USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=18 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 Single : A 28 LYS NZ :NH3+ -114:sc= 1.19 (180deg=-0.385) USER MOD Single : A 33 ASN : amide:sc= -5.84! C(o=-5.8!,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 -26:sc= -0.958 USER MOD Single : A 45 ASN : amide:sc= -0.102 K(o=-0.1,f=-2.3) USER MOD Single : A 49 CYS SG : rot 33:sc= -0.0446 USER MOD Single : A 52 CYS SG : rot -64:sc= 0.0735 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.832 K(o=-0.83,f=-0.16) USER MOD Single : A 64 CYS SG : rot -80:sc= -0.751 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -2.24 K(o=-2.2,f=-4.9!) USER MOD Single : A 74 THR OG1 : rot -122:sc=0.000796 USER MOD Single : A 75 GLN : amide:sc= -0.127 K(o=-0.13,f=-1.2) USER MOD Single : A 81 GLN : amide:sc= -0.469 K(o=-0.47,f=-1.8!) USER MOD Single : A 84 GLN : amide:sc= -1.75 X(o=-1.8,f=-1.5) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -149:sc= 0.066 (180deg=-0.71) USER MOD Single : A 104 SER OG : rot 180:sc= -0.0507 USER MOD Single : A 105 CYS SG : rot 6:sc= 0.0809 USER MOD Single : A 108 CYS SG : rot -112:sc= -0.836 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -6.54! C(o=-6.5!,f=-17!) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -0.046 K(o=-0.046,f=-0.86) USER MOD Single : A 133 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.57) USER MOD ----------------------------------------------------------------- ATOM 424 N ARG A 27 -8.453 -25.065 10.728 1.00 0.00 N ATOM 425 CA ARG A 27 -8.811 -26.478 10.732 1.00 0.00 C ATOM 426 C ARG A 27 -8.802 -27.045 9.316 1.00 0.00 C ATOM 427 O ARG A 27 -8.166 -26.493 8.418 1.00 0.00 O ATOM 428 CB ARG A 27 -10.191 -26.674 11.363 1.00 0.00 C ATOM 429 CG ARG A 27 -11.329 -26.114 10.526 1.00 0.00 C ATOM 430 CD ARG A 27 -12.591 -26.949 10.671 1.00 0.00 C ATOM 431 NE ARG A 27 -13.790 -26.120 10.751 1.00 0.00 N ATOM 432 CZ ARG A 27 -15.017 -26.612 10.878 1.00 0.00 C ATOM 433 NH1 ARG A 27 -15.206 -27.923 10.939 1.00 0.00 N ATOM 434 NH2 ARG A 27 -16.059 -25.793 10.944 1.00 0.00 N ATOM 0 HA ARG A 27 -8.069 -27.014 11.324 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -10.360 -27.739 11.524 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -10.204 -26.198 12.343 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -11.534 -25.087 10.829 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -11.030 -26.083 9.478 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -12.676 -27.628 9.822 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -12.516 -27.566 11.567 1.00 0.00 H new ATOM 0 HE ARG A 27 -13.679 -25.107 10.707 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -14.408 -28.556 10.888 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -16.149 -28.298 11.037 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -15.918 -24.784 10.897 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -17.001 -26.173 11.042 1.00 0.00 H new ATOM 448 N LYS A 28 -9.511 -28.152 9.123 1.00 0.00 N ATOM 449 CA LYS A 28 -9.587 -28.796 7.817 1.00 0.00 C ATOM 450 C LYS A 28 -11.029 -29.146 7.466 1.00 0.00 C ATOM 451 O LYS A 28 -11.898 -29.187 8.336 1.00 0.00 O ATOM 452 CB LYS A 28 -8.724 -30.060 7.798 1.00 0.00 C ATOM 453 CG LYS A 28 -7.343 -29.863 8.399 1.00 0.00 C ATOM 454 CD LYS A 28 -6.484 -28.955 7.535 1.00 0.00 C ATOM 455 CE LYS A 28 -5.268 -28.449 8.296 1.00 0.00 C ATOM 456 NZ LYS A 28 -5.452 -27.049 8.768 1.00 0.00 N ATOM 0 H LYS A 28 -10.042 -28.623 9.856 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.211 -28.095 7.072 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -9.239 -30.850 8.344 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -8.618 -30.402 6.768 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.437 -29.435 9.397 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.853 -30.830 8.512 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.159 -29.497 6.647 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.078 -28.108 7.192 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.078 -29.098 9.151 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.389 -28.503 7.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.779 -26.426 8.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.424 -26.739 8.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.282 -27.003 9.793 1.00 0.00 H new ATOM 470 N PHE A 29 -11.276 -29.399 6.185 1.00 0.00 N ATOM 471 CA PHE A 29 -12.613 -29.747 5.718 1.00 0.00 C ATOM 472 C PHE A 29 -12.567 -30.298 4.296 1.00 0.00 C ATOM 473 O PHE A 29 -11.856 -29.774 3.439 1.00 0.00 O ATOM 474 CB PHE A 29 -13.530 -28.523 5.773 1.00 0.00 C ATOM 475 CG PHE A 29 -14.514 -28.460 4.641 1.00 0.00 C ATOM 476 CD1 PHE A 29 -15.515 -29.411 4.521 1.00 0.00 C ATOM 477 CD2 PHE A 29 -14.439 -27.450 3.696 1.00 0.00 C ATOM 478 CE1 PHE A 29 -16.422 -29.355 3.479 1.00 0.00 C ATOM 479 CE2 PHE A 29 -15.343 -27.389 2.652 1.00 0.00 C ATOM 480 CZ PHE A 29 -16.336 -28.342 2.544 1.00 0.00 C ATOM 0 H PHE A 29 -10.568 -29.370 5.452 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.010 -30.520 6.376 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.075 -28.529 6.717 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -12.919 -27.620 5.763 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.587 -30.205 5.250 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -13.665 -26.701 3.776 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -17.197 -30.103 3.396 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -15.273 -26.597 1.922 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.044 -28.296 1.730 1.00 0.00 H new ATOM 490 N ILE A 30 -13.330 -31.359 4.054 1.00 0.00 N ATOM 491 CA ILE A 30 -13.377 -31.981 2.737 1.00 0.00 C ATOM 492 C ILE A 30 -14.767 -32.533 2.439 1.00 0.00 C ATOM 493 O ILE A 30 -15.407 -33.131 3.305 1.00 0.00 O ATOM 494 CB ILE A 30 -12.348 -33.120 2.615 1.00 0.00 C ATOM 495 CG1 ILE A 30 -12.485 -34.089 3.792 1.00 0.00 C ATOM 496 CG2 ILE A 30 -10.937 -32.554 2.550 1.00 0.00 C ATOM 497 CD1 ILE A 30 -11.643 -33.708 4.990 1.00 0.00 C ATOM 0 H ILE A 30 -13.924 -31.805 4.753 1.00 0.00 H new ATOM 0 HA ILE A 30 -13.134 -31.204 2.012 1.00 0.00 H new ATOM 0 HB ILE A 30 -12.542 -33.668 1.693 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.531 -34.136 4.094 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.203 -35.089 3.463 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.221 -33.371 2.464 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.847 -31.900 1.683 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.731 -31.985 3.457 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -11.790 -34.439 5.785 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -10.591 -33.689 4.704 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -11.940 -32.721 5.345 1.00 0.00 H new ATOM 509 N ILE A 31 -15.227 -32.331 1.209 1.00 0.00 N ATOM 510 CA ILE A 31 -16.539 -32.811 0.796 1.00 0.00 C ATOM 511 C ILE A 31 -16.430 -33.747 -0.404 1.00 0.00 C ATOM 512 O ILE A 31 -15.656 -33.499 -1.328 1.00 0.00 O ATOM 513 CB ILE A 31 -17.479 -31.645 0.439 1.00 0.00 C ATOM 514 CG1 ILE A 31 -18.862 -32.174 0.055 1.00 0.00 C ATOM 515 CG2 ILE A 31 -16.890 -30.817 -0.694 1.00 0.00 C ATOM 516 CD1 ILE A 31 -19.037 -32.383 -1.433 1.00 0.00 C ATOM 0 H ILE A 31 -14.710 -31.838 0.481 1.00 0.00 H new ATOM 0 HA ILE A 31 -16.956 -33.356 1.643 1.00 0.00 H new ATOM 0 HB ILE A 31 -17.586 -31.004 1.314 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -19.036 -33.119 0.569 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -19.620 -31.475 0.407 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -17.566 -29.997 -0.935 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -15.925 -30.414 -0.386 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -16.756 -31.447 -1.573 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -20.041 -32.759 -1.632 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -18.895 -31.435 -1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.302 -33.105 -1.788 1.00 0.00 H new ATOM 528 N ALA A 32 -17.212 -34.821 -0.382 1.00 0.00 N ATOM 529 CA ALA A 32 -17.206 -35.792 -1.470 1.00 0.00 C ATOM 530 C ALA A 32 -18.616 -36.032 -1.999 1.00 0.00 C ATOM 531 O ALA A 32 -19.594 -35.910 -1.263 1.00 0.00 O ATOM 532 CB ALA A 32 -16.585 -37.101 -1.005 1.00 0.00 C ATOM 0 H ALA A 32 -17.857 -35.041 0.377 1.00 0.00 H new ATOM 0 HA ALA A 32 -16.605 -35.386 -2.284 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -16.587 -37.817 -1.827 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.559 -36.923 -0.682 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -17.163 -37.503 -0.173 1.00 0.00 H new ATOM 538 N ASN A 33 -18.712 -36.371 -3.280 1.00 0.00 N ATOM 539 CA ASN A 33 -20.003 -36.627 -3.909 1.00 0.00 C ATOM 540 C ASN A 33 -20.202 -38.119 -4.155 1.00 0.00 C ATOM 541 O ASN A 33 -19.277 -38.820 -4.562 1.00 0.00 O ATOM 542 CB ASN A 33 -20.111 -35.861 -5.229 1.00 0.00 C ATOM 543 CG ASN A 33 -19.110 -36.344 -6.261 1.00 0.00 C ATOM 544 OD1 ASN A 33 -18.095 -36.953 -5.920 1.00 0.00 O ATOM 545 ND2 ASN A 33 -19.391 -36.073 -7.530 1.00 0.00 N ATOM 0 H ASN A 33 -17.911 -36.475 -3.903 1.00 0.00 H new ATOM 0 HA ASN A 33 -20.784 -36.282 -3.232 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -21.120 -35.969 -5.627 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -19.953 -34.799 -5.043 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -18.754 -36.372 -8.268 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -20.244 -35.566 -7.766 1.00 0.00 H new ATOM 552 N ALA A 34 -21.417 -38.597 -3.906 1.00 0.00 N ATOM 553 CA ALA A 34 -21.739 -40.005 -4.103 1.00 0.00 C ATOM 554 C ALA A 34 -21.460 -40.436 -5.538 1.00 0.00 C ATOM 555 O ALA A 34 -21.229 -41.615 -5.809 1.00 0.00 O ATOM 556 CB ALA A 34 -23.194 -40.268 -3.744 1.00 0.00 C ATOM 0 H ALA A 34 -22.194 -38.030 -3.568 1.00 0.00 H new ATOM 0 HA ALA A 34 -21.101 -40.594 -3.444 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -23.421 -41.323 -3.896 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -23.364 -40.007 -2.700 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -23.841 -39.663 -4.379 1.00 0.00 H new ATOM 631 N CYS A 39 -13.590 -41.797 -7.824 1.00 0.00 N ATOM 632 CA CYS A 39 -13.600 -42.285 -6.450 1.00 0.00 C ATOM 633 C CYS A 39 -12.675 -41.452 -5.569 1.00 0.00 C ATOM 634 O CYS A 39 -11.800 -41.988 -4.889 1.00 0.00 O ATOM 635 CB CYS A 39 -13.179 -43.755 -6.406 1.00 0.00 C ATOM 636 SG CYS A 39 -13.885 -44.684 -5.024 1.00 0.00 S ATOM 0 HA CYS A 39 -14.616 -42.193 -6.066 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -13.473 -44.234 -7.340 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -12.092 -43.809 -6.349 1.00 0.00 H new ATOM 0 HG CYS A 39 -13.473 -45.916 -5.074 1.00 0.00 H new ATOM 642 N ALA A 40 -12.873 -40.138 -5.588 1.00 0.00 N ATOM 643 CA ALA A 40 -12.056 -39.231 -4.792 1.00 0.00 C ATOM 644 C ALA A 40 -12.886 -38.065 -4.265 1.00 0.00 C ATOM 645 O ALA A 40 -14.053 -37.908 -4.624 1.00 0.00 O ATOM 646 CB ALA A 40 -10.883 -38.717 -5.614 1.00 0.00 C ATOM 0 H ALA A 40 -13.592 -39.678 -6.146 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.670 -39.785 -3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.282 -38.041 -5.007 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.269 -39.558 -5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -11.257 -38.184 -6.488 1.00 0.00 H new ATOM 652 N VAL A 41 -12.276 -37.249 -3.410 1.00 0.00 N ATOM 653 CA VAL A 41 -12.959 -36.098 -2.833 1.00 0.00 C ATOM 654 C VAL A 41 -13.280 -35.057 -3.901 1.00 0.00 C ATOM 655 O VAL A 41 -12.567 -34.937 -4.898 1.00 0.00 O ATOM 656 CB VAL A 41 -12.113 -35.439 -1.728 1.00 0.00 C ATOM 657 CG1 VAL A 41 -10.805 -34.912 -2.299 1.00 0.00 C ATOM 658 CG2 VAL A 41 -12.896 -34.324 -1.051 1.00 0.00 C ATOM 0 H VAL A 41 -11.310 -37.364 -3.102 1.00 0.00 H new ATOM 0 HA VAL A 41 -13.888 -36.467 -2.398 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.876 -36.193 -0.978 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.221 -34.450 -1.503 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.239 -35.736 -2.733 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -11.017 -34.172 -3.070 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -12.283 -33.869 -0.273 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.165 -33.568 -1.789 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.802 -34.734 -0.605 1.00 0.00 H new ATOM 668 N ILE A 42 -14.355 -34.308 -3.684 1.00 0.00 N ATOM 669 CA ILE A 42 -14.769 -33.276 -4.628 1.00 0.00 C ATOM 670 C ILE A 42 -14.130 -31.934 -4.289 1.00 0.00 C ATOM 671 O ILE A 42 -13.700 -31.197 -5.177 1.00 0.00 O ATOM 672 CB ILE A 42 -16.300 -33.113 -4.648 1.00 0.00 C ATOM 673 CG1 ILE A 42 -16.960 -34.359 -5.242 1.00 0.00 C ATOM 674 CG2 ILE A 42 -16.690 -31.873 -5.437 1.00 0.00 C ATOM 675 CD1 ILE A 42 -16.597 -34.602 -6.691 1.00 0.00 C ATOM 0 H ILE A 42 -14.955 -34.396 -2.864 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.434 -33.597 -5.614 1.00 0.00 H new ATOM 0 HB ILE A 42 -16.651 -32.993 -3.623 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.671 -35.229 -4.653 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -18.042 -34.262 -5.158 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.775 -31.771 -5.442 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -16.245 -30.992 -4.974 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -16.329 -31.965 -6.461 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -17.100 -35.501 -7.046 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -16.911 -33.749 -7.293 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.518 -34.731 -6.779 1.00 0.00 H new ATOM 687 N TYR A 43 -14.070 -31.622 -2.999 1.00 0.00 N ATOM 688 CA TYR A 43 -13.484 -30.368 -2.542 1.00 0.00 C ATOM 689 C TYR A 43 -12.655 -30.582 -1.279 1.00 0.00 C ATOM 690 O TYR A 43 -12.971 -31.439 -0.453 1.00 0.00 O ATOM 691 CB TYR A 43 -14.581 -29.335 -2.276 1.00 0.00 C ATOM 692 CG TYR A 43 -14.351 -28.014 -2.975 1.00 0.00 C ATOM 693 CD1 TYR A 43 -14.829 -27.794 -4.261 1.00 0.00 C ATOM 694 CD2 TYR A 43 -13.655 -26.987 -2.350 1.00 0.00 C ATOM 695 CE1 TYR A 43 -14.621 -26.589 -4.904 1.00 0.00 C ATOM 696 CE2 TYR A 43 -13.444 -25.778 -2.984 1.00 0.00 C ATOM 697 CZ TYR A 43 -13.928 -25.584 -4.261 1.00 0.00 C ATOM 698 OH TYR A 43 -13.718 -24.382 -4.897 1.00 0.00 O ATOM 0 H TYR A 43 -14.420 -32.221 -2.251 1.00 0.00 H new ATOM 0 HA TYR A 43 -12.826 -29.996 -3.328 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.539 -29.744 -2.597 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.652 -29.161 -1.202 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.372 -28.578 -4.767 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -13.272 -27.136 -1.351 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -14.999 -26.435 -5.904 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -12.903 -24.989 -2.483 1.00 0.00 H new ATOM 0 HH TYR A 43 -13.215 -23.783 -4.307 1.00 0.00 H new ATOM 708 N CYS A 44 -11.594 -29.796 -1.136 1.00 0.00 N ATOM 709 CA CYS A 44 -10.718 -29.898 0.026 1.00 0.00 C ATOM 710 C CYS A 44 -10.208 -28.523 0.445 1.00 0.00 C ATOM 711 O CYS A 44 -9.470 -27.872 -0.293 1.00 0.00 O ATOM 712 CB CYS A 44 -9.537 -30.821 -0.279 1.00 0.00 C ATOM 713 SG CYS A 44 -8.715 -30.474 -1.852 1.00 0.00 S ATOM 0 H CYS A 44 -11.319 -29.081 -1.810 1.00 0.00 H new ATOM 0 HA CYS A 44 -11.296 -30.318 0.849 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -8.807 -30.737 0.526 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -9.888 -31.853 -0.285 1.00 0.00 H new ATOM 0 HG CYS A 44 -9.559 -29.917 -2.669 1.00 0.00 H new ATOM 719 N ASN A 45 -10.609 -28.087 1.635 1.00 0.00 N ATOM 720 CA ASN A 45 -10.195 -26.787 2.151 1.00 0.00 C ATOM 721 C ASN A 45 -8.684 -26.611 2.032 1.00 0.00 C ATOM 722 O ASN A 45 -7.932 -27.585 2.047 1.00 0.00 O ATOM 723 CB ASN A 45 -10.624 -26.636 3.612 1.00 0.00 C ATOM 724 CG ASN A 45 -10.355 -25.244 4.152 1.00 0.00 C ATOM 725 OD1 ASN A 45 -10.395 -24.261 3.413 1.00 0.00 O ATOM 726 ND2 ASN A 45 -10.080 -25.156 5.448 1.00 0.00 N ATOM 0 H ASN A 45 -11.219 -28.614 2.259 1.00 0.00 H new ATOM 0 HA ASN A 45 -10.681 -26.015 1.555 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -11.687 -26.858 3.701 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -10.094 -27.368 4.221 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -9.891 -24.246 5.869 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -10.058 -25.998 6.023 1.00 0.00 H new ATOM 733 N ASP A 46 -8.248 -25.362 1.915 1.00 0.00 N ATOM 734 CA ASP A 46 -6.827 -25.056 1.795 1.00 0.00 C ATOM 735 C ASP A 46 -6.030 -25.733 2.906 1.00 0.00 C ATOM 736 O ASP A 46 -4.866 -26.087 2.721 1.00 0.00 O ATOM 737 CB ASP A 46 -6.603 -23.544 1.839 1.00 0.00 C ATOM 738 CG ASP A 46 -5.356 -23.121 1.087 1.00 0.00 C ATOM 739 OD1 ASP A 46 -4.247 -23.287 1.637 1.00 0.00 O ATOM 740 OD2 ASP A 46 -5.489 -22.625 -0.052 1.00 0.00 O ATOM 0 H ASP A 46 -8.858 -24.545 1.901 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.478 -25.439 0.836 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.470 -23.039 1.413 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.525 -23.221 2.877 1.00 0.00 H new ATOM 745 N GLY A 47 -6.665 -25.911 4.060 1.00 0.00 N ATOM 746 CA GLY A 47 -6.000 -26.543 5.184 1.00 0.00 C ATOM 747 C GLY A 47 -5.487 -27.930 4.848 1.00 0.00 C ATOM 748 O GLY A 47 -4.314 -28.235 5.064 1.00 0.00 O ATOM 0 H GLY A 47 -7.629 -25.628 4.237 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.167 -25.919 5.507 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -6.693 -26.608 6.023 1.00 0.00 H new ATOM 752 N PHE A 48 -6.368 -28.773 4.319 1.00 0.00 N ATOM 753 CA PHE A 48 -5.998 -30.136 3.955 1.00 0.00 C ATOM 754 C PHE A 48 -4.700 -30.151 3.153 1.00 0.00 C ATOM 755 O PHE A 48 -3.780 -30.912 3.456 1.00 0.00 O ATOM 756 CB PHE A 48 -7.119 -30.792 3.146 1.00 0.00 C ATOM 757 CG PHE A 48 -6.976 -32.282 3.023 1.00 0.00 C ATOM 758 CD1 PHE A 48 -6.003 -32.833 2.206 1.00 0.00 C ATOM 759 CD2 PHE A 48 -7.817 -33.132 3.724 1.00 0.00 C ATOM 760 CE1 PHE A 48 -5.868 -34.204 2.090 1.00 0.00 C ATOM 761 CE2 PHE A 48 -7.687 -34.503 3.613 1.00 0.00 C ATOM 762 CZ PHE A 48 -6.712 -35.040 2.795 1.00 0.00 C ATOM 0 H PHE A 48 -7.343 -28.536 4.133 1.00 0.00 H new ATOM 0 HA PHE A 48 -5.843 -30.702 4.874 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -8.076 -30.564 3.615 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.141 -30.353 2.148 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -5.341 -32.183 1.652 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -8.582 -32.718 4.364 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -5.104 -34.620 1.450 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -8.348 -35.155 4.166 1.00 0.00 H new ATOM 0 HZ PHE A 48 -6.610 -36.112 2.707 1.00 0.00 H new ATOM 772 N CYS A 49 -4.635 -29.308 2.128 1.00 0.00 N ATOM 773 CA CYS A 49 -3.451 -29.225 1.281 1.00 0.00 C ATOM 774 C CYS A 49 -2.232 -28.794 2.090 1.00 0.00 C ATOM 775 O CYS A 49 -1.128 -29.296 1.881 1.00 0.00 O ATOM 776 CB CYS A 49 -3.688 -28.244 0.132 1.00 0.00 C ATOM 777 SG CYS A 49 -2.219 -27.907 -0.867 1.00 0.00 S ATOM 0 H CYS A 49 -5.388 -28.673 1.864 1.00 0.00 H new ATOM 0 HA CYS A 49 -3.259 -30.216 0.870 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -4.471 -28.641 -0.515 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -4.059 -27.304 0.542 1.00 0.00 H new ATOM 0 HG CYS A 49 -1.475 -28.972 -0.918 1.00 0.00 H new ATOM 783 N GLU A 50 -2.440 -27.860 3.012 1.00 0.00 N ATOM 784 CA GLU A 50 -1.357 -27.360 3.851 1.00 0.00 C ATOM 785 C GLU A 50 -0.884 -28.434 4.826 1.00 0.00 C ATOM 786 O GLU A 50 0.253 -28.401 5.300 1.00 0.00 O ATOM 787 CB GLU A 50 -1.811 -26.120 4.623 1.00 0.00 C ATOM 788 CG GLU A 50 -2.085 -26.384 6.094 1.00 0.00 C ATOM 789 CD GLU A 50 -0.822 -26.374 6.933 1.00 0.00 C ATOM 790 OE1 GLU A 50 0.197 -25.823 6.465 1.00 0.00 O ATOM 791 OE2 GLU A 50 -0.851 -26.917 8.057 1.00 0.00 O ATOM 0 H GLU A 50 -3.348 -27.434 3.197 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.524 -27.090 3.202 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.045 -25.349 4.538 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.715 -25.725 4.159 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.774 -25.629 6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -2.580 -27.349 6.200 1.00 0.00 H new ATOM 798 N LEU A 51 -1.763 -29.386 5.121 1.00 0.00 N ATOM 799 CA LEU A 51 -1.436 -30.470 6.040 1.00 0.00 C ATOM 800 C LEU A 51 -0.566 -31.520 5.356 1.00 0.00 C ATOM 801 O LEU A 51 0.511 -31.862 5.845 1.00 0.00 O ATOM 802 CB LEU A 51 -2.716 -31.119 6.570 1.00 0.00 C ATOM 803 CG LEU A 51 -3.014 -30.901 8.054 1.00 0.00 C ATOM 804 CD1 LEU A 51 -4.354 -31.517 8.425 1.00 0.00 C ATOM 805 CD2 LEU A 51 -1.901 -31.484 8.913 1.00 0.00 C ATOM 0 H LEU A 51 -2.707 -29.429 4.737 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.876 -30.049 6.875 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.558 -30.740 5.991 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.659 -32.192 6.385 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.066 -29.828 8.241 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -4.549 -31.352 9.485 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.144 -31.053 7.834 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -4.331 -32.588 8.223 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.130 -31.320 9.966 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.817 -32.554 8.723 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.958 -30.996 8.666 1.00 0.00 H new ATOM 817 N CYS A 52 -1.040 -32.026 4.223 1.00 0.00 N ATOM 818 CA CYS A 52 -0.304 -33.036 3.470 1.00 0.00 C ATOM 819 C CYS A 52 0.826 -32.400 2.666 1.00 0.00 C ATOM 820 O CYS A 52 1.575 -33.089 1.977 1.00 0.00 O ATOM 821 CB CYS A 52 -1.248 -33.793 2.535 1.00 0.00 C ATOM 822 SG CYS A 52 -2.268 -32.724 1.492 1.00 0.00 S ATOM 0 H CYS A 52 -1.930 -31.754 3.806 1.00 0.00 H new ATOM 0 HA CYS A 52 0.132 -33.738 4.181 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.659 -34.451 1.896 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.901 -34.430 3.132 1.00 0.00 H new ATOM 0 HG CYS A 52 -3.062 -32.017 2.240 1.00 0.00 H new ATOM 828 N GLY A 53 0.940 -31.078 2.760 1.00 0.00 N ATOM 829 CA GLY A 53 1.979 -30.371 2.035 1.00 0.00 C ATOM 830 C GLY A 53 2.091 -30.823 0.593 1.00 0.00 C ATOM 831 O GLY A 53 3.189 -30.888 0.038 1.00 0.00 O ATOM 0 H GLY A 53 0.332 -30.485 3.325 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.773 -29.301 2.062 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.935 -30.524 2.536 1.00 0.00 H new ATOM 835 N TYR A 54 0.954 -31.140 -0.016 1.00 0.00 N ATOM 836 CA TYR A 54 0.930 -31.593 -1.402 1.00 0.00 C ATOM 837 C TYR A 54 0.549 -30.453 -2.342 1.00 0.00 C ATOM 838 O TYR A 54 0.326 -29.324 -1.907 1.00 0.00 O ATOM 839 CB TYR A 54 -0.055 -32.752 -1.564 1.00 0.00 C ATOM 840 CG TYR A 54 0.610 -34.109 -1.615 1.00 0.00 C ATOM 841 CD1 TYR A 54 1.725 -34.388 -0.835 1.00 0.00 C ATOM 842 CD2 TYR A 54 0.123 -35.112 -2.444 1.00 0.00 C ATOM 843 CE1 TYR A 54 2.337 -35.626 -0.879 1.00 0.00 C ATOM 844 CE2 TYR A 54 0.727 -36.354 -2.493 1.00 0.00 C ATOM 845 CZ TYR A 54 1.833 -36.606 -1.710 1.00 0.00 C ATOM 846 OH TYR A 54 2.439 -37.840 -1.757 1.00 0.00 O ATOM 0 H TYR A 54 0.037 -31.092 0.428 1.00 0.00 H new ATOM 0 HA TYR A 54 1.931 -31.936 -1.663 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.763 -32.735 -0.735 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.630 -32.604 -2.478 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.121 -33.624 -0.183 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.742 -34.918 -3.061 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.204 -35.826 -0.267 1.00 0.00 H new ATOM 0 HE2 TYR A 54 0.334 -37.123 -3.141 1.00 0.00 H new ATOM 0 HH TYR A 54 1.961 -38.415 -2.390 1.00 0.00 H new ATOM 856 N SER A 55 0.478 -30.759 -3.633 1.00 0.00 N ATOM 857 CA SER A 55 0.128 -29.760 -4.637 1.00 0.00 C ATOM 858 C SER A 55 -1.386 -29.656 -4.795 1.00 0.00 C ATOM 859 O SER A 55 -2.119 -30.593 -4.480 1.00 0.00 O ATOM 860 CB SER A 55 0.770 -30.110 -5.980 1.00 0.00 C ATOM 861 OG SER A 55 1.040 -28.942 -6.736 1.00 0.00 O ATOM 0 H SER A 55 0.658 -31.690 -4.009 1.00 0.00 H new ATOM 0 HA SER A 55 0.508 -28.795 -4.302 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.696 -30.660 -5.812 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.107 -30.767 -6.543 1.00 0.00 H new ATOM 0 HG SER A 55 1.452 -29.193 -7.589 1.00 0.00 H new ATOM 867 N ARG A 56 -1.846 -28.510 -5.286 1.00 0.00 N ATOM 868 CA ARG A 56 -3.272 -28.282 -5.485 1.00 0.00 C ATOM 869 C ARG A 56 -3.873 -29.356 -6.387 1.00 0.00 C ATOM 870 O ARG A 56 -4.984 -29.829 -6.149 1.00 0.00 O ATOM 871 CB ARG A 56 -3.509 -26.899 -6.094 1.00 0.00 C ATOM 872 CG ARG A 56 -4.974 -26.501 -6.151 1.00 0.00 C ATOM 873 CD ARG A 56 -5.160 -25.018 -5.872 1.00 0.00 C ATOM 874 NE ARG A 56 -5.940 -24.782 -4.660 1.00 0.00 N ATOM 875 CZ ARG A 56 -6.236 -23.571 -4.201 1.00 0.00 C ATOM 876 NH1 ARG A 56 -5.820 -22.492 -4.849 1.00 0.00 N ATOM 877 NH2 ARG A 56 -6.950 -23.438 -3.090 1.00 0.00 N ATOM 0 H ARG A 56 -1.252 -27.725 -5.553 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.762 -28.332 -4.512 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.962 -26.157 -5.512 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -3.097 -26.880 -7.103 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.379 -26.741 -7.134 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -5.539 -27.083 -5.423 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.184 -24.543 -5.773 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.658 -24.549 -6.721 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.276 -25.591 -4.137 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -5.271 -22.590 -5.703 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -6.049 -21.564 -4.494 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.272 -24.266 -2.588 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -7.177 -22.508 -2.738 1.00 0.00 H new ATOM 891 N ALA A 57 -3.131 -29.736 -7.422 1.00 0.00 N ATOM 892 CA ALA A 57 -3.590 -30.755 -8.357 1.00 0.00 C ATOM 893 C ALA A 57 -3.367 -32.156 -7.797 1.00 0.00 C ATOM 894 O ALA A 57 -3.830 -33.143 -8.367 1.00 0.00 O ATOM 895 CB ALA A 57 -2.882 -30.601 -9.695 1.00 0.00 C ATOM 0 H ALA A 57 -2.210 -29.353 -7.634 1.00 0.00 H