USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 824 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 ASN : amide:sc= -0.391 K(o=-0.39,f=-1.7!) USER MOD Set 1.2: A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 146:sc= -0.873 (180deg=-2.95!) USER MOD Single : A 33 ASN : amide:sc= -0.811 X(o=-0.81,f=-0.78) 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 13:sc= -0.295 USER MOD Single : A 45 ASN : amide:sc= -0.288 K(o=-0.29,f=-2.2!) USER MOD Single : A 49 CYS SG : rot 74:sc= 0.353 USER MOD Single : A 52 CYS SG : rot 180:sc= -0.271 USER MOD Single : A 54 TYR OH : rot 30:sc= -0.256 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0.11) USER MOD Single : A 64 CYS SG : rot -35:sc= -1.53 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot -167:sc= 0.268 USER MOD Single : A 70 HIS : no HD1:sc= -3.2 K(o=-3.2,f=-3.9) USER MOD Single : A 74 THR OG1 : rot -129:sc= 0.00664 USER MOD Single : A 75 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.12) USER MOD Single : A 81 GLN : amide:sc= -0.645 K(o=-0.65,f=-1.6!) USER MOD Single : A 84 GLN : amide:sc= 0.0115 X(o=0.011,f=-0.053) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 0:sc= 1.33 USER MOD Single : A 101 LYS NZ :NH3+ 163:sc= -0.203 (180deg=-0.45) USER MOD Single : A 104 SER OG : rot -74:sc= -0.0977 USER MOD Single : A 105 CYS SG : rot 180:sc= -0.3 USER MOD Single : A 108 CYS SG : rot -26:sc= -0.298 USER MOD Single : A 116 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0106) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) 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 -6.782 -27.812 11.424 1.00 0.00 N ATOM 425 CA ARG A 27 -8.151 -28.132 11.037 1.00 0.00 C ATOM 426 C ARG A 27 -8.204 -28.641 9.599 1.00 0.00 C ATOM 427 O ARG A 27 -7.294 -28.392 8.807 1.00 0.00 O ATOM 428 CB ARG A 27 -9.047 -26.902 11.186 1.00 0.00 C ATOM 429 CG ARG A 27 -8.795 -25.832 10.136 1.00 0.00 C ATOM 430 CD ARG A 27 -9.777 -25.944 8.980 1.00 0.00 C ATOM 431 NE ARG A 27 -9.790 -24.739 8.155 1.00 0.00 N ATOM 432 CZ ARG A 27 -10.447 -23.632 8.481 1.00 0.00 C ATOM 433 NH1 ARG A 27 -11.141 -23.577 9.610 1.00 0.00 N ATOM 434 NH2 ARG A 27 -10.411 -22.576 7.678 1.00 0.00 N ATOM 0 HA ARG A 27 -8.514 -28.919 11.698 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -10.090 -27.214 11.131 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -8.895 -26.471 12.175 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.879 -24.846 10.592 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -7.776 -25.923 9.760 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -9.514 -26.803 8.363 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -10.778 -26.127 9.371 1.00 0.00 H new ATOM 0 HE ARG A 27 -9.266 -24.748 7.280 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -11.171 -24.386 10.230 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -11.645 -22.725 9.858 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -9.878 -22.614 6.809 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.916 -21.726 7.930 1.00 0.00 H new ATOM 448 N LYS A 28 -9.274 -29.355 9.269 1.00 0.00 N ATOM 449 CA LYS A 28 -9.447 -29.899 7.927 1.00 0.00 C ATOM 450 C LYS A 28 -10.923 -30.134 7.622 1.00 0.00 C ATOM 451 O LYS A 28 -11.749 -30.220 8.530 1.00 0.00 O ATOM 452 CB LYS A 28 -8.671 -31.210 7.782 1.00 0.00 C ATOM 453 CG LYS A 28 -7.290 -31.034 7.174 1.00 0.00 C ATOM 454 CD LYS A 28 -6.234 -31.794 7.960 1.00 0.00 C ATOM 455 CE LYS A 28 -6.305 -33.289 7.688 1.00 0.00 C ATOM 456 NZ LYS A 28 -6.360 -34.079 8.949 1.00 0.00 N ATOM 0 H LYS A 28 -10.035 -29.571 9.913 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.057 -29.172 7.214 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -8.571 -31.674 8.763 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.247 -31.897 7.162 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.299 -31.384 6.142 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.034 -29.975 7.149 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -5.244 -31.422 7.696 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -6.370 -31.610 9.026 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -7.186 -33.507 7.084 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -5.436 -33.594 7.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.949 -34.924 8.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.399 -34.370 9.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.771 -33.496 9.706 1.00 0.00 H new ATOM 470 N PHE A 29 -11.248 -30.238 6.337 1.00 0.00 N ATOM 471 CA PHE A 29 -12.624 -30.464 5.912 1.00 0.00 C ATOM 472 C PHE A 29 -12.680 -30.869 4.442 1.00 0.00 C ATOM 473 O PHE A 29 -11.976 -30.304 3.604 1.00 0.00 O ATOM 474 CB PHE A 29 -13.463 -29.204 6.138 1.00 0.00 C ATOM 475 CG PHE A 29 -14.375 -28.877 4.990 1.00 0.00 C ATOM 476 CD1 PHE A 29 -15.504 -29.642 4.745 1.00 0.00 C ATOM 477 CD2 PHE A 29 -14.103 -27.805 4.155 1.00 0.00 C ATOM 478 CE1 PHE A 29 -16.344 -29.344 3.689 1.00 0.00 C ATOM 479 CE2 PHE A 29 -14.940 -27.502 3.098 1.00 0.00 C ATOM 480 CZ PHE A 29 -16.062 -28.272 2.865 1.00 0.00 C ATOM 0 H PHE A 29 -10.577 -30.169 5.572 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.034 -31.278 6.510 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.060 -29.332 7.041 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -12.796 -28.360 6.314 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.730 -30.481 5.387 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -13.227 -27.199 4.332 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -17.220 -29.949 3.508 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -14.717 -26.664 2.455 1.00 0.00 H new ATOM 0 HZ PHE A 29 -16.718 -28.037 2.040 1.00 0.00 H new ATOM 490 N ILE A 30 -13.521 -31.851 4.137 1.00 0.00 N ATOM 491 CA ILE A 30 -13.670 -32.332 2.769 1.00 0.00 C ATOM 492 C ILE A 30 -15.058 -32.920 2.541 1.00 0.00 C ATOM 493 O ILE A 30 -15.684 -33.437 3.467 1.00 0.00 O ATOM 494 CB ILE A 30 -12.611 -33.397 2.429 1.00 0.00 C ATOM 495 CG1 ILE A 30 -12.799 -34.634 3.310 1.00 0.00 C ATOM 496 CG2 ILE A 30 -11.211 -32.826 2.600 1.00 0.00 C ATOM 497 CD1 ILE A 30 -11.699 -35.661 3.151 1.00 0.00 C ATOM 0 H ILE A 30 -14.110 -32.329 4.819 1.00 0.00 H new ATOM 0 HA ILE A 30 -13.531 -31.471 2.115 1.00 0.00 H new ATOM 0 HB ILE A 30 -12.736 -33.693 1.388 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -12.847 -34.323 4.354 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -13.756 -35.098 3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.474 -33.591 2.356 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -11.082 -31.973 1.934 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.073 -32.505 3.632 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -11.897 -36.510 3.805 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -11.665 -36.000 2.116 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -10.742 -35.213 3.418 1.00 0.00 H new ATOM 509 N ILE A 31 -15.532 -32.840 1.302 1.00 0.00 N ATOM 510 CA ILE A 31 -16.845 -33.367 0.951 1.00 0.00 C ATOM 511 C ILE A 31 -16.772 -34.240 -0.297 1.00 0.00 C ATOM 512 O ILE A 31 -16.083 -33.906 -1.260 1.00 0.00 O ATOM 513 CB ILE A 31 -17.861 -32.235 0.713 1.00 0.00 C ATOM 514 CG1 ILE A 31 -19.224 -32.815 0.330 1.00 0.00 C ATOM 515 CG2 ILE A 31 -17.358 -31.291 -0.370 1.00 0.00 C ATOM 516 CD1 ILE A 31 -19.443 -32.909 -1.163 1.00 0.00 C ATOM 0 H ILE A 31 -15.026 -32.415 0.525 1.00 0.00 H new ATOM 0 HA ILE A 31 -17.178 -33.971 1.795 1.00 0.00 H new ATOM 0 HB ILE A 31 -17.975 -31.669 1.638 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -19.322 -33.809 0.767 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -20.008 -32.196 0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -18.087 -30.496 -0.527 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -16.408 -30.856 -0.061 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -17.219 -31.844 -1.299 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -20.429 -33.329 -1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -19.377 -31.914 -1.604 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.681 -33.552 -1.603 1.00 0.00 H new ATOM 528 N ALA A 32 -17.487 -35.360 -0.272 1.00 0.00 N ATOM 529 CA ALA A 32 -17.507 -36.279 -1.403 1.00 0.00 C ATOM 530 C ALA A 32 -18.934 -36.546 -1.869 1.00 0.00 C ATOM 531 O ALA A 32 -19.893 -36.279 -1.147 1.00 0.00 O ATOM 532 CB ALA A 32 -16.818 -37.584 -1.034 1.00 0.00 C ATOM 0 H ALA A 32 -18.060 -35.653 0.519 1.00 0.00 H new ATOM 0 HA ALA A 32 -16.965 -35.814 -2.227 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -16.840 -38.261 -1.888 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.783 -37.383 -0.757 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -17.336 -38.044 -0.193 1.00 0.00 H new ATOM 538 N ASN A 33 -19.066 -37.073 -3.082 1.00 0.00 N ATOM 539 CA ASN A 33 -20.377 -37.374 -3.646 1.00 0.00 C ATOM 540 C ASN A 33 -20.444 -38.821 -4.125 1.00 0.00 C ATOM 541 O ASN A 33 -19.883 -39.168 -5.164 1.00 0.00 O ATOM 542 CB ASN A 33 -20.687 -36.426 -4.806 1.00 0.00 C ATOM 543 CG ASN A 33 -21.200 -37.159 -6.030 1.00 0.00 C ATOM 544 OD1 ASN A 33 -22.345 -37.612 -6.062 1.00 0.00 O ATOM 545 ND2 ASN A 33 -20.353 -37.280 -7.046 1.00 0.00 N ATOM 0 H ASN A 33 -18.282 -37.300 -3.693 1.00 0.00 H new ATOM 0 HA ASN A 33 -21.122 -37.234 -2.863 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -21.430 -35.695 -4.486 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -19.786 -35.871 -5.069 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -20.642 -37.764 -7.896 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -19.413 -36.889 -6.976 1.00 0.00 H new ATOM 552 N ALA A 34 -21.135 -39.661 -3.360 1.00 0.00 N ATOM 553 CA ALA A 34 -21.277 -41.069 -3.708 1.00 0.00 C ATOM 554 C ALA A 34 -20.225 -41.493 -4.726 1.00 0.00 C ATOM 555 O ALA A 34 -20.549 -41.817 -5.869 1.00 0.00 O ATOM 556 CB ALA A 34 -22.675 -41.341 -4.245 1.00 0.00 C ATOM 0 H ALA A 34 -21.605 -39.390 -2.496 1.00 0.00 H new ATOM 0 HA ALA A 34 -21.126 -41.658 -2.803 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -22.767 -42.396 -4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -23.413 -41.086 -3.484 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -22.847 -40.735 -5.135 1.00 0.00 H new ATOM 631 N CYS A 39 -13.580 -40.410 -9.300 1.00 0.00 N ATOM 632 CA CYS A 39 -13.042 -41.223 -8.216 1.00 0.00 C ATOM 633 C CYS A 39 -12.182 -40.381 -7.279 1.00 0.00 C ATOM 634 O CYS A 39 -11.173 -40.852 -6.755 1.00 0.00 O ATOM 635 CB CYS A 39 -12.218 -42.382 -8.780 1.00 0.00 C ATOM 636 SG CYS A 39 -12.428 -43.940 -7.888 1.00 0.00 S ATOM 0 HA CYS A 39 -13.880 -41.625 -7.647 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -12.492 -42.534 -9.824 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -11.164 -42.106 -8.764 1.00 0.00 H new ATOM 0 HG CYS A 39 -11.693 -44.859 -8.441 1.00 0.00 H new ATOM 642 N ALA A 40 -12.589 -39.133 -7.074 1.00 0.00 N ATOM 643 CA ALA A 40 -11.856 -38.225 -6.200 1.00 0.00 C ATOM 644 C ALA A 40 -12.807 -37.305 -5.442 1.00 0.00 C ATOM 645 O ALA A 40 -13.867 -36.937 -5.949 1.00 0.00 O ATOM 646 CB ALA A 40 -10.859 -37.406 -7.006 1.00 0.00 C ATOM 0 H ALA A 40 -13.422 -38.727 -7.501 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.312 -38.824 -5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.319 -36.733 -6.340 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.152 -38.074 -7.498 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -11.391 -36.823 -7.758 1.00 0.00 H new ATOM 652 N VAL A 41 -12.423 -36.938 -4.223 1.00 0.00 N ATOM 653 CA VAL A 41 -13.242 -36.061 -3.395 1.00 0.00 C ATOM 654 C VAL A 41 -13.766 -34.877 -4.199 1.00 0.00 C ATOM 655 O VAL A 41 -13.137 -34.442 -5.164 1.00 0.00 O ATOM 656 CB VAL A 41 -12.451 -35.535 -2.183 1.00 0.00 C ATOM 657 CG1 VAL A 41 -13.371 -34.790 -1.227 1.00 0.00 C ATOM 658 CG2 VAL A 41 -11.743 -36.678 -1.472 1.00 0.00 C ATOM 0 H VAL A 41 -11.550 -37.235 -3.787 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.084 -36.656 -3.040 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.695 -34.836 -2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -12.794 -34.426 -0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -13.827 -33.946 -1.744 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -14.152 -35.464 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.189 -36.288 -0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -12.480 -37.403 -1.126 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -11.052 -37.163 -2.162 1.00 0.00 H new ATOM 668 N ILE A 42 -14.922 -34.360 -3.796 1.00 0.00 N ATOM 669 CA ILE A 42 -15.530 -33.225 -4.479 1.00 0.00 C ATOM 670 C ILE A 42 -14.845 -31.919 -4.091 1.00 0.00 C ATOM 671 O ILE A 42 -14.335 -31.196 -4.947 1.00 0.00 O ATOM 672 CB ILE A 42 -17.033 -33.117 -4.162 1.00 0.00 C ATOM 673 CG1 ILE A 42 -17.796 -34.280 -4.799 1.00 0.00 C ATOM 674 CG2 ILE A 42 -17.583 -31.785 -4.650 1.00 0.00 C ATOM 675 CD1 ILE A 42 -17.873 -34.198 -6.308 1.00 0.00 C ATOM 0 H ILE A 42 -15.456 -34.709 -3.000 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.404 -33.395 -5.548 1.00 0.00 H new ATOM 0 HB ILE A 42 -17.166 -33.169 -3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -17.315 -35.217 -4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -18.807 -34.307 -4.393 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -18.646 -31.724 -4.419 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.056 -30.970 -4.154 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.441 -31.706 -5.728 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -18.428 -35.055 -6.691 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -18.381 -33.278 -6.597 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -16.866 -34.202 -6.724 1.00 0.00 H new ATOM 687 N TYR A 43 -14.836 -31.625 -2.796 1.00 0.00 N ATOM 688 CA TYR A 43 -14.214 -30.405 -2.294 1.00 0.00 C ATOM 689 C TYR A 43 -13.307 -30.706 -1.104 1.00 0.00 C ATOM 690 O TYR A 43 -13.402 -31.769 -0.490 1.00 0.00 O ATOM 691 CB TYR A 43 -15.284 -29.391 -1.889 1.00 0.00 C ATOM 692 CG TYR A 43 -15.086 -28.024 -2.504 1.00 0.00 C ATOM 693 CD1 TYR A 43 -15.340 -27.803 -3.852 1.00 0.00 C ATOM 694 CD2 TYR A 43 -14.647 -26.952 -1.737 1.00 0.00 C ATOM 695 CE1 TYR A 43 -15.160 -26.556 -4.418 1.00 0.00 C ATOM 696 CE2 TYR A 43 -14.465 -25.701 -2.294 1.00 0.00 C ATOM 697 CZ TYR A 43 -14.722 -25.508 -3.635 1.00 0.00 C ATOM 698 OH TYR A 43 -14.543 -24.264 -4.195 1.00 0.00 O ATOM 0 H TYR A 43 -15.252 -32.214 -2.075 1.00 0.00 H new ATOM 0 HA TYR A 43 -13.606 -29.982 -3.094 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -16.263 -29.773 -2.180 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -15.289 -29.295 -0.803 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.684 -28.621 -4.468 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -14.444 -27.099 -0.686 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -15.361 -26.402 -5.468 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -14.123 -24.879 -1.683 1.00 0.00 H new ATOM 0 HH TYR A 43 -14.232 -23.638 -3.508 1.00 0.00 H new ATOM 708 N CYS A 44 -12.428 -29.762 -0.785 1.00 0.00 N ATOM 709 CA CYS A 44 -11.503 -29.925 0.331 1.00 0.00 C ATOM 710 C CYS A 44 -10.992 -28.572 0.815 1.00 0.00 C ATOM 711 O CYS A 44 -10.829 -27.641 0.027 1.00 0.00 O ATOM 712 CB CYS A 44 -10.326 -30.811 -0.080 1.00 0.00 C ATOM 713 SG CYS A 44 -9.137 -29.998 -1.174 1.00 0.00 S ATOM 0 H CYS A 44 -12.337 -28.877 -1.283 1.00 0.00 H new ATOM 0 HA CYS A 44 -12.040 -30.404 1.149 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -9.807 -31.147 0.818 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -10.711 -31.701 -0.577 1.00 0.00 H new ATOM 0 HG CYS A 44 -9.369 -28.719 -1.193 1.00 0.00 H new ATOM 719 N ASN A 45 -10.742 -28.470 2.116 1.00 0.00 N ATOM 720 CA ASN A 45 -10.252 -27.230 2.706 1.00 0.00 C ATOM 721 C ASN A 45 -8.752 -27.074 2.476 1.00 0.00 C ATOM 722 O ASN A 45 -8.112 -27.937 1.874 1.00 0.00 O ATOM 723 CB ASN A 45 -10.556 -27.199 4.205 1.00 0.00 C ATOM 724 CG ASN A 45 -11.039 -25.838 4.669 1.00 0.00 C ATOM 725 OD1 ASN A 45 -10.966 -24.856 3.930 1.00 0.00 O ATOM 726 ND2 ASN A 45 -11.537 -25.775 5.899 1.00 0.00 N ATOM 0 H ASN A 45 -10.871 -29.232 2.782 1.00 0.00 H new ATOM 0 HA ASN A 45 -10.764 -26.399 2.221 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -11.314 -27.948 4.435 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -9.659 -27.472 4.761 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -11.878 -24.887 6.266 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -11.578 -26.615 6.476 1.00 0.00 H new ATOM 733 N ASP A 46 -8.197 -25.968 2.960 1.00 0.00 N ATOM 734 CA ASP A 46 -6.771 -25.699 2.809 1.00 0.00 C ATOM 735 C ASP A 46 -5.952 -26.558 3.767 1.00 0.00 C ATOM 736 O ASP A 46 -4.815 -26.924 3.471 1.00 0.00 O ATOM 737 CB ASP A 46 -6.481 -24.218 3.058 1.00 0.00 C ATOM 738 CG ASP A 46 -5.024 -23.868 2.832 1.00 0.00 C ATOM 739 OD1 ASP A 46 -4.306 -24.685 2.220 1.00 0.00 O ATOM 740 OD2 ASP A 46 -4.601 -22.776 3.269 1.00 0.00 O ATOM 0 H ASP A 46 -8.712 -25.244 3.460 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.485 -25.951 1.788 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.104 -23.613 2.399 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.758 -23.963 4.081 1.00 0.00 H new ATOM 745 N GLY A 47 -6.538 -26.877 4.917 1.00 0.00 N ATOM 746 CA GLY A 47 -5.847 -27.690 5.901 1.00 0.00 C ATOM 747 C GLY A 47 -5.301 -28.975 5.311 1.00 0.00 C ATOM 748 O GLY A 47 -4.111 -29.266 5.433 1.00 0.00 O ATOM 0 H GLY A 47 -7.479 -26.587 5.185 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.028 -27.115 6.332 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -6.531 -27.930 6.715 1.00 0.00 H new ATOM 752 N PHE A 48 -6.172 -29.747 4.670 1.00 0.00 N ATOM 753 CA PHE A 48 -5.771 -31.010 4.061 1.00 0.00 C ATOM 754 C PHE A 48 -4.527 -30.826 3.197 1.00 0.00 C ATOM 755 O PHE A 48 -3.607 -31.645 3.231 1.00 0.00 O ATOM 756 CB PHE A 48 -6.913 -31.579 3.216 1.00 0.00 C ATOM 757 CG PHE A 48 -6.769 -33.045 2.923 1.00 0.00 C ATOM 758 CD1 PHE A 48 -6.866 -33.981 3.939 1.00 0.00 C ATOM 759 CD2 PHE A 48 -6.536 -33.486 1.630 1.00 0.00 C ATOM 760 CE1 PHE A 48 -6.733 -35.331 3.672 1.00 0.00 C ATOM 761 CE2 PHE A 48 -6.403 -34.835 1.357 1.00 0.00 C ATOM 762 CZ PHE A 48 -6.502 -35.758 2.379 1.00 0.00 C ATOM 0 H PHE A 48 -7.160 -29.520 4.559 1.00 0.00 H new ATOM 0 HA PHE A 48 -5.536 -31.712 4.861 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -7.857 -31.411 3.735 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -6.965 -31.032 2.275 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.048 -33.653 4.952 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -6.457 -32.768 0.827 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -6.810 -36.051 4.474 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.222 -35.166 0.345 1.00 0.00 H new ATOM 0 HZ PHE A 48 -6.399 -36.812 2.168 1.00 0.00 H new ATOM 772 N CYS A 49 -4.506 -29.747 2.423 1.00 0.00 N ATOM 773 CA CYS A 49 -3.376 -29.455 1.548 1.00 0.00 C ATOM 774 C CYS A 49 -2.152 -29.042 2.360 1.00 0.00 C ATOM 775 O CYS A 49 -1.017 -29.319 1.973 1.00 0.00 O ATOM 776 CB CYS A 49 -3.743 -28.348 0.558 1.00 0.00 C ATOM 777 SG CYS A 49 -2.378 -27.828 -0.507 1.00 0.00 S ATOM 0 H CYS A 49 -5.259 -29.060 2.383 1.00 0.00 H new ATOM 0 HA CYS A 49 -3.133 -30.362 0.994 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -4.566 -28.693 -0.067 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -4.105 -27.483 1.114 1.00 0.00 H new ATOM 0 HG CYS A 49 -2.161 -28.738 -1.410 1.00 0.00 H new ATOM 783 N GLU A 50 -2.392 -28.377 3.486 1.00 0.00 N ATOM 784 CA GLU A 50 -1.308 -27.925 4.350 1.00 0.00 C ATOM 785 C GLU A 50 -0.723 -29.089 5.145 1.00 0.00 C ATOM 786 O GLU A 50 0.395 -29.007 5.655 1.00 0.00 O ATOM 787 CB GLU A 50 -1.809 -26.840 5.307 1.00 0.00 C ATOM 788 CG GLU A 50 -2.060 -27.343 6.719 1.00 0.00 C ATOM 789 CD GLU A 50 -0.801 -27.361 7.564 1.00 0.00 C ATOM 790 OE1 GLU A 50 0.157 -26.639 7.218 1.00 0.00 O ATOM 791 OE2 GLU A 50 -0.775 -28.097 8.573 1.00 0.00 O ATOM 0 H GLU A 50 -3.326 -28.140 3.821 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.523 -27.509 3.718 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.078 -26.033 5.343 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.732 -26.417 4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -2.806 -26.710 7.199 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -2.477 -28.349 6.674 1.00 0.00 H new ATOM 798 N LEU A 51 -1.487 -30.171 5.245 1.00 0.00 N ATOM 799 CA LEU A 51 -1.046 -31.353 5.978 1.00 0.00 C ATOM 800 C LEU A 51 -0.220 -32.271 5.083 1.00 0.00 C ATOM 801 O LEU A 51 0.932 -32.582 5.390 1.00 0.00 O ATOM 802 CB LEU A 51 -2.252 -32.113 6.533 1.00 0.00 C ATOM 803 CG LEU A 51 -2.347 -32.201 8.057 1.00 0.00 C ATOM 804 CD1 LEU A 51 -2.908 -30.910 8.632 1.00 0.00 C ATOM 805 CD2 LEU A 51 -3.204 -33.388 8.470 1.00 0.00 C ATOM 0 H LEU A 51 -2.414 -30.255 4.828 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.419 -31.024 6.807 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.159 -31.638 6.159 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.234 -33.126 6.131 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.344 -32.347 8.457 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.968 -30.991 9.717 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.255 -30.079 8.366 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.904 -30.733 8.225 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.261 -33.435 9.558 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.207 -33.273 8.059 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.759 -34.308 8.090 1.00 0.00 H new ATOM 817 N CYS A 52 -0.814 -32.701 3.976 1.00 0.00 N ATOM 818 CA CYS A 52 -0.133 -33.583 3.035 1.00 0.00 C ATOM 819 C CYS A 52 0.836 -32.797 2.157 1.00 0.00 C ATOM 820 O CYS A 52 1.743 -33.366 1.551 1.00 0.00 O ATOM 821 CB CYS A 52 -1.152 -34.316 2.161 1.00 0.00 C ATOM 822 SG CYS A 52 -0.818 -36.082 1.961 1.00 0.00 S ATOM 0 H CYS A 52 -1.766 -32.453 3.708 1.00 0.00 H new ATOM 0 HA CYS A 52 0.436 -34.315 3.608 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -2.144 -34.192 2.596 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.174 -33.848 1.177 1.00 0.00 H new ATOM 0 HG CYS A 52 -1.735 -36.614 1.208 1.00 0.00 H new ATOM 828 N GLY A 53 0.635 -31.484 2.091 1.00 0.00 N ATOM 829 CA GLY A 53 1.497 -30.641 1.283 1.00 0.00 C ATOM 830 C GLY A 53 1.715 -31.200 -0.109 1.00 0.00 C ATOM 831 O GLY A 53 2.740 -30.935 -0.738 1.00 0.00 O ATOM 0 H GLY A 53 -0.109 -30.989 2.583 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.059 -29.646 1.207 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.460 -30.528 1.781 1.00 0.00 H new ATOM 835 N TYR A 54 0.751 -31.977 -0.590 1.00 0.00 N ATOM 836 CA TYR A 54 0.844 -32.578 -1.915 1.00 0.00 C ATOM 837 C TYR A 54 1.007 -31.507 -2.990 1.00 0.00 C ATOM 838 O TYR A 54 1.117 -30.320 -2.686 1.00 0.00 O ATOM 839 CB TYR A 54 -0.399 -33.422 -2.204 1.00 0.00 C ATOM 840 CG TYR A 54 -1.692 -32.754 -1.794 1.00 0.00 C ATOM 841 CD1 TYR A 54 -2.022 -31.489 -2.264 1.00 0.00 C ATOM 842 CD2 TYR A 54 -2.583 -33.388 -0.937 1.00 0.00 C ATOM 843 CE1 TYR A 54 -3.203 -30.874 -1.892 1.00 0.00 C ATOM 844 CE2 TYR A 54 -3.766 -32.782 -0.561 1.00 0.00 C ATOM 845 CZ TYR A 54 -4.071 -31.525 -1.040 1.00 0.00 C ATOM 846 OH TYR A 54 -5.248 -30.917 -0.667 1.00 0.00 O ATOM 0 H TYR A 54 -0.104 -32.205 -0.082 1.00 0.00 H new ATOM 0 HA TYR A 54 1.724 -33.221 -1.933 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.437 -33.645 -3.270 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.310 -34.375 -1.682 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.344 -30.977 -2.931 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -2.347 -34.371 -0.558 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -3.445 -29.890 -2.266 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.448 -33.290 0.104 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.552 -30.325 -1.386 1.00 0.00 H new ATOM 856 N SER A 55 1.020 -31.938 -4.247 1.00 0.00 N ATOM 857 CA SER A 55 1.173 -31.017 -5.368 1.00 0.00 C ATOM 858 C SER A 55 -0.185 -30.658 -5.964 1.00 0.00 C ATOM 859 O SER A 55 -1.172 -31.366 -5.760 1.00 0.00 O ATOM 860 CB SER A 55 2.068 -31.635 -6.444 1.00 0.00 C ATOM 861 OG SER A 55 2.705 -30.631 -7.215 1.00 0.00 O ATOM 0 H SER A 55 0.927 -32.918 -4.515 1.00 0.00 H new ATOM 0 HA SER A 55 1.640 -30.105 -4.997 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.820 -32.270 -5.976 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.471 -32.274 -7.095 1.00 0.00 H new ATOM 0 HG SER A 55 3.273 -31.051 -7.895 1.00 0.00 H new ATOM 867 N ARG A 56 -0.227 -29.554 -6.702 1.00 0.00 N ATOM 868 CA ARG A 56 -1.463 -29.099 -7.327 1.00 0.00 C ATOM 869 C ARG A 56 -2.044 -30.180 -8.233 1.00 0.00 C ATOM 870 O ARG A 56 -3.261 -30.302 -8.369 1.00 0.00 O ATOM 871 CB ARG A 56 -1.212 -27.824 -8.134 1.00 0.00 C ATOM 872 CG ARG A 56 -2.485 -27.129 -8.587 1.00 0.00 C ATOM 873 CD ARG A 56 -2.699 -27.277 -10.085 1.00 0.00 C ATOM 874 NE ARG A 56 -3.891 -26.568 -10.541 1.00 0.00 N ATOM 875 CZ ARG A 56 -4.441 -26.746 -11.737 1.00 0.00 C ATOM 876 NH1 ARG A 56 -3.908 -27.608 -12.593 1.00 0.00 N ATOM 877 NH2 ARG A 56 -5.526 -26.063 -12.079 1.00 0.00 N ATOM 0 H ARG A 56 0.581 -28.958 -6.882 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.183 -28.885 -6.537 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -0.625 -27.132 -7.530 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.612 -28.071 -9.010 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -3.339 -27.547 -8.054 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -2.435 -26.071 -8.328 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -1.826 -26.896 -10.615 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.788 -28.334 -10.336 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.326 -25.899 -9.906 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.074 -28.135 -12.333 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.332 -27.743 -13.511 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.939 -25.400 -11.423 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.947 -26.201 -12.998 1.00 0.00 H new ATOM 891 N ALA A 57 -1.165 -30.963 -8.851 1.00 0.00 N ATOM 892 CA ALA A 57 -1.591 -32.035 -9.742 1.00 0.00 C ATOM 893 C ALA A 57 -2.490 -33.029 -9.014 1.00 0.00 C ATOM 894 O ALA A 57 -3.339 -33.675 -9.627 1.00 0.00 O ATOM 