USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 824 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 70 HIS : no HD1:sc= -2.87 X(o=-0.63,f=-0.79) USER MOD Set 1.2: A 74 THR OG1 : rot 73:sc= 2.24 USER MOD Single : A 28 LYS NZ :NH3+ 173:sc= -0.323 (180deg=-0.438) USER MOD Single : A 33 ASN : amide:sc= -5.88! C(o=-5.9!,f=-12!) USER MOD Single : A 39 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot 11:sc= 0.0626 USER MOD Single : A 45 ASN : amide:sc= -0.0764 X(o=-0.076,f=0) USER MOD Single : A 49 CYS SG : rot -39:sc= 0.12 USER MOD Single : A 52 CYS SG : rot -49:sc= 0.578 USER MOD Single : A 54 TYR OH : rot -130:sc= -0.82 USER MOD Single : A 55 SER OG : rot 180:sc= 0.0218 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 CYS SG : rot 140:sc= -3.03! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 178:sc= 0.0649 USER MOD Single : A 75 GLN : amide:sc= -0.382 K(o=-0.38,f=-1.1) USER MOD Single : A 81 GLN : amide:sc= -0.169 K(o=-0.17,f=-1.6!) USER MOD Single : A 84 GLN : amide:sc= -1.75! K(o=-1.7!,f=-0.44) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot -5:sc= 1.25 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0.134 USER MOD Single : A 105 CYS SG : rot 180:sc= -0.0454 USER MOD Single : A 108 CYS SG : rot 111:sc= -1.19 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -0.971 K(o=-0.97,f=-1.6!) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -1.33 X(o=-1.3,f=-1.2) USER MOD Single : A 133 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 424 N ARG A 27 -7.563 -26.515 11.918 1.00 0.00 N ATOM 425 CA ARG A 27 -8.922 -26.819 11.487 1.00 0.00 C ATOM 426 C ARG A 27 -8.933 -27.339 10.053 1.00 0.00 C ATOM 427 O ARG A 27 -8.264 -26.792 9.177 1.00 0.00 O ATOM 428 CB ARG A 27 -9.806 -25.576 11.597 1.00 0.00 C ATOM 429 CG ARG A 27 -9.241 -24.361 10.879 1.00 0.00 C ATOM 430 CD ARG A 27 -10.346 -23.492 10.301 1.00 0.00 C ATOM 431 NE ARG A 27 -11.168 -22.886 11.346 1.00 0.00 N ATOM 432 CZ ARG A 27 -12.000 -21.872 11.131 1.00 0.00 C ATOM 433 NH1 ARG A 27 -12.120 -21.355 9.916 1.00 0.00 N ATOM 434 NH2 ARG A 27 -12.714 -21.375 12.133 1.00 0.00 N ATOM 0 HA ARG A 27 -9.318 -27.596 12.141 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -10.791 -25.804 11.188 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -9.946 -25.332 12.650 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.640 -23.774 11.573 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -8.576 -24.686 10.079 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -9.906 -22.708 9.685 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -10.977 -24.094 9.647 1.00 0.00 H new ATOM 0 HE ARG A 27 -11.100 -23.262 12.292 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -11.573 -21.735 9.144 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -12.759 -20.577 9.754 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -12.624 -21.771 13.069 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -13.352 -20.597 11.968 1.00 0.00 H new ATOM 448 N LYS A 28 -9.698 -28.401 9.820 1.00 0.00 N ATOM 449 CA LYS A 28 -9.799 -28.995 8.492 1.00 0.00 C ATOM 450 C LYS A 28 -11.254 -29.086 8.045 1.00 0.00 C ATOM 451 O LYS A 28 -12.170 -29.039 8.867 1.00 0.00 O ATOM 452 CB LYS A 28 -9.165 -30.388 8.486 1.00 0.00 C ATOM 453 CG LYS A 28 -7.761 -30.420 9.064 1.00 0.00 C ATOM 454 CD LYS A 28 -7.782 -30.645 10.567 1.00 0.00 C ATOM 455 CE LYS A 28 -6.477 -31.254 11.058 1.00 0.00 C ATOM 456 NZ LYS A 28 -5.294 -30.482 10.587 1.00 0.00 N ATOM 0 H LYS A 28 -10.257 -28.868 10.534 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.262 -28.354 7.793 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -9.799 -31.069 9.055 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.136 -30.760 7.462 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.187 -31.213 8.584 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.254 -29.481 8.843 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.956 -29.697 11.075 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.612 -31.303 10.826 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -6.479 -31.287 12.147 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.402 -32.283 10.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.434 -30.856 11.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.211 -30.570 9.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.410 -29.480 10.841 1.00 0.00 H new ATOM 470 N PHE A 29 -11.461 -29.217 6.739 1.00 0.00 N ATOM 471 CA PHE A 29 -12.805 -29.314 6.184 1.00 0.00 C ATOM 472 C PHE A 29 -12.758 -29.711 4.711 1.00 0.00 C ATOM 473 O PHE A 29 -11.953 -29.186 3.941 1.00 0.00 O ATOM 474 CB PHE A 29 -13.543 -27.983 6.341 1.00 0.00 C ATOM 475 CG PHE A 29 -14.685 -27.813 5.380 1.00 0.00 C ATOM 476 CD1 PHE A 29 -14.469 -27.301 4.110 1.00 0.00 C ATOM 477 CD2 PHE A 29 -15.974 -28.165 5.746 1.00 0.00 C ATOM 478 CE1 PHE A 29 -15.517 -27.144 3.223 1.00 0.00 C ATOM 479 CE2 PHE A 29 -17.026 -28.010 4.863 1.00 0.00 C ATOM 480 CZ PHE A 29 -16.798 -27.498 3.601 1.00 0.00 C ATOM 0 H PHE A 29 -10.714 -29.258 6.045 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.343 -30.086 6.734 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -13.922 -27.905 7.360 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -12.836 -27.166 6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -13.470 -27.021 3.810 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -16.159 -28.565 6.732 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -15.335 -26.745 2.236 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.026 -28.289 5.160 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.619 -27.374 2.911 1.00 0.00 H new ATOM 490 N ILE A 30 -13.625 -30.642 4.327 1.00 0.00 N ATOM 491 CA ILE A 30 -13.683 -31.109 2.948 1.00 0.00 C ATOM 492 C ILE A 30 -15.083 -31.595 2.590 1.00 0.00 C ATOM 493 O ILE A 30 -15.800 -32.132 3.436 1.00 0.00 O ATOM 494 CB ILE A 30 -12.677 -32.248 2.697 1.00 0.00 C ATOM 495 CG1 ILE A 30 -13.079 -33.496 3.485 1.00 0.00 C ATOM 496 CG2 ILE A 30 -11.271 -31.806 3.075 1.00 0.00 C ATOM 497 CD1 ILE A 30 -12.153 -34.673 3.268 1.00 0.00 C ATOM 0 H ILE A 30 -14.297 -31.088 4.952 1.00 0.00 H new ATOM 0 HA ILE A 30 -13.424 -30.259 2.316 1.00 0.00 H new ATOM 0 HB ILE A 30 -12.686 -32.493 1.635 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.102 -33.253 4.547 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.092 -33.784 3.202 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.572 -32.622 2.892 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.987 -30.943 2.473 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.246 -31.537 4.131 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -12.499 -35.522 3.858 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -12.148 -34.942 2.212 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -11.143 -34.404 3.578 1.00 0.00 H new ATOM 509 N ILE A 31 -15.466 -31.405 1.332 1.00 0.00 N ATOM 510 CA ILE A 31 -16.779 -31.827 0.862 1.00 0.00 C ATOM 511 C ILE A 31 -16.660 -32.752 -0.345 1.00 0.00 C ATOM 512 O ILE A 31 -15.848 -32.520 -1.240 1.00 0.00 O ATOM 513 CB ILE A 31 -17.657 -30.619 0.484 1.00 0.00 C ATOM 514 CG1 ILE A 31 -16.799 -29.358 0.360 1.00 0.00 C ATOM 515 CG2 ILE A 31 -18.756 -30.419 1.516 1.00 0.00 C ATOM 516 CD1 ILE A 31 -17.505 -28.213 -0.333 1.00 0.00 C ATOM 0 H ILE A 31 -14.885 -30.962 0.620 1.00 0.00 H new ATOM 0 HA ILE A 31 -17.250 -32.365 1.684 1.00 0.00 H new ATOM 0 HB ILE A 31 -18.124 -30.815 -0.481 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -16.494 -29.037 1.356 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -15.889 -29.600 -0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -19.368 -29.562 1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -19.380 -31.311 1.560 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -18.309 -30.240 2.494 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -16.838 -27.353 -0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -17.787 -28.516 -1.341 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.400 -27.944 0.228 1.00 0.00 H new ATOM 528 N ALA A 32 -17.477 -33.800 -0.363 1.00 0.00 N ATOM 529 CA ALA A 32 -17.467 -34.758 -1.461 1.00 0.00 C ATOM 530 C ALA A 32 -18.861 -34.929 -2.054 1.00 0.00 C ATOM 531 O ALA A 32 -19.852 -34.987 -1.327 1.00 0.00 O ATOM 532 CB ALA A 32 -16.924 -36.099 -0.987 1.00 0.00 C ATOM 0 H ALA A 32 -18.154 -34.007 0.371 1.00 0.00 H new ATOM 0 HA ALA A 32 -16.814 -34.370 -2.243 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -16.922 -36.805 -1.818 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.906 -35.970 -0.619 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -17.554 -36.484 -0.185 1.00 0.00 H new ATOM 538 N ASN A 33 -18.930 -35.009 -3.379 1.00 0.00 N ATOM 539 CA ASN A 33 -20.205 -35.173 -4.069 1.00 0.00 C ATOM 540 C ASN A 33 -20.452 -36.638 -4.415 1.00 0.00 C ATOM 541 O ASN A 33 -19.544 -37.347 -4.846 1.00 0.00 O ATOM 542 CB ASN A 33 -20.231 -34.325 -5.343 1.00 0.00 C ATOM 543 CG ASN A 33 -19.238 -34.812 -6.381 1.00 0.00 C ATOM 544 OD1 ASN A 33 -18.249 -35.467 -6.052 1.00 0.00 O ATOM 545 ND2 ASN A 33 -19.498 -34.492 -7.644 1.00 0.00 N ATOM 0 H ASN A 33 -18.119 -34.963 -3.996 1.00 0.00 H new ATOM 0 HA ASN A 33 -20.998 -34.838 -3.400 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -21.235 -34.343 -5.768 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -20.010 -33.288 -5.091 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -18.866 -34.791 -8.386 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -20.330 -33.947 -7.871 1.00 0.00 H new ATOM 552 N ALA A 34 -21.689 -37.085 -4.222 1.00 0.00 N ATOM 553 CA ALA A 34 -22.057 -38.464 -4.516 1.00 0.00 C ATOM 554 C ALA A 34 -21.821 -38.795 -5.986 1.00 0.00 C ATOM 555 O ALA A 34 -21.650 -39.958 -6.350 1.00 0.00 O ATOM 556 CB ALA A 34 -23.512 -38.713 -4.144 1.00 0.00 C ATOM 0 H ALA A 34 -22.453 -36.512 -3.863 1.00 0.00 H new ATOM 0 HA ALA A 34 -21.423 -39.118 -3.917 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -23.773 -39.747 -4.369 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -23.652 -38.527 -3.079 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -24.154 -38.044 -4.717 1.00 0.00 H new ATOM 631 N CYS A 39 -14.052 -40.271 -8.469 1.00 0.00 N ATOM 632 CA CYS A 39 -14.065 -40.882 -7.144 1.00 0.00 C ATOM 633 C CYS A 39 -13.100 -40.165 -6.206 1.00 0.00 C ATOM 634 O CYS A 39 -12.280 -40.798 -5.541 1.00 0.00 O ATOM 635 CB CYS A 39 -13.697 -42.363 -7.239 1.00 0.00 C ATOM 636 SG CYS A 39 -14.606 -43.269 -8.513 1.00 0.00 S ATOM 0 HA CYS A 39 -15.073 -40.791 -6.739 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -12.629 -42.449 -7.439 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -13.879 -42.834 -6.273 1.00 0.00 H new ATOM 0 HG CYS A 39 -14.224 -44.512 -8.518 1.00 0.00 H new ATOM 642 N ALA A 40 -13.202 -38.841 -6.158 1.00 0.00 N ATOM 643 CA ALA A 40 -12.339 -38.038 -5.302 1.00 0.00 C ATOM 644 C ALA A 40 -13.092 -36.840 -4.731 1.00 0.00 C ATOM 645 O ALA A 40 -14.096 -36.402 -5.291 1.00 0.00 O ATOM 646 CB ALA A 40 -11.113 -37.574 -6.074 1.00 0.00 C ATOM 0 H ALA A 40 -13.875 -38.302 -6.703 1.00 0.00 H new ATOM 0 HA ALA A 40 -12.015 -38.661 -4.468 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.477 -36.975 -5.422 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.556 -38.442 -6.427 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -11.426 -36.972 -6.927 1.00 0.00 H new ATOM 652 N VAL A 41 -12.600 -36.316 -3.613 1.00 0.00 N ATOM 653 CA VAL A 41 -13.226 -35.169 -2.967 1.00 0.00 C ATOM 654 C VAL A 41 -13.440 -34.029 -3.957 1.00 0.00 C ATOM 655 O VAL A 41 -12.702 -33.896 -4.934 1.00 0.00 O ATOM 656 CB VAL A 41 -12.378 -34.657 -1.787 1.00 0.00 C ATOM 657 CG1 VAL A 41 -13.125 -33.575 -1.023 1.00 0.00 C ATOM 658 CG2 VAL A 41 -11.999 -35.807 -0.866 1.00 0.00 C ATOM 0 H VAL A 41 -11.770 -36.668 -3.136 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.192 -35.506 -2.591 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.461 -34.221 -2.183 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -12.511 -33.225 -0.193 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -13.341 -32.741 -1.691 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -14.059 -33.982 -0.636 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.400 -35.428 -0.038 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -12.903 -36.274 -0.476 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -11.421 -36.544 -1.423 1.00 0.00 H new ATOM 668 N ILE A 42 -14.453 -33.210 -3.698 1.00 0.00 N ATOM 669 CA ILE A 42 -14.762 -32.080 -4.565 1.00 0.00 C ATOM 670 C ILE A 42 -14.051 -30.815 -4.096 1.00 0.00 C ATOM 671 O ILE A 42 -13.399 -30.129 -4.883 1.00 0.00 O ATOM 672 CB ILE A 42 -16.278 -31.812 -4.622 1.00 0.00 C ATOM 673 CG1 ILE A 42 -17.000 -32.983 -5.290 1.00 0.00 C ATOM 674 CG2 ILE A 42 -16.559 -30.515 -5.366 1.00 0.00 C ATOM 675 CD1 ILE A 42 -16.651 -33.154 -6.752 1.00 0.00 C ATOM 0 H ILE A 42 -15.074 -33.308 -2.895 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.410 -32.343 -5.562 1.00 0.00 H new ATOM 0 HB ILE A 42 -16.653 -31.712 -3.603 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.756 -33.902 -4.757 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -18.076 -32.837 -5.196 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.634 -30.339 -5.398 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -16.071 -29.687 -4.851 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -16.173 -30.588 -6.383 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -17.200 -34.003 -7.160 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -16.921 -32.251 -7.299 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.580 -33.332 -6.852 1.00 0.00 H new ATOM 687 N TYR A 43 -14.179 -30.514 -2.809 1.00 0.00 N ATOM 688 CA TYR A 43 -13.549 -29.332 -2.234 1.00 0.00 C ATOM 689 C TYR A 43 -12.825 -29.677 -0.936 1.00 0.00 C ATOM 690 O TYR A 43 -13.133 -30.678 -0.287 1.00 0.00 O ATOM 691 CB TYR A 43 -14.594 -28.246 -1.975 1.00 0.00 C ATOM 692 CG TYR A 43 -14.258 -26.917 -2.613 1.00 0.00 C ATOM 693 CD1 TYR A 43 -14.187 -26.785 -3.994 1.00 0.00 C ATOM 694 CD2 TYR A 43 -14.009 -25.793 -1.834 1.00 0.00 C ATOM 695 CE1 TYR A 43 -13.879 -25.573 -4.582 1.00 0.00 C ATOM 696 CE2 TYR A 43 -13.702 -24.577 -2.413 1.00 0.00 C ATOM 697 CZ TYR A 43 -13.638 -24.472 -3.787 1.00 0.00 C ATOM 698 OH TYR A 43 -13.331 -23.263 -4.367 1.00 0.00 O ATOM 0 H TYR A 43 -14.714 -31.073 -2.144 1.00 0.00 H new ATOM 0 HA TYR A 43 -12.816 -28.958 -2.949 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.559 -28.586 -2.350 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.701 -28.106 -0.899 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -14.376 -27.645 -4.619 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -14.056 -25.872 -0.758 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.827 -25.488 -5.657 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -13.513 -23.713 -1.793 1.00 0.00 H new ATOM 0 HH TYR A 43 -13.191 -22.591 -3.668 1.00 0.00 H new ATOM 708 N CYS A 44 -11.863 -28.840 -0.562 1.00 0.00 N ATOM 709 CA CYS A 44 -11.094 -29.055 0.658 1.00 0.00 C ATOM 710 C CYS A 44 -10.526 -27.740 1.182 1.00 0.00 C ATOM 711 O CYS A 44 -10.289 -26.807 0.416 1.00 0.00 O ATOM 712 CB CYS A 44 -9.960 -30.049 0.404 1.00 0.00 C ATOM 713 SG CYS A 44 -8.574 -29.362 -0.532 1.00 0.00 S ATOM 0 H CYS A 44 -11.597 -28.006 -1.086 1.00 0.00 H new ATOM 0 HA CYS A 44 -11.765 -29.466 1.412 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -9.591 -30.416 1.362 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -10.358 -30.909 -0.135 1.00 0.00 H new ATOM 0 HG CYS A 44 -8.700 -28.070 -0.609 1.00 0.00 H new ATOM 719 N ASN A 45 -10.313 -27.674 2.492 1.00 0.00 N ATOM 720 CA ASN A 45 -9.775 -26.471 3.119 1.00 0.00 C ATOM 721 C ASN A 45 -8.252 -26.443 3.025 1.00 0.00 C ATOM 722 O ASN A 45 -7.644 -27.299 2.381 1.00 0.00 O ATOM 723 CB ASN A 45 -10.208 -26.398 4.584 1.00 0.00 C ATOM 724 CG ASN A 45 -10.742 -25.030 4.961 1.00 0.00 C ATOM 725 OD1 ASN A 45 -10.200 -24.360 5.841 1.00 0.00 O ATOM 726 ND2 ASN A 45 -11.810 -24.608 4.295 1.00 0.00 N ATOM 0 H ASN A 45 -10.504 -28.438 3.140 1.00 0.00 H new ATOM 0 HA ASN A 45 -10.170 -25.606 2.587 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -10.976 -27.149 4.771 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -9.360 -26.643 5.223 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -12.214 -23.695 4.505 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -12.227 -25.197 3.574 1.00 0.00 H new ATOM 733 N ASP A 46 -7.643 -25.455 3.671 1.00 0.00 N ATOM 734 CA ASP A 46 -6.192 -25.316 3.662 1.00 0.00 C ATOM 735 C ASP A 46 -5.542 -26.334 4.594 1.00 0.00 C ATOM 736 O ASP A 46 -4.503 -26.909 4.275 1.00 0.00 O ATOM 737 CB ASP A 46 -5.791 -23.899 4.075 1.00 0.00 C ATOM 738 CG ASP A 46 -4.360 -23.569 3.701 1.00 0.00 C ATOM 739 OD1 ASP A 46 -3.442 -24.005 4.426 1.00 0.00 O ATOM 740 OD2 ASP A 46 -4.157 -22.876 2.682 1.00 0.00 O ATOM 0 H ASP A 46 -8.132 -24.738 4.208 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.841 -25.503 2.647 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.462 -23.182 3.601 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -5.916 -23.789 5.152 1.00 0.00 H new ATOM 745 N GLY A 47 -6.163 -26.551 5.750 1.00 0.00 N ATOM 746 CA GLY A 47 -5.631 -27.498 6.712 1.00 0.00 C ATOM 747 C GLY A 47 -5.423 -28.876 6.115 1.00 0.00 C ATOM 748 O GLY A 47 -4.357 -29.473 6.270 1.00 0.00 O ATOM 0 H GLY A 47 -7.025 -26.088 6.037 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.682 -27.125 7.097 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -6.312 -27.572 7.560 1.00 0.00 H new ATOM 752 N PHE A 48 -6.443 -29.383 5.431 1.00 0.00 N ATOM 753 CA PHE A 48 -6.368 -30.701 4.811 1.00 0.00 C ATOM 754 C PHE A 48 -5.149 -30.804 3.899 1.00 0.00 C ATOM 755 O PHE A 48 -4.356 -31.740 4.009 1.00 0.00 O ATOM 756 CB PHE A 48 -7.642 -30.985 4.012 1.00 0.00 C ATOM 757 CG PHE A 48 -7.577 -32.255 3.212 1.00 0.00 C ATOM 758 CD1 PHE A 48 -7.508 -33.485 3.846 1.00 0.00 C ATOM 759 CD2 PHE A 48 -7.587 -32.218 1.827 1.00 0.00 C ATOM 760 CE1 PHE A 48 -7.448 -34.655 3.113 1.00 0.00 C ATOM 761 CE2 PHE A 48 -7.527 -33.385 1.089 1.00 0.00 C ATOM 762 CZ PHE A 48 -7.459 -34.605 1.733 1.00 0.00 C ATOM 0 H PHE A 48 -7.331 -28.901 5.292 1.00 0.00 H new ATOM 0 HA PHE A 48 -6.271 -31.443 5.603 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -8.487 -31.040 4.698 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.833 -30.150 3.338 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.501 -33.530 4.925 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.642 -31.267 1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -7.393 -35.608 3.619 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.533 -33.343 0.010 1.00 0.00 H new ATOM 0 HZ PHE A 48 -7.415 -35.518 1.158 1.00 0.00 H new ATOM 772 N CYS A 49 -5.007 -29.837 3.000 1.00 0.00 N ATOM 773 CA CYS A 49 -3.885 -29.819 2.067 1.00 0.00 C ATOM 774 C CYS A 49 -2.562 -29.665 2.811 1.00 0.00 C ATOM 775 O CYS A 49 -1.534 -30.185 2.380 1.00 0.00 O ATOM 776 CB CYS A 49 -4.052 -28.682 1.059 1.00 0.00 C ATOM 777 SG CYS A 49 -3.453 -29.074 -0.602 1.00 0.00 S ATOM 0 H CYS A 49 -5.654 -29.055 2.897 1.00 0.00 H new ATOM 0 HA CYS A 49 -3.873 -30.769 1.533 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -5.107 -28.416 1.000 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -3.522 -27.804 1.427 1.00 0.00 H new ATOM 0 HG CYS A 49 -2.358 -29.769 -0.516 1.00 0.00 H new ATOM 783 N GLU A 50 -2.598 -28.947 3.929 1.00 0.00 N ATOM 784 CA GLU A 50 -1.401 -28.724 4.731 1.00 0.00 C ATOM 785 C GLU A 50 -1.029 -29.979 5.515 1.00 0.00 C ATOM 786 O GLU A 50 0.128 -30.168 5.894 1.00 0.00 O ATOM 787 CB GLU A 50 -1.615 -27.553 5.693 1.00 0.00 C ATOM 788 CG GLU A 50 -1.784 -27.979 7.142 1.00 0.00 C ATOM 789 CD GLU A 50 -0.458 -28.243 7.830 1.00 0.00 C ATOM 790 OE1 GLU A 50 0.592 -27.924 7.235 1.00 0.00 O ATOM 791 OE2 GLU A 50 -0.471 -28.767 8.963 1.00 0.00 O ATOM 0 H GLU A 50 -3.442 -28.510 4.300 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.581 -28.484 4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -0.766 -26.873 5.619 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.498 -26.995 5.382 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.323 -27.202 7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -2.396 -28.880 7.183 1.00 0.00 H new ATOM 798 N LEU A 51 -2.017 -30.834 5.755 1.00 0.00 N ATOM 799 CA LEU A 51 -1.795 -32.072 6.495 1.00 0.00 C ATOM 800 C LEU A 51 -1.208 -33.149 5.589 1.00 0.00 C ATOM 801 O LEU A 51 -0.131 -33.682 5.859 1.00 0.00 O ATOM 802 CB LEU A 51 -3.107 -32.564 7.108 1.00 0.00 C ATOM 803 CG LEU A 51 -3.193 -32.516 8.634 1.00 0.00 C ATOM 804 CD1 LEU A 51 -4.518 -33.092 9.112 1.00 0.00 C ATOM 805 CD2 LEU A 51 -2.027 -33.268 9.259 1.00 0.00 C ATOM 0 H LEU A 51 -2.979 -30.693 5.448 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.082 -31.867 7.294 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.922 -31.967 6.699 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.272 -33.592 6.787 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.137 -31.474 8.949 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -4.562 -33.050 10.200 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.340 -32.511 8.693 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -4.603 -34.128 8.785 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.105 -33.223 10.345 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.051 -34.309 8.936 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.089 -32.812 8.944 1.00 0.00 H new ATOM 817 N CYS A 52 -1.921 -33.464 4.513 1.00 0.00 N ATOM 818 CA CYS A 52 -1.470 -34.477 3.566 1.00 0.00 C ATOM 819 C CYS A 52 -0.457 -33.893 2.587 1.00 0.00 C ATOM 820 O CYS A 52 0.116 -34.612 1.769 1.00 0.00 O ATOM 821 CB CYS A 52 -2.661 -35.056 2.801 1.00 0.00 C ATOM 822 SG CYS A 52 -3.615 -33.827 1.880 1.00 0.00 S ATOM 0 H CYS A 52 -2.814 -33.032 4.275 1.00 0.00 H new ATOM 0 HA CYS A 52 -0.986 -35.275 4.129 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -2.299 -35.814 2.107 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -3.322 -35.559 3.506 1.00 0.00 H new ATOM 0 HG CYS A 52 -3.884 -32.818 2.654 1.00 0.00 H new ATOM 828 N GLY A 53 -0.241 -32.584 2.676 1.00 0.00 N ATOM 829 CA GLY A 53 0.702 -31.926 1.792 1.00 0.00 C ATOM 830 C GLY A 53 0.466 -32.267 0.334 1.00 0.00 C ATOM 831 O GLY A 53 1.401 -32.285 -0.466 1.00 0.00 O ATOM 0 H GLY A 53 -0.703 -31.968 3.345 1.00 0.00 H new ATOM 0 HA2 GLY A 53 0.628 -30.847 1.926 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.716 -32.213 2.069 1.00 0.00 H new ATOM 835 N TYR A 54 -0.787 -32.542 -0.012 1.00 0.00 N ATOM 836 CA TYR A 54 -1.143 -32.889 -1.382 1.00 0.00 C ATOM 837 C TYR A 54 -0.769 -31.765 -2.344 1.00 0.00 C ATOM 838 O TYR A 54 -1.019 -30.591 -2.071 1.00 0.00 O ATOM 839 CB TYR A 54 -2.640 -33.185 -1.483 1.00 0.00 C ATOM 840 CG TYR A 54 -2.967 -34.661 -1.491 1.00 0.00 C ATOM 841 CD1 TYR A 54 -2.258 -35.554 -0.697 1.00 0.00 C ATOM 842 CD2 TYR A 54 -3.983 -35.164 -2.294 1.00 0.00 C ATOM 843 CE1 TYR A 54 -2.552 -36.903 -0.701 1.00 0.00 C ATOM 844 CE2 TYR A 54 -4.285 -36.512 -2.304 1.00 0.00 C ATOM 845 CZ TYR A 54 -3.567 -37.378 -1.506 1.00 0.00 C ATOM 846 OH TYR A 54 -3.863 -38.721 -1.514 1.00 0.00 O ATOM 0 H TYR A 54 -1.573 -32.531 0.638 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.583 -33.782 -1.660 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -3.152 -32.713 -0.645 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -3.031 -32.730 -2.393 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.463 -35.186 -0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.547 -34.489 -2.921 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -1.990 -37.583 -0.077 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.079 -36.886 -2.933 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.901 -39.042 -2.439 1.00 0.00 H new ATOM 856 N SER A 55 -0.170 -32.134 -3.471 1.00 0.00 N ATOM 857 CA SER A 55 0.241 -31.158 -4.473 1.00 0.00 C ATOM 858 C SER A 55 -0.800 -31.046 -5.582 1.00 0.00 C ATOM 859 O SER A 55 -1.754 -31.822 -5.634 1.00 0.00 O ATOM 860 CB SER A 55 1.596 -31.547 -5.068 1.00 0.00 C ATOM 861 OG SER A 55 1.834 -32.937 -4.929 1.00 0.00 O ATOM 0 H SER A 55 0.042 -33.102 -3.713 1.00 0.00 H new ATOM 0 HA SER A 55 0.331 -30.188 -3.984 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.626 -31.274 -6.123 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.389 -30.988 -4.571 1.00 0.00 H new ATOM 0 HG SER A 55 2.705 -33.160 -5.318 1.00 0.00 H new ATOM 867 N ARG A 56 -0.610 -30.074 -6.468 1.00 0.00 N ATOM 868 CA ARG A 56 -1.533 -29.858 -7.576 1.00 0.00 C ATOM 869 C ARG A 56 -1.757 -31.149 -8.356 1.00 0.00 C ATOM 870 O ARG A 56 -2.856 -31.408 -8.846 1.00 0.00 O ATOM 871 CB ARG A 56 -0.997 -28.771 -8.510 1.00 0.00 C ATOM 872 CG ARG A 56 -1.925 -28.453 -9.670 1.00 0.00 C ATOM 873 CD ARG A 56 -1.731 -27.028 -10.164 1.00 0.00 C ATOM 874 NE ARG A 56 -2.179 -26.861 -11.544 1.00 0.00 N ATOM 875 CZ ARG A 56 -1.538 -27.368 -12.592 1.00 0.00 C ATOM 876 NH1 ARG A 56 -0.427 -28.071 -12.416 1.00 0.00 N ATOM 877 NH2 ARG A 56 -2.008 -27.174 -13.817 1.00 0.00 N ATOM 0 H ARG A 56 0.175 -29.423 -6.440 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.488 -29.533 -7.163 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -0.824 -27.862 -7.934 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.031 -29.087 -8.904 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.740 -29.151 -10.487 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -2.960 -28.594 -9.358 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -2.281 -26.343 -9.519 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.677 -26.759 -10.090 1.00 0.00 H new ATOM 0 HE ARG A 56 -3.031 -26.326 -11.713 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -0.063 -28.223 -11.475 1.00 0.00 H new ATOM 0 HH12 ARG A 56 0.064 -28.459 -13.221 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -2.863 -26.635 -13.956 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -1.515 -27.564 -14.620 1.00 0.00 H new ATOM 891 N ALA A 57 -0.707 -31.956 -8.469 1.00 0.00 N ATOM 892 CA ALA A 57 -0.790 -33.221 -9.189 1.00 0.00 C ATOM 893 C ALA A 57 -1.762 -34.178 -8.507 1.00 0.00 C ATOM 894 O ALA A 57 -2.422 -34.980 -9.167 1.00 0.00 O ATOM 895 CB ALA A 57 0.588 -33.857 -9.299 1.00 0.00 C