USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 MET CE :methyl 153:sc= -4.26 (180deg=-4.72!) USER MOD Set 1.2: A 53 ASN : amide:sc= -5.84 K(o=-21,f=-24!) USER MOD Set 1.3: B 49 MET CE :methyl 156:sc= -5.09 (180deg=-5.42!) USER MOD Set 1.4: B 53 ASN : amide:sc= -5.85 K(o=-21,f=-24!) USER MOD Single : A 23 HIS : no HD1:sc= -1.84 X(o=-1.8,f=-1.3) USER MOD Single : A 24 THR OG1 : rot 93:sc= 0.168 USER MOD Single : A 26 SER OG : rot 180:sc= 0.153 USER MOD Single : A 28 GLN :FLIP amide:sc= -5.59! C(o=-9.1!,f=-5.6!) USER MOD Single : A 29 ASN : amide:sc=-0.00338 K(o=-0.0034,f=-1.5!) USER MOD Single : A 30 MET CE :methyl -129:sc= -0.287 (180deg=-5.93!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -131:sc= 0.942 (180deg=-3.62!) USER MOD Single : A 33 GLN : amide:sc= 0.23 K(o=0.23,f=-10!) USER MOD Single : A 37 LYS NZ :NH3+ 155:sc= -2.26! (180deg=-3.61!) USER MOD Single : A 39 TYR OH : rot 98:sc= -1.01 USER MOD Single : A 44 LYS NZ :NH3+ 161:sc= -0.182 (180deg=-0.678) USER MOD Single : A 45 CYS SG : rot 58:sc= 0.494 USER MOD Single : A 47 SER OG : rot 91:sc= 0.858 USER MOD Single : A 54 ASN : amide:sc= -0.0381 K(o=-0.038,f=-1.2) USER MOD Single : A 60 SER OG : rot 173:sc= 1.03 USER MOD Single : A 61 LYS NZ :NH3+ 161:sc= -0.0393 (180deg=-0.406) USER MOD Single : B 23 HIS :FLIP no HD1:sc= -1.21 F(o=-2.2!,f=-1.2) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.119 USER MOD Single : B 26 SER OG : rot 180:sc= 0.131 USER MOD Single : B 28 GLN :FLIP amide:sc= -7.51! C(o=-9.9!,f=-7.5!) USER MOD Single : B 29 ASN : amide:sc=-0.00641 K(o=-0.0064,f=-1.8!) USER MOD Single : B 30 MET CE :methyl -125:sc= -0.72 (180deg=-7.72!) USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ -128:sc= 0.852! (180deg=-3.7!) USER MOD Single : B 33 GLN : amide:sc= -0.406 K(o=-0.41,f=-15!) USER MOD Single : B 37 LYS NZ :NH3+ 156:sc= -2.02! (180deg=-3.07!) USER MOD Single : B 39 TYR OH : rot 101:sc= -0.0284 USER MOD Single : B 44 LYS NZ :NH3+ 152:sc= -0.117 (180deg=-0.841) USER MOD Single : B 45 CYS SG : rot 55:sc= 0.792 USER MOD Single : B 47 SER OG : rot 83:sc= 0.92 USER MOD Single : B 54 ASN : amide:sc= -0.113 K(o=-0.11,f=-1.5) USER MOD Single : B 60 SER OG : rot 163:sc= 1.3 USER MOD Single : B 61 LYS NZ :NH3+ 166:sc= -1.16 (180deg=-1.99) USER MOD Single : B 84 ASN : amide:sc= 0.452 K(o=0.45,f=-0.72) USER MOD Single : B 86 GLN : amide:sc= -0.366 K(o=-0.37,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 153.030 10.618 -5.310 1.00 0.00 N ATOM 333 CA HIS A 23 152.136 11.781 -5.010 1.00 0.00 C ATOM 334 C HIS A 23 150.949 11.333 -4.167 1.00 0.00 C ATOM 335 O HIS A 23 150.440 10.224 -4.304 1.00 0.00 O ATOM 336 CB HIS A 23 151.663 12.505 -6.285 1.00 0.00 C ATOM 337 CG HIS A 23 151.273 13.916 -5.944 1.00 0.00 C ATOM 338 ND1 HIS A 23 151.848 14.617 -4.891 1.00 0.00 N ATOM 339 CD2 HIS A 23 150.356 14.765 -6.497 1.00 0.00 C ATOM 340 CE1 HIS A 23 151.269 15.825 -4.851 1.00 0.00 C ATOM 341 NE2 HIS A 23 150.356 15.967 -5.806 1.00 0.00 N ATOM 0 HA HIS A 23 152.723 12.502 -4.441 1.00 0.00 H new ATOM 0 HB2 HIS A 23 152.457 12.506 -7.031 1.00 0.00 H new ATOM 0 HB3 HIS A 23 150.815 11.978 -6.722 1.00 0.00 H new ATOM 0 HD2 HIS A 23 149.727 14.535 -7.344 1.00 0.00 H new ATOM 0 HE1 HIS A 23 151.515 16.590 -4.130 1.00 0.00 H new ATOM 0 HE2 HIS A 23 149.778 16.787 -5.991 1.00 0.00 H new ATOM 350 N THR A 24 150.532 12.171 -3.268 1.00 0.00 N ATOM 351 CA THR A 24 149.431 11.837 -2.344 1.00 0.00 C ATOM 352 C THR A 24 148.204 11.353 -3.124 1.00 0.00 C ATOM 353 O THR A 24 147.779 10.222 -2.960 1.00 0.00 O ATOM 354 CB THR A 24 149.121 13.080 -1.513 1.00 0.00 C ATOM 355 OG1 THR A 24 150.254 13.950 -1.577 1.00 0.00 O ATOM 356 CG2 THR A 24 148.880 12.687 -0.057 1.00 0.00 C ATOM 0 H THR A 24 150.924 13.103 -3.134 1.00 0.00 H new ATOM 0 HA THR A 24 149.721 11.023 -1.680 1.00 0.00 H new ATOM 0 HB THR A 24 148.229 13.573 -1.901 1.00 0.00 H new ATOM 0 HG1 THR A 24 150.135 14.589 -2.310 1.00 0.00 H new ATOM 0 HG21 THR A 24 148.660 13.579 0.529 1.00 0.00 H new ATOM 0 HG22 THR A 24 148.037 11.998 -0.001 1.00 0.00 H new ATOM 0 HG23 THR A 24 149.771 12.202 0.341 1.00 0.00 H new ATOM 364 N GLU A 25 147.633 12.181 -3.951 1.00 0.00 N ATOM 365 CA GLU A 25 146.442 11.769 -4.763 1.00 0.00 C ATOM 366 C GLU A 25 146.611 10.325 -5.186 1.00 0.00 C ATOM 367 O GLU A 25 145.873 9.458 -4.765 1.00 0.00 O ATOM 368 CB GLU A 25 146.337 12.655 -6.036 1.00 0.00 C ATOM 369 CG GLU A 25 147.431 13.734 -6.051 1.00 0.00 C ATOM 370 CD GLU A 25 147.049 14.846 -5.110 1.00 0.00 C ATOM 371 OE1 GLU A 25 147.301 14.714 -3.944 1.00 0.00 O ATOM 372 OE2 GLU A 25 146.494 15.812 -5.559 1.00 0.00 O ATOM 0 H GLU A 25 147.941 13.141 -4.105 1.00 0.00 H new ATOM 0 HA GLU A 25 145.539 11.886 -4.164 1.00 0.00 H new ATOM 0 HB2 GLU A 25 146.425 12.031 -6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 25 145.355 13.127 -6.074 1.00 0.00 H new ATOM 0 HG2 GLU A 25 148.387 13.303 -5.753 1.00 0.00 H new ATOM 0 HG3 GLU A 25 147.558 14.125 -7.061 1.00 0.00 H new ATOM 379 N SER A 26 147.579 10.067 -5.998 1.00 0.00 N ATOM 380 CA SER A 26 147.848 8.689 -6.452 1.00 0.00 C ATOM 381 C SER A 26 147.796 7.733 -5.264 1.00 0.00 C ATOM 382 O SER A 26 147.054 6.775 -5.269 1.00 0.00 O ATOM 383 CB SER A 26 149.238 8.647 -7.074 1.00 0.00 C ATOM 384 OG SER A 26 149.567 9.943 -7.613 1.00 0.00 O ATOM 0 H SER A 26 148.213 10.771 -6.377 1.00 0.00 H new ATOM 0 HA SER A 26 147.098 8.387 -7.183 1.00 0.00 H new ATOM 0 HB2 SER A 26 149.974 8.356 -6.324 1.00 0.00 H new ATOM 0 HB3 SER A 26 149.272 7.895 -7.862 1.00 0.00 H new ATOM 0 HG SER A 26 150.462 9.914 -8.011 1.00 0.00 H new ATOM 390 N LEU A 27 148.499 8.048 -4.215 1.00 0.00 N ATOM 391 CA LEU A 27 148.477 7.191 -3.013 1.00 0.00 C ATOM 392 C LEU A 27 147.027 6.964 -2.568 1.00 0.00 C ATOM 393 O LEU A 27 146.620 5.841 -2.302 1.00 0.00 O ATOM 394 CB LEU A 27 149.294 7.839 -1.897 1.00 0.00 C ATOM 395 CG LEU A 27 150.792 7.627 -2.139 1.00 0.00 C ATOM 396 CD1 LEU A 27 151.596 8.432 -1.106 1.00 0.00 C ATOM 397 CD2 LEU A 27 151.142 6.132 -2.012 1.00 0.00 C ATOM 0 H LEU A 27 149.093 8.874 -4.144 1.00 0.00 H new ATOM 0 HA LEU A 27 148.923 6.224 -3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 27 149.074 8.906 -1.849 1.00 0.00 H new ATOM 0 HB3 LEU A 27 149.011 7.412 -0.935 1.00 0.00 H new ATOM 0 HG LEU A 27 151.042 7.966 -3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 27 152.662 8.282 -1.277 1.00 0.00 H new ATOM 0 HD12 LEU A 27 151.358 9.491 -1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 27 151.339 8.095 -0.102 1.00 0.00 H new ATOM 0 HD21 LEU A 27 152.209 5.992 -2.186 1.00 0.00 H new ATOM 0 HD22 LEU A 27 150.888 5.783 -1.011 1.00 0.00 H new ATOM 0 HD23 LEU A 27 150.577 5.562 -2.749 1.00 0.00 H new ATOM 409 N GLN A 28 146.242 8.003 -2.469 1.00 0.00 N ATOM 410 CA GLN A 28 144.831 7.785 -2.016 1.00 0.00 C ATOM 411 C GLN A 28 143.976 7.310 -3.179 1.00 0.00 C ATOM 412 O GLN A 28 142.950 6.676 -2.985 1.00 0.00 O ATOM 413 CB GLN A 28 144.179 9.006 -1.319 1.00 0.00 C ATOM 414 CG GLN A 28 144.948 10.301 -1.603 1.00 0.00 C ATOM 415 CD GLN A 28 145.936 10.537 -0.478 1.00 0.00 C ATOM 416 OE1 GLN A 28 147.169 10.264 -0.653 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 145.562 10.966 0.591 1.00 0.00 N flip ATOM 0 H GLN A 28 146.502 8.968 -2.674 1.00 0.00 H new ATOM 0 HA GLN A 28 144.882 7.013 -1.248 1.00 0.00 H new ATOM 0 HB2 GLN A 28 143.149 9.112 -1.660 1.00 0.00 H new ATOM 0 HB3 GLN A 28 144.142 8.834 -0.243 1.00 0.00 H new ATOM 0 HG2 GLN A 28 145.471 10.228 -2.556 1.00 0.00 H new ATOM 0 HG3 GLN A 28 144.258 11.141 -1.682 1.00 0.00 H new ATOM 0 HE21 GLN A 28 144.577 11.186 0.736 1.00 0.00 H new ATOM 0 HE22 GLN A 28 146.232 11.107 1.347 1.00 0.00 H new ATOM 426 N ASN A 29 144.347 7.621 -4.366 1.00 0.00 N ATOM 427 CA ASN A 29 143.524 7.220 -5.515 1.00 0.00 C ATOM 428 C ASN A 29 143.883 5.802 -5.929 1.00 0.00 C ATOM 429 O ASN A 29 143.308 5.263 -6.858 1.00 0.00 O ATOM 430 CB ASN A 29 143.735 8.187 -6.663 1.00 0.00 C ATOM 431 CG ASN A 29 143.005 9.502 -6.376 1.00 0.00 C ATOM 432 OD1 ASN A 29 142.455 9.702 -5.295 1.00 0.00 O ATOM 433 ND2 ASN A 29 142.945 10.399 -7.283 1.00 0.00 N ATOM 0 H ASN A 29 145.194 8.141 -4.596 1.00 0.00 H new ATOM 0 HA ASN A 29 142.471 7.245 -5.236 1.00 0.00 H new ATOM 0 HB2 ASN A 29 144.800 8.374 -6.801 1.00 0.00 H new ATOM 0 HB3 ASN A 29 143.365 7.750 -7.591 1.00 0.00 H new ATOM 0 HD21 ASN A 29 142.445 11.270 -7.106 1.00 0.00 H new ATOM 0 HD22 ASN A 29 143.398 10.244 -8.184 1.00 0.00 H new ATOM 440 N MET A 30 144.793 5.175 -5.228 1.00 0.00 N ATOM 441 CA MET A 30 145.156 3.781 -5.529 1.00 0.00 C ATOM 442 C MET A 30 144.265 2.872 -4.700 1.00 0.00 C ATOM 443 O MET A 30 143.798 3.262 -3.627 1.00 0.00 O ATOM 444 CB MET A 30 146.610 3.534 -5.104 1.00 0.00 C ATOM 445 CG MET A 30 147.570 4.196 -6.094 1.00 0.00 C ATOM 446 SD MET A 30 148.645 2.938 -6.810 1.00 0.00 S ATOM 447 CE MET A 30 149.689 2.670 -5.354 1.00 0.00 C ATOM 0 H MET A 30 145.302 5.589 -4.447 1.00 0.00 H new ATOM 0 HA MET A 30 145.038 3.586 -6.595 1.00 0.00 H new ATOM 0 HB2 MET A 30 146.777 3.932 -4.103 1.00 0.00 H new ATOM 0 HB3 MET A 30 146.806 2.463 -5.057 1.00 0.00 H new ATOM 0 HG2 MET A 30 147.009 4.702 -6.880 1.00 0.00 H new ATOM 0 HG3 MET A 30 148.166 4.956 -5.588 1.00 0.00 H new ATOM 0 HE1 MET A 30 150.738 2.744 -5.640 1.00 0.00 H new ATOM 0 HE2 MET A 30 149.464 3.425 -4.601 1.00 0.00 H new ATOM 0 HE3 MET A 30 149.494 1.679 -4.944 1.00 0.00 H new ATOM 457 N SER A 31 144.074 1.670 -5.109 1.00 0.00 N ATOM 458 CA SER A 31 143.248 0.735 -4.294 1.00 0.00 C ATOM 459 C SER A 31 144.165 0.040 -3.307 1.00 0.00 C ATOM 460 O SER A 31 145.260 -0.381 -3.658 1.00 0.00 O ATOM 461 CB SER A 31 142.622 -0.312 -5.198 1.00 0.00 C ATOM 462 OG SER A 31 142.075 0.316 -6.366 1.00 0.00 O ATOM 0 H SER A 31 144.450 1.280 -5.974 1.00 0.00 H new ATOM 0 HA SER A 31 142.461 1.284 -3.776 1.00 0.00 H new ATOM 0 HB2 SER A 31 143.371 -1.049 -5.488 1.00 0.00 H new ATOM 0 HB3 SER A 31 141.839 -0.847 -4.661 1.00 0.00 H new ATOM 0 HG SER A 31 141.674 -0.365 -6.946 1.00 0.00 H new ATOM 468 N LYS A 32 143.763 -0.044 -2.061 1.00 0.00 N ATOM 469 CA LYS A 32 144.632 -0.663 -1.012 1.00 0.00 C ATOM 470 C LYS A 32 145.281 -1.920 -1.542 1.00 0.00 C ATOM 471 O LYS A 32 146.443 -2.161 -1.325 1.00 0.00 O ATOM 472 CB LYS A 32 143.782 -1.035 0.225 1.00 0.00 C ATOM 473 CG LYS A 32 143.855 0.098 1.273 1.00 0.00 C ATOM 474 CD LYS A 32 144.000 -0.460 2.699 1.00 0.00 C ATOM 475 CE LYS A 32 142.842 -1.412 3.011 1.00 0.00 C ATOM 476 NZ LYS A 32 142.314 -1.160 4.362 1.00 0.00 N ATOM 0 H LYS A 32 142.861 0.293 -1.724 1.00 0.00 H new ATOM 0 HA LYS A 32 145.400 0.059 -0.736 1.00 0.00 H new ATOM 0 HB2 LYS A 32 142.746 -1.202 -0.071 1.00 0.00 H new ATOM 0 HB3 LYS A 32 144.144 -1.967 0.659 1.00 0.00 H new ATOM 0 HG2 LYS A 32 144.700 0.749 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 32 142.956 0.711 1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 32 144.950 -0.986 2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 32 144.012 0.358 3.419 1.00 0.00 H new ATOM 0 HE2 LYS A 32 142.049 -1.282 2.275 1.00 0.00 H new ATOM 0 HE3 LYS A 32 143.182 -2.445 2.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 142.235 -2.060 4.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 142.958 -0.523 4.