USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 769 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 THR OG1 : rot 101:sc= 0.908 USER MOD Set 1.2: A 123 GLN : amide:sc= -4.65! C(o=-3.7!,f=-17!) USER MOD Set 2.1: A 120 MET CE :methyl -156:sc= -2.08 (180deg=-0.314) USER MOD Set 2.2: A 125 GLN : amide:sc= -4.85! C(o=-6.9!,f=-9!) USER MOD Set 3.1: A 70 THR OG1 : rot -60:sc= 0.818 USER MOD Set 3.2: A 109 THR OG1 : rot -120:sc= -0.783! USER MOD Set 4.1: A 86 HIS : no HD1:sc= -0.32 X(o=-2.9,f=-2.5) USER MOD Set 4.2: A 88 ASN : amide:sc= -1.85 K(o=-2.9,f=-6.3!) USER MOD Set 4.3: A 108 SER OG : rot 140:sc= -0.727 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 110:sc= -1.74 USER MOD Single : A 26 SER OG : rot 40:sc= 0.142 USER MOD Single : A 34 THR OG1 : rot 132:sc= -4.13! USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0372 USER MOD Single : A 36 ASN : amide:sc= -3.72 K(o=-3.7,f=-1.9) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 57 GLN : amide:sc= -3.04! C(o=-3!,f=-3.6!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -90:sc= -2.61! USER MOD Single : A 62 MET CE :methyl -162:sc= -4.26 (180deg=-4.74!) USER MOD Single : A 65 THR OG1 : rot 83:sc= 0.0776 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 7:sc= 0.0613 USER MOD Single : A 74 LYS NZ :NH3+ -174:sc= 0.703! (180deg=0.454!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 106:sc= 1.18 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -135:sc= -4.07! (180deg=-4.77!) USER MOD Single : A 111 SER OG : rot 129:sc= 0.139 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot -67:sc= 0.0175 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 79:sc= -1.27 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.901 -13.732 -8.392 1.00 0.00 N ATOM 319 CA ASP A 21 -4.704 -14.771 -7.388 1.00 0.00 C ATOM 320 C ASP A 21 -3.763 -14.291 -6.286 1.00 0.00 C ATOM 321 O ASP A 21 -2.582 -14.051 -6.527 1.00 0.00 O ATOM 322 CB ASP A 21 -4.147 -16.039 -8.040 1.00 0.00 C ATOM 323 CG ASP A 21 -4.825 -17.296 -7.534 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.904 -17.641 -8.060 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.278 -17.935 -6.611 1.00 0.00 O ATOM 0 HA ASP A 21 -5.671 -14.998 -6.939 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.271 -15.973 -9.121 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.076 -16.104 -7.846 1.00 0.00 H new ATOM 330 N ARG A 22 -4.300 -14.152 -5.077 1.00 0.00 N ATOM 331 CA ARG A 22 -3.521 -13.694 -3.926 1.00 0.00 C ATOM 332 C ARG A 22 -2.146 -14.366 -3.861 1.00 0.00 C ATOM 333 O ARG A 22 -1.191 -13.793 -3.337 1.00 0.00 O ATOM 334 CB ARG A 22 -4.293 -13.964 -2.631 1.00 0.00 C ATOM 335 CG ARG A 22 -4.836 -12.707 -1.973 1.00 0.00 C ATOM 336 CD ARG A 22 -6.055 -12.175 -2.708 1.00 0.00 C ATOM 337 NE ARG A 22 -7.245 -12.988 -2.455 1.00 0.00 N ATOM 338 CZ ARG A 22 -7.928 -13.634 -3.400 1.00 0.00 C ATOM 339 NH1 ARG A 22 -7.550 -13.573 -4.673 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.997 -14.345 -3.071 1.00 0.00 N ATOM 0 H ARG A 22 -5.278 -14.351 -4.866 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.361 -12.622 -4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.122 -14.638 -2.846 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.638 -14.478 -1.928 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -5.100 -12.922 -0.937 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.060 -11.942 -1.952 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.245 -11.147 -2.398 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.852 -12.153 -3.779 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.573 -13.065 -1.492 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -6.729 -13.028 -4.936 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -8.081 -14.072 -5.387 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -9.295 -14.397 -2.097 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.522 -14.840 -3.792 1.00 0.00 H new ATOM 354 N GLU A 23 -2.056 -15.586 -4.384 1.00 0.00 N ATOM 355 CA GLU A 23 -0.800 -16.333 -4.369 1.00 0.00 C ATOM 356 C GLU A 23 -0.007 -16.128 -5.661 1.00 0.00 C ATOM 357 O GLU A 23 1.156 -15.725 -5.626 1.00 0.00 O ATOM 358 CB GLU A 23 -1.075 -17.824 -4.157 1.00 0.00 C ATOM 359 CG GLU A 23 -0.776 -18.301 -2.745 1.00 0.00 C ATOM 360 CD GLU A 23 -1.539 -19.558 -2.380 1.00 0.00 C ATOM 361 OE1 GLU A 23 -1.079 -20.659 -2.747 1.00 0.00 O ATOM 362 OE2 GLU A 23 -2.598 -19.442 -1.728 1.00 0.00 O ATOM 0 H GLU A 23 -2.835 -16.078 -4.822 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.199 -15.954 -3.542 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.120 -18.029 -4.387 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.475 -18.400 -4.861 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.293 -18.489 -2.648 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.026 -17.510 -2.038 1.00 0.00 H new ATOM 369 N LYS A 24 -0.638 -16.412 -6.798 1.00 0.00 N ATOM 370 CA LYS A 24 0.016 -16.264 -8.096 1.00 0.00 C ATOM 371 C LYS A 24 -0.211 -14.872 -8.682 1.00 0.00 C ATOM 372 O LYS A 24 -0.241 -14.696 -9.900 1.00 0.00 O ATOM 373 CB LYS A 24 -0.495 -17.327 -9.071 1.00 0.00 C ATOM 374 CG LYS A 24 -0.127 -18.747 -8.672 1.00 0.00 C ATOM 375 CD LYS A 24 0.491 -19.511 -9.832 1.00 0.00 C ATOM 376 CE LYS A 24 0.150 -20.991 -9.768 1.00 0.00 C ATOM 377 NZ LYS A 24 -1.049 -21.320 -10.589 1.00 0.00 N ATOM 0 H LYS A 24 -1.601 -16.746 -6.847 1.00 0.00 H new ATOM 0 HA LYS A 24 1.087 -16.397 -7.944 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.580 -17.249 -9.145 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.093 -17.122 -10.063 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.574 -18.721 -7.838 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -1.018 -19.270 -8.324 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.135 -19.095 -10.774 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.574 -19.385 -9.817 1.00 0.00 H new ATOM 0 HE2 LYS A 24 1.001 -21.575 -10.118 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.029 -21.278 -8.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -1.249 -22.338 -10.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.867 -20.782 -10.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -0.869 -21.070 -11.582 1.00 0.00 H new ATOM 391 N THR A 25 -0.375 -13.887 -7.806 1.00 0.00 N ATOM 392 CA THR A 25 -0.605 -12.509 -8.229 1.00 0.00 C ATOM 393 C THR A 25 0.661 -11.877 -8.799 1.00 0.00 C ATOM 394 O THR A 25 1.768 -12.371 -8.587 1.00 0.00 O ATOM 395 CB THR A 25 -1.095 -11.675 -7.047 1.00 0.00 C ATOM 396 OG1 THR A 25 -1.126 -10.300 -7.386 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.228 -11.824 -5.815 1.00 0.00 C ATOM 0 H THR A 25 -0.353 -14.017 -6.795 1.00 0.00 H new ATOM 0 HA THR A 25 -1.362 -12.528 -9.013 1.00 0.00 H new ATOM 0 HB THR A 25 -2.093 -12.049 -6.819 1.00 0.00 H new ATOM 0 HG1 THR A 25 -2.057 -10.001 -7.454 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.629 -11.207 -5.011 1.00 0.00 H new ATOM 0 HG22 THR A 25 -0.218 -12.868 -5.501 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.789 -11.505 -6.045 1.00 0.00 H new ATOM 405 N SER A 26 0.482 -10.769 -9.514 1.00 0.00 N ATOM 406 CA SER A 26 1.602 -10.045 -10.106 1.00 0.00 C ATOM 407 C SER A 26 1.866 -8.753 -9.331 1.00 0.00 C ATOM 408 O SER A 26 0.975 -7.915 -9.193 1.00 0.00 O ATOM 409 CB SER A 26 1.310 -9.726 -11.573 1.00 0.00 C ATOM 410 OG SER A 26 0.035 -9.127 -11.721 1.00 0.00 O ATOM 0 H SER A 26 -0.431 -10.353 -9.697 1.00 0.00 H new ATOM 0 HA SER A 26 2.490 -10.675 -10.053 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.077 -9.057 -11.962 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.356 -10.641 -12.163 1.00 0.00 H new ATOM 0 HG SER A 26 -0.119 -8.499 -10.985 1.00 0.00 H new ATOM 416 N PRO A 27 3.092 -8.574 -8.805 1.00 0.00 N ATOM 417 CA PRO A 27 3.450 -7.376 -8.035 1.00 0.00 C ATOM 418 C PRO A 27 3.571 -6.128 -8.904 1.00 0.00 C ATOM 419 O PRO A 27 3.864 -6.212 -10.097 1.00 0.00 O ATOM 420 CB PRO A 27 4.805 -7.737 -7.428 1.00 0.00 C ATOM 421 CG PRO A 27 5.384 -8.740 -8.367 1.00 0.00 C ATOM 422 CD PRO A 27 4.219 -9.522 -8.907 1.00 0.00 C ATOM 0 HA PRO A 27 2.686 -7.128 -7.298 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.446 -6.860 -7.340 1.00 0.00 H new ATOM 0 HB3 PRO A 27 4.693 -8.151 -6.426 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.932 -8.250 -9.172 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.089 -9.394 -7.854 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.388 -9.835 -9.937 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.038 -10.426 -8.325 1.00 0.00 H new ATOM 430 N LEU A 28 3.348 -4.969 -8.289 1.00 0.00 N ATOM 431 CA LEU A 28 3.437 -3.693 -8.991 1.00 0.00 C ATOM 432 C LEU A 28 4.146 -2.656 -8.124 1.00 0.00 C ATOM 433 O LEU A 28 4.190 -2.783 -6.900 1.00 0.00 O ATOM 434 CB LEU A 28 2.040 -3.193 -9.371 1.00 0.00 C ATOM 435 CG LEU A 28 1.145 -2.802 -8.191 1.00 0.00 C ATOM 436 CD1 LEU A 28 0.905 -1.299 -8.169 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.176 -3.556 -8.250 1.00 0.00 C ATOM 0 H LEU A 28 3.103 -4.888 -7.302 1.00 0.00 H new ATOM 0 HA LEU A 28 4.016 -3.842 -9.903 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.147 -2.329 -10.028 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.537 -3.970 -9.946 1.00 0.00 H new ATOM 0 HG LEU A 28 1.657 -3.077 -7.269 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.267 -1.045 -7.323 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.859 -0.780 -8.073 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.417 -0.995 -9.095 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.799 -3.266 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.691 -3.315 -9.180 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.015 -4.628 -8.209 1.00 0.00 H new ATOM 449 N LEU A 29 4.709 -1.637 -8.765 1.00 0.00 N ATOM 450 CA LEU A 29 5.425 -0.587 -8.048 1.00 0.00 C ATOM 451 C LEU A 29 4.517 0.600 -7.740 1.00 0.00 C ATOM 452 O LEU A 29 3.930 1.198 -8.643 1.00 0.00 O ATOM 453 CB LEU A 29 6.636 -0.124 -8.865 1.00 0.00 C ATOM 454 CG LEU A 29 7.346 1.126 -8.334 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.637 0.988 -6.848 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.630 1.378 -9.111 1.00 0.00 C ATOM 0 H LEU A 29 4.684 -1.516 -9.777 1.00 0.00 H new ATOM 0 HA LEU A 29 5.766 -1.003 -7.100 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.357 -0.940 -8.909 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.311 0.070 -9.887 1.00 0.00 H new ATOM 0 HG LEU A 29 6.685 1.982 -8.473 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.141 1.886 -6.491 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.701 0.857 -6.305 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.277 0.122 -6.682 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.122 2.269 -8.721 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.294 0.521 -9.004 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.395 1.525 -10.165 1.00 0.00 H new ATOM 468 N LEU A 30 4.414 0.943 -6.459 1.00 0.00 N ATOM 469 CA LEU A 30 3.587 2.065 -6.031 1.00 0.00 C ATOM 470 C LEU A 30 4.349 2.962 -5.053 1.00 0.00 C ATOM 471 O LEU A 30 5.322 2.530 -4.428 1.00 0.00 O ATOM 472 CB LEU A 30 2.284 1.556 -5.400 1.00 0.00 C ATOM 473 CG LEU A 30 2.359 1.220 -3.909 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.193 2.479 -3.077 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.303 0.192 -3.539 1.00 0.00 C ATOM 0 H LEU A 30 4.893 0.459 -5.700 1.00 0.00 H new ATOM 0 HA LEU A 30 3.337 2.662 -6.908 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.512 2.311 -5.546 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.964 0.665 -5.939 1.00 0.00 H new ATOM 0 HG LEU A 30 3.339 0.792 -3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.248 2.225 -2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.986 3.185 -3.323 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.225 2.932 -3.291 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.372 -0.034 -2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.313 0.591 -3.762 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.465 -0.719 -4.115 1.00 0.00 H new ATOM 487 N ARG A 31 3.905 4.213 -4.932 1.00 0.00 N ATOM 488 CA ARG A 31 4.545 5.182 -4.042 1.00 0.00 C ATOM 489 C ARG A 31 3.902 5.181 -2.655 1.00 0.00 C ATOM 490 O ARG A 31 2.676 5.124 -2.525 1.00 0.00 O ATOM 491 CB ARG A 31 4.467 6.586 -4.646 1.00 0.00 C ATOM 492 CG ARG A 31 5.594 6.895 -5.617 1.00 0.00 C ATOM 493 CD ARG A 31 5.147 7.858 -6.705 1.00 0.00 C ATOM 494 NE ARG A 31 6.279 8.524 -7.347 1.00 0.00 N ATOM 495 CZ ARG A 31 6.895 9.592 -6.846 1.00 0.00 C ATOM 496 NH1 ARG A 31 6.495 10.119 -5.694 1.00 0.00 N ATOM 497 NH2 ARG A 31 7.915 10.134 -7.495 1.00 0.00 N ATOM 0 H ARG A 31 3.101 4.580 -5.441 1.00 0.00 H new ATOM 0 HA ARG A 31 5.589 4.890 -3.932 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.513 6.698 -5.162 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.481 7.320 -3.840 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.436 7.324 -5.074 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.947 5.970 -6.072 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.573 7.315 -7.456 1.00 0.00 H new ATOM 0 HD3 ARG A 31 4.482 8.607 -6.275 1.00 0.00 H new ATOM 0 HE ARG A 31 6.617 8.147 -8.233 1.00 0.00 H new ATOM 0 HH11 ARG A 31 5.712 9.705 -5.188 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.971 10.938 -5.315 1.00 0.00 H new ATOM 0 HH21 ARG A 31 8.228 9.733 -8.379 1.00 0.00 H new ATOM 0 HH22 ARG A 31 8.387 10.953 -7.111 1.00 0.00 H new ATOM 511 N VAL A 32 4.741 5.248 -1.623 1.00 0.00 N ATOM 512 CA VAL A 32 4.262 5.254 -0.242 1.00 0.00 C ATOM 513 C VAL A 32 5.017 6.267 0.608 1.00 0.00 C ATOM 514 O VAL A 32 6.222 6.441 0.455 1.00 0.00 O ATOM 515 CB VAL A 32 4.406 3.870 0.416 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.191 3.009 0.126 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.683 3.182 -0.046 1.00 0.00 C ATOM 0 H VAL A 32 5.755 5.299 -1.717 1.00 0.00 H new ATOM 0 HA VAL A 32 3.208 5.528 -0.289 1.00 0.00 H new ATOM 0 HB VAL A 32 4.471 4.011 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.314 2.035 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.298 3.495 0.520 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.087 2.877 -0.951 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.764 2.206 0.432 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.657 3.055 -1.128 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.544 3.792 0.227 1.00 0.00 H new ATOM 527 N PHE A 33 4.303 6.919 1.517 1.00 0.00 N ATOM 528 CA PHE A 33 4.909 7.902 2.408 1.00 0.00 C ATOM 529 C PHE A 33 4.797 7.432 3.852 1.00 0.00 C ATOM 530 O PHE A 33 3.703 7.379 4.415 1.00 0.00 O ATOM 531 CB PHE A 33 4.233 9.260 2.231 1.00 0.00 C ATOM 532 CG PHE A 33 4.126 9.681 0.794 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.291 9.001 -0.077 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.868 10.746 0.311 1.00 0.00 C ATOM 535 CE1 PHE A 33 3.193 9.378 -1.403 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.777 11.126 -1.014 1.00 0.00 C ATOM 537 CZ PHE A 33 3.937 10.442 -1.872 1.00 0.00 C ATOM 0 H PHE A 33 3.302 6.785 1.657 1.00 0.00 H new ATOM 0 HA PHE A 33 5.964 8.008 2.157 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.235 9.222 2.668 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.794 10.014 2.783 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.709 8.166 0.284 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.525 11.285 0.977 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.536 8.841 -2.071 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.362 11.957 -1.379 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.863 10.739 -2.908 1.00 0.00 H new ATOM 547 N THR A 34 5.931 7.064 4.436 1.00 0.00 N ATOM 548 CA THR A 34 5.954 6.566 5.804 1.00 0.00 C ATOM 549 C THR A 34 6.563 7.568 6.777 1.00 0.00 C ATOM 550 O THR A 34 7.707 7.995 6.618 1.00 0.00 O ATOM 551 CB THR A 34 6.734 5.255 5.873 1.00 0.00 C ATOM 552 OG1 THR A 34 8.033 5.417 5.332 1.00 0.00 O ATOM 553 CG2 THR A 34 6.064 4.119 5.130 1.00 0.00 C ATOM 0 H THR A 34 6.845 7.101 3.984 1.00 0.00 H new ATOM 0 HA THR A 34 4.918 6.403 6.100 1.00 0.00 H new ATOM 0 HB THR A 34 6.776 4.998 6.932 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.694 5.040 5.949 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.671 3.218 5.219 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.078 3.936 5.557 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.960 4.384 4.078 1.00 0.00 H new ATOM 561 N THR A 35 5.795 7.906 7.807 1.00 0.00 N ATOM 562 CA THR A 35 6.256 8.822 8.844 1.00 0.00 C ATOM 563 C THR A 35 6.613 8.016 10.090 1.00 0.00 C ATOM 564 O THR A 35 6.125 6.901 10.259 1.00 0.00 O ATOM 565 CB THR A 35 5.186 9.875 9.165 1.00 0.00 C ATOM 566 OG1 THR A 35 5.343 10.367 10.488 1.00 0.00 O ATOM 567 CG2 THR A 35 3.764 9.365 9.020 1.00 0.00 C ATOM 0 H THR A 35 4.846 7.558 7.946 1.00 0.00 H new ATOM 0 HA THR A 35 7.138 9.354 8.488 1.00 0.00 H new ATOM 0 HB THR A 35 5.338 10.666 8.431 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.653 11.038 10.672 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.064 10.164 9.263 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.598 9.037 7.994 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.607 8.527 9.699 1.00 0.00 H new ATOM 575 N ASN A 36 7.472 8.558 10.950 1.00 0.00 N ATOM 576 CA ASN A 36 7.882 7.839 12.154 1.00 0.00 C ATOM 577 C ASN A 36 7.115 8.315 13.384 1.00 0.00 C ATOM 578 O ASN A 36 7.593 8.190 14.510 1.00 0.00 O ATOM 579 CB ASN A 36 9.385 8.008 12.380 1.00 0.00 C ATOM 580 CG ASN A 36 9.897 7.170 13.534 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.608 7.665 14.409 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.536 5.892 13.545 1.00 0.00 N ATOM 0 H ASN A 36 7.893 9.480 10.839 1.00 0.00 H new ATOM 0 HA ASN A 36 7.652 6.784 12.004 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.919 7.733 11.471 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.604 9.058 12.573 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.849 5.280 14.299 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.946 5.522 12.800 1.00 0.00 H new ATOM 589 N ASN A 37 5.921 8.852 13.168 1.00 0.00 N ATOM 590 CA ASN A 37 5.095 9.331 14.270 1.00 0.00 C ATOM 591 C ASN A 37 3.608 9.139 13.974 1.00 0.00 C ATOM 592 O ASN A 37 2.753 9.639 14.704 1.00 0.00 O ATOM 593 CB ASN A 37 5.382 10.808 14.549 1.00 0.00 C ATOM 594 CG ASN A 37 5.374 11.129 16.032 1.00 0.00 C ATOM 595 OD1 ASN A 37 6.120 10.533 16.810 1.00 0.00 O ATOM 596 ND2 ASN A 37 4.531 12.073 16.430 1.00 0.00 N ATOM 0 H ASN A 37 5.504 8.967 12.244 1.00 0.00 H new ATOM 0 HA ASN A 37 5.347 8.743 15.153 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.352 11.073 14.128 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.637 11.422 14.043 1.00 0.00 H new ATOM 0 HD21 ASN A 37 4.483 12.331 17.416 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.931 12.541 15.750 1.00 0.00 H new ATOM 603 N GLY A 38 3.303 8.417 12.895 1.00 0.00 N ATOM 604 CA GLY A 38 1.920 8.185 12.528 1.00 0.00 C ATOM 605 C GLY A 38 1.147 9.476 12.370 1.00 0.00 C ATOM 606 O GLY A 38 0.118 9.675 13.016 1.00 0.00 O ATOM 0 H GLY A 38 3.990 7.991 12.272 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.883 7.624 11.594 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.442 7.568 13.289 1.00 0.00 H new ATOM 610 N ARG A 39 1.651 10.360 11.519 1.00 0.00 N ATOM 611 CA ARG A 39 1.010 11.647 11.287 1.00 0.00 C ATOM 612 C ARG A 39 0.254 11.662 9.960 1.00 0.00 C ATOM 613 O ARG A 39 0.795 12.060 8.929 1.00 0.00 O ATOM 614 CB ARG A 39 2.064 12.756 11.304 1.00 0.00 C ATOM 615 CG ARG A 39 2.637 13.029 12.686 1.00 0.00 C ATOM 616 CD ARG A 39 2.512 14.494 13.072 1.00 0.00 C ATOM 617 NE ARG A 39 2.096 14.661 14.462 1.00 0.00 N ATOM 618 CZ ARG A 39 2.247 15.788 15.153 1.00 0.00 C ATOM 619 NH1 ARG A 39 2.806 16.852 14.587 1.00 0.00 N ATOM 620 NH2 ARG A 39 1.840 15.854 16.413 1.00 0.00 N ATOM 0 H ARG A 39 2.502 10.209 10.978 1.00 0.00 H new ATOM 0 HA ARG A 39 0.286 11.817 12.084 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.876 12.484 10.630 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.621 13.673 10.916 1.00 0.00 H new ATOM 0 HG2 ARG A 39 2.119 12.414 13.422 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.687 12.736 12.708 1.00 0.00 H new ATOM 0 HD2 ARG A 39 3.469 14.992 12.918 1.00 0.00 H new ATOM 0 HD3 ARG A 39 1.790 14.981 12.417 1.00 0.00 H new ATOM 0 HE ARG A 39 1.663 13.865 14.932 1.00 0.00 H new ATOM 0 HH11 ARG A 39 3.122 16.807 13.618 1.00 0.00 H new ATOM 0 HH12 ARG A 39 2.919 17.713 15.121 1.00 0.00 H new ATOM 0 HH21 ARG A 39 1.411 15.040 16.854 1.00 0.00 H new ATOM 0 HH22 ARG A 39 1.956 16.718 16.942 1.00 0.00 H new ATOM 864 N GLU A 55 9.209 9.304 1.056 1.00 0.00 N ATOM 865 CA GLU A 55 8.522 8.336 0.207 1.00 0.00 C ATOM 866 C GLU A 55 9.410 7.141 -0.123 1.00 0.00 C ATOM 867 O GLU A 55 10.611 7.283 -0.353 1.00 0.00 O ATOM 868 CB GLU A 55 8.051 9.006 -1.084 1.00 0.00 C ATOM 869 CG GLU A 55 9.162 9.712 -1.844 1.00 0.00 C ATOM 870 CD GLU A 55 9.028 11.222 -1.806 1.00 0.00 C ATOM 871 OE1 GLU A 55 8.046 11.745 -2.373 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.903 11.880 -1.207 1.00 0.00 O ATOM 0 HA GLU A 55 7.659 7.968 0.762 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.601 8.253 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.270 9.728 -0.845 1.00 0.00 H new ATOM 0 HG2 GLU A 55 10.125 9.426 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.157 9.377 -2.881 1.00 0.00 H new ATOM 879 N LEU A 56 8.797 5.961 -0.159 1.00 0.00 N ATOM 880 CA LEU A 56 9.507 4.725 -0.475 1.00 0.00 C ATOM 881 C LEU A 56 8.778 3.953 -1.571 1.00 0.00 C ATOM 882 O LEU A 56 7.661 4.309 -1.948 1.00 0.00 O ATOM 883 CB LEU A 56 9.654 3.834 0.768 1.00 0.00 C ATOM 884 CG LEU A 56 8.677 4.114 1.920 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.931 2.846 2.319 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.416 4.697 3.117 1.00 0.00 C ATOM 0 H LEU A 56 7.802 5.835 0.028 1.00 0.00 H new ATOM 0 HA LEU A 56 10.502 4.999 -0.827 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.534 2.795 0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.671 3.939 1.147 1.00 0.00 H new ATOM 0 HG LEU A 56 7.946 4.845 1.575 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.245 3.069 3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.367 2.471 1.465 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.646 2.089 2.642 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.708 4.889 3.923 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.171 3.989 3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.898 5.631 2.827 1.00 0.00 H new ATOM 898 N GLN A 57 9.416 2.902 -2.079 1.00 0.00 N ATOM 899 CA GLN A 57 8.827 2.084 -3.128 1.00 0.00 C ATOM 900 C GLN A 57 8.506 0.687 -2.612 1.00 0.00 C ATOM 901 O GLN A 57 9.304 0.084 -1.893 1.00 0.00 O ATOM 902 CB GLN A 57 9.785 1.995 -4.317 1.00 0.00 C ATOM 903 CG GLN A 57 10.242 3.347 -4.838 1.00 0.00 C ATOM 904 CD GLN A 57 9.302 3.920 -5.879 1.00 0.00 C ATOM 905 OE1 GLN A 57 9.547 3.813 -7.080 1.00 0.00 O ATOM 906 NE2 GLN A 57 8.216 4.533 -5.422 1.00 0.00 N ATOM 0 H GLN A 57 10.342 2.599 -1.779 1.00 0.00 H new ATOM 0 HA GLN A 57 7.896 2.552 -3.448 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.660 1.414 -4.024 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.297 1.451 -5.125 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.323 4.045 -4.004 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.238 3.248 -5.269 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.052 4.599 -4.417 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.546 4.938 -6.076 1.00 0.00 H new ATOM 915 N ILE A 58 7.336 0.173 -2.981 1.00 0.00 N ATOM 916 CA ILE A 58 6.923 -1.162 -2.553 1.00 0.00 C ATOM 917 C ILE A 58 6.342 -1.962 -3.710 1.00 0.00 C ATOM 918 O ILE A 58 5.476 -1.480 -4.439 1.00 0.00 O ATOM 919 CB ILE A 58 5.869 -1.124 -1.421 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.059 0.173 -1.453 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.535 -1.306 -0.069 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.585 -0.037 -1.194 1.00 0.00 C ATOM 0 H ILE A 