USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 699 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 61 LYS NZ :NH3+ -121:sc=-0.00693 (180deg=-2.19!) USER MOD Single : A 65 ASN : amide:sc= -0.0772 K(o=-0.077,f=-2.3!) USER MOD Single : A 68 SER OG : rot 180:sc= -0.0129 USER MOD Single : A 74 GLN : amide:sc=-0.00332 K(o=-0.0033,f=-1.4!) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HD1:sc= -2.74! C(o=-2.7!,f=-2.8!) USER MOD Single : A 85 SER OG : rot 98:sc= 0.386 USER MOD Single : A 93 THR OG1 : rot -41:sc= -1.06 USER MOD Single : A 95 SER OG : rot 180:sc= 0.478 USER MOD Single : A 98 HIS : no HD1:sc= -0.106 X(o=-0.11,f=-0.16) USER MOD Single : A 105 ASN : amide:sc= -1.62! C(o=-1.6!,f=-6.6!) USER MOD Single : A 106 ASN : amide:sc= -0.0427 K(o=-0.043,f=-1.9!) USER MOD Single : A 109 ASN : amide:sc= -4.3 K(o=-4.3,f=-12!) USER MOD Single : A 119 THR OG1 : rot 35:sc= 0.265 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -1.87! C(o=-1.9!,f=-12!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -1.6 K(o=-1.6,f=-5.6!) USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0.0423 USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -14.049 -7.008 -4.420 1.00 0.00 N ATOM 417 CA GLY A 54 -13.181 -5.846 -4.073 1.00 0.00 C ATOM 418 C GLY A 54 -11.848 -6.330 -3.519 1.00 0.00 C ATOM 419 O GLY A 54 -11.652 -6.407 -2.324 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.014 -5.231 -4.957 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.681 -5.216 -3.337 1.00 0.00 H new ATOM 423 N LEU A 55 -10.931 -6.652 -4.391 1.00 0.00 N ATOM 424 CA LEU A 55 -9.586 -7.134 -3.952 1.00 0.00 C ATOM 425 C LEU A 55 -8.482 -6.389 -4.695 1.00 0.00 C ATOM 426 O LEU A 55 -8.658 -5.902 -5.794 1.00 0.00 O ATOM 427 CB LEU A 55 -9.464 -8.632 -4.235 1.00 0.00 C ATOM 428 CG LEU A 55 -10.496 -9.396 -3.396 1.00 0.00 C ATOM 429 CD1 LEU A 55 -10.488 -10.873 -3.798 1.00 0.00 C ATOM 430 CD2 LEU A 55 -10.157 -9.264 -1.898 1.00 0.00 C ATOM 0 H LEU A 55 -11.057 -6.601 -5.402 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.480 -6.948 -2.883 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.625 -8.827 -5.295 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.458 -8.977 -3.997 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.486 -8.976 -3.575 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.221 -11.416 -3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.740 -10.964 -4.855 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.497 -11.292 -3.624 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.894 -9.809 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.166 -9.677 -1.711 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.171 -8.212 -1.613 1.00 0.00 H new ATOM 442 N ALA A 56 -7.335 -6.310 -4.079 1.00 0.00 N ATOM 443 CA ALA A 56 -6.169 -5.613 -4.695 1.00 0.00 C ATOM 444 C ALA A 56 -4.878 -6.218 -4.152 1.00 0.00 C ATOM 445 O ALA A 56 -4.866 -6.845 -3.111 1.00 0.00 O ATOM 446 CB ALA A 56 -6.213 -4.128 -4.347 1.00 0.00 C ATOM 0 H ALA A 56 -7.153 -6.707 -3.157 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.208 -5.732 -5.778 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.359 -3.623 -4.799 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.136 -3.692 -4.729 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.175 -4.007 -3.264 1.00 0.00 H new ATOM 452 N LEU A 57 -3.790 -6.048 -4.860 1.00 0.00 N ATOM 453 CA LEU A 57 -2.484 -6.625 -4.402 1.00 0.00 C ATOM 454 C LEU A 57 -1.385 -5.573 -4.431 1.00 0.00 C ATOM 455 O LEU A 57 -1.394 -4.644 -5.218 1.00 0.00 O ATOM 456 CB LEU A 57 -2.076 -7.790 -5.311 1.00 0.00 C ATOM 457 CG LEU A 57 -3.124 -8.923 -5.226 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.173 -8.754 -6.333 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.429 -10.278 -5.397 1.00 0.00 C ATOM 0 H LEU A 57 -3.747 -5.533 -5.739 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.615 -6.978 -3.379 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.986 -7.444 -6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.097 -8.167 -5.015 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.614 -8.878 -4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.907 -9.557 -6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.674 -7.793 -6.216 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.684 -8.791 -7.306 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.169 -11.076 -5.337 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.935 -10.313 -6.368 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.689 -10.409 -4.608 1.00 0.00 H new ATOM 471 N LEU A 58 -0.428 -5.738 -3.558 1.00 0.00 N ATOM 472 CA LEU A 58 0.724 -4.792 -3.472 1.00 0.00 C ATOM 473 C LEU A 58 2.001 -5.525 -3.840 1.00 0.00 C ATOM 474 O LEU A 58 2.232 -6.636 -3.419 1.00 0.00 O ATOM 475 CB LEU A 58 0.839 -4.256 -2.037 1.00 0.00 C ATOM 476 CG LEU A 58 -0.221 -3.165 -1.809 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.564 -3.079 -0.319 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.331 -1.810 -2.276 1.00 0.00 C ATOM 0 H LEU A 58 -0.395 -6.505 -2.886 1.00 0.00 H new ATOM 0 HA LEU A 58 0.567 -3.960 -4.159 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.700 -5.067 -1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.836 -3.850 -1.868 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.118 -3.414 -2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.315 -2.305 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.955 -4.038 0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.334 -2.833 0.247 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.420 -1.036 -2.115 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.229 -1.568 -1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.576 -1.863 -3.337 1.00 0.00 H new ATOM 490 N VAL A 59 2.826 -4.896 -4.630 1.00 0.00 N ATOM 491 CA VAL A 59 4.113 -5.529 -5.060 1.00 0.00 C ATOM 492 C VAL A 59 5.288 -4.650 -4.642 1.00 0.00 C ATOM 493 O VAL A 59 5.290 -3.449 -4.831 1.00 0.00 O ATOM 494 CB VAL A 59 4.113 -5.704 -6.579 1.00 0.00 C ATOM 495 CG1 VAL A 59 5.446 -6.318 -7.009 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.967 -6.637 -6.981 1.00 0.00 C ATOM 0 H VAL A 59 2.665 -3.960 -5.002 1.00 0.00 H new ATOM 0 HA VAL A 59 4.212 -6.504 -4.583 1.00 0.00 H new ATOM 0 HB VAL A 59 3.980 -4.737 -7.064 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.455 -6.447 -8.091 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.262 -5.658 -6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.572 -7.288 -6.527 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.964 -6.764 -8.064 1.00 0.00 H new ATOM 0 HG22 VAL A 59 3.102 -7.607 -6.502 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.018 -6.205 -6.664 1.00 0.00 H new ATOM 506 N VAL A 60 6.284 -5.261 -4.059 1.00 0.00 N ATOM 507 CA VAL A 60 7.482 -4.503 -3.598 1.00 0.00 C ATOM 508 C VAL A 60 8.274 -4.015 -4.808 1.00 0.00 C ATOM 509 O VAL A 60 8.982 -4.759 -5.454 1.00 0.00 O ATOM 510 CB VAL A 60 8.353 -5.413 -2.723 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.636 -4.676 -2.339 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.580 -5.780 -1.452 1.00 0.00 C ATOM 0 H VAL A 60 6.318 -6.265 -3.881 1.00 0.00 H new ATOM 0 HA VAL A 60 7.169 -3.639 -3.011 1.00 0.00 H new ATOM 0 HB VAL A 60 8.605 -6.318 -3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.255 -5.323 -1.717 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.185 -4.407 -3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.384 -3.772 -1.784 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.195 -6.427 -0.826 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.332 -4.872 -0.902 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.662 -6.302 -1.722 1.00 0.00 H new ATOM 522 N LYS A 61 8.134 -2.756 -5.108 1.00 0.00 N ATOM 523 CA LYS A 61 8.847 -2.151 -6.267 1.00 0.00 C ATOM 524 C LYS A 61 10.348 -2.160 -6.006 1.00 0.00 C ATOM 525 O LYS A 61 11.133 -2.480 -6.871 1.00 0.00 O ATOM 526 CB LYS A 61 8.364 -0.705 -6.445 1.00 0.00 C ATOM 527 CG LYS A 61 9.001 -0.095 -7.700 1.00 0.00 C ATOM 528 CD LYS A 61 8.483 1.336 -7.898 1.00 0.00 C ATOM 529 CE LYS A 61 9.103 1.940 -9.162 1.00 0.00 C ATOM 530 NZ LYS A 61 8.587 3.327 -9.361 1.00 0.00 N ATOM 0 H LYS A 61 7.543 -2.107 -4.588 1.00 0.00 H new ATOM 0 HA LYS A 61 8.639 -2.725 -7.170 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.278 -0.683 -6.530 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.627 -0.113 -5.568 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.087 -0.089 -7.603 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.763 -0.703 -8.573 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.396 1.331 -7.981 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.734 1.947 -7.031 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.189 1.955 -9.075 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.861 1.324 -10.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.109 3.391 -10.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.912 3.558 -8.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.380 3.999 -9.335 1.00 0.00 H new ATOM 544 N ARG A 62 10.750 -1.800 -4.813 1.00 0.00 N ATOM 545 CA ARG A 62 12.209 -1.771 -4.474 1.00 0.00 C ATOM 546 C ARG A 62 12.448 -2.502 -3.156 1.00 0.00 C ATOM 547 O ARG A 62 11.722 -2.347 -2.194 1.00 0.00 O ATOM 548 CB ARG A 62 12.675 -0.317 -4.354 1.00 0.00 C ATOM 549 CG ARG A 62 14.187 -0.283 -4.102 1.00 0.00 C ATOM 550 CD ARG A 62 14.661 1.174 -4.002 1.00 0.00 C ATOM 551 NE ARG A 62 16.154 1.211 -3.975 1.00 0.00 N ATOM 552 CZ ARG A 62 16.787 2.291 -3.587 1.00 0.00 C ATOM 553 NH1 ARG A 62 16.124 3.355 -3.206 1.00 0.00 N ATOM 554 NH2 ARG A 62 18.091 2.306 -3.583 1.00 0.00 N ATOM 0 H ARG A 62 10.128 -1.523 -4.054 1.00 0.00 H new ATOM 0 HA ARG A 62 12.774 -2.268 -5.263 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.435 0.229 -5.266 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.149 0.179 -3.538 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.424 -0.817 -3.182 1.00 0.00 H new ATOM 0 HG3 ARG A 62 14.712 -0.792 -4.910 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.288 1.748 -4.850 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.259 1.638 -3.101 1.00 0.00 H new ATOM 0 HE ARG A 62 16.685 0.389 -4.261 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.104 3.349 -3.209 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.628 4.190 -2.906 1.00 0.00 H new ATOM 0 HH21 ARG A 62 18.611 1.481 -3.881 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.590 3.143 -3.282 1.00 0.00 H new ATOM 568 N GLY A 63 13.480 -3.300 -3.116 1.00 0.00 N ATOM 569 CA GLY A 63 13.813 -4.060 -1.876 1.00 0.00 C ATOM 570 C GLY A 63 14.541 -5.357 -2.244 1.00 0.00 C ATOM 571 O GLY A 63 14.597 -5.753 -3.393 1.00 0.00 O ATOM 0 H GLY A 63 14.114 -3.460 -3.899 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.440 -3.453 -1.223 1.00 0.00 H new ATOM 0 HA3 GLY A 63 12.902 -4.288 -1.322 1.00 0.00 H new ATOM 575 N PRO A 64 15.097 -6.013 -1.260 1.00 0.00 N ATOM 576 CA PRO A 64 15.841 -7.295 -1.457 1.00 0.00 C ATOM 577 C PRO A 64 14.923 -8.400 -1.990 1.00 0.00 C ATOM 578 O PRO A 64 15.332 -9.245 -2.757 1.00 0.00 O ATOM 579 CB PRO A 64 16.340 -7.641 -0.038 1.00 0.00 C ATOM 580 CG PRO A 64 15.418 -6.905 0.880 1.00 0.00 C ATOM 581 CD PRO A 64 15.074 -5.612 0.154 1.00 0.00 C ATOM 0 HA PRO A 64 16.645 -7.204 -2.188 1.00 0.00 H new ATOM 0 HB2 PRO A 64 16.304 -8.715 0.143 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.374 -7.328 0.105 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.522 -7.489 1.088 1.00 0.00 H new ATOM 0 HG3 PRO A 64 15.896 -6.703 1.838 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.097 -5.230 0.450 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.800 -4.826 0.363 1.00 0.00 H new ATOM 589 N ASN A 65 13.686 -8.391 -1.567 1.00 0.00 N ATOM 590 CA ASN A 65 12.718 -9.430 -2.025 1.00 0.00 C ATOM 591 C ASN A 65 12.454 -9.246 -3.515 1.00 0.00 C ATOM 592 O ASN A 65 12.451 -10.195 -4.267 1.00 0.00 O ATOM 593 CB ASN A 65 11.397 -9.272 -1.252 1.00 0.00 C ATOM 594 CG ASN A 65 11.545 -9.854 0.157 1.00 0.00 C ATOM 595 OD1 ASN A 65 12.483 -10.572 0.434 1.00 0.00 O ATOM 596 ND2 ASN A 65 10.643 -9.578 1.061 1.00 0.00 N ATOM 0 H ASN A 65 13.303 -7.703 -0.919 1.00 0.00 H new ATOM 0 HA ASN A 65 13.131 -10.422 -1.844 1.00 0.00 H new ATOM 0 HB2 ASN A 65 11.124 -8.218 -1.193 1.00 0.00 H new ATOM 0 HB3 ASN A 65 10.592 -9.781 -1.782 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.727 -9.966 2.000 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.855 -8.974 0.827 1.00 0.00 H new ATOM 603 N ALA A 66 12.231 -8.020 -3.928 1.00 0.00 N ATOM 604 CA ALA A 66 11.953 -7.706 -5.364 1.00 0.00 C ATOM 605 C ALA A 66 11.224 -8.864 -6.042 1.00 0.00 C ATOM 606 O ALA A 66 11.829 -9.799 -6.520 1.00 0.00 O ATOM 607 CB ALA A 66 13.267 -7.413 -6.087 1.00 0.00 C ATOM 0 H ALA A 66 12.231 -7.206 -3.313 1.00 0.00 H new ATOM 0 HA ALA A 66 11.310 -6.827 -5.412 1.00 0.00 H new ATOM 0 HB1 ALA A 66 13.064 -7.184 -7.133 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.758 -6.560 -5.618 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.918 -8.285 -6.026 1.00 0.00 H new ATOM 613 N GLY A 67 9.922 -8.795 -6.078 1.00 0.00 N ATOM 614 CA GLY A 67 9.108 -9.874 -6.720 1.00 0.00 C ATOM 615 C GLY A 67 7.999 -10.312 -5.759 1.00 0.00 C ATOM 616 O GLY A 67 6.982 -10.831 -6.169 1.00 0.00 O ATOM 0 H GLY A 67 9.377 -8.027 -5.685 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.675 -9.512 -7.653 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.743 -10.723 -6.972 1.00 0.00 H new ATOM 620 N SER A 68 8.205 -10.115 -4.485 1.00 0.00 N ATOM 621 CA SER A 68 7.190 -10.525 -3.470 1.00 0.00 C ATOM 622 C SER A 68 5.955 -9.637 -3.549 1.00 0.00 C ATOM 623 O SER A 68 5.983 -8.549 -4.084 1.00 0.00 O ATOM 624 CB SER A 68 7.803 -10.417 -2.073 1.00 0.00 C ATOM 625 OG SER A 68 8.163 -9.066 -1.815 1.00 0.00 O ATOM 0 H SER A 68 9.044 -9.682 -4.099 1.00 0.00 H new ATOM 0 HA SER A 68 6.891 -11.554 -3.671 1.00 0.00 H new ATOM 0 HB2 SER A 68 7.091 -10.764 -1.324 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.681 -11.059 -1.999 1.00 0.00 H new ATOM 0 HG SER A 68 8.554 -8.997 -0.919 1.00 0.00 H new ATOM 631 N ARG A 69 4.867 -10.112 -3.011 1.00 0.00 N ATOM 632 CA ARG A 69 3.601 -9.329 -3.038 1.00 0.00 C ATOM 633 C ARG A 69 2.716 -9.699 -1.849 1.00 0.00 C ATOM 634 O ARG A 69 2.891 -10.717 -1.210 1.00 0.00 O ATOM 635 CB ARG A 69 2.846 -9.615 -4.343 1.00 0.00 C ATOM 636 CG ARG A 69 2.250 -11.035 -4.330 1.00 0.00 C ATOM 637 CD ARG A 69 3.365 -12.056 -4.087 1.00 0.00 C ATOM 638 NE ARG A 69 2.923 -13.402 -4.548 1.00 0.00 N ATOM 639 CZ ARG A 69 3.146 -13.793 -5.778 1.00 0.00 C ATOM 640 NH1 ARG A 69 3.722 -12.993 -6.642 1.00 0.00 N ATOM 641 NH2 ARG A 69 2.786 -14.990 -6.147 1.00 0.00 N ATOM 0 H ARG A 69 4.800 -11.019 -2.549 1.00 0.00 H new ATOM 0 HA ARG A 69 3.846 -8.269 -2.978 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.050 -8.883 -4.476 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.522 -9.507 -5.191 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.493 -11.116 -3.550 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.754 -11.241 -5.279 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.268 -11.757 -4.620 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.617 -12.089 -3.027 1.00 0.00 H new ATOM 0 HE ARG A 69 2.442 -14.025 -3.899 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.002 -12.054 -6.359 1.00 0.00 H new ATOM 0 HH12 ARG A 69 3.890 -13.310 -7.597 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.334 -15.615 -5.480 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.956 -15.302 -7.103 1.00 0.00 H new ATOM 655 N PHE A 70 1.743 -8.870 -1.577 1.00 0.00 N ATOM 656 CA PHE A 70 0.797 -9.130 -0.449 1.00 0.00 C ATOM 657 C PHE A 70 -0.640 -9.034 -0.950 1.00 0.00 C ATOM 658 O PHE A 70 -0.977 -8.213 -1.783 1.00 0.00 O ATOM 659 CB PHE A 70 1.026 -8.092 0.649 1.00 0.00 C ATOM 660 CG PHE A 70 2.434 -8.228 1.177 1.00 0.00 C ATOM 661 CD1 PHE A 70 2.779 -9.331 1.969 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.396 -7.255 0.877 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.084 -9.457 2.462 1.00 0.00 C ATOM 664 CE2 PHE A 70 4.699 -7.382 1.369 1.00 0.00 C ATOM 665 CZ PHE A 70 5.043 -8.483 2.162 1.00 0.00 C ATOM 0 H PHE A 70 1.560 -8.011 -2.096 1.00 0.00 H new ATOM 0 HA PHE A 70 0.971 -10.130 -0.051 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.868 -7.088 0.255 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.307 -8.234 1.456 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.039 -10.084 2.199 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.131 -6.406 0.265 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.350 -10.306 3.074 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.440 -6.631 1.137 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.049 -8.581 2.542 1.00 0.00 H new ATOM 675 N LEU A 71 -1.486 -9.887 -0.443 1.00 0.00 N ATOM 676 CA LEU A 71 -2.914 -9.895 -0.867 1.00 0.00 C ATOM 677 C LEU A 71 -3.792 -9.270 0.211 1.00 0.00 C ATOM 678 O LEU A 71 -3.755 -9.647 1.366 1.00 0.00 O ATOM 679 CB LEU A 71 -3.353 -11.343 -1.113 1.00 0.00 C ATOM 680 CG LEU A 71 -4.741 -11.357 -1.810 1.00 0.00 C ATOM 681 CD1 LEU A 71 -4.789 -12.483 -2.843 1.00 0.00 C ATOM 682 CD2 LEU A 71 -5.844 -11.580 -0.768 1.00 0.00 C ATOM 0 H LEU A 71 -1.245 -10.589 0.257 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.020 -9.312 -1.782 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.618 -11.856 -1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.404 -11.883 -0.168 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.898 -10.399 -2.306 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.764 -12.489 -3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.012 -12.324 -3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.625 -13.439 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.815 -11.589 -1.263 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.683 -12.534 -0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.818 -10.775 -0.033 1.00 0.00 H new ATOM 694 N LEU A 72 -4.589 -8.312 -0.178 1.00 0.00 N ATOM 695 CA LEU A 72 -5.494 -7.626 0.790 1.00 0.00 C ATOM 696 C LEU A 72 -6.847 -8.331 0.828 1.00 0.00 C ATOM 697 O LEU A 72 -7.576 -8.372 -0.141 1.00 0.00 O ATOM 698 CB LEU A 72 -5.683 -6.166 0.353 1.00 0.00 C ATOM 699 CG LEU A 72 -4.317 -5.480 0.228 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.514 -4.037 -0.252 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.611 -5.471 1.592 1.00 0.00 C ATOM 0 H LEU A 72 -4.653 -7.971 -1.137 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.052 -7.658 1.786 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.208 -6.128 -0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.301 -5.637 1.078 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.705 -6.026 -0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.544 -3.548 -0.341 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.009 -4.041 -1.223 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.129 -3.495 0.467 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.641 -4.982 1.497 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.221 -4.928 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.469 -6.496 1.935 1.00 0.00 H new ATOM 713 N ASP A 73 -7.178 -8.877 1.963 1.00 0.00 N ATOM 714 CA ASP A 73 -8.479 -9.582 2.126 1.00 0.00 C ATOM 715 C ASP A 73 -8.839 -9.619 3.611 1.00 0.00 C ATOM 716 O ASP A 73 -9.643 -10.417 4.048 1.00 0.00 O ATOM 717 CB ASP A 73 -8.367 -11.005 1.579 1.00 0.00 C ATOM 718 CG ASP A 73 -7.262 -11.770 2.314 1.00 0.00 C ATOM 719 OD1 ASP A 73 -6.579 -11.164 3.125 1.00 0.00 O ATOM 720 OD2 ASP A 73 -7.112 -12.952 2.048 1.00 0.00 O ATOM 0 H ASP A 73 -6.593 -8.864 2.798 1.00 0.00 H new ATOM 0 HA ASP A 73 -9.258 -9.055 1.574 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.318 -11.524 1.697 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.150 -10.976 0.511 1.00 0.00 H new ATOM 725 N GLN A 74 -8.243 -8.750 4.391 1.00 0.00 N ATOM 726 CA GLN A 74 -8.533 -8.707 5.862 1.00 0.00 C ATOM 727 C GLN A 74 -8.858 -7.273 6.285 1.00 0.00 C ATOM 728 O GLN A 74 -8.243 -6.320 5.849 1.00 0.00 O ATOM 729 CB GLN A 74 -7.312 -9.201 6.638 1.00 0.00 C ATOM 730 CG GLN A 74 -7.675 -9.328 8.118 1.00 0.00 C ATOM 731 CD GLN A 74 -6.476 -9.864 8.902 1.00 0.00 C ATOM 732 OE1 GLN A 74 -5.553 -10.406 8.328 1.00 0.00 O ATOM 733 NE2 GLN A 74 -6.453 -9.737 10.200 1.00 0.00 N ATOM 0 H GLN A 74 -7.562 -8.062 4.070 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.387 -9.349 6.077 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -6.983 -10.164 6.248 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.481 -8.506 6.513 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -7.975 -8.357 8.513 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -8.527 -9.997 8.237 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.228 -9.282 10.682 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.660 -10.093 10.733 1.00 0.00 H new ATOM 742 N ALA A 75 -9.840 -7.130 7.133 1.00 0.00 N ATOM 743 CA ALA A 75 -10.255 -5.781 7.611 1.00 0.00 C ATOM 744 C ALA A 75 -9.164 -5.165 8.483 1.00 0.00 C ATOM 745 O ALA A 75 -8.606 -5.801 9.353 1.00 0.00 O ATOM 746 CB ALA A 75 -11.550 -5.908 8.425 1.00 0.00 C ATOM 0 H ALA A 75 -10.380 -7.903 7.520 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.420 -5.135 6.748 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.857 -4.923 8.777 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.335 -6.330 7.797 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.379 -6.562 9.280 1.00 0.00 H new ATOM 752 N ILE A 76 -8.876 -3.921 8.240 1.00 0.00 N ATOM 753 CA