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 141.375 -0.718 4.291 1.00 0.00 H new ATOM 490 N GLN A 33 144.538 -2.712 -2.250 1.00 0.00 N ATOM 491 CA GLN A 33 145.090 -3.984 -2.780 1.00 0.00 C ATOM 492 C GLN A 33 146.397 -3.712 -3.519 1.00 0.00 C ATOM 493 O GLN A 33 147.316 -4.518 -3.482 1.00 0.00 O ATOM 494 CB GLN A 33 144.077 -4.646 -3.725 1.00 0.00 C ATOM 495 CG GLN A 33 142.699 -4.748 -3.045 1.00 0.00 C ATOM 496 CD GLN A 33 141.862 -3.527 -3.409 1.00 0.00 C ATOM 497 OE1 GLN A 33 142.153 -2.421 -2.966 1.00 0.00 O ATOM 498 NE2 GLN A 33 140.852 -3.658 -4.191 1.00 0.00 N ATOM 0 H GLN A 33 143.562 -2.533 -2.488 1.00 0.00 H new ATOM 0 HA GLN A 33 145.286 -4.660 -1.948 1.00 0.00 H new ATOM 0 HB2 GLN A 33 143.994 -4.066 -4.644 1.00 0.00 H new ATOM 0 HB3 GLN A 33 144.426 -5.640 -4.005 1.00 0.00 H new ATOM 0 HG2 GLN A 33 142.191 -5.658 -3.363 1.00 0.00 H new ATOM 0 HG3 GLN A 33 142.819 -4.811 -1.963 1.00 0.00 H new ATOM 0 HE21 GLN A 33 140.609 -4.577 -4.560 1.00 0.00 H new ATOM 0 HE22 GLN A 33 140.293 -2.843 -4.443 1.00 0.00 H new ATOM 507 N GLU A 34 146.494 -2.604 -4.194 1.00 0.00 N ATOM 508 CA GLU A 34 147.733 -2.295 -4.954 1.00 0.00 C ATOM 509 C GLU A 34 148.787 -1.773 -4.003 1.00 0.00 C ATOM 510 O GLU A 34 149.844 -2.378 -3.858 1.00 0.00 O ATOM 511 CB GLU A 34 147.422 -1.274 -6.053 1.00 0.00 C ATOM 512 CG GLU A 34 146.197 -1.754 -6.872 1.00 0.00 C ATOM 513 CD GLU A 34 146.297 -3.254 -7.122 1.00 0.00 C ATOM 514 OE1 GLU A 34 147.064 -3.638 -7.946 1.00 0.00 O ATOM 515 OE2 GLU A 34 145.622 -3.999 -6.454 1.00 0.00 O ATOM 0 H GLU A 34 145.763 -1.895 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 34 148.115 -3.198 -5.429 1.00 0.00 H new ATOM 0 HB2 GLU A 34 147.218 -0.299 -5.611 1.00 0.00 H new ATOM 0 HB3 GLU A 34 148.286 -1.153 -6.707 1.00 0.00 H new ATOM 0 HG2 GLU A 34 145.277 -1.527 -6.334 1.00 0.00 H new ATOM 0 HG3 GLU A 34 146.151 -1.220 -7.821 1.00 0.00 H new ATOM 522 N LEU A 35 148.492 -0.699 -3.304 1.00 0.00 N ATOM 523 CA LEU A 35 149.453 -0.148 -2.297 1.00 0.00 C ATOM 524 C LEU A 35 149.981 -1.314 -1.447 1.00 0.00 C ATOM 525 O LEU A 35 151.143 -1.385 -1.066 1.00 0.00 O ATOM 526 CB LEU A 35 148.701 0.832 -1.365 1.00 0.00 C ATOM 527 CG LEU A 35 147.983 1.952 -2.176 1.00 0.00 C ATOM 528 CD1 LEU A 35 146.524 2.051 -1.765 1.00 0.00 C ATOM 529 CD2 LEU A 35 148.620 3.301 -1.892 1.00 0.00 C ATOM 0 H LEU A 35 147.619 -0.178 -3.391 1.00 0.00 H new ATOM 0 HA LEU A 35 150.271 0.367 -2.801 1.00 0.00 H new ATOM 0 HB2 LEU A 35 147.969 0.283 -0.773 1.00 0.00 H new ATOM 0 HB3 LEU A 35 149.404 1.282 -0.665 1.00 0.00 H new ATOM 0 HG LEU A 35 148.070 1.699 -3.233 1.00 0.00 H new ATOM 0 HD11 LEU A 35 146.036 2.838 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 35 146.027 1.100 -1.956 1.00 0.00 H new ATOM 0 HD13 LEU A 35 146.460 2.286 -0.703 1.00 0.00 H new ATOM 0 HD21 LEU A 35 148.108 4.073 -2.466 1.00 0.00 H new ATOM 0 HD22 LEU A 35 148.539 3.525 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 35 149.672 3.274 -2.178 1.00 0.00 H new ATOM 541 N ILE A 36 149.130 -2.221 -1.144 1.00 0.00 N ATOM 542 CA ILE A 36 149.536 -3.368 -0.323 1.00 0.00 C ATOM 543 C ILE A 36 150.633 -4.174 -1.064 1.00 0.00 C ATOM 544 O ILE A 36 151.712 -4.375 -0.535 1.00 0.00 O ATOM 545 CB ILE A 36 148.286 -4.194 0.007 1.00 0.00 C ATOM 546 CG1 ILE A 36 147.411 -3.375 0.980 1.00 0.00 C ATOM 547 CG2 ILE A 36 148.661 -5.518 0.661 1.00 0.00 C ATOM 548 CD1 ILE A 36 146.005 -3.943 1.035 1.00 0.00 C ATOM 0 H ILE A 36 148.152 -2.220 -1.433 1.00 0.00 H new ATOM 0 HA ILE A 36 149.977 -3.050 0.622 1.00 0.00 H new ATOM 0 HB ILE A 36 147.747 -4.412 -0.915 1.00 0.00 H new ATOM 0 HG12 ILE A 36 147.854 -3.388 1.976 1.00 0.00 H new ATOM 0 HG13 ILE A 36 147.377 -2.334 0.660 1.00 0.00 H new ATOM 0 HG21 ILE A 36 147.756 -6.083 0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 36 149.290 -6.094 -0.018 1.00 0.00 H new ATOM 0 HG23 ILE A 36 149.206 -5.326 1.585 1.00 0.00 H new ATOM 0 HD11 ILE A 36 145.401 -3.354 1.726 1.00 0.00 H new ATOM 0 HD12 ILE A 36 145.559 -3.907 0.041 1.00 0.00 H new ATOM 0 HD13 ILE A 36 146.043 -4.977 1.378 1.00 0.00 H new ATOM 560 N LYS A 37 150.379 -4.624 -2.269 1.00 0.00 N ATOM 561 CA LYS A 37 151.411 -5.404 -3.005 1.00 0.00 C ATOM 562 C LYS A 37 152.750 -4.647 -2.990 1.00 0.00 C ATOM 563 O LYS A 37 153.825 -5.221 -2.724 1.00 0.00 O ATOM 564 CB LYS A 37 150.980 -5.570 -4.448 1.00 0.00 C ATOM 565 CG LYS A 37 149.470 -5.778 -4.562 1.00 0.00 C ATOM 566 CD LYS A 37 149.166 -6.768 -5.690 1.00 0.00 C ATOM 567 CE LYS A 37 147.847 -6.392 -6.405 1.00 0.00 C ATOM 568 NZ LYS A 37 146.860 -5.846 -5.437 1.00 0.00 N ATOM 0 H LYS A 37 149.502 -4.483 -2.770 1.00 0.00 H new ATOM 0 HA LYS A 37 151.526 -6.376 -2.525 1.00 0.00 H new ATOM 0 HB2 LYS A 37 151.271 -4.688 -5.019 1.00 0.00 H new ATOM 0 HB3 LYS A 37 151.500 -6.421 -4.888 1.00 0.00 H new ATOM 0 HG2 LYS A 37 149.073 -6.154 -3.619 1.00 0.00 H new ATOM 0 HG3 LYS A 37 148.976 -4.826 -4.758 1.00 0.00 H new ATOM 0 HD2 LYS A 37 149.986 -6.773 -6.408 1.00 0.00 H new ATOM 0 HD3 LYS A 37 149.091 -7.777 -5.285 1.00 0.00 H new ATOM 0 HE2 LYS A 37 148.047 -5.655 -7.183 1.00 0.00 H new ATOM 0 HE3 LYS A 37 147.432 -7.271 -6.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 146.188 -5.229 -5.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 146.343 -6.629 -4.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 147.357 -5.297 -4.707 1.00 0.00 H new ATOM 582 N GLU A 38 152.712 -3.380 -3.288 1.00 0.00 N ATOM 583 CA GLU A 38 153.968 -2.619 -3.325 1.00 0.00 C ATOM 584 C GLU A 38 154.549 -2.466 -1.935 1.00 0.00 C ATOM 585 O GLU A 38 155.737 -2.509 -1.782 1.00 0.00 O ATOM 586 CB GLU A 38 153.819 -1.285 -4.049 1.00 0.00 C ATOM 587 CG GLU A 38 152.584 -0.515 -3.605 1.00 0.00 C ATOM 588 CD GLU A 38 152.180 0.375 -4.744 1.00 0.00 C ATOM 589 OE1 GLU A 38 152.839 1.358 -4.951 1.00 0.00 O ATOM 590 OE2 GLU A 38 151.256 0.049 -5.423 1.00 0.00 O ATOM 0 H GLU A 38 151.868 -2.850 -3.505 1.00 0.00 H new ATOM 0 HA GLU A 38 154.683 -3.194 -3.913 1.00 0.00 H new ATOM 0 HB2 GLU A 38 154.706 -0.677 -3.870 1.00 0.00 H new ATOM 0 HB3 GLU A 38 153.766 -1.462 -5.123 1.00 0.00 H new ATOM 0 HG2 GLU A 38 151.776 -1.200 -3.347 1.00 0.00 H new ATOM 0 HG3 GLU A 38 152.799 0.075 -2.714 1.00 0.00 H new ATOM 597 N TYR A 39 153.742 -2.382 -0.900 1.00 0.00 N ATOM 598 CA TYR A 39 154.339 -2.353 0.472 1.00 0.00 C ATOM 599 C TYR A 39 155.261 -3.518 0.638 1.00 0.00 C ATOM 600 O TYR A 39 156.328 -3.396 1.200 1.00 0.00 O ATOM 601 CB TYR A 39 153.271 -2.464 1.550 1.00 0.00 C ATOM 602 CG TYR A 39 152.810 -1.118 1.988 1.00 0.00 C ATOM 603 CD1 TYR A 39 153.703 -0.267 2.647 1.00 0.00 C ATOM 604 CD2 TYR A 39 151.498 -0.731 1.788 1.00 0.00 C ATOM 605 CE1 TYR A 39 153.274 0.963 3.104 1.00 0.00 C ATOM 606 CE2 TYR A 39 151.073 0.496 2.231 1.00 0.00 C ATOM 607 CZ TYR A 39 151.953 1.344 2.893 1.00 0.00 C ATOM 608 OH TYR A 39 151.507 2.530 3.354 1.00 0.00 O ATOM 0 H TYR A 39 152.724 -2.334 -0.944 1.00 0.00 H new ATOM 0 HA TYR A 39 154.866 -1.405 0.578 1.00 0.00 H new ATOM 0 HB2 TYR A 39 152.424 -3.036 1.170 1.00 0.00 H new ATOM 0 HB3 TYR A 39 153.668 -3.012 2.405 1.00 0.00 H new ATOM 0 HD1 TYR A 39 154.728 -0.572 2.798 1.00 0.00 H new ATOM 0 HD2 TYR A 39 150.809 -1.393 1.284 1.00 0.00 H new ATOM 0 HE1 TYR A 39 153.957 1.622 3.620 1.00 0.00 H new ATOM 0 HE2 TYR A 39 150.051 0.804 2.065 1.00 0.00 H new ATOM 0 HH TYR A 39 151.517 3.188 2.628 1.00 0.00 H new ATOM 618 N LEU A 40 154.854 -4.658 0.195 1.00 0.00 N ATOM 619 CA LEU A 40 155.708 -5.854 0.363 1.00 0.00 C ATOM 620 C LEU A 40 157.011 -5.608 -0.366 1.00 0.00 C ATOM 621 O LEU A 40 158.077 -5.793 0.183 1.00 0.00 O ATOM 622 CB LEU A 40 154.993 -7.105 -0.193 1.00 0.00 C ATOM 623 CG LEU A 40 153.476 -7.049 0.132 1.00 0.00 C ATOM 624 CD1 LEU A 40 152.805 -8.351 -0.269 1.00 0.00 C ATOM 625 CD2 LEU A 40 153.252 -6.820 1.629 1.00 0.00 C ATOM 0 H LEU A 40 153.965 -4.818 -0.278 1.00 0.00 H new ATOM 0 HA LEU A 40 155.906 -6.032 1.420 1.00 0.00 H new ATOM 0 HB2 LEU A 40 155.139 -7.166 -1.272 1.00 0.00 H new ATOM 0 HB3 LEU A 40 155.431 -8.005 0.239 1.00 0.00 H new ATOM 0 HG LEU A 40 153.043 -6.221 -0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 40 151.741 -8.299 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 40 152.934 -8.513 -1.339 1.00 0.00 H new ATOM 0 HD13 LEU A 40 153.257 -9.177 0.280 1.00 0.00 H new ATOM 0 HD21 LEU A 40 152.182 -6.784 1.836 1.00 0.00 H new ATOM 0 HD22 LEU A 40 153.703 -7.636 2.193 1.00 0.00 H new ATOM 0 HD23 LEU A 40 153.711 -5.877 1.925 1.00 0.00 H new ATOM 637 N GLU A 41 156.941 -5.138 -1.571 1.00 0.00 N ATOM 638 CA GLU A 41 158.202 -4.845 -2.317 1.00 0.00 C ATOM 639 C GLU A 41 158.958 -3.720 -1.609 1.00 0.00 C ATOM 640 O GLU A 41 160.061 -3.891 -1.133 1.00 0.00 O ATOM 641 CB GLU A 41 157.863 -4.400 -3.746 1.00 0.00 C ATOM 642 CG GLU A 41 156.844 -5.360 -4.379 1.00 0.00 C ATOM 643 CD GLU A 41 157.505 -6.101 -5.496 1.00 0.00 C ATOM 644 OE1 GLU A 41 158.149 -7.079 -5.224 1.00 0.00 O ATOM 645 OE2 GLU A 41 157.369 -5.681 -6.603 1.00 0.00 O ATOM 0 H GLU A 41 156.076 -4.942 -2.076 1.00 0.00 H new ATOM 0 HA GLU A 41 158.819 -5.743 -2.351 1.00 0.00 H new ATOM 0 HB2 GLU A 41 157.459 -3.388 -3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 41 158.770 -4.373 -4.350 1.00 0.00 H new ATOM 0 HG2 GLU A 41 156.471 -6.060 -3.631 1.00 0.00 H new ATOM 0 HG3 GLU A 41 155.984 -4.804 -4.753 1.00 0.00 H new ATOM 652 N LEU A 42 158.358 -2.579 -1.565 1.00 0.00 N ATOM 653 CA LEU A 42 158.956 -1.368 -0.948 1.00 0.00 C ATOM 654 C LEU A 42 159.600 -1.753 0.389 1.00 0.00 C ATOM 655 O LEU A 42 160.776 -1.488 0.641 1.00 0.00 O ATOM 656 CB LEU A 42 157.805 -0.362 -0.695 1.00 0.00 C ATOM 657 CG LEU A 42 158.288 1.093 -0.800 1.00 0.00 C ATOM 658 CD1 LEU A 42 159.617 1.282 -0.082 1.00 0.00 C ATOM 659 CD2 LEU A 42 158.442 1.475 -2.270 1.00 0.00 C ATOM 0 H LEU A 42 157.427 -2.424 -1.951 1.00 0.00 H new ATOM 0 HA LEU A 42 159.715 -0.931 -1.597 1.00 0.00 H new ATOM 0 HB2 LEU A 42 157.007 -0.533 -1.417 1.00 0.00 H new ATOM 0 HB3 LEU A 42 157.382 -0.534 0.295 1.00 0.00 H new ATOM 0 HG LEU A 42 157.547 1.736 -0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 42 159.935 2.321 -0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 42 159.501 1.029 0.972 1.00 0.00 H new ATOM 0 HD13 LEU A 42 160.368 0.632 -0.530 1.00 0.00 H new ATOM 0 HD21 LEU A 42 158.785 2.507 -2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 42 159.170 0.816 -2.743 1.00 0.00 H new ATOM 0 HD23 LEU A 42 157.481 1.375 -2.775 1.00 0.00 H new ATOM 671 N GLU A 43 158.833 -2.354 1.248 1.00 0.00 N ATOM 672 CA GLU A 43 159.352 -2.747 2.585 1.00 0.00 C ATOM 673 C GLU A 43 160.495 -3.723 2.423 1.00 0.00 C ATOM 674 O GLU A 43 161.541 -3.565 3.031 1.00 0.00 O ATOM 675 CB GLU A 43 158.243 -3.408 3.396 1.00 0.00 C ATOM 676 CG GLU A 43 157.277 -2.331 3.924 1.00 0.00 C ATOM 677 CD GLU A 43 156.961 -2.636 5.356 1.00 0.00 C ATOM 678 OE1 GLU A 43 157.758 -2.312 6.194 1.00 0.00 O ATOM 679 OE2 GLU A 43 155.951 -3.223 5.598 1.00 0.00 O ATOM 0 H GLU A 43 157.856 -2.593 1.080 1.00 0.00 H new ATOM 0 HA GLU A 43 159.703 -1.855 3.104 1.00 0.00 H new ATOM 0 HB2 GLU A 43 157.702 -4.123 2.776 1.00 0.00 H new ATOM 0 HB3 GLU A 43 158.671 -3.967 4.228 1.00 0.00 H new ATOM 0 HG2 GLU A 43 157.728 -1.343 3.838 1.00 0.00 H new ATOM 0 HG3 GLU A 43 156.364 -2.317 3.329 1.00 0.00 H new ATOM 686 N LYS A 44 160.313 -4.755 1.649 1.00 0.00 N ATOM 687 CA LYS A 44 161.397 -5.738 1.487 1.00 0.00 C ATOM 688 C LYS A 44 162.640 -5.000 1.016 1.00 0.00 C ATOM 689 O LYS A 44 163.735 -5.224 1.508 1.00 0.00 O ATOM 690 CB LYS A 44 160.980 -6.784 0.456 1.00 0.00 C ATOM 691 CG LYS A 44 159.945 -7.749 1.080 1.00 0.00 C ATOM 692 CD LYS A 44 160.643 -8.767 2.008 1.00 0.00 C ATOM 693 CE LYS A 44 160.642 -10.155 1.360 1.00 0.00 C ATOM 694 NZ LYS A 44 161.213 -10.063 -0.007 1.00 0.00 N ATOM 0 H LYS A 44 159.460 -4.953 1.126 1.00 0.00 H new ATOM 0 HA LYS A 44 161.604 -6.243 2.431 1.00 0.00 H new ATOM 0 HB2 LYS A 44 160.554 -6.295 -0.420 1.00 0.00 H new ATOM 0 HB3 LYS A 44 161.853 -7.342 0.116 1.00 0.00 H new ATOM 0 HG2 LYS A 44 159.205 -7.182 1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 44 159.409 -8.276 0.291 1.00 0.00 H new ATOM 0 HD2 LYS A 44 161.667 -8.449 2.205 1.00 0.00 H new ATOM 0 HD3 LYS A 44 160.131 -8.805 2.969 1.00 0.00 H new ATOM 0 HE2 LYS A 44 161.226 -10.850 1.963 1.00 0.00 H new ATOM 0 HE3 LYS A 44 159.626 -10.547 1.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 161.511 -11.008 -0.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 160.494 -9.691 -0.