58 6.660 0.657 -3.572 1.00 0.00 H new ATOM 0 HA ILE A 58 7.829 -1.640 -2.180 1.00 0.00 H new ATOM 0 HB ILE A 58 5.176 -1.950 -1.583 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.458 0.861 -0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.186 0.649 -2.425 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.779 -1.277 0.716 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.048 -2.267 -0.043 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.256 -0.505 0.092 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.069 0.922 -1.231 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.173 -0.700 -1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.449 -0.485 -0.210 1.00 0.00 H new ATOM 934 N TYR A 59 6.807 -3.196 -3.856 1.00 0.00 N ATOM 935 CA TYR A 59 6.311 -4.071 -4.904 1.00 0.00 C ATOM 936 C TYR A 59 5.173 -4.924 -4.357 1.00 0.00 C ATOM 937 O TYR A 59 5.372 -6.082 -3.987 1.00 0.00 O ATOM 938 CB TYR A 59 7.437 -4.963 -5.436 1.00 0.00 C ATOM 939 CG TYR A 59 7.793 -4.696 -6.881 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.214 -3.437 -7.292 1.00 0.00 C ATOM 941 CD2 TYR A 59 7.709 -5.704 -7.834 1.00 0.00 C ATOM 942 CE1 TYR A 59 8.540 -3.190 -8.612 1.00 0.00 C ATOM 943 CE2 TYR A 59 8.033 -5.464 -9.156 1.00 0.00 C ATOM 944 CZ TYR A 59 8.447 -4.206 -9.539 1.00 0.00 C ATOM 945 OH TYR A 59 8.772 -3.963 -10.855 1.00 0.00 O ATOM 0 H TYR A 59 7.525 -3.611 -3.262 1.00 0.00 H new ATOM 0 HA TYR A 59 5.940 -3.463 -5.729 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.325 -4.819 -4.820 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.142 -6.007 -5.331 1.00 0.00 H new ATOM 0 HD1 TYR A 59 8.288 -2.639 -6.568 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.385 -6.691 -7.537 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.866 -2.206 -8.916 1.00 0.00 H new ATOM 0 HE2 TYR A 59 7.962 -6.258 -9.885 1.00 0.00 H new ATOM 0 HH TYR A 59 8.654 -4.783 -11.378 1.00 0.00 H new ATOM 955 N THR A 60 3.980 -4.337 -4.295 1.00 0.00 N ATOM 956 CA THR A 60 2.814 -5.034 -3.778 1.00 0.00 C ATOM 957 C THR A 60 1.825 -5.344 -4.891 1.00 0.00 C ATOM 958 O THR A 60 1.934 -4.832 -6.005 1.00 0.00 O ATOM 959 CB THR A 60 2.131 -4.202 -2.691 1.00 0.00 C ATOM 960 OG1 THR A 60 1.135 -4.962 -2.032 1.00 0.00 O ATOM 961 CG2 THR A 60 1.473 -2.944 -3.219 1.00 0.00 C ATOM 0 H THR A 60 3.799 -3.380 -4.598 1.00 0.00 H new ATOM 0 HA THR A 60 3.152 -5.975 -3.345 1.00 0.00 H new ATOM 0 HB THR A 60 2.929 -3.913 -2.006 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.278 -4.848 -2.493 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.009 -2.403 -2.395 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.224 -2.311 -3.691 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.712 -3.212 -3.952 1.00 0.00 H new ATOM 969 N TRP A 61 0.853 -6.189 -4.588 1.00 0.00 N ATOM 970 CA TRP A 61 -0.157 -6.563 -5.580 1.00 0.00 C ATOM 971 C TRP A 61 -1.555 -6.112 -5.174 1.00 0.00 C ATOM 972 O TRP A 61 -2.038 -6.422 -4.091 1.00 0.00 O ATOM 973 CB TRP A 61 -0.150 -8.068 -5.840 1.00 0.00 C ATOM 974 CG TRP A 61 -0.191 -8.906 -4.603 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.257 -9.611 -4.125 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.888 -9.138 -3.692 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.905 -10.277 -2.977 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.406 -9.999 -2.687 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.215 -8.703 -3.627 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.205 -10.433 -1.635 1.00 0.00 C ATOM 981 CZ3 TRP A 61 3.006 -9.135 -2.580 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.500 -9.992 -1.597 1.00 0.00 C ATOM 0 H TRP A 61 0.737 -6.628 -3.675 1.00 0.00 H new ATOM 0 HA TRP A 61 0.109 -6.046 -6.502 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.007 -8.321 -6.465 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.745 -8.323 -6.408 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.235 -9.641 -4.583 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.519 -10.880 -2.429 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.614 -8.041 -4.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.817 -11.095 -0.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 4.033 -8.805 -2.519 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.144 -10.312 -0.792 1.00 0.00 H new ATOM 993 N MET A 62 -2.189 -5.366 -6.077 1.00 0.00 N ATOM 994 CA MET A 62 -3.539 -4.828 -5.872 1.00 0.00 C ATOM 995 C MET A 62 -4.411 -5.742 -5.003 1.00 0.00 C ATOM 996 O MET A 62 -5.224 -5.263 -4.211 1.00 0.00 O ATOM 997 CB MET A 62 -4.220 -4.607 -7.228 1.00 0.00 C ATOM 998 CG MET A 62 -4.914 -3.261 -7.351 1.00 0.00 C ATOM 999 SD MET A 62 -3.813 -1.967 -7.957 1.00 0.00 S ATOM 1000 CE MET A 62 -3.092 -1.395 -6.423 1.00 0.00 C ATOM 0 H MET A 62 -1.781 -5.115 -6.977 1.00 0.00 H new ATOM 0 HA MET A 62 -3.431 -3.881 -5.343 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.474 -4.695 -8.018 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.951 -5.399 -7.391 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.765 -3.355 -8.026 1.00 0.00 H new ATOM 0 HG3 MET A 62 -5.310 -2.970 -6.378 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.647 -0.412 -6.575 1.00 0.00 H new ATOM 0 HE2 MET A 62 -3.867 -1.329 -5.659 1.00 0.00 H new ATOM 0 HE3 MET A 62 -2.322 -2.096 -6.099 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.245 -7.053 -5.158 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.025 -8.025 -4.389 1.00 0.00 C ATOM 1012 C ASP A 63 -4.273 -8.493 -3.141 1.00 0.00 C ATOM 1013 O ASP A 63 -4.444 -9.626 -2.693 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.378 -9.229 -5.267 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.873 -9.387 -5.461 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -7.522 -10.012 -4.596 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.396 -8.882 -6.477 1.00 0.00 O ATOM 0 H ASP A 63 -3.578 -7.469 -5.808 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.940 -7.531 -4.063 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.898 -9.119 -6.240 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.976 -10.135 -4.814 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.433 -7.622 -2.590 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.651 -7.956 -1.403 1.00 0.00 C ATOM 1024 C ALA A 64 -3.358 -7.529 -0.123 1.00 0.00 C ATOM 1025 O ALA A 64 -3.951 -6.452 -0.062 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.277 -7.302 -1.473 1.00 0.00 C ATOM 0 H ALA A 64 -3.276 -6.679 -2.946 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.538 -9.040 -1.381 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.705 -7.560 -0.581 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.749 -7.658 -2.358 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.392 -6.220 -1.530 1.00 0.00 H new ATOM 1032 N THR A 65 -3.273 -8.367 0.907 1.00 0.00 N ATOM 1033 CA THR A 65 -3.887 -8.053 2.191 1.00 0.00 C ATOM 1034 C THR A 65 -3.009 -7.060 2.947 1.00 0.00 C ATOM 1035 O THR A 65 -1.786 -7.076 2.802 1.00 0.00 O ATOM 1036 CB THR A 65 -4.096 -9.323 3.020 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.350 -10.403 2.488 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.545 -9.754 3.087 1.00 0.00 C ATOM 0 H THR A 65 -2.787 -9.263 0.877 1.00 0.00 H new ATOM 0 HA THR A 65 -4.865 -7.605 2.014 1.00 0.00 H new ATOM 0 HB THR A 65 -3.757 -9.072 4.025 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.426 -10.353 2.811 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.628 -10.659 3.688 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.140 -8.961 3.541 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.913 -9.952 2.080 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.632 -6.195 3.747 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.892 -5.190 4.513 1.00 0.00 C ATOM 1048 C LEU A 66 -1.635 -5.784 5.141 1.00 0.00 C ATOM 1049 O LEU A 66 -0.632 -5.093 5.316 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.784 -4.579 5.599 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.772 -3.503 5.125 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -5.199 -2.632 6.295 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -4.167 -2.645 4.022 1.00 0.00 C ATOM 0 H LEU A 66 -4.643 -6.169 3.882 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.587 -4.405 3.821 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.350 -5.382 6.072 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.144 -4.145 6.367 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.648 -4.006 4.716 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.899 -1.873 5.947 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.681 -3.250 7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.323 -2.147 6.726 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.891 -1.893 3.708 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.270 -2.152 4.396 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.907 -3.276 3.172 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.691 -7.070 5.470 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.548 -7.744 6.069 1.00 0.00 C ATOM 1067 C LYS A 67 0.655 -7.694 5.132 1.00 0.00 C ATOM 1068 O LYS A 67 1.743 -7.259 5.518 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.896 -9.198 6.400 1.00 0.00 C ATOM 1070 CG LYS A 67 0.069 -9.844 7.380 1.00 0.00 C ATOM 1071 CD LYS A 67 0.281 -11.315 7.066 1.00 0.00 C ATOM 1072 CE LYS A 67 -0.711 -12.193 7.812 1.00 0.00 C ATOM 1073 NZ LYS A 67 -1.935 -12.460 7.005 1.00 0.00 N ATOM 0 H LYS A 67 -2.510 -7.662 5.333 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.292 -7.226 6.993 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -1.903 -9.237 6.815 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -0.909 -9.779 5.478 1.00 0.00 H new ATOM 0 HG2 LYS A 67 1.026 -9.323 7.347 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.317 -9.739 8.394 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.177 -11.478 5.993 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.297 -11.603 7.335 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.235 -13.138 8.072 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.992 -11.709 8.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.585 -13.062 7.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -2.404 -11.560 6.