new ATOM 0 HA ALA A 57 -4.661 -30.619 -8.507 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -3.235 -31.369 -10.384 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.097 -29.616 -10.109 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.807 -30.708 -9.552 1.00 0.00 H new ATOM 901 N GLU A 58 -2.654 -32.234 -6.678 1.00 0.00 N ATOM 902 CA GLU A 58 -2.369 -33.515 -6.042 1.00 0.00 C ATOM 903 C GLU A 58 -3.309 -33.759 -4.865 1.00 0.00 C ATOM 904 O GLU A 58 -3.506 -34.897 -4.439 1.00 0.00 O ATOM 905 CB GLU A 58 -0.915 -33.561 -5.567 1.00 0.00 C ATOM 906 CG GLU A 58 0.096 -33.535 -6.700 1.00 0.00 C ATOM 907 CD GLU A 58 1.527 -33.625 -6.207 1.00 0.00 C ATOM 908 OE1 GLU A 58 1.848 -34.598 -5.492 1.00 0.00 O ATOM 909 OE2 GLU A 58 2.327 -32.724 -6.535 1.00 0.00 O ATOM 0 H GLU A 58 -2.263 -31.426 -6.193 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.527 -34.302 -6.780 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.730 -32.714 -4.907 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.763 -34.464 -4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.103 -34.364 -7.379 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.030 -32.616 -7.273 1.00 0.00 H new ATOM 916 N VAL A 59 -3.885 -32.681 -4.342 1.00 0.00 N ATOM 917 CA VAL A 59 -4.804 -32.777 -3.214 1.00 0.00 C ATOM 918 C VAL A 59 -6.253 -32.826 -3.688 1.00 0.00 C ATOM 919 O VAL A 59 -7.124 -33.355 -2.998 1.00 0.00 O ATOM 920 CB VAL A 59 -4.632 -31.591 -2.247 1.00 0.00 C ATOM 921 CG1 VAL A 59 -5.454 -31.806 -0.985 1.00 0.00 C ATOM 922 CG2 VAL A 59 -3.163 -31.389 -1.908 1.00 0.00 C ATOM 0 H VAL A 59 -3.731 -31.731 -4.681 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.565 -33.702 -2.689 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.996 -30.689 -2.739 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -5.319 -30.958 -0.314 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.508 -31.897 -1.248 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.125 -32.718 -0.487 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.060 -30.547 -1.224 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.771 -32.290 -1.436 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.604 -31.185 -2.821 1.00 0.00 H new ATOM 932 N MET A 60 -6.502 -32.272 -4.870 1.00 0.00 N ATOM 933 CA MET A 60 -7.845 -32.255 -5.437 1.00 0.00 C ATOM 934 C MET A 60 -8.075 -33.471 -6.329 1.00 0.00 C ATOM 935 O MET A 60 -8.662 -33.360 -7.405 1.00 0.00 O ATOM 936 CB MET A 60 -8.067 -30.970 -6.239 1.00 0.00 C ATOM 937 CG MET A 60 -8.070 -29.713 -5.384 1.00 0.00 C ATOM 938 SD MET A 60 -9.724 -29.029 -5.162 1.00 0.00 S ATOM 939 CE MET A 60 -9.676 -27.651 -6.306 1.00 0.00 C ATOM 0 H MET A 60 -5.792 -31.829 -5.453 1.00 0.00 H new ATOM 0 HA MET A 60 -8.560 -32.290 -4.615 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.286 -30.884 -6.995 1.00 0.00 H new ATOM 0 HB3 MET A 60 -9.017 -31.042 -6.769 1.00 0.00 H new ATOM 0 HG2 MET A 60 -7.641 -29.941 -4.408 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.429 -28.962 -5.846 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.631 -27.126 -6.284 1.00 0.00 H new ATOM 0 HE2 MET A 60 -8.879 -26.966 -6.017 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.489 -28.021 -7.314 1.00 0.00 H new ATOM 949 N GLN A 61 -7.607 -34.629 -5.875 1.00 0.00 N ATOM 950 CA GLN A 61 -7.761 -35.865 -6.633 1.00 0.00 C ATOM 951 C GLN A 61 -7.375 -37.074 -5.788 1.00 0.00 C ATOM 952 O GLN A 61 -6.918 -38.090 -6.313 1.00 0.00 O ATOM 953 CB GLN A 61 -6.907 -35.820 -7.901 1.00 0.00 C ATOM 954 CG GLN A 61 -5.413 -35.897 -7.631 1.00 0.00 C ATOM 955 CD GLN A 61 -4.593 -35.982 -8.904 1.00 0.00 C ATOM 956 OE1 GLN A 61 -3.662 -36.781 -9.004 1.00 0.00 O ATOM 957 NE2 GLN A 61 -4.936 -35.155 -9.885 1.00 0.00 N ATOM 0 H GLN A 61 -7.118 -34.737 -4.986 1.00 0.00 H new ATOM 0 HA GLN A 61 -8.810 -35.961 -6.913 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -7.193 -36.646 -8.551 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -7.123 -34.899 -8.442 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -5.105 -35.019 -7.063 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -5.204 -36.768 -7.010 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -5.715 -34.509 -9.758 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -4.420 -35.166 -10.765 1.00 0.00 H new ATOM 966 N ARG A 62 -7.560 -36.957 -4.477 1.00 0.00 N ATOM 967 CA ARG A 62 -7.230 -38.040 -3.559 1.00 0.00 C ATOM 968 C ARG A 62 -8.486 -38.584 -2.885 1.00 0.00 C ATOM 969 O ARG A 62 -9.492 -37.890 -2.740 1.00 0.00 O ATOM 970 CB ARG A 62 -6.238 -37.555 -2.500 1.00 0.00 C ATOM 971 CG ARG A 62 -4.943 -37.012 -3.082 1.00 0.00 C ATOM 972 CD ARG A 62 -3.729 -37.585 -2.369 1.00 0.00 C ATOM 973 NE ARG A 62 -3.284 -38.840 -2.968 1.00 0.00 N ATOM 974 CZ ARG A 62 -2.531 -38.907 -4.060 1.00 0.00 C ATOM 975 NH1 ARG A 62 -2.141 -37.796 -4.669 1.00 0.00 N ATOM 976 NH2 ARG A 62 -2.167 -40.087 -4.546 1.00 0.00 N ATOM 0 H ARG A 62 -7.937 -36.123 -4.027 1.00 0.00 H new ATOM 0 HA ARG A 62 -6.772 -38.844 -4.135 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.711 -36.777 -1.900 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -6.006 -38.380 -1.827 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -4.890 -37.253 -4.144 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -4.934 -35.925 -3.002 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.915 -36.860 -2.399 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -3.970 -37.750 -1.319 1.00 0.00 H new ATOM 0 HE ARG A 62 -3.567 -39.713 -2.523 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -2.419 -36.887 -4.299 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.563 -37.850 -5.507 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -2.466 -40.944 -4.081 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -1.589 -40.137 -5.385 1.00 0.00 H new ATOM 990 N PRO A 63 -8.427 -39.855 -2.461 1.00 0.00 N ATOM 991 CA PRO A 63 -9.551 -40.520 -1.795 1.00 0.00 C ATOM 992 C PRO A 63 -9.808 -39.964 -0.399 1.00 0.00 C ATOM 993 O PRO A 63 -8.892 -39.475 0.264 1.00 0.00 O ATOM 994 CB PRO A 63 -9.101 -41.981 -1.714 1.00 0.00 C ATOM 995 CG PRO A 63 -7.613 -41.921 -1.737 1.00 0.00 C ATOM 996 CD PRO A 63 -7.259 -40.741 -2.600 1.00 0.00 C ATOM 0 HA PRO A 63 -10.487 -40.377 -2.335 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -9.464 -42.457 -0.803 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -9.487 -42.561 -2.552 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.212 -41.803 -0.731 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -7.192 -42.841 -2.142 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.344 -40.256 -2.261 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.099 -41.035 -3.637 1.00 0.00 H new ATOM 1004 N CYS A 64 -11.059 -40.042 0.043 1.00 0.00 N ATOM 1005 CA CYS A 64 -11.436 -39.546 1.361 1.00 0.00 C ATOM 1006 C CYS A 64 -11.102 -40.568 2.443 1.00 0.00 C ATOM 1007 O CYS A 64 -11.384 -40.356 3.623 1.00 0.00 O ATOM 1008 CB CYS A 64 -12.930 -39.218 1.397 1.00 0.00 C ATOM 1009 SG CYS A 64 -13.296 -37.447 1.417 1.00 0.00 S ATOM 0 H CYS A 64 -11.829 -40.444 -0.492 1.00 0.00 H new ATOM 0 HA CYS A 64 -10.866 -38.637 1.556 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -13.411 -39.668 0.528 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.371 -39.679 2.280 1.00 0.00 H new ATOM 0 HG CYS A 64 -13.150 -36.987 2.624 1.00 0.00 H new ATOM 1015 N THR A 65 -10.500 -41.680 2.033 1.00 0.00 N ATOM 1016 CA THR A 65 -10.129 -42.737 2.966 1.00 0.00 C ATOM 1017 C THR A 65 -8.682 -42.588 3.420 1.00 0.00 C ATOM 1018 O THR A 65 -8.151 -43.446 4.126 1.00 0.00 O ATOM 1019 CB THR A 65 -10.317 -44.131 2.339 1.00 0.00 C ATOM 1020 OG1 THR A 65 -11.546 -44.177 1.606 1.00 0.00 O ATOM 1021 CG2 THR A 65 -10.320 -45.211 3.411 1.00 0.00 C ATOM 0 H THR A 65 -10.259 -41.872 1.061 1.00 0.00 H new ATOM 0 HA THR A 65 -10.789 -42.642 3.829 1.00 0.00 H new ATOM 0 HB THR A 65 -9.483 -44.315 1.662 1.00 0.00 H new ATOM 0 HG1 THR A 65 -11.657 -45.066 1.209 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.454 -46.187 2.944 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.372 -45.193 3.948 1.00 0.00 H new ATOM 0 HG23 THR A 65 -11.136 -45.028 4.110 1.00 0.00 H new ATOM 1029 N CYS A 66 -8.049 -41.494 3.011 1.00 0.00 N ATOM 1030 CA CYS A 66 -6.661 -41.232 3.376 1.00 0.00 C ATOM 1031 C CYS A 66 -5.769 -42.412 3.005 1.00 0.00 C ATOM 1032 O CYS A 66 -4.755 -42.666 3.656 1.00 0.00 O ATOM 1033 CB CYS A 66 -6.551 -40.945 4.875 1.00 0.00 C ATOM 1034 SG CYS A 66 -7.766 -39.756 5.490 1.00 0.00 S ATOM 0 H CYS A 66 -8.474 -40.774 2.427 1.00 0.00 H new ATOM 0 HA CYS A 66 -6.324 -40.357 2.820 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -6.665 -41.881 5.422 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -5.550 -40.570 5.090 1.00 0.00 H new ATOM 0 HG CYS A 66 -7.594 -39.581 6.767 1.00 0.00 H new ATOM 1040 N ASP A 67 -6.155 -43.131 1.957 1.00 0.00 N ATOM 1041 CA ASP A 67 -5.390 -44.286 1.499 1.00 0.00 C ATOM 1042 C ASP A 67 -3.939 -43.903 1.226 1.00 0.00 C ATOM 1043 O ASP A 67 -3.014 -44.619 1.611 1.00 0.00 O ATOM 1044 CB ASP A 67 -6.022 -44.874 0.236 1.00 0.00 C ATOM 1045 CG ASP A 67 -5.236 -46.050 -0.310 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -4.496 -46.684 0.471 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -5.362 -46.337 -1.519 1.00 0.00 O ATOM 0 H ASP A 67 -6.992 -42.935 1.409 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.406 -45.038 2.288 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.041 -45.193 0.457 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.089 -44.099 -0.528 1.00 0.00 H new ATOM 1052 N PHE A 68 -3.746 -42.770 0.559 1.00 0.00 N ATOM 1053 CA PHE A 68 -2.407 -42.294 0.232 1.00 0.00 C ATOM 1054 C PHE A 68 -1.641 -41.915 1.497 1.00 0.00 C ATOM 1055 O PHE A 68 -0.436 -41.664 1.455 1.00 0.00 O ATOM 1056 CB PHE A 68 -2.487 -41.090 -0.709 1.00 0.00 C ATOM 1057 CG PHE A 68 -2.808 -39.801 -0.007 1.00 0.00 C ATOM 1058 CD1 PHE A 68 -4.071 -39.579 0.519 1.00 0.00 C ATOM 1059 CD2 PHE A 68 -1.848 -38.811 0.125 1.00 0.00 C ATOM 1060 CE1 PHE A 68 -4.370 -38.395 1.166 1.00 0.00 C ATOM 1061 CE2 PHE A 68 -2.141 -37.625 0.771 1.00 0.00 C ATOM 1062 CZ PHE A 68 -3.404 -37.416 1.291 1.00 0.00 C ATOM 0 H PHE A 68 -4.500 -42.164 0.234 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.872 -43.102 -0.267 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.536 -40.983 -1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -3.247 -41.281 -1.467 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.831 -40.341 0.422 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.860 -38.968 -0.281 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -5.358 -38.236 1.573 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -1.383 -36.862 0.869 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.635 -36.489 1.794 1.00 0.00 H new ATOM 1072 N LEU A 69 -2.349 -41.877 2.620 1.00 0.00 N ATOM 1073 CA LEU A 69 -1.737 -41.529 3.898 1.00 0.00 C ATOM 1074 C LEU A 69 -1.679 -42.741 4.822 1.00 0.00 C ATOM 1075 O LEU A 69 -1.145 -42.667 5.929 1.00 0.00 O ATOM 1076 CB LEU A 69 -2.520 -40.399 4.570 1.00 0.00 C ATOM 1077 CG LEU A 69 -2.271 -38.993 4.023 1.00 0.00 C ATOM 1078 CD1 LEU A 69 -3.373 -38.044 4.468 1.00 0.00 C ATOM 1079 CD2 LEU A 69 -0.910 -38.480 4.472 1.00 0.00 C ATOM 0 H LEU A 69 -3.347 -42.083 2.672 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.718 -41.193 3.705 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.584 -40.619 4.482 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.281 -40.401 5.634 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.279 -39.041 2.934 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.179 -37.048 4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.333 -38.402 4.097 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.398 -38.000 5.557 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.749 -37.478 4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.875 -38.448 5.561 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.130 -39.146 4.103 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.230 -43.859 4.359 1.00 0.00 N ATOM 1092 CA HIS A 70 -2.238 -45.089 5.142 1.00 0.00 C ATOM 1093 C HIS A 70 -1.204 -46.078 4.612 1.00 0.00 C ATOM 1094 O HIS A 70 -0.832 -46.034 3.440 1.00 0.00 O ATOM 1095 CB HIS A 70 -3.628 -45.725 5.118 1.00 0.00 C ATOM 1096 CG HIS A 70 -3.742 -46.949 5.974 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -3.418 -48.213 5.527 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -4.145 -47.097 7.258 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -3.618 -49.085 6.499 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -4.059 -48.434 7.560 1.00 0.00 N ATOM 0 H HIS A 70 -2.677 -43.938 3.445 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.980 -44.837 6.170 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.361 -44.990 5.451 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.882 -45.985 4.090 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -4.473 -46.310 7.921 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.449 -50.150 6.437 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -4.297 -48.856 