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 162.035 -9.426 0.002 1.00 0.00 H new ATOM 708 N CYS A 45 162.476 -4.093 0.105 1.00 0.00 N ATOM 709 CA CYS A 45 163.622 -3.315 -0.389 1.00 0.00 C ATOM 710 C CYS A 45 164.207 -2.496 0.754 1.00 0.00 C ATOM 711 O CYS A 45 165.347 -2.648 1.083 1.00 0.00 O ATOM 712 CB CYS A 45 163.170 -2.391 -1.518 1.00 0.00 C ATOM 713 SG CYS A 45 162.198 -3.328 -2.727 1.00 0.00 S ATOM 0 H CYS A 45 161.580 -3.858 -0.322 1.00 0.00 H new ATOM 0 HA CYS A 45 164.385 -3.993 -0.772 1.00 0.00 H new ATOM 0 HB2 CYS A 45 162.574 -1.573 -1.114 1.00 0.00 H new ATOM 0 HB3 CYS A 45 164.037 -1.944 -2.003 1.00 0.00 H new ATOM 0 HG CYS A 45 161.172 -3.865 -2.136 1.00 0.00 H new ATOM 719 N LEU A 46 163.445 -1.627 1.368 1.00 0.00 N ATOM 720 CA LEU A 46 164.032 -0.809 2.499 1.00 0.00 C ATOM 721 C LEU A 46 164.622 -1.755 3.539 1.00 0.00 C ATOM 722 O LEU A 46 165.626 -1.482 4.118 1.00 0.00 O ATOM 723 CB LEU A 46 162.957 0.087 3.154 1.00 0.00 C ATOM 724 CG LEU A 46 163.621 1.037 4.195 1.00 0.00 C ATOM 725 CD1 LEU A 46 164.859 1.709 3.606 1.00 0.00 C ATOM 726 CD2 LEU A 46 162.642 2.126 4.613 1.00 0.00 C ATOM 0 H LEU A 46 162.465 -1.443 1.151 1.00 0.00 H new ATOM 0 HA LEU A 46 164.810 -0.160 2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 46 162.444 0.672 2.390 1.00 0.00 H new ATOM 0 HB3 LEU A 46 162.204 -0.531 3.642 1.00 0.00 H new ATOM 0 HG LEU A 46 163.907 0.434 5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 46 165.305 2.367 4.351 1.00 0.00 H new ATOM 0 HD12 LEU A 46 165.583 0.948 3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 46 164.574 2.293 2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 46 163.118 2.783 5.341 1.00 0.00 H new ATOM 0 HD22 LEU A 46 162.348 2.706 3.738 1.00 0.00 H new ATOM 0 HD23 LEU A 46 161.759 1.669 5.060 1.00 0.00 H new ATOM 738 N SER A 47 164.031 -2.881 3.729 1.00 0.00 N ATOM 739 CA SER A 47 164.576 -3.863 4.692 1.00 0.00 C ATOM 740 C SER A 47 165.932 -4.351 4.198 1.00 0.00 C ATOM 741 O SER A 47 166.923 -4.360 4.925 1.00 0.00 O ATOM 742 CB SER A 47 163.634 -5.038 4.764 1.00 0.00 C ATOM 743 OG SER A 47 162.311 -4.557 5.056 1.00 0.00 O ATOM 0 H SER A 47 163.178 -3.174 3.253 1.00 0.00 H new ATOM 0 HA SER A 47 164.685 -3.402 5.674 1.00 0.00 H new ATOM 0 HB2 SER A 47 163.637 -5.582 3.820 1.00 0.00 H new ATOM 0 HB3 SER A 47 163.960 -5.736 5.535 1.00 0.00 H new ATOM 0 HG SER A 47 161.834 -4.383 4.218 1.00 0.00 H new ATOM 749 N ARG A 48 165.988 -4.769 2.976 1.00 0.00 N ATOM 750 CA ARG A 48 167.249 -5.281 2.423 1.00 0.00 C ATOM 751 C ARG A 48 168.256 -4.141 2.432 1.00 0.00 C ATOM 752 O ARG A 48 169.371 -4.252 2.950 1.00 0.00 O ATOM 753 CB ARG A 48 166.959 -5.823 0.993 1.00 0.00 C ATOM 754 CG ARG A 48 167.383 -4.852 -0.093 1.00 0.00 C ATOM 755 CD ARG A 48 167.267 -5.535 -1.464 1.00 0.00 C ATOM 756 NE ARG A 48 167.829 -4.633 -2.525 1.00 0.00 N ATOM 757 CZ ARG A 48 169.084 -4.730 -2.918 1.00 0.00 C ATOM 758 NH1 ARG A 48 169.886 -5.553 -2.315 1.00 0.00 N ATOM 759 NH2 ARG A 48 169.520 -3.987 -3.899 1.00 0.00 N ATOM 0 H ARG A 48 165.199 -4.776 2.330 1.00 0.00 H new ATOM 0 HA ARG A 48 167.667 -6.100 3.009 1.00 0.00 H new ATOM 0 HB2 ARG A 48 167.481 -6.770 0.854 1.00 0.00 H new ATOM 0 HB3 ARG A 48 165.893 -6.030 0.895 1.00 0.00 H new ATOM 0 HG2 ARG A 48 166.756 -3.961 -0.064 1.00 0.00 H new ATOM 0 HG3 ARG A 48 168.409 -4.525 0.077 1.00 0.00 H new ATOM 0 HD2 ARG A 48 167.805 -6.483 -1.456 1.00 0.00 H new ATOM 0 HD3 ARG A 48 166.223 -5.762 -1.681 1.00 0.00 H new ATOM 0 HE ARG A 48 167.226 -3.929 -2.951 1.00 0.00 H new ATOM 0 HH11 ARG A 48 169.545 -6.122 -1.540 1.00 0.00 H new ATOM 0 HH12 ARG A 48 170.857 -5.631 -2.616 1.00 0.00 H new ATOM 0 HH21 ARG A 48 168.890 -3.332 -4.361 1.00 0.00 H new ATOM 0 HH22 ARG A 48 170.491 -4.062 -4.203 1.00 0.00 H new ATOM 773 N MET A 49 167.850 -3.054 1.896 1.00 0.00 N ATOM 774 CA MET A 49 168.681 -1.842 1.835 1.00 0.00 C ATOM 775 C MET A 49 169.038 -1.396 3.234 1.00 0.00 C ATOM 776 O MET A 49 170.059 -0.843 3.438 1.00 0.00 O ATOM 777 CB MET A 49 167.892 -0.725 1.159 1.00 0.00 C ATOM 778 CG MET A 49 167.524 -1.131 -0.273 1.00 0.00 C ATOM 779 SD MET A 49 168.702 -0.390 -1.413 1.00 0.00 S ATOM 780 CE MET A 49 168.096 1.311 -1.278 1.00 0.00 C ATOM 0 H MET A 49 166.928 -2.945 1.474 1.00 0.00 H new ATOM 0 HA MET A 49 169.589 -2.060 1.273 1.00 0.00 H new ATOM 0 HB2 MET A 49 166.987 -0.512 1.729 1.00 0.00 H new ATOM 0 HB3 MET A 49 168.483 0.191 1.145 1.00 0.00 H new ATOM 0 HG2 MET A 49 167.537 -2.216 -0.372 1.00 0.00 H new ATOM 0 HG3 MET A 49 166.512 -0.801 -0.510 1.00 0.00 H new ATOM 0 HE1 MET A 49 168.909 2.005 -1.490 1.00 0.00 H new ATOM 0 HE2 MET A 49 167.289 1.468 -1.994 1.00 0.00 H new ATOM 0 HE3 MET A 49 167.724 1.486 -0.269 1.00 0.00 H new ATOM 790 N GLU A 50 168.255 -1.735 4.205 1.00 0.00 N ATOM 791 CA GLU A 50 168.602 -1.372 5.595 1.00 0.00 C ATOM 792 C GLU A 50 169.768 -2.207 6.031 1.00 0.00 C ATOM 793 O GLU A 50 170.800 -1.694 6.477 1.00 0.00 O ATOM 794 CB GLU A 50 167.419 -1.614 6.513 1.00 0.00 C ATOM 795 CG GLU A 50 166.548 -0.355 6.605 1.00 0.00 C ATOM 796 CD GLU A 50 166.862 0.357 7.885 1.00 0.00 C ATOM 797 OE1 GLU A 50 166.372 -0.061 8.890 1.00 0.00 O ATOM 798 OE2 GLU A 50 167.607 1.300 7.857 1.00 0.00 O ATOM 0 H GLU A 50 167.382 -2.252 4.096 1.00 0.00 H new ATOM 0 HA GLU A 50 168.862 -0.315 5.644 1.00 0.00 H new ATOM 0 HB2 GLU A 50 166.825 -2.448 6.139 1.00 0.00 H new ATOM 0 HB3 GLU A 50 167.772 -1.893 7.506 1.00 0.00 H new ATOM 0 HG2 GLU A 50 166.738 0.298 5.753 1.00 0.00 H new ATOM 0 HG3 GLU A 50 165.492 -0.623 6.572 1.00 0.00 H new ATOM 805 N ASP A 51 169.646 -3.485 5.880 1.00 0.00 N ATOM 806 CA ASP A 51 170.748 -4.379 6.256 1.00 0.00 C ATOM 807 C ASP A 51 172.003 -3.986 5.526 1.00 0.00 C ATOM 808 O ASP A 51 173.066 -3.915 6.125 1.00 0.00 O ATOM 809 CB ASP A 51 170.387 -5.825 5.945 1.00 0.00 C ATOM 810 CG ASP A 51 169.751 -6.445 7.147 1.00 0.00 C ATOM 811 OD1 ASP A 51 170.440 -6.586 8.130 1.00 0.00 O ATOM 812 OD2 ASP A 51 168.599 -6.783 7.085 1.00 0.00 O ATOM 0 H ASP A 51 168.818 -3.950 5.507 1.00 0.00 H new ATOM 0 HA ASP A 51 170.922 -4.289 7.328 1.00 0.00 H new ATOM 0 HB2 ASP A 51 169.705 -5.867 5.096 1.00 0.00 H new ATOM 0 HB3 ASP A 51 171.280 -6.382 5.664 1.00 0.00 H new ATOM 817 N GLU A 52 171.914 -3.756 4.249 1.00 0.00 N ATOM 818 CA GLU A 52 173.120 -3.368 3.492 1.00 0.00 C ATOM 819 C GLU A 52 173.538 -1.968 3.921 1.00 0.00 C ATOM 820 O GLU A 52 174.663 -1.745 4.252 1.00 0.00 O ATOM 821 CB GLU A 52 172.856 -3.432 1.974 1.00 0.00 C ATOM 822 CG GLU A 52 173.424 -4.755 1.427 1.00 0.00 C ATOM 823 CD GLU A 52 173.035 -4.960 -0.016 1.00 0.00 C ATOM 824 OE1 GLU A 52 171.952 -4.586 -0.393 1.00 0.00 O ATOM 825 OE2 GLU A 52 173.838 -5.463 -0.751 1.00 0.00 O ATOM 0 H GLU A 52 171.056 -3.821 3.701 1.00 0.00 H new ATOM 0 HA GLU A 52 173.930 -4.065 3.707 1.00 0.00 H new ATOM 0 HB2 GLU A 52 171.786 -3.369 1.774 1.00 0.00 H new ATOM 0 HB3 GLU A 52 173.324 -2.585 1.473 1.00 0.00 H new ATOM 0 HG2 GLU A 52 174.510 -4.752 1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 52 173.057 -5.587 2.027 1.00 0.00 H new ATOM 832 N ASN A 53 172.619 -1.044 3.959 1.00 0.00 N ATOM 833 CA ASN A 53 172.926 0.350 4.413 1.00 0.00 C ATOM 834 C ASN A 53 173.727 0.290 5.673 1.00 0.00 C ATOM 835 O ASN A 53 174.748 0.928 5.811 1.00 0.00 O ATOM 836 CB ASN A 53 171.612 1.101 4.700 1.00 0.00 C ATOM 837 CG ASN A 53 171.160 1.819 3.457 1.00 0.00 C ATOM 838 OD1 ASN A 53 170.069 1.668 3.013 1.00 0.00 O ATOM 839 ND2 ASN A 53 171.975 2.605 2.881 1.00 0.00 N ATOM 0 H ASN A 53 171.647 -1.196 3.690 1.00 0.00 H new ATOM 0 HA ASN A 53 173.486 0.868 3.634 1.00 0.00 H new ATOM 0 HB2 ASN A 53 170.844 0.400 5.027 1.00 0.00 H new ATOM 0 HB3 ASN A 53 171.758 1.814 5.511 1.00 0.00 H new ATOM 0 HD21 ASN A 53 171.692 3.105 2.038 1.00 0.00 H new ATOM 0 HD22 ASN A 53 172.912 2.736 3.261 1.00 0.00 H new ATOM 846 N ASN A 54 173.275 -0.503 6.570 1.00 0.00 N ATOM 847 CA ASN A 54 173.960 -0.692 7.871 1.00 0.00 C ATOM 848 C ASN A 54 175.419 -1.055 7.638 1.00 0.00 C ATOM 849 O ASN A 54 176.317 -0.322 8.014 1.00 0.00 O ATOM 850 CB ASN A 54 173.279 -1.831 8.638 1.00 0.00 C ATOM 851 CG ASN A 54 172.155 -1.294 9.521 1.00 0.00 C ATOM 852 OD1 ASN A 54 171.696 -0.164 9.353 1.00 0.00 O ATOM 853 ND2 ASN A 54 171.673 -2.052 10.439 1.00 0.00 N ATOM 0 H ASN A 54 172.425 -1.056 6.461 1.00 0.00 H new ATOM 0 HA ASN A 54 173.903 0.233 8.445 1.00 0.00 H new ATOM 0 HB2 ASN A 54 172.878 -2.560 7.934 1.00 0.00 H new ATOM 0 HB3 ASN A 54 174.013 -2.352 9.253 1.00 0.00 H new ATOM 0 HD21 ASN A 54 170.910 -1.718 11.028 1.00 0.00 H new ATOM 0 HD22 ASN A 54 172.053 -2.988 10.579 1.00 0.00 H new ATOM 860 N ARG A 55 175.671 -2.175 7.007 1.00 0.00 N ATOM 861 CA ARG A 55 177.076 -2.581 6.752 1.00 0.00 C ATOM 862 C ARG A 55 177.727 -1.495 5.927 1.00 0.00 C ATOM 863 O ARG A 55 178.696 -0.923 6.326 1.00 0.00 O ATOM 864 CB ARG A 55 177.115 -3.919 5.992 1.00 0.00 C ATOM 865 CG ARG A 55 176.848 -5.088 6.964 1.00 0.00 C ATOM 866 CD ARG A 55 175.344 -5.212 7.195 1.00 0.00 C ATOM 867 NE ARG A 55 175.006 -6.498 7.879 1.00 0.00 N ATOM 868 CZ ARG A 55 173.734 -6.834 8.023 1.00 0.00 C ATOM 869 NH1 ARG A 55 172.805 -6.058 7.544 1.00 0.00 N ATOM 870 NH2 ARG A 55 173.408 -7.931 8.622 1.00 0.00 N ATOM 0 H ARG A 55 174.962 -2.821 6.660 1.00 0.00 H new ATOM 0 HA ARG A 55 177.608 -2.714 7.694 1.00 0.00 H new ATOM 0 HB2 ARG A 55 176.368 -3.918 5.198 1.00 0.00 H new ATOM 0 HB3 ARG A 55 178.087 -4.047 5.515 1.00 0.00 H new ATOM 0 HG2 ARG A 55 177.243 -6.017 6.553 1.00 0.00 H new ATOM 0 HG3 ARG A 55 177.361 -4.915 7.910 1.00 0.00 H new ATOM 0 HD2 ARG A 55 174.996 -4.374 7.798 1.00 0.00 H new ATOM 0 HD3 ARG A 55 174.821 -5.156 6.240 1.00 0.00 H new ATOM 0 HE ARG A 55 175.745 -7.107 8.230 1.00 0.00 H new ATOM 0 HH11 ARG A 55 173.059 -5.196 7.061 1.00 0.00 H new ATOM 0 HH12 ARG A 55 171.823 -6.312 7.652 1.00 0.00 H new ATOM 0 HH21 ARG A 55 174.134 -8.547 8.989 1.00 0.00 H new ATOM 0 HH22 ARG A 55 172.425 -8.181 8.728 1.00 0.00 H new ATOM 884 N LEU A 56 177.191 -1.230 4.777 1.00 0.00 N ATOM 885 CA LEU A 56 177.725 -0.181 3.859 1.00 0.00 C ATOM 886 C LEU A 56 178.287 0.994 4.654 1.00 0.00 C ATOM 887 O LEU A 56 179.423 1.402 4.460 1.00 0.00 O ATOM 888 CB LEU A 56 176.562 0.335 3.002 1.00 0.00 C ATOM 889 CG LEU A 56 176.412 -0.522 1.729 1.00 0.00 C ATOM 890 CD1 LEU A 56 175.170 -0.081 0.948 1.00 0.00 C ATOM 891 CD2 LEU A 56 177.653 -0.365 0.837 1.00 0.00 C ATOM 0 H LEU A 56 176.370 -1.715 4.416 1.00 0.00 H new ATOM 0 HA LEU A 56 178.518 -0.609 3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 56 175.637 0.307 3.578 1.00 0.00 H new ATOM 0 HB3 LEU A 56 176.737 1.376 2.729 1.00 0.00 H new ATOM 0 HG LEU A 56 176.308 -1.567 2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 56 175.070 -0.690 0.050 1.00 0.00 H new ATOM 0 HD12 LEU A 56 174.285 -0.206 1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 56 175.271 0.967 0.666 1.00 0.00 H new ATOM 0 HD21 LEU A 56 177.536 -0.974 -0.059 1.00 0.00 H new ATOM 0 HD22 LEU A 56 177.766 0.681 0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 56 178.538 -0.690 1.384 1.00 0.00 H new ATOM 903 N ARG A 57 177.502 1.553 5.533 1.00 0.00 N ATOM 904 CA ARG A 57 177.980 2.691 6.350 1.00 0.00 C ATOM 905 C ARG A 57 179.232 2.272 7.097 1.00 0.00 C ATOM 906 O ARG A 57 180.225 3.001 7.134 1.00 0.00 O ATOM 907 CB ARG A 57 176.906 3.091 7.378 1.00 0.00 C ATOM 908 CG ARG A 57 175.586 3.408 6.664 1.00 0.00 C ATOM 909 CD ARG A 57 175.330 4.918 6.639 1.00 0.00 C ATOM 910 NE ARG A 57 173.897 5.143 6.282 1.00 0.00 N ATOM 911 CZ ARG A 57 173.497 6.256 5.712 1.00 0.00 C ATOM 912 NH1 ARG A 57 174.323 7.247 5.574 1.00 0.00 N ATOM 913 NH2 ARG A 57 172.261 6.367 5.319 1.00 0.00 N ATOM 0 H ARG A 57 176.542 1.263 5.718 1.00 0.00 H new ATOM 0 HA ARG A 57 178.190 3.537 5.695 1.00 0.00 H new ATOM 0 HB2 ARG A 57 176.757 2.282 8.093 1.00 0.00 H new ATOM 0 HB3 ARG A 57 177.240 3.960 7.945 1.00 0.00 H new ATOM 0 HG2 ARG A 57 175.617 3.023 5.645 1.00 0.00 H new ATOM 0 HG3 ARG A 57 174.763 2.903 7.170 1.00 0.00 H new ATOM 0 HD2 ARG A 57 175.553 5.357 7.611 1.00 0.00 H new ATOM 0 HD3 ARG A 57 175.983 5.402 5.913 1.00 0.00 H new ATOM 0 HE ARG A 57 173.213 4.414 6.486 1.00 0.00 H new ATOM 0 HH11 ARG A 57 175.283 7.161 5.908 1.00 0.00 H new ATOM 0 HH12 ARG A 57 174.013 8.112 5.131 1.00 0.00 H new ATOM 0 HH21 ARG A 57 171.611 5.593 5.455 1.00 0.00 H new ATOM 0 HH22 ARG A 57 171.942 7.228 4.875 1.00 0.00 H new ATOM 927 N LEU A 58 179.212 1.114 7.674 1.00 0.00 N ATOM 928 CA LEU A 58 180.362 0.620 8.427 1.00 0.00 C ATOM 929 C LEU A 58 181.506 0.357 7.453 1.00 0.00 C ATOM 930 O LEU A 58 182.570 0.923 7.584 1.00 0.00 O ATOM 931 CB LEU A 58 179.977 -0.645 9.196 1.00 0.00 C ATOM 932 CG LEU A 58 178.721 -0.383 10.066 1.00 0.00 C ATOM 933 CD1 LEU A 58 177.976 -1.699 10.345 1.00 0.00 C ATOM 934 