USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 945 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 121 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 122 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 61 SER OG : rot -80:sc= -1.22 USER MOD Set 2.2: A 68 GLN : amide:sc= 0 K(o=-1.2,f=-3) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -1.81 K(o=-1.8,f=-0.64) USER MOD Single : A 31 GLN : amide:sc= -2.6! C(o=-2.6!,f=-2.7!) USER MOD Single : A 32 MET CE :methyl -164:sc= -3.48! (180deg=-4.68!) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 CYS SG : rot -12:sc= -9.95! USER MOD Single : A 35 LYS NZ :NH3+ -148:sc= 0.0135 (180deg=-0.0421) USER MOD Single : A 41 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.00547) USER MOD Single : A 42 THR OG1 : rot 90:sc= 0.078 USER MOD Single : A 43 SER OG : rot -22:sc= 0.184 USER MOD Single : A 44 GLN : amide:sc= -3.26 K(o=-3.3,f=-0.78) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.139 K(o=-0.14,f=-1.7!) USER MOD Single : A 59 MET CE :methyl -139:sc= -2.12! (180deg=-2.43!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.232 USER MOD Single : A 66 THR OG1 : rot 150:sc= -0.0719 USER MOD Single : A 69 SER OG : rot 14:sc= 0.255 USER MOD Single : A 73 MET CE :methyl -132:sc= -0.659 (180deg=-1.04) USER MOD Single : A 75 THR OG1 : rot 110:sc= -0.493 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot -170:sc= -0.927 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -2.71! C(o=-2.7!,f=-5.4!) USER MOD Single : A 91 MET CE :methyl 146:sc= -1.22 (180deg=-2.32!) USER MOD Single : A 92 GLN : amide:sc= -0.173 K(o=-0.17,f=-1.6!) USER MOD Single : A 95 LYS NZ :NH3+ -159:sc= 0.212 (180deg=-0.0705) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 46:sc= -2.22! USER MOD Single : A 102 HIS : no HD1:sc= -5.7! K(o=-5.7!,f=-4.3) USER MOD Single : A 104 THR OG1 : rot 37:sc= 0.684 USER MOD Single : A 106 MET CE :methyl 179:sc= 0 (180deg=-0.00192) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.013) USER MOD Single : A 114 LYS NZ :NH3+ -126:sc= -1.42! (180deg=-3.37!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00165) USER MOD Single : A 125 THR OG1 : rot -82:sc= -3.06! USER MOD Single : A 127 GLN : amide:sc= -0.645 K(o=-0.64,f=-0.13) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HD1:sc= -4.52! C(o=-4.5!,f=-5.2!) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 364 N SER A 27 -0.869 5.798 -11.220 1.00 0.00 N ATOM 365 CA SER A 27 -0.233 7.106 -11.321 1.00 0.00 C ATOM 366 C SER A 27 0.805 7.292 -10.218 1.00 0.00 C ATOM 367 O SER A 27 0.462 7.434 -9.046 1.00 0.00 O ATOM 368 CB SER A 27 -1.283 8.216 -11.240 1.00 0.00 C ATOM 369 OG SER A 27 -0.820 9.402 -11.863 1.00 0.00 O ATOM 0 HA SER A 27 0.272 7.163 -12.285 1.00 0.00 H new ATOM 0 HB2 SER A 27 -2.204 7.885 -11.720 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.522 8.419 -10.196 1.00 0.00 H new ATOM 0 HG SER A 27 -1.509 10.096 -11.799 1.00 0.00 H new ATOM 375 N ASN A 28 2.077 7.290 -10.605 1.00 0.00 N ATOM 376 CA ASN A 28 3.166 7.457 -9.649 1.00 0.00 C ATOM 377 C ASN A 28 3.403 8.933 -9.347 1.00 0.00 C ATOM 378 O ASN A 28 3.873 9.685 -10.200 1.00 0.00 O ATOM 379 CB ASN A 28 4.450 6.825 -10.192 1.00 0.00 C ATOM 380 CG ASN A 28 5.697 7.434 -9.582 1.00 0.00 C ATOM 381 OD1 ASN A 28 6.407 8.202 -10.230 1.00 0.00 O ATOM 382 ND2 ASN A 28 5.970 7.092 -8.327 1.00 0.00 N ATOM 0 H ASN A 28 2.379 7.175 -11.573 1.00 0.00 H new ATOM 0 HA ASN A 28 2.884 6.955 -8.724 1.00 0.00 H new ATOM 0 HB2 ASN A 28 4.437 5.754 -9.992 1.00 0.00 H new ATOM 0 HB3 ASN A 28 4.482 6.947 -11.275 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.796 7.470 -7.864 1.00 0.00 H new ATOM 0 HD22 ASN A 28 5.353 6.452 -7.827 1.00 0.00 H new ATOM 389 N VAL A 29 3.073 9.342 -8.126 1.00 0.00 N ATOM 390 CA VAL A 29 3.250 10.728 -7.710 1.00 0.00 C ATOM 391 C VAL A 29 4.728 11.095 -7.634 1.00 0.00 C ATOM 392 O VAL A 29 5.219 11.905 -8.422 1.00 0.00 O ATOM 393 CB VAL A 29 2.596 10.991 -6.340 1.00 0.00 C ATOM 394 CG1 VAL A 29 2.898 12.405 -5.868 1.00 0.00 C ATOM 395 CG2 VAL A 29 1.096 10.752 -6.411 1.00 0.00 C ATOM 0 H VAL A 29 2.682 8.733 -7.408 1.00 0.00 H new ATOM 0 HA VAL A 29 2.763 11.349 -8.462 1.00 0.00 H new ATOM 0 HB VAL A 29 3.017 10.294 -5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.428 12.573 -4.899 1.00 0.00 H new ATOM 0 HG12 VAL A 29 3.976 12.535 -5.776 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.506 13.121 -6.590 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.651 10.942 -5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 29 0.655 11.423 -7.148 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.906 9.719 -6.701 1.00 0.00 H new ATOM 405 N LEU A 30 5.433 10.492 -6.683 1.00 0.00 N ATOM 406 CA LEU A 30 6.857 10.754 -6.504 1.00 0.00 C ATOM 407 C LEU A 30 7.626 9.454 -6.286 1.00 0.00 C ATOM 408 O LEU A 30 7.164 8.561 -5.576 1.00 0.00 O ATOM 409 CB LEU A 30 7.077 11.696 -5.320 1.00 0.00 C ATOM 410 CG LEU A 30 6.637 11.169 -3.953 1.00 0.00 C ATOM 411 CD1 LEU A 30 7.761 10.381 -3.297 1.00 0.00 C ATOM 412 CD2 LEU A 30 6.195 12.316 -3.056 1.00 0.00 C ATOM 0 H LEU A 30 5.042 9.819 -6.024 1.00 0.00 H new ATOM 0 HA LEU A 30 7.232 11.228 -7.411 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.138 11.941 -5.268 1.00 0.00 H new ATOM 0 HB3 LEU A 30 6.544 12.626 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 30 5.789 10.500 -4.099 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.429 10.014 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.031 9.536 -3.931 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.629 11.027 -3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.885 11.922 -2.088 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.024 13.010 -2.917 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.358 12.839 -3.519 1.00 0.00 H new ATOM 424 N GLN A 31 8.802 9.359 -6.899 1.00 0.00 N ATOM 425 CA GLN A 31 9.635 8.169 -6.771 1.00 0.00 C ATOM 426 C GLN A 31 11.061 8.544 -6.379 1.00 0.00 C ATOM 427 O GLN A 31 11.663 9.438 -6.973 1.00 0.00 O ATOM 428 CB GLN A 31 9.643 7.383 -8.082 1.00 0.00 C ATOM 429 CG GLN A 31 10.714 6.304 -8.137 1.00 0.00 C ATOM 430 CD GLN A 31 10.949 5.787 -9.543 1.00 0.00 C ATOM 431 OE1 GLN A 31 10.132 5.043 -10.088 1.00 0.00 O ATOM 432 NE2 GLN A 31 12.068 6.180 -10.139 1.00 0.00 N ATOM 0 H GLN A 31 9.199 10.091 -7.488 1.00 0.00 H new ATOM 0 HA GLN A 31 9.214 7.543 -5.984 1.00 0.00 H new ATOM 0 HB2 GLN A 31 8.666 6.921 -8.225 1.00 0.00 H new ATOM 0 HB3 GLN A 31 9.793 8.075 -8.910 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.647 6.703 -7.740 1.00 0.00 H new ATOM 0 HG3 GLN A 31 10.422 5.475 -7.493 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.717 6.797 -9.650 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.279 5.865 -11.086 1.00 0.00 H new ATOM 441 N MET A 32 11.595 7.854 -5.376 1.00 0.00 N ATOM 442 CA MET A 32 12.950 8.114 -4.907 1.00 0.00 C ATOM 443 C MET A 32 13.504 6.911 -4.150 1.00 0.00 C ATOM 444 O MET A 32 12.749 6.050 -3.699 1.00 0.00 O ATOM 445 CB MET A 32 12.973 9.352 -4.007 1.00 0.00 C ATOM 446 CG MET A 32 12.375 9.113 -2.630 1.00 0.00 C ATOM 447 SD MET A 32 12.613 10.513 -1.519 1.00 0.00 S ATOM 448 CE MET A 32 12.856 9.667 0.043 1.00 0.00 C ATOM 0 H MET A 32 11.110 7.111 -4.873 1.00 0.00 H new ATOM 0 HA MET A 32 13.580 8.295 -5.778 1.00 0.00 H new ATOM 0 HB2 MET A 32 14.003 9.689 -3.893 1.00 0.00 H new ATOM 0 HB3 MET A 32 12.426 10.158 -4.497 1.00 0.00 H new ATOM 0 HG2 MET A 32 11.309 8.911 -2.731 1.00 0.00 H new ATOM 0 HG3 MET A 32 12.828 8.224 -2.191 1.00 0.00 H new ATOM 0 HE1 MET A 32 12.733 10.375 0.863 1.00 0.00 H new ATOM 0 HE2 MET A 32 12.122 8.867 0.141 1.00 0.00 H new ATOM 0 HE3 MET A 32 13.860 9.244 0.076 1.00 0.00 H new ATOM 458 N GLN A 33 14.825 6.859 -4.015 1.00 0.00 N ATOM 459 CA GLN A 33 15.478 5.760 -3.313 1.00 0.00 C ATOM 460 C GLN A 33 15.530 6.027 -1.812 1.00 0.00 C ATOM 461 O GLN A 33 16.134 7.002 -1.365 1.00 0.00 O ATOM 462 CB GLN A 33 16.892 5.551 -3.854 1.00 0.00 C ATOM 463 CG GLN A 33 16.940 5.300 -5.353 1.00 0.00 C ATOM 464 CD GLN A 33 18.140 4.474 -5.770 1.00 0.00 C ATOM 465 OE1 GLN A 33 19.272 4.759 -5.374 1.00 0.00 O ATOM 466 NE2 GLN A 33 17.901 3.443 -6.572 1.00 0.00 N ATOM 0 H GLN A 33 15.464 7.564 -4.382 1.00 0.00 H new ATOM 0 HA GLN A 33 14.894 4.856 -3.483 1.00 0.00 H new ATOM 0 HB2 GLN A 33 17.494 6.429 -3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 33 17.348 4.706 -3.338 1.00 0.00 H new ATOM 0 HG2 GLN A 33 16.028 4.789 -5.661 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.962 6.256 -5.877 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.948 3.243 -6.876 1.00 0.00 H new ATOM 0 HE22 GLN A 33 18.670 2.851 -6.884 1.00 0.00 H new ATOM 475 N CYS A 34 14.892 5.154 -1.040 1.00 0.00 N ATOM 476 CA CYS A 34 14.864 5.297 0.412 1.00 0.00 C ATOM 477 C CYS A 34 15.069 3.948 1.094 1.00 0.00 C ATOM 478 O CYS A 34 15.185 2.916 0.433 1.00 0.00 O ATOM 479 CB CYS A 34 13.537 5.912 0.860 1.00 0.00 C ATOM 480 SG CYS A 34 13.663 6.942 2.341 1.00 0.00 S ATOM 0 H CYS A 34 14.388 4.341 -1.394 1.00 0.00 H new ATOM 0 HA CYS A 34 15.679 5.960 0.703 1.00 0.00 H new ATOM 0 HB2 CYS A 34 13.134 6.514 0.045 1.00 0.00 H new ATOM 0 HB3 CYS A 34 12.822 5.111 1.048 1.00 0.00 H new ATOM 0 HG CYS A 34 14.822 6.757 2.901 1.00 0.00 H new ATOM 486 N LYS A 35 15.115 3.963 2.422 1.00 0.00 N ATOM 487 CA LYS A 35 15.307 2.743 3.196 1.00 0.00 C ATOM 488 C LYS A 35 14.115 2.488 4.114 1.00 0.00 C ATOM 489 O LYS A 35 13.589 3.411 4.736 1.00 0.00 O ATOM 490 CB LYS A 35 16.590 2.836 4.024 1.00 0.00 C ATOM 491 CG LYS A 35 17.844 2.484 3.242 1.00 0.00 C ATOM 492 CD LYS A 35 19.013 2.184 4.167 1.00 0.00 C ATOM 493 CE LYS A 35 18.908 0.790 4.765 1.00 0.00 C ATOM 494 NZ LYS A 35 20.080 0.464 5.622 1.00 0.00 N ATOM 0 H LYS A 35 15.022 4.808 2.985 1.00 0.00 H new ATOM 0 HA LYS A 35 15.392 1.910 2.498 1.00 0.00 H new ATOM 0 HB2 LYS A 35 16.688 3.849 4.415 1.00 0.00 H new ATOM 0 HB3 LYS A 35 16.508 2.169 4.882 1.00 0.00 H new ATOM 0 HG2 LYS A 35 17.648 1.618 2.609 1.00 0.00 H new ATOM 0 HG3 LYS A 35 18.105 3.310 2.580 1.00 0.00 H new ATOM 0 HD2 LYS A 35 19.948 2.274 3.614 1.00 0.00 H new ATOM 0 HD3 LYS A 35 19.044 2.923 4.968 1.00 0.00 H new ATOM 0 HE2 LYS A 35 17.995 0.716 5.355 1.00 0.00 H new ATOM 0 HE3 LYS A 35 18.829 0.056 3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 20.276 -0.556 5.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 20.911 0.994 5.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 19.873 0.726 6.607 1.00 0.00 H new ATOM 508 N LEU A 36 13.696 1.230 4.195 1.00 0.00 N ATOM 509 CA LEU A 36 12.567 0.853 5.038 1.00 0.00 C ATOM 510 C LEU A 36 13.027 -0.006 6.212 1.00 0.00 C ATOM 511 O LEU A 36 13.623 -1.066 6.023 1.00 0.00 O ATOM 512 CB LEU A 36 11.522 0.096 4.217 1.00 0.00 C ATOM 513 CG LEU A 36 10.452 -0.650 5.016 1.00 0.00 C ATOM 514 CD1 LEU A 36 9.305 0.283 5.374 1.00 0.00 C ATOM 515 CD2 LEU A 36 9.941 -1.851 4.231 1.00 0.00 C ATOM 0 H LEU A 36 14.121 0.454 3.687 1.00 0.00 H new ATOM 0 HA LEU A 36 12.119 1.765 5.432 1.00 0.00 H new ATOM 0 HB2 LEU A 36 11.025 0.806 3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 36 12.039 -0.623 3.581 1.00 0.00 H new ATOM 0 HG LEU A 36 10.902 -1.010 5.941 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.554 -0.265 5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 36 9.683 1.110 5.976 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.856 0.674 4.461 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.180 -2.370 4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 36 9.508 -1.513 3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.768 -2.531 4.027 1.00 0.00 H new ATOM 527 N PHE A 37 12.745 0.459 7.424 1.00 0.00 N ATOM 528 CA PHE A 37 13.129 -0.267 8.629 1.00 0.00 C ATOM 529 C PHE A 37 11.897 -0.725 9.404 1.00 0.00 C ATOM 530 O PHE A 37 10.907 -0.001 9.503 1.00 0.00 O ATOM 531 CB PHE A 37 14.009 0.612 9.521 1.00 0.00 C ATOM 532 CG PHE A 37 15.288 1.044 8.863 1.00 0.00 C ATOM 533 CD1 PHE A 37 16.235 0.107 8.480 1.00 0.00 C ATOM 534 CD2 PHE A 37 15.544 2.385 8.629 1.00 0.00 C ATOM 535 CE1 PHE A 37 17.413 0.501 7.875 1.00 0.00 C ATOM 536 CE2 PHE A 37 16.720 2.784 8.022 1.00 0.00 C ATOM 537 CZ PHE A 37 17.657 1.841 7.646 1.00 0.00 C ATOM 0 H PHE A 37 12.252 1.335 7.598 1.00 0.00 H new ATOM 0 HA PHE A 37 13.695 -1.148 8.327 1.00 0.00 H new ATOM 0 HB2 PHE A 37 13.445 1.497 9.816 1.00 0.00 H new ATOM 0 HB3 PHE A 37 14.246 0.066 10.434 1.00 0.00 H new ATOM 0 HD1 PHE A 37 16.050 -0.942 8.656 1.00 0.00 H new ATOM 0 HD2 PHE A 37 14.817 3.127 8.924 1.00 0.00 H new ATOM 0 HE1 PHE A 37 18.143 -0.239 7.581 1.00 0.00 H new ATOM 0 HE2 PHE A 37 16.906 3.832 7.842 1.00 0.00 H new ATOM 0 HZ PHE A 37 18.578 2.151 7.174 1.00 0.00 H new ATOM 547 N VAL A 38 11.966 -1.934 9.953 1.00 0.00 N ATOM 548 CA VAL A 38 10.857 -2.490 10.719 1.00 0.00 C ATOM 549 C VAL A 38 11.283 -2.812 12.147 1.00 0.00 C ATOM 550 O VAL A 38 12.301 -3.467 12.370 1.00 0.00 O ATOM 551 CB VAL A 38 10.304 -3.768 10.060 1.00 0.00 C ATOM 552 CG1 VAL A 38 11.315 -4.900 10.159 1.00 0.00 C ATOM 553 CG2 VAL A 38 8.982 -4.165 10.697 1.00 0.00 C ATOM 0 H VAL A 38 12.778 -2.547 9.881 1.00 0.00 H new ATOM 0 HA VAL A 38 10.074 -1.732 10.738 1.00 0.00 H new ATOM 0 HB VAL A 38 10.126 -3.564 9.004 1.00 0.00 H new ATOM 0 HG11 VAL A 38 10.907 -5.794 9.688 1.00 0.00 H new ATOM 0 HG12 VAL A 38 12.236 -4.611 9.652 1.00 0.00 H new ATOM 0 HG13 VAL A 38 11.528 -5.107 11.208 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.605 -5.070 10.220 1.00 0.00 H new ATOM 0 HG22 VAL A 38 9.132 -4.351 11.760 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.260 -3.359 10.568 1.00 0.00 H new ATOM 563 N PHE A 39 10.497 -2.346 13.112 1.00 0.00 N ATOM 564 CA PHE A 39 10.792 -2.582 14.520 1.00 0.00 C ATOM 565 C PHE A 39 10.228 -3.924 14.976 1.00 0.00 C ATOM 566 O PHE A 39 