8.458 1.00 0.00 H new ATOM 1108 N GLY A 71 -0.742 -46.969 5.484 1.00 0.00 N ATOM 1109 CA GLY A 71 0.246 -47.954 5.085 1.00 0.00 C ATOM 1110 C GLY A 71 0.100 -49.260 5.842 1.00 0.00 C ATOM 1111 O GLY A 71 -0.808 -49.433 6.654 1.00 0.00 O ATOM 0 H GLY A 71 -1.034 -47.026 6.460 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.153 -48.145 4.016 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.245 -47.551 5.251 1.00 0.00 H new ATOM 1115 N PRO A 72 1.010 -50.208 5.574 1.00 0.00 N ATOM 1116 CA PRO A 72 1.000 -51.522 6.224 1.00 0.00 C ATOM 1117 C PRO A 72 1.374 -51.441 7.700 1.00 0.00 C ATOM 1118 O PRO A 72 1.316 -52.438 8.420 1.00 0.00 O ATOM 1119 CB PRO A 72 2.056 -52.311 5.447 1.00 0.00 C ATOM 1120 CG PRO A 72 2.976 -51.275 4.899 1.00 0.00 C ATOM 1121 CD PRO A 72 2.121 -50.070 4.616 1.00 0.00 C ATOM 0 HA PRO A 72 0.010 -51.978 6.206 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.586 -53.008 6.096 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.603 -52.900 4.649 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.764 -51.036 5.613 1.00 0.00 H new ATOM 0 HG3 PRO A 72 3.465 -51.628 3.991 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.671 -49.142 4.770 1.00 0.00 H new ATOM 0 HD3 PRO A 72 1.765 -50.063 3.586 1.00 0.00 H new ATOM 1129 N ARG A 73 1.757 -50.249 8.145 1.00 0.00 N ATOM 1130 CA ARG A 73 2.142 -50.039 9.535 1.00 0.00 C ATOM 1131 C ARG A 73 1.076 -49.239 10.279 1.00 0.00 C ATOM 1132 O ARG A 73 1.105 -49.135 11.506 1.00 0.00 O ATOM 1133 CB ARG A 73 3.485 -49.311 9.611 1.00 0.00 C ATOM 1134 CG ARG A 73 4.526 -50.040 10.445 1.00 0.00 C ATOM 1135 CD ARG A 73 5.931 -49.542 10.142 1.00 0.00 C ATOM 1136 NE ARG A 73 6.832 -49.724 11.277 1.00 0.00 N ATOM 1137 CZ ARG A 73 6.815 -48.956 12.360 1.00 0.00 C ATOM 1138 NH1 ARG A 73 5.946 -47.959 12.456 1.00 0.00 N ATOM 1139 NH2 ARG A 73 7.667 -49.185 13.351 1.00 0.00 N ATOM 0 H ARG A 73 1.809 -49.413 7.562 1.00 0.00 H new ATOM 0 HA ARG A 73 2.238 -51.015 10.010 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.872 -49.173 8.601 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.327 -48.317 10.030 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.309 -49.899 11.504 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.468 -51.110 10.247 1.00 0.00 H new ATOM 0 HD2 ARG A 73 6.326 -50.074 9.277 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.892 -48.486 9.876 1.00 0.00 H new ATOM 0 HE ARG A 73 7.512 -50.483 11.235 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.289 -47.781 11.697 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.935 -47.371 13.289 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.336 -49.952 13.281 1.00 0.00 H new ATOM 0 HH22 ARG A 73 7.653 -48.594 14.182 1.00 0.00 H new ATOM 1153 N THR A 74 0.134 -48.676 9.528 1.00 0.00 N ATOM 1154 CA THR A 74 -0.939 -47.885 10.116 1.00 0.00 C ATOM 1155 C THR A 74 -2.115 -48.767 10.520 1.00 0.00 C ATOM 1156 O THR A 74 -2.380 -49.789 9.889 1.00 0.00 O ATOM 1157 CB THR A 74 -1.437 -46.801 9.140 1.00 0.00 C ATOM 1158 OG1 THR A 74 -0.353 -45.944 8.765 1.00 0.00 O ATOM 1159 CG2 THR A 74 -2.549 -45.976 9.770 1.00 0.00 C ATOM 0 H THR A 74 0.093 -48.754 8.512 1.00 0.00 H new ATOM 0 HA THR A 74 -0.527 -47.404 11.003 1.00 0.00 H new ATOM 0 HB THR A 74 -1.832 -47.295 8.252 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.570 -45.019 9.003 1.00 0.00 H new ATOM 0 HG21 THR A 74 -2.885 -45.217 9.063 1.00 0.00 H new ATOM 0 HG22 THR A 74 -3.384 -46.627 10.027 1.00 0.00 H new ATOM 0 HG23 THR A 74 -2.176 -45.491 10.672 1.00 0.00 H new ATOM 1167 N GLN A 75 -2.815 -48.365 11.575 1.00 0.00 N ATOM 1168 CA GLN A 75 -3.963 -49.121 12.063 1.00 0.00 C ATOM 1169 C GLN A 75 -4.929 -49.438 10.926 1.00 0.00 C ATOM 1170 O GLN A 75 -5.229 -48.580 10.096 1.00 0.00 O ATOM 1171 CB GLN A 75 -4.687 -48.338 13.160 1.00 0.00 C ATOM 1172 CG GLN A 75 -3.796 -47.973 14.336 1.00 0.00 C ATOM 1173 CD GLN A 75 -2.866 -49.101 14.736 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -3.312 -50.178 15.133 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -1.564 -48.860 14.634 1.00 0.00 N ATOM 0 H GLN A 75 -2.608 -47.521 12.108 1.00 0.00 H new ATOM 0 HA GLN A 75 -3.598 -50.061 12.478 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.100 -47.425 12.731 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.528 -48.929 13.522 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -3.205 -47.094 14.080 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.419 -47.701 15.188 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -1.238 -47.953 14.300 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.890 -49.582 14.889 1.00 0.00 H new ATOM 1184 N ARG A 76 -5.411 -50.676 10.895 1.00 0.00 N ATOM 1185 CA ARG A 76 -6.342 -51.107 9.858 1.00 0.00 C ATOM 1186 C ARG A 76 -7.755 -50.615 10.158 1.00 0.00 C ATOM 1187 O ARG A 76 -8.554 -50.397 9.246 1.00 0.00 O ATOM 1188 CB ARG A 76 -6.336 -52.632 9.740 1.00 0.00 C ATOM 1189 CG ARG A 76 -7.315 -53.166 8.707 1.00 0.00 C ATOM 1190 CD ARG A 76 -7.485 -54.673 8.828 1.00 0.00 C ATOM 1191 NE ARG A 76 -8.889 -55.057 8.949 1.00 0.00 N ATOM 1192 CZ ARG A 76 -9.328 -56.299 8.776 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -8.478 -57.271 8.477 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -10.621 -56.570 8.903 1.00 0.00 N ATOM 0 H ARG A 76 -5.173 -51.398 11.575 1.00 0.00 H new ATOM 0 HA ARG A 76 -6.018 -50.675 8.911 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -5.331 -52.964 9.481 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.574 -53.064 10.712 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.282 -52.678 8.834 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.961 -52.918 7.706 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -7.050 -55.158 7.954 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.935 -55.031 9.698 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.569 -54.332 9.179 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.483 -57.067 8.379 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.818 -58.223 8.345 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.278 -55.825 9.133 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.958 -57.524 8.770 1.00 0.00 H new ATOM 1208 N ARG A 77 -8.057 -50.442 11.441 1.00 0.00 N ATOM 1209 CA ARG A 77 -9.373 -49.978 11.860 1.00 0.00 C ATOM 1210 C ARG A 77 -9.760 -48.700 11.121 1.00 0.00 C ATOM 1211 O ARG A 77 -10.942 -48.420 10.923 1.00 0.00 O ATOM 1212 CB ARG A 77 -9.394 -49.732 13.370 1.00 0.00 C ATOM 1213 CG ARG A 77 -8.588 -48.517 13.800 1.00 0.00 C ATOM 1214 CD ARG A 77 -8.239 -48.576 15.279 1.00 0.00 C ATOM 1215 NE ARG A 77 -7.217 -49.580 15.562 1.00 0.00 N ATOM 1216 CZ ARG A 77 -6.611 -49.701 16.737 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -6.923 -48.886 17.735 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -5.690 -50.640 16.917 1.00 0.00 N ATOM 0 H ARG A 77 -7.407 -50.616 12.208 1.00 0.00 H new ATOM 0 HA ARG A 77 -10.099 -50.754 11.615 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -10.427 -49.606 13.695 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -9.005 -50.614 13.879 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.673 -48.459 13.211 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -9.157 -47.610 13.595 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -7.887 -47.598 15.607 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -9.137 -48.801 15.854 1.00 0.00 H new ATOM 0 HE ARG A 77 -6.954 -50.224 14.816 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -7.630 -48.163 17.601 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -6.456 -48.982 18.637 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -5.447 -51.270 16.152 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -5.225 -50.732 17.820 1.00 0.00 H new ATOM 1232 N ALA A 78 -8.756 -47.930 10.716 1.00 0.00 N ATOM 1233 CA ALA A 78 -8.991 -46.683 9.998 1.00 0.00 C ATOM 1234 C ALA A 78 -9.612 -46.947 8.630 1.00 0.00 C ATOM 1235 O ALA A 78 -10.668 -46.406 8.303 1.00 0.00 O ATOM 1236 CB ALA A 78 -7.692 -45.907 9.849 1.00 0.00 C ATOM 0 H ALA A 78 -7.772 -48.148 10.873 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.694 -46.085 10.578 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.883 -44.978 9.311 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.289 -45.679 10.836 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.971 -46.507 9.293 1.00 0.00 H new ATOM 1242 N ALA A 79 -8.949 -47.780 7.835 1.00 0.00 N ATOM 1243 CA ALA A 79 -9.437 -48.116 6.503 1.00 0.00 C ATOM 1244 C ALA A 79 -10.797 -48.801 6.573 1.00 0.00 C ATOM 1245 O ALA A 79 -11.662 -48.572 5.728 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.433 -49.003 5.782 1.00 0.00 C ATOM 0 H ALA A 79 -8.072 -48.235 8.090 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.555 -47.189 5.942 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.810 -49.246 4.789 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.483 -48.477 5.691 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.286 -49.922 6.349 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.980 -49.642 7.586 1.00 0.00 N ATOM 1253 CA ALA A 80 -12.236 -50.359 7.767 1.00 0.00 C ATOM 1254 C ALA A 80 -13.352 -49.412 8.196 1.00 0.00 C ATOM 1255 O ALA A 80 -14.416 -49.374 7.578 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.065 -51.473 8.788 1.00 0.00 C ATOM 0 H ALA A 80 -10.274 -49.843 8.294 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.516 -50.798 6.810 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.011 -52.000 8.913 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -11.304 -52.171 8.440 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -11.758 -51.047 9.743 1.00 0.00 H new ATOM 1262 N GLN A 81 -13.101 -48.651 9.256 1.00 0.00 N ATOM 1263 CA GLN A 81 -14.086 -47.706 9.767 1.00 0.00 C ATOM 1264 C GLN A 81 -14.555 -46.760 8.667 1.00 0.00 C ATOM 1265 O GLN A 81 -15.744 -46.456 8.562 1.00 0.00 O ATOM 1266 CB GLN A 81 -13.499 -46.903 10.930 1.00 0.00 C ATOM 1267 CG GLN A 81 -13.592 -47.616 12.269 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.899 -49.093 12.124 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -15.060 -49.492 12.032 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -12.856 -49.915 12.103 1.00 0.00 N ATOM 0 H GLN A 81 -12.224 -48.670 9.777 1.00 0.00 H new ATOM 0 HA GLN A 81 -14.945 -48.274 10.124 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -12.453 -46.682 10.717 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -14.019 -45.947 11.000 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.651 -47.495 12.806 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -14.367 -47.145 12.874 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.910 -49.541 12.182 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -13.001 -50.920 12.008 1.00 0.00 H new ATOM 1279 N ILE A 82 -13.615 -46.298 7.849 1.00 0.00 N ATOM 1280 CA ILE A 82 -13.933 -45.388 6.757 1.00 0.00 C ATOM 1281 C ILE A 82 -14.722 -46.098 5.662 1.00 0.00 C ATOM 1282 O ILE A 82 -15.700 -45.562 5.141 1.00 0.00 O ATOM 1283 CB ILE A 82 -12.659 -44.779 6.142 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -11.949 -43.888 7.164 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -13.001 -43.987 4.889 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -12.704 -42.616 7.484 1.00 0.00 C ATOM 0 H ILE A 82 -12.627 -46.540 7.922 1.00 0.00 H new ATOM 0 HA ILE A 82 -14.541 -44.588 7.180 1.00 0.00 H new ATOM 0 HB ILE A 82 -11.985 -45.589 5.863 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -11.798 -44.453 8.084 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -10.961 -43.629 6.784 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.090 -43.563 4.467 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -13.467 -44.647 4.157 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -13.691 -43.183 5.144 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -12.143 -42.034 8.215 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.832 -42.030 6.574 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -13.682 -42.867 7.894 1.00 0.00 H new ATOM 1298 N ALA A 83 -14.291 -47.307 5.318 1.00 0.00 N ATOM 1299 CA ALA A 83 -14.959 -48.092 4.288 1.00 0.00 C ATOM 1300 C ALA A 83 -16.398 -48.405 4.684 1.00 0.00 C ATOM 1301 O ALA A 83 -17.327 -48.181 3.908 1.00 0.00 O ATOM 1302 CB ALA A 83 -14.191 -49.378 4.023 1.00 0.00 C ATOM 0 H ALA A 83 -13.482 -47.764 5.738 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.982 -47.501 3.373 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -14.702 -49.954 3.251 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -13.182 -49.137 3.688 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -14.138 -49.966 4.939 1.00 0.00 H new ATOM 1308 N GLN A 84 -16.574 -48.925 5.894 1.00 0.00 N ATOM 1309 CA GLN A 84 -17.901 -49.270 6.391 1.00 0.00 C ATOM 1310 C GLN A 84 -18.755 -48.020 6.578 1.00 0.00 C ATOM 1311 O GLN A 84 -19.953 -48.027 6.297 1.00 0.00 O ATOM 1312 CB GLN A 84 -17.791 -50.030 7.715 1.00 0.00 C ATOM 1313 CG GLN A 84 -19.104 -50.117 8.477 1.00 0.00 C ATOM 1314 CD GLN A 84 -20.273 -50.487 7.585 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -21.357 -49.913 7.694 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -20.059 -51.450 6.697 1.00 0.00 N ATOM 0 H GLN A 84 -15.815 -49.117 6.548 1.00 0.00 H new ATOM 0 HA GLN A 84 -18.383 -49.909 5.652 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -17.428 -51.038 7.517 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -17.047 -49.542 8.344 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -19.010 -50.857 9.272 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -19.306 -49.159 8.956 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -19.145 -51.898 6.641 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -20.809 -51.742 6.070 1.00 0.00 H new ATOM 1325 N ALA A 85 -18.129 -46.949 7.055 1.00 0.00 N ATOM 1326 CA ALA A 85 -18.831 -45.691 7.278 1.00 0.00 C ATOM 1327 C ALA A 85 -19.318 -45.093 5.962 1.00 0.00 C ATOM 1328 O ALA A 85 -20.366 -44.449 5.911 1.00 0.00 O ATOM 1329 CB ALA A 85 -17.930 -44.705 8.006 1.00 0.00 C ATOM 0 H ALA A 85 -17.138 -46.927 7.294 1.00 0.00 H new ATOM 0 HA ALA A 85 -19.703 -45.896 7.899 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -18.468 -43.770 8.166 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -17.636 -45.123 8.969 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -17.040 -44.514 7.406 1.00 0.00 H new ATOM 1335 N LEU A 86 -18.550 -45.310 4.900 1.00 0.00 N ATOM 1336 CA LEU A 86 -18.903 -44.791 3.582 1.00 0.00 C ATOM 1337 C LEU A 86 -20.000 -45.634 2.941 1.00 0.00 C ATOM 1338 O LEU A 86 -20.900 -45.107 2.286 1.00 0.00 O ATOM 1339 CB LEU A 86 -17.670 -44.764 2.677 1.00 0.00 C ATOM 1340 CG LEU A 86 -17.781 -43.903 1.418 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -16.745 -42.790 1.440 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -17.621 -44.759 0.170 1.00 0.00 C ATOM 0 H LEU A 86 -17.680 -45.841 4.925 1.00 0.00 H new ATOM 0 HA LEU A 86 -19.278 -43.775 3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -16.822 -44.409 3.262 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -17.443 -45.786 2.375 1.00 0.00 H new ATOM 0 HG LEU A 86 -18.772 -43.449 1.398 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -16.839 -42.188 0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -16.906 -42.160 2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -15.746 -43.224 1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -17.703 -44.129 -0.716 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -16.644 -45.242 0.183 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -18.401 -45.520 0.148 1.00 0.00 H new ATOM 1354 N LEU A 87 -19.922 -46.946 3.137 1.00 0.00 N ATOM 1355 CA LEU A 87 -20.910 -47.863 2.580 1.00 0.00 C ATOM 1356 C LEU A 87 -22.314 -47.506 3.057 1.00 0.00 C ATOM 1357 O LEU A 87 -23.291 -47.679 2.330 1.00 0.00 O ATOM 1358 CB LEU A 87 -20.577 -49.303 2.972 1.00 0.00 C ATOM 1359 CG LEU A 87 -21.634 -50.354 2.631 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -20.978 -51.688 2.310 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -22.624 -50.506 3.777 1.00 0.00 C ATOM 0 H LEU A 87 -19.185 -47.398 3.678 1.00 0.00 H new ATOM 0 HA LEU A 87 -20.881 -47.773 1.494 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -19.644 -49.584 2.484 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -20.397 -49.333 4.047 1.00 0.00 H new ATOM 0 HG LEU A 87 -22.179 -50.020 1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -21.746 -52.423 2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -20.310 -51.569 1.457 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -20.406 -52.029 3.173 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -23.369 -51.258 3.517 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -22.094 -50.817 4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -23.119 -49.552 3.959 1.00 0.00 H new ATOM 1373 N GLY A 88 -22.407 -47.005 4.285 1.00 0.00 N ATOM 1374 CA GLY A 88 -23.695 -46.629 4.838 1.00 0.00 C ATOM 1375 C GLY A 88 -23.888 -45.126 4.888 1.00 0.00 C ATOM 1376 O GLY A 88 -25.004 -44.644 5.079 1.00 0.00 O ATOM 0 H GLY A 88 -21.613 -46.853 4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -24.489 -47.074 4.238 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -23.788 -47.038 5.844 1.00 0.00 H new ATOM 1380 N ALA A 89 -22.799 -44.385 4.717 1.00 0.00 N ATOM 1381 CA ALA A 89 -22.854 -42.929 4.743 1.00 0.00 C ATOM 1382 C ALA A 89 -23.476 -42.426 6.042 1.00 0.00 C ATOM 1383 O ALA A 89 -24.278 -41.493 6.035 1.00 0.00 O ATOM 1384 CB ALA A 89 -23.635 -42.409 3.546 1.00 0.00 C ATOM 0 H ALA A 89 -21.867 -44.769 4.559 1.00 0.00 H new ATOM 0 HA ALA A 89 -21.833 -42.551 4.689 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -23.668 -41.320 3.578 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -23.147 -42.730 2.626 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -24.651 -42.804 3.575 1.00 0.00 H new ATOM 1390 N GLU A 90 -23.100 -43.051 7.153 1.00 0.00 N ATOM 1391 CA GLU A 90 -23.624 -42.667 8.459 1.00 0.00 C ATOM 1392 C GLU A 90 -22.562 -41.939 9.278 1.00 0.00 C ATOM 1393 O GLU A 90 -21.365 -42.085 9.031 1.00 0.00 O ATOM 1394 CB GLU A 90 -24.113 -43.900 9.220 1.00 0.00 C ATOM 1395 CG GLU A 90 -24.710 -43.579 10.580 1.00 0.00 C ATOM 1396 CD GLU A 90 -25.264 -44.806 11.279 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -24.643 -45.883 11.168 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -26.320 -44.688 11.936 1.00 0.00 O ATOM 0 H GLU A 90 -22.435 -43.824 7.175 1.00 0.00 H new ATOM 0 HA GLU A 90 -24.464 -41.990 8.300 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -24.860 -44.416 8.617 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -23.279 -44.589 9.352 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -23.946 -43.121 11.209 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -25.506 -42.844 10.459 1.00 0.00 H new ATOM 1405 N GLU A 91 -23.010 -41.154 10.253 1.00 0.00 N ATOM 1406 CA GLU A 91 -22.098 -40.402 11.107 1.00 0.00 C ATOM 1407 C GLU A 91 -21.116 -41.335 11.810 1.00 0.00 C ATOM 1408 O GLU A 91 -21.467 -42.005 12.781 1.00 0.00 O ATOM 1409 CB GLU A 91 -22.883 -39.595 12.144 1.00 0.00 C ATOM 1410 CG GLU A 91 -23.841 -40.436 12.971 1.00 0.00 C ATOM 1411 CD GLU A 91 -25.236 -39.846 13.027 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -25.357 -38.604 12.980 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -26.208 -40.626 13.117 1.00 0.00 O ATOM 0 H GLU A 91 -23.998 -41.022 10.471 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.533 -39.717 10.476 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -22.180 -39.097 12.812 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -23.446 -38.814 11.634 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -23.892 -41.440 12.551 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -23.451 -40.534 13.984 1.00 0.00 H new ATOM 1420 N ARG A 92 -19.885 -41.374 11.311 1.00 0.00 N ATOM 1421 CA ARG A 92 -18.853 -42.226 11.889 1.00 0.00 C ATOM 1422 C ARG A 92 -17.481 -41.565 11.785 1.00 0.00 C ATOM 1423 O ARG A 92 -17.086 -41.094 10.718 1.00 0.00 O ATOM 1424 CB ARG A 92 -18.831 -43.585 11.186 1.00 0.00 C ATOM 1425 CG ARG A 92 -17.551 -44.370 11.420 1.00 0.00 C ATOM 1426 CD ARG A 92 -17.307 -44.609 12.902 1.00 0.00 C ATOM 1427 NE ARG A 92 -16.944 -45.996 13.182 1.00 0.00 N ATOM 1428 CZ ARG A 92 -16.716 -46.464 14.404 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -16.813 -45.660 15.454 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -16.391 -47.739 14.577 1.00 0.00 N ATOM 0 H ARG A 92 -19.578 -40.825 10.508 1.00 0.00 H new ATOM 0 HA ARG A 92 -19.087 -42.374 12.943 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -19.679 -44.177 11.531 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -18.963 -43.433 10.115 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -17.610 -45.327 10.901 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -16.707 -43.827 10.994 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -16.512 -43.949 13.249 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -18.204 -44.349 13.463 1.00 0.00 H new ATOM 0 HE ARG A 92 -16.861 -46.641 12.396 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -17.063 -44.680 15.324 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -16.637 -46.022 16.391 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -16.316 -48.360 13.771 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.216 -48.098 15.516 1.00 0.00 H new ATOM 1444 N LYS A 93 -16.760 -41.533 12.900 1.00 0.00 N ATOM 1445 CA LYS A 93 -15.432 -40.931 12.936 1.00 0.00 C ATOM 1446 C LYS A 93 -14.380 -41.959 13.341 1.00 0.00 C ATOM 1447 O LYS A 93 -14.642 -42.840 14.160 1.00 0.00 O ATOM 1448 CB LYS A 93 -15.411 -39.752 13.911 1.00 0.00 C ATOM 1449 CG LYS A 93 -15.287 -40.168 15.366 1.00 0.00 C ATOM 1450 CD LYS A 93 -15.278 -38.963 16.292 1.00 0.00 C ATOM 1451 CE LYS A 93 -16.688 -38.483 16.598 1.00 0.00 C ATOM 1452 NZ LYS A 93 -16.776 -36.997 16.624 1.00 0.00 N ATOM 0 H LYS A 93 -17.073 -41.917 13.792 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.196 -40.571 11.935 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -14.578 -39.096 13.657 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.324 -39.171 13.785 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.116 -40.824 15.630 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.370 -40.741 15.505 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -14.771 -39.221 17.222 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -14.709 -38.154 15.833 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -17.375 -38.874 15.848 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -17.006 -38.882 17.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -17.753 -36.711 16.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -16.139 -36.624 17.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -16.497 -36.616 15.697 1.00 0.00 H new ATOM 1466 N VAL A 94 -13.188 -41.838 12.765 1.00 0.00 N ATOM 1467 CA VAL A 94 -12.096 -42.754 13.068 1.00 0.00 C ATOM 1468 C VAL A 94 -10.751 -42.038 13.028 1.00 0.00 C ATOM 1469 O VAL A 94 -10.554 -41.109 12.245 1.00 0.00 O ATOM 1470 CB VAL A 94 -12.065 -43.937 12.082 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -11.923 -43.436 10.652 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -10.937 -44.894 12.434 1.00 0.00 C ATOM 0 H VAL A 94 -12.955 -41.114 12.086 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.272 -43.134 14.074 1.00 0.00 H new ATOM 0 HB VAL A 94 -13.008 -44.478 12.161 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -11.903 -44.285 9.969 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.768 -42.793 10.406 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -10.996 -42.870 10.555 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -10.930 -45.724 11.727 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.984 -44.367 12.385 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.087 -45.278 13.443 1.00 0.00 H new ATOM 1482 N GLU A 95 -9.827 -42.477 13.878 1.00 0.00 N ATOM 1483 CA GLU A 95 -8.500 -41.876 13.939 1.00 0.00 C ATOM 1484 C GLU A 95 -7.503 -42.673 13.103 1.00 0.00 C ATOM 1485 O GLU A 95 -7.476 -43.903 13.155 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.018 -41.798 15.389 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.775 -43.157 16.024 1.00 0.00 C ATOM 1488 CD GLU A 95 -7.573 -43.072 17.525 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -7.011 -42.059 17.991 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -7.976 -44.019 18.233 1.00 0.00 O ATOM 0 H GLU A 95 -9.973 -43.245 14.533 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.567 -40.868 13.530 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.095 -41.219 15.426 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.757 -41.257 15.980 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.622 -43.810 15.811 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.897 -43.615 15.568 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.685 -41.963 12.332 1.00 0.00 N ATOM 1498 CA ILE A 96 -5.687 -42.604 11.485 1.00 0.00 C ATOM 1499 C ILE A 96 -4.340 -41.896 11.592 1.00 0.00 C ATOM 1500 O ILE A 96 -4.277 -40.671 11.688 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.128 -42.623 10.010 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -7.653 -42.704 9.913 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.483 -43.790 9.279 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -8.326 -41.352 9.821 1.00 0.00 C ATOM 0 H ILE A 96 -6.694 -40.945 12.277 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.586 -43.630 11.838 1.00 0.00 H new ATOM 0 HB ILE A 96 -5.801 -41.698 9.536 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.922 -43.295 9.038 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.037 -43.233 10.785 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.805 -43.790 8.238 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.398 -43.693 9.324 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -5.783 -44.726 9.751 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.406 -41.487 9.755 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.087 -40.765 10.708 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.971 -40.828 8.933 1.00 0.00 H new ATOM 1516 N ALA A 97 -3.265 -42.676 11.573 1.00 0.00 N ATOM 1517 CA ALA A 97 -1.919 -42.125 11.663 1.00 0.00 C ATOM 1518 C ALA A 97 -1.353 -41.827 10.279 1.00 0.00 C ATOM 1519 O ALA A 97 -0.914 -42.733 9.569 1.00 0.00 O ATOM 1520 CB ALA A 97 -1.005 -43.082 12.415 1.00 0.00 C ATOM 0 H ALA A 97 -3.300 -43.692 11.496 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.975 -41.186 12.213 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.003 -42.657 12.474 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.392 -43.240 13.422 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -0.964 -44.035 11.888 1.00 0.00 H new ATOM 1526 N PHE A 98 -1.366 -40.554 9.900 1.00 0.00 N ATOM 1527 CA PHE A 98 -0.855 -40.137 8.599 1.00 0.00 C ATOM 1528 C PHE A 98 0.513 -39.477 8.738 1.00 0.00 C ATOM 1529 O PHE A 98 0.916 -39.082 9.833 1.00 0.00 O ATOM 1530 CB PHE A 98 -1.834 -39.172 7.929 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.839 -37.801 8.541 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.466 -37.571 9.755 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -1.215 -36.741 7.902 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.471 -36.310 10.321 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -1.217 -35.478 8.464 1.00 0.00 C ATOM 1536 CZ PHE A 98 -1.847 -35.262 9.674 1.00 0.00 C ATOM 0 H PHE A 98 -1.725 -39.792 10.475 1.00 0.00 H new ATOM 0 HA PHE A 98 -0.748 -41.025 7.977 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -1.582 -39.088 6.872 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -2.839 -39.590 7.985 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.957 -38.387 10.265 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -0.722 -36.904 6.955 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.963 -36.145 11.268 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.726 -34.660 7.957 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.852 -34.275 10.113 1.00 0.00 H new ATOM 1546 N TYR A 99 1.223 -39.361 7.622 1.00 0.00 N ATOM 1547 CA TYR A 99 2.548 -38.751 7.618 1.00 0.00 C ATOM 1548 C TYR A 99 2.519 -37.390 6.929 1.00 0.00 C ATOM 1549 O TYR A 99 1.746 -37.170 5.997 1.00 0.00 O ATOM 1550 CB TYR A 99 3.552 -39.668 6.918 1.00 0.00 C ATOM 1551 CG TYR A 99 4.176 -40.695 7.836 1.00 0.00 C ATOM 1552 CD1 TYR A 99 3.419 -41.335 8.810 1.00 0.00 C ATOM 1553 CD2 TYR A 99 5.521 -41.025 7.729 1.00 0.00 C ATOM 1554 CE1 TYR A 99 3.984 -42.274 9.651 1.00 0.00 C ATOM 1555 CE2 TYR A 99 6.094 -41.964 8.565 1.00 0.00 C ATOM 1556 CZ TYR A 99 5.322 -42.585 9.525 1.00 0.00 C ATOM 1557 OH TYR A 99 5.890 -43.520 10.360 1.00 0.00 O ATOM 0 H TYR A 99 0.904 -39.681 6.708 1.00 0.00 H new ATOM 0 HA TYR A 99 2.857 -38.607 8.653 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.051 -40.183 6.098 1.00 0.00 H new ATOM 0 HB3 TYR A 99 4.342 -39.059 6.477 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.371 -41.094 8.911 1.00 0.00 H new ATOM 0 HD2 TYR A 99 6.129 -40.540 6.980 1.00 0.00 H new ATOM 0 HE1 TYR A 99 3.382 -42.762 10.403 1.00 0.00 H new ATOM 0 HE2 TYR A 99 7.141 -42.211 8.467 1.00 0.00 H new ATOM 0 HH TYR A 99 6.839 -43.623 10.138 1.00 0.00 H new ATOM 1567 N ARG A 100 3.367 -36.480 7.396 1.00 0.00 N ATOM 1568 CA ARG A 100 3.440 -35.139 6.827 1.00 0.00 C ATOM 1569 C ARG A 100 4.643 -35.007 5.898 1.00 0.00 C ATOM 1570 O ARG A 100 5.419 -35.949 5.732 1.00 0.00 O ATOM 1571 CB ARG A 100 3.524 -34.093 7.940 1.00 0.00 C ATOM 1572 CG ARG A 100 2.364 -33.112 7.942 1.00 0.00 C ATOM 1573 CD ARG A 100 2.814 -31.715 7.542 1.00 0.00 C ATOM 1574 NE ARG A 100 3.856 -31.202 8.428 1.00 0.00 N ATOM 1575 CZ ARG A 100 4.215 -29.924 8.476 1.00 0.00 C ATOM 1576 NH1 ARG A 100 3.620 -29.034 7.694 1.00 0.00 N ATOM 1577 NH2 ARG A 100 5.172 -29.534 9.309 1.00 0.00 N ATOM 0 H ARG A 100 4.014 -36.647 8.167 1.00 0.00 H new ATOM 0 HA ARG A 100 2.534 -34.969 6.246 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.560 -34.602 8.903 1.00 0.00 H new ATOM 0 HB3 ARG A 100 4.457 -33.539 7.837 1.00 0.00 H new ATOM 0 HG2 ARG A 100 1.593 -33.458 7.254 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.915 -33.080 8.935 1.00 0.00 H new ATOM 0 HD2 ARG A 100 3.186 -31.733 6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 100 1.959 -31.040 7.559 1.00 0.00 H new ATOM 0 HE ARG A 100 4.334 -31.861 9.043 1.00 0.00 H new ATOM 0 HH11 ARG A 100 2.884 -29.330 7.053 1.00 0.00 H new ATOM 0 HH12 ARG A 100 3.898 -28.053 7.734 1.00 0.00 H new ATOM 0 HH21 ARG A 100 5.632 -30.216 9.912 1.00 0.00 H new ATOM 0 HH22 ARG A 100 5.448 -28.553 9.346 1.00 0.00 H new ATOM 1591 N LYS A 101 4.792 -33.833 5.295 1.00 0.00 N ATOM 1592 CA LYS A 101 5.901 -33.576 4.383 1.00 0.00 C ATOM 1593 C LYS A 101 7.179 -33.263 5.155 1.00 0.00 C ATOM 1594 O LYS A 101 8.280 -33.342 4.610 1.00 0.00 O ATOM 1595 CB LYS A 101 5.560 -32.414 3.447 1.00 0.00 C ATOM 1596 CG LYS A 101 4.344 -32.673 2.574 1.00 0.00 C ATOM 1597 CD LYS A 101 4.486 -33.967 1.791 1.00 0.00 C ATOM 1598 CE LYS A 101 3.683 -35.093 2.424 1.00 0.00 C ATOM 1599 NZ LYS A 101 4.508 -36.315 2.630 1.00 0.00 N ATOM 0 H LYS A 101 4.159 -33.044 5.421 1.00 0.00 H new ATOM 0 HA LYS A 101 6.067 -34.475 3.790 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.385 -31.518 4.043 1.00 0.00 H new ATOM 0 HB3 LYS A 101 6.419 -32.209 2.808 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.451 -32.720 3.197 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.207 -31.841 1.883 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.151 -33.812 0.766 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.537 -34.251 1.743 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.283 -34.760 3.381 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.831 -35.333 1.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.905 -37.159 2.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.257 -36.354 1.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.939 -36.287 3.576 1.00 0.00 H new ATOM 1613 N ASP A 102 7.025 -32.909 6.426 1.00 0.00 N ATOM 1614 CA ASP A 102 8.167 -32.587 7.274 1.00 0.00 C ATOM 1615 C ASP A 102 8.830 -33.857 7.797 1.00 0.00 C ATOM 1616 O ASP A 102 9.825 -33.797 8.519 1.00 0.00 O ATOM 1617 CB ASP A 102 7.728 -31.706 8.444 1.00 0.00 C ATOM 1618 CG ASP A 102 8.878 -30.918 9.040 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.974 -30.925 8.441 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.683 -30.295 10.105 1.00 0.00 O ATOM 0 H ASP A 102 6.120 -32.838 6.892 1.00 0.00 H new ATOM 0 HA ASP A 102 8.893 -32.041 6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.956 -31.016 8.105 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.280 -32.331 9.217 1.00 0.00 H new ATOM 1625 N GLY A 103 8.272 -35.006 7.429 1.00 0.00 N ATOM 1626 CA GLY A 103 8.822 -36.273 7.872 1.00 0.00 C ATOM 1627 C GLY A 103 8.207 -36.749 9.173 1.00 0.00 C ATOM 1628 O GLY A 103 8.439 -37.881 9.600 1.00 0.00 O ATOM 0 H GLY A 103 7.449 -35.082 6.832 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.660 -37.026 7.100 1.00 0.00 H new ATOM 0 HA3 GLY A 103 9.900 -36.173 7.998 1.00 0.00 H new ATOM 1632 N SER A 104 7.422 -35.884 9.807 1.00 0.00 N ATOM 1633 CA SER A 104 6.777 -36.220 11.070 1.00 0.00 C ATOM 1634 C SER A 104 5.463 -36.958 10.830 1.00 0.00 C ATOM 1635 O SER A 104 4.894 -36.895 9.739 1.00 0.00 O ATOM 1636 CB SER A 104 6.520 -34.953 11.889 1.00 0.00 C ATOM 1637 OG SER A 104 6.772 -33.790 11.121 1.00 0.00 O ATOM 0 H SER A 104 7.217 -34.945 9.466 1.00 0.00 H new ATOM 0 HA SER A 104 7.446 -36.876 11.627 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.488 -34.945 12.238 1.00 0.00 H new ATOM 0 HB3 SER A 104 7.156 -34.953 12.774 1.00 0.00 H new ATOM 0 HG SER A 104 6.599 -32.994 11.666 1.00 0.00 H new ATOM 1643 N CYS A 105 4.989 -37.657 11.855 1.00 0.00 N ATOM 1644 CA CYS A 105 3.743 -38.409 11.756 1.00 0.00 C ATOM 1645 C CYS A 105 2.842 -38.127 12.954 1.00 0.00 C ATOM 1646 O CYS A 105 3.321 -37.830 14.048 1.00 0.00 O ATOM 1647 CB CYS A 105 4.033 -39.907 11.661 1.00 0.00 C ATOM 1648 SG CYS A 105 4.513 -40.666 13.231 1.00 0.00 S ATOM 0 H CYS A 105 5.448 -37.719 12.764 1.00 0.00 H new ATOM 0 HA CYS A 105 3.225 -38.090 10.852 1.00 0.00 H new ATOM 0 HB2 CYS A 105 3.147 -40.415 11.280 1.00 0.00 H new ATOM 0 HB3 CYS A 105 4.829 -40.067 10.934 1.00 0.00 H new ATOM 0 HG CYS A 105 4.400 -39.793 14.188 1.00 0.00 H new ATOM 1654 N PHE A 106 1.534 -38.222 12.739 1.00 0.00 N ATOM 1655 CA PHE A 106 0.565 -37.975 13.801 1.00 0.00 C ATOM 1656 C PHE A 106 -0.771 -38.641 13.483 1.00 0.00 C ATOM 1657 O PHE A 106 -1.022 -39.045 12.347 1.00 0.00 O ATOM 1658 CB PHE A 106 0.364 -36.471 13.998 1.00 0.00 C ATOM 1659 CG PHE A 106 1.145 -35.630 13.028 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.758 -35.540 11.701 1.00 0.00 C ATOM 1661 CD2 PHE A 106 2.266 -34.931 13.444 1.00 0.00 C ATOM 1662 CE1 PHE A 106 1.474 -34.767 10.806 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.986 -34.156 12.555 1.00 0.00 C ATOM 1664 CZ PHE A 106 2.590 -34.075 11.234 1.00 0.00 C ATOM 0 H PHE A 106 1.121 -38.468 11.840 1.00 0.00 H new ATOM 0 HA PHE A 106 0.956 -38.406 14.723 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.696 -36.238 13.897 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.654 -36.204 15.014 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.113 -36.080 11.362 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.581 -34.992 14.475 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.161 -34.704 9.774 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.857 -33.614 12.892 1.00 0.00 H new ATOM 0 HZ PHE A 106 3.152 -33.471 10.537 1.00 0.00 H new ATOM 1674 N LEU A 107 -1.625 -38.751 14.495 1.00 0.00 N ATOM 1675 CA LEU A 107 -2.936 -39.368 14.325 1.00 0.00 C ATOM 1676 C LEU A 107 -4.035 -38.311 14.290 1.00 0.00 C ATOM 1677 O LEU A 107 -4.189 -37.530 15.230 1.00 0.00 O ATOM 1678 CB LEU A 107 -3.205 -40.361 15.457 1.00 0.00 C ATOM 1679 CG LEU A 107 -2.840 -41.819 15.172 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -1.363 -42.062 15.440 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -3.697 -42.756 16.010 1.00 0.00 C ATOM 0 H LEU A 107 -1.433 -38.421 15.441 1.00 0.00 H new ATOM 0 HA LEU A 107 -2.939 -39.901 13.374 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -2.653 -40.035 16.338 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.264 -40.315 15.709 1.00 0.00 H new ATOM 0 HG LEU A 107 -3.035 -42.023 14.119 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.122 -43.104 15.232 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -0.765 -41.416 14.797 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.141 -41.840 16.484 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.424 -43.789 15.795 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -3.533 -42.550 17.068 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.749 -42.601 15.769 1.00 0.00 H new ATOM 1693 N CYS A 108 -4.797 -38.293 13.202 1.00 0.00 N ATOM 1694 CA CYS A 108 -5.883 -37.332 13.045 1.00 0.00 C ATOM 1695 C CYS A 108 -7.219 -38.047 12.869 1.00 0.00 C ATOM 1696 O CYS A 108 -7.320 -39.025 12.127 1.00 0.00 O ATOM 1697 CB CYS A 108 -5.617 -36.421 11.846 1.00 0.00 C ATOM 1698 SG CYS A 108 -5.111 -34.743 12.292 1.00 0.00 S ATOM 0 H CYS A 108 -4.683 -38.933 12.416 1.00 0.00 H new ATOM 0 HA CYS A 108 -5.932 -36.725 13.949 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -4.841 -36.871 11.227 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -6.519 -36.367 11.237 1.00 0.00 H new ATOM 0 HG CYS A 108 -6.049 -33.905 11.963 1.00 0.00 H new ATOM 1704 N LEU A 109 -8.243 -37.553 13.556 1.00 0.00 N ATOM 1705 CA LEU A 109 -9.574 -38.145 13.477 1.00 0.00 C ATOM 1706 C LEU A 109 -10.331 -37.624 12.259 1.00 0.00 C ATOM 1707 O LEU A 109 -10.243 -36.445 11.918 1.00 0.00 O ATOM 1708 CB LEU A 109 -10.365 -37.841 14.751 1.00 0.00 C ATOM 1709 CG LEU A 109 -10.990 -39.045 15.457 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -11.345 -38.696 16.894 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -12.221 -39.525 14.703 1.00 0.00 C ATOM 0 H LEU A 109 -8.177 -36.744 14.174 1.00 0.00 H new ATOM 0 HA LEU A 109 -9.459 -39.224 13.376 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.702 -37.337 15.454 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -11.160 -37.138 14.502 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.259 -39.854 15.471 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -11.789 -39.565 17.380 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.443 -38.401 17.430 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.058 -37.872 16.903 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -12.653 -40.382 15.220 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.956 -38.721 14.657 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.938 -39.816 13.691 1.00 0.00 H new ATOM 1723 N VAL A 110 -11.075 -38.512 11.608 1.00 0.00 N ATOM 1724 CA VAL A 110 -11.850 -38.142 10.429 1.00 0.00 C ATOM 1725 C VAL A 110 -13.307 -38.568 10.573 1.00 0.00 C ATOM 1726 O VAL A 110 -13.620 -39.758 10.566 1.00 0.00 O ATOM 1727 CB VAL A 110 -11.266 -38.774 9.152 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -11.967 -38.230 7.917 