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= -0.184 X(o=-0.18,f=-0.075) USER MOD Single : A 23 HIS : no HE2:sc= -4.75! C(o=-4.7!,f=-9!) USER MOD Single : A 26 ASN : amide:sc= -4.18! C(o=-4.2!,f=-3.9!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -4.38! C(o=-4.4!,f=-6.5!) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) 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= -3.85! USER MOD Single : A 61 ASN : amide:sc= -0.19 K(o=-0.19,f=-0.75) USER MOD Single : A 65 TYR OH : rot -86:sc= -2.22! 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 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -7.25! C(o=-7.3!,f=-12!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 312 N THR A 21 11.603 38.006 37.896 1.00 0.00 N ATOM 313 CA THR A 21 12.265 39.219 37.447 1.00 0.00 C ATOM 314 C THR A 21 12.996 38.971 36.126 1.00 0.00 C ATOM 315 O THR A 21 13.927 39.698 35.782 1.00 0.00 O ATOM 316 CB THR A 21 13.185 39.699 38.571 1.00 0.00 C ATOM 317 OG1 THR A 21 13.157 41.119 38.462 1.00 0.00 O ATOM 318 CG2 THR A 21 14.651 39.335 38.322 1.00 0.00 C ATOM 0 HA THR A 21 11.544 40.009 37.238 1.00 0.00 H new ATOM 0 HB THR A 21 12.858 39.267 39.517 1.00 0.00 H new ATOM 0 HG1 THR A 21 13.727 41.512 39.156 1.00 0.00 H new ATOM 0 HG21 THR A 21 15.262 39.698 39.149 1.00 0.00 H new ATOM 0 HG22 THR A 21 14.749 38.252 38.247 1.00 0.00 H new ATOM 0 HG23 THR A 21 14.987 39.795 37.393 1.00 0.00 H new ATOM 326 N HIS A 22 12.547 37.943 35.423 1.00 0.00 N ATOM 327 CA HIS A 22 13.147 37.590 34.147 1.00 0.00 C ATOM 328 C HIS A 22 12.179 37.930 33.013 1.00 0.00 C ATOM 329 O HIS A 22 12.602 38.207 31.892 1.00 0.00 O ATOM 330 CB HIS A 22 13.579 36.122 34.137 1.00 0.00 C ATOM 331 CG HIS A 22 12.531 35.170 34.663 1.00 0.00 C ATOM 332 ND1 HIS A 22 12.637 34.546 35.894 1.00 0.00 N ATOM 333 CD2 HIS A 22 11.358 34.744 34.114 1.00 0.00 C ATOM 334 CE1 HIS A 22 11.570 33.779 36.067 1.00 0.00 C ATOM 335 NE2 HIS A 22 10.779 33.904 34.962 1.00 0.00 N ATOM 0 H HIS A 22 11.775 37.343 35.712 1.00 0.00 H new ATOM 0 HA HIS A 22 14.053 38.176 33.993 1.00 0.00 H new ATOM 0 HB2 HIS A 22 13.836 35.836 33.117 1.00 0.00 H new ATOM 0 HB3 HIS A 22 14.484 36.016 34.735 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.967 35.040 33.152 1.00 0.00 H new ATOM 0 HE1 HIS A 22 11.363 33.164 36.930 1.00 0.00 H new ATOM 0 HE2 HIS A 22 9.889 33.429 34.813 1.00 0.00 H new ATOM 343 N HIS A 23 10.896 37.900 33.344 1.00 0.00 N ATOM 344 CA HIS A 23 9.864 38.202 32.366 1.00 0.00 C ATOM 345 C HIS A 23 9.212 39.543 32.707 1.00 0.00 C ATOM 346 O HIS A 23 8.798 40.281 31.814 1.00 0.00 O ATOM 347 CB HIS A 23 8.853 37.058 32.272 1.00 0.00 C ATOM 348 CG HIS A 23 8.335 36.808 30.876 1.00 0.00 C ATOM 349 ND1 HIS A 23 7.050 36.362 30.622 1.00 0.00 N ATOM 350 CD2 HIS A 23 8.941 36.948 29.663 1.00 0.00 C ATOM 351 CE1 HIS A 23 6.901 36.241 29.311 1.00 0.00 C ATOM 352 NE2 HIS A 23 8.074 36.605 28.718 1.00 0.00 N ATOM 0 H HIS A 23 10.548 37.671 34.275 1.00 0.00 H new ATOM 0 HA HIS A 23 10.311 38.296 31.376 1.00 0.00 H new ATOM 0 HB2 HIS A 23 9.317 36.145 32.645 1.00 0.00 H new ATOM 0 HB3 HIS A 23 8.010 37.277 32.927 1.00 0.00 H new ATOM 0 HD1 HIS A 23 6.338 36.161 31.325 1.00 0.00 H new ATOM 0 HD2 HIS A 23 9.955 37.282 29.499 1.00 0.00 H new ATOM 0 HE1 HIS A 23 6.007 35.912 28.801 1.00 0.00 H new ATOM 360 N TRP A 24 9.138 39.817 34.002 1.00 0.00 N ATOM 361 CA TRP A 24 8.543 41.057 34.471 1.00 0.00 C ATOM 362 C TRP A 24 9.521 42.195 34.171 1.00 0.00 C ATOM 363 O TRP A 24 9.115 43.262 33.714 1.00 0.00 O ATOM 364 CB TRP A 24 8.175 40.961 35.954 1.00 0.00 C ATOM 365 CG TRP A 24 7.655 42.270 36.552 1.00 0.00 C ATOM 366 CD1 TRP A 24 8.203 43.006 37.528 1.00 0.00 C ATOM 367 CD2 TRP A 24 6.454 42.972 36.169 1.00 0.00 C ATOM 368 NE1 TRP A 24 7.446 44.126 37.803 1.00 0.00 N ATOM 369 CE2 TRP A 24 6.349 44.105 36.951 1.00 0.00 C ATOM 370 CE3 TRP A 24 5.488 42.660 35.197 1.00 0.00 C ATOM 371 CZ2 TRP A 24 5.292 45.018 36.838 1.00 0.00 C ATOM 372 CZ3 TRP A 24 4.439 43.582 35.097 1.00 0.00 C ATOM 373 CH2 TRP A 24 4.318 44.727 35.876 1.00 0.00 C ATOM 0 H TRP A 24 9.480 39.202 34.740 1.00 0.00 H new ATOM 0 HA TRP A 24 7.607 41.257 33.950 1.00 0.00 H new ATOM 0 HB2 TRP A 24 7.416 40.189 36.080 1.00 0.00 H new ATOM 0 HB3 TRP A 24 9.052 40.640 36.516 1.00 0.00 H new ATOM 0 HD1 TRP A 24 9.122 42.754 38.036 1.00 0.00 H new ATOM 0 HE1 TRP A 24 7.654 44.838 38.503 1.00 0.00 H new ATOM 0 HE3 TRP A 24 5.550 41.778 34.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 5.232 45.899 37.460 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 3.670 43.390 34.363 1.00 0.00 H new ATOM 0 HH2 TRP A 24 3.476 45.389 35.739 1.00 0.00 H new ATOM 384 N LEU A 25 10.791 41.929 34.441 1.00 0.00 N ATOM 385 CA LEU A 25 11.829 42.917 34.205 1.00 0.00 C ATOM 386 C LEU A 25 11.738 43.411 32.759 1.00 0.00 C ATOM 387 O LEU A 25 12.163 44.523 32.452 1.00 0.00 O ATOM 388 CB LEU A 25 13.201 42.351 34.576 1.00 0.00 C ATOM 389 CG LEU A 25 14.286 43.381 34.899 1.00 0.00 C ATOM 390 CD1 LEU A 25 13.738 44.491 35.799 1.00 0.00 C ATOM 391 CD2 LEU A 25 15.519 42.707 35.505 1.00 0.00 C ATOM 0 H LEU A 25 11.124 41.043 34.821 1.00 0.00 H new ATOM 0 HA LEU A 25 11.683 43.785 34.848 1.00 0.00 H new ATOM 0 HB2 LEU A 25 13.081 41.696 35.439 1.00 0.00 H new ATOM 0 HB3 LEU A 25 13.551 41.730 33.751 1.00 0.00 H new ATOM 0 HG LEU A 25 14.601 43.849 33.967 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.529 45.209 36.013 1.00 0.00 H new ATOM 0 HD12 LEU A 25 12.916 44.997 35.293 1.00 0.00 H new ATOM 0 HD13 LEU A 25 13.378 44.058 36.733 1.00 0.00 H new ATOM 0 HD21 LEU A 25 16.275 43.461 35.725 1.00 0.00 H new ATOM 0 HD22 LEU A 25 15.238 42.195 36.425 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.924 41.984 34.797 1.00 0.00 H new ATOM 403 N ASN A 26 11.181 42.559 31.911 1.00 0.00 N ATOM 404 CA ASN A 26 11.029 42.895 30.505 1.00 0.00 C ATOM 405 C ASN A 26 9.902 43.917 30.348 1.00 0.00 C ATOM 406 O ASN A 26 9.896 44.701 29.402 1.00 0.00 O ATOM 407 CB ASN A 26 10.666 41.659 29.680 1.00 0.00 C ATOM 408 CG ASN A 26 10.551 42.007 28.194 1.00 0.00 C ATOM 409 OD1 ASN A 26 11.310 42.793 27.653 1.00 0.00 O ATOM 410 ND2 ASN A 26 9.561 41.378 27.567 1.00 0.00 N ATOM 0 H ASN A 26 10.830 41.637 32.170 1.00 0.00 H new ATOM 0 HA ASN A 26 11.977 43.299 30.150 1.00 0.00 H new ATOM 0 HB2 ASN A 26 11.424 40.889 29.819 1.00 0.00 H new ATOM 0 HB3 ASN A 26 9.722 41.245 30.034 1.00 0.00 H new ATOM 0 HD21 ASN A 26 9.401 41.542 26.573 1.00 0.00 H new ATOM 0 HD22 ASN A 26 8.962 40.732 28.080 1.00 0.00 H new ATOM 417 N PHE A 27 8.972 43.874 31.292 1.00 0.00 N ATOM 418 CA PHE A 27 7.841 44.785 31.271 1.00 0.00 C ATOM 419 C PHE A 27 8.135 46.044 32.091 1.00 0.00 C ATOM 420 O PHE A 27 7.744 47.144 31.707 1.00 0.00 O ATOM 421 CB PHE A 27 6.658 44.046 31.899 1.00 0.00 C ATOM 422 CG PHE A 27 5.299 44.441 31.320 1.00 0.00 C ATOM 423 CD1 PHE A 27 4.615 45.493 31.846 1.00 0.00 C ATOM 424 CD2 PHE A 27 4.773 43.741 30.280 1.00 0.00 C ATOM 425 CE1 PHE A 27 3.353 45.861 31.309 1.00 0.00 C ATOM 426 CE2 PHE A 27 3.511 44.108 29.742 1.00 0.00 C ATOM 427 CZ PHE A 27 2.827 45.160 30.268 1.00 0.00 C ATOM 0 H PHE A 27 8.980 43.222 32.076 1.00 0.00 H new ATOM 0 HA PHE A 27 7.631 45.092 30.247 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.800 42.974 31.765 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.653 44.235 32.972 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.032 46.049 32.673 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.315 42.905 29.863 1.00 0.00 H new ATOM 0 HE1 PHE A 27 2.811 46.697 31.726 1.00 0.00 H new ATOM 0 HE2 PHE A 27 3.094 43.552 28.915 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.867 45.439 29.859 1.00 0.00 H new ATOM 437 N LEU A 28 8.822 45.837 33.204 1.00 0.00 N ATOM 438 CA LEU A 28 9.175 46.941 34.081 1.00 0.00 C ATOM 439 C LEU A 28 10.130 47.885 33.349 1.00 0.00 C ATOM 440 O LEU A 28 10.343 49.017 33.781 1.00 0.00 O ATOM 441 CB LEU A 28 9.726 46.416 35.409 1.00 0.00 C ATOM 442 CG LEU A 28 9.896 47.452 36.522 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.647 48.327 36.651 1.00 0.00 C ATOM 444 CD2 