ILE A 76 -7.836 -3.195 9.016 1.00 0.00 C ATOM 754 C ILE A 76 -6.535 -3.992 8.990 1.00 0.00 C ATOM 755 O ILE A 76 -6.315 -4.866 9.801 1.00 0.00 O ATOM 756 CB ILE A 76 -8.309 -3.001 10.460 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.808 -2.667 10.471 1.00 0.00 C ATOM 758 CG2 ILE A 76 -7.518 -1.860 11.108 1.00 0.00 C ATOM 759 CD1 ILE A 76 -10.093 -1.451 9.583 1.00 0.00 C ATOM 0 H ILE A 76 -9.329 -3.362 7.517 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.664 -2.216 8.569 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.143 -3.919 11.023 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -10.380 -3.525 10.118 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.134 -2.464 11.491 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.854 -1.722 12.136 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.456 -2.105 11.104 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.680 -0.940 10.546 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.160 -1.228 9.602 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.536 -0.591 9.954 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.786 -1.668 8.560 1.00 0.00 H new ATOM 771 N THR A 77 -5.678 -3.691 8.049 1.00 0.00 N ATOM 772 CA THR A 77 -4.376 -4.423 7.937 1.00 0.00 C ATOM 773 C THR A 77 -3.231 -3.536 8.416 1.00 0.00 C ATOM 774 O THR A 77 -2.956 -2.486 7.868 1.00 0.00 O ATOM 775 CB THR A 77 -4.144 -4.823 6.478 1.00 0.00 C ATOM 776 OG1 THR A 77 -5.150 -5.741 6.078 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.769 -5.481 6.347 1.00 0.00 C ATOM 0 H THR A 77 -5.823 -2.965 7.348 1.00 0.00 H new ATOM 0 HA THR A 77 -4.412 -5.316 8.561 1.00 0.00 H new ATOM 0 HB THR A 77 -4.186 -3.938 5.843 1.00 0.00 H new ATOM 0 HG1 THR A 77 -5.005 -5.998 5.143 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.600 -5.767 5.309 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.998 -4.777 6.659 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.728 -6.368 6.979 1.00 0.00 H new ATOM 785 N SER A 78 -2.565 -3.973 9.448 1.00 0.00 N ATOM 786 CA SER A 78 -1.421 -3.202 10.015 1.00 0.00 C ATOM 787 C SER A 78 -0.139 -3.548 9.265 1.00 0.00 C ATOM 788 O SER A 78 -0.035 -4.571 8.620 1.00 0.00 O ATOM 789 CB SER A 78 -1.260 -3.556 11.497 1.00 0.00 C ATOM 790 OG SER A 78 -2.247 -2.865 12.247 1.00 0.00 O ATOM 0 H SER A 78 -2.768 -4.848 9.932 1.00 0.00 H new ATOM 0 HA SER A 78 -1.617 -2.135 9.911 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.363 -4.632 11.640 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.264 -3.282 11.843 1.00 0.00 H new ATOM 0 HG SER A 78 -2.152 -3.088 13.197 1.00 0.00 H new ATOM 796 N ALA A 79 0.838 -2.686 9.346 1.00 0.00 N ATOM 797 CA ALA A 79 2.135 -2.924 8.642 1.00 0.00 C ATOM 798 C ALA A 79 3.225 -3.298 9.646 1.00 0.00 C ATOM 799 O ALA A 79 3.055 -3.197 10.844 1.00 0.00 O ATOM 800 CB ALA A 79 2.551 -1.645 7.908 1.00 0.00 C ATOM 0 H ALA A 79 0.794 -1.816 9.876 1.00 0.00 H new ATOM 0 HA ALA A 79 2.007 -3.742 7.933 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.497 -1.813 7.392 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.784 -1.377 7.181 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.669 -0.835 8.627 1.00 0.00 H new ATOM 806 N GLY A 80 4.348 -3.724 9.138 1.00 0.00 N ATOM 807 CA GLY A 80 5.490 -4.116 10.009 1.00 0.00 C ATOM 808 C GLY A 80 5.250 -5.510 10.584 1.00 0.00 C ATOM 809 O GLY A 80 5.912 -6.464 10.226 1.00 0.00 O ATOM 0 H GLY A 80 4.525 -3.818 8.138 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.417 -4.104 9.436 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.606 -3.395 10.818 1.00 0.00 H new ATOM 813 N ARG A 81 4.313 -5.618 11.484 1.00 0.00 N ATOM 814 CA ARG A 81 4.013 -6.931 12.125 1.00 0.00 C ATOM 815 C ARG A 81 3.323 -7.855 11.129 1.00 0.00 C ATOM 816 O ARG A 81 2.525 -7.436 10.318 1.00 0.00 O ATOM 817 CB ARG A 81 3.098 -6.707 13.337 1.00 0.00 C ATOM 818 CG ARG A 81 3.872 -5.972 14.435 1.00 0.00 C ATOM 819 CD ARG A 81 2.942 -5.665 15.613 1.00 0.00 C ATOM 820 NE ARG A 81 2.439 -6.943 16.203 1.00 0.00 N ATOM 821 CZ ARG A 81 3.135 -7.578 17.112 1.00 0.00 C ATOM 822 NH1 ARG A 81 4.296 -7.118 17.504 1.00 0.00 N ATOM 823 NH2 ARG A 81 2.668 -8.679 17.632 1.00 0.00 N ATOM 0 H ARG A 81 3.734 -4.843 11.807 1.00 0.00 H new ATOM 0 HA ARG A 81 4.946 -7.393 12.448 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.224 -6.126 13.043 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.734 -7.663 13.712 1.00 0.00 H new ATOM 0 HG2 ARG A 81 4.710 -6.582 14.772 1.00 0.00 H new ATOM 0 HG3 ARG A 81 4.290 -5.046 14.040 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.475 -5.089 16.369 1.00 0.00 H new ATOM 0 HD3 ARG A 81 2.104 -5.053 15.278 1.00 0.00 H new ATOM 0 HE ARG A 81 1.545 -7.324 15.894 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.666 -6.257 17.101 1.00 0.00 H new ATOM 0 HH12 ARG A 81 4.831 -7.620 18.213 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.764 -9.042 17.330 1.00 0.00 H new ATOM 0 HH22 ARG A 81 3.207 -9.177 18.340 1.00 0.00 H new ATOM 837 N HIS A 82 3.647 -9.118 11.187 1.00 0.00 N ATOM 838 CA HIS A 82 3.040 -10.102 10.245 1.00 0.00 C ATOM 839 C HIS A 82 1.705 -10.614 10.811 1.00 0.00 C ATOM 840 O HIS A 82 0.728 -10.708 10.101 1.00 0.00 O ATOM 841 CB HIS A 82 4.038 -11.275 10.024 1.00 0.00 C ATOM 842 CG HIS A 82 3.390 -12.605 10.328 1.00 0.00 C ATOM 843 ND1 HIS A 82 3.814 -13.420 11.361 1.00 0.00 N ATOM 844 CD2 HIS A 82 2.324 -13.248 9.751 1.00 0.00 C ATOM 845 CE1 HIS A 82 3.014 -14.501 11.376 1.00 0.00 C ATOM 846 NE2 HIS A 82 2.087 -14.447 10.414 1.00 0.00 N ATOM 0 H HIS A 82 4.312 -9.514 11.852 1.00 0.00 H new ATOM 0 HA HIS A 82 2.838 -9.625 9.286 1.00 0.00 H new ATOM 0 HB2 HIS A 82 4.391 -11.266 8.993 1.00 0.00 H new ATOM 0 HB3 HIS A 82 4.911 -11.138 10.662 1.00 0.00 H new ATOM 0 HD2 HIS A 82 1.756 -12.879 8.910 1.00 0.00 H new ATOM 0 HE1 HIS A 82 3.109 -15.314 12.080 1.00 0.00 H new ATOM 0 HE2 HIS A 82 1.363 -15.136 10.211 1.00 0.00 H new ATOM 854 N PRO A 83 1.670 -10.971 12.073 1.00 0.00 N ATOM 855 CA PRO A 83 0.431 -11.506 12.717 1.00 0.00 C ATOM 856 C PRO A 83 -0.772 -10.574 12.550 1.00 0.00 C ATOM 857 O PRO A 83 -0.678 -9.377 12.726 1.00 0.00 O ATOM 858 CB PRO A 83 0.825 -11.641 14.200 1.00 0.00 C ATOM 859 CG PRO A 83 2.306 -11.801 14.180 1.00 0.00 C ATOM 860 CD PRO A 83 2.793 -10.926 13.029 1.00 0.00 C ATOM 0 HA PRO A 83 0.112 -12.445 12.265 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.529 -10.761 14.771 1.00 0.00 H new ATOM 0 HB3 PRO A 83 0.339 -12.500 14.663 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.748 -11.487 15.126 1.00 0.00 H new ATOM 0 HG3 PRO A 83 2.586 -12.843 14.027 1.00 0.00 H new ATOM 0 HD2 PRO A 83 3.002 -9.908 13.358 1.00 0.00 H new ATOM 0 HD3 PRO A 83 3.712 -11.314 12.589 1.00 0.00 H new ATOM 868 N ASP A 84 -1.896 -11.144 12.206 1.00 0.00 N ATOM 869 CA ASP A 84 -3.143 -10.349 12.004 1.00 0.00 C ATOM 870 C ASP A 84 -2.870 -9.239 10.994 1.00 0.00 C ATOM 871 O ASP A 84 -3.427 -8.164 11.067 1.00 0.00 O ATOM 872 CB ASP A 84 -3.609 -9.757 13.334 1.00 0.00 C ATOM 873 CG ASP A 84 -4.178 -10.870 14.220 1.00 0.00 C ATOM 874 OD1 ASP A 84 -4.443 -11.943 13.699 1.00 0.00 O ATOM 875 OD2 ASP A 84 -4.338 -10.630 15.404 1.00 0.00 O ATOM 0 H ASP A 84 -2.004 -12.147 12.054 1.00 0.00 H new ATOM 0 HA ASP A 84 -3.932 -10.997 11.622 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -2.776 -9.267 13.838 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.368 -8.994 13.158 1.00 0.00 H new ATOM 880 N SER A 85 -2.014 -9.507 10.047 1.00 0.00 N ATOM 881 CA SER A 85 -1.687 -8.486 9.013 1.00 0.00 C ATOM 882 C SER A 85 -1.091 -9.168 7.778 1.00 0.00 C ATOM 883 O SER A 85 -0.052 -9.795 7.829 1.00 0.00 O ATOM 884 CB SER A 85 -0.684 -7.489 9.592 1.00 0.00 C ATOM 885 OG SER A 85 0.101 -6.946 8.537 1.00 0.00 O ATOM 0 H SER A 85 -1.524 -10.396 9.945 1.00 0.00 H new ATOM 0 HA SER A 85 -2.595 -7.960 8.720 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.209 -6.691 10.118 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.042 -7.983 10.321 1.00 0.00 H new ATOM 0 HG SER A 85 -0.267 -6.078 8.268 1.00 0.00 H new ATOM 891 N ASP A 86 -1.767 -9.044 6.669 1.00 0.00 N ATOM 892 CA ASP A 86 -1.286 -9.665 5.404 1.00 0.00 C ATOM 893 C ASP A 86 0.035 -9.017 5.001 1.00 0.00 C ATOM 894 O ASP A 86 0.928 -9.665 4.498 1.00 0.00 O ATOM 895 CB ASP A 86 -2.327 -9.433 4.300 1.00 0.00 C ATOM 896 CG ASP A 86 -3.541 -10.331 4.543 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.435 -11.229 5.361 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.557 -10.107 3.904 1.00 0.00 O ATOM 0 H ASP A 86 -2.645 -8.531 6.586 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.140 -10.736 5.548 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.632 -8.387 4.288 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.892 -9.649 3.324 1.00 0.00 H new ATOM 903 N ILE A 87 0.151 -7.733 5.211 1.00 0.00 N ATOM 904 CA ILE A 87 1.402 -7.011 4.837 1.00 0.00 C ATOM 905 C ILE A 87 2.459 -7.222 5.915 1.00 0.00 C ATOM 906 O ILE A 87 2.240 -6.961 7.079 1.00 0.00 O ATOM 907 CB ILE A 87 1.105 -5.512 4.693 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.146 -5.295 3.518 1.00 0.00 C ATOM 909 CG2 ILE A 87 2.409 -4.755 4.436 1.00 0.00 C ATOM 910 CD1 ILE A 87 -0.353 -3.848 3.516 1.00 0.00 C ATOM 0 H ILE A 87 -0.573 -7.149 5.629 1.00 0.00 H new ATOM 0 HA ILE A 87 1.774 -7.400 3.889 1.00 0.00 H new ATOM 0 HB ILE A 87 0.647 -5.141 5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 87 0.652 -5.516 2.578 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.698 -5.980 3.594 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.198 -3.691 4.334 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.091 -4.911 5.272 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.869 -5.123 3.519 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.035 -3.699 2.678 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.876 -3.642 4.450 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.495 -3.171 3.418 1.00 0.00 H new ATOM 922 N PHE A 88 3.610 -7.698 5.520 1.00 0.00 N ATOM 923 CA PHE A 88 4.720 -7.942 6.494 1.00 0.00 C ATOM 924 C PHE A 88 6.008 -7.301 5.974 1.00 0.00 C ATOM 925 O PHE A 88 6.819 -7.926 5.321 1.00 0.00 O ATOM 926 CB PHE A 88 4.895 -9.454 6.691 1.00 0.00 C ATOM 927 CG PHE A 88 6.085 -9.719 7.588 1.00 0.00 C ATOM 928 CD1 PHE A 88 6.066 -9.287 8.920 1.00 0.00 C ATOM 929 CD2 PHE A 88 7.205 -10.399 7.090 1.00 0.00 C ATOM 930 CE1 PHE A 88 7.166 -9.532 9.752 1.00 0.00 C ATOM 931 CE2 PHE A 88 8.303 -10.644 7.922 1.00 0.00 C ATOM 932 CZ PHE A 88 8.284 -10.210 9.253 1.00 0.00 C ATOM 0 H PHE A 88 3.833 -7.932 4.553 1.00 0.00 H new ATOM 0 HA PHE A 88 4.481 -7.492 7.457 1.00 0.00 H new ATOM 0 HB2 PHE A 88 3.994 -9.879 7.132 1.00 0.00 H new ATOM 0 HB3 PHE A 88 5.039 -9.942 5.727 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.203 -8.765 9.306 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.220 -10.734 6.063 1.00 0.00 H new ATOM 0 HE1 PHE A 88 7.151 -9.198 10.779 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.165 -11.168 7.537 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.132 -10.398 9.895 1.00 0.00 H new ATOM 942 N LEU A 89 6.186 -6.041 6.271 1.00 0.00 N ATOM 943 CA LEU A 89 7.406 -5.312 5.824 1.00 0.00 C ATOM 944 C LEU A 89 8.572 -5.646 6.744 1.00 0.00 C ATOM 945 O LEU A 89 8.409 -5.876 7.923 1.00 0.00 O ATOM 946 CB LEU A 89 7.142 -3.802 5.850 1.00 0.00 C ATOM 947 CG LEU A 89 6.070 -3.456 4.810 1.00 0.00 C ATOM 948 CD1 LEU A 89 5.681 -1.981 4.944 1.00 0.00 C ATOM 949 CD2 LEU A 89 6.608 -3.720 3.391 1.00 0.00 C ATOM 0 H LEU A 89 5.528 -5.480 6.812 1.00 0.00 H new ATOM 0 HA LEU A 89 7.654 -5.617 4.807 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.813 -3.496 6.843 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.061 -3.257 5.636 1.00 0.00 H new ATOM 0 HG LEU A 89 5.193 -4.081 4.981 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.919 -1.737 4.204 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.288 -1.798 5.944 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.559 -1.357 4.780 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.840 -3.472 2.659 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.490 -3.104 3.216 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.876 -4.772 3.293 1.00 0.00 H new ATOM 961 N ASP A 90 9.748 -5.680 6.186 1.00 0.00 N ATOM 962 CA ASP A 90 10.966 -6.008 6.975 1.00 0.00 C ATOM 963 C ASP A 90 11.099 -5.058 8.161 1.00 0.00 C ATOM 964 O ASP A 90 10.347 -5.121 9.109 1.00 0.00 O ATOM 965 CB ASP A 90 12.199 -5.864 6.071 1.00 0.00 C ATOM 966 CG ASP A 90 13.460 -6.222 6.861 1.00 0.00 C ATOM 967 OD1 ASP A 90 13.351 -6.404 8.062 1.00 0.00 O ATOM 968 OD2 ASP A 90 14.515 -6.298 6.252 1.00 0.00 O ATOM 0 H ASP A 90 9.919 -5.491 5.198 1.00 0.00 H new ATOM 0 HA ASP A 90 10.888 -7.029 7.347 1.00 0.00 H new ATOM 0 HB2 ASP A 90 12.104 -6.516 5.203 1.00 0.00 H new ATOM 0 HB3 ASP A 90 12.270 -4.843 5.696 1.00 0.00 H new ATOM 973 N ASP A 91 12.060 -4.178 8.101 1.00 0.00 N ATOM 974 CA ASP A 91 12.282 -3.210 9.207 1.00 0.00 C ATOM 975 C ASP A 91 13.141 -2.051 8.705 1.00 0.00 C ATOM 976 O ASP A 91 12.677 -1.176 8.007 1.00 0.00 O ATOM 977 CB ASP A 91 13.019 -3.903 10.354 1.00 0.00 C ATOM 978 CG ASP A 91 12.097 -4.920 11.021 1.00 0.00 C ATOM 979 OD1 ASP A 91 11.012 -4.532 11.419 1.00 0.00 O ATOM 980 OD2 ASP A 91 12.490 -6.071 11.119 1.00 0.00 O ATOM 0 H ASP A 91 12.710 -4.089 7.320 1.00 0.00 H new ATOM 0 HA ASP A 91 11.318 -2.838 9.555 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.912 -4.401 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.350 -3.165 11.084 1.00 0.00 H new ATOM 985 N VAL A 92 14.395 -2.057 9.069 1.00 0.00 N ATOM 986 CA VAL A 92 15.335 -0.981 8.654 1.00 0.00 C ATOM 987 C VAL A 92 14.756 0.383 9.017 1.00 0.00 C ATOM 988 O VAL A 92 15.152 0.995 9.987 1.00 0.00 O ATOM 989 CB VAL A 92 15.558 -1.050 7.143 1.00 0.00 C ATOM 990 CG1 VAL A 92 16.717 -0.130 6.755 1.00 0.00 C ATOM 991 CG2 VAL A 92 15.891 -2.490 6.745 1.00 0.00 C ATOM 0 H VAL A 92 14.815 -2.782 9.651 1.00 0.00 H new ATOM 0 HA VAL A 92 16.285 -1.119 9.171 1.00 0.00 H new ATOM 0 HB VAL A 92 14.654 -0.729 6.626 1.00 0.00 H new ATOM 0 HG11 VAL A 92 16.876 -0.179 5.678 1.00 0.00 H new ATOM 0 HG12 VAL A 92 16.479 0.895 7.040 1.00 0.00 H new ATOM 0 HG13 VAL A 92 17.623 -0.449 7.270 1.00 0.00 H new ATOM 0 HG21 VAL A 92 16.051 -2.542 5.668 1.00 0.00 H new ATOM 0 HG22 VAL A 92 16.796 -2.810 7.262 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.064 -3.144 7.021 1.00 0.00 H new ATOM 1001 N THR A 93 13.824 0.860 8.241 1.00 0.00 N ATOM 1002 CA THR A 93 13.197 2.190 8.506 1.00 0.00 C ATOM 1003 C THR A 93 11.719 1.996 8.840 1.00 0.00 C ATOM 1004 O THR A 93 10.970 2.947 8.921 1.00 0.00 O ATOM 1005 CB THR A 93 13.335 3.066 7.258 1.00 0.00 C ATOM 1006 OG1 THR A 93 12.386 2.668 6.276 1.00 0.00 O ATOM 1007 CG2 THR A 93 14.748 2.926 6.684 1.00 0.00 C ATOM 0 H THR A 93 13.462 0.377 7.419 1.00 0.00 H new ATOM 0 HA THR A 93 13.694 2.673 9.347 1.00 0.00 H new ATOM 0 HB THR A 93 13.153 4.105 7.533 1.00 0.00 H new ATOM 0 HG1 THR A 93 12.335 1.690 6.248 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.843 3.551 5.796 1.00 0.00 H new ATOM 0 HG22 THR A 93 15.477 3.242 7.430 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.931 1.885 6.417 1.00 0.00 H new ATOM 1015 N VAL A 94 11.294 0.770 9.026 1.00 0.00 N ATOM 1016 CA VAL A 94 9.853 0.499 9.349 1.00 0.00 C ATOM 1017 C VAL A 94 9.733 -0.047 10.776 1.00 0.00 C ATOM 1018 O VAL A 94 10.437 -0.951 11.179 1.00 0.00 O ATOM 1019 CB VAL A 94 9.293 -0.526 8.361 1.00 0.00 C ATOM 1020 CG1 VAL A 94 7.902 -0.971 8.825 1.00 0.00 C ATOM 1021 CG2 VAL A 94 9.191 0.118 6.979 1.00 0.00 C ATOM 0 H VAL A 94 11.884 -0.060 8.968 1.00 0.00 H new ATOM 0 HA VAL A 94 9.287 1.427 9.272 1.00 0.00 H new ATOM 0 HB VAL A 94 9.952 -1.393 8.313 1.00 0.00 H new ATOM 0 HG11 VAL A 94 7.501 -1.701 8.123 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.975 -1.422 9.815 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.239 -0.107 8.868 1.00 0.00 H new ATOM 0 HG21 VAL A 94 8.793 -0.606 6.269 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.527 0.981 7.028 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.180 0.439 6.653 1.00 0.00 H new ATOM 1031 N SER A 95 8.837 0.525 11.534 1.00 0.00 N ATOM 1032 CA SER A 95 8.628 0.095 12.948 1.00 0.00 C ATOM 1033 C SER A 95 7.589 -1.026 13.031 1.00 0.00 C ATOM 1034 O SER A 95 7.369 -1.766 12.093 1.00 0.00 O ATOM 1035 CB SER A 95 8.139 1.293 13.768 1.00 0.00 C ATOM 1036 OG SER A 95 8.298 1.007 15.152 1.00 0.00 O ATOM 0 H SER A 95 8.230 1.286 11.228 1.00 0.00 H new ATOM 0 HA SER A 95 9.574 -0.277 13.342 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.704 2.186 13.502 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.092 1.499 13.545 1.00 0.00 H new ATOM 0 HG SER A 95 7.988 1.771 15.682 1.00 0.00 H new ATOM 1042 N ARG A 96 6.965 -1.150 14.174 1.00 0.00 N ATOM 1043 CA ARG A 96 5.941 -2.215 14.391 1.00 0.00 C ATOM 1044 C ARG A 96 4.755 -1.993 13.457 1.00 0.00 C ATOM 1045 O ARG A 96 4.214 -2.920 12.895 1.00 0.00 O ATOM 1046 CB ARG A 96 5.453 -2.151 15.844 1.00 0.00 C ATOM 1047 CG ARG A 96 6.558 -2.641 16.783 1.00 0.00 C ATOM 1048 CD ARG A 96 6.120 -2.463 18.240 1.00 0.00 C ATOM 1049 NE ARG A 96 4.923 -3.314 18.511 1.00 0.00 N ATOM 1050 CZ ARG A 96 5.059 -4.560 18.891 1.00 0.00 C ATOM 1051 NH1 ARG A 96 6.249 -5.088 19.043 1.00 0.00 N ATOM 1052 NH2 ARG A 96 3.998 -5.282 19.127 1.00 0.00 N ATOM 0 H ARG A 96 7.125 -0.547 14.981 1.00 0.00 H new ATOM 0 HA ARG A 96 6.384 -3.189 14.186 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.173 -1.129 16.099 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.561 -2.765 15.965 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.777 -3.690 16.585 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.477 -2.084 16.600 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.934 -2.738 18.911 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.886 -1.416 18.435 1.00 0.00 H new ATOM 0 HE ARG A 96 3.989 -2.920 18.399 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.082 -4.527 18.865 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.342 -6.060 19.339 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.069 -4.875 19.015 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.097 -6.253 19.423 1.00 0.00 H new ATOM 1066 N ARG A 97 4.352 -0.763 13.302 1.00 0.00 N ATOM 1067 CA ARG A 97 3.197 -0.441 12.415 1.00 0.00 C ATOM 1068 C ARG A 97 3.156 1.069 12.152 1.00 0.00 C ATOM 1069 O ARG A 97 2.170 1.729 12.406 1.00 0.00 O ATOM 1070 CB ARG A 97 1.900 -0.899 13.082 1.00 0.00 C ATOM 1071 CG ARG A 97 1.822 -0.357 14.515 1.00 0.00 C ATOM 1072 CD ARG A 97 0.485 -0.775 15.138 1.00 0.00 C ATOM 1073 NE ARG A 97 0.397 -0.249 16.534 1.00 0.00 N ATOM 1074 CZ ARG A 97 -0.707 -0.384 17.229 1.00 0.00 C ATOM 1075 NH1 ARG A 97 -1.759 -0.969 16.710 1.00 0.00 N ATOM 1076 NH2 ARG A 97 -0.763 0.076 18.448 1.00 0.00 N ATOM 0 H ARG A 97 4.779 0.044 13.758 1.00 0.00 H new ATOM 0 HA ARG A 97 3.309 -0.961 11.463 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.043 -0.550 12.506 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.853 -1.988 13.094 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.650 -0.743 15.109 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.912 0.729 14.511 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -0.342 -0.391 14.541 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.398 -1.861 15.142 1.00 0.00 H new ATOM 0 HE ARG A 97 1.202 0.219 16.950 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -1.725 -1.326 15.755 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -2.612 -1.068 17.261 1.00 0.00 H new ATOM 0 HH21 ARG A 97 0.049 0.538 18.857 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -1.619 -0.026 18.993 1.00 0.00 H new ATOM 1090 N HIS A 98 4.230 1.610 11.639 1.00 0.00 N ATOM 1091 CA HIS A 98 4.281 3.074 11.342 1.00 0.00 C ATOM 1092 C HIS A 98 3.232 3.396 10.288 1.00 0.00 C ATOM 1093 O HIS A 98 2.996 4.539 9.956 1.00 0.00 O ATOM 1094 CB HIS A 98 5.670 3.440 10.810 1.00 0.00 C ATOM 1095 CG HIS A 98 5.807 4.938 10.767 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.877 5.705 11.918 1.00 0.00 N ATOM 1097 CD2 HIS A 98 5.882 5.823 9.720 1.00 0.00 C ATOM 1098 CE1 HIS A 98 5.988 6.992 11.541 1.00 0.00 C ATOM 1099 NE2 HIS A 98 5.995 7.120 10.212 1.00 0.00 N ATOM 0 H HIS A 98 5.081 1.097 11.411 1.00 0.00 H new ATOM 0 HA HIS A 98 4.083 3.644 12.250 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.442 3.011 11.449 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.812 3.021 9.814 1.00 0.00 H new ATOM 0 HD2 HIS A 98 5.857 5.554 8.674 1.00 0.00 H new ATOM 0 HE1 HIS A 98 6.062 7.821 12.230 1.00 0.00 H new ATOM 0 HE2 HIS A 98 6.068 7.983 9.673 1.00 0.00 H new ATOM 1107 N ALA A 99 2.602 2.384 9.758 1.00 0.00 N ATOM 1108 CA ALA A 99 1.554 2.597 8.718 1.00 0.00 C ATOM 1109 C ALA A 99 0.433 1.580 8.903 1.00 0.00 C ATOM 1110 O ALA A 99 0.644 0.459 9.330 1.00 0.00 O ATOM 1111 CB ALA A 99 2.165 2.435 7.327 1.00 0.00 C ATOM 0 H ALA A 99 2.770 1.408 10.003 1.00 0.00 H new ATOM 0 HA ALA A 99 1.150 3.604 8.819 1.00 0.00 H new ATOM 0 HB1 ALA A 99 1.395 2.592 6.571 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.961 3.167 7.192 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.575 1.430 7.225 1.00 0.00 H new ATOM 1117 N GLU A 100 -0.765 1.979 8.583 1.00 0.00 N ATOM 1118 CA GLU A 100 -1.938 1.070 8.730 1.00 0.00 C ATOM 1119 C GLU A 100 -2.926 1.309 7.594 1.00 0.00 C ATOM 1120 O GLU A 100 -3.198 2.426 7.200 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.623 1.340 10.069 1.00 0.00 C ATOM 1122 CG GLU A 100 -3.794 0.370 10.241 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.436 0.577 11.613 