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.671 -12.945 6.124 1.00 0.00 H new ATOM 1087 N GLU A 68 0.452 -8.132 3.897 1.00 0.00 N ATOM 1088 CA GLU A 68 1.518 -8.128 2.904 1.00 0.00 C ATOM 1089 C GLU A 68 2.123 -6.736 2.770 1.00 0.00 C ATOM 1090 O GLU A 68 3.314 -6.588 2.497 1.00 0.00 O ATOM 1091 CB GLU A 68 0.982 -8.606 1.556 1.00 0.00 C ATOM 1092 CG GLU A 68 0.782 -10.112 1.498 1.00 0.00 C ATOM 1093 CD GLU A 68 -0.605 -10.501 1.026 1.00 0.00 C ATOM 1094 OE1 GLU A 68 -1.071 -9.927 0.020 1.00 0.00 O ATOM 1095 OE2 GLU A 68 -1.223 -11.381 1.661 1.00 0.00 O ATOM 0 H GLU A 68 -0.440 -8.494 3.559 1.00 0.00 H new ATOM 0 HA GLU A 68 2.301 -8.811 3.234 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.033 -8.111 1.352 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.674 -8.306 0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.524 -10.547 0.829 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.957 -10.536 2.487 1.00 0.00 H new ATOM 1102 N LEU A 69 1.296 -5.718 2.981 1.00 0.00 N ATOM 1103 CA LEU A 69 1.756 -4.336 2.899 1.00 0.00 C ATOM 1104 C LEU A 69 2.579 -3.973 4.133 1.00 0.00 C ATOM 1105 O LEU A 69 3.417 -3.071 4.092 1.00 0.00 O ATOM 1106 CB LEU A 69 0.570 -3.380 2.749 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.252 -3.566 1.471 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.652 -3.584 0.249 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.069 -4.842 1.554 1.00 0.00 C ATOM 0 H LEU A 69 0.307 -5.823 3.209 1.00 0.00 H new ATOM 0 HA LEU A 69 2.390 -4.238 2.018 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.089 -3.504 3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.942 -2.356 2.778 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.936 -2.723 1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.048 -3.717 -0.648 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.195 -2.641 0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.362 -4.407 0.334 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.649 -4.963 0.639 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.401 -5.695 1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.745 -4.786 2.407 1.00 0.00 H new ATOM 1121 N THR A 70 2.344 -4.694 5.227 1.00 0.00 N ATOM 1122 CA THR A 70 3.068 -4.466 6.474 1.00 0.00 C ATOM 1123 C THR A 70 4.526 -4.906 6.323 1.00 0.00 C ATOM 1124 O THR A 70 5.428 -4.311 6.916 1.00 0.00 O ATOM 1125 CB THR A 70 2.403 -5.234 7.619 1.00 0.00 C ATOM 1126 OG1 THR A 70 1.103 -4.732 7.867 1.00 0.00 O ATOM 1127 CG2 THR A 70 3.176 -5.171 8.921 1.00 0.00 C ATOM 0 H THR A 70 1.655 -5.444 5.274 1.00 0.00 H new ATOM 0 HA THR A 70 3.043 -3.401 6.705 1.00 0.00 H new ATOM 0 HB THR A 70 2.373 -6.272 7.288 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.159 -3.785 8.113 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.646 -5.737 9.687 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.168 -5.598 8.776 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.271 -4.132 9.238 1.00 0.00 H new ATOM 1135 N SER A 71 4.749 -5.943 5.516 1.00 0.00 N ATOM 1136 CA SER A 71 6.095 -6.452 5.288 1.00 0.00 C ATOM 1137 C SER A 71 6.814 -5.622 4.234 1.00 0.00 C ATOM 1138 O SER A 71 7.946 -5.185 4.439 1.00 0.00 O ATOM 1139 CB SER A 71 6.039 -7.916 4.856 1.00 0.00 C ATOM 1140 OG SER A 71 5.017 -8.129 3.899 1.00 0.00 O ATOM 0 H SER A 71 4.016 -6.443 5.013 1.00 0.00 H new ATOM 0 HA SER A 71 6.652 -6.379 6.222 1.00 0.00 H new ATOM 0 HB2 SER A 71 7.001 -8.211 4.437 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.863 -8.548 5.726 1.00 0.00 H new ATOM 0 HG SER A 71 4.631 -7.268 3.635 1.00 0.00 H new ATOM 1146 N LEU A 72 6.148 -5.405 3.101 1.00 0.00 N ATOM 1147 CA LEU A 72 6.724 -4.622 2.010 1.00 0.00 C ATOM 1148 C LEU A 72 7.300 -3.309 2.534 1.00 0.00 C ATOM 1149 O LEU A 72 8.425 -2.933 2.195 1.00 0.00 O ATOM 1150 CB LEU A 72 5.666 -4.353 0.938 1.00 0.00 C ATOM 1151 CG LEU A 72 5.191 -5.593 0.178 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.729 -5.453 -0.217 1.00 0.00 C ATOM 1153 CD2 LEU A 72 6.061 -5.827 -1.048 1.00 0.00 C ATOM 0 H LEU A 72 5.210 -5.760 2.915 1.00 0.00 H new ATOM 0 HA LEU A 72 7.536 -5.195 1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.804 -3.881 1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.069 -3.638 0.221 1.00 0.00 H new ATOM 0 HG LEU A 72 5.282 -6.458 0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.411 -6.345 -0.756 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.120 -5.334 0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.607 -4.579 -0.857 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.711 -6.712 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.001 -4.961 -1.707 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.095 -5.975 -0.737 1.00 0.00 H new ATOM 1165 N VAL A 73 6.539 -2.626 3.382 1.00 0.00 N ATOM 1166 CA VAL A 73 6.999 -1.374 3.963 1.00 0.00 C ATOM 1167 C VAL A 73 8.191 -1.638 4.869 1.00 0.00 C ATOM 1168 O VAL A 73 9.167 -0.895 4.858 1.00 0.00 O ATOM 1169 CB VAL A 73 5.888 -0.678 4.772 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.384 0.640 5.350 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.656 -0.456 3.907 1.00 0.00 C ATOM 0 H VAL A 73 5.608 -2.917 3.680 1.00 0.00 H new ATOM 0 HA VAL A 73 7.286 -0.714 3.145 1.00 0.00 H new ATOM 0 HB VAL A 73 5.612 -1.329 5.602 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.582 1.113 5.917 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.232 0.452 6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.693 1.300 4.539 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.882 0.037 4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.918 0.171 3.055 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.284 -1.416 3.550 1.00 0.00 H new ATOM 1181 N LYS A 74 8.099 -2.706 5.657 1.00 0.00 N ATOM 1182 CA LYS A 74 9.168 -3.076 6.577 1.00 0.00 C ATOM 1183 C LYS A 74 10.481 -3.311 5.840 1.00 0.00 C ATOM 1184 O LYS A 74 11.539 -2.861 6.279 1.00 0.00 O ATOM 1185 CB LYS A 74 8.775 -4.338 7.352 1.00 0.00 C ATOM 1186 CG LYS A 74 7.909 -4.075 8.578 1.00 0.00 C ATOM 1187 CD LYS A 74 7.110 -2.784 8.452 1.00 0.00 C ATOM 1188 CE LYS A 74 5.793 -2.867 9.201 1.00 0.00 C ATOM 1189 NZ LYS A 74 4.733 -2.056 8.541 1.00 0.00 N ATOM 0 H LYS A 74 7.293 -3.331 5.676 1.00 0.00 H new ATOM 0 HA LYS A 74 9.314 -2.249 7.272 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.241 -5.011 6.681 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.682 -4.855 7.666 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.225 -4.911 8.724 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.542 -4.023 9.464 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.698 -1.952 8.840 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.918 -2.575 7.399 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.472 -3.907 9.259 1.00 0.00 H new ATOM 0 HE3 LYS A 74 5.934 -2.519 10.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 3.878 -2.054 9.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.070 -1.080 8.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.510 -2.467 7.612 1.00 0.00 H new ATOM 1203 N GLU A 75 10.408 -4.019 4.719 1.00 0.00 N ATOM 1204 CA GLU A 75 11.593 -4.314 3.925 1.00 0.00 C ATOM 1205 C GLU A 75 12.222 -3.035 3.384 1.00 0.00 C ATOM 1206 O GLU A 75 13.427 -2.984 3.135 1.00 0.00 O ATOM 1207 CB GLU A 75 11.239 -5.250 2.770 1.00 0.00 C ATOM 1208 CG GLU A 75 12.371 -6.183 2.373 1.00 0.00 C ATOM 1209 CD GLU A 75 12.253 -6.669 0.942 1.00 0.00 C ATOM 1210 OE1 GLU A 75 12.773 -5.982 0.037 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.637 -7.734 0.725 1.00 0.00 O ATOM 0 H GLU A 75 9.541 -4.399 4.340 1.00 0.00 H new ATOM 0 HA GLU A 75 12.318 -4.806 4.573 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.370 -5.845 3.049 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.951 -4.653 1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 75 13.323 -5.667 2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.381 -7.042 3.044 1.00 0.00 H new ATOM 1218 N VAL A 76 11.402 -2.005 3.195 1.00 0.00 N ATOM 1219 CA VAL A 76 11.895 -0.730 2.673 1.00 0.00 C ATOM 1220 C VAL A 76 11.979 0.340 3.759 1.00 0.00 C ATOM 1221 O VAL A 76 12.349 1.481 3.485 1.00 0.00 O ATOM 1222 CB VAL A 76 10.999 -0.201 1.536 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.730 0.867 0.733 1.00 0.00 C ATOM 1224 CG2 VAL A 76 10.541 -1.336 0.633 1.00 0.00 C ATOM 0 H VAL A 76 10.402 -2.025 3.393 1.00 0.00 H new ATOM 0 HA VAL A 76 12.896 -0.930 2.290 1.00 0.00 H new ATOM 0 HB VAL A 76 10.113 0.251 1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 76 11.082 1.229 -0.065 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.996 1.696 1.388 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.635 0.441 0.301 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.910 -0.937 -0.161 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.411 -1.826 0.195 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.974 -2.060 1.218 1.00 0.00 H new ATOM 1234 N TYR A 77 11.620 -0.022 4.988 1.00 0.00 N ATOM 1235 CA TYR A 77 11.643 0.924 6.094 1.00 0.00 C ATOM 1236 C TYR A 77 11.924 0.215 7.418 1.00 0.00 C ATOM 1237 O TYR A 77 11.037 -0.414 7.995 1.00 0.00 O ATOM 1238 CB TYR A 77 10.305 1.666 6.155 1.00 0.00 C ATOM 1239 CG TYR A 77 10.333 2.967 6.935 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.527 3.639 7.184 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.156 3.527 7.414 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.543 4.826 7.890 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.165 4.716 8.119 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.361 5.360 8.355 1.00 0.00 C ATOM 1245 OH TYR A 77 10.374 6.544 9.057 1.00 0.00 O ATOM 0 H TYR A 77 11.311 -0.961 5.240 1.00 0.00 H new ATOM 0 HA TYR A 77 12.447 1.641 5.927 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.976 1.876 5.137 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.560 1.007 6.602 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.456 3.225 6.819 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.217 3.025 7.233 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.478 5.333 8.077 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.240 5.138 8.483 1.00 0.00 H new ATOM 0 HH TYR A 77 9.459 6.783 9.312 1.00 0.00 H new ATOM 1255 N PRO A 78 13.169 0.304 7.914 1.00 0.00 N ATOM 1256 CA PRO A 78 13.566 -0.337 9.174 1.00 0.00 C ATOM 1257 C PRO A 78 12.915 0.304 10.398 1.00 0.00 C ATOM 1258 O PRO A 78 12.766 -0.336 11.438 1.00 0.00 O ATOM 1259 CB PRO A 78 15.082 -0.134 9.214 1.00 0.00 C ATOM 1260 CG PRO A 78 15.334 1.061 8.364 1.00 0.00 C ATOM 1261 CD PRO A 78 14.290 1.029 7.285 1.00 0.00 C ATOM 0 HA PRO A 78 13.255 -1.381 9.206 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.432 0.026 10.234 1.00 0.00 H new ATOM 0 HB3 PRO A 78 15.607 -1.009 8.831 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.263 1.978 8.949 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.337 1.032 7.938 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.998 2.034 6.979 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.650 0.516 6.393 1.00 0.00 H new ATOM 1269 N GLU A 79 12.536 1.573 10.270 1.00 0.00 N ATOM 1270 CA GLU A 79 11.907 2.301 11.370 1.00 0.00 C ATOM 1271 C GLU A 79 10.551 1.701 11.746 1.00 0.00 C ATOM 1272 O GLU A 79 9.980 2.050 12.779 1.00 0.00 O ATOM 1273 CB GLU A 79 11.737 3.775 10.996 1.00 0.00 C ATOM 1274 CG GLU A 79 12.187 4.734 12.086 1.00 0.00 C ATOM 1275 CD GLU A 79 13.511 5.401 11.769 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.504 6.414 11.039 1.00 0.00 O ATOM 1277 OE2 GLU A 79 14.554 4.910 12.248 1.00 0.00 O ATOM 0 H GLU A 79 12.653 2.119 9.416 1.00 0.00 H new ATOM 0 HA GLU A 79 12.562 2.217 12.237 1.00 0.00 H new ATOM 0 HB2 GLU A 79 12.304 3.979 10.088 1.00 0.00 H new ATOM 0 HB3 GLU A 79 10.688 3.965 10.767 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.424 5.499 12.228 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.274 4.192 13.028 1.00 0.00 H new ATOM 1284 N ALA A 80 10.038 0.803 10.909 1.00 0.00 N ATOM 1285 CA ALA A 80 8.751 0.169 11.172 1.00 0.00 C ATOM 1286 C ALA A 80 8.924 -1.284 11.608 1.00 0.00 C ATOM 1287 O ALA A 80 8.082 -1.831 12.319 1.00 0.00 O ATOM 1288 CB ALA A 80 7.865 0.250 9.938 1.00 0.00 C ATOM 0 H ALA A 80 10.492 0.500 10.047 1.00 0.00 H new ATOM 0 HA ALA A 80 8.272 0.707 11.990 1.00 0.00 H new ATOM 0 HB1 ALA A 80 6.907 -0.226 10.146 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.701 1.295 9.676 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.351 -0.261 9.107 1.00 0.00 H new ATOM 1294 N ARG A 81 10.017 -1.904 11.174 1.00 0.00 N ATOM 1295 CA ARG A 81 10.299 -3.296 11.516 1.00 0.00 C ATOM 1296 C ARG A 81 10.248 -3.533 13.026 1.00 0.00 C ATOM 1297 O ARG A 81 10.063 -4.664 13.475 1.00 0.00 O ATOM 1298 CB ARG A 81 11.668 -3.708 10.968 1.00 0.00 C ATOM 1299 CG ARG A 81 11.601 -4.850 9.967 1.00 0.00 C ATOM 1300 CD ARG A 81 12.788 -4.834 9.018 1.00 0.00 C ATOM 1301 NE ARG A 81 13.729 -5.914 9.302 1.00 0.00 N ATOM 1302 CZ ARG A 81 14.889 -6.075 8.668 1.00 0.00 C ATOM 1303 NH1 ARG A 81 15.254 -5.228 7.713 1.00 0.00 N ATOM 1304 NH2 ARG A 81 15.685 -7.085 8.989 1.00 0.00 N ATOM 0 H ARG A 81 10.723 -1.465 10.584 1.00 0.00 H new ATOM 0 HA ARG A 81 9.524 -3.910 11.057 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.135 -2.845 10.493 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.310 -4.001 11.799 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.574 -5.800 10.500 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.676 -4.779 9.395 1.00 0.00 H new ATOM 0 HD2 ARG A 81 12.433 -4.923 7.991 1.00 0.00 H new ATOM 0 HD3 ARG A 81 13.302 -3.876 9.096 1.00 0.00 H new ATOM 0 HE ARG A 81 13.483 -6.585 10.030 1.00 0.00 H new ATOM 0 HH11 ARG A 81 14.645 -4.449 7.462 1.00 0.00 H new ATOM 0 HH12 ARG A 81 16.144 -5.356 7.231 1.00 0.00 H new ATOM 0 HH21 ARG A 81 15.409 -7.739 9.722 1.00 0.00 H new ATOM 0 HH22 ARG A 81 16.573 -7.208 8.503 1.00 0.00 H new ATOM 1318 N LYS A 82 10.410 -2.467 13.806 1.00 0.00 N ATOM 1319 CA LYS A 82 10.379 -2.579 15.260 1.00 0.00 C ATOM 1320 C LYS A 82 9.068 -3.205 15.729 1.00 0.00 C ATOM 1321 O LYS A 82 7.992 -2.848 15.248 1.00 0.00 O ATOM 1322 CB LYS A 82 10.564 -1.203 15.902 1.00 0.00 C ATOM 1323 CG LYS A 82 11.903 -0.560 15.581 1.00 0.00 C ATOM 1324 CD LYS A 82 12.291 0.473 16.628 1.00 0.00 C ATOM 1325 CE LYS A 82 13.098 1.608 16.019 1.00 0.00 C ATOM 1326 NZ LYS A 82 12.578 2.942 16.431 1.00 0.00 N ATOM 0 H LYS A 82 10.563 -1.521 13.457 1.00 0.00 H new ATOM 0 HA LYS A 82 11.199 -3.227 15.569 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.763 -0.544 15.567 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.466 -1.299 16.983 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.673 -1.329 15.525 1.00 0.00 H new ATOM 0 HG3 LYS A 82 11.854 -0.086 14.601 1.00 0.00 H new ATOM 0 HD2 LYS A 82 11.392 0.875 17.095 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.872 -0.006 17.416 1.00 0.00 H new ATOM 0 HE2 LYS A 82 14.141 1.515 16.322 1.00 0.00 H new ATOM 0 HE3 LYS A 82 13.074 1.529 14.