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -9.766 -38.530 9.075 1.00 0.00 C ATOM 0 H VAL A 110 -11.158 -39.493 11.877 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.798 -37.057 10.344 1.00 0.00 H new ATOM 0 HB VAL A 110 -11.435 -39.850 9.191 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.540 -38.688 7.025 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -13.031 -38.462 7.971 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.833 -37.149 7.869 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.370 -38.983 8.166 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.572 -37.457 9.060 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.280 -38.974 9.944 1.00 0.00 H new ATOM 1739 N ASP A 111 -14.194 -37.587 10.704 1.00 0.00 N ATOM 1740 CA ASP A 111 -15.619 -37.860 10.848 1.00 0.00 C ATOM 1741 C ASP A 111 -16.330 -37.760 9.502 1.00 0.00 C ATOM 1742 O ASP A 111 -16.139 -36.800 8.757 1.00 0.00 O ATOM 1743 CB ASP A 111 -16.248 -36.885 11.844 1.00 0.00 C ATOM 1744 CG ASP A 111 -17.673 -37.261 12.202 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -18.100 -38.376 11.838 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -18.360 -36.440 12.845 1.00 0.00 O ATOM 0 H ASP A 111 -13.951 -36.596 10.713 1.00 0.00 H new ATOM 0 HA ASP A 111 -15.733 -38.877 11.224 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -15.644 -36.857 12.751 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -16.236 -35.880 11.421 1.00 0.00 H new ATOM 1751 N VAL A 112 -17.151 -38.761 9.197 1.00 0.00 N ATOM 1752 CA VAL A 112 -17.890 -38.786 7.941 1.00 0.00 C ATOM 1753 C VAL A 112 -19.387 -38.629 8.181 1.00 0.00 C ATOM 1754 O VAL A 112 -19.982 -39.368 8.966 1.00 0.00 O ATOM 1755 CB VAL A 112 -17.641 -40.096 7.169 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -18.142 -39.976 5.738 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -16.163 -40.457 7.197 1.00 0.00 C ATOM 0 H VAL A 112 -17.320 -39.564 9.802 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.530 -37.947 7.346 1.00 0.00 H new ATOM 0 HB VAL A 112 -18.197 -40.897 7.657 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -17.958 -40.911 5.208 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -19.212 -39.767 5.743 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -17.616 -39.164 5.235 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -16.005 -41.385 6.647 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.584 -39.658 6.734 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -15.840 -40.588 8.230 1.00 0.00 H new ATOM 1767 N VAL A 113 -19.992 -37.661 7.500 1.00 0.00 N ATOM 1768 CA VAL A 113 -21.421 -37.407 7.638 1.00 0.00 C ATOM 1769 C VAL A 113 -22.022 -36.920 6.324 1.00 0.00 C ATOM 1770 O VAL A 113 -21.474 -36.052 5.645 1.00 0.00 O ATOM 1771 CB VAL A 113 -21.702 -36.363 8.736 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -23.197 -36.119 8.870 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -21.105 -36.811 10.061 1.00 0.00 C ATOM 0 H VAL A 113 -19.514 -37.040 6.847 1.00 0.00 H new ATOM 0 HA VAL A 113 -21.885 -38.353 7.918 1.00 0.00 H new ATOM 0 HB VAL A 113 -21.229 -35.423 8.450 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -23.376 -35.379 9.650 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -23.592 -35.751 7.923 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -23.696 -37.052 9.133 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -21.313 -36.062 10.825 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -21.547 -37.763 10.356 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -20.027 -36.930 9.953 1.00 0.00 H new ATOM 1783 N PRO A 114 -23.178 -37.492 5.955 1.00 0.00 N ATOM 1784 CA PRO A 114 -23.880 -37.132 4.720 1.00 0.00 C ATOM 1785 C PRO A 114 -24.479 -35.731 4.781 1.00 0.00 C ATOM 1786 O PRO A 114 -24.694 -35.183 5.862 1.00 0.00 O ATOM 1787 CB PRO A 114 -24.989 -38.183 4.622 1.00 0.00 C ATOM 1788 CG PRO A 114 -25.224 -38.618 6.027 1.00 0.00 C ATOM 1789 CD PRO A 114 -23.889 -38.533 6.715 1.00 0.00 C ATOM 0 HA PRO A 114 -23.210 -37.118 3.860 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -25.893 -37.764 4.181 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -24.686 -39.021 3.994 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -25.957 -37.977 6.517 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -25.616 -39.634 6.061 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -23.995 -38.262 7.765 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -23.360 -39.485 6.684 1.00 0.00 H new ATOM 1797 N VAL A 115 -24.748 -35.155 3.613 1.00 0.00 N ATOM 1798 CA VAL A 115 -25.324 -33.818 3.534 1.00 0.00 C ATOM 1799 C VAL A 115 -26.657 -33.837 2.794 1.00 0.00 C ATOM 1800 O VAL A 115 -26.698 -33.794 1.564 1.00 0.00 O ATOM 1801 CB VAL A 115 -24.370 -32.837 2.826 1.00 0.00 C ATOM 1802 CG1 VAL A 115 -24.861 -31.406 2.987 1.00 0.00 C ATOM 1803 CG2 VAL A 115 -22.956 -32.988 3.365 1.00 0.00 C ATOM 0 H VAL A 115 -24.576 -35.594 2.708 1.00 0.00 H new ATOM 0 HA VAL A 115 -25.485 -33.481 4.558 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.356 -33.074 1.762 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -24.175 -30.727 2.481 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -25.855 -31.311 2.549 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -24.905 -31.154 4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -22.295 -32.288 2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -22.950 -32.778 4.435 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -22.608 -34.007 3.193 1.00 0.00 H new ATOM 1813 N LYS A 116 -27.747 -33.900 3.552 1.00 0.00 N ATOM 1814 CA LYS A 116 -29.083 -33.922 2.970 1.00 0.00 C ATOM 1815 C LYS A 116 -29.530 -32.517 2.578 1.00 0.00 C ATOM 1816 O LYS A 116 -28.884 -31.531 2.928 1.00 0.00 O ATOM 1817 CB LYS A 116 -30.082 -34.530 3.958 1.00 0.00 C ATOM 1818 CG LYS A 116 -29.772 -35.970 4.328 1.00 0.00 C ATOM 1819 CD LYS A 116 -30.682 -36.469 5.438 1.00 0.00 C ATOM 1820 CE LYS A 116 -30.524 -37.965 5.658 1.00 0.00 C ATOM 1821 NZ LYS A 116 -30.593 -38.323 7.102 1.00 0.00 N ATOM 0 H LYS A 116 -27.731 -33.937 4.571 1.00 0.00 H new ATOM 0 HA LYS A 116 -29.050 -34.537 2.071 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -30.097 -33.926 4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -31.082 -34.482 3.527 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -29.886 -36.605 3.449 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -28.732 -36.049 4.645 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -30.455 -35.938 6.362 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -31.719 -36.244 5.188 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -31.305 -38.497 5.114 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -29.569 -38.294 5.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -30.481 -39.351 7.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -29.832 -37.836 7.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -31.514 -38.032 7.488 1.00 0.00 H new ATOM 1835 N ASN A 117 -30.640 -32.435 1.852 1.00 0.00 N ATOM 1836 CA ASN A 117 -31.173 -31.150 1.414 1.00 0.00 C ATOM 1837 C ASN A 117 -32.420 -30.778 2.212 1.00 0.00 C ATOM 1838 O ASN A 117 -32.752 -31.430 3.201 1.00 0.00 O ATOM 1839 CB ASN A 117 -31.504 -31.194 -0.079 1.00 0.00 C ATOM 1840 CG ASN A 117 -32.423 -32.348 -0.434 1.00 0.00 C ATOM 1841 OD1 ASN A 117 -33.245 -32.773 0.377 1.00 0.00 O ATOM 1842 ND2 ASN A 117 -32.286 -32.859 -1.652 1.00 0.00 N ATOM 0 H ASN A 117 -31.188 -33.242 1.555 1.00 0.00 H new ATOM 0 HA ASN A 117 -30.411 -30.390 1.588 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -31.974 -30.255 -0.372 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -30.580 -31.280 -0.651 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -32.876 -33.636 -1.948 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -31.591 -32.474 -2.291 1.00 0.00 H new ATOM 1849 N GLU A 118 -33.104 -29.727 1.773 1.00 0.00 N ATOM 1850 CA GLU A 118 -34.314 -29.268 2.447 1.00 0.00 C ATOM 1851 C GLU A 118 -35.362 -30.376 2.497 1.00 0.00 C ATOM 1852 O GLU A 118 -36.270 -30.350 3.327 1.00 0.00 O ATOM 1853 CB GLU A 118 -34.887 -28.041 1.735 1.00 0.00 C ATOM 1854 CG GLU A 118 -35.179 -26.878 2.668 1.00 0.00 C ATOM 1855 CD GLU A 118 -36.508 -27.024 3.384 1.00 0.00 C ATOM 1856 OE1 GLU A 118 -37.358 -27.803 2.904 1.00 0.00 O ATOM 1857 OE2 GLU A 118 -36.697 -26.360 4.424 1.00 0.00 O ATOM 0 H GLU A 118 -32.842 -29.177 0.955 1.00 0.00 H new ATOM 0 HA GLU A 118 -34.049 -28.995 3.469 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -34.183 -27.714 0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -35.806 -28.325 1.223 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -34.380 -26.799 3.405 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -35.178 -25.950 2.097 1.00 0.00 H new ATOM 1864 N ASP A 119 -35.229 -31.349 1.601 1.00 0.00 N ATOM 1865 CA ASP A 119 -36.164 -32.467 1.542 1.00 0.00 C ATOM 1866 C ASP A 119 -35.624 -33.667 2.314 1.00 0.00 C ATOM 1867 O ASP A 119 -36.326 -34.659 2.510 1.00 0.00 O ATOM 1868 CB ASP A 119 -36.433 -32.858 0.089 1.00 0.00 C ATOM 1869 CG ASP A 119 -37.868 -32.597 -0.325 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -38.187 -31.437 -0.662 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -38.672 -33.552 -0.312 1.00 0.00 O ATOM 0 H ASP A 119 -34.483 -31.386 0.906 1.00 0.00 H new ATOM 0 HA ASP A 119 -37.100 -32.152 2.004 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -35.762 -32.300 -0.564 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -36.205 -33.915 -0.048 1.00 0.00 H new ATOM 1876 N GLY A 120 -34.371 -33.570 2.749 1.00 0.00 N ATOM 1877 CA GLY A 120 -33.759 -34.655 3.493 1.00 0.00 C ATOM 1878 C GLY A 120 -33.142 -35.703 2.588 1.00 0.00 C ATOM 1879 O GLY A 120 -32.890 -36.829 3.014 1.00 0.00 O ATOM 0 H GLY A 120 -33.770 -32.760 2.599 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -32.991 -34.251 4.153 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -34.510 -35.125 4.128 1.00 0.00 H new ATOM 1883 N ALA A 121 -32.900 -35.332 1.335 1.00 0.00 N ATOM 1884 CA ALA A 121 -32.309 -36.248 0.367 1.00 0.00 C ATOM 1885 C ALA A 121 -30.790 -36.123 0.350 1.00 0.00 C ATOM 1886 O ALA A 121 -30.245 -35.113 -0.097 1.00 0.00 O ATOM 1887 CB ALA A 121 -32.878 -35.990 -1.020 1.00 0.00 C ATOM 0 H ALA A 121 -33.104 -34.403 0.966 1.00 0.00 H new ATOM 0 HA ALA A 121 -32.560 -37.266 0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -32.428 -36.681 -1.732 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -33.958 -36.138 -1.004 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -32.657 -34.965 -1.319 1.00 0.00 H new ATOM 1893 N VAL A 122 -30.110 -37.154 0.839 1.00 0.00 N ATOM 1894 CA VAL A 122 -28.652 -37.160 0.879 1.00 0.00 C ATOM 1895 C VAL A 122 -28.064 -37.181 -0.527 1.00 0.00 C ATOM 1896 O VAL A 122 -28.116 -38.200 -1.217 1.00 0.00 O ATOM 1897 CB VAL A 122 -28.117 -38.371 1.666 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -28.737 -39.660 1.150 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -26.599 -38.430 1.585 1.00 0.00 C ATOM 0 H VAL A 122 -30.545 -37.997 1.214 1.00 0.00 H new ATOM 0 HA VAL A 122 -28.345 -36.244 1.384 1.00 0.00 H new ATOM 0 HB VAL A 122 -28.398 -38.255 2.713 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -28.347 -40.504 1.718 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -29.820 -39.614 1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -28.489 -39.786 0.096 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -26.238 -39.292 2.147 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -26.294 -38.522 0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -26.176 -37.518 2.008 1.00 0.00 H new ATOM 1909 N ILE A 123 -27.505 -36.051 -0.946 1.00 0.00 N ATOM 1910 CA ILE A 123 -26.906 -35.941 -2.270 1.00 0.00 C ATOM 1911 C ILE A 123 -25.407 -36.216 -2.219 1.00 0.00 C ATOM 1912 O ILE A 123 -24.881 -36.993 -3.015 1.00 0.00 O ATOM 1913 CB ILE A 123 -27.140 -34.546 -2.880 1.00 0.00 C ATOM 1914 CG1 ILE A 123 -28.637 -34.235 -2.937 1.00 0.00 C ATOM 1915 CG2 ILE A 123 -26.523 -34.464 -4.268 1.00 0.00 C ATOM 1916 CD1 ILE A 123 -29.011 -32.935 -2.261 1.00 0.00 C ATOM 0 H ILE A 123 -27.454 -35.199 -0.388 1.00 0.00 H new ATOM 0 HA ILE A 123 -27.390 -36.689 -2.898 1.00 0.00 H new ATOM 0 HB ILE A 123 -26.658 -33.803 -2.245 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -28.952 -34.197 -3.980 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -29.187 -35.050 -2.468 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -26.697 -33.472 -4.685 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -25.450 -34.646 -4.201 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -26.979 -35.215 -4.914 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -30.087 -32.780 -2.341 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -28.727 -32.977 -1.209 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -28.489 -32.110 -2.745 1.00 0.00 H new ATOM 1928 N MET A 124 -24.724 -35.573 -1.277 1.00 0.00 N ATOM 1929 CA MET A 124 -23.285 -35.751 -1.120 1.00 0.00 C ATOM 1930 C MET A 124 -22.926 -36.011 0.339 1.00 0.00 C ATOM 1931 O MET A 124 -23.797 -36.035 1.209 1.00 0.00 O ATOM 1932 CB MET A 124 -22.539 -34.517 -1.630 1.00 0.00 C ATOM 1933 CG MET A 124 -23.028 -33.215 -1.018 1.00 0.00 C ATOM 1934 SD MET A 124 -24.156 -32.319 -2.102 1.00 0.00 S ATOM 1935 CE MET A 124 -24.051 -30.669 -1.411 1.00 0.00 C ATOM 0 H MET A 124 -25.144 -34.924 -0.611 1.00 0.00 H new ATOM 0 HA MET A 124 -22.984 -36.617 -1.709 1.00 0.00 H new ATOM 0 HB2 MET A 124 -21.476 -34.632 -1.418 1.00 0.00 H new ATOM 0 HB3 MET A 124 -22.644 -34.461 -2.714 1.00 0.00 H new ATOM 0 HG2 MET A 124 -23.530 -33.428 -0.074 1.00 0.00 H new ATOM 0 HG3 MET A 124 -22.171 -32.582 -0.788 1.00 0.00 H new ATOM 0 HE1 MET A 124 -24.696 -29.996 -1.976 1.00 0.00 H new ATOM 0 HE2 MET A 124 -24.372 -30.690 -0.369 1.00 0.00 H new ATOM 0 HE3 MET A 124 -23.021 -30.316 -1.466 1.00 0.00 H new ATOM 1945 N PHE A 125 -21.637 -36.205 0.601 1.00 0.00 N ATOM 1946 CA PHE A 125 -21.163 -36.464 1.955 1.00 0.00 C ATOM 1947 C PHE A 125 -20.016 -35.525 2.319 1.00 0.00 C ATOM 1948 O PHE A 125 -19.176 -35.200 1.479 1.00 0.00 O ATOM 1949 CB PHE A 125 -20.707 -37.919 2.089 1.00 0.00 C ATOM 1950 CG PHE A 125 -21.400 -38.854 1.139 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -22.782 -38.953 1.129 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -20.669 -39.634 0.258 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -23.423 -39.812 0.256 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -21.305 -40.495 -0.617 1.00 0.00 C ATOM 1955 CZ PHE A 125 -22.683 -40.585 -0.617 1.00 0.00 C ATOM 0 H PHE A 125 -20.903 -36.188 -0.107 1.00 0.00 H new ATOM 0 HA PHE A 125 -21.989 -36.284 2.643 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.632 -37.972 1.918 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -20.885 -38.254 3.111 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -23.365 -38.352 1.811 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -19.591 -39.569 0.255 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -24.501 -39.879 0.257 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -20.724 -41.097 -1.300 1.00 0.00 H new ATOM 0 HZ PHE A 125 -23.181 -41.259 -1.298 1.00 0.00 H new ATOM 1965 N ILE A 126 -19.990 -35.092 3.575 1.00 0.00 N ATOM 1966 CA ILE A 126 -18.948 -34.191 4.050 1.00 0.00 C ATOM 1967 C ILE A 126 -18.159 -34.818 5.194 1.00 0.00 C ATOM 1968 O ILE A 126 -18.718 -35.522 6.036 1.00 0.00 O ATOM 1969 CB ILE A 126 -19.537 -32.848 4.522 1.00 0.00 C ATOM 1970 CG1 ILE A 126 -18.434 -31.958 5.098 1.00 0.00 C ATOM 1971 CG2 ILE A 126 -20.629 -33.083 5.554 1.00 0.00 C ATOM 1972 CD1 ILE A 126 -18.861 -30.520 5.297 1.00 0.00 C ATOM 0 H ILE A 126 -20.679 -35.351 4.282 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.280 -34.009 3.208 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.978 -32.339 3.665 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.110 -32.368 6.054 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.572 -31.984 4.431 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -21.036 -32.125 5.878 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.424 -33.684 5.112 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.211 -33.609 6.412 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -18.030 -29.947 5.708 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -19.158 -30.093 4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -19.704 -30.483 5.987 1.00 0.00 H new ATOM 1984 N LEU A 127 -16.857 -34.556 5.221 1.00 0.00 N ATOM 1985 CA LEU A 127 -15.990 -35.094 6.263 1.00 0.00 C ATOM 1986 C LEU A 127 -15.176 -33.983 6.920 1.00 0.00 C ATOM 1987 O LEU A 127 -14.821 -32.996 6.277 1.00 0.00 O ATOM 1988 CB LEU A 127 -15.052 -36.152 5.679 1.00 0.00 C ATOM 1989 CG LEU A 127 -15.725 -37.374 5.055 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -16.199 -37.060 3.644 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -14.774 -38.562 5.048 1.00 0.00 C ATOM 0 H LEU A 127 -16.379 -33.974 4.533 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.620 -35.557 7.023 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -14.430 -35.678 4.920 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -14.385 -36.494 6.470 1.00 0.00 H new ATOM 0 HG LEU A 127 -16.594 -37.634 5.659 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.676 -37.942 3.216 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.916 -36.239 3.675 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.346 -36.774 3.029 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -15.270 -39.423 4.600 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -13.885 -38.313 4.468 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -14.484 -38.802 6.071 1.00 0.00 H new ATOM 2003 N ASN A 128 -14.881 -34.153 8.205 1.00 0.00 N ATOM 2004 CA ASN A 128 -14.107 -33.166 8.949 1.00 0.00 C ATOM 2005 C ASN A 128 -12.934 -33.824 9.669 1.00 0.00 C ATOM 2006 O ASN A 128 -13.002 -34.993 10.049 1.00 0.00 O ATOM 2007 CB ASN A 128 -15.000 -32.444 9.960 1.00 0.00 C ATOM 2008 CG ASN A 128 -15.813 -31.333 9.325 1.00 0.00 C ATOM 2009 OD1 ASN A 128 -15.315 -30.593 8.476 1.00 0.00 O ATOM 2010 ND2 ASN A 128 -17.070 -31.211 9.734 1.00 0.00 N ATOM 0 H ASN A 128 -15.166 -34.965 8.752 1.00 0.00 H new ATOM 0 HA ASN A 128 -13.713 -32.440 8.238 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -15.674 -33.164 10.424 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -14.381 -32.028 10.755 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -17.665 -30.481 9.342 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -17.441 -31.847 10.440 1.00 0.00 H new ATOM 2017 N PHE A 129 -11.859 -33.066 9.853 1.00 0.00 N ATOM 2018 CA PHE A 129 -10.670 -33.575 10.526 1.00 0.00 C ATOM 2019 C PHE A 129 -10.635 -33.124 11.983 1.00 0.00 C ATOM 2020 O PHE A 129 -11.299 -32.159 12.361 1.00 0.00 O ATOM 2021 CB PHE A 129 -9.407 -33.102 9.804 1.00 0.00 C ATOM 2022 CG PHE A 129 -8.609 -32.097 10.586 1.00 0.00 C ATOM 2023 CD1 PHE A 129 -9.150 -30.863 10.908 1.00 0.00 C ATOM 2024 CD2 PHE A 129 -7.319 -32.387 10.999 1.00 0.00 C ATOM 2025 CE1 PHE A 129 -8.420 -29.937 11.628 1.00 0.00 C ATOM 2026 CE2 PHE A 129 -6.584 -31.465 11.719 1.00 0.00 C ATOM 2027 CZ PHE A 129 -7.134 -30.238 12.033 1.00 0.00 C ATOM 0 H PHE A 129 -11.786 -32.096 9.545 1.00 0.00 H new ATOM 0 HA PHE A 129 -10.708 -34.664 10.501 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -8.777 -33.965 9.588 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -9.688 -32.665 8.846 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -10.154 -30.622 10.592 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -6.883 -33.345 10.755 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -8.854 -28.979 11.874 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -5.580 -31.704 12.036 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.560 -29.515 12.594 1.00 0.00 H new ATOM 2037 N GLU A 130 -9.856 -33.830 12.797 1.00 0.00 N ATOM 2038 CA GLU A 130 -9.736 -33.503 14.213 1.00 0.00 C ATOM 2039 C GLU A 130 -8.533 -34.207 14.834 1.00 0.00 C ATOM 2040 O GLU A 130 -8.563 -35.413 15.078 1.00 0.00 O ATOM 2041 CB GLU A 130 -11.013 -33.896 14.960 1.00 0.00 C ATOM 2042 CG GLU A 130 -10.875 -33.837 16.472 1.00 0.00 C ATOM 2043 CD GLU A 130 -11.977 -33.027 17.127 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -13.150 -33.192 16.732 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -11.666 -32.229 18.036 1.00 0.00 O ATOM 0 H GLU A 130 -9.299 -34.631 12.500 1.00 0.00 H new ATOM 0 HA GLU A 130 -9.590 -32.426 14.300 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -11.823 -33.235 14.651 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -11.298 -34.907 14.669 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -10.886 -34.850 16.874 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.909 -33.403 16.728 1.00 0.00 H new ATOM 2052 N VAL A 131 -7.474 -33.444 15.086 1.00 0.00 N ATOM 2053 CA VAL A 131 -6.260 -33.993 15.679 1.00 0.00 C ATOM 2054 C VAL A 131 -6.566 -34.723 16.982 1.00 0.00 C ATOM 2055 O VAL A 131 -7.350 -34.247 17.803 1.00 0.00 O ATOM 2056 CB VAL A 131 -5.221 -32.890 15.953 1.00 0.00 C ATOM 2057 CG1 VAL A 131 -3.900 -33.500 16.398 1.00 0.00 C ATOM 2058 CG2 VAL A 131 -5.027 -32.022 14.718 1.00 0.00 C ATOM 0 H VAL A 131 -7.432 -32.444 14.889 1.00 0.00 H new ATOM 0 HA VAL A 131 -5.848 -34.699 14.959 1.00 0.00 H new ATOM 0 HB VAL A 131 -5.592 -32.257 16.759 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -3.178 -32.706 16.587 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -4.054 -34.075 17.311 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -3.520 -34.157 15.615 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -4.289 -31.248 14.930 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -4.678 -32.640 13.890 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -5.975 -31.556 14.448 1.00 0.00 H new ATOM 2068 N VAL A 132 -5.942 -35.882 17.166 1.00 0.00 N ATOM 2069 CA VAL A 132 -6.146 -36.677 18.370 1.00 0.00 C ATOM 2070 C VAL A 132 -4.816 -37.026 19.030 1.00 0.00 C ATOM 2071 O VAL A 132 -4.723 -37.110 20.254 1.00 0.00 O ATOM 2072 CB VAL A 132 -6.909 -37.979 18.061 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -6.940 -38.883 19.283 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -8.319 -37.667 17.582 1.00 0.00 C ATOM 0 H VAL A 132 -5.291 -36.291 16.496 1.00 0.00 H new ATOM 0 HA VAL A 132 -6.740 -36.070 19.053 1.00 0.00 H new ATOM 0 HB VAL A 132 -6.386 -38.506 17.263 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -7.483 -39.798 19.045 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -5.920 -39.132 19.577 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -7.439 -38.368 20.104 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -8.845 -38.597 17.368 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -8.854 -37.118 18.357 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -8.270 -37.061 16.677 1.00 0.00 H new ATOM 2084 N MET A 133 -3.790 -37.227 18.210 1.00 0.00 N ATOM 2085 CA MET A 133 -2.464 -37.565 18.715 1.00 0.00 C ATOM 2086 C MET A 133 -1.378 -36.873 17.897 1.00 0.00 C ATOM 2087 O MET A 133 -0.715 -37.502 17.073 1.00 0.00 O ATOM 2088 CB MET A 133 -2.254 -39.080 18.685 1.00 0.00 C ATOM 2089 CG MET A 133 -1.598 -39.628 19.942 1.00 0.00 C ATOM 2090 SD MET A 133 -2.587 -40.907 20.741 1.00 0.00 S ATOM 2091 CE MET A 133 -1.817 -42.387 20.090 1.00 0.00 C ATOM 0 H MET A 133 -3.851 -37.162 17.194 1.00 0.00 H new ATOM 0 HA MET A 133 -2.396 -37.217 19.746 1.00 0.00 H new ATOM 0 HB2 MET A 133 -3.218 -39.569 18.545 1.00 0.00 H new ATOM 0 HB3 MET A 133 -1.638 -39.336 17.823 1.00 0.00 H new ATOM 0 HG2 MET A 133 -0.620 -40.036 19.688 1.00 0.00 H new ATOM 0 HG3 MET A 133 -1.430 -38.812 20.645 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.320 -43.266 20.493 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.896 -42.390 19.003 1.00 0.00 H new ATOM 0 HE3 MET A 133 -0.766 -42.407 20.377 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.203 -35.576 18.131 1.00 0.00 N ATOM 2102 CA GLU A 134 -0.198 -34.801 17.413 1.00 0.00 C ATOM 2103 C GLU A 134 1.197 -35.072 17.969 1.00 0.00 C ATOM 2104 O GLU A 134 1.674 -34.364 18.856 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.513 -33.306 17.506 1.00 0.00 C ATOM 2106 CG GLU A 134 0.038 -32.495 16.345 1.00 0.00 C ATOM 2107 CD GLU A 134 0.728 -31.223 16.798 1.00 0.00 C ATOM 2108 OE1 GLU A 134 0.024 -30.225 17.056 1.00 0.00 O ATOM 2109 OE2 GLU A 134 1.973 -31.227 16.894 1.00 0.00 O ATOM 0 H GLU A 134 -1.743 -35.041 18.811 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.220 -35.106 16.367 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -1.594 -33.173 17.551 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.105 -32.914 18.438 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.744 -33.106 15.782 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -0.776 -32.241 15.666 1.00 0.00 H new ATOM 2116 N LYS A 135 1.847 -36.104 17.441 1.00 0.00 N ATOM 2117 CA LYS A 135 3.188 -36.471 17.881 1.00 0.00 C ATOM 2118 C LYS A 135 4.209 -35.424 17.447 1.00 0.00 C ATOM 2119 O LYS A 135 5.407 -35.700 17.385 1.00 0.00 O ATOM 2120 CB LYS A 135 3.575 -37.840 17.318 1.00 0.00 C ATOM 2121 CG LYS A 135 2.470 -38.877 17.427 1.00 0.00 C ATOM 2122 CD LYS A 135 2.001 -39.044 18.863 1.00 0.00 C ATOM 2123 CE LYS A 135 3.119 -39.556 19.758 1.00 0.00 C ATOM 2124 NZ LYS A 135 3.520 -38.548 20.778 1.00 0.00 N ATOM 0 H LYS A 135 1.466 -36.701 16.707 1.00 0.00 H new ATOM 0 HA LYS A 135 3.185 -36.520 18.970 1.00 0.00 H new ATOM 0 HB2 LYS A 135 3.854 -37.727 16.270 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.457 -38.204 17.845 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.629 -38.581 16.801 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.829 -39.834 17.047 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.639 -38.088 19.242 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.161 -39.738 18.894 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.795 -40.469 20.258 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.983 -39.817 19.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.986 -39.027 21.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.178 -37.865 20.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.676 -38.047 21.121 1.00 0.00 H new