0.00 C ATOM 1239 CG TYR A 76 -6.010 44.494 27.677 1.00 0.00 C ATOM 1240 CD1 TYR A 76 -7.146 43.710 27.687 1.00 0.00 C ATOM 1241 CD2 TYR A 76 -5.104 44.410 28.714 1.00 0.00 C ATOM 1242 CE1 TYR A 76 -7.385 42.804 28.780 1.00 0.00 C ATOM 1243 CE2 TYR A 76 -5.342 43.504 29.807 1.00 0.00 C ATOM 1244 CZ TYR A 76 -6.471 42.746 29.786 1.00 0.00 C ATOM 1245 OH TYR A 76 -6.697 41.889 30.819 1.00 0.00 O ATOM 0 H TYR A 76 -6.335 45.672 24.177 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.924 45.755 26.356 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.385 44.890 25.662 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -4.971 46.156 26.801 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -7.855 43.776 26.875 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.216 45.024 28.706 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.270 42.185 28.801 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -4.640 43.428 30.625 1.00 0.00 H new ATOM 0 HH TYR A 76 -6.438 42.317 31.662 1.00 0.00 H new ATOM 1255 N PRO A 77 -7.591 47.660 27.980 1.00 0.00 N ATOM 1256 CA PRO A 77 -7.649 48.893 28.746 1.00 0.00 C ATOM 1257 C PRO A 77 -6.296 49.206 29.387 1.00 0.00 C ATOM 1258 O PRO A 77 -5.288 48.585 29.052 1.00 0.00 O ATOM 1259 CB PRO A 77 -8.752 48.670 29.768 1.00 0.00 C ATOM 1260 CG PRO A 77 -8.952 47.165 29.843 1.00 0.00 C ATOM 1261 CD PRO A 77 -8.247 46.541 28.649 1.00 0.00 C ATOM 0 HA PRO A 77 -7.868 49.762 28.126 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -8.472 49.076 30.740 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -9.671 49.172 29.466 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -8.545 46.772 30.775 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -10.014 46.920 29.830 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -7.524 45.789 28.965 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.955 46.044 27.986 1.00 0.00 H new ATOM 1269 N GLY A 78 -6.316 50.169 30.296 1.00 0.00 N ATOM 1270 CA GLY A 78 -5.102 50.572 30.987 1.00 0.00 C ATOM 1271 C GLY A 78 -3.974 50.855 29.993 1.00 0.00 C ATOM 1272 O GLY A 78 -4.194 50.859 28.783 1.00 0.00 O ATOM 0 H GLY A 78 -7.153 50.682 30.571 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -5.298 51.463 31.584 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -4.795 49.787 31.678 1.00 0.00 H new ATOM 1276 N ARG A 79 -2.790 51.087 30.540 1.00 0.00 N ATOM 1277 CA ARG A 79 -1.627 51.370 29.717 1.00 0.00 C ATOM 1278 C ARG A 79 -0.784 50.105 29.534 1.00 0.00 C ATOM 1279 O ARG A 79 0.397 50.186 29.201 1.00 0.00 O ATOM 1280 CB ARG A 79 -0.762 52.464 30.344 1.00 0.00 C ATOM 1281 CG ARG A 79 -1.524 53.789 30.423 1.00 0.00 C ATOM 1282 CD ARG A 79 -0.717 54.843 31.183 1.00 0.00 C ATOM 1283 NE ARG A 79 0.206 55.537 30.258 1.00 0.00 N ATOM 1284 CZ ARG A 79 -0.123 56.636 29.545 1.00 0.00 C ATOM 1285 NH1 ARG A 79 -1.356 57.173 29.644 1.00 0.00 N ATOM 1286 NH2 ARG A 79 0.781 57.176 28.748 1.00 0.00 N ATOM 0 H ARG A 79 -2.611 51.085 31.544 1.00 0.00 H new ATOM 0 HA ARG A 79 -1.984 51.716 28.747 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -0.452 52.159 31.343 1.00 0.00 H new ATOM 0 HB3 ARG A 79 0.146 52.597 29.755 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -1.741 54.148 29.417 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -2.482 53.632 30.919 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.390 55.564 31.647 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -0.152 54.371 31.987 1.00 0.00 H new ATOM 0 HE ARG A 79 1.149 55.162 30.152 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -2.049 56.749 30.261 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -1.596 58.003 29.102 1.00 0.00 H new ATOM 0 HH21 ARG A 79 1.711 56.763 28.678 1.00 0.00 H new ATOM 0 HH22 ARG A 79 0.549 58.006 28.202 1.00 0.00 H new ATOM 1299 N VAL A 80 -1.425 48.968 29.762 1.00 0.00 N ATOM 1300 CA VAL A 80 -0.749 47.689 29.626 1.00 0.00 C ATOM 1301 C VAL A 80 -0.236 47.538 28.193 1.00 0.00 C ATOM 1302 O VAL A 80 0.896 47.105 27.978 1.00 0.00 O ATOM 1303 CB VAL A 80 -1.686 46.556 30.049 1.00 0.00 C ATOM 1304 CG1 VAL A 80 -1.846 45.529 28.925 1.00 0.00 C ATOM 1305 CG2 VAL A 80 -1.195 45.889 31.335 1.00 0.00 C ATOM 0 H VAL A 80 -2.404 48.906 30.040 1.00 0.00 H new ATOM 0 HA VAL A 80 0.116 47.641 30.287 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.666 46.989 30.250 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -2.517 44.734 29.251 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.262 46.016 28.043 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.873 45.104 28.679 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.879 45.087 31.613 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.199 45.476 31.174 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.156 46.627 32.136 1.00 0.00 H new ATOM 1315 N VAL A 81 -1.092 47.902 27.250 1.00 0.00 N ATOM 1316 CA VAL A 81 -0.739 47.812 25.844 1.00 0.00 C ATOM 1317 C VAL A 81 0.283 48.901 25.507 1.00 0.00 C ATOM 1318 O VAL A 81 1.228 48.660 24.759 1.00 0.00 O ATOM 1319 CB VAL A 81 -2.000 47.889 24.981 1.00 0.00 C ATOM 1320 CG1 VAL A 81 -1.700 47.494 23.534 1.00 0.00 C ATOM 1321 CG2 VAL A 81 -3.118 47.023 25.566 1.00 0.00 C ATOM 0 H VAL A 81 -2.030 48.260 27.432 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.272 46.851 25.629 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.343 48.924 24.981 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.613 47.557 22.943 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.952 48.170 23.120 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.320 46.473 23.507 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.003 47.095 24.934 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.788 45.985 25.611 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -3.360 47.371 26.570 1.00 0.00 H new ATOM 1331 N GLU A 82 0.056 50.075 26.077 1.00 0.00 N ATOM 1332 CA GLU A 82 0.945 51.202 25.848 1.00 0.00 C ATOM 1333 C GLU A 82 2.378 50.837 26.242 1.00 0.00 C ATOM 1334 O GLU A 82 3.334 51.370 25.683 