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.155 3.689 15.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.591 3.041 16.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.625 3.028 17.466 1.00 0.00 H new ATOM 1340 N LYS A 83 9.166 -4.142 16.666 1.00 0.00 N ATOM 1341 CA LYS A 83 7.989 -4.820 17.196 1.00 0.00 C ATOM 1342 C LYS A 83 7.113 -3.857 17.990 1.00 0.00 C ATOM 1343 O LYS A 83 7.614 -3.044 18.768 1.00 0.00 O ATOM 1344 CB LYS A 83 8.405 -5.997 18.080 1.00 0.00 C ATOM 1345 CG LYS A 83 7.404 -7.141 18.080 1.00 0.00 C ATOM 1346 CD LYS A 83 8.041 -8.437 18.556 1.00 0.00 C ATOM 1347 CE LYS A 83 8.164 -8.474 20.070 1.00 0.00 C ATOM 1348 NZ LYS A 83 8.577 -9.818 20.560 1.00 0.00 N ATOM 0 H LYS A 83 10.049 -4.449 17.074 1.00 0.00 H new ATOM 0 HA LYS A 83 7.410 -5.195 16.352 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.371 -6.371 17.742 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.540 -5.643 19.102 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.562 -6.890 18.725 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.006 -7.278 17.075 1.00 0.00 H new ATOM 0 HD2 LYS A 83 7.443 -9.283 18.218 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.028 -8.545 18.107 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.892 -7.730 20.394 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.209 -8.202 20.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.650 -9.802 21.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.870 -10.524 20.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.501 -10.068 20.152 1.00 0.00 H new ATOM 1362 N GLY A 84 5.802 -3.954 17.790 1.00 0.00 N ATOM 1363 CA GLY A 84 4.876 -3.087 18.492 1.00 0.00 C ATOM 1364 C GLY A 84 4.614 -1.788 17.753 1.00 0.00 C ATOM 1365 O GLY A 84 4.036 -0.856 18.314 1.00 0.00 O ATOM 0 H GLY A 84 5.365 -4.620 17.153 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.933 -3.613 18.639 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.274 -2.863 19.482 1.00 0.00 H new ATOM 1369 N THR A 85 5.041 -1.720 16.495 1.00 0.00 N ATOM 1370 CA THR A 85 4.847 -0.521 15.688 1.00 0.00 C ATOM 1371 C THR A 85 3.440 -0.476 15.098 1.00 0.00 C ATOM 1372 O THR A 85 3.033 -1.376 14.364 1.00 0.00 O ATOM 1373 CB THR A 85 5.888 -0.473 14.567 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.201 -0.501 15.100 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.773 0.760 13.700 1.00 0.00 C ATOM 0 H THR A 85 5.522 -2.480 16.014 1.00 0.00 H new ATOM 0 HA THR A 85 4.971 0.348 16.334 1.00 0.00 H new ATOM 0 HB THR A 85 5.692 -1.352 13.952 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.594 -1.387 14.954 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.539 0.733 12.925 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.787 0.787 13.235 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.909 1.650 14.314 1.00 0.00 H new ATOM 1383 N HIS A 86 2.705 0.585 15.423 1.00 0.00 N ATOM 1384 CA HIS A 86 1.341 0.759 14.928 1.00 0.00 C ATOM 1385 C HIS A 86 1.308 1.734 13.756 1.00 0.00 C ATOM 1386 O HIS A 86 1.544 2.929 13.926 1.00 0.00 O ATOM 1387 CB HIS A 86 0.435 1.266 16.050 1.00 0.00 C ATOM 1388 CG HIS A 86 -1.023 1.056 15.783 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.834 2.022 15.225 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.817 -0.019 16.002 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -3.063 1.550 15.113 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -3.079 0.314 15.576 1.00 0.00 N ATOM 0 H HIS A 86 3.032 1.339 16.028 1.00 0.00 H new ATOM 0 HA HIS A 86 0.979 -0.209 14.582 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.702 0.761 16.978 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.619 2.330 16.202 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.514 -0.962 16.432 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.911 2.085 14.711 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.896 -0.295 15.612 1.00 0.00 H new ATOM 1400 N PHE A 87 1.016 1.219 12.564 1.00 0.00 N ATOM 1401 CA PHE A 87 0.958 2.053 11.364 1.00 0.00 C ATOM 1402 C PHE A 87 -0.441 2.055 10.758 1.00 0.00 C ATOM 1403 O PHE A 87 -1.072 1.007 10.628 1.00 0.00 O ATOM 1404 CB PHE A 87 1.972 1.573 10.320 1.00 0.00 C ATOM 1405 CG PHE A 87 2.538 0.212 10.604 1.00 0.00 C ATOM 1406 CD1 PHE A 87 1.813 -0.929 10.302 1.00 0.00 C ATOM 1407 CD2 PHE A 87 3.791 0.075 11.175 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.330 -2.181 10.563 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.315 -1.175 11.439 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.583 -2.304 11.131 1.00 0.00 C ATOM 0 H PHE A 87 0.816 0.232 12.402 1.00 0.00 H new ATOM 0 HA PHE A 87 1.208 3.071 11.662 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.492 1.559 9.341 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.790 2.292 10.264 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.833 -0.837 9.858 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.366 0.956 11.417 1.00 0.00 H new ATOM 0 HE1 PHE A 87 1.756 -3.064 10.324 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.294 -1.269 11.885 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.990 -3.284 11.334 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.915 3.242 10.386 1.00 0.00 N ATOM 1421 CA ASN A 88 -2.239 3.386 9.792 1.00 0.00 C ATOM 1422 C ASN A 88 -2.150 3.728 8.309 1.00 0.00 C ATOM 1423 O ASN A 88 -1.527 4.719 7.924 1.00 0.00 O ATOM 1424 CB ASN A 88 -3.033 4.471 10.524 1.00 0.00 C ATOM 1425 CG ASN A 88 -3.058 4.259 12.024 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -2.059 3.860 12.624 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.202 4.529 12.641 1.00 0.00 N ATOM 0 H ASN A 88 -0.401 4.117 10.486 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.752 2.430 9.892 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.597 5.446 10.305 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.055 4.487 10.145 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.278 4.408 13.651 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.005 4.858 12.105 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.786 2.906 7.481 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.794 3.120 6.038 1.00 0.00 C ATOM 1436 C PHE A 89 -3.905 4.082 5.641 1.00 0.00 C ATOM 1437 O PHE A 89 -5.062 3.916 6.044 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.970 1.795 5.298 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.001 0.738 5.734 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.259 -0.027 6.856 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.831 0.511 5.026 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.375 -0.997 7.270 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.062 -0.461 5.435 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.210 -1.217 6.560 1.00 0.00 C ATOM 0 H PHE A 89 -3.305 2.082 7.786 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.835 3.556 5.759 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.986 1.433 5.453 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.853 1.966 4.228 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.168 0.139 7.416 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.615 1.099 4.146 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.592 -1.586 8.149 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.971 -0.630 4.877 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.486 -1.977 6.883 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.540 5.084 4.848 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.483 6.088 4.379 1.00 0.00 C ATOM 1456 C ALA A 90 -4.093 6.585 2.993 1.00 0.00 C ATOM 1457 O ALA A 90 -2.911 6.693 2.677 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.537 7.254 5.355 1.00 0.00 C ATOM 0 H ALA A 90 -2.586 5.221 4.515 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.470 5.630 4.318 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.246 7.999 4.993 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.856 6.895 6.334 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.548 7.705 5.438 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.089 6.899 2.174 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.832 7.398 0.831 1.00 0.00 C ATOM 1466 C ILE A 91 -4.809 8.919 0.835 1.00 0.00 C ATOM 1467 O ILE A 91 -5.793 9.559 1.202 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.893 6.913 -0.175 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.173 5.420 0.019 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.435 7.192 -1.600 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.532 5.135 0.626 1.00 0.00 C ATOM 0 H ILE A 91 -6.077 6.817 2.415 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.863 7.008 0.521 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.819 7.460 0.004 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.101 4.917 -0.945 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.401 4.994 0.659 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.194 6.844 -2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.284 8.264 -1.731 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.498 6.668 -1.790 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.663 4.058 0.735 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -7.600 5.610 1.605 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -8.311 5.531 -0.025 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.676 9.492 0.445 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.519 10.941 0.420 1.00 0.00 C ATOM 1485 C VAL A 92 -2.895 11.395 -0.898 1.00 0.00 C ATOM 1486 O VAL A 92 -2.307 10.594 -1.621 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.664 11.445 1.618 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -2.672 10.440 2.763 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.231 11.749 1.194 1.00 0.00 C ATOM 0 H VAL A 92 -2.851 8.974 0.141 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.514 11.377 0.509 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.119 12.372 1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.066 10.820 3.585 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.695 10.288 3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.260 9.492 2.418 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.663 12.099 2.056 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.769 10.845 0.798 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.235 12.521 0.425 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.804 12.369 1.102 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.729 11.742 1.863 1.00 0.00 C ATOM 1675 C VAL A 103 -8.239 11.218 3.202 1.00 0.00 C ATOM 1676 O VAL A 103 -8.735 11.982 4.032 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.553 12.716 2.098 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -7.035 13.992 2.767 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.459 12.057 2.924 1.00 0.00 C ATOM 0 HA VAL A 103 -7.366 10.903 1.269 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.133 12.978 1.127 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.190 14.663 2.923 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.773 14.480 2.131 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.488 13.750 3.728 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.642 12.763 3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.864 11.757 3.891 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.086 11.178 2.398 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.118 9.909 3.405 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.574 9.285 4.644 1.00 0.00 C ATOM 1691 C LYS A 104 -7.884 7.942 4.872 1.00 0.00 C ATOM 1692 O LYS A 104 -7.242 7.401 3.971 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.093 9.098 4.616 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.822 9.892 5.689 1.00 0.00 C ATOM 1695 CD LYS A 104 -11.674 8.992 6.572 1.00 0.00 C ATOM 1696 CE LYS A 104 -11.030 8.777 7.934 1.00 0.00 C ATOM 1697 NZ LYS A 104 -11.400 7.459 8.520 1.00 0.00 N ATOM 0 H LYS A 104 -7.710 9.262 2.731 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.311 9.946 5.470 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.470 9.394 3.637 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.323 8.040 4.739 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.097 10.424 6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.454 10.645 5.218 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -12.661 9.436 6.701 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.819 8.030 6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -9.946 8.840 7.837 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -11.337 9.574 8.