9.064 -4.238 14.723 1.00 0.00 O ATOM 567 CB PHE A 39 10.217 -1.456 15.381 1.00 0.00 C ATOM 568 CG PHE A 39 10.266 -1.742 16.854 1.00 0.00 C ATOM 569 CD1 PHE A 39 9.276 -2.499 17.459 1.00 0.00 C ATOM 570 CD2 PHE A 39 11.302 -1.253 17.635 1.00 0.00 C ATOM 571 CE1 PHE A 39 9.319 -2.766 18.815 1.00 0.00 C ATOM 572 CE2 PHE A 39 11.349 -1.516 18.990 1.00 0.00 C ATOM 573 CZ PHE A 39 10.355 -2.272 19.581 1.00 0.00 C ATOM 0 H PHE A 39 9.650 -1.802 12.944 1.00 0.00 H new ATOM 0 HA PHE A 39 11.875 -2.603 14.639 1.00 0.00 H new ATOM 0 HB2 PHE A 39 10.768 -0.538 15.179 1.00 0.00 H new ATOM 0 HB3 PHE A 39 9.182 -1.278 15.088 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.461 -2.885 16.865 1.00 0.00 H new ATOM 0 HD2 PHE A 39 12.081 -0.660 17.179 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.543 -3.360 19.274 1.00 0.00 H new ATOM 0 HE2 PHE A 39 12.162 -1.131 19.587 1.00 0.00 H new ATOM 0 HZ PHE A 39 10.389 -2.476 20.641 1.00 0.00 H new ATOM 583 N ASP A 40 11.060 -4.712 15.648 1.00 0.00 N ATOM 584 CA ASP A 40 10.645 -6.020 16.140 1.00 0.00 C ATOM 585 C ASP A 40 10.701 -6.071 17.663 1.00 0.00 C ATOM 586 O ASP A 40 11.777 -6.171 18.253 1.00 0.00 O ATOM 587 CB ASP A 40 11.532 -7.117 15.548 1.00 0.00 C ATOM 588 CG ASP A 40 10.808 -8.442 15.421 1.00 0.00 C ATOM 589 OD1 ASP A 40 9.891 -8.697 16.230 1.00 0.00 O ATOM 590 OD2 ASP A 40 11.158 -9.226 14.514 1.00 0.00 O ATOM 0 H ASP A 40 12.026 -4.467 15.864 1.00 0.00 H new ATOM 0 HA ASP A 40 9.615 -6.188 15.826 1.00 0.00 H new ATOM 0 HB2 ASP A 40 11.885 -6.804 14.565 1.00 0.00 H new ATOM 0 HB3 ASP A 40 12.413 -7.247 16.177 1.00 0.00 H new ATOM 595 N LYS A 41 9.535 -6.000 18.297 1.00 0.00 N ATOM 596 CA LYS A 41 9.450 -6.038 19.752 1.00 0.00 C ATOM 597 C LYS A 41 10.404 -7.081 20.325 1.00 0.00 C ATOM 598 O LYS A 41 10.834 -6.979 21.475 1.00 0.00 O ATOM 599 CB LYS A 41 8.017 -6.347 20.191 1.00 0.00 C ATOM 600 CG LYS A 41 7.468 -7.639 19.611 1.00 0.00 C ATOM 601 CD LYS A 41 5.950 -7.623 19.552 1.00 0.00 C ATOM 602 CE LYS A 41 5.450 -7.027 18.244 1.00 0.00 C ATOM 603 NZ LYS A 41 5.551 -7.997 17.118 1.00 0.00 N ATOM 0 H LYS A 41 8.635 -5.916 17.825 1.00 0.00 H new ATOM 0 HA LYS A 41 9.738 -5.059 20.134 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.984 -6.404 21.279 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.369 -5.522 19.895 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.870 -7.789 18.609 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.801 -8.481 20.218 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.570 -8.639 19.659 1.00 0.00 H new ATOM 0 HD3 LYS A 41 5.558 -7.046 20.390 1.00 0.00 H new ATOM 0 HE2 LYS A 41 4.413 -6.713 18.361 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.029 -6.134 18.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.584 -7.480 16.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.417 -8.563 17.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 4.723 -8.626 17.126 1.00 0.00 H new ATOM 617 N THR A 42 10.735 -8.083 19.517 1.00 0.00 N ATOM 618 CA THR A 42 11.640 -9.143 19.944 1.00 0.00 C ATOM 619 C THR A 42 13.026 -8.591 20.254 1.00 0.00 C ATOM 620 O THR A 42 13.638 -8.952 21.259 1.00 0.00 O ATOM 621 CB THR A 42 11.764 -10.241 18.872 1.00 0.00 C ATOM 622 OG1 THR A 42 10.472 -10.775 18.565 1.00 0.00 O ATOM 623 CG2 THR A 42 12.681 -11.359 19.345 1.00 0.00 C ATOM 0 H THR A 42 10.390 -8.183 18.562 1.00 0.00 H new ATOM 0 HA THR A 42 11.215 -9.576 20.849 1.00 0.00 H new ATOM 0 HB THR A 42 12.194 -9.795 17.976 1.00 0.00 H new ATOM 0 HG1 THR A 42 10.072 -10.263 17.831 1.00 0.00 H new ATOM 0 HG21 THR A 42 12.753 -12.123 18.571 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.672 -10.955 19.549 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.276 -11.802 20.255 1.00 0.00 H new ATOM 631 N SER A 43 13.517 -7.713 19.385 1.00 0.00 N ATOM 632 CA SER A 43 14.834 -7.114 19.565 1.00 0.00 C ATOM 633 C SER A 43 14.714 -5.699 20.122 1.00 0.00 C ATOM 634 O SER A 43 15.706 -5.097 20.533 1.00 0.00 O ATOM 635 CB SER A 43 15.591 -7.089 18.236 1.00 0.00 C ATOM 636 OG SER A 43 16.931 -6.664 18.421 1.00 0.00 O ATOM 0 H SER A 43 13.022 -7.401 18.549 1.00 0.00 H new ATOM 0 HA SER A 43 15.389 -7.722 20.280 1.00 0.00 H new ATOM 0 HB2 SER A 43 15.580 -8.083 17.789 1.00 0.00 H new ATOM 0 HB3 SER A 43 15.087 -6.420 17.539 1.00 0.00 H new ATOM 0 HG SER A 43 16.999 -6.150 19.252 1.00 0.00 H new ATOM 642 N GLN A 44 13.493 -5.174 20.133 1.00 0.00 N ATOM 643 CA GLN A 44 13.244 -3.830 20.638 1.00 0.00 C ATOM 644 C GLN A 44 14.128 -2.808 19.929 1.00 0.00 C ATOM 645 O GLN A 44 14.565 -1.827 20.531 1.00 0.00 O ATOM 646 CB GLN A 44 13.491 -3.776 22.147 1.00 0.00 C ATOM 647 CG GLN A 44 12.981 -5.000 22.891 1.00 0.00 C ATOM 648 CD GLN A 44 11.548 -4.841 23.361 1.00 0.00 C ATOM 649 OE1 GLN A 44 11.261 -4.936 24.554 1.00 0.00 O ATOM 650 NE2 GLN A 44 10.641 -4.598 22.423 1.00 0.00 N ATOM 0 H GLN A 44 12.661 -5.659 19.798 1.00 0.00 H new ATOM 0 HA GLN A 44 12.202 -3.582 20.438 1.00 0.00 H new ATOM 0 HB2 GLN A 44 14.561 -3.670 22.328 1.00 0.00 H new ATOM 0 HB3 GLN A 44 13.010 -2.887 22.554 1.00 0.00 H new ATOM 0 HG2 GLN A 44 13.052 -5.872 22.240 1.00 0.00 H new ATOM 0 HG3 GLN A 44 13.623 -5.191 23.751 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.924 -4.527 21.446 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.661 -4.482 22.679 1.00 0.00 H new ATOM 659 N SER A 45 14.389 -3.047 18.648 1.00 0.00 N ATOM 660 CA SER A 45 15.224 -2.150 17.859 1.00 0.00 C ATOM 661 C SER A 45 14.782 -2.142 16.398 1.00 0.00 C ATOM 662 O SER A 45 13.992 -2.984 15.973 1.00 0.00 O ATOM 663 CB SER A 45 16.693 -2.568 17.956 1.00 0.00 C ATOM 664 OG SER A 45 17.549 -1.441 17.887 1.00 0.00 O ATOM 0 H SER A 45 14.034 -3.854 18.135 1.00 0.00 H new ATOM 0 HA SER A 45 15.113 -1.143 18.261 1.00 0.00 H new ATOM 0 HB2 SER A 45 16.862 -3.100 18.892 1.00 0.00 H new ATOM 0 HB3 SER A 45 16.932 -3.260 17.148 1.00 0.00 H new ATOM 0 HG SER A 45 18.482 -1.734 17.953 1.00 0.00 H new ATOM 670 N TRP A 46 15.300 -1.185 15.636 1.00 0.00 N ATOM 671 CA TRP A 46 14.958 -1.066 14.223 1.00 0.00 C ATOM 672 C TRP A 46 15.736 -2.078 13.389 1.00 0.00 C ATOM 673 O TRP A 46 16.952 -1.971 13.240 1.00 0.00 O ATOM 674 CB TRP A 46 15.247 0.352 13.725 1.00 0.00 C ATOM 675 CG TRP A 46 14.294 1.376 14.264 1.00 0.00 C ATOM 676 CD1 TRP A 46 14.541 2.283 15.255 1.00 0.00 C ATOM 677 CD2 TRP A 46 12.943 1.595 13.844 1.00 0.00 C ATOM 678 NE1 TRP A 46 13.425 3.054 15.475 1.00 0.00 N ATOM 679 CE2 TRP A 46 12.431 2.652 14.622 1.00 0.00 C ATOM 680 CE3 TRP A 46 12.117 1.003 12.886 1.00 0.00 C ATOM 681 CZ2 TRP A 46 11.131 3.125 14.470 1.00 0.00 C ATOM 682 CZ3 TRP A 46 10.827 1.474 12.735 1.00 0.00 C ATOM 683 CH2 TRP A 46 10.344 2.528 13.524 1.00 0.00 C ATOM 0 H TRP A 46 15.957 -0.481 15.972 1.00 0.00 H new ATOM 0 HA TRP A 46 13.893 -1.273 14.113 1.00 0.00 H new ATOM 0 HB2 TRP A 46 16.263 0.628 14.006 1.00 0.00 H new ATOM 0 HB3 TRP A 46 15.203 0.363 12.636 1.00 0.00 H new ATOM 0 HD1 TRP A 46 15.476 2.380 15.787 1.00 0.00 H new ATOM 0 HE1 TRP A 46 13.349 3.804 16.162 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.480 0.191 12.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.757 3.935 15.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.180 1.023 11.997 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.331 2.875 13.382 1.00 0.00 H new ATOM 694 N VAL A 47 15.024 -3.062 12.846 1.00 0.00 N ATOM 695 CA VAL A 47 15.647 -4.093 12.025 1.00 0.00 C ATOM 696 C VAL A 47 15.355 -3.869 10.546 1.00 0.00 C ATOM 697 O VAL A 47 14.247 -3.482 10.174 1.00 0.00 O ATOM 698 CB VAL A 47 15.162 -5.499 12.427 1.00 0.00 C ATOM 699 CG1 VAL A 47 15.768 -6.553 11.513 1.00 0.00 C ATOM 700 CG2 VAL A 47 15.500 -5.783 13.882 1.00 0.00 C ATOM 0 H VAL A 47 14.016 -3.166 12.960 1.00 0.00 H new ATOM 0 HA VAL A 47 16.722 -4.026 12.193 1.00 0.00 H new ATOM 0 HB VAL A 47 14.078 -5.537 12.317 1.00 0.00 H new ATOM 0 HG11 VAL A 47 15.415 -7.540 11.811 1.00 0.00 H new ATOM 0 HG12 VAL A 47 15.469 -6.357 10.483 1.00 0.00 H new ATOM 0 HG13 VAL A 47 16.855 -6.519 11.588 1.00 0.00 H new ATOM 0 HG21 VAL A 47 15.150 -6.780 14.149 1.00 0.00 H new ATOM 0 HG22 VAL A 47 16.580 -5.728 14.022 1.00 0.00 H new ATOM 0 HG23 VAL A 47 15.013 -5.045 14.519 1.00 0.00 H new ATOM 710 N GLU A 48 16.356 -4.115 9.706 1.00 0.00 N ATOM 711 CA GLU A 48 16.205 -3.940 8.266 1.00 0.00 C ATOM 712 C GLU A 48 14.987 -4.701 7.751 1.00 0.00 C ATOM 713 O GLU A 48 14.691 -5.805 8.209 1.00 0.00 O ATOM 714 CB GLU A 48 17.464 -4.416 7.539 1.00 0.00 C ATOM 715 CG GLU A 48 17.367 -4.314 6.026 1.00 0.00 C ATOM 716 CD GLU A 48 16.765 -5.554 5.393 1.00 0.00 C ATOM 717 OE1 GLU A 48 16.920 -6.649 5.973 1.00 0.00 O ATOM 718 OE2 GLU A 48 16.139 -5.428 4.320 1.00 0.00 O ATOM 0 H GLU A 48 17.279 -4.436 9.998 1.00 0.00 H new ATOM 0 HA GLU A 48 16.059 -2.878 8.067 1.00 0.00 H new ATOM 0 HB2 GLU A 48 18.315 -3.827 7.881 1.00 0.00 H new ATOM 0 HB3 GLU A 48 17.662 -5.452 7.813 1.00 0.00 H new ATOM 0 HG2 GLU A 48 16.762 -3.446 5.763 1.00 0.00 H new ATOM 0 HG3 GLU A 48 18.362 -4.146 5.613 1.00 0.00 H new ATOM 725 N ARG A 49 14.284 -4.103 6.795 1.00 0.00 N ATOM 726 CA ARG A 49 13.098 -4.721 6.217 1.00 0.00 C ATOM 727 C ARG A 49 13.234 -4.851 4.703 1.00 0.00 C ATOM 728 O ARG A 49 12.789 -5.833 4.110 1.00 0.00 O ATOM 729 CB ARG A 49 11.851 -3.903 6.559 1.00 0.00 C ATOM 730 CG ARG A 49 10.584 -4.738 6.660 1.00 0.00 C ATOM 731 CD ARG A 49 10.397 -5.617 5.434 1.00 0.00 C ATOM 732 NE ARG A 49 9.002 -6.011 5.252 1.00 0.00 N ATOM 733 CZ ARG A 49 8.627 -7.095 4.582 1.00 0.00 C ATOM 734 NH1 ARG A 49 9.537 -7.889 4.037 1.00 0.00 N ATOM 735 NH2 ARG A 49 7.339 -7.387 4.459 1.00 0.00 N ATOM 0 H ARG A 49 14.516 -3.190 6.404 1.00 0.00 H new ATOM 0 HA ARG A 49 12.997 -5.720 6.642 1.00 0.00 H new ATOM 0 HB2 ARG A 49 12.013 -3.388 7.506 1.00 0.00 H new ATOM 0 HB3 ARG A 49 11.710 -3.135 5.798 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.628 -5.362 7.553 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.722 -4.081 6.773 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.741 -5.083 4.549 1.00 0.00 H new ATOM 0 HD3 ARG A 49 11.016 -6.509 5.529 1.00 0.00 H new ATOM 0 HE ARG A 49 8.277 -5.422 5.661 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.528 -7.669 4.131 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.246 -8.721 3.523 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.636 -6.779 4.879 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.052 -8.219 3.944 1.00 0.00 H new ATOM 749 N GLY A 50 13.852 -3.850 4.082 1.00 0.00 N ATOM 750 CA GLY A 50 14.036 -3.871 2.642 1.00 0.00 C ATOM 751 C GLY A 50 14.375 -2.504 2.082 1.00 0.00 C ATOM 752 O GLY A 50 13.657 -1.533 2.318 1.00 0.00 O ATOM 0 H GLY A 50 14.228 -3.026 4.550 1.00 0.00 H new ATOM 0 HA2 GLY A 50 14.833 -4.571 2.391 1.00 0.00 H new ATOM 0 HA3 GLY A 50 13.126 -4.239 2.168 1.00 0.00 H new ATOM 756 N ARG A 51 15.474 -2.428 1.338 1.00 0.00 N ATOM 757 CA ARG A 51 15.909 -1.169 0.745 1.00 0.00 C ATOM 758 C ARG A 51 15.913 -1.258 -0.778 1.00 0.00 C ATOM 759 O ARG A 51 16.124 -2.328 -1.346 1.00 0.00 O ATOM 760 CB ARG A 51 17.305 -0.798 1.248 1.00 0.00 C ATOM 761 CG ARG A 51 18.357 -1.858 0.962 1.00 0.00 C ATOM 762 CD ARG A 51 19.733 -1.240 0.774 1.00 0.00 C ATOM 763 NE ARG A 51 20.466 -1.143 2.034 1.00 0.00 N ATOM 764 CZ ARG A 51 21.763 -0.863 2.110 1.00 0.00 C ATOM 765 NH1 ARG A 51 22.465 -0.652 1.005 1.00 0.00 N ATOM 766 NH2 ARG A 51 22.359 -0.791 3.294 1.00 0.00 N ATOM 0 H ARG A 51 16.079 -3.223 1.132 1.00 0.00 H new ATOM 0 HA ARG A 51 15.204 -0.393 1.045 1.00 0.00 H new ATOM 0 HB2 ARG A 51 17.611 0.140 0.785 1.00 0.00 H new ATOM 0 HB3 ARG A 51 17.260 -0.623 2.323 1.00 0.00 H new ATOM 0 HG2 ARG A 51 18.387 -2.573 1.784 1.00 0.00 H new ATOM 0 HG3 ARG A 51 18.081 -2.414 0.066 1.00 0.00 H new ATOM 0 HD2 ARG A 51 20.306 -1.839 0.066 1.00 0.00 H new ATOM 0 HD3 ARG A 51 19.628 -0.246 0.338 1.00 0.00 H new ATOM 0 HE ARG A 51 19.955 -1.299 2.903 1.00 0.00 H new ATOM 0 HH11 ARG A 51 22.010 -0.704 0.094 1.00 0.00 H new ATOM 0 HH12 ARG A 51 23.460 -0.437 1.066 1.00 0.00 H new ATOM 0 HH21 ARG A 51 21.822 -0.951 4.146 1.00 0.00 H new ATOM 0 HH22 ARG A 51 23.354 -0.576 3.352 1.00 0.00 H new ATOM 780 N GLY A 52 15.677 -0.126 -1.434 1.00 0.00 N ATOM 781 CA GLY A 52 15.657 -0.098 -2.884 1.00 0.00 C ATOM 782 C GLY A 52 15.156 1.223 -3.433 1.00 0.00 C ATOM 783 O GLY A 52 15.866 2.229 -3.395 1.00 0.00 O ATOM 0 H GLY A 52 15.499 0.773 -0.986 1.00 0.00 H new ATOM 0 HA2 GLY A 52 16.662 -0.287 -3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 52 15.022 -0.904 -3.251 1.00 0.00 H new ATOM 787 N LEU A 53 13.931 1.223 -3.945 1.00 0.00 N ATOM 788 CA LEU A 53 13.335 2.431 -4.505 1.00 0.00 C ATOM 789 C LEU A 53 11.888 2.587 -4.048 1.00 0.00 C ATOM 790 O LEU A 53 11.041 1.741 -4.335 1.00 0.00 O ATOM 791 CB LEU A 53 13.399 2.393 -6.033 1.00 0.00 C ATOM 792 CG LEU A 53 12.413 3.303 -6.768 1.00 0.00 C ATOM 793 CD1 LEU A 53 12.644 4.757 -6.390 1.00 0.00 C ATOM 794 CD2 LEU A 53 12.536 3.115 -8.274 1.00 0.00 C ATOM 0 H LEU A 53 13.330 0.400 -3.984 1.00 0.00 H new ATOM 0 HA LEU A 53 13.904 3.288 -4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 53 14.410 2.661 -6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 53 13.228 1.367 -6.359 1.00 0.00 H new ATOM 0 HG LEU A 53 11.402 3.028 -6.468 1.00 0.00 H new ATOM 0 HD11 LEU A 53 11.933 5.389 -6.923 1.00 0.00 H new ATOM 0 HD12 LEU A 53 12.505 4.880 -5.316 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.660 5.046 -6.660 1.00 0.00 H new ATOM 0 HD21 LEU A 53 11.828 3.770 -8.781 1.00 0.00 H new ATOM 0 HD22 LEU A 53 13.549 3.362 -8.590 1.00 0.00 H new ATOM 0 HD23 LEU A 53 12.319 2.078 -8.530 1.00 0.00 H new ATOM 806 N LEU A 54 11.611 3.676 -3.340 1.00 0.00 N ATOM 807 CA LEU A 54 10.266 3.946 -2.846 1.00 0.00 C ATOM 808 C LEU A 54 9.502 4.849 -3.809 1.00 0.00 C ATOM 809 O LEU A 54 10.071 5.768 -4.396 1.00 0.00 O ATOM 810 CB LEU A 54 10.329 4.596 -1.462 1.00 0.00 C ATOM 811 CG LEU A 54 8.999 5.086 -0.889 1.00 0.00 C ATOM 812 CD1 LEU A 54 8.247 3.940 -0.230 1.00 0.00 C ATOM 813 CD2 LEU A 54 9.231 6.216 0.104 1.00 0.00 C ATOM 0 H LEU A 54 12.300 4.387 -3.095 1.00 0.00 H new ATOM 0 HA LEU A 54 9.737 2.996 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 54 10.759 3.877 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 54 11.014 5.442 -1.511 1.00 0.00 H new ATOM 0 HG LEU A 54 8.390 5.468 -1.709 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.303 4.308 0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.049 3.163 -0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.850 3.527 0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.274 6.553 0.502 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.858 5.859 0.921 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.727 7.046 -0.399 1.00 0.00 H new ATOM 825 N ARG A 55 8.209 4.581 -3.965 1.00 0.00 N ATOM 826 CA ARG A 55 7.367 5.369 -4.856 1.00 0.00 C ATOM 827 C ARG A 55 5.919 5.374 -4.374 1.00 0.00 C ATOM 828 O ARG A 55 5.476 4.443 -3.699 1.00 0.00 O ATOM 829 CB ARG A 55 7.441 4.819 -6.282 1.00 0.00 C ATOM 830 CG ARG A 55 6.794 3.453 -6.441 1.00 0.00 C ATOM 831 CD ARG A 55 7.252 2.765 -7.716 1.00 0.00 C ATOM 832 NE ARG A 55 6.245 1.844 -8.234 1.00 0.00 N ATOM 833 CZ ARG A 55 6.242 1.383 -9.480 1.00 0.00 C ATOM 834 NH1 ARG A 55 7.189 1.753 -10.331 1.00 0.00 N ATOM 835 NH2 ARG A 55 5.290 0.547 -9.878 1.00 0.00 N ATOM 0 H ARG A 55 7.722 3.824 -3.485 1.00 0.00 H new ATOM 0 HA ARG A 55 7.736 6.395 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 55 6.957 5.522 -6.959 1.00 0.00 H new ATOM 0 HB3 ARG A 55 8.486 4.754 -6.584 1.00 0.00 H new ATOM 0 HG2 ARG A 55 7.041 2.830 -5.581 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.710 3.562 -6.455 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.478 3.517 -8.472 1.00 0.00 H new ATOM 0 HD3 ARG A 55 8.176 2.220 -7.522 1.00 0.00 H new ATOM 0 HE ARG A 55 5.503 1.538 -7.605 1.00 0.00 H new ATOM 0 HH11 ARG A 55 7.923 2.394 -10.030 1.00 0.00 H new ATOM 0 HH12 ARG A 55 7.183 1.397 -11.287 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.560 0.258 -9.227 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.289 0.194 -10.835 1.00 0.00 H new ATOM 849 N LEU A 56 5.188 6.425 -4.724 1.00 0.00 N ATOM 850 CA LEU A 56 3.789 6.550 -4.328 1.00 0.00 C ATOM 851 C LEU A 56 2.863 6.330 -5.520 1.00 0.00 C ATOM 852 O LEU A 56 2.830 7.135 -6.450 1.00 0.00 O ATOM 853 CB LEU A 56 3.533 7.930 -3.718 1.00 0.00 C ATOM 854 CG LEU A 56 2.127 8.499 -3.911 1.00 0.00 C ATOM 855 CD1 LEU A 56 1.105 7.659 -3.161 1.00 0.00 C ATOM 856 CD2 LEU A 56 2.071 9.949 -3.450 1.00 0.00 C ATOM 0 H LEU A 56 5.540 7.204 -5.281 1.00 0.00 H new ATOM 0 HA LEU A 56 3.579 5.784 -3.582 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.738 7.876 -2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.249 8.632 -4.145 1.00 0.00 H new ATOM 0 HG LEU A 56 1.884 8.467 -4.973 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.110 8.078 -3.309 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.128 6.636 -3.538 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.344 7.659 -2.097 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.063 10.338 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.334 10.005 -2.394 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.776 10.543 -4.031 1.00 0.00 H new ATOM 868 N ASN A 57 2.111 5.234 -5.483 1.00 0.00 N ATOM 869 CA ASN A 57 1.183 4.908 -6.561 1.00 0.00 C ATOM 870 C ASN A 57 -0.227 5.385 -6.226 1.00 0.00 C ATOM 871 O ASN A 57 -0.732 5.141 -5.129 1.00 0.00 O ATOM 872 CB ASN A 57 1.177 3.399 -6.816 1.00 0.00 C ATOM 873 CG ASN A 57 2.360 2.950 -7.650 1.00 0.00 C ATOM 874 OD1 ASN A 57 2.935 3.733 -8.406 1.00 0.00 O ATOM 875 ND2 ASN A 57 2.730 1.680 -7.517 1.00 0.00 N ATOM 0 H ASN A 57 2.126 4.558 -4.720 1.00 0.00 H new ATOM 0 HA ASN A 57 1.516 5.421 -7.463 1.00 0.00 H new ATOM 0 HB2 ASN A 57 1.187 2.872 -5.862 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.253 3.122 -7.323 1.00 0.00 H new ATOM 0 HD21 ASN A 57 3.519 1.320 -8.054 1.00 0.00 H new ATOM 0 HD22 ASN A 57 2.225 1.066 -6.878 1.00 0.00 H new ATOM 882 N ASP A 58 -0.857 6.064 -7.177 1.00 0.00 N ATOM 883 CA ASP A 58 -2.210 6.574 -6.985 1.00 0.00 C ATOM 884 C ASP A 58 -3.240 5.625 -7.589 1.00 0.00 C ATOM 885 O ASP A 58 -3.008 5.031 -8.642 1.00 0.00 O ATOM 886 CB ASP A 58 -2.348 7.963 -7.612 1.00 0.00 C ATOM 887 CG ASP A 58 -3.365 8.825 -6.889 1.00 0.00 C ATOM 888 OD1 ASP A 58 -4.262 8.259 -6.230 1.00 0.00 O ATOM 889 OD2 ASP A 58 -3.262 10.066 -6.982 1.00 0.00 O ATOM 0 H ASP A 58 -0.453 6.275 -8.090 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.395 6.647 -5.913 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.379 8.462 -7.600 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.641 7.860 -8.657 1.00 0.00 H new ATOM 894 N MET A 59 -4.376 5.485 -6.914 1.00 0.00 N ATOM 895 CA MET A 59 -5.440 4.607 -7.386 1.00 0.00 C ATOM 896 C MET A 59 -6.811 5.171 -7.023 1.00 0.00 C ATOM 897 O MET A 59 -6.944 5.937 -6.069 1.00 0.00 O ATOM 898 CB MET A 59 -5.278 3.208 -6.790 1.00 0.00 C ATOM 899 CG MET A 59 -5.654 3.127 -5.319 1.00 0.00 C ATOM 900 SD MET A 59 -5.509 1.455 -4.657 1.00 0.00 S ATOM 901 CE MET A 59 -5.679 1.771 -2.901 1.00 0.00 C ATOM 0 H MET A 59 -4.583 5.968 -6.040 1.00 0.00 H new ATOM 0 HA MET A 59 -5.369 4.542 -8.472 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.895 2.508 -7.353 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.243 2.888 -6.910 1.00 0.00 H new ATOM 0 HG2 MET A 59 -5.013 3.797 -4.746 1.00 0.00 H new ATOM 0 HG3 MET A 59 -6.678 3.477 -5.190 1.00 0.00 H new ATOM 0 HE1 MET A 59 -4.968 1.155 -2.350 1.00 0.00 H new ATOM 0 HE2 MET A 59 -5.480 2.824 -2.700 1.00 0.00 H new ATOM 0 HE3 MET A 59 -6.693 1.527 -2.584 1.00 0.00 H new ATOM 911 N ALA A 60 -7.826 4.787 -7.790 1.00 0.00 N ATOM 912 CA ALA A 60 -9.185 5.254 -7.548 1.00 0.00 C ATOM 913 C ALA A 60 -9.897 4.369 -6.530 1.00 0.00 C ATOM 914 O ALA A 60 -9.667 3.160 -6.478 1.00 0.00 O ATOM 915 CB ALA A 60 -9.968 5.297 -8.851 1.00 0.00 C ATOM 0 H ALA A 60 -7.733 4.154 -8.584 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.128 6.262 -7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -10.981 5.648 -8.655 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -9.477 5.976 -9.548 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.007 4.298 -9.285 1.00 0.00 H new ATOM 921 N SER A 61 -10.759 4.978 -5.723 1.00 0.00 N ATOM 922 CA SER A 61 -11.501 4.245 -4.703 1.00 0.00 C ATOM 923 C SER A 61 -12.709 3.540 -5.312 1.00 0.00 C ATOM 924 O SER A 61 -13.168 3.894 -6.399 1.00 0.00 O ATOM 925 CB SER A 61 -11.955 5.194 -3.593 1.00 0.00 C ATOM 926 OG SER A 61 -12.007 4.527 -2.343 1.00 0.00 O ATOM 0 H SER A 61 -10.961 5.977 -5.755 1.00 0.00 H new ATOM 0 HA SER A 61 -10.839 3.491 -4.278 1.00 0.00 H new ATOM 0 HB2 SER A 61 -11.270 6.039 -3.530 1.00 0.00 H new ATOM 0 HB3 SER A 61 -12.938 5.598 -3.835 1.00 0.00 H new ATOM 0 HG SER A 61 -12.837 4.010 -2.283 1.00 0.00 H new ATOM 932 N THR A 62 -13.223 2.539 -4.603 1.00 0.00 N ATOM 933 CA THR A 62 -14.377 1.783 -5.072 1.00 0.00 C ATOM 934 C THR A 62 -15.663 2.291 -4.431 1.00 0.00 C ATOM 935 O THR A 62 -16.506 2.893 -5.099 1.00 0.00 O ATOM 936 CB THR A 62 -14.225 0.281 -4.770 1.00 0.00 C ATOM 937 OG1 THR A 62 -15.497 -0.281 -4.427 1.00 0.00 O ATOM 938 CG2 THR A 62 -13.241 0.055 -3.631 1.00 0.00 C ATOM 0 H THR A 62 -12.857 2.233 -3.701 1.00 0.00 H new ATOM 0 HA THR A 62 -14.431 1.925 -6.151 1.00 0.00 H new ATOM 0 HB THR A 62 -13.841 -0.210 -5.664 1.00 0.00 H new ATOM 0 HG1 THR A 62 -15.392 -1.237 -4.238 1.00 0.00 H new ATOM 0 HG21 THR A 62 -13.150 -1.013 -3.435 1.00 0.00 H new ATOM 0 HG22 THR A 62 -12.266 0.458 -3.907 1.00 0.00 H new ATOM 0 HG23 THR A 62 -13.601 0.559 -2.734 1.00 0.00 H new ATOM 946 N ASP A 63 -15.810 2.046 -3.134 1.00 0.00 N ATOM 947 CA ASP A 63 -16.995 2.481 -2.402 1.00 0.00 C ATOM 948 C ASP A 63 -16.997 3.996 -2.222 1.00 0.00 C ATOM 949 O ASP A 63 -18.038 4.599 -1.966 1.00 0.00 O ATOM 950 CB ASP A 63 -17.059 1.792 -1.038 1.00 0.00 C ATOM 951 CG ASP A 63 -16.939 0.284 -1.145 1.00 0.00 C ATOM 952 OD1 ASP A 63 -17.808 -0.336 -1.794 1.00 0.00 O ATOM 953 OD2 ASP A 63 -15.977 -0.276 -0.579 1.00 0.00 O ATOM 0 H ASP A 63 -15.123 1.548 -2.567 1.00 0.00 H new ATOM 0 HA ASP A 63 -17.874 2.202 -2.983 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -16.259 2.173 -0.404 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -18.000 2.045 -0.550 1.00 0.00 H new ATOM 958 N ASP A 64 -15.824 4.604 -2.357 1.00 0.00 N ATOM 959 CA ASP A 64 -15.689 6.049 -2.208 1.00 0.00 C ATOM 960 C ASP A 64 -15.521 6.721 -3.567 1.00 0.00 C ATOM 961 O ASP A 64 -15.820 7.904 -3.727 1.00 0.00 O ATOM 962 CB ASP A 64 -14.497 6.382 -1.310 1.00 0.00 C ATOM 963 CG ASP A 64 -14.627 5.774 0.073 1.00 0.00 C ATOM 964 OD1 ASP A 64 -15.226 4.684 0.189 1.00 0.00 O ATOM 965 OD2 ASP A 64 -14.128 6.387 1.040 1.00 0.00 O ATOM 0 H ASP A 64 -14.952 4.119 -2.569 1.00 0.00 H new ATOM 0 HA ASP A 64 -16.600 6.428 -1.744 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -13.581 6.021 -1.778 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -14.404 7.464 -1.221 1.00 0.00 H new ATOM 970 N GLY A 65 -15.040 5.958 -4.544 1.00 0.00 N ATOM 971 CA GLY A 65 -14.840 6.498 -5.876 1.00 0.00 C ATOM 972 C GLY A 65 -13.942 7.719 -5.878 1.00 0.00 C ATOM 973 O GLY A 65 -13.829 8.416 -6.888 1.00 0.00 O ATOM 0 H GLY A 65 -14.785 4.976 -4.437 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -14.404 5.729 -6.515 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -15.806 6.761 -6.307 1.00 0.00 H new ATOM 977 N THR A 66 -13.303 7.984 -4.743 1.00 0.00 N ATOM 978 CA THR A 66 -12.412 9.131 -4.616 1.00 0.00 C ATOM 979 C THR A 66 -10.968 8.742 -4.911 1.00 0.00 C ATOM 980 O THR A 66 -10.653 7.563 -5.076 1.00 0.00 O ATOM 981 CB THR A 66 -12.488 9.747 -3.206 1.00 0.00 C ATOM 982 OG1 THR A 66 -11.888 11.047 -3.208 1.00 0.00 O ATOM 983 CG2 THR A 66 -11.786 8.860 -2.189 1.00 0.00 C ATOM 0 H THR A 66 -13.386 7.419 -3.898 1.00 0.00 H new ATOM 0 HA THR A 66 -12.742 9.870 -5.346 1.00 0.00 H new ATOM 0 HB THR A 66 -13.538 9.832 -2.926 1.00 0.00 H new ATOM 0 HG1 THR A 66 -12.324 11.610 -2.535 1.00 0.00 H new ATOM 0 HG21 THR A 66 -11.853 9.316 -1.201 1.00 0.00 H new ATOM 0 HG22 THR A 66 -12.263 7.880 -2.170 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.738 8.748 -2.466 1.00 0.00 H new ATOM 991 N LEU A 67 -10.094 9.740 -4.976 1.00 0.00 N ATOM 992 CA LEU A 67 -8.681 9.502 -5.252 1.00 0.00 C ATOM 993 C LEU A 67 -8.028 8.723 -4.114 1.00 0.00 C ATOM 994 O LEU A 67 -7.676 9.293 -3.081 1.00 0.00 O ATOM 995 CB LEU A 67 -7.951 10.830 -5.460 1.00 0.00 C ATOM 996 CG LEU A 67 -6.495 10.732 -5.917 1.00 0.00 C ATOM 997 CD1 LEU A 67 -5.588 10.398 -4.743 1.00 0.00 C ATOM 998 CD2 LEU A 67 -6.351 9.690 -7.018 1.00 0.00 C ATOM 0 H LEU A 67 -10.338 10.721 -4.842 1.00 0.00 H new ATOM 0 HA LEU A 67 -8.609 8.908 -6.163 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.503 11.414 -6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.980 11.388 -4.524 1.00 0.00 H new ATOM 0 HG LEU A 67 -6.194 11.700 -6.318 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.556 10.332 -5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.669 11.179 -3.987 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.888 9.443 -4.312 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.309 9.633 -7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.670 8.718 -6.643 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.971 9.972 -7.869 1.00 0.00 H new ATOM 1010 N GLN A 68 -7.869 7.418 -4.312 1.00 0.00 N ATOM 1011 CA GLN A 68 -7.258 6.562 -3.303 1.00 0.00 C ATOM 1012 C GLN A 68 -5.752 6.455 -3.520 1.00 0.00 C ATOM 1013 O GLN A 68 -5.240 6.821 -4.577 1.00 0.00 O ATOM 1014 CB GLN A 68 -7.889 5.170 -3.334 1.00 0.00 C ATOM 1015 CG GLN A 68 -9.069 5.015 -2.388 1.00 0.00 C ATOM 1016 CD GLN A 68 -8.641 4.676 -0.973 1.00 0.00 C ATOM 1017 OE1 GLN A 68 -7.680 5.240 -0.451 1.00 0.00 O ATOM 1018 NE2 GLN A 68 -9.356 3.749 -0.345 1.00 0.00 N ATOM 0 H GLN A 68 -8.155 6.931 -5.162 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.436 7.012 -2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.218 4.952 -4.350 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.130 4.430 -3.079 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.646 5.940 -2.378 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -9.729 4.232 -2.761 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.145 3.307 -0.817 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.116 3.479 0.609 1.00 0.00 H new ATOM 1027 N SER A 69 -5.048 5.953 -2.511 1.00 0.00 N ATOM 1028 CA SER A 69 -3.599 5.802 -2.590 1.00 0.00 C ATOM 1029 C SER A 69 -3.132 4.609 -1.762 1.00 0.00 C ATOM 1030 O SER A 69 -3.902 4.031 -0.994 1.00 0.00 O ATOM 1031 CB SER A 69 -2.905 7.076 -2.106 1.00 0.00 C ATOM 1032 OG SER A 69 -2.925 8.079 -3.107 1.00 0.00 O ATOM 0 H SER A 69 -5.457 5.644 -1.629 1.00 0.00 H new ATOM 0 HA SER A 69 -3.333 5.626 -3.632 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.400 7.445 -1.207 1.00 0.00 H new ATOM 0 HB3 SER A 69 -1.874 6.851 -1.833 1.00 0.00 H new ATOM 0 HG SER A 69 -3.560 7.827 -3.810 1.00 0.00 H new ATOM 1038 N ARG A 70 -1.863 4.246 -1.923 1.00 0.00 N ATOM 1039 CA ARG A 70 -1.292 3.121 -1.193 1.00 0.00 C ATOM 1040 C ARG A 70 0.229 3.228 -1.131 1.00 0.00 C ATOM 1041 O ARG A 70 0.845 3.941 -1.926 1.00 0.00 O ATOM 1042 CB ARG A 70 -1.694 1.800 -1.851 1.00 0.00 C ATOM 1043 CG ARG A 70 -1.110 1.610 -3.241 1.00 0.00 C ATOM 1044 CD ARG A 70 -0.912 0.138 -3.566 1.00 0.00 C ATOM 1045 NE ARG A 70 -2.095 -0.449 -4.189 1.00 0.00 N ATOM 1046 CZ ARG A 70 -2.469 -0.197 -5.439 1.00 0.00 C ATOM 1047 NH1 ARG A 70 -1.757 0.627 -6.194 1.00 0.00 N ATOM 