LEU A 28 10.265 46.779 37.845 1.00 0.00 C ATOM 0 H LEU A 28 9.144 44.922 33.519 1.00 0.00 H new ATOM 0 HA LEU A 28 8.289 47.521 34.337 1.00 0.00 H new ATOM 0 HB2 LEU A 28 9.062 45.630 35.770 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.695 45.953 35.220 1.00 0.00 H new ATOM 0 HG LEU A 28 10.723 48.110 36.255 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.794 49.055 37.449 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.470 48.850 35.711 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.786 47.700 36.885 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.380 47.537 38.619 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.476 46.084 38.132 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.202 46.235 37.728 1.00 0.00 H new ATOM 456 N GLN A 29 10.679 47.385 32.252 1.00 0.00 N ATOM 457 CA GLN A 29 11.607 48.170 31.455 1.00 0.00 C ATOM 458 C GLN A 29 10.841 49.084 30.496 1.00 0.00 C ATOM 459 O GLN A 29 11.020 50.301 30.517 1.00 0.00 O ATOM 460 CB GLN A 29 12.577 47.265 30.694 1.00 0.00 C ATOM 461 CG GLN A 29 13.829 48.036 30.269 1.00 0.00 C ATOM 462 CD GLN A 29 14.485 47.387 29.049 1.00 0.00 C ATOM 463 OE1 GLN A 29 14.526 47.944 27.964 1.00 0.00 O ATOM 464 NE2 GLN A 29 14.995 46.183 29.286 1.00 0.00 N ATOM 0 H GLN A 29 10.499 46.446 31.896 1.00 0.00 H new ATOM 0 HA GLN A 29 12.196 48.794 32.127 1.00 0.00 H new ATOM 0 HB2 GLN A 29 12.861 46.421 31.322 1.00 0.00 H new ATOM 0 HB3 GLN A 29 12.082 46.855 29.814 1.00 0.00 H new ATOM 0 HG2 GLN A 29 13.564 49.068 30.038 1.00 0.00 H new ATOM 0 HG3 GLN A 29 14.539 48.067 31.095 1.00 0.00 H new ATOM 0 HE21 GLN A 29 14.926 45.774 30.218 1.00 0.00 H new ATOM 0 HE22 GLN A 29 15.455 45.667 28.536 1.00 0.00 H new ATOM 473 N ALA A 30 10.004 48.463 29.679 1.00 0.00 N ATOM 474 CA ALA A 30 9.211 49.204 28.714 1.00 0.00 C ATOM 475 C ALA A 30 8.362 50.243 29.449 1.00 0.00 C ATOM 476 O ALA A 30 8.198 51.366 28.973 1.00 0.00 O ATOM 477 CB ALA A 30 8.360 48.231 27.895 1.00 0.00 C ATOM 0 H ALA A 30 9.858 47.454 29.666 1.00 0.00 H new ATOM 0 HA ALA A 30 9.857 49.738 28.017 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.765 48.788 27.171 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.011 47.532 27.369 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.697 47.678 28.561 1.00 0.00 H new ATOM 483 N ALA A 31 7.846 49.833 30.598 1.00 0.00 N ATOM 484 CA ALA A 31 7.018 50.714 31.404 1.00 0.00 C ATOM 485 C ALA A 31 7.853 51.912 31.861 1.00 0.00 C ATOM 486 O ALA A 31 7.325 53.010 32.037 1.00 0.00 O ATOM 487 CB ALA A 31 6.431 49.931 32.579 1.00 0.00 C ATOM 0 H ALA A 31 7.985 48.902 30.990 1.00 0.00 H new ATOM 0 HA ALA A 31 6.182 51.097 30.819 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.810 50.593 33.183 1.00 0.00 H new ATOM 0 HB2 ALA A 31 5.824 49.108 32.201 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.240 49.533 33.192 1.00 0.00 H new ATOM 493 N TYR A 32 9.141 51.662 32.042 1.00 0.00 N ATOM 494 CA TYR A 32 10.053 52.706 32.476 1.00 0.00 C ATOM 495 C TYR A 32 10.419 53.632 31.313 1.00 0.00 C ATOM 496 O TYR A 32 10.977 54.708 31.525 1.00 0.00 O ATOM 497 CB TYR A 32 11.316 51.989 32.958 1.00 0.00 C ATOM 498 CG TYR A 32 11.855 52.510 34.292 1.00 0.00 C ATOM 499 CD1 TYR A 32 11.116 52.350 35.446 1.00 0.00 C ATOM 500 CD2 TYR A 32 13.082 53.141 34.342 1.00 0.00 C ATOM 501 CE1 TYR A 32 11.623 52.840 36.701 1.00 0.00 C ATOM 502 CE2 TYR A 32 13.590 53.632 35.596 1.00 0.00 C ATOM 503 CZ TYR A 32 12.835 53.456 36.714 1.00 0.00 C ATOM 504 OH TYR A 32 13.315 53.919 37.901 1.00 0.00 O ATOM 0 H TYR A 32 9.575 50.751 31.896 1.00 0.00 H new ATOM 0 HA TYR A 32 9.596 53.316 33.255 1.00 0.00 H new ATOM 0 HB2 TYR A 32 11.103 50.924 33.055 1.00 0.00 H new ATOM 0 HB3 TYR A 32 12.092 52.091 32.199 1.00 0.00 H new ATOM 0 HD1 TYR A 32 10.156 51.857 35.408 1.00 0.00 H new ATOM 0 HD2 TYR A 32 13.661 53.266 33.439 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.054 52.721 37.611 1.00 0.00 H new ATOM 0 HE2 TYR A 32 14.548 54.128 35.648 1.00 0.00 H new ATOM 0 HH TYR A 32 14.191 54.335 37.760 1.00 0.00 H new ATOM 514 N ARG A 33 10.091 53.180 30.112 1.00 0.00 N ATOM 515 CA ARG A 33 10.379 53.953 28.917 1.00 0.00 C ATOM 516 C ARG A 33 9.184 54.840 28.559 1.00 0.00 C ATOM 517 O ARG A 33 9.302 55.741 27.729 1.00 0.00 O ATOM 518 CB ARG A 33 10.699 53.039 27.732 1.00 0.00 C ATOM 519 CG ARG A 33 11.820 53.627 26.874 1.00 0.00 C ATOM 520 CD ARG A 33 11.359 54.904 26.169 1.00 0.00 C ATOM 521 NE ARG A 33 11.670 56.085 27.007 1.00 0.00 N ATOM 522 CZ ARG A 33 11.241 57.337 26.740 1.00 0.00 C ATOM 523 NH1 ARG A 33 10.479 57.582 25.652 1.00 0.00 N ATOM 524 NH2 ARG A 33 11.577 58.316 27.557 1.00 0.00 N ATOM 0 H ARG A 33 9.628 52.287 29.941 1.00 0.00 H new ATOM 0 HA ARG A 33 11.249 54.575 29.126 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.993 52.055 28.096 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.805 52.900 27.124 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.685 53.845 27.500 1.00 0.00 H new ATOM 0 HG3 ARG A 33 12.139 52.893 26.133 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.853 54.994 25.202 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.287 54.856 25.976 1.00 0.00 H new ATOM 0 HE ARG A 33 12.244 55.944 27.838 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.224 56.818 25.026 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.159 58.531 25.457 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.153 58.122 28.376 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.261 59.268 27.370 1.00 0.00 H new ATOM 537 N LEU A 34 8.062 54.555 29.203 1.00 0.00 N ATOM 538 CA LEU A 34 6.848 55.316 28.963 1.00 0.00 C ATOM 539 C LEU A 34 6.647 56.319 30.100 1.00 0.00 C ATOM 540 O LEU A 34 7.584 56.625 30.836 1.00 0.00 O ATOM 541 CB LEU A 34 5.659 54.375 28.755 1.00 0.00 C ATOM 542 CG LEU A 34 5.876 53.227 27.767 1.00 0.00 C ATOM 543 CD1 LEU A 34 4.806 52.147 27.938 1.00 0.00 C ATOM 544 CD2 LEU A 34 5.943 53.746 26.330 1.00 0.00 C ATOM 0 H LEU A 34 7.968 53.808 29.891 1.00 0.00 H new ATOM 0 HA LEU A 34 6.935 55.892 28.042 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.385 53.950 29.720 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.809 54.966 28.414 1.00 0.00 H new ATOM 0 HG LEU A 34 6.838 52.764 27.987 1.00 0.00 H new ATOM 0 HD11 LEU A 34 4.983 51.343 27.224 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.850 51.749 28.952 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.821 52.579 27.760 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.098 52.910 25.648 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.009 54.249 26.081 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.770 54.449 26.235 1.00 0.00 H new ATOM 665 N PHE A 43 0.894 50.096 38.583 1.00 0.00 N ATOM 666 CA PHE A 43 1.326 48.709 38.569 1.00 0.00 C ATOM 667 C PHE A 43 0.179 47.774 38.958 1.00 0.00 C ATOM 668 O PHE A 43 0.149 46.616 38.544 1.00 0.00 O ATOM 669 CB PHE A 43 2.447 48.579 39.602 1.00 0.00 C ATOM 670 CG PHE A 43 3.757 49.251 39.186 1.00 0.00 C ATOM 671 CD1 PHE A 43 4.189 49.164 37.901 1.00 0.00 C ATOM 672 CD2 PHE A 43 4.489 49.938 40.104 1.00 0.00 C ATOM 673 CE1 PHE A 43 5.405 49.788 37.515 1.00 0.00 C ATOM 674 CE2 PHE A 43 5.705 50.562 39.719 1.00 0.00 C ATOM 675 CZ PHE A 43 6.137 50.475 38.433 1.00 0.00 C ATOM 0 HA PHE A 43 1.661 48.434 37.569 1.00 0.00 H new ATOM 0 HB2 PHE A 43 2.111 49.013 40.544 1.00 0.00 H new ATOM 0 HB3 PHE A 43 2.636 47.522 39.787 1.00 0.00 H new ATOM 0 HD1 PHE A 43 3.607 48.620 37.172 1.00 0.00 H new ATOM 0 HD2 PHE A 43 4.145 50.009 41.125 1.00 0.00 H new ATOM 0 HE1 PHE A 43 5.748 49.717 36.493 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.287 51.106 40.448 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.061 50.951 38.140 1.00 0.00 H new ATOM 685 N GLN A 44 -0.737 48.310 39.751 1.00 0.00 N ATOM 686 CA GLN A 44 -1.883 47.538 40.201 1.00 0.00 C ATOM 687 C GLN A 44 -2.739 47.115 39.006 1.00 0.00 C ATOM 688 O GLN A 44 -3.087 45.943 38.872 1.00 0.00 O ATOM 689 CB GLN A 44 -2.711 48.328 41.216 1.00 0.00 C ATOM 690 CG GLN A 44 -3.194 49.651 40.619 1.00 0.00 C ATOM 691 CD GLN A 44 -4.545 49.477 39.921 1.00 0.00 C ATOM 692 OE1 GLN A 44 -5.188 48.443 40.006 1.00 0.00 O ATOM 693 NE2 GLN A 44 -4.937 50.541 39.228 1.00 0.00 N ATOM 0 H GLN A 44 -0.709 49.270 40.094 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.519 46.639 40.699 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -3.568 47.734 41.533 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -2.112 48.523 42.106 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -3.281 50.399 41.407 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.458 50.023 39.906 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -4.350 51.375 39.199 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.825 50.524 38.726 1.00 0.00 H new ATOM 702 N GLN A 45 -3.053 48.091 38.168 1.00 0.00 N ATOM 703 CA GLN A 45 -3.861 47.833 36.988 1.00 0.00 C ATOM 704 C GLN A 45 -3.047 47.070 35.941 1.00 0.00 C ATOM 705 O GLN A 45 -3.590 46.620 34.934 1.00 0.00 O ATOM 706 CB GLN A 45 -4.416 49.136 36.408 1.00 0.00 C ATOM 707 CG GLN A 45 -5.945 49.158 36.474 1.00 0.00 C ATOM 708 CD GLN A 45 -6.557 48.764 35.127 1.00 0.00 C ATOM 709 OE1 GLN A 45 -6.633 49.550 34.197 1.00 0.00 O ATOM 710 NE2 GLN A 45 -6.987 47.507 35.075 1.00 0.00 N ATOM 0 H GLN A 45 -2.763 49.062 38.282 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.708 47.214 37.282 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.012 49.985 36.960 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.091 49.245 35.373 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.289 48.473 37.248 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.286 50.154 36.755 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.893 46.902 35.891 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.411 47.148 34.220 1.00 0.00 H new ATOM 719 N LEU A 46 -1.756 46.950 36.216 1.00 0.00 N ATOM 720 CA LEU A 46 -0.860 46.250 35.311 1.00 0.00 C ATOM 721 C LEU A 46 -0.702 44.801 35.776 1.00 0.00 C ATOM 722 O LEU A 46 -0.655 43.884 34.957 1.00 0.00 O ATOM 723 CB LEU A 46 0.465 47.001 35.181 1.00 0.00 C ATOM 724 CG LEU A 46 1.337 46.622 33.982 1.00 0.00 C ATOM 725 CD1 LEU A 46 2.764 47.146 34.154 1.00 0.00 C ATOM 726 CD2 LEU A 46 1.307 45.112 33.738 1.00 0.00 C ATOM 0 H LEU A 46 -1.309 47.326 37.053 1.00 0.00 H new ATOM 0 HA LEU A 46 -1.282 46.219 34.306 1.00 0.00 H new ATOM 0 HB2 LEU A 46 0.251 48.068 35.126 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.043 46.838 36.091 1.00 0.00 H new ATOM 0 HG LEU A 46 0.923 47.100 33.094 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.362 46.863 33.288 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.745 48.232 34.242 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.203 46.717 35.055 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.935 44.869 32.881 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.682 44.593 34.620 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.283 44.796 33.539 1.00 0.00 H new ATOM 738 N ARG A 47 -0.627 44.639 37.088 1.00 0.00 N ATOM 739 CA ARG A 47 -0.476 43.317 37.672 1.00 0.00 C ATOM 740 C ARG A 47 -1.769 42.515 37.511 1.00 0.00 C ATOM 741 O ARG A 47 -1.742 41.286 37.495 1.00 0.00 O ATOM 742 CB ARG A 47 -0.122 43.409 39.158 1.00 0.00 C ATOM 743 CG ARG A 47 0.666 42.177 39.610 1.00 0.00 C ATOM 744 CD ARG A 47 2.172 42.427 39.523 1.00 0.00 C ATOM 745 NE ARG A 47 2.822 42.053 40.800 1.00 0.00 N ATOM 746 CZ ARG A 47 2.899 40.790 41.269 1.00 0.00 C ATOM 747 NH1 ARG A 47 2.367 39.765 40.569 1.00 0.00 N ATOM 748 NH2 ARG A 47 3.503 40.571 42.422 1.00 0.00 N ATOM 0 H ARG A 47 -0.668 45.402 37.764 1.00 0.00 H new ATOM 0 HA ARG A 47 0.336 42.813 37.147 1.00 0.00 H new ATOM 0 HB2 ARG A 47 0.466 44.309 39.341 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.034 43.499 39.748 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.395 41.923 40.635 1.00 0.00 H new ATOM 0 HG3 ARG A 47 0.399 41.322 38.989 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.599 41.847 38.705 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.363 43.477 39.302 1.00 0.00 H new ATOM 0 HE ARG A 47 3.238 42.797 41.360 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.902 39.942 39.678 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.430 38.813 40.931 1.00 0.00 H new ATOM 0 HH21 ARG A 47 3.903 41.350 42.944 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.570 39.622 42.791 1.00 0.00 H new ATOM 761 N ARG A 48 -2.869 43.244 37.398 1.00 0.00 N ATOM 762 CA ARG A 48 -4.169 42.615 37.239 1.00 0.00 C ATOM 763 C ARG A 48 -4.233 41.853 35.914 1.00 0.00 C ATOM 764 O ARG A 48 -4.915 40.834 35.811 1.00 0.00 O ATOM 765 CB ARG A 48 -5.292 43.655 37.275 1.00 0.00 C ATOM 766 CG ARG A 48 -6.430 43.200 38.190 1.00 0.00 C ATOM 767 CD ARG A 48 -6.049 43.361 39.663 1.00 0.00 C ATOM 768 NE ARG A 48 -7.259 43.628 40.473 1.00 0.00 N ATOM 769 CZ ARG A 48 -8.051 44.709 40.315 1.00 0.00 C ATOM 770 NH1 ARG A 48 -7.770 45.634 39.373 1.00 0.00 N ATOM 771 NH2 ARG A 48 -9.107 44.848 41.095 1.00 0.00 N ATOM 0 H ARG A 48 -2.887 44.264 37.413 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.304 41.920 38.068 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.898 44.609 37.625 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -5.674 43.818 36.267 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.327 43.782 37.977 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.671 42.157 37.985 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.554 42.458 40.020 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.338 44.179 39.776 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.510 42.953 41.195 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.953 45.519 38.773 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -8.375 46.448 39.261 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -9.314 44.144 41.804 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.716 45.659 40.989 1.00 0.00 H new ATOM 784 N PHE A 49 -3.511 42.375 34.933 1.00 0.00 N ATOM 785 CA PHE A 49 -3.477 41.756 33.619 1.00 0.00 C ATOM 786 C PHE A 49 -2.577 40.520 33.618 1.00 0.00 C ATOM 787 O PHE A 49 -2.817 39.572 32.871 1.00 0.00 O ATOM 788 CB PHE A 49 -2.901 42.792 32.651 1.00 0.00 C ATOM 789 CG PHE A 49 -2.501 42.218 31.290 1.00 0.00 C ATOM 790 CD1 PHE A 49 -3.382 41.457 30.588 1.00 0.00 C ATOM 791 CD2 PHE A 49 -1.264 42.470 30.783 1.00 0.00 C ATOM 792 CE1 PHE A 49 -3.011 40.925 29.325 1.00 0.00 C ATOM 793 CE2 PHE A 49 -0.894 41.938 29.520 1.00 0.00 C ATOM 794 CZ PHE A 49 -1.774 41.176 28.817 1.00 0.00 C ATOM 0 H PHE A 49 -2.945 43.219 35.022 1.00 0.00 H new ATOM 0 HA PHE A 49 -4.480 41.442 33.330 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.638 43.581 32.499 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.027 43.256 33.109 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.364 41.257 30.991 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.564 43.074 31.341 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.711 40.321 28.767 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.088 42.139 29.117 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.491 40.771 27.857 1.00 0.00 H new ATOM 804 N LEU A 50 -1.559 40.567 34.464 1.00 0.00 N ATOM 805 CA LEU A 50 -0.621 39.462 34.571 1.00 0.00 C ATOM 806 C LEU A 50 -1.308 38.281 35.260 1.00 0.00 C ATOM 807 O LEU A 50 -1.256 37.156 34.768 1.00 0.00 O ATOM 808 CB LEU A 50 0.665 39.916 35.266 1.00 0.00 C ATOM 809 CG LEU A 50 1.342 41.156 34.679 1.00 0.00 C ATOM 810 CD1 LEU A 50 2.174 41.880 35.739 1.00 0.00 C ATOM 811 CD2 LEU A 50 2.174 40.794 33.446 1.00 0.00 C ATOM 0 H LEU A 50 -1.363 41.354 35.083 1.00 0.00 H new ATOM 0 HA LEU A 50 -0.318 39.122 33.581 1.00 0.00 H new ATOM 0 HB2 LEU A 50 0.439 40.112 36.314 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.378 39.092 35.243 1.00 0.00 H new ATOM 0 HG LEU A 50 0.565 41.847 34.352 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.644 42.758 35.295 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.527 42.191 36.560 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.944 41.208 36.118 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.645 41.693 33.048 