CD2 LEU A 58 179.139 0.246 11.395 1.00 0.00 C ATOM 0 H LEU A 58 178.416 0.476 7.649 1.00 0.00 H new ATOM 0 HA LEU A 58 180.686 1.361 9.157 1.00 0.00 H new ATOM 0 HB2 LEU A 58 179.781 -1.458 8.497 1.00 0.00 H new ATOM 0 HB3 LEU A 58 180.807 -0.961 9.828 1.00 0.00 H new ATOM 0 HG LEU A 58 178.060 0.294 9.525 1.00 0.00 H new ATOM 0 HD11 LEU A 58 177.097 -1.497 10.957 1.00 0.00 H new ATOM 0 HD12 LEU A 58 177.666 -2.149 9.402 1.00 0.00 H new ATOM 0 HD13 LEU A 58 178.636 -2.386 10.874 1.00 0.00 H new ATOM 0 HD21 LEU A 58 178.254 0.429 12.005 1.00 0.00 H new ATOM 0 HD22 LEU A 58 179.810 -0.432 11.923 1.00 0.00 H new ATOM 0 HD23 LEU A 58 179.651 1.189 11.206 1.00 0.00 H new ATOM 946 N GLU A 59 181.298 -0.453 6.473 1.00 0.00 N ATOM 947 CA GLU A 59 182.360 -0.740 5.478 1.00 0.00 C ATOM 948 C GLU A 59 182.945 0.579 4.997 1.00 0.00 C ATOM 949 O GLU A 59 184.135 0.813 5.053 1.00 0.00 O ATOM 950 CB GLU A 59 181.721 -1.431 4.264 1.00 0.00 C ATOM 951 CG GLU A 59 180.939 -2.698 4.668 1.00 0.00 C ATOM 952 CD GLU A 59 180.477 -3.445 3.411 1.00 0.00 C ATOM 953 OE1 GLU A 59 180.657 -2.933 2.318 1.00 0.00 O ATOM 954 OE2 GLU A 59 179.950 -4.520 3.556 1.00 0.00 O ATOM 0 H GLU A 59 180.418 -0.943 6.310 1.00 0.00 H new ATOM 0 HA GLU A 59 183.129 -1.369 5.927 1.00 0.00 H new ATOM 0 HB2 GLU A 59 181.049 -0.735 3.762 1.00 0.00 H new ATOM 0 HB3 GLU A 59 182.498 -1.697 3.547 1.00 0.00 H new ATOM 0 HG2 GLU A 59 181.569 -3.347 5.277 1.00 0.00 H new ATOM 0 HG3 GLU A 59 180.078 -2.426 5.278 1.00 0.00 H new ATOM 961 N SER A 60 182.104 1.415 4.496 1.00 0.00 N ATOM 962 CA SER A 60 182.557 2.698 3.935 1.00 0.00 C ATOM 963 C SER A 60 183.367 3.470 4.975 1.00 0.00 C ATOM 964 O SER A 60 184.419 4.014 4.665 1.00 0.00 O ATOM 965 CB SER A 60 181.331 3.518 3.456 1.00 0.00 C ATOM 966 OG SER A 60 181.759 4.632 2.648 1.00 0.00 O ATOM 0 H SER A 60 181.097 1.260 4.450 1.00 0.00 H new ATOM 0 HA SER A 60 183.204 2.513 3.077 1.00 0.00 H new ATOM 0 HB2 SER A 60 180.660 2.880 2.881 1.00 0.00 H new ATOM 0 HB3 SER A 60 180.768 3.879 4.317 1.00 0.00 H new ATOM 0 HG SER A 60 180.976 5.073 2.257 1.00 0.00 H new ATOM 972 N LYS A 61 182.910 3.552 6.204 1.00 0.00 N ATOM 973 CA LYS A 61 183.694 4.348 7.202 1.00 0.00 C ATOM 974 C LYS A 61 184.828 3.494 7.777 1.00 0.00 C ATOM 975 O LYS A 61 185.854 4.004 8.189 1.00 0.00 O ATOM 976 CB LYS A 61 182.775 4.877 8.319 1.00 0.00 C ATOM 977 CG LYS A 61 182.403 3.740 9.298 1.00 0.00 C ATOM 978 CD LYS A 61 181.138 4.106 10.097 1.00 0.00 C ATOM 979 CE LYS A 61 181.524 4.592 11.510 1.00 0.00 C ATOM 980 NZ LYS A 61 182.507 5.697 11.413 1.00 0.00 N ATOM 0 H LYS A 61 182.055 3.117 6.551 1.00 0.00 H new ATOM 0 HA LYS A 61 184.133 5.210 6.700 1.00 0.00 H new ATOM 0 HB2 LYS A 61 183.275 5.681 8.859 1.00 0.00 H new ATOM 0 HB3 LYS A 61 181.870 5.300 7.883 1.00 0.00 H new ATOM 0 HG2 LYS A 61 182.236 2.816 8.744 1.00 0.00 H new ATOM 0 HG3 LYS A 61 183.231 3.556 9.982 1.00 0.00 H new ATOM 0 HD2 LYS A 61 180.582 4.885 9.575 1.00 0.00 H new ATOM 0 HD3 LYS A 61 180.481 3.239 10.169 1.00 0.00 H new ATOM 0 HE2 LYS A 61 180.635 4.930 12.043 1.00 0.00 H new ATOM 0 HE3 LYS A 61 181.946 3.768 12.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 182.522 6.228 12.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 183.452 5.305 11.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 182.237 6.335 10.637 1.00 0.00 H new ATOM 994 N ARG A 62 184.628 2.204 7.854 1.00 0.00 N ATOM 995 CA ARG A 62 185.661 1.306 8.425 1.00 0.00 C ATOM 996 C ARG A 62 186.714 0.991 7.364 1.00 0.00 C ATOM 997 O ARG A 62 187.765 0.454 7.681 1.00 0.00 O ATOM 998 CB ARG A 62 185.075 0.025 9.020 1.00 0.00 C ATOM 999 CG ARG A 62 184.105 0.346 10.177 1.00 0.00 C ATOM 1000 CD ARG A 62 183.676 -0.976 10.852 1.00 0.00 C ATOM 1001 NE ARG A 62 184.893 -1.815 11.119 1.00 0.00 N ATOM 1002 CZ ARG A 62 185.732 -1.488 12.090 1.00 0.00 C ATOM 1003 NH1 ARG A 62 185.451 -0.481 12.881 1.00 0.00 N ATOM 1004 NH2 ARG A 62 186.825 -2.170 12.263 1.00 0.00 N ATOM 0 H ARG A 62 183.779 1.734 7.540 1.00 0.00 H new ATOM 0 HA ARG A 62 186.131 1.833 9.255 1.00 0.00 H new ATOM 0 HB2 ARG A 62 184.550 -0.533 8.245 1.00 0.00 H new ATOM 0 HB3 ARG A 62 185.881 -0.614 9.383 1.00 0.00 H new ATOM 0 HG2 ARG A 62 184.588 1.001 10.903 1.00 0.00 H new ATOM 0 HG3 ARG A 62 183.231 0.878 9.800 1.00 0.00 H new ATOM 0 HD2 ARG A 62 183.152 -0.768 11.785 1.00 0.00 H new ATOM 0 HD3 ARG A 62 182.981 -1.517 10.210 1.00 0.00 H new ATOM 0 HE ARG A 62 185.074 -2.641 10.549 1.00 0.00 H new ATOM 0 HH11 ARG A 62 184.589 0.047 12.747 1.00 0.00 H new ATOM 0 HH12 ARG A 62 186.095 -0.226 13.630 1.00 0.00 H new ATOM 0 HH21 ARG A 62 187.037 -2.958 11.651 1.00 0.00 H new ATOM 0 HH22 ARG A 62 187.471 -1.917 13.011 1.00 0.00 H new ATOM 1018 N LEU A 63 186.561 1.481 6.192 1.00 0.00 N ATOM 1019 CA LEU A 63 187.649 1.381 5.219 1.00 0.00 C ATOM 1020 C LEU A 63 188.535 2.587 5.490 1.00 0.00 C ATOM 1021 O LEU A 63 188.551 3.552 4.750 1.00 0.00 O ATOM 1022 CB LEU A 63 187.088 1.400 3.789 1.00 0.00 C ATOM 1023 CG LEU A 63 186.694 -0.041 3.380 1.00 0.00 C ATOM 1024 CD1 LEU A 63 185.478 -0.024 2.449 1.00 0.00 C ATOM 1025 CD2 LEU A 63 187.871 -0.723 2.669 1.00 0.00 C ATOM 0 H LEU A 63 185.720 1.953 5.860 1.00 0.00 H new ATOM 0 HA LEU A 63 188.209 0.451 5.312 1.00 0.00 H new ATOM 0 HB2 LEU A 63 186.220 2.057 3.734 1.00 0.00 H new ATOM 0 HB3 LEU A 63 187.832 1.797 3.098 1.00 0.00 H new ATOM 0 HG LEU A 63 186.440 -0.597 4.282 1.00 0.00 H new ATOM 0 HD11 LEU A 63 185.217 -1.046 2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 63 184.635 0.441 2.960 1.00 0.00 H new ATOM 0 HD13 LEU A 63 185.716 0.545 1.550 1.00 0.00 H new ATOM 0 HD21 LEU A 63 187.587 -1.736 2.384 1.00 0.00 H new ATOM 0 HD22 LEU A 63 188.135 -0.156 1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 63 188.729 -0.762 3.341 1.00 0.00 H new ATOM 2083 N HIS B 23 152.861 -7.345 7.962 1.00 0.00 N ATOM 2084 CA HIS B 23 151.976 -8.511 7.602 1.00 0.00 C ATOM 2085 C HIS B 23 150.818 -8.044 6.722 1.00 0.00 C ATOM 2086 O HIS B 23 150.329 -6.926 6.846 1.00 0.00 O ATOM 2087 CB HIS B 23 151.451 -9.255 8.853 1.00 0.00 C ATOM 2088 CG HIS B 23 151.069 -10.665 8.480 1.00 0.00 C ATOM 2089 ND1 HIS B 23 149.996 -11.446 8.833 1.00 0.00 N flip ATOM 2090 CD2 HIS B 23 151.825 -11.437 7.604 1.00 0.00 C flip ATOM 2091 CE1 HIS B 23 150.070 -12.675 8.186 1.00 0.00 C flip ATOM 2092 NE2 HIS B 23 151.189 -12.618 7.457 1.00 0.00 N flip ATOM 0 HA HIS B 23 152.583 -9.222 7.042 1.00 0.00 H new ATOM 0 HB2 HIS B 23 152.217 -9.268 9.629 1.00 0.00 H new ATOM 0 HB3 HIS B 23 150.589 -8.731 9.265 1.00 0.00 H new ATOM 0 HD2 HIS B 23 152.750 -11.145 7.129 1.00 0.00 H new ATOM 0 HE1 HIS B 23 149.374 -13.498 8.257 1.00 0.00 H new ATOM 0 HE2 HIS B 23 151.522 -13.376 6.861 1.00 0.00 H new ATOM 2101 N THR B 24 150.428 -8.865 5.791 1.00 0.00 N ATOM 2102 CA THR B 24 149.379 -8.493 4.813 1.00 0.00 C ATOM 2103 C THR B 24 148.118 -7.990 5.537 1.00 0.00 C ATOM 2104 O THR B 24 147.723 -6.841 5.366 1.00 0.00 O ATOM 2105 CB THR B 24 149.070 -9.713 3.926 1.00 0.00 C ATOM 2106 OG1 THR B 24 150.139 -10.674 4.033 1.00 0.00 O ATOM 2107 CG2 THR B 24 148.927 -9.281 2.463 1.00 0.00 C ATOM 0 H THR B 24 150.805 -9.804 5.666 1.00 0.00 H new ATOM 0 HA THR B 24 149.734 -7.678 4.182 1.00 0.00 H new ATOM 0 HB THR B 24 148.135 -10.162 4.261 1.00 0.00 H new ATOM 0 HG1 THR B 24 149.939 -11.450 3.469 1.00 0.00 H new ATOM 0 HG21 THR B 24 148.709 -10.153 1.846 1.00 0.00 H new ATOM 0 HG22 THR B 24 148.114 -8.561 2.374 1.00 0.00 H new ATOM 0 HG23 THR B 24 149.857 -8.822 2.127 1.00 0.00 H new ATOM 2115 N GLU B 25 147.472 -8.826 6.302 1.00 0.00 N ATOM 2116 CA GLU B 25 146.231 -8.411 7.033 1.00 0.00 C ATOM 2117 C GLU B 25 146.356 -6.959 7.463 1.00 0.00 C ATOM 2118 O GLU B 25 145.614 -6.106 7.017 1.00 0.00 O ATOM 2119 CB GLU B 25 146.040 -9.295 8.306 1.00 0.00 C ATOM 2120 CG GLU B 25 146.980 -10.517 8.291 1.00 0.00 C ATOM 2121 CD GLU B 25 146.545 -11.482 7.216 1.00 0.00 C ATOM 2122 OE1 GLU B 25 146.976 -11.332 6.115 1.00 0.00 O ATOM 2123 OE2 GLU B 25 145.774 -12.357 7.506 1.00 0.00 O ATOM 0 H GLU B 25 147.752 -9.794 6.457 1.00 0.00 H new ATOM 0 HA GLU B 25 145.375 -8.533 6.370 1.00 0.00 H new ATOM 0 HB2 GLU B 25 146.232 -8.698 9.197 1.00 0.00 H new ATOM 0 HB3 GLU B 25 145.005 -9.631 8.365 1.00 0.00 H new ATOM 0 HG2 GLU B 25 148.006 -10.196 8.111 1.00 0.00 H new ATOM 0 HG3 GLU B 25 146.966 -11.010 9.263 1.00 0.00 H new ATOM 2130 N SER B 26 147.274 -6.682 8.326 1.00 0.00 N ATOM 2131 CA SER B 26 147.481 -5.301 8.808 1.00 0.00 C ATOM 2132 C SER B 26 147.495 -4.332 7.630 1.00 0.00 C ATOM 2133 O SER B 26 146.758 -3.369 7.606 1.00 0.00 O ATOM 2134 CB SER B 26 148.826 -5.246 9.524 1.00 0.00 C ATOM 2135 OG SER B 26 149.202 -6.572 9.924 1.00 0.00 O ATOM 0 H SER B 26 147.908 -7.372 8.730 1.00 0.00 H new ATOM 0 HA SER B 26 146.674 -5.018 9.484 1.00 0.00 H new ATOM 0 HB2 SER B 26 149.585 -4.823 8.866 1.00 0.00 H new ATOM 0 HB3 SER B 26 148.761 -4.595 10.396 1.00 0.00 H new ATOM 0 HG SER B 26 150.067 -6.542 10.383 1.00 0.00 H new ATOM 2141 N LEU B 27 148.254 -4.636 6.616 1.00 0.00 N ATOM 2142 CA LEU B 27 148.294 -3.764 5.425 1.00 0.00 C ATOM 2143 C LEU B 27 146.876 -3.558 4.908 1.00 0.00 C ATOM 2144 O LEU B 27 146.461 -2.440 4.628 1.00 0.00 O ATOM 2145 CB LEU B 27 149.162 -4.396 4.341 1.00 0.00 C ATOM 2146 CG LEU B 27 150.642 -4.136 4.599 1.00 0.00 C ATOM 2147 CD1 LEU B 27 151.465 -4.831 3.512 1.00 0.00 C ATOM 2148 CD2 LEU B 27 150.936 -2.626 4.565 1.00 0.00 C ATOM 0 H LEU B 27 148.852 -5.461 6.567 1.00 0.00 H new ATOM 0 HA LEU B 27 148.725 -2.800 5.695 1.00 0.00 H new ATOM 0 HB2 LEU B 27 148.979 -5.470 4.305 1.00 0.00 H new ATOM 0 HB3 LEU B 27 148.884 -3.993 3.367 1.00 0.00 H new ATOM 0 HG LEU B 27 150.906 -4.525 5.582 1.00 0.00 H new ATOM 0 HD11 LEU B 27 152.526 -4.651 3.688 1.00 0.00 H new ATOM 0 HD12 LEU B 27 151.270 -5.903 3.537 1.00 0.00 H new ATOM 0 HD13 LEU B 27 151.187 -4.435 2.536 1.00 0.00 H new ATOM 0 HD21 LEU B 27 151.997 -2.458 4.751 1.00 0.00 H new ATOM 0 HD22 LEU B 27 150.671 -2.226 3.586 1.00 0.00 H new ATOM 0 HD23 LEU B 27 150.349 -2.124 5.334 1.00 0.00 H new ATOM 2160 N GLN B 28 146.122 -4.609 4.753 1.00 0.00 N ATOM 2161 CA GLN B 28 144.744 -4.409 4.223 1.00 0.00 C ATOM 2162 C GLN B 28 143.820 -3.952 5.337 1.00 0.00 C ATOM 2163 O GLN B 28 142.783 -3.366 5.083 1.00 0.00 O ATOM 2164 CB GLN B 28 144.160 -5.634 3.475 1.00 0.00 C ATOM 2165 CG GLN B 28 144.951 -6.915 3.767 1.00 0.00 C ATOM 2166 CD GLN B 28 146.036 -7.105 2.714 1.00 0.00 C ATOM 2167 OE1 GLN B 28 147.257 -6.888 3.024 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 145.756 -7.444 1.579 1.00 0.00 N flip ATOM 0 H GLN B 28 146.388 -5.571 4.963 1.00 0.00 H new ATOM 0 HA GLN B 28 144.820 -3.630 3.465 1.00 0.00 H new ATOM 0 HB2 GLN B 28 143.120 -5.776 3.768 1.00 0.00 H new ATOM 0 HB3 GLN B 28 144.166 -5.441 2.402 1.00 0.00 H new ATOM 0 HG2 GLN B 28 145.400 -6.858 4.758 1.00 0.00 H new ATOM 0 HG3 GLN B 28 144.280 -7.774 3.770 1.00 0.00 H new ATOM 0 HE21 GLN B 28 144.784 -7.619 1.324 1.00 0.00 H new ATOM 0 HE22 GLN B 28 146.493 -7.553 0.883 1.00 0.00 H new ATOM 2177 N ASN B 29 144.145 -4.227 6.549 1.00 0.00 N ATOM 2178 CA ASN B 29 143.252 -3.838 7.654 1.00 0.00 C ATOM 2179 C ASN B 29 143.575 -2.425 8.115 1.00 0.00 C ATOM 2180 O ASN B 29 142.947 -1.908 9.024 1.00 0.00 O ATOM 2181 CB ASN B 29 143.394 -4.819 8.797 1.00 0.00 C ATOM 2182 CG ASN B 29 142.663 -6.115 8.457 1.00 0.00 C ATOM 2183 OD1 ASN B 29 142.151 -6.287 7.354 1.00 0.00 O ATOM 2184 ND2 ASN B 29 142.563 -7.025 9.336 1.00 0.00 N ATOM 0 H ASN B 29 144.999 -4.709 6.829 1.00 0.00 H new ATOM 0 HA ASN B 29 142.220 -3.857 7.305 1.00 0.00 H new ATOM 0 HB2 ASN B 29 144.448 -5.023 8.985 1.00 0.00 H new ATOM 0 HB3 ASN B 29 142.985 -4.389 9.711 1.00 0.00 H new ATOM 0 HD21 ASN B 29 142.062 -7.887 9.123 1.00 0.00 H new ATOM 0 HD22 ASN B 29 142.984 -6.894 10.256 1.00 0.00 H new ATOM 2191 N MET B 30 144.517 -1.781 7.481 1.00 0.00 N ATOM 2192 CA MET B 30 144.855 -0.392 7.835 1.00 0.00 C ATOM 2193 C MET B 30 143.991 0.537 7.000 1.00 0.00 C ATOM 2194 O MET B 30 143.550 0.168 5.908 1.00 0.00 O ATOM 2195 CB MET B 30 146.322 -0.124 7.478 1.00 0.00 C ATOM 2196 CG MET B 30 147.245 -0.784 8.506 1.00 0.00 C ATOM 2197 SD MET B 30 148.298 0.479 