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -10.942 7.350 9.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -12.432 7.408 8.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -11.085 6.697 7.887 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.024 7.409 6.084 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.420 6.128 6.436 1.00 0.00 C ATOM 1713 C GLU A 105 -8.427 4.991 6.266 1.00 0.00 C ATOM 1714 O GLU A 105 -9.627 5.177 6.465 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.885 6.178 7.874 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.461 4.829 8.434 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.283 4.409 9.635 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -7.052 4.955 10.734 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -8.162 3.534 9.479 1.00 0.00 O ATOM 0 H GLU A 105 -8.552 7.846 6.839 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.585 5.936 5.762 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.032 6.856 7.908 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.654 6.601 8.520 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.551 4.072 7.655 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.409 4.872 8.716 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.929 3.817 5.884 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.786 2.655 5.671 1.00 0.00 C ATOM 1728 C ILE A 106 -8.508 1.542 6.677 1.00 0.00 C ATOM 1729 O ILE A 106 -9.352 0.672 6.888 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.617 2.080 4.250 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.134 1.875 3.926 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.275 2.990 3.223 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.549 0.620 4.536 1.00 0.00 C ATOM 0 H ILE A 106 -6.938 3.646 5.716 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.807 3.011 5.806 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.111 1.109 4.209 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.009 1.835 2.844 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.570 2.738 4.280 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.145 2.568 2.227 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.339 3.079 3.444 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.813 3.976 3.262 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.496 0.540 4.265 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.642 0.666 5.621 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.087 -0.251 4.162 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.334 1.570 7.305 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.000 0.544 8.278 1.00 0.00 C ATOM 1747 C GLY A 107 -5.548 0.611 8.700 1.00 0.00 C ATOM 1748 O GLY A 107 -4.716 1.132 7.965 1.00 0.00 O ATOM 0 H GLY A 107 -6.615 2.278 7.159 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.638 0.655 9.155 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.209 -0.438 7.855 1.00 0.00 H new ATOM 1752 N SER A 108 -5.244 0.097 9.890 1.00 0.00 N ATOM 1753 CA SER A 108 -3.881 0.122 10.411 1.00 0.00 C ATOM 1754 C SER A 108 -3.400 -1.276 10.806 1.00 0.00 C ATOM 1755 O SER A 108 -4.142 -2.046 11.417 1.00 0.00 O ATOM 1756 CB SER A 108 -3.810 1.049 11.625 1.00 0.00 C ATOM 1757 OG SER A 108 -4.834 2.028 11.579 1.00 0.00 O ATOM 0 H SER A 108 -5.924 -0.342 10.511 1.00 0.00 H new ATOM 0 HA SER A 108 -3.229 0.491 9.620 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.903 0.463 12.540 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.836 1.538 11.657 1.00 0.00 H new ATOM 0 HG SER A 108 -5.201 2.161 12.478 1.00 0.00 H new ATOM 1763 N THR A 109 -2.150 -1.587 10.469 1.00 0.00 N ATOM 1764 CA THR A 109 -1.560 -2.881 10.803 1.00 0.00 C ATOM 1765 C THR A 109 -0.487 -2.714 11.877 1.00 0.00 C ATOM 1766 O THR A 109 -0.365 -1.649 12.481 1.00 0.00 O ATOM 1767 CB THR A 109 -0.959 -3.546 9.563 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.002 -2.702 8.951 1.00 0.00 O ATOM 1769 CG2 THR A 109 -1.992 -3.912 8.520 1.00 0.00 C ATOM 0 H THR A 109 -1.525 -0.959 9.964 1.00 0.00 H new ATOM 0 HA THR A 109 -2.352 -3.523 11.188 1.00 0.00 H new ATOM 0 HB THR A 109 -0.495 -4.463 9.925 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.278 -2.508 8.031 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.499 -4.379 7.668 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.712 -4.609 8.950 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.511 -3.012 8.190 1.00 0.00 H new ATOM 1777 N MET A 110 0.285 -3.770 12.115 1.00 0.00 N ATOM 1778 CA MET A 110 1.339 -3.725 13.120 1.00 0.00 C ATOM 1779 C MET A 110 2.518 -4.607 12.726 1.00 0.00 C ATOM 1780 O MET A 110 2.398 -5.472 11.858 1.00 0.00 O ATOM 1781 CB MET A 110 0.795 -4.171 14.476 1.00 0.00 C ATOM 1782 CG MET A 110 -0.206 -3.203 15.084 1.00 0.00 C ATOM 1783 SD MET A 110 -0.040 -3.078 16.874 1.00 0.00 S ATOM 1784 CE MET A 110 1.682 -2.614 17.015 1.00 0.00 C ATOM 0 H MET A 110 0.201 -4.662 11.628 1.00 0.00 H new ATOM 0 HA MET A 110 1.689 -2.695 13.189 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.321 -5.146 14.364 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.628 -4.299 15.167 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.070 -2.217 14.639 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.217 -3.527 14.837 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.155 -3.205 17.799 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.187 -2.798 16.067 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.754 -1.556 17.265 1.00 0.00 H new ATOM 1794 N SER A 111 3.657 -4.382 13.373 1.00 0.00 N ATOM 1795 CA SER A 111 4.862 -5.155 13.098 1.00 0.00 C ATOM 1796 C SER A 111 4.821 -6.498 13.819 1.00 0.00 C ATOM 1797 O SER A 111 5.421 -6.662 14.881 1.00 0.00 O ATOM 1798 CB SER A 111 6.105 -4.371 13.525 1.00 0.00 C ATOM 1799 OG SER A 111 7.244 -4.777 12.787 1.00 0.00 O ATOM 0 H SER A 111 3.770 -3.669 14.093 1.00 0.00 H new ATOM 0 HA SER A 111 4.909 -5.340 12.025 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.934 -3.305 13.378 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.285 -4.521 14.589 1.00 0.00 H new ATOM 0 HG SER A 111 7.685 -3.989 12.407 1.00 0.00 H new ATOM 1805 N GLY A 112 4.105 -7.453 13.237 1.00 0.00 N ATOM 1806 CA GLY A 112 3.995 -8.768 13.838 1.00 0.00 C ATOM 1807 C GLY A 112 2.691 -8.959 14.590 1.00 0.00 C ATOM 1808 O GLY A 112 2.556 -9.892 15.383 1.00 0.00 O ATOM 0 H GLY A 112 3.598 -7.340 12.359 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.076 -9.527 13.060 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.830 -8.922 14.521 1.00 0.00 H new ATOM 1812 N ARG A 113 1.727 -8.075 14.343 1.00 0.00 N ATOM 1813 CA ARG A 113 0.428 -8.154 15.002 1.00 0.00 C ATOM 1814 C ARG A 113 -0.697 -8.162 13.971 1.00 0.00 C ATOM 1815 O ARG A 113 -0.802 -7.255 13.146 1.00 0.00 O ATOM 1816 CB ARG A 113 0.250 -6.980 15.968 1.00 0.00 C ATOM 1817 CG ARG A 113 -0.061 -7.407 17.393 1.00 0.00 C ATOM 1818 CD ARG A 113 -0.713 -6.283 18.182 1.00 0.00 C ATOM 1819 NE ARG A 113 -1.922 -6.726 18.871 1.00 0.00 N ATOM 1820 CZ ARG A 113 -2.884 -5.903 19.287 1.00 0.00 C ATOM 1821 NH1 ARG A 113 -2.777 -4.594 19.090 1.00 0.00 N ATOM 1822 NH2 ARG A 113 -3.952 -6.390 19.903 1.00 0.00 N ATOM 0 H ARG A 113 1.822 -7.296 13.691 1.00 0.00 H new ATOM 0 HA ARG A 113 0.386 -9.085 15.568 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.159 -6.379 15.968 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.555 -6.341 15.605 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -0.722 -8.273 17.378 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.858 -7.716 17.890 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -0.003 -5.893 18.911 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.960 -5.463 17.508 1.00 0.00 H new ATOM 0 HE ARG A 113 -2.037 -7.725 19.044 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -1.956 -4.215 18.618 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -3.516 -3.968 19.410 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -4.037 -7.394 20.058 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -4.688 -5.760 20.222 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.533 -9.193 14.023 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.646 -9.322 13.090 1.00 0.00 C ATOM 1838 C LYS A 114 -3.848 -8.504 13.553 1.00 0.00 C ATOM 1839 O LYS A 114 -4.590 -8.922 14.440 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.043 -10.791 12.937 1.00 0.00 C ATOM 1841 CG LYS A 114 -3.629 -11.124 11.576 1.00 0.00 C ATOM 1842 CD LYS A 114 -5.137 -10.934 11.555 1.00 0.00 C ATOM 1843 CE LYS A 114 -5.744 -11.413 10.246 1.00 0.00 C ATOM 1844 NZ LYS A 114 -6.878 -12.351 10.470 1.00 0.00 N ATOM 0 H LYS A 114 -1.461 -9.951 14.701 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.321 -8.937 12.124 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.166 -11.415 13.108 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.770 -11.044 13.708 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.171 -10.490 10.817 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.388 -12.155 11.318 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.585 -11.480 12.385 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.373 -9.880 11.702 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -6.091 -10.554 9.671 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.977 -11.907 9.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.264 -12.654 9.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.542 -13.183 10.