USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 986 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -159:sc= -3.35! (180deg=-5.01!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.0041 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot -40:sc= 0.887 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 164:sc= -1.32 (180deg=-2.14) USER MOD Single : A 75 SER OG : rot 180:sc= -1.71 USER MOD Single : A 76 LYS NZ :NH3+ -117:sc= 0 (180deg=-0.0132) USER MOD Single : A 79 ASN : amide:sc= 0.636 K(o=0.64,f=-0.44) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -117:sc= -0.996 (180deg=-4.44!) USER MOD Single : A 93 ASN :FLIP amide:sc= -0.0579 F(o=-0.99,f=-0.058) USER MOD Single : A 96 ASN :FLIP amide:sc= -0.0196 F(o=-1,f=-0.02) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -161:sc= -3.49! (180deg=-5.1!) USER MOD Single : B 58 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 THR OG1 : rot -42:sc= 0.87 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 LYS NZ :NH3+ 164:sc= -1.21 (180deg=-1.9) USER MOD Single : B 75 SER OG : rot 180:sc= -1.8 USER MOD Single : B 76 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.00938) USER MOD Single : B 79 ASN : amide:sc= 0.693 K(o=0.69,f=-0.46) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 MET CE :methyl -111:sc= -1.13 (180deg=-4.03!) USER MOD Single : B 93 ASN :FLIP amide:sc= -0.0181 F(o=-1.5!,f=-0.018) USER MOD Single : B 96 ASN :FLIP amide:sc= -0.0394 F(o=-1,f=-0.039) USER MOD ----------------------------------------------------------------- ATOM 357 N PRO A 43 -2.107 -17.849 -8.108 1.00 0.29 N ATOM 358 CA PRO A 43 -1.529 -17.337 -6.854 1.00 0.29 C ATOM 359 C PRO A 43 -2.367 -16.175 -6.307 1.00 0.27 C ATOM 360 O PRO A 43 -2.755 -16.169 -5.154 1.00 0.30 O ATOM 361 CB PRO A 43 -0.159 -16.837 -7.291 1.00 0.32 C ATOM 362 CG PRO A 43 -0.299 -16.496 -8.743 1.00 0.33 C ATOM 363 CD PRO A 43 -1.551 -17.156 -9.272 1.00 0.33 C ATOM 0 HA PRO A 43 -1.489 -18.085 -6.062 1.00 0.29 H new ATOM 0 HB2 PRO A 43 0.143 -15.965 -6.711 1.00 0.32 H new ATOM 0 HB3 PRO A 43 0.604 -17.601 -7.139 1.00 0.32 H new ATOM 0 HG2 PRO A 43 -0.356 -15.415 -8.875 1.00 0.33 H new ATOM 0 HG3 PRO A 43 0.574 -16.839 -9.299 1.00 0.33 H new ATOM 0 HD2 PRO A 43 -2.251 -16.422 -9.671 1.00 0.33 H new ATOM 0 HD3 PRO A 43 -1.324 -17.852 -10.080 1.00 0.33 H new ATOM 371 N LEU A 44 -2.627 -15.182 -7.126 1.00 0.27 N ATOM 372 CA LEU A 44 -3.413 -13.995 -6.669 1.00 0.30 C ATOM 373 C LEU A 44 -2.705 -13.342 -5.482 1.00 0.28 C ATOM 374 O LEU A 44 -3.328 -12.781 -4.600 1.00 0.38 O ATOM 375 CB LEU A 44 -4.788 -14.522 -6.256 1.00 0.37 C ATOM 376 CG LEU A 44 -5.772 -13.350 -6.200 1.00 0.43 C ATOM 377 CD1 LEU A 44 -7.045 -13.712 -6.962 1.00 0.81 C ATOM 378 CD2 LEU A 44 -6.123 -13.034 -4.742 1.00 0.71 C ATOM 0 H LEU A 44 -2.325 -15.145 -8.099 1.00 0.27 H new ATOM 0 HA LEU A 44 -3.508 -13.243 -7.452 1.00 0.30 H new ATOM 0 HB2 LEU A 44 -5.134 -15.271 -6.968 1.00 0.37 H new ATOM 0 HB3 LEU A 44 -4.728 -15.011 -5.283 1.00 0.37 H new ATOM 0 HG LEU A 44 -5.310 -12.475 -6.657 1.00 0.43 H new ATOM 0 HD11 LEU A 44 -7.744 -12.876 -6.921 1.00 0.81 H new ATOM 0 HD12 LEU A 44 -6.798 -13.927 -8.002 1.00 0.81 H new ATOM 0 HD13 LEU A 44 -7.503 -14.591 -6.508 1.00 0.81 H new ATOM 0 HD21 LEU A 44 -6.823 -12.199 -4.709 1.00 0.71 H new ATOM 0 HD22 LEU A 44 -6.580 -13.909 -4.280 1.00 0.71 H new ATOM 0 HD23 LEU A 44 -5.216 -12.768 -4.199 1.00 0.71 H new ATOM 390 N LYS A 45 -1.403 -13.415 -5.464 1.00 0.26 N ATOM 391 CA LYS A 45 -0.625 -12.807 -4.346 1.00 0.28 C ATOM 392 C LYS A 45 0.137 -11.589 -4.859 1.00 0.28 C ATOM 393 O LYS A 45 0.384 -10.657 -4.131 1.00 0.33 O ATOM 394 CB LYS A 45 0.364 -13.887 -3.880 1.00 0.32 C ATOM 395 CG LYS A 45 -0.184 -15.286 -4.185 1.00 0.30 C ATOM 396 CD LYS A 45 0.772 -16.341 -3.623 1.00 0.32 C ATOM 397 CE LYS A 45 0.588 -16.439 -2.107 1.00 0.31 C ATOM 398 NZ LYS A 45 1.846 -17.062 -1.607 1.00 0.30 N ATOM 0 H LYS A 45 -0.840 -13.873 -6.181 1.00 0.26 H new ATOM 0 HA LYS A 45 -1.272 -12.482 -3.531 1.00 0.28 H new ATOM 0 HB2 LYS A 45 1.323 -13.749 -4.379 1.00 0.32 H new ATOM 0 HB3 LYS A 45 0.544 -13.786 -2.810 1.00 0.32 H new ATOM 0 HG2 LYS A 45 -1.174 -15.405 -3.744 1.00 0.30 H new ATOM 0 HG3 LYS A 45 -0.296 -15.418 -5.261 1.00 0.30 H new ATOM 0 HD2 LYS A 45 0.577 -17.308 -4.087 1.00 0.32 H new ATOM 0 HD3 LYS A 45 1.803 -16.076 -3.859 1.00 0.32 H new ATOM 0 HE2 LYS A 45 0.431 -15.456 -1.664 1.00 0.31 H new ATOM 0 HE3 LYS A 45 -0.281 -17.046 -1.853 1.00 0.31 H new ATOM 0 HZ1 LYS A 45 1.796 -17.163 -0.573 1.00 0.30 H new ATOM 0 HZ2 LYS A 45 1.965 -18.000 -2.041 1.00 0.30 H new ATOM 0 HZ3 LYS A 45 2.655 -16.459 -1.858 1.00 0.30 H new ATOM 412 N LEU A 46 0.513 -11.602 -6.111 1.00 0.28 N ATOM 413 CA LEU A 46 1.268 -10.450 -6.693 1.00 0.29 C ATOM 414 C LEU A 46 0.541 -9.123 -6.421 1.00 0.30 C ATOM 415 O LEU A 46 1.163 -8.084 -6.272 1.00 0.35 O ATOM 416 CB LEU A 46 1.314 -10.744 -8.195 1.00 0.31 C ATOM 417 CG LEU A 46 2.692 -11.291 -8.565 1.00 0.37 C ATOM 418 CD1 LEU A 46 2.711 -12.807 -8.356 1.00 0.41 C ATOM 419 CD2 LEU A 46 2.988 -10.974 -10.032 1.00 0.44 C ATOM 0 H LEU A 46 0.329 -12.366 -6.761 1.00 0.28 H new ATOM 0 HA LEU A 46 2.262 -10.346 -6.258 1.00 0.29 H new ATOM 0 HB2 LEU A 46 0.541 -11.466 -8.459 1.00 0.31 H new ATOM 0 HB3 LEU A 46 1.108 -9.835 -8.761 1.00 0.31 H new ATOM 0 HG LEU A 46 3.450 -10.828 -7.933 1.00 0.37 H new ATOM 0 HD11 LEU A 46 3.694 -13.198 -8.620 1.00 0.41 H new ATOM 0 HD12 LEU A 46 2.499 -13.033 -7.311 1.00 0.41 H new ATOM 0 HD13 LEU A 46 1.954 -13.271 -8.988 1.00 0.41 H new ATOM 0 HD21 LEU A 46 3.971 -11.364 -10.297 1.00 0.44 H new ATOM 0 HD22 LEU A 46 2.231 -11.438 -10.664 1.00 0.44 H new ATOM 0 HD23 LEU A 46 2.973 -9.894 -10.181 1.00 0.44 H new ATOM 431 N PHE A 47 -0.766 -9.158 -6.340 1.00 0.31 N ATOM 432 CA PHE A 47 -1.541 -7.910 -6.070 1.00 0.33 C ATOM 433 C PHE A 47 -1.501 -7.603 -4.575 1.00 0.32 C ATOM 434 O PHE A 47 -1.325 -6.471 -4.164 1.00 0.37 O ATOM 435 CB PHE A 47 -2.970 -8.232 -6.535 1.00 0.37 C ATOM 436 CG PHE A 47 -3.966 -7.275 -5.913 1.00 0.36 C ATOM 437 CD1 PHE A 47 -3.685 -5.904 -5.843 1.00 0.43 C ATOM 438 CD2 PHE A 47 -5.177 -7.765 -5.410 1.00 0.42 C ATOM 439 CE1 PHE A 47 -4.615 -5.027 -5.269 1.00 0.53 C ATOM 440 CE2 PHE A 47 -6.106 -6.889 -4.837 1.00 0.50 C ATOM 441 CZ PHE A 47 -5.825 -5.520 -4.766 1.00 0.55 C ATOM 0 H PHE A 47 -1.330 -10.000 -6.450 1.00 0.31 H new ATOM 0 HA PHE A 47 -1.142 -7.035 -6.584 1.00 0.33 H new ATOM 0 HB2 PHE A 47 -3.027 -8.168 -7.622 1.00 0.37 H new ATOM 0 HB3 PHE A 47 -3.224 -9.256 -6.262 1.00 0.37 H new ATOM 0 HD1 PHE A 47 -2.752 -5.523 -6.231 1.00 0.43 H new ATOM 0 HD2 PHE A 47 -5.395 -8.821 -5.464 1.00 0.42 H new ATOM 0 HE1 PHE A 47 -4.398 -3.970 -5.215 1.00 0.53 H new ATOM 0 HE2 PHE A 47 -7.040 -7.270 -4.450 1.00 0.50 H new ATOM 0 HZ PHE A 47 -6.541 -4.844 -4.323 1.00 0.55 H new ATOM 451 N MET A 48 -1.660 -8.613 -3.767 1.00 0.33 N ATOM 452 CA MET A 48 -1.632 -8.413 -2.294 1.00 0.38 C ATOM 453 C MET A 48 -0.215 -8.061 -1.843 1.00 0.39 C ATOM 454 O MET A 48 -0.012 -7.173 -1.041 1.00 0.47 O ATOM 455 CB MET A 48 -2.066 -9.757 -1.709 1.00 0.45 C ATOM 456 CG MET A 48 -3.153 -9.528 -0.663 1.00 0.55 C ATOM 457 SD MET A 48 -4.745 -10.126 -1.283 1.00 0.60 S ATOM 458 CE MET A 48 -4.800 -9.103 -2.773 1.00 0.54 C ATOM 0 H MET A 48 -1.809 -9.576 -4.068 1.00 0.33 H new ATOM 0 HA MET A 48 -2.281 -7.599 -1.969 1.00 0.38 H new ATOM 0 HB2 MET A 48 -2.439 -10.407 -2.500 1.00 0.45 H new ATOM 0 HB3 MET A 48 -1.212 -10.262 -1.257 1.00 0.45 H new ATOM 0 HG2 MET A 48 -2.895 -10.046 0.261 1.00 0.55 H new ATOM 0 HG3 MET A 48 -3.222 -8.467 -0.424 1.00 0.55 H new ATOM 0 HE1 MET A 48 -5.830 -9.018 -3.118 1.00 0.54 H new ATOM 0 HE2 MET A 48 -4.410 -8.110 -2.548 1.00 0.54 H new ATOM 0 HE3 MET A 48 -4.193 -9.563 -3.553 1.00 0.54 H new ATOM 468 N ALA A 49 0.760 -8.757 -2.361 1.00 0.37 N ATOM 469 CA ALA A 49 2.178 -8.489 -1.984 1.00 0.43 C ATOM 470 C ALA A 49 2.575 -7.069 -2.388 1.00 0.42 C ATOM 471 O ALA A 49 3.155 -6.339 -1.607 1.00 0.47 O ATOM 472 CB ALA A 49 2.998 -9.516 -2.765 1.00 0.50 C ATOM 0 H ALA A 49 0.633 -9.509 -3.038 1.00 0.37 H new ATOM 0 HA ALA A 49 2.340 -8.570 -0.909 1.00 0.43 H new ATOM 0 HB1 ALA A 49 4.056 -9.383 -2.541 1.00 0.50 H new ATOM 0 HB2 ALA A 49 2.690 -10.522 -2.479 1.00 0.50 H new ATOM 0 HB3 ALA A 49 2.833 -9.376 -3.833 1.00 0.50 H new ATOM 478 N LEU A 50 2.272 -6.670 -3.600 1.00 0.42 N ATOM 479 CA LEU A 50 2.642 -5.291 -4.038 1.00 0.46 C ATOM 480 C LEU A 50 1.982 -4.251 -3.127 1.00 0.42 C ATOM 481 O LEU A 50 2.650 -3.415 -2.540 1.00 0.45 O ATOM 482 CB LEU A 50 2.120 -5.167 -5.470 1.00 0.55 C ATOM 483 CG LEU A 50 2.811 -3.992 -6.163 1.00 0.83 C ATOM 484 CD1 LEU A 50 4.317 -4.257 -6.247 1.00 1.20 C ATOM 485 CD2 LEU A 50 2.243 -3.830 -7.574 1.00 1.14 C ATOM 0 H LEU A 50 1.789 -7.235 -4.298 1.00 0.42 H new ATOM 0 HA LEU A 50 3.717 -5.119 -3.987 1.00 0.46 H new ATOM 0 HB2 LEU A 50 2.309 -6.089 -6.019 1.00 0.55 H new ATOM 0 HB3 LEU A 50 1.041 -5.016 -5.463 1.00 0.55 H new ATOM 0 HG LEU A 50 2.636 -3.081 -5.591 1.00 0.83 H new ATOM 0 HD11 LEU A 50 4.807 -3.418 -6.741 1.00 1.20 H new ATOM 0 HD12 LEU A 50 4.723 -4.373 -5.242 1.00 1.20 H new ATOM 0 HD13 LEU A 50 4.495 -5.169 -6.818 1.00 1.20 H new ATOM 0 HD21 LEU A 50 2.734 -2.993 -8.070 1.00 1.14 H new ATOM 0 HD22 LEU A 50 2.418 -4.743 -8.144 1.00 1.14 H new ATOM 0 HD23 LEU A 50 1.171 -3.639 -7.515 1.00 1.14 H new ATOM 497 N VAL A 51 0.679 -4.300 -2.995 1.00 0.42 N ATOM 498 CA VAL A 51 -0.019 -3.324 -2.118 1.00 0.42 C ATOM 499 C VAL A 51 0.438 -3.515 -0.669 1.00 0.38 C ATOM 500 O VAL A 51 0.514 -2.570 0.090 1.00 0.42 O ATOM 501 CB VAL A 51 -1.508 -3.639 -2.277 1.00 0.45 C ATOM 502 CG1 VAL A 51 -2.321 -2.704 -1.392 1.00 0.58 C ATOM 503 CG2 VAL A 51 -1.918 -3.438 -3.738 1.00 0.59 C ATOM 0 H VAL A 51 0.073 -4.976 -3.459 1.00 0.42 H new ATOM 0 HA VAL A 51 0.196 -2.289 -2.383 1.00 0.42 H new ATOM 0 HB VAL A 51 -1.694 -4.672 -1.984 1.00 0.45 H new ATOM 0 HG11 VAL A 51 -3.382 -2.927 -1.504 1.00 0.58 H new ATOM 0 HG12 VAL A 51 -2.029 -2.843 -0.351 1.00 0.58 H new ATOM 0 HG13 VAL A 51 -2.135 -1.671 -1.686 1.00 0.58 H new ATOM 0 HG21 VAL A 51 -2.979 -3.662 -3.852 1.00 0.59 H new ATOM 0 HG22 VAL A 51 -1.732 -2.404 -4.029 1.00 0.59 H new ATOM 0 HG23 VAL A 51 -1.336 -4.104 -4.374 1.00 0.59 H new ATOM 513 N ALA A 52 0.757 -4.729 -0.287 1.00 0.34 N ATOM 514 CA ALA A 52 1.226 -4.977 1.111 1.00 0.35 C ATOM 515 C ALA A 52 2.550 -4.256 1.334 1.00 0.35 C ATOM 516 O ALA A 52 2.702 -3.501 2.276 1.00 0.37 O ATOM 517 CB ALA A 52 1.416 -6.490 1.223 1.00 0.38 C ATOM 0 H ALA A 52 0.713 -5.556 -0.882 1.00 0.34 H new ATOM 0 HA ALA A 52 0.519 -4.612 1.856 1.00 0.35 H new ATOM 0 HB1 ALA A 52 1.760 -6.740 2.227 1.00 0.38 H new ATOM 0 HB2 ALA A 52 0.468 -6.991 1.029 1.00 0.38 H new ATOM 0 HB3 ALA A 52 2.156 -6.819 0.493 1.00 0.38 H new ATOM 523 N PHE A 53 3.502 -4.470 0.456 1.00 0.38 N ATOM 524 CA PHE A 53 4.823 -3.783 0.583 1.00 0.43 C ATOM 525 C PHE A 53 4.583 -2.287 0.800 1.00 0.41 C ATOM 526 O PHE A 53 5.020 -1.699 1.780 1.00 0.42 O ATOM 527 CB PHE A 53 5.516 -4.036 -0.759 1.00 0.51 C ATOM 528 CG PHE A 53 6.822 -3.287 -0.807 1.00 0.59 C ATOM 529 CD1 PHE A 53 7.814 -3.552 0.142 1.00 0.70 C ATOM 530 CD2 PHE A 53 7.038 -2.324 -1.798 1.00 0.80 C ATOM 531 CE1 PHE A 53 9.024 -2.854 0.100 1.00 0.79 C ATOM 532 CE2 PHE A 53 8.246 -1.624 -1.841 1.00 0.91 C ATOM 533 CZ PHE A 53 9.240 -1.888 -0.892 1.00 0.82 C ATOM 0 H PHE A 53 3.418 -5.094 -0.346 1.00 0.38 H new ATOM 0 HA PHE A 53 5.423 -4.143 1.419 1.00 0.43 H new ATOM 0 HB2 PHE A 53 5.693 -5.103 -0.892 1.00 0.51 H new ATOM 0 HB3 PHE A 53 4.872 -3.715 -1.578 1.00 0.51 H new ATOM 0 HD1 PHE A 53 7.645 -4.296 0.907 1.00 0.70 H new ATOM 0 HD2 PHE A 53 6.270 -2.122 -2.530 1.00 0.80 H new ATOM 0 HE1 PHE A 53 9.792 -3.059 0.831 1.00 0.79 H new ATOM 0 HE2 PHE A 53 8.413 -0.880 -2.606 1.00 0.91 H new ATOM 0 HZ PHE A 53 10.174 -1.347 -0.924 1.00 0.82 H new ATOM 543 N LEU A 54 3.850 -1.679 -0.092 1.00 0.43 N ATOM 544 CA LEU A 54 3.537 -0.236 0.067 1.00 0.47 C ATOM 545 C LEU A 54 2.770 -0.039 1.377 1.00 0.41 C ATOM 546 O LEU A 54 2.952 0.940 2.071 1.00 0.42 O ATOM 547 CB LEU A 54 2.670 0.117 -1.145 1.00 0.53 C ATOM 548 CG LEU A 54 3.549 0.697 -2.259 1.00 0.62 C ATOM 549 CD1 LEU A 54 4.249 1.967 -1.764 1.00 0.66 C ATOM 550 CD2 LEU A 54 4.599 -0.340 -2.672 1.00 0.74 C ATOM 0 H LEU A 54 3.456 -2.121 -0.922 1.00 0.43 H new ATOM 0 HA LEU A 54 4.423 0.398 0.111 1.00 0.47 H new ATOM 0 HB2 LEU A 54 2.151 -0.772 -1.504 1.00 0.53 H new ATOM 0 HB3 LEU A 54 1.905 0.839 -0.859 1.00 0.53 H new ATOM 0 HG LEU A 54 2.924 0.946 -3.117 1.00 0.62 H new ATOM 0 HD11 LEU A 54 4.872 2.373 -2.561 1.00 0.66 H new ATOM 0 HD12 LEU A 54 3.501 2.706 -1.475 1.00 0.66 H new ATOM 0 HD13 LEU A 54 4.873 1.727 -0.903 1.00 0.66 H new ATOM 0 HD21 LEU A 54 5.225 0.071 -3.464 1.00 0.74 H new ATOM 0 HD22 LEU A 54 5.220 -0.591 -1.812 1.00 0.74 H new ATOM 0 HD23 LEU A 54 4.100 -1.239 -3.034 1.00 0.74 H new ATOM 562 N ARG A 55 1.932 -0.987 1.727 1.00 0.40 N ATOM 563 CA ARG A 55 1.158 -0.887 3.003 1.00 0.38 C ATOM 564 C ARG A 55 2.068 -1.159 4.207 1.00 0.34 C ATOM 565 O ARG A 55 1.652 -1.047 5.345 1.00 0.37 O ATOM 566 CB ARG A 