1048 NH2 ARG A 70 -3.558 -0.770 -5.935 1.00 0.00 N ATOM 0 H ARG A 70 -1.212 4.715 -2.552 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.683 3.146 -0.176 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.373 0.975 -1.215 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -2.781 1.751 -1.913 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -1.773 2.061 -3.980 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.155 2.131 -3.310 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.058 0.026 -4.233 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -0.676 -0.406 -2.652 1.00 0.00 H new ATOM 0 HE ARG A 70 -2.665 -1.087 -3.634 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.919 1.070 -5.816 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -2.047 0.819 -7.153 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -4.109 -1.404 -5.357 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -3.844 -0.576 -6.895 1.00 0.00 H new ATOM 1062 N LEU A 71 0.830 2.518 -0.183 1.00 0.00 N ATOM 1063 CA LEU A 71 2.278 2.534 -0.016 1.00 0.00 C ATOM 1064 C LEU A 71 2.928 1.390 -0.790 1.00 0.00 C ATOM 1065 O LEU A 71 2.294 0.369 -1.057 1.00 0.00 O ATOM 1066 CB LEU A 71 2.644 2.434 1.465 1.00 0.00 C ATOM 1067 CG LEU A 71 2.648 3.750 2.246 1.00 0.00 C ATOM 1068 CD1 LEU A 71 2.271 3.509 3.699 1.00 0.00 C ATOM 1069 CD2 LEU A 71 4.009 4.423 2.149 1.00 0.00 C ATOM 0 H LEU A 71 0.336 1.923 0.482 1.00 0.00 H new ATOM 0 HA LEU A 71 2.653 3.478 -0.413 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.944 1.751 1.946 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.634 1.984 1.545 1.00 0.00 H new ATOM 0 HG LEU A 71 1.905 4.415 1.806 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.279 4.456 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.274 3.072 3.748 1.00 0.00 H new ATOM 0 HD13 LEU A 71 2.989 2.826 4.153 1.00 0.00 H new ATOM 0 HD21 LEU A 71 3.994 5.357 2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 71 4.771 3.763 2.563 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.238 4.631 1.104 1.00 0.00 H new ATOM 1081 N VAL A 72 4.197 1.568 -1.146 1.00 0.00 N ATOM 1082 CA VAL A 72 4.933 0.550 -1.885 1.00 0.00 C ATOM 1083 C VAL A 72 6.430 0.647 -1.610 1.00 0.00 C ATOM 1084 O VAL A 72 6.942 1.714 -1.277 1.00 0.00 O ATOM 1085 CB VAL A 72 4.692 0.673 -3.401 1.00 0.00 C ATOM 1086 CG1 VAL A 72 3.308 1.242 -3.677 1.00 0.00 C ATOM 1087 CG2 VAL A 72 5.769 1.533 -4.044 1.00 0.00 C ATOM 0 H VAL A 72 4.736 2.408 -0.934 1.00 0.00 H new ATOM 0 HA VAL A 72 4.565 -0.418 -1.544 1.00 0.00 H new ATOM 0 HB VAL A 72 4.744 -0.323 -3.841 1.00 0.00 H new ATOM 0 HG11 VAL A 72 3.155 1.322 -4.753 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.552 0.582 -3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 72 3.224 2.230 -3.224 1.00 0.00 H new ATOM 0 HG21 VAL A 72 5.583 1.609 -5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 72 5.752 2.529 -3.601 1.00 0.00 H new ATOM 0 HG23 VAL A 72 6.746 1.078 -3.877 1.00 0.00 H new ATOM 1097 N MET A 73 7.126 -0.476 -1.753 1.00 0.00 N ATOM 1098 CA MET A 73 8.564 -0.518 -1.523 1.00 0.00 C ATOM 1099 C MET A 73 9.215 -1.631 -2.340 1.00 0.00 C ATOM 1100 O MET A 73 8.969 -2.813 -2.101 1.00 0.00 O ATOM 1101 CB MET A 73 8.858 -0.724 -0.035 1.00 0.00 C ATOM 1102 CG MET A 73 10.333 -0.612 0.315 1.00 0.00 C ATOM 1103 SD MET A 73 11.112 0.839 -0.417 1.00 0.00 S ATOM 1104 CE MET A 73 12.812 0.287 -0.538 1.00 0.00 C ATOM 0 H MET A 73 6.717 -1.369 -2.027 1.00 0.00 H new ATOM 0 HA MET A 73 8.985 0.436 -1.842 1.00 0.00 H new ATOM 0 HB2 MET A 73 8.299 0.012 0.543 1.00 0.00 H new ATOM 0 HB3 MET A 73 8.495 -1.707 0.266 1.00 0.00 H new ATOM 0 HG2 MET A 73 10.443 -0.571 1.399 1.00 0.00 H new ATOM 0 HG3 MET A 73 10.852 -1.508 -0.024 1.00 0.00 H new ATOM 0 HE1 MET A 73 13.474 1.057 -0.140 1.00 0.00 H new ATOM 0 HE2 MET A 73 12.938 -0.632 0.035 1.00 0.00 H new ATOM 0 HE3 MET A 73 13.060 0.100 -1.583 1.00 0.00 H new ATOM 1114 N ARG A 74 10.043 -1.243 -3.303 1.00 0.00 N ATOM 1115 CA ARG A 74 10.727 -2.208 -4.156 1.00 0.00 C ATOM 1116 C ARG A 74 12.203 -2.311 -3.785 1.00 0.00 C ATOM 1117 O ARG A 74 12.899 -1.302 -3.672 1.00 0.00 O ATOM 1118 CB ARG A 74 10.587 -1.810 -5.627 1.00 0.00 C ATOM 1119 CG ARG A 74 9.201 -1.301 -5.991 1.00 0.00 C ATOM 1120 CD ARG A 74 9.090 -1.001 -7.477 1.00 0.00 C ATOM 1121 NE ARG A 74 9.525 0.356 -7.796 1.00 0.00 N ATOM 1122 CZ ARG A 74 9.581 0.839 -9.032 1.00 0.00 C ATOM 1123 NH1 ARG A 74 9.232 0.078 -10.060 1.00 0.00 N ATOM 1124 NH2 ARG A 74 9.987 2.084 -9.242 1.00 0.00 N ATOM 0 H ARG A 74 10.257 -0.268 -3.513 1.00 0.00 H new ATOM 0 HA ARG A 74 10.263 -3.182 -4.004 1.00 0.00 H new ATOM 0 HB2 ARG A 74 11.321 -1.037 -5.857 1.00 0.00 H new ATOM 0 HB3 ARG A 74 10.824 -2.671 -6.252 1.00 0.00 H new ATOM 0 HG2 ARG A 74 8.454 -2.045 -5.712 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.982 -0.399 -5.419 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.693 -1.716 -8.037 1.00 0.00 H new ATOM 0 HD3 ARG A 74 8.057 -1.135 -7.798 1.00 0.00 H new ATOM 0 HE ARG A 74 9.801 0.967 -7.027 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.920 -0.880 -9.902 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.276 0.451 -11.008 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.257 2.672 -8.454 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.029 2.453 -10.192 1.00 0.00 H new ATOM 1138 N THR A 75 12.676 -3.540 -3.596 1.00 0.00 N ATOM 1139 CA THR A 75 14.068 -3.776 -3.236 1.00 0.00 C ATOM 1140 C THR A 75 14.989 -3.558 -4.432 1.00 0.00 C ATOM 1141 O THR A 75 14.579 -3.723 -5.580 1.00 0.00 O ATOM 1142 CB THR A 75 14.274 -5.204 -2.697 1.00 0.00 C ATOM 1143 OG1 THR A 75 13.485 -6.131 -3.450 1.00 0.00 O ATOM 1144 CG2 THR A 75 13.897 -5.286 -1.226 1.00 0.00 C ATOM 0 H THR A 75 12.115 -4.387 -3.687 1.00 0.00 H new ATOM 0 HA THR A 75 14.318 -3.061 -2.453 1.00 0.00 H new ATOM 0 HB THR A 75 15.329 -5.459 -2.800 1.00 0.00 H new ATOM 0 HG1 THR A 75 14.073 -6.692 -3.997 1.00 0.00 H new ATOM 0 HG21 THR A 75 14.051 -6.304 -0.867 1.00 0.00 H new ATOM 0 HG22 THR A 75 14.521 -4.601 -0.652 1.00 0.00 H new ATOM 0 HG23 THR A 75 12.849 -5.012 -1.103 1.00 0.00 H new ATOM 1152 N GLN A 76 16.235 -3.188 -4.153 1.00 0.00 N ATOM 1153 CA GLN A 76 17.215 -2.949 -5.207 1.00 0.00 C ATOM 1154 C GLN A 76 17.805 -4.262 -5.709 1.00 0.00 C ATOM 1155 O GLN A 76 18.876 -4.680 -5.272 1.00 0.00 O ATOM 1156 CB GLN A 76 18.331 -2.036 -4.696 1.00 0.00 C ATOM 1157 CG GLN A 76 18.852 -2.422 -3.322 1.00 0.00 C ATOM 1158 CD GLN A 76 20.185 -1.777 -3.001 1.00 0.00 C ATOM 1159 OE1 GLN A 76 20.280 -0.557 -2.859 1.00 0.00 O ATOM 1160 NE2 GLN A 76 21.226 -2.594 -2.883 1.00 0.00 N ATOM 0 H GLN A 76 16.590 -3.047 -3.207 1.00 0.00 H new ATOM 0 HA GLN A 76 16.707 -2.460 -6.038 1.00 0.00 H new ATOM 0 HB2 GLN A 76 19.157 -2.054 -5.407 1.00 0.00 H new ATOM 0 HB3 GLN A 76 17.963 -1.011 -4.661 1.00 0.00 H new ATOM 0 HG2 GLN A 76 18.122 -2.133 -2.566 1.00 0.00 H new ATOM 0 HG3 GLN A 76 18.955 -3.506 -3.268 1.00 0.00 H new ATOM 0 HE21 GLN A 76 21.103 -3.599 -3.009 1.00 0.00 H new ATOM 0 HE22 GLN A 76 22.149 -2.217 -2.667 1.00 0.00 H new ATOM 1169 N GLY A 77 17.098 -4.909 -6.631 1.00 0.00 N ATOM 1170 CA GLY A 77 17.568 -6.168 -7.179 1.00 0.00 C ATOM 1171 C GLY A 77 16.660 -6.701 -8.269 1.00 0.00 C ATOM 1172 O GLY A 77 17.017 -6.684 -9.446 1.00 0.00 O ATOM 0 H GLY A 77 16.208 -4.583 -7.008 1.00 0.00 H new ATOM 0 HA2 GLY A 77 18.572 -6.033 -7.581 1.00 0.00 H new ATOM 0 HA3 GLY A 77 17.641 -6.904 -6.379 1.00 0.00 H new ATOM 1176 N SER A 78 15.483 -7.178 -7.876 1.00 0.00 N ATOM 1177 CA SER A 78 14.523 -7.725 -8.828 1.00 0.00 C ATOM 1178 C SER A 78 13.140 -7.116 -8.615 1.00 0.00 C ATOM 1179 O SER A 78 12.125 -7.810 -8.698 1.00 0.00 O ATOM 1180 CB SER A 78 14.450 -9.247 -8.694 1.00 0.00 C ATOM 1181 OG SER A 78 15.729 -9.835 -8.854 1.00 0.00 O ATOM 0 H SER A 78 15.171 -7.197 -6.905 1.00 0.00 H new ATOM 0 HA SER A 78 14.861 -7.473 -9.833 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.045 -9.510 -7.717 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.766 -9.649 -9.441 1.00 0.00 H new ATOM 0 HG SER A 78 15.656 -10.808 -8.762 1.00 0.00 H new ATOM 1187 N LEU A 79 13.108 -5.818 -8.339 1.00 0.00 N ATOM 1188 CA LEU A 79 11.851 -5.115 -8.113 1.00 0.00 C ATOM 1189 C LEU A 79 10.886 -5.971 -7.300 1.00 0.00 C ATOM 1190 O LEU A 79 9.710 -6.095 -7.641 1.00 0.00 O ATOM 1191 CB LEU A 79 11.209 -4.734 -9.449 1.00 0.00 C ATOM 1192 CG LEU A 79 11.930 -3.653 -10.255 1.00 0.00 C ATOM 1193 CD1 LEU A 79 11.512 -3.709 -11.716 1.00 0.00 C ATOM 1194 CD2 LEU A 79 11.649 -2.276 -9.671 1.00 0.00 C ATOM 0 H LEU A 79 13.939 -5.230 -8.266 1.00 0.00 H new ATOM 0 HA LEU A 79 12.068 -4.208 -7.548 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.138 -5.631 -10.064 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.190 -4.397 -9.257 1.00 0.00 H new ATOM 0 HG LEU A 79 13.003 -3.838 -10.197 1.00 0.00 H new ATOM 0 HD11 LEU A 79 12.035 -2.933 -12.274 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.764 -4.686 -12.129 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.437 -3.549 -11.793 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.170 -1.519 -10.257 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.577 -2.081 -9.698 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.999 -2.240 -8.639 1.00 0.00 H new ATOM 1206 N ARG A 80 11.391 -6.559 -6.220 1.00 0.00 N ATOM 1207 CA ARG A 80 10.574 -7.403 -5.356 1.00 0.00 C ATOM 1208 C ARG A 80 9.837 -6.565 -4.317 1.00 0.00 C ATOM 1209 O ARG A 80 10.457 -5.899 -3.487 1.00 0.00 O ATOM 1210 CB ARG A 80 11.446 -8.450 -4.660 1.00 0.00 C ATOM 1211 CG ARG A 80 10.769 -9.110 -3.469 1.00 0.00 C ATOM 1212 CD ARG A 80 9.591 -9.968 -3.903 1.00 0.00 C ATOM 1213 NE ARG A 80 9.357 -11.080 -2.984 1.00 0.00 N ATOM 1214 CZ ARG A 80 8.528 -12.086 -3.245 1.00 0.00 C ATOM 1215 NH1 ARG A 80 7.860 -12.119 -4.389 1.00 0.00 N ATOM 1216 NH2 ARG A 80 8.369 -13.061 -2.359 1.00 0.00 N ATOM 0 H ARG A 80 12.362 -6.466 -5.923 1.00 0.00 H new ATOM 0 HA ARG A 80 9.835 -7.910 -5.977 1.00 0.00 H new ATOM 0 HB2 ARG A 80 11.723 -9.218 -5.382 1.00 0.00 H new ATOM 0 HB3 ARG A 80 12.370 -7.978 -4.327 1.00 0.00 H new ATOM 0 HG2 ARG A 80 11.492 -9.726 -2.934 1.00 0.00 H new ATOM 0 HG3 ARG A 80 10.426 -8.344 -2.774 1.00 0.00 H new ATOM 0 HD2 ARG A 80 8.695 -9.351 -3.961 1.00 0.00 H new ATOM 0 HD3 ARG A 80 9.775 -10.357 -4.904 1.00 0.00 H new ATOM 0 HE ARG A 80 9.856 -11.084 -2.095 1.00 0.00 H new ATOM 0 HH11 ARG A 80 7.981 -11.371 -5.072 1.00 0.00 H new ATOM 0 HH12 ARG A 80 7.225 -12.892 -4.586 1.00 0.00 H new ATOM 0 HH21 ARG A 80 8.883 -13.038 -1.478 1.00 0.00 H new ATOM 0 HH22 ARG A 80 7.733 -13.833 -2.559 1.00 0.00 H new ATOM 1230 N LEU A 81 8.510 -6.602 -4.367 1.00 0.00 N ATOM 1231 CA LEU A 81 7.687 -5.845 -3.430 1.00 0.00 C ATOM 1232 C LEU A 81 7.576 -6.572 -2.094 1.00 0.00 C ATOM 1233 O LEU A 81 7.310 -7.773 -2.049 1.00 0.00 O ATOM 1234 CB LEU A 81 6.293 -5.615 -4.016 1.00 0.00 C ATOM 1235 CG LEU A 81 5.591 -4.324 -3.592 1.00 0.00 C ATOM 1236 CD1 LEU A 81 5.621 -4.174 -2.079 1.00 0.00 C ATOM 1237 CD2 LEU A 81 6.238 -3.121 -4.262 1.00 0.00 C ATOM 0 H LEU A 81 7.981 -7.148 -5.047 1.00 0.00 H new ATOM 0 HA LEU A 81 8.166 -4.881 -3.260 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.372 -5.622 -5.103 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.660 -6.458 -3.737 1.00 0.00 H new ATOM 0 HG LEU A 81 4.550 -4.376 -3.911 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.117 -3.250 -1.795 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.112 -5.021 -1.619 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.655 -4.143 -1.737 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.726 -2.211 -3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 81 7.287 -3.064 -3.973 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.165 -3.224 -5.345 1.00 0.00 H new ATOM 1249 N ILE A 82 7.779 -5.835 -1.007 1.00 0.00 N ATOM 1250 CA ILE A 82 7.698 -6.409 0.330 1.00 0.00 C ATOM 1251 C ILE A 82 6.723 -5.629 1.205 1.00 0.00 C ATOM 1252 O ILE A 82 6.204 -6.149 2.194 1.00 0.00 O ATOM 1253 CB ILE A 82 9.077 -6.436 1.016 1.00 0.00 C ATOM 1254 CG1 ILE A 82 9.555 -5.011 1.305 1.00 0.00 C ATOM 1255 CG2 ILE A 82 10.086 -7.173 0.147 1.00 0.00 C ATOM 1256 CD1 ILE A 82 10.366 -4.406 0.181 1.00 0.00 C ATOM 0 H ILE A 82 8.001 -4.840 -1.026 1.00 0.00 H new ATOM 0 HA ILE A 82 7.339 -7.432 0.213 1.00 0.00 H new ATOM 0 HB ILE A 82 8.985 -6.968 1.963 1.00 0.00 H new ATOM 0 HG12 ILE A 82 8.689 -4.378 1.499 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.156 -5.015 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 82 11.056 -7.184 0.645 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.749 -8.197 -0.013 1.00 0.00 H new ATOM 0 HG23 ILE A 82 10.177 -6.667 -0.814 1.00 0.00 H new ATOM 0 HD11 ILE A 82 10.671 -3.396 0.455 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.251 -5.016 0.002 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.761 -4.369 -0.725 1.00 0.00 H new ATOM 1268 N LEU A 83 6.476 -4.376 0.836 1.00 0.00 N ATOM 1269 CA LEU A 83 5.562 -3.523 1.586 1.00 0.00 C ATOM 1270 C LEU A 83 4.469 -2.968 0.679 1.00 0.00 C ATOM 1271 O LEU A 83 4.721 -2.096 -0.152 1.00 0.00 O ATOM 1272 CB LEU A 83 6.328 -2.374 2.243 1.00 0.00 C ATOM 1273 CG LEU A 83 5.503 -1.139 2.607 1.00 0.00 C ATOM 1274 CD1 LEU A 83 4.489 -1.475 3.690 1.00 0.00 C ATOM 1275 CD2 LEU A 83 6.412 -0.005 3.059 1.00 0.00 C ATOM 0 H LEU A 83 6.897 -3.929 0.021 1.00 0.00 H new ATOM 0 HA LEU A 83 5.093 -4.128 2.362 1.00 0.00 H new ATOM 0 HB2 LEU A 83 6.801 -2.751 3.150 1.00 0.00 H new ATOM 0 HB3 LEU A 83 7.129 -2.066 1.570 1.00 0.00 H new ATOM 0 HG LEU A 83 4.962 -0.813 1.719 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.911 -0.584 3.936 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.818 -2.255 3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.010 -1.827 4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 83 5.808 0.866 3.314 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.981 -0.321 3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 83 7.099 0.254 2.253 1.00 0.00 H new ATOM 1287 N ASN A 84 3.253 -3.477 0.847 1.00 0.00 N ATOM 1288 CA ASN A 84 2.120 -3.031 0.044 1.00 0.00 C ATOM 1289 C ASN A 84 0.850 -2.961 0.887 1.00 0.00 C ATOM 1290 O ASN A 84 0.252 -3.986 1.216 1.00 0.00 O ATOM 1291 CB ASN A 84 1.905 -3.972 -1.143 1.00 0.00 C ATOM 1292 CG ASN A 84 1.064 -3.342 -2.235 1.00 0.00 C ATOM 1293 OD1 ASN A 84 -0.160 -3.471 -2.243 1.00 0.00 O ATOM 1294 ND2 ASN A 84 1.718 -2.658 -3.167 1.00 0.00 N ATOM 0 H ASN A 84 3.027 -4.198 1.532 1.00 0.00 H new ATOM 0 HA ASN A 84 2.344 -2.032 -0.330 1.00 0.00 H new ATOM 0 HB2 ASN A 84 2.872 -4.261 -1.554 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.421 -4.885 -0.796 1.00 0.00 H new ATOM 0 HD21 ASN A 84 1.205 -2.214 -3.928 1.00 0.00 H new ATOM 0 HD22 ASN A 84 2.734 -2.577 -3.121 1.00 0.00 H new ATOM 1301 N THR A 85 0.442 -1.743 1.234 1.00 0.00 N ATOM 1302 CA THR A 85 -0.755 -1.539 2.039 1.00 0.00 C ATOM 1303 C THR A 85 -1.553 -0.338 1.542 1.00 0.00 C ATOM 1304 O THR A 85 -1.008 0.561 0.902 1.00 0.00 O ATOM 1305 CB THR A 85 -0.406 -1.329 3.524 1.00 0.00 C ATOM 1306 OG1 THR A 85 -1.554 -1.587 4.339 1.00 0.00 O ATOM 1307 CG2 THR A 85 0.088 0.089 3.769 1.00 0.00 C ATOM 0 H THR A 85 0.924 -0.884 0.969 1.00 0.00 H new ATOM 0 HA THR A 85 -1.359 -2.441 1.940 1.00 0.00 H new ATOM 0 HB THR A 85 0.390 -2.025 3.789 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.373 -1.302 5.259 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.328 0.213 4.825 1.00 0.00 H new ATOM 0 HG22 THR A 85 0.980 0.272 3.170 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.690 0.799 3.488 1.00 0.00 H new ATOM 1315 N LYS A 86 -2.848 -0.329 1.841 1.00 0.00 N ATOM 1316 CA LYS A 86 -3.722 0.762 1.427 1.00 0.00 C ATOM 1317 C LYS A 86 -3.911 1.766 2.559 1.00 0.00 C ATOM 1318 O LYS A 86 -4.354 1.409 3.652 1.00 0.00 O ATOM 1319 CB LYS A 86 -5.080 0.215 0.982 1.00 0.00 C ATOM 1320 CG LYS A 86 -6.034 1.286 0.484 1.00 0.00 C ATOM 1321 CD LYS A 86 -7.469 0.786 0.456 1.00 0.00 C ATOM 1322 CE LYS A 86 -8.184 1.077 1.766 1.00 0.00 C ATOM 1323 NZ LYS A 86 -9.642 0.788 1.678 1.00 0.00 N ATOM 0 H LYS A 86 -3.315 -1.066 2.369 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.252 1.273 0.587 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.925 -0.518 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.542 -0.311 1.818 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.966 2.163 1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.738 1.601 -0.517 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -8.005 1.260 -0.366 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.478 -0.287 0.265 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -7.742 0.477 2.562 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.037 2.123 2.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.093 0.999 2.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.069 1.378 0.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.784 -0.216 1.446 1.00 0.00 H new ATOM 1337 N LEU A 87 -3.577 3.023 2.290 1.00 0.00 N ATOM 1338 CA LEU A 87 -3.714 4.081 3.287 1.00 0.00 C ATOM 1339 C LEU A 87 -5.155 4.189 3.773 1.00 0.00 C ATOM 1340 O LEU A 87 -6.089 3.815 3.064 1.00 0.00 O ATOM 1341 CB LEU A 87 -3.259 5.420 2.704 1.00 0.00 C ATOM 1342 CG LEU A 87 -1.946 5.399 1.920 1.00 0.00 C ATOM 1343 CD1 LEU A 87 -2.030 6.322 0.713 1.00 0.00 C ATOM 1344 CD2 LEU A 87 -0.783 5.796 2.816 1.00 0.00 C ATOM 0 H LEU A 87 -3.210 3.335 1.391 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.082 3.828 4.138 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.045 5.794 2.048 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.160 6.134 3.521 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.774 4.383 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.087 6.294 0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.838 5.993 0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.226 7.341 1.047 1.00 0.00 H new ATOM 0 HD21 LEU A 87 0.143 5.775 2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.948 6.802 3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -0.709 5.096 3.648 1.00 0.00 H new ATOM 1356 N TRP A 88 -5.328 4.703 4.985 1.00 0.00 N ATOM 1357 CA TRP A 88 -6.657 4.862 5.566 1.00 0.00 C ATOM 1358 C TRP A 88 -6.761 6.176 6.333 1.00 0.00 C ATOM 1359 O TRP A 88 -5.771 6.672 6.871 1.00 0.00 O ATOM 1360 CB TRP A 88 -6.974 3.688 6.493 1.00 0.00 C ATOM 1361 CG TRP A 88 -6.035 3.579 7.656 1.00 0.00 C ATOM 1362 CD1 TRP A 88 -6.203 4.120 8.899 1.00 0.00 C ATOM 1363 CD2 TRP A 88 -4.782 2.887 7.683 1.00 0.00 C ATOM 1364 NE1 TRP A 88 -5.129 3.805 9.696 1.00 0.00 N ATOM 1365 CE2 TRP A 88 -4.244 3.050 8.974 1.00 0.00 C ATOM 1366 CE3 TRP A 88 -4.062 2.144 6.743 1.00 0.00 C ATOM 1367 CZ2 TRP A 88 -3.021 2.497 9.346 1.00 0.00 C ATOM 1368 CZ3 TRP A 88 -2.849 1.598 7.113 1.00 0.00 C ATOM 1369 CH2 TRP A 88 -2.338 1.775 8.406 1.00 0.00 C ATOM 0 H TRP A 88 -4.565 5.017 5.585 1.00 0.00 H new ATOM 0 HA TRP A 88 -7.383 4.879 4.753 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -7.993 3.794 6.866 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.940 2.762 5.919 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -7.054 4.708 9.209 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -5.010 4.088 10.669 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -4.448 2.000 5.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -2.626 2.633 10.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -2.284 1.024 6.393 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -1.387 1.333 8.665 1.00 0.00 H new ATOM 1380 N ALA A 89 -7.966 6.733 6.381 1.00 0.00 N ATOM 1381 CA ALA A 89 -8.201 7.987 7.086 1.00 0.00 C ATOM 1382 C ALA A 89 -7.554 7.971 8.467 1.00 0.00 C ATOM 1383 O ALA A 89 -6.927 8.945 8.880 1.00 0.00 O ATOM 1384 CB ALA A 89 -9.694 8.257 7.203 1.00 0.00 C ATOM 0 H ALA A 89 -8.795 6.336 5.940 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.743 8.790 6.508 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -9.853 9.197 7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.131 8.323 6.207 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -10.168 7.445 7.755 1.00 0.00 H new ATOM 1390 N GLN A 90 -7.712 6.858 9.175 1.00 0.00 N ATOM 1391 CA GLN A 90 -7.145 6.716 10.511 1.00 0.00 C ATOM 1392 C GLN A 90 -5.674 6.320 10.439 1.00 0.00 C ATOM 1393 O GLN A 90 -5.134 5.725 11.370 1.00 0.00 O ATOM 1394 CB GLN A 90 -7.926 5.672 11.312 1.00 0.00 C ATOM 1395 CG GLN A 90 -9.402 5.612 10.956 1.00 0.00 C ATOM 1396 CD GLN A 90 -9.692 4.643 9.826 1.00 0.00 C ATOM 1397 OE1 GLN A 90 -8.951 3.683 9.612 1.00 0.00 O ATOM 1398 NE2 GLN A 90 -10.773 4.890 9.097 1.00 0.00 N ATOM 0 H GLN A 90 -8.228 6.042 8.846 1.00 0.00 H new ATOM 0 HA GLN A 90 -7.220 7.680 11.013 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -7.481 4.691 11.146 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.826 5.892 12.375 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -9.972 5.318 11.837 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -9.744 6.607 10.673 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -11.358 5.698 9.310 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -11.018 4.272 8.323 1.00 0.00 H new ATOM 1407 N MET A 91 -5.031 6.657 9.325 1.00 0.00 N ATOM 1408 CA MET A 91 -3.621 6.338 9.131 1.00 0.00 C ATOM 1409 C MET A 91 -2.745 7.150 10.080 1.00 0.00 C ATOM 1410 O MET A 91 -2.944 8.352 10.246 1.00 0.00 O ATOM 1411 CB MET A 91 -3.209 6.607 7.683 1.00 0.00 C ATOM 1412 CG MET A 91 -1.709 6.764 7.496 1.00 0.00 C ATOM 1413 SD MET A 91 -0.794 5.277 7.952 1.00 0.00 S ATOM 1414 CE MET A 91 -0.263 4.700 6.341 1.00 0.00 C ATOM 0 H MET A 91 -5.464 7.150 8.544 1.00 0.00 H new ATOM 0 HA MET A 91 -3.480 5.280 9.350 1.00 0.00 H new ATOM 0 HB2 MET A 91 -3.561 5.788 7.056 1.00 0.00 H new ATOM 0 HB3 MET A 91 -3.707 7.512 7.335 1.00 0.00 H new ATOM 0 HG2 MET A 91 -1.500 7.010 6.455 1.00 0.00 H new ATOM 0 HG3 MET A 91 -1.357 7.602 8.098 1.00 0.00 H new ATOM 0 HE1 MET A 91 0.717 4.231 6.427 1.00 0.00 H new ATOM 0 HE2 MET A 91 -0.981 3.973 5.960 1.00 0.00 H new ATOM 0 HE3 MET A 91 -0.202 5.544 5.654 1.00 0.00 H new ATOM 1424 N GLN A 92 -1.775 6.484 10.699 1.00 0.00 N ATOM 1425 CA GLN A 92 -0.869 7.145 11.631 1.00 0.00 C ATOM 1426 C GLN A 92 0.453 7.489 10.955 1.00 0.00 C ATOM 1427 O GLN A 92 1.130 6.615 10.412 1.00 0.00 O ATOM 1428 CB GLN A 92 -0.616 6.253 12.848 1.00 0.00 C ATOM 1429 CG GLN A 92 -1.609 6.470 13.979 1.00 0.00 C ATOM 1430 CD GLN A 92 -1.162 7.547 14.948 1.00 0.00 C ATOM 1431 OE1 GLN A 92 0.033 7.771 15.138 1.00 0.00 O ATOM 1432 NE2 GLN A 92 -2.124 8.222 15.567 1.00 0.00 N ATOM 0 H GLN A 92 -1.597 5.488 10.572 1.00 0.00 H new ATOM 0 HA GLN A 92 -1.339 8.072 11.959 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.655 5.209 12.537 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.392 6.438 13.220 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.578 6.743 13.560 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -1.748 5.534 14.520 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -3.102 8.003 15.379 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -1.884 8.959 16.230 1.00 0.00 H new ATOM 1441 N ILE A 93 0.814 8.767 10.990 1.00 0.00 N ATOM 1442 CA ILE A 93 2.057 9.226 10.380 1.00 0.00 C ATOM 1443 C ILE A 93 2.558 10.501 11.049 1.00 0.00 C ATOM 1444 O ILE A 93 1.926 11.554 10.955 1.00 0.00 O ATOM 1445 CB ILE A 93 1.882 9.485 8.873 1.00 0.00 C ATOM 1446 CG1 ILE A 93 2.985 10.414 8.360 1.00 0.00 C ATOM 1447 CG2 ILE A 93 0.510 10.080 8.593 1.00 0.00 C ATOM 1448 CD1 ILE A 93 2.923 10.661 6.870 1.00 0.00 C ATOM 0 H ILE A 93 0.264 9.503 11.434 1.00 0.00 H new ATOM 0 HA ILE A 93 2.790 8.432 10.521 1.00 0.00 H new ATOM 0 HB ILE A 93 1.959 8.534 8.346 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.916 11.369 8.881 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.955 9.984 8.609 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.402 10.257 7.523 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.262 9.386 8.926 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.406 11.023 9.129 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.734 11.328 6.578 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.023 9.714 6.340 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.967 11.120 6.617 1.00 0.00 H new ATOM 1460 N ASP A 94 3.699 10.401 11.722 1.00 0.00 N ATOM 1461 CA ASP A 94 4.287 11.547 12.405 1.00 0.00 C ATOM 1462 C ASP A 94 5.748 11.728 12.002 1.00 0.00 C ATOM 1463 O ASP A 94 6.475 10.753 11.806 1.00 0.00 O ATOM 1464 CB ASP A 94 4.182 11.376 13.921 1.00 0.00 C ATOM 1465 CG ASP A 94 2.744 11.342 14.401 1.00 0.00 C ATOM 1466 OD1 ASP A 94 1.961 10.526 13.873 1.00 0.00 O ATOM 1467 OD2 ASP A 94 2.403 12.133 15.304 1.00 0.00 O ATOM 0 H ASP A 94 4.235 9.538 11.809 1.00 0.00 H new ATOM 0 HA ASP A 94 3.732 12.438 12.109 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.682 10.453 14.215 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.707 12.194 14.413 1.00 0.00 H new ATOM 1472 N LYS A 95 6.171 12.980 11.879 1.00 0.00 N ATOM 1473 CA LYS A 95 7.545 13.290 11.499 1.00 0.00 C ATOM 1474 C LYS A 95 8.471 13.230 12.710 1.00 0.00 C ATOM 1475 O LYS A 95 8.602 14.202 13.452 1.00 0.00 O ATOM 1476 CB LYS A 95 7.619 14.678 10.858 1.00 0.00 C ATOM 1477 CG LYS A 95 8.991 15.023 10.307 1.00 0.00 C ATOM 1478 CD LYS A 95 9.147 14.561 8.868 1.00 0.00 C ATOM 1479 CE LYS A 95 10.103 15.456 8.095 1.00 0.00 C ATOM 1480 NZ LYS A 95 9.549 16.826 7.906 1.00 0.00 N ATOM 0 H LYS A 95 5.583 13.798 12.037 1.00 0.00 H new ATOM 0 HA LYS A 95 7.871 12.544 10.775 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.888 14.735 10.051 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.336 15.426 11.598 1.00 0.00 H new ATOM 0 HG2 LYS A 95 9.146 16.100 10.363 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.759 14.558 10.925 1.00 0.00 H new ATOM 0 HD2 LYS A 95 9.515 13.535 8.852 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.173 14.558 8.378 1.00 0.00 H new ATOM 0 HE2 LYS A 95 11.053 15.518 8.627 1.00 0.00 H new ATOM 0 HE3 LYS A 95 10.311 15.011 7.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 10.027 17.287 7.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 8.529 16.764 7.