895 CB ALA A 57 -0.380 -32.746 -10.328 1.00 0.00 C ATOM 0 H ALA A 57 -0.154 -30.875 -8.751 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.167 -31.592 -10.555 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.713 -33.544 -10.992 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.223 -32.034 -10.891 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.218 -33.170 -9.522 1.00 0.00 H new ATOM 901 N GLU A 58 -2.295 -33.148 -7.705 1.00 0.00 N ATOM 902 CA GLU A 58 -3.088 -34.065 -6.895 1.00 0.00 C ATOM 903 C GLU A 58 -4.396 -33.413 -6.457 1.00 0.00 C ATOM 904 O GLU A 58 -5.408 -34.089 -6.269 1.00 0.00 O ATOM 905 CB GLU A 58 -2.294 -34.515 -5.667 1.00 0.00 C ATOM 906 CG GLU A 58 -1.545 -35.821 -5.872 1.00 0.00 C ATOM 907 CD GLU A 58 -0.652 -36.171 -4.698 1.00 0.00 C ATOM 908 OE1 GLU A 58 -1.147 -36.811 -3.746 1.00 0.00 O ATOM 909 OE2 GLU A 58 0.542 -35.806 -4.730 1.00 0.00 O ATOM 0 H GLU A 58 -1.595 -32.621 -7.183 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.323 -34.937 -7.506 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.581 -33.735 -5.400 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.976 -34.626 -4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -2.262 -36.626 -6.031 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.940 -35.751 -6.776 1.00 0.00 H new ATOM 916 N VAL A 59 -4.368 -32.094 -6.295 1.00 0.00 N ATOM 917 CA VAL A 59 -5.550 -31.348 -5.880 1.00 0.00 C ATOM 918 C VAL A 59 -6.701 -31.555 -6.858 1.00 0.00 C ATOM 919 O VAL A 59 -7.867 -31.378 -6.505 1.00 0.00 O ATOM 920 CB VAL A 59 -5.252 -29.842 -5.765 1.00 0.00 C ATOM 921 CG1 VAL A 59 -6.514 -29.074 -5.402 1.00 0.00 C ATOM 922 CG2 VAL A 59 -4.154 -29.592 -4.743 1.00 0.00 C ATOM 0 H VAL A 59 -3.539 -31.520 -6.445 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.837 -31.729 -4.900 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.903 -29.484 -6.734 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.284 -28.011 -5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.268 -29.227 -6.174 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.896 -29.433 -4.446 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.957 -28.522 -4.675 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.472 -29.965 -3.769 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.246 -30.110 -5.051 1.00 0.00 H new ATOM 932 N MET A 60 -6.366 -31.930 -8.087 1.00 0.00 N ATOM 933 CA MET A 60 -7.373 -32.163 -9.116 1.00 0.00 C ATOM 934 C MET A 60 -7.984 -33.553 -8.975 1.00 0.00 C ATOM 935 O MET A 60 -8.813 -33.961 -9.787 1.00 0.00 O ATOM 936 CB MET A 60 -6.758 -32.002 -10.508 1.00 0.00 C ATOM 937 CG MET A 60 -5.881 -33.172 -10.923 1.00 0.00 C ATOM 938 SD MET A 60 -6.633 -34.178 -12.217 1.00 0.00 S ATOM 939 CE MET A 60 -5.528 -33.849 -13.587 1.00 0.00 C ATOM 0 H MET A 60 -5.405 -32.079 -8.395 1.00 0.00 H new ATOM 0 HA MET A 60 -8.164 -31.424 -8.988 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.558 -31.881 -11.238 1.00 0.00 H new ATOM 0 HB3 MET A 60 -6.165 -31.088 -10.531 1.00 0.00 H new ATOM 0 HG2 MET A 60 -4.920 -32.795 -11.273 1.00 0.00 H new ATOM 0 HG3 MET A 60 -5.680 -33.797 -10.053 1.00 0.00 H new ATOM 0 HE1 MET A 60 -5.862 -34.402 -14.465 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.530 -32.782 -13.808 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.518 -34.163 -13.323 1.00 0.00 H new ATOM 949 N GLN A 61 -7.567 -34.275 -7.940 1.00 0.00 N ATOM 950 CA GLN A 61 -8.073 -35.621 -7.695 1.00 0.00 C ATOM 951 C GLN A 61 -7.530 -36.175 -6.382 1.00 0.00 C ATOM 952 O GLN A 61 -6.588 -36.967 -6.373 1.00 0.00 O ATOM 953 CB GLN A 61 -7.694 -36.550 -8.849 1.00 0.00 C ATOM 954 CG GLN A 61 -8.193 -37.975 -8.673 1.00 0.00 C ATOM 955 CD GLN A 61 -7.162 -39.009 -9.081 1.00 0.00 C ATOM 956 OE1 GLN A 61 -6.249 -39.327 -8.319 1.00 0.00 O ATOM 957 NE2 GLN A 61 -7.303 -39.540 -10.290 1.00 0.00 N ATOM 0 H GLN A 61 -6.881 -33.951 -7.258 1.00 0.00 H new ATOM 0 HA GLN A 61 -9.159 -35.566 -7.625 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.097 -36.145 -9.777 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -6.609 -36.564 -8.952 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -8.468 -38.133 -7.630 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -9.097 -38.115 -9.266 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -8.075 -39.247 -10.889 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -6.639 -40.241 -10.620 1.00 0.00 H new ATOM 966 N ARG A 62 -8.131 -35.753 -5.274 1.00 0.00 N ATOM 967 CA ARG A 62 -7.707 -36.207 -3.955 1.00 0.00 C ATOM 968 C ARG A 62 -8.570 -37.370 -3.476 1.00 0.00 C ATOM 969 O ARG A 62 -9.784 -37.400 -3.680 1.00 0.00 O ATOM 970 CB ARG A 62 -7.780 -35.056 -2.949 1.00 0.00 C ATOM 971 CG ARG A 62 -7.082 -33.791 -3.420 1.00 0.00 C ATOM 972 CD ARG A 62 -8.009 -32.587 -3.356 1.00 0.00 C ATOM 973 NE ARG A 62 -9.251 -32.813 -4.090 1.00 0.00 N ATOM 974 CZ ARG A 62 -10.016 -31.834 -4.560 1.00 0.00 C ATOM 975 NH1 ARG A 62 -9.667 -30.569 -4.374 1.00 0.00 N ATOM 976 NH2 ARG A 62 -11.132 -32.121 -5.218 1.00 0.00 N ATOM 0 H ARG A 62 -8.913 -35.098 -5.264 1.00 0.00 H new ATOM 0 HA ARG A 62 -6.675 -36.550 -4.031 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.826 -34.829 -2.745 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -7.334 -35.378 -2.008 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.203 -33.608 -2.803 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.731 -33.927 -4.443 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.239 -32.362 -2.315 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.499 -31.715 -3.766 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.547 -33.776 -4.251 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.809 -30.346 -3.869 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.256 -29.819 -4.736 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.403 -33.094 -5.363 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.719 -31.369 -5.579 1.00 0.00 H new ATOM 990 N PRO A 63 -7.931 -38.352 -2.823 1.00 0.00 N ATOM 991 CA PRO A 63 -8.621 -39.536 -2.302 1.00 0.00 C ATOM 992 C PRO A 63 -9.525 -39.207 -1.120 1.00 0.00 C ATOM 993 O PRO A 63 -9.186 -38.372 -0.280 1.00 0.00 O ATOM 994 CB PRO A 63 -7.474 -40.449 -1.860 1.00 0.00 C ATOM 995 CG PRO A 63 -6.342 -39.524 -1.575 1.00 0.00 C ATOM 996 CD PRO A 63 -6.485 -38.383 -2.544 1.00 0.00 C ATOM 0 HA PRO A 63 -9.279 -39.985 -3.046 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.746 -41.026 -0.976 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -7.214 -41.164 -2.640 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -6.379 -39.168 -0.545 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -5.384 -40.028 -1.704 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -6.139 -37.444 -2.113 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.904 -38.551 -3.451 1.00 0.00 H new ATOM 1004 N CYS A 64 -10.677 -39.866 -1.061 1.00 0.00 N ATOM 1005 CA CYS A 64 -11.631 -39.642 0.020 1.00 0.00 C ATOM 1006 C CYS A 64 -11.248 -40.445 1.259 1.00 0.00 C ATOM 1007 O CYS A 64 -11.591 -40.076 2.382 1.00 0.00 O ATOM 1008 CB CYS A 64 -13.043 -40.020 -0.432 1.00 0.00 C ATOM 1009 SG CYS A 64 -14.359 -39.287 0.567 1.00 0.00 S ATOM 0 H CYS A 64 -10.973 -40.559 -1.748 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.611 -38.583 0.276 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -13.175 -39.713 -1.469 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.143 -41.105 -0.406 1.00 0.00 H new ATOM 0 HG CYS A 64 -13.972 -39.210 1.806 1.00 0.00 H new ATOM 1015 N THR A 65 -10.536 -41.547 1.046 1.00 0.00 N ATOM 1016 CA THR A 65 -10.108 -42.404 2.145 1.00 0.00 C ATOM 1017 C THR A 65 -8.738 -41.987 2.666 1.00 0.00 C ATOM 1018 O THR A 65 -8.170 -42.643 3.540 1.00 0.00 O ATOM 1019 CB THR A 65 -10.054 -43.883 1.715 1.00 0.00 C ATOM 1020 OG1 THR A 65 -11.194 -44.202 0.910 1.00 0.00 O ATOM 1021 CG2 THR A 65 -10.011 -44.798 2.929 1.00 0.00 C ATOM 0 H THR A 65 -10.244 -41.867 0.123 1.00 0.00 H new ATOM 0 HA THR A 65 -10.845 -42.291 2.940 1.00 0.00 H new ATOM 0 HB THR A 65 -9.145 -44.036 1.132 1.00 0.00 H new ATOM 0 HG1 THR A 65 -11.151 -45.143 0.640 1.00 0.00 H new ATOM 0 HG21 THR A 65 -9.973 -45.837 2.601 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.125 -44.573 3.523 1.00 0.00 H new ATOM 0 HG23 THR A 65 -10.904 -44.641 3.535 1.00 0.00 H new ATOM 1029 N CYS A 66 -8.213 -40.894 2.126 1.00 0.00 N ATOM 1030 CA CYS A 66 -6.907 -40.389 2.538 1.00 0.00 C ATOM 1031 C CYS A 66 -5.857 -41.493 2.487 1.00 0.00 C ATOM 1032 O CYS A 66 -4.976 -41.566 3.345 1.00 0.00 O ATOM 1033 CB CYS A 66 -6.985 -39.806 3.950 1.00 0.00 C ATOM 1034 SG CYS A 66 -8.373 -38.677 4.207 1.00 0.00 S ATOM 0 H CYS A 66 -8.670 -40.340 1.402 1.00 0.00 H new ATOM 0 HA CYS A 66 -6.613 -39.602 1.844 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -7.059 -40.625 4.666 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -6.056 -39.278 4.165 1.00 0.00 H new ATOM 0 HG CYS A 66 -8.210 -38.037 5.327 1.00 0.00 H new ATOM 1040 N ASP A 67 -5.957 -42.352 1.478 1.00 0.00 N ATOM 1041 CA ASP A 67 -5.015 -43.453 1.316 1.00 0.00 C ATOM 1042 C ASP A 67 -3.580 -42.938 1.261 1.00 0.00 C ATOM 1043 O ASP A 67 -2.668 -43.551 1.817 1.00 0.00 O ATOM 1044 CB ASP A 67 -5.336 -44.243 0.045 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.170 -45.095 -0.416 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -3.805 -46.044 0.309 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -3.622 -44.813 -1.502 1.00 0.00 O ATOM 0 H ASP A 67 -6.681 -42.307 0.761 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.112 -44.112 2.179 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -6.200 -44.882 0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -5.613 -43.550 -0.750 1.00 0.00 H new ATOM 1052 N PHE A 68 -3.387 -41.810 0.586 1.00 0.00 N ATOM 1053 CA PHE A 68 -2.063 -41.214 0.456 1.00 0.00 C ATOM 1054 C PHE A 68 -1.537 -40.757 1.814 1.00 0.00 C ATOM 1055 O PHE A 68 -0.372 -40.379 1.946 1.00 0.00 O ATOM 1056 CB PHE A 68 -2.106 -40.029 -0.512 1.00 0.00 C ATOM 1057 CG PHE A 68 -1.515 -40.334 -1.859 1.00 0.00 C ATOM 1058 CD1 PHE A 68 -1.753 -41.552 -2.475 1.00 0.00 C ATOM 1059 CD2 PHE A 68 -0.722 -39.402 -2.508 1.00 0.00 C ATOM 1060 CE1 PHE A 68 -1.211 -41.835 -3.714 1.00 0.00 C ATOM 1061 CE2 PHE A 68 -0.178 -39.680 -3.748 1.00 0.00 C ATOM 1062 CZ PHE A 68 -0.422 -40.898 -4.351 1.00 0.00 C ATOM 0 H PHE A 68 -4.131 -41.290 0.120 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.388 -41.973 0.061 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.141 -39.713 -0.641 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.569 -39.189 -0.070 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.369 -42.289 -1.981 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.527 -38.448 -2.040 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.404 -42.788 -4.184 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.438 -38.945 -4.245 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.004 -41.117 -5.319 1.00 0.00 H new ATOM 1072 N LEU A 69 -2.404 -40.794 2.820 1.00 0.00 N ATOM 1073 CA LEU A 69 -2.028 -40.384 4.168 1.00 0.00 C ATOM 1074 C LEU A 69 -1.851 -41.596 5.077 1.00 0.00 C ATOM 1075 O LEU A 69 -1.350 -41.479 6.196 1.00 0.00 O ATOM 1076 CB LEU A 69 -3.087 -39.446 4.751 1.00 0.00 C ATOM 1077 CG LEU A 69 -2.948 -37.968 4.386 1.00 0.00 C ATOM 1078 CD1 LEU A 69 -4.306 -37.371 4.051 1.00 0.00 C ATOM 1079 CD2 LEU A 69 -2.290 -37.198 5.522 1.00 0.00 C ATOM 0 H LEU A 69 -3.371 -41.104 2.728 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.076 -39.856 4.108 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.068 -39.790 4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.064 -39.535 5.837 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.312 -37.889 3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.187 -36.318 3.794 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.739 -37.905 3.205 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.966 -37.461 4.914 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.199 -36.148 5.245 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.900 -37.285 6.421 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.299 -37.610 5.715 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.264 -42.761 4.588 1.00 0.00 N ATOM 1092 CA HIS A 70 -2.148 -43.996 5.355 1.00 0.00 C ATOM 1093 C HIS A 70 -0.914 -44.786 4.929 1.00 0.00 C ATOM 1094 O HIS A 70 -0.505 -44.741 3.770 1.00 0.00 O ATOM 1095 CB HIS A 70 -3.402 -44.852 5.176 1.00 0.00 C ATOM 1096 CG HIS A 70 -3.257 -46.246 5.705 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -3.764 -46.644 6.924 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -2.660 -47.337 5.173 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -3.483 -47.920 7.120 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -2.813 -48.364 6.072 1.00 0.00 N ATOM 0 H HIS A 70 -2.682 -42.876 3.665 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.044 -43.733 6.408 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.238 -44.366 5.679 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.652 -44.899 4.116 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -2.157 -47.391 4.219 