55 0.070 -1.959 2.902 1.00 0.41 C ATOM 567 CG ARG A 55 -0.922 -1.796 4.057 1.00 0.40 C ATOM 568 CD ARG A 55 -0.690 -2.894 5.097 1.00 0.45 C ATOM 569 NE ARG A 55 -1.442 -2.445 6.300 1.00 0.37 N ATOM 570 CZ ARG A 55 -0.832 -2.334 7.448 1.00 0.39 C ATOM 571 NH1 ARG A 55 0.210 -1.556 7.559 1.00 0.42 N ATOM 572 NH2 ARG A 55 -1.261 -3.002 8.483 1.00 0.46 N ATOM 0 H ARG A 55 1.751 -1.829 1.180 1.00 0.40 H new ATOM 0 HA ARG A 55 0.736 0.108 3.144 1.00 0.38 H new ATOM 0 HB2 ARG A 55 -0.450 -1.874 1.948 1.00 0.41 H new ATOM 0 HB3 ARG A 55 0.520 -2.952 2.933 1.00 0.41 H new ATOM 0 HG2 ARG A 55 -0.801 -0.815 4.517 1.00 0.40 H new ATOM 0 HG3 ARG A 55 -1.944 -1.848 3.681 1.00 0.40 H new ATOM 0 HD2 ARG A 55 -1.053 -3.858 4.741 1.00 0.45 H new ATOM 0 HD3 ARG A 55 0.371 -3.013 5.316 1.00 0.45 H new ATOM 0 HE ARG A 55 -2.435 -2.224 6.227 1.00 0.37 H new ATOM 0 HH11 ARG A 55 0.547 -1.036 6.749 1.00 0.42 H new ATOM 0 HH12 ARG A 55 0.688 -1.468 8.456 1.00 0.42 H new ATOM 0 HH21 ARG A 55 -2.074 -3.612 8.395 1.00 0.46 H new ATOM 0 HH22 ARG A 55 -0.783 -2.915 9.380 1.00 0.46 H new ATOM 586 N PHE A 56 3.304 -1.518 3.969 1.00 0.33 N ATOM 587 CA PHE A 56 4.233 -1.793 5.102 1.00 0.32 C ATOM 588 C PHE A 56 5.162 -0.599 5.332 1.00 0.32 C ATOM 589 O PHE A 56 5.699 -0.428 6.411 1.00 0.34 O ATOM 590 CB PHE A 56 5.052 -3.012 4.668 1.00 0.35 C ATOM 591 CG PHE A 56 4.193 -4.263 4.611 1.00 0.39 C ATOM 592 CD1 PHE A 56 2.841 -4.242 4.998 1.00 0.52 C ATOM 593 CD2 PHE A 56 4.768 -5.459 4.165 1.00 0.52 C ATOM 594 CE1 PHE A 56 2.077 -5.413 4.935 1.00 0.63 C ATOM 595 CE2 PHE A 56 4.002 -6.629 4.103 1.00 0.62 C ATOM 596 CZ PHE A 56 2.656 -6.606 4.488 1.00 0.62 C ATOM 0 H PHE A 56 3.708 -1.632 3.039 1.00 0.33 H new ATOM 0 HA PHE A 56 3.693 -1.969 6.032 1.00 0.32 H new ATOM 0 HB2 PHE A 56 5.493 -2.826 3.689 1.00 0.35 H new ATOM 0 HB3 PHE A 56 5.876 -3.166 5.365 1.00 0.35 H new ATOM 0 HD1 PHE A 56 2.392 -3.322 5.344 1.00 0.52 H new ATOM 0 HD2 PHE A 56 5.806 -5.479 3.868 1.00 0.52 H new ATOM 0 HE1 PHE A 56 1.039 -5.396 5.232 1.00 0.63 H new ATOM 0 HE2 PHE A 56 4.449 -7.550 3.758 1.00 0.62 H new ATOM 0 HZ PHE A 56 2.065 -7.509 4.440 1.00 0.62 H new ATOM 606 N LEU A 57 5.382 0.214 4.324 1.00 0.34 N ATOM 607 CA LEU A 57 6.312 1.377 4.501 1.00 0.36 C ATOM 608 C LEU A 57 5.562 2.709 4.657 1.00 0.40 C ATOM 609 O LEU A 57 5.903 3.511 5.507 1.00 0.46 O ATOM 610 CB LEU A 57 7.176 1.405 3.235 1.00 0.43 C ATOM 611 CG LEU A 57 7.623 -0.015 2.856 1.00 0.41 C ATOM 612 CD1 LEU A 57 8.636 0.057 1.710 1.00 0.55 C ATOM 613 CD2 LEU A 57 8.271 -0.703 4.065 1.00 0.44 C ATOM 0 H LEU A 57 4.964 0.125 3.398 1.00 0.34 H new ATOM 0 HA LEU A 57 6.900 1.259 5.411 1.00 0.36 H new ATOM 0 HB2 LEU A 57 6.613 1.847 2.413 1.00 0.43 H new ATOM 0 HB3 LEU A 57 8.050 2.036 3.398 1.00 0.43 H new ATOM 0 HG LEU A 57 6.752 -0.590 2.542 1.00 0.41 H new ATOM 0 HD11 LEU A 57 8.953 -0.951 1.441 1.00 0.55 H new ATOM 0 HD12 LEU A 57 8.174 0.535 0.846 1.00 0.55 H new ATOM 0 HD13 LEU A 57 9.502 0.638 2.026 1.00 0.55 H new ATOM 0 HD21 LEU A 57 8.585 -1.709 3.786 1.00 0.44 H new ATOM 0 HD22 LEU A 57 9.139 -0.129 4.388 1.00 0.44 H new ATOM 0 HD23 LEU A 57 7.550 -0.761 4.881 1.00 0.44 H new ATOM 625 N THR A 58 4.570 2.971 3.839 1.00 0.41 N ATOM 626 CA THR A 58 3.841 4.277 3.945 1.00 0.48 C ATOM 627 C THR A 58 2.333 4.105 3.703 1.00 0.45 C ATOM 628 O THR A 58 1.562 5.028 3.885 1.00 0.51 O ATOM 629 CB THR A 58 4.468 5.146 2.852 1.00 0.55 C ATOM 630 OG1 THR A 58 5.830 5.394 3.172 1.00 0.87 O ATOM 631 CG2 THR A 58 3.719 6.473 2.753 1.00 0.88 C ATOM 0 H THR A 58 4.235 2.343 3.108 1.00 0.41 H new ATOM 0 HA THR A 58 3.931 4.715 4.939 1.00 0.48 H new ATOM 0 HB THR A 58 4.404 4.626 1.896 1.00 0.55 H new ATOM 0 HG1 THR A 58 6.234 5.949 2.473 1.00 0.87 H new ATOM 0 HG21 THR A 58 4.169 7.088 1.974 1.00 0.88 H new ATOM 0 HG22 THR A 58 2.674 6.284 2.507 1.00 0.88 H new ATOM 0 HG23 THR A 58 3.778 6.996 3.707 1.00 0.88 H new ATOM 639 N ILE A 59 1.914 2.933 3.306 1.00 0.40 N ATOM 640 CA ILE A 59 0.466 2.672 3.056 1.00 0.40 C ATOM 641 C ILE A 59 -0.153 3.716 2.106 1.00 0.43 C ATOM 642 O ILE A 59 -1.137 4.350 2.440 1.00 0.48 O ATOM 643 CB ILE A 59 -0.187 2.725 4.436 1.00 0.43 C ATOM 644 CG1 ILE A 59 0.487 1.709 5.363 1.00 0.43 C ATOM 645 CG2 ILE A 59 -1.676 2.379 4.312 1.00 0.48 C ATOM 646 CD1 ILE A 59 1.650 2.371 6.107 1.00 0.45 C ATOM 0 H ILE A 59 2.524 2.132 3.142 1.00 0.40 H new ATOM 0 HA ILE A 59 0.313 1.712 2.564 1.00 0.40 H new ATOM 0 HB ILE A 59 -0.075 3.728 4.848 1.00 0.43 H new ATOM 0 HG12 ILE A 59 -0.238 1.319 6.078 1.00 0.43 H new ATOM 0 HG13 ILE A 59 0.851 0.861 4.783 1.00 0.43 H new ATOM 0 HG21 ILE A 59 -2.142 2.417 5.297 1.00 0.48 H new ATOM 0 HG22 ILE A 59 -2.163 3.098 3.653 1.00 0.48 H new ATOM 0 HG23 ILE A 59 -1.783 1.376 3.898 1.00 0.48 H new ATOM 0 HD11 ILE A 59 2.124 1.642 6.764 1.00 0.45 H new ATOM 0 HD12 ILE A 59 2.381 2.739 5.387 1.00 0.45 H new ATOM 0 HD13 ILE A 59 1.275 3.204 6.701 1.00 0.45 H new ATOM 658 N PRO A 60 0.429 3.843 0.936 1.00 0.44 N ATOM 659 CA PRO A 60 -0.082 4.759 -0.096 1.00 0.48 C ATOM 660 C PRO A 60 -0.807 3.939 -1.188 1.00 0.43 C ATOM 661 O PRO A 60 -0.311 3.828 -2.295 1.00 0.47 O ATOM 662 CB PRO A 60 1.215 5.342 -0.655 1.00 0.57 C ATOM 663 CG PRO A 60 2.271 4.294 -0.386 1.00 0.57 C ATOM 664 CD PRO A 60 1.637 3.199 0.449 1.00 0.48 C ATOM 0 HA PRO A 60 -0.788 5.508 0.264 1.00 0.48 H new ATOM 0 HB2 PRO A 60 1.127 5.547 -1.722 1.00 0.57 H new ATOM 0 HB3 PRO A 60 1.464 6.285 -0.169 1.00 0.57 H new ATOM 0 HG2 PRO A 60 2.653 3.887 -1.323 1.00 0.57 H new ATOM 0 HG3 PRO A 60 3.119 4.733 0.140 1.00 0.57 H new ATOM 0 HD2 PRO A 60 1.414 2.312 -0.144 1.00 0.48 H new ATOM 0 HD3 PRO A 60 2.286 2.882 1.265 1.00 0.48 H new ATOM 672 N PRO A 61 -1.944 3.363 -0.853 1.00 0.39 N ATOM 673 CA PRO A 61 -2.682 2.534 -1.840 1.00 0.38 C ATOM 674 C PRO A 61 -3.224 3.398 -2.976 1.00 0.37 C ATOM 675 O PRO A 61 -3.933 4.361 -2.753 1.00 0.42 O ATOM 676 CB PRO A 61 -3.819 1.921 -1.030 1.00 0.39 C ATOM 677 CG PRO A 61 -4.011 2.856 0.113 1.00 0.42 C ATOM 678 CD PRO A 61 -2.651 3.421 0.432 1.00 0.44 C ATOM 0 HA PRO A 61 -2.052 1.780 -2.312 1.00 0.38 H new ATOM 0 HB2 PRO A 61 -4.727 1.831 -1.626 1.00 0.39 H new ATOM 0 HB3 PRO A 61 -3.564 0.919 -0.684 1.00 0.39 H new ATOM 0 HG2 PRO A 61 -4.710 3.650 -0.148 1.00 0.42 H new ATOM 0 HG3 PRO A 61 -4.427 2.335 0.975 1.00 0.42 H new ATOM 0 HD2 PRO A 61 -2.719 4.442 0.807 1.00 0.44 H new ATOM 0 HD3 PRO A 61 -2.142 2.834 1.197 1.00 0.44 H new ATOM 686 N THR A 62 -2.895 3.055 -4.194 1.00 0.37 N ATOM 687 CA THR A 62 -3.387 3.846 -5.361 1.00 0.37 C ATOM 688 C THR A 62 -4.924 3.860 -5.365 1.00 0.37 C ATOM 689 O THR A 62 -5.559 3.111 -4.647 1.00 0.39 O ATOM 690 CB THR A 62 -2.806 3.129 -6.594 1.00 0.40 C ATOM 691 OG1 THR A 62 -1.929 4.013 -7.276 1.00 0.50 O ATOM 692 CG2 THR A 62 -3.920 2.693 -7.547 1.00 0.45 C ATOM 0 H THR A 62 -2.304 2.258 -4.432 1.00 0.37 H new ATOM 0 HA THR A 62 -3.076 4.891 -5.338 1.00 0.37 H new ATOM 0 HB THR A 62 -2.267 2.242 -6.260 1.00 0.40 H new ATOM 0 HG1 THR A 62 -1.555 3.561 -8.061 1.00 0.50 H new ATOM 0 HG21 THR A 62 -3.484 2.189 -8.410 1.00 0.45 H new ATOM 0 HG22 THR A 62 -4.594 2.010 -7.030 1.00 0.45 H new ATOM 0 HG23 THR A 62 -4.476 3.569 -7.881 1.00 0.45 H new ATOM 700 N ALA A 63 -5.517 4.717 -6.157 1.00 0.38 N ATOM 701 CA ALA A 63 -7.011 4.804 -6.206 1.00 0.41 C ATOM 702 C ALA A 63 -7.637 3.441 -6.527 1.00 0.38 C ATOM 703 O ALA A 63 -8.611 3.040 -5.919 1.00 0.40 O ATOM 704 CB ALA A 63 -7.312 5.803 -7.324 1.00 0.48 C ATOM 0 H ALA A 63 -5.029 5.364 -6.776 1.00 0.38 H new ATOM 0 HA ALA A 63 -7.426 5.114 -5.247 1.00 0.41 H new ATOM 0 HB1 ALA A 63 -8.391 5.923 -7.424 1.00 0.48 H new ATOM 0 HB2 ALA A 63 -6.861 6.765 -7.083 1.00 0.48 H new ATOM 0 HB3 ALA A 63 -6.899 5.434 -8.263 1.00 0.48 H new ATOM 710 N GLY A 64 -7.094 2.740 -7.488 1.00 0.40 N ATOM 711 CA GLY A 64 -7.660 1.411 -7.872 1.00 0.42 C ATOM 712 C GLY A 64 -7.674 0.458 -6.673 1.00 0.34 C ATOM 713 O GLY A 64 -8.643 -0.233 -6.443 1.00 0.36 O ATOM 0 H GLY A 64 -6.278 3.032 -8.027 1.00 0.40 H new ATOM 0 HA2 GLY A 64 -8.673 1.539 -8.252 1.00 0.42 H new ATOM 0 HA3 GLY A 64 -7.069 0.978 -8.679 1.00 0.42 H new ATOM 717 N ILE A 65 -6.606 0.408 -5.920 1.00 0.32 N ATOM 718 CA ILE A 65 -6.542 -0.510 -4.736 1.00 0.33 C ATOM 719 C ILE A 65 -7.788 -0.344 -3.863 1.00 0.35 C ATOM 720 O ILE A 65 -8.251 -1.283 -3.247 1.00 0.45 O ATOM 721 CB ILE A 65 -5.286 -0.088 -3.954 1.00 0.35 C ATOM 722 CG1 ILE A 65 -4.051 -0.071 -4.874 1.00 0.40 C ATOM 723 CG2 ILE A 65 -5.043 -1.066 -2.797 1.00 0.39 C ATOM 724 CD1 ILE A 65 -3.955 -1.378 -5.669 1.00 0.44 C ATOM 0 H ILE A 65 -5.767 0.967 -6.073 1.00 0.32 H new ATOM 0 HA ILE A 65 -6.499 -1.556 -5.040 1.00 0.33 H new ATOM 0 HB ILE A 65 -5.446 0.916 -3.562 1.00 0.35 H new ATOM 0 HG12 ILE A 65 -4.112 0.774 -5.559 1.00 0.40 H new ATOM 0 HG13 ILE A 65 -3.148 0.066 -4.278 1.00 0.40 H new ATOM 0 HG21 ILE A 65 -4.153 -0.764 -2.246 1.00 0.39 H new ATOM 0 HG22 ILE A 65 -5.904 -1.059 -2.128 1.00 0.39 H new ATOM 0 HG23 ILE A 65 -4.900 -2.071 -3.194 1.00 0.39 H new ATOM 0 HD11 ILE A 65 -3.077 -1.348 -6.314 1.00 0.44 H new ATOM 0 HD12 ILE A 65 -3.871 -2.218 -4.979 1.00 0.44 H new ATOM 0 HD13 ILE A 65 -4.849 -1.499 -6.280 1.00 0.44 H new ATOM 736 N LEU A 66 -8.332 0.844 -3.815 1.00 0.35 N ATOM 737 CA LEU A 66 -9.547 1.083 -2.983 1.00 0.43 C ATOM 738 C LEU A 66 -10.802 0.689 -3.763 1.00 0.43 C ATOM 739 O LEU A 66 -11.607 -0.099 -3.302 1.00 0.59 O ATOM 740 CB LEU A 66 -9.549 2.590 -2.691 1.00 0.51 C ATOM 741 CG LEU A 66 -8.575 2.926 -1.549 1.00 0.55 C ATOM 742 CD1 LEU A 66 -8.971 2.172 -0.276 1.00 0.74 C ATOM 743 CD2 LEU A 66 -7.148 2.541 -1.950 1.00 0.56 C ATOM 0 H LEU A 66 -7.986 1.661 -4.318 1.00 0.35 H new ATOM 0 HA LEU A 66 -9.539 0.494 -2.066 1.00 0.43 H new ATOM 0 HB2 LEU A 66 -9.267 3.139 -3.589 1.00 0.51 H new ATOM 0 HB3 LEU A 66 -10.555 2.912 -2.423 1.00 0.51 H new ATOM 0 HG LEU A 66 -8.620 3.998 -1.356 1.00 0.55 H new ATOM 0 HD11 LEU A 66 -8.274 2.419 0.525 1.00 0.74 H new ATOM 0 HD12 LEU A 66 -9.980 2.461 0.019 1.00 0.74 H new ATOM 0 HD13 LEU A 66 -8.942 1.099 -0.465 1.00 0.74 H new ATOM 0 HD21 LEU A 66 -6.464 2.782 -1.136 1.00 0.56 H new ATOM 0 HD22 LEU A 66 -7.104 1.472 -2.156 1.00 0.56 H new ATOM 0 HD23 LEU A 66 -6.859 3.095 -2.843 1.00 0.56 H new ATOM 755 N LYS A 67 -10.971 1.231 -4.942 1.00 0.35 N ATOM 756 CA LYS A 67 -12.172 0.891 -5.763 1.00 0.37 C ATOM 757 C LYS A 67 -12.213 -0.614 -6.032 1.00 0.35 C ATOM 758 O LYS A 67 -13.269 -1.200 -6.179 1.00 0.41 O ATOM 759 CB LYS A 67 -11.994 1.663 -7.070 1.00 0.41 C ATOM 760 CG LYS A 67 -12.391 3.124 -6.859 1.00 0.48 C ATOM 761 CD LYS A 67 -13.914 3.231 -6.756 1.00 0.59 C ATOM 762 CE LYS A 67 -14.550 2.817 -8.088 1.00 0.67 C ATOM 763 NZ LYS A 67 -15.423 1.657 -7.754 1.00 0.80 N ATOM 0 H LYS A 67 -10.328 1.896 -5.372 1.00 0.35 H new ATOM 0 HA LYS A 67 -13.103 1.153 -5.261 1.00 0.37 H new ATOM 0 HB2 LYS A 67 -10.958 1.601 -7.403 1.00 0.41 H new ATOM 0 HB3 LYS A 67 -12.607 1.218 -7.854 1.00 0.41 H new ATOM 0 HG2 LYS A 67 -11.927 3.510 -5.952 1.00 0.48 H new ATOM 0 HG3 LYS A 67 -12.028 3.733 -7.687 1.00 0.48 H new ATOM 0 HD2 LYS A 67 -14.280 2.592 -5.953 1.00 0.59 H new ATOM 0 HD3 LYS A 67 -14.201 4.253 -6.506 1.00 0.59 H new ATOM 0 HE2 LYS A 67 -15.128 3.634 -8.520 1.00 0.67 H new ATOM 0 HE3 LYS A 67 -13.790 2.542 -8.819 1.00 0.67 H new ATOM 0 HZ1 LYS A 67 -15.894 1.317 -8.617 1.00 0.80 H new ATOM 0 HZ2 LYS A 67 -14.845 0.892 -7.351 1.00 0.80 H new ATOM 0 HZ3 LYS A 67 -16.141 1.951 -7.061 1.00 0.80 H new ATOM 777 N ARG A 68 -11.066 -1.239 -6.095 1.00 0.33 N ATOM 778 CA ARG A 68 -11.019 -2.705 -6.353 1.00 0.34 C ATOM 779 C ARG A 68 -11.186 -3.471 -5.032 1.00 0.33 C ATOM 780 O ARG A 68 -11.708 -4.568 -5.002 1.00 0.36 O ATOM 781 CB ARG A 68 -9.644 -2.952 -6.999 1.00 0.38 C ATOM 782 CG ARG A 68 -8.579 -3.244 -5.937 1.00 0.43 C ATOM 783 CD ARG A 68 -7.203 -3.321 -6.608 1.00 0.46 C ATOM 784 NE ARG A 68 -7.227 -4.587 -7.395 1.00 0.63 N ATOM 785 CZ ARG A 68 -7.686 -4.589 -8.617 1.00 0.66 C ATOM 786 NH1 ARG A 68 -7.342 -3.642 -9.448 1.00 0.65 N ATOM 787 NH2 ARG A 68 -8.489 -5.541 -9.010 1.00 0.78 N ATOM 0 H ARG A 68 -10.156 -0.793 -5.978 1.00 0.33 H new ATOM 0 HA ARG A 68 -11.820 -3.051 -7.006 1.00 0.34 H new ATOM 0 HB2 ARG A 68 -9.710 -3.791 -7.692 1.00 0.38 H new ATOM 0 HB3 ARG A 68 -9.351 -2.079 -7.582 1.00 0.38 H new ATOM 0 HG2 ARG A 68 -8.583 -2.463 -5.177 1.00 0.43 H new ATOM 0 HG3 ARG A 68 -8.802 -4.183 -5.430 1.00 0.43 H new ATOM 0 HD2 ARG A 68 -7.029 -2.459 -7.252 1.00 0.46 H new ATOM 0 HD3 ARG A 68 -6.403 -3.332 -5.868 1.00 0.46 H new ATOM 0 HE ARG A 68 -6.884 -5.453 -6.978 1.00 0.63 H new ATOM 0 HH11 ARG A 68 -6.714 -2.899 -9.143 1.00 0.65 H new ATOM 0 HH12 ARG A 68 -7.702 -3.645 -10.402 1.00 0.65 H new ATOM 0 HH21 ARG A 68 -8.757 -6.282 -8.362 1.00 0.78 H new ATOM 0 HH22 ARG A 68 -8.848 -5.544 -9.965 1.00 0.78 H new ATOM 801 N TRP A 69 -10.744 -2.885 -3.947 1.00 0.34 N ATOM 802 CA TRP A 69 -10.862 -3.542 -2.604 1.00 0.38 C ATOM 803 C TRP A 69 -12.282 -4.068 -2.343 1.00 0.35 C ATOM 804 O TRP A 69 -12.460 -5.056 -1.656 1.00 0.37 O ATOM 805 CB TRP A 69 -10.554 -2.420 -1.620 1.00 0.47 C ATOM 806 CG TRP A 69 -9.928 -2.966 -0.383 1.00 0.41 C ATOM 807 