USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 824 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 CYS SG : rot -38:sc= 0.56 USER MOD Set 1.2: A 99 TYR OH : rot -166:sc= 0.88 USER MOD Single : A 28 LYS NZ :NH3+ 167:sc= 1.2 (180deg=0.907) USER MOD Single : A 33 ASN :FLIP amide:sc= -0.178 F(o=-1.3,f=-0.18) 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 127:sc= 1.06 USER MOD Single : A 45 ASN : amide:sc= -0.0372 X(o=-0.037,f=-0.17) USER MOD Single : A 49 CYS SG : rot 64:sc= 0.849 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -169:sc= -0.511 USER MOD Single : A 60 MET CE :methyl 169:sc= -0.0169 (180deg=-0.246) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 CYS SG : rot -30:sc= -2.7 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot -162:sc= -0.208 USER MOD Single : A 70 HIS : no HD1:sc= -3.43 K(o=-3.4,f=-4) USER MOD Single : A 74 THR OG1 : rot -160:sc= 0.372 USER MOD Single : A 75 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.3) USER MOD Single : A 81 GLN : amide:sc= -5.95! C(o=-6!,f=-9.1!) USER MOD Single : A 84 GLN :FLIP amide:sc= -0.537 F(o=-1.3!,f=-0.54) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 158:sc= -0.0497 (180deg=-0.541) USER MOD Single : A 104 SER OG : rot 120:sc= 0.511 USER MOD Single : A 105 CYS SG : rot 180:sc= -0.298 USER MOD Single : A 108 CYS SG : rot 180:sc= -0.355 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -1.93 K(o=-1.9,f=-4.9!) USER MOD Single : A 124 MET CE :methyl 157:sc= -1.65 (180deg=-2.68!) USER MOD Single : A 128 ASN : amide:sc= -0.0354 K(o=-0.035,f=-0.6) USER MOD Single : A 133 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 424 N ARG A 27 -7.078 -25.860 11.042 1.00 0.00 N ATOM 425 CA ARG A 27 -7.670 -27.160 10.752 1.00 0.00 C ATOM 426 C ARG A 27 -7.788 -27.380 9.247 1.00 0.00 C ATOM 427 O ARG A 27 -7.059 -26.775 8.461 1.00 0.00 O ATOM 428 CB ARG A 27 -9.049 -27.273 11.404 1.00 0.00 C ATOM 429 CG ARG A 27 -10.092 -26.357 10.785 1.00 0.00 C ATOM 430 CD ARG A 27 -11.473 -26.994 10.803 1.00 0.00 C ATOM 431 NE ARG A 27 -12.516 -26.029 11.140 1.00 0.00 N ATOM 432 CZ ARG A 27 -12.797 -25.655 12.384 1.00 0.00 C ATOM 433 NH1 ARG A 27 -12.115 -26.162 13.402 1.00 0.00 N ATOM 434 NH2 ARG A 27 -13.761 -24.772 12.611 1.00 0.00 N ATOM 0 HA ARG A 27 -7.016 -27.929 11.164 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -9.393 -28.304 11.329 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -8.960 -27.043 12.466 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -10.118 -25.413 11.330 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -9.810 -26.125 9.758 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -11.684 -27.430 9.826 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -11.487 -27.810 11.526 1.00 0.00 H new ATOM 0 HE ARG A 27 -13.058 -25.620 10.379 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -11.373 -26.841 13.231 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -12.333 -25.873 14.356 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -14.287 -24.380 11.830 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -13.976 -24.486 13.566 1.00 0.00 H new ATOM 448 N LYS A 28 -8.710 -28.251 8.852 1.00 0.00 N ATOM 449 CA LYS A 28 -8.925 -28.551 7.441 1.00 0.00 C ATOM 450 C LYS A 28 -10.327 -29.106 7.211 1.00 0.00 C ATOM 451 O LYS A 28 -10.978 -29.583 8.141 1.00 0.00 O ATOM 452 CB LYS A 28 -7.881 -29.555 6.947 1.00 0.00 C ATOM 453 CG LYS A 28 -8.049 -30.946 7.533 1.00 0.00 C ATOM 454 CD LYS A 28 -8.880 -31.836 6.625 1.00 0.00 C ATOM 455 CE LYS A 28 -8.015 -32.544 5.593 1.00 0.00 C ATOM 456 NZ LYS A 28 -7.005 -33.432 6.232 1.00 0.00 N ATOM 0 H LYS A 28 -9.321 -28.762 9.489 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.823 -27.623 6.878 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.936 -29.619 5.860 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.887 -29.183 7.194 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.069 -31.397 7.689 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.526 -30.875 8.510 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.411 -32.575 7.225 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.635 -31.236 6.118 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.649 -33.133 4.930 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.508 -31.803 4.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.588 -34.057 5.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.257 -32.853 6.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -7.464 -34.008 6.967 1.00 0.00 H new ATOM 470 N PHE A 29 -10.787 -29.042 5.965 1.00 0.00 N ATOM 471 CA PHE A 29 -12.112 -29.539 5.613 1.00 0.00 C ATOM 472 C PHE A 29 -12.168 -29.942 4.142 1.00 0.00 C ATOM 473 O PHE A 29 -11.612 -29.262 3.280 1.00 0.00 O ATOM 474 CB PHE A 29 -13.172 -28.475 5.902 1.00 0.00 C ATOM 475 CG PHE A 29 -14.193 -28.332 4.809 1.00 0.00 C ATOM 476 CD1 PHE A 29 -15.147 -29.315 4.603 1.00 0.00 C ATOM 477 CD2 PHE A 29 -14.198 -27.216 3.989 1.00 0.00 C ATOM 478 CE1 PHE A 29 -16.087 -29.187 3.597 1.00 0.00 C ATOM 479 CE2 PHE A 29 -15.135 -27.082 2.982 1.00 0.00 C ATOM 480 CZ PHE A 29 -16.082 -28.069 2.787 1.00 0.00 C ATOM 0 H PHE A 29 -10.262 -28.651 5.183 1.00 0.00 H new ATOM 0 HA PHE A 29 -12.316 -30.420 6.221 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -13.681 -28.724 6.833 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -12.679 -27.515 6.055 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.157 -30.191 5.235 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -13.461 -26.441 4.138 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.825 -29.961 3.445 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -15.127 -26.207 2.349 1.00 0.00 H new ATOM 0 HZ PHE A 29 -16.817 -27.966 2.002 1.00 0.00 H new ATOM 490 N ILE A 30 -12.842 -31.053 3.865 1.00 0.00 N ATOM 491 CA ILE A 30 -12.972 -31.547 2.500 1.00 0.00 C ATOM 492 C ILE A 30 -14.308 -32.253 2.295 1.00 0.00 C ATOM 493 O ILE A 30 -14.844 -32.869 3.217 1.00 0.00 O ATOM 494 CB ILE A 30 -11.831 -32.518 2.142 1.00 0.00 C ATOM 495 CG1 ILE A 30 -12.011 -33.846 2.880 1.00 0.00 C ATOM 496 CG2 ILE A 30 -10.483 -31.897 2.478 1.00 0.00 C ATOM 497 CD1 ILE A 30 -11.527 -33.811 4.313 1.00 0.00 C ATOM 0 H ILE A 30 -13.306 -31.628 4.568 1.00 0.00 H new ATOM 0 HA ILE A 30 -12.919 -30.678 1.844 1.00 0.00 H new ATOM 0 HB ILE A 30 -11.862 -32.713 1.070 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.066 -34.119 2.868 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -11.473 -34.627 2.342 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -9.686 -32.595 2.220 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.356 -30.975 1.911 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.440 -31.676 3.544 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -11.686 -34.786 4.775 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -10.464 -33.569 4.332 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -12.082 -33.053 4.866 1.00 0.00 H new ATOM 509 N ILE A 31 -14.839 -32.161 1.081 1.00 0.00 N ATOM 510 CA ILE A 31 -16.111 -32.794 0.754 1.00 0.00 C ATOM 511 C ILE A 31 -15.988 -33.666 -0.490 1.00 0.00 C ATOM 512 O ILE A 31 -15.241 -33.344 -1.415 1.00 0.00 O ATOM 513 CB ILE A 31 -17.218 -31.748 0.527 1.00 0.00 C ATOM 514 CG1 ILE A 31 -16.610 -30.424 0.057 1.00 0.00 C ATOM 515 CG2 ILE A 31 -18.024 -31.544 1.801 1.00 0.00 C ATOM 516 CD1 ILE A 31 -17.559 -29.583 -0.769 1.00 0.00 C ATOM 0 H ILE A 31 -14.409 -31.654 0.307 1.00 0.00 H new ATOM 0 HA ILE A 31 -16.381 -33.418 1.606 1.00 0.00 H new ATOM 0 HB ILE A 31 -17.890 -32.114 -0.250 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -16.292 -29.850 0.927 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -15.716 -30.632 -0.531 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -18.802 -30.802 1.624 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -18.483 -32.488 2.096 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -17.365 -31.196 2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -17.062 -28.660 -1.067 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -17.857 -30.138 -1.658 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.442 -29.344 -0.177 1.00 0.00 H new ATOM 528 N ALA A 32 -16.726 -34.771 -0.508 1.00 0.00 N ATOM 529 CA ALA A 32 -16.702 -35.688 -1.640 1.00 0.00 C ATOM 530 C ALA A 32 -18.087 -35.825 -2.265 1.00 0.00 C ATOM 531 O ALA A 32 -19.048 -36.194 -1.592 1.00 0.00 O ATOM 532 CB ALA A 32 -16.180 -37.050 -1.206 1.00 0.00 C ATOM 0 H ALA A 32 -17.348 -35.053 0.249 1.00 0.00 H new ATOM 0 HA ALA A 32 -16.030 -35.277 -2.394 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -16.168 -37.725 -2.062 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.169 -36.944 -0.813 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.829 -37.458 -0.431 1.00 0.00 H new ATOM 538 N ASN A 33 -18.181 -35.523 -3.556 1.00 0.00 N ATOM 539 CA ASN A 33 -19.448 -35.611 -4.271 1.00 0.00 C ATOM 540 C ASN A 33 -19.796 -37.063 -4.586 1.00 0.00 C ATOM 541 O ASN A 33 -18.950 -37.829 -5.046 1.00 0.00 O ATOM 542 CB ASN A 33 -19.385 -34.798 -5.566 1.00 0.00 C ATOM 543 CG ASN A 33 -18.828 -35.601 -6.726 1.00 0.00 C ATOM 544 OD1 ASN A 33 -17.556 -35.971 -6.632 1.00 0.00 O flip ATOM 545 ND2 ASN A 33 -19.533 -35.884 -7.694 1.00 0.00 N flip ATOM 0 H ASN A 33 -17.395 -35.215 -4.128 1.00 0.00 H new ATOM 0 HA ASN A 33 -20.227 -35.200 -3.629 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -20.385 -34.445 -5.819 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -18.765 -33.915 -5.408 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -20.506 -35.578 -7.723 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -19.145 -36.424 -8.467 1.00 0.00 H new ATOM 552 N ALA A 34 -21.047 -37.434 -4.334 1.00 0.00 N ATOM 553 CA ALA A 34 -21.507 -38.793 -4.592 1.00 0.00 C ATOM 554 C ALA A 34 -21.255 -39.191 -6.042 1.00 0.00 C ATOM 555 O ALA A 34 -21.176 -40.377 -6.365 1.00 0.00 O ATOM 556 CB ALA A 34 -22.986 -38.922 -4.257 1.00 0.00 C ATOM 0 H ALA A 34 -21.760 -36.813 -3.952 1.00 0.00 H new ATOM 0 HA ALA A 34 -20.940 -39.470 -3.953 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -23.316 -39.942 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -23.142 -38.687 -3.204 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -23.560 -38.229 -4.872 1.00 0.00 H new ATOM 631 N CYS A 39 -13.569 -41.572 -7.992 1.00 0.00 N ATOM 632 CA CYS A 39 -13.580 -41.956 -6.585 1.00 0.00 C ATOM 633 C CYS A 39 -12.584 -41.121 -5.786 1.00 0.00 C ATOM 634 O CYS A 39 -11.725 -41.661 -5.090 1.00 0.00 O ATOM 635 CB CYS A 39 -13.253 -43.442 -6.437 1.00 0.00 C ATOM 636 SG CYS A 39 -14.194 -44.519 -7.543 1.00 0.00 S ATOM 0 HA CYS A 39 -14.580 -41.771 -6.191 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -12.189 -43.589 -6.623 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -13.441 -43.744 -5.407 1.00 0.00 H new ATOM 0 HG CYS A 39 -13.846 -45.756 -7.345 1.00 0.00 H new ATOM 642 N ALA A 40 -12.705 -39.802 -5.893 1.00 0.00 N ATOM 643 CA ALA A 40 -11.816 -38.893 -5.181 1.00 0.00 C ATOM 644 C ALA A 40 -12.560 -37.643 -4.725 1.00 0.00 C ATOM 645 O ALA A 40 -13.612 -37.302 -5.265 1.00 0.00 O ATOM 646 CB ALA A 40 -10.633 -38.515 -6.060 1.00 0.00 C ATOM 0 H ALA A 40 -13.410 -39.339 -6.466 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.445 -39.407 -4.294 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.977 -37.836 -5.515 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.079 -39.414 -6.331 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.994 -38.024 -6.964 1.00 0.00 H new ATOM 652 N VAL A 41 -12.007 -36.962 -3.726 1.00 0.00 N ATOM 653 CA VAL A 41 -12.618 -35.748 -3.197 1.00 0.00 C ATOM 654 C VAL A 41 -12.961 -34.773 -4.317 1.00 0.00 C ATOM 655 O VAL A 41 -12.313 -34.762 -5.364 1.00 0.00 O ATOM 656 CB VAL A 41 -11.691 -35.047 -2.187 1.00 0.00 C ATOM 657 CG1 VAL A 41 -10.482 -34.454 -2.894 1.00 0.00 C ATOM 658 CG2 VAL A 41 -12.451 -33.974 -1.422 1.00 0.00 C ATOM 0 H VAL A 41 -11.137 -37.231 -3.267 1.00 0.00 H new ATOM 0 HA VAL A 41 -13.534 -36.050 -2.689 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.336 -35.788 -1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -9.838 -33.963 -2.164 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.926 -35.248 -3.392 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -10.814 -33.725 -3.633 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.780 -33.489 -0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -12.837 -33.233 -2.122 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.281 -34.431 -0.883 1.00 0.00 H new ATOM 668 N ILE A 42 -13.983 -33.955 -4.090 1.00 0.00 N ATOM 669 CA ILE A 42 -14.411 -32.974 -5.080 1.00 0.00 C ATOM 670 C ILE A 42 -14.017 -31.562 -4.660 1.00 0.00 C ATOM 671 O ILE A 42 -13.710 -30.716 -5.501 1.00 0.00 O ATOM 672 CB ILE A 42 -15.934 -33.025 -5.301 1.00 0.00 C ATOM 673 CG1 ILE A 42 -16.355 -31.988 -6.344 1.00 0.00 C ATOM 674 CG2 ILE A 42 -16.668 -32.792 -3.988 1.00 0.00 C ATOM 675 CD1 ILE A 42 -15.668 -32.162 -7.680 1.00 0.00 C ATOM 0 H ILE A 42 -14.530 -33.952 -3.229 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.908 -33.227 -6.013 1.00 0.00 H new ATOM 0 HB ILE A 42 -16.199 -34.015 -5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -17.434 -32.047 -6.489 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -16.139 -30.991 -5.961 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.744 -32.831 -4.161 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -16.387 -33.564 -3.272 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -16.400 -31.813 -3.590 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -16.014 -31.393 -8.370 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.590 -32.073 -7.549 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.904 -33.146 -8.085 1.00 0.00 H new ATOM 687 N TYR A 43 -14.025 -31.314 -3.355 1.00 0.00 N ATOM 688 CA TYR A 43 -13.669 -30.004 -2.824 1.00 0.00 C ATOM 689 C TYR A 43 -12.800 -30.140 -1.577 1.00 0.00 C ATOM 690 O TYR A 43 -12.851 -31.153 -0.879 1.00 0.00 O ATOM 691 CB TYR A 43 -14.930 -29.203 -2.495 1.00 0.00 C ATOM 692 CG TYR A 43 -15.002 -27.869 -3.203 1.00 0.00 C ATOM 693 CD1 TYR A 43 -15.323 -27.793 -4.553 1.00 0.00 C ATOM 694 CD2 TYR A 43 -14.751 -26.685 -2.521 1.00 0.00 C ATOM 695 CE1 TYR A 43 -15.389 -26.576 -5.203 1.00 0.00 C ATOM 696 CE2 TYR A 43 -14.816 -25.463 -3.164 1.00 0.00 C ATOM 697 CZ TYR A 43 -15.135 -25.414 -4.505 1.00 0.00 C ATOM 698 OH TYR A 43 -15.202 -24.200 -5.149 1.00 0.00 O ATOM 0 H TYR A 43 -14.274 -32.003 -2.646 1.00 0.00 H new ATOM 0 HA TYR A 43 -13.099 -29.474 -3.587 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.806 -29.794 -2.762 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.974 -29.036 -1.419 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.524 -28.700 -5.103 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -14.501 -26.720 -1.471 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -15.638 -26.535 -6.253 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -14.618 -24.552 -2.619 1.00 0.00 H new ATOM 0 HH TYR A 43 -14.997 -23.482 -4.515 1.00 0.00 H new ATOM 708 N CYS A 44 -12.003 -29.112 -1.305 1.00 0.00 N ATOM 709 CA CYS A 44 -11.122 -29.115 -0.143 1.00 0.00 C ATOM 710 C CYS A 44 -10.667 -27.700 0.198 1.00 0.00 C ATOM 711 O CYS A 44 -10.220 -26.955 -0.673 1.00 0.00 O ATOM 712 CB CYS A 44 -9.906 -30.007 -0.401 1.00 0.00 C ATOM 713 SG CYS A 44 -9.172 -29.797 -2.040 1.00 0.00 S ATOM 0 H CYS A 44 -11.949 -28.267 -1.873 1.00 0.00 H new ATOM 0 HA CYS A 44 -11.681 -29.511 0.705 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -9.148 -29.798 0.354 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -10.200 -31.049 -0.277 1.00 0.00 H new ATOM 0 HG CYS A 44 -7.899 -29.561 -1.919 1.00 0.00 H new ATOM 719 N ASN A 45 -10.785 -27.336 1.471 1.00 0.00 N ATOM 720 CA ASN A 45 -10.388 -26.009 1.927 1.00 0.00 C ATOM 721 C ASN A 45 -8.869 -25.861 1.914 1.00 0.00 C ATOM 722 O ASN A 45 -8.144 -26.819 1.646 1.00 0.00 O ATOM 723 CB ASN A 45 -10.925 -25.749 3.335 1.00 0.00 C ATOM 724 CG ASN A 45 -11.767 -24.490 3.410 1.00 0.00 C ATOM 725 OD1 ASN A 45 -12.642 -24.265 2.575 1.00 0.00 O ATOM 726 ND2 ASN A 45 -11.503 -23.661 4.414 1.00 0.00 N ATOM 0 H ASN A 45 -11.152 -27.942 2.205 1.00 0.00 H new ATOM 0 HA ASN A 45 -10.813 -25.275 1.242 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -11.523 -26.602 3.656 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -10.089 -25.666 4.030 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -12.036 -22.797 4.515 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -10.768 -23.889 5.083 1.00 0.00 H new ATOM 733 N ASP A 46 -8.396 -24.655 2.206 1.00 0.00 N ATOM 734 CA ASP A 46 -6.963 -24.381 2.230 1.00 0.00 C ATOM 735 C ASP A 46 -6.271 -25.206 3.310 1.00 0.00 C ATOM 736 O ASP A 46 -5.127 -25.629 3.145 1.00 0.00 O ATOM 737 CB ASP A 46 -6.711 -22.892 2.467 1.00 0.00 C ATOM 738 CG ASP A 46 -5.325 -22.462 2.028 1.00 0.00 C ATOM 739 OD1 ASP A 46 -4.370 -22.649 2.810 1.00 0.00 O ATOM 740 OD2 ASP A 46 -5.196 -21.939 0.901 1.00 0.00 O ATOM 0 H ASP A 46 -8.983 -23.851 2.429 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.548 -24.661 1.262 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.457 -22.310 1.926 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.839 -22.669 3.526 1.00 0.00 H new ATOM 745 N GLY A 47 -6.972 -25.430 4.417 1.00 0.00 N ATOM 746 CA GLY A 47 -6.407 -26.202 5.509 1.00 0.00 C ATOM 747 C GLY A 47 -5.818 -27.519 5.044 1.00 0.00 C ATOM 748 O GLY A 47 -4.704 -27.878 5.424 1.00 0.00 O ATOM 0 H GLY A 47 -7.921 -25.091 4.577 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.632 -25.615 6.002 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.181 -26.396 6.252 1.00 0.00 H new ATOM 752 N PHE A 48 -6.569 -28.243 4.220 1.00 0.00 N ATOM 753 CA PHE A 48 -6.116 -29.530 3.705 1.00 0.00 C ATOM 754 C PHE A 48 -4.723 -29.411 3.093 1.00 0.00 C ATOM 755 O PHE A 48 -3.863 -30.266 3.310 1.00 0.00 O ATOM 756 CB PHE A 48 -7.100 -30.060 2.660 1.00 0.00 C ATOM 757 CG PHE A 48 -6.468 -30.331 1.324 1.00 0.00 C ATOM 758 CD1 PHE A 48 -5.770 -31.507 1.100 1.00 0.00 C ATOM 759 CD2 PHE A 48 -6.572 -29.411 0.294 1.00 0.00 C ATOM 760 CE1 PHE A 48 -5.188 -31.760 -0.128 1.00 0.00 C ATOM 761 CE2 PHE A 48 -5.992 -29.658 -0.936 1.00 0.00 C ATOM 762 CZ PHE A 48 -5.298 -30.834 -1.147 1.00 0.00 C ATOM 0 H PHE A 48 -7.494 -27.960 3.895 1.00 0.00 H new ATOM 0 HA PHE A 48 -6.069 -30.231 4.539 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -7.552 -30.979 3.032 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.906 -29.337 2.532 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -5.680 -32.234 1.894 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.113 -28.490 0.454 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -4.648 -32.681 -0.291 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.081 -28.933 -1.731 1.00 0.00 H new ATOM 0 HZ PHE A 48 -4.842 -31.029 -2.107 1.00 0.00 H new ATOM 772 N CYS A 49 -4.508 -28.346 2.329 1.00 0.00 N ATOM 773 CA CYS A 49 -3.220 -28.114 1.685 1.00 0.00 C ATOM 774 C CYS A 49 -2.146 -27.790 2.718 1.00 0.00 C ATOM 775 O CYS A 49 -0.990 -28.184 2.569 1.00 0.00 O ATOM 776 CB CYS A 49 -3.331 -26.974 0.671 1.00 0.00 C ATOM 777 SG CYS A 49 -1.740 -26.375 0.057 1.00 0.00 S ATOM 0 H CYS A 49 -5.209 -27.629 2.140 1.00 0.00 H new ATOM 0 HA CYS A 49 -2.933 -29.027 1.164 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -3.931 -27.311 -0.174 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -3.867 -26.144 1.131 1.00 0.00 H new ATOM 0 HG CYS A 49 -1.148 -27.321 -0.610 1.00 0.00 H new ATOM 783 N GLU A 50 -2.536 -27.069 3.764 1.00 0.00 N ATOM 784 CA GLU A 50 -1.605 -26.690 4.820 1.00 0.00 C ATOM 785 C GLU A 50 -1.247 -27.893 5.687 1.00 0.00 C ATOM 786 O GLU A 50 -0.198 -27.918 6.332 1.00 0.00 O ATOM 787 CB GLU A 50 -2.207 -25.583 5.688 1.00 0.00 C ATOM 788 CG GLU A 50 -2.732 -26.076 7.026 1.00 0.00 C ATOM 789 CD GLU A 50 -1.641 -26.194 8.073 1.00 0.00 C ATOM 790 OE1 GLU A 50 -0.951 -25.184 8.326 1.00 0.00 O ATOM 791 OE2 GLU A 50 -1.476 -27.295 8.638 1.00 0.00 O ATOM 0 H GLU A 50 -3.490 -26.736 3.903 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.694 -26.319 4.350 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.450 -24.819 5.864 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -3.021 -25.106 5.141 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -3.502 -25.392 7.384 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.207 -27.048 6.890 1.00 0.00 H new ATOM 798 N LEU A 51 -2.126 -28.889 5.698 1.00 0.00 N ATOM 799 CA LEU A 51 -1.904 -30.097 6.486 1.00 0.00 C ATOM 800 C LEU A 51 -1.098 -31.122 5.696 1.00 0.00 C ATOM 801 O LEU A 51 -0.012 -31.528 6.113 1.00 0.00 O ATOM 802 CB LEU A 51 -3.242 -30.703 6.914 1.00 0.00 C ATOM 803 CG LEU A 51 -3.546 -30.667 8.412 1.00 0.00 C ATOM 804 CD1 LEU A 51 -2.446 -31.364 9.197 1.00 0.00 C ATOM 805 CD2 LEU A 51 -3.716 -29.232 8.888 1.00 0.00 C ATOM 0 H LEU A 51 -2.999 -28.884 5.170 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.336 -29.822 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -4.040 -30.179 6.389 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.271 -31.741 6.583 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.481 -31.199 8.586 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.680 -31.328 10.261 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.373 -32.403 8.876 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.496 -30.861 9.017 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.932 -29.226 9.956 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.798 -28.675 8.700 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.540 -28.765 8.349 1.00 0.00 H new ATOM 817 N CYS A 52 -1.634 -31.536 4.553 1.00 0.00 N ATOM 818 CA CYS A 52 -0.964 -32.514 3.703 1.00 0.00 C ATOM 819 C CYS A 52 0.213 -31.879 2.970 1.00 0.00 C ATOM 820 O CYS A 52 1.026 -32.574 2.361 1.00 0.00 O ATOM 821 CB CYS A 52 -1.950 -33.105 2.695 1.00 0.00 C ATOM 822 SG CYS A 52 -2.166 -34.895 2.837 1.00 0.00 S ATOM 0 H CYS A 52 -2.531 -31.209 4.193 1.00 0.00 H new ATOM 0 HA CYS A 52 -0.584 -33.314 4.339 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -2.918 -32.622 2.824 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.608 -32.870 1.687 1.00 0.00 H new ATOM 0 HG CYS A 52 -1.022 -35.450 3.106 1.00 0.00 H new ATOM 828 N GLY A 53 0.297 -30.554 3.030 1.00 0.00 N ATOM 829 CA GLY A 53 1.377 -29.848 2.366 1.00 0.00 C ATOM 830 C GLY A 53 1.449 -30.160 0.884 1.00 0.00 C ATOM 831 O GLY A 53 2.485 -29.959 0.250 1.00 0.00 O ATOM 0 H GLY A 53 -0.364 -29.956 3.527 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.243 -28.775 2.502 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.324 -30.113 2.836 1.00 0.00 H new ATOM 835 N TYR A 54 0.346 -30.653 0.331 1.00 0.00 N ATOM 836 CA TYR A 54 0.290 -30.997 -1.084 1.00 0.00 C ATOM 837 C TYR A 54 -0.551 -29.986 -1.858 1.00 0.00 C ATOM 838 O TYR A 54 -1.164 -29.094 -1.272 1.00 0.00 O ATOM 839 CB TYR A 54 -0.287 -32.402 -1.266 1.00 0.00 C ATOM 840 CG TYR A 54 0.758 -33.452 -1.567 1.00 0.00 C ATOM 841 CD1 TYR A 54 1.760 -33.745 -0.650 1.00 0.00 C ATOM 842 CD2 TYR A 54 0.746 -34.150 -2.768 1.00 0.00 C ATOM 843 CE1 TYR A 54 2.718 -34.703 -0.920 1.00 0.00 C ATOM 844 CE2 TYR A 54 1.699 -35.110 -3.047 1.00 0.00 C ATOM 845 CZ TYR A 54 2.683 -35.383 -2.120 1.00 0.00 C ATOM 846 OH TYR A 54 3.635 -36.338 -2.394 1.00 0.00 O ATOM 0 H TYR A 54 -0.521 -30.823 0.841 1.00 0.00 H new ATOM 0 HA TYR A 54 1.306 -30.974 -1.478 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.824 -32.685 -0.361 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.016 -32.384 -2.076 1.00 0.00 H new ATOM 0 HD1 TYR A 54 1.790 -33.215 0.290 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.022 -33.938 -3.497 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.490 -34.918 -0.196 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.674 -35.644 -3.986 1.00 0.00 H new ATOM 0 HH TYR A 54 3.467 -36.723 -3.279 1.00 0.00 H new ATOM 856 N SER A 55 -0.574 -30.133 -3.179 1.00 0.00 N ATOM 857 CA SER A 55 -1.337 -29.232 -4.035 1.00 0.00 C ATOM 858 C SER A 55 -2.778 -29.710 -4.179 1.00 0.00 C ATOM 859 O SER A 55 -3.040 -30.908 -4.279 1.00 0.00 O ATOM 860 CB SER A 55 -0.681 -29.127 -5.413 1.00 0.00 C ATOM 861 OG SER A 55 0.465 -29.956 -5.497 1.00 0.00 O ATOM 0 H SER A 55 -0.073 -30.867 -3.680 1.00 0.00 H new ATOM 0 HA SER A 55 -1.345 -28.247 -3.569 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.398 -29.413 -6.183 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.400 -28.092 -5.607 1.00 0.00 H new ATOM 0 HG SER A 55 0.963 -29.744 -6.314 1.00 0.00 H new ATOM 867 N ARG A 56 -3.711 -28.762 -4.189 1.00 0.00 N ATOM 868 CA ARG A 56 -5.126 -29.085 -4.320 1.00 0.00 C ATOM 869 C ARG A 56 -5.390 -29.861 -5.608 1.00 0.00 C ATOM 870 O ARG A 56 -6.361 -30.611 -5.704 1.00 0.00 O ATOM 871 CB ARG A 56 -5.967 -27.807 -4.301 1.00 0.00 C ATOM 872 CG ARG A 56 -7.430 -28.035 -4.646 1.00 0.00 C ATOM 873 CD ARG A 56 -8.325 -26.998 -3.986 1.00 0.00 C ATOM 874 NE ARG A 56 -9.733 -27.200 -4.317 1.00 0.00 N ATOM 875 CZ ARG A 56 -10.246 -26.965 -5.520 1.00 0.00 C ATOM 876 NH1 ARG A 56 -9.471 -26.521 -6.500 1.00 0.00 N ATOM 877 NH2 ARG A 56 -11.537 -27.173 -5.744 1.00 0.00 N ATOM 0 H ARG A 56 -3.512 -27.765 -4.108 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.409 -29.711 -3.474 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.902 -27.354 -3.312 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.543 -27.093 -5.007 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.561 -27.995 -5.727 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.730 -29.033 -4.326 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.197 -27.044 -2.905 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.018 -26.001 -4.301 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.357 -27.540 -3.585 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.478 -26.359 -6.331 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -9.868 -26.342 -7.422 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.137 -27.514 -4.992 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.930 -26.992 -6.668 1.00 0.00 H new ATOM 891 N ALA A 57 -4.519 -29.675 -6.594 1.00 0.00 N ATOM 892 CA ALA A 57 -4.657 -30.358 -7.874 1.00 0.00 C ATOM 893 C ALA A 57 -3.953 -31.710 -7.853 