ATOM 0 H ALA A 57 0.211 -31.756 -8.071 1.00 0.00 H new ATOM 0 HA ALA A 57 -1.165 -33.016 -10.192 1.00 0.00 H new ATOM 0 HB1 ALA A 57 0.511 -34.801 -9.839 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.257 -33.185 -9.837 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.984 -34.041 -8.301 1.00 0.00 H new ATOM 901 N GLU A 58 -1.845 -34.087 -7.183 1.00 0.00 N ATOM 902 CA GLU A 58 -2.736 -34.947 -6.413 1.00 0.00 C ATOM 903 C GLU A 58 -4.162 -34.405 -6.429 1.00 0.00 C ATOM 904 O GLU A 58 -5.122 -35.144 -6.205 1.00 0.00 O ATOM 905 CB GLU A 58 -2.241 -35.070 -4.971 1.00 0.00 C ATOM 906 CG GLU A 58 -0.756 -35.373 -4.860 1.00 0.00 C ATOM 907 CD GLU A 58 -0.380 -35.966 -3.516 1.00 0.00 C ATOM 908 OE1 GLU A 58 -0.976 -36.994 -3.133 1.00 0.00 O ATOM 909 OE2 GLU A 58 0.511 -35.401 -2.847 1.00 0.00 O ATOM 0 H GLU A 58 -1.306 -33.427 -6.622 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.736 -35.934 -6.875 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.454 -34.141 -4.442 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.802 -35.858 -4.469 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.470 -36.066 -5.651 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.189 -34.456 -5.020 1.00 0.00 H new ATOM 916 N VAL A 59 -4.294 -33.109 -6.695 1.00 0.00 N ATOM 917 CA VAL A 59 -5.602 -32.467 -6.741 1.00 0.00 C ATOM 918 C VAL A 59 -6.505 -33.133 -7.773 1.00 0.00 C ATOM 919 O VAL A 59 -7.729 -33.027 -7.702 1.00 0.00 O ATOM 920 CB VAL A 59 -5.480 -30.968 -7.072 1.00 0.00 C ATOM 921 CG1 VAL A 59 -6.858 -30.343 -7.234 1.00 0.00 C ATOM 922 CG2 VAL A 59 -4.683 -30.248 -5.995 1.00 0.00 C ATOM 0 H VAL A 59 -3.511 -32.483 -6.882 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.044 -32.578 -5.751 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.947 -30.865 -8.017 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.752 -29.284 -7.468 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.391 -30.842 -8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.420 -30.456 -6.307 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -4.607 -29.190 -6.245 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -5.187 -30.359 -5.035 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.684 -30.679 -5.932 1.00 0.00 H new ATOM 932 N MET A 60 -5.893 -33.821 -8.731 1.00 0.00 N ATOM 933 CA MET A 60 -6.643 -34.506 -9.778 1.00 0.00 C ATOM 934 C MET A 60 -7.177 -35.844 -9.276 1.00 0.00 C ATOM 935 O MET A 60 -7.764 -36.612 -10.038 1.00 0.00 O ATOM 936 CB MET A 60 -5.759 -34.725 -11.007 1.00 0.00 C ATOM 937 CG MET A 60 -5.093 -33.455 -11.511 1.00 0.00 C ATOM 938 SD MET A 60 -4.653 -33.547 -13.257 1.00 0.00 S ATOM 939 CE MET A 60 -2.955 -32.977 -13.209 1.00 0.00 C ATOM 0 H MET A 60 -4.880 -33.919 -8.804 1.00 0.00 H new ATOM 0 HA MET A 60 -7.489 -33.878 -10.056 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.989 -35.458 -10.765 1.00 0.00 H new ATOM 0 HB3 MET A 60 -6.363 -35.151 -11.808 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.764 -32.611 -11.353 1.00 0.00 H new ATOM 0 HG3 MET A 60 -4.195 -33.263 -10.924 1.00 0.00 H new ATOM 0 HE1 MET A 60 -2.542 -32.978 -14.218 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.922 -31.966 -12.804 1.00 0.00 H new ATOM 0 HE3 MET A 60 -2.366 -33.641 -12.576 1.00 0.00 H new ATOM 949 N GLN A 61 -6.970 -36.115 -7.992 1.00 0.00 N ATOM 950 CA GLN A 61 -7.431 -37.361 -7.391 1.00 0.00 C ATOM 951 C GLN A 61 -7.198 -37.356 -5.883 1.00 0.00 C ATOM 952 O GLN A 61 -6.217 -37.917 -5.395 1.00 0.00 O ATOM 953 CB GLN A 61 -6.714 -38.554 -8.026 1.00 0.00 C ATOM 954 CG GLN A 61 -7.074 -39.888 -7.392 1.00 0.00 C ATOM 955 CD GLN A 61 -7.273 -40.986 -8.417 1.00 0.00 C ATOM 956 OE1 GLN A 61 -8.400 -41.407 -8.682 1.00 0.00 O ATOM 957 NE2 GLN A 61 -6.178 -41.458 -9.000 1.00 0.00 N ATOM 0 H GLN A 61 -6.486 -35.489 -7.348 1.00 0.00 H new ATOM 0 HA GLN A 61 -8.502 -37.450 -7.575 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -6.956 -38.589 -9.088 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -5.637 -38.403 -7.949 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -6.285 -40.181 -6.699 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -7.986 -39.773 -6.806 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -5.264 -41.080 -8.750 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -6.250 -42.199 -9.698 1.00 0.00 H new ATOM 966 N ARG A 62 -8.106 -36.720 -5.151 1.00 0.00 N ATOM 967 CA ARG A 62 -7.999 -36.641 -3.699 1.00 0.00 C ATOM 968 C ARG A 62 -8.994 -37.584 -3.029 1.00 0.00 C ATOM 969 O ARG A 62 -10.158 -37.246 -2.812 1.00 0.00 O ATOM 970 CB ARG A 62 -8.240 -35.207 -3.226 1.00 0.00 C ATOM 971 CG ARG A 62 -7.550 -34.158 -4.083 1.00 0.00 C ATOM 972 CD ARG A 62 -8.546 -33.404 -4.949 1.00 0.00 C ATOM 973 NE ARG A 62 -9.609 -32.792 -4.156 1.00 0.00 N ATOM 974 CZ ARG A 62 -9.486 -31.620 -3.543 1.00 0.00 C ATOM 975 NH1 ARG A 62 -8.353 -30.937 -3.632 1.00 0.00 N ATOM 976 NH2 ARG A 62 -10.497 -31.128 -2.839 1.00 0.00 N ATOM 0 H ARG A 62 -8.925 -36.252 -5.540 1.00 0.00 H new ATOM 0 HA ARG A 62 -6.991 -36.944 -3.417 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -9.312 -35.011 -3.220 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.892 -35.110 -2.198 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -7.018 -33.455 -3.442 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.804 -34.638 -4.717 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.024 -32.631 -5.513 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.984 -34.088 -5.676 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.494 -33.292 -4.068 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.573 -31.311 -4.172 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.261 -30.037 -3.160 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.371 -31.650 -2.768 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -10.401 -30.228 -2.369 1.00 0.00 H new ATOM 990 N PRO A 63 -8.527 -38.796 -2.693 1.00 0.00 N ATOM 991 CA PRO A 63 -9.360 -39.812 -2.042 1.00 0.00 C ATOM 992 C PRO A 63 -9.711 -39.441 -0.606 1.00 0.00 C ATOM 993 O PRO A 63 -8.856 -38.987 0.155 1.00 0.00 O ATOM 994 CB PRO A 63 -8.479 -41.064 -2.071 1.00 0.00 C ATOM 995 CG PRO A 63 -7.084 -40.544 -2.130 1.00 0.00 C ATOM 996 CD PRO A 63 -7.151 -39.267 -2.921 1.00 0.00 C ATOM 0 HA PRO A 63 -10.319 -39.937 -2.545 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.635 -41.679 -1.185 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -8.706 -41.688 -2.936 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -6.692 -40.363 -1.129 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.419 -41.264 -2.607 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.415 -38.541 -2.575 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.955 -39.439 -3.979 1.00 0.00 H new ATOM 1004 N CYS A 64 -10.973 -39.637 -0.241 1.00 0.00 N ATOM 1005 CA CYS A 64 -11.438 -39.322 1.106 1.00 0.00 C ATOM 1006 C CYS A 64 -11.072 -40.436 2.081 1.00 0.00 C ATOM 1007 O CYS A 64 -11.366 -40.354 3.274 1.00 0.00 O ATOM 1008 CB CYS A 64 -12.951 -39.103 1.107 1.00 0.00 C ATOM 1009 SG CYS A 64 -13.460 -37.475 1.707 1.00 0.00 S ATOM 0 H CYS A 64 -11.693 -40.012 -0.858 1.00 0.00 H new ATOM 0 HA CYS A 64 -10.946 -38.405 1.429 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -13.328 -39.239 0.093 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.418 -39.869 1.726 1.00 0.00 H new ATOM 0 HG CYS A 64 -14.440 -37.030 0.977 1.00 0.00 H new ATOM 1015 N THR A 65 -10.431 -41.480 1.566 1.00 0.00 N ATOM 1016 CA THR A 65 -10.028 -42.613 2.390 1.00 0.00 C ATOM 1017 C THR A 65 -8.636 -42.400 2.975 1.00 0.00 C ATOM 1018 O THR A 65 -8.153 -43.213 3.764 1.00 0.00 O ATOM 1019 CB THR A 65 -10.038 -43.926 1.584 1.00 0.00 C ATOM 1020 OG1 THR A 65 -10.962 -43.826 0.496 1.00 0.00 O ATOM 1021 CG2 THR A 65 -10.416 -45.102 2.472 1.00 0.00 C ATOM 0 H THR A 65 -10.179 -41.565 0.581 1.00 0.00 H new ATOM 0 HA THR A 65 -10.753 -42.687 3.201 1.00 0.00 H new ATOM 0 HB THR A 65 -9.035 -44.094 1.192 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.961 -44.664 -0.012 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.417 -46.018 1.882 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.693 -45.193 3.283 1.00 0.00 H new ATOM 0 HG23 THR A 65 -11.410 -44.938 2.889 1.00 0.00 H new ATOM 1029 N CYS A 66 -7.998 -41.302 2.585 1.00 0.00 N ATOM 1030 CA CYS A 66 -6.660 -40.982 3.072 1.00 0.00 C ATOM 1031 C CYS A 66 -5.717 -42.167 2.888 1.00 0.00 C ATOM 1032 O CYS A 66 -4.757 -42.330 3.641 1.00 0.00 O ATOM 1033 CB CYS A 66 -6.714 -40.581 4.546 1.00 0.00 C ATOM 1034 SG CYS A 66 -8.005 -39.377 4.937 1.00 0.00 S ATOM 0 H CYS A 66 -8.385 -40.619 1.934 1.00 0.00 H new ATOM 0 HA CYS A 66 -6.278 -40.144 2.489 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -6.871 -41.475 5.149 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -5.747 -40.168 4.835 1.00 0.00 H new ATOM 0 HG CYS A 66 -8.002 -39.137 6.215 1.00 0.00 H new ATOM 1040 N ASP A 67 -5.999 -42.990 1.885 1.00 0.00 N ATOM 1041 CA ASP A 67 -5.176 -44.161 1.603 1.00 0.00 C ATOM 1042 C ASP A 67 -3.717 -43.764 1.403 1.00 0.00 C ATOM 1043 O ASP A 67 -2.810 -44.408 1.931 1.00 0.00 O ATOM 1044 CB ASP A 67 -5.694 -44.888 0.361 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.648 -45.793 -0.259 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -3.981 -46.533 0.495 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -4.496 -45.762 -1.498 1.00 0.00 O ATOM 0 H ASP A 67 -6.791 -42.869 1.253 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.237 -44.832 2.460 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -6.569 -45.480 0.629 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.019 -44.154 -0.377 1.00 0.00 H new ATOM 1052 N PHE A 68 -3.497 -42.700 0.637 1.00 0.00 N ATOM 1053 CA PHE A 68 -2.148 -42.219 0.366 1.00 0.00 C ATOM 1054 C PHE A 68 -1.514 -41.638 1.627 1.00 0.00 C ATOM 1055 O PHE A 68 -0.337 -41.276 1.634 1.00 0.00 O ATOM 1056 CB PHE A 68 -2.174 -41.161 -0.739 1.00 0.00 C ATOM 1057 CG PHE A 68 -1.722 -41.678 -2.075 1.00 0.00 C ATOM 1058 CD1 PHE A 68 -2.136 -42.920 -2.527 1.00 0.00 C ATOM 1059 CD2 PHE A 68 -0.883 -40.922 -2.877 1.00 0.00 C ATOM 1060 CE1 PHE A 68 -1.722 -43.399 -3.756 1.00 0.00 C ATOM 1061 CE2 PHE A 68 -0.467 -41.395 -4.107 1.00 0.00 C ATOM 1062 CZ PHE A 68 -0.886 -42.636 -4.547 1.00 0.00 C ATOM 0 H PHE A 68 -4.236 -42.155 0.193 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.547 -43.066 0.035 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.187 -40.771 -0.833 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.537 -40.326 -0.447 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.790 -43.521 -1.912 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.550 -39.952 -2.537 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.052 -44.369 -4.097 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.185 -40.795 -4.724 1.00 0.00 H new ATOM 0 HZ PHE A 68 -0.560 -43.008 -5.507 1.00 0.00 H new ATOM 1072 N LEU A 69 -2.303 -41.551 2.692 1.00 0.00 N ATOM 1073 CA LEU A 69 -1.821 -41.014 3.960 1.00 0.00 C ATOM 1074 C LEU A 69 -1.635 -42.127 4.987 1.00 0.00 C ATOM 1075 O LEU A 69 -1.101 -41.900 6.074 1.00 0.00 O ATOM 1076 CB LEU A 69 -2.797 -39.967 4.497 1.00 0.00 C ATOM 1077 CG LEU A 69 -2.733 -38.589 3.837 1.00 0.00 C ATOM 1078 CD1 LEU A 69 -4.133 -38.039 3.613 1.00 0.00 C ATOM 1079 CD2 LEU A 69 -1.911 -37.629 4.685 1.00 0.00 C ATOM 0 H LEU A 69 -3.280 -41.845 2.703 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.854 -40.543 3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.810 -40.354 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.616 -39.845 5.565 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.246 -38.694 2.867 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.068 -37.058 3.143 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.690 -38.716 2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.646 -37.949 4.571 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.876 -36.653 4.200 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.369 -37.529 5.669 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.898 -38.016 4.794 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.076 -43.330 4.635 1.00 0.00 N ATOM 1092 CA HIS A 70 -1.956 -44.479 5.525 1.00 0.00 C ATOM 1093 C HIS A 70 -0.727 -45.312 5.174 1.00 0.00 C ATOM 1094 O HIS A 70 -0.321 -45.379 4.015 1.00 0.00 O ATOM 1095 CB HIS A 70 -3.213 -45.346 5.447 1.00 0.00 C ATOM 1096 CG HIS A 70 -3.062 -46.681 6.109 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -3.567 -46.962 7.361 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -2.460 -47.816 5.684 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -3.280 -48.212 7.678 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -2.609 -48.753 6.677 1.00 0.00 N ATOM 0 H HIS A 70 -2.520 -43.535 3.740 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.843 -44.107 6.543 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.042 -44.812 5.910 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.476 -45.497 4.400 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -1.956 -47.959 4.739 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.548 -48.708 8.599 