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.944 40.075 33.725 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.527 40.356 32.686 1.00 0.00 H new ATOM 823 N LYS A 51 -1.937 38.579 36.388 1.00 0.00 N ATOM 824 CA LYS A 51 -2.633 37.557 37.150 1.00 0.00 C ATOM 825 C LYS A 51 -3.667 36.874 36.252 1.00 0.00 C ATOM 826 O LYS A 51 -4.009 35.712 36.466 1.00 0.00 O ATOM 827 CB LYS A 51 -3.226 38.151 38.429 1.00 0.00 C ATOM 828 CG LYS A 51 -2.223 38.080 39.582 1.00 0.00 C ATOM 829 CD LYS A 51 -2.943 37.952 40.926 1.00 0.00 C ATOM 830 CE LYS A 51 -2.962 39.291 41.667 1.00 0.00 C ATOM 831 NZ LYS A 51 -4.236 40.003 41.417 1.00 0.00 N ATOM 0 H LYS A 51 -1.979 39.515 36.792 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.936 36.786 37.479 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.512 39.188 38.254 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.134 37.611 38.698 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -1.558 37.228 39.439 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -1.600 38.974 39.583 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.964 37.607 40.764 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.446 37.200 41.539 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.836 39.123 42.737 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.124 39.907 41.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -4.233 40.909 41.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.341 40.179 40.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -5.030 39.421 41.751 1.00 0.00 H new ATOM 844 N LEU A 52 -4.135 37.626 35.266 1.00 0.00 N ATOM 845 CA LEU A 52 -5.123 37.107 34.335 1.00 0.00 C ATOM 846 C LEU A 52 -4.490 36.000 33.490 1.00 0.00 C ATOM 847 O LEU A 52 -5.013 34.888 33.425 1.00 0.00 O ATOM 848 CB LEU A 52 -5.726 38.244 33.507 1.00 0.00 C ATOM 849 CG LEU A 52 -6.559 37.821 32.295 1.00 0.00 C ATOM 850 CD1 LEU A 52 -7.387 38.993 31.763 1.00 0.00 C ATOM 851 CD2 LEU A 52 -5.675 37.205 31.209 1.00 0.00 C ATOM 0 H LEU A 52 -3.849 38.589 35.092 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.957 36.658 34.875 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.353 38.850 34.161 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.915 38.884 33.160 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.260 37.050 32.615 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.970 38.666 30.902 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.061 39.347 32.544 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.721 39.803 31.464 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.292 36.913 30.359 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.934 37.936 30.885 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.168 36.326 31.608 1.00 0.00 H new ATOM 863 N ALA A 53 -3.374 36.342 32.864 1.00 0.00 N ATOM 864 CA ALA A 53 -2.665 35.390 32.026 1.00 0.00 C ATOM 865 C ALA A 53 -2.292 34.162 32.859 1.00 0.00 C ATOM 866 O ALA A 53 -2.210 33.053 32.334 1.00 0.00 O ATOM 867 CB ALA A 53 -1.439 36.069 31.407 1.00 0.00 C ATOM 0 H ALA A 53 -2.943 37.265 32.920 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.300 35.052 31.207 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.907 35.355 30.778 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.760 36.917 30.802 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.777 36.418 32.200 1.00 0.00 H new ATOM 873 N LEU A 54 -2.075 34.402 34.144 1.00 0.00 N ATOM 874 CA LEU A 54 -1.714 33.328 35.055 1.00 0.00 C ATOM 875 C LEU A 54 -2.851 32.307 35.109 1.00 0.00 C ATOM 876 O LEU A 54 -2.673 31.201 35.617 1.00 0.00 O ATOM 877 CB LEU A 54 -1.329 33.894 36.423 1.00 0.00 C ATOM 878 CG LEU A 54 0.049 33.494 36.951 1.00 0.00 C ATOM 879 CD1 LEU A 54 1.106 33.585 35.849 1.00 0.00 C ATOM 880 CD2 LEU A 54 0.428 34.324 38.180 1.00 0.00 C ATOM 0 H LEU A 54 -2.142 35.324 34.576 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.831 32.802 34.693 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.374 34.982 36.370 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.079 33.579 37.148 1.00 0.00 H new ATOM 0 HG LEU A 54 0.004 32.452 37.268 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.077 33.295 36.251 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.838 32.916 35.031 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.158 34.609 35.478 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.412 34.019 38.535 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.450 35.381 37.913 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.308 34.164 38.968 1.00 0.00 H new ATOM 892 N LYS A 55 -3.996 32.713 34.579 1.00 0.00 N ATOM 893 CA LYS A 55 -5.162 31.847 34.562 1.00 0.00 C ATOM 894 C LYS A 55 -4.958 30.745 33.519 1.00 0.00 C ATOM 895 O LYS A 55 -5.784 29.844 33.394 1.00 0.00 O ATOM 896 CB LYS A 55 -6.436 32.667 34.347 1.00 0.00 C ATOM 897 CG LYS A 55 -6.756 32.803 32.857 1.00 0.00 C ATOM 898 CD LYS A 55 -7.792 33.904 32.617 1.00 0.00 C ATOM 899 CE LYS A 55 -9.189 33.310 32.432 1.00 0.00 C ATOM 900 NZ LYS A 55 -10.204 34.385 32.360 1.00 0.00 N ATOM 0 H LYS A 55 -4.141 33.631 34.158 1.00 0.00 H new ATOM 0 HA LYS A 55 -5.285 31.356 35.527 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -7.271 32.189 34.860 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.315 33.656 34.788 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -5.844 33.030 32.305 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -7.133 31.854 32.474 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -7.795 34.595 33.460 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.518 34.480 31.733 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -9.219 32.712 31.521 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -9.418 32.640 33.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.147 33.964 32.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.186 34.939 33.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.993 35.008 31.555 1.00 0.00 H new ATOM 913 N THR A 56 -3.852 30.855 32.798 1.00 0.00 N ATOM 914 CA THR A 56 -3.528 29.880 31.771 1.00 0.00 C ATOM 915 C THR A 56 -2.011 29.738 31.629 1.00 0.00 C ATOM 916 O THR A 56 -1.373 30.519 30.924 1.00 0.00 O ATOM 917 CB THR A 56 -4.221 30.308 30.476 1.00 0.00 C ATOM 918 OG1 THR A 56 -3.989 29.223 29.582 1.00 0.00 O ATOM 919 CG2 THR A 56 -3.530 31.498 29.808 1.00 0.00 C ATOM 0 H THR A 56 -3.169 31.605 32.905 1.00 0.00 H new ATOM 0 HA THR A 56 -3.892 28.888 32.039 1.00 0.00 H new ATOM 0 HB THR A 56 -5.259 30.564 30.688 1.00 0.00 H new ATOM 0 HG1 THR A 56 -4.535 29.340 28.777 1.00 0.00 H new ATOM 0 HG21 THR A 56 -4.062 31.761 28.894 1.00 0.00 H new ATOM 0 HG22 THR A 56 -3.534 32.350 30.488 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.501 31.232 29.566 1.00 0.00 H new ATOM 927 N PRO A 57 -1.462 28.709 32.329 1.00 0.00 N ATOM 928 CA PRO A 57 -0.033 28.454 32.288 1.00 0.00 C ATOM 929 C PRO A 57 0.372 27.813 30.960 1.00 0.00 C ATOM 930 O PRO A 57 0.774 26.650 30.924 1.00 0.00 O ATOM 931 CB PRO A 57 0.243 27.561 33.487 1.00 0.00 C ATOM 932 CG PRO A 57 -1.100 26.971 33.884 1.00 0.00 C ATOM 933 CD PRO A 57 -2.186 27.764 33.174 1.00 0.00 C ATOM 0 HA PRO A 57 0.558 29.368 32.345 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.955 26.776 33.234 1.00 0.00 H new ATOM 0 HB3 PRO A 57 0.677 28.132 34.308 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.152 25.918 33.605 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.235 27.022 34.964 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -2.828 27.113 32.580 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -2.829 28.281 33.886 1.00 0.00 H new ATOM 941 N ILE A 58 0.252 28.597 29.899 1.00 0.00 N ATOM 942 CA ILE A 58 0.601 28.120 28.571 1.00 0.00 C ATOM 943 C ILE A 58 1.707 29.003 27.991 1.00 0.00 C ATOM 944 O ILE A 58 2.440 28.581 27.098 1.00 0.00 O ATOM 945 CB ILE A 58 -0.646 28.035 27.688 1.00 0.00 C ATOM 946 CG1 ILE A 58 -0.334 28.473 26.255 1.00 0.00 C ATOM 947 CG2 ILE A 58 -1.801 28.835 28.293 1.00 0.00 C ATOM 948 CD1 ILE A 58 0.653 27.511 25.591 1.00 0.00 C ATOM 0 H ILE A 58 -0.082 29.560 29.932 