1.00 0.00 C ATOM 894 O ALA A 57 -4.244 -32.584 -8.669 1.00 0.00 O ATOM 895 CB ALA A 57 -4.106 -29.491 -8.997 1.00 0.00 C ATOM 0 H ALA A 57 -3.710 -29.057 -6.531 1.00 0.00 H new ATOM 0 HA ALA A 57 -5.718 -30.533 -8.052 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.216 -30.014 -9.947 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -4.656 -28.551 -9.034 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -3.051 -29.287 -8.815 1.00 0.00 H new ATOM 901 N GLU A 58 -3.025 -31.875 -6.916 1.00 0.00 N ATOM 902 CA GLU A 58 -2.278 -33.121 -6.791 1.00 0.00 C ATOM 903 C GLU A 58 -3.036 -34.125 -5.927 1.00 0.00 C ATOM 904 O GLU A 58 -2.925 -35.336 -6.120 1.00 0.00 O ATOM 905 CB GLU A 58 -0.896 -32.856 -6.191 1.00 0.00 C ATOM 906 CG GLU A 58 0.116 -32.340 -7.200 1.00 0.00 C ATOM 907 CD GLU A 58 1.544 -32.442 -6.699 1.00 0.00 C ATOM 908 OE1 GLU A 58 1.858 -33.427 -5.997 1.00 0.00 O ATOM 909 OE2 GLU A 58 2.347 -31.538 -7.009 1.00 0.00 O ATOM 0 H GLU A 58 -2.772 -31.161 -6.232 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.157 -33.544 -7.788 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.993 -32.131 -5.383 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.518 -33.778 -5.749 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.019 -32.905 -8.127 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.109 -31.300 -7.435 1.00 0.00 H new ATOM 916 N VAL A 59 -3.806 -33.612 -4.973 1.00 0.00 N ATOM 917 CA VAL A 59 -4.583 -34.462 -4.078 1.00 0.00 C ATOM 918 C VAL A 59 -6.016 -34.618 -4.574 1.00 0.00 C ATOM 919 O VAL A 59 -6.706 -35.574 -4.222 1.00 0.00 O ATOM 920 CB VAL A 59 -4.606 -33.897 -2.646 1.00 0.00 C ATOM 921 CG1 VAL A 59 -5.458 -34.773 -1.739 1.00 0.00 C ATOM 922 CG2 VAL A 59 -3.191 -33.769 -2.101 1.00 0.00 C ATOM 0 H VAL A 59 -3.909 -32.612 -4.800 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.097 -35.438 -4.068 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.052 -32.903 -2.674 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -5.462 -34.358 -0.731 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.478 -34.808 -2.121 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.045 -35.781 -1.714 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.226 -33.368 -1.088 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.716 -34.750 -2.087 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.615 -33.097 -2.737 1.00 0.00 H new ATOM 932 N MET A 60 -6.458 -33.671 -5.395 1.00 0.00 N ATOM 933 CA MET A 60 -7.810 -33.703 -5.942 1.00 0.00 C ATOM 934 C MET A 60 -8.127 -35.076 -6.526 1.00 0.00 C ATOM 935 O MET A 60 -9.273 -35.522 -6.498 1.00 0.00 O ATOM 936 CB MET A 60 -7.974 -32.628 -7.018 1.00 0.00 C ATOM 937 CG MET A 60 -8.938 -31.520 -6.627 1.00 0.00 C ATOM 938 SD MET A 60 -8.762 -30.051 -7.658 1.00 0.00 S ATOM 939 CE MET A 60 -9.030 -30.747 -9.287 1.00 0.00 C ATOM 0 H MET A 60 -5.900 -32.872 -5.696 1.00 0.00 H new ATOM 0 HA MET A 60 -8.509 -33.503 -5.130 1.00 0.00 H new ATOM 0 HB2 MET A 60 -6.999 -32.191 -7.235 1.00 0.00 H new ATOM 0 HB3 MET A 60 -8.325 -33.096 -7.938 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.960 -31.890 -6.701 1.00 0.00 H new ATOM 0 HG3 MET A 60 -8.771 -31.250 -5.584 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.147 -29.942 -10.012 1.00 0.00 H new ATOM 0 HE2 MET A 60 -8.175 -31.363 -9.565 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.931 -31.360 -9.277 1.00 0.00 H new ATOM 949 N GLN A 61 -7.104 -35.740 -7.055 1.00 0.00 N ATOM 950 CA GLN A 61 -7.275 -37.062 -7.646 1.00 0.00 C ATOM 951 C GLN A 61 -6.961 -38.157 -6.632 1.00 0.00 C ATOM 952 O GLN A 61 -6.352 -39.173 -6.969 1.00 0.00 O ATOM 953 CB GLN A 61 -6.376 -37.215 -8.874 1.00 0.00 C ATOM 954 CG GLN A 61 -4.913 -36.907 -8.599 1.00 0.00 C ATOM 955 CD GLN A 61 -4.005 -37.323 -9.740 1.00 0.00 C ATOM 956 OE1 GLN A 61 -3.701 -38.505 -9.907 1.00 0.00 O ATOM 957 NE2 GLN A 61 -3.566 -36.352 -10.532 1.00 0.00 N ATOM 0 H GLN A 61 -6.149 -35.384 -7.086 1.00 0.00 H new ATOM 0 HA GLN A 61 -8.316 -37.163 -7.952 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -6.460 -38.235 -9.250 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -6.736 -36.554 -9.662 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -4.798 -35.838 -8.419 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -4.603 -37.418 -7.688 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -3.843 -35.386 -10.357 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -2.951 -36.572 -11.316 1.00 0.00 H new ATOM 966 N ARG A 62 -7.380 -37.943 -5.389 1.00 0.00 N ATOM 967 CA ARG A 62 -7.142 -38.912 -4.325 1.00 0.00 C ATOM 968 C ARG A 62 -8.446 -39.283 -3.626 1.00 0.00 C ATOM 969 O ARG A 62 -9.356 -38.466 -3.483 1.00 0.00 O ATOM 970 CB ARG A 62 -6.147 -38.349 -3.308 1.00 0.00 C ATOM 971 CG ARG A 62 -4.775 -38.061 -3.893 1.00 0.00 C ATOM 972 CD ARG A 62 -3.762 -37.736 -2.806 1.00 0.00 C ATOM 973 NE ARG A 62 -2.388 -37.907 -3.269 1.00 0.00 N ATOM 974 CZ ARG A 62 -1.325 -37.503 -2.582 1.00 0.00 C ATOM 975 NH1 ARG A 62 -1.478 -36.910 -1.406 1.00 0.00 N ATOM 976 NH2 ARG A 62 -0.106 -37.694 -3.070 1.00 0.00 N ATOM 0 H ARG A 62 -7.886 -37.108 -5.094 1.00 0.00 H new ATOM 0 HA ARG A 62 -6.722 -39.812 -4.774 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.553 -37.430 -2.886 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -6.041 -39.057 -2.486 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -4.433 -38.924 -4.464 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -4.843 -37.225 -4.589 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -3.906 -36.709 -2.471 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -3.937 -38.380 -1.944 1.00 0.00 H new ATOM 0 HE ARG A 62 -2.236 -38.362 -4.169 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -2.413 -36.763 -1.027 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.660 -36.601 -0.881 1.00 0.00 H new ATOM 0 HH21 ARG A 62 0.016 -38.151 -3.974 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.709 -37.383 -2.542 1.00 0.00 H new ATOM 990 N PRO A 63 -8.541 -40.544 -3.180 1.00 0.00 N ATOM 991 CA PRO A 63 -9.729 -41.053 -2.489 1.00 0.00 C ATOM 992 C PRO A 63 -9.896 -40.446 -1.100 1.00 0.00 C ATOM 993 O PRO A 63 -8.916 -40.073 -0.454 1.00 0.00 O ATOM 994 CB PRO A 63 -9.464 -42.557 -2.387 1.00 0.00 C ATOM 995 CG PRO A 63 -7.980 -42.684 -2.429 1.00 0.00 C ATOM 996 CD PRO A 63 -7.495 -41.572 -3.317 1.00 0.00 C ATOM 0 HA PRO A 63 -10.647 -40.804 -3.021 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -9.871 -42.969 -1.463 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -9.931 -43.098 -3.210 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.553 -42.600 -1.430 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -7.682 -43.656 -2.823 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.521 -41.199 -2.999 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.388 -41.901 -4.351 1.00 0.00 H new ATOM 1004 N CYS A 64 -11.141 -40.350 -0.647 1.00 0.00 N ATOM 1005 CA CYS A 64 -11.435 -39.788 0.666 1.00 0.00 C ATOM 1006 C CYS A 64 -11.245 -40.833 1.761 1.00 0.00 C ATOM 1007 O CYS A 64 -11.542 -40.586 2.930 1.00 0.00 O ATOM 1008 CB CYS A 64 -12.865 -39.247 0.704 1.00 0.00 C ATOM 1009 SG CYS A 64 -12.975 -37.444 0.626 1.00 0.00 S ATOM 0 H CYS A 64 -11.963 -40.654 -1.169 1.00 0.00 H new ATOM 0 HA CYS A 64 -10.739 -38.969 0.846 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -13.425 -39.671 -0.130 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.348 -39.590 1.619 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.917 -36.921 1.171 1.00 0.00 H new ATOM 1015 N THR A 65 -10.749 -42.004 1.373 1.00 0.00 N ATOM 1016 CA THR A 65 -10.522 -43.089 2.320 1.00 0.00 C ATOM 1017 C THR A 65 -9.155 -42.963 2.982 1.00 0.00 C ATOM 1018 O THR A 65 -8.785 -43.781 3.825 1.00 0.00 O ATOM 1019 CB THR A 65 -10.622 -44.464 1.633 1.00 0.00 C ATOM 1020 OG1 THR A 65 -11.741 -44.485 0.740 1.00 0.00 O ATOM 1021 CG2 THR A 65 -10.768 -45.574 2.663 1.00 0.00 C ATOM 0 H THR A 65 -10.497 -42.225 0.410 1.00 0.00 H new ATOM 0 HA THR A 65 -11.300 -43.013 3.080 1.00 0.00 H new ATOM 0 HB THR A 65 -9.704 -44.632 1.069 1.00 0.00 H new ATOM 0 HG1 THR A 65 -11.797 -45.362 0.306 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.837 -46.536 2.154 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.901 -45.574 3.323 1.00 0.00 H new ATOM 0 HG23 THR A 65 -11.671 -45.409 3.250 1.00 0.00 H new ATOM 1029 N CYS A 66 -8.408 -41.934 2.597 1.00 0.00 N ATOM 1030 CA CYS A 66 -7.081 -41.701 3.154 1.00 0.00 C ATOM 1031 C CYS A 66 -6.139 -42.852 2.816 1.00 0.00 C ATOM 1032 O CYS A 66 -5.139 -43.071 3.499 1.00 0.00 O ATOM 1033 CB CYS A 66 -7.165 -41.524 4.671 1.00 0.00 C ATOM 1034 SG CYS A 66 -8.617 -40.600 5.227 1.00 0.00 S ATOM 0 H CYS A 66 -8.699 -41.248 1.901 1.00 0.00 H new ATOM 0 HA CYS A 66 -6.684 -40.788 2.710 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -7.172 -42.507 5.141 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -6.267 -41.012 5.017 1.00 0.00 H new ATOM 0 HG CYS A 66 -8.427 -40.184 6.444 1.00 0.00 H new ATOM 1040 N ASP A 67 -6.468 -43.587 1.759 1.00 0.00 N ATOM 1041 CA ASP A 67 -5.652 -44.717 1.330 1.00 0.00 C ATOM 1042 C ASP A 67 -4.209 -44.286 1.092 1.00 0.00 C ATOM 1043 O ASP A 67 -3.270 -44.971 1.499 1.00 0.00 O ATOM 1044 CB ASP A 67 -6.230 -45.336 0.056 1.00 0.00 C ATOM 1045 CG ASP A 67 -5.420 -46.522 -0.430 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -4.396 -46.302 -1.109 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -5.811 -47.670 -0.132 1.00 0.00 O ATOM 0 H ASP A 67 -7.294 -43.421 1.184 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.662 -45.463 2.124 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.256 -45.652 0.242 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.267 -44.579 -0.728 1.00 0.00 H new ATOM 1052 N PHE A 68 -4.039 -43.147 0.428 1.00 0.00 N ATOM 1053 CA PHE A 68 -2.709 -42.625 0.133 1.00 0.00 C ATOM 1054 C PHE A 68 -2.003 -42.183 1.411 1.00 0.00 C ATOM 1055 O PHE A 68 -0.816 -41.854 1.396 1.00 0.00 O ATOM 1056 CB PHE A 68 -2.804 -41.451 -0.843 1.00 0.00 C ATOM 1057 CG PHE A 68 -2.454 -41.818 -2.257 1.00 0.00 C ATOM 1058 CD1 PHE A 68 -2.946 -42.980 -2.828 1.00 0.00 C ATOM 1059 CD2 PHE A 68 -1.632 -40.999 -3.015 1.00 0.00 C ATOM 1060 CE1 PHE A 68 -2.625 -43.320 -4.129 1.00 0.00 C ATOM 1061 CE2 PHE A 68 -1.308 -41.334 -4.317 1.00 0.00 C ATOM 1062 CZ PHE A 68 -1.805 -42.496 -4.874 1.00 0.00 C ATOM 0 H PHE A 68 -4.805 -42.568 0.084 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.126 -43.423 -0.326 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.818 -41.051 -0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.139 -40.655 -0.507 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.588 -43.628 -2.250 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -1.240 -40.089 -2.584 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -3.015 -44.229 -4.562 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.667 -40.687 -4.898 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.553 -42.760 -5.890 1.00 0.00 H new ATOM 1072 N LEU A 69 -2.741 -42.177 2.516 1.00 0.00 N ATOM 1073 CA LEU A 69 -2.186 -41.774 3.804 1.00 0.00 C ATOM 1074 C LEU A 69 -1.998 -42.981 4.717 1.00 0.00 C ATOM 1075 O LEU A 69 -1.423 -42.870 5.800 1.00 0.00 O ATOM 1076 CB LEU A 69 -3.101 -40.749 4.477 1.00 0.00 C ATOM 1077 CG LEU A 69 -3.260 -39.413 3.751 1.00 0.00 C ATOM 1078 CD1 LEU A 69 -4.682 -39.250 3.237 1.00 0.00 C ATOM 1079 CD2 LEU A 69 -2.888 -38.259 4.670 1.00 0.00 C ATOM 0 H LEU A 69 -3.724 -42.446 2.546 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.211 -41.321 3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.088 -41.195 4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.718 -40.552 5.478 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.584 -39.404 2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.776 -38.293 2.723 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.913 -40.059 2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.378 -39.281 4.075 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -3.007 -37.316 4.136 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -3.539 -38.266 5.544 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.851 -38.367 4.988 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.484 -44.135 4.271 1.00 0.00 N ATOM 1092 CA HIS A 70 -2.367 -45.365 5.047 1.00 0.00 C ATOM 1093 C HIS A 70 -1.085 -46.112 4.691 1.00 0.00 C ATOM 1094 O HIS A 70 -0.617 -46.054 3.555 1.00 0.00 O ATOM 1095 CB HIS A 70 -3.580 -46.264 4.804 1.00 0.00 C ATOM 1096 CG HIS A 70 -3.402 -47.660 5.316 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -3.954 -48.104 6.499 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -2.730 -48.715 4.797 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -3.628 -49.371 6.686 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -2.886 -49.765 5.667 1.00 0.00 N ATOM 0 H HIS A 70 -2.962 -44.244 3.377 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.329 -45.097 6.103 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.453 -45.819 5.281 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.786 -46.301 3.734 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -2.175 -48.728 3.871 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.919 -49.981 7.529 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -2.493 -50.698 5.546 1.00 0.00 H new ATOM 1108 N GLY A 71 -0.523 -46.813 5.670 1.00 0.00 N ATOM 1109 CA GLY A 71 0.700 -47.561 5.440 1.00 0.00 C ATOM 1110 C GLY A 71 0.626 -48.975 5.981 1.00 0.00 C ATOM 1111 O GLY A 71 -0.365 -49.377 6.592 1.00 0.00 O ATOM 0 H GLY A 71 -0.892 -46.877 6.619 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.905 -47.595 4.370 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.535 -47.039 5.908 1.00 0.00 H new ATOM 1115 N PRO A 72 1.693 -49.755 5.757 1.00 0.00 N ATOM 1116 CA PRO A 72 1.769 -51.145 6.218 1.00 0.00 C ATOM 1117 C PRO A 72 1.891 -51.246 7.735 1.00 0.00 C ATOM 1118 O PRO A 72 1.951 -52.343 8.290 1.00 0.00 O ATOM 1119 CB PRO A 72 3.037 -51.674 5.543 1.00 0.00 C ATOM 1120 CG PRO A 72 3.872 -50.464 5.305 1.00 0.00 C ATOM 1121 CD PRO A 72 2.909 -49.341 5.036 1.00 0.00 C ATOM 0 HA PRO A 72 0.870 -51.708 5.967 1.00 0.00 H new ATOM 0 HB2 PRO A 72 3.554 -52.393 6.179 1.00 0.00 H new ATOM 0 HB3 PRO A 72 2.804 -52.185 4.609 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.496 -50.244 6.172 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.543 -50.613 4.459 1.00 0.00 H new ATOM 0 HD2 PRO A 72 3.290 -48.388 5.404 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.722 -49.219 3.969 1.00 0.00 H new ATOM 1129 N ARG A 73 1.926 -50.096 8.399 1.00 0.00 N ATOM 1130 CA ARG A 73 2.042 -50.056 9.852 1.00 0.00 C ATOM 1131 C ARG A 73 0.805 -49.420 10.479 1.00 0.00 C ATOM 1132 O ARG A 73 0.613 -49.473 11.694 1.00 0.00 O ATOM 1133 CB ARG A 73 3.293 -49.278 10.264 1.00 0.00 C ATOM 1134 CG ARG A 73 4.206 -50.048 11.205 1.00 0.00 C ATOM 1135 CD ARG A 73 5.560 -49.370 11.344 1.00 0.00 C ATOM 1136 NE ARG A 73 6.545 -49.919 10.416 1.00 0.00 N ATOM 1137 CZ ARG A 73 7.851 -49.690 10.510 1.00 0.00 C ATOM 1138 NH1 ARG A 73 8.325 -48.927 11.485 1.00 0.00 N ATOM 1139 NH2 ARG A 73 8.684 -50.226 9.627 1.00 0.00 N ATOM 0 H ARG A 73 1.876 -49.179 7.954 1.00 0.00 H new ATOM 0 HA ARG A 73 2.125 -51.081 10.213 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.853 -49.007 9.369 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.990 -48.348 10.745 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.736 -50.129 12.185 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.342 -51.063 10.832 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.450 -48.300 11.165 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.921 -49.487 12.366 1.00 0.00 H new ATOM 0 HE ARG A 73 6.213 -50.510 9.654 1.00 0.00 H new ATOM 0 HH11 ARG A 73 7.687 -48.514 12.165 1.00 0.00 H new ATOM 0 HH12 ARG A 73 9.328 -48.753 11.555 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.322 -50.814 8.876 1.00 0.00 H new ATOM 0 HH22 ARG A 73 9.686 -50.050 9.699 1.00 0.00 H new ATOM 1153 N THR A 74 -0.033 -48.817 9.641 1.00 0.00 N ATOM 1154 CA THR A 74 -1.251 -48.168 10.112 1.00 0.00 C ATOM 1155 C THR A 74 -2.229 -49.187 10.687 1.00 0.00 C ATOM 1156 O THR A 74 -2.328 -50.310 10.195 1.00 0.00 O ATOM 1157 CB THR A 74 -1.946 -47.388 8.981 1.00 0.00 C ATOM 1158 OG1 THR A 74 -1.127 -46.288 8.569 1.00 0.00 O ATOM 1159 CG2 THR A 74 -3.304 -46.874 9.433 1.00 0.00 C ATOM 0 H THR A 74 0.110 -48.765 8.632 1.00 0.00 H new ATOM 0 HA THR A 74 -0.955 -47.470 10.895 1.00 0.00 H new ATOM 0 HB THR A 74 -2.093 -48.066 8.140 1.00 0.00 H new ATOM 0 HG1 THR A 74 -1.678 -45.627 8.100 1.00 0.00 H new ATOM 0 HG21 THR A 74 -3.776 -46.326 8.617 1.00 0.00 H new ATOM 0 HG22 THR A 74 -3.935 -47.716 9.718 1.00 0.00 H new ATOM 0 HG23 THR A 74 -3.176 -46.211 10.289 1.00 0.00 H new ATOM 1167 N GLN A 75 -2.948 -48.786 11.730 1.00 0.00 N ATOM 1168 CA GLN A 75 -3.919 -49.665 12.371 1.00 0.00 C ATOM 1169 C GLN A 75 -5.008 -50.082 11.389 1.00 0.00 C ATOM 1170 O GLN A 75 -5.457 -49.281 10.569 1.00 0.00 O ATOM 1171 CB GLN A 75 -4.545 -48.971 13.582 1.00 0.00 C ATOM 1172 CG GLN A 75 -3.557 -48.692 14.703 1.00 0.00 C ATOM 1173 CD GLN A 75 -2.646 -49.871 14.984 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -2.985 -50.761 15.765 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -1.481 -49.884 14.347 1.00 0.00 N ATOM 0 H GLN A 75 -2.877 -47.859 12.149 1.00 0.00 H new ATOM 0 HA GLN A 75 -3.395 -50.561 12.705 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -4.991 -48.030 13.260 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.354 -49.592 13.968 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -2.952 -47.824 14.441 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.105 -48.437 15.610 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -1.240 -49.126 13.708 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.827 -50.652 14.496 1.00 0.00 H new ATOM 1184 N ARG A 76 -5.429 -51.339 11.477 1.00 0.00 N ATOM 1185 CA ARG A 76 -6.464 -51.863 10.595 1.00 0.00 C ATOM 1186 C ARG A 76 -7.840 -51.344 11.004 1.00 0.00 C ATOM 1187 O ARG A 76 -8.690 -51.074 10.155 1.00 0.00 O ATOM 1188 CB ARG A 76 -6.457 -53.392 10.616 1.00 0.00 C ATOM 1189 CG ARG A 76 -7.124 -54.021 9.404 1.00 0.00 C ATOM 1190 CD ARG A 76 -7.450 -55.487 9.645 1.00 0.00 C ATOM 1191 NE ARG A 76 -6.259 -56.265 9.976 1.00 0.00 N ATOM 1192 CZ ARG A 76 -6.288 -57.554 10.294 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -7.441 -58.207 10.324 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -5.161 -58.193 10.583 1.00 0.00 N ATOM 0 H ARG A 76 -5.069 -52.014 12.151 1.00 0.00 H new ATOM 0 HA ARG A 76 -6.251 -51.520 9.583 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -5.426 -53.741 10.675 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.962 -53.737 11.518 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.039 -53.478 9.168 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.468 -53.931 8.538 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.174 -55.569 10.456 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.920 -55.905 8.755 1.00 0.00 H new ATOM 0 HE ARG A 76 -5.355 -55.792 9.962 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.309 -57.719 10.102 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -7.460 -59.197 10.569 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -4.272 -57.694 10.561 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -5.184 -59.183 10.827 1.00 0.00 H new ATOM 1208 N ARG A 77 -8.051 -51.208 12.308 1.00 0.00 N ATOM 1209 CA ARG A 77 -9.324 -50.723 12.830 1.00 0.00 C ATOM 1210 C ARG A 77 -9.780 -49.477 12.077 1.00 0.00 C ATOM 1211 O ARG A 77 -10.972 -49.286 11.837 1.00 0.00 O ATOM 1212 CB ARG A 77 -9.204 -50.415 14.323 1.00 0.00 C ATOM 1213 CG ARG A 77 -10.361 -50.949 15.151 1.00 0.00 C ATOM 1214 CD ARG A 77 -10.449 -50.254 16.500 1.00 0.00 C ATOM 1215 NE ARG A 77 -11.720 -49.556 16.674 1.00 0.00 N ATOM 1216 CZ ARG A 77 -12.867 -50.173 16.936 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -12.902 -51.493 17.053 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -13.983 -49.468 17.081 1.00 0.00 N ATOM 0 H ARG A 77 -7.358 -51.427 13.023 1.00 0.00 H new ATOM 0 HA ARG A 77 -10.069 -51.506 12.687 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.273 -50.840 14.699 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -9.140 -49.335 14.458 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -11.295 -50.808 14.607 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -10.238 -52.022 15.301 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -10.327 -50.989 17.295 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -9.629 -49.543 16.596 1.00 0.00 H new ATOM 0 HE ARG A 77 -11.727 -48.540 16.590 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -12.047 -52.038 16.942 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -13.784 -51.964 17.254 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -13.960 -48.452 16.991 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -14.863 -49.942 17.282 1.00 0.00 H new ATOM 1232 N ALA A 78 -8.824 -48.631 11.709 1.00 0.00 N ATOM 1233 CA ALA A 78 -9.127 -47.404 10.983 1.00 0.00 C ATOM 1234 C ALA A 78 -9.759 -47.709 9.629 1.00 0.00 C ATOM 1235 O ALA A 78 -10.822 -47.186 9.298 1.00 0.00 O ATOM 1236 CB ALA A 78 -7.866 -46.571 10.804 1.00 0.00 C ATOM 0 H ALA A 78 -7.832 -48.773 11.902 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.846 -46.832 11.570 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.107 -45.658 10.260 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.458 -46.314 11.781 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.128 -47.144 10.242 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.096 -48.557 8.850 1.00 0.00 N ATOM 1243 CA ALA A 79 -9.594 -48.933 7.533 1.00 0.00 C ATOM 1244 C ALA A 79 -11.008 -49.495 7.620 1.00 0.00 C ATOM 1245 O ALA A 79 -11.818 -49.306 6.712 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.660 -49.945 6.885 1.00 0.00 C ATOM 0 H ALA A 79 -8.213 -48.997 9.108 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.626 -48.036 6.914 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -9.044 -50.217 5.902 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.667 -49.508 6.779 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.599 -50.836 7.510 1.00 0.00 H new ATOM 1252 N ALA A 80 -11.299 -50.186 8.717 1.00 0.00 N ATOM 1253 CA ALA A 80 -12.617 -50.774 8.923 1.00 0.00 C ATOM 1254 C ALA A 80 -13.669 -49.695 9.156 1.00 0.00 C ATOM 1255 O ALA A 80 -14.697 -49.663 8.480 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.585 -51.745 10.094 1.00 0.00 C ATOM 0 H ALA A 80 -10.640 -50.352 9.477 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.889 -51.321 8.020 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.576 -52.176 10.236 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -11.869 -52.541 9.888 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.287 -51.215 10.998 1.00 0.00 H new ATOM 1262 N GLN A 81 -13.405 -48.815 10.116 1.00 0.00 N ATOM 1263 CA GLN A 81 -14.331 -47.736 10.438 1.00 0.00 C ATOM 1264 C GLN A 81 -14.672 -46.921 9.195 1.00 0.00 C ATOM 1265 O GLN A 81 -15.837 -46.610 8.945 1.00 0.00 O ATOM 1266 CB GLN A 81 -13.732 -46.825 11.511 1.00 0.00 C ATOM 1267 CG GLN A 81 -13.322 -47.562 12.776 1.00 0.00 C ATOM 1268 CD GLN A 81 -12.207 -46.860 13.525 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -11.048 -47.274 13.468 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -12.550 -45.790 14.232 1.00 0.00 N ATOM 0 H GLN A 81 -12.558 -48.828 10.684 1.00 0.00 H new ATOM 0 HA GLN A 81 -15.249 -48.182 10.820 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -12.861 -46.316 11.099 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -14.459 -46.055 11.769 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -14.188 -47.662 13.431 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.001 -48.571 12.516 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -13.522 -45.482 14.251 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -11.841 -45.276 14.756 1.00 0.00 H new ATOM 1279 N ILE A 82 -13.649 -46.579 8.419 1.00 0.00 N ATOM 1280 CA ILE A 82 -13.841 -45.802 7.201 1.00 0.00 C ATOM 1281 C ILE A 82 -14.634 -46.590 6.165 1.00 0.00 C ATOM 1282 O ILE A 82 -15.517 -46.048 5.501 1.00 0.00 O ATOM 1283 CB ILE A 82 -12.494 -45.377 6.586 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -11.869 -44.246 7.405 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -12.684 -44.948 5.139 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -12.551 -42.910 7.210 1.00 0.00 C ATOM 0 H ILE A 82 -12.679 -46.828 8.612 1.00 0.00 H new ATOM 0 HA ILE A 82 -14.401 -44.910 7.481 1.00 0.00 H new ATOM 0 HB ILE A 82 -11.817 -46.231 6.605 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -11.904 -44.512 8.462 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -10.817 -44.151 7.135 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -11.723 -44.651 4.719 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -13.090 -45.780 4.563 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -13.375 -44.106 5.097 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -12.055 -42.156 7.821 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.494 -42.622 6.160 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -13.597 -42.988 7.508 1.00 0.00 H new ATOM 1298 N ALA A 83 -14.313 -47.873 6.033 1.00 0.00 N ATOM 1299 CA ALA A 83 -14.998 -48.737 5.080 1.00 0.00 C ATOM 1300 C ALA A 83 -16.476 -48.879 5.430 1.00 0.00 C ATOM 1301 O ALA A 83 -17.344 -48.702 4.577 1.00 0.00 O ATOM 1302 CB ALA A 83 -14.332 -50.104 5.033 1.00 0.00 C ATOM 0 H ALA A 83 -13.583 -48.337 6.574 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.927 -48.276 4.095 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -14.854 -50.739 4.317 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -13.292 -49.992 4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -14.372 -50.562 6.021 1.00 0.00 H new ATOM 1308 N GLN A 84 -16.752 -49.199 6.690 1.00 0.00 N ATOM 1309 CA GLN A 84 -18.125 -49.365 7.152 1.00 0.00 C ATOM 1310 C GLN A 84 -18.867 -48.032 7.146 1.00 0.00 C ATOM 1311 O GLN A 84 -20.041 -47.966 6.782 1.00 0.00 O ATOM 1312 CB GLN A 84 -18.143 -49.965 8.559 1.00 0.00 