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -2.259 -49.710 6.647 1.00 0.00 H new ATOM 1108 N GLY A 71 -0.138 -45.945 6.184 1.00 0.00 N ATOM 1109 CA GLY A 71 1.039 -46.764 5.962 1.00 0.00 C ATOM 1110 C GLY A 71 0.949 -48.110 6.654 1.00 0.00 C ATOM 1111 O GLY A 71 -0.001 -48.394 7.383 1.00 0.00 O ATOM 0 H GLY A 71 -0.455 -45.905 7.153 1.00 0.00 H new ATOM 0 HA2 GLY A 71 1.174 -46.918 4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.920 -46.233 6.321 1.00 0.00 H new ATOM 1115 N PRO A 72 1.955 -48.966 6.425 1.00 0.00 N ATOM 1116 CA PRO A 72 2.008 -50.304 7.022 1.00 0.00 C ATOM 1117 C PRO A 72 2.258 -50.258 8.526 1.00 0.00 C ATOM 1118 O PRO A 72 2.337 -51.296 9.183 1.00 0.00 O ATOM 1119 CB PRO A 72 3.186 -50.967 6.304 1.00 0.00 C ATOM 1120 CG PRO A 72 4.052 -49.835 5.871 1.00 0.00 C ATOM 1121 CD PRO A 72 3.120 -48.694 5.566 1.00 0.00 C ATOM 0 HA PRO A 72 1.065 -50.839 6.907 1.00 0.00 H new ATOM 0 HB2 PRO A 72 3.723 -51.645 6.967 1.00 0.00 H new ATOM 0 HB3 PRO A 72 2.849 -51.556 5.451 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.759 -49.563 6.655 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.638 -50.106 4.993 1.00 0.00 H new ATOM 0 HD2 PRO A 72 3.574 -47.731 5.798 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.845 -48.671 4.512 1.00 0.00 H new ATOM 1129 N ARG A 73 2.382 -49.049 9.064 1.00 0.00 N ATOM 1130 CA ARG A 73 2.624 -48.869 10.490 1.00 0.00 C ATOM 1131 C ARG A 73 1.359 -48.396 11.201 1.00 0.00 C ATOM 1132 O ARG A 73 1.240 -48.509 12.421 1.00 0.00 O ATOM 1133 CB ARG A 73 3.754 -47.863 10.714 1.00 0.00 C ATOM 1134 CG ARG A 73 4.838 -48.363 11.655 1.00 0.00 C ATOM 1135 CD ARG A 73 5.070 -47.394 12.804 1.00 0.00 C ATOM 1136 NE ARG A 73 5.807 -48.013 13.902 1.00 0.00 N ATOM 1137 CZ ARG A 73 6.023 -47.418 15.070 1.00 0.00 C ATOM 1138 NH1 ARG A 73 5.562 -46.195 15.289 1.00 0.00 N ATOM 1139 NH2 ARG A 73 6.703 -48.047 16.020 1.00 0.00 N ATOM 0 H ARG A 73 2.319 -48.180 8.534 1.00 0.00 H new ATOM 0 HA ARG A 73 2.916 -49.832 10.908 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.205 -47.616 9.753 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.334 -46.941 11.115 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.555 -49.338 12.052 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.767 -48.501 11.101 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.621 -46.527 12.441 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.110 -47.031 13.171 1.00 0.00 H new ATOM 0 HE ARG A 73 6.176 -48.954 13.765 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.040 -45.709 14.560 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.729 -45.740 16.187 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.060 -48.988 15.854 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.869 -47.590 16.917 1.00 0.00 H new ATOM 1153 N THR A 74 0.416 -47.865 10.429 1.00 0.00 N ATOM 1154 CA THR A 74 -0.839 -47.374 10.984 1.00 0.00 C ATOM 1155 C THR A 74 -1.741 -48.527 11.409 1.00 0.00 C ATOM 1156 O THR A 74 -1.563 -49.661 10.967 1.00 0.00 O ATOM 1157 CB THR A 74 -1.594 -46.492 9.971 1.00 0.00 C ATOM 1158 OG1 THR A 74 -0.841 -46.385 8.758 1.00 0.00 O ATOM 1159 CG2 THR A 74 -1.846 -45.105 10.542 1.00 0.00 C ATOM 0 H THR A 74 0.498 -47.764 9.417 1.00 0.00 H new ATOM 0 HA THR A 74 -0.585 -46.774 11.858 1.00 0.00 H new ATOM 0 HB THR A 74 -2.556 -46.960 9.761 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.879 -47.236 8.273 1.00 0.00 H new ATOM 0 HG21 THR A 74 -2.380 -44.501 9.808 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.445 -45.188 11.449 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.894 -44.630 10.778 1.00 0.00 H new ATOM 1167 N GLN A 75 -2.710 -48.228 12.268 1.00 0.00 N ATOM 1168 CA GLN A 75 -3.641 -49.241 12.752 1.00 0.00 C ATOM 1169 C GLN A 75 -4.620 -49.648 11.656 1.00 0.00 C ATOM 1170 O GLN A 75 -5.057 -48.817 10.860 1.00 0.00 O ATOM 1171 CB GLN A 75 -4.406 -48.720 13.970 1.00 0.00 C ATOM 1172 CG GLN A 75 -3.519 -48.047 15.004 1.00 0.00 C ATOM 1173 CD GLN A 75 -2.225 -48.800 15.242 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -2.208 -50.030 15.282 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -1.132 -48.063 15.402 1.00 0.00 N ATOM 0 H GLN A 75 -2.871 -47.293 12.643 1.00 0.00 H new ATOM 0 HA GLN A 75 -3.065 -50.119 13.043 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.163 -48.011 13.637 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -4.932 -49.551 14.440 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -3.290 -47.033 14.676 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.064 -47.962 15.944 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -1.192 -47.046 15.361 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.232 -48.514 15.566 1.00 0.00 H new ATOM 1184 N ARG A 76 -4.961 -50.932 11.622 1.00 0.00 N ATOM 1185 CA ARG A 76 -5.888 -51.450 10.623 1.00 0.00 C ATOM 1186 C ARG A 76 -7.317 -51.005 10.924 1.00 0.00 C ATOM 1187 O ARG A 76 -8.092 -50.714 10.013 1.00 0.00 O ATOM 1188 CB ARG A 76 -5.818 -52.978 10.574 1.00 0.00 C ATOM 1189 CG ARG A 76 -6.854 -53.606 9.657 1.00 0.00 C ATOM 1190 CD ARG A 76 -6.673 -53.151 8.218 1.00 0.00 C ATOM 1191 NE ARG A 76 -6.567 -54.278 7.296 1.00 0.00 N ATOM 1192 CZ ARG A 76 -7.608 -54.998 6.892 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -8.827 -54.709 7.327 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -7.432 -56.010 6.052 1.00 0.00 N ATOM 0 H ARG A 76 -4.609 -51.633 12.275 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.597 -51.049 9.652 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -4.823 -53.277 10.243 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.951 -53.372 11.582 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.777 -54.692 9.709 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.854 -53.341 10.001 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -7.516 -52.523 7.928 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -5.776 -52.536 8.143 1.00 0.00 H new ATOM 0 HE ARG A 76 -5.643 -54.526 6.943 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.967 -53.932 7.973 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.624 -55.263 7.015 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -6.496 -56.236 5.715 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -8.233 -56.562 5.743 1.00 0.00 H new ATOM 1208 N ARG A 77 -7.657 -50.956 12.208 1.00 0.00 N ATOM 1209 CA ARG A 77 -8.992 -50.549 12.629 1.00 0.00 C ATOM 1210 C ARG A 77 -9.385 -49.222 11.985 1.00 0.00 C ATOM 1211 O ARG A 77 -10.563 -48.964 11.741 1.00 0.00 O ATOM 1212 CB ARG A 77 -9.055 -50.427 14.152 1.00 0.00 C ATOM 1213 CG ARG A 77 -10.076 -51.350 14.796 1.00 0.00 C ATOM 1214 CD ARG A 77 -10.953 -50.605 15.789 1.00 0.00 C ATOM 1215 NE ARG A 77 -11.317 -51.438 16.932 1.00 0.00 N ATOM 1216 CZ ARG A 77 -10.483 -51.731 17.924 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -9.244 -51.259 17.913 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -10.888 -52.496 18.929 1.00 0.00 N ATOM 0 H ARG A 77 -7.027 -51.193 12.974 1.00 0.00 H new ATOM 0 HA ARG A 77 -9.697 -51.314 12.303 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.070 -50.643 14.566 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -9.292 -49.396 14.416 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -10.700 -51.799 14.023 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -9.561 -52.165 15.304 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -10.428 -49.717 16.141 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -11.858 -50.263 15.287 1.00 0.00 H new ATOM 0 HE ARG A 77 -12.264 -51.816 16.971 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -8.930 -50.670 17.142 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -8.605 -51.485 18.675 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -11.841 -52.860 18.941 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -10.247 -52.720 19.690 1.00 0.00 H new ATOM 1232 N ALA A 78 -8.389 -48.386 11.712 1.00 0.00 N ATOM 1233 CA ALA A 78 -8.629 -47.087 11.095 1.00 0.00 C ATOM 1234 C ALA A 78 -9.183 -47.244 9.683 1.00 0.00 C ATOM 1235 O ALA A 78 -10.226 -46.683 9.350 1.00 0.00 O ATOM 1236 CB ALA A 78 -7.347 -46.268 11.074 1.00 0.00 C ATOM 0 H ALA A 78 -7.408 -48.585 11.908 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.373 -46.560 11.692 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.541 -45.301 10.611 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -6.995 -46.117 12.094 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.586 -46.798 10.502 1.00 0.00 H new ATOM 1242 N ALA A 79 -8.478 -48.010 8.858 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.900 -48.241 7.482 1.00 0.00 C ATOM 1244 C ALA A 79 -10.249 -48.950 7.434 1.00 0.00 C ATOM 1245 O ALA A 79 -11.063 -48.697 6.546 1.00 0.00 O ATOM 1246 CB ALA A 79 -7.849 -49.050 6.736 1.00 0.00 C ATOM 0 H ALA A 79 -7.612 -48.481 9.118 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.010 -47.273 6.994 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.178 -49.215 5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -6.905 -48.504 6.732 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -7.710 -50.011 7.231 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.479 -49.841 8.394 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.730 -50.586 8.461 1.00 0.00 C ATOM 1254 C ALA A 80 -12.897 -49.669 8.813 1.00 0.00 C ATOM 1255 O ALA A 80 -13.917 -49.658 8.125 1.00 0.00 O ATOM 1256 CB ALA A 80 -11.619 -51.714 9.476 1.00 0.00 C ATOM 0 H ALA A 80 -9.815 -50.064 9.136 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.922 -51.014 7.477 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.560 -52.262 9.516 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.817 -52.391 9.181 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -11.400 -51.298 10.459 1.00 0.00 H new ATOM 1262 N GLN A 81 -12.738 -48.902 9.887 1.00 0.00 N ATOM 1263 CA GLN A 81 -13.780 -47.983 10.330 1.00 0.00 C ATOM 1264 C GLN A 81 -14.142 -46.997 9.224 1.00 0.00 C ATOM 1265 O GLN A 81 -15.319 -46.766 8.946 1.00 0.00 O ATOM 1266 CB GLN A 81 -13.323 -47.224 11.577 1.00 0.00 C ATOM 1267 CG GLN A 81 -13.517 -48.003 12.868 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.785 -49.475 12.626 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -14.926 -49.882 12.403 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -12.732 -50.284 12.669 1.00 0.00 N ATOM 0 H GLN A 81 -11.898 -48.899 10.466 1.00 0.00 H new ATOM 0 HA GLN A 81 -14.666 -48.568 10.574 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -12.269 -46.969 11.471 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -13.873 -46.285 11.643 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.628 -47.897 13.489 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -14.349 -47.573 13.426 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.804 -49.904 12.857 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.851 -51.285 12.514 1.00 0.00 H new ATOM 1279 N ILE A 82 -13.123 -46.419 8.597 1.00 0.00 N ATOM 1280 CA ILE A 82 -13.334 -45.459 7.521 1.00 0.00 C ATOM 1281 C ILE A 82 -13.906 -46.138 6.281 1.00 0.00 C ATOM 1282 O ILE A 82 -14.676 -45.539 5.532 1.00 0.00 O ATOM 1283 CB ILE A 82 -12.026 -44.741 7.141 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -12.318 -43.553 6.222 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -11.064 -45.712 6.472 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -12.334 -42.222 6.941 1.00 0.00 C ATOM 0 H ILE A 82 -12.143 -46.599 8.816 1.00 0.00 H new ATOM 0 HA ILE A 82 -14.048 -44.724 7.892 1.00 0.00 H new ATOM 0 HB ILE A 82 -11.558 -44.365 8.051 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -11.567 -43.521 5.433 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -13.282 -43.707 5.738 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -10.144 -45.190 6.209 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -10.835 -46.528 7.158 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -11.523 -46.115 5.569 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -12.547 -41.426 6.228 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -13.104 -42.234 7.712 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -11.362 -42.046 7.402 1.00 0.00 H new ATOM 1298 N ALA A 83 -13.526 -47.395 6.074 1.00 0.00 N ATOM 1299 CA ALA A 83 -14.003 -48.158 4.927 1.00 0.00 C ATOM 1300 C ALA A 83 -15.482 -48.499 5.073 1.00 0.00 C ATOM 1301 O ALA A 83 -16.284 -48.210 4.185 1.00 0.00 O ATOM 1302 CB ALA A 83 -13.181 -49.427 4.759 1.00 0.00 C ATOM 0 H ALA A 83 -12.889 -47.906 6.686 1.00 0.00 H new ATOM 0 HA ALA A 83 -13.885 -47.541 4.036 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -13.548 -49.987 3.899 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -12.135 -49.165 4.602 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -13.270 -50.040 5.656 1.00 0.00 H new ATOM 1308 N GLN A 84 -15.835 -49.114 6.196 1.00 0.00 N ATOM 1309 CA GLN A 84 -17.219 -49.496 6.456 1.00 0.00 C ATOM 1310 C GLN A 84 -18.105 -48.263 6.601 1.00 0.00 C ATOM 1311 O GLN A 84 -19.276 -48.281 6.223 1.00 0.00 O ATOM 1312 CB GLN A 84 -17.305 -50.352 7.720 1.00 0.00 C ATOM 1313 CG GLN A 84 -18.730 -50.612 8.183 1.00 0.00 C ATOM 1314 