1.00 0.00 H new ATOM 0 HA ILE A 58 0.997 27.106 28.622 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.964 26.993 27.644 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.255 28.513 25.674 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.083 29.480 26.261 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.675 28.758 27.646 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.043 28.437 29.278 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.509 29.881 28.386 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.858 27.845 24.574 1.00 0.00 H new ATOM 0 HD12 ILE A 58 1.582 27.492 26.161 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.223 26.510 25.565 1.00 0.00 H new ATOM 960 N TRP A 59 1.792 30.215 28.520 1.00 0.00 N ATOM 961 CA TRP A 59 2.796 31.162 28.066 1.00 0.00 C ATOM 962 C TRP A 59 4.009 31.047 28.991 1.00 0.00 C ATOM 963 O TRP A 59 5.117 31.426 28.618 1.00 0.00 O ATOM 964 CB TRP A 59 2.224 32.580 28.005 1.00 0.00 C ATOM 965 CG TRP A 59 1.392 32.970 29.228 1.00 0.00 C ATOM 966 CD1 TRP A 59 0.121 32.643 29.499 1.00 0.00 C ATOM 967 CD2 TRP A 59 1.827 33.778 30.342 1.00 0.00 C ATOM 968 NE1 TRP A 59 -0.293 33.179 30.701 1.00 0.00 N ATOM 969 CE2 TRP A 59 0.778 33.891 31.230 1.00 0.00 C ATOM 970 CE3 TRP A 59 3.067 34.392 30.590 1.00 0.00 C ATOM 971 CZ2 TRP A 59 0.860 34.613 32.427 1.00 0.00 C ATOM 972 CZ3 TRP A 59 3.134 35.110 31.790 1.00 0.00 C ATOM 973 CH2 TRP A 59 2.086 35.234 32.695 1.00 0.00 C ATOM 0 H TRP A 59 1.181 30.563 29.259 1.00 0.00 H new ATOM 0 HA TRP A 59 3.111 30.930 27.049 1.00 0.00 H new ATOM 0 HB2 TRP A 59 3.046 33.288 27.897 1.00 0.00 H new ATOM 0 HB3 TRP A 59 1.605 32.673 27.113 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -0.501 32.036 28.857 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -1.215 33.073 31.124 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.902 34.316 29.909 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 0.024 34.687 33.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 4.065 35.602 32.029 1.00 0.00 H new ATOM 0 HH2 TRP A 59 2.217 35.807 33.601 1.00 0.00 H new ATOM 984 N LEU A 60 3.757 30.521 30.182 1.00 0.00 N ATOM 985 CA LEU A 60 4.814 30.350 31.163 1.00 0.00 C ATOM 986 C LEU A 60 5.747 29.226 30.712 1.00 0.00 C ATOM 987 O LEU A 60 6.963 29.403 30.666 1.00 0.00 O ATOM 988 CB LEU A 60 4.221 30.135 32.557 1.00 0.00 C ATOM 989 CG LEU A 60 4.596 31.177 33.614 1.00 0.00 C ATOM 990 CD1 LEU A 60 4.631 32.582 33.010 1.00 0.00 C ATOM 991 CD2 LEU A 60 3.660 31.095 34.820 1.00 0.00 C ATOM 0 H LEU A 60 2.836 30.208 30.489 1.00 0.00 H new ATOM 0 HA LEU A 60 5.417 31.255 31.234 1.00 0.00 H new ATOM 0 HB2 LEU A 60 3.135 30.111 32.468 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.533 29.154 32.916 1.00 0.00 H new ATOM 0 HG LEU A 60 5.602 30.955 33.971 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.900 33.303 33.782 1.00 0.00 H new ATOM 0 HD12 LEU A 60 5.370 32.615 32.209 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.649 32.830 32.608 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.948 31.846 35.556 1.00 0.00 H new ATOM 0 HD22 LEU A 60 2.635 31.277 34.498 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.729 30.103 35.267 1.00 0.00 H new ATOM 1003 N ASN A 61 5.142 28.092 30.388 1.00 0.00 N ATOM 1004 CA ASN A 61 5.903 26.937 29.942 1.00 0.00 C ATOM 1005 C ASN A 61 6.909 27.377 28.876 1.00 0.00 C ATOM 1006 O ASN A 61 8.114 27.204 29.046 1.00 0.00 O ATOM 1007 CB ASN A 61 4.988 25.880 29.322 1.00 0.00 C ATOM 1008 CG ASN A 61 5.031 24.578 30.124 1.00 0.00 C ATOM 1009 OD1 ASN A 61 5.199 24.570 31.333 1.00 0.00 O ATOM 1010 ND2 ASN A 61 4.869 23.483 29.388 1.00 0.00 N ATOM 0 H ASN A 61 4.133 27.949 30.426 1.00 0.00 H new ATOM 0 HA ASN A 61 6.409 26.511 30.808 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.965 26.255 29.286 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.293 25.688 28.293 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.881 22.564 29.831 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.733 23.561 28.380 1.00 0.00 H new ATOM 1017 N PRO A 62 6.361 27.951 27.771 1.00 0.00 N ATOM 1018 CA PRO A 62 7.197 28.416 26.678 1.00 0.00 C ATOM 1019 C PRO A 62 7.906 29.721 27.046 1.00 0.00 C ATOM 1020 O PRO A 62 8.700 30.242 26.264 1.00 0.00 O ATOM 1021 CB PRO A 62 6.251 28.568 25.497 1.00 0.00 C ATOM 1022 CG PRO A 62 4.852 28.630 26.089 1.00 0.00 C ATOM 1023 CD PRO A 62 4.937 28.172 27.536 1.00 0.00 C ATOM 0 HA PRO A 62 8.003 27.722 26.440 1.00 0.00 H new ATOM 0 HB2 PRO A 62 6.476 29.472 24.930 1.00 0.00 H new ATOM 0 HB3 PRO A 62 6.347 27.728 24.809 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.458 29.645 26.032 1.00 0.00 H new ATOM 0 HG3 PRO A 62 4.171 27.992 25.526 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.536 28.925 28.214 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.363 27.260 27.697 1.00 0.00 H new ATOM 1031 N ILE A 63 7.594 30.211 28.237 1.00 0.00 N ATOM 1032 CA ILE A 63 8.192 31.444 28.718 1.00 0.00 C ATOM 1033 C ILE A 63 8.397 32.401 27.542 1.00 0.00 C ATOM 1034 O ILE A 63 9.452 32.398 26.911 1.00 0.00 O ATOM 1035 CB ILE A 63 9.474 31.148 29.500 1.00 0.00 C ATOM 1036 CG1 ILE A 63 9.990 32.406 30.203 1.00 0.00 C ATOM 1037 CG2 ILE A 63 10.536 30.522 28.595 1.00 0.00 C ATOM 1038 CD1 ILE A 63 8.842 33.181 30.853 1.00 0.00 C ATOM 0 H ILE A 63 6.935 29.776 28.883 1.00 0.00 H new ATOM 0 HA ILE A 63 7.524 31.942 29.421 1.00 0.00 H new ATOM 0 HB ILE A 63 9.240 30.418 30.275 1.00 0.00 H new ATOM 0 HG12 ILE A 63 10.722 32.129 30.962 1.00 0.00 H new ATOM 0 HG13 ILE A 63 10.503 33.044 29.484 1.00 0.00 H new ATOM 0 HG21 ILE A 63 11.437 30.322 29.175 1.00 0.00 H new ATOM 0 HG22 ILE A 63 10.156 29.588 28.181 1.00 0.00 H new ATOM 0 HG23 ILE A 63 10.773 31.209 27.783 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.236 34.070 31.345 1.00 0.00 H new ATOM 0 HD12 ILE A 63 8.124 33.478 30.088 1.00 0.00 H new ATOM 0 HD13 ILE A 63 8.347 32.548 31.589 1.00 0.00 H new ATOM 1050 N ASP A 64 7.368 33.196 27.282 1.00 0.00 N ATOM 1051 CA ASP A 64 7.422 34.155 26.193 1.00 0.00 C ATOM 1052 C ASP A 64 6.206 35.081 26.274 1.00 0.00 C ATOM 1053 O ASP A 64 5.075 34.647 26.062 1.00 0.00 O ATOM 1054 CB ASP A 64 7.388 33.450 24.836 1.00 0.00 C ATOM 1055 CG ASP A 64 8.703 33.486 24.055 1.00 0.00 C ATOM 1056 OD1 ASP A 64 8.915 34.359 23.199 1.00 0.00 O ATOM 1057 OD2 ASP A 64 9.544 32.556 24.359 1.00 0.00 O ATOM 0 H ASP A 64 6.493 33.195 27.807 1.00 0.00 H new ATOM 0 HA ASP A 64 8.351 34.717 26.285 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.104 32.409 24.991 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.608 33.906 24.226 1.00 0.00 H new ATOM 1063 N TYR A 65 6.481 36.340 26.583 1.00 0.00 N ATOM 1064 CA TYR A 65 5.425 37.331 26.696 1.00 0.00 C ATOM 1065 C TYR A 65 4.720 37.536 25.353 1.00 0.00 C ATOM 1066 O TYR A 65 3.677 38.186 25.287 1.00 0.00 O ATOM 1067 CB TYR A 65 6.111 38.635 27.103 1.00 0.00 C ATOM 1068 CG TYR A 65 5.285 39.504 28.053 1.00 0.00 C ATOM 1069 CD1 TYR A 65 4.126 40.106 27.606 1.00 0.00 C ATOM 1070 CD2 TYR A 65 5.697 39.685 29.358 1.00 0.00 C ATOM 1071 CE1 TYR A 65 3.348 40.924 28.500 1.00 0.00 C ATOM 1072 CE2 TYR A 65 4.919 40.502 30.252 1.00 0.00 C ATOM 1073 CZ TYR A 65 3.783 41.081 29.779 1.00 0.00 C ATOM 1074 OH TYR A 65 3.048 41.854 30.624 1.00 0.00 O ATOM 0 H TYR A 65 7.421 36.696 26.759 1.00 0.00 H new ATOM 0 HA TYR A 65 4.675 37.011 27.419 1.00 0.00 H new ATOM 0 HB2 TYR A 65 7.063 38.399 27.578 1.00 0.00 H new ATOM 0 HB3 TYR A 65 6.337 39.210 26.205 1.00 0.00 H new ATOM 0 HD1 TYR A 65 3.803 39.963 26.585 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.603 39.214 29.708 1.00 0.00 H new ATOM 0 HE1 TYR A 65 2.440 41.402 28.163 1.00 0.00 H new ATOM 0 HE2 TYR A 65 5.230 40.652 31.275 1.00 0.00 H new ATOM 0 HH TYR A 65 3.315 42.792 30.526 1.00 0.00 H new ATOM 1084 N SER A 66 5.318 36.970 24.315 1.00 0.00 N ATOM 1085 CA SER A 66 4.761 37.083 22.978 1.00 0.00 C ATOM 1086 C SER A 66 3.349 36.495 22.948 1.00 0.00 C ATOM 1087 O SER A 66 2.573 36.780 22.036 1.00 0.00 O ATOM 1088 CB SER A 66 5.651 36.382 21.950 1.00 0.00 C ATOM 1089 OG