1.00 0.00 O ATOM 1335 CB GLU A 82 0.466 52.441 26.606 1.00 0.00 C ATOM 1336 CG GLU A 82 0.186 53.599 25.646 1.00 0.00 C ATOM 1337 CD GLU A 82 1.428 54.475 25.466 1.00 0.00 C ATOM 1338 OE1 GLU A 82 2.044 54.465 24.391 1.00 0.00 O ATOM 1339 OE2 GLU A 82 1.746 55.186 26.495 1.00 0.00 O ATOM 0 H GLU A 82 -0.730 50.271 26.697 1.00 0.00 H new ATOM 0 HA GLU A 82 0.931 51.440 24.784 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.438 52.202 27.166 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.221 52.741 27.333 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.130 53.206 24.679 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.637 54.203 26.029 1.00 0.00 H new ATOM 1347 N ILE A 83 2.480 49.930 27.203 1.00 0.00 N ATOM 1348 CA ILE A 83 3.779 49.488 27.678 1.00 0.00 C ATOM 1349 C ILE A 83 4.269 48.327 26.808 1.00 0.00 C ATOM 1350 O ILE A 83 5.316 48.425 26.171 1.00 0.00 O ATOM 1351 CB ILE A 83 3.719 49.154 29.171 1.00 0.00 C ATOM 1352 CG1 ILE A 83 3.086 50.300 29.963 1.00 0.00 C ATOM 1353 CG2 ILE A 83 5.104 48.783 29.706 1.00 0.00 C ATOM 1354 CD1 ILE A 83 2.237 49.764 31.117 1.00 0.00 C ATOM 0 H ILE A 83 1.684 49.490 27.665 1.00 0.00 H new ATOM 0 HA ILE A 83 4.511 50.290 27.583 1.00 0.00 H new ATOM 0 HB ILE A 83 3.080 48.281 29.301 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.867 50.952 30.354 1.00 0.00 H new ATOM 0 HG13 ILE A 83 2.467 50.906 29.301 1.00 0.00 H new ATOM 0 HG21 ILE A 83 5.033 48.550 30.769 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.481 47.913 29.168 1.00 0.00 H new ATOM 0 HG23 ILE A 83 5.786 49.621 29.563 1.00 0.00 H new ATOM 0 HD11 ILE A 83 1.798 50.598 31.664 1.00 0.00 H new ATOM 0 HD12 ILE A 83 1.442 49.132 30.721 1.00 0.00 H new ATOM 0 HD13 ILE A 83 2.865 49.179 31.789 1.00 0.00 H new ATOM 1366 N ILE A 84 3.487 47.258 26.811 1.00 0.00 N ATOM 1367 CA ILE A 84 3.827 46.081 26.030 1.00 0.00 C ATOM 1368 C ILE A 84 4.020 46.484 24.566 1.00 0.00 C ATOM 1369 O ILE A 84 4.713 45.797 23.816 1.00 0.00 O ATOM 1370 CB ILE A 84 2.781 44.983 26.231 1.00 0.00 C ATOM 1371 CG1 ILE A 84 2.679 44.589 27.706 1.00 0.00 C ATOM 1372 CG2 ILE A 84 3.071 43.778 25.335 1.00 0.00 C ATOM 1373 CD1 ILE A 84 1.658 43.466 27.905 1.00 0.00 C ATOM 0 H ILE A 84 2.619 47.182 27.342 1.00 0.00 H new ATOM 0 HA ILE A 84 4.771 45.657 26.373 1.00 0.00 H new ATOM 0 HB ILE A 84 1.809 45.378 25.934 1.00 0.00 H new ATOM 0 HG12 ILE A 84 3.655 44.266 28.068 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.390 45.457 28.299 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.312 43.012 25.498 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.054 44.089 24.290 1.00 0.00 H new ATOM 0 HG23 ILE A 84 4.053 43.373 25.577 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.605 43.205 28.962 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.678 43.801 27.564 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.963 42.591 27.330 1.00 0.00 H new ATOM 1385 N ASN A 85 3.397 47.595 24.204 1.00 0.00 N ATOM 1386 CA ASN A 85 3.490 48.098 