CD GLN A 84 -19.500 -51.503 7.229 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -19.744 -52.675 7.517 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -19.889 -50.951 6.086 1.00 0.00 N ATOM 0 H GLN A 84 -15.183 -49.359 6.941 1.00 0.00 H new ATOM 0 HA GLN A 84 -17.575 -50.079 5.607 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -16.812 -51.306 7.537 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -16.756 -49.858 8.521 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -18.709 -51.075 9.169 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -19.253 -49.661 8.288 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -19.665 -49.976 5.888 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -20.412 -51.502 5.405 1.00 0.00 H new ATOM 1325 N ALA A 85 -17.538 -47.194 7.151 1.00 0.00 N ATOM 1326 CA ALA A 85 -18.276 -45.952 7.344 1.00 0.00 C ATOM 1327 C ALA A 85 -18.568 -45.273 6.010 1.00 0.00 C ATOM 1328 O ALA A 85 -19.659 -44.744 5.797 1.00 0.00 O ATOM 1329 CB ALA A 85 -17.501 -45.014 8.257 1.00 0.00 C ATOM 0 H ALA A 85 -16.570 -47.163 7.471 1.00 0.00 H new ATOM 0 HA ALA A 85 -19.229 -46.194 7.814 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -18.064 -44.090 8.392 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -17.349 -45.492 9.225 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -16.534 -44.787 7.809 1.00 0.00 H new ATOM 1335 N LEU A 86 -17.586 -45.291 5.116 1.00 0.00 N ATOM 1336 CA LEU A 86 -17.737 -44.676 3.801 1.00 0.00 C ATOM 1337 C LEU A 86 -18.689 -45.487 2.927 1.00 0.00 C ATOM 1338 O LEU A 86 -19.477 -44.927 2.164 1.00 0.00 O ATOM 1339 CB LEU A 86 -16.376 -44.553 3.115 1.00 0.00 C ATOM 1340 CG LEU A 86 -16.326 -43.653 1.879 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -15.368 -42.493 2.101 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -15.920 -44.456 0.651 1.00 0.00 C ATOM 0 H LEU A 86 -16.677 -45.724 5.277 1.00 0.00 H new ATOM 0 HA LEU A 86 -18.159 -43.680 3.939 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -15.657 -44.177 3.843 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -16.045 -45.551 2.827 1.00 0.00 H new ATOM 0 HG LEU A 86 -17.323 -43.246 1.709 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.346 -41.864 1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -15.703 -41.903 2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -14.368 -42.880 2.297 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -15.890 -43.800 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -14.934 -44.892 0.811 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -16.645 -45.252 0.480 1.00 0.00 H new ATOM 1354 N LEU A 87 -18.611 -46.808 3.044 1.00 0.00 N ATOM 1355 CA LEU A 87 -19.467 -47.697 2.266 1.00 0.00 C ATOM 1356 C LEU A 87 -20.940 -47.397 2.524 1.00 0.00 C ATOM 1357 O LEU A 87 -21.785 -47.590 1.651 1.00 0.00 O ATOM 1358 CB LEU A 87 -19.165 -49.157 2.609 1.00 0.00 C ATOM 1359 CG LEU A 87 -20.128 -50.195 2.032 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -19.393 -51.488 1.715 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -21.275 -50.454 2.998 1.00 0.00 C ATOM 0 H LEU A 87 -17.964 -47.287 3.670 1.00 0.00 H new ATOM 0 HA LEU A 87 -19.260 -47.528 1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -18.159 -49.391 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -19.158 -49.261 3.694 1.00 0.00 H new ATOM 0 HG LEU A 87 -20.543 -49.801 1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -20.095 -52.214 1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -18.608 -51.291 0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -18.949 -51.887 2.627 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -21.950 -51.195 2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -20.878 -50.826 3.942 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -21.819 -49.526 3.174 1.00 0.00 H new ATOM 1373 N GLY A 88 -21.241 -46.920 3.728 1.00 0.00 N ATOM 1374 CA GLY A 88 -22.612 -46.598 4.078 1.00 0.00 C ATOM 1375 C GLY A 88 -22.866 -45.104 4.112 1.00 0.00 C ATOM 1376 O GLY A 88 -24.015 -44.664 4.126 1.00 0.00 O ATOM 0 H GLY A 88 -20.559 -46.751 4.468 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -23.286 -47.062 3.358 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -22.845 -47.025 5.053 1.00 0.00 H new ATOM 1380 N ALA A 89 -21.791 -44.323 4.126 1.00 0.00 N ATOM 1381 CA ALA A 89 -21.904 -42.870 4.159 1.00 0.00 C ATOM 1382 C ALA A 89 -22.747 -42.411 5.344 1.00 0.00 C ATOM 1383 O ALA A 89 -23.574 -41.509 5.216 1.00 0.00 O ATOM 1384 CB ALA A 89 -22.499 -42.357 2.855 1.00 0.00 C ATOM 0 H ALA A 89 -20.833 -44.672 4.115 1.00 0.00 H new ATOM 0 HA ALA A 89 -20.903 -42.455 4.277 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -22.578 -41.271 2.894 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -21.856 -42.645 2.023 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -23.490 -42.788 2.713 1.00 0.00 H new ATOM 1390 N GLU A 90 -22.531 -43.038 6.496 1.00 0.00 N ATOM 1391 CA GLU A 90 -23.273 -42.694 7.703 1.00 0.00 C ATOM 1392 C GLU A 90 -22.395 -41.915 8.678 1.00 0.00 C ATOM 1393 O GLU A 90 -21.169 -42.001 8.628 1.00 0.00 O ATOM 1394 CB GLU A 90 -23.807 -43.959 8.379 1.00 0.00 C ATOM 1395 CG GLU A 90 -24.617 -43.683 9.634 1.00 0.00 C ATOM 1396 CD GLU A 90 -25.195 -44.944 10.245 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -24.868 -46.045 9.755 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -25.975 -44.830 11.213 1.00 0.00 O ATOM 0 H GLU A 90 -21.849 -43.786 6.619 1.00 0.00 H new ATOM 0 HA GLU A 90 -24.114 -42.063 7.414 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -24.428 -44.506 7.669 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -22.968 -44.607 8.633 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -23.984 -43.185 10.368 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -25.428 -42.995 9.394 1.00 0.00 H new ATOM 1405 N GLU A 91 -23.033 -41.154 9.562 1.00 0.00 N ATOM 1406 CA GLU A 91 -22.310 -40.359 10.547 1.00 0.00 C ATOM 1407 C GLU A 91 -21.408 -41.242 11.403 1.00 0.00 C ATOM 1408 O GLU A 91 -21.875 -41.929 12.312 1.00 0.00 O ATOM 1409 CB GLU A 91 -23.291 -39.596 11.439 1.00 0.00 C ATOM 1410 CG GLU A 91 -24.322 -40.488 12.111 1.00 0.00 C ATOM 1411 CD GLU A 91 -24.198 -40.487 13.622 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -23.055 -40.456 14.124 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -25.244 -40.518 14.303 1.00 0.00 O ATOM 0 H GLU A 91 -24.048 -41.072 9.616 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.686 -39.644 10.011 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -22.731 -39.061 12.206 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -23.807 -38.846 10.839 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -25.322 -40.155 11.832 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -24.211 -41.507 11.742 1.00 0.00 H new ATOM 1420 N ARG A 92 -20.112 -41.220 11.106 1.00 0.00 N ATOM 1421 CA ARG A 92 -19.144 -42.020 11.847 1.00 0.00 C ATOM 1422 C ARG A 92 -17.755 -41.394 11.776 1.00 0.00 C ATOM 1423 O ARG A 92 -17.348 -40.873 10.737 1.00 0.00 O ATOM 1424 CB ARG A 92 -19.102 -43.446 11.296 1.00 0.00 C ATOM 1425 CG ARG A 92 -17.883 -44.236 11.744 1.00 0.00 C ATOM 1426 CD ARG A 92 -17.854 -44.405 13.255 1.00 0.00 C ATOM 1427 NE ARG A 92 -17.620 -45.793 13.646 1.00 0.00 N ATOM 1428 CZ ARG A 92 -17.408 -46.178 14.899 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -17.402 -45.284 15.879 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -17.203 -47.459 15.176 1.00 0.00 N ATOM 0 H ARG A 92 -19.709 -40.657 10.357 1.00 0.00 H new ATOM 0 HA ARG A 92 -19.457 -42.050 12.891 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -20.002 -43.974 11.610 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -19.119 -43.406 10.207 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -17.888 -45.216 11.267 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -16.977 -43.726 11.416 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -17.072 -43.773 13.676 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -18.800 -44.064 13.676 1.00 0.00 H new ATOM 0 HE ARG A 92 -17.619 -46.506 12.916 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -17.561 -44.298 15.671 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -17.239 -45.582 16.841 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -17.208 -48.150 14.426 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -17.040 -47.753 16.139 1.00 0.00 H new ATOM 1444 N LYS A 93 -17.030 -41.448 12.889 1.00 0.00 N ATOM 1445 CA LYS A 93 -15.685 -40.888 12.955 1.00 0.00 C ATOM 1446 C LYS A 93 -14.654 -41.980 13.217 1.00 0.00 C ATOM 1447 O LYS A 93 -14.937 -42.964 13.901 1.00 0.00 O ATOM 1448 CB LYS A 93 -15.607 -39.823 14.051 1.00 0.00 C ATOM 1449 CG LYS A 93 -15.355 -40.393 15.436 1.00 0.00 C ATOM 1450 CD LYS A 93 -15.804 -39.433 16.525 1.00 0.00 C ATOM 1451 CE LYS A 93 -17.031 -39.955 17.256 1.00 0.00 C ATOM 1452 NZ LYS A 93 -17.692 -38.890 18.060 1.00 0.00 N ATOM 0 H LYS A 93 -17.352 -41.874 13.758 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.462 -40.427 11.993 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -14.811 -39.120 13.806 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.539 -39.258 14.064 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -15.885 -41.339 15.543 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.293 -40.608 15.554 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -14.992 -39.282 17.236 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.027 -38.461 16.085 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -17.741 -40.358 16.533 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -16.742 -40.777 17.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.524 -39.285 18.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.023 -38.523 18.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -17.991 -38.117 17.432 1.00 0.00 H new ATOM 1466 N VAL A 94 -13.455 -41.799 12.671 1.00 0.00 N ATOM 1467 CA VAL A 94 -12.380 -42.768 12.849 1.00 0.00 C ATOM 1468 C VAL A 94 -11.043 -42.070 13.074 1.00 0.00 C ATOM 1469 O VAL A 94 -10.761 -41.038 12.466 1.00 0.00 O ATOM 1470 CB VAL A 94 -12.260 -43.703 11.631 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -12.112 -42.896 10.350 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -11.090 -44.659 11.807 1.00 0.00 C ATOM 0 H VAL A 94 -13.204 -40.990 12.102 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.630 -43.360 13.729 1.00 0.00 H new ATOM 0 HB VAL A 94 -13.174 -44.293 11.556 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.029 -43.574 9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.985 -42.257 10.220 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -11.216 -42.278 10.411 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.020 -45.312 10.937 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -10.166 -44.089 11.908 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.244 -45.262 12.702 1.00 0.00 H new ATOM 1482 N GLU A 95 -10.224 -42.641 13.951 1.00 0.00 N ATOM 1483 CA GLU A 95 -8.916 -42.073 14.256 1.00 0.00 C ATOM 1484 C GLU A 95 -7.809 -42.839 13.537 1.00 0.00 C ATOM 1485 O GLU A 95 -7.685 -44.055 13.684 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.667 -42.091 15.766 1.00 0.00 C ATOM 1487 CG GLU A 95 -8.808 -43.470 16.389 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.609 -43.454 17.892 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -7.529 -43.015 18.342 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.531 -43.880 18.618 1.00 0.00 O ATOM 0 H GLU A 95 -10.443 -43.496 14.463 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.906 -41.041 13.906 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.665 -41.712 15.965 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.367 -41.410 16.249 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.797 -43.868 16.161 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.081 -44.145 15.937 1.00 0.00 H new ATOM 1497 N ILE A 96 -7.008 -42.118 12.760 1.00 0.00 N ATOM 1498 CA ILE A 96 -5.911 -42.729 12.019 1.00 0.00 C ATOM 1499 C ILE A 96 -4.639 -41.896 12.134 1.00 0.00 C ATOM 1500 O ILE A 96 -4.685 -40.722 12.499 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.266 -42.902 10.530 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -7.754 -43.218 10.371 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.416 -44.000 9.908 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -8.615 -41.990 10.176 1.00 0.00 C ATOM 0 H ILE A 96 -7.098 -41.111 12.627 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.740 -43.711 12.460 1.00 0.00 H new ATOM 0 HB ILE A 96 -6.055 -41.967 10.010 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.887 -43.884 9.518 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.099 -43.757 11.253 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.678 -44.111 8.856 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.362 -43.737 9.994 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -5.599 -44.940 10.428 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.658 -42.290 10.070 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.512 -41.333 11.039 