SER A 66 6.875 37.079 21.738 1.00 0.00 O ATOM 0 H SER A 66 6.183 36.432 24.373 1.00 0.00 H new ATOM 0 HA SER A 66 4.713 38.140 22.715 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.865 35.368 22.288 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.115 36.296 21.005 1.00 0.00 H new ATOM 0 HG SER A 66 7.415 36.598 21.076 1.00 0.00 H new ATOM 1095 N LEU A 67 3.058 35.685 23.955 1.00 0.00 N ATOM 1096 CA LEU A 67 1.752 35.055 24.056 1.00 0.00 C ATOM 1097 C LEU A 67 0.838 35.920 24.925 1.00 0.00 C ATOM 1098 O LEU A 67 -0.383 35.781 24.877 1.00 0.00 O ATOM 1099 CB LEU A 67 1.890 33.614 24.552 1.00 0.00 C ATOM 1100 CG LEU A 67 0.594 32.806 24.632 1.00 0.00 C ATOM 1101 CD1 LEU A 67 0.888 31.314 24.797 1.00 0.00 C ATOM 1102 CD2 LEU A 67 -0.315 33.337 25.742 1.00 0.00 C ATOM 0 H LEU A 67 3.704 35.450 24.709 1.00 0.00 H new ATOM 0 HA LEU A 67 1.285 34.987 23.073 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.582 33.089 23.894 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.345 33.634 25.543 1.00 0.00 H new ATOM 0 HG LEU A 67 0.057 32.926 23.691 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.050 30.762 24.851 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.468 30.961 23.944 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.456 31.154 25.713 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.230 32.745 25.778 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.201 33.266 26.700 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.565 34.379 25.541 1.00 0.00 H new ATOM 1114 N LEU A 68 1.465 36.794 25.699 1.00 0.00 N ATOM 1115 CA LEU A 68 0.723 37.681 26.578 1.00 0.00 C ATOM 1116 C LEU A 68 -0.062 38.688 25.735 1.00 0.00 C ATOM 1117 O LEU A 68 -1.290 38.735 25.800 1.00 0.00 O ATOM 1118 CB LEU A 68 1.660 38.332 27.598 1.00 0.00 C ATOM 1119 CG LEU A 68 1.606 37.763 29.017 1.00 0.00 C ATOM 1120 CD1 LEU A 68 2.345 38.672 30.001 1.00 0.00 C ATOM 1121 CD2 LEU A 68 0.162 37.504 29.449 1.00 0.00 C ATOM 0 H LEU A 68 2.478 36.907 25.735 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.004 37.117 27.162 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.682 38.243 27.231 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.430 39.396 27.646 1.00 0.00 H new ATOM 0 HG LEU A 68 2.120 36.802 29.019 1.00 0.00 H new ATOM 0 HD11 LEU A 68 2.291 38.244 31.002 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.389 38.761 29.700 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.882 39.659 30.003 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.152 37.100 30.461 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.398 38.439 29.426 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.299 36.788 28.768 1.00 0.00 H new ATOM 1133 N ALA A 69 0.679 39.470 24.962 1.00 0.00 N ATOM 1134 CA ALA A 69 0.067 40.473 24.108 1.00 0.00 C ATOM 1135 C ALA A 69 -1.061 39.829 23.300 1.00 0.00 C ATOM 1136 O ALA A 69 -1.972 40.518 22.841 1.00 0.00 O ATOM 1137 CB ALA A 69 1.137 41.104 23.214 1.00 0.00 C ATOM 0 H ALA A 69 1.697 39.429 24.910 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.371 41.272 24.707 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.678 41.857 22.573 1.00 0.00 H new ATOM 0 HB2 ALA A 69 1.900 41.573 23.835 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.596 40.332 22.596 1.00 0.00 H new ATOM 1143 N SER A 70 -0.966 38.516 23.152 1.00 0.00 N ATOM 1144 CA SER A 70 -1.968 37.772 22.408 1.00 0.00 C ATOM 1145 C SER A 70 -3.257 37.667 23.226 1.00 0.00 C ATOM 1146 O SER A 70 -4.353 37.689 22.667 1.00 0.00 O ATOM 1147 CB SER A 70 -1.457 36.376 22.041 1.00 0.00 C ATOM 1148 OG SER A 70 -2.144 35.835 20.917 1.00 0.00 O ATOM 0 H SER A 70 -0.210 37.948 23.535 1.00 0.00 H new ATOM 0 HA SER A 70 -2.176 38.309 21.482 1.00 0.00 H new ATOM 0 HB2 SER A 70 -0.390 36.426 21.824 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.578 35.710 22.895 1.00 0.00 H new ATOM 0 HG SER A 70 -1.788 34.945 20.714 1.00 0.00 H new ATOM 1154 N LEU A 71 -3.082 37.558 24.534 1.00 0.00 N ATOM 1155 CA LEU A 71 -4.218 37.450 25.434 1.00 0.00 C ATOM 1156 C LEU A 71 -5.068 38.717 25.329 1.00 0.00 C ATOM 1157 O LEU A 71 -6.279 38.643 25.125 1.00 0.00 O ATOM 1158 CB LEU A 71 -3.748 37.141 26.857 1.00 0.00 C ATOM 1159 CG LEU A 71 -4.084 35.747 27.387 1.00 0.00 C ATOM 1160 CD1 LEU A 71 -2.828 34.879 27.482 1.00 0.00 C ATOM 1161 CD2 LEU A 71 -4.824 35.831 28.723 1.00 0.00 C ATOM 0 H LEU A 71 -2.171 37.542 24.993 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.854 36.613 25.145 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.667 37.272 26.898 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.184 37.879 27.530 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.756 35.265 26.677 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.095 33.893 27.862 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -2.380 34.778 26.494 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.113 35.347 28.159 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.051 34.825 29.077 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.197 36.341 29.455 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.752 36.387 28.590 1.00 0.00 H new ATOM 1173 N ILE A 72 -4.400 39.853 25.473 1.00 0.00 N ATOM 1174 CA ILE A 72 -5.080 41.135 25.396 1.00 0.00 C ATOM 1175 C ILE A 72 -6.132 41.085 24.287 1.00 0.00 C ATOM 1176 O ILE A 72 -5.806 41.232 23.110 1.00 0.00 O ATOM 1177 CB ILE A 72 -4.067 42.270 25.232 1.00 0.00 C ATOM 1178 CG1 ILE A 72 -3.029 42.245 26.356 1.00 0.00 C ATOM 1179 CG2 ILE A 72 -4.771 43.624 25.131 1.00 0.00 C ATOM 1180 CD1 ILE A 72 -2.324 43.597 26.481 1.00 0.00 C ATOM 0 H ILE A 72 -3.396 39.912 25.642 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.608 41.342 26.327 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.531 42.116 24.295 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.515 41.996 27.299 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.294 41.464 26.160 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -4.028 44.413 25.015 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.438 43.624 24.269 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.350 43.801 26.037 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.591 43.552 27.287 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.819 43.832 25.544 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.059 44.371 26.701 1.00 0.00 H new ATOM 1192 N PRO A 73 -7.406 40.871 24.712 1.00 0.00 N ATOM 1193 CA PRO A 73 -8.508 40.800 23.769 1.00 0.00 C ATOM 1194 C PRO A 73 -8.877 42.192 23.251 1.00 0.00 C ATOM 1195 O PRO A 73 -9.775 42.839 23.787 1.00 0.00 O ATOM 1196 CB PRO A 73 -9.639 40.132 24.534 1.00 0.00 C ATOM 1197 CG PRO A 73 -9.288 40.275 26.006 1.00 0.00 C ATOM 1198 CD PRO A 73 -7.830 40.693 26.099 1.00 0.00 C ATOM 0 HA PRO A 73 -8.259 40.230 22.874 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -10.595 40.607 24.312 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -9.733 39.082 24.255 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -9.929 41.018 26.481 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -9.449 39.333 26.530 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.718 41.615 26.669 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -7.232 39.933 26.602 1.00 0.00 H new ATOM 1206 N LYS A 74 -8.167 42.610 22.213 1.00 0.00 N ATOM 1207 CA LYS A 74 -8.408 43.912 21.618 1.00 0.00 C ATOM 1208 C LYS A 74 -7.780 44.996 22.497 1.00 0.00 C ATOM 1209 O LYS A 74 -7.698 44.841 23.715 1.00 0.00 O ATOM 1210 CB LYS A 74 -9.903 44.117 21.364 1.00 0.00 C ATOM 1211 CG LYS A 74 -10.512 45.061 22.403 1.00 0.00 C ATOM 1212 CD LYS A 74 -10.453 46.513 21.925 1.00 0.00 C ATOM 1213 CE LYS A 74 -11.629 46.835 21.001 1.00 0.00 C ATOM 1214 NZ LYS A 74 -11.155 47.520 19.779 1.00 0.00 N ATOM 0 H LYS A 74 -7.425 42.069 21.769 1.00 0.00 H new ATOM 0 HA LYS A 74 -7.930 43.977 20.641 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.053 44.525 20.365 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.416 43.156 21.396 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.547 44.779 22.593 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.976 44.963 23.347 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.467 47.183 22.784 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.514 46.689 21.399 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.149 45.916 20.731 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.347 47.467 21.