9.250 1.00 0.00 S ATOM 2198 CE MET B 30 149.343 0.780 7.802 1.00 0.00 C ATOM 0 H MET B 30 145.071 -2.175 6.720 1.00 0.00 H new ATOM 0 HA MET B 30 144.690 -0.229 8.900 1.00 0.00 H new ATOM 0 HB2 MET B 30 146.538 -0.512 6.482 1.00 0.00 H new ATOM 0 HB3 MET B 30 146.507 0.950 7.449 1.00 0.00 H new ATOM 0 HG2 MET B 30 146.655 -1.283 9.275 1.00 0.00 H new ATOM 0 HG3 MET B 30 147.856 -1.549 8.027 1.00 0.00 H new ATOM 0 HE1 MET B 30 150.390 0.646 8.075 1.00 0.00 H new ATOM 0 HE2 MET B 30 149.081 0.076 7.012 1.00 0.00 H new ATOM 0 HE3 MET B 30 149.188 1.799 7.447 1.00 0.00 H new ATOM 2208 N SER B 31 143.794 1.736 7.433 1.00 0.00 N ATOM 2209 CA SER B 31 142.979 2.691 6.622 1.00 0.00 C ATOM 2210 C SER B 31 143.927 3.400 5.660 1.00 0.00 C ATOM 2211 O SER B 31 145.018 3.805 6.043 1.00 0.00 O ATOM 2212 CB SER B 31 142.324 3.726 7.552 1.00 0.00 C ATOM 2213 OG SER B 31 142.010 3.118 8.819 1.00 0.00 O ATOM 0 H SER B 31 144.157 2.107 8.311 1.00 0.00 H new ATOM 0 HA SER B 31 142.196 2.164 6.076 1.00 0.00 H new ATOM 0 HB2 SER B 31 142.997 4.571 7.701 1.00 0.00 H new ATOM 0 HB3 SER B 31 141.417 4.118 7.092 1.00 0.00 H new ATOM 0 HG SER B 31 141.595 3.783 9.407 1.00 0.00 H new ATOM 2219 N LYS B 32 143.566 3.476 4.396 1.00 0.00 N ATOM 2220 CA LYS B 32 144.474 4.078 3.362 1.00 0.00 C ATOM 2221 C LYS B 32 145.108 5.343 3.890 1.00 0.00 C ATOM 2222 O LYS B 32 146.279 5.579 3.711 1.00 0.00 O ATOM 2223 CB LYS B 32 143.667 4.429 2.092 1.00 0.00 C ATOM 2224 CG LYS B 32 143.838 3.318 1.028 1.00 0.00 C ATOM 2225 CD LYS B 32 144.087 3.915 -0.368 1.00 0.00 C ATOM 2226 CE LYS B 32 142.927 4.840 -0.761 1.00 0.00 C ATOM 2227 NZ LYS B 32 142.452 4.531 -2.130 1.00 0.00 N ATOM 0 H LYS B 32 142.672 3.143 4.034 1.00 0.00 H new ATOM 0 HA LYS B 32 145.250 3.350 3.125 1.00 0.00 H new ATOM 0 HB2 LYS B 32 142.612 4.544 2.342 1.00 0.00 H new ATOM 0 HB3 LYS B 32 144.005 5.384 1.689 1.00 0.00 H new ATOM 0 HG2 LYS B 32 144.672 2.672 1.304 1.00 0.00 H new ATOM 0 HG3 LYS B 32 142.945 2.693 1.005 1.00 0.00 H new ATOM 0 HD2 LYS B 32 145.024 4.472 -0.372 1.00 0.00 H new ATOM 0 HD3 LYS B 32 144.189 3.115 -1.101 1.00 0.00 H new ATOM 0 HE2 LYS B 32 142.107 4.725 -0.052 1.00 0.00 H new ATOM 0 HE3 LYS B 32 143.250 5.880 -0.709 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 142.430 5.404 -2.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 143.096 3.847 -2.575 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 141.496 4.125 -2.082 1.00 0.00 H new ATOM 2241 N GLN B 33 144.346 6.137 4.558 1.00 0.00 N ATOM 2242 CA GLN B 33 144.865 7.415 5.100 1.00 0.00 C ATOM 2243 C GLN B 33 146.133 7.146 5.903 1.00 0.00 C ATOM 2244 O GLN B 33 147.044 7.963 5.939 1.00 0.00 O ATOM 2245 CB GLN B 33 143.803 8.057 6.003 1.00 0.00 C ATOM 2246 CG GLN B 33 142.435 8.088 5.284 1.00 0.00 C ATOM 2247 CD GLN B 33 141.640 6.828 5.637 1.00 0.00 C ATOM 2248 OE1 GLN B 33 142.119 5.727 5.447 1.00 0.00 O ATOM 2249 NE2 GLN B 33 140.466 6.933 6.151 1.00 0.00 N ATOM 0 H GLN B 33 143.363 5.956 4.759 1.00 0.00 H new ATOM 0 HA GLN B 33 145.096 8.094 4.279 1.00 0.00 H new ATOM 0 HB2 GLN B 33 143.720 7.496 6.934 1.00 0.00 H new ATOM 0 HB3 GLN B 33 144.105 9.070 6.268 1.00 0.00 H new ATOM 0 HG2 GLN B 33 141.877 8.977 5.580 1.00 0.00 H new ATOM 0 HG3 GLN B 33 142.581 8.148 4.205 1.00 0.00 H new ATOM 0 HE21 GLN B 33 140.060 7.855 6.312 1.00 0.00 H new ATOM 0 HE22 GLN B 33 139.940 6.094 6.398 1.00 0.00 H new ATOM 2258 N GLU B 34 146.204 6.028 6.551 1.00 0.00 N ATOM 2259 CA GLU B 34 147.399 5.712 7.361 1.00 0.00 C ATOM 2260 C GLU B 34 148.490 5.194 6.455 1.00 0.00 C ATOM 2261 O GLU B 34 149.544 5.804 6.348 1.00 0.00 O ATOM 2262 CB GLU B 34 147.027 4.690 8.443 1.00 0.00 C ATOM 2263 CG GLU B 34 145.792 5.211 9.225 1.00 0.00 C ATOM 2264 CD GLU B 34 145.949 6.703 9.494 1.00 0.00 C ATOM 2265 OE1 GLU B 34 146.832 7.051 10.227 1.00 0.00 O ATOM 2266 OE2 GLU B 34 145.206 7.484 8.930 1.00 0.00 O ATOM 0 H GLU B 34 145.478 5.312 6.554 1.00 0.00 H new ATOM 0 HA GLU B 34 147.769 6.608 7.860 1.00 0.00 H new ATOM 0 HB2 GLU B 34 146.805 3.724 7.989 1.00 0.00 H new ATOM 0 HB3 GLU B 34 147.866 4.538 9.122 1.00 0.00 H new ATOM 0 HG2 GLU B 34 144.883 5.028 8.652 1.00 0.00 H new ATOM 0 HG3 GLU B 34 145.690 4.670 10.166 1.00 0.00 H new ATOM 2273 N LEU B 35 148.235 4.124 5.753 1.00 0.00 N ATOM 2274 CA LEU B 35 149.243 3.582 4.785 1.00 0.00 C ATOM 2275 C LEU B 35 149.813 4.756 3.970 1.00 0.00 C ATOM 2276 O LEU B 35 151.006 4.864 3.698 1.00 0.00 O ATOM 2277 CB LEU B 35 148.525 2.613 3.819 1.00 0.00 C ATOM 2278 CG LEU B 35 147.809 1.475 4.602 1.00 0.00 C ATOM 2279 CD1 LEU B 35 146.368 1.336 4.140 1.00 0.00 C ATOM 2280 CD2 LEU B 35 148.504 0.148 4.345 1.00 0.00 C ATOM 0 H LEU B 35 147.365 3.594 5.806 1.00 0.00 H new ATOM 0 HA LEU B 35 150.042 3.064 5.315 1.00 0.00 H new ATOM 0 HB2 LEU B 35 147.797 3.162 3.222 1.00 0.00 H new ATOM 0 HB3 LEU B 35 149.248 2.183 3.125 1.00 0.00 H new ATOM 0 HG LEU B 35 147.842 1.728 5.662 1.00 0.00 H new ATOM 0 HD11 LEU B 35 145.883 0.536 4.698 1.00 0.00 H new ATOM 0 HD12 LEU B 35 145.838 2.273 4.314 1.00 0.00 H new ATOM 0 HD13 LEU B 35 146.348 1.100 3.076 1.00 0.00 H new ATOM 0 HD21 LEU B 35 147.995 -0.642 4.897 1.00 0.00 H new ATOM 0 HD22 LEU B 35 148.475 -0.078 3.279 1.00 0.00 H new ATOM 0 HD23 LEU B 35 149.541 0.211 4.674 1.00 0.00 H new ATOM 2292 N ILE B 36 148.973 5.649 3.608 1.00 0.00 N ATOM 2293 CA ILE B 36 149.424 6.810 2.831 1.00 0.00 C ATOM 2294 C ILE B 36 150.478 7.608 3.649 1.00 0.00 C ATOM 2295 O ILE B 36 151.574 7.848 3.172 1.00 0.00 O ATOM 2296 CB ILE B 36 148.200 7.642 2.433 1.00 0.00 C ATOM 2297 CG1 ILE B 36 147.367 6.821 1.425 1.00 0.00 C ATOM 2298 CG2 ILE B 36 148.621 8.956 1.786 1.00 0.00 C ATOM 2299 CD1 ILE B 36 145.960 7.383 1.316 1.00 0.00 C ATOM 0 H ILE B 36 147.975 5.629 3.818 1.00 0.00 H new ATOM 0 HA ILE B 36 149.919 6.503 1.910 1.00 0.00 H new ATOM 0 HB ILE B 36 147.617 7.873 3.324 1.00 0.00 H new ATOM 0 HG12 ILE B 36 147.848 6.838 0.447 1.00 0.00 H new ATOM 0 HG13 ILE B 36 147.325 5.779 1.742 1.00 0.00 H new ATOM 0 HG21 ILE B 36 147.734 9.528 1.513 1.00 0.00 H new ATOM 0 HG22 ILE B 36 149.222 9.532 2.490 1.00 0.00 H new ATOM 0 HG23 ILE B 36 149.209 8.749 0.892 1.00 0.00 H new ATOM 0 HD11 ILE B 36 145.387 6.792 0.601 1.00 0.00 H new ATOM 0 HD12 ILE B 36 145.475 7.343 2.292 1.00 0.00 H new ATOM 0 HD13 ILE B 36 146.007 8.418 0.977 1.00 0.00 H new ATOM 2311 N LYS B 37 150.166 8.018 4.856 1.00 0.00 N ATOM 2312 CA LYS B 37 151.156 8.792 5.654 1.00 0.00 C ATOM 2313 C LYS B 37 152.495 8.043 5.719 1.00 0.00 C ATOM 2314 O LYS B 37 153.574 8.627 5.508 1.00 0.00 O ATOM 2315 CB LYS B 37 150.643 8.970 7.067 1.00 0.00 C ATOM 2316 CG LYS B 37 149.139 9.230 7.087 1.00 0.00 C ATOM 2317 CD LYS B 37 148.798 10.281 8.155 1.00 0.00 C ATOM 2318 CE LYS B 37 147.471 9.920 8.861 1.00 0.00 C ATOM 2319 NZ LYS B 37 146.515 9.309 7.897 1.00 0.00 N ATOM 0 H LYS B 37 149.272 7.849 5.317 1.00 0.00 H new ATOM 0 HA LYS B 37 151.300 9.761 5.175 1.00 0.00 H new ATOM 0 HB2 LYS B 37 150.867 8.078 7.652 1.00 0.00 H new ATOM 0 HB3 LYS B 37 151.163 9.801 7.542 1.00 0.00 H new ATOM 0 HG2 LYS B 37 148.809 9.576 6.107 1.00 0.00 H new ATOM 0 HG3 LYS B 37 148.605 8.303 7.295 1.00 0.00 H new ATOM 0 HD2 LYS B 37 149.603 10.339 8.888 1.00 0.00 H new ATOM 0 HD3 LYS B 37 148.716 11.265 7.693 1.00 0.00 H new ATOM 0 HE2 LYS B 37 147.665 9.226 9.679 1.00 0.00 H new ATOM 0 HE3 LYS B 37 147.031 10.815 9.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 145.831 8.719 8.413 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 146.009 10.061 7.387 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 147.037 8.720 7.217 1.00 0.00 H new ATOM 2333 N GLU B 38 152.458 6.770 6.019 1.00 0.00 N ATOM 2334 CA GLU B 38 153.728 6.035 6.126 1.00 0.00 C ATOM 2335 C GLU B 38 154.387 5.930 4.778 1.00 0.00 C ATOM 2336 O GLU B 38 155.579 6.020 4.688 1.00 0.00 O ATOM 2337 CB GLU B 38 153.568 4.670 6.800 1.00 0.00 C ATOM 2338 CG GLU B 38 152.444 3.846 6.189 1.00 0.00 C ATOM 2339 CD GLU B 38 152.076 2.775 7.181 1.00 0.00 C ATOM 2340 OE1 GLU B 38 151.229 3.036 7.991 1.00 0.00 O ATOM 2341 OE2 GLU B 38 152.694 1.730 7.167 1.00 0.00 O ATOM 0 H GLU B 38 151.613 6.225 6.190 1.00 0.00 H new ATOM 0 HA GLU B 38 154.384 6.608 6.781 1.00 0.00 H new ATOM 0 HB2 GLU B 38 154.504 4.117 6.720 1.00 0.00 H new ATOM 0 HB3 GLU B 38 153.372 4.814 7.863 1.00 0.00 H new ATOM 0 HG2 GLU B 38 151.583 4.477 5.969 1.00 0.00 H new ATOM 0 HG3 GLU B 38 152.763 3.402 5.246 1.00 0.00 H new ATOM 2348 N TYR B 39 153.637 5.837 3.705 1.00 0.00 N ATOM 2349 CA TYR B 39 154.296 5.846 2.366 1.00 0.00 C ATOM 2350 C TYR B 39 155.198 7.031 2.251 1.00 0.00 C ATOM 2351 O TYR B 39 156.303 6.919 1.794 1.00 0.00 O ATOM 2352 CB TYR B 39 153.279 5.941 1.242 1.00 0.00 C ATOM 2353 CG TYR B 39 152.880 4.589 0.765 1.00 0.00 C ATOM 2354 CD1 TYR B 39 153.846 3.741 0.215 1.00 0.00 C ATOM 2355 CD2 TYR B 39 151.554 4.201 0.811 1.00 0.00 C ATOM 2356 CE1 TYR B 39 153.475 2.517 -0.294 1.00 0.00 C ATOM 2357 CE2 TYR B 39 151.185 2.975 0.319 1.00 0.00 C ATOM 2358 CZ TYR B 39 152.141 2.131 -0.240 1.00 0.00 C ATOM 2359 OH TYR B 39 151.757 0.954 -0.789 1.00 0.00 O ATOM 0 H TYR B 39 152.620 5.757 3.699 1.00 0.00 H new ATOM 0 HA TYR B 39 154.853 4.913 2.278 1.00 0.00 H new ATOM 0 HB2 TYR B 39 152.399 6.482 1.589 1.00 0.00 H new ATOM 0 HB3 TYR B 39 153.699 6.513 0.415 1.00 0.00 H new ATOM 0 HD1 TYR B 39 154.882 4.046 0.190 1.00 0.00 H new ATOM 0 HD2 TYR B 39 150.811 4.861 1.233 1.00 0.00 H new ATOM 0 HE1 TYR B 39 154.214 1.862 -0.732 1.00 0.00 H new ATOM 0 HE2 TYR B 39 150.152 2.664 0.365 1.00 0.00 H new ATOM 0 HH TYR B 39 151.644 0.285 -0.082 1.00 0.00 H new ATOM 2369 N LEU B 40 154.739 8.169 2.644 1.00 0.00 N ATOM 2370 CA LEU B 40 155.588 9.372 2.514 1.00 0.00 C ATOM 2371 C LEU B 40 156.857 9.149 3.321 1.00 0.00 C ATOM 2372 O LEU B 40 157.944 9.409 2.860 1.00 0.00 O ATOM 2373 CB LEU B 40 154.827 10.621 3.009 1.00 0.00 C ATOM 2374 CG LEU B 40 153.332 10.547 2.583 1.00 0.00 C ATOM 2375 CD1 LEU B 40 152.622 11.848 2.919 1.00 0.00 C ATOM 2376 CD2 LEU B 40 153.201 10.287 1.075 1.00 0.00 C ATOM 0 H LEU B 40 153.816 8.323 3.049 1.00 0.00 H new ATOM 0 HA LEU B 40 155.847 9.541 1.469 1.00 0.00 H new ATOM 0 HB2 LEU B 40 154.900 10.693 4.094 1.00 0.00 H new ATOM 0 HB3 LEU B 40 155.285 11.521 2.598 1.00 0.00 H new ATOM 0 HG LEU B 40 152.874 9.723 3.130 1.00 0.00 H new ATOM 0 HD11 LEU B 40 151.577 11.781 2.615 1.00 0.00 H new ATOM 0 HD12 LEU B 40 152.677 12.026 3.993 1.00 0.00 H new ATOM 0 HD13 LEU B 40 153.102 12.671 2.390 1.00 0.00 H new ATOM 0 HD21 LEU B 40 152.146 10.240 0.804 1.00 0.00 H new ATOM 0 HD22 LEU B 40 153.682 11.095 0.523 1.00 0.00 H new ATOM 0 HD23 LEU B 40 153.682 9.341 0.826 1.00 0.00 H new ATOM 2388 N GLU B 41 156.734 8.619 4.496 1.00 0.00 N ATOM 2389 CA GLU B 41 157.962 8.339 5.303 1.00 0.00 C ATOM 2390 C GLU B 41 158.781 7.239 4.614 1.00 0.00 C ATOM 2391 O GLU B 41 159.916 7.435 4.213 1.00 0.00 O ATOM 2392 CB GLU B 41 157.551 7.856 6.698 1.00 0.00 C ATOM 2393 CG GLU B 41 156.595 8.868 7.342 1.00 0.00 C ATOM 2394 CD GLU B 41 157.195 9.350 8.625 1.00 0.00 C ATOM 2395 OE1 GLU B 41 158.081 10.159 8.569 1.00 0.00 O ATOM 2396 OE2 GLU B 41 156.775 8.898 9.653 1.00 0.00 O ATOM 0 H GLU B 41 155.850 8.366 4.937 1.00 0.00 H new ATOM 0 HA GLU B 41 158.559 9.247 5.387 1.00 0.00 H new ATOM 0 HB2 GLU B 41 157.068 6.881 6.627 1.00 0.00 H new ATOM 0 HB3 GLU B 41 158.435 7.729 7.323 1.00 0.00 H new ATOM 0 HG2 GLU B 41 156.423 9.707 6.667 1.00 0.00 H new ATOM 0 HG3 GLU B 41 155.626 8.405 7.529 1.00 0.00 H new ATOM 2403 N LEU B 42 158.203 6.090 4.513 1.00 0.00 N ATOM 2404 CA LEU B 42 158.850 4.897 3.915 1.00 0.00 C ATOM 2405 C LEU B 42 159.517 5.297 2.591 1.00 0.00 C ATOM 2406 O LEU B 42 160.710 5.078 2.375 1.00 0.00 O ATOM 2407 CB LEU B 42 157.734 3.853 3.645 1.00 0.00 C ATOM 2408 CG LEU B 42 158.260 2.414 3.768 1.00 0.00 C ATOM 2409 CD1 LEU B 42 159.561 2.246 3.004 1.00 0.00 C ATOM 2410 CD2 LEU B 42 158.479 2.068 5.245 1.00 0.00 C ATOM 0 H LEU B 42 157.252 5.916 4.839 1.00 0.00 H new ATOM 0 HA LEU B 42 159.608 4.485 4.581 1.00 0.00 H new ATOM 0 HB2 LEU B 42 156.917 4.003 4.350 1.00 0.00 H new ATOM 0 HB3 LEU B 42 157.325 4.007 2.646 1.00 0.00 H new ATOM 0 HG LEU B 42 157.519 1.739 