22.844 1.00 0.00 C ATOM 1387 C ASN A 85 4.931 48.533 22.565 1.00 0.00 C ATOM 1388 O ASN A 85 5.377 48.517 21.419 1.00 0.00 O ATOM 1389 CB ASN A 85 2.581 49.311 22.640 1.00 0.00 C ATOM 1390 CG ASN A 85 2.927 50.043 21.342 1.00 0.00 C ATOM 1391 OD1 ASN A 85 3.461 51.140 21.341 1.00 0.00 O ATOM 1392 ND2 ASN A 85 2.592 49.378 20.241 1.00 0.00 N ATOM 0 H ASN A 85 2.825 48.162 24.830 1.00 0.00 H new ATOM 0 HA ASN A 85 3.181 47.301 22.168 1.00 0.00 H new ATOM 0 HB2 ASN A 85 1.540 48.989 22.614 1.00 0.00 H new ATOM 0 HB3 ASN A 85 2.683 49.993 23.484 1.00 0.00 H new ATOM 0 HD21 ASN A 85 2.780 49.783 19.324 1.00 0.00 H new ATOM 0 HD22 ASN A 85 2.147 48.463 20.313 1.00 0.00 H new ATOM 1399 N ILE A 86 5.617 48.913 23.632 1.00 0.00 N ATOM 1400 CA ILE A 86 6.997 49.352 23.516 1.00 0.00 C ATOM 1401 C ILE A 86 7.894 48.141 23.254 1.00 0.00 C ATOM 1402 O ILE A 86 8.994 48.281 22.720 1.00 0.00 O ATOM 1403 CB ILE A 86 7.406 50.164 24.747 1.00 0.00 C ATOM 1404 CG1 ILE A 86 6.771 51.556 24.722 1.00 0.00 C ATOM 1405 CG2 ILE A 86 8.929 50.231 24.879 1.00 0.00 C ATOM 1406 CD1 ILE A 86 6.527 52.073 26.141 1.00 0.00 C ATOM 0 H ILE A 86 5.243 48.926 24.581 1.00 0.00 H new ATOM 0 HA ILE A 86 7.112 50.024 22.665 1.00 0.00 H new ATOM 0 HB ILE A 86 7.028 49.654 25.633 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.422 52.247 24.186 1.00 0.00 H new ATOM 0 HG13 ILE A 86 5.828 51.520 24.177 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.192 50.814 25.762 1.00 0.00 H new ATOM 0 HG22 ILE A 86 9.330 49.222 24.977 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.351 50.705 23.992 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.075 53.064 26.095 1.00 0.00 H new ATOM 0 HD12 ILE A 86 5.856 51.393 26.666 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.475 52.131 26.675 1.00 0.00 H new ATOM 1418 N LEU A 87 7.391 46.978 23.640 1.00 0.00 N ATOM 1419 CA LEU A 87 8.132 45.742 23.453 1.00 0.00 C ATOM 1420 C LEU A 87 7.970 45.270 22.007 1.00 0.00 C ATOM 1421 O LEU A 87 8.951 44.924 21.349 1.00 0.00 O ATOM 1422 CB LEU A 87 7.709 44.701 24.490 1.00 0.00 C ATOM 1423 CG LEU A 87 7.600 45.198 25.933 1.00 0.00 C ATOM 1424 CD1 LEU A 87 7.102 44.087 26.860 1.00 0.00 C ATOM 1425 CD2 LEU A 87 8.928 45.790 26.412 1.00 0.00 C ATOM 0 H LEU A 87 6.479 46.865 24.082 1.00 0.00 H new ATOM 0 HA LEU A 87 9.197 45.908 23.618 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.743 44.293 24.193 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.424 43.879 24.463 1.00 0.00 H new ATOM 0 HG LEU A 87 6.861 45.998 25.962 1.00 0.00 H new ATOM 0 HD11 LEU A 87 7.034 44.467 27.879 1.00 0.00 H new ATOM 0 HD12 LEU A 87 6.118 43.752 26.531 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.799 43.249 26.831 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.822 46.136 27.440 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.705 45.027 26.363 1.00 0.00 H new ATOM 0 HD23 LEU A 87 9.203 46.630 25.774 1.00 0.00 H new ATOM 1437 N VAL A 88 6.725 45.270 21.553 1.00 0.00 N ATOM 