CD1 TRP A 69 -10.425 -2.797 0.862 1.00 0.41 C ATOM 808 CD2 TRP A 69 -8.702 -3.745 -0.233 1.00 0.37 C ATOM 809 NE1 TRP A 69 -9.587 -3.416 1.765 1.00 0.39 N ATOM 810 CE2 TRP A 69 -8.514 -4.012 1.143 1.00 0.37 C ATOM 811 CE3 TRP A 69 -7.743 -4.243 -1.140 1.00 0.39 C ATOM 812 CZ2 TRP A 69 -7.420 -4.738 1.605 1.00 0.38 C ATOM 813 CZ3 TRP A 69 -6.641 -4.974 -0.672 1.00 0.40 C ATOM 814 CH2 TRP A 69 -6.483 -5.218 0.697 1.00 0.39 C ATOM 0 H TRP A 69 -10.300 -1.967 -3.933 1.00 0.34 H new ATOM 0 HA TRP A 69 -10.197 -4.402 -2.521 1.00 0.38 H new ATOM 0 HB2 TRP A 69 -9.885 -1.696 -2.084 1.00 0.47 H new ATOM 0 HB3 TRP A 69 -11.472 -1.889 -1.366 1.00 0.47 H new ATOM 0 HD1 TRP A 69 -11.331 -2.264 1.109 1.00 0.41 H new ATOM 0 HE1 TRP A 69 -9.744 -3.430 2.773 1.00 0.39 H new ATOM 0 HE3 TRP A 69 -7.858 -4.061 -2.198 1.00 0.39 H new ATOM 0 HZ2 TRP A 69 -7.300 -4.927 2.662 1.00 0.38 H new ATOM 0 HZ3 TRP A 69 -5.910 -5.351 -1.372 1.00 0.40 H new ATOM 0 HH2 TRP A 69 -5.631 -5.781 1.049 1.00 0.39 H new ATOM 825 N GLY A 70 -13.289 -3.400 -2.855 1.00 0.35 N ATOM 826 CA GLY A 70 -14.693 -3.848 -2.602 1.00 0.39 C ATOM 827 C GLY A 70 -15.328 -4.394 -3.880 1.00 0.38 C ATOM 828 O GLY A 70 -16.463 -4.084 -4.193 1.00 0.47 O ATOM 0 H GLY A 70 -13.198 -2.566 -3.435 1.00 0.35 H new ATOM 0 HA2 GLY A 70 -14.700 -4.617 -1.830 1.00 0.39 H new ATOM 0 HA3 GLY A 70 -15.284 -3.013 -2.225 1.00 0.39 H new ATOM 832 N THR A 71 -14.620 -5.214 -4.613 1.00 0.34 N ATOM 833 CA THR A 71 -15.202 -5.790 -5.863 1.00 0.39 C ATOM 834 C THR A 71 -14.307 -6.908 -6.409 1.00 0.39 C ATOM 835 O THR A 71 -14.241 -7.132 -7.603 1.00 0.51 O ATOM 836 CB THR A 71 -15.283 -4.620 -6.850 1.00 0.47 C ATOM 837 OG1 THR A 71 -15.860 -5.071 -8.068 1.00 0.58 O ATOM 838 CG2 THR A 71 -13.884 -4.073 -7.121 1.00 0.51 C ATOM 0 H THR A 71 -13.667 -5.509 -4.401 1.00 0.34 H new ATOM 0 HA THR A 71 -16.181 -6.236 -5.689 1.00 0.39 H new ATOM 0 HB THR A 71 -15.900 -3.829 -6.422 1.00 0.47 H new ATOM 0 HG1 THR A 71 -15.517 -5.964 -8.282 1.00 0.58 H new ATOM 0 HG21 THR A 71 -13.948 -3.242 -7.823 1.00 0.51 H new ATOM 0 HG22 THR A 71 -13.442 -3.726 -6.187 1.00 0.51 H new ATOM 0 HG23 THR A 71 -13.262 -4.860 -7.547 1.00 0.51 H new ATOM 846 N ILE A 72 -13.626 -7.617 -5.541 1.00 0.35 N ATOM 847 CA ILE A 72 -12.743 -8.728 -6.006 1.00 0.36 C ATOM 848 C ILE A 72 -13.338 -10.084 -5.591 1.00 0.37 C ATOM 849 O ILE A 72 -14.496 -10.355 -5.848 1.00 0.43 O ATOM 850 CB ILE A 72 -11.382 -8.470 -5.346 1.00 0.37 C ATOM 851 CG1 ILE A 72 -11.527 -8.481 -3.822 1.00 0.40 C ATOM 852 CG2 ILE A 72 -10.843 -7.110 -5.796 1.00 0.42 C ATOM 853 CD1 ILE A 72 -10.247 -9.047 -3.202 1.00 0.40 C ATOM 0 H ILE A 72 -13.645 -7.473 -4.531 1.00 0.35 H new ATOM 0 HA ILE A 72 -12.645 -8.761 -7.091 1.00 0.36 H new ATOM 0 HB ILE A 72 -10.688 -9.256 -5.645 1.00 0.37 H new ATOM 0 HG12 ILE A 72 -11.709 -7.471 -3.454 1.00 0.40 H new ATOM 0 HG13 ILE A 72 -12.386 -9.086 -3.530 1.00 0.40 H new ATOM 0 HG21 ILE A 72 -9.876 -6.928 -5.326 1.00 0.42 H new ATOM 0 HG22 ILE A 72 -10.727 -7.105 -6.880 1.00 0.42 H new ATOM 0 HG23 ILE A 72 -11.542 -6.327 -5.503 1.00 0.42 H new ATOM 0 HD11 ILE A 72 -10.343 -9.058 -2.116 1.00 0.40 H new ATOM 0 HD12 ILE A 72 -10.087 -10.063 -3.562 1.00 0.40 H new ATOM 0 HD13 ILE A 72 -9.399 -8.423 -3.485 1.00 0.40 H new ATOM 865 N LYS A 73 -12.561 -10.941 -4.972 1.00 0.37 N ATOM 866 CA LYS A 73 -13.086 -12.281 -4.567 1.00 0.37 C ATOM 867 C LYS A 73 -13.079 -12.442 -3.051 1.00 0.32 C ATOM 868 O LYS A 73 -13.923 -13.115 -2.492 1.00 0.33 O ATOM 869 CB LYS A 73 -12.112 -13.275 -5.193 1.00 0.41 C ATOM 870 CG LYS A 73 -12.561 -14.702 -4.890 1.00 0.43 C ATOM 871 CD LYS A 73 -13.310 -15.275 -6.096 1.00 0.52 C ATOM 872 CE LYS A 73 -14.811 -15.029 -5.933 1.00 0.49 C ATOM 873 NZ LYS A 73 -15.456 -15.899 -6.954 1.00 0.68 N ATOM 0 H LYS A 73 -11.585 -10.769 -4.730 1.00 0.37 H new ATOM 0 HA LYS A 73 -14.116 -12.425 -4.892 1.00 0.37 H new ATOM 0 HB2 LYS A 73 -12.064 -13.121 -6.271 1.00 0.41 H new ATOM 0 HB3 LYS A 73 -11.108 -13.109 -4.802 1.00 0.41 H new ATOM 0 HG2 LYS A 73 -11.696 -15.324 -4.658 1.00 0.43 H new ATOM 0 HG3 LYS A 73 -13.206 -14.712 -4.011 1.00 0.43 H new ATOM 0 HD2 LYS A 73 -12.952 -14.808 -7.014 1.00 0.52 H new ATOM 0 HD3 LYS A 73 -13.114 -16.344 -6.184 1.00 0.52 H new ATOM 0 HE2 LYS A 73 -15.146 -15.285 -4.928 1.00 0.49 H new ATOM 0 HE3 LYS A 73 -15.059 -13.980 -6.095 1.00 0.49 H new ATOM 0 HZ1 LYS A 73 -16.489 -15.786 -6.904 1.00 0.68 H new ATOM 0 HZ2 LYS A 73 -15.123 -15.628 -7.901 1.00 0.68 H new ATOM 0 HZ3 LYS A 73 -15.208 -16.892 -6.771 1.00 0.68 H new ATOM 887 N LYS A 74 -12.113 -11.852 -2.400 1.00 0.31 N ATOM 888 CA LYS A 74 -11.976 -11.962 -0.912 1.00 0.29 C ATOM 889 C LYS A 74 -11.516 -13.371 -0.527 1.00 0.29 C ATOM 890 O LYS A 74 -10.594 -13.534 0.247 1.00 0.30 O ATOM 891 CB LYS A 74 -13.349 -11.666 -0.281 1.00 0.30 C ATOM 892 CG LYS A 74 -14.032 -10.481 -0.965 1.00 0.33 C ATOM 893 CD LYS A 74 -13.058 -9.310 -1.106 1.00 0.32 C ATOM 894 CE LYS A 74 -12.669 -8.804 0.283 1.00 0.35 C ATOM 895 NZ LYS A 74 -12.568 -7.323 0.144 1.00 0.33 N ATOM 0 H LYS A 74 -11.393 -11.283 -2.846 1.00 0.31 H new ATOM 0 HA LYS A 74 -11.234 -11.250 -0.551 1.00 0.29 H new ATOM 0 HB2 LYS A 74 -13.984 -12.548 -0.358 1.00 0.30 H new ATOM 0 HB3 LYS A 74 -13.225 -11.454 0.781 1.00 0.30 H new ATOM 0 HG2 LYS A 74 -14.395 -10.781 -1.948 1.00 0.33 H new ATOM 0 HG3 LYS A 74 -14.902 -10.171 -0.386 1.00 0.33 H new ATOM 0 HD2 LYS A 74 -12.169 -9.626 -1.652 1.00 0.32 H new ATOM 0 HD3 LYS A 74 -13.518 -8.507 -1.682 1.00 0.32 H new ATOM 0 HE2 LYS A 74 -13.417 -9.080 1.027 1.00 0.35 H new ATOM 0 HE3 LYS A 74 -11.722 -9.235 0.608 1.00 0.35 H new ATOM 0 HZ1 LYS A 74 -12.575 -6.885 1.087 1.00 0.33 H new ATOM 0 HZ2 LYS A 74 -11.683 -7.080 -0.345 1.00 0.33 H new ATOM 0 HZ3 LYS A 74 -13.376 -6.970 -0.407 1.00 0.33 H new ATOM 909 N SER A 75 -12.143 -14.390 -1.064 1.00 0.30 N ATOM 910 CA SER A 75 -11.733 -15.783 -0.723 1.00 0.33 C ATOM 911 C SER A 75 -10.273 -15.993 -1.112 1.00 0.33 C ATOM 912 O SER A 75 -9.496 -16.538 -0.357 1.00 0.37 O ATOM 913 CB SER A 75 -12.656 -16.693 -1.537 1.00 0.37 C ATOM 914 OG SER A 75 -12.259 -16.679 -2.902 1.00 0.40 O ATOM 0 H SER A 75 -12.919 -14.315 -1.722 1.00 0.30 H new ATOM 0 HA SER A 75 -11.816 -15.995 0.343 1.00 0.33 H new ATOM 0 HB2 SER A 75 -12.616 -17.710 -1.147 1.00 0.37 H new ATOM 0 HB3 SER A 75 -13.689 -16.356 -1.445 1.00 0.37 H new ATOM 0 HG SER A 75 -12.850 -17.264 -3.421 1.00 0.40 H new ATOM 920 N LYS A 76 -9.899 -15.549 -2.282 1.00 0.33 N ATOM 921 CA LYS A 76 -8.486 -15.707 -2.726 1.00 0.33 C ATOM 922 C LYS A 76 -7.595 -14.707 -1.984 1.00 0.32 C ATOM 923 O LYS A 76 -6.507 -15.039 -1.557 1.00 0.38 O ATOM 924 CB LYS A 76 -8.503 -15.412 -4.226 1.00 0.36 C ATOM 925 CG LYS A 76 -7.390 -16.206 -4.919 1.00 0.39 C ATOM 926 CD LYS A 76 -7.649 -17.709 -4.765 1.00 0.43 C ATOM 927 CE LYS A 76 -6.523 -18.343 -3.944 1.00 0.45 C ATOM 928 NZ LYS A 76 -5.377 -18.459 -4.889 1.00 0.38 N ATOM 0 H LYS A 76 -10.513 -15.083 -2.950 1.00 0.33 H new ATOM 0 HA LYS A 76 -8.091 -16.702 -2.519 1.00 0.33 H new ATOM 0 HB2 LYS A 76 -9.472 -15.680 -4.648 1.00 0.36 H new ATOM 0 HB3 LYS A 76 -8.364 -14.345 -4.399 1.00 0.36 H new ATOM 0 HG2 LYS A 76 -7.346 -15.942 -5.976 1.00 0.39 H new ATOM 0 HG3 LYS A 76 -6.423 -15.948 -4.486 1.00 0.39 H new ATOM 0 HD2 LYS A 76 -8.608 -17.875 -4.274 1.00 0.43 H new ATOM 0 HD3 LYS A 76 -7.707 -18.181 -5.746 1.00 0.43 H new ATOM 0 HE2 LYS A 76 -6.265 -17.725 -3.084 1.00 0.45 H new ATOM 0 HE3 LYS A 76 -6.817 -19.319 -3.558 1.00 0.45 H new ATOM 0 HZ1 LYS A 76 -5.138 -19.462 -5.023 1.00 0.38 H new ATOM 0 HZ2 LYS A 76 -5.638 -18.040 -5.804 1.00 0.38 H new ATOM 0 HZ3 LYS A 76 -4.554 -17.956 -4.500 1.00 0.38 H new ATOM 942 N ALA A 77 -8.056 -13.489 -1.822 1.00 0.29 N ATOM 943 CA ALA A 77 -7.241 -12.464 -1.097 1.00 0.29 C ATOM 944 C ALA A 77 -7.020 -12.905 0.350 1.00 0.28 C ATOM 945 O ALA A 77 -5.902 -12.967 0.826 1.00 0.32 O ATOM 946 CB ALA A 77 -8.071 -11.180 -1.135 1.00 0.31 C ATOM 0 H ALA A 77 -8.961 -13.161 -2.160 1.00 0.29 H new ATOM 0 HA ALA A 77 -6.260 -12.325 -1.552 1.00 0.29 H new ATOM 0 HB1 ALA A 77 -7.533 -10.384 -0.620 1.00 0.31 H new ATOM 0 HB2 ALA A 77 -8.245 -10.890 -2.171 1.00 0.31 H new ATOM 0 HB3 ALA A 77 -9.027 -11.350 -0.640 1.00 0.31 H new ATOM 952 N ILE A 78 -8.083 -13.212 1.051 1.00 0.27 N ATOM 953 CA ILE A 78 -7.944 -13.653 2.470 1.00 0.28 C ATOM 954 C ILE A 78 -7.076 -14.913 2.538 1.00 0.29 C ATOM 955 O ILE A 78 -6.201 -15.023 3.376 1.00 0.32 O ATOM 956 CB ILE A 78 -9.373 -13.928 2.947 1.00 0.30 C ATOM 957 CG1 ILE A 78 -10.178 -12.623 2.903 1.00 0.31 C ATOM 958 CG2 ILE A 78 -9.343 -14.460 4.382 1.00 0.35 C ATOM 959 CD1 ILE A 78 -11.662 -12.929 2.683 1.00 0.35 C ATOM 0 H ILE A 78 -9.040 -13.176 0.701 1.00 0.27 H new ATOM 0 HA ILE A 78 -7.459 -12.906 3.098 1.00 0.28 H new ATOM 0 HB ILE A 78 -9.838 -14.670 2.298 1.00 0.30 H new ATOM 0 HG12 ILE A 78 -10.046 -12.073 3.835 1.00 0.31 H new ATOM 0 HG13 ILE A 78 -9.807 -11.984 2.101 1.00 0.31 H new ATOM 0 HG21 ILE A 78 -10.361 -14.655 4.719 1.00 0.35 H new ATOM 0 HG22 ILE A 78 -8.766 -15.384 4.415 1.00 0.35 H new ATOM 0 HG23 ILE A 78 -8.880 -13.720 5.035 1.00 0.35 H new ATOM 0 HD11 ILE A 78 -12.225 -11.996 2.653 1.00 0.35 H new ATOM 0 HD12 ILE A 78 -11.788 -13.459 1.739 1.00 0.35 H new ATOM 0 HD13 ILE A 78 -12.031 -13.550 3.500 1.00 0.35 H new ATOM 971 N ASN A 79 -7.291 -15.854 1.648 1.00 0.29 N ATOM 972 CA ASN A 79 -6.450 -17.088 1.656 1.00 0.31 C ATOM 973 C ASN A 79 -5.006 -16.698 1.350 1.00 0.32 C ATOM 974 O ASN A 79 -4.071 -17.224 1.924 1.00 0.34 O ATOM 975 CB ASN A 79 -7.008 -17.982 0.548 1.00 0.33 C ATOM 976 CG ASN A 79 -8.050 -18.935 1.139 1.00 0.39 C ATOM 977 OD1 ASN A 79 -7.767 -19.656 2.076 1.00 0.53 O ATOM 978 ND2 ASN A 79 -9.249 -18.971 0.629 1.00 0.44 N ATOM 0 H ASN A 79 -8.007 -15.819 0.923 1.00 0.29 H new ATOM 0 HA ASN A 79 -6.468 -17.602 2.617 1.00 0.31 H new ATOM 0 HB2 ASN A 79 -7.460 -17.372 -0.234 1.00 0.33 H new ATOM 0 HB3 ASN A 79 -6.202 -18.550 0.083 1.00 0.33 H new ATOM 0 HD21 ASN A 79 -9.949 -19.604 1.016 1.00 0.44 H new ATOM 0 HD22 ASN A 79 -9.487 -18.366 -0.157 1.00 0.44 H new ATOM 985 N VAL A 80 -4.829 -15.757 0.457 1.00 0.32 N ATOM 986 CA VAL A 80 -3.457 -15.291 0.106 1.00 0.34 C ATOM 987 C VAL A 80 -2.785 -14.731 1.362 1.00 0.33 C ATOM 988 O VAL A 80 -1.681 -15.108 1.708 1.00 0.36 O ATOM 989 CB VAL A 80 -3.677 -14.196 -0.956 1.00 0.38 C ATOM 990 CG1 VAL A 80 -2.766 -12.992 -0.695 1.00 0.44 C ATOM 991 CG2 VAL A 80 -3.381 -14.767 -2.347 1.00 0.51 C ATOM 0 H VAL A 80 -5.583 -15.290 -0.046 1.00 0.32 H new ATOM 0 HA VAL A 80 -2.811 -16.082 -0.274 1.00 0.34 H new ATOM 0 HB VAL A 80 -4.714 -13.865 -0.902 1.00 0.38 H new ATOM 0 HG11 VAL A 80 -2.939 -12.233 -1.457 1.00 0.44 H new ATOM 0 HG12 VAL A 80 -2.986 -12.576 0.288 1.00 0.44 H new ATOM 0 HG13 VAL A 80 -1.724 -13.310 -0.730 1.00 0.44 H new ATOM 0 HG21 VAL A 80 -3.536 -13.993 -3.099 1.00 0.51 H new ATOM 0 HG22 VAL A 80 -2.347 -15.109 -2.387 1.00 0.51 H new ATOM 0 HG23 VAL A 80 -4.049 -15.605 -2.546 1.00 0.51 H new ATOM 1001 N LEU A 81 -3.455 -13.837 2.045 1.00 0.34 N ATOM 1002 CA LEU A 81 -2.874 -13.247 3.287 1.00 0.37 C ATOM 1003 C LEU A 81 -2.549 -14.359 4.283 1.00 0.38 C ATOM 1004 O LEU A 81 -1.539 -14.322 4.961 1.00 0.42 O ATOM 1005 CB LEU A 81 -3.961 -12.325 3.836 1.00 0.42 C ATOM 1006 CG LEU A 81 -3.512 -10.872 3.687 1.00 0.49 C ATOM 1007 CD1 LEU A 81 -4.067 -10.301 2.383 1.00 0.79 C ATOM 1008 CD2 LEU A 81 -4.037 -10.052 4.863 1.00 0.54 C ATOM 0 H LEU A 81 -4.381 -13.490 1.795 1.00 0.34 H new ATOM 0 HA LEU A 81 -1.947 -12.705 3.100 1.00 0.37 H new ATOM 0 HB2 LEU A 81 -4.896 -12.486 3.299 1.00 0.42 H new ATOM 0 HB3 LEU A 81 -4.152 -12.553 4.885 1.00 0.42 H new ATOM 0 HG LEU A 81 -2.423 -10.828 3.671 1.00 0.49 H new ATOM 0 HD11 LEU A 81 -3.748 -9.264 2.275 1.00 0.79 H new ATOM 0 HD12 LEU A 81 -3.694 -10.885 1.542 1.00 0.79 H new ATOM 0 HD13 LEU A 81 -5.156 -10.345 2.401 1.00 0.79 H new ATOM 0 HD21 LEU A 81 -3.716 -9.016 4.756 1.00 0.54 H new ATOM 0 HD22 LEU A 81 -5.126 -10.095 4.879 1.00 0.54 H new ATOM 0 HD23 LEU A 81 -3.644 -10.459 5.795 1.00 0.54 H new ATOM 1020 N ARG A 82 -3.388 -15.359 4.356 1.00 0.40 N ATOM 1021 CA ARG A 82 -3.118 -16.491 5.286 1.00 0.46 C ATOM 1022 C ARG A 82 -1.898 -17.260 4.777 1.00 0.41 C ATOM 1023 O ARG A 82 -1.028 -17.650 5.537 1.00 0.43 O ATOM 1024 CB ARG A 82 -4.373 -17.364 5.238 1.00 0.53 C ATOM 1025 CG ARG A 82 -4.578 -18.036 6.597 1.00 0.61 C ATOM 1026 CD ARG A 82 -5.201 -17.036 7.575 1.00 0.76 C ATOM 1027 NE ARG A 82 -6.317 -17.778 8.225 1.00 0.85 N ATOM 1028 CZ ARG A 82 -7.439 -17.960 7.585 1.00 1.08 C ATOM 1029 NH1 ARG A 82 -8.306 -16.988 7.499 1.00 1.45 N ATOM 1030 NH2 ARG A 82 -7.695 -19.113 7.031 1.00 1.53 N ATOM 0 H ARG A 82 -4.247 -15.439 3.812 1.00 0.40 H new ATOM 0 HA ARG A 82 -2.908 -16.167 6.305 1.00 0.46 H new ATOM 0 HB2 ARG A 82 -5.242 -16.757 4.986 1.00 0.53 H new ATOM 0 HB3 ARG A 82 -4.274 -18.119 4.458 1.00 0.53 H new ATOM 0 HG2 ARG A 82 -5.225 -18.907 6.490 1.00 0.61 H new ATOM 0 HG3 ARG A 82 -3.624 -18.394 6.985 1.00 0.61 H new ATOM 0 HD2 ARG A 82 -4.472 -16.696 8.310 1.00 0.76 H new ATOM 0 HD3 ARG A 82 -5.566 -16.150 7.055 1.00 0.76 H new ATOM 