3.340 1.00 0.00 H new ATOM 0 HD11 LEU B 42 159.913 1.220 3.106 1.00 0.00 H new ATOM 0 HD12 LEU B 42 159.396 2.470 1.950 1.00 0.00 H new ATOM 0 HD13 LEU B 42 160.310 2.928 3.406 1.00 0.00 H new ATOM 0 HD21 LEU B 42 158.852 1.047 5.328 1.00 0.00 H new ATOM 0 HD22 LEU B 42 159.206 2.756 5.676 1.00 0.00 H new ATOM 0 HD23 LEU B 42 157.535 2.154 5.783 1.00 0.00 H new ATOM 2422 N GLU B 43 158.757 5.864 1.704 1.00 0.00 N ATOM 2423 CA GLU B 43 159.304 6.275 0.382 1.00 0.00 C ATOM 2424 C GLU B 43 160.447 7.241 0.595 1.00 0.00 C ATOM 2425 O GLU B 43 161.506 7.088 0.007 1.00 0.00 O ATOM 2426 CB GLU B 43 158.222 6.961 -0.465 1.00 0.00 C ATOM 2427 CG GLU B 43 157.390 5.907 -1.223 1.00 0.00 C ATOM 2428 CD GLU B 43 157.513 6.156 -2.706 1.00 0.00 C ATOM 2429 OE1 GLU B 43 158.617 6.118 -3.202 1.00 0.00 O ATOM 2430 OE2 GLU B 43 156.522 6.407 -3.333 1.00 0.00 O ATOM 0 H GLU B 43 157.766 6.064 1.838 1.00 0.00 H new ATOM 0 HA GLU B 43 159.651 5.385 -0.143 1.00 0.00 H new ATOM 0 HB2 GLU B 43 157.571 7.556 0.176 1.00 0.00 H new ATOM 0 HB3 GLU B 43 158.686 7.647 -1.174 1.00 0.00 H new ATOM 0 HG2 GLU B 43 157.741 4.904 -0.979 1.00 0.00 H new ATOM 0 HG3 GLU B 43 156.345 5.962 -0.918 1.00 0.00 H new ATOM 2437 N LYS B 44 160.243 8.266 1.374 1.00 0.00 N ATOM 2438 CA LYS B 44 161.317 9.254 1.586 1.00 0.00 C ATOM 2439 C LYS B 44 162.547 8.521 2.088 1.00 0.00 C ATOM 2440 O LYS B 44 163.652 8.734 1.609 1.00 0.00 O ATOM 2441 CB LYS B 44 160.864 10.280 2.622 1.00 0.00 C ATOM 2442 CG LYS B 44 159.831 11.238 1.993 1.00 0.00 C ATOM 2443 CD LYS B 44 160.525 12.229 1.046 1.00 0.00 C ATOM 2444 CE LYS B 44 160.419 13.652 1.600 1.00 0.00 C ATOM 2445 NZ LYS B 44 160.912 13.685 2.999 1.00 0.00 N ATOM 0 H LYS B 44 159.373 8.456 1.871 1.00 0.00 H new ATOM 0 HA LYS B 44 161.548 9.772 0.655 1.00 0.00 H new ATOM 0 HB2 LYS B 44 160.427 9.773 3.482 1.00 0.00 H new ATOM 0 HB3 LYS B 44 161.722 10.845 2.987 1.00 0.00 H new ATOM 0 HG2 LYS B 44 159.082 10.666 1.445 1.00 0.00 H new ATOM 0 HG3 LYS B 44 159.306 11.782 2.778 1.00 0.00 H new ATOM 0 HD2 LYS B 44 161.573 11.955 0.926 1.00 0.00 H new ATOM 0 HD3 LYS B 44 160.067 12.181 0.058 1.00 0.00 H new ATOM 0 HE2 LYS B 44 161.002 14.336 0.983 1.00 0.00 H new ATOM 0 HE3 LYS B 44 159.384 13.991 1.562 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 161.285 14.632 3.213 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 160.130 13.466 3.648 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 161.668 12.980 3.117 1.00 0.00 H new ATOM 2459 N CYS B 45 162.367 7.634 3.018 1.00 0.00 N ATOM 2460 CA CYS B 45 163.505 6.870 3.546 1.00 0.00 C ATOM 2461 C CYS B 45 164.135 6.060 2.419 1.00 0.00 C ATOM 2462 O CYS B 45 165.286 6.210 2.142 1.00 0.00 O ATOM 2463 CB CYS B 45 163.030 5.941 4.659 1.00 0.00 C ATOM 2464 SG CYS B 45 162.054 6.876 5.863 1.00 0.00 S ATOM 0 H CYS B 45 161.464 7.408 3.436 1.00 0.00 H new ATOM 0 HA CYS B 45 164.248 7.555 3.954 1.00 0.00 H new ATOM 0 HB2 CYS B 45 162.430 5.133 4.240 1.00 0.00 H new ATOM 0 HB3 CYS B 45 163.887 5.480 5.151 1.00 0.00 H new ATOM 0 HG CYS B 45 161.080 7.484 5.254 1.00 0.00 H new ATOM 2470 N LEU B 46 163.400 5.203 1.763 1.00 0.00 N ATOM 2471 CA LEU B 46 164.039 4.407 0.651 1.00 0.00 C ATOM 2472 C LEU B 46 164.649 5.375 -0.366 1.00 0.00 C ATOM 2473 O LEU B 46 165.688 5.131 -0.902 1.00 0.00 O ATOM 2474 CB LEU B 46 163.003 3.491 -0.036 1.00 0.00 C ATOM 2475 CG LEU B 46 163.716 2.544 -1.040 1.00 0.00 C ATOM 2476 CD1 LEU B 46 164.935 1.893 -0.397 1.00 0.00 C ATOM 2477 CD2 LEU B 46 162.767 1.441 -1.485 1.00 0.00 C ATOM 0 H LEU B 46 162.412 5.016 1.934 1.00 0.00 H new ATOM 0 HA LEU B 46 164.820 3.771 1.069 1.00 0.00 H new ATOM 0 HB2 LEU B 46 162.469 2.906 0.713 1.00 0.00 H new ATOM 0 HB3 LEU B 46 162.260 4.095 -0.557 1.00 0.00 H new ATOM 0 HG LEU B 46 164.028 3.142 -1.896 1.00 0.00 H new ATOM 0 HD11 LEU B 46 165.419 1.234 -1.118 1.00 0.00 H new ATOM 0 HD12 LEU B 46 165.637 2.666 -0.084 1.00 0.00 H new ATOM 0 HD13 LEU B 46 164.622 1.313 0.471 1.00 0.00 H new ATOM 0 HD21 LEU B 46 163.278 0.783 -2.189 1.00 0.00 H new ATOM 0 HD22 LEU B 46 162.446 0.865 -0.617 1.00 0.00 H new ATOM 0 HD23 LEU B 46 161.896 1.883 -1.969 1.00 0.00 H new ATOM 2489 N SER B 47 164.040 6.497 -0.576 1.00 0.00 N ATOM 2490 CA SER B 47 164.611 7.497 -1.513 1.00 0.00 C ATOM 2491 C SER B 47 165.966 7.967 -0.977 1.00 0.00 C ATOM 2492 O SER B 47 166.975 7.963 -1.677 1.00 0.00 O ATOM 2493 CB SER B 47 163.680 8.697 -1.590 1.00 0.00 C ATOM 2494 OG SER B 47 162.340 8.253 -1.887 1.00 0.00 O ATOM 0 H SER B 47 163.162 6.771 -0.136 1.00 0.00 H new ATOM 0 HA SER B 47 164.730 7.049 -2.500 1.00 0.00 H new ATOM 0 HB2 SER B 47 163.693 9.241 -0.645 1.00 0.00 H new ATOM 0 HB3 SER B 47 164.024 9.388 -2.360 1.00 0.00 H new ATOM 0 HG SER B 47 161.898 7.970 -1.059 1.00 0.00 H new ATOM 2500 N ARG B 48 165.992 8.383 0.249 1.00 0.00 N ATOM 2501 CA ARG B 48 167.242 8.879 0.861 1.00 0.00 C ATOM 2502 C ARG B 48 168.241 7.723 0.887 1.00 0.00 C ATOM 2503 O ARG B 48 169.384 7.828 0.439 1.00 0.00 O ATOM 2504 CB ARG B 48 166.889 9.394 2.289 1.00 0.00 C ATOM 2505 CG ARG B 48 167.247 8.394 3.375 1.00 0.00 C ATOM 2506 CD ARG B 48 166.971 9.011 4.751 1.00 0.00 C ATOM 2507 NE ARG B 48 167.558 8.147 5.817 1.00 0.00 N ATOM 2508 CZ ARG B 48 168.817 8.276 6.173 1.00 0.00 C ATOM 2509 NH1 ARG B 48 169.578 9.135 5.566 1.00 0.00 N ATOM 2510 NH2 ARG B 48 169.295 7.544 7.118 1.00 0.00 N ATOM 0 H ARG B 48 165.180 8.400 0.866 1.00 0.00 H new ATOM 0 HA ARG B 48 167.693 9.699 0.302 1.00 0.00 H new ATOM 0 HB2 ARG B 48 167.416 10.330 2.474 1.00 0.00 H new ATOM 0 HB3 ARG B 48 165.822 9.613 2.339 1.00 0.00 H new ATOM 0 HG2 ARG B 48 166.664 7.482 3.250 1.00 0.00 H new ATOM 0 HG3 ARG B 48 168.297 8.114 3.294 1.00 0.00 H new ATOM 0 HD2 ARG B 48 167.399 10.012 4.804 1.00 0.00 H new ATOM 0 HD3 ARG B 48 165.897 9.115 4.905 1.00 0.00 H new ATOM 0 HE ARG B 48 166.975 7.447 6.275 1.00 0.00 H new ATOM 0 HH11 ARG B 48 169.199 9.710 4.813 1.00 0.00 H new ATOM 0 HH12 ARG B 48 170.555 9.235 5.842 1.00 0.00 H new ATOM 0 HH21 ARG B 48 168.697 6.865 7.589 1.00 0.00 H new ATOM 0 HH22 ARG B 48 170.272 7.643 7.395 1.00 0.00 H new ATOM 2524 N MET B 49 167.807 6.635 1.396 1.00 0.00 N ATOM 2525 CA MET B 49 168.645 5.430 1.488 1.00 0.00 C ATOM 2526 C MET B 49 169.076 5.005 0.101 1.00 0.00 C ATOM 2527 O MET B 49 170.122 4.488 -0.061 1.00 0.00 O ATOM 2528 CB MET B 49 167.844 4.297 2.131 1.00 0.00 C ATOM 2529 CG MET B 49 167.385 4.712 3.539 1.00 0.00 C ATOM 2530 SD MET B 49 168.517 4.034 4.761 1.00 0.00 S ATOM 2531 CE MET B 49 167.969 2.318 4.635 1.00 0.00 C ATOM 0 H MET B 49 166.865 6.520 1.770 1.00 0.00 H new ATOM 0 HA MET B 49 169.523 5.650 2.095 1.00 0.00 H new ATOM 0 HB2 MET B 49 166.979 4.056 1.514 1.00 0.00 H new ATOM 0 HB3 MET B 49 168.455 3.396 2.189 1.00 0.00 H new ATOM 0 HG2 MET B 49 167.355 5.799 3.618 1.00 0.00 H new ATOM 0 HG3 MET B 49 166.373 4.351 3.725 1.00 0.00 H new ATOM 0 HE1 MET B 49 168.771 1.655 4.960 1.00 0.00 H new ATOM 0 HE2 MET B 49 167.095 2.168 5.269 1.00 0.00 H new ATOM 0 HE3 MET B 49 167.710 2.094 3.600 1.00 0.00 H new ATOM 2541 N GLU B 50 168.332 5.347 -0.908 1.00 0.00 N ATOM 2542 CA GLU B 50 168.766 5.017 -2.284 1.00 0.00 C ATOM 2543 C GLU B 50 169.966 5.870 -2.633 1.00 0.00 C ATOM 2544 O GLU B 50 171.016 5.367 -3.055 1.00 0.00 O ATOM 2545 CB GLU B 50 167.634 5.257 -3.277 1.00 0.00 C ATOM 2546 CG GLU B 50 166.779 3.976 -3.467 1.00 0.00 C ATOM 2547 CD GLU B 50 167.339 3.089 -4.578 1.00 0.00 C ATOM 2548 OE1 GLU B 50 168.261 3.495 -5.252 1.00 0.00 O ATOM 2549 OE2 GLU B 50 166.845 2.002 -4.736 1.00 0.00 O ATOM 0 H GLU B 50 167.442 5.841 -0.837 1.00 0.00 H new ATOM 0 HA GLU B 50 169.037 3.963 -2.337 1.00 0.00 H new ATOM 0 HB2 GLU B 50 167.002 6.071 -2.923 1.00 0.00 H new ATOM 0 HB3 GLU B 50 168.047 5.568 -4.236 1.00 0.00 H new ATOM 0 HG2 GLU B 50 166.749 3.415 -2.533 1.00 0.00 H new ATOM 0 HG3 GLU B 50 165.752 4.254 -3.705 1.00 0.00 H new ATOM 2556 N ASP B 51 169.852 7.145 -2.427 1.00 0.00 N ATOM 2557 CA ASP B 51 170.981 8.050 -2.703 1.00 0.00 C ATOM 2558 C ASP B 51 172.192 7.603 -1.947 1.00 0.00 C ATOM 2559 O ASP B 51 173.281 7.549 -2.500 1.00 0.00 O ATOM 2560 CB ASP B 51 170.635 9.482 -2.307 1.00 0.00 C ATOM 2561 CG ASP B 51 170.060 10.198 -3.481 1.00 0.00 C ATOM 2562 OD1 ASP B 51 170.817 10.496 -4.368 1.00 0.00 O ATOM 2563 OD2 ASP B 51 168.889 10.457 -3.490 1.00 0.00 O ATOM 0 H ASP B 51 169.011 7.601 -2.074 1.00 0.00 H new ATOM 0 HA ASP B 51 171.187 8.021 -3.773 1.00 0.00 H new ATOM 0 HB2 ASP B 51 169.921 9.480 -1.483 1.00 0.00 H new ATOM 0 HB3 ASP B 51 171.528 9.999 -1.954 1.00 0.00 H new ATOM 2568 N GLU B 52 172.045 7.348 -0.690 1.00 0.00 N ATOM 2569 CA GLU B 52 173.206 6.940 0.119 1.00 0.00 C ATOM 2570 C GLU B 52 173.639 5.547 -0.304 1.00 0.00 C ATOM 2571 O GLU B 52 174.783 5.321 -0.574 1.00 0.00 O ATOM 2572 CB GLU B 52 172.853 6.982 1.612 1.00 0.00 C ATOM 2573 CG GLU B 52 173.274 8.351 2.172 1.00 0.00 C ATOM 2574 CD GLU B 52 172.685 8.579 3.540 1.00 0.00 C ATOM 2575 OE1 GLU B 52 171.572 8.190 3.776 1.00 0.00 O ATOM 2576 OE2 GLU B 52 173.359 9.136 4.351 1.00 0.00 O ATOM 0 H GLU B 52 171.161 7.405 -0.184 1.00 0.00 H new ATOM 0 HA GLU B 52 174.033 7.631 -0.044 1.00 0.00 H new ATOM 0 HB2 GLU B 52 171.783 6.827 1.753 1.00 0.00 H new ATOM 0 HB3 GLU B 52 173.364 6.181 2.145 1.00 0.00 H new ATOM 0 HG2 GLU B 52 174.361 8.407 2.226 1.00 0.00 H new ATOM 0 HG3 GLU B 52 172.948 9.141 1.495 1.00 0.00 H new ATOM 2583 N ASN B 53 172.717 4.634 -0.415 1.00 0.00 N ATOM 2584 CA ASN B 53 173.041 3.245 -0.870 1.00 0.00 C ATOM 2585 C ASN B 53 173.900 3.327 -2.092 1.00 0.00 C ATOM 2586 O ASN B 53 174.944 2.720 -2.179 1.00 0.00 O ATOM 2587 CB ASN B 53 171.734 2.502 -1.220 1.00 0.00 C ATOM 2588 CG ASN B 53 171.229 1.782 0.001 1.00 0.00 C ATOM 2589 OD1 ASN B 53 170.127 1.950 0.410 1.00 0.00 O ATOM 2590 ND2 ASN B 53 172.015 0.984 0.603 1.00 0.00 N ATOM 0 H ASN B 53 171.731 4.791 -0.206 1.00 0.00 H new ATOM 0 HA ASN B 53 173.564 2.709 -0.078 1.00 0.00 H new ATOM 0 HB2 ASN B 53 170.984 3.209 -1.575 1.00 0.00 H new ATOM 0 HB3 ASN B 53 171.911 1.792 -2.028 1.00 0.00 H new ATOM 0 HD21 ASN B 53 171.699 0.489 1.437 1.00 0.00 H new ATOM 0 HD22 ASN B 53 172.962 0.839 0.252 1.00 0.00 H new ATOM 2597 N ASN B 54 173.484 4.136 -3.000 1.00 0.00 N ATOM 2598 CA ASN B 54 174.241 4.365 -4.255 1.00 0.00 C ATOM 2599 C ASN B 54 175.680 4.708 -3.938 1.00 0.00 C ATOM 2600 O ASN B 54 176.594 4.005 -4.331 1.00 0.00 O ATOM 2601 CB ASN B 54 173.621 5.526 -5.039 1.00 0.00 C ATOM 2602 CG ASN B 54 172.561 5.033 -6.012 1.00 0.00 C ATOM 2603 OD1 ASN B 54 172.135 3.902 -5.957 1.00 0.00 O ATOM 2604 ND2 ASN B 54 172.108 5.840 -6.907 1.00 0.00 N ATOM 0 H ASN B 54 172.619 4.672 -2.929 1.00 0.00 H new ATOM 0 HA ASN B 54 174.201 3.454 -4.852 1.00 0.00 H new ATOM 0 HB2 ASN B 54 173.177 6.240 -4.345 1.00 0.00 H new ATOM 0 HB3 ASN B 54 174.401 6.056 -5.586 1.00 0.00 H new ATOM 0 HD21 ASN B 54 171.394 5.524 -7.564 1.00 0.00 H new ATOM 0 HD22 ASN B 54 172.463 6.795 -6.959 1.00 0.00 H new ATOM 2611 N ARG B 55 175.901 5.798 -3.243 1.00 0.00 N ATOM 2612 CA ARG B 55 177.294 6.202 -2.919 1.00 0.00 C ATOM 2613 C ARG B 55 177.918 5.108 -2.097 1.00 0.00 C ATOM 2614 O ARG B 55 178.894 4.548 -2.473 1.00 0.00 O ATOM 2615 CB ARG B 55 177.302 7.520 -2.128 1.00 0.00 C ATOM 2616 CG ARG B 55 177.071 8.706 -3.085 1.00 0.00 C ATOM 2617 CD ARG B 55 175.579 8.827 -3.380 1.00 0.00 C ATOM 2618 NE ARG B 55 175.302 10.019 -4.221 1.00 0.00 N ATOM 2619 CZ ARG B 55 174.055 10.358 -4.463 1.00 0.00 C ATOM 2620 NH1 ARG B 55 173.088 9.625 -3.994 1.00 0.00 N ATOM 2621 NH2 ARG B 55 173.786 11.412 -5.165 1.00 0.00 N ATOM 0 H ARG B 55 175.175 6.421 -2.889 1.00 0.00 H new ATOM 0 HA ARG B 55 177.858 6.357 -3.839 1.00 0.00 H new ATOM 0 HB2 ARG B 55 176.525 7.501 -1.364 1.00 0.00 H new ATOM 0 HB3 ARG B 55 178.254 7.638 -1.611 1.00 0.00 H new ATOM 0 HG2 ARG B 55 177.442 9.628 -2.637 1.00 0.00 H new ATOM 0 HG3 ARG B 55 177.626 8.556 -4.011 1.00 0.00 H new ATOM 0 HD2 ARG B 55 175.230 7.928 -3.889 1.00 0.00 H new ATOM 0 HD3 ARG B 55 175.024 8.899 -2.445 1.00 0.00 H new ATOM 0 HE ARG B 55 176.070 10.568 -4.606 1.00 0.00 H new ATOM 0 HH11 ARG B 55 173.300 8.793 -3.443 1.00 0.00 H new ATOM 0 HH12 ARG B 55 172.118 9.882 -4.178 1.00 0.00 H new ATOM 