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.755 -48.501 7.989 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -2.466 -49.315 5.950 1.00 0.00 H new ATOM 1108 N GLY A 71 -0.324 -45.510 5.876 1.00 0.00 N ATOM 1109 CA GLY A 71 0.857 -46.299 5.580 1.00 0.00 C ATOM 1110 C GLY A 71 0.763 -47.711 6.123 1.00 0.00 C ATOM 1111 O GLY A 71 -0.208 -48.081 6.783 1.00 0.00 O ATOM 0 H GLY A 71 -0.644 -45.564 6.843 1.00 0.00 H new ATOM 0 HA2 GLY A 71 1.003 -46.337 4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.733 -45.808 6.003 1.00 0.00 H new ATOM 1115 N PRO A 72 1.791 -48.526 5.843 1.00 0.00 N ATOM 1116 CA PRO A 72 1.843 -49.919 6.298 1.00 0.00 C ATOM 1117 C PRO A 72 2.038 -50.029 7.806 1.00 0.00 C ATOM 1118 O PRO A 72 2.089 -51.129 8.356 1.00 0.00 O ATOM 1119 CB PRO A 72 3.055 -50.489 5.558 1.00 0.00 C ATOM 1120 CG PRO A 72 3.918 -49.307 5.279 1.00 0.00 C ATOM 1121 CD PRO A 72 2.981 -48.151 5.061 1.00 0.00 C ATOM 0 HA PRO A 72 0.913 -50.450 6.093 1.00 0.00 H new ATOM 0 HB2 PRO A 72 3.579 -51.227 6.165 1.00 0.00 H new ATOM 0 HB3 PRO A 72 2.757 -50.988 4.636 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.592 -49.111 6.113 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.539 -49.477 4.400 1.00 0.00 H new ATOM 0 HD2 PRO A 72 3.412 -47.213 5.410 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.743 -48.020 4.005 1.00 0.00 H new ATOM 1129 N ARG A 73 2.147 -48.882 8.469 1.00 0.00 N ATOM 1130 CA ARG A 73 2.338 -48.851 9.914 1.00 0.00 C ATOM 1131 C ARG A 73 1.098 -48.304 10.615 1.00 0.00 C ATOM 1132 O ARG A 73 0.940 -48.451 11.828 1.00 0.00 O ATOM 1133 CB ARG A 73 3.557 -47.997 10.271 1.00 0.00 C ATOM 1134 CG ARG A 73 4.549 -48.702 11.181 1.00 0.00 C ATOM 1135 CD ARG A 73 4.609 -48.048 12.552 1.00 0.00 C ATOM 1136 NE ARG A 73 5.741 -47.132 12.673 1.00 0.00 N ATOM 1137 CZ ARG A 73 5.901 -46.292 13.689 1.00 0.00 C ATOM 1138 NH1 ARG A 73 5.008 -46.253 14.668 1.00 0.00 N ATOM 1139 NH2 ARG A 73 6.958 -45.490 13.728 1.00 0.00 N ATOM 0 H ARG A 73 2.106 -47.963 8.029 1.00 0.00 H new ATOM 0 HA ARG A 73 2.506 -49.873 10.255 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.065 -47.702 9.353 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.219 -47.081 10.756 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.266 -49.749 11.288 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.539 -48.685 10.725 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.682 -47.505 12.735 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.683 -48.819 13.319 1.00 0.00 H new ATOM 0 HE ARG A 73 6.447 -47.138 11.937 1.00 0.00 H new ATOM 0 HH11 ARG A 73 4.196 -46.869 14.642 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.133 -45.607 15.447 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.648 -45.519 12.977 1.00 0.00 H new ATOM 0 HH22 ARG A 73 7.080 -44.845 14.509 1.00 0.00 H new ATOM 1153 N THR A 74 0.219 -47.671 9.844 1.00 0.00 N ATOM 1154 CA THR A 74 -1.006 -47.101 10.389 1.00 0.00 C ATOM 1155 C THR A 74 -2.010 -48.191 10.743 1.00 0.00 C ATOM 1156 O THR A 74 -2.109 -49.204 10.051 1.00 0.00 O ATOM 1157 CB THR A 74 -1.659 -46.119 9.398 1.00 0.00 C ATOM 1158 OG1 THR A 74 -0.815 -44.977 9.212 1.00 0.00 O ATOM 1159 CG2 THR A 74 -3.023 -45.671 9.900 1.00 0.00 C ATOM 0 H THR A 74 0.334 -47.540 8.839 1.00 0.00 H new ATOM 0 HA THR A 74 -0.727 -46.560 11.294 1.00 0.00 H new ATOM 0 HB THR A 74 -1.790 -46.632 8.445 1.00 0.00 H new ATOM 0 HG1 THR A 74 -1.338 -44.159 9.342 1.00 0.00 H new ATOM 0 HG21 THR A 74 -3.465 -44.978 9.184 1.00 0.00 H new ATOM 0 HG22 THR A 74 -3.672 -46.539 10.013 1.00 0.00 H new ATOM 0 HG23 THR A 74 -2.911 -45.174 10.864 1.00 0.00 H new ATOM 1167 N GLN A 75 -2.753 -47.977 11.824 1.00 0.00 N ATOM 1168 CA GLN A 75 -3.751 -48.943 12.269 1.00 0.00 C ATOM 1169 C GLN A 75 -4.679 -49.333 11.123 1.00 0.00 C ATOM 1170 O GLN A 75 -5.112 -48.483 10.345 1.00 0.00 O ATOM 1171 CB GLN A 75 -4.566 -48.369 13.429 1.00 0.00 C ATOM 1172 CG GLN A 75 -3.712 -47.788 14.544 1.00 0.00 C ATOM 1173 CD GLN A 75 -2.507 -48.649 14.865 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -2.645 -49.805 15.269 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -1.315 -48.091 14.688 1.00 0.00 N ATOM 0 H GLN A 75 -2.683 -47.144 12.408 1.00 0.00 H new ATOM 0 HA GLN A 75 -3.229 -49.837 12.610 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.228 -47.592 13.047 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.200 -49.154 13.840 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -3.376 -46.792 14.257 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.321 -47.673 15.441 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -1.246 -47.131 14.352 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.468 -48.623 14.888 1.00 0.00 H new ATOM 1184 N ARG A 76 -4.980 -50.624 11.026 1.00 0.00 N ATOM 1185 CA ARG A 76 -5.855 -51.127 9.974 1.00 0.00 C ATOM 1186 C ARG A 76 -7.306 -50.741 10.244 1.00 0.00 C ATOM 1187 O ARG A 76 -8.052 -50.410 9.322 1.00 0.00 O ATOM 1188 CB ARG A 76 -5.733 -52.648 9.863 1.00 0.00 C ATOM 1189 CG ARG A 76 -5.787 -53.161 8.433 1.00 0.00 C ATOM 1190 CD ARG A 76 -4.497 -53.865 8.044 1.00 0.00 C ATOM 1191 NE ARG A 76 -4.714 -54.875 7.012 1.00 0.00 N ATOM 1192 CZ ARG A 76 -5.358 -56.017 7.225 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -5.846 -56.293 8.427 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -5.515 -56.886 6.235 1.00 0.00 N ATOM 0 H ARG A 76 -4.631 -51.340 11.663 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.546 -50.675 9.032 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -4.794 -52.963 10.318 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.536 -53.111 10.437 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.625 -53.849 8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -5.967 -52.328 7.753 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -3.777 -53.130 7.686 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -4.061 -54.335 8.925 1.00 0.00 H new ATOM 0 HE ARG A 76 -4.351 -54.694 6.076 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -5.727 -55.627 9.191 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -6.340 -57.171 8.588 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -5.141 -56.677 5.309 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -6.010 -57.763 6.400 1.00 0.00 H new ATOM 1208 N ARG A 77 -7.700 -50.788 11.512 1.00 0.00 N ATOM 1209 CA ARG A 77 -9.062 -50.445 11.903 1.00 0.00 C ATOM 1210 C ARG A 77 -9.455 -49.075 11.358 1.00 0.00 C ATOM 1211 O ARG A 77 -10.634 -48.798 11.139 1.00 0.00 O ATOM 1212 CB ARG A 77 -9.196 -50.457 13.427 1.00 0.00 C ATOM 1213 CG ARG A 77 -9.360 -51.850 14.013 1.00 0.00 C ATOM 1214 CD ARG A 77 -10.826 -52.195 14.228 1.00 0.00 C ATOM 1215 NE ARG A 77 -11.021 -53.050 15.395 1.00 0.00 N ATOM 1216 CZ ARG A 77 -10.680 -54.334 15.431 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -10.128 -54.906 14.369 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -10.889 -55.047 16.530 1.00 0.00 N ATOM 0 H ARG A 77 -7.095 -51.060 12.287 1.00 0.00 H new ATOM 0 HA ARG A 77 -9.734 -51.192 11.480 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.314 -49.990 13.865 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -10.054 -49.849 13.713 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -8.907 -52.583 13.345 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.828 -51.912 14.962 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -11.400 -51.277 14.351 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -11.214 -52.697 13.342 1.00 0.00 H new ATOM 0 HE ARG A 77 -11.442 -52.639 16.228 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -9.965 -54.360 13.523 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -9.867 -55.892 14.399 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -11.312 -54.610 17.349 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -10.627 -56.032 16.556 1.00 0.00 H new ATOM 1232 N ALA A 78 -8.459 -48.221 11.142 1.00 0.00 N ATOM 1233 CA ALA A 78 -8.701 -46.881 10.622 1.00 0.00 C ATOM 1234 C ALA A 78 -9.277 -46.936 9.211 1.00 0.00 C ATOM 1235 O ALA A 78 -10.331 -46.361 8.939 1.00 0.00 O ATOM 1236 CB ALA A 78 -7.414 -46.069 10.637 1.00 0.00 C ATOM 0 H ALA A 78 -7.477 -48.434 11.319 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.433 -46.394 11.267 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.609 -45.070 10.246 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.044 -45.992 11.659 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.666 -46.562 10.016 1.00 0.00 H new ATOM 1242 N ALA A 79 -8.580 -47.630 8.318 1.00 0.00 N ATOM 1243 CA ALA A 79 -9.024 -47.761 6.936 1.00 0.00 C ATOM 1244 C ALA A 79 -10.331 -48.542 6.851 1.00 0.00 C ATOM 1245 O ALA A 79 -11.187 -48.247 6.017 1.00 0.00 O ATOM 1246 CB ALA A 79 -7.948 -48.435 6.098 1.00 0.00 C ATOM 0 H ALA A 79 -7.705 -48.111 8.527 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.203 -46.761 6.541 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.293 -48.526 5.068 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.038 -47.836 6.124 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -7.741 -49.427 6.501 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.477 -49.538 7.717 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.680 -50.361 7.740 1.00 0.00 C ATOM 1254 C ALA A 80 -12.883 -49.559 8.226 1.00 0.00 C ATOM 1255 O ALA A 80 -13.936 -49.556 7.588 1.00 0.00 O ATOM 1256 CB ALA A 80 -11.468 -51.583 8.621 1.00 0.00 C ATOM 0 H ALA A 80 -9.777 -49.795 8.413 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.883 -50.692 6.722 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.375 -52.188 8.628 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.640 -52.175 8.230 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -11.237 -51.263 9.637 1.00 0.00 H new ATOM 1262 N GLN A 81 -12.720 -48.882 9.357 1.00 0.00 N ATOM 1263 CA GLN A 81 -13.794 -48.078 9.928 1.00 0.00 C ATOM 1264 C GLN A 81 -14.257 -47.009 8.943 1.00 0.00 C ATOM 1265 O GLN A 81 -15.455 -46.827 8.728 1.00 0.00 O ATOM 1266 CB GLN A 81 -13.333 -47.422 11.231 1.00 0.00 C ATOM 1267 CG GLN A 81 -13.448 -48.331 12.443 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.631 -49.788 12.066 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -14.749 -50.245 11.830 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -12.529 -50.527 12.006 1.00 0.00 N ATOM 0 H GLN A 81 -11.854 -48.874 9.897 1.00 0.00 H new ATOM 0 HA GLN A 81 -14.634 -48.739 10.140 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -12.296 -47.106 11.122 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -13.924 -46.523 11.404 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.552 -48.228 13.056 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -14.291 -48.009 13.055 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.622 -50.107 12.209 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.590 -51.514 11.756 1.00 0.00 H new ATOM 1279 N ILE A 82 -13.299 -46.306 8.348 1.00 0.00 N ATOM 1280 CA ILE A 82 -13.609 -45.256 7.385 1.00 0.00 C ATOM 1281 C ILE A 82 -14.189 -45.841 6.102 1.00 0.00 C ATOM 1282 O ILE A 82 -15.021 -45.217 5.445 1.00 0.00 O ATOM 1283 CB ILE A 82 -12.360 -44.424 7.039 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -12.758 -43.166 6.264 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -11.374 -45.258 6.235 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -12.169 -41.894 6.834 1.00 0.00 C ATOM 0 H ILE A 82 -12.302 -46.444 8.516 1.00 0.00 H new ATOM 0 HA ILE A 82 -14.350 -44.607 7.852 1.00 0.00 H new ATOM 0 HB ILE A 82 -11.876 -44.119 7.967 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -12.439 -43.272 5.227 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -13.845 -43.082 6.256 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -10.497 -44.656 5.998 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -11.071 -46.127 6.819 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -11.847 -45.590 5.311 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -12.493 -41.043 6.235 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.508 -41.765 7.862 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -11.081 -41.957 6.816 1.00 0.00 H new ATOM 1298 N ALA A 83 -13.743 -47.043 5.752 1.00 0.00 N ATOM 1299 CA ALA A 83 -14.221 -47.714 4.549 1.00 0.00 C ATOM 1300 C ALA A 83 -15.680 -48.131 4.696 1.00 0.00 C ATOM 1301 O ALA A 83 -16.524 -47.769 3.876 1.00 0.00 O ATOM 1302 CB ALA A 83 -13.353 -48.925 4.240 1.00 0.00 C ATOM 0 H ALA A 83 -13.052 -47.572 6.284 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.153 -47.010 3.719 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -13.721 -49.416 3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -12.323 -48.604 4.083 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -13.392 -49.623 5.076 1.00 0.00 H new ATOM 1308 N GLN A 84 -15.970 -48.895 5.744 1.00 0.00 N ATOM 1309 CA GLN A 84 -17.328 -49.362 5.997 1.00 0.00 C ATOM 1310 C GLN A 84 -18.261 -48.191 6.290 1.00 0.00 C ATOM 1311 O GLN A 84 -19.432 -48.209 5.914 1.00 0.00 O ATOM 1312 CB GLN A 84 -17.343 -50.346 7.167 1.00 0.00 C ATOM 1313 CG GLN A 84 -18.741 -50.714 7.636 1.00 0.00 C ATOM 1314 CD GLN A 84 -19.502 -51.534 6.613 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -19.684 -52.741 6.779 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -19.953 -50.882 5.548 1.00 0.00 N ATOM 0 H GLN A 84 -15.283 -49.204 6.432 1.00 0.00 H new ATOM 0 HA GLN A 84 -17.683 -49.870 5.100 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -16.817 -51.254 6.873 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -16.791 -49.913 8.002 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -18.672 -51.276 8.568 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -19.299 -49.803 7.854 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -19.779 -49.882 5.451 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -20.473 -51.382 4.827 1.00 0.00 H new ATOM 1325 N ALA A 85 -17.733 -47.175 6.964 1.00 0.00 N ATOM 1326 CA ALA A 85 -18.517 -45.995 7.306 1.00 0.00 C ATOM 1327 C ALA A 85 -18.864 -45.186 6.061 1.00 0.00 C ATOM 1328 O ALA A 85 -19.969 -44.656 5.940 1.00 0.00 O ATOM 1329 CB ALA A 85 -17.763 -45.132 8.306 1.00 0.00 C ATOM 0 H ALA A 85 -16.765 -47.145 7.284 1.00 0.00 H new ATOM 0 HA ALA A 85 -19.449 -46.329 7.761 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -18.360 -44.254 8.552 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -17.572 -45.707 9.212 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -16.815 -44.815 7.871 1.00 0.00 H new ATOM 1335 N LEU A 86 -17.913 -45.094 5.137 1.00 0.00 N ATOM 1336 CA LEU A 86 -18.117 -44.349 3.900 1.00 0.00 C ATOM 1337 C LEU A 86 -19.099 -45.072 2.984 1.00 0.00 C ATOM 1338 O LEU A 86 -19.925 -44.444 2.321 1.00 0.00 O ATOM 1339 CB LEU A 86 -16.784 -44.144 3.179 1.00 0.00 C ATOM 1340 CG LEU A 86 -16.806 -43.186 1.987 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -15.808 -42.057 2.192 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -16.510 -43.935 0.696 1.00 0.00 C ATOM 0 H LEU A 86 -16.993 -45.526 5.222 1.00 0.00 H new ATOM 0 HA LEU A 86 -18.537 -43.376 4.156 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -16.056 -43.776 3.902 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -16.428 -45.114 2.833 1.00 0.00 H new ATOM 0 HG LEU A 86 -17.803 -42.752 1.911 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.837 -41.385 1.334 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -16.065 -41.504 3.095 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -14.805 -42.472 2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -16.530 -43.238 -0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -15.525 -44.397 0.761 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -17.263 -44.708 0.543 1.00 0.00 H new ATOM 1354 N LEU A 87 -19.005 -46.397 2.953 1.00 0.00 N ATOM 1355 CA LEU A 87 -19.886 -47.208 2.120 1.00 0.00 C ATOM 1356 C LEU A 87 -21.349 -46.955 2.469 1.00 0.00 C ATOM 1357 O LEU A 87 -22.231 -47.078 1.619 1.00 0.00 O ATOM 1358 CB LEU A 87 -19.558 -48.692 2.289 1.00 0.00 C ATOM 1359 CG LEU A 87 -20.441 -49.668 1.510 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -19.645 -50.898 1.102 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -21.654 -50.066 2.338 1.00 0.00 C ATOM 0 H LEU A 87 -18.327 -46.933 3.495 1.00 0.00 H new ATOM 0 HA LEU A 87 -19.725 -46.924 1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -18.522 -48.851 1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -19.624 -48.940 3.348 1.00 0.00 H new ATOM 0 HG LEU A 87 -20.791 -49.170 0.606 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -20.289 -51.581 0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -18.808 -50.597 0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -19.266 -51.398 1.993 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -22.271 -50.761 1.768 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -21.324 -50.545 3.260 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -22.237 -49.177 2.580 1.00 0.00 H new ATOM 1373 N GLY A 88 -21.600 -46.600 3.725 1.00 0.00 N ATOM 1374 CA GLY A 88 -22.958 -46.333 4.164 1.00 0.00 C ATOM 1375 C GLY A 88 -23.228 -44.853 4.345 1.00 0.00 C ATOM 1376 O GLY A 88 -24.381 -44.434 4.447 1.00 0.00 O ATOM 0 H GLY A 88 -20.887 -46.492 4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -23.659 -46.741 3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -23.140 -46.850 5.106 1.00 0.00 H new ATOM 1380 N ALA A 89 -22.164 -44.059 4.388 1.00 0.00 N ATOM 1381 CA ALA A 89 -22.292 -42.617 4.558 1.00 0.00 C ATOM 1382 C ALA A 89 -23.118 -42.282 5.795 1.00 0.00 C ATOM 1383 O ALA A 89 -23.962 -41.387 5.765 1.00 0.00 O ATOM 1384 CB ALA A 89 -22.917 -41.993 3.319 1.00 0.00 C ATOM 0 H ALA A 89 -21.203 -44.390 4.307 1.00 0.00 H new ATOM 0 HA ALA A 89 -21.294 -42.202 4.696 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -23.007 -40.916 3.460 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -22.287 -42.194 2.453 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -23.906 -42.421 3.156 1.00 0.00 H new ATOM 1390 N GLU A 90 -22.869 -43.006 6.882 1.00 0.00 N ATOM 1391 CA GLU A 90 -23.592 -42.785 8.129 1.00 0.00 C ATOM 1392 C GLU A 90 -22.710 -42.071 9.149 1.00 0.00 C ATOM 1393 O GLU A 90 -21.484 -42.145 9.084 1.00 0.00 O ATOM 1394 CB GLU A 90 -24.081 -44.116 8.703 1.00 0.00 C ATOM 1395 CG GLU A 90 -24.837 -43.972 10.013 1.00 0.00 C ATOM 1396 CD GLU A 90 -25.339 -45.301 10.546 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -24.501 -46.125 10.967 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -26.569 -45.516 10.542 1.00 0.00 O ATOM 0 H GLU A 90 -22.173 -43.750 6.924 1.00 0.00 H new ATOM 0 HA GLU A 90 -24.453 -42.153 7.914 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -24.727 -44.602 7.972 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -23.224 -44.772 8.858 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -24.186 -43.510 10.755 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -25.683 -43.300 9.868 1.00 0.00 H new ATOM 1405 N GLU A 91 -23.346 -41.379 10.090 1.00 0.00 N ATOM 1406 CA GLU A 91 -22.620 -40.651 11.123 1.00 0.00 C ATOM 1407 C GLU A 91 -21.700 -41.585 11.904 1.00 0.00 C ATOM 1408 O GLU A 91 -22.150 -42.338 12.768 1.00 0.00 O ATOM 1409 CB GLU A 91 -23.599 -39.965 12.079 1.00 0.00 C ATOM 1410 CG GLU A 91 -24.602 -40.917 12.709 1.00 0.00 C ATOM 1411 CD GLU A 91 -26.037 -40.479 12.492 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -26.390 -40.154 11.339 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -26.807 -40.461 13.475 1.00 0.00 O ATOM 0 H GLU A 91 -24.361 -41.308 10.158 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.009 -39.893 10.634 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -23.035 -39.469 12.869 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -24.139 -39.188 11.537 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -24.463 -41.914 12.291 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -24.406 -40.990 13.779 1.00 0.00 H new ATOM 1420 N ARG A 92 -20.409 -41.531 11.593 1.00 0.00 N ATOM 1421 CA ARG A 92 -19.425 -42.373 12.263 1.00 0.00 C ATOM 1422 C ARG A 92 -18.045 -41.723 12.237 1.00 0.00 C ATOM 1423 O ARG A 92 -17.655 -41.108 11.245 1.00 0.00 O ATOM 1424 CB ARG A 92 -19.365 -43.750 11.599 1.00 0.00 C ATOM 1425 CG ARG A 92 -18.131 -44.554 11.975 1.00 0.00 C ATOM 1426 CD ARG A 92 -18.095 -44.854 13.465 1.00 0.00 C ATOM 1427 NE ARG A 92 -17.838 -46.267 13.733 1.00 0.00 N ATOM 1428 CZ ARG A 92 -18.093 -46.853 14.897 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -18.611 -46.151 15.897 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -17.832 -48.143 15.064 1.00 0.00 N ATOM 0 H ARG A 92 -20.020 -40.913 10.881 1.00 0.00 H new ATOM 0 HA ARG A 92 -19.732 -42.491 13.302 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -20.255 -44.316 11.874 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -19.390 -43.624 10.517 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -18.119 -45.489 11.414 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -17.235 -44.001 11.692 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -17.322 -44.249 13.938 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -19.045 -44.566 13.916 1.00 0.00 H new ATOM 0 HE ARG A 92 -17.441 -46.835 12.985 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -18.814 -45.159 15.772 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -18.806 -46.603 16.790 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -17.435 -48.686 14.298 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -18.029 -48.591 15.959 1.00 0.00 H new ATOM 1444 N LYS A 93 -17.311 -41.863 13.335 1.00 0.00 N ATOM 1445 CA LYS A 93 -15.974 -41.291 13.440 1.00 0.00 C ATOM 1446 C LYS A 93 -14.914 -42.388 13.482 1.00 0.00 C ATOM 1447 O LYS A 93 -15.156 -43.479 13.997 1.00 0.00 O ATOM 1448 CB LYS A 93 -15.867 -40.417 14.692 1.00 0.00 C ATOM 1449 CG LYS A 93 -15.639 -41.208 15.969 1.00 0.00 C ATOM 1450 CD LYS A 93 -15.857 -40.350 17.203 1.00 0.00 C ATOM 1451 CE LYS A 93 -15.426 -41.074 18.469 1.00 0.00 C ATOM 1452 NZ LYS A 93 -14.872 -40.136 19.484 1.00 0.00 N ATOM 0 H LYS A 93 -17.620 -42.368 14.166 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.800 -40.675 12.558 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -15.048 -39.709 14.562 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.781 -39.832 14.795 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.316 -42.062 15.995 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.624 -41.605 15.976 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -15.296 -39.421 17.105 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.910 -40.080 17.278 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -16.279 -41.604 18.892 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -14.676 -41.824 18.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -14.590 -40.669 20.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -14.042 -39.648 19.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -15.596 -39.435 19.741 1.00 0.00 H new ATOM 1466 N VAL A 94 -13.739 -42.090 12.937 1.00 0.00 N ATOM 1467 CA VAL A 94 -12.641 -43.050 12.914 1.00 0.00 C ATOM 1468 C VAL A 94 -11.298 -42.352 13.096 1.00 0.00 C ATOM 1469 O VAL A 94 -11.012 -41.354 12.436 1.00 0.00 O ATOM 1470 CB VAL A 94 -12.620 -43.847 11.596 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -12.640 -42.905 10.402 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -11.404 -44.759 11.546 1.00 0.00 C ATOM 0 H VAL A 94 -13.523 -41.192 12.505 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.804 -43.739 13.743 1.00 0.00 H new ATOM 0 HB VAL A 94 -13.514 -44.469 11.552 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.625 -43.486 9.480 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.544 -42.297 10.433 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -11.765 -42.256 10.436 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.404 -45.315 10.608 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -10.496 -44.159 11.612 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.439 -45.458 12.382 1.00 0.00 H new ATOM 1482 N GLU A 95 -10.477 -42.886 13.994 1.00 0.00 N ATOM 1483 CA GLU A 95 -9.162 -42.314 14.262 1.00 0.00 C ATOM 1484 C GLU A 95 -8.096 -42.969 13.389 1.00 0.00 C ATOM 1485 O GLU A 95 -7.922 -44.188 13.412 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.801 -42.481 15.740 1.00 0.00 C ATOM 1487 CG GLU A 95 -8.916 -43.913 16.236 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.478 -44.066 17.680 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.850 -43.209 18.508 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -7.763 -45.045 17.982 1.00 0.00 O ATOM 0 H GLU A 95 -10.698 -43.713 14.548 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.200 -41.251 14.023 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.781 -42.131 15.898 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.452 -41.844 16.339 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.949 -44.247 16.136 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.309 -44.562 15.605 1.00 0.00 H new ATOM 1497 N ILE A 96 -7.385 -42.151 12.621 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.335 -42.649 11.741 1.00 0.00 C ATOM 1499 C ILE A 96 -5.040 -41.867 11.932 1.00 0.00 C ATOM 1500 O ILE A 96 -5.060 -40.693 12.299 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.756 -42.569 10.261 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -8.174 -43.115 10.081 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.773 -43.335 9.389 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -9.188 -42.055 9.713 1.00 0.00 C ATOM 0 H ILE A 96 -7.517 -41.140 12.590 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.169 -43.693 12.008 1.00 0.00 H new ATOM 0 HB ILE A 96 -6.748 -41.524 9.952 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.164 -43.881 9.306 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.487 -43.601 11.005 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -6.084 -43.269 8.346 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.777 -42.905 9.499 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -5.752 -44.381 9.696 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.170 -42.514 9.602 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -9.227 -41.301 10.499 