C ATOM 1313 CG GLN A 84 -19.520 -49.962 9.204 1.00 0.00 C ATOM 1314 CD GLN A 84 -20.493 -50.893 8.507 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -21.108 -50.411 7.434 1.00 0.00 O flip ATOM 1316 NE2 GLN A 84 -20.689 -52.033 8.929 1.00 0.00 N flip ATOM 0 H GLN A 84 -16.044 -49.348 7.409 1.00 0.00 H new ATOM 0 HA GLN A 84 -18.632 -50.045 6.468 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -17.775 -50.990 8.513 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -17.453 -49.407 9.192 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -19.428 -50.256 10.250 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -19.921 -48.948 9.192 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -20.194 -52.362 9.758 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -21.346 -52.648 8.450 1.00 0.00 H new ATOM 1325 N ALA A 85 -18.174 -46.973 7.550 1.00 0.00 N ATOM 1326 CA ALA A 85 -18.766 -45.642 7.589 1.00 0.00 C ATOM 1327 C ALA A 85 -19.076 -45.137 6.183 1.00 0.00 C ATOM 1328 O ALA A 85 -20.018 -44.371 5.981 1.00 0.00 O ATOM 1329 CB ALA A 85 -17.840 -44.672 8.308 1.00 0.00 C ATOM 0 H ALA A 85 -17.201 -47.011 7.855 1.00 0.00 H new ATOM 0 HA ALA A 85 -19.705 -45.706 8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -18.296 -43.682 8.329 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -17.673 -45.017 9.329 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -16.887 -44.621 7.782 1.00 0.00 H new ATOM 1335 N LEU A 86 -18.276 -45.571 5.215 1.00 0.00 N ATOM 1336 CA LEU A 86 -18.464 -45.163 3.827 1.00 0.00 C ATOM 1337 C LEU A 86 -19.591 -45.957 3.174 1.00 0.00 C ATOM 1338 O LEU A 86 -20.373 -45.416 2.391 1.00 0.00 O ATOM 1339 CB LEU A 86 -17.167 -45.352 3.039 1.00 0.00 C ATOM 1340 CG LEU A 86 -17.094 -44.643 1.686 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -15.936 -43.657 1.662 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -16.958 -45.657 0.559 1.00 0.00 C ATOM 0 H LEU A 86 -17.491 -46.205 5.366 1.00 0.00 H new ATOM 0 HA LEU A 86 -18.736 -44.108 3.818 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -16.338 -45.004 3.654 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -17.017 -46.419 2.876 1.00 0.00 H new ATOM 0 HG LEU A 86 -18.020 -44.088 1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.900 -43.162 0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -16.077 -42.911 2.445 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -15.001 -44.190 1.833 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -16.908 -45.135 -0.396 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -16.048 -46.240 0.702 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -17.821 -46.323 0.563 1.00 0.00 H new ATOM 1354 N LEU A 87 -19.669 -47.242 3.502 1.00 0.00 N ATOM 1355 CA LEU A 87 -20.701 -48.111 2.948 1.00 0.00 C ATOM 1356 C LEU A 87 -22.093 -47.579 3.274 1.00 0.00 C ATOM 1357 O LEU A 87 -23.023 -47.716 2.480 1.00 0.00 O ATOM 1358 CB LEU A 87 -20.546 -49.532 3.494 1.00 0.00 C ATOM 1359 CG LEU A 87 -21.738 -50.466 3.284 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -21.266 -51.896 3.073 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -22.692 -50.387 4.467 1.00 0.00 C ATOM 0 H LEU A 87 -19.030 -47.705 4.149 1.00 0.00 H new ATOM 0 HA LEU A 87 -20.583 -48.129 1.865 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -19.670 -49.984 3.030 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -20.344 -49.469 4.563 1.00 0.00 H new ATOM 0 HG LEU A 87 -22.272 -50.146 2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -22.129 -52.546 2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -20.623 -51.941 2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -20.708 -52.228 3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -23.535 -51.058 4.300 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -22.168 -50.681 5.377 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -23.057 -49.365 4.572 1.00 0.00 H new ATOM 1373 N GLY A 88 -22.228 -46.968 4.448 1.00 0.00 N ATOM 1374 CA GLY A 88 -23.509 -46.423 4.857 1.00 0.00 C ATOM 1375 C GLY A 88 -23.549 -44.910 4.771 1.00 0.00 C ATOM 1376 O GLY A 88 -24.621 -44.307 4.817 1.00 0.00 O ATOM 0 H GLY A 88 -21.473 -46.841 5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -24.295 -46.841 4.228 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -23.722 -46.731 5.881 1.00 0.00 H new ATOM 1380 N ALA A 89 -22.377 -44.295 4.647 1.00 0.00 N ATOM 1381 CA ALA A 89 -22.282 -42.843 4.554 1.00 0.00 C ATOM 1382 C ALA A 89 -22.996 -42.171 5.722 1.00 0.00 C ATOM 1383 O ALA A 89 -23.707 -41.183 5.541 1.00 0.00 O ATOM 1384 CB ALA A 89 -22.859 -42.360 3.232 1.00 0.00 C ATOM 0 H ALA A 89 -21.480 -44.780 4.609 1.00 0.00 H new ATOM 0 HA ALA A 89 -21.228 -42.569 4.599 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -22.781 -41.274 3.176 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -22.303 -42.806 2.408 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -23.907 -42.653 3.164 1.00 0.00 H new ATOM 1390 N GLU A 90 -22.801 -42.713 6.920 1.00 0.00 N ATOM 1391 CA GLU A 90 -23.428 -42.165 8.117 1.00 0.00 C ATOM 1392 C GLU A 90 -22.407 -41.425 8.976 1.00 0.00 C ATOM 1393 O GLU A 90 -21.204 -41.657 8.865 1.00 0.00 O ATOM 1394 CB GLU A 90 -24.084 -43.282 8.933 1.00 0.00 C ATOM 1395 CG GLU A 90 -24.797 -42.786 10.180 1.00 0.00 C ATOM 1396 CD GLU A 90 -25.529 -43.893 10.913 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -25.445 -45.057 10.467 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -26.184 -43.596 11.933 1.00 0.00 O ATOM 0 H GLU A 90 -22.214 -43.530 7.087 1.00 0.00 H new ATOM 0 HA GLU A 90 -24.194 -41.456 7.803 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -24.799 -43.810 8.302 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -23.321 -44.004 9.224 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -24.070 -42.329 10.852 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -25.508 -42.008 9.902 1.00 0.00 H new ATOM 1405 N GLU A 91 -22.897 -40.533 9.831 1.00 0.00 N ATOM 1406 CA GLU A 91 -22.027 -39.757 10.707 1.00 0.00 C ATOM 1407 C GLU A 91 -21.174 -40.675 11.578 1.00 0.00 C ATOM 1408 O GLU A 91 -21.656 -41.241 12.560 1.00 0.00 O ATOM 1409 CB GLU A 91 -22.857 -38.824 11.591 1.00 0.00 C ATOM 1410 CG GLU A 91 -23.937 -39.539 12.385 1.00 0.00 C ATOM 1411 CD GLU A 91 -25.308 -38.918 12.196 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -26.005 -39.301 11.233 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -25.683 -38.050 13.011 1.00 0.00 O ATOM 0 H GLU A 91 -23.891 -40.330 9.936 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.364 -39.159 10.081 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -22.192 -38.306 12.282 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -23.322 -38.063 10.965 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -23.972 -40.586 12.083 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -23.677 -39.521 13.443 1.00 0.00 H new ATOM 1420 N ARG A 92 -19.905 -40.818 11.211 1.00 0.00 N ATOM 1421 CA ARG A 92 -18.985 -41.668 11.957 1.00 0.00 C ATOM 1422 C ARG A 92 -17.561 -41.124 11.884 1.00 0.00 C ATOM 1423 O ARG A 92 -17.130 -40.620 10.846 1.00 0.00 O ATOM 1424 CB ARG A 92 -19.025 -43.098 11.415 1.00 0.00 C ATOM 1425 CG ARG A 92 -17.866 -43.960 11.886 1.00 0.00 C ATOM 1426 CD ARG A 92 -17.877 -44.131 13.397 1.00 0.00 C ATOM 1427 NE ARG A 92 -17.755 -45.532 13.791 1.00 0.00 N ATOM 1428 CZ ARG A 92 -18.772 -46.385 13.795 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -19.981 -45.983 13.427 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -18.582 -47.645 14.166 1.00 0.00 N ATOM 0 H ARG A 92 -19.490 -40.356 10.402 1.00 0.00 H new ATOM 0 HA ARG A 92 -19.300 -41.673 13.000 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -19.962 -43.566 11.718 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -19.023 -43.065 10.326 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -17.921 -44.938 11.408 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -16.924 -43.506 11.577 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -17.057 -43.560 13.832 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -18.802 -43.720 13.801 1.00 0.00 H new ATOM 0 HE ARG A 92 -16.838 -45.874 14.079 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -20.131 -45.016 13.140 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -20.760 -46.641 13.431 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -17.654 -47.959 14.449 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -19.364 -48.299 14.169 1.00 0.00 H new ATOM 1444 N LYS A 93 -16.836 -41.228 12.992 1.00 0.00 N ATOM 1445 CA LYS A 93 -15.460 -40.748 13.055 1.00 0.00 C ATOM 1446 C LYS A 93 -14.488 -41.907 13.246 1.00 0.00 C ATOM 1447 O LYS A 93 -14.843 -42.943 13.809 1.00 0.00 O ATOM 1448 CB LYS A 93 -15.301 -39.741 14.197 1.00 0.00 C ATOM 1449 CG LYS A 93 -15.107 -40.390 15.556 1.00 0.00 C ATOM 1450 CD LYS A 93 -15.638 -39.509 16.675 1.00 0.00 C ATOM 1451 CE LYS A 93 -14.815 -39.665 17.945 1.00 0.00 C ATOM 1452 NZ LYS A 93 -15.201 -38.668 18.982 1.00 0.00 N ATOM 0 H LYS A 93 -17.178 -41.641 13.860 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.230 -40.256 12.110 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -14.448 -39.097 13.986 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.183 -39.101 14.232 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -15.617 -41.353 15.577 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.047 -40.587 15.718 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -15.624 -38.467 16.357 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.677 -39.766 16.880 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -14.947 -40.672 18.342 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -13.757 -39.552 17.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -14.618 -38.807 19.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -15.051 -37.707 18.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -16.204 -38.792 19.227 1.00 0.00 H new ATOM 1466 N VAL A 94 -13.258 -41.726 12.774 1.00 0.00 N ATOM 1467 CA VAL A 94 -12.233 -42.756 12.896 1.00 0.00 C ATOM 1468 C VAL A 94 -10.855 -42.138 13.099 1.00 0.00 C ATOM 1469 O VAL A 94 -10.488 -41.179 12.421 1.00 0.00 O ATOM 1470 CB VAL A 94 -12.199 -43.663 11.651 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -12.210 -42.827 10.381 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -10.980 -44.573 11.689 1.00 0.00 C ATOM 0 H VAL A 94 -12.948 -40.876 12.304 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.490 -43.357 13.768 1.00 0.00 H new ATOM 0 HB VAL A 94 -13.092 -44.288 11.654 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.186 -43.485 9.512 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.116 -42.221 10.352 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -11.337 -42.175 10.367 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -10.971 -45.207 10.802 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -10.074 -43.967 11.711 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.020 -45.198 12.581 1.00 0.00 H new ATOM 1482 N GLU A 95 -10.095 -42.695 14.038 1.00 0.00 N ATOM 1483 CA GLU A 95 -8.756 -42.197 14.331 1.00 0.00 C ATOM 1484 C GLU A 95 -7.696 -43.052 13.643 1.00 0.00 C ATOM 1485 O GLU A 95 -7.632 -44.264 13.848 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.513 -42.181 15.841 1.00 0.00 C ATOM 1487 CG GLU A 95 -8.741 -43.527 16.509 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.538 -43.475 18.010 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.056 -42.437 18.509 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -8.863 -44.474 18.687 1.00 0.00 O ATOM 0 H GLU A 95 -10.384 -43.490 14.608 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.682 -41.179 13.948 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.489 -41.859 16.032 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.171 -41.442 16.298 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.754 -43.868 16.295 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.060 -44.262 16.079 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.867 -42.411 12.825 1.00 0.00 N ATOM 1498 CA ILE A 96 -5.809 -43.111 12.108 1.00 0.00 C ATOM 1499 C ILE A 96 -4.499 -42.332 12.161 1.00 0.00 C ATOM 1500 O ILE A 96 -4.470 -41.175 12.577 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.191 -43.351 10.635 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -7.711 -43.452 10.490 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.519 -44.611 10.111 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -8.385 -42.120 10.243 1.00 0.00 C ATOM 0 H ILE A 96 -6.908 -41.408 12.643 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.677 -44.073 12.603 1.00 0.00 H new ATOM 0 HB ILE A 96 -5.843 -42.505 10.043 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.945 -44.127 9.666 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.125 -43.897 11.395 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.799 -44.766 9.069 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.437 -44.503 10.184 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -5.839 -45.468 10.704 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.461 -42.268 10.151 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.182 -41.449 11.078 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.999 -41.682 9.323 1.00 0.00 H new ATOM 1516 N ALA A 97 -3.417 -42.975 11.735 1.00 0.00 N ATOM 1517 CA ALA A 97 -2.104 -42.342 11.731 1.00 0.00 C ATOM 1518 C ALA A 97 -1.641 -42.048 10.308 1.00 0.00 C ATOM 1519 O ALA A 97 -1.249 -42.955 9.573 1.00 0.00 O ATOM 1520 CB ALA A 97 -1.091 -43.223 12.447 1.00 0.00 C ATOM 0 H ALA A 97 -3.424 -43.934 11.388 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.183 -41.394 12.262 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.115 -42.738 12.436 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.408 -43.378 13.478 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.023 -44.186 11.940 1.00 0.00 H new ATOM 1526 N PHE A 98 -1.690 -40.777 9.925 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.277 -40.364 8.589 1.00 0.00 C ATOM 1528 C PHE A 98 -0.004 -39.525 8.648 1.00 0.00 C ATOM 1529 O PHE A 98 0.497 -39.212 9.728 1.00 0.00 O ATOM 1530 CB PHE A 98 -2.394 -39.569 7.909 1.00 0.00 C ATOM 1531 CG PHE A 98 -3.694 -40.316 7.822 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -3.709 -41.699 7.730 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -4.901 -39.636 7.832 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -4.903 -42.390 7.650 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -6.098 -40.322 7.752 1.00 0.00 C ATOM 1536 CZ PHE A 98 -6.100 -41.700 7.660 1.00 0.00 C ATOM 0 H PHE A 98 -2.012 -40.015 10.521 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.073 -41.262 8.006 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.554 -38.640 8.457 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -2.074 -39.295 6.904 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.776 -42.243 7.721 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -4.907 -38.558 7.903 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -4.901 -43.468 7.580 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.032 -39.780 7.761 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.035 -42.237 7.596 1.00 0.00 H new ATOM 1546 N TYR A 99 0.515 -39.166 7.479 1.00 0.00 N ATOM 1547 CA TYR A 99 1.732 -38.366 7.397 1.00 0.00 C ATOM 1548 C TYR A 99 1.404 -36.876 7.377 1.00 0.00 C ATOM 1549 O TYR A 99 0.237 -36.487 7.339 1.00 0.00 O ATOM 1550 CB TYR A 99 2.530 -38.741 6.147 1.00 0.00 C ATOM 1551 CG TYR A 99 2.145 -37.944 4.921 1.00 0.00 C ATOM 1552 CD1 TYR A 99 0.829 -37.910 4.475 1.00 0.00 C ATOM 1553 CD2 TYR A 99 3.097 -37.226 4.208 1.00 0.00 C ATOM 1554 CE1 TYR A 99 0.473 -37.184 3.355 1.00 0.00 C ATOM 1555 CE2 TYR A 99 2.749 -36.496 3.088 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.436 -36.478 2.665 1.00 0.00 C ATOM 1557 OH TYR A 99 1.086 -35.754 1.549 1.00 0.00 O ATOM 0 H TYR A 99 0.113 -39.416 6.576 1.00 0.00 H new ATOM 0 HA TYR A 99 2.335 -38.575 8.281 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.592 -38.595 6.346 1.00 0.00 H new ATOM 0 HB3 TYR A 99 2.388 -39.802 5.940 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.072 -38.461 5.013 1.00 0.00 H new ATOM 0 HD2 TYR A 99 4.126 -37.239 4.535 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -0.554 -37.169 3.021 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.501 -35.942 2.546 1.00 0.00 H new ATOM 0 HH TYR A 99 1.894 -35.503 1.055 1.00 0.00 H new ATOM 1567 N ARG A 100 2.443 -36.048 7.401 1.00 0.00 N ATOM 1568 CA ARG A 100 2.267 -34.601 7.386 1.00 0.00 C ATOM 1569 C ARG A 100 3.368 -33.928 6.572 1.00 0.00 C ATOM 1570 O ARG A 100 4.244 -34.595 6.021 1.00 0.00 O ATOM 1571 CB ARG A 100 2.265 -34.051 8.814 1.00 0.00 C ATOM 1572 CG ARG A 100 0.932 -34.211 9.527 1.00 0.00 C ATOM 1573 CD ARG A 100 0.453 -32.892 10.113 1.00 0.00 C ATOM 1574 NE ARG A 100 1.503 -32.218 10.873 1.00 0.00 N ATOM 1575 CZ ARG A 100 1.347 -31.029 11.445 1.00 0.00 C ATOM 1576 NH1 ARG A 100 0.191 -30.387 11.344 1.00 0.00 N ATOM 1577 NH2 ARG A 100 2.349 -30.480 12.120 1.00 0.00 N ATOM 0 H ARG A 100 3.415 -36.354 7.431 1.00 0.00 H new ATOM 0 HA ARG A 100 1.307 -34.382 6.918 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.039 -34.558 9.391 1.00 0.00 H new ATOM 0 HB3 ARG A 100 2.528 -32.994 8.787 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.187 -34.592 8.828 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.030 -34.950 10.322 1.00 0.00 H new ATOM 0 HD2 ARG A 100 0.112 -32.240 9.309 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -0.404 -33.073 10.761 1.00 0.00 H new ATOM 0 HE ARG A 100 2.404 -32.685 10.970 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -0.581 -30.806 10.826 1.00 0.00 H new ATOM 0 HH12 ARG A 100 0.074 -29.474 11.784 1.00 0.00 H new ATOM 0 HH21 ARG A 100 3.240 -30.971 12.200 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.229 -29.567 12.559 1.00 0.00 H new ATOM 1591 N LYS A 101 3.317 -32.602 6.500 1.00 0.00 N ATOM 1592 CA LYS A 101 4.309 -31.837 5.754 1.00 0.00 C ATOM 1593 C LYS A 101 5.718 -32.144 6.250 1.00 0.00 C ATOM 1594 O LYS A 101 6.671 -32.161 5.471 1.00 0.00 O ATOM 1595 CB LYS A 101 4.027 -30.338 5.880 1.00 0.00 C ATOM 1596 CG LYS A 101 2.557 -29.982 5.745 1.00 0.00 C ATOM 1597 CD LYS A 101 2.370 -28.618 5.101 1.00 0.00 C ATOM 1598 CE LYS A 101 2.652 -27.493 6.085 1.00 0.00 C ATOM 1599 NZ LYS A 101 4.103 -27.164 6.150 1.00 0.00 N ATOM 0 H LYS A 101 2.598 -32.035 6.950 1.00 0.00 H new ATOM 0 HA LYS A 101 4.241 -32.126 4.705 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.389 -29.989 6.847 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.593 -29.805 5.116 1.00 0.00 H new ATOM 0 HG2 LYS A 101 2.052 -30.740 5.147 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.088 -29.988 6.729 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.034 -28.526 4.242 1.00 0.00 H new ATOM 0 HD3 LYS A 101 1.350 -28.528 4.727 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.091 -26.605 5.792 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.300 -27.780 7.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 4.224 -26.197 6.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.583 -27.835 6.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.517 -27.230 5.198 1.00 0.00 H new ATOM 1613 N ASP A 102 5.843 -32.386 7.550 1.00 0.00 N ATOM 1614 CA ASP A 102 7.136 -32.695 8.150 1.00 0.00 C ATOM 1615 C ASP A 102 7.635 -34.061 7.690 1.00 0.00 C ATOM 1616 O ASP A 102 8.798 -34.409 7.893 1.00 0.00 O ATOM 1617 CB ASP A 102 7.035 -32.662 9.676 1.00 0.00 C ATOM 1618 CG ASP A 102 8.387 -32.493 10.341 1.00 0.00 C ATOM 1619 OD1 ASP A 102 8.940 -31.375 10.286 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.892 -33.480 10.917 1.00 0.00 O ATOM 0 H ASP A 102 5.065 -32.374 8.209 1.00 0.00 H new ATOM 0 HA ASP A 102 7.850 -31.939 7.825 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.380 -31.844 9.977 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.573 -33.585 10.027 1.00 0.00 H new ATOM 1625 N GLY A 103 6.747 -34.833 7.071 1.00 0.00 N ATOM 1626 CA GLY A 103 7.116 -36.153 6.594 1.00 0.00 C ATOM 1627 C GLY A 103 6.855 -37.236 7.622 1.00 0.00 C ATOM 1628 O GLY A 103 6.761 -38.415 7.282 1.00 0.00 O ATOM 0 H GLY A 103 5.779 -34.568 6.891 1.00 0.00 H new ATOM 0 HA2 GLY A 103 6.557 -36.377 5.685 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.173 -36.157 6.327 1.00 0.00 H new ATOM 1632 N SER A 104 6.739 -36.835 8.884 1.00 0.00 N ATOM 1633 CA SER A 104 6.492 -37.781 9.967 1.00 0.00 C ATOM 1634 C SER A 104 5.035 -38.231 9.973 1.00 0.00 C ATOM 1635 O SER A 104 4.198 -37.675 9.261 1.00 0.00 O ATOM 1636 CB SER A 104 6.849 -37.150 11.314 1.00 0.00 C ATOM 1637 OG SER A 104 7.062 -35.755 11.184 1.00 0.00 O ATOM 0 H SER A 104 6.812 -35.862 9.182 1.00 0.00 H new ATOM 0 HA SER A 104 7.123 -38.655 9.805 1.00 0.00 H new ATOM 0 HB2 SER A 104 6.047 -37.333 12.029 1.00 0.00 H new ATOM 0 HB3 SER A 104 7.746 -37.622 11.714 1.00 0.00 H new ATOM 0 HG SER A 104 6.427 -35.273 11.754 1.00 0.00 H new ATOM 1643 N CYS A 105 4.739 -39.243 10.782 1.00 0.00 N ATOM 1644 CA CYS A 105 3.382 -39.770 10.882 1.00 0.00 C ATOM 1645 C CYS A 105 2.743 -39.377 12.209 1.00 0.00 C ATOM 1646 O CYS A 105 3.308 -39.614 13.277 1.00 0.00 O ATOM 1647 CB CYS A 105 3.393 -41.292 10.738 1.00 0.00 C ATOM 1648 SG CYS A 105 1.897 -41.973 9.985 1.00 0.00 S ATOM 0 H CYS A 105 5.420 -39.715 11.378 1.00 0.00 H new ATOM 0 HA CYS A 105 2.790 -39.340 10.074 1.00 0.00 H new ATOM 0 HB2 CYS A 105 4.254 -41.583 10.137 1.00 0.00 H new ATOM 0 HB3 CYS A 105 3.526 -41.739 11.723 1.00 0.00 H new ATOM 0 HG CYS A 105 2.002 -43.266 9.904 1.00 0.00 H new ATOM 1654 N PHE A 106 1.561 -38.774 12.135 1.00 0.00 N ATOM 1655 CA PHE A 106 0.845 -38.345 13.331 1.00 0.00 C ATOM 1656 C PHE A 106 -0.568 -38.922 13.355 1.00 0.00 C ATOM 1657 O PHE A 106 -1.103 -39.327 12.323 1.00 0.00 O ATOM 1658 CB PHE A 106 0.785 -36.817 13.395 1.00 0.00 C ATOM 1659 CG PHE A 106 2.137 -36.163 13.371 1.00 0.00 C ATOM 1660 CD1 PHE A 106 3.218 -36.753 14.005 1.00 0.00 C ATOM 1661 CD2 PHE A 106 2.326 -34.958 12.714 1.00 0.00 C ATOM 1662 CE1 PHE A 106 4.464 -36.153 13.984 1.00 0.00 C ATOM 1663 CE2 PHE A 106 3.569 -34.354 12.689 1.00 0.00 C ATOM 1664 CZ PHE A 106 4.639 -34.952 13.326 1.00 0.00 C ATOM 0 H PHE A 106 1.079 -38.571 11.259 1.00 0.00 H new ATOM 0 HA PHE A 106 1.386 -38.717 14.201 1.00 0.00 H new ATOM 0 HB2 PHE A 106 0.197 -36.449 12.554 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.262 -36.520 14.304 1.00 0.00 H new ATOM 0 HD1 PHE A 106 3.086 -37.692 14.522 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.493 -34.485 12.216 1.00 0.00 H new ATOM 0 HE1 PHE A 106 5.299 -36.623 14.482 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.704 -33.415 12.172 1.00 0.00 H new ATOM 0 HZ PHE A 106 5.611 -34.481 13.309 1.00 0.00 H new ATOM 1674 N LEU A 107 -1.165 -38.957 14.541 1.00 0.00 N ATOM 1675 CA LEU A 107 -2.516 -39.485 14.702 1.00 0.00 C ATOM 1676 C LEU A 107 -3.554 -38.377 14.558 1.00 0.00 C ATOM 1677 O LEU A 107 -3.513 -37.377 15.276 1.00 0.00 O ATOM 1678 CB LEU A 107 -2.661 -40.162 16.066 1.00 0.00 C ATOM 1679 CG LEU A 107 -2.570 -41.688 16.071 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -3.699 -42.292 15.250 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -1.219 -42.144 15.540 1.00 0.00 C ATOM 0 H LEU A 107 -0.736 -38.626 15.405 1.00 0.00 H new ATOM 0 HA LEU A 107 -2.688 -40.222 13.918 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -1.889 -39.770 16.728 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -3.622 -39.874 16.492 1.00 0.00 H new ATOM 0 HG LEU A 107 -2.669 -42.035 17.099 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -3.618 -43.379 15.265 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -4.658 -41.993 15.674 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -3.631 -41.937 14.222 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -1.172 -43.233 15.551 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -1.090 -41.786 14.519 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -0.426 -41.741 16.169 1.00 0.00 H new ATOM 1693 N CYS A 108 -4.484 -38.563 13.628 1.00 0.00 N ATOM 1694 CA CYS A 108 -5.535 -37.579 13.391 1.00 0.00 C ATOM 1695 C CYS A 108 -6.895 -38.258 13.258 1.00 0.00 C ATOM 1696 O CYS A 108 -6.985 -39.416 12.850 1.00 0.00 O ATOM 1697 CB CYS A 108 -5.230 -36.770 12.130 1.00 0.00 C ATOM 1698 SG CYS A 108 -4.929 -37.779 10.660 1.00 0.00 S ATOM 0 H CYS A 108 -4.532 -39.385 13.026 1.00 0.00 H new ATOM 0 HA CYS A 108 -5.568 -36.905 14.247 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -6.065 -36.098 11.932 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -4.356 -36.146 12.314 1.00 0.00 H new ATOM 0 HG CYS A 108 -4.682 -37.005 9.645 1.00 0.00 H new ATOM 1704 N LEU A 109 -7.950 -37.529 13.606 1.00 0.00 N ATOM 1705 CA LEU A 109 -9.306 -38.061 13.527 1.00 0.00 C ATOM 1706 C LEU A 109 -9.943 -37.732 12.180 1.00 0.00 C ATOM 1707 O LEU A 109 -9.645 -36.701 11.577 1.00 0.00 O ATOM 1708 CB LEU A 109 -10.163 -37.496 14.661 1.00 0.00 C ATOM 1709 CG LEU A 109 -11.677 -37.588 14.467 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -12.381 -37.696 15.811 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -12.190 -36.384 13.690 1.00 0.00 C ATOM 0 H LEU A 109 -7.893 -36.569 13.945 1.00 0.00 H new ATOM 0 HA LEU A 109 -9.251 -39.145 13.627 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.902 -38.018 15.582 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.898 -36.448 14.803 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.896 -38.487 13.891 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -13.458 -37.761 15.654 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.036 -38.589 16.332 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.154 -36.816 16.412 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.269 -36.467 13.562 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -11.959 -35.471 14.239 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.710 -36.351 12.712 1.00 0.00 H new ATOM 1723 N VAL A 110 -10.822 -38.614 11.715 1.00 0.00 N ATOM 1724 CA VAL A 110 -11.503 -38.416 10.442 1.00 0.00 C ATOM 1725 C VAL A 110 -13.005 -38.638 10.582 1.00 0.00 C ATOM 1726 O