0 HH21 ARG B 55 174.544 11.986 -5.535 1.00 0.00 H new ATOM 0 HH22 ARG B 55 172.816 11.669 -5.349 1.00 0.00 H new ATOM 2635 N LEU B 56 177.340 4.814 -0.980 1.00 0.00 N ATOM 2636 CA LEU B 56 177.848 3.751 -0.068 1.00 0.00 C ATOM 2637 C LEU B 56 178.448 2.597 -0.867 1.00 0.00 C ATOM 2638 O LEU B 56 179.575 2.185 -0.628 1.00 0.00 O ATOM 2639 CB LEU B 56 176.654 3.216 0.728 1.00 0.00 C ATOM 2640 CG LEU B 56 176.409 4.098 1.967 1.00 0.00 C ATOM 2641 CD1 LEU B 56 175.111 3.681 2.659 1.00 0.00 C ATOM 2642 CD2 LEU B 56 177.576 3.956 2.951 1.00 0.00 C ATOM 0 H LEU B 56 176.500 5.283 -0.641 1.00 0.00 H new ATOM 0 HA LEU B 56 178.617 4.165 0.583 1.00 0.00 H new ATOM 0 HB2 LEU B 56 175.764 3.203 0.099 1.00 0.00 H new ATOM 0 HB3 LEU B 56 176.843 2.187 1.035 1.00 0.00 H new ATOM 0 HG LEU B 56 176.330 5.137 1.646 1.00 0.00 H new ATOM 0 HD11 LEU B 56 174.947 4.310 3.534 1.00 0.00 H new ATOM 0 HD12 LEU B 56 174.277 3.796 1.967 1.00 0.00 H new ATOM 0 HD13 LEU B 56 175.183 2.639 2.970 1.00 0.00 H new ATOM 0 HD21 LEU B 56 177.394 4.583 3.824 1.00 0.00 H new ATOM 0 HD22 LEU B 56 177.664 2.915 3.264 1.00 0.00 H new ATOM 0 HD23 LEU B 56 178.501 4.268 2.466 1.00 0.00 H new ATOM 2654 N ARG B 57 177.706 2.074 -1.805 1.00 0.00 N ATOM 2655 CA ARG B 57 178.211 0.960 -2.644 1.00 0.00 C ATOM 2656 C ARG B 57 179.508 1.397 -3.308 1.00 0.00 C ATOM 2657 O ARG B 57 180.517 0.694 -3.278 1.00 0.00 O ATOM 2658 CB ARG B 57 177.185 0.644 -3.749 1.00 0.00 C ATOM 2659 CG ARG B 57 175.827 0.281 -3.131 1.00 0.00 C ATOM 2660 CD ARG B 57 175.621 -1.233 -3.162 1.00 0.00 C ATOM 2661 NE ARG B 57 174.177 -1.536 -2.914 1.00 0.00 N ATOM 2662 CZ ARG B 57 173.824 -2.592 -2.220 1.00 0.00 C ATOM 2663 NH1 ARG B 57 174.719 -3.483 -1.887 1.00 0.00 N ATOM 2664 NH2 ARG B 57 172.572 -2.766 -1.910 1.00 0.00 N ATOM 0 H ARG B 57 176.758 2.379 -2.025 1.00 0.00 H new ATOM 0 HA ARG B 57 178.374 0.079 -2.023 1.00 0.00 H new ATOM 0 HB2 ARG B 57 177.073 1.505 -4.407 1.00 0.00 H new ATOM 0 HB3 ARG B 57 177.545 -0.182 -4.363 1.00 0.00 H new ATOM 0 HG2 ARG B 57 175.779 0.641 -2.103 1.00 0.00 H new ATOM 0 HG3 ARG B 57 175.026 0.776 -3.680 1.00 0.00 H new ATOM 0 HD2 ARG B 57 175.929 -1.635 -4.127 1.00 0.00 H new ATOM 0 HD3 ARG B 57 176.241 -1.712 -2.405 1.00 0.00 H new ATOM 0 HE ARG B 57 173.460 -0.915 -3.288 1.00 0.00 H new ATOM 0 HH11 ARG B 57 175.692 -3.358 -2.166 1.00 0.00 H new ATOM 0 HH12 ARG B 57 174.445 -4.304 -1.347 1.00 0.00 H new ATOM 0 HH21 ARG B 57 171.874 -2.084 -2.206 1.00 0.00 H new ATOM 0 HH22 ARG B 57 172.289 -3.584 -1.371 1.00 0.00 H new ATOM 2678 N LEU B 58 179.492 2.546 -3.901 1.00 0.00 N ATOM 2679 CA LEU B 58 180.669 3.062 -4.587 1.00 0.00 C ATOM 2680 C LEU B 58 181.758 3.314 -3.556 1.00 0.00 C ATOM 2681 O LEU B 58 182.842 2.777 -3.658 1.00 0.00 O ATOM 2682 CB LEU B 58 180.314 4.340 -5.341 1.00 0.00 C ATOM 2683 CG LEU B 58 179.053 4.118 -6.210 1.00 0.00 C ATOM 2684 CD1 LEU B 58 178.341 5.451 -6.464 1.00 0.00 C ATOM 2685 CD2 LEU B 58 179.461 3.514 -7.545 1.00 0.00 C ATOM 0 H LEU B 58 178.679 3.161 -3.933 1.00 0.00 H new ATOM 0 HA LEU B 58 181.031 2.338 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU B 58 180.139 5.151 -4.634 1.00 0.00 H new ATOM 0 HB3 LEU B 58 181.150 4.642 -5.972 1.00 0.00 H new ATOM 0 HG LEU B 58 178.377 3.444 -5.683 1.00 0.00 H new ATOM 0 HD11 LEU B 58 177.456 5.280 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU B 58 178.044 5.892 -5.512 1.00 0.00 H new ATOM 0 HD13 LEU B 58 179.016 6.131 -6.984 1.00 0.00 H new ATOM 0 HD21 LEU B 58 178.574 3.357 -8.159 1.00 0.00 H new ATOM 0 HD22 LEU B 58 180.142 4.193 -8.058 1.00 0.00 H new ATOM 0 HD23 LEU B 58 179.959 2.559 -7.375 1.00 0.00 H new ATOM 2697 N GLU B 59 181.486 4.103 -2.578 1.00 0.00 N ATOM 2698 CA GLU B 59 182.484 4.411 -1.540 1.00 0.00 C ATOM 2699 C GLU B 59 183.096 3.122 -1.048 1.00 0.00 C ATOM 2700 O GLU B 59 184.302 2.956 -1.030 1.00 0.00 O ATOM 2701 CB GLU B 59 181.783 5.069 -0.357 1.00 0.00 C ATOM 2702 CG GLU B 59 181.126 6.390 -0.769 1.00 0.00 C ATOM 2703 CD GLU B 59 180.369 6.978 0.411 1.00 0.00 C ATOM 2704 OE1 GLU B 59 180.160 6.273 1.390 1.00 0.00 O ATOM 2705 OE2 GLU B 59 180.015 8.123 0.337 1.00 0.00 O ATOM 0 H GLU B 59 180.585 4.563 -2.449 1.00 0.00 H new ATOM 0 HA GLU B 59 183.247 5.070 -1.954 1.00 0.00 H new ATOM 0 HB2 GLU B 59 181.027 4.393 0.044 1.00 0.00 H new ATOM 0 HB3 GLU B 59 182.503 5.251 0.441 1.00 0.00 H new ATOM 0 HG2 GLU B 59 181.885 7.093 -1.113 1.00 0.00 H new ATOM 0 HG3 GLU B 59 180.445 6.223 -1.603 1.00 0.00 H new ATOM 2712 N SER B 60 182.265 2.231 -0.610 1.00 0.00 N ATOM 2713 CA SER B 60 182.755 0.957 -0.045 1.00 0.00 C ATOM 2714 C SER B 60 183.661 0.268 -1.060 1.00 0.00 C ATOM 2715 O SER B 60 184.778 -0.131 -0.739 1.00 0.00 O ATOM 2716 CB SER B 60 181.570 0.034 0.339 1.00 0.00 C ATOM 2717 OG SER B 60 182.069 -1.150 1.010 1.00 0.00 O ATOM 0 H SER B 60 181.250 2.334 -0.620 1.00 0.00 H new ATOM 0 HA SER B 60 183.323 1.166 0.861 1.00 0.00 H new ATOM 0 HB2 SER B 60 180.877 0.568 0.990 1.00 0.00 H new ATOM 0 HB3 SER B 60 181.014 -0.250 -0.554 1.00 0.00 H new ATOM 0 HG SER B 60 181.334 -1.592 1.484 1.00 0.00 H new ATOM 2723 N LYS B 61 183.205 0.081 -2.280 1.00 0.00 N ATOM 2724 CA LYS B 61 184.071 -0.652 -3.245 1.00 0.00 C ATOM 2725 C LYS B 61 185.199 0.260 -3.721 1.00 0.00 C ATOM 2726 O LYS B 61 186.312 -0.180 -3.934 1.00 0.00 O ATOM 2727 CB LYS B 61 183.252 -1.198 -4.428 1.00 0.00 C ATOM 2728 CG LYS B 61 182.807 -0.055 -5.363 1.00 0.00 C ATOM 2729 CD LYS B 61 181.605 -0.500 -6.224 1.00 0.00 C ATOM 2730 CE LYS B 61 182.096 -1.108 -7.551 1.00 0.00 C ATOM 2731 NZ LYS B 61 183.154 -2.115 -7.284 1.00 0.00 N ATOM 0 H LYS B 61 182.301 0.394 -2.635 1.00 0.00 H new ATOM 0 HA LYS B 61 184.510 -1.512 -2.739 1.00 0.00 H new ATOM 0 HB2 LYS B 61 183.849 -1.919 -4.987 1.00 0.00 H new ATOM 0 HB3 LYS B 61 182.377 -1.730 -4.055 1.00 0.00 H new ATOM 0 HG2 LYS B 61 182.536 0.821 -4.773 1.00 0.00 H new ATOM 0 HG3 LYS B 61 183.635 0.239 -6.008 1.00 0.00 H new ATOM 0 HD2 LYS B 61 181.009 -1.232 -5.679 1.00 0.00 H new ATOM 0 HD3 LYS B 61 180.957 0.353 -6.424 1.00 0.00 H new ATOM 0 HE2 LYS B 61 181.263 -1.574 -8.078 1.00 0.00 H new ATOM 0 HE3 LYS B 61 182.484 -0.323 -8.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 183.314 -2.686 -8.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 184.036 -1.631 -7.022 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 182.854 -2.735 -6.505 1.00 0.00 H new ATOM 2745 N ARG B 62 184.918 1.523 -3.897 1.00 0.00 N ATOM 2746 CA ARG B 62 185.954 2.475 -4.367 1.00 0.00 C ATOM 2747 C ARG B 62 186.904 2.816 -3.216 1.00 0.00 C ATOM 2748 O ARG B 62 187.927 3.480 -3.420 1.00 0.00 O ATOM 2749 CB ARG B 62 185.345 3.728 -4.990 1.00 0.00 C ATOM 2750 CG ARG B 62 184.514 3.355 -6.235 1.00 0.00 C ATOM 2751 CD ARG B 62 184.060 4.640 -6.959 1.00 0.00 C ATOM 2752 NE ARG B 62 185.180 5.645 -6.964 1.00 0.00 N ATOM 2753 CZ ARG B 62 186.179 5.542 -7.816 1.00 0.00 C ATOM 2754 NH1 ARG B 62 186.204 4.548 -8.675 1.00 0.00 N ATOM 2755 NH2 ARG B 62 187.136 6.420 -7.802 1.00 0.00 N ATOM 0 H ARG B 62 184.001 1.937 -3.732 1.00 0.00 H new ATOM 0 HA ARG B 62 186.526 1.993 -5.159 1.00 0.00 H new ATOM 0 HB2 ARG B 62 184.713 4.235 -4.261 1.00 0.00 H new ATOM 0 HB3 ARG B 62 186.135 4.426 -5.267 1.00 0.00 H new ATOM 0 HG2 ARG B 62 185.107 2.736 -6.909 1.00 0.00 H new ATOM 0 HG3 ARG B 62 183.646 2.765 -5.942 1.00 0.00 H new ATOM 0 HD2 ARG B 62 183.764 4.407 -7.982 1.00 0.00 H new ATOM 0 HD3 ARG B 62 183.185 5.059 -6.462 1.00 0.00 H new ATOM 0 HE ARG B 62 185.165 6.417 -6.298 1.00 0.00 H new ATOM 0 HH11 ARG B 62 185.451 3.860 -8.680 1.00 0.00 H new ATOM 0 HH12 ARG B 62 186.976 4.465 -9.336 1.00 0.00 H new ATOM 0 HH21 ARG B 62 187.113 7.188 -7.132 1.00 0.00 H new ATOM 0 HH22 ARG B 62 187.910 6.341 -8.461 1.00 0.00 H new ATOM 2769 N LEU B 63 186.711 2.225 -2.089 1.00 0.00 N ATOM 2770 CA LEU B 63 187.703 2.325 -1.026 1.00 0.00 C ATOM 2771 C LEU B 63 188.613 1.136 -1.240 1.00 0.00 C ATOM 2772 O LEU B 63 188.525 0.132 -0.552 1.00 0.00 O ATOM 2773 CB LEU B 63 187.027 2.251 0.348 1.00 0.00 C ATOM 2774 CG LEU B 63 186.652 3.674 0.803 1.00 0.00 C ATOM 2775 CD1 LEU B 63 185.380 3.650 1.648 1.00 0.00 C ATOM 2776 CD2 LEU B 63 187.798 4.286 1.615 1.00 0.00 C ATOM 0 H LEU B 63 185.889 1.667 -1.861 1.00 0.00 H new ATOM 0 HA LEU B 63 188.247 3.269 -1.053 1.00 0.00 H new ATOM 0 HB2 LEU B 63 186.136 1.626 0.295 1.00 0.00 H new ATOM 0 HB3 LEU B 63 187.698 1.789 1.073 1.00 0.00 H new ATOM 0 HG LEU B 63 186.473 4.282 -0.084 1.00 0.00 H new ATOM 0 HD11 LEU B 63 185.131 4.664 1.960 1.00 0.00 H new ATOM 0 HD12 LEU B 63 184.560 3.240 1.059 1.00 0.00 H new ATOM 0 HD13 LEU B 63 185.540 3.028 2.529 1.00 0.00 H new ATOM 0 HD21 LEU B 63 187.523 5.292 1.932 1.00 0.00 H new ATOM 0 HD22 LEU B 63 187.992 3.669 2.493 1.00 0.00 H new ATOM 0 HD23 LEU B 63 188.696 4.333 0.999 1.00 0.00 H new ATOM 2788 N GLY B 64 189.364 1.183 -2.306 1.00 0.00 N ATOM 2789 CA GLY B 64 190.206 0.028 -2.740 1.00 0.00 C ATOM 2790 C GLY B 64 190.816 -0.685 -1.547 1.00 0.00 C ATOM 2791 O GLY B 64 190.435 -1.804 -1.214 1.00 0.00 O ATOM 0 H GLY B 64 189.432 1.999 -2.914 1.00 0.00 H new ATOM 0 HA2 GLY B 64 189.599 -0.672 -3.314 1.00 0.00 H new ATOM 0 HA3 GLY B 64 190.998 0.380 -3.401 1.00 0.00 H new ATOM 2795 N GLY B 65 191.752 -0.080 -0.902 1.00 0.00 N ATOM 2796 CA GLY B 65 192.393 -0.735 0.267 1.00 0.00 C ATOM 2797 C GLY B 65 193.764 -0.140 0.466 1.00 0.00 C ATOM 2798 O GLY B 65 194.168 0.128 1.570 1.00 0.00 O ATOM 0 H GLY B 65 192.109 0.848 -1.130 1.00 0.00 H new ATOM 0 HA2 GLY B 65 191.786 -0.591 1.160 1.00 0.00 H new ATOM 0 HA3 GLY B 65 192.468 -1.810 0.103 1.00 0.00 H new ATOM 2802 N ASP B 66 194.505 0.019 -0.584 1.00 0.00 N ATOM 2803 CA ASP B 66 195.911 0.566 -0.509 1.00 0.00 C ATOM 2804 C ASP B 66 196.829 -0.364 0.299 1.00 0.00 C ATOM 2805 O ASP B 66 198.035 -0.280 0.194 1.00 0.00 O ATOM 2806 CB ASP B 66 195.945 2.006 0.062 1.00 0.00 C ATOM 2807 CG ASP B 66 196.316 2.967 -1.049 1.00 0.00 C ATOM 2808 OD1 ASP B 66 195.446 3.366 -1.781 1.00 0.00 O ATOM 2809 OD2 ASP B 66 197.459 3.282 -1.183 1.00 0.00 O ATOM 0 H ASP B 66 194.199 -0.210 -1.530 1.00 0.00 H new ATOM 0 HA ASP B 66 196.288 0.612 -1.531 1.00 0.00 H new ATOM 0 HB2 ASP B 66 194.973 2.269 0.479 1.00 0.00 H new ATOM 0 HB3 ASP B 66 196.669 2.072 0.875 1.00 0.00 H new ATOM 2814 N ASP B 67 196.283 -1.269 1.076 1.00 0.00 N ATOM 2815 CA ASP B 67 197.137 -2.230 1.852 1.00 0.00 C ATOM 2816 C ASP B 67 198.129 -2.900 0.902 1.00 0.00 C ATOM 2817 O ASP B 67 199.220 -3.251 1.290 1.00 0.00 O ATOM 2818 CB ASP B 67 196.258 -3.307 2.553 1.00 0.00 C ATOM 2819 CG ASP B 67 196.785 -4.702 2.251 1.00 0.00 C ATOM 2820 OD1 ASP B 67 197.712 -5.130 2.893 1.00 0.00 O ATOM 2821 OD2 ASP B 67 196.265 -5.319 1.364 1.00 0.00 O ATOM 0 H ASP B 67 195.278 -1.385 1.208 1.00 0.00 H new ATOM 0 HA ASP B 67 197.679 -1.681 2.622 1.00 0.00 H new ATOM 0 HB2 ASP B 67 196.255 -3.138 3.630 1.00 0.00 H new ATOM 0 HB3 ASP B 67 195.226 -3.220 2.214 1.00 0.00 H new ATOM 2826 N ALA B 68 197.796 -2.997 -0.353 1.00 0.00 N ATOM 2827 CA ALA B 68 198.776 -3.562 -1.329 1.00 0.00 C ATOM 2828 C ALA B 68 199.835 -2.506 -1.567 1.00 0.00 C ATOM 2829 O ALA B 68 201.006 -2.802 -1.618 1.00 0.00 O ATOM 2830 CB ALA B 68 198.099 -3.940 -2.647 1.00 0.00 C ATOM 0 H ALA B 68 196.898 -2.714 -0.746 1.00 0.00 H new ATOM 0 HA ALA B 68 199.216 -4.474 -0.926 1.00 0.00 H new ATOM 0 HB1 ALA B 68 198.841 -4.348 -3.333 1.00 0.00 H new ATOM 0 HB2 ALA B 68 197.329 -4.688 -2.459 1.00 0.00 H new ATOM 0 HB3 ALA B 68 197.644 -3.054 -3.089 1.00 0.00 H new ATOM 2836 N ARG B 69 199.438 -1.273 -1.600 1.00 0.00 N ATOM 2837 CA ARG B 69 200.403 -0.169 -1.716 1.00 0.00 C ATOM 2838 C ARG B 69 201.259 -0.208 -0.472 1.00 0.00 C ATOM 2839 O ARG B 69 202.477 -0.226 -0.527 1.00 0.00 O ATOM 2840 CB ARG B 69 199.641 1.158 -1.740 1.00 0.00 C ATOM 2841 CG ARG B 69 200.495 2.240 -2.411 1.00 0.00 C ATOM 2842 CD ARG B 69 199.835 2.648 -3.714 1.00 0.00 C ATOM 2843 NE ARG B 69 198.408 3.000 -3.437 1.00 0.00 N ATOM 2844 CZ ARG B 69 197.579 3.274 -4.410 1.00 0.00 C ATOM 2845 NH1 ARG B 69 198.008 3.302 -5.647 1.00 0.00 N ATOM 2846 NH2 ARG B 69 196.333 3.527 -4.137 1.00 0.00 N ATOM 0 H ARG B 69 198.462 -0.982 -1.550 1.00 0.00 H new ATOM 0 HA ARG B 69 