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 9.703 17.385 8.769 1.00 0.00 H new ATOM 1494 N ALA A 96 9.112 12.081 12.901 1.00 0.00 N ATOM 1495 CA ALA A 96 10.028 11.895 14.020 1.00 0.00 C ATOM 1496 C ALA A 96 11.256 12.790 13.879 1.00 0.00 C ATOM 1497 O ALA A 96 11.694 13.414 14.844 1.00 0.00 O ATOM 1498 CB ALA A 96 10.446 10.436 14.122 1.00 0.00 C ATOM 0 H ALA A 96 9.014 11.266 12.296 1.00 0.00 H new ATOM 0 HA ALA A 96 9.507 12.178 14.935 1.00 0.00 H new ATOM 0 HB1 ALA A 96 11.130 10.311 14.962 1.00 0.00 H new ATOM 0 HB2 ALA A 96 9.564 9.815 14.277 1.00 0.00 H new ATOM 0 HB3 ALA A 96 10.944 10.135 13.200 1.00 0.00 H new ATOM 1504 N SER A 97 11.804 12.846 12.669 1.00 0.00 N ATOM 1505 CA SER A 97 12.985 13.661 12.404 1.00 0.00 C ATOM 1506 C SER A 97 12.978 14.173 10.967 1.00 0.00 C ATOM 1507 O SER A 97 12.149 13.763 10.155 1.00 0.00 O ATOM 1508 CB SER A 97 14.258 12.853 12.664 1.00 0.00 C ATOM 1509 OG SER A 97 15.369 13.706 12.871 1.00 0.00 O ATOM 0 H SER A 97 11.450 12.338 11.858 1.00 0.00 H new ATOM 0 HA SER A 97 12.964 14.518 13.078 1.00 0.00 H new ATOM 0 HB2 SER A 97 14.116 12.216 13.537 1.00 0.00 H new ATOM 0 HB3 SER A 97 14.454 12.194 11.818 1.00 0.00 H new ATOM 0 HG SER A 97 16.170 13.166 13.037 1.00 0.00 H new ATOM 1515 N GLU A 98 13.909 15.071 10.661 1.00 0.00 N ATOM 1516 CA GLU A 98 14.010 15.640 9.322 1.00 0.00 C ATOM 1517 C GLU A 98 14.620 14.636 8.349 1.00 0.00 C ATOM 1518 O GLU A 98 14.716 14.896 7.149 1.00 0.00 O ATOM 1519 CB GLU A 98 14.854 16.917 9.349 1.00 0.00 C ATOM 1520 CG GLU A 98 16.343 16.666 9.191 1.00 0.00 C ATOM 1521 CD GLU A 98 17.176 17.903 9.470 1.00 0.00 C ATOM 1522 OE1 GLU A 98 16.805 18.674 10.379 1.00 0.00 O ATOM 1523 OE2 GLU A 98 18.198 18.099 8.780 1.00 0.00 O ATOM 0 H GLU A 98 14.604 15.420 11.321 1.00 0.00 H new ATOM 0 HA GLU A 98 13.004 15.884 8.982 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.519 17.580 8.551 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.680 17.438 10.291 1.00 0.00 H new ATOM 0 HG2 GLU A 98 16.647 15.868 9.868 1.00 0.00 H new ATOM 0 HG3 GLU A 98 16.544 16.318 8.178 1.00 0.00 H new ATOM 1530 N LYS A 99 15.031 13.486 8.874 1.00 0.00 N ATOM 1531 CA LYS A 99 15.631 12.441 8.054 1.00 0.00 C ATOM 1532 C LYS A 99 14.957 11.097 8.307 1.00 0.00 C ATOM 1533 O LYS A 99 15.284 10.097 7.667 1.00 0.00 O ATOM 1534 CB LYS A 99 17.130 12.334 8.344 1.00 0.00 C ATOM 1535 CG LYS A 99 17.938 13.504 7.811 1.00 0.00 C ATOM 1536 CD LYS A 99 19.189 13.741 8.637 1.00 0.00 C ATOM 1537 CE LYS A 99 18.897 14.600 9.858 1.00 0.00 C ATOM 1538 NZ LYS A 99 20.073 14.692 10.767 1.00 0.00 N ATOM 0 H LYS A 99 14.959 13.255 9.865 1.00 0.00 H new ATOM 0 HA LYS A 99 15.488 12.708 7.007 1.00 0.00 H new ATOM 0 HB2 LYS A 99 17.279 12.262 9.421 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.511 11.411 7.907 1.00 0.00 H new ATOM 0 HG2 LYS A 99 18.216 13.313 6.775 1.00 0.00 H new ATOM 0 HG3 LYS A 99 17.323 14.404 7.815 1.00 0.00 H new ATOM 0 HD2 LYS A 99 19.603 12.784 8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.946 14.227 8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 99 18.607 15.601 9.537 1.00 0.00 H new ATOM 0 HE3 LYS A 99 18.050 14.182 10.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 19.833 15.286 11.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 20.334 13.740 11.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 20.874 15.115 10.256 1.00 0.00 H new ATOM 1552 N SER A 100 14.012 11.081 9.242 1.00 0.00 N ATOM 1553 CA SER A 100 13.292 9.858 9.580 1.00 0.00 C ATOM 1554 C SER A 100 11.800 10.132 9.739 1.00 0.00 C ATOM 1555 O SER A 100 11.400 11.207 10.185 1.00 0.00 O ATOM 1556 CB SER A 100 13.851 9.253 10.869 1.00 0.00 C ATOM 1557 OG SER A 100 13.694 7.844 10.882 1.00 0.00 O ATOM 0 H SER A 100 13.727 11.900 9.779 1.00 0.00 H new ATOM 0 HA SER A 100 13.428 9.148 8.764 1.00 0.00 H new ATOM 0 HB2 SER A 100 14.907 9.505 10.964 1.00 0.00 H new ATOM 0 HB3 SER A 100 13.341 9.687 11.729 1.00 0.00 H new ATOM 0 HG SER A 100 13.971 7.476 10.017 1.00 0.00 H new ATOM 1563 N ILE A 101 10.983 9.152 9.370 1.00 0.00 N ATOM 1564 CA ILE A 101 9.535 9.286 9.471 1.00 0.00 C ATOM 1565 C ILE A 101 8.899 8.003 9.996 1.00 0.00 C ATOM 1566 O ILE A 101 9.281 6.901 9.600 1.00 0.00 O ATOM 1567 CB ILE A 101 8.904 9.638 8.111 1.00 0.00 C ATOM 1568 CG1 ILE A 101 9.462 10.967 7.596 1.00 0.00 C ATOM 1569 CG2 ILE A 101 7.389 9.706 8.231 1.00 0.00 C ATOM 1570 CD1 ILE A 101 9.287 11.158 6.105 1.00 0.00 C ATOM 0 H ILE A 101 11.299 8.256 8.998 1.00 0.00 H new ATOM 0 HA ILE A 101 9.343 10.098 10.172 1.00 0.00 H new ATOM 0 HB ILE A 101 9.157 8.855 7.396 1.00 0.00 H new ATOM 0 HG12 ILE A 101 8.969 11.786 8.120 1.00 0.00 H new ATOM 0 HG13 ILE A 101 10.523 11.025 7.840 1.00 0.00 H new ATOM 0 HG21 ILE A 101 6.958 9.956 7.261 1.00 0.00 H new ATOM 0 HG22 ILE A 101 7.006 8.740 8.560 1.00 0.00 H new ATOM 0 HG23 ILE A 101 7.116 10.471 8.958 1.00 0.00 H new ATOM 0 HD11 ILE A 101 9.705 12.120 5.810 1.00 0.00 H new ATOM 0 HD12 ILE A 101 9.804 10.359 5.573 1.00 0.00 H new ATOM 0 HD13 ILE A 101 8.226 11.132 5.857 1.00 0.00 H new ATOM 1582 N HIS A 102 7.925 8.153 10.888 1.00 0.00 N ATOM 1583 CA HIS A 102 7.234 7.006 11.467 1.00 0.00 C ATOM 1584 C HIS A 102 5.861 6.821 10.828 1.00 0.00 C ATOM 1585 O HIS A 102 4.925 7.564 11.123 1.00 0.00 O ATOM 1586 CB HIS A 102 7.087 7.180 12.979 1.00 0.00 C ATOM 1587 CG HIS A 102 8.391 7.147 13.714 1.00 0.00 C ATOM 1588 ND1 HIS A 102 8.509 6.714 15.018 1.00 0.00 N ATOM 1589 CD2 HIS A 102 9.639 7.495 13.321 1.00 0.00 C ATOM 1590 CE1 HIS A 102 9.773 6.799 15.396 1.00 0.00 C ATOM 1591 NE2 HIS A 102 10.479 7.269 14.383 1.00 0.00 N ATOM 0 H HIS A 102 7.596 9.058 11.226 1.00 0.00 H new ATOM 0 HA HIS A 102 7.831 6.116 11.269 1.00 0.00 H new ATOM 0 HB2 HIS A 102 6.589 8.128 13.181 1.00 0.00 H new ATOM 0 HB3 HIS A 102 6.441 6.392 13.366 1.00 0.00 H new ATOM 0 HD2 HIS A 102 9.921 7.879 12.352 1.00 0.00 H new ATOM 0 HE1 HIS A 102 10.162 6.530 16.367 1.00 0.00 H new ATOM 0 HE2 HIS A 102 11.485 7.437 14.389 1.00 0.00 H new ATOM 1599 N ILE A 103 5.749 5.828 9.953 1.00 0.00 N ATOM 1600 CA ILE A 103 4.490 5.546 9.274 1.00 0.00 C ATOM 1601 C ILE A 103 3.984 4.148 9.612 1.00 0.00 C ATOM 1602 O ILE A 103 4.768 3.209 9.756 1.00 0.00 O ATOM 1603 CB ILE A 103 4.633 5.674 7.746 1.00 0.00 C ATOM 1604 CG1 ILE A 103 5.165 4.368 7.152 1.00 0.00 C ATOM 1605 CG2 ILE A 103 5.553 6.834 7.395 1.00 0.00 C ATOM 1606 CD1 ILE A 103 4.074 3.401 6.746 1.00 0.00 C ATOM 0 H ILE A 103 6.515 5.205 9.697 1.00 0.00 H new ATOM 0 HA ILE A 103 3.770 6.285 9.626 1.00 0.00 H new ATOM 0 HB ILE A 103 3.650 5.873 7.319 1.00 0.00 H new ATOM 0 HG12 ILE A 103 5.779 4.598 6.281 1.00 0.00 H new ATOM 0 HG13 ILE A 103 5.815 3.885 7.881 1.00 0.00 H new ATOM 0 HG21 ILE A 103 5.644 6.911 6.312 1.00 0.00 H new ATOM 0 HG22 ILE A 103 5.138 7.761 7.791 1.00 0.00 H new ATOM 0 HG23 ILE A 103 6.537 6.662 7.830 1.00 0.00 H new ATOM 0 HD11 ILE A 103 4.523 2.498 6.333 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.474 3.142 7.619 1.00 0.00 H new ATOM 0 HD13 ILE A 103 3.437 3.866 5.993 1.00 0.00 H new ATOM 1618 N THR A 104 2.667 4.014 9.734 1.00 0.00 N ATOM 1619 CA THR A 104 2.055 2.731 10.053 1.00 0.00 C ATOM 1620 C THR A 104 1.537 2.042 8.796 1.00 0.00 C ATOM 1621 O THR A 104 0.658 2.562 8.109 1.00 0.00 O ATOM 1622 CB THR A 104 0.894 2.896 11.051 1.00 0.00 C ATOM 1623 OG1 THR A 104 0.075 4.007 10.671 1.00 0.00 O ATOM 1624 CG2 THR A 104 1.418 3.105 12.463 1.00 0.00 C ATOM 0 H THR A 104 2.003 4.780 9.616 1.00 0.00 H new ATOM 0 HA THR A 104 2.830 2.115 10.508 1.00 0.00 H new ATOM 0 HB THR A 104 0.298 1.983 11.034 1.00 0.00 H new ATOM 0 HG1 THR A 104 0.014 4.049 9.694 1.00 0.00 H new ATOM 0 HG21 THR A 104 0.579 3.219 13.149 1.00 0.00 H new ATOM 0 HG22 THR A 104 2.016 2.243 12.761 1.00 0.00 H new ATOM 0 HG23 THR A 104 2.036 4.003 12.493 1.00 0.00 H new ATOM 1632 N ALA A 105 2.085 0.867 8.501 1.00 0.00 N ATOM 1633 CA ALA A 105 1.676 0.105 7.329 1.00 0.00 C ATOM 1634 C ALA A 105 1.508 -1.372 7.665 1.00 0.00 C ATOM 1635 O ALA A 105 1.931 -1.829 8.727 1.00 0.00 O ATOM 1636 CB ALA A 105 2.688 0.280 6.206 1.00 0.00 C ATOM 0 H ALA A 105 2.814 0.423 9.059 1.00 0.00 H new ATOM 0 HA ALA A 105 0.711 0.487 6.997 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.370 -0.295 5.336 1.00 0.00 H new ATOM 0 HB2 ALA A 105 2.756 1.335 5.939 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.664 -0.074 6.537 1.00 0.00 H new ATOM 1642 N MET A 106 0.885 -2.115 6.756 1.00 0.00 N ATOM 1643 CA MET A 106 0.661 -3.541 6.957 1.00 0.00 C ATOM 1644 C MET A 106 1.716 -4.366 6.227 1.00 0.00 C ATOM 1645 O MET A 106 2.058 -4.078 5.080 1.00 0.00 O ATOM 1646 CB MET A 106 -0.736 -3.934 6.471 1.00 0.00 C ATOM 1647 CG MET A 106 -1.829 -3.678 7.495 1.00 0.00 C ATOM 1648 SD MET A 106 -3.484 -3.908 6.817 1.00 0.00 S ATOM 1649 CE MET A 106 -4.488 -3.227 8.133 1.00 0.00 C ATOM 0 H MET A 106 0.526 -1.752 5.873 1.00 0.00 H new ATOM 0 HA MET A 106 0.738 -3.748 8.024 1.00 0.00 H new ATOM 0 HB2 MET A 106 -0.965 -3.379 5.561 1.00 0.00 H new ATOM 0 HB3 MET A 106 -0.736 -4.992 6.208 1.00 0.00 H new ATOM 0 HG2 MET A 106 -1.691 -4.349 8.343 1.00 0.00 H new ATOM 0 HG3 MET A 106 -1.734 -2.661 7.875 1.00 0.00 H new ATOM 0 HE1 MET A 106 -5.540 -3.281 7.853 1.00 0.00 H new ATOM 0 HE2 MET A 106 -4.326 -3.798 9.047 1.00 0.00 H new ATOM 0 HE3 MET A 106 -4.211 -2.186 8.301 1.00 0.00 H new ATOM 1659 N ASP A 107 2.230 -5.391 6.899 1.00 0.00 N ATOM 1660 CA ASP A 107 3.245 -6.257 6.313 1.00 0.00 C ATOM 1661 C ASP A 107 2.605 -7.343 5.454 1.00 0.00 C ATOM 1662 O ASP A 107 1.388 -7.529 5.475 1.00 0.00 O ATOM 1663 CB ASP A 107 4.097 -6.895 7.413 1.00 0.00 C ATOM 1664 CG ASP A 107 3.255 -7.575 8.475 1.00 0.00 C ATOM 1665 OD1 ASP A 107 2.831 -6.885 9.427 1.00 0.00 O ATOM 1666 OD2 ASP A 107 3.021 -8.795 8.355 1.00 0.00 O ATOM 0 H ASP A 107 1.960 -5.642 7.850 1.00 0.00 H new ATOM 0 HA ASP A 107 3.884 -5.646 5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 107 4.774 -7.624 6.968 1.00 0.00 H new ATOM 0 HB3 ASP A 107 4.716 -6.129 7.880 1.00 0.00 H new ATOM 1671 N THR A 108 3.432 -8.056 4.696 1.00 0.00 N ATOM 1672 CA THR A 108 2.947 -9.120 3.827 1.00 0.00 C ATOM 1673 C THR A 108 3.255 -10.494 4.415 1.00 0.00 C ATOM 1674 O THR A 108 2.701 -11.503 3.982 1.00 0.00 O ATOM 1675 CB THR A 108 3.567 -9.025 2.421 1.00 0.00 C ATOM 1676 OG1 THR A 108 4.976 -9.273 2.490 1.00 0.00 O ATOM 1677 CG2 THR A 108 3.317 -7.655 1.811 1.00 0.00 C ATOM 0 H THR A 108 4.442 -7.915 4.667 1.00 0.00 H new ATOM 0 HA THR A 108 1.867 -8.995 3.748 1.00 0.00 H new ATOM 0 HB THR A 108 3.096 -9.778 1.788 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.363 -9.212 1.592 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.764 -7.612 0.818 1.00 0.00 H new ATOM 0 HG22 THR A 108 2.244 -7.482 1.733 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.764 -6.888 2.444 1.00 0.00 H new ATOM 1685 N GLU A 109 4.143 -10.522 5.404 1.00 0.00 N ATOM 1686 CA GLU A 109 4.525 -11.772 6.050 1.00 0.00 C ATOM 1687 C GLU A 109 3.562 -12.116 7.184 1.00 0.00 C ATOM 1688 O GLU A 109 2.953 -13.186 7.194 1.00 0.00 O ATOM 1689 CB GLU A 109 5.952 -11.678 6.592 1.00 0.00 C ATOM 1690 CG GLU A 109 6.943 -11.097 5.597 1.00 0.00 C ATOM 1691 CD GLU A 109 8.380 -11.434 5.939 1.00 0.00 C ATOM 1692 OE1 GLU A 109 8.743 -12.627 5.874 1.00 0.00 O ATOM 1693 OE2 GLU A 109 9.144 -10.504 6.274 1.00 0.00 O ATOM 0 H GLU A 109 4.611 -9.695 5.775 1.00 0.00 H new ATOM 0 HA GLU A 109 4.479 -12.564 5.303 1.00 0.00 H new ATOM 0 HB2 GLU A 109 5.950 -11.063 7.492 1.00 0.00 H new ATOM 0 HB3 GLU A 109 6.286 -12.673 6.887 1.00 0.00 H new ATOM 0 HG2 GLU A 109 6.713 -11.473 4.600 1.00 0.00 H new ATOM 0 HG3 GLU A 109 6.826 -10.014 5.564 1.00 0.00 H new ATOM 1700 N ASP A 110 3.429 -11.200 8.137 1.00 0.00 N ATOM 1701 CA ASP A 110 2.540 -11.403 9.275 1.00 0.00 C ATOM 1702 C ASP A 110 1.221 -10.663 9.074 1.00 0.00 C ATOM 1703 O ASP A 110 0.403 -10.576 9.990 1.00 0.00 O ATOM 1704 CB ASP A 110 3.213 -10.932 10.565 1.00 0.00 C ATOM 1705 CG ASP A 110 2.279 -10.986 11.758 1.00 0.00 C ATOM 1706 OD1 ASP A 110 1.822 -12.095 12.105 1.00 0.00 O ATOM 1707 OD2 ASP A 110 2.006 -9.919 12.346 1.00 0.00 O ATOM 0 H ASP A 110 3.926 -10.309 8.144 1.00 0.00 H new ATOM 0 HA ASP A 110 2.328 -12.469 9.353 1.00 0.00 H new ATOM 0 HB2 ASP A 110 4.087 -11.553 10.763 1.00 0.00 H new ATOM 0 HB3 ASP A 110 3.571 -9.911 10.433 1.00 0.00 H new ATOM 1712 N GLN A 111 1.025 -10.131 7.872 1.00 0.00 N ATOM 1713 CA GLN A 111 -0.194 -9.397 7.553 1.00 0.00 C ATOM 1714 C GLN A 111 -0.695 -8.621 8.767 1.00 0.00 C ATOM 1715 O GLN A 111 -1.861 -8.727 9.146 1.00 0.00 O ATOM 1716 CB GLN A 111 -1.279 -10.356 7.062 1.00 0.00 C ATOM 1717 CG GLN A 111 -0.887 -11.129 5.813 1.00 0.00 C ATOM 1718 CD GLN A 111 -2.089 -11.604 5.020 1.00 0.00 C ATOM 1719 OE1 GLN A 111 -2.255 -12.801 4.778 1.00 0.00 O ATOM 1720 NE2 GLN A 111 -2.937 -10.668 4.611 1.00 0.00 N ATOM 0 H GLN A 111 1.693 -10.194 7.104 1.00 0.00 H new ATOM 0 HA GLN A 111 0.037 -8.686 6.760 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -1.515 -11.063 7.858 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -2.188 -9.790 6.859 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -0.265 -10.497 5.179 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -0.281 -11.989 6.098 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -2.761 -9.688 4.834 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -3.764 -10.929 4.074 1.00 0.00 H new ATOM 1729 N GLY A 112 0.194 -7.840 9.373 1.00 0.00 N ATOM 1730 CA GLY A 112 -0.178 -7.058 10.538 1.00 0.00 C ATOM 1731 C GLY A 112 0.274 -5.615 10.436 1.00 0.00 C ATOM 1732 O GLY A 112 1.068 -5.266 9.560 1.00 0.00 O ATOM 0 H GLY A 112 1.165 -7.735 9.078 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -1.261 -7.089 10.662 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.258 -7.510 11.429 1.00 0.00 H new ATOM 1736 N VAL A 113 -0.232 -4.773 11.330 1.00 0.00 N ATOM 1737 CA VAL A 113 0.124 -3.359 11.337 1.00 0.00 C ATOM 1738 C VAL A 113 1.235 -3.077 12.343 1.00 0.00 C ATOM 1739 O VAL A 113 1.071 -3.296 13.543 1.00 0.00 O ATOM 1740 CB VAL A 113 -1.093 -2.476 11.671 1.00 0.00 C ATOM 1741 CG1 VAL A 113 -0.703 -1.005 11.664 1.00 0.00 C ATOM 1742 CG2 VAL A 113 -2.227 -2.739 10.692 1.00 0.00 C ATOM 0 H VAL A 113 -0.891 -5.045 12.060 1.00 0.00 H new ATOM 0 HA VAL A 113 0.476 -3.116 10.334 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.441 -2.731 12.672 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -1.575 -0.396 11.902 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.075 -0.831 12.408 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.329 -0.733 10.677 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -3.079 -2.107 10.943 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.893 -2.513 9.679 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -2.523 -3.786 10.751 1.00 0.00 H new ATOM 1752 N LYS A 114 2.366 -2.589 11.845 1.00 0.00 N ATOM 1753 CA LYS A 114 3.505 -2.274 12.698 1.00 0.00 C ATOM 1754 C LYS A 114 4.068 -0.895 12.368 1.00 0.00 C ATOM 1755 O LYS A 114 3.790 -0.338 11.306 1.00 0.00 O ATOM 1756 CB LYS A 114 4.598 -3.334 12.538 1.00 0.00 C ATOM 1757 CG LYS A 114 5.116 -3.462 11.116 1.00 0.00 C ATOM 1758 CD LYS A 114 5.896 -4.752 10.921 1.00 0.00 C ATOM 1759 CE LYS A 114 5.028 -5.973 11.185 1.00 0.00 C ATOM 1760 NZ LYS A 114 5.087 -6.398 12.612 1.00 0.00 N ATOM 0 H LYS A 114 2.518 -2.403 10.854 1.00 0.00 H new ATOM 0 HA LYS A 114 3.161 -2.269 13.732 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.430 -3.089 13.198 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.207 -4.299 12.862 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.279 -3.433 10.419 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.755 -2.610 10.882 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.284 -4.793 9.903 1.00 0.00 H new ATOM 0 HD3 LYS A 114 6.756 -4.764 11.591 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.996 -5.750 10.915 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.354 -6.795 10.