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -4.125 1.572 12.247 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.228 -0.262 12.005 1.00 0.00 O ATOM 0 H GLU A 100 -0.985 2.907 8.221 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.598 0.035 8.694 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.912 1.218 10.886 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.979 2.369 10.107 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.532 0.532 9.455 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.445 -0.658 10.143 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.468 0.242 7.076 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.455 0.338 5.961 1.00 0.00 C ATOM 1134 C PHE A 101 -5.848 0.044 6.496 1.00 0.00 C ATOM 1135 O PHE A 101 -6.032 -0.752 7.395 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.096 -0.679 4.876 1.00 0.00 C ATOM 1137 CG PHE A 101 -2.714 -0.380 4.349 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.547 0.557 3.324 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.599 -1.039 4.884 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.266 0.835 2.832 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.317 -0.760 4.392 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.152 0.178 3.366 1.00 0.00 C ATOM 0 H PHE A 101 -3.266 -0.709 7.383 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.433 1.342 5.537 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.132 -1.690 5.283 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -4.824 -0.636 4.066 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.406 1.066 2.912 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.728 -1.762 5.676 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.138 1.557 2.039 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.543 -1.268 4.804 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.836 0.395 2.986 1.00 0.00 H new ATOM 1152 N ARG A 102 -6.832 0.700 5.947 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.239 0.497 6.408 1.00 0.00 C ATOM 1154 C ARG A 102 -9.162 0.308 5.211 1.00 0.00 C ATOM 1155 O ARG A 102 -8.996 0.911 4.168 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.687 1.718 7.211 1.00 0.00 C ATOM 1157 CG ARG A 102 -7.809 1.852 8.455 1.00 0.00 C ATOM 1158 CD ARG A 102 -8.205 3.105 9.242 1.00 0.00 C ATOM 1159 NE ARG A 102 -9.589 2.938 9.775 1.00 0.00 N ATOM 1160 CZ ARG A 102 -10.177 3.918 10.414 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -9.551 5.049 10.623 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -11.394 3.761 10.854 1.00 0.00 N ATOM 0 H ARG A 102 -6.723 1.376 5.191 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.286 -0.394 7.034 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.612 2.617 6.600 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.733 1.615 7.499 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.917 0.968 9.084 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.760 1.911 8.165 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.505 3.270 10.061 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -8.155 3.983 8.598 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.080 2.054 9.641 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.596 5.173 10.287 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -10.018 5.806 11.122 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.882 2.879 10.700 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.858 4.520 11.353 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.142 -0.538 5.373 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.115 -0.812 4.277 1.00 0.00 C ATOM 1178 C LEU A 103 -12.454 -0.156 4.606 1.00 0.00 C ATOM 1179 O LEU A 103 -13.068 -0.426 5.618 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.295 -2.329 4.142 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.307 -2.640 3.029 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -11.805 -2.075 1.692 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.480 -4.155 2.911 1.00 0.00 C ATOM 0 H LEU A 103 -10.312 -1.060 6.233 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.743 -0.403 3.338 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.338 -2.799 3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.641 -2.748 5.087 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.264 -2.179 3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.528 -2.300 0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.684 -0.995 1.776 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.846 -2.529 1.442 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.198 -4.379 2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.521 -4.613 2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.845 -4.554 3.857 1.00 0.00 H new ATOM 1195 N GLU A 104 -12.905 0.707 3.738 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.205 1.411 3.950 1.00 0.00 C ATOM 1197 C GLU A 104 -15.262 0.852 2.993 1.00 0.00 C ATOM 1198 O GLU A 104 -15.636 -0.300 3.066 1.00 0.00 O ATOM 1199 CB GLU A 104 -14.021 2.910 3.660 1.00 0.00 C ATOM 1200 CG GLU A 104 -13.276 3.098 2.319 1.00 0.00 C ATOM 1201 CD GLU A 104 -11.770 3.195 2.574 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -11.292 2.492 3.449 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -11.120 3.964 1.886 1.00 0.00 O ATOM 0 H GLU A 104 -12.421 0.959 2.876 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.528 1.262 4.980 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -14.992 3.403 3.619 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.459 3.379 4.467 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -13.489 2.261 1.654 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.629 4.000 1.819 1.00 0.00 H new ATOM 1210 N ASN A 105 -15.755 1.682 2.102 1.00 0.00 N ATOM 1211 CA ASN A 105 -16.807 1.246 1.141 1.00 0.00 C ATOM 1212 C ASN A 105 -16.169 0.633 -0.108 1.00 0.00 C ATOM 1213 O ASN A 105 -16.046 1.267 -1.136 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.677 2.456 0.756 1.00 0.00 C ATOM 1215 CG ASN A 105 -16.850 3.503 0.002 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -15.638 3.459 0.006 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -17.467 4.456 -0.649 1.00 0.00 N ATOM 0 H ASN A 105 -15.466 2.655 2.003 1.00 0.00 H new ATOM 0 HA ASN A 105 -17.431 0.487 1.612 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -18.510 2.128 0.134 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -18.105 2.902 1.654 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -16.929 5.161 -1.153 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -18.486 4.494 -0.653 1.00 0.00 H new ATOM 1224 N ASN A 106 -15.783 -0.609 -0.008 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.167 -1.321 -1.161 1.00 0.00 C ATOM 1226 C ASN A 106 -13.981 -0.517 -1.681 1.00 0.00 C ATOM 1227 O ASN A 106 -13.664 -0.543 -2.851 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.212 -1.507 -2.263 1.00 0.00 C ATOM 1229 CG ASN A 106 -17.232 -2.566 -1.829 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -16.964 -3.364 -0.951 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -18.400 -2.607 -2.411 1.00 0.00 N ATOM 0 H ASN A 106 -15.871 -1.170 0.840 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.813 -2.302 -0.843 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.717 -0.562 -2.463 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.727 -1.812 -3.190 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -19.086 -3.307 -2.129 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -18.627 -1.939 -3.147 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.316 0.187 -0.806 1.00 0.00 N ATOM 1239 CA GLU A 107 -12.129 0.999 -1.213 1.00 0.00 C ATOM 1240 C GLU A 107 -11.052 0.914 -0.126 1.00 0.00 C ATOM 1241 O GLU A 107 -11.312 1.103 1.045 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.551 2.459 -1.420 1.00 0.00 C ATOM 1243 CG GLU A 107 -13.438 2.571 -2.665 1.00 0.00 C ATOM 1244 CD GLU A 107 -12.627 2.204 -3.912 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -11.410 2.273 -3.845 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -13.238 1.859 -4.910 1.00 0.00 O ATOM 0 H GLU A 107 -13.546 0.236 0.186 1.00 0.00 H new ATOM 0 HA GLU A 107 -11.725 0.609 -2.147 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -13.091 2.819 -0.544 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -11.669 3.090 -1.532 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -14.298 1.908 -2.571 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -13.826 3.586 -2.757 1.00 0.00 H new ATOM 1253 N PHE A 108 -9.840 0.620 -0.525 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.711 0.503 0.454 1.00 0.00 C ATOM 1255 C PHE A 108 -7.986 1.844 0.565 1.00 0.00 C ATOM 1256 O PHE A 108 -7.911 2.604 -0.379 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.713 -0.566 -0.025 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.287 -1.951 0.185 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.107 -2.609 1.412 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.988 -2.582 -0.848 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.633 -3.895 1.600 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -9.513 -3.867 -0.658 1.00 0.00 C ATOM 1263 CZ PHE A 108 -9.335 -4.523 0.566 1.00 0.00 C ATOM 0 H PHE A 108 -9.580 0.454 -1.497 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.114 0.219 1.426 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.486 -0.415 -1.080 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.774 -0.467 0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.564 -2.125 2.210 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.125 -2.078 -1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.496 -4.401 2.544 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -10.055 -4.352 -1.456 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.740 -5.514 0.712 1.00 0.00 H new ATOM 1273 N ASN A 109 -7.450 2.131 1.721 1.00 0.00 N ATOM 1274 CA ASN A 109 -6.722 3.421 1.925 1.00 0.00 C ATOM 1275 C ASN A 109 -5.576 3.235 2.916 1.00 0.00 C ATOM 1276 O ASN A 109 -5.429 2.199 3.533 1.00 0.00 O ATOM 1277 CB ASN A 109 -7.683 4.476 2.474 1.00 0.00 C ATOM 1278 CG ASN A 109 -8.409 3.944 3.715 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -7.929 3.049 4.381 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -9.554 4.472 4.057 1.00 0.00 N ATOM 0 H ASN A 109 -7.485 1.524 2.540 1.00 0.00 H new ATOM 0 HA ASN A 109 -6.321 3.745 0.965 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -7.132 5.382 2.728 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.410 4.748 1.709 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -10.045 4.133 4.884 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -9.956 5.224 3.497 1.00 0.00 H new ATOM 1287 N VAL A 110 -4.763 4.251 3.065 1.00 0.00 N ATOM 1288 CA VAL A 110 -3.604 4.184 4.011 1.00 0.00 