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -8.898 -41.585 8.773 1.00 0.00 H new ATOM 1516 N ALA A 97 -3.914 -42.527 11.679 1.00 0.00 N ATOM 1517 CA ALA A 97 -2.609 -41.893 11.820 1.00 0.00 C ATOM 1518 C ALA A 97 -2.191 -41.205 10.525 1.00 0.00 C ATOM 1519 O ALA A 97 -1.779 -41.860 9.567 1.00 0.00 O ATOM 1520 CB ALA A 97 -1.566 -42.920 12.235 1.00 0.00 C ATOM 0 H ALA A 97 -3.880 -43.500 11.375 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.683 -41.132 12.597 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.596 -42.433 12.337 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.851 -43.363 13.189 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.502 -43.701 11.477 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.300 -39.881 10.502 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.934 -39.104 9.323 1.00 0.00 C ATOM 1528 C PHE A 98 -0.555 -38.473 9.494 1.00 0.00 C ATOM 1529 O PHE A 98 -0.211 -37.989 10.573 1.00 0.00 O ATOM 1530 CB PHE A 98 -2.977 -38.015 9.061 1.00 0.00 C ATOM 1531 CG PHE A 98 -4.202 -38.517 8.352 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -4.499 -39.870 8.327 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -5.057 -37.635 7.710 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -5.627 -40.335 7.676 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -6.186 -38.094 7.058 1.00 0.00 C ATOM 1536 CZ PHE A 98 -6.470 -39.445 7.040 1.00 0.00 C ATOM 0 H PHE A 98 -2.639 -39.323 11.286 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.901 -39.780 8.468 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -3.273 -37.571 10.011 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -2.522 -37.223 8.467 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -3.842 -40.570 8.822 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -4.839 -36.577 7.719 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -5.848 -41.392 7.665 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -6.845 -37.396 6.563 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.351 -39.805 6.529 1.00 0.00 H new ATOM 1546 N TYR A 99 0.229 -38.483 8.422 1.00 0.00 N ATOM 1547 CA TYR A 99 1.572 -37.915 8.453 1.00 0.00 C ATOM 1548 C TYR A 99 1.655 -36.666 7.582 1.00 0.00 C ATOM 1549 O TYR A 99 0.895 -36.511 6.625 1.00 0.00 O ATOM 1550 CB TYR A 99 2.596 -38.948 7.981 1.00 0.00 C ATOM 1551 CG TYR A 99 2.131 -39.765 6.797 1.00 0.00 C ATOM 1552 CD1 TYR A 99 1.903 -39.169 5.563 1.00 0.00 C ATOM 1553 CD2 TYR A 99 1.918 -41.134 6.912 1.00 0.00 C ATOM 1554 CE1 TYR A 99 1.477 -39.911 4.478 1.00 0.00 C ATOM 1555 CE2 TYR A 99 1.494 -41.884 5.833 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.274 -41.268 4.618 1.00 0.00 C ATOM 1557 OH TYR A 99 0.850 -42.012 3.541 1.00 0.00 O ATOM 0 H TYR A 99 -0.042 -38.878 7.521 1.00 0.00 H new ATOM 0 HA TYR A 99 1.797 -37.634 9.482 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.521 -38.436 7.717 1.00 0.00 H new ATOM 0 HB3 TYR A 99 2.828 -39.620 8.807 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.062 -38.107 5.450 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.087 -41.619 7.862 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.304 -39.431 3.526 1.00 0.00 H new ATOM 0 HE2 TYR A 99 1.335 -42.947 5.939 1.00 0.00 H new ATOM 0 HH TYR A 99 0.742 -41.427 2.762 1.00 0.00 H new ATOM 1567 N ARG A 100 2.583 -35.777 7.920 1.00 0.00 N ATOM 1568 CA ARG A 100 2.767 -34.540 7.170 1.00 0.00 C ATOM 1569 C ARG A 100 4.026 -34.606 6.311 1.00 0.00 C ATOM 1570 O ARG A 100 4.768 -35.588 6.352 1.00 0.00 O ATOM 1571 CB ARG A 100 2.849 -33.348 8.124 1.00 0.00 C ATOM 1572 CG ARG A 100 1.491 -32.809 8.544 1.00 0.00 C ATOM 1573 CD ARG A 100 1.555 -31.322 8.858 1.00 0.00 C ATOM 1574 NE ARG A 100 1.562 -31.066 10.296 1.00 0.00 N ATOM 1575 CZ ARG A 100 2.663 -31.072 11.038 1.00 0.00 C ATOM 1576 NH1 ARG A 100 3.841 -31.320 10.481 1.00 0.00 N ATOM 1577 NH2 ARG A 100 2.588 -30.829 12.340 1.00 0.00 N ATOM 0 H ARG A 100 3.220 -35.890 8.709 1.00 0.00 H new ATOM 0 HA ARG A 100 1.907 -34.412 6.513 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.404 -33.644 9.014 1.00 0.00 H new ATOM 0 HB3 ARG A 100 3.415 -32.549 7.646 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.767 -32.983 7.748 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.138 -33.352 9.420 1.00 0.00 H new ATOM 0 HD2 ARG A 100 2.452 -30.895 8.409 1.00 0.00 H new ATOM 0 HD3 ARG A 100 0.701 -30.819 8.404 1.00 0.00 H new ATOM 0 HE ARG A 100 0.672 -30.872 10.755 1.00 0.00 H new ATOM 0 HH11 ARG A 100 3.903 -31.507 9.480 1.00 0.00 H new ATOM 0 HH12 ARG A 100 4.685 -31.324 11.054 1.00 0.00 H new ATOM 0 HH21 ARG A 100 1.684 -30.637 12.772 1.00 0.00 H new ATOM 0 HH22 ARG A 100 3.434 -30.834 12.909 1.00 0.00 H new ATOM 1591 N LYS A 101 4.262 -33.555 5.534 1.00 0.00 N ATOM 1592 CA LYS A 101 5.432 -33.492 4.666 1.00 0.00 C ATOM 1593 C LYS A 101 6.718 -33.625 5.475 1.00 0.00 C ATOM 1594 O LYS A 101 7.734 -34.102 4.969 1.00 0.00 O ATOM 1595 CB LYS A 101 5.442 -32.176 3.884 1.00 0.00 C ATOM 1596 CG LYS A 101 4.243 -32.003 2.968 1.00 0.00 C ATOM 1597 CD LYS A 101 4.533 -32.514 1.567 1.00 0.00 C ATOM 1598 CE LYS A 101 4.557 -34.035 1.522 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.948 -34.567 1.481 1.00 0.00 N ATOM 0 H LYS A 101 3.658 -32.734 5.487 1.00 0.00 H new ATOM 0 HA LYS A 101 5.378 -34.324 3.964 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.473 -31.345 4.588 1.00 0.00 H new ATOM 0 HB3 LYS A 101 6.354 -32.124 3.289 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.388 -32.538 3.382 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.968 -30.949 2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.775 -32.140 0.878 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.492 -32.124 1.228 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.042 -34.432 2.397 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.010 -34.381 0.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.942 -35.575 1.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.334 -34.457 0.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.541 -34.041 2.155 1.00 0.00 H new ATOM 1613 N ASP A 102 6.666 -33.202 6.733 1.00 0.00 N ATOM 1614 CA ASP A 102 7.827 -33.277 7.613 1.00 0.00 C ATOM 1615 C ASP A 102 8.252 -34.726 7.829 1.00 0.00 C ATOM 1616 O ASP A 102 9.356 -34.995 8.301 1.00 0.00 O ATOM 1617 CB ASP A 102 7.517 -32.617 8.958 1.00 0.00 C ATOM 1618 CG ASP A 102 8.737 -31.964 9.577 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.302 -31.045 8.948 1.00 0.00 O ATOM 1620 OD2 ASP A 102 9.127 -32.372 10.691 1.00 0.00 O ATOM 0 H ASP A 102 5.833 -32.804 7.166 1.00 0.00 H new ATOM 0 HA ASP A 102 8.649 -32.743 7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.738 -31.867 8.821 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.122 -33.366 9.644 1.00 0.00 H new ATOM 1625 N GLY A 103 7.368 -35.656 7.481 1.00 0.00 N ATOM 1626 CA GLY A 103 7.670 -37.065 7.646 1.00 0.00 C ATOM 1627 C GLY A 103 7.094 -37.636 8.927 1.00 0.00 C ATOM 1628 O GLY A 103 6.987 -38.853 9.079 1.00 0.00 O ATOM 0 H GLY A 103 6.448 -35.458 7.088 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.275 -37.620 6.795 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.751 -37.204 7.644 1.00 0.00 H new ATOM 1632 N SER A 104 6.724 -36.756 9.851 1.00 0.00 N ATOM 1633 CA SER A 104 6.161 -37.179 11.128 1.00 0.00 C ATOM 1634 C SER A 104 4.748 -37.727 10.943 1.00 0.00 C ATOM 1635 O SER A 104 4.093 -37.457 9.936 1.00 0.00 O ATOM 1636 CB SER A 104 6.142 -36.009 12.114 1.00 0.00 C ATOM 1637 OG SER A 104 6.499 -34.797 11.473 1.00 0.00 O ATOM 0 H SER A 104 6.804 -35.745 9.740 1.00 0.00 H new ATOM 0 HA SER A 104 6.791 -37.973 11.530 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.148 -35.914 12.551 1.00 0.00 H new ATOM 0 HB3 SER A 104 6.833 -36.208 12.933 1.00 0.00 H new ATOM 0 HG SER A 104 7.464 -34.790 11.300 1.00 0.00 H new ATOM 1643 N CYS A 105 4.287 -38.496 11.923 1.00 0.00 N ATOM 1644 CA CYS A 105 2.953 -39.083 11.870 1.00 0.00 C ATOM 1645 C CYS A 105 2.227 -38.904 13.200 1.00 0.00 C ATOM 1646 O CYS A 105 2.794 -39.144 14.266 1.00 0.00 O ATOM 1647 CB CYS A 105 3.040 -40.569 11.518 1.00 0.00 C ATOM 1648 SG CYS A 105 1.497 -41.271 10.890 1.00 0.00 S ATOM 0 H CYS A 105 4.817 -38.727 12.763 1.00 0.00 H new ATOM 0 HA CYS A 105 2.386 -38.567 11.095 1.00 0.00 H new ATOM 0 HB2 CYS A 105 3.821 -40.709 10.771 1.00 0.00 H new ATOM 0 HB3 CYS A 105 3.345 -41.124 12.405 1.00 0.00 H new ATOM 0 HG CYS A 105 1.672 -42.530 10.619 1.00 0.00 H new ATOM 1654 N PHE A 106 0.970 -38.480 13.129 1.00 0.00 N ATOM 1655 CA PHE A 106 0.167 -38.266 14.327 1.00 0.00 C ATOM 1656 C PHE A 106 -1.245 -38.815 14.141 1.00 0.00 C ATOM 1657 O PHE A 106 -1.693 -39.039 13.016 1.00 0.00 O ATOM 1658 CB PHE A 106 0.106 -36.776 14.667 1.00 0.00 C ATOM 1659 CG PHE A 106 0.747 -35.898 13.631 1.00 0.00 C ATOM 1660 CD1 PHE A 106 2.092 -35.577 13.712 1.00 0.00 C ATOM 1661 CD2 PHE A 106 0.005 -35.395 12.574 1.00 0.00 C ATOM 1662 CE1 PHE A 106 2.684 -34.769 12.760 1.00 0.00 C ATOM 1663 CE2 PHE A 106 0.591 -34.586 11.619 1.00 0.00 C ATOM 1664 CZ PHE A 106 1.934 -34.274 11.712 1.00 0.00 C ATOM 0 H PHE A 106 0.485 -38.278 12.255 1.00 0.00 H new ATOM 0 HA PHE A 106 0.640 -38.800 15.151 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.937 -36.481 14.787 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.596 -36.610 15.626 1.00 0.00 H new ATOM 0 HD1 PHE A 106 2.685 -35.963 14.528 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -1.044 -35.638 12.496 1.00 0.00 H new ATOM 0 HE1 PHE A 106 3.733 -34.525 12.836 1.00 0.00 H new ATOM 0 HE2 PHE A 106 0.001 -34.198 10.802 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.396 -33.644 10.966 1.00 0.00 H new ATOM 1674 N LEU A 107 -1.941 -39.030 15.252 1.00 0.00 N ATOM 1675 CA LEU A 107 -3.302 -39.554 15.213 1.00 0.00 C ATOM 1676 C LEU A 107 -4.317 -38.423 15.082 1.00 0.00 C ATOM 1677 O LEU A 107 -4.247 -37.426 15.803 1.00 0.00 O ATOM 1678 CB LEU A 107 -3.592 -40.371 16.473 1.00 0.00 C ATOM 1679 CG LEU A 107 -3.696 -41.884 16.283 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -4.847 -42.227 15.350 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -2.387 -42.446 15.747 1.00 0.00 C ATOM 0 H LEU A 107 -1.585 -38.850 16.191 1.00 0.00 H new ATOM 0 HA LEU A 107 -3.391 -40.201 14.340 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -2.806 -40.170 17.201 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.527 -40.014 16.906 1.00 0.00 H new ATOM 0 HG LEU A 107 -3.893 -42.340 17.253 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -4.906 -43.308 15.227 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.781 -41.859 15.774 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -4.680 -41.760 14.379 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.480 -43.524 15.618 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -2.159 -41.984 14.786 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -1.584 -42.233 16.452 1.00 0.00 H new ATOM 1693 N CYS A 108 -5.259 -38.584 14.160 1.00 0.00 N ATOM 1694 CA CYS A 108 -6.290 -37.577 13.935 1.00 0.00 C ATOM 1695 C CYS A 108 -7.654 -38.230 13.735 1.00 0.00 C ATOM 1696 O CYS A 108 -7.784 -39.204 12.993 1.00 0.00 O ATOM 1697 CB CYS A 108 -5.938 -36.719 12.719 1.00 0.00 C ATOM 1698 SG CYS A 108 -5.859 -37.640 11.164 1.00 0.00 S ATOM 0 H CYS A 108 -5.330 -39.403 13.556 1.00 0.00 H new ATOM 0 HA CYS A 108 -6.339 -36.940 14.818 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -6.678 -35.925 12.621 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -4.976 -36.238 12.893 1.00 0.00 H new ATOM 0 HG CYS A 108 -5.573 -38.884 11.410 1.00 0.00 H new ATOM 1704 N LEU A 109 -8.667 -37.689 14.402 1.00 0.00 N ATOM 1705 CA LEU A 109 -10.021 -38.219 14.299 1.00 0.00 C ATOM 1706 C LEU A 109 -10.679 -37.785 12.993 1.00 0.00 C ATOM 1707 O LEU A 109 -10.469 -36.667 12.522 1.00 0.00 O ATOM 1708 CB LEU A 109 -10.865 -37.753 15.487 1.00 0.00 C ATOM 1709 CG LEU A 109 -12.211 -38.455 15.671 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -13.236 -37.909 14.689 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -12.056 -39.959 15.502 1.00 0.00 C ATOM 0 H LEU A 109 -8.576 -36.883 15.020 1.00 0.00 H new ATOM 0 HA LEU A 109 -9.959 -39.307 14.309 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.280 -37.887 16.397 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -11.047 -36.684 15.380 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.566 -38.258 16.683 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -14.188 -38.420 14.835 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -13.369 -36.840 14.858 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.887 -38.075 13.670 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.024 -40.442 15.636 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -11.678 -40.176 14.503 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.355 -40.338 16.245 1.00 0.00 H new ATOM 1723 N VAL A 110 -11.477 -38.676 12.413 1.00 0.00 N ATOM 1724 CA VAL A 110 -12.168 -38.384 11.163 1.00 0.00 C ATOM 1725 C VAL A 110 -13.648 -38.736 11.258 1.00 0.00 C ATOM 1726 O VAL A 110 -14.014 -39.909 11.338 1.00 0.00 O ATOM 1727 CB VAL A 110 -11.543 -39.152 9.983 