0 HE ARG A 82 -6.204 -18.144 9.170 1.00 0.85 H new ATOM 0 HH11 ARG A 82 -8.106 -16.086 7.932 1.00 1.45 H new ATOM 0 HH12 ARG A 82 -9.183 -17.130 6.999 1.00 1.45 H new ATOM 0 HH21 ARG A 82 -7.018 -19.873 7.098 1.00 1.53 H new ATOM 0 HH22 ARG A 82 -8.572 -19.255 6.531 1.00 1.53 H new ATOM 1044 N GLY A 83 -1.823 -17.458 3.482 1.00 0.38 N ATOM 1045 CA GLY A 83 -0.656 -18.175 2.896 1.00 0.37 C ATOM 1046 C GLY A 83 0.606 -17.370 3.197 1.00 0.34 C ATOM 1047 O GLY A 83 1.659 -17.922 3.458 1.00 0.36 O ATOM 0 H GLY A 83 -2.524 -17.151 2.807 1.00 0.38 H new ATOM 0 HA2 GLY A 83 -0.576 -19.177 3.318 1.00 0.37 H new ATOM 0 HA3 GLY A 83 -0.784 -18.291 1.820 1.00 0.37 H new ATOM 1051 N PHE A 84 0.496 -16.063 3.184 1.00 0.33 N ATOM 1052 CA PHE A 84 1.677 -15.210 3.495 1.00 0.33 C ATOM 1053 C PHE A 84 2.073 -15.434 4.953 1.00 0.33 C ATOM 1054 O PHE A 84 3.241 -15.460 5.295 1.00 0.37 O ATOM 1055 CB PHE A 84 1.212 -13.766 3.275 1.00 0.35 C ATOM 1056 CG PHE A 84 1.339 -13.392 1.822 1.00 0.35 C ATOM 1057 CD1 PHE A 84 2.510 -13.689 1.114 1.00 0.41 C ATOM 1058 CD2 PHE A 84 0.283 -12.732 1.183 1.00 0.55 C ATOM 1059 CE1 PHE A 84 2.620 -13.328 -0.231 1.00 0.43 C ATOM 1060 CE2 PHE A 84 0.398 -12.371 -0.159 1.00 0.65 C ATOM 1061 CZ PHE A 84 1.564 -12.669 -0.865 1.00 0.51 C ATOM 0 H PHE A 84 -0.362 -15.554 2.971 1.00 0.33 H new ATOM 0 HA PHE A 84 2.542 -15.440 2.873 1.00 0.33 H new ATOM 0 HB2 PHE A 84 0.176 -13.657 3.596 1.00 0.35 H new ATOM 0 HB3 PHE A 84 1.808 -13.088 3.886 1.00 0.35 H new ATOM 0 HD1 PHE A 84 3.326 -14.196 1.607 1.00 0.41 H new ATOM 0 HD2 PHE A 84 -0.620 -12.503 1.729 1.00 0.55 H new ATOM 0 HE1 PHE A 84 3.521 -13.558 -0.780 1.00 0.43 H new ATOM 0 HE2 PHE A 84 -0.416 -11.860 -0.652 1.00 0.65 H new ATOM 0 HZ PHE A 84 1.650 -12.389 -1.905 1.00 0.51 H new ATOM 1071 N ARG A 85 1.098 -15.621 5.811 1.00 0.32 N ATOM 1072 CA ARG A 85 1.400 -15.873 7.251 1.00 0.33 C ATOM 1073 C ARG A 85 2.246 -17.139 7.366 1.00 0.33 C ATOM 1074 O ARG A 85 3.202 -17.196 8.116 1.00 0.34 O ATOM 1075 CB ARG A 85 0.040 -16.071 7.922 1.00 0.38 C ATOM 1076 CG ARG A 85 0.197 -15.944 9.439 1.00 0.45 C ATOM 1077 CD ARG A 85 0.399 -17.333 10.051 1.00 0.48 C ATOM 1078 NE ARG A 85 1.450 -17.146 11.090 1.00 0.56 N ATOM 1079 CZ ARG A 85 2.122 -18.174 11.530 1.00 0.47 C ATOM 1080 NH1 ARG A 85 1.660 -18.876 12.528 1.00 0.65 N ATOM 1081 NH2 ARG A 85 3.255 -18.501 10.971 1.00 0.34 N ATOM 0 H ARG A 85 0.106 -15.609 5.573 1.00 0.32 H new ATOM 0 HA ARG A 85 1.955 -15.058 7.716 1.00 0.33 H new ATOM 0 HB2 ARG A 85 -0.670 -15.329 7.556 1.00 0.38 H new ATOM 0 HB3 ARG A 85 -0.364 -17.051 7.668 1.00 0.38 H new ATOM 0 HG2 ARG A 85 1.047 -15.304 9.675 1.00 0.45 H new ATOM 0 HG3 ARG A 85 -0.686 -15.471 9.868 1.00 0.45 H new ATOM 0 HD2 ARG A 85 -0.526 -17.710 10.488 1.00 0.48 H new ATOM 0 HD3 ARG A 85 0.713 -18.055 9.297 1.00 0.48 H new ATOM 0 HE ARG A 85 1.644 -16.214 11.457 1.00 0.56 H new ATOM 0 HH11 ARG A 85 0.774 -18.621 12.964 1.00 0.65 H new ATOM 0 HH12 ARG A 85 2.185 -19.680 12.872 1.00 0.65 H new ATOM 0 HH21 ARG A 85 3.615 -17.953 10.190 1.00 0.34 H new ATOM 0 HH22 ARG A 85 3.780 -19.305 11.315 1.00 0.34 H new ATOM 1095 N LYS A 86 1.910 -18.150 6.608 1.00 0.34 N ATOM 1096 CA LYS A 86 2.709 -19.408 6.649 1.00 0.34 C ATOM 1097 C LYS A 86 4.027 -19.187 5.906 1.00 0.32 C ATOM 1098 O LYS A 86 5.046 -19.764 6.240 1.00 0.37 O ATOM 1099 CB LYS A 86 1.851 -20.460 5.944 1.00 0.38 C ATOM 1100 CG LYS A 86 1.865 -21.758 6.756 1.00 0.48 C ATOM 1101 CD LYS A 86 1.139 -21.541 8.088 1.00 0.60 C ATOM 1102 CE LYS A 86 2.163 -21.415 9.221 1.00 0.56 C ATOM 1103 NZ LYS A 86 2.060 -22.694 9.977 1.00 0.59 N ATOM 0 H LYS A 86 1.119 -18.158 5.964 1.00 0.34 H new ATOM 0 HA LYS A 86 2.954 -19.721 7.664 1.00 0.34 H new ATOM 0 HB2 LYS A 86 0.829 -20.098 5.835 1.00 0.38 H new ATOM 0 HB3 LYS A 86 2.233 -20.643 4.940 1.00 0.38 H new ATOM 0 HG2 LYS A 86 1.381 -22.556 6.193 1.00 0.48 H new ATOM 0 HG3 LYS A 86 2.892 -22.074 6.938 1.00 0.48 H new ATOM 0 HD2 LYS A 86 0.527 -20.641 8.037 1.00 0.60 H new ATOM 0 HD3 LYS A 86 0.465 -22.374 8.285 1.00 0.60 H new ATOM 0 HE2 LYS A 86 3.169 -21.268 8.829 1.00 0.56 H new ATOM 0 HE3 LYS A 86 1.942 -20.560 9.860 1.00 0.56 H new ATOM 0 HZ1 LYS A 86 2.732 -22.683 10.770 1.00 0.59 H new ATOM 0 HZ2 LYS A 86 1.093 -22.803 10.344 1.00 0.59 H new ATOM 0 HZ3 LYS A 86 2.283 -23.490 9.345 1.00 0.59 H new ATOM 1117 N GLU A 87 4.014 -18.335 4.909 1.00 0.29 N ATOM 1118 CA GLU A 87 5.263 -18.047 4.147 1.00 0.29 C ATOM 1119 C GLU A 87 6.230 -17.272 5.042 1.00 0.28 C ATOM 1120 O GLU A 87 7.432 -17.460 4.984 1.00 0.30 O ATOM 1121 CB GLU A 87 4.823 -17.190 2.958 1.00 0.32 C ATOM 1122 CG GLU A 87 4.203 -18.084 1.877 1.00 0.37 C ATOM 1123 CD GLU A 87 5.013 -17.964 0.584 1.00 0.34 C ATOM 1124 OE1 GLU A 87 5.263 -16.845 0.166 1.00 0.45 O ATOM 1125 OE2 GLU A 87 5.367 -18.993 0.032 1.00 0.36 O ATOM 0 H GLU A 87 3.188 -17.827 4.592 1.00 0.29 H new ATOM 0 HA GLU A 87 5.773 -18.952 3.816 1.00 0.29 H new ATOM 0 HB2 GLU A 87 4.100 -16.443 3.284 1.00 0.32 H new ATOM 0 HB3 GLU A 87 5.678 -16.650 2.551 1.00 0.32 H new ATOM 0 HG2 GLU A 87 4.187 -19.121 2.213 1.00 0.37 H new ATOM 0 HG3 GLU A 87 3.168 -17.791 1.698 1.00 0.37 H new ATOM 1132 N ILE A 88 5.709 -16.413 5.883 1.00 0.28 N ATOM 1133 CA ILE A 88 6.590 -15.638 6.800 1.00 0.28 C ATOM 1134 C ILE A 88 7.149 -16.590 7.862 1.00 0.27 C ATOM 1135 O ILE A 88 8.321 -16.546 8.194 1.00 0.26 O ATOM 1136 CB ILE A 88 5.686 -14.530 7.391 1.00 0.29 C ATOM 1137 CG1 ILE A 88 6.468 -13.213 7.434 1.00 0.34 C ATOM 1138 CG2 ILE A 88 5.200 -14.873 8.809 1.00 0.31 C ATOM 1139 CD1 ILE A 88 5.605 -12.088 6.857 1.00 0.59 C ATOM 0 H ILE A 88 4.712 -16.217 5.972 1.00 0.28 H new ATOM 0 HA ILE A 88 7.453 -15.185 6.311 1.00 0.28 H new ATOM 0 HB ILE A 88 4.809 -14.440 6.751 1.00 0.29 H new ATOM 0 HG12 ILE A 88 6.751 -12.979 8.460 1.00 0.34 H new ATOM 0 HG13 ILE A 88 7.391 -13.307 6.862 1.00 0.34 H new ATOM 0 HG21 ILE A 88 4.569 -14.066 9.182 1.00 0.31 H new ATOM 0 HG22 ILE A 88 4.627 -15.800 8.783 1.00 0.31 H new ATOM 0 HG23 ILE A 88 6.059 -14.996 9.468 1.00 0.31 H new ATOM 0 HD11 ILE A 88 6.161 -11.151 6.887 1.00 0.59 H new ATOM 0 HD12 ILE A 88 5.345 -12.322 5.825 1.00 0.59 H new ATOM 0 HD13 ILE A 88 4.694 -11.989 7.447 1.00 0.59 H new ATOM 1151 N GLY A 89 6.321 -17.472 8.372 1.00 0.29 N ATOM 1152 CA GLY A 89 6.801 -18.453 9.388 1.00 0.29 C ATOM 1153 C GLY A 89 7.924 -19.273 8.758 1.00 0.27 C ATOM 1154 O GLY A 89 8.871 -19.666 9.415 1.00 0.29 O ATOM 0 H GLY A 89 5.334 -17.552 8.126 1.00 0.29 H new ATOM 0 HA2 GLY A 89 7.160 -17.935 10.278 1.00 0.29 H new ATOM 0 HA3 GLY A 89 5.986 -19.103 9.705 1.00 0.29 H new ATOM 1158 N ARG A 90 7.828 -19.508 7.475 1.00 0.26 N ATOM 1159 CA ARG A 90 8.890 -20.276 6.769 1.00 0.25 C ATOM 1160 C ARG A 90 10.154 -19.423 6.682 1.00 0.23 C ATOM 1161 O ARG A 90 11.256 -19.922 6.814 1.00 0.26 O ATOM 1162 CB ARG A 90 8.332 -20.535 5.370 1.00 0.27 C ATOM 1163 CG ARG A 90 7.598 -21.874 5.341 1.00 0.33 C ATOM 1164 CD ARG A 90 7.121 -22.150 3.914 1.00 0.38 C ATOM 1165 NE ARG A 90 7.278 -23.619 3.732 1.00 0.68 N ATOM 1166 CZ ARG A 90 6.628 -24.231 2.782 1.00 1.01 C ATOM 1167 NH1 ARG A 90 5.330 -24.114 2.698 1.00 1.77 N ATOM 1168 NH2 ARG A 90 7.274 -24.961 1.914 1.00 1.44 N ATOM 0 H ARG A 90 7.055 -19.199 6.886 1.00 0.26 H new ATOM 0 HA ARG A 90 9.147 -21.204 7.280 1.00 0.25 H new ATOM 0 HB2 ARG A 90 7.652 -19.732 5.086 1.00 0.27 H new ATOM 0 HB3 ARG A 90 9.142 -20.539 4.641 1.00 0.27 H new ATOM 0 HG2 ARG A 90 8.259 -22.673 5.678 1.00 0.33 H new ATOM 0 HG3 ARG A 90 6.749 -21.853 6.024 1.00 0.33 H new ATOM 0 HD2 ARG A 90 6.084 -21.844 3.779 1.00 0.38 H new ATOM 0 HD3 ARG A 90 7.714 -21.597 3.186 1.00 0.38 H new ATOM 0 HE ARG A 90 7.894 -24.147 4.350 1.00 0.68 H new ATOM 0 HH11 ARG A 90 4.824 -23.544 3.376 1.00 1.77 H new ATOM 0 HH12 ARG A 90 4.822 -24.593 1.955 1.00 1.77 H new ATOM 0 HH21 ARG A 90 8.288 -25.053 1.979 1.00 1.44 H new ATOM 0 HH22 ARG A 90 6.765 -25.440 1.171 1.00 1.44 H new ATOM 1182 N MET A 91 9.996 -18.130 6.486 1.00 0.23 N ATOM 1183 CA MET A 91 11.185 -17.230 6.408 1.00 0.23 C ATOM 1184 C MET A 91 11.962 -17.362 7.706 1.00 0.22 C ATOM 1185 O MET A 91 13.178 -17.372 7.723 1.00 0.24 O ATOM 1186 CB MET A 91 10.622 -15.816 6.246 1.00 0.25 C ATOM 1187 CG MET A 91 11.469 -15.042 5.231 1.00 0.35 C ATOM 1188 SD MET A 91 10.853 -13.344 5.098 1.00 0.59 S ATOM 1189 CE MET A 91 9.321 -13.727 4.215 1.00 0.84 C ATOM 0 H MET A 91 9.094 -17.666 6.378 1.00 0.23 H new ATOM 0 HA MET A 91 11.856 -17.471 5.584 1.00 0.23 H new ATOM 0 HB2 MET A 91 9.586 -15.862 5.911 1.00 0.25 H new ATOM 0 HB3 MET A 91 10.624 -15.300 7.206 1.00 0.25 H new ATOM 0 HG2 MET A 91 12.514 -15.038 5.542 1.00 0.35 H new ATOM 0 HG3 MET A 91 11.428 -15.532 4.258 1.00 0.35 H new ATOM 0 HE1 MET A 91 9.340 -13.255 3.233 1.00 0.84 H new ATOM 0 HE2 MET A 91 9.229 -14.807 4.097 1.00 0.84 H new ATOM 0 HE3 MET A 91 8.470 -13.350 4.783 1.00 0.84 H new ATOM 1199 N LEU A 92 11.250 -17.505 8.790 1.00 0.24 N ATOM 1200 CA LEU A 92 11.915 -17.684 10.103 1.00 0.24 C ATOM 1201 C LEU A 92 12.617 -19.025 10.099 1.00 0.25 C ATOM 1202 O LEU A 92 13.748 -19.139 10.530 1.00 0.28 O ATOM 1203 CB LEU A 92 10.792 -17.627 11.122 1.00 0.27 C ATOM 1204 CG LEU A 92 10.212 -16.223 11.072 1.00 0.30 C ATOM 1205 CD1 LEU A 92 8.717 -16.262 11.395 1.00 0.39 C ATOM 1206 CD2 LEU A 92 10.937 -15.337 12.088 1.00 0.35 C ATOM 0 H LEU A 92 10.230 -17.505 8.818 1.00 0.24 H new ATOM 0 HA LEU A 92 12.668 -16.928 10.328 1.00 0.24 H new ATOM 0 HB2 LEU A 92 10.026 -18.368 10.893 1.00 0.27 H new ATOM 0 HB3 LEU A 92 11.166 -17.854 12.120 1.00 0.27 H new ATOM 0 HG LEU A 92 10.346 -15.814 10.070 1.00 0.30 H new ATOM 0 HD11 LEU A 92 8.310 -15.252 11.357 1.00 0.39 H new ATOM 0 HD12 LEU A 92 8.203 -16.888 10.665 1.00 0.39 H new ATOM 0 HD13 LEU A 92 8.571 -16.674 12.393 1.00 0.39 H new ATOM 0 HD21 LEU A 92 10.522 -14.330 12.054 1.00 0.35 H new ATOM 0 HD22 LEU A 92 10.806 -15.749 13.089 1.00 0.35 H new ATOM 0 HD23 LEU A 92 11.999 -15.301 11.846 1.00 0.35 H new ATOM 1218 N ASN A 93 11.975 -20.034 9.556 1.00 0.27 N ATOM 1219 CA ASN A 93 12.633 -21.366 9.460 1.00 0.29 C ATOM 1220 C ASN A 93 13.982 -21.174 8.761 1.00 0.28 C ATOM 1221 O ASN A 93 14.917 -21.927 8.962 1.00 0.33 O ATOM 1222 CB ASN A 93 11.694 -22.226 8.607 1.00 0.34 C ATOM 1223 CG ASN A 93 11.947 -23.720 8.863 1.00 0.52 C ATOM 1224 OD1 ASN A 93 12.993 -24.104 9.546 1.00 1.12 O flip ATOM 1225 ND2 ASN A 93 11.177 -24.552 8.427 1.00 0.90 N flip ATOM 0 H ASN A 93 11.029 -19.988 9.178 1.00 0.27 H new ATOM 0 HA ASN A 93 12.810 -21.834 10.428 1.00 0.29 H new ATOM 0 HB2 ASN A 93 10.657 -21.982 8.839 1.00 0.34 H new ATOM 0 HB3 ASN A 93 11.845 -22.002 7.551 1.00 0.34 H new ATOM 0 HD21 ASN A 93 10.359 -24.259 7.893 1.00 0.90 H new ATOM 0 HD22 ASN A 93 11.349 -25.543 8.595 1.00 0.90 H new ATOM 1232 N ILE A 94 14.083 -20.137 7.955 1.00 0.24 N ATOM 1233 CA ILE A 94 15.367 -19.847 7.250 1.00 0.25 C ATOM 1234 C ILE A 94 16.307 -19.061 8.171 1.00 0.25 C ATOM 1235 O ILE A 94 17.501 -19.300 8.180 1.00 0.32 O ATOM 1236 CB ILE A 94 15.031 -18.997 6.010 1.00 0.26 C ATOM 1237 CG1 ILE A 94 13.666 -19.404 5.429 1.00 0.30 C ATOM 1238 CG2 ILE A 94 16.132 -19.199 4.958 1.00 0.30 C ATOM 1239 CD1 ILE A 94 13.472 -18.803 4.032 1.00 0.46 C ATOM 0 H ILE A 94 13.327 -19.481 7.759 1.00 0.24 H new ATOM 0 HA ILE A 94 15.862 -20.775 6.964 1.00 0.25 H new ATOM 0 HB ILE A 94 14.978 -17.946 6.295 1.00 0.26 H new ATOM 0 HG12 ILE A 94 13.597 -20.491 5.376 1.00 0.30 H new ATOM 0 HG13 ILE A 94 12.868 -19.066 6.090 1.00 0.30 H new ATOM 0 HG21 ILE A 94 15.905 -18.602 4.075 1.00 0.30 H new ATOM 0 HG22 ILE A 94 17.091 -18.887 5.371 1.00 0.30 H new ATOM 0 HG23 ILE A 94 16.182 -20.252 4.681 1.00 0.30 H new ATOM 0 HD11 ILE A 94 12.501 -19.103 3.639 1.00 0.46 H new ATOM 0 HD12 ILE A 94 13.519 -17.716 4.094 1.00 0.46 H new ATOM 0 HD13 ILE A 94 14.259 -19.163 3.369 1.00 0.46 H new ATOM 1251 N LEU A 95 15.800 -18.113 8.938 1.00 0.23 N ATOM 1252 CA LEU A 95 16.724 -17.331 9.824 1.00 0.25 C ATOM 1253 C LEU A 95 16.775 -17.913 11.244 1.00 0.30 C ATOM 1254 O LEU A 95 17.273 -17.279 12.157 1.00 0.44 O ATOM 1255 CB LEU A 95 16.194 -15.896 9.833 1.00 0.25 C ATOM 1256 CG LEU A 95 14.765 -15.863 10.365 1.00 0.28 C ATOM 1257 CD1 LEU A 95 14.752 -15.257 11.769 1.00 0.41 C ATOM 1258 CD2 LEU A 95 13.904 -15.009 9.430 1.00 0.31 C ATOM 0 H LEU A 95 14.814 -17.855 8.987 1.00 0.23 H new ATOM 0 HA LEU A 95 17.747 -17.373 9.450 1.00 0.25 H new ATOM 0 HB2 LEU A 95 16.835 -15.268 10.453 1.00 0.25 H new ATOM 0 HB3 LEU A 95 16.223 -15.484 8.824 1.00 0.25 H new ATOM 0 HG LEU A 95 14.367 -16.877 10.410 1.00 0.28 H new ATOM 0 HD11 LEU A 95 13.730 -15.235 12.146 1.00 0.41 H new ATOM 0 HD12 LEU A 95 15.370 -15.862 12.432 1.00 0.41 H new ATOM 0 HD13 LEU A 95 15.147 -14.242 11.731 1.00 0.41 H new ATOM 0 HD21 LEU A 95 12.880 -14.980 9.803 1.00 0.31 H new ATOM 0 HD22 LEU A 95 14.305 -13.996 9.390 1.00 0.31 H new ATOM 0 HD23 LEU A 95 13.913 -15.442 8.430 1.00 0.31 H new ATOM 1270 N ASN A 96 16.289 -19.117 11.436 1.00 0.29 N ATOM 1271 CA ASN A 96 16.337 -19.743 12.798 1.00 0.34 C ATOM 1272 C ASN A 96 17.162 -21.035 12.763 1.00 0.36 C ATOM 1273 O ASN A 96 17.413 -21.645 13.785 1.00 0.40 