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.352 -7.402 12.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.795 -5.826 13.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.155 -6.262 13.053 1.00 0.00 H new ATOM 1774 N VAL A 115 4.861 -0.349 13.285 1.00 0.00 N ATOM 1775 CA VAL A 115 5.465 0.962 13.090 1.00 0.00 C ATOM 1776 C VAL A 115 6.738 0.864 12.258 1.00 0.00 C ATOM 1777 O VAL A 115 7.738 0.296 12.698 1.00 0.00 O ATOM 1778 CB VAL A 115 5.796 1.634 14.436 1.00 0.00 C ATOM 1779 CG1 VAL A 115 6.489 2.969 14.211 1.00 0.00 C ATOM 1780 CG2 VAL A 115 4.533 1.813 15.266 1.00 0.00 C ATOM 0 H VAL A 115 5.100 -0.796 14.170 1.00 0.00 H new ATOM 0 HA VAL A 115 4.733 1.570 12.558 1.00 0.00 H new ATOM 0 HB VAL A 115 6.478 0.987 14.987 1.00 0.00 H new ATOM 0 HG11 VAL A 115 6.715 3.428 15.173 1.00 0.00 H new ATOM 0 HG12 VAL A 115 7.415 2.810 13.659 1.00 0.00 H new ATOM 0 HG13 VAL A 115 5.834 3.627 13.639 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.785 2.289 16.214 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.826 2.439 14.722 1.00 0.00 H new ATOM 0 HG23 VAL A 115 4.083 0.839 15.458 1.00 0.00 H new ATOM 1790 N PHE A 116 6.696 1.421 11.052 1.00 0.00 N ATOM 1791 CA PHE A 116 7.847 1.395 10.157 1.00 0.00 C ATOM 1792 C PHE A 116 8.601 2.721 10.202 1.00 0.00 C ATOM 1793 O PHE A 116 8.159 3.678 10.840 1.00 0.00 O ATOM 1794 CB PHE A 116 7.398 1.099 8.725 1.00 0.00 C ATOM 1795 CG PHE A 116 6.968 -0.324 8.513 1.00 0.00 C ATOM 1796 CD1 PHE A 116 7.890 -1.357 8.569 1.00 0.00 C ATOM 1797 CD2 PHE A 116 5.640 -0.630 8.260 1.00 0.00 C ATOM 1798 CE1 PHE A 116 7.496 -2.667 8.374 1.00 0.00 C ATOM 1799 CE2 PHE A 116 5.240 -1.938 8.064 1.00 0.00 C ATOM 1800 CZ PHE A 116 6.169 -2.958 8.123 1.00 0.00 C ATOM 0 H PHE A 116 5.877 1.896 10.672 1.00 0.00 H new ATOM 0 HA PHE A 116 8.519 0.604 10.491 1.00 0.00 H new ATOM 0 HB2 PHE A 116 6.572 1.762 8.468 1.00 0.00 H new ATOM 0 HB3 PHE A 116 8.216 1.329 8.042 1.00 0.00 H new ATOM 0 HD1 PHE A 116 8.928 -1.136 8.767 1.00 0.00 H new ATOM 0 HD2 PHE A 116 4.909 0.164 8.216 1.00 0.00 H new ATOM 0 HE1 PHE A 116 8.225 -3.463 8.418 1.00 0.00 H new ATOM 0 HE2 PHE A 116 4.202 -2.162 7.865 1.00 0.00 H new ATOM 0 HZ PHE A 116 5.859 -3.982 7.973 1.00 0.00 H new ATOM 1810 N LEU A 117 9.741 2.770 9.521 1.00 0.00 N ATOM 1811 CA LEU A 117 10.557 3.978 9.483 1.00 0.00 C ATOM 1812 C LEU A 117 11.074 4.241 8.072 1.00 0.00 C ATOM 1813 O LEU A 117 11.177 3.324 7.257 1.00 0.00 O ATOM 1814 CB LEU A 117 11.733 3.854 10.454 1.00 0.00 C ATOM 1815 CG LEU A 117 12.401 5.164 10.871 1.00 0.00 C ATOM 1816 CD1 LEU A 117 11.757 5.714 12.133 1.00 0.00 C ATOM 1817 CD2 LEU A 117 13.895 4.958 11.078 1.00 0.00 C ATOM 0 H LEU A 117 10.121 1.988 8.988 1.00 0.00 H new ATOM 0 HA LEU A 117 9.932 4.819 9.784 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.384 3.346 11.353 1.00 0.00 H new ATOM 0 HB3 LEU A 117 12.488 3.214 9.998 1.00 0.00 H new ATOM 0 HG LEU A 117 12.262 5.891 10.071 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.246 6.647 12.414 1.00 0.00 H new ATOM 0 HD12 LEU A 117 10.699 5.900 11.950 1.00 0.00 H new ATOM 0 HD13 LEU A 117 11.864 4.990 12.941 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.355 5.901 11.374 1.00 0.00 H new ATOM 0 HD22 LEU A 117 14.055 4.215 11.859 1.00 0.00 H new ATOM 0 HD23 LEU A 117 14.347 4.611 10.149 1.00 0.00 H new ATOM 1829 N ILE A 118 11.399 5.499 7.793 1.00 0.00 N ATOM 1830 CA ILE A 118 11.909 5.882 6.482 1.00 0.00 C ATOM 1831 C ILE A 118 13.135 6.779 6.609 1.00 0.00 C ATOM 1832 O ILE A 118 13.027 7.947 6.985 1.00 0.00 O ATOM 1833 CB ILE A 118 10.836 6.611 5.651 1.00 0.00 C ATOM 1834 CG1 ILE A 118 9.649 5.685 5.385 1.00 0.00 C ATOM 1835 CG2 ILE A 118 11.429 7.112 4.343 1.00 0.00 C ATOM 1836 CD1 ILE A 118 8.338 6.419 5.204 1.00 0.00 C ATOM 0 H ILE A 118 11.318 6.270 8.456 1.00 0.00 H new ATOM 0 HA ILE A 118 12.188 4.961 5.971 1.00 0.00 H new ATOM 0 HB ILE A 118 10.480 7.471 6.218 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.852 5.095 4.491 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.552 4.984 6.214 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.659 7.625 3.767 1.00 0.00 H new ATOM 0 HG22 ILE A 118 12.245 7.803 4.555 1.00 0.00 H new ATOM 0 HG23 ILE A 118 11.809 6.267 3.769 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.541 5.699 5.019 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.112 6.987 6.106 1.00 0.00 H new ATOM 0 HD13 ILE A 118 8.416 7.100 4.356 1.00 0.00 H new ATOM 1848 N SER A 119 14.302 6.227 6.291 1.00 0.00 N ATOM 1849 CA SER A 119 15.550 6.977 6.371 1.00 0.00 C ATOM 1850 C SER A 119 15.928 7.549 5.009 1.00 0.00 C ATOM 1851 O SER A 119 16.311 6.814 4.099 1.00 0.00 O ATOM 1852 CB SER A 119 16.675 6.082 6.892 1.00 0.00 C ATOM 1853 OG SER A 119 17.940 6.697 6.717 1.00 0.00 O ATOM 0 H SER A 119 14.409 5.263 5.976 1.00 0.00 H new ATOM 0 HA SER A 119 15.404 7.805 7.065 1.00 0.00 H new ATOM 0 HB2 SER A 119 16.514 5.869 7.949 1.00 0.00 H new ATOM 0 HB3 SER A 119 16.656 5.127 6.368 1.00 0.00 H new ATOM 0 HG SER A 119 18.642 6.105 7.060 1.00 0.00 H new ATOM 1859 N ALA A 120 15.820 8.867 4.876 1.00 0.00 N ATOM 1860 CA ALA A 120 16.152 9.539 3.626 1.00 0.00 C ATOM 1861 C ALA A 120 16.886 10.851 3.887 1.00 0.00 C ATOM 1862 O ALA A 120 17.013 11.285 5.032 1.00 0.00 O ATOM 1863 CB ALA A 120 14.893 9.790 2.810 1.00 0.00 C ATOM 0 H ALA A 120 15.505 9.491 5.619 1.00 0.00 H new ATOM 0 HA ALA A 120 16.816 8.888 3.057 1.00 0.00 H new ATOM 0 HB1 ALA A 120 15.157 10.292 1.879 1.00 0.00 H new ATOM 0 HB2 ALA A 120 14.410 8.839 2.585 1.00 0.00 H new ATOM 0 HB3 ALA A 120 14.209 10.418 3.380 1.00 0.00 H new ATOM 1869 N SER A 121 17.369 11.476 2.817 1.00 0.00 N ATOM 1870 CA SER A 121 18.094 12.735 2.931 1.00 0.00 C ATOM 1871 C SER A 121 17.225 13.806 3.585 1.00 0.00 C ATOM 1872 O SER A 121 16.012 13.850 3.375 1.00 0.00 O ATOM 1873 CB SER A 121 18.555 13.209 1.551 1.00 0.00 C ATOM 1874 OG SER A 121 19.239 14.447 1.639 1.00 0.00 O ATOM 0 H SER A 121 17.271 11.130 1.862 1.00 0.00 H new ATOM 0 HA SER A 121 18.968 12.567 3.561 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.209 12.460 1.105 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.693 13.312 0.892 1.00 0.00 H new ATOM 0 HG SER A 121 19.525 14.727 0.744 1.00 0.00 H new ATOM 1880 N SER A 122 17.853 14.666 4.377 1.00 0.00 N ATOM 1881 CA SER A 122 17.138 15.735 5.066 1.00 0.00 C ATOM 1882 C SER A 122 16.033 16.305 4.183 1.00 0.00 C ATOM 1883 O SER A 122 14.968 16.689 4.670 1.00 0.00 O ATOM 1884 CB SER A 122 18.107 16.847 5.472 1.00 0.00 C ATOM 1885 OG SER A 122 19.021 17.135 4.427 1.00 0.00 O ATOM 0 H SER A 122 18.856 14.645 4.559 1.00 0.00 H new ATOM 0 HA SER A 122 16.683 15.315 5.963 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.547 17.746 5.727 1.00 0.00 H new ATOM 0 HB3 SER A 122 18.654 16.548 6.366 1.00 0.00 H new ATOM 0 HG SER A 122 19.628 17.850 4.711 1.00 0.00 H new ATOM 1891 N LYS A 123 16.293 16.358 2.881 1.00 0.00 N ATOM 1892 CA LYS A 123 15.321 16.880 1.928 1.00 0.00 C ATOM 1893 C LYS A 123 14.366 15.783 1.468 1.00 0.00 C ATOM 1894 O LYS A 123 13.162 15.849 1.722 1.00 0.00 O ATOM 1895 CB LYS A 123 16.037 17.485 0.718 1.00 0.00 C ATOM 1896 CG LYS A 123 15.133 17.689 -0.485 1.00 0.00 C ATOM 1897 CD LYS A 123 14.174 18.849 -0.274 1.00 0.00 C ATOM 1898 CE LYS A 123 13.480 19.242 -1.568 1.00 0.00 C ATOM 1899 NZ LYS A 123 14.370 20.043 -2.454 1.00 0.00 N ATOM 0 H LYS A 123 17.169 16.046 2.462 1.00 0.00 H new ATOM 0 HA LYS A 123 14.742 17.657 2.427 1.00 0.00 H new ATOM 0 HB2 LYS A 123 16.469 18.444 1.004 1.00 0.00 H new ATOM 0 HB3 LYS A 123 16.865 16.835 0.434 1.00 0.00 H new ATOM 0 HG2 LYS A 123 15.741 17.875 -1.370 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.566 16.777 -0.674 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.428 18.574 0.471 1.00 0.00 H new ATOM 0 HD3 LYS A 123 14.719 19.706 0.122 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.157 18.344 -2.094 1.00 0.00 H new ATOM 0 HE3 LYS A 123 12.583 19.817 -1.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 13.849 20.320 -3.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 14.685 20.896 -1.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.198 19.473 -2.721 1.00 0.00 H new ATOM 1913 N ASP A 124 14.909 14.774 0.795 1.00 0.00 N ATOM 1914 CA ASP A 124 14.104 13.662 0.305 1.00 0.00 C ATOM 1915 C ASP A 124 13.055 13.254 1.334 1.00 0.00 C ATOM 1916 O ASP A 124 11.853 13.316 1.070 1.00 0.00 O ATOM 1917 CB ASP A 124 14.999 12.467 -0.031 1.00 0.00 C ATOM 1918 CG ASP A 124 15.563 12.543 -1.437 1.00 0.00 C ATOM 1919 OD1 ASP A 124 15.404 13.599 -2.083 1.00 0.00 O ATOM 1920 OD2 ASP A 124 16.163 11.546 -1.888 1.00 0.00 O ATOM 0 H ASP A 124 15.903 14.704 0.577 1.00 0.00 H new ATOM 0 HA ASP A 124 13.591 13.988 -0.599 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.820 12.419 0.685 1.00 0.00 H new ATOM 0 HB3 ASP A 124 14.427 11.546 0.078 1.00 0.00 H new ATOM 1925 N THR A 125 13.516 12.835 2.508 1.00 0.00 N ATOM 1926 CA THR A 125 12.618 12.415 3.576 1.00 0.00 C ATOM 1927 C THR A 125 11.352 13.262 3.595 1.00 0.00 C ATOM 1928 O THR A 125 10.267 12.768 3.898 1.00 0.00 O ATOM 1929 CB THR A 125 13.303 12.505 4.953 1.00 0.00 C ATOM 1930 OG1 THR A 125 14.310 11.493 5.066 1.00 0.00 O ATOM 1931 CG2 THR A 125 12.287 12.342 6.074 1.00 0.00 C ATOM 0 H THR A 125 14.507 12.778 2.743 1.00 0.00 H new ATOM 0 HA THR A 125 12.354 11.377 3.377 1.00 0.00 H new ATOM 0 HB THR A 125 13.764 13.489 5.041 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.893 10.644 5.321 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.794 12.409 7.037 1.00 0.00 H new ATOM 0 HG22 THR A 125 11.537 13.130 6.003 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.801 11.370 5.986 1.00 0.00 H new ATOM 1939 N GLY A 126 11.497 14.543 3.268 1.00 0.00 N ATOM 1940 CA GLY A 126 10.355 15.440 3.254 1.00 0.00 C ATOM 1941 C GLY A 126 9.437 15.189 2.074 1.00 0.00 C ATOM 1942 O GLY A 126 8.214 15.212 2.216 1.00 0.00 O ATOM 0 H GLY A 126 12.385 14.976 3.013 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.792 15.322 4.180 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.707 16.471 3.224 1.00 0.00 H new ATOM 1946 N GLN A 127 10.027 14.951 0.907 1.00 0.00 N ATOM 1947 CA GLN A 127 9.252 14.698 -0.302 1.00 0.00 C ATOM 1948 C GLN A 127 8.080 13.765 -0.012 1.00 0.00 C ATOM 1949 O GLN A 127 6.921 14.178 -0.046 1.00 0.00 O ATOM 1950 CB GLN A 127 10.144 14.094 -1.387 1.00 0.00 C ATOM 1951 CG GLN A 127 10.785 15.131 -2.295 1.00 0.00 C ATOM 1952 CD GLN A 127 12.133 14.687 -2.828 1.00 0.00 C ATOM 1953 OE1 GLN A 127 12.261 13.606 -3.403 1.00 0.00 O ATOM 1954 NE2 GLN A 127 13.148 15.523 -2.641 1.00 0.00 N ATOM 0 H GLN A 127 11.038 14.928 0.773 1.00 0.00 H new ATOM 0 HA GLN A 127 8.856 15.650 -0.656 1.00 0.00 H new ATOM 0 HB2 GLN A 127 10.928 13.503 -0.914 1.00 0.00 H new ATOM 0 HB3 GLN A 127 9.551 13.409 -1.993 1.00 0.00 H new ATOM 0 HG2 GLN A 127 10.118 15.338 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 127 10.905 16.065 -1.745 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.997 16.409 -2.159 1.00 0.00 H new ATOM 0 HE22 GLN A 127 14.079 15.279 -2.979 1.00 0.00 H new ATOM 1963 N LEU A 128 8.391 12.504 0.271 1.00 0.00 N ATOM 1964 CA LEU A 128 7.363 11.512 0.566 1.00 0.00 C ATOM 1965 C LEU A 128 6.436 12.000 1.675 1.00 0.00 C ATOM 1966 O LEU A 128 5.221 11.812 1.609 1.00 0.00 O ATOM 1967 CB LEU A 128 8.010 10.186 0.973 1.00 0.00 C ATOM 1968 CG LEU A 128 8.854 10.215 2.248 1.00 0.00 C ATOM 1969 CD1 LEU A 128 8.822 8.861 2.939 1.00 0.00 C ATOM 1970 CD2 LEU A 128 10.286 10.621 1.930 1.00 0.00 C ATOM 0 H LEU A 128 9.345 12.145 0.302 1.00 0.00 H new ATOM 0 HA LEU A 128 6.770 11.360 -0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.222 9.444 1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 128 8.640 9.845 0.152 1.00 0.00 H new ATOM 0 HG LEU A 128 8.430 10.956 2.926 1.00 0.00 H new ATOM 0 HD11 LEU A 128 9.428 8.900 3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 128 7.794 8.610 3.201 1.00 0.00 H new ATOM 0 HD13 LEU A 128 9.221 8.100 2.268 1.00 0.00 H new ATOM 0 HD21 LEU A 128 10.872 10.636 2.849 1.00 0.00 H new ATOM 0 HD22 LEU A 128 10.721 9.904 1.234 1.00 0.00 H new ATOM 0 HD23 LEU A 128 10.291 11.614 1.480 1.00 0.00 H new ATOM 1982 N TYR A 129 7.017 12.630 2.689 1.00 0.00 N ATOM 1983 CA TYR A 129 6.243 13.146 3.812 1.00 0.00 C ATOM 1984 C TYR A 129 5.119 14.055 3.326 1.00 0.00 C ATOM 1985 O TYR A 129 3.939 13.763 3.524 1.00 0.00 O ATOM 1986 CB TYR A 129 7.151 13.910 4.776 1.00 0.00 C ATOM 1987 CG TYR A 129 6.441 14.400 6.018 1.00 0.00 C ATOM 1988 CD1 TYR A 129 5.571 13.572 6.717 1.00 0.00 C ATOM 1989 CD2 TYR A 129 6.638 15.691 6.491 1.00 0.00 C ATOM 1990 CE1 TYR A 129 4.919 14.015 7.851 1.00 0.00 C ATOM 1991 CE2 TYR A 129 5.991 16.143 7.626 1.00 0.00 C ATOM 1992 CZ TYR A 129 5.133 15.301 8.302 1.00 0.00 C ATOM 1993 OH TYR A 129 4.485 15.747 9.432 1.00 0.00 O ATOM 0 H TYR A 129 8.021 12.796 2.757 1.00 0.00 H new ATOM 0 HA TYR A 129 5.800 12.299 4.335 1.00 0.00 H new ATOM 0 HB2 TYR A 129 7.978 13.264 5.071 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.584 