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -12.145 -38.689 8.665 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -10.031 -38.982 9.978 1.00 0.00 C ATOM 0 H VAL A 110 -11.661 -39.606 12.789 1.00 0.00 H new ATOM 0 HA VAL A 110 -12.063 -37.314 10.986 1.00 0.00 H new ATOM 0 HB VAL A 110 -11.766 -40.212 10.103 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.691 -39.243 7.843 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -13.220 -38.868 8.673 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.956 -37.624 8.533 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.606 -39.531 9.138 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.784 -37.925 9.883 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.618 -39.368 10.910 1.00 0.00 H new ATOM 1739 N ASP A 111 -14.495 -37.713 11.248 1.00 0.00 N ATOM 1740 CA ASP A 111 -15.937 -37.914 11.331 1.00 0.00 C ATOM 1741 C ASP A 111 -16.585 -37.777 9.957 1.00 0.00 C ATOM 1742 O ASP A 111 -16.272 -36.858 9.200 1.00 0.00 O ATOM 1743 CB ASP A 111 -16.558 -36.909 12.303 1.00 0.00 C ATOM 1744 CG ASP A 111 -18.021 -37.197 12.577 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -18.825 -37.145 11.622 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -18.363 -37.474 13.746 1.00 0.00 O ATOM 0 H ASP A 111 -14.208 -36.736 11.183 1.00 0.00 H new ATOM 0 HA ASP A 111 -16.117 -38.924 11.699 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -16.005 -36.927 13.242 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -16.459 -35.904 11.894 1.00 0.00 H new ATOM 1751 N VAL A 112 -17.490 -38.699 9.640 1.00 0.00 N ATOM 1752 CA VAL A 112 -18.182 -38.682 8.357 1.00 0.00 C ATOM 1753 C VAL A 112 -19.694 -38.665 8.549 1.00 0.00 C ATOM 1754 O VAL A 112 -20.237 -39.415 9.360 1.00 0.00 O ATOM 1755 CB VAL A 112 -17.798 -39.900 7.496 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -18.313 -41.184 8.128 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -18.333 -39.741 6.081 1.00 0.00 C ATOM 0 H VAL A 112 -17.760 -39.467 10.255 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.874 -37.772 7.843 1.00 0.00 H new ATOM 0 HB VAL A 112 -16.711 -39.959 7.445 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -18.032 -42.034 7.506 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -17.878 -41.301 9.120 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -19.399 -41.138 8.211 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -18.053 -40.610 5.486 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.419 -39.656 6.110 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -17.911 -38.842 5.631 1.00 0.00 H new ATOM 1767 N VAL A 113 -20.371 -37.804 7.796 1.00 0.00 N ATOM 1768 CA VAL A 113 -21.822 -37.690 7.881 1.00 0.00 C ATOM 1769 C VAL A 113 -22.417 -37.243 6.550 1.00 0.00 C ATOM 1770 O VAL A 113 -21.796 -36.513 5.778 1.00 0.00 O ATOM 1771 CB VAL A 113 -22.243 -36.695 8.979 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -23.115 -35.593 8.396 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -22.967 -37.419 10.104 1.00 0.00 C ATOM 0 H VAL A 113 -19.938 -37.175 7.120 1.00 0.00 H new ATOM 0 HA VAL A 113 -22.203 -38.680 8.132 1.00 0.00 H new ATOM 0 HB VAL A 113 -21.345 -36.235 9.392 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -23.402 -34.900 9.187 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -22.558 -35.056 7.628 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -24.010 -36.032 7.955 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -23.257 -36.701 10.871 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -23.858 -37.907 9.708 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -22.306 -38.168 10.540 1.00 0.00 H new ATOM 1783 N PRO A 114 -23.651 -37.690 6.274 1.00 0.00 N ATOM 1784 CA PRO A 114 -24.359 -37.348 5.037 1.00 0.00 C ATOM 1785 C PRO A 114 -24.775 -35.882 4.993 1.00 0.00 C ATOM 1786 O PRO A 114 -24.949 -35.244 6.032 1.00 0.00 O ATOM 1787 CB PRO A 114 -25.593 -38.253 5.072 1.00 0.00 C ATOM 1788 CG PRO A 114 -25.816 -38.533 6.519 1.00 0.00 C ATOM 1789 CD PRO A 114 -24.451 -38.564 7.149 1.00 0.00 C ATOM 0 HA PRO A 114 -23.733 -37.492 4.157 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -26.457 -37.761 4.626 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -25.425 -39.173 4.512 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -26.439 -37.763 6.974 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -26.332 -39.483 6.658 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -24.473 -38.194 8.174 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -24.047 -39.576 7.184 1.00 0.00 H new ATOM 1797 N VAL A 115 -24.932 -35.352 3.784 1.00 0.00 N ATOM 1798 CA VAL A 115 -25.329 -33.961 3.605 1.00 0.00 C ATOM 1799 C VAL A 115 -26.681 -33.860 2.907 1.00 0.00 C ATOM 1800 O VAL A 115 -26.764 -33.916 1.680 1.00 0.00 O ATOM 1801 CB VAL A 115 -24.283 -33.179 2.789 1.00 0.00 C ATOM 1802 CG1 VAL A 115 -24.560 -31.685 2.856 1.00 0.00 C ATOM 1803 CG2 VAL A 115 -22.879 -33.492 3.284 1.00 0.00 C ATOM 0 H VAL A 115 -24.790 -35.865 2.914 1.00 0.00 H new ATOM 0 HA VAL A 115 -25.404 -33.523 4.600 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.354 -33.490 1.747 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -23.810 -31.149 2.273 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -25.550 -31.480 2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -24.518 -31.353 3.893 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -22.152 -32.931 2.696 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -22.792 -33.210 4.333 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -22.685 -34.559 3.178 1.00 0.00 H new ATOM 1813 N LYS A 116 -27.739 -33.711 3.697 1.00 0.00 N ATOM 1814 CA LYS A 116 -29.088 -33.600 3.156 1.00 0.00 C ATOM 1815 C LYS A 116 -29.358 -32.186 2.651 1.00 0.00 C ATOM 1816 O LYS A 116 -28.590 -31.264 2.921 1.00 0.00 O ATOM 1817 CB LYS A 116 -30.119 -33.979 4.221 1.00 0.00 C ATOM 1818 CG LYS A 116 -29.994 -35.412 4.707 1.00 0.00 C ATOM 1819 CD LYS A 116 -30.917 -35.685 5.883 1.00 0.00 C ATOM 1820 CE LYS A 116 -30.946 -37.164 6.237 1.00 0.00 C ATOM 1821 NZ LYS A 116 -29.625 -37.643 6.730 1.00 0.00 N ATOM 0 H LYS A 116 -27.688 -33.664 4.715 1.00 0.00 H new ATOM 0 HA LYS A 116 -29.173 -34.289 2.315 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -30.014 -33.306 5.072 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -31.120 -33.828 3.816 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -30.230 -36.096 3.892 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -28.963 -35.609 4.999 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -30.587 -35.109 6.748 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -31.925 -35.348 5.642 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -31.704 -37.340 7.000 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -31.237 -37.742 5.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -29.700 -38.642 7.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -28.917 -37.546 5.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -29.335 -37.076 7.552 1.00 0.00 H new ATOM 1835 N ASN A 117 -30.456 -32.023 1.920 1.00 0.00 N ATOM 1836 CA ASN A 117 -30.827 -30.721 1.378 1.00 0.00 C ATOM 1837 C ASN A 117 -31.930 -30.079 2.215 1.00 0.00 C ATOM 1838 O ASN A 117 -32.298 -30.591 3.271 1.00 0.00 O ATOM 1839 CB ASN A 117 -31.289 -30.862 -0.074 1.00 0.00 C ATOM 1840 CG ASN A 117 -30.128 -31.031 -1.035 1.00 0.00 C ATOM 1841 OD1 ASN A 117 -28.969 -30.847 -0.665 1.00 0.00 O ATOM 1842 ND2 ASN A 117 -30.437 -31.383 -2.278 1.00 0.00 N ATOM 0 H ASN A 117 -31.104 -32.776 1.689 1.00 0.00 H new ATOM 0 HA ASN A 117 -29.948 -30.077 1.411 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -31.956 -31.720 -0.159 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -31.866 -29.981 -0.356 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -29.699 -31.511 -2.970 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -31.412 -31.525 -2.540 1.00 0.00 H new ATOM 1849 N GLU A 118 -32.453 -28.956 1.732 1.00 0.00 N ATOM 1850 CA GLU A 118 -33.514 -28.245 2.436 1.00 0.00 C ATOM 1851 C GLU A 118 -34.729 -29.145 2.642 1.00 0.00 C ATOM 1852 O GLU A 118 -35.553 -28.901 3.523 1.00 0.00 O ATOM 1853 CB GLU A 118 -33.921 -26.991 1.658 1.00 0.00 C ATOM 1854 CG GLU A 118 -33.940 -25.730 2.505 1.00 0.00 C ATOM 1855 CD GLU A 118 -32.989 -24.667 1.990 1.00 0.00 C ATOM 1856 OE1 GLU A 118 -32.844 -24.546 0.756 1.00 0.00 O ATOM 1857 OE2 GLU A 118 -32.388 -23.956 2.823 1.00 0.00 O ATOM 0 H GLU A 118 -32.160 -28.520 0.858 1.00 0.00 H new ATOM 0 HA GLU A 118 -33.132 -27.950 3.413 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -33.231 -26.850 0.826 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -34.911 -27.145 1.228 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -34.952 -25.327 2.527 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -33.675 -25.982 3.532 1.00 0.00 H new ATOM 1864 N ASP A 119 -34.832 -30.186 1.823 1.00 0.00 N ATOM 1865 CA ASP A 119 -35.945 -31.123 1.915 1.00 0.00 C ATOM 1866 C ASP A 119 -35.565 -32.338 2.755 1.00 0.00 C ATOM 1867 O ASP A 119 -36.414 -33.161 3.096 1.00 0.00 O ATOM 1868 CB ASP A 119 -36.380 -31.570 0.518 1.00 0.00 C ATOM 1869 CG ASP A 119 -37.772 -31.086 0.163 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -38.637 -31.054 1.063 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -37.998 -30.740 -1.016 1.00 0.00 O ATOM 0 H ASP A 119 -34.158 -30.402 1.088 1.00 0.00 H new ATOM 0 HA ASP A 119 -36.777 -30.613 2.401 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -35.669 -31.195 -0.218 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -36.352 -32.658 0.463 1.00 0.00 H new ATOM 1876 N GLY A 120 -34.281 -32.445 3.085 1.00 0.00 N ATOM 1877 CA GLY A 120 -33.810 -33.563 3.882 1.00 0.00 C ATOM 1878 C GLY A 120 -33.369 -34.736 3.030 1.00 0.00 C ATOM 1879 O GLY A 120 -33.250 -35.858 3.522 1.00 0.00 O ATOM 0 H GLY A 120 -33.559 -31.777 2.815 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -32.977 -33.236 4.504 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -34.604 -33.885 4.556 1.00 0.00 H new ATOM 1883 N ALA A 121 -33.129 -34.479 1.749 1.00 0.00 N ATOM 1884 CA ALA A 121 -32.699 -35.523 0.827 1.00 0.00 C ATOM 1885 C ALA A 121 -31.178 -35.640 0.801 1.00 0.00 C ATOM 1886 O ALA A 121 -30.479 -34.695 0.434 1.00 0.00 O ATOM 1887 CB ALA A 121 -33.233 -35.246 -0.570 1.00 0.00 C ATOM 0 H ALA A 121 -33.225 -33.556 1.326 1.00 0.00 H new ATOM 0 HA ALA A 121 -33.104 -36.472 1.177 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -32.904 -36.034 -1.248 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -34.322 -35.221 -0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -32.856 -34.285 -0.920 1.00 0.00 H new ATOM 1893 N VAL A 122 -30.672 -36.805 1.193 1.00 0.00 N ATOM 1894 CA VAL A 122 -29.234 -37.045 1.213 1.00 0.00 C ATOM 1895 C VAL A 122 -28.716 -37.395 -0.177 1.00 0.00 C ATOM 1896 O VAL A 122 -29.262 -38.267 -0.853 1.00 0.00 O ATOM 1897 CB VAL A 122 -28.870 -38.183 2.186 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -29.519 -39.487 1.750 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -27.359 -38.336 2.284 1.00 0.00 C ATOM 0 H VAL A 122 -31.236 -37.597 1.501 1.00 0.00 H new ATOM 0 HA VAL A 122 -28.763 -36.122 1.551 1.00 0.00 H new ATOM 0 HB VAL A 122 -29.252 -37.929 3.175 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -29.250 -40.279 2.449 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -30.602 -39.367 1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -29.170 -39.751 0.752 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -27.119 -39.144 2.975 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -26.952 -38.568 1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -26.922 -37.406 2.647 1.00 0.00 H new ATOM 1909 N ILE A 123 -27.658 -36.709 -0.597 1.00 0.00 N ATOM 1910 CA ILE A 123 -27.064 -36.948 -1.907 1.00 0.00 C ATOM 1911 C ILE A 123 -25.553 -37.123 -1.801 1.00 0.00 C ATOM 1912 O ILE A 123 -24.973 -37.996 -2.447 1.00 0.00 O ATOM 1913 CB ILE A 123 -27.369 -35.796 -2.882 1.00 0.00 C ATOM 1914 CG1 ILE A 123 -28.880 -35.617 -3.038 1.00 0.00 C ATOM 1915 CG2 ILE A 123 -26.719 -36.058 -4.232 1.00 0.00 C ATOM 1916 CD1 ILE A 123 -29.327 -34.173 -2.979 1.00 0.00 C ATOM 0 H ILE A 123 -27.195 -35.984 -0.050 1.00 0.00 H new ATOM 0 HA ILE A 123 -27.508 -37.866 -2.292 1.00 0.00 H new ATOM 0 HB ILE A 123 -26.953 -34.875 -2.473 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -29.192 -36.047 -3.990 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -29.387 -36.178 -2.253 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -26.944 -35.235 -4.910 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -25.639 -36.140 -4.106 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -27.107 -36.987 -4.649 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -30.409 -34.122 -3.097 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -29.046 -33.744 -2.017 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -28.848 -33.611 -3.781 1.00 0.00 H new ATOM 1928 N MET A 124 -24.922 -36.290 -0.981 1.00 0.00 N ATOM 1929 CA MET A 124 -23.478 -36.355 -0.788 1.00 0.00 C ATOM 1930 C MET A 124 -23.134 -36.567 0.683 1.00 0.00 C ATOM 