O ATOM 1274 CB ASN A 96 14.887 -20.055 13.164 1.00 0.39 C ATOM 1275 CG ASN A 96 14.283 -18.867 13.915 1.00 0.48 C ATOM 1276 OD1 ASN A 96 13.351 -18.154 13.345 1.00 0.55 O flip ATOM 1277 ND2 ASN A 96 14.663 -18.587 15.034 1.00 0.59 N flip ATOM 0 H ASN A 96 15.862 -19.693 10.710 1.00 0.29 H new ATOM 0 HA ASN A 96 16.804 -19.080 13.526 1.00 0.34 H new ATOM 0 HB2 ASN A 96 14.310 -20.261 12.263 1.00 0.39 H new ATOM 0 HB3 ASN A 96 14.842 -20.951 13.783 1.00 0.39 H new ATOM 0 HD21 ASN A 96 15.392 -19.145 15.480 1.00 0.59 H new ATOM 0 HD22 ASN A 96 14.253 -17.794 15.528 1.00 0.59 H new ATOM 1738 N PRO B 43 12.313 0.693 11.839 1.00 0.33 N ATOM 1739 CA PRO B 43 11.385 -0.312 11.295 1.00 0.33 C ATOM 1740 C PRO B 43 12.129 -1.607 10.949 1.00 0.30 C ATOM 1741 O PRO B 43 11.736 -2.684 11.354 1.00 0.31 O ATOM 1742 CB PRO B 43 10.871 0.355 10.026 1.00 0.38 C ATOM 1743 CG PRO B 43 11.950 1.307 9.606 1.00 0.40 C ATOM 1744 CD PRO B 43 12.880 1.524 10.776 1.00 0.40 C ATOM 0 HA PRO B 43 10.596 -0.592 11.994 1.00 0.33 H new ATOM 0 HB2 PRO B 43 10.674 -0.382 9.248 1.00 0.38 H new ATOM 0 HB3 PRO B 43 9.934 0.881 10.211 1.00 0.38 H new ATOM 0 HG2 PRO B 43 12.500 0.905 8.755 1.00 0.40 H new ATOM 0 HG3 PRO B 43 11.516 2.254 9.286 1.00 0.40 H new ATOM 0 HD2 PRO B 43 13.900 1.224 10.536 1.00 0.40 H new ATOM 0 HD3 PRO B 43 12.917 2.574 11.067 1.00 0.40 H new ATOM 1752 N LEU B 44 13.188 -1.505 10.179 1.00 0.30 N ATOM 1753 CA LEU B 44 13.958 -2.720 9.763 1.00 0.28 C ATOM 1754 C LEU B 44 13.028 -3.681 9.023 1.00 0.27 C ATOM 1755 O LEU B 44 13.183 -4.886 9.077 1.00 0.40 O ATOM 1756 CB LEU B 44 14.486 -3.359 11.051 1.00 0.29 C ATOM 1757 CG LEU B 44 15.605 -4.346 10.695 1.00 0.41 C ATOM 1758 CD1 LEU B 44 16.820 -4.091 11.589 1.00 0.51 C ATOM 1759 CD2 LEU B 44 15.115 -5.783 10.902 1.00 0.54 C ATOM 0 H LEU B 44 13.554 -0.624 9.819 1.00 0.30 H new ATOM 0 HA LEU B 44 14.781 -2.472 9.092 1.00 0.28 H new ATOM 0 HB2 LEU B 44 14.862 -2.590 11.726 1.00 0.29 H new ATOM 0 HB3 LEU B 44 13.680 -3.875 11.573 1.00 0.29 H new ATOM 0 HG LEU B 44 15.885 -4.206 9.651 1.00 0.41 H new ATOM 0 HD11 LEU B 44 17.613 -4.794 11.334 1.00 0.51 H new ATOM 0 HD12 LEU B 44 17.175 -3.072 11.438 1.00 0.51 H new ATOM 0 HD13 LEU B 44 16.538 -4.226 12.633 1.00 0.51 H new ATOM 0 HD21 LEU B 44 15.914 -6.480 10.648 1.00 0.54 H new ATOM 0 HD22 LEU B 44 14.829 -5.923 11.944 1.00 0.54 H new ATOM 0 HD23 LEU B 44 14.253 -5.969 10.261 1.00 0.54 H new ATOM 1771 N LYS B 45 12.061 -3.144 8.329 1.00 0.25 N ATOM 1772 CA LYS B 45 11.102 -4.001 7.572 1.00 0.26 C ATOM 1773 C LYS B 45 11.346 -3.839 6.075 1.00 0.25 C ATOM 1774 O LYS B 45 11.107 -4.739 5.304 1.00 0.29 O ATOM 1775 CB LYS B 45 9.699 -3.490 7.932 1.00 0.32 C ATOM 1776 CG LYS B 45 9.703 -2.833 9.317 1.00 0.38 C ATOM 1777 CD LYS B 45 8.279 -2.415 9.688 1.00 0.41 C ATOM 1778 CE LYS B 45 7.477 -3.648 10.106 1.00 0.51 C ATOM 1779 NZ LYS B 45 6.050 -3.254 9.938 1.00 0.33 N ATOM 0 H LYS B 45 11.893 -2.141 8.253 1.00 0.25 H new ATOM 0 HA LYS B 45 11.217 -5.056 7.822 1.00 0.26 H new ATOM 0 HB2 LYS B 45 9.365 -2.771 7.184 1.00 0.32 H new ATOM 0 HB3 LYS B 45 8.990 -4.318 7.918 1.00 0.32 H new ATOM 0 HG2 LYS B 45 10.094 -3.528 10.060 1.00 0.38 H new ATOM 0 HG3 LYS B 45 10.360 -1.963 9.317 1.00 0.38 H new ATOM 0 HD2 LYS B 45 8.302 -1.690 10.502 1.00 0.41 H new ATOM 0 HD3 LYS B 45 7.799 -1.927 8.840 1.00 0.41 H new ATOM 0 HE2 LYS B 45 7.725 -4.509 9.485 1.00 0.51 H new ATOM 0 HE3 LYS B 45 7.691 -3.927 11.138 1.00 0.51 H new ATOM 0 HZ1 LYS B 45 5.436 -4.050 10.206 1.00 0.33 H new ATOM 0 HZ2 LYS B 45 5.842 -2.436 10.546 1.00 0.33 H new ATOM 0 HZ3 LYS B 45 5.874 -3.001 8.945 1.00 0.33 H new ATOM 1793 N LEU B 46 11.816 -2.690 5.665 1.00 0.25 N ATOM 1794 CA LEU B 46 12.079 -2.447 4.213 1.00 0.25 C ATOM 1795 C LEU B 46 12.963 -3.557 3.625 1.00 0.23 C ATOM 1796 O LEU B 46 12.852 -3.899 2.460 1.00 0.25 O ATOM 1797 CB LEU B 46 12.806 -1.100 4.177 1.00 0.30 C ATOM 1798 CG LEU B 46 11.829 -0.008 3.745 1.00 0.47 C ATOM 1799 CD1 LEU B 46 11.077 0.510 4.971 1.00 0.63 C ATOM 1800 CD2 LEU B 46 12.603 1.142 3.097 1.00 0.76 C ATOM 0 H LEU B 46 12.031 -1.903 6.277 1.00 0.25 H new ATOM 0 HA LEU B 46 11.163 -2.441 3.622 1.00 0.25 H new ATOM 0 HB2 LEU B 46 13.215 -0.869 5.160 1.00 0.30 H new ATOM 0 HB3 LEU B 46 13.646 -1.146 3.485 1.00 0.30 H new ATOM 0 HG LEU B 46 11.119 -0.416 3.026 1.00 0.47 H new ATOM 0 HD11 LEU B 46 10.379 1.290 4.667 1.00 0.63 H new ATOM 0 HD12 LEU B 46 10.527 -0.310 5.434 1.00 0.63 H new ATOM 0 HD13 LEU B 46 11.788 0.920 5.688 1.00 0.63 H new ATOM 0 HD21 LEU B 46 11.906 1.921 2.789 1.00 0.76 H new ATOM 0 HD22 LEU B 46 13.313 1.553 3.815 1.00 0.76 H new ATOM 0 HD23 LEU B 46 13.142 0.772 2.225 1.00 0.76 H new ATOM 1812 N PHE B 47 13.824 -4.129 4.430 1.00 0.23 N ATOM 1813 CA PHE B 47 14.713 -5.221 3.936 1.00 0.22 C ATOM 1814 C PHE B 47 13.934 -6.532 3.907 1.00 0.21 C ATOM 1815 O PHE B 47 14.013 -7.297 2.964 1.00 0.24 O ATOM 1816 CB PHE B 47 15.860 -5.279 4.957 1.00 0.25 C ATOM 1817 CG PHE B 47 16.584 -6.608 4.877 1.00 0.25 C ATOM 1818 CD1 PHE B 47 16.884 -7.181 3.633 1.00 0.30 C ATOM 1819 CD2 PHE B 47 16.959 -7.265 6.056 1.00 0.30 C ATOM 1820 CE1 PHE B 47 17.556 -8.408 3.571 1.00 0.39 C ATOM 1821 CE2 PHE B 47 17.631 -8.490 5.993 1.00 0.38 C ATOM 1822 CZ PHE B 47 17.930 -9.062 4.751 1.00 0.42 C ATOM 0 H PHE B 47 13.948 -3.884 5.412 1.00 0.23 H new ATOM 0 HA PHE B 47 15.085 -5.050 2.926 1.00 0.22 H new ATOM 0 HB2 PHE B 47 16.561 -4.466 4.770 1.00 0.25 H new ATOM 0 HB3 PHE B 47 15.465 -5.134 5.963 1.00 0.25 H new ATOM 0 HD1 PHE B 47 16.597 -6.676 2.723 1.00 0.30 H new ATOM 0 HD2 PHE B 47 16.729 -6.825 7.015 1.00 0.30 H new ATOM 0 HE1 PHE B 47 17.786 -8.850 2.613 1.00 0.39 H new ATOM 0 HE2 PHE B 47 17.919 -8.995 6.903 1.00 0.38 H new ATOM 0 HZ PHE B 47 18.449 -10.008 4.703 1.00 0.42 H new ATOM 1832 N MET B 48 13.179 -6.785 4.937 1.00 0.23 N ATOM 1833 CA MET B 48 12.379 -8.037 4.994 1.00 0.25 C ATOM 1834 C MET B 48 11.257 -7.986 3.957 1.00 0.24 C ATOM 1835 O MET B 48 11.004 -8.945 3.260 1.00 0.28 O ATOM 1836 CB MET B 48 11.802 -8.068 6.409 1.00 0.33 C ATOM 1837 CG MET B 48 12.062 -9.437 7.032 1.00 0.47 C ATOM 1838 SD MET B 48 13.299 -9.292 8.345 1.00 0.46 S ATOM 1839 CE MET B 48 14.621 -8.600 7.323 1.00 0.42 C ATOM 0 H MET B 48 13.081 -6.174 5.748 1.00 0.23 H new ATOM 0 HA MET B 48 12.974 -8.924 4.777 1.00 0.25 H new ATOM 0 HB2 MET B 48 12.258 -7.287 7.017 1.00 0.33 H new ATOM 0 HB3 MET B 48 10.731 -7.866 6.382 1.00 0.33 H new ATOM 0 HG2 MET B 48 11.135 -9.844 7.437 1.00 0.47 H new ATOM 0 HG3 MET B 48 12.409 -10.133 6.269 1.00 0.47 H new ATOM 0 HE1 MET B 48 15.579 -8.736 7.825 1.00 0.42 H new ATOM 0 HE2 MET B 48 14.641 -9.110 6.360 1.00 0.42 H new ATOM 0 HE3 MET B 48 14.441 -7.536 7.167 1.00 0.42 H new ATOM 1849 N ALA B 49 10.590 -6.868 3.858 1.00 0.26 N ATOM 1850 CA ALA B 49 9.477 -6.724 2.875 1.00 0.29 C ATOM 1851 C ALA B 49 10.002 -6.898 1.450 1.00 0.26 C ATOM 1852 O ALA B 49 9.440 -7.637 0.663 1.00 0.31 O ATOM 1853 CB ALA B 49 8.946 -5.305 3.081 1.00 0.36 C ATOM 0 H ALA B 49 10.771 -6.038 4.423 1.00 0.26 H new ATOM 0 HA ALA B 49 8.700 -7.475 3.020 1.00 0.29 H new ATOM 0 HB1 ALA B 49 8.122 -5.121 2.392 1.00 0.36 H new ATOM 0 HB2 ALA B 49 8.593 -5.194 4.106 1.00 0.36 H new ATOM 0 HB3 ALA B 49 9.744 -4.587 2.892 1.00 0.36 H new ATOM 1859 N LEU B 50 11.073 -6.223 1.108 1.00 0.26 N ATOM 1860 CA LEU B 50 11.625 -6.356 -0.274 1.00 0.28 C ATOM 1861 C LEU B 50 11.978 -7.819 -0.565 1.00 0.27 C ATOM 1862 O LEU B 50 11.494 -8.403 -1.521 1.00 0.31 O ATOM 1863 CB LEU B 50 12.880 -5.483 -0.293 1.00 0.31 C ATOM 1864 CG LEU B 50 13.274 -5.188 -1.741 1.00 0.42 C ATOM 1865 CD1 LEU B 50 12.157 -4.398 -2.428 1.00 0.74 C ATOM 1866 CD2 LEU B 50 14.562 -4.364 -1.755 1.00 0.55 C ATOM 0 H LEU B 50 11.585 -5.590 1.723 1.00 0.26 H new ATOM 0 HA LEU B 50 10.908 -6.046 -1.034 1.00 0.28 H new ATOM 0 HB2 LEU B 50 12.696 -4.551 0.242 1.00 0.31 H new ATOM 0 HB3 LEU B 50 13.696 -5.990 0.221 1.00 0.31 H new ATOM 0 HG LEU B 50 13.432 -6.126 -2.273 1.00 0.42 H new ATOM 0 HD11 LEU B 50 12.440 -4.189 -3.460 1.00 0.74 H new ATOM 0 HD12 LEU B 50 11.237 -4.983 -2.416 1.00 0.74 H new ATOM 0 HD13 LEU B 50 11.997 -3.459 -1.899 1.00 0.74 H new ATOM 0 HD21 LEU B 50 14.847 -4.151 -2.785 1.00 0.55 H new ATOM 0 HD22 LEU B 50 14.400 -3.427 -1.222 1.00 0.55 H new ATOM 0 HD23 LEU B 50 15.359 -4.926 -1.267 1.00 0.55 H new ATOM 1878 N VAL B 51 12.808 -8.418 0.253 1.00 0.27 N ATOM 1879 CA VAL B 51 13.182 -9.839 0.028 1.00 0.30 C ATOM 1880 C VAL B 51 11.939 -10.724 0.146 1.00 0.29 C ATOM 1881 O VAL B 51 11.825 -11.732 -0.520 1.00 0.34 O ATOM 1882 CB VAL B 51 14.198 -10.160 1.125 1.00 0.34 C ATOM 1883 CG1 VAL B 51 14.636 -11.613 0.999 1.00 0.44 C ATOM 1884 CG2 VAL B 51 15.416 -9.249 0.969 1.00 0.42 C ATOM 0 H VAL B 51 13.240 -7.980 1.066 1.00 0.27 H new ATOM 0 HA VAL B 51 13.601 -10.015 -0.963 1.00 0.30 H new ATOM 0 HB VAL B 51 13.743 -9.999 2.102 1.00 0.34 H new ATOM 0 HG11 VAL B 51 15.360 -11.844 1.780 1.00 0.44 H new ATOM 0 HG12 VAL B 51 13.769 -12.265 1.104 1.00 0.44 H new ATOM 0 HG13 VAL B 51 15.093 -11.772 0.022 1.00 0.44 H new ATOM 0 HG21 VAL B 51 16.142 -9.475 1.750 1.00 0.42 H new ATOM 0 HG22 VAL B 51 15.870 -9.413 -0.008 1.00 0.42 H new ATOM 0 HG23 VAL B 51 15.105 -8.208 1.054 1.00 0.42 H new ATOM 1894 N ALA B 52 11.000 -10.344 0.980 1.00 0.28 N ATOM 1895 CA ALA B 52 9.755 -11.157 1.130 1.00 0.30 C ATOM 1896 C ALA B 52 8.974 -11.135 -0.179 1.00 0.31 C ATOM 1897 O ALA B 52 8.607 -12.167 -0.708 1.00 0.35 O ATOM 1898 CB ALA B 52 8.952 -10.479 2.240 1.00 0.32 C ATOM 0 H ALA B 52 11.043 -9.507 1.562 1.00 0.28 H new ATOM 0 HA ALA B 52 9.968 -12.198 1.372 1.00 0.30 H new ATOM 0 HB1 ALA B 52 8.023 -11.025 2.403 1.00 0.32 H new ATOM 0 HB2 ALA B 52 9.536 -10.474 3.160 1.00 0.32 H new ATOM 0 HB3 ALA B 52 8.724 -9.454 1.950 1.00 0.32 H new ATOM 1904 N PHE B 53 8.738 -9.959 -0.712 1.00 0.30 N ATOM 1905 CA PHE B 53 8.001 -9.847 -2.007 1.00 0.32 C ATOM 1906 C PHE B 53 8.645 -10.795 -3.023 1.00 0.32 C ATOM 1907 O PHE B 53 8.001 -11.670 -3.588 1.00 0.34 O ATOM 1908 CB PHE B 53 8.184 -8.385 -2.425 1.00 0.35 C ATOM 1909 CG PHE B 53 7.598 -8.170 -3.796 1.00 0.38 C ATOM 1910 CD1 PHE B 53 6.242 -8.421 -4.022 1.00 0.54 C ATOM 1911 CD2 PHE B 53 8.413 -7.724 -4.841 1.00 0.56 C ATOM 1912 CE1 PHE B 53 5.698 -8.225 -5.295 1.00 0.59 C ATOM 1913 CE2 PHE B 53 7.872 -7.529 -6.115 1.00 0.61 C ATOM 1914 CZ PHE B 53 6.515 -7.779 -6.343 1.00 0.51 C ATOM 0 H PHE B 53 9.026 -9.070 -0.303 1.00 0.30 H new ATOM 0 HA PHE B 53 6.946 -10.113 -1.936 1.00 0.32 H new ATOM 0 HB2 PHE B 53 7.698 -7.727 -1.704 1.00 0.35 H new ATOM 0 HB3 PHE B 53 9.243 -8.128 -2.428 1.00 0.35 H new ATOM 0 HD1 PHE B 53 5.614 -8.766 -3.214 1.00 0.54 H new ATOM 0 HD2 PHE B 53 9.461 -7.530 -4.664 1.00 0.56 H new ATOM 0 HE1 PHE B 53 4.650 -8.417 -5.471 1.00 0.59 H new ATOM 0 HE2 PHE B 53 8.501 -7.186 -6.923 1.00 0.61 H new ATOM 0 HZ PHE B 53 6.096 -7.628 -7.327 1.00 0.51 H new ATOM 1924 N LEU B 54 9.927 -10.651 -3.221 1.00 0.32 N ATOM 1925 CA LEU B 54 10.638 -11.557 -4.159 1.00 0.35 C ATOM 1926 C LEU B 54 10.494 -12.997 -3.658 1.00 0.33 C ATOM 1927 O LEU B 54 10.354 -13.921 -4.433 1.00 0.35 O ATOM 1928 CB LEU B 54 12.098 -11.099 -4.120 1.00 0.39 C ATOM 1929 CG LEU B 54 12.367 -10.122 -5.271 1.00 0.44 C ATOM 1930 CD1 LEU B 54 12.097 -10.812 -6.614 1.00 0.56 C ATOM 1931 CD2 LEU B 54 11.452 -8.902 -5.128 1.00 0.54 C ATOM 0 H LEU B 54 10.510 -9.944 -2.773 1.00 0.32 H new ATOM 0 HA LEU B 54 10.245 -11.525 -5.175 1.00 0.35 H new ATOM 0 HB2 LEU B 54 12.313 -10.619 -3.165 1.00 0.39 H new ATOM 0 HB3 LEU B 54 12.761 -11.960 -4.200 1.00 0.39 H new ATOM 0 HG LEU B 54 13.409 -9.803 -5.236 1.00 0.44 H new ATOM 0 HD11 LEU B 54 12.290 -10.113 -7.428 1.00 0.56 H new ATOM 0 HD12 LEU B 54 12.752 -11.677 -6.716 1.00 0.56 H new ATOM 0 HD13 LEU B 54 11.057 -11.137 -6.654 1.00 0.56 H new ATOM 0 HD21 LEU B 54 11.642 -8.207 -5.946 1.00 0.54 H new ATOM 0 HD22 LEU B 54 10.411 -9.223 -5.159 1.00 0.54 H new ATOM 0 HD23 LEU B 54 11.651 -8.407 -4.177 1.00 0.54 H new ATOM 1943 N ARG B 55 10.505 -13.180 -2.358 1.00 0.32 N ATOM 1944 CA ARG B 55 10.351 -14.551 -1.781 1.00 0.32 C ATOM 1945 C ARG B 55 8.899 -15.028 -1.905 1.00 0.30 C ATOM 1946 O ARG B 55 8.579 -16.155 -1.574 1.00 0.34 O ATOM 1947 CB ARG B 55 10.747 -14.419 -0.309 1.00 0.34 C ATOM 1948 CG ARG B 55 10.835 -15.811 0.325 1.00 0.34 C ATOM 1949 CD ARG B 55 9.624 -16.044 1.232 1.00 0.35 C ATOM 1950 NE ARG B 55 9.631 -17.507 1.508 1.00 0.30 N ATOM 1951 CZ ARG B 55 8.572 -18.225 1.250 1.00 0.30 C ATOM 1952 NH1 ARG B 55 8.078 -18.249 0.042 1.00 0.33 N ATOM 1953 NH2 ARG B 55 8.008 -18.921 2.199 1.00 0.35 N ATOM 0 H ARG B 55 10.615 -12.434 -1.671 1.00 0.32 H new ATOM 0 HA ARG B 55 10.969 -15.281 -2.304 1.00 0.32 H new ATOM 0 HB2 ARG B 55 11.706 -13.908 -0.224 1.00 0.34 H new ATOM 0 HB3 ARG B 55 10.014 -13.812 0.222 1.00 0.34 H new ATOM 0 HG2 ARG B 55 10.871 -16.574 -0.453 1.00 0.34 H new ATOM 0 HG3 ARG B 55 11.756 -15.901 0.902 1.00 0.34 H new ATOM 0 HD2 ARG B 55 9.703 -15.467 2.154 1.00 0.35 H new ATOM 0 HD3 ARG B 55 8.699 -15.738 0.743 1.00 0.35 H new ATOM 0 HE ARG B 55 10.463 -17.948 1.899 1.00 0.30 H new ATOM 0 HH11 ARG B 55 8.520 -17.707 -0.700 1.00 0.33 H