VAL A 110 -13.463 -39.770 10.734 1.00 0.00 O ATOM 1727 CB VAL A 110 -10.954 -39.362 9.358 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -11.583 -39.051 8.008 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -9.438 -39.264 9.284 1.00 0.00 C ATOM 0 H VAL A 110 -11.079 -39.473 12.201 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.317 -37.385 10.141 1.00 0.00 H new ATOM 0 HB VAL A 110 -11.217 -40.385 9.627 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.183 -39.730 7.255 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -12.664 -39.177 8.072 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.354 -38.023 7.728 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.067 -39.939 8.513 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.151 -38.241 9.040 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.008 -39.541 10.246 1.00 0.00 H new ATOM 1739 N ASP A 111 -13.766 -37.551 10.528 1.00 0.00 N ATOM 1740 CA ASP A 111 -15.217 -37.626 10.647 1.00 0.00 C ATOM 1741 C ASP A 111 -15.882 -37.502 9.280 1.00 0.00 C ATOM 1742 O ASP A 111 -15.502 -36.659 8.467 1.00 0.00 O ATOM 1743 CB ASP A 111 -15.732 -36.528 11.580 1.00 0.00 C ATOM 1744 CG ASP A 111 -17.210 -36.673 11.884 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -18.020 -36.598 10.938 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -17.556 -36.862 13.070 1.00 0.00 O ATOM 0 H ASP A 111 -13.402 -36.607 10.402 1.00 0.00 H new ATOM 0 HA ASP A 111 -15.472 -38.599 11.068 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -15.168 -36.553 12.512 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -15.551 -35.554 11.125 1.00 0.00 H new ATOM 1751 N VAL A 112 -16.876 -38.349 9.032 1.00 0.00 N ATOM 1752 CA VAL A 112 -17.594 -38.335 7.763 1.00 0.00 C ATOM 1753 C VAL A 112 -19.101 -38.266 7.985 1.00 0.00 C ATOM 1754 O VAL A 112 -19.674 -39.097 8.689 1.00 0.00 O ATOM 1755 CB VAL A 112 -17.267 -39.581 6.919 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -18.044 -39.560 5.611 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -15.771 -39.669 6.658 1.00 0.00 C ATOM 0 H VAL A 112 -17.202 -39.054 9.693 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.268 -37.445 7.225 1.00 0.00 H new ATOM 0 HB VAL A 112 -17.569 -40.467 7.478 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -17.800 -40.448 5.028 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -19.113 -39.548 5.823 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -17.777 -38.669 5.043 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -15.557 -40.555 6.060 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.443 -38.780 6.119 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -15.239 -39.735 7.607 1.00 0.00 H new ATOM 1767 N VAL A 113 -19.738 -37.270 7.378 1.00 0.00 N ATOM 1768 CA VAL A 113 -21.179 -37.093 7.507 1.00 0.00 C ATOM 1769 C VAL A 113 -21.810 -36.721 6.169 1.00 0.00 C ATOM 1770 O VAL A 113 -21.306 -35.874 5.432 1.00 0.00 O ATOM 1771 CB VAL A 113 -21.521 -36.005 8.543 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -23.028 -35.847 8.675 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -20.891 -36.335 9.888 1.00 0.00 C ATOM 0 H VAL A 113 -19.278 -36.573 6.792 1.00 0.00 H new ATOM 0 HA VAL A 113 -21.585 -38.047 7.844 1.00 0.00 H new ATOM 0 HB VAL A 113 -21.110 -35.056 8.197 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -23.250 -35.074 9.411 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -23.450 -35.562 7.711 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -23.466 -36.792 8.997 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -21.142 -35.556 10.608 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -21.271 -37.293 10.242 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -19.808 -36.392 9.778 1.00 0.00 H new ATOM 1783 N PRO A 114 -22.939 -37.368 5.847 1.00 0.00 N ATOM 1784 CA PRO A 114 -23.664 -37.122 4.597 1.00 0.00 C ATOM 1785 C PRO A 114 -24.328 -35.749 4.573 1.00 0.00 C ATOM 1786 O PRO A 114 -24.700 -35.210 5.616 1.00 0.00 O ATOM 1787 CB PRO A 114 -24.722 -38.228 4.576 1.00 0.00 C ATOM 1788 CG PRO A 114 -24.929 -38.581 6.009 1.00 0.00 C ATOM 1789 CD PRO A 114 -23.596 -38.391 6.679 1.00 0.00 C ATOM 0 HA PRO A 114 -23.000 -37.132 3.732 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -25.647 -37.882 4.116 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -24.383 -39.090 4.001 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -25.688 -37.943 6.462 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -25.274 -39.610 6.112 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -23.709 -38.058 7.711 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -23.023 -39.318 6.704 1.00 0.00 H new ATOM 1797 N VAL A 115 -24.475 -35.189 3.377 1.00 0.00 N ATOM 1798 CA VAL A 115 -25.096 -33.879 3.218 1.00 0.00 C ATOM 1799 C VAL A 115 -26.492 -34.002 2.617 1.00 0.00 C ATOM 1800 O VAL A 115 -26.651 -34.084 1.398 1.00 0.00 O ATOM 1801 CB VAL A 115 -24.244 -32.959 2.324 1.00 0.00 C ATOM 1802 CG1 VAL A 115 -24.774 -31.534 2.364 1.00 0.00 C ATOM 1803 CG2 VAL A 115 -22.784 -33.005 2.750 1.00 0.00 C ATOM 0 H VAL A 115 -24.173 -35.621 2.504 1.00 0.00 H new ATOM 0 HA VAL A 115 -25.169 -33.440 4.213 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.311 -33.317 1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -24.159 -30.899 1.726 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -25.804 -31.519 2.007 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -24.740 -31.162 3.388 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -22.197 -32.349 2.107 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -22.696 -32.673 3.785 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -22.412 -34.026 2.664 1.00 0.00 H new ATOM 1813 N LYS A 116 -27.502 -34.015 3.479 1.00 0.00 N ATOM 1814 CA LYS A 116 -28.887 -34.126 3.035 1.00 0.00 C ATOM 1815 C LYS A 116 -29.460 -32.755 2.692 1.00 0.00 C ATOM 1816 O LYS A 116 -28.850 -31.727 2.982 1.00 0.00 O ATOM 1817 CB LYS A 116 -29.739 -34.791 4.119 1.00 0.00 C ATOM 1818 CG LYS A 116 -29.280 -36.193 4.479 1.00 0.00 C ATOM 1819 CD LYS A 116 -30.026 -36.730 5.689 1.00 0.00 C ATOM 1820 CE LYS A 116 -29.708 -38.198 5.934 1.00 0.00 C ATOM 1821 NZ LYS A 116 -29.388 -38.465 7.363 1.00 0.00 N ATOM 0 H LYS A 116 -27.388 -33.950 4.491 1.00 0.00 H new ATOM 0 HA LYS A 116 -28.907 -34.743 2.137 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -29.721 -34.171 5.015 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -30.774 -34.832 3.781 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -29.437 -36.858 3.629 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -28.210 -36.185 4.684 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -29.759 -36.147 6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -31.099 -36.609 5.539 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -30.559 -38.809 5.632 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -28.864 -38.496 5.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -29.177 -39.476 7.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -28.561 -37.901 7.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -30.202 -38.205 7.956 1.00 0.00 H new ATOM 1835 N ASN A 117 -30.637 -32.749 2.075 1.00 0.00 N ATOM 1836 CA ASN A 117 -31.293 -31.503 1.694 1.00 0.00 C ATOM 1837 C ASN A 117 -32.517 -31.244 2.566 1.00 0.00 C ATOM 1838 O ASN A 117 -32.765 -31.962 3.534 1.00 0.00 O ATOM 1839 CB ASN A 117 -31.703 -31.549 0.220 1.00 0.00 C ATOM 1840 CG ASN A 117 -30.549 -31.235 -0.711 1.00 0.00 C ATOM 1841 OD1 ASN A 117 -29.444 -30.924 -0.266 1.00 0.00 O ATOM 1842 ND2 ASN A 117 -30.800 -31.314 -2.013 1.00 0.00 N ATOM 0 H ASN A 117 -31.156 -33.592 1.828 1.00 0.00 H new ATOM 0 HA ASN A 117 -30.585 -30.688 1.842 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -32.096 -32.538 -0.014 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -32.510 -30.836 0.048 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -30.062 -31.113 -2.688 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -31.731 -31.576 -2.338 1.00 0.00 H new ATOM 1849 N GLU A 118 -33.279 -30.212 2.216 1.00 0.00 N ATOM 1850 CA GLU A 118 -34.477 -29.858 2.968 1.00 0.00 C ATOM 1851 C GLU A 118 -35.453 -31.030 3.019 1.00 0.00 C ATOM 1852 O GLU A 118 -36.309 -31.101 3.901 1.00 0.00 O ATOM 1853 CB GLU A 118 -35.159 -28.641 2.340 1.00 0.00 C ATOM 1854 CG GLU A 118 -35.479 -27.541 3.338 1.00 0.00 C ATOM 1855 CD GLU A 118 -34.534 -26.360 3.229 1.00 0.00 C ATOM 1856 OE1 GLU A 118 -34.666 -25.581 2.262 1.00 0.00 O ATOM 1857 OE2 GLU A 118 -33.661 -26.216 4.110 1.00 0.00 O ATOM 0 H GLU A 118 -33.088 -29.607 1.417 1.00 0.00 H new ATOM 0 HA GLU A 118 -34.176 -29.612 3.986 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -34.514 -28.236 1.560 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -36.082 -28.961 1.857 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -36.502 -27.199 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -35.431 -27.947 4.348 1.00 0.00 H new ATOM 1864 N ASP A 119 -35.317 -31.948 2.068 1.00 0.00 N ATOM 1865 CA ASP A 119 -36.186 -33.118 2.005 1.00 0.00 C ATOM 1866 C ASP A 119 -35.516 -34.327 2.649 1.00 0.00 C ATOM 1867 O ASP A 119 -36.144 -35.367 2.843 1.00 0.00 O ATOM 1868 CB ASP A 119 -36.547 -33.432 0.552 1.00 0.00 C ATOM 1869 CG ASP A 119 -38.023 -33.236 0.267 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -38.423 -32.089 -0.023 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -38.779 -34.228 0.335 1.00 0.00 O ATOM 0 H ASP A 119 -34.614 -31.905 1.330 1.00 0.00 H new ATOM 0 HA ASP A 119 -37.098 -32.894 2.558 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -35.964 -32.792 -0.111 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -36.270 -34.462 0.326 1.00 0.00 H new ATOM 1876 N GLY A 120 -34.236 -34.183 2.978 1.00 0.00 N ATOM 1877 CA GLY A 120 -33.502 -35.272 3.595 1.00 0.00 C ATOM 1878 C GLY A 120 -32.814 -36.159 2.577 1.00 0.00 C ATOM 1879 O GLY A 120 -32.414 -37.280 2.889 1.00 0.00 O ATOM 0 H GLY A 120 -33.694 -33.332 2.828 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -32.757 -34.863 4.278 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -34.186 -35.874 4.193 1.00 0.00 H new ATOM 1883 N ALA A 121 -32.677 -35.657 1.354 1.00 0.00 N ATOM 1884 CA ALA A 121 -32.033 -36.412 0.286 1.00 0.00 C ATOM 1885 C ALA A 121 -30.536 -36.124 0.236 1.00 0.00 C ATOM 1886 O ALA A 121 -30.119 -34.998 -0.034 1.00 0.00 O ATOM 1887 CB ALA A 121 -32.680 -36.089 -1.053 1.00 0.00 C ATOM 0 H ALA A 121 -33.003 -34.731 1.078 1.00 0.00 H new ATOM 0 HA ALA A 121 -32.165 -37.474 0.494 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -32.189 -36.660 -1.841 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -33.737 -36.352 -1.019 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -32.578 -35.024 -1.259 1.00 0.00 H new ATOM 1893 N VAL A 122 -29.732 -37.149 0.498 1.00 0.00 N ATOM 1894 CA VAL A 122 -28.281 -37.006 0.483 1.00 0.00 C ATOM 1895 C VAL A 122 -27.745 -37.001 -0.944 1.00 0.00 C ATOM 1896 O VAL A 122 -27.996 -37.927 -1.716 1.00 0.00 O ATOM 1897 CB VAL A 122 -27.597 -38.138 1.272 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -27.969 -39.494 0.692 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -26.088 -37.946 1.278 1.00 0.00 C ATOM 0 H VAL A 122 -30.061 -38.088 0.723 1.00 0.00 H new ATOM 0 HA VAL A 122 -28.052 -36.052 0.958 1.00 0.00 H new ATOM 0 HB VAL A 122 -27.949 -38.103 2.303 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -27.476 -40.281 1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -29.049 -39.629 0.746 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -27.648 -39.545 -0.349 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -25.621 -38.755 1.840 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -25.716 -37.954 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -25.844 -36.992 1.745 1.00 0.00 H new ATOM 1909 N ILE A 123 -27.005 -35.952 -1.288 1.00 0.00 N ATOM 1910 CA ILE A 123 -26.432 -35.827 -2.623 1.00 0.00 C ATOM 1911 C ILE A 123 -24.910 -35.910 -2.577 1.00 0.00 C ATOM 1912 O ILE A 123 -24.279 -36.431 -3.496 1.00 0.00 O ATOM 1913 CB ILE A 123 -26.843 -34.501 -3.290 1.00 0.00 C ATOM 1914 CG1 ILE A 123 -26.710 -33.344 -2.299 1.00 0.00 C ATOM 1915 CG2 ILE A 123 -28.266 -34.593 -3.819 1.00 0.00 C ATOM 1916 CD1 ILE A 123 -27.962 -33.099 -1.485 1.00 0.00 C ATOM 0 H ILE A 123 -26.788 -35.177 -0.661 1.00 0.00 H new ATOM 0 HA ILE A 123 -26.821 -36.657 -3.213 1.00 0.00 H new ATOM 0 HB ILE A 123 -26.176 -34.312 -4.131 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -25.881 -33.549 -1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -26.458 -32.435 -2.845 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -28.542 -33.648 -4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -28.330 -35.395 -4.554 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -28.948 -34.802 -2.995 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -27.796 -32.265 -0.804 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -28.790 -32.862 -2.153 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -28.204 -33.994 -0.911 1.00 0.00 H new ATOM 1928 N MET A 124 -24.327 -35.395 -1.499 1.00 0.00 N ATOM 1929 CA