C ATOM 1289 C VAL A 110 -3.682 5.342 4.996 1.00 0.00 C ATOM 1290 O VAL A 110 -3.878 6.483 4.632 1.00 0.00 O ATOM 1291 CB VAL A 110 -2.285 4.253 3.230 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -2.064 5.660 2.658 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.131 3.908 4.177 1.00 0.00 C ATOM 0 H VAL A 110 -4.853 5.136 2.565 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.642 3.242 4.558 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.326 3.544 2.403 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.123 5.686 2.108 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.884 5.912 1.986 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.028 6.383 3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.188 3.954 3.633 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.110 4.622 5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.273 2.902 4.573 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.531 5.034 6.254 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.588 6.078 7.320 1.00 0.00 C ATOM 1305 C VAL A 111 -2.346 5.972 8.205 1.00 0.00 C ATOM 1306 O VAL A 111 -1.961 4.905 8.640 1.00 0.00 O ATOM 1307 CB VAL A 111 -4.846 5.864 8.167 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.779 6.744 9.419 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -6.078 6.245 7.343 1.00 0.00 C ATOM 0 H VAL A 111 -3.368 4.087 6.596 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.620 7.068 6.864 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.911 4.818 8.465 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.675 6.590 10.020 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.899 6.477 10.004 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.715 7.792 9.124 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.977 6.095 7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.009 7.292 7.049 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.127 5.620 6.451 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.728 7.089 8.473 1.00 0.00 N ATOM 1320 CA ASP A 112 -0.507 7.103 9.335 1.00 0.00 C ATOM 1321 C ASP A 112 -0.917 7.261 10.798 1.00 0.00 C ATOM 1322 O ASP A 112 -1.447 8.277 11.204 1.00 0.00 O ATOM 1323 CB ASP A 112 0.390 8.277 8.920 1.00 0.00 C ATOM 1324 CG ASP A 112 1.765 8.138 9.579 1.00 0.00 C ATOM 1325 OD1 ASP A 112 2.079 7.046 10.024 1.00 0.00 O ATOM 1326 OD2 ASP A 112 2.480 9.127 9.627 1.00 0.00 O ATOM 0 H ASP A 112 -2.018 8.004 8.129 1.00 0.00 H new ATOM 0 HA ASP A 112 0.039 6.167 9.215 1.00 0.00 H new ATOM 0 HB2 ASP A 112 0.497 8.299 7.835 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.071 9.220 9.214 1.00 0.00 H new ATOM 1331 N VAL A 113 -0.678 6.249 11.582 1.00 0.00 N ATOM 1332 CA VAL A 113 -1.046 6.303 13.023 1.00 0.00 C ATOM 1333 C VAL A 113 -0.109 7.262 13.755 1.00 0.00 C ATOM 1334 O VAL A 113 0.840 6.861 14.398 1.00 0.00 O ATOM 1335 CB VAL A 113 -0.952 4.894 13.630 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -2.182 4.080 13.213 1.00 0.00 C ATOM 1337 CG2 VAL A 113 0.314 4.186 13.130 1.00 0.00 C ATOM 0 H VAL A 113 -0.239 5.378 11.283 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.069 6.664 13.128 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.910 4.977 14.716 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.119 3.080 13.642 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.084 4.573 13.574 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.219 4.007 12.126 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.370 3.189 13.567 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.281 4.105 12.044 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.192 4.761 13.424 1.00 0.00 H new ATOM 1405 N THR A 119 3.826 8.181 5.531 1.00 0.00 N ATOM 1406 CA THR A 119 3.551 7.680 4.153 1.00 0.00 C ATOM 1407 C THR A 119 3.306 8.851 3.212 1.00 0.00 C ATOM 1408 O THR A 119 2.570 9.766 3.518 1.00 0.00 O ATOM 1409 CB THR A 119 2.322 6.766 4.176 1.00 0.00 C ATOM 1410 OG1 THR A 119 2.493 5.774 5.180 1.00 0.00 O ATOM 1411 CG2 THR A 119 2.165 6.091 2.812 1.00 0.00 C ATOM 0 HA THR A 119 4.414 7.117 3.798 1.00 0.00 H new ATOM 0 HB THR A 119 1.431 7.355 4.394 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.984 6.156 5.937 1.00 0.00 H new ATOM 0 HG21 THR A 119 1.291 5.440 2.827 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.038 6.852 2.042 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.054 5.499 2.594 1.00 0.00 H new ATOM 1419 N TYR A 120 3.925 8.814 2.061 1.00 0.00 N ATOM 1420 CA TYR A 120 3.755 9.911 1.059 1.00 0.00 C ATOM 1421 C TYR A 120 3.217 9.333 -0.247 1.00 0.00 C ATOM 1422 O TYR A 120 3.550 8.235 -0.647 1.00 0.00 O ATOM 1423 CB TYR A 120 5.103 10.593 0.783 1.00 0.00 C ATOM 1424 CG TYR A 120 5.858 10.825 2.079 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.241 11.488 3.149 1.00 0.00 C ATOM 1426 CD2 TYR A 120 7.183 10.381 2.205 1.00 0.00 C ATOM 1427 CE1 TYR A 120 5.949 11.707 4.339 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.888 10.600 3.394 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.271 11.260 4.461 1.00 0.00 C ATOM 1430 OH TYR A 120 7.968 11.474 5.632 1.00 0.00 O ATOM 0 H TYR A 120 4.549 8.062 1.768 1.00 0.00 H new ATOM 0 HA TYR A 120 3.054 10.644 1.460 1.00 0.00 H new ATOM 0 HB2 TYR A 120 5.700 9.974 0.114 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.939 11.544 0.276 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.221 11.830 3.057 1.00 0.00 H new ATOM 0 HD2 TYR A 120 7.660 9.869 1.382 1.00 0.00 H new ATOM 0 HE1 TYR A 120 5.475 12.221 5.162 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.909 10.259 3.487 1.00 0.00 H new ATOM 0 HH TYR A 120 8.870 11.100 5.549 1.00 0.00 H new ATOM 1440 N VAL A 121 2.377 10.082 -0.907 1.00 0.00 N ATOM 1441 CA VAL A 121 1.779 9.621 -2.196 1.00 0.00 C ATOM 1442 C VAL A 121 2.489 10.297 -3.373 1.00 0.00 C ATOM 1443 O VAL A 121 3.062 11.360 -3.241 1.00 0.00 O ATOM 1444 CB VAL A 121 0.277 9.956 -2.213 1.00 0.00 C ATOM 1445 CG1 VAL A 121 0.050 11.429 -2.573 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.422 9.066 -3.244 1.00 0.00 C ATOM 0 H VAL A 121 2.074 11.008 -0.605 1.00 0.00 H new ATOM 0 HA VAL A 121 1.904 8.542 -2.289 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.134 9.777 -1.220 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.019 11.642 -2.579 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.542 12.064 -1.836 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.465 11.630 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.487 9.297 -3.262 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.005 9.247 -4.230 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.283 8.019 -2.975 1.00 0.00 H new ATOM 1456 N ASN A 122 2.460 9.652 -4.509 1.00 0.00 N ATOM 1457 CA ASN A 122 3.134 10.180 -5.737 1.00 0.00 C ATOM 1458 C ASN A 122 3.075 11.710 -5.784 1.00 0.00 C ATOM 1459 O ASN A 122 4.058 12.363 -6.071 1.00 0.00 O ATOM 1460 CB ASN A 122 2.448 9.598 -6.991 1.00 0.00 C ATOM 1461 CG ASN A 122 1.006 10.104 -7.122 1.00 0.00 C ATOM 1462 OD1 ASN A 122 0.397 10.508 -6.155 1.00 0.00 O ATOM 1463 ND2 ASN A 122 0.432 10.089 -8.299 1.00 0.00 N ATOM 0 H ASN A 122 1.986 8.759 -4.642 1.00 0.00 H new ATOM 0 HA ASN A 122 4.181 9.878 -5.711 1.00 0.00 H new ATOM 0 HB2 ASN A 122 3.015 9.875 -7.880 1.00 0.00 H new ATOM 0 HB3 ASN A 122 2.450 8.509 -6.937 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.528 10.417 -8.402 1.00 0.00 H new ATOM 0 HD22 ASN A 122 0.945 9.749 -9.112 1.00 0.00 H new ATOM 1470 N ARG A 123 1.935 12.277 -5.505 1.00 0.00 N ATOM 1471 CA ARG A 123 1.793 13.765 -5.536 1.00 0.00 C ATOM 1472 C ARG A 123 2.465 14.404 -4.317 1.00 0.00 C ATOM 1473 O ARG A 123 3.669 14.365 -4.166 1.00 0.00 O ATOM 1474 CB ARG A 123 0.301 14.133 -5.525 1.00 0.00 C ATOM 1475 CG ARG A 123 -0.337 13.748 -6.860 1.00 0.00 C ATOM 1476 CD ARG A 123 -1.833 14.090 -6.831 1.00 0.00 C ATOM 1477 NE ARG A 123 -2.449 13.737 -8.145 1.00 0.00 N ATOM 1478 CZ ARG A 123 -3.739 13.862 -8.329 1.00 0.00 C ATOM 1479 NH1 ARG A 123 -4.513 14.297 -7.365 1.00 0.00 N ATOM 1480 NH2 ARG A 123 -4.260 13.550 -9.484 1.00 0.00 N ATOM 0 H ARG A 123 1.086 11.771 -5.254 1.00 0.00 H new ATOM 0 HA ARG A 123 2.273 14.137 -6.441 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -0.204 13.618 -4.708 1.00 0.00 H new ATOM 0 HB3 ARG A 123 0.182 15.202 -5.349 1.00 0.00 H new ATOM 0 HG2 ARG A 123 0.153 14.280 -7.676 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -0.200 12.683 -7.047 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -2.327 13.544 -6.027 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -1.971 15.152 -6.626 1.00 0.00 H new ATOM 0 HE ARG A 123 -1.860 13.396 -8.905 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -4.112 14.542 -6.460 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -5.517 14.390 -7.520 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -3.663 13.211 -10.238 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -5.265 13.645 -9.633 1.00 0.00 H new ATOM 1494 N GLU A 124 1.682 15.018 -3.460 1.00 0.00 N ATOM 1495 CA GLU A 124 2.238 15.706 -2.255 1.00 0.00 C ATOM 1496 C GLU A 124 2.021 14.835 -1.005 1.00 0.00 C ATOM 1497 O GLU A 124 1.055 14.103 -0.916 1.00 0.00 O ATOM 1498 CB GLU A 124 1.541 17.062 -2.064 1.00 0.00 C ATOM 1499 CG GLU A 124 0.039 16.924 -2.337 1.00 0.00 C ATOM 1500 CD GLU A 124 -0.694 18.188 -1.868 1.00 0.00 C ATOM 1501 OE1 GLU A 124 -0.774 19.127 -2.645 1.00 0.00 O ATOM 1502 OE2 GLU A 124 -1.173 18.190 -0.745 1.00 0.00 O ATOM 0 H GLU A 124 0.667 15.071 -3.548 1.00 0.00 H new ATOM 0 HA GLU A 124 3.307 15.865 -2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.702 17.423 -1.048 1.00 0.00 H new ATOM 0 HB3 GLU A 124 1.975 17.801 -2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -0.133 16.767 -3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.355 16.050 -1.818 1.00 0.00 H new ATOM 1509 N PRO A 125 2.932 14.898 -0.061 1.00 0.00 N ATOM 1510 CA PRO A 125 2.854 14.091 1.194 1.00 0.00 C ATOM 1511 C PRO A 125 1.595 14.378 2.012 1.00 0.00 C ATOM 1512 O PRO A 125 1.198 15.512 2.185 1.00 0.00 O ATOM 1513 CB PRO A 125 4.128 14.485 1.975 1.00 0.00 C ATOM 1514 CG PRO A 125 4.594 15.774 1.366 1.00 0.00 C ATOM 1515 CD PRO A 125 4.117 15.770 -0.078 1.00 0.00 C ATOM 0 HA PRO A 125 2.797 13.024 0.976 1.00 0.00 H new ATOM 0 HB2 PRO A 125 3.914 14.608 3.037 1.00 0.00 H new ATOM 0 HB3 PRO A 125 4.893 13.713 1.891 1.00 0.00 H new ATOM 0 HG2 PRO A 125 4.186 16.628 1.907 1.00 0.00 H new ATOM 0 HG3 PRO A 125 5.680 15.855 1.415 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.868 16.775 -0.418 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.884 15.387 -0.750 1.00 0.00 H new ATOM 1523 N VAL A 126 0.983 13.346 2.530 1.00 0.00 N ATOM 1524 CA VAL A 126 -0.249 13.520 3.362 1.00 0.00 C ATOM 1525 C VAL A 126 -0.265 12.513 4.517 1.00 0.00 C ATOM 1526 O VAL A 126 0.420 11.510 4.501 1.00 0.00 O ATOM 