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.966 47.731 19.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.679 48.407 20.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.487 46.904 19.273 1.00 0.00 H new ATOM 1227 N GLY A 75 -7.352 46.068 21.845 1.00 0.00 N ATOM 1228 CA GLY A 75 -6.734 47.176 22.553 1.00 0.00 C ATOM 1229 C GLY A 75 -7.411 47.408 23.906 1.00 0.00 C ATOM 1230 O GLY A 75 -8.608 47.684 23.967 1.00 0.00 O ATOM 0 H GLY A 75 -7.421 46.192 20.835 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -5.674 46.970 22.703 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -6.801 48.081 21.949 1.00 0.00 H new ATOM 1234 N TYR A 76 -6.615 47.290 24.958 1.00 0.00 N ATOM 1235 CA TYR A 76 -7.121 47.483 26.306 1.00 0.00 C ATOM 1236 C TYR A 76 -6.931 48.931 26.761 1.00 0.00 C ATOM 1237 O TYR A 76 -6.362 49.745 26.033 1.00 0.00 O ATOM 1238 CB TYR A 76 -6.290 46.565 27.205 1.00 0.00 C ATOM 1239 CG TYR A 76 -7.113 45.524 27.964 1.00 0.00 C ATOM 1240 CD1 TYR A 76 -8.140 44.858 27.326 1.00 0.00 C ATOM 1241 CD2 TYR A 76 -6.831 45.251 29.287 1.00 0.00 C ATOM 1242 CE1 TYR A 76 -8.916 43.878 28.040 1.00 0.00 C ATOM 1243 CE2 TYR A 76 -7.608 44.271 30.001 1.00 0.00 C ATOM 1244 CZ TYR A 76 -8.612 43.633 29.343 1.00 0.00 C ATOM 1245 OH TYR A 76 -9.344 42.707 30.018 1.00 0.00 O ATOM 0 H TYR A 76 -5.622 47.063 24.904 1.00 0.00 H new ATOM 0 HA TYR A 76 -8.187 47.259 26.351 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.548 46.051 26.594 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.744 47.176 27.924 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -8.361 45.072 26.291 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.028 45.772 29.787 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.721 43.349 27.552 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -7.398 44.048 31.037 1.00 0.00 H new ATOM 0 HH TYR A 76 -9.014 42.636 30.938 1.00 0.00 H new ATOM 1255 N PRO A 77 -7.430 49.218 27.992 1.00 0.00 N ATOM 1256 CA PRO A 77 -7.321 50.553 28.553 1.00 0.00 C ATOM 1257 C PRO A 77 -5.893 50.835 29.027 1.00 0.00 C ATOM 1258 O PRO A 77 -4.998 50.013 28.834 1.00 0.00 O ATOM 1259 CB PRO A 77 -8.340 50.593 29.680 1.00 0.00 C ATOM 1260 CG PRO A 77 -8.650 49.142 30.012 1.00 0.00 C ATOM 1261 CD PRO A 77 -8.108 48.279 28.883 1.00 0.00 C ATOM 0 HA PRO A 77 -7.527 51.334 27.821 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -7.941 51.116 30.549 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -9.241 51.125 29.374 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -8.192 48.861 30.961 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -9.725 48.997 30.121 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -7.420 47.522 29.259 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.911 47.752 28.367 1.00 0.00 H new ATOM 1269 N GLY A 78 -5.726 51.997 29.639 1.00 0.00 N ATOM 1270 CA GLY A 78 -4.422 52.396 30.143 1.00 0.00 C ATOM 1271 C GLY A 78 -3.329 52.128 29.108 1.00 0.00 C ATOM 1272 O GLY A 78 -3.621 51.774 27.967 1.00 0.00 O ATOM 0 H GLY A 78 -6.471 52.675 29.798 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -4.435 53.456 30.397 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -4.200 51.851 31.061 1.00 0.00 H new ATOM 1276 N ARG A 79 -2.089 52.304 29.543 1.00 0.00 N ATOM 1277 CA ARG A 79 -0.950 52.086 28.669 1.00 0.00 C ATOM 1278 C ARG A 79 -0.302 50.733 28.970 1.00 0.00 C ATOM 1279 O ARG A 79 0.863 50.512 28.643 1.00 0.00 O ATOM 1280 CB ARG A 79 0.094 53.191 28.836 1.00 0.00 C ATOM 1281 CG ARG A 79 -0.170 54.345 27.866 1.00 0.00 C ATOM 1282 CD ARG A 79 1.135 54.840 27.237 1.00 0.00 C ATOM 1283 NE ARG A 79 0.899 56.115 26.523 1.00 0.00 N ATOM 1284 CZ ARG A 79 1.831 56.750 25.781 1.00 0.00 C ATOM 1285 NH1 ARG A 79 3.072 56.234 25.650 1.00 0.00 N ATOM 1286 NH2 ARG A 79 1.511 57.885 25.185 1.00 0.00 N ATOM 0 H ARG A 79 -1.849 52.595 30.491 1.00 0.00 H new ATOM 0 HA ARG A 79 -1.314 52.099 27.642 1.00 0.00 H new ATOM 0 HB2 ARG A 79 0.076 53.561 29.861 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.090 52.785 28.661 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -0.854 54.018 27.083 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -0.658 55.165 28.394 1.00 0.00 H new ATOM 0 HD2 ARG A 79 1.891 54.981 28.010 1.00 0.00 H new ATOM 0 HD3 ARG A 79 1.522 54.092 26.545 1.00 0.00 H new ATOM 0 HE ARG A 79 -0.025 56.540 26.596 1.00 0.00 H new ATOM 0 HH11 ARG A 79 3.311 55.358 26.114 1.00 0.00 H new ATOM 0 HH12 ARG A 79 3.770 56.721 25.087 1.00 0.00 H new ATOM 0 HH21 ARG A 79 0.572 58.269 25.289 1.00 0.00 H new ATOM 0 HH22 ARG A 79 2.203 58.378 24.621 1.00 0.00 H new ATOM 1299 N VAL A 80 -1.086 49.861 29.589 1.00 0.00 N ATOM 1300 CA VAL A 80 -0.604 48.536 29.937 1.00 0.00 C ATOM 1301 C VAL A 80 -0.155 47.811 28.667 1.00 0.00 C ATOM 1302 O VAL A 80 0.896 47.172 28.651 1.00 0.00 O ATOM 1303 CB VAL A 80 -1.680 47.774 30.712 1.00 0.00 C ATOM 1304 CG1 VAL A 80 -2.017 46.450 30.025 1.00 0.00 C ATOM 1305 CG2 VAL A 80 -1.252 47.545 32.164 1.00 0.00 C ATOM 0 H VAL A 80 -2.052 50.047 29.858 1.00 0.00 H new ATOM 0 HA VAL A 80 0.262 48.606 30.595 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.582 48.386 30.721 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -2.785 45.928 30.597 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.385 46.646 29.018 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.122 45.830 29.970 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.035 47.001 32.693 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.330 46.964 32.184 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.086 48.506 32.650 1.00 0.00 H new ATOM 1315 N VAL A 81 -0.975 47.934 27.634 1.00 0.00 N ATOM 1316 CA VAL A 81 -0.676 47.298 26.362 1.00 0.00 C ATOM 1317 C VAL A 81 0.513 48.006 25.709 1.00 0.00 C ATOM 1318 O VAL A 81 1.366 47.362 25.101 1.00 0.00 O ATOM 1319 CB VAL A 81 -1.924 47.286 25.477 1.00 0.00 C ATOM 1320 CG1 VAL A 81 -1.724 46.381 24.259 1.00 0.00 C ATOM 1321 CG2 VAL A 81 -3.158 46.865 26.276 1.00 0.00 C ATOM 0 H VAL A 81 -1.846 48.464 27.652 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.391 46.257 26.514 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.089 48.301 25.116 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.626 46.390 23.647 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.882 46.744 23.670 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.522 45.363 24.592 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.031 46.865 25.624 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.006 45.864 26.679 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -3.317 47.566 27.095 1.00 0.00 H new ATOM 1331 N GLU A 82 0.530 49.323 25.857 1.00 0.00 N ATOM 1332 CA GLU A 82 1.600 50.126 25.290 1.00 0.00 C ATOM 1333 C GLU A 82 2.952 49.679 25.849 1.00 0.00 C ATOM 1334 O GLU A 82 3.987 49.875 25.213 1.00 0.00 O ATOM 1335 CB GLU A 82 1.364 51.615 25.548 1.00 0.00 C ATOM 1336 CG GLU A 82 0.194 52.138 24.711 1.00 0.00 C ATOM 1337 CD GLU A 82 0.585 52.258 23.237 1.00 0.00 C ATOM 1338 OE1 GLU A 82 1.109 53.301 22.819 1.00 0.00 O ATOM 1339 OE2 GLU A 82 0.328 51.220 22.518 1.00 0.00 O ATOM 0 H GLU A 82 -0.180 49.854 26.361 1.00 0.00 H new ATOM 0 HA GLU A 82 1.608 49.976 24.210 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.159 51.776 26.606 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.267 52.177 25.309 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.658 51.466 24.811 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.121 53.111 25.088 1.00 0.00 H new ATOM 1347 N ILE A 83 2.901 49.089 27.034 1.00 0.00 N ATOM 1348 CA ILE A 83 4.109 48.614 27.687 1.00 0.00 C ATOM 1349 C ILE A 83 4.416 47.193 27.209 1.00 0.00 C ATOM 1350 O ILE A 83 5.238 46.498 27.806 1.00 0.00 O ATOM 1351 