1438 CA VAL A 88 6.423 44.845 20.197 1.00 0.00 C ATOM 1439 C VAL A 88 7.098 45.797 19.206 1.00 0.00 C ATOM 1440 O VAL A 88 7.773 45.356 18.278 1.00 0.00 O ATOM 1441 CB VAL A 88 4.907 44.757 20.002 1.00 0.00 C ATOM 1442 CG1 VAL A 88 4.541 44.809 18.517 1.00 0.00 C ATOM 1443 CG2 VAL A 88 4.343 43.498 20.663 1.00 0.00 C ATOM 0 H VAL A 88 5.914 45.558 22.100 1.00 0.00 H new ATOM 0 HA VAL A 88 6.821 43.847 20.012 1.00 0.00 H new ATOM 0 HB VAL A 88 4.455 45.622 20.488 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.459 44.745 18.407 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.894 45.747 18.088 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.009 43.973 17.997 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.264 43.459 20.510 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.805 42.616 20.219 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.558 43.521 21.731 1.00 0.00 H new ATOM 1453 N LYS A 89 6.892 47.086 19.438 1.00 0.00 N ATOM 1454 CA LYS A 89 7.472 48.102 18.579 1.00 0.00 C ATOM 1455 C LYS A 89 8.992 47.926 18.541 1.00 0.00 C ATOM 1456 O LYS A 89 9.657 48.438 17.642 1.00 0.00 O ATOM 1457 CB LYS A 89 7.025 49.497 19.021 1.00 0.00 C ATOM 1458 CG LYS A 89 6.878 50.433 17.820 1.00 0.00 C ATOM 1459 CD LYS A 89 8.150 51.255 17.606 1.00 0.00 C ATOM 1460 CE LYS A 89 8.688 51.072 16.185 1.00 0.00 C ATOM 1461 NZ LYS A 89 9.750 52.064 15.902 1.00 0.00 N ATOM 0 H LYS A 89 6.331 47.449 20.209 1.00 0.00 H new ATOM 0 HA LYS A 89 7.112 47.986 17.557 1.00 0.00 H new ATOM 0 HB2 LYS A 89 6.075 49.427 19.550 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.751 49.910 19.722 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.663 49.850 16.924 1.00 0.00 H new ATOM 0 HG3 LYS A 89 6.031 51.101 17.977 1.00 0.00 H new ATOM 0 HD2 LYS A 89 7.941 52.309 17.787 1.00 0.00 H new ATOM 0 HD3 LYS A 89 8.909 50.952 18.328 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.083 50.063 16.066 1.00 0.00 H new ATOM 0 HE3 LYS A 89 7.877 51.183 15.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 10.105 51.926 14.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 9.362 53.024 15.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 10.531 51.939 16.578 1.00 0.00 H new ATOM 1474 N ASN A 90 9.495 47.200 19.528 1.00 0.00 N ATOM 1475 CA ASN A 90 10.924 46.950 19.619 1.00 0.00 C ATOM 1476 C ASN A 90 11.321 45.900 18.580 1.00 0.00 C ATOM 1477 O ASN A 90 12.097 46.185 17.669 1.00 0.00 O ATOM 1478 CB ASN A 90 11.302 46.414 21.001 1.00 0.00 C ATOM 1479 CG ASN A 90 12.770 46.704 21.319 1.00 0.00 C ATOM 1480 OD1 ASN A 90 13.259 47.811 21.164 1.00 0.00 O ATOM 1481 ND2 ASN A 90 13.444 45.650 21.771 1.00 0.00 N ATOM 0 H ASN A 90 8.939 46.777 20.271 1.00 0.00 H new ATOM 0 HA ASN A 90 11.443 47.892 19.443 1.00 0.00 H new ATOM 0 HB2 ASN A 90 10.665 46.870 21.759 1.00 0.00 H new ATOM 0 HB3 ASN A 90 11.123 45.339 21.040 1.00 0.00 H new ATOM 0 HD21 ASN A 90 14.431 45.741 22.011 1.00 0.00 H new ATOM 0 HD22 ASN A 90 12.974 44.751 21.877 1.00 0.00 H new