1931 O MET A 124 -24.021 -36.622 1.535 1.00 0.00 O ATOM 1932 CB MET A 124 -22.815 -35.074 -1.299 1.00 0.00 C ATOM 1933 CG MET A 124 -23.512 -33.804 -0.839 1.00 0.00 C ATOM 1934 SD MET A 124 -24.225 -32.869 -2.205 1.00 0.00 S ATOM 1935 CE MET A 124 -25.452 -31.890 -1.341 1.00 0.00 C ATOM 0 H MET A 124 -25.388 -35.562 -0.439 1.00 0.00 H new ATOM 0 HA MET A 124 -23.099 -37.204 -1.357 1.00 0.00 H new ATOM 0 HB2 MET A 124 -21.778 -35.052 -0.963 1.00 0.00 H new ATOM 0 HB3 MET A 124 -22.796 -35.094 -2.389 1.00 0.00 H new ATOM 0 HG2 MET A 124 -24.299 -34.062 -0.131 1.00 0.00 H new ATOM 0 HG3 MET A 124 -22.798 -33.175 -0.307 1.00 0.00 H new ATOM 0 HE1 MET A 124 -25.980 -31.256 -2.054 1.00 0.00 H new ATOM 0 HE2 MET A 124 -26.164 -32.552 -0.847 1.00 0.00 H new ATOM 0 HE3 MET A 124 -24.960 -31.265 -0.595 1.00 0.00 H new ATOM 1945 N PHE A 125 -21.843 -36.685 0.973 1.00 0.00 N ATOM 1946 CA PHE A 125 -21.383 -36.893 2.341 1.00 0.00 C ATOM 1947 C PHE A 125 -20.189 -35.996 2.656 1.00 0.00 C ATOM 1948 O PHE A 125 -19.286 -35.838 1.835 1.00 0.00 O ATOM 1949 CB PHE A 125 -21.005 -38.359 2.558 1.00 0.00 C ATOM 1950 CG PHE A 125 -21.463 -39.266 1.452 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -22.809 -39.553 1.286 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -20.549 -39.833 0.579 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -23.234 -40.387 0.269 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -20.968 -40.668 -0.439 1.00 0.00 C ATOM 1955 CZ PHE A 125 -22.312 -40.946 -0.594 1.00 0.00 C ATOM 0 H PHE A 125 -21.097 -36.640 0.279 1.00 0.00 H new ATOM 0 HA PHE A 125 -22.199 -36.632 3.015 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.922 -38.436 2.655 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -21.435 -38.701 3.499 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -23.534 -39.120 1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -19.497 -39.620 0.695 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -24.286 -40.601 0.149 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -20.245 -41.103 -1.113 1.00 0.00 H new ATOM 0 HZ PHE A 125 -22.641 -41.599 -1.389 1.00 0.00 H new ATOM 1965 N ILE A 126 -20.194 -35.411 3.849 1.00 0.00 N ATOM 1966 CA ILE A 126 -19.112 -34.531 4.272 1.00 0.00 C ATOM 1967 C ILE A 126 -18.415 -35.075 5.515 1.00 0.00 C ATOM 1968 O ILE A 126 -19.064 -35.569 6.438 1.00 0.00 O ATOM 1969 CB ILE A 126 -19.626 -33.109 4.566 1.00 0.00 C ATOM 1970 CG1 ILE A 126 -18.470 -32.206 5.001 1.00 0.00 C ATOM 1971 CG2 ILE A 126 -20.707 -33.147 5.636 1.00 0.00 C ATOM 1972 CD1 ILE A 126 -18.888 -30.778 5.272 1.00 0.00 C ATOM 0 H ILE A 126 -20.935 -35.531 4.539 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.399 -34.488 3.448 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.060 -32.699 3.654 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.015 -32.620 5.901 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.704 -32.211 4.225 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -21.060 -32.135 5.833 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.539 -33.761 5.291 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.297 -33.573 6.552 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -18.018 -30.196 5.576 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -19.316 -30.346 4.367 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -19.632 -30.762 6.069 1.00 0.00 H new ATOM 1984 N LEU A 127 -17.090 -34.979 5.533 1.00 0.00 N ATOM 1985 CA LEU A 127 -16.304 -35.460 6.663 1.00 0.00 C ATOM 1986 C LEU A 127 -15.237 -34.443 7.056 1.00 0.00 C ATOM 1987 O LEU A 127 -14.717 -33.716 6.210 1.00 0.00 O ATOM 1988 CB LEU A 127 -15.647 -36.799 6.321 1.00 0.00 C ATOM 1989 CG LEU A 127 -14.686 -36.790 5.131 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -13.681 -37.925 5.249 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -15.456 -36.891 3.823 1.00 0.00 C ATOM 0 H LEU A 127 -16.538 -34.572 4.778 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.977 -35.599 7.509 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -15.104 -37.149 7.199 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -16.434 -37.527 6.122 1.00 0.00 H new ATOM 0 HG LEU A 127 -14.140 -35.846 5.136 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -13.005 -37.903 4.394 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -13.107 -37.808 6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -14.209 -38.878 5.270 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -14.756 -36.883 2.987 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -16.028 -37.819 3.808 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -16.136 -36.044 3.735 1.00 0.00 H new ATOM 2003 N ASN A 128 -14.913 -34.400 8.344 1.00 0.00 N ATOM 2004 CA ASN A 128 -13.907 -33.473 8.849 1.00 0.00 C ATOM 2005 C ASN A 128 -12.873 -34.204 9.701 1.00 0.00 C ATOM 2006 O ASN A 128 -13.157 -35.255 10.275 1.00 0.00 O ATOM 2007 CB ASN A 128 -14.569 -32.365 9.670 1.00 0.00 C ATOM 2008 CG ASN A 128 -15.648 -32.897 10.595 1.00 0.00 C ATOM 2009 OD1 ASN A 128 -15.356 -33.418 11.671 1.00 0.00 O ATOM 2010 ND2 ASN A 128 -16.902 -32.767 10.177 1.00 0.00 N ATOM 0 H ASN A 128 -15.333 -34.996 9.057 1.00 0.00 H new ATOM 0 HA ASN A 128 -13.399 -33.027 7.994 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -13.810 -31.850 10.259 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -15.004 -31.627 8.996 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -17.670 -33.106 10.756 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -17.097 -32.328 9.277 1.00 0.00 H new ATOM 2017 N PHE A 129 -11.673 -33.639 9.778 1.00 0.00 N ATOM 2018 CA PHE A 129 -10.596 -34.237 10.559 1.00 0.00 C ATOM 2019 C PHE A 129 -10.272 -33.383 11.781 1.00 0.00 C ATOM 2020 O PHE A 129 -10.497 -32.173 11.783 1.00 0.00 O ATOM 2021 CB PHE A 129 -9.344 -34.406 9.695 1.00 0.00 C ATOM 2022 CG PHE A 129 -9.609 -35.085 8.382 1.00 0.00 C ATOM 2023 CD1 PHE A 129 -10.223 -34.401 7.345 1.00 0.00 C ATOM 2024 CD2 PHE A 129 -9.246 -36.407 8.185 1.00 0.00 C ATOM 2025 CE1 PHE A 129 -10.468 -35.022 6.135 1.00 0.00 C ATOM 2026 CE2 PHE A 129 -9.488 -37.034 6.977 1.00 0.00 C ATOM 2027 CZ PHE A 129 -10.101 -36.341 5.951 1.00 0.00 C ATOM 0 H PHE A 129 -11.422 -32.768 9.310 1.00 0.00 H new ATOM 0 HA PHE A 129 -10.929 -35.217 10.900 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -8.908 -33.425 9.506 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -8.604 -34.983 10.250 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -10.514 -33.370 7.484 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -8.768 -36.954 8.984 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -10.946 -34.477 5.334 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -9.198 -38.065 6.835 1.00 0.00 H new ATOM 0 HZ PHE A 129 -10.293 -36.829 5.007 1.00 0.00 H new ATOM 2037 N GLU A 130 -9.744 -34.023 12.820 1.00 0.00 N ATOM 2038 CA GLU A 130 -9.390 -33.322 14.049 1.00 0.00 C ATOM 2039 C GLU A 130 -8.301 -34.073 14.809 1.00 0.00 C ATOM 2040 O GLU A 130 -8.534 -35.160 15.339 1.00 0.00 O ATOM 2041 CB GLU A 130 -10.624 -33.153 14.938 1.00 0.00 C ATOM 2042 CG GLU A 130 -10.314 -32.562 16.303 1.00 0.00 C ATOM 2043 CD GLU A 130 -11.040 -31.255 16.552 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -10.983 -30.368 15.676 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -11.666 -31.120 17.624 1.00 0.00 O ATOM 0 H GLU A 130 -9.552 -35.025 12.835 1.00 0.00 H new ATOM 0 HA GLU A 130 -9.007 -32.338 13.779 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -11.343 -32.512 14.429 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -11.101 -34.124 15.072 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -10.590 -33.279 17.076 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.240 -32.398 16.388 1.00 0.00 H new ATOM 2052 N VAL A 131 -7.110 -33.485 14.859 1.00 0.00 N ATOM 2053 CA VAL A 131 -5.984 -34.097 15.554 1.00 0.00 C ATOM 2054 C VAL A 131 -6.338 -34.412 17.003 1.00 0.00 C ATOM 2055 O VAL A 131 -6.943 -33.595 17.698 1.00 0.00 O ATOM 2056 CB VAL A 131 -4.744 -33.184 15.528 1.00 0.00 C ATOM 2057 CG1 VAL A 131 -3.531 -33.913 16.086 1.00 0.00 C ATOM 2058 CG2 VAL A 131 -4.476 -32.691 14.113 1.00 0.00 C ATOM 0 H VAL A 131 -6.900 -32.585 14.426 1.00 0.00 H new ATOM 0 HA VAL A 131 -5.755 -35.024 15.029 1.00 0.00 H new ATOM 0 HB VAL A 131 -4.939 -32.318 16.160 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -2.665 -33.252 16.059 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -3.728 -34.212 17.116 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -3.330 -34.799 15.483 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -3.596 -32.047 14.112 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -4.302 -33.544 13.457 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -5.338 -32.128 13.754 1.00 0.00 H new ATOM 2068 N VAL A 132 -5.957 -35.604 17.454 1.00 0.00 N ATOM 2069 CA VAL A 132 -6.233 -36.027 18.822 1.00 0.00 C ATOM 2070 C VAL A 132 -4.951 -36.433 19.540 1.00 0.00 C ATOM 2071 O VAL A 132 -4.830 -36.271 20.754 1.00 0.00 O ATOM 2072 CB VAL A 132 -7.223 -37.206 18.855 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -7.482 -37.646 20.288 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -8.523 -36.830 18.161 1.00 0.00 C ATOM 0 H VAL A 132 -5.457 -36.293 16.892 1.00 0.00 H new ATOM 0 HA VAL A 132 -6.678 -35.174 19.334 1.00 0.00 H new ATOM 0 HB VAL A 132 -6.780 -38.044 18.317 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -8.184 -38.480 20.291 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -6.544 -37.959 20.748 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -7.904 -36.815 20.853 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -9.211 -37.675 18.194 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -8.973 -35.976 18.668 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -8.319 -36.569 17.123 1.00 0.00 H new ATOM 2084 N MET A 133 -3.997 -36.963 18.782 1.00 0.00 N ATOM 2085 CA MET A 133 -2.722 -37.391 19.347 1.00 0.00 C ATOM 2086 C MET A 133 -1.556 -36.884 18.503 1.00 0.00 C ATOM 2087 O MET A 133 -1.018 -37.614 17.671 1.00 0.00 O ATOM 2088 CB MET A 133 -2.671 -38.917 19.445 1.00 0.00 C ATOM 2089 CG MET A 133 -2.817 -39.439 20.865 1.00 0.00 C ATOM 2090 SD MET A 133 -4.135 -40.660 21.024 1.00 0.00 S ATOM 2091 CE MET A 133 -4.740 -40.293 22.669 1.00 0.00 C ATOM 0 H MET A 133 -4.082 -37.106 17.776 1.00 0.00 H new ATOM 0 HA MET A 133 -2.635 -36.967 20.347 1.00 0.00 H new ATOM 0 HB2 MET A 133 -3.464 -39.339 18.828 1.00 0.00 H new ATOM 0 HB3 MET A 133 -1.725 -39.268 19.033 1.00 0.00 H new ATOM 0 HG2 MET A 133 -1.874 -39.884 21.183 1.00 0.00 H new ATOM 0 HG3 MET A 133 -3.018 -38.604 21.536 1.00 0.00 H new ATOM 0 HE1 MET A 133 -5.561 -40.967 22.914 1.00 0.00 H new ATOM 0 HE2 MET A 133 -3.934 -40.425 23.391 1.00 0.00 H new ATOM 0 HE3 MET A 133 -5.094 -39.263 22.705 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.172 -35.631 18.724 1.00 0.00 N ATOM 2102 CA GLU A 134 -0.071 -35.028 17.983 1.00 0.00 C ATOM 2103 C GLU A 134 1.274 -35.469 18.553 1.00 0.00 C ATOM 2104 O GLU A 134 1.843 -34.803 19.418 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.177 -33.502 18.019 1.00 0.00 C ATOM 2106 CG GLU A 134 0.768 -32.804 17.056 1.00 0.00 C ATOM 2107 CD GLU A 134 1.505 -31.645 17.699 1.00 0.00 C ATOM 2108 OE1 GLU A 134 0.837 -30.676 18.117 1.00 0.00 O ATOM 2109 OE2 GLU A 134 2.749 -31.708 17.786 1.00 0.00 O ATOM 0 H GLU A 134 -1.607 -35.014 19.410 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.136 -35.365 16.948 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -1.201 -33.212 17.785 1.00 0.00 H new ATOM 0 HB3 GLU A 134 0.029 -33.156 19.032 1.00 0.00 H new ATOM 0 HG2 GLU A 134 1.492 -33.525 16.677 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.203 -32.439 16.198 1.00 0.00 H new ATOM 2116 N LYS A 135 1.778 -36.597 18.063 1.00 0.00 N ATOM 2117 CA LYS A 135 3.056 -37.128 18.522 1.00 0.00 C ATOM 2118 C LYS A 135 4.170 -36.104 18.331 1.00 0.00 C ATOM 2119 O LYS A 135 5.343 -36.398 18.567 1.00 0.00 O ATOM 2120 CB LYS A 135 3.396 -38.415 17.767 1.00 0.00 C ATOM 2121 CG LYS A 135 2.265 -39.429 17.752 1.00 0.00 C ATOM 2122 CD LYS A 135 1.811 -39.778 19.159 1.00 0.00 C ATOM 2123 CE LYS A 135 2.927 -40.431 19.959 1.00 0.00 C ATOM 2124 NZ LYS A 135 2.400 -41.400 20.960 1.00 0.00 N ATOM 0 H LYS A 135 1.320 -37.161 17.347 1.00 0.00 H new ATOM 0 HA LYS A 135 2.969 -37.350 19.586 1.00 0.00 H new ATOM 0 HB2 LYS A 135 3.661 -38.164 16.740 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.276 -38.871 18.221 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.424 -39.029 17.186 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.593 -40.333 17.240 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.477 -38.875 19.669 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.955 -40.451 19.110 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.608 -40.945 19.280 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.506 -39.661 20.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.192 -41.823 21.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 1.770 -40.905 21.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 1.869 -42.149 20.472 1.00 0.00 H new