CB ILE A 83 3.982 48.738 29.207 1.00 0.00 C ATOM 1352 CG1 ILE A 83 3.532 50.145 29.607 1.00 0.00 C ATOM 1353 CG2 ILE A 83 5.283 48.332 29.901 1.00 0.00 C ATOM 1354 CD1 ILE A 83 2.586 50.097 30.809 1.00 0.00 C ATOM 0 H ILE A 83 2.041 48.929 27.559 1.00 0.00 H new ATOM 0 HA ILE A 83 4.961 49.235 27.411 1.00 0.00 H new ATOM 0 HB ILE A 83 3.210 48.046 29.543 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.403 50.754 29.849 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.032 50.624 28.765 1.00 0.00 H new ATOM 0 HG21 ILE A 83 5.165 48.429 30.980 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.520 47.297 29.654 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.092 48.980 29.564 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.281 51.110 31.073 1.00 0.00 H new ATOM 0 HD12 ILE A 83 1.705 49.507 30.555 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.097 49.640 31.656 1.00 0.00 H new ATOM 1366 N ILE A 84 3.741 46.804 26.139 1.00 0.00 N ATOM 1367 CA ILE A 84 3.932 45.479 25.574 1.00 0.00 C ATOM 1368 C ILE A 84 4.418 45.610 24.130 1.00 0.00 C ATOM 1369 O ILE A 84 5.391 44.967 23.738 1.00 0.00 O ATOM 1370 CB ILE A 84 2.657 44.645 25.721 1.00 0.00 C ATOM 1371 CG1 ILE A 84 1.892 45.030 26.989 1.00 0.00 C ATOM 1372 CG2 ILE A 84 2.971 43.149 25.673 1.00 0.00 C ATOM 1373 CD1 ILE A 84 0.784 44.020 27.289 1.00 0.00 C ATOM 0 H ILE A 84 3.060 47.383 25.647 1.00 0.00 H new ATOM 0 HA ILE A 84 4.704 44.939 26.122 1.00 0.00 H new ATOM 0 HB ILE A 84 2.007 44.864 24.874 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.581 45.081 27.832 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.460 46.024 26.870 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.048 42.580 25.780 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.439 42.906 24.719 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.651 42.894 26.486 1.00 0.00 H new ATOM 0 HD11 ILE A 84 0.256 44.317 28.195 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.084 43.990 26.454 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.221 43.032 27.432 1.00 0.00 H new ATOM 1385 N ASN A 85 3.718 46.446 23.376 1.00 0.00 N ATOM 1386 CA ASN A 85 4.066 46.669 21.984 1.00 0.00 C ATOM 1387 C ASN A 85 5.539 47.072 21.889 1.00 0.00 C ATOM 1388 O ASN A 85 6.153 46.949 20.830 1.00 0.00 O ATOM 1389 CB ASN A 85 3.227 47.797 21.380 1.00 0.00 C ATOM 1390 CG ASN A 85 3.735 49.164 21.840 1.00 0.00 C ATOM 1391 OD1 ASN A 85 4.914 49.470 21.781 1.00 0.00 O ATOM 1392 ND2 ASN A 85 2.781 49.968 22.301 1.00 0.00 N ATOM 0 H ASN A 85 2.911 46.977 23.704 1.00 0.00 H new ATOM 0 HA ASN A 85 3.876 45.746 21.437 1.00 0.00 H new ATOM 0 HB2 ASN A 85 3.262 47.739 20.292 1.00 0.00 H new ATOM 0 HB3 ASN A 85 2.184 47.676 21.672 1.00 0.00 H new ATOM 0 HD21 ASN A 85 3.018 50.903 22.632 1.00 0.00 H new ATOM 0 HD22 ASN A 85 1.812 49.650 22.323 1.00 0.00 H new ATOM 1399 N ILE A 86 6.062 47.546 23.010 1.00 0.00 N ATOM 1400 CA ILE A 86 7.452 47.968 23.067 1.00 0.00 C ATOM 1401 C ILE A 86 8.354 46.734 23.124 1.00 0.00 C ATOM 1402 O ILE A 86 9.457 46.741 22.581 1.00 0.00 O ATOM 1403 CB ILE A 86 7.669 48.943 24.226 1.00 0.00 C ATOM 1404 CG1 ILE A 86 6.876 50.234 24.012 1.00 0.00 C ATOM 1405 CG2 ILE A 86 9.159 49.214 24.444 1.00 0.00 C ATOM 1406 CD1 ILE A 86 6.791 51.046 25.306 1.00 0.00 C ATOM 0 H ILE A 86 5.549 47.647 23.886 1.00 0.00 H new ATOM 0 HA ILE A 86 7.720 48.517 22.165 1.00 0.00 H new ATOM 0 HB ILE A 86 7.290 48.480 25.137 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.351 50.832 23.234 1.00 0.00 H new ATOM 0 HG13 ILE A 86 5.872 49.994 23.662 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.285 49.910 25.273 1.00 0.00 H new ATOM 0 HG22 ILE A 86 9.669 48.279 24.675 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.586 49.647 23.539 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.222 51.958 25.126 1.00 0.00 H new ATOM 0 HD12 ILE A 86 6.294 50.454 26.075 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.796 51.305 25.640 1.00 0.00 H new ATOM 1418 N LEU A 87 7.851 45.703 23.788 1.00 0.00 N ATOM 1419 CA LEU A 87 8.597 44.464 23.924 1.00 0.00 C ATOM 1420 C LEU A 87 8.602 43.726 22.583 1.00 0.00 C ATOM 1421 O LEU A 87 9.634 43.211 22.158 1.00 0.00 O ATOM 1422 CB LEU A 87 8.046 43.631 25.083 1.00 0.00 C ATOM 1423 CG LEU A 87 7.757 44.391 26.379 1.00 0.00 C ATOM 1424 CD1 LEU A 87 7.070 43.487 27.403 1.00 0.00 C ATOM 1425 CD2 LEU A 87 9.033 45.025 26.938 1.00 0.00 C ATOM 0 H LEU A 87 6.935 45.701 24.238 1.00 0.00 H new ATOM 0 HA LEU A 87 9.637 44.671 24.177 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.124 43.152 24.753 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.758 42.836 25.303 1.00 0.00 H new ATOM 0 HG LEU A 87 7.066 45.203 26.153 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.876 44.052 28.315 1.00 0.00 H new ATOM 0 HD12 LEU A 87 6.127 43.124 26.993 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.716 42.640 27.632 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.800 45.559 27.859 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.766 44.245 27.146 1.00 0.00 H new ATOM 0 HD23 LEU A 87 9.443 45.723 26.208 1.00 0.00 H new ATOM 1437 N VAL A 88 7.435 43.700 21.955 1.00 0.00 N ATOM 1438 CA VAL A 88 7.293 43.035 20.671 1.00 0.00 C ATOM 1439 C VAL A 88 8.179 43.733 19.638 1.00 0.00 C ATOM 1440 O VAL A 88 8.937 43.080 18.923 1.00 0.00 O ATOM 1441 CB VAL A 88 5.818 42.994 20.265 1.00 0.00 C ATOM 1442 CG1 VAL A 88 5.670 42.770 18.758 1.00 0.00 C ATOM 1443 CG2 VAL A 88 5.060 41.926 21.056 1.00 0.00 C ATOM 0 H VAL A 88 6.580 44.128 22.311 1.00 0.00 H new ATOM 0 HA VAL A 88 7.628 42.000 20.737 1.00 0.00 H new ATOM 0 HB VAL A 88 5.378 43.962 20.504 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.612 42.745 18.496 1.00 0.00 H new ATOM 0 HG12 VAL A 88 6.158 43.583 18.220 1.00 0.00 H new ATOM 0 HG13 VAL A 88 6.134 41.823 18.484 1.00 0.00 H new ATOM 0 HG21 VAL A 88 4.015 41.918 20.748 1.00 0.00 H new ATOM 0 HG22 VAL A 88 5.502 40.948 20.864 1.00 0.00 H new ATOM 0 HG23 VAL A 88 5.123 42.149 22.121 1.00 0.00 H new ATOM 1453 N LYS A 89 8.053 45.052 19.592 1.00 0.00 N ATOM 1454 CA LYS A 89 8.833 45.845 18.658 1.00 0.00 C ATOM 1455 C LYS A 89 10.322 45.643 18.943 1.00 0.00 C ATOM 1456 O LYS A 89 11.168 45.984 18.118 1.00 0.00 O ATOM 1457 CB LYS A 89 8.391 47.310 18.701 1.00 0.00 C ATOM 1458 CG LYS A 89 8.500 47.956 17.319 1.00 0.00 C ATOM 1459 CD LYS A 89 7.392 48.989 17.107 1.00 0.00 C ATOM 1460 CE LYS A 89 7.902 50.405 17.385 1.00 0.00 C ATOM 1461 NZ LYS A 89 6.853 51.403 17.076 1.00 0.00 N ATOM 0 H LYS A 89 7.423 45.590 20.186 1.00 0.00 H new ATOM 0 HA LYS A 89 8.657 45.512 17.635 1.00 0.00 H new ATOM 0 HB2 LYS A 89 7.362 47.373 19.056 1.00 0.00 H new ATOM 0 HB3 LYS A 89 9.008 47.859 19.413 1.00 0.00 H new ATOM 0 HG2 LYS A 89 9.473 48.435 17.213 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.438 47.187 16.549 1.00 0.00 H new ATOM 0 HD2 LYS A 89 7.022 48.926 16.084 1.00 0.00 H new ATOM 0 HD3 LYS A 89 6.551 48.766 17.764 1.00 0.00 H new ATOM 0 HE2 LYS A 89 8.199 50.492 18.430 1.00 0.00 H new ATOM 0 HE3 LYS A 89 8.789 50.603 16.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 7.215 52.358 17.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.589 51.330 16.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 6.017 51.223 17.668 1.00 0.00 H new ATOM 1474 N ASN A 90 10.598 45.091 20.115 1.00 0.00 N ATOM 1475 CA ASN A 90 11.971 44.840 20.519 1.00 0.00 C ATOM 1476 C ASN A 90 12.492 43.596 19.797 1.00 0.00 C ATOM 1477 O ASN A 90 13.532 43.644 19.142 1.00 0.00 O ATOM 1478 CB ASN A 90 12.063 44.583 22.025 1.00 0.00 C ATOM 1479 CG ASN A 90 13.462 44.912 22.552 1.00 0.00 C ATOM 1480 OD1 ASN A 90 13.825 46.060 22.750 1.00 0.00 O ATOM 1481 ND2 ASN A 90 14.223 43.844 22.768 1.00 0.00 N ATOM 0 H ASN A 90 9.894 44.810 20.798 1.00 0.00 H new ATOM 0 HA ASN A 90 12.563 45.719 20.265 1.00 0.00 H new ATOM 0 HB2 ASN A 90 11.322 45.188 22.547 1.00 0.00 H new ATOM 0 HB3 ASN A 90 11.827 43.540 22.235 1.00 0.00 H new ATOM 0 HD21 ASN A 90 15.173 43.958 23.121 1.00 0.00 H new ATOM 0 HD22 ASN A 90 13.857 42.911 22.581 1.00 0.00 H new