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.622 -11.872 11.017 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.035 -7.339 12.940 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.154 -6.484 13.297 1.00 0.00 C ATOM 1860 C GLY A 115 -6.441 -6.909 12.616 1.00 0.00 C ATOM 1861 O GLY A 115 -6.547 -8.039 12.144 1.00 0.00 O ATOM 0 H GLY A 115 -3.433 -6.972 12.203 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.293 -6.504 14.378 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.924 -5.454 13.024 1.00 0.00 H new ATOM 1865 N THR A 116 -7.420 -6.005 12.562 1.00 0.00 N ATOM 1866 CA THR A 116 -8.695 -6.302 11.930 1.00 0.00 C ATOM 1867 C THR A 116 -8.633 -6.020 10.433 1.00 0.00 C ATOM 1868 O THR A 116 -9.246 -6.724 9.634 1.00 0.00 O ATOM 1869 CB THR A 116 -9.809 -5.477 12.573 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.626 -5.392 13.977 1.00 0.00 O ATOM 1871 CG2 THR A 116 -11.190 -6.039 12.324 1.00 0.00 C ATOM 0 H THR A 116 -7.350 -5.064 12.949 1.00 0.00 H new ATOM 0 HA THR A 116 -8.910 -7.361 12.074 1.00 0.00 H new ATOM 0 HB THR A 116 -9.745 -4.494 12.106 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.348 -4.859 14.369 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.933 -5.405 12.808 1.00 0.00 H new ATOM 0 HG22 THR A 116 -11.382 -6.070 11.252 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.252 -7.048 12.733 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.891 -4.980 10.062 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.751 -4.600 8.662 1.00 0.00 C ATOM 1881 C ASP A 117 -6.704 -5.460 7.957 1.00 0.00 C ATOM 1882 O ASP A 117 -6.671 -5.529 6.729 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.375 -3.121 8.549 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.363 -2.217 9.260 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -9.530 -2.150 8.819 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -7.971 -1.576 10.258 1.00 0.00 O ATOM 0 H ASP A 117 -7.378 -4.386 10.713 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.711 -4.764 8.173 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.381 -2.969 8.969 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.323 -2.842 7.497 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.849 -6.115 8.740 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.800 -6.971 8.190 1.00 0.00 C ATOM 1893 C ASP A 118 -5.370 -7.947 7.161 1.00 0.00 C ATOM 1894 O ASP A 118 -4.737 -8.237 6.146 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.111 -7.745 9.315 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.717 -8.203 8.934 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.885 -7.341 8.582 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -2.458 -9.423 8.988 1.00 0.00 O ATOM 0 H ASP A 118 -5.862 -6.069 9.759 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.070 -6.334 7.690 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.053 -7.115 10.203 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.716 -8.613 9.578 1.00 0.00 H new ATOM 1903 N SER A 119 -6.567 -8.452 7.436 1.00 0.00 N ATOM 1904 CA SER A 119 -7.228 -9.399 6.542 1.00 0.00 C ATOM 1905 C SER A 119 -7.816 -8.700 5.315 1.00 0.00 C ATOM 1906 O SER A 119 -8.242 -9.357 4.366 1.00 0.00 O ATOM 1907 CB SER A 119 -8.332 -10.150 7.287 1.00 0.00 C ATOM 1908 OG SER A 119 -9.376 -9.274 7.673 1.00 0.00 O ATOM 0 H SER A 119 -7.102 -8.221 8.273 1.00 0.00 H new ATOM 0 HA SER A 119 -6.474 -10.107 6.199 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.732 -10.939 6.650 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.914 -10.634 8.170 1.00 0.00 H new ATOM 0 HG SER A 119 -9.046 -8.653 8.355 1.00 0.00 H new ATOM 1914 N MET A 120 -7.829 -7.370 5.334 1.00 0.00 N ATOM 1915 CA MET A 120 -8.359 -6.597 4.218 1.00 0.00 C ATOM 1916 C MET A 120 -7.317 -6.494 3.111 1.00 0.00 C ATOM 1917 O MET A 120 -6.130 -6.703 3.351 1.00 0.00 O ATOM 1918 CB MET A 120 -8.766 -5.197 4.681 1.00 0.00 C ATOM 1919 CG MET A 120 -9.922 -4.608 3.888 1.00 0.00 C ATOM 1920 SD MET A 120 -11.016 -3.595 4.903 1.00 0.00 S ATOM 1921 CE MET A 120 -9.844 -2.446 5.622 1.00 0.00 C ATOM 0 H MET A 120 -7.479 -6.807 6.109 1.00 0.00 H new ATOM 0 HA MET A 120 -9.241 -7.108 3.832 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.042 -5.237 5.735 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.906 -4.532 4.602 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.527 -4.003 3.072 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.497 -5.416 3.436 1.00 0.00 H new ATOM 0 HE1 MET A 120 -10.246 -2.052 6.555 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.904 -2.961 5.821 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.667 -1.624 4.928 1.00 0.00 H new ATOM 1931 N THR A 121 -7.765 -6.174 1.902 1.00 0.00 N ATOM 1932 CA THR A 121 -6.861 -6.050 0.764 1.00 0.00 C ATOM 1933 C THR A 121 -6.795 -4.607 0.270 1.00 0.00 C ATOM 1934 O THR A 121 -7.670 -3.796 0.574 1.00 0.00 O ATOM 1935 CB THR A 121 -7.305 -6.983 -0.363 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.702 -7.213 -0.300 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.620 -8.331 -0.320 1.00 0.00 C ATOM 0 H THR A 121 -8.746 -5.996 1.685 1.00 0.00 H new ATOM 0 HA THR A 121 -5.861 -6.338 1.088 1.00 0.00 H new ATOM 0 HB THR A 121 -7.028 -6.477 -1.288 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.156 -6.651 -0.962 1.00 0.00 H new ATOM 0 HG21 THR A 121 -6.977 -8.947 -1.145 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.542 -8.194 -0.409 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.846 -8.824 0.625 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.741 -4.287 -0.478 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.549 -2.934 -0.996 1.00 0.00 C ATOM 1947 C LEU A 122 -6.660 -2.522 -1.961 1.00 0.00 C ATOM 1948 O LEU A 122 -7.241 -1.445 -1.823 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.189 -2.830 -1.689 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.236 -1.796 -1.088 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -1.912 -1.792 -1.836 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.870 -0.411 -1.108 1.00 0.00 C ATOM 0 H LEU A 122 -5.007 -4.946 -0.739 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.584 -2.250 -0.148 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.707 -3.807 -1.659 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.351 -2.586 -2.739 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.041 -2.068 -0.051 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.247 -1.050 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.452 -2.778 -1.767 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.086 -1.545 -2.883 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.178 0.312 -0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.095 -0.129 -2.136 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.791 -0.424 -0.525 1.00 0.00 H new ATOM 1964 N GLN A 123 -6.944 -3.367 -2.949 1.00 0.00 N ATOM 1965 CA GLN A 123 -7.977 -3.062 -3.938 1.00 0.00 C ATOM 1966 C GLN A 123 -9.297 -2.669 -3.272 1.00 0.00 C ATOM 1967 O GLN A 123 -10.119 -1.975 -3.870 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.180 -4.250 -4.894 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.212 -5.270 -4.432 1.00 0.00 C ATOM 1970 CD GLN A 123 -8.765 -6.044 -3.207 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -8.930 -5.588 -2.078 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -8.195 -7.222 -3.429 1.00 0.00 N ATOM 0 H GLN A 123 -6.477 -4.263 -3.087 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.636 -2.205 -4.518 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -8.480 -3.867 -5.869 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.224 -4.756 -5.030 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -10.149 -4.758 -4.211 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.414 -5.969 -5.244 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.079 -7.560 -4.384 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -7.873 -7.789 -2.644 1.00 0.00 H new ATOM 1981 N SER A 124 -9.495 -3.116 -2.035 1.00 0.00 N ATOM 1982 CA SER A 124 -10.714 -2.808 -1.297 1.00 0.00 C ATOM 1983 C SER A 124 -10.667 -1.400 -0.704 1.00 0.00 C ATOM 1984 O SER A 124 -11.684 -0.875 -0.253 1.00 0.00 O ATOM 1985 CB SER A 124 -10.933 -3.835 -0.184 1.00 0.00 C ATOM 1986 OG SER A 124 -11.800 -4.871 -0.607 1.00 0.00 O ATOM 0 H SER A 124 -8.827 -3.692 -1.524 1.00 0.00 H new ATOM 0 HA SER A 124 -11.547 -2.853 -1.998 1.00 0.00 H new ATOM 0 HB2 SER A 124 -9.975 -4.259 0.117 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.352 -3.341 0.693 1.00 0.00 H new ATOM 0 HG SER A 124 -11.921 -5.514 0.122 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.483 -0.790 -0.708 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.320 0.558 -0.171 1.00 0.00 C ATOM 1994 C GLN A 125 -9.428 1.605 -1.275 1.00 0.00 C ATOM 1995 O GLN A 125 -8.999 2.746 -1.103 1.00 0.00 O ATOM 1996 CB GLN A 125 -7.967 0.702 0.537 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.428 -0.593 1.129 1.00 0.00 C ATOM 1998 CD GLN A 125 -8.240 -1.080 2.312 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -9.331 -0.578 2.582 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -7.709 -2.065 3.026 1.00 0.00 N ATOM 0 H GLN A 125 -8.627 -1.206 -1.075 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.121 0.722 0.550 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.239 1.094 -0.173 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.064 1.439 1.334 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.419 -1.364 0.358 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -6.394 -0.442 1.441 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.802 -2.452 2.766 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -8.208 -2.435 3.835 1.00 0.00 H new ATOM 2009 N LYS A 126 -9.997 1.210 -2.413 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.158 2.111 -3.551 1.00 0.00 C ATOM 2011 C LYS A 126 -8.808 2.478 -4.173 1.00 0.00 C ATOM 2012 O LYS A 126 -8.741 3.324 -5.064 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.901 3.383 -3.133 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.272 3.115 -2.534 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.755 4.295 -1.705 1.00 0.00 C ATOM 2016 CE LYS A 126 -12.419 4.114 -0.233 1.00 0.00 C ATOM 2017 NZ LYS A 126 -13.521 3.441 0.509 1.00 0.00 N ATOM 0 H LYS A 126 -10.355 0.268 -2.571 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.747 1.584 -4.302 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.296 3.926 -2.407 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.013 4.031 -4.002 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.986 2.912 -3.332 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.230 2.223 -1.910 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -12.297 5.213 -2.074 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -13.833 4.407 -1.823 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -11.506 3.526 -0.139 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -12.220 5.087 0.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -13.253 3.336 1.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -14.386 4.014 0.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.694 2.502 0.097 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.737 1.835 -3.709 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.405 2.099 -4.233 1.00 0.00 C ATOM 2033 C PHE A 127 -6.217 1.429 -5.590 1.00 0.00 C ATOM 2034 O PHE A 127 -6.933 0.487 -5.931 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.342 1.600 -3.254 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.936 1.864 -3.710 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.395 3.136 -3.625 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.156 0.842 -4.224 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.101 3.382 -4.042 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.863 1.082 -4.645 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.334 2.354 -4.554 1.00 0.00 C ATOM 0 H PHE A 127 -7.769 1.130 -2.973 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.295 3.176 -4.359 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.497 2.078 -2.287 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.472 0.528 -3.105 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -3.991 3.945 -3.228 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.564 -0.155 -4.297 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.689 4.378 -3.968 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.266 0.276 -5.045 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.323 2.545 -4.882 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.251 1.917 -6.360 1.00 0.00 N ATOM 2052 CA GLN A 128 -4.972 1.360 -7.678 1.00 0.00 C ATOM 2053 C GLN A 128 -3.504 1.540 -8.044 1.00 0.00 C ATOM 2054 O GLN A 128 -2.740 2.157 -7.302 1.00 0.00 O ATOM 2055 CB GLN A 128 -5.858 2.022 -8.735 1.00 0.00 C ATOM 2056 CG GLN A 128 -5.802 3.540 -8.713 1.00 0.00 C ATOM 2057 CD GLN A 128 -7.126 4.179 -9.083 