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -8.297 -41.461 9.278 1.00 0.00 H new ATOM 1516 N ALA A 97 -3.505 -42.511 11.817 1.00 0.00 N ATOM 1517 CA ALA A 97 -2.220 -41.826 11.880 1.00 0.00 C ATOM 1518 C ALA A 97 -1.757 -41.397 10.492 1.00 0.00 C ATOM 1519 O ALA A 97 -1.305 -42.220 9.696 1.00 0.00 O ATOM 1520 CB ALA A 97 -1.177 -42.720 12.534 1.00 0.00 C ATOM 0 H ALA A 97 -3.450 -43.483 11.514 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.344 -40.928 12.486 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.222 -42.196 12.574 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.496 -42.971 13.545 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.064 -43.634 11.951 1.00 0.00 H new ATOM 1526 N PHE A 98 -1.874 -40.104 10.207 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.469 -39.567 8.914 1.00 0.00 C ATOM 1528 C PHE A 98 -0.105 -38.890 9.009 1.00 0.00 C ATOM 1529 O PHE A 98 0.254 -38.335 10.048 1.00 0.00 O ATOM 1530 CB PHE A 98 -2.511 -38.569 8.403 1.00 0.00 C ATOM 1531 CG PHE A 98 -3.884 -39.159 8.255 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -4.046 -40.477 7.859 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -5.012 -38.396 8.509 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -5.309 -41.024 7.722 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -6.276 -38.938 8.374 1.00 0.00 C ATOM 1536 CZ PHE A 98 -6.425 -40.253 7.978 1.00 0.00 C ATOM 0 H PHE A 98 -2.246 -39.409 10.854 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.395 -40.397 8.211 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.560 -37.723 9.089 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -2.186 -38.179 7.439 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -3.176 -41.084 7.655 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -4.902 -37.366 8.816 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -5.422 -42.053 7.415 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.147 -38.333 8.578 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.412 -40.677 7.869 1.00 0.00 H new ATOM 1546 N TYR A 99 0.651 -38.941 7.918 1.00 0.00 N ATOM 1547 CA TYR A 99 1.978 -38.336 7.879 1.00 0.00 C ATOM 1548 C TYR A 99 1.992 -37.114 6.966 1.00 0.00 C ATOM 1549 O TYR A 99 1.169 -36.994 6.058 1.00 0.00 O ATOM 1550 CB TYR A 99 3.012 -39.356 7.400 1.00 0.00 C ATOM 1551 CG TYR A 99 2.513 -40.248 6.285 1.00 0.00 C ATOM 1552 CD1 TYR A 99 2.237 -39.729 5.026 1.00 0.00 C ATOM 1553 CD2 TYR A 99 2.316 -41.607 6.491 1.00 0.00 C ATOM 1554 CE1 TYR A 99 1.780 -40.539 4.004 1.00 0.00 C ATOM 1555 CE2 TYR A 99 1.861 -42.425 5.475 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.594 -41.887 4.234 1.00 0.00 C ATOM 1557 OH TYR A 99 1.139 -42.698 3.220 1.00 0.00 O ATOM 0 H TYR A 99 0.368 -39.395 7.049 1.00 0.00 H new ATOM 0 HA TYR A 99 2.234 -38.016 8.889 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.902 -38.826 7.059 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.314 -39.977 8.243 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.382 -38.675 4.843 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.522 -42.032 7.462 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.570 -40.120 3.031 1.00 0.00 H new ATOM 0 HE2 TYR A 99 1.715 -43.480 5.652 1.00 0.00 H new ATOM 0 HH TYR A 99 0.923 -42.151 2.436 1.00 0.00 H new ATOM 1567 N ARG A 100 2.934 -36.209 7.214 1.00 0.00 N ATOM 1568 CA ARG A 100 3.056 -34.995 6.416 1.00 0.00 C ATOM 1569 C ARG A 100 4.265 -35.074 5.489 1.00 0.00 C ATOM 1570 O ARG A 100 4.999 -36.063 5.490 1.00 0.00 O ATOM 1571 CB ARG A 100 3.176 -33.772 7.326 1.00 0.00 C ATOM 1572 CG ARG A 100 1.854 -33.333 7.934 1.00 0.00 C ATOM 1573 CD ARG A 100 2.060 -32.638 9.271 1.00 0.00 C ATOM 1574 NE ARG A 100 2.319 -31.210 9.112 1.00 0.00 N ATOM 1575 CZ ARG A 100 2.138 -30.318 10.080 1.00 0.00 C ATOM 1576 NH1 ARG A 100 1.699 -30.705 11.269 1.00 0.00 N ATOM 1577 NH2 ARG A 100 2.396 -29.035 9.858 1.00 0.00 N ATOM 0 H ARG A 100 3.623 -36.294 7.961 1.00 0.00 H new ATOM 0 HA ARG A 100 2.158 -34.898 5.806 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.879 -33.994 8.129 1.00 0.00 H new ATOM 0 HB3 ARG A 100 3.596 -32.944 6.755 1.00 0.00 H new ATOM 0 HG2 ARG A 100 1.342 -32.659 7.247 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.208 -34.201 8.069 1.00 0.00 H new ATOM 0 HD2 ARG A 100 1.176 -32.779 9.893 1.00 0.00 H new ATOM 0 HD3 ARG A 100 2.896 -33.102 9.795 1.00 0.00 H new ATOM 0 HE ARG A 100 2.657 -30.879 8.208 1.00 0.00 H new ATOM 0 HH11 ARG A 100 1.499 -31.690 11.443 1.00 0.00 H new ATOM 0 HH12 ARG A 100 1.561 -30.018 12.010 1.00 0.00 H new ATOM 0 HH21 ARG A 100 2.733 -28.733 8.944 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.257 -28.351 10.602 1.00 0.00 H new ATOM 1591 N LYS A 101 4.467 -34.026 4.697 1.00 0.00 N ATOM 1592 CA LYS A 101 5.587 -33.974 3.765 1.00 0.00 C ATOM 1593 C LYS A 101 6.916 -34.085 4.505 1.00 0.00 C ATOM 1594 O LYS A 101 7.907 -34.561 3.952 1.00 0.00 O ATOM 1595 CB LYS A 101 5.546 -32.674 2.959 1.00 0.00 C ATOM 1596 CG LYS A 101 4.279 -32.507 2.138 1.00 0.00 C ATOM 1597 CD LYS A 101 4.421 -33.129 0.759 1.00 0.00 C ATOM 1598 CE LYS A 101 4.757 -32.083 -0.292 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.589 -32.647 -1.391 1.00 0.00 N ATOM 0 H LYS A 101 3.868 -33.200 4.682 1.00 0.00 H new ATOM 0 HA LYS A 101 5.500 -34.820 3.083 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.640 -31.830 3.642 1.00 0.00 H new ATOM 0 HB3 LYS A 101 6.408 -32.642 2.292 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.442 -32.969 2.662 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.047 -31.447 2.038 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.202 -33.889 0.780 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.493 -33.633 0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.835 -31.676 -0.707 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.288 -31.255 0.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.796 -31.902 -2.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.480 -33.012 -0.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 5.072 -33.421 -1.856 1.00 0.00 H new ATOM 1613 N ASP A 102 6.929 -33.643 5.758 1.00 0.00 N ATOM 1614 CA ASP A 102 8.136 -33.694 6.574 1.00 0.00 C ATOM 1615 C ASP A 102 8.510 -35.137 6.901 1.00 0.00 C ATOM 1616 O ASP A 102 9.623 -35.415 7.345 1.00 0.00 O ATOM 1617 CB ASP A 102 7.938 -32.900 7.866 1.00 0.00 C ATOM 1618 CG ASP A 102 9.250 -32.573 8.552 1.00 0.00 C ATOM 1619 OD1 ASP A 102 10.006 -31.736 8.016 1.00 0.00 O ATOM 1620 OD2 ASP A 102 9.521 -33.155 9.624 1.00 0.00 O ATOM 0 H ASP A 102 6.117 -33.245 6.230 1.00 0.00 H new ATOM 0 HA ASP A 102 8.950 -33.247 6.003 1.00 0.00 H new ATOM 0 HB2 ASP A 102 7.408 -31.974 7.642 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.308 -33.472 8.547 1.00 0.00 H new ATOM 1625 N GLY A 103 7.571 -36.051 6.679 1.00 0.00 N ATOM 1626 CA GLY A 103 7.820 -37.454 6.957 1.00 0.00 C ATOM 1627 C GLY A 103 7.243 -37.893 8.288 1.00 0.00 C ATOM 1628 O GLY A 103 6.984 -39.077 8.499 1.00 0.00 O ATOM 0 H GLY A 103 6.642 -35.845 6.312 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.390 -38.061 6.160 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.895 -37.637 6.952 1.00 0.00 H new ATOM 1632 N SER A 104 7.043 -36.936 9.189 1.00 0.00 N ATOM 1633 CA SER A 104 6.498 -37.231 10.509 1.00 0.00 C ATOM 1634 C SER A 104 5.093 -37.815 10.398 1.00 0.00 C ATOM 1635 O SER A 104 4.437 -37.691 9.363 1.00 0.00 O ATOM 1636 CB SER A 104 6.472 -35.966 11.367 1.00 0.00 C ATOM 1637 OG SER A 104 6.855 -34.829 10.613 1.00 0.00 O ATOM 0 H SER A 104 7.250 -35.950 9.029 1.00 0.00 H new ATOM 0 HA SER A 104 7.142 -37.970 10.985 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.471 -35.818 11.771 1.00 0.00 H new ATOM 0 HB3 SER A 104 7.144 -36.086 12.217 1.00 0.00 H new ATOM 0 HG SER A 104 6.829 -34.033 11.185 1.00 0.00 H new ATOM 1643 N CYS A 105 4.637 -38.449 11.472 1.00 0.00 N ATOM 1644 CA CYS A 105 3.309 -39.053 11.497 1.00 0.00 C ATOM 1645 C CYS A 105 2.552 -38.649 12.758 1.00 0.00 C ATOM 1646 O CYS A 105 3.073 -38.756 13.869 1.00 0.00 O ATOM 1647 CB CYS A 105 3.417 -40.577 11.419 1.00 0.00 C ATOM 1648 SG CYS A 105 1.929 -41.391 10.793 1.00 0.00 S ATOM 0 H CYS A 105 5.167 -38.558 12.337 1.00 0.00 H new ATOM 0 HA CYS A 105 2.756 -38.691 10.631 1.00 0.00 H new ATOM 0 HB2 CYS A 105 4.259 -40.839 10.777 1.00 0.00 H new ATOM 0 HB3 CYS A 105 3.640 -40.966 12.412 1.00 0.00 H new ATOM 0 HG CYS A 105 2.118 -42.677 10.762 1.00 0.00 H new ATOM 1654 N PHE A 106 1.320 -38.184 12.579 1.00 0.00 N ATOM 1655 CA PHE A 106 0.492 -37.761 13.702 1.00 0.00 C ATOM 1656 C PHE A 106 -0.885 -38.417 13.640 1.00 0.00 C ATOM 1657 O PHE A 106 -1.325 -38.864 12.579 1.00 0.00 O ATOM 1658 CB PHE A 106 0.344 -36.239 13.710 1.00 0.00 C ATOM 1659 CG PHE A 106 1.641 -35.509 13.507 1.00 0.00 C ATOM 1660 CD1 PHE A 106 2.783 -35.897 14.189 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.719 -34.436 12.633 1.00 0.00 C ATOM 1662 CE1 PHE A 106 3.979 -35.228 14.004 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.911 -33.764 12.444 1.00 0.00 C ATOM 1664 CZ PHE A 106 4.042 -34.160 13.131 1.00 0.00 C ATOM 0 H PHE A 106 0.873 -38.091 11.667 1.00 0.00 H new ATOM 0 HA PHE A 106 0.984 -38.076 14.622 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.355 -35.946 12.927 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.093 -35.930 14.659 1.00 0.00 H new ATOM 0 HD1 PHE A 106 2.739 -36.732 14.873 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.838 -34.122 12.094 1.00 0.00 H new ATOM 0 HE1 PHE A 106 4.862 -35.540 14.541 1.00 0.00 H new ATOM 0 HE2 PHE A 106 2.959 -32.930 11.760 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.974 -33.635 12.986 1.00 0.00 H new ATOM 1674 N LEU A 107 -1.560 -38.472 14.782 1.00 0.00 N ATOM 1675 CA LEU A 107 -2.887 -39.073 14.859 1.00 0.00 C ATOM 1676 C LEU A 107 -3.974 -38.014 14.704 1.00 0.00 C ATOM 1677 O LEU A 107 -4.034 -37.055 15.474 1.00 0.00 O ATOM 1678 CB LEU A 107 -3.059 -39.807 16.190 1.00 0.00 C ATOM 1679 CG LEU A 107 -2.996 -41.333 16.128 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -1.565 -41.816 16.307 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -3.904 -41.948 17.183 1.00 0.00 C ATOM 0 H LEU A 107 -1.210 -38.108 15.668 1.00 0.00 H new ATOM 0 HA LEU A 107 -2.984 -39.788 14.042 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -2.287 -39.459 16.876 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.019 -39.520 16.619 1.00 0.00 H new ATOM 0 HG LEU A 107 -3.345 -41.652 15.146 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.540 -42.905 16.260 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -0.940 -41.404 15.515 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.188 -41.486 17.275 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.846 -43.035 17.124 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -3.585 -41.621 18.173 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.932 -41.629 17.009 1.00 0.00 H new ATOM 1693 N CYS A 108 -4.832 -38.196 13.707 1.00 0.00 N ATOM 1694 CA CYS A 108 -5.919 -37.258 13.452 1.00 0.00 C ATOM 1695 C CYS A 108 -7.249 -37.990 13.315 1.00 0.00 C ATOM 1696 O CYS A 108 -7.289 -39.160 12.930 1.00 0.00 O ATOM 1697 CB CYS A 108 -5.635 -36.448 12.186 1.00 0.00 C ATOM 1698 SG CYS A 108 -6.689 -34.993 11.988 1.00 0.00 S ATOM 0 H CYS A 108 -4.796 -38.985 13.062 1.00 0.00 H new ATOM 0 HA CYS A 108 -5.986 -36.579 14.302 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -4.593 -36.129 12.198 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -5.761 -37.095 11.318 1.00 0.00 H new ATOM 0 HG CYS A 108 -5.976 -33.917 12.140 1.00 0.00 H new ATOM 1704 N LEU A 109 -8.336 -37.296 13.632 1.00 0.00 N ATOM 1705 CA LEU A 109 -9.670 -37.881 13.546 1.00 0.00 C ATOM 1706 C LEU A 109 -10.315 -37.570 12.200 1.00 0.00 C ATOM 1707 O LEU A 109 -10.059 -36.523 11.604 1.00 0.00 O ATOM 1708 CB LEU A 109 -10.552 -37.358 14.681 1.00 0.00 C ATOM 1709 CG LEU A 109 -12.061 -37.504 14.480 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -12.769 -37.626 15.820 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -12.610 -36.325 13.690 1.00 0.00 C ATOM 0 H LEU A 109 -8.320 -36.327 13.951 1.00 0.00 H new ATOM 0 HA LEU A 109 -9.572 -38.963 13.640 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.276 -37.878 15.598 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.326 -36.302 14.833 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.246 -38.415 13.911 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -13.842 -37.729 15.657 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.397 -38.503 16.350 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.577 -36.734 16.416 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.685 -36.446 13.556 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.413 -35.400 14.232 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -12.126 -36.283 12.714 1.00 0.00 H new ATOM 1723 N VAL A 110 -11.155 -38.484 11.726 1.00 0.00 N ATOM 1724 CA VAL A 110 -11.841 -38.306 10.451 1.00 0.00 C ATOM 1725 C VAL A 110 -13.332 -38.592 10.584 1.00 0.00 C ATOM 1726 O VAL A 110 -13.750 -39.749 10.634 1.00 0.00 O ATOM 1727 CB VAL A 110 -11.248 -39.220 9.363 