1527 CB VAL A 126 -1.494 13.320 2.494 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -1.570 14.433 1.449 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -1.433 11.962 1.783 1.00 0.00 C ATOM 0 H VAL A 126 1.286 12.379 2.412 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.248 14.529 3.774 1.00 0.00 H new ATOM 0 HB VAL A 126 -2.377 13.349 3.132 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.456 14.291 0.830 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.628 15.399 1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -0.680 14.403 0.820 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.324 11.832 1.169 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -0.547 11.923 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.384 11.165 2.525 1.00 0.00 H new ATOM 1539 N ASP A 127 -1.061 12.792 5.518 1.00 0.00 N ATOM 1540 CA ASP A 127 -1.167 11.883 6.697 1.00 0.00 C ATOM 1541 C ASP A 127 -1.954 10.636 6.296 1.00 0.00 C ATOM 1542 O ASP A 127 -1.898 9.616 6.950 1.00 0.00 O ATOM 1543 CB ASP A 127 -1.903 12.603 7.838 1.00 0.00 C ATOM 1544 CG ASP A 127 -1.005 13.692 8.428 1.00 0.00 C ATOM 1545 OD1 ASP A 127 0.178 13.685 8.129 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -1.515 14.512 9.174 1.00 0.00 O ATOM 0 H ASP A 127 -1.650 13.623 5.568 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.169 11.600 7.032 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -2.828 13.044 7.466 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -2.180 11.888 8.613 1.00 0.00 H new ATOM 1551 N SER A 128 -2.685 10.717 5.216 1.00 0.00 N ATOM 1552 CA SER A 128 -3.478 9.544 4.748 1.00 0.00 C ATOM 1553 C SER A 128 -3.787 9.686 3.258 1.00 0.00 C ATOM 1554 O SER A 128 -3.750 10.763 2.698 1.00 0.00 O ATOM 1555 CB SER A 128 -4.787 9.455 5.531 1.00 0.00 C ATOM 1556 OG SER A 128 -5.458 10.708 5.479 1.00 0.00 O ATOM 0 H SER A 128 -2.767 11.551 4.635 1.00 0.00 H new ATOM 0 HA SER A 128 -2.896 8.637 4.912 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.421 8.673 5.112 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.586 9.181 6.567 1.00 0.00 H new ATOM 0 HG SER A 128 -6.298 10.650 5.980 1.00 0.00 H new ATOM 1562 N ALA A 129 -4.092 8.591 2.618 1.00 0.00 N ATOM 1563 CA ALA A 129 -4.406 8.624 1.159 1.00 0.00 C ATOM 1564 C ALA A 129 -5.259 7.416 0.775 1.00 0.00 C ATOM 1565 O ALA A 129 -5.247 6.389 1.425 1.00 0.00 O ATOM 1566 CB ALA A 129 -3.109 8.600 0.354 1.00 0.00 C ATOM 0 H ALA A 129 -4.138 7.666 3.046 1.00 0.00 H new ATOM 0 HA ALA A 129 -4.959 9.537 0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -3.341 8.624 -0.711 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -2.504 9.469 0.613 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -2.555 7.690 0.584 1.00 0.00 H new ATOM 1572 N VAL A 130 -6.008 7.551 -0.287 1.00 0.00 N ATOM 1573 CA VAL A 130 -6.892 6.439 -0.755 1.00 0.00 C ATOM 1574 C VAL A 130 -6.216 5.696 -1.906 1.00 0.00 C ATOM 1575 O VAL A 130 -5.764 6.285 -2.869 1.00 0.00 O ATOM 1576 CB VAL A 130 -8.230 7.019 -1.224 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.058 5.920 -1.893 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -8.993 7.568 -0.015 1.00 0.00 C ATOM 0 H VAL A 130 -6.046 8.395 -0.859 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.068 5.742 0.064 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.050 7.821 -1.939 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.010 6.334 -2.226 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.513 5.525 -2.751 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -9.241 5.117 -1.179 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.946 7.982 -0.344 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -9.173 6.763 0.698 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -8.403 8.350 0.463 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.144 4.402 -1.791 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.496 3.572 -2.845 1.00 0.00 C ATOM 1590 C LEU A 131 -6.442 3.367 -4.021 1.00 0.00 C ATOM 1591 O LEU A 131 -7.635 3.209 -3.862 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.113 2.210 -2.252 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.116 2.410 -1.103 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -3.828 1.061 -0.433 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -2.805 3.007 -1.645 1.00 0.00 C ATOM 0 H LEU A 131 -6.512 3.874 -0.999 1.00 0.00 H new ATOM 0 HA LEU A 131 -4.604 4.087 -3.201 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.004 1.697 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.673 1.577 -3.023 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.545 3.095 -0.372 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.120 1.204 0.383 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -4.755 0.645 -0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.404 0.374 -1.165 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.102 3.146 -0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.373 2.329 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.010 3.969 -2.114 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.893 3.360 -5.202 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.713 3.158 -6.430 1.00 0.00 C ATOM 1609 C ALA A 132 -5.847 2.545 -7.531 1.00 0.00 C ATOM 1610 O ALA A 132 -4.651 2.749 -7.588 1.00 0.00 O ATOM 1611 CB ALA A 132 -7.270 4.499 -6.904 1.00 0.00 C ATOM 0 H ALA A 132 -4.895 3.488 -5.372 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.540 2.485 -6.203 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.869 4.347 -7.802 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.893 4.931 -6.121 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -6.446 5.177 -7.128 1.00 0.00 H new ATOM 1617 N ASN A 133 -6.457 1.782 -8.395 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.708 1.114 -9.498 1.00 0.00 C ATOM 1619 C ASN A 133 -4.649 2.043 -10.086 1.00 0.00 C ATOM 1620 O ASN A 133 -4.937 3.124 -10.555 1.00 0.00 O ATOM 1621 CB ASN A 133 -6.689 0.673 -10.599 1.00 0.00 C ATOM 1622 CG ASN A 133 -7.405 1.887 -11.207 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -7.374 2.967 -10.655 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -8.059 1.747 -12.334 1.00 0.00 N ATOM 0 H ASN A 133 -7.459 1.590 -8.384 1.00 0.00 H new ATOM 0 HA ASN A 133 -5.202 0.240 -9.088 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -6.150 0.135 -11.379 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -7.423 -0.018 -10.184 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -8.541 2.546 -12.746 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -8.086 0.839 -12.799 1.00 0.00 H new ATOM 1631 N GLY A 134 -3.422 1.597 -10.065 1.00 0.00 N ATOM 1632 CA GLY A 134 -2.298 2.402 -10.625 1.00 0.00 C ATOM 1633 C GLY A 134 -1.761 3.361 -9.561 1.00 0.00 C ATOM 1634 O GLY A 134 -1.009 4.264 -9.860 1.00 0.00 O ATOM 0 H GLY A 134 -3.147 0.695 -9.677 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.501 1.741 -10.966 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.640 2.964 -11.494 1.00 0.00 H new ATOM 1638 N ASP A 135 -2.138 3.167 -8.325 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.648 4.068 -7.235 1.00 0.00 C ATOM 1640 C ASP A 135 -0.304 3.573 -6.720 1.00 0.00 C ATOM 1641 O ASP A 135 -0.018 2.395 -6.727 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.662 4.102 -6.083 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.816 5.040 -6.443 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.903 5.425 -7.598 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -4.595 5.352 -5.559 1.00 0.00 O ATOM 0 H ASP A 135 -2.765 2.423 -8.020 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.531 5.075 -7.636 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -3.042 3.099 -5.890 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -2.177 4.441 -5.168 1.00 0.00 H new ATOM 1650 N GLU A 136 0.521 4.482 -6.275 1.00 0.00 N ATOM 1651 CA GLU A 136 1.871 4.106 -5.752 1.00 0.00 C ATOM 1652 C GLU A 136 1.946 4.366 -4.253 1.00 0.00 C ATOM 1653 O GLU A 136 1.419 5.334 -3.743 1.00 0.00 O ATOM 1654 CB GLU A 136 2.937 4.936 -6.469 1.00 0.00 C ATOM 1655 CG GLU A 136 4.322 4.477 -6.005 1.00 0.00 C ATOM 1656 CD GLU A 136 5.404 5.236 -6.776 1.00 0.00 C ATOM 1657 OE1 GLU A 136 5.071 5.851 -7.775 1.00 0.00 O ATOM 1658 OE2 GLU A 136 6.546 5.187 -6.353 1.00 0.00 O ATOM 0 H GLU A 136 0.317 5.481 -6.250 1.00 0.00 H new ATOM 0 HA GLU A 136 2.043 3.045 -5.934 1.00 0.00 H new ATOM 0 HB2 GLU A 136 2.843 4.818 -7.548 1.00 0.00 H new ATOM 0 HB3 GLU A 136 2.799 5.995 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.434 4.652 -4.935 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.433 3.405 -6.165 1.00 0.00 H new ATOM 1665 N VAL A 137 2.610 3.487 -3.549 1.00 0.00 N ATOM 1666 CA VAL A 137 2.756 3.629 -2.068 1.00 0.00 C ATOM 1667 C VAL A 137 4.235 3.683 -1.708 1.00 0.00 C ATOM 1668 O VAL A 137 5.036 2.894 -2.170 1.00 0.00 O ATOM 1669 CB VAL A 137 2.102 2.430 -1.371 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.457 2.451 0.120 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.586 2.521 -1.535 1.00 0.00 C ATOM 0 H VAL A 137 3.065 2.663 -3.943 1.00 0.00 H new ATOM 0 HA VAL A 137 2.268 4.547 -1.741 1.00 0.00 H new ATOM 0 HB VAL A 137 2.464 1.503 -1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.993 1.599 0.617 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.539 2.394 0.237 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.092 3.375 0.568 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.115 1.671 -1.041 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.226 3.447 -1.086 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.333 2.510 -2.595 1.00 0.00 H new ATOM 1681 N GLN A 138 4.592 4.616 -0.871 1.00 0.00 N ATOM 1682 CA GLN A 138 6.012 4.759 -0.438 1.00 0.00 C ATOM 1683 C GLN A 138 6.077 4.804 1.085 1.00 0.00 C ATOM 1684 O GLN A 138 5.629 5.739 1.718 1.00 0.00 O ATOM 1685 CB GLN A 138 6.594 6.045 -1.027 1.00 0.00 C ATOM 1686 CG GLN A 138 8.071 6.149 -0.641 1.00 0.00 C ATOM 1687 CD GLN A 138 8.690 7.395 -1.278 1.00 0.00 C ATOM 1688 OE1 GLN A 138 8.104 8.458 -1.254 1.00 0.00 O ATOM 1689 NE2 GLN A 138 9.861 7.307 -1.846 1.00 0.00 N ATOM 0 H GLN A 138 3.951 5.296 -0.462 1.00 0.00 H new ATOM 0 HA GLN A 138 6.593 3.908 -0.793 1.00 0.00 H new ATOM 0 HB2 GLN A 138 6.488 6.043 -2.112 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.046 6.911 -0.655 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.170 6.197 0.443 1.00 0.00 H new ATOM 0 HG3 GLN A 138 8.605 5.258 -0.970 1.00 0.00 H new ATOM 0 HE21 GLN A 138 10.352 6.413 -1.866 1.00 0.00 H new ATOM 0 HE22 GLN A 138 10.285 8.132 -2.271 1.00 0.00 H new ATOM 1698 N ILE A 139 6.650 3.787 1.668 1.00 0.00 N ATOM 1699 CA ILE A 139 6.786 3.724 3.154 1.00 0.00 C ATOM 1700 C ILE A 139 8.226 3.366 3.524 1.00 0.00 C ATOM 1701 O ILE A 139 8.789 2.398 3.050 1.00 0.00 O ATOM 