14.764 4.255 1.00 0.00 H new ATOM 0 HD1 TYR A 129 5.402 12.564 6.367 1.00 0.00 H new ATOM 0 HD2 TYR A 129 7.308 16.353 5.963 1.00 0.00 H new ATOM 0 HE1 TYR A 129 4.245 13.358 8.382 1.00 0.00 H new ATOM 0 HE2 TYR A 129 6.156 17.149 7.981 1.00 0.00 H new ATOM 0 HH TYR A 129 4.746 16.674 9.615 1.00 0.00 H new ATOM 2003 N ALA A 130 5.493 15.161 2.690 1.00 0.00 N ATOM 2004 CA ALA A 130 4.518 16.112 2.173 1.00 0.00 C ATOM 2005 C ALA A 130 3.435 15.404 1.366 1.00 0.00 C ATOM 2006 O ALA A 130 2.354 15.952 1.144 1.00 0.00 O ATOM 2007 CB ALA A 130 5.209 17.167 1.321 1.00 0.00 C ATOM 0 H ALA A 130 6.465 15.420 2.521 1.00 0.00 H new ATOM 0 HA ALA A 130 4.041 16.602 3.022 1.00 0.00 H new ATOM 0 HB1 ALA A 130 4.468 17.871 0.941 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.941 17.702 1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 130 5.714 16.685 0.484 1.00 0.00 H new ATOM 2013 N ALA A 131 3.730 14.184 0.930 1.00 0.00 N ATOM 2014 CA ALA A 131 2.780 13.401 0.149 1.00 0.00 C ATOM 2015 C ALA A 131 1.870 12.580 1.055 1.00 0.00 C ATOM 2016 O ALA A 131 0.648 12.739 1.034 1.00 0.00 O ATOM 2017 CB ALA A 131 3.518 12.494 -0.825 1.00 0.00 C ATOM 0 H ALA A 131 4.619 13.716 1.104 1.00 0.00 H new ATOM 0 HA ALA A 131 2.156 14.092 -0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 131 2.796 11.915 -1.401 1.00 0.00 H new ATOM 0 HB2 ALA A 131 4.120 13.100 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA A 131 4.167 11.816 -0.271 1.00 0.00 H new ATOM 2023 N LEU A 132 2.471 11.701 1.849 1.00 0.00 N ATOM 2024 CA LEU A 132 1.714 10.852 2.763 1.00 0.00 C ATOM 2025 C LEU A 132 0.545 11.618 3.374 1.00 0.00 C ATOM 2026 O LEU A 132 -0.617 11.279 3.151 1.00 0.00 O ATOM 2027 CB LEU A 132 2.626 10.320 3.869 1.00 0.00 C ATOM 2028 CG LEU A 132 3.539 9.155 3.485 1.00 0.00 C ATOM 2029 CD1 LEU A 132 4.914 9.664 3.086 1.00 0.00 C ATOM 2030 CD2 LEU A 132 3.648 8.162 4.633 1.00 0.00 C ATOM 0 H LEU A 132 3.480 11.557 1.879 1.00 0.00 H new ATOM 0 HA LEU A 132 1.316 10.011 2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.248 11.141 4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.003 10.006 4.706 1.00 0.00 H new ATOM 0 HG LEU A 132 3.101 8.643 2.628 1.00 0.00 H new ATOM 0 HD11 LEU A 132 5.550 8.821 2.816 1.00 0.00 H new ATOM 0 HD12 LEU A 132 4.820 10.335 2.232 1.00 0.00 H new ATOM 0 HD13 LEU A 132 5.360 10.201 3.923 1.00 0.00 H new ATOM 0 HD21 LEU A 132 4.302 7.340 4.342 1.00 0.00 H new ATOM 0 HD22 LEU A 132 4.062 8.662 5.509 1.00 0.00 H new ATOM 0 HD23 LEU A 132 2.659 7.772 4.872 1.00 0.00 H new ATOM 2042 N HIS A 133 0.862 12.653 4.146 1.00 0.00 N ATOM 2043 CA HIS A 133 -0.162 13.469 4.787 1.00 0.00 C ATOM 2044 C HIS A 133 -1.399 13.585 3.901 1.00 0.00 C ATOM 2045 O HIS A 133 -2.478 13.112 4.258 1.00 0.00 O ATOM 2046 CB HIS A 133 0.387 14.861 5.102 1.00 0.00 C ATOM 2047 CG HIS A 133 -0.288 15.523 6.262 1.00 0.00 C ATOM 2048 ND1 HIS A 133 -0.641 16.857 6.266 1.00 0.00 N ATOM 2049 CD2 HIS A 133 -0.678 15.029 7.461 1.00 0.00 C ATOM 2050 CE1 HIS A 133 -1.217 17.154 7.417 1.00 0.00 C ATOM 2051 NE2 HIS A 133 -1.251 16.062 8.160 1.00 0.00 N ATOM 0 H HIS A 133 1.819 12.946 4.342 1.00 0.00 H new ATOM 0 HA HIS A 133 -0.449 12.981 5.718 1.00 0.00 H new ATOM 0 HB2 HIS A 133 1.454 14.783 5.310 1.00 0.00 H new ATOM 0 HB3 HIS A 133 0.279 15.493 4.221 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.560 14.012 7.804 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -1.596 18.124 7.702 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -1.640 15.997 9.101 1.00 0.00 H new ATOM 2059 N HIS A 134 -1.235 14.220 2.744 1.00 0.00 N ATOM 2060 CA HIS A 134 -2.338 14.399 1.807 1.00 0.00 C ATOM 2061 C HIS A 134 -3.096 13.091 1.604 1.00 0.00 C ATOM 2062 O HIS A 134 -4.295 13.010 1.870 1.00 0.00 O ATOM 2063 CB HIS A 134 -1.816 14.913 0.465 1.00 0.00 C ATOM 2064 CG HIS A 134 -2.899 15.357 -0.469 1.00 0.00 C ATOM 2065 ND1 HIS A 134 -3.498 16.596 -0.392 1.00 0.00 N ATOM 2066 CD2 HIS A 134 -3.490 14.719 -1.507 1.00 0.00 C ATOM 2067 CE1 HIS A 134 -4.412 16.701 -1.340 1.00 0.00 C ATOM 2068 NE2 HIS A 134 -4.427 15.575 -2.030 1.00 0.00 N ATOM 0 H HIS A 134 -0.349 14.619 2.434 1.00 0.00 H new ATOM 0 HA HIS A 134 -3.024 15.134 2.227 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -1.137 15.747 0.644 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -1.234 14.126 -0.015 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -3.266 13.722 -1.858 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -5.040 17.561 -1.520 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -5.036 15.374 -2.823 1.00 0.00 H new ATOM 2076 N ARG A 135 -2.389 12.069 1.131 1.00 0.00 N ATOM 2077 CA ARG A 135 -2.997 10.766 0.892 1.00 0.00 C ATOM 2078 C ARG A 135 -4.050 10.454 1.950 1.00 0.00 C ATOM 2079 O ARG A 135 -5.026 9.754 1.680 1.00 0.00 O ATOM 2080 CB ARG A 135 -1.925 9.674 0.887 1.00 0.00 C ATOM 2081 CG ARG A 135 -0.735 9.993 -0.004 1.00 0.00 C ATOM 2082 CD ARG A 135 0.177 8.787 -0.169 1.00 0.00 C ATOM 2083 NE ARG A 135 0.571 8.220 1.118 1.00 0.00 N ATOM 2084 CZ ARG A 135 1.480 7.259 1.250 1.00 0.00 C ATOM 2085 NH1 ARG A 135 2.084 6.762 0.179 1.00 0.00 N ATOM 2086 NH2 ARG A 135 1.786 6.795 2.455 1.00 0.00 N ATOM 0 H ARG A 135 -1.395 12.119 0.906 1.00 0.00 H new ATOM 0 HA ARG A 135 -3.484 10.794 -0.083 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -1.573 9.517 1.907 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -2.374 8.737 0.557 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -1.089 10.320 -0.982 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -0.171 10.822 0.424 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -0.332 8.026 -0.760 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.068 9.079 -0.725 1.00 0.00 H new ATOM 0 HE ARG A 135 0.125 8.581 1.961 1.00 0.00 H new ATOM 0 HH11 ARG A 135 1.851 7.117 -0.748 1.00 0.00 H new ATOM 0 HH12 ARG A 135 2.781 6.025 0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 135 1.324 7.176 3.281 1.00 0.00 H new ATOM 0 HH22 ARG A 135 2.484 6.058 2.556 1.00 0.00 H new ATOM 2100 N ILE A 136 -3.846 10.979 3.154 1.00 0.00 N ATOM 2101 CA ILE A 136 -4.780 10.756 4.251 1.00 0.00 C ATOM 2102 C ILE A 136 -5.796 11.889 4.346 1.00 0.00 C ATOM 2103 O ILE A 136 -6.997 11.650 4.472 1.00 0.00 O ATOM 2104 CB ILE A 136 -4.043 10.628 5.598 1.00 0.00 C ATOM 2105 CG1 ILE A 136 -3.139 9.393 5.594 1.00 0.00 C ATOM 2106 CG2 ILE A 136 -5.043 10.555 6.743 1.00 0.00 C ATOM 2107 CD1 ILE A 136 -1.867 9.579 4.797 1.00 0.00 C ATOM 0 H ILE A 136 -3.043 11.561 3.394 1.00 0.00 H new ATOM 0 HA ILE A 136 -5.300 9.822 4.039 1.00 0.00 H new ATOM 0 HB ILE A 136 -3.420 11.511 5.740 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -2.880 9.138 6.622 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -3.694 8.548 5.186 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -4.508 10.465 7.688 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -5.650 11.460 6.754 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -5.689 9.687 6.607 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -1.275 8.665 4.838 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -2.117 9.803 3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.291 10.403 5.218 1.00 0.00 H new ATOM 2119 N LEU A 137 -5.307 13.122 4.284 1.00 0.00 N ATOM 2120 CA LEU A 137 -6.173 14.294 4.361 1.00 0.00 C ATOM 2121 C LEU A 137 -7.325 14.186 3.368 1.00 0.00 C ATOM 2122 O LEU A 137 -8.431 14.659 3.631 1.00 0.00 O ATOM 2123 CB LEU A 137 -5.368 15.567 4.088 1.00 0.00 C ATOM 2124 CG LEU A 137 -4.082 15.734 4.898 1.00 0.00 C ATOM 2125 CD1 LEU A 137 -3.067 16.561 4.124 1.00 0.00 C ATOM 2126 CD2 LEU A 137 -4.380 16.377 6.245 1.00 0.00 C ATOM 0 H LEU A 137 -4.315 13.337 4.181 1.00 0.00 H new ATOM 0 HA LEU A 137 -6.588 14.342 5.368 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -5.112 15.591 3.029 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.009 16.427 4.281 1.00 0.00 H new ATOM 0 HG LEU A 137 -3.656 14.746 5.075 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -2.158 16.669 4.716 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -2.831 16.061 3.185 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.484 17.546 3.915 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -3.453 16.488 6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -4.829 17.358 6.089 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -5.071 15.746 6.804 1.00 0.00 H new ATOM 2138 N ALA A 138 -7.060 13.556 2.228 1.00 0.00 N ATOM 2139 CA ALA A 138 -8.077 13.381 1.199 1.00 0.00 C ATOM 2140 C ALA A 138 -9.155 12.402 1.652 1.00 0.00 C ATOM 2141 O ALA A 138 -10.290 12.449 1.175 1.00 0.00 O ATOM 2142 CB ALA A 138 -7.438 12.903 -0.097 1.00 0.00 C ATOM 0 H ALA A 138 -6.150 13.159 1.994 1.00 0.00 H new ATOM 0 HA ALA A 138 -8.552 14.347 1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.209 12.776 -0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -6.710 13.640 -0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -6.937 11.950 0.074 1.00 0.00 H new ATOM 2148 N LEU A 139 -8.793 11.517 2.573 1.00 0.00 N ATOM 2149 CA LEU A 139 -9.730 10.525 3.091 1.00 0.00 C ATOM 2150 C LEU A 139 -10.469 11.061 4.314 1.00 0.00 C ATOM 2151 O LEU A 139 -11.700 11.091 4.343 1.00 0.00 O ATOM 2152 CB LEU A 139 -8.991 9.236 3.452 1.00 0.00 C ATOM 2153 CG LEU A 139 -7.784 8.888 2.580 1.00 0.00 C ATOM 2154 CD1 LEU A 139 -7.228 7.523 2.958 1.00 0.00 C ATOM 2155 CD2 LEU A 139 -8.164 8.921 1.106 1.00 0.00 C ATOM 0 H LEU A 139 -7.858 11.465 2.977 1.00 0.00 H new ATOM 0 HA LEU A 139 -10.462 10.311 2.312 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.657 9.310 4.487 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -9.699 8.409 3.404 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.008 9.634 2.752 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.370 7.292 2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.918 7.533 4.003 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.998 6.764 2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.293 8.671 0.500 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.957 8.197 0.918 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -8.515 9.919 0.843 1.00 0.00 H new ATOM 2167 N ARG A 140 -9.710 11.484 5.319 1.00 0.00 N ATOM 2168 CA ARG A 140 -10.293 12.020 6.543 1.00 0.00 C ATOM 2169 C ARG A 140 -11.196 13.212 6.240 1.00 0.00 C ATOM 2170 O ARG A 140 -12.040 13.586 7.053 1.00 0.00 O ATOM 2171 CB ARG A 140 -9.190 12.437 7.518 1.00 0.00 C ATOM 2172 CG ARG A 140 -8.016 13.132 6.848 1.00 0.00 C ATOM 2173 CD ARG A 140 -7.287 14.051 7.816 1.00 0.00 C ATOM 2174 NE ARG A 140 -6.243 13.348 8.557 1.00 0.00 N ATOM 2175 CZ ARG A 140 -5.552 13.895 9.551 1.00 0.00 C ATOM 2176 NH1 ARG A 140 -5.793 15.146 9.921 1.00 0.00 N ATOM 2177 NH2 ARG A 140 -4.617 13.192 10.177 1.00 0.00 N ATOM 0 H ARG A 140 -8.690 11.466 5.310 1.00 0.00 H new ATOM 0 HA ARG A 140 -10.897 11.237 7.001 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -9.614 13.102 8.270 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -8.827 11.553 8.042 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -7.322 12.386 6.461 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -8.372 13.709 5.995 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -6.844 14.880 7.265 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -8.003 14.480 8.517 1.00 0.00 H new ATOM 0 HE ARG A 140 -6.033 12.384 8.297 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -6.510 15.690 9.442 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -5.261 15.563 10.685 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -4.428 12.230 9.895 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -4.087 13.613 10.940 1.00 0.00 H new ATOM 2191 N SER A 141 -11.011 13.804 5.064 1.00 0.00 N ATOM 2192 CA SER A 141 -11.805 14.956 4.655 1.00 0.00 C ATOM 2193 C SER A 141 -13.210 14.528 4.242 1.00 0.00 C ATOM 2194 O SER A 141 -14.182 15.246 4.474 1.00 0.00 O ATOM 2195 CB SER A 141 -11.122 15.688 3.498 1.00 0.00 C ATOM 2196 OG SER A 141 -11.878 16.815 3.091 1.00 0.00 O ATOM 0 H SER A 141 -10.318 13.504 4.378 1.00 0.00 H new ATOM 0 HA SER A 141 -11.885 15.632 5.506 1.00 0.00 H new ATOM 0 HB2 SER A 141 -10.125 16.006 3.803 1.00 0.00 H new ATOM 0 HB3 SER A 141 -10.996 15.007 2.656 1.00 0.00 H new ATOM 0 HG SER A 141 -11.420 17.267 2.352 1.00 0.00 H new ATOM 2202 N ARG A 142 -13.307 13.354 3.629 1.00 0.00 N ATOM 2203 CA ARG A 142 -14.592 12.829 3.182 1.00 0.00 C ATOM 2204 C ARG A 142 -15.433 12.366 4.369 1.00 0.00 C ATOM 2205 O ARG A 142 -16.592 12.756 4.511 1.00 0.00 O ATOM 2206 CB ARG A 142 -14.383 11.668 2.209 1.00 0.00 C ATOM 2207 CG ARG A 142 -13.193 11.857 1.281 1.00 0.00 C ATOM 2208 CD ARG A 142 -13.183 10.820 0.169 1.00 0.00 C ATOM 2209 NE ARG A 142 -14.386 10.891 -0.656 1.00 0.00 N ATOM 2210 CZ ARG A 142 -15.509 10.238 -0.375 1.00 0.00 C ATOM 2211 NH1 ARG A 142 -15.581 9.469 0.702 1.00 0.00 N ATOM 2212 NH2 ARG A 142 -16.562 10.354 -1.174 1.00 0.00 N ATOM 0 H ARG A 142 -12.511 12.748 3.430 1.00 0.00 H new ATOM 0 HA ARG A 142 -15.125 13.631 2.671 1.00 0.00 H new ATOM 0 HB2 ARG A 142 -14.247 10.748 2.778 1.00 0.00 H new ATOM 0 HB3 ARG A 142 -15.284 11.541 1.609 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -13.224 12.857 0.847 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -12.269 11.786 1.854 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -12.304 10.969 -0.458 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -13.099 9.824 0.603 1.00 0.00 H new ATOM 0 HE ARG A 142 -14.363 11.473 -1.493 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -14.773 9.377 1.318 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -16.444 8.969 0.915 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -16.510 10.944 -2.004 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -17.424 9.853 -0.958 1.00 0.00 H new