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -7.374 4.492 -10.248 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -7.986 4.375 -8.091 1.00 0.00 N ATOM 0 H GLN A 128 -4.649 2.696 -6.095 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.193 0.293 -7.647 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.557 1.670 -9.722 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -6.889 1.703 -8.584 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -5.507 3.874 -7.718 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -5.032 3.881 -9.405 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -7.739 4.100 -7.140 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -8.894 4.800 -8.280 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.113 0.997 -9.193 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.734 1.099 -9.654 1.00 0.00 C ATOM 2070 C ILE A 129 -1.380 2.540 -10.006 1.00 0.00 C ATOM 2071 O ILE A 129 -1.866 3.085 -10.997 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.485 0.206 -10.886 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.001 -1.212 -10.632 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.003 0.184 -11.232 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.758 -2.161 -11.786 1.00 0.00 C ATOM 0 H ILE A 129 -3.731 0.483 -9.821 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.100 0.760 -8.835 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.031 0.622 -11.733 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.521 -1.610 -9.738 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.071 -1.169 -10.427 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.158 -0.450 -12.104 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.334 1.197 -11.453 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.562 -0.210 -10.387 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.150 -3.147 -11.535 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.262 -1.787 -12.677 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.687 -2.234 -11.978 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.529 3.151 -9.188 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.122 4.523 -9.432 1.00 0.00 C ATOM 2089 C GLY A 130 -0.648 5.489 -8.385 1.00 0.00 C ATOM 2090 O GLY A 130 -0.125 6.594 -8.237 1.00 0.00 O ATOM 0 H GLY A 130 -0.114 2.721 -8.361 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.967 4.576 -9.454 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.476 4.833 -10.415 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.684 5.077 -7.661 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.274 5.922 -6.629 1.00 0.00 C ATOM 2096 C ASP A 131 -1.257 6.247 -5.539 1.00 0.00 C ATOM 2097 O ASP A 131 -0.228 5.582 -5.410 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.506 5.246 -6.021 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.796 5.939 -6.411 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.069 6.046 -7.626 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.534 6.375 -5.503 1.00 0.00 O ATOM 0 H ASP A 131 -2.131 4.167 -7.769 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.582 6.857 -7.096 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.543 4.206 -6.345 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.414 5.239 -4.935 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.549 7.282 -4.767 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.657 7.716 -3.692 1.00 0.00 C ATOM 2108 C TYR A 132 -1.152 7.258 -2.318 1.00 0.00 C ATOM 2109 O TYR A 132 -2.171 7.740 -1.820 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.514 9.239 -3.706 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.301 9.816 -5.085 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -1.360 9.946 -5.974 1.00 0.00 C ATOM 2113 CD2 TYR A 132 0.958 10.233 -5.498 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -1.171 10.474 -7.237 1.00 0.00 C ATOM 2115 CE2 TYR A 132 1.156 10.765 -6.759 1.00 0.00 C ATOM 2116 CZ TYR A 132 0.089 10.882 -7.624 1.00 0.00 C ATOM 2117 OH TYR A 132 0.282 11.410 -8.880 1.00 0.00 O ATOM 0 H TYR A 132 -2.397 7.841 -4.861 1.00 0.00 H new ATOM 0 HA TYR A 132 0.314 7.254 -3.870 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.409 9.683 -3.270 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.325 9.522 -3.070 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -2.348 9.629 -5.673 1.00 0.00 H new ATOM 0 HD2 TYR A 132 1.796 10.140 -4.823 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.005 10.567 -7.917 1.00 0.00 H new ATOM 0 HE2 TYR A 132 2.141 11.087 -7.064 1.00 0.00 H new ATOM 0 HH TYR A 132 1.226 11.648 -8.993 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.411 6.337 -1.706 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.759 5.825 -0.383 1.00 0.00 C ATOM 2129 C LEU A 133 0.173 6.419 0.671 1.00 0.00 C ATOM 2130 O LEU A 133 1.392 6.389 0.513 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.645 4.293 -0.354 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.960 3.507 -0.458 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.748 2.075 0.006 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.064 4.164 0.357 1.00 0.00 C ATOM 0 H LEU A 133 0.435 5.930 -2.106 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.787 6.112 -0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.003 3.983 -1.174 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.148 4.005 0.572 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.271 3.505 -1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.686 1.525 -0.071 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.995 1.597 -0.620 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.411 2.075 1.043 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.981 3.583 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.767 4.205 1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.235 5.175 -0.011 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.395 6.951 1.746 1.00 0.00 N ATOM 2147 CA ASP A 134 0.406 7.536 2.817 1.00 0.00 C ATOM 2148 C ASP A 134 0.260 6.722 4.097 1.00 0.00 C ATOM 2149 O ASP A 134 -0.796 6.735 4.730 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.021 8.981 3.074 1.00 0.00 C ATOM 2151 CG ASP A 134 1.112 9.838 3.607 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.566 9.581 4.742 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.544 10.764 2.890 1.00 0.00 O ATOM 0 H ASP A 134 -1.402 6.990 1.900 1.00 0.00 H new ATOM 0 HA ASP A 134 1.451 7.524 2.507 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.395 9.416 2.147 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.846 8.991 3.787 1.00 0.00 H new ATOM 2158 N ILE A 135 1.314 6.009 4.470 1.00 0.00 N ATOM 2159 CA ILE A 135 1.283 5.188 5.672 1.00 0.00 C ATOM 2160 C ILE A 135 1.852 5.941 6.872 1.00 0.00 C ATOM 2161 O ILE A 135 2.972 6.449 6.831 1.00 0.00 O ATOM 2162 CB ILE A 135 2.063 3.871 5.476 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.471 3.072 4.313 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.049 3.042 6.755 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.489 2.680 3.266 1.00 0.00 C ATOM 0 H ILE A 135 2.197 5.982 3.960 1.00 0.00 H new ATOM 0 HA ILE A 135 0.237 4.951 5.866 1.00 0.00 H new ATOM 0 HB ILE A 135 3.099 4.115 5.239 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.000 2.170 4.705 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.686 3.662 3.841 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.604 2.118 6.596 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.513 3.610 7.562 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.020 2.805 7.024 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.997 2.117 2.473 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.943 3.578 2.846 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.262 2.063 3.723 1.00 0.00 H new ATOM 2177 N ALA A 136 1.072 5.996 7.942 1.00 0.00 N ATOM 2178 CA ALA A 136 1.492 6.674 9.161 1.00 0.00 C ATOM 2179 C ALA A 136 1.972 5.657 10.191 1.00 0.00 C ATOM 2180 O ALA A 136 1.164 4.990 10.834 1.00 0.00 O ATOM 2181 CB ALA A 136 0.347 7.505 9.720 1.00 0.00 C ATOM 0 H ALA A 136 0.143 5.578 7.991 1.00 0.00 H new ATOM 0 HA ALA A 136 2.320 7.342 8.926 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.673 8.007 10.631 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.045 8.250 8.984 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.498 6.855 9.946 1.00 0.00 H new ATOM 2187 N ILE A 137 3.288 5.542 10.341 1.00 0.00 N ATOM 2188 CA ILE A 137 3.866 4.598 11.291 1.00 0.00 C ATOM 2189 C ILE A 137 4.112 5.262 12.642 1.00 0.00 C ATOM 2190 O ILE A 137 4.772 6.298 12.728 1.00 0.00 O ATOM 2191 CB ILE A 137 5.184 3.995 10.755 1.00 0.00 C ATOM 2192 CG1 ILE A 137 4.915 3.205 9.472 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.838 3.104 11.802 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.087 3.174 8.517 1.00 0.00 C ATOM 0 H ILE A 137 3.972 6.089 9.819 1.00 0.00 H new ATOM 0 HA ILE A 137 3.145 3.791 11.422 1.00 0.00 H new ATOM 0 HB ILE A 137 5.871 4.811 10.530 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.646 2.182 9.736 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.055 3.639 8.963 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.764 2.691 11.401 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.058 3.691 12.693 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.161 2.291 12.062 1.00 0.00 H new ATOM 0 HD11 ILE A 137 5.820 2.596 7.632 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.343 4.192 8.222 1.00 0.00 H new ATOM 0 HD13 ILE A 137 6.944 2.712 9.007 1.00 0.00 H new ATOM 2206 N THR A 138 3.568 4.656 13.691 1.00 0.00 N ATOM 2207 CA THR A 138 3.712 5.177 15.044 1.00 0.00 C ATOM 2208 C THR A 138 4.446 4.182 15.942 1.00 0.00 C ATOM 2209 O THR A 138 3.900 3.133 16.287 1.00 0.00 O ATOM 2210 CB THR A 138 2.337 5.481 15.639 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.426 5.866 14.627 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.363 6.580 16.681 1.00 0.00 C ATOM 0 H THR A 138 3.020 3.798 13.629 1.00 0.00 H new ATOM 0 HA THR A 138 4.299 6.094 14.989 1.00 0.00 H new ATOM 0 HB THR A 138 2.021 4.556 16.121 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.105 5.069 14.155 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.355 6.745 17.062 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.018 6.288 17.502 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.735 7.500 16.230 1.00 0.00 H new ATOM 2220 N PRO A 139 5.689 4.496 16.344 1.00 0.00 N ATOM 2221 CA PRO A 139 6.476 3.615 17.215 1.00 0.00 C ATOM 2222 C PRO A 139 5.790 3.396 18.561 1.00 0.00 C ATOM 2223 O PRO A 139 4.680 3.881 18.784 1.00 0.00 O ATOM 2224 CB PRO A 139 7.798 4.370 17.404 1.00 0.00 C ATOM 2225 CG PRO A 139 7.849 5.356 16.288 1.00 0.00 C ATOM 2226 CD PRO A 139 6.422 5.725 15.997 1.00 0.00 C ATOM 0 HA PRO A 139 6.606 2.622 16.784 1.00 0.00 H new ATOM 0 HB2 PRO A 139 7.831 4.869 18.372 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.649 3.689 17.367 1.00 0.00 H new ATOM 0 HG2 PRO A 139 8.430 6.234 16.570 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.328 4.926 15.409 1.00 0.00 H new ATOM 0 HD2 PRO A 139 6.094 6.574 16.596 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.280 5.999 14.951 1.00 0.00 H new ATOM 2234 N PRO A 140 6.438 2.661 19.478 1.00 0.00 N ATOM 2235 CA PRO A 140 5.881 2.380 20.802 1.00 0.00 C ATOM 2236 C PRO A 140 6.127 3.509 21.802 1.00 0.00 C ATOM 2237 O PRO A 140 6.155 3.280 23.011 1.00 0.00 O ATOM 2238 CB PRO A 140 6.636 1.123 21.220 1.00 0.00 C ATOM 2239 CG PRO A 140 7.975 1.260 20.576 1.00 0.00 C ATOM 2240 CD PRO A 140 7.763 2.035 19.298 1.00 0.00 C ATOM 0 HA PRO A 140 4.797 2.269 20.777 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.722 1.054 22.304 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.124 0.222 20.883 1.00 0.00 H new ATOM 0 HG2 PRO A 140 8.670 1.781 21.234 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.407 0.281 20.368 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.542 2.783 19.151 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.781 1.381 18.426 1.00 0.00 H new