1702 CB ILE A 139 5.833 2.666 3.716 1.00 0.00 C ATOM 1703 CG1 ILE A 139 4.385 3.096 3.453 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.063 2.535 5.223 1.00 0.00 C ATOM 1705 CD1 ILE A 139 3.436 1.942 3.782 1.00 0.00 C ATOM 0 H ILE A 139 7.036 2.984 1.171 1.00 0.00 H new ATOM 0 HA ILE A 139 6.535 4.696 3.579 1.00 0.00 H new ATOM 0 HB ILE A 139 6.019 1.707 3.233 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.138 3.967 4.060 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.267 3.391 2.410 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.387 1.783 5.630 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.094 2.235 5.409 1.00 0.00 H new ATOM 0 HG23 ILE A 139 5.871 3.494 5.705 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.408 2.251 3.594 1.00 0.00 H new ATOM 0 HD12 ILE A 139 3.677 1.083 3.156 1.00 0.00 H new ATOM 0 HD13 ILE A 139 3.546 1.668 4.831 1.00 0.00 H new ATOM 1717 N GLY A 140 8.807 4.148 4.388 1.00 0.00 N ATOM 1718 CA GLY A 140 10.202 3.893 4.843 1.00 0.00 C ATOM 1719 C GLY A 140 11.146 3.832 3.652 1.00 0.00 C ATOM 1720 O GLY A 140 11.104 4.656 2.763 1.00 0.00 O ATOM 0 H GLY A 140 8.367 4.968 4.806 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.518 4.682 5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.245 2.955 5.397 1.00 0.00 H new ATOM 1724 N LYS A 141 12.004 2.850 3.643 1.00 0.00 N ATOM 1725 CA LYS A 141 12.979 2.694 2.526 1.00 0.00 C ATOM 1726 C LYS A 141 12.398 1.709 1.512 1.00 0.00 C ATOM 1727 O LYS A 141 12.870 1.594 0.402 1.00 0.00 O ATOM 1728 CB LYS A 141 14.299 2.141 3.081 1.00 0.00 C ATOM 1729 CG LYS A 141 15.367 2.177 1.984 1.00 0.00 C ATOM 1730 CD LYS A 141 16.718 1.740 2.555 1.00 0.00 C ATOM 1731 CE LYS A 141 17.784 1.809 1.458 1.00 0.00 C ATOM 1732 NZ LYS A 141 19.108 1.417 2.020 1.00 0.00 N ATOM 0 H LYS A 141 12.072 2.139 4.372 1.00 0.00 H new ATOM 0 HA LYS A 141 13.165 3.656 2.048 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.622 2.732 3.938 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.158 1.119 3.434 1.00 0.00 H new ATOM 0 HG2 LYS A 141 15.080 1.519 1.163 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.445 3.184 1.573 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.997 2.384 3.389 1.00 0.00 H new ATOM 0 HD3 LYS A 141 16.648 0.725 2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 141 17.517 1.146 0.635 1.00 0.00 H new ATOM 0 HE3 LYS A 141 17.835 2.819 1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 19.830 1.465 1.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 19.364 2.066 2.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 19.055 0.446 2.389 1.00 0.00 H new ATOM 1746 N PHE A 142 11.368 1.001 1.895 1.00 0.00 N ATOM 1747 CA PHE A 142 10.734 0.013 0.969 1.00 0.00 C ATOM 1748 C PHE A 142 9.639 0.689 0.153 1.00 0.00 C ATOM 1749 O PHE A 142 8.782 1.373 0.674 1.00 0.00 O ATOM 1750 CB PHE A 142 10.127 -1.136 1.780 1.00 0.00 C ATOM 1751 CG PHE A 142 11.206 -1.786 2.613 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.161 -2.605 1.999 1.00 0.00 C ATOM 1753 CD2 PHE A 142 11.251 -1.574 3.997 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.163 -3.209 2.767 1.00 0.00 C ATOM 1755 CE2 PHE A 142 12.254 -2.179 4.766 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.209 -2.997 4.150 1.00 0.00 C ATOM 0 H PHE A 142 10.935 1.065 2.816 1.00 0.00 H new ATOM 0 HA PHE A 142 11.495 -0.377 0.293 1.00 0.00 H new ATOM 0 HB2 PHE A 142 9.331 -0.761 2.424 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.677 -1.870 1.111 1.00 0.00 H new ATOM 0 HD1 PHE A 142 12.125 -2.771 0.932 1.00 0.00 H new ATOM 0 HD2 PHE A 142 10.513 -0.944 4.471 1.00 0.00 H new ATOM 0 HE1 PHE A 142 13.901 -3.839 2.293 1.00 0.00 H new ATOM 0 HE2 PHE A 142 12.290 -2.015 5.833 1.00 0.00 H new ATOM 0 HZ PHE A 142 13.982 -3.465 4.742 1.00 0.00 H new ATOM 1766 N ARG A 143 9.676 0.493 -1.137 1.00 0.00 N ATOM 1767 CA ARG A 143 8.657 1.105 -2.041 1.00 0.00 C ATOM 1768 C ARG A 143 7.683 0.035 -2.518 1.00 0.00 C ATOM 1769 O ARG A 143 8.066 -1.053 -2.899 1.00 0.00 O ATOM 1770 CB ARG A 143 9.360 1.725 -3.252 1.00 0.00 C ATOM 1771 CG ARG A 143 10.236 2.892 -2.790 1.00 0.00 C ATOM 1772 CD ARG A 143 11.033 3.446 -3.980 1.00 0.00 C ATOM 1773 NE ARG A 143 10.091 4.021 -4.985 1.00 0.00 N ATOM 1774 CZ ARG A 143 10.530 4.445 -6.145 1.00 0.00 C ATOM 1775 NH1 ARG A 143 11.800 4.356 -6.457 1.00 0.00 N ATOM 1776 NH2 ARG A 143 9.690 4.957 -7.001 1.00 0.00 N ATOM 0 H ARG A 143 10.379 -0.074 -1.611 1.00 0.00 H new ATOM 0 HA ARG A 143 8.110 1.876 -1.498 1.00 0.00 H new ATOM 0 HB2 ARG A 143 9.970 0.975 -3.755 1.00 0.00 H new ATOM 0 HB3 ARG A 143 8.623 2.074 -3.975 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.615 3.677 -2.359 1.00 0.00 H new ATOM 0 HG3 ARG A 143 10.918 2.560 -2.007 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.730 4.212 -3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 143 11.627 2.653 -4.434 1.00 0.00 H new ATOM 0 HE ARG A 143 9.097 4.085 -4.767 1.00 0.00 H new ATOM 0 HH11 ARG A 143 12.461 3.953 -5.793 1.00 0.00 H new ATOM 0 HH12 ARG A 143 12.127 4.690 -7.364 1.00 0.00 H new ATOM 0 HH21 ARG A 143 8.700 5.025 -6.766 1.00 0.00 H new ATOM 0 HH22 ARG A 143 10.023 5.289 -7.906 1.00 0.00 H new ATOM 1790 N LEU A 144 6.418 0.355 -2.497 1.00 0.00 N ATOM 1791 CA LEU A 144 5.367 -0.610 -2.945 1.00 0.00 C ATOM 1792 C LEU A 144 4.441 0.067 -3.943 1.00 0.00 C ATOM 1793 O LEU A 144 4.208 1.256 -3.890 1.00 0.00 O ATOM 1794 CB LEU A 144 4.542 -1.081 -1.744 1.00 0.00 C ATOM 1795 CG LEU A 144 5.433 -1.885 -0.771 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.011 -0.951 0.298 1.00 0.00 C ATOM 1797 CD2 LEU A 144 4.595 -2.973 -0.092 1.00 0.00 C ATOM 0 H LEU A 144 6.060 1.258 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 144 5.854 -1.466 -3.412 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.111 -0.222 -1.230 1.00 0.00 H new ATOM 0 HB3 LEU A 144 3.711 -1.699 -2.084 1.00 0.00 H new ATOM 0 HG LEU A 144 6.249 -2.344 -1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 144 6.638 -1.524 0.981 1.00 0.00 H new ATOM 0 HD12 LEU A 144 6.610 -0.176 -0.181 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.197 -0.488 0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.223 -3.541 0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 144 3.778 -2.510 0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.187 -3.643 -0.849 1.00 0.00 H new ATOM 1809 N VAL A 145 3.910 -0.703 -4.854 1.00 0.00 N ATOM 1810 CA VAL A 145 2.982 -0.153 -5.889 1.00 0.00 C ATOM 1811 C VAL A 145 1.617 -0.816 -5.743 1.00 0.00 C ATOM 1812 O VAL A 145 1.501 -2.020 -5.620 1.00 0.00 O ATOM 1813 CB VAL A 145 3.556 -0.423 -7.284 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.647 -1.930 -7.544 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.648 0.219 -8.332 1.00 0.00 C ATOM 0 H VAL A 145 4.082 -1.706 -4.927 1.00 0.00 H new ATOM 0 HA VAL A 145 2.872 0.923 -5.755 1.00 0.00 H new ATOM 0 HB VAL A 145 4.557 0.004 -7.344 1.00 0.00 H new ATOM 0 HG11 VAL A 145 4.057 -2.103 -8.539 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.297 -2.389 -6.799 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.652 -2.371 -7.479 1.00 0.00 H new ATOM 0 HG21 VAL A 145 3.051 0.031 -9.327 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.648 -0.209 -8.258 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.596 1.294 -8.159 1.00 0.00 H new ATOM 1825 N PHE A 146 0.580 -0.021 -5.739 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.801 -0.567 -5.584 1.00 0.00 C ATOM 1827 C PHE A 146 -1.432 -0.786 -6.954 1.00 0.00 C ATOM 1828 O PHE A 146 -1.737 0.146 -7.681 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.650 0.420 -4.778 1.00 0.00 C ATOM 1830 CG PHE A 146 -3.067 -0.099 -4.686 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -4.009 0.248 -5.664 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.439 -0.928 -3.621 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -5.320 -0.233 -5.576 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -4.749 -1.410 -3.533 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.689 -1.063 -4.510 1.00 0.00 C ATOM 0 H PHE A 146 0.631 0.993 -5.837 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.753 -1.521 -5.059 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.231 0.547 -3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.640 1.400 -5.255 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -3.723 0.887 -6.486 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -2.714 -1.196 -2.867 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -6.046 0.035 -6.329 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -5.035 -2.050 -2.711 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.700 -1.436 -4.442 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.632 -2.033 -7.288 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.254 -2.400 -8.595 1.00 0.00 C ATOM 1847 C LEU A 147 -3.255 -3.529 -8.396 1.00 0.00 C ATOM 1848 O LEU A 147 -3.125 -4.351 -7.512 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.161 -2.846 -9.572 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.429 -1.612 -10.127 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.953 -2.019 -10.640 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -1.241 -1.003 -11.284 1.00 0.00 C ATOM 0 H LEU A 147 -1.386 -2.828 -6.699 1.00 0.00 H new ATOM 0 HA LEU A 147 -2.774 -1.533 -9.001 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.454 -3.504 -9.067 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -1.601 -3.418 -10.389 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.320 -0.875 -9.331 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.468 -1.142 -11.032 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.534 -2.445 -9.822 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.843 -2.760 -11.432 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.719 -0.129 -11.674 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.355 -1.742 -12.077 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.225 -0.706 -10.921 1.00 0.00 H new ATOM 1864 N THR A 148 -4.259 -3.562 -9.227 1.00 0.00 N ATOM 1865 CA THR A 148 -5.306 -4.619 -9.125 1.00 0.00 C ATOM 1866 C THR A 148 -4.900 -5.849 -9.935 1.00 0.00 C ATOM 1867 O THR A 148 -3.786 -5.968 -10.397 1.00 0.00 O ATOM 1868 CB THR A 148 -6.635 -4.080 -9.673 1.00 0.00 C ATOM 1869 OG1 THR A 148 -6.403 -3.361 -10.878 1.00 0.00 O ATOM 1870 CG2 THR A 148 -7.281 -3.155 -8.641 1.00 0.00 C ATOM 0 H THR A 148 -4.401 -2.892 -9.983 1.00 0.00 H new ATOM 0 HA THR A 148 -5.418 -4.898 -8.077 1.00 0.00 H new ATOM 0 HB THR A 148 -7.303 -4.917 -9.876 1.00 0.00 H new ATOM 0 HG1 THR A 148 -7.254 -3.021 -11.225 1.00 0.00 H new ATOM 0 HG21 THR A 148 -8.224 -2.774 -9.033 1.00 0.00 H new ATOM 0 HG22 THR A 148 -7.468 -3.710 -7.722 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.612 -2.320 -8.431 1.00 0.00 H new