MET A 124 -22.878 -35.414 -1.332 1.00 0.00 C ATOM 1930 C MET A 124 -22.501 -35.793 0.097 1.00 0.00 C ATOM 1931 O MET A 124 -23.369 -35.994 0.946 1.00 0.00 O ATOM 1932 CB MET A 124 -22.285 -34.049 -1.684 1.00 0.00 C ATOM 1933 CG MET A 124 -22.893 -32.900 -0.894 1.00 0.00 C ATOM 1934 SD MET A 124 -22.690 -31.309 -1.716 1.00 0.00 S ATOM 1935 CE MET A 124 -22.985 -30.184 -0.354 1.00 0.00 C ATOM 0 H MET A 124 -24.835 -34.960 -0.729 1.00 0.00 H new ATOM 0 HA MET A 124 -22.469 -36.165 -2.008 1.00 0.00 H new ATOM 0 HB2 MET A 124 -21.210 -34.072 -1.506 1.00 0.00 H new ATOM 0 HB3 MET A 124 -22.428 -33.863 -2.748 1.00 0.00 H new ATOM 0 HG2 MET A 124 -23.955 -33.092 -0.740 1.00 0.00 H new ATOM 0 HG3 MET A 124 -22.430 -32.857 0.092 1.00 0.00 H new ATOM 0 HE1 MET A 124 -22.515 -29.224 -0.567 1.00 0.00 H new ATOM 0 HE2 MET A 124 -24.058 -30.042 -0.225 1.00 0.00 H new ATOM 0 HE3 MET A 124 -22.562 -30.601 0.560 1.00 0.00 H new ATOM 1945 N PHE A 125 -21.201 -35.889 0.355 1.00 0.00 N ATOM 1946 CA PHE A 125 -20.709 -36.245 1.681 1.00 0.00 C ATOM 1947 C PHE A 125 -19.601 -35.294 2.123 1.00 0.00 C ATOM 1948 O PHE A 125 -18.748 -34.905 1.326 1.00 0.00 O ATOM 1949 CB PHE A 125 -20.193 -37.685 1.687 1.00 0.00 C ATOM 1950 CG PHE A 125 -20.725 -38.518 0.555 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -22.079 -38.792 0.457 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -19.871 -39.025 -0.410 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -22.573 -39.558 -0.583 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -20.358 -39.791 -1.453 1.00 0.00 C ATOM 1955 CZ PHE A 125 -21.710 -40.058 -1.539 1.00 0.00 C ATOM 0 H PHE A 125 -20.469 -35.725 -0.336 1.00 0.00 H new ATOM 0 HA PHE A 125 -21.538 -36.161 2.384 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.104 -37.672 1.638 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -20.464 -38.156 2.632 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -22.757 -38.403 1.202 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -18.813 -38.820 -0.347 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -23.631 -39.765 -0.648 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -19.682 -40.180 -2.200 1.00 0.00 H new ATOM 0 HZ PHE A 125 -22.092 -40.657 -2.352 1.00 0.00 H new ATOM 1965 N ILE A 126 -19.622 -34.924 3.399 1.00 0.00 N ATOM 1966 CA ILE A 126 -18.620 -34.019 3.948 1.00 0.00 C ATOM 1967 C ILE A 126 -17.826 -34.690 5.064 1.00 0.00 C ATOM 1968 O ILE A 126 -18.375 -35.453 5.859 1.00 0.00 O ATOM 1969 CB ILE A 126 -19.263 -32.730 4.494 1.00 0.00 C ATOM 1970 CG1 ILE A 126 -18.214 -31.871 5.203 1.00 0.00 C ATOM 1971 CG2 ILE A 126 -20.405 -33.069 5.440 1.00 0.00 C ATOM 1972 CD1 ILE A 126 -18.565 -30.401 5.244 1.00 0.00 C ATOM 0 H ILE A 126 -20.322 -35.237 4.072 1.00 0.00 H new ATOM 0 HA ILE A 126 -17.947 -33.761 3.131 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.666 -32.160 3.657 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.087 -32.235 6.223 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.255 -31.993 4.699 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.850 -32.148 5.818 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.161 -33.645 4.906 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.024 -33.657 6.275 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -17.777 -29.853 5.761 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -18.663 -30.022 4.227 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -19.508 -30.267 5.774 1.00 0.00 H new ATOM 1984 N LEU A 127 -16.531 -34.399 5.118 1.00 0.00 N ATOM 1985 CA LEU A 127 -15.660 -34.972 6.138 1.00 0.00 C ATOM 1986 C LEU A 127 -14.558 -33.992 6.528 1.00 0.00 C ATOM 1987 O LEU A 127 -14.103 -33.197 5.707 1.00 0.00 O ATOM 1988 CB LEU A 127 -15.042 -36.278 5.634 1.00 0.00 C ATOM 1989 CG LEU A 127 -14.204 -36.175 4.359 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -13.183 -37.300 4.299 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -15.100 -36.199 3.129 1.00 0.00 C ATOM 0 H LEU A 127 -16.061 -33.770 4.467 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.264 -35.180 7.021 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -14.415 -36.689 6.425 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -15.846 -36.994 5.460 1.00 0.00 H new ATOM 0 HG LEU A 127 -13.668 -35.226 4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -12.596 -37.210 3.385 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -12.521 -37.237 5.163 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -13.699 -38.260 4.306 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -14.487 -36.125 2.231 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -15.664 -37.132 3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -15.792 -35.358 3.166 1.00 0.00 H new ATOM 2003 N ASN A 128 -14.133 -34.057 7.786 1.00 0.00 N ATOM 2004 CA ASN A 128 -13.083 -33.175 8.284 1.00 0.00 C ATOM 2005 C ASN A 128 -12.083 -33.949 9.138 1.00 0.00 C ATOM 2006 O ASN A 128 -12.358 -35.067 9.575 1.00 0.00 O ATOM 2007 CB ASN A 128 -13.692 -32.034 9.101 1.00 0.00 C ATOM 2008 CG ASN A 128 -14.562 -32.535 10.237 1.00 0.00 C ATOM 2009 OD1 ASN A 128 -14.060 -33.048 11.238 1.00 0.00 O ATOM 2010 ND2 ASN A 128 -15.873 -32.390 10.087 1.00 0.00 N ATOM 0 H ASN A 128 -14.499 -34.710 8.478 1.00 0.00 H new ATOM 0 HA ASN A 128 -12.556 -32.758 7.426 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -12.892 -31.414 9.506 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -14.287 -31.398 8.445 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -16.508 -32.709 10.818 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -16.245 -31.959 9.241 1.00 0.00 H new ATOM 2017 N PHE A 129 -10.922 -33.347 9.371 1.00 0.00 N ATOM 2018 CA PHE A 129 -9.880 -33.979 10.172 1.00 0.00 C ATOM 2019 C PHE A 129 -9.680 -33.234 11.488 1.00 0.00 C ATOM 2020 O PHE A 129 -9.994 -32.050 11.597 1.00 0.00 O ATOM 2021 CB PHE A 129 -8.564 -34.023 9.392 1.00 0.00 C ATOM 2022 CG PHE A 129 -8.521 -35.105 8.351 1.00 0.00 C ATOM 2023 CD1 PHE A 129 -9.467 -35.151 7.340 1.00 0.00 C ATOM 2024 CD2 PHE A 129 -7.534 -36.077 8.385 1.00 0.00 C ATOM 2025 CE1 PHE A 129 -9.429 -36.145 6.381 1.00 0.00 C ATOM 2026 CE2 PHE A 129 -7.491 -37.073 7.428 1.00 0.00 C ATOM 2027 CZ PHE A 129 -8.440 -37.108 6.425 1.00 0.00 C ATOM 0 H PHE A 129 -10.679 -32.422 9.017 1.00 0.00 H new ATOM 0 HA PHE A 129 -10.196 -34.998 10.396 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -8.404 -33.059 8.909 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -7.741 -34.170 10.091 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -10.243 -34.401 7.301 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -6.790 -36.056 9.168 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -10.172 -36.169 5.598 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -6.716 -37.824 7.464 1.00 0.00 H new ATOM 0 HZ PHE A 129 -8.409 -37.886 5.677 1.00 0.00 H new ATOM 2037 N GLU A 130 -9.154 -33.939 12.486 1.00 0.00 N ATOM 2038 CA GLU A 130 -8.913 -33.345 13.796 1.00 0.00 C ATOM 2039 C GLU A 130 -7.758 -34.045 14.506 1.00 0.00 C ATOM 2040 O GLU A 130 -7.886 -35.189 14.943 1.00 0.00 O ATOM 2041 CB GLU A 130 -10.176 -33.421 14.655 1.00 0.00 C ATOM 2042 CG GLU A 130 -9.963 -32.973 16.092 1.00 0.00 C ATOM 2043 CD GLU A 130 -9.460 -31.546 16.190 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -8.231 -31.342 16.101 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -10.296 -30.633 16.355 1.00 0.00 O ATOM 0 H GLU A 130 -8.887 -34.921 12.412 1.00 0.00 H new ATOM 0 HA GLU A 130 -8.645 -32.299 13.649 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -10.951 -32.803 14.202 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -10.545 -34.447 14.654 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -10.902 -33.062 16.639 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.249 -33.640 16.574 1.00 0.00 H new ATOM 2052 N VAL A 131 -6.631 -33.350 14.618 1.00 0.00 N ATOM 2053 CA VAL A 131 -5.453 -33.904 15.275 1.00 0.00 C ATOM 2054 C VAL A 131 -5.787 -34.394 16.679 1.00 0.00 C ATOM 2055 O VAL A 131 -6.515 -33.735 17.422 1.00 0.00 O ATOM 2056 CB VAL A 131 -4.319 -32.865 15.362 1.00 0.00 C ATOM 2057 CG1 VAL A 131 -4.840 -31.550 15.919 1.00 0.00 C ATOM 2058 CG2 VAL A 131 -3.174 -33.397 16.212 1.00 0.00 C ATOM 0 H VAL A 131 -6.509 -32.402 14.262 1.00 0.00 H new ATOM 0 HA VAL A 131 -5.119 -34.746 14.669 1.00 0.00 H new ATOM 0 HB VAL A 131 -3.941 -32.681 14.356 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -4.024 -30.829 15.973 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -5.623 -31.164 15.267 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -5.246 -31.713 16.917 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -2.381 -32.651 16.263 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -3.536 -33.611 17.218 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -2.783 -34.311 15.765 1.00 0.00 H new ATOM 2068 N VAL A 132 -5.250 -35.556 17.038 1.00 0.00 N ATOM 2069 CA VAL A 132 -5.489 -36.135 18.354 1.00 0.00 C ATOM 2070 C VAL A 132 -4.177 -36.487 19.046 1.00 0.00 C ATOM 2071 O VAL A 132 -4.057 -36.372 20.266 1.00 0.00 O ATOM 2072 CB VAL A 132 -6.363 -37.400 18.261 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -6.627 -37.970 19.646 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -7.669 -37.092 17.544 1.00 0.00 C ATOM 0 H VAL A 132 -4.646 -36.115 16.435 1.00 0.00 H new ATOM 0 HA VAL A 132 -6.015 -35.381 18.940 1.00 0.00 H new ATOM 0 HB VAL A 132 -5.825 -38.151 17.682 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -7.246 -38.863 19.560 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -5.680 -38.229 20.119 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -7.145 -37.227 20.253 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -8.275 -37.996 17.487 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -8.214 -36.325 18.094 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -7.455 -36.734 16.537 1.00 0.00 H new ATOM 2084 N MET A 133 -3.196 -36.916 18.259 1.00 0.00 N ATOM 2085 CA MET A 133 -1.891 -37.284 18.797 1.00 0.00 C ATOM 2086 C MET A 133 -0.775 -36.878 17.840 1.00 0.00 C ATOM 2087 O MET A 133 -0.230 -37.713 17.118 1.00 0.00 O ATOM 2088 CB MET A 133 -1.830 -38.789 19.061 1.00 0.00 C ATOM 2089 CG MET A 133 -1.995 -39.156 20.527 1.00 0.00 C ATOM 2090 SD MET A 133 -3.447 -40.181 20.828 1.00 0.00 S ATOM 2091 CE MET A 133 -2.679 -41.708 21.363 1.00 0.00 C ATOM 0 H MET A 133 -3.279 -37.017 17.247 1.00 0.00 H new ATOM 0 HA MET A 133 -1.750 -36.752 19.738 1.00 0.00 H new ATOM 0 HB2 MET A 133 -2.610 -39.283 18.481 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.875 -39.174 18.704 1.00 0.00 H new ATOM 0 HG2 MET A 133 -1.105 -39.685 20.867 1.00 0.00 H new ATOM 0 HG3 MET A 133 -2.070 -38.244 21.119 1.00 0.00 H new ATOM 0 HE1 MET A 133 -3.451 -42.444 21.587 1.00 0.00 H new ATOM 0 HE2 MET A 133 -2.034 -42.088 20.571 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.084 -41.522 22.257 1.00 0.00 H new ATOM 2101 N GLU A 134 -0.440 -35.592 17.839 1.00 0.00 N ATOM 2102 CA GLU A 134 0.611 -35.077 16.969 1.00 0.00 C ATOM 2103 C GLU A 134 1.983 -35.247 17.614 1.00 0.00 C ATOM 2104 O GLU A 134 2.476 -34.350 18.299 1.00 0.00 O ATOM 2105 CB GLU A 134 0.364 -33.601 16.652 1.00 0.00 C ATOM 2106 CG GLU A 134 1.458 -32.967 15.809 1.00 0.00 C ATOM 2107 CD GLU A 134 0.914 -32.251 14.588 1.00 0.00 C ATOM 2108 OE1 GLU A 134 0.470 -32.940 13.646 1.00 0.00 O ATOM 2109 OE2 GLU A 134 0.932 -31.003 14.575 1.00 0.00 O ATOM 0 H GLU A 134 -0.881 -34.888 18.431 1.00 0.00 H new ATOM 0 HA GLU A 134 0.591 -35.649 16.041 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -0.587 -33.505 16.129 1.00 0.00 H new ATOM 0 HB3 GLU A 134 0.271 -33.048 17.587 1.00 0.00 H new ATOM 0 HG2 GLU A 134 2.018 -32.260 16.420 1.00 0.00 H new ATOM 0 HG3 GLU A 134 2.159 -33.739 15.491 1.00 0.00 H new ATOM 2116 N LYS A 135 2.596 -36.404 17.390 1.00 0.00 N ATOM 2117 CA LYS A 135 3.912 -36.694 17.947 1.00 0.00 C ATOM 2118 C LYS A 135 5.017 -36.178 17.031 1.00 0.00 C ATOM 2119 O LYS A 135 5.001 -35.019 16.616 1.00 0.00 O ATOM 2120 CB LYS A 135 4.076 -38.200 18.164 1.00 0.00 C ATOM 2121 CG LYS A 135 5.499 -38.692 17.963 1.00 0.00 C ATOM 2122 CD LYS A 135 5.741 -39.129 16.528 1.00 0.00 C ATOM 2123 CE LYS A 135 5.841 -40.642 16.415 1.00 0.00 C ATOM 2124 NZ LYS A 135 6.017 -41.083 15.003 1.00 0.00 N ATOM 0 H LYS A 135 2.202 -37.157 16.826 1.00 0.00 H new ATOM 0 HA LYS A 135 3.993 -36.184 18.907 1.00 0.00 H new ATOM 0 HB2 LYS A 135 3.753 -38.450 19.175 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.416 -38.731 17.478 1.00 0.00 H new ATOM 0 HG2 LYS A 135 6.199 -37.899 18.226 1.00 0.00 H new ATOM 0 HG3 LYS A 135 5.695 -39.527 18.636 1.00 0.00 H new ATOM 0 HD2 LYS A 135 4.930 -38.769 15.895 1.00 0.00 H new ATOM 0 HD3 LYS A 135 6.660 -38.674 16.158 1.00 0.00 H new ATOM 0 HE2 LYS A 135 6.681 -40.996 17.013 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.941 -41.097 16.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 6.081 -42.120 14.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 5.204 -40.767 14.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 6.889 -40.669 14.616 1.00 0.00 H new