new ATOM 0 HH12 ARG B 55 7.250 -18.810 -0.160 1.00 0.33 H new ATOM 0 HH21 ARG B 55 8.395 -18.904 3.143 1.00 0.35 H new ATOM 0 HH22 ARG B 55 7.180 -19.482 1.997 1.00 0.35 H new ATOM 1967 N PHE B 56 8.017 -14.184 -2.375 1.00 0.30 N ATOM 1968 CA PHE B 56 6.592 -14.597 -2.519 1.00 0.30 C ATOM 1969 C PHE B 56 6.283 -14.953 -3.975 1.00 0.31 C ATOM 1970 O PHE B 56 5.347 -15.681 -4.250 1.00 0.34 O ATOM 1971 CB PHE B 56 5.771 -13.376 -2.099 1.00 0.33 C ATOM 1972 CG PHE B 56 5.913 -13.100 -0.612 1.00 0.32 C ATOM 1973 CD1 PHE B 56 6.647 -13.959 0.226 1.00 0.37 C ATOM 1974 CD2 PHE B 56 5.295 -11.966 -0.074 1.00 0.41 C ATOM 1975 CE1 PHE B 56 6.758 -13.676 1.592 1.00 0.40 C ATOM 1976 CE2 PHE B 56 5.407 -11.686 1.293 1.00 0.49 C ATOM 1977 CZ PHE B 56 6.138 -12.540 2.125 1.00 0.44 C ATOM 0 H PHE B 56 8.223 -13.228 -2.665 1.00 0.30 H new ATOM 0 HA PHE B 56 6.365 -15.475 -1.914 1.00 0.30 H new ATOM 0 HB2 PHE B 56 6.097 -12.504 -2.666 1.00 0.33 H new ATOM 0 HB3 PHE B 56 4.721 -13.540 -2.342 1.00 0.33 H new ATOM 0 HD1 PHE B 56 7.125 -14.836 -0.185 1.00 0.37 H new ATOM 0 HD2 PHE B 56 4.730 -11.305 -0.715 1.00 0.41 H new ATOM 0 HE1 PHE B 56 7.322 -14.335 2.235 1.00 0.40 H new ATOM 0 HE2 PHE B 56 4.929 -10.810 1.705 1.00 0.49 H new ATOM 0 HZ PHE B 56 6.224 -12.323 3.179 1.00 0.44 H new ATOM 1987 N LEU B 57 7.039 -14.428 -4.912 1.00 0.32 N ATOM 1988 CA LEU B 57 6.744 -14.729 -6.351 1.00 0.35 C ATOM 1989 C LEU B 57 7.723 -15.755 -6.948 1.00 0.37 C ATOM 1990 O LEU B 57 7.312 -16.666 -7.641 1.00 0.42 O ATOM 1991 CB LEU B 57 6.872 -13.390 -7.084 1.00 0.39 C ATOM 1992 CG LEU B 57 6.209 -12.267 -6.274 1.00 0.40 C ATOM 1993 CD1 LEU B 57 6.201 -10.979 -7.100 1.00 0.50 C ATOM 1994 CD2 LEU B 57 4.766 -12.655 -5.921 1.00 0.45 C ATOM 0 H LEU B 57 7.836 -13.813 -4.747 1.00 0.32 H new ATOM 0 HA LEU B 57 5.752 -15.170 -6.452 1.00 0.35 H new ATOM 0 HB2 LEU B 57 7.924 -13.157 -7.246 1.00 0.39 H new ATOM 0 HB3 LEU B 57 6.406 -13.461 -8.067 1.00 0.39 H new ATOM 0 HG LEU B 57 6.773 -12.111 -5.354 1.00 0.40 H new ATOM 0 HD11 LEU B 57 5.730 -10.181 -6.525 1.00 0.50 H new ATOM 0 HD12 LEU B 57 7.225 -10.696 -7.342 1.00 0.50 H new ATOM 0 HD13 LEU B 57 5.642 -11.141 -8.021 1.00 0.50 H new ATOM 0 HD21 LEU B 57 4.304 -11.852 -5.346 1.00 0.45 H new ATOM 0 HD22 LEU B 57 4.199 -12.819 -6.837 1.00 0.45 H new ATOM 0 HD23 LEU B 57 4.770 -13.570 -5.328 1.00 0.45 H new ATOM 2006 N THR B 58 9.007 -15.608 -6.716 1.00 0.38 N ATOM 2007 CA THR B 58 9.988 -16.575 -7.311 1.00 0.42 C ATOM 2008 C THR B 58 11.120 -16.911 -6.327 1.00 0.40 C ATOM 2009 O THR B 58 11.926 -17.788 -6.577 1.00 0.45 O ATOM 2010 CB THR B 58 10.538 -15.846 -8.539 1.00 0.48 C ATOM 2011 OG1 THR B 58 9.495 -15.665 -9.486 1.00 0.55 O ATOM 2012 CG2 THR B 58 11.660 -16.670 -9.168 1.00 0.62 C ATOM 0 H THR B 58 9.416 -14.868 -6.146 1.00 0.38 H new ATOM 0 HA THR B 58 9.521 -17.528 -7.559 1.00 0.42 H new ATOM 0 HB THR B 58 10.931 -14.875 -8.237 1.00 0.48 H new ATOM 0 HG1 THR B 58 9.845 -15.197 -10.273 1.00 0.55 H new ATOM 0 HG21 THR B 58 12.049 -16.148 -10.042 1.00 0.62 H new ATOM 0 HG22 THR B 58 12.461 -16.808 -8.442 1.00 0.62 H new ATOM 0 HG23 THR B 58 11.272 -17.643 -9.470 1.00 0.62 H new ATOM 2020 N ILE B 59 11.177 -16.226 -5.216 1.00 0.35 N ATOM 2021 CA ILE B 59 12.235 -16.488 -4.197 1.00 0.33 C ATOM 2022 C ILE B 59 13.649 -16.449 -4.807 1.00 0.34 C ATOM 2023 O ILE B 59 14.408 -17.389 -4.670 1.00 0.39 O ATOM 2024 CB ILE B 59 11.910 -17.873 -3.638 1.00 0.36 C ATOM 2025 CG1 ILE B 59 10.499 -17.866 -3.043 1.00 0.35 C ATOM 2026 CG2 ILE B 59 12.918 -18.223 -2.538 1.00 0.40 C ATOM 2027 CD1 ILE B 59 9.480 -18.307 -4.097 1.00 0.38 C ATOM 0 H ILE B 59 10.524 -15.483 -4.968 1.00 0.35 H new ATOM 0 HA ILE B 59 12.239 -15.722 -3.422 1.00 0.33 H new ATOM 0 HB ILE B 59 11.965 -18.611 -4.439 1.00 0.36 H new ATOM 0 HG12 ILE B 59 10.456 -18.534 -2.183 1.00 0.35 H new ATOM 0 HG13 ILE B 59 10.253 -16.867 -2.684 1.00 0.35 H new ATOM 0 HG21 ILE B 59 12.690 -19.210 -2.136 1.00 0.40 H new ATOM 0 HG22 ILE B 59 13.925 -18.225 -2.955 1.00 0.40 H new ATOM 0 HG23 ILE B 59 12.857 -17.483 -1.740 1.00 0.40 H new ATOM 0 HD11 ILE B 59 8.480 -18.298 -3.663 1.00 0.38 H new ATOM 0 HD12 ILE B 59 9.514 -17.622 -4.944 1.00 0.38 H new ATOM 0 HD13 ILE B 59 9.720 -19.315 -4.435 1.00 0.38 H new ATOM 2039 N PRO B 60 13.970 -15.346 -5.441 1.00 0.34 N ATOM 2040 CA PRO B 60 15.305 -15.143 -6.027 1.00 0.36 C ATOM 2041 C PRO B 60 16.119 -14.189 -5.122 1.00 0.33 C ATOM 2042 O PRO B 60 16.365 -13.057 -5.499 1.00 0.36 O ATOM 2043 CB PRO B 60 14.958 -14.447 -7.343 1.00 0.42 C ATOM 2044 CG PRO B 60 13.632 -13.762 -7.094 1.00 0.42 C ATOM 2045 CD PRO B 60 13.138 -14.189 -5.726 1.00 0.36 C ATOM 0 HA PRO B 60 15.896 -16.051 -6.146 1.00 0.36 H new ATOM 0 HB2 PRO B 60 15.727 -13.726 -7.622 1.00 0.42 H new ATOM 0 HB3 PRO B 60 14.883 -15.165 -8.160 1.00 0.42 H new ATOM 0 HG2 PRO B 60 13.748 -12.679 -7.137 1.00 0.42 H new ATOM 0 HG3 PRO B 60 12.910 -14.036 -7.863 1.00 0.42 H new ATOM 0 HD2 PRO B 60 13.268 -13.402 -4.983 1.00 0.36 H new ATOM 0 HD3 PRO B 60 12.078 -14.444 -5.738 1.00 0.36 H new ATOM 2053 N PRO B 61 16.496 -14.650 -3.946 1.00 0.32 N ATOM 2054 CA PRO B 61 17.256 -13.780 -3.012 1.00 0.30 C ATOM 2055 C PRO B 61 18.648 -13.473 -3.564 1.00 0.31 C ATOM 2056 O PRO B 61 19.409 -14.367 -3.886 1.00 0.39 O ATOM 2057 CB PRO B 61 17.344 -14.604 -1.732 1.00 0.32 C ATOM 2058 CG PRO B 61 17.195 -16.015 -2.181 1.00 0.36 C ATOM 2059 CD PRO B 61 16.276 -15.984 -3.376 1.00 0.35 C ATOM 0 HA PRO B 61 16.779 -12.813 -2.855 1.00 0.30 H new ATOM 0 HB2 PRO B 61 18.296 -14.448 -1.225 1.00 0.32 H new ATOM 0 HB3 PRO B 61 16.559 -14.327 -1.028 1.00 0.32 H new ATOM 0 HG2 PRO B 61 18.162 -16.443 -2.445 1.00 0.36 H new ATOM 0 HG3 PRO B 61 16.779 -16.634 -1.386 1.00 0.36 H new ATOM 0 HD2 PRO B 61 16.520 -16.770 -4.090 1.00 0.35 H new ATOM 0 HD3 PRO B 61 15.236 -16.129 -3.085 1.00 0.35 H new ATOM 2067 N THR B 62 18.985 -12.213 -3.669 1.00 0.32 N ATOM 2068 CA THR B 62 20.331 -11.834 -4.194 1.00 0.36 C ATOM 2069 C THR B 62 21.421 -12.439 -3.297 1.00 0.34 C ATOM 2070 O THR B 62 21.159 -12.843 -2.181 1.00 0.33 O ATOM 2071 CB THR B 62 20.339 -10.290 -4.180 1.00 0.39 C ATOM 2072 OG1 THR B 62 20.431 -9.814 -5.516 1.00 0.49 O ATOM 2073 CG2 THR B 62 21.523 -9.745 -3.374 1.00 0.39 C ATOM 0 H THR B 62 18.385 -11.429 -3.413 1.00 0.32 H new ATOM 0 HA THR B 62 20.529 -12.209 -5.198 1.00 0.36 H new ATOM 0 HB THR B 62 19.417 -9.947 -3.711 1.00 0.39 H new ATOM 0 HG1 THR B 62 20.435 -8.834 -5.515 1.00 0.49 H new ATOM 0 HG21 THR B 62 21.499 -8.655 -3.384 1.00 0.39 H new ATOM 0 HG22 THR B 62 21.457 -10.100 -2.345 1.00 0.39 H new ATOM 0 HG23 THR B 62 22.456 -10.092 -3.818 1.00 0.39 H new ATOM 2081 N ALA B 63 22.634 -12.511 -3.789 1.00 0.39 N ATOM 2082 CA ALA B 63 23.756 -13.098 -2.989 1.00 0.42 C ATOM 2083 C ALA B 63 23.836 -12.465 -1.594 1.00 0.39 C ATOM 2084 O ALA B 63 23.973 -13.154 -0.600 1.00 0.41 O ATOM 2085 CB ALA B 63 25.018 -12.777 -3.790 1.00 0.50 C ATOM 0 H ALA B 63 22.898 -12.185 -4.719 1.00 0.39 H new ATOM 0 HA ALA B 63 23.620 -14.168 -2.832 1.00 0.42 H new ATOM 0 HB1 ALA B 63 25.890 -13.174 -3.270 1.00 0.50 H new ATOM 0 HB2 ALA B 63 24.947 -13.231 -4.778 1.00 0.50 H new ATOM 0 HB3 ALA B 63 25.118 -11.697 -3.893 1.00 0.50 H new ATOM 2091 N GLY B 64 23.766 -11.161 -1.518 1.00 0.39 N ATOM 2092 CA GLY B 64 23.852 -10.469 -0.197 1.00 0.39 C ATOM 2093 C GLY B 64 22.776 -10.988 0.760 1.00 0.34 C ATOM 2094 O GLY B 64 23.044 -11.231 1.917 1.00 0.36 O ATOM 0 H GLY B 64 23.652 -10.542 -2.320 1.00 0.39 H new ATOM 0 HA2 GLY B 64 24.839 -10.627 0.238 1.00 0.39 H new ATOM 0 HA3 GLY B 64 23.734 -9.394 -0.336 1.00 0.39 H new ATOM 2098 N ILE B 65 21.565 -11.147 0.291 1.00 0.31 N ATOM 2099 CA ILE B 65 20.461 -11.641 1.179 1.00 0.28 C ATOM 2100 C ILE B 65 20.904 -12.899 1.928 1.00 0.28 C ATOM 2101 O ILE B 65 20.508 -13.128 3.054 1.00 0.31 O ATOM 2102 CB ILE B 65 19.283 -11.969 0.244 1.00 0.27 C ATOM 2103 CG1 ILE B 65 18.954 -10.768 -0.662 1.00 0.31 C ATOM 2104 CG2 ILE B 65 18.045 -12.330 1.075 1.00 0.30 C ATOM 2105 CD1 ILE B 65 18.777 -9.495 0.172 1.00 0.33 C ATOM 0 H ILE B 65 21.289 -10.956 -0.672 1.00 0.31 H new ATOM 0 HA ILE B 65 20.187 -10.897 1.927 1.00 0.28 H new ATOM 0 HB ILE B 65 19.568 -12.815 -0.382 1.00 0.27 H new ATOM 0 HG12 ILE B 65 19.753 -10.625 -1.389 1.00 0.31 H new ATOM 0 HG13 ILE B 65 18.043 -10.970 -1.225 1.00 0.31 H new ATOM 0 HG21 ILE B 65 17.214 -12.561 0.408 1.00 0.30 H new ATOM 0 HG22 ILE B 65 18.264 -13.198 1.696 1.00 0.30 H new ATOM 0 HG23 ILE B 65 17.776 -11.487 1.712 1.00 0.30 H new ATOM 0 HD11 ILE B 65 18.545 -8.658 -0.487 1.00 0.33 H new ATOM 0 HD12 ILE B 65 17.961 -9.635 0.881 1.00 0.33 H new ATOM 0 HD13 ILE B 65 19.698 -9.285 0.715 1.00 0.33 H new ATOM 2117 N LEU B 66 21.722 -13.711 1.310 1.00 0.30 N ATOM 2118 CA LEU B 66 22.189 -14.958 1.983 1.00 0.33 C ATOM 2119 C LEU B 66 23.370 -14.645 2.904 1.00 0.33 C ATOM 2120 O LEU B 66 23.348 -14.953 4.081 1.00 0.37 O ATOM 2121 CB LEU B 66 22.628 -15.896 0.850 1.00 0.41 C ATOM 2122 CG LEU B 66 21.411 -16.542 0.167 1.00 0.42 C ATOM 2123 CD1 LEU B 66 20.663 -17.445 1.153 1.00 0.54 C ATOM 2124 CD2 LEU B 66 20.465 -15.454 -0.353 1.00 0.41 C ATOM 0 H LEU B 66 22.086 -13.564 0.369 1.00 0.30 H new ATOM 0 HA LEU B 66 21.409 -15.407 2.598 1.00 0.33 H new ATOM 0 HB2 LEU B 66 23.208 -15.338 0.115 1.00 0.41 H new ATOM 0 HB3 LEU B 66 23.281 -16.673 1.248 1.00 0.41 H new ATOM 0 HG LEU B 66 21.762 -17.146 -0.670 1.00 0.42 H new ATOM 0 HD11 LEU B 66 19.804 -17.895 0.655 1.00 0.54 H new ATOM 0 HD12 LEU B 66 21.331 -18.231 1.505 1.00 0.54 H new ATOM 0 HD13 LEU B 66 20.321 -16.852 2.001 1.00 0.54 H new ATOM 0 HD21 LEU B 66 19.605 -15.919 -0.835 1.00 0.41 H new ATOM 0 HD22 LEU B 66 20.125 -14.839 0.480 1.00 0.41 H new ATOM 0 HD23 LEU B 66 20.991 -14.829 -1.074 1.00 0.41 H new ATOM 2136 N LYS B 67 24.399 -14.033 2.373 1.00 0.32 N ATOM 2137 CA LYS B 67 25.589 -13.692 3.210 1.00 0.34 C ATOM 2138 C LYS B 67 25.169 -12.804 4.383 1.00 0.30 C ATOM 2139 O LYS B 67 25.774 -12.827 5.439 1.00 0.34 O ATOM 2140 CB LYS B 67 26.530 -12.933 2.274 1.00 0.39 C ATOM 2141 CG LYS B 67 27.279 -13.928 1.386 1.00 0.45 C ATOM 2142 CD LYS B 67 28.334 -14.663 2.218 1.00 0.53 C ATOM 2143 CE LYS B 67 29.391 -13.667 2.705 1.00 0.65 C ATOM 2144 NZ LYS B 67 29.347 -13.755 4.192 1.00 0.81 N ATOM 0 H LYS B 67 24.466 -13.755 1.394 1.00 0.32 H new ATOM 0 HA LYS B 67 26.064 -14.577 3.633 1.00 0.34 H new ATOM 0 HB2 LYS B 67 25.963 -12.235 1.658 1.00 0.39 H new ATOM 0 HB3 LYS B 67 27.239 -12.342 2.854 1.00 0.39 H new ATOM 0 HG2 LYS B 67 26.580 -14.643 0.953 1.00 0.45 H new ATOM 0 HG3 LYS B 67 27.755 -13.405 0.557 1.00 0.45 H new ATOM 0 HD2 LYS B 67 27.863 -15.154 3.070 1.00 0.53 H new ATOM 0 HD3 LYS B 67 28.804 -15.444 1.620 1.00 0.53 H new ATOM 0 HE2 LYS B 67 30.380 -13.922 2.324 1.00 0.65 H new ATOM 0 HE3 LYS B 67 29.169 -12.656 2.363 1.00 0.65 H new ATOM 0 HZ1 LYS B 67 30.045 -13.100 4.599 1.00 0.81 H new ATOM 0 HZ2 LYS B 67 28.396 -13.500 4.527 1.00 0.81 H new ATOM 0 HZ3 LYS B 67 29.569 -14.727 4.489 1.00 0.81 H new ATOM 2158 N ARG B 68 24.133 -12.027 4.202 1.00 0.26 N ATOM 2159 CA ARG B 68 23.658 -11.135 5.296 1.00 0.25 C ATOM 2160 C ARG B 68 22.694 -11.904 6.211 1.00 0.23 C ATOM 2161 O ARG B 68 22.591 -11.630 7.390 1.00 0.29 O ATOM 2162 CB ARG B 68 22.968 -9.959 4.581 1.00 0.27 C ATOM 2163 CG ARG B 68 21.478 -10.242 4.368 1.00 0.26 C ATOM 2164 CD ARG B 68 20.867 -9.128 3.511 1.00 0.30 C ATOM 2165 NE ARG B 68 20.831 -7.933 4.401 1.00 0.29 N ATOM 2166 CZ ARG B 68 21.869 -7.144 4.479 1.00 0.32 C ATOM 2167 NH1 ARG B 68 22.496 -6.778 3.394 1.00 0.42 N ATOM 2168 NH2 ARG B 68 22.278 -6.719 5.643 1.00 0.42 N ATOM 0 H ARG B 68 23.594 -11.973 3.338 1.00 0.26 H new ATOM 0 HA ARG B 68 24.463 -10.778 5.938 1.00 0.25 H new ATOM 0 HB2 ARG B 68 23.088 -9.050 5.170 1.00 0.27 H new ATOM 0 HB3 ARG B 68 23.449 -9.781 3.619 1.00 0.27 H new ATOM 0 HG2 ARG B 68 21.346 -11.207 3.878 1.00 0.26 H new ATOM 0 HG3 ARG B 68 20.966 -10.299 5.329 1.00 0.26 H new ATOM 0 HD2 ARG B 68 21.468 -8.940 2.621 1.00 0.30 H new ATOM 0 HD3 ARG B 68 19.867 -9.396 3.169 1.00 0.30 H new ATOM 0 HE ARG B 68 19.995 -7.731 4.950 1.00 0.29 H new ATOM 0 HH11 ARG B 68 22.175 -7.108 2.484 1.00 0.42 H new ATOM 0 HH12 ARG B 68 23.306 -6.162 3.457 1.00 0.42 H new ATOM 0 HH21 ARG B 68 21.787 -7.003 6.491 1.00 0.42 H new ATOM 0 HH22 ARG B 68 23.089 -6.103 5.705 1.00 0.42 H new ATOM 2182 N TRP B 69 21.996 -12.867 5.661 1.00 0.22 N ATOM 2183 CA TRP B 69 21.028 -13.685 6.462 1.00 0.22 C ATOM 2184 C TRP B 69 21.660 -14.214 7.758 1.00 0.25 C ATOM 2185 O TRP B 69 20.983 -14.383 8.754 1.00 0.29 O ATOM 2186 CB TRP B 69 20.697 -14.861 5.550 1.00 0.23 C ATOM 2187 CG TRP B 69 19.314 -15.357 5.812 1.00 0.22 C ATOM 2188 CD1 TRP B 69 19.012 -16.628 6.157 1.00 0.24 C ATOM 2189 CD2 TRP B 69 18.045 -14.637 5.744 1.00 0.22 C ATOM 2190 NE1 TRP B 69 17.645 -16.740 6.302 1.00 0.25 N ATOM 2191 CE2 TRP B 69 17.004 -15.545 6.058 1.00 0.23 C ATOM 2192 CE3 TRP B 69 17.691 -13.305 5.444 1.00 0.25 C ATOM 2193 CZ2 TRP B 69 15.669 -15.150 6.072 1.00 0.26 C ATOM 2194 CZ3 TRP B 69 16.346 -12.910 5.459 1.00 0.28 C ATOM 2195 CH2 TRP B 69 15.341 -13.833 5.770 1.00 0.28 C ATOM 0 H TRP B 69 22.056 -13.126 4.676 1.00 0.22 H new ATOM 0 HA TRP B 69 20.161 -13.096 6.760 1.00 0.22 H new ATOM 0 HB2 TRP B 69 20.788 -14.556 4.507 1.00 0.23 H new ATOM 0 HB3 TRP B 69 21.414 -15.666 5.711 1.00 0.23 H new ATOM 0 HD1 TRP B 69 19.725 -17.427 6.297 1.00 0.24 H new ATOM 0 HE1 TRP B 69 17.166 -17.603 6.559 1.00 0.25 H new ATOM 0 HE3 TRP B 69 18.460 -12.586 5.202 1.00 0.25 H new ATOM 0 HZ2 TRP B 69 14.894 -15.861 6.316 1.00 0.26 H new ATOM 0 HZ3 TRP B 69 16.084 -11.888 5.229 1.00 0.28 H new ATOM 0 HH2 TRP B 69 14.307 -13.521 5.775 1.00 0.28 H new ATOM 2206 N GLY B 70 22.939 -14.508 7.743 1.00 0.27 N ATOM 2207 CA GLY B 70 23.597 -15.062 8.966 1.00 0.32 C ATOM 2208 C GLY B 70 24.576 -14.051 9.564 1.00 0.33 C ATOM 2209 O GLY B 70 25.683 -14.399 9.929 1.00 0.40 O ATOM 0 H GLY B 70 23.553 -14.388 6.938 1.00 0.27 H new ATOM 0 HA2 GLY B 70 22.839 -15.322 9.705 1.00 0.32 H new ATOM 0 HA3 GLY B 70 24.126 -15.981 8.715 1.00 0.32 H new ATOM 2213 N THR B 71 24.177 -12.811 9.683 1.00 0.30 N ATOM 2214 CA THR B 71 25.089 -11.789 10.279 1.00 0.33 C ATOM 2215 C THR B 71 24.327 -10.488 10.556 1.00 0.33 C ATOM 2216 O THR B 71 24.887 -9.408 10.502 1.00 0.43 O ATOM 2217 CB THR B 71 26.192 -11.570 9.238 1.00 0.36 C ATOM 2218 OG1 THR B 71 27.129 -10.625 9.734 1.00 0.40 O ATOM 2219 CG2 THR B 71 25.581 -11.048 7.939 1.00 0.42 C ATOM 0 H THR B 71 23.263 -12.463 9.395 1.00 0.30 H new ATOM 0 HA THR B 71 25.501 -12.116 11.234 1.00 0.33 H new ATOM 0 HB THR B 71 26.696 -12.517 9.043 1.00 0.36 H new ATOM 0 HG1 THR B 71 26.652 -9.894 10.180 1.00 0.40 H new ATOM 0 HG21 THR B 71 26.369 -10.894 7.202 1.00 0.42 H new ATOM 0 HG22 THR B 71 24.864 -11.774 7.557 1.00 0.42 H new ATOM 0 HG23 THR B 71 25.073 -10.103 8.130 1.00 0.42 H new ATOM 2227 N ILE B 72 23.056 -10.586 10.861 1.00 0.31 N ATOM 2228 CA ILE B 72 22.256 -9.359 11.151 1.00 0.32 C ATOM 2229 C ILE B 72 21.890 -9.308 12.644 1.00 0.33 C ATOM 2230 O ILE B 72 22.750 -9.434 13.496 1.00 0.38 O ATOM 2231 CB ILE B 72 21.013 -9.463 10.259 1.00 0.31 C ATOM 2232 CG1 ILE B 72 20.226 -10.732 10.597 1.00 0.30 C ATOM 2233 CG2 ILE B 72 21.438 -9.506 8.789 1.00 0.33 C ATOM 2234 CD1 ILE B 72 18.733 -10.462 10.396 1.00 0.30 C ATOM 0 H ILE B 72 22.539 -11.463 10.921 1.00 0.31 H new ATOM 0 HA ILE B 72 22.806 -8.441 10.942 1.00 0.32 H new ATOM 0 HB ILE B 72 20.380 -8.593 10.433 1.00 0.31 H new ATOM 0 HG12 ILE B 72 20.549 -11.556 9.960 1.00 0.30 H new ATOM 0 HG13 ILE B 72 20.419 -11.031 11.627 1.00 0.30 H new ATOM 0 HG21 ILE B 72 20.553 -9.580 8.157 1.00 0.33 H new ATOM 0 HG22 ILE B 72 21.986 -8.597 8.542 1.00 0.33 H new ATOM 0 HG23 ILE B 72 22.078 -10.372 8.620 1.00 0.33 H new ATOM 0 HD11 ILE B 72 18.165 -11.361 10.635 1.00 0.30 H new ATOM 0 HD12 ILE B 72 18.419 -9.650 11.051 1.00 0.30 H new ATOM 0 HD13 ILE B 72 18.550 -10.182 9.358 1.00 0.30 H new ATOM 2246 N LYS B 73 20.636 -9.109 12.970 1.00 0.32 N ATOM 2247 CA LYS B 73 20.232 -9.031 14.406 1.00 0.33 C ATOM 2248 C LYS B 73 19.277 -10.162 14.772 1.00 0.29 C ATOM 2249 O LYS B 73 19.275 -10.638 15.890 1.00 0.34 O ATOM 2250 CB LYS B 73 19.511 -7.690 14.521 1.00 0.36 C ATOM 2251 CG LYS B 73 19.074 -7.458 15.965 1.00 0.38 C ATOM 2252 CD LYS B 73 20.076 -6.538 16.666 1.00 0.43 C ATOM 2253 CE LYS B 73 21.132 -7.382 17.383 1.00 0.43 C ATOM 2254 NZ LYS B 73 21.836 -6.429 18.286 1.00 0.39 N ATOM 0 H LYS B 73 19.874 -8.997 12.301 1.00 0.32 H new ATOM 0 HA LYS B 73 21.089 -9.118 15.074 1.00 0.33 H new ATOM 0 HB2 LYS B 73 20.170 -6.884 14.197 1.00 0.36 H new ATOM 0 HB3 LYS B 73 18.643 -7.676 13.862 1.00 0.36 H new ATOM 0 HG2 LYS B 73 18.080 -7.012 15.987 1.00 0.38 H new ATOM 0 HG3 LYS B 73 19.009 -8.410 16.493 1.00 0.38 H new ATOM 0 HD2 LYS B 73 20.553 -5.881 15.938 1.00 0.43 H new ATOM 0 HD3 LYS B 73 19.559 -5.899 17.382 1.00 0.43 H new ATOM 0 HE2 LYS B 73 20.673 -8.194 17.946 1.00 0.43 H new ATOM 0 HE3 LYS B 73 21.823 -7.837 16.673 1.00 0.43 H new ATOM 0 HZ1 LYS B 73 22.577 -6.933 18.814 1.00 0.39 H new ATOM 0 HZ2 LYS B 73 22.269 -5.671 17.721 1.00 0.39 H new ATOM 0 HZ3 LYS B 73 21.155 -6.017 18.955 1.00 0.39 H new ATOM 2268 N LYS B 74 18.453 -10.562 13.841 1.00 0.27 N ATOM 2269 CA LYS B 74 17.444 -11.642 14.086 1.00 0.26 C ATOM 2270 C LYS B 74 16.327 -11.123 14.997 1.00 0.25 C ATOM 2271 O LYS B 74 15.159 -11.297 14.712 1.00 0.26 O ATOM 2272 CB LYS B 74 18.162 -12.829 14.755 1.00 0.31 C ATOM 2273 CG LYS B 74 19.518 -13.098 14.102 1.00 0.29 C ATOM 2274 CD LYS B 74 19.383 -13.127 12.579 1.00 0.31 C ATOM 2275 CE LYS B 74 18.504 -14.310 12.172 1.00 0.30 C ATOM 2276 NZ LYS B 74 19.106 -14.825 10.910 1.00 0.26 N ATOM 0 H LYS B 74 18.434 -10.177 12.896 1.00 0.27 H new ATOM 0 HA LYS B 74 16.997 -11.957 13.143 1.00 0.26 H new ATOM 0 HB2 LYS B 74 18.302 -12.621 15.816 1.00 0.31 H new ATOM 0 HB3 LYS B 74 17.539 -13.720 14.684 1.00 0.31 H new ATOM 0 HG2 LYS B 74 20.229 -12.326 14.395 1.00 0.29 H new ATOM 0 HG3 LYS B 74 19.916 -14.049 14.456 1.00 0.29 H new ATOM 0 HD2 LYS B 74 18.945 -12.194 12.223 1.00 0.31 H new ATOM 0 HD3 LYS B 74 20.366 -13.214 12.117 1.00 0.31 H new ATOM 0 HE2 LYS B 74 18.493 -15.078 12.946 1.00 0.30 H new ATOM 0 HE3 LYS B 74 17.471 -13.999 12.018 1.00 0.30 H new ATOM 0 HZ1 LYS B 74 18.740 -15.779 10.715 1.00 0.26 H new ATOM 0 HZ2 LYS B 74 18.858 -14.191 10.123 1.00 0.26 H new ATOM 0 HZ3 LYS B 74 20.140 -14.865 11.010 1.00 0.26 H new ATOM 2290 N SER B 75 16.672 -10.479 16.087 1.00 0.27 N ATOM 2291 CA SER B 75 15.623 -9.951 17.008 1.00 0.28 C ATOM 2292 C SER B 75 14.735 -8.965 16.255 1.00 0.26 C ATOM 2293 O SER B 75 13.527 -9.008 16.355 1.00 0.30 O ATOM 2294 CB SER B 75 16.384 -9.254 18.139 1.00 0.33 C ATOM 2295 OG SER B 75 16.911 -8.020 17.671 1.00 0.58 O ATOM 0 H SER B 75 17.633 -10.298 16.376 1.00 0.27 H new ATOM 0 HA SER B 75 14.975 -10.736 17.398 1.00 0.28 H new ATOM 0 HB2 SER B 75 15.719 -9.079 18.985 1.00 0.33 H new ATOM 0 HB3 SER B 75 17.191 -9.894 18.496 1.00 0.33 H new ATOM 0 HG SER B 75 17.396 -7.575 18.397 1.00 0.58 H new ATOM 2301 N LYS B 76 15.331 -8.090 15.490 1.00 0.24 N ATOM 2302 CA LYS B 76 14.528 -7.104 14.713 1.00 0.25 C ATOM 2303 C LYS B 76 13.871 -7.798 13.516 1.00 0.22 C ATOM 2304 O LYS B 76 12.722 -7.552 13.208 1.00 0.23 O ATOM 2305 CB LYS B 76 15.534 -6.052 14.248 1.00 0.29 C ATOM 2306 CG LYS B 76 14.834 -4.697 14.112 1.00 0.31 C ATOM 2307 CD LYS B 76 14.331 -4.232 15.484 1.00 0.39 C ATOM 2308 CE LYS B 76 12.802 -4.153 15.471 1.00 0.39 C ATOM 2309 NZ LYS B 76 12.489 -2.890 14.746 1.00 0.32 N ATOM 0 H LYS B 76 16.341 -8.016 15.370 1.00 0.24 H new ATOM 0 HA LYS B 76 13.726 -6.659 15.302 1.00 0.25 H new ATOM 0 HB2 LYS B 76 16.355 -5.979 14.961 1.00 0.29 H new ATOM 0 HB3 LYS B 76 15.968 -6.346 13.292 1.00 0.29 H new ATOM 0 HG2 LYS B 76 15.524 -3.961 13.699 1.00 0.31 H new ATOM 0 HG3 LYS B 76 13.999 -4.777 13.416 1.00 0.31 H new ATOM 0 HD2 LYS B 76 14.663 -4.924 16.258 1.00 0.39 H new ATOM 0 HD3 LYS B 76 14.754 -3.257 15.726 1.00 0.39 H new ATOM 0 HE2 LYS B 76 12.366 -5.016 14.967 1.00 0.39 H new ATOM 0 HE3 LYS B 76 12.399 -4.138 16.484 1.00 0.39 H new ATOM 0 HZ1 LYS B 76 11.801 -2.336 15.295 1.00 0.32 H new ATOM 0 HZ2 LYS B 76 13.360 -2.336 14.622 1.00 0.32 H new ATOM 0 HZ3 LYS B 76 12.087 -3.115 13.814 1.00 0.32 H new ATOM 2323 N ALA B 77 14.591 -8.668 12.845 1.00 0.23 N ATOM 2324 CA ALA B 77 14.006 -9.387 11.670 1.00 0.24 C ATOM 2325 C ALA B 77 12.830 -10.253 12.122 1.00 0.24 C ATOM 2326 O ALA B 77 11.742 -10.169 11.585 1.00 0.28 O ATOM 2327 CB ALA B 77 15.130 -10.271 11.127 1.00 0.27 C ATOM 0 H ALA B 77 15.558 -8.910 13.062 1.00 0.23 H new ATOM 0 HA ALA B 77 13.635 -8.695 10.914 1.00 0.24 H new ATOM 0 HB1 ALA B 77 14.769 -10.828 10.262 1.00 0.27 H new ATOM 0 HB2 ALA B 77 15.973 -9.647 10.831 1.00 0.27 H new ATOM 0 HB3 ALA B 77 15.450 -10.969 11.901 1.00 0.27 H new ATOM 2333 N ILE B 78 13.045 -11.086 13.109 1.00 0.23 N ATOM 2334 CA ILE B 78 11.943 -11.961 13.603 1.00 0.24 C ATOM 2335 C ILE B 78 10.783 -11.095 14.103 1.00 0.24 C ATOM 2336 O ILE B 78 9.634 -11.356 13.799 1.00 0.29 O ATOM 2337 CB ILE B 78 12.562 -12.784 14.736 1.00 0.25 C ATOM 2338 CG1 ILE B 78 13.682 -13.661 14.163 1.00 0.27 C ATOM 2339 CG2 ILE B 78 11.492 -13.674 15.372 1.00 0.32 C ATOM 2340 CD1 ILE B 78 14.734 -13.937 15.241 1.00 0.27 C ATOM 0 H ILE B 78 13.936 -11.197 13.593 1.00 0.23 H new ATOM 0 HA ILE B 78 11.536 -12.610 12.827 1.00 0.24 H new ATOM 0 HB ILE B 78 12.968 -12.115 15.495 1.00 0.25 H new ATOM 0 HG12 ILE B 78 13.268 -14.601 13.798 1.00 0.27 H new ATOM 0 HG13 ILE B 78 14.145 -13.164 13.311 1.00 0.27 H new ATOM 0 HG21 ILE B 78 11.936 -14.258 16.178 1.00 0.32 H new ATOM 0 HG22 ILE B 78 10.692 -13.051 15.773 1.00 0.32 H new ATOM 0 HG23 ILE B 78 11.084 -14.347 14.618 1.00 0.32 H new ATOM 0 HD11 ILE B 78 15.526 -14.560 14.826 1.00 0.27 H new ATOM 0 HD12 ILE B 78 15.158 -12.994 15.586 1.00 0.27 H new ATOM 0 HD13 ILE B 78 14.268 -14.453 16.080 1.00 0.27 H new ATOM 2352 N ASN B 79 11.073 -10.052 14.844 1.00 0.22 N ATOM 2353 CA ASN B 79 9.977 -9.159 15.329 1.00 0.23 C ATOM 2354 C ASN B 79 9.302 -8.517 14.119 1.00 0.23 C ATOM 2355 O ASN B 79 8.097 -8.351 14.077 1.00 0.26 O ATOM 2356 CB ASN B 79 10.658 -8.093 16.189 1.00 0.25 C ATOM 2357 CG ASN B 79 10.664 -8.546 17.651 1.00 0.30 C ATOM 2358 OD1 ASN B 79 9.628 -8.848 18.209 1.00 0.39 O ATOM 2359 ND2 ASN B 79 11.794 -8.606 18.300 1.00 0.40 N ATOM 0 H ASN B 79 12.014 -9.783 15.131 1.00 0.22 H new ATOM 0 HA ASN B 79 9.219 -9.694 15.900 1.00 0.23 H new ATOM 0 HB2 ASN B 79 11.679 -7.929 15.844 1.00 0.25 H new ATOM 0 HB3 ASN B 79 10.133 -7.143 16.093 1.00 0.25 H new ATOM 0 HD21 ASN B 79 11.807 -8.906 19.275 1.00 0.40 H new ATOM 0 HD22 ASN B 79 12.665 -8.353 17.833 1.00 0.40 H new ATOM 2366 N VAL B 80 10.084 -8.173 13.127 1.00 0.23 N ATOM 2367 CA VAL B 80 9.521 -7.558 11.891 1.00 0.25 C ATOM 2368 C VAL B 80 8.540 -8.539 11.246 1.00 0.25 C ATOM 2369 O VAL B 80 7.424 -8.189 10.911 1.00 0.29 O ATOM 2370 CB VAL B 80 10.747 -7.303 10.994 1.00 0.26 C ATOM 2371 CG1 VAL B 80 10.442 -7.656 9.535 1.00 0.31 C ATOM 2372 CG2 VAL B 80 11.145 -5.826 11.086 1.00 0.36 C ATOM 0 H VAL B 80 11.097 -8.294 13.123 1.00 0.23 H new ATOM 0 HA VAL B 80 8.968 -6.636 12.073 1.00 0.25 H new ATOM 0 HB VAL B 80 11.565 -7.935 11.339 1.00 0.26 H new ATOM 0 HG11 VAL B 80 11.324 -7.467 8.923 1.00 0.31 H new ATOM 0 HG12 VAL B 80 10.171 -8.709 9.465 1.00 0.31 H new ATOM 0 HG13 VAL B 80 9.614 -7.043 9.178 1.00 0.31 H new ATOM 0 HG21 VAL B 80 12.013 -5.643 10.452 1.00 0.36 H new ATOM 0 HG22 VAL B 80 10.314 -5.204 10.753 1.00 0.36 H new ATOM 0 HG23 VAL B 80 11.392 -5.579 12.119 1.00 0.36 H new ATOM 2382 N LEU B 81 8.956 -9.770 11.077 1.00 0.26 N ATOM 2383 CA LEU B 81 8.057 -10.789 10.461 1.00 0.28 C ATOM 2384 C LEU B 81 6.797 -10.937 11.311 1.00 0.27 C ATOM 2385 O LEU B 81 5.704 -11.081 10.796 1.00 0.31 O ATOM 2386 CB LEU B 81 8.866 -12.085 10.453 1.00 0.30 C ATOM 2387 CG LEU B 81 9.217 -12.451 9.011 1.00 0.45 C ATOM 2388 CD1 LEU B 81 10.592 -11.882 8.664 1.00 0.98 C ATOM 2389 CD2 LEU B 81 9.244 -13.972 8.862 1.00 0.51 C ATOM 0 H LEU B 81 9.880 -10.111 11.340 1.00 0.26 H new ATOM 0 HA LEU B 81 7.737 -10.516 9.456 1.00 0.28 H new ATOM 0 HB2 LEU B 81 9.775 -11.963 11.041 1.00 0.30 H new ATOM 0 HB3 LEU B 81 8.292 -12.888 10.915 1.00 0.30 H new ATOM 0 HG LEU B 81 8.468 -12.034 8.338 1.00 0.45 H new ATOM 0 HD11 LEU B 81 10.844 -12.142 7.636 1.00 0.98 H new ATOM 0 HD12 LEU B 81 10.574 -10.797 8.770 1.00 0.98 H new ATOM 0 HD13 LEU B 81 11.340 -12.300 9.338 1.00 0.98 H new ATOM 0 HD21 LEU B 81 9.494 -14.232 7.834 1.00 0.51 H new ATOM 0 HD22 LEU B 81 9.993 -14.390 9.535 1.00 0.51 H new ATOM 0 HD23 LEU B 81 8.264 -14.379 9.111 1.00 0.51 H new ATOM 2401 N ARG B 82 6.942 -10.882 12.610 1.00 0.25 N ATOM 2402 CA ARG B 82 5.751 -10.994 13.497 1.00 0.26 C ATOM 2403 C ARG B 82 4.879 -9.752 13.307 1.00 0.26 C ATOM 2404 O ARG B 82 3.665 -9.832 13.231 1.00 0.31 O ATOM 2405 CB ARG B 82 6.309 -11.054 14.920 1.00 0.28 C ATOM 2406 CG ARG B 82 5.394 -11.916 15.791 1.00 0.35 C ATOM 2407 CD ARG B 82 5.668 -13.397 15.515 1.00 0.42 C ATOM 2408 NE ARG B 82 5.779 -14.025 16.860 1.00 0.50 N ATOM 2409 CZ ARG B 82 6.871 -13.880 17.559 1.00 0.50 C ATOM 2410 NH1 ARG B 82 7.924 -14.599 17.280 1.00 0.57 N ATOM 2411 NH2 ARG B 82 6.911 -13.016 18.537 1.00 0.53 N ATOM 0 H ARG B 82 7.833 -10.765 13.092 1.00 0.25 H new ATOM 0 HA ARG B 82 5.138 -11.869 13.280 1.00 0.26 H new ATOM 0 HB2 ARG B 82 7.316 -11.470 14.910 1.00 0.28 H new ATOM 0 HB3 ARG B 82 6.383 -10.049 15.336 1.00 0.28 H new ATOM 0 HG2 ARG B 82 5.564 -11.695 16.845 1.00 0.35 H new ATOM 0 HG3 ARG B 82 4.350 -11.684 15.581 1.00 0.35 H new ATOM 0 HD2 ARG B 82 4.862 -13.846 14.935 1.00 0.42 H new ATOM 0 HD3 ARG B 82 6.585 -13.528 14.941 1.00 0.42 H new ATOM 0 HE ARG B 82 5.002 -14.569 17.235 1.00 0.50 H new ATOM 0 HH11 ARG B 82 7.893 -15.274 16.516 1.00 0.57 H new ATOM 0 HH12 ARG B 82 8.778 -14.486 17.826 1.00 0.57 H new ATOM 0 HH21 ARG B 82 6.088 -12.454 18.755 1.00 0.53 H new ATOM 0 HH22 ARG B 82 7.765 -12.903 19.083 1.00 0.53 H new ATOM 2425 N GLY B 83 5.502 -8.603 13.204 1.00 0.28 N ATOM 2426 CA GLY B 83 4.733 -7.343 12.993 1.00 0.31 C ATOM 2427 C GLY B 83 3.988 -7.450 11.664 1.00 0.30 C ATOM 2428 O GLY B 83 2.868 -6.992 11.531 1.00 0.33 O ATOM 0 H GLY B 83 6.514 -8.486 13.258 1.00 0.28 H new ATOM 0 HA2 GLY B 83 4.029 -7.187 13.811 1.00 0.31 H new ATOM 0 HA3 GLY B 83 5.406 -6.485 12.983 1.00 0.31 H new ATOM 2432 N PHE B 84 4.598 -8.074 10.685 1.00 0.29 N ATOM 2433 CA PHE B 84 3.924 -8.240 9.367 1.00 0.30 C ATOM 2434 C PHE B 84 2.702 -9.139 9.550 1.00 0.30 C ATOM 2435 O PHE B 84 1.666 -8.927 8.948 1.00 0.33 O ATOM 2436 CB PHE B 84 4.957 -8.910 8.456 1.00 0.32 C ATOM 2437 CG PHE B 84 5.877 -7.877 7.860 1.00 0.34 C ATOM 2438 CD1 PHE B 84 5.358 -6.695 7.318 1.00 0.52 C ATOM 2439 CD2 PHE B 84 7.256 -8.110 7.837 1.00 0.35 C ATOM 2440 CE1 PHE B 84 6.220 -5.748 6.760 1.00 0.59 C ATOM 2441 CE2 PHE B 84 8.114 -7.164 7.276 1.00 0.41 C ATOM 2442 CZ PHE B 84 7.597 -5.985 6.739 1.00 0.49 C ATOM 0 H PHE B 84 5.534 -8.474 10.746 1.00 0.29 H new ATOM 0 HA PHE B 84 3.586 -7.294 8.943 1.00 0.30 H new ATOM 0 HB2 PHE B 84 5.536 -9.637 9.025 1.00 0.32 H new ATOM 0 HB3 PHE B 84 4.450 -9.457 7.661 1.00 0.32 H new ATOM 0 HD1 PHE B 84 4.293 -6.516 7.331 1.00 0.52 H new ATOM 0 HD2 PHE B 84 7.656 -9.022 8.254 1.00 0.35 H new ATOM 0 HE1 PHE B 84 5.823 -4.833 6.345 1.00 0.59 H new ATOM 0 HE2 PHE B 84 9.179 -7.344 7.257 1.00 0.41 H new ATOM 0 HZ PHE B 84 8.263 -5.253 6.306 1.00 0.49 H new ATOM 2452 N ARG B 85 2.817 -10.133 10.399 1.00 0.28 N ATOM 2453 CA ARG B 85 1.663 -11.044 10.655 1.00 0.30 C ATOM 2454 C ARG B 85 0.488 -10.222 11.179 1.00 0.29 C ATOM 2455 O ARG B 85 -0.641 -10.396 10.763 1.00 0.34 O ATOM 2456 CB ARG B 85 2.153 -12.027 11.721 1.00 0.34 C ATOM 2457 CG ARG B 85 1.209 -13.230 11.778 1.00 0.38 C ATOM 2458 CD ARG B 85 0.153 -13.002 12.862 1.00 0.57 C ATOM 2459 NE ARG B 85 -1.121 -13.494 12.267 1.00 0.39 N ATOM 2460 CZ ARG B 85 -2.266 -13.108 12.762 1.00 0.45 C ATOM 2461 NH1 ARG B 85 -2.805 -13.768 13.750 1.00 0.60 N ATOM 2462 NH2 ARG B 85 -2.871 -12.062 12.269 1.00 0.71 N ATOM 0 H ARG B 85 3.663 -10.350 10.925 1.00 0.28 H new ATOM 0 HA ARG B 85 1.329 -11.567 9.759 1.00 0.30 H new ATOM 0 HB2 ARG B 85 3.166 -12.357 11.489 1.00 0.34 H new ATOM 0 HB3 ARG B 85 2.193 -11.536 12.693 1.00 0.34 H new ATOM 0 HG2 ARG B 85 0.727 -13.373 10.811 1.00 0.38 H new ATOM 0 HG3 ARG B 85 1.773 -14.138 11.991 1.00 0.38 H new ATOM 0 HD2 ARG B 85 0.399 -13.546 13.774 1.00 0.57 H new ATOM 0 HD3 ARG B 85 0.083 -11.948 13.129 1.00 0.57 H new ATOM 0 HE ARG B 85 -1.099 -14.133 11.472 1.00 0.39 H new ATOM 0 HH11 ARG B 85 -2.332 -14.585 14.136 1.00 0.60 H new ATOM 0 HH12 ARG B 85 -3.699 -13.467 14.137 1.00 0.60 H new ATOM 0 HH21 ARG B 85 -2.449 -11.546 11.497 1.00 0.71 H new ATOM 0 HH22 ARG B 85 -3.765 -11.761 12.656 1.00 0.71 H new ATOM 2476 N LYS B 86 0.757 -9.308 12.078 1.00 0.28 N ATOM 2477 CA LYS B 86 -0.334 -8.448 12.619 1.00 0.30 C ATOM 2478 C LYS B 86 -0.742 -7.426 11.556 1.00 0.29 C ATOM 2479 O LYS B 86 -1.890 -7.030 11.468 1.00 0.33 O ATOM 2480 CB LYS B 86 0.267 -7.752 13.843 1.00 0.34 C ATOM 2481 CG LYS B 86 -0.740 -7.786 14.997 1.00 0.40 C ATOM 2482 CD LYS B 86 -0.918 -9.229 15.482 1.00 0.51 C ATOM 2483 CE LYS B 86 -2.254 -9.784 14.976 1.00 0.52 C ATOM 2484 NZ LYS B 86 -3.133 -9.827 16.177 1.00 0.63 N ATOM 0 H LYS B 86 1.685 -9.122 12.459 1.00 0.28 H new ATOM 0 HA LYS B 86 -1.225 -9.015 12.887 1.00 0.30 H new ATOM 0 HB2 LYS B 86 1.192 -8.248 14.139 1.00 0.34 H new ATOM 0 HB3 LYS B 86 0.522 -6.721 13.599 1.00 0.34 H new ATOM 0 HG2 LYS B 86 -0.391 -7.157 15.816 1.00 0.40 H new ATOM 0 HG3 LYS B 86 -1.698 -7.381 14.669 1.00 0.40 H new ATOM 0 HD2 LYS B 86 -0.096 -9.848 15.121 1.00 0.51 H new ATOM 0 HD3 LYS B 86 -0.888 -9.263 16.571 1.00 0.51 H new ATOM 0 HE2 LYS B 86 -2.677 -9.147 14.200 1.00 0.52 H new ATOM 0 HE3 LYS B 86 -2.130 -10.776 14.542 1.00 0.52 H new ATOM 0 HZ1 LYS B 86 -4.068 -10.197 15.910 1.00 0.63 H new ATOM 0 HZ2 LYS B 86 -2.708 -10.446 16.896 1.00 0.63 H new ATOM 0 HZ3 LYS B 86 -3.238 -8.868 16.565 1.00 0.63 H new ATOM 2498 N GLU B 87 0.193 -7.014 10.735 1.00 0.28 N ATOM 2499 CA GLU B 87 -0.129 -6.035 9.658 1.00 0.29 C ATOM 2500 C GLU B 87 -1.016 -6.713 8.615 1.00 0.29 C ATOM 2501 O GLU B 87 -1.894 -6.099 8.036 1.00 0.34 O ATOM 2502 CB GLU B 87 1.219 -5.646 9.048 1.00 0.32 C ATOM 2503 CG GLU B 87 1.915 -4.620 9.947 1.00 0.37 C ATOM 2504 CD GLU B 87 2.158 -3.328 9.163 1.00 0.42 C ATOM 2505 OE1 GLU B 87 2.684 -3.415 8.065 1.00 0.58 O ATOM 2506 OE2 GLU B 87 1.814 -2.275 9.673 1.00 0.47 O ATOM 0 H GLU B 87 1.167 -7.316 10.767 1.00 0.28 H new ATOM 0 HA GLU B 87 -0.663 -5.160 10.029 1.00 0.29 H new ATOM 0 HB2 GLU B 87 1.847 -6.530 8.935 1.00 0.32 H new ATOM 0 HB3 GLU B 87 1.072 -5.230 8.051 1.00 0.32 H new ATOM 0 HG2 GLU B 87 1.301 -4.415 10.824 1.00 0.37 H new ATOM 0 HG3 GLU B 87 2.862 -5.021 10.308 1.00 0.37 H new ATOM 2513 N ILE B 88 -0.799 -7.984 8.386 1.00 0.28 N ATOM 2514 CA ILE B 88 -1.635 -8.718 7.397 1.00 0.29 C ATOM 2515 C ILE B 88 -3.033 -8.927 7.992 1.00 0.29 C ATOM 2516 O ILE B 88 -4.035 -8.793 7.312 1.00 0.32 O ATOM 2517 CB ILE B 88 -0.878 -10.039 7.135 1.00 0.32 C ATOM 2518 CG1 ILE B 88 -0.930 -10.361 5.637 1.00 0.37 C ATOM 2519 CG2 ILE B 88 -1.482 -11.211 7.922 1.00 0.34 C ATOM 2520 CD1 ILE B 88 0.466 -10.752 5.149 1.00 0.70 C ATOM 0 H ILE B 88 -0.078 -8.542 8.843 1.00 0.28 H new ATOM 0 HA ILE B 88 -1.784 -8.187 6.457 1.00 0.29 H new ATOM 0 HB ILE B 88 0.152 -9.906 7.466 1.00 0.32 H new ATOM 0 HG12 ILE B 88 -1.632 -11.175 5.453 1.00 0.37 H new ATOM 0 HG13 ILE B 88 -1.292 -9.496 5.081 1.00 0.37 H new ATOM 0 HG21 ILE B 88 -0.920 -12.120 7.709 1.00 0.34 H new ATOM 0 HG22 ILE B 88 -1.433 -10.996 8.989 1.00 0.34 H new ATOM 0 HG23 ILE B 88 -2.522 -11.350 7.627 1.00 0.34 H new ATOM 0 HD11 ILE B 88 0.428 -10.981 4.084 1.00 0.70 H new ATOM 0 HD12 ILE B 88 1.156 -9.925 5.318 1.00 0.70 H new ATOM 0 HD13 ILE B 88 0.810 -11.629 5.697 1.00 0.70 H new ATOM 2532 N GLY B 89 -3.106 -9.212 9.270 1.00 0.31 N ATOM 2533 CA GLY B 89 -4.435 -9.390 9.921 1.00 0.34 C ATOM 2534 C GLY B 89 -5.191 -8.071 9.807 1.00 0.34 C ATOM 2535 O GLY B 89 -6.400 -8.039 9.665 1.00 0.38 O ATOM 0 H GLY B 89 -2.302 -9.328 9.887 1.00 0.31 H new ATOM 0 HA2 GLY B 89 -4.992 -10.193 9.438 1.00 0.34 H new ATOM 0 HA3 GLY B 89 -4.313 -9.671 10.967 1.00 0.34 H new ATOM 2539 N ARG B 90 -4.471 -6.980 9.846 1.00 0.34 N ATOM 2540 CA ARG B 90 -5.116 -5.646 9.715 1.00 0.36 C ATOM 2541 C ARG B 90 -5.609 -5.467 8.281 1.00 0.32 C ATOM 2542 O ARG B 90 -6.665 -4.910 8.048 1.00 0.34 O ATOM 2543 CB ARG B 90 -4.010 -4.636 10.021 1.00 0.40 C ATOM 2544 CG ARG B 90 -4.003 -4.307 11.514 1.00 0.45 C ATOM 2545 CD ARG B 90 -2.945 -3.237 11.786 1.00 0.52 C ATOM 2546 NE ARG B 90 -3.543 -2.358 12.829 1.00 0.65 N ATOM 2547 CZ ARG B 90 -2.777 -1.584 13.546 1.00 0.92 C ATOM 2548 NH1 ARG B 90 -1.766 -2.088 14.198 1.00 1.25 N ATOM 2549 NH2 ARG B 90 -3.021 -0.304 13.611 1.00 1.58 N ATOM 0 H ARG B 90 -3.458 -6.959 9.964 1.00 0.34 H new ATOM 0 HA ARG B 90 -5.970 -5.524 10.381 1.00 0.36 H new ATOM 0 HB2 ARG B 90 -3.043 -5.042 9.725 1.00 0.40 H new ATOM 0 HB3 ARG B 90 -4.165 -3.727 9.440 1.00 0.40 H new ATOM 0 HG2 ARG B 90 -4.985 -3.952 11.825 1.00 0.45 H new ATOM 0 HG3 ARG B 90 -3.789 -5.204 12.096 1.00 0.45 H new ATOM 0 HD2 ARG B 90 -2.013 -3.683 12.133 1.00 0.52 H new ATOM 0 HD3 ARG B 90 -2.712 -2.674 10.882 1.00 0.52 H new ATOM 0 HE ARG B 90 -4.551 -2.362 12.982 1.00 0.65 H new ATOM 0 HH11 ARG B 90 -1.574 -3.088 14.147 1.00 1.25 H new ATOM 0 HH12 ARG B 90 -1.167 -1.482 14.759 1.00 1.25 H new ATOM 0 HH21 ARG B 90 -3.811 0.091 13.101 1.00 1.58 H new ATOM 0 HH22 ARG B 90 -2.422 0.302 14.172 1.00 1.58 H new ATOM 2563 N MET B 91 -4.859 -5.962 7.319 1.00 0.31 N ATOM 2564 CA MET B 91 -5.287 -5.841 5.895 1.00 0.30 C ATOM 2565 C MET B 91 -6.647 -6.502 5.755 1.00 0.27 C ATOM 2566 O MET B 91 -7.520 -6.025 5.055 1.00 0.30 O ATOM 2567 CB MET B 91 -4.226 -6.587 5.082 1.00 0.33 C ATOM 2568 CG MET B 91 -3.916 -5.804 3.803 1.00 0.47 C ATOM 2569 SD MET B 91 -2.721 -6.725 2.804 1.00 0.61 S ATOM 2570 CE MET B 91 -1.274 -6.423 3.849 1.00 0.63 C ATOM 0 H MET B 91 -3.971 -6.443 7.464 1.00 0.31 H new ATOM 0 HA MET B 91 -5.374 -4.809 5.555 1.00 0.30 H new ATOM 0 HB2 MET B 91 -3.319 -6.710 5.674 1.00 0.33 H new ATOM 0 HB3 MET B 91 -4.581 -7.587 4.832 1.00 0.33 H new ATOM 0 HG2 MET B 91 -4.831 -5.640 3.234 1.00 0.47 H new ATOM 0 HG3 MET B 91 -3.516 -4.822 4.054 1.00 0.47 H new ATOM 0 HE1 MET B 91 -0.580 -5.764 3.328 1.00 0.63 H new ATOM 0 HE2 MET B 91 -1.590 -5.954 4.781 1.00 0.63 H new ATOM 0 HE3 MET B 91 -0.780 -7.369 4.068 1.00 0.63 H new ATOM 2580 N LEU B 92 -6.834 -7.586 6.458 1.00 0.27 N ATOM 2581 CA LEU B 92 -8.143 -8.284 6.421 1.00 0.27 C ATOM 2582 C LEU B 92 -9.182 -7.395 7.071 1.00 0.29 C ATOM 2583 O LEU B 92 -10.274 -7.239 6.561 1.00 0.32 O ATOM 2584 CB LEU B 92 -7.923 -9.568 7.198 1.00 0.31 C ATOM 2585 CG LEU B 92 -6.925 -10.403 6.413 1.00 0.34 C ATOM 2586 CD1 LEU B 92 -6.092 -11.261 7.369 1.00 0.43 C ATOM 2587 CD2 LEU B 92 -7.676 -11.307 5.430 1.00 0.42 C ATOM 0 H LEU B 92 -6.131 -8.017 7.058 1.00 0.27 H new ATOM 0 HA LEU B 92 -8.498 -8.504 5.414 1.00 0.27 H new ATOM 0 HB2 LEU B 92 -7.543 -9.353 8.197 1.00 0.31 H new ATOM 0 HB3 LEU B 92 -8.862 -10.108 7.323 1.00 0.31 H new ATOM 0 HG LEU B 92 -6.259 -9.739 5.861 1.00 0.34 H new ATOM 0 HD11 LEU B 92 -5.380 -11.856 6.797 1.00 0.43 H new ATOM 0 HD12 LEU B 92 -5.552 -10.615 8.061 1.00 0.43 H new ATOM 0 HD13 LEU B 92 -6.750 -11.924 7.930 1.00 0.43 H new ATOM 0 HD21 LEU B 92 -6.960 -11.906 4.867 1.00 0.42 H new ATOM 0 HD22 LEU B 92 -8.346 -11.966 5.981 1.00 0.42 H new ATOM 0 HD23 LEU B 92 -8.256 -10.693 4.741 1.00 0.42 H new ATOM 2599 N ASN B 93 -8.831 -6.765 8.169 1.00 0.32 N ATOM 2600 CA ASN B 93 -9.789 -5.831 8.823 1.00 0.37 C ATOM 2601 C ASN B 93 -10.249 -4.818 7.771 1.00 0.35 C ATOM 2602 O ASN B 93 -11.331 -4.268 7.848 1.00 0.40 O ATOM 2603 CB ASN B 93 -8.992 -5.144 9.940 1.00 0.44 C ATOM 2604 CG ASN B 93 -9.931 -4.411 10.912 1.00 0.53 C ATOM 2605 OD1 ASN B 93 -11.224 -4.592 10.845 1.00 0.65 O flip ATOM 2606 ND2 ASN B 93 -9.476 -3.659 11.750 1.00 0.85 N flip ATOM 0 H ASN B 93 -7.928 -6.860 8.634 1.00 0.32 H new ATOM 0 HA ASN B 93 -10.671 -6.324 9.231 1.00 0.37 H new ATOM 0 HB2 ASN B 93 -8.406 -5.885 10.483 1.00 0.44 H new ATOM 0 HB3 ASN B 93 -8.286 -4.436 9.506 1.00 0.44 H new ATOM 0 HD21 ASN B 93 -8.468 -3.512 11.810 1.00 0.85 H new ATOM 0 HD22 ASN B 93 -10.101 -3.175 12.394 1.00 0.85 H new ATOM 2613 N ILE B 94 -9.424 -4.600 6.767 1.00 0.33 N ATOM 2614 CA ILE B 94 -9.799 -3.655 5.676 1.00 0.36 C ATOM 2615 C ILE B 94 -10.680 -4.368 4.643 1.00 0.31 C ATOM 2616 O ILE B 94 -11.624 -3.790 4.138 1.00 0.36 O ATOM 2617 CB ILE B 94 -8.493 -3.188 5.008 1.00 0.40 C ATOM 2618 CG1 ILE B 94 -7.367 -3.075 6.047 1.00 0.43 C ATOM 2619 CG2 ILE B 94 -8.730 -1.823 4.352 1.00 0.48 C ATOM 2620 CD1 ILE B 94 -6.208 -2.236 5.495 1.00 0.59 C ATOM 0 H ILE B 94 -8.509 -5.039 6.663 1.00 0.33 H new ATOM 0 HA ILE B 94 -10.358 -2.809 6.076 1.00 0.36 H new ATOM 0 HB ILE B 94 -8.195 -3.917 4.255 1.00 0.40 H new ATOM 0 HG12 ILE B 94 -7.751 -2.619 6.960 1.00 0.43 H new ATOM 0 HG13 ILE B 94 -7.009 -4.069 6.313 1.00 0.43 H new ATOM 0 HG21 ILE B 94 -7.810 -1.484 3.876 1.00 0.48 H new ATOM 0 HG22 ILE B 94 -9.516 -1.911 3.602 1.00 0.48 H new ATOM 0 HG23 ILE B 94 -9.033 -1.102 5.111 1.00 0.48 H new ATOM 0 HD11 ILE B 94 -5.420 -2.167 6.245 1.00 0.59 H new ATOM 0 HD12 ILE B 94 -5.813 -2.708 4.596 1.00 0.59 H new ATOM 0 HD13 ILE B 94 -6.566 -1.236 5.252 1.00 0.59 H new ATOM 2632 N LEU B 95 -10.383 -5.610 4.303 1.00 0.28 N ATOM 2633 CA LEU B 95 -11.233 -6.299 3.277 1.00 0.29 C ATOM 2634 C LEU B 95 -12.330 -7.152 3.933 1.00 0.27 C ATOM 2635 O LEU B 95 -12.953 -7.970 3.283 1.00 0.31 O ATOM 2636 CB LEU B 95 -10.283 -7.166 2.447 1.00 0.34 C ATOM 2637 CG LEU B 95 -9.574 -8.178 3.342 1.00 0.35 C ATOM 2638 CD1 LEU B 95 -10.135 -9.578 3.085 1.00 0.45 C ATOM 2639 CD2 LEU B 95 -8.077 -8.161 3.025 1.00 0.42 C ATOM 0 H LEU B 95 -9.611 -6.159 4.681 1.00 0.28 H new ATOM 0 HA LEU B 95 -11.753 -5.572 2.653 1.00 0.29 H new ATOM 0 HB2 LEU B 95 -10.841 -7.686 1.668 1.00 0.34 H new ATOM 0 HB3 LEU B 95 -9.548 -6.536 1.946 1.00 0.34 H new ATOM 0 HG LEU B 95 -9.734 -7.916 4.388 1.00 0.35 H new ATOM 0 HD11 LEU B 95 -9.626 -10.297 3.726 1.00 0.45 H new ATOM 0 HD12 LEU B 95 -11.203 -9.588 3.305 1.00 0.45 H new ATOM 0 HD13 LEU B 95 -9.977 -9.847 2.041 1.00 0.45 H new ATOM 0 HD21 LEU B 95 -7.562 -8.882 3.660 1.00 0.42 H new ATOM 0 HD22 LEU B 95 -7.924 -8.425 1.979 1.00 0.42 H new ATOM 0 HD23 LEU B 95 -7.677 -7.164 3.210 1.00 0.42 H new ATOM 2651 N ASN B 96 -12.586 -6.952 5.206 1.00 0.28 N ATOM 2652 CA ASN B 96 -13.664 -7.735 5.893 1.00 0.32 C ATOM 2653 C ASN B 96 -14.746 -6.790 6.432 1.00 0.36 C ATOM 2654 O ASN B 96 -15.761 -7.226 6.942 1.00 0.45 O ATOM 2655 CB ASN B 96 -12.976 -8.461 7.049 1.00 0.36 C ATOM 2656 CG ASN B 96 -12.507 -9.839 6.577 1.00 0.44 C ATOM 2657 OD1 ASN B 96 -11.230 -10.078 6.460 1.00 0.61 O flip ATOM 2658 ND2 ASN B 96 -13.313 -10.708 6.310 1.00 0.47 N flip ATOM 0 H ASN B 96 -12.096 -6.281 5.798 1.00 0.28 H new ATOM 0 HA ASN B 96 -14.151 -8.432 5.211 1.00 0.32 H new ATOM 0 HB2 ASN B 96 -12.127 -7.878 7.405 1.00 0.36 H new ATOM 0 HB3 ASN B 96 -13.664 -8.567 7.888 1.00 0.36 H new ATOM 0 HD21 ASN B 96 -14.312 -10.523 6.401 1.00 0.47 H new ATOM 0 HD22 ASN B 96 -12.991 -11.623 5.995 1.00 0.47 H new