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -11.829 -38.874 8.000 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -9.731 -39.116 9.347 1.00 0.00 C ATOM 0 H VAL A 110 -11.377 -39.356 12.206 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.699 -37.266 10.158 1.00 0.00 H new ATOM 0 HB VAL A 110 -11.515 -40.251 9.595 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.398 -39.530 7.244 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -12.911 -39.006 8.021 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.595 -37.838 7.757 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.330 -39.769 8.572 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.439 -38.086 9.141 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.335 -39.418 10.317 1.00 0.00 H new ATOM 1739 N ASP A 111 -14.130 -37.531 10.641 1.00 0.00 N ATOM 1740 CA ASP A 111 -15.576 -37.668 10.766 1.00 0.00 C ATOM 1741 C ASP A 111 -16.257 -37.503 9.411 1.00 0.00 C ATOM 1742 O ASP A 111 -15.985 -36.551 8.680 1.00 0.00 O ATOM 1743 CB ASP A 111 -16.124 -36.638 11.755 1.00 0.00 C ATOM 1744 CG ASP A 111 -17.577 -36.888 12.107 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -17.880 -37.977 12.639 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -18.411 -35.995 11.851 1.00 0.00 O ATOM 0 H ASP A 111 -13.800 -36.567 10.603 1.00 0.00 H new ATOM 0 HA ASP A 111 -15.790 -38.669 11.140 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -15.524 -36.658 12.665 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -16.023 -35.640 11.329 1.00 0.00 H new ATOM 1751 N VAL A 112 -17.143 -38.438 9.082 1.00 0.00 N ATOM 1752 CA VAL A 112 -17.863 -38.397 7.815 1.00 0.00 C ATOM 1753 C VAL A 112 -19.371 -38.404 8.039 1.00 0.00 C ATOM 1754 O VAL A 112 -19.897 -39.248 8.765 1.00 0.00 O ATOM 1755 CB VAL A 112 -17.483 -39.587 6.914 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -17.830 -40.903 7.593 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -18.175 -39.475 5.564 1.00 0.00 C ATOM 0 H VAL A 112 -17.379 -39.233 9.676 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.577 -37.470 7.319 1.00 0.00 H new ATOM 0 HB VAL A 112 -16.406 -39.565 6.747 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -17.554 -41.732 6.942 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -17.284 -40.983 8.533 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -18.901 -40.938 7.792 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -17.895 -40.324 4.940 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.255 -39.471 5.708 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -17.871 -38.550 5.075 1.00 0.00 H new ATOM 1767 N VAL A 113 -20.062 -37.459 7.410 1.00 0.00 N ATOM 1768 CA VAL A 113 -21.511 -37.357 7.540 1.00 0.00 C ATOM 1769 C VAL A 113 -22.146 -36.875 6.240 1.00 0.00 C ATOM 1770 O VAL A 113 -21.698 -35.909 5.622 1.00 0.00 O ATOM 1771 CB VAL A 113 -21.907 -36.398 8.678 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -23.406 -36.454 8.927 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -21.135 -36.730 9.946 1.00 0.00 C ATOM 0 H VAL A 113 -19.642 -36.753 6.805 1.00 0.00 H new ATOM 0 HA VAL A 113 -21.879 -38.356 7.773 1.00 0.00 H new ATOM 0 HB VAL A 113 -21.651 -35.382 8.379 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -23.667 -35.770 9.734 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -23.937 -36.164 8.020 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -23.691 -37.469 9.205 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -21.427 -36.043 10.740 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -21.358 -37.752 10.251 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -20.066 -36.633 9.757 1.00 0.00 H new ATOM 1783 N PRO A 114 -23.216 -37.563 5.814 1.00 0.00 N ATOM 1784 CA PRO A 114 -23.937 -37.223 4.584 1.00 0.00 C ATOM 1785 C PRO A 114 -24.706 -35.913 4.706 1.00 0.00 C ATOM 1786 O PRO A 114 -25.038 -35.477 5.809 1.00 0.00 O ATOM 1787 CB PRO A 114 -24.904 -38.396 4.404 1.00 0.00 C ATOM 1788 CG PRO A 114 -25.106 -38.935 5.778 1.00 0.00 C ATOM 1789 CD PRO A 114 -23.804 -38.726 6.500 1.00 0.00 C ATOM 0 HA PRO A 114 -23.260 -37.077 3.742 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -25.846 -38.068 3.965 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -24.489 -39.153 3.739 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -25.921 -38.417 6.284 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -25.370 -39.992 5.748 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -23.960 -38.530 7.561 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -23.160 -39.602 6.429 1.00 0.00 H new ATOM 1797 N VAL A 115 -24.987 -35.288 3.567 1.00 0.00 N ATOM 1798 CA VAL A 115 -25.720 -34.027 3.547 1.00 0.00 C ATOM 1799 C VAL A 115 -27.066 -34.185 2.850 1.00 0.00 C ATOM 1800 O VAL A 115 -27.156 -34.112 1.624 1.00 0.00 O ATOM 1801 CB VAL A 115 -24.914 -32.922 2.839 1.00 0.00 C ATOM 1802 CG1 VAL A 115 -25.557 -31.562 3.068 1.00 0.00 C ATOM 1803 CG2 VAL A 115 -23.470 -32.925 3.319 1.00 0.00 C ATOM 0 H VAL A 115 -24.718 -35.634 2.646 1.00 0.00 H new ATOM 0 HA VAL A 115 -25.884 -33.739 4.585 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.918 -33.124 1.768 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -24.974 -30.794 2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -26.572 -31.568 2.671 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -25.586 -31.349 4.137 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -22.915 -32.138 2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -23.444 -32.748 4.394 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -23.015 -33.891 3.099 1.00 0.00 H new ATOM 1813 N LYS A 116 -28.113 -34.401 3.639 1.00 0.00 N ATOM 1814 CA LYS A 116 -29.457 -34.568 3.099 1.00 0.00 C ATOM 1815 C LYS A 116 -30.084 -33.216 2.773 1.00 0.00 C ATOM 1816 O LYS A 116 -29.554 -32.170 3.144 1.00 0.00 O ATOM 1817 CB LYS A 116 -30.339 -35.324 4.096 1.00 0.00 C ATOM 1818 CG LYS A 116 -29.845 -36.727 4.403 1.00 0.00 C ATOM 1819 CD LYS A 116 -30.646 -37.367 5.524 1.00 0.00 C ATOM 1820 CE LYS A 116 -30.293 -38.837 5.693 1.00 0.00 C ATOM 1821 NZ LYS A 116 -31.280 -39.550 6.550 1.00 0.00 N ATOM 0 H LYS A 116 -28.056 -34.465 4.655 1.00 0.00 H new ATOM 0 HA LYS A 116 -29.382 -35.146 2.178 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -30.393 -34.756 5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -31.353 -35.383 3.699 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -29.916 -37.343 3.506 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -28.792 -36.690 4.682 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -30.456 -36.837 6.457 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -31.711 -37.269 5.313 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -30.250 -39.315 4.714 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -29.300 -38.924 6.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -31.004 -40.549 6.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -31.303 -39.110 7.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -32.224 -39.490 6.117 1.00 0.00 H new ATOM 1835 N ASN A 117 -31.217 -33.246 2.078 1.00 0.00 N ATOM 1836 CA ASN A 117 -31.916 -32.023 1.703 1.00 0.00 C ATOM 1837 C ASN A 117 -33.179 -31.840 2.539 1.00 0.00 C ATOM 1838 O ASN A 117 -33.424 -32.591 3.482 1.00 0.00 O ATOM 1839 CB ASN A 117 -32.275 -32.051 0.216 1.00 0.00 C ATOM 1840 CG ASN A 117 -31.100 -31.685 -0.670 1.00 0.00 C ATOM 1841 OD1 ASN A 117 -30.012 -31.378 -0.181 1.00 0.00 O ATOM 1842 ND2 ASN A 117 -31.314 -31.717 -1.980 1.00 0.00 N ATOM 0 H ASN A 117 -31.670 -34.104 1.763 1.00 0.00 H new ATOM 0 HA ASN A 117 -31.250 -31.181 1.893 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -32.631 -33.046 -0.050 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -33.096 -31.359 0.030 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -30.560 -31.481 -2.626 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -32.232 -31.977 -2.341 1.00 0.00 H new ATOM 1849 N GLU A 118 -33.977 -30.837 2.185 1.00 0.00 N ATOM 1850 CA GLU A 118 -35.214 -30.556 2.904 1.00 0.00 C ATOM 1851 C GLU A 118 -36.138 -31.771 2.892 1.00 0.00 C ATOM 1852 O GLU A 118 -37.021 -31.900 3.740 1.00 0.00 O ATOM 1853 CB GLU A 118 -35.928 -29.353 2.283 1.00 0.00 C ATOM 1854 CG GLU A 118 -36.325 -28.292 3.296 1.00 0.00 C ATOM 1855 CD GLU A 118 -36.182 -26.884 2.752 1.00 0.00 C ATOM 1856 OE1 GLU A 118 -37.001 -26.493 1.895 1.00 0.00 O ATOM 1857 OE2 GLU A 118 -35.251 -26.173 3.186 1.00 0.00 O ATOM 0 H GLU A 118 -33.789 -30.206 1.406 1.00 0.00 H new ATOM 0 HA GLU A 118 -34.959 -30.325 3.938 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -35.278 -28.902 1.533 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -36.821 -29.700 1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -37.358 -28.456 3.602 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -35.707 -28.397 4.188 1.00 0.00 H new ATOM 1864 N ASP A 119 -35.926 -32.658 1.926 1.00 0.00 N ATOM 1865 CA ASP A 119 -36.739 -33.863 1.804 1.00 0.00 C ATOM 1866 C ASP A 119 -36.048 -35.053 2.462 1.00 0.00 C ATOM 1867 O ASP A 119 -36.637 -36.123 2.607 1.00 0.00 O ATOM 1868 CB ASP A 119 -37.016 -34.169 0.331 1.00 0.00 C ATOM 1869 CG ASP A 119 -38.483 -34.025 -0.024 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -39.335 -34.408 0.806 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -38.780 -33.530 -1.131 1.00 0.00 O ATOM 0 H ASP A 119 -35.199 -32.566 1.217 1.00 0.00 H new ATOM 0 HA ASP A 119 -37.685 -33.687 2.315 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -36.426 -33.498 -0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -36.689 -35.184 0.106 1.00 0.00 H new ATOM 1876 N GLY A 120 -34.794 -34.858 2.859 1.00 0.00 N ATOM 1877 CA GLY A 120 -34.043 -35.924 3.496 1.00 0.00 C ATOM 1878 C GLY A 120 -33.300 -36.787 2.496 1.00 0.00 C ATOM 1879 O GLY A 120 -32.895 -37.906 2.811 1.00 0.00 O ATOM 0 H GLY A 120 -34.285 -33.981 2.751 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -33.330 -35.492 4.199 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -34.724 -36.548 4.075 1.00 0.00 H new ATOM 1883 N ALA A 121 -33.121 -36.268 1.286 1.00 0.00 N ATOM 1884 CA ALA A 121 -32.421 -36.999 0.237 1.00 0.00 C ATOM 1885 C ALA A 121 -30.927 -36.695 0.260 1.00 0.00 C ATOM 1886 O ALA A 121 -30.504 -35.581 -0.050 1.00 0.00 O ATOM 1887 CB ALA A 121 -33.009 -36.660 -1.125 1.00 0.00 C ATOM 0 H ALA A 121 -33.451 -35.344 1.008 1.00 0.00 H new ATOM 0 HA ALA A 121 -32.552 -38.065 0.422 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -32.477 -37.213 -1.899 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -34.064 -36.933 -1.144 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -32.908 -35.590 -1.309 1.00 0.00 H new ATOM 1893 N VAL A 122 -30.130 -37.694 0.629 1.00 0.00 N ATOM 1894 CA VAL A 122 -28.682 -37.534 0.691 1.00 0.00 C ATOM 1895 C VAL A 122 -28.102 -37.236 -0.687 1.00 0.00 C ATOM 1896 O VAL A 122 -28.031 -38.117 -1.544 1.00 0.00 O ATOM 1897 CB VAL A 122 -28.003 -38.793 1.262 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -28.478 -40.036 0.525 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -26.489 -38.662 1.183 1.00 0.00 C ATOM 0 H VAL A 122 -30.463 -38.622 0.889 1.00 0.00 H new ATOM 0 HA VAL A 122 -28.484 -36.692 1.354 1.00 0.00 H new ATOM 0 HB VAL A 122 -28.283 -38.893 2.311 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -27.988 -40.916 0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -29.558 -40.135 0.637 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -28.229 -39.949 -0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -26.024 -39.560 1.590 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -26.188 -38.538 0.143 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -26.168 -37.794 1.759 1.00 0.00 H new ATOM 1909 N ILE A 123 -27.689 -35.990 -0.892 1.00 0.00 N ATOM 1910 CA ILE A 123 -27.113 -35.577 -2.166 1.00 0.00 C ATOM 1911 C ILE A 123 -25.597 -35.739 -2.162 1.00 0.00 C ATOM 1912 O ILE A 123 -25.038 -36.461 -2.987 1.00 0.00 O ATOM 1913 CB ILE A 123 -27.461 -34.113 -2.493 1.00 0.00 C ATOM 1914 CG1 ILE A 123 -28.942 -33.844 -2.216 1.00 0.00 C ATOM 1915 CG2 ILE A 123 -27.122 -33.799 -3.942 1.00 0.00 C ATOM 1916 CD1 ILE A 123 -29.876 -34.629 -3.109 1.00 0.00 C ATOM 0 H ILE A 123 -27.742 -35.249 -0.193 1.00 0.00 H new ATOM 0 HA ILE A 123 -27.543 -36.223 -2.931 1.00 0.00 H new ATOM 0 HB ILE A 123 -26.867 -33.462 -1.852 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -29.158 -34.086 -1.175 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -29.140 -32.780 -2.343 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -27.374 -32.761 -4.158 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -26.056 -33.956 -4.109 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -27.693 -34.455 -4.600 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -30.909 -34.388 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -29.687 -34.369 -4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -29.706 -35.696 -2.965 1.00 0.00 H new ATOM 1928 N MET A 124 -24.938 -35.064 -1.227 1.00 0.00 N ATOM 1929 CA MET A 124 -23.486 -35.135 -1.114 1.00 0.00 C ATOM 1930 C MET A 124 -23.070 -35.564 0.290 1.00 0.00 C ATOM 1931 O MET A 124 -23.915 -35.861 1.134 1.00 0.00 O ATOM 1932 CB MET A 124 -22.859 -33.781 -1.452 1.00 0.00 C ATOM 1933 CG MET A 124 -23.467 -32.621 -0.682 1.00 0.00 C ATOM 1934 SD MET A 124 -24.023 -31.287 -1.759 1.00 0.00 S ATOM 1935 CE MET A 124 -23.969 -29.896 -0.632 1.00 0.00 C ATOM 0 H MET A 124 -25.386 -34.462 -0.536 1.00 0.00 H new ATOM 0 HA MET A 124 -23.128 -35.880 -1.824 1.00 0.00 H new ATOM 0 HB2 MET A 124 -21.790 -33.823 -1.245 1.00 0.00 H new ATOM 0 HB3 MET A 124 -22.970 -33.595 -2.520 1.00 0.00 H new ATOM 0 HG2 MET A 124 -24.310 -32.983 -0.094 1.00 0.00 H new ATOM 0 HG3 MET A 124 -22.731 -32.232 0.022 1.00 0.00 H new ATOM 0 HE1 MET A 124 -24.287 -28.993 -1.153 1.00 0.00 H new ATOM 0 HE2 MET A 124 -24.636 -30.083 0.209 1.00 0.00 H new ATOM 0 HE3 MET A 124 -22.951 -29.764 -0.265 1.00 0.00 H new ATOM 1945 N PHE A 125 -21.764 -35.595 0.532 1.00 0.00 N ATOM 1946 CA PHE A 125 -21.237 -35.989 1.834 1.00 0.00 C ATOM 1947 C PHE A 125 -20.204 -34.981 2.330 1.00 0.00 C ATOM 1948 O PHE A 125 -19.416 -34.448 1.548 1.00 0.00 O ATOM 1949 CB PHE A 125 -20.609 -37.382 1.753 1.00 0.00 C ATOM 1950 CG PHE A 125 -21.135 -38.212 0.616 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -22.479 -38.540 0.545 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -20.285 -38.663 -0.380 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -22.967 -39.303 -0.499 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -20.767 -39.426 -1.427 1.00 0.00 C ATOM 1955 CZ PHE A 125 -22.109 -39.747 -1.486 1.00 0.00 C ATOM 0 H PHE A 125 -21.051 -35.352 -0.156 1.00 0.00 H new ATOM 0 HA PHE A 125 -22.065 -36.012 2.542 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.529 -37.279 1.648 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -20.790 -37.908 2.690 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -23.154 -38.195 1.315 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -19.234 -38.416 -0.338 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -24.017 -39.552 -0.543 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -20.095 -39.771 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 125 -22.487 -40.344 -2.303 1.00 0.00 H new ATOM 1965 N ILE A 126 -20.215 -34.725 3.634 1.00 0.00 N ATOM 1966 CA ILE A 126 -19.280 -33.783 4.235 1.00 0.00 C ATOM 1967 C ILE A 126 -18.383 -34.474 5.257 1.00 0.00 C ATOM 1968 O ILE A 126 -18.852 -35.265 6.076 1.00 0.00 O ATOM 1969 CB ILE A 126 -20.018 -32.617 4.920 1.00 0.00 C ATOM 1970 CG1 ILE A 126 -19.015 -31.671 5.584 1.00 0.00 C ATOM 1971 CG2 ILE A 126 -21.011 -33.148 5.943 1.00 0.00 C ATOM 1972 CD1 ILE A 126 -18.133 -30.938 4.598 1.00 0.00 C ATOM 0 H ILE A 126 -20.861 -35.157 4.294 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.666 -33.388 3.426 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.569 -32.059 4.163 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -19.558 -30.942 6.185 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.386 -32.242 6.267 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -21.525 -32.313 6.419 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.740 -33.786 5.445 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.480 -33.726 6.700 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -17.447 -30.286 5.138 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.563 -31.660 4.014 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.753 -30.339 3.930 1.00 0.00 H new ATOM 1984 N LEU A 127 -17.092 -34.168 5.204 1.00 0.00 N ATOM 1985 CA LEU A 127 -16.128 -34.758 6.127 1.00 0.00 C ATOM 1986 C LEU A 127 -15.220 -33.688 6.723 1.00 0.00 C ATOM 1987 O LEU A 127 -14.961 -32.661 6.098 1.00 0.00 O ATOM 1988 CB LEU A 127 -15.287 -35.816 5.410 1.00 0.00 C ATOM 1989 CG LEU A 127 -16.051 -37.017 4.852 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -16.565 -36.720 3.452 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -15.168 -38.256 4.847 1.00 0.00 C ATOM 0 H LEU A 127 -16.688 -33.515 4.532 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.681 -35.231 6.938 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -14.757 -35.334 4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -14.531 -36.183 6.105 1.00 0.00 H new ATOM 0 HG LEU A 127 -16.908 -37.209 5.498 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -17.106 -37.586 3.072 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -17.234 -35.860 3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.724 -36.500 2.795 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -15.729 -39.101 4.447 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -14.291 -38.075 4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -14.851 -38.481 5.865 1.00 0.00 H new ATOM 2003 N ASN A 128 -14.736 -33.938 7.936 1.00 0.00 N ATOM 2004 CA ASN A 128 -13.855 -32.997 8.617 1.00 0.00 C ATOM 2005 C ASN A 128 -12.812 -33.734 9.451 1.00 0.00 C ATOM 2006 O ASN A 128 -13.091 -34.787 10.025 1.00 0.00 O ATOM 2007 CB ASN A 128 -14.669 -32.059 9.510 1.00 0.00 C ATOM 2008 CG ASN A 128 -15.199 -30.856 8.754 1.00 0.00 C ATOM 2009 OD1 ASN A 128 -14.671 -29.750 8.876 1.00 0.00 O ATOM 2010 ND2 ASN A 128 -16.249 -31.067 7.968 1.00 0.00 N ATOM 0 H ASN A 128 -14.940 -34.785 8.467 1.00 0.00 H new ATOM 0 HA ASN A 128 -13.338 -32.408 7.859 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -15.504 -32.609 9.944 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -14.047 -31.719 10.338 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -16.650 -30.296 7.435 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -16.654 -32.001 7.898 1.00 0.00 H new ATOM 2017 N PHE A 129 -11.609 -33.173 9.514 1.00 0.00 N ATOM 2018 CA PHE A 129 -10.523 -33.777 10.278 1.00 0.00 C ATOM 2019 C PHE A 129 -10.290 -33.021 11.583 1.00 0.00 C ATOM 2020 O PHE A 129 -10.632 -31.844 11.700 1.00 0.00 O ATOM 2021 CB PHE A 129 -9.237 -33.795 9.450 1.00 0.00 C ATOM 2022 CG PHE A 129 -9.427 -34.330 8.059 1.00 0.00 C ATOM 2023 CD1 PHE A 129 -9.878 -33.506 7.041 1.00 0.00 C ATOM 2024 CD2 PHE A 129 -9.155 -35.658 7.770 1.00 0.00 C ATOM 2025 CE1 PHE A 129 -10.054 -33.994 5.760 1.00 0.00 C ATOM 2026 CE2 PHE A 129 -9.329 -36.152 6.491 1.00 0.00 C ATOM 2027 CZ PHE A 129 -9.780 -35.320 5.485 1.00 0.00 C ATOM 0 H PHE A 129 -11.361 -32.301 9.046 1.00 0.00 H new ATOM 0 HA PHE A 129 -10.807 -34.802 10.518 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -8.839 -32.782 9.390 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -8.491 -34.401 9.965 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -10.095 -32.469 7.251 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -8.803 -36.314 8.553 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -10.405 -33.340 4.975 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -9.112 -37.188 6.278 1.00 0.00 H new ATOM 0 HZ PHE A 129 -9.918 -35.705 4.486 1.00 0.00 H new ATOM 2037 N GLU A 130 -9.706 -33.706 12.561 1.00 0.00 N ATOM 2038 CA GLU A 130 -9.429 -33.099 13.858 1.00 0.00 C ATOM 2039 C GLU A 130 -8.318 -33.853 14.584 1.00 0.00 C ATOM 2040 O GLU A 130 -8.507 -34.986 15.027 1.00 0.00 O ATOM 2041 CB GLU A 130 -10.694 -33.080 14.718 1.00 0.00 C ATOM 2042 CG GLU A 130 -10.444 -32.670 16.159 1.00 0.00 C ATOM 2043 CD GLU A 130 -9.889 -31.264 16.278 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -10.448 -30.349 15.637 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -8.896 -31.079 17.012 1.00 0.00 O ATOM 0 H GLU A 130 -9.416 -34.680 12.480 1.00 0.00 H new ATOM 0 HA GLU A 130 -9.099 -32.074 13.688 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -11.415 -32.394 14.274 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -11.147 -34.071 14.705 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -11.377 -32.737 16.719 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.747 -33.372 16.617 1.00 0.00 H new ATOM 2052 N VAL A 131 -7.158 -33.215 14.703 1.00 0.00 N ATOM 2053 CA VAL A 131 -6.016 -33.823 15.375 1.00 0.00 C ATOM 2054 C VAL A 131 -6.371 -34.231 16.800 1.00 0.00 C ATOM 2055 O VAL A 131 -7.054 -33.498 17.516 1.00 0.00 O ATOM 2056 CB VAL A 131 -4.811 -32.864 15.413 1.00 0.00 C ATOM 2057 CG1 VAL A 131 -3.565 -33.591 15.895 1.00 0.00 C ATOM 2058 CG2 VAL A 131 -4.580 -32.246 14.042 1.00 0.00 C ATOM 0 H VAL A 131 -6.984 -32.277 14.343 1.00 0.00 H new ATOM 0 HA VAL A 131 -5.747 -34.710 14.802 1.00 0.00 H new ATOM 0 HB VAL A 131 -5.029 -32.061 16.117 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -2.724 -32.898 15.915 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -3.737 -33.982 16.898 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -3.340 -34.415 15.218 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -3.725 -31.571 14.086 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -4.382 -33.035 13.316 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -5.467 -31.689 13.740 1.00 0.00 H new ATOM 2068 N VAL A 132 -5.903 -35.406 17.208 1.00 0.00 N ATOM 2069 CA VAL A 132 -6.169 -35.913 18.549 1.00 0.00 C ATOM 2070 C VAL A 132 -4.872 -36.246 19.278 1.00 0.00 C ATOM 2071 O VAL A 132 -4.783 -36.111 20.498 1.00 0.00 O ATOM 2072 CB VAL A 132 -7.059 -37.169 18.508 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -7.320 -37.685 19.915 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -8.367 -36.871 17.789 1.00 0.00 C ATOM 0 H VAL A 132 -5.337 -36.026 16.628 1.00 0.00 H new ATOM 0 HA VAL A 132 -6.693 -35.123 19.088 1.00 0.00 H new ATOM 0 HB VAL A 132 -6.535 -37.947 17.953 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -7.951 -38.573 19.866 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -6.373 -37.939 20.391 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -7.824 -36.914 20.498 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -8.984 -37.769 17.769 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -8.898 -36.077 18.314 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -8.157 -36.553 16.768 1.00 0.00 H new ATOM 2084 N MET A 133 -3.870 -36.680 18.522 1.00 0.00 N ATOM 2085 CA MET A 133 -2.576 -37.031 19.097 1.00 0.00 C ATOM 2086 C MET A 133 -1.436 -36.450 18.267 1.00 0.00 C ATOM 2087 O MET A 133 -0.887 -37.122 17.394 1.00 0.00 O ATOM 2088 CB MET A 133 -2.431 -38.551 19.191 1.00 0.00 C ATOM 2089 CG MET A 133 -2.469 -39.079 20.616 1.00 0.00 C ATOM 2090 SD MET A 133 -3.858 -40.191 20.907 1.00 0.00 S ATOM 2091 CE MET A 133 -3.496 -40.757 22.568 1.00 0.00 C ATOM 0 H MET A 133 -3.928 -36.797 17.510 1.00 0.00 H new ATOM 0 HA MET A 133 -2.525 -36.606 20.099 1.00 0.00 H new ATOM 0 HB2 MET A 133 -3.230 -39.020 18.617 1.00 0.00 H new ATOM 0 HB3 MET A 133 -1.490 -38.847 18.728 1.00 0.00 H new ATOM 0 HG2 MET A 133 -1.538 -39.603 20.830 1.00 0.00 H new ATOM 0 HG3 MET A 133 -2.529 -38.240 21.309 1.00 0.00 H new ATOM 0 HE1 MET A 133 -4.268 -41.455 22.891 1.00 0.00 H new ATOM 0 HE2 MET A 133 -2.528 -41.257 22.579 1.00 0.00 H new ATOM 0 HE3 MET A 133 -3.471 -39.904 23.246 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.086 -35.198 18.544 1.00 0.00 N ATOM 2102 CA GLU A 134 -0.012 -34.527 17.821 1.00 0.00 C ATOM 2103 C GLU A 134 1.341 -35.146 18.159 1.00 0.00 C ATOM 2104 O GLU A 134 2.041 -34.684 19.060 1.00 0.00 O ATOM 2105 CB GLU A 134 0.001 -33.033 18.152 1.00 0.00 C ATOM 2106 CG GLU A 134 -1.386 -32.432 18.308 1.00 0.00 C ATOM 2107 CD GLU A 134 -1.724 -32.112 19.751 1.00 0.00 C ATOM 2108 OE1 GLU A 134 -1.487 -32.975 20.622 1.00 0.00 O ATOM 2109 OE2 GLU A 134 -2.226 -30.998 20.009 1.00 0.00 O ATOM 0 H GLU A 134 -1.530 -34.628 19.264 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.193 -34.653 16.754 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.560 -32.879 19.075 1.00 0.00 H new ATOM 0 HB3 GLU A 134 0.532 -32.499 17.364 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -1.452 -31.521 17.713 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -2.126 -33.127 17.911 1.00 0.00 H new ATOM 2116 N LYS A 135 1.703 -36.197 17.430 1.00 0.00 N ATOM 2117 CA LYS A 135 2.971 -36.881 17.651 1.00 0.00 C ATOM 2118 C LYS A 135 4.112 -36.151 16.949 1.00 0.00 C ATOM 2119 O LYS A 135 5.035 -35.654 17.596 1.00 0.00 O ATOM 2120 CB LYS A 135 2.890 -38.324 17.148 1.00 0.00 C ATOM 2121 CG LYS A 135 1.735 -39.111 17.742 1.00 0.00 C ATOM 2122 CD LYS A 135 1.765 -39.086 19.261 1.00 0.00 C ATOM 2123 CE LYS A 135 3.040 -39.715 19.803 1.00 0.00 C ATOM 2124 NZ LYS A 135 2.750 -40.801 20.780 1.00 0.00 N ATOM 0 H LYS A 135 1.135 -36.593 16.681 1.00 0.00 H new ATOM 0 HA LYS A 135 3.170 -36.886 18.723 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.793 -38.317 16.062 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.824 -38.834 17.381 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.791 -38.696 17.389 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.779 -40.143 17.393 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.689 -38.056 19.611 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.899 -39.621 19.652 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.627 -40.117 18.977 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.648 -38.948 20.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.644 -41.204 21.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.212 -40.413 21.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.191 -41.545 20.316 1.00 0.00 H new