201.003 -0.262 -2.621 1.00 0.00 H new ATOM 0 HB2 ARG B 69 198.702 1.038 -2.280 1.00 0.00 H new ATOM 0 HB3 ARG B 69 199.388 1.460 -0.724 1.00 0.00 H new ATOM 0 HG2 ARG B 69 200.596 3.103 -1.753 1.00 0.00 H new ATOM 0 HG3 ARG B 69 201.501 1.864 -2.599 1.00 0.00 H new ATOM 0 HD2 ARG B 69 200.356 3.499 -4.152 1.00 0.00 H new ATOM 0 HD3 ARG B 69 199.890 1.834 -4.437 1.00 0.00 H new ATOM 0 HE ARG B 69 198.076 3.027 -2.473 1.00 0.00 H new ATOM 0 HH11 ARG B 69 198.989 3.110 -5.851 1.00 0.00 H new ATOM 0 HH12 ARG B 69 197.361 3.516 -6.406 1.00 0.00 H new ATOM 0 HH21 ARG B 69 196.009 3.511 -3.170 1.00 0.00 H new ATOM 0 HH22 ARG B 69 195.679 3.742 -4.890 1.00 0.00 H new ATOM 2860 N VAL B 70 200.613 -0.283 0.654 1.00 0.00 N ATOM 2861 CA VAL B 70 201.326 -0.370 1.947 1.00 0.00 C ATOM 2862 C VAL B 70 202.327 -1.504 1.845 1.00 0.00 C ATOM 2863 O VAL B 70 203.521 -1.330 2.020 1.00 0.00 O ATOM 2864 CB VAL B 70 200.298 -0.689 3.064 1.00 0.00 C ATOM 2865 CG1 VAL B 70 200.973 -0.775 4.432 1.00 0.00 C ATOM 2866 CG2 VAL B 70 199.228 0.396 3.113 1.00 0.00 C ATOM 0 H VAL B 70 199.596 -0.287 0.730 1.00 0.00 H new ATOM 0 HA VAL B 70 201.833 0.567 2.179 1.00 0.00 H new ATOM 0 HB VAL B 70 199.847 -1.654 2.832 1.00 0.00 H new ATOM 0 HG11 VAL B 70 200.226 -1.000 5.193 1.00 0.00 H new ATOM 0 HG12 VAL B 70 201.725 -1.564 4.418 1.00 0.00 H new ATOM 0 HG13 VAL B 70 201.451 0.177 4.663 1.00 0.00 H new ATOM 0 HG21 VAL B 70 198.510 0.164 3.900 1.00 0.00 H new ATOM 0 HG22 VAL B 70 199.695 1.359 3.320 1.00 0.00 H new ATOM 0 HG23 VAL B 70 198.712 0.442 2.154 1.00 0.00 H new ATOM 2876 N ARG B 71 201.841 -2.659 1.567 1.00 0.00 N ATOM 2877 CA ARG B 71 202.716 -3.849 1.486 1.00 0.00 C ATOM 2878 C ARG B 71 203.803 -3.632 0.459 1.00 0.00 C ATOM 2879 O ARG B 71 204.936 -3.971 0.685 1.00 0.00 O ATOM 2880 CB ARG B 71 201.889 -5.087 1.129 1.00 0.00 C ATOM 2881 CG ARG B 71 201.796 -5.993 2.360 1.00 0.00 C ATOM 2882 CD ARG B 71 200.718 -7.063 2.159 1.00 0.00 C ATOM 2883 NE ARG B 71 199.446 -6.453 1.592 1.00 0.00 N ATOM 2884 CZ ARG B 71 199.141 -6.611 0.322 1.00 0.00 C ATOM 2885 NH1 ARG B 71 200.029 -7.096 -0.495 1.00 0.00 N ATOM 2886 NH2 ARG B 71 197.970 -6.246 -0.124 1.00 0.00 N ATOM 0 H ARG B 71 200.854 -2.841 1.387 1.00 0.00 H new ATOM 0 HA ARG B 71 203.183 -4.007 2.458 1.00 0.00 H new ATOM 0 HB2 ARG B 71 200.892 -4.793 0.801 1.00 0.00 H new ATOM 0 HB3 ARG B 71 202.351 -5.623 0.300 1.00 0.00 H new ATOM 0 HG2 ARG B 71 202.760 -6.469 2.542 1.00 0.00 H new ATOM 0 HG3 ARG B 71 201.564 -5.396 3.242 1.00 0.00 H new ATOM 0 HD2 ARG B 71 201.088 -7.835 1.484 1.00 0.00 H new ATOM 0 HD3 ARG B 71 200.500 -7.549 3.110 1.00 0.00 H new ATOM 0 HE ARG B 71 198.826 -5.918 2.200 1.00 0.00 H new ATOM 0 HH11 ARG B 71 200.954 -7.351 -0.150 1.00 0.00 H new ATOM 0 HH12 ARG B 71 199.800 -7.222 -1.481 1.00 0.00 H new ATOM 0 HH21 ARG B 71 197.287 -5.836 0.513 1.00 0.00 H new ATOM 0 HH22 ARG B 71 197.738 -6.370 -1.109 1.00 0.00 H new ATOM 2900 N GLU B 72 203.492 -3.042 -0.647 1.00 0.00 N ATOM 2901 CA GLU B 72 204.541 -2.793 -1.652 1.00 0.00 C ATOM 2902 C GLU B 72 205.581 -1.865 -1.046 1.00 0.00 C ATOM 2903 O GLU B 72 206.780 -2.006 -1.288 1.00 0.00 O ATOM 2904 CB GLU B 72 203.927 -2.181 -2.896 1.00 0.00 C ATOM 2905 CG GLU B 72 203.166 -3.268 -3.672 1.00 0.00 C ATOM 2906 CD GLU B 72 202.040 -2.630 -4.461 1.00 0.00 C ATOM 2907 OE1 GLU B 72 202.262 -1.576 -5.015 1.00 0.00 O ATOM 2908 OE2 GLU B 72 200.980 -3.205 -4.521 1.00 0.00 O ATOM 0 H GLU B 72 202.557 -2.721 -0.899 1.00 0.00 H new ATOM 0 HA GLU B 72 205.020 -3.729 -1.940 1.00 0.00 H new ATOM 0 HB2 GLU B 72 203.250 -1.372 -2.621 1.00 0.00 H new ATOM 0 HB3 GLU B 72 204.705 -1.746 -3.524 1.00 0.00 H new ATOM 0 HG2 GLU B 72 203.845 -3.792 -4.345 1.00 0.00 H new ATOM 0 HG3 GLU B 72 202.766 -4.010 -2.981 1.00 0.00 H new ATOM 2915 N LEU B 73 205.157 -0.936 -0.251 1.00 0.00 N ATOM 2916 CA LEU B 73 206.115 -0.046 0.404 1.00 0.00 C ATOM 2917 C LEU B 73 206.848 -0.823 1.477 1.00 0.00 C ATOM 2918 O LEU B 73 208.024 -0.658 1.651 1.00 0.00 O ATOM 2919 CB LEU B 73 205.423 1.162 0.989 1.00 0.00 C ATOM 2920 CG LEU B 73 204.744 1.950 -0.138 1.00 0.00 C ATOM 2921 CD1 LEU B 73 203.854 2.998 0.467 1.00 0.00 C ATOM 2922 CD2 LEU B 73 205.794 2.637 -1.018 1.00 0.00 C ATOM 0 H LEU B 73 204.177 -0.760 -0.030 1.00 0.00 H new ATOM 0 HA LEU B 73 206.830 0.320 -0.333 1.00 0.00 H new ATOM 0 HB2 LEU B 73 204.684 0.851 1.727 1.00 0.00 H new ATOM 0 HB3 LEU B 73 206.144 1.794 1.507 1.00 0.00 H new ATOM 0 HG LEU B 73 204.162 1.262 -0.751 1.00 0.00 H new ATOM 0 HD11 LEU B 73 203.367 3.564 -0.327 1.00 0.00 H new ATOM 0 HD12 LEU B 73 203.097 2.518 1.088 1.00 0.00 H new ATOM 0 HD13 LEU B 73 204.451 3.673 1.080 1.00 0.00 H new ATOM 0 HD21 LEU B 73 205.296 3.192 -1.813 1.00 0.00 H new ATOM 0 HD22 LEU B 73 206.384 3.324 -0.411 1.00 0.00 H new ATOM 0 HD23 LEU B 73 206.450 1.885 -1.457 1.00 0.00 H new ATOM 2934 N GLU B 74 206.183 -1.707 2.165 1.00 0.00 N ATOM 2935 CA GLU B 74 206.885 -2.545 3.169 1.00 0.00 C ATOM 2936 C GLU B 74 207.930 -3.395 2.438 1.00 0.00 C ATOM 2937 O GLU B 74 209.088 -3.492 2.853 1.00 0.00 O ATOM 2938 CB GLU B 74 205.880 -3.478 3.826 1.00 0.00 C ATOM 2939 CG GLU B 74 204.845 -2.683 4.620 1.00 0.00 C ATOM 2940 CD GLU B 74 204.300 -3.565 5.699 1.00 0.00 C ATOM 2941 OE1 GLU B 74 203.535 -4.442 5.387 1.00 0.00 O ATOM 2942 OE2 GLU B 74 204.667 -3.378 6.828 1.00 0.00 O ATOM 0 H GLU B 74 205.183 -1.884 2.074 1.00 0.00 H new ATOM 0 HA GLU B 74 207.357 -1.915 3.922 1.00 0.00 H new ATOM 0 HB2 GLU B 74 205.380 -4.077 3.065 1.00 0.00 H new ATOM 0 HB3 GLU B 74 206.399 -4.172 4.487 1.00 0.00 H new ATOM 0 HG2 GLU B 74 205.301 -1.792 5.052 1.00 0.00 H new ATOM 0 HG3 GLU B 74 204.042 -2.345 3.965 1.00 0.00 H new ATOM 2949 N LEU B 75 207.523 -4.025 1.378 1.00 0.00 N ATOM 2950 CA LEU B 75 208.425 -4.885 0.587 1.00 0.00 C ATOM 2951 C LEU B 75 209.592 -4.024 0.084 1.00 0.00 C ATOM 2952 O LEU B 75 210.762 -4.389 0.221 1.00 0.00 O ATOM 2953 CB LEU B 75 207.619 -5.487 -0.589 1.00 0.00 C ATOM 2954 CG LEU B 75 206.635 -6.579 -0.046 1.00 0.00 C ATOM 2955 CD1 LEU B 75 205.223 -6.458 -0.687 1.00 0.00 C ATOM 2956 CD2 LEU B 75 207.199 -7.977 -0.337 1.00 0.00 C ATOM 0 H LEU B 75 206.570 -3.975 1.019 1.00 0.00 H new ATOM 0 HA LEU B 75 208.828 -5.703 1.185 1.00 0.00 H new ATOM 0 HB2 LEU B 75 207.061 -4.702 -1.101 1.00 0.00 H new ATOM 0 HB3 LEU B 75 208.297 -5.925 -1.321 1.00 0.00 H new ATOM 0 HG LEU B 75 206.536 -6.425 1.028 1.00 0.00 H new ATOM 0 HD11 LEU B 75 204.572 -7.234 -0.283 1.00 0.00 H new ATOM 0 HD12 LEU B 75 204.803 -5.478 -0.460 1.00 0.00 H new ATOM 0 HD13 LEU B 75 205.302 -6.578 -1.767 1.00 0.00 H new ATOM 0 HD21 LEU B 75 206.511 -8.733 0.042 1.00 0.00 H new ATOM 0 HD22 LEU B 75 207.320 -8.104 -1.413 1.00 0.00 H new ATOM 0 HD23 LEU B 75 208.166 -8.088 0.153 1.00 0.00 H new ATOM 2968 N GLU B 76 209.291 -2.850 -0.405 1.00 0.00 N ATOM 2969 CA GLU B 76 210.339 -1.894 -0.828 1.00 0.00 C ATOM 2970 C GLU B 76 211.210 -1.562 0.391 1.00 0.00 C ATOM 2971 O GLU B 76 212.430 -1.573 0.324 1.00 0.00 O ATOM 2972 CB GLU B 76 209.652 -0.606 -1.346 1.00 0.00 C ATOM 2973 CG GLU B 76 210.685 0.371 -1.966 1.00 0.00 C ATOM 2974 CD GLU B 76 210.949 0.037 -3.417 1.00 0.00 C ATOM 2975 OE1 GLU B 76 210.047 -0.399 -4.085 1.00 0.00 O ATOM 2976 OE2 GLU B 76 212.042 0.222 -3.851 1.00 0.00 O ATOM 0 H GLU B 76 208.337 -2.512 -0.529 1.00 0.00 H new ATOM 0 HA GLU B 76 210.958 -2.320 -1.618 1.00 0.00 H new ATOM 0 HB2 GLU B 76 208.901 -0.866 -2.092 1.00 0.00 H new ATOM 0 HB3 GLU B 76 209.130 -0.114 -0.525 1.00 0.00 H new ATOM 0 HG2 GLU B 76 210.316 1.394 -1.887 1.00 0.00 H new ATOM 0 HG3 GLU B 76 211.617 0.324 -1.404 1.00 0.00 H new ATOM 2983 N LEU B 77 210.597 -1.262 1.497 1.00 0.00 N ATOM 2984 CA LEU B 77 211.366 -0.916 2.718 1.00 0.00 C ATOM 2985 C LEU B 77 212.322 -2.031 3.017 1.00 0.00 C ATOM 2986 O LEU B 77 213.499 -1.811 3.155 1.00 0.00 O ATOM 2987 CB LEU B 77 210.423 -0.701 3.913 1.00 0.00 C ATOM 2988 CG LEU B 77 209.838 0.719 3.853 1.00 0.00 C ATOM 2989 CD1 LEU B 77 208.580 0.806 4.708 1.00 0.00 C ATOM 2990 CD2 LEU B 77 210.866 1.738 4.357 1.00 0.00 C ATOM 0 H LEU B 77 209.583 -1.242 1.608 1.00 0.00 H new ATOM 0 HA LEU B 77 211.913 0.011 2.547 1.00 0.00 H new ATOM 0 HB2 LEU B 77 209.620 -1.438 3.894 1.00 0.00 H new ATOM 0 HB3 LEU B 77 210.965 -0.844 4.848 1.00 0.00 H new ATOM 0 HG LEU B 77 209.586 0.944 2.817 1.00 0.00 H new ATOM 0 HD11 LEU B 77 208.175 1.817 4.657 1.00 0.00 H new ATOM 0 HD12 LEU B 77 207.838 0.099 4.337 1.00 0.00 H new ATOM 0 HD13 LEU B 77 208.826 0.565 5.742 1.00 0.00 H new ATOM 0 HD21 LEU B 77 210.439 2.740 4.309 1.00 0.00 H new ATOM 0 HD22 LEU B 77 211.133 1.506 5.388 1.00 0.00 H new ATOM 0 HD23 LEU B 77 211.758 1.694 3.733 1.00 0.00 H new ATOM 3002 N ASP B 78 211.838 -3.239 3.092 1.00 0.00 N ATOM 3003 CA ASP B 78 212.744 -4.383 3.353 1.00 0.00 C ATOM 3004 C ASP B 78 213.841 -4.408 2.316 1.00 0.00 C ATOM 3005 O ASP B 78 214.988 -4.653 2.625 1.00 0.00 O ATOM 3006 CB ASP B 78 211.969 -5.699 3.320 1.00 0.00 C ATOM 3007 CG ASP B 78 211.472 -6.059 4.696 1.00 0.00 C ATOM 3008 OD1 ASP B 78 212.268 -6.084 5.602 1.00 0.00 O ATOM 3009 OD2 ASP B 78 210.312 -6.337 4.826 1.00 0.00 O ATOM 0 H ASP B 78 210.853 -3.480 2.983 1.00 0.00 H new ATOM 0 HA ASP B 78 213.183 -4.264 4.344 1.00 0.00 H new ATOM 0 HB2 ASP B 78 211.126 -5.613 2.634 1.00 0.00 H new ATOM 0 HB3 ASP B 78 212.610 -6.495 2.940 1.00 0.00 H new ATOM 3014 N ARG B 79 213.507 -4.136 1.096 1.00 0.00 N ATOM 3015 CA ARG B 79 214.515 -4.119 0.031 1.00 0.00 C ATOM 3016 C ARG B 79 215.560 -3.066 0.429 1.00 0.00 C ATOM 3017 O ARG B 79 216.754 -3.337 0.500 1.00 0.00 O ATOM 3018 CB ARG B 79 213.821 -3.708 -1.266 1.00 0.00 C ATOM 3019 CG ARG B 79 214.476 -4.358 -2.507 1.00 0.00 C ATOM 3020 CD ARG B 79 215.968 -3.992 -2.638 1.00 0.00 C ATOM 3021 NE ARG B 79 216.720 -5.169 -3.178 1.00 0.00 N ATOM 3022 CZ ARG B 79 218.008 -5.091 -3.432 1.00 0.00 C ATOM 3023 NH1 ARG B 79 218.666 -4.005 -3.152 1.00 0.00 N ATOM 3024 NH2 ARG B 79 218.626 -6.114 -3.947 1.00 0.00 N ATOM 0 H ARG B 79 212.557 -3.921 0.792 1.00 0.00 H new ATOM 0 HA ARG B 79 214.990 -5.090 -0.109 1.00 0.00 H new ATOM 0 HB2 ARG B 79 212.770 -3.993 -1.220 1.00 0.00 H new ATOM 0 HB3 ARG B 79 213.853 -2.623 -1.366 1.00 0.00 H new ATOM 0 HG2 ARG B 79 214.374 -5.441 -2.444 1.00 0.00 H new ATOM 0 HG3 ARG B 79 213.946 -4.039 -3.404 1.00 0.00 H new ATOM 0 HD2 ARG B 79 216.087 -3.135 -3.300 1.00 0.00 H new ATOM 0 HD3 ARG B 79 216.370 -3.703 -1.667 1.00 0.00 H new ATOM 0 HE ARG B 79 216.226 -6.044 -3.351 1.00 0.00 H new ATOM 0 HH11 ARG B 79 218.183 -3.210 -2.734 1.00 0.00 H new ATOM 0 HH12 ARG B 79 219.665 -3.948 -3.350 1.00 0.00 H new ATOM 0 HH21 ARG B 79 218.111 -6.971 -4.152 1.00 0.00 H new ATOM 0 HH22 ARG B 79 219.625 -6.059 -4.146 1.00 0.00 H new ATOM 3038 N LEU B 80 215.111 -1.885 0.758 1.00 0.00 N ATOM 3039 CA LEU B 80 216.048 -0.827 1.196 1.00 0.00 C ATOM 3040 C LEU B 80 216.809 -1.320 2.425 1.00 0.00 C ATOM 3041 O LEU B 80 217.974 -1.047 2.575 1.00 0.00 O ATOM 3042 CB LEU B 80 215.282 0.459 1.520 1.00 0.00 C ATOM 3043 CG LEU B 80 215.000 1.269 0.231 1.00 0.00 C ATOM 3044 CD1 LEU B 80 214.404 2.631 0.595 1.00 0.00 C ATOM 3045 CD2 LEU B 80 216.298 1.487 -0.572 1.00 0.00 C ATOM 0 H LEU B 80 214.128 -1.612 0.740 1.00 0.00 H new ATOM 0 HA LEU B 80 216.754 -0.607 0.395 1.00 0.00 H new ATOM 0 HB2 LEU B 80 214.342 0.213 2.014 1.00 0.00 H new ATOM 0 HB3 LEU B 80 215.859 1.066 2.218 1.00 0.00 H new ATOM 0 HG LEU B 80 214.295 0.705 -0.379 1.00 0.00 H new ATOM 0 HD11 LEU B 80 214.207 3.197 -0.315 1.00 0.00 H new ATOM 0 HD12 LEU B 80 213.472 2.486 1.141 1.00 0.00 H new ATOM 0 HD13 LEU B 80 215.108 3.181 1.219 1.00 0.00 H new ATOM 0 HD21 LEU B 80 216.077 2.058 -1.474 1.00 0.00 H new ATOM 0 HD22 LEU B 80 217.015 2.036 0.038 1.00 0.00 H new ATOM 0 HD23 LEU B 80 216.721 0.521 -0.849 1.00 0.00 H new ATOM 3057 N ARG B 81 216.158 -1.982 3.332 1.00 0.00 N ATOM 3058 CA ARG B 81 216.866 -2.490 4.540 1.00 0.00 C ATOM 3059 C ARG B 81 217.902 -3.497 4.092 1.00 0.00 C ATOM 3060 O ARG B 81 218.995 -3.544 4.631 1.00 0.00 O ATOM 3061 CB ARG B 81 215.864 -3.134 5.503 1.00 0.00 C ATOM 3062 CG ARG B 81 215.208 -2.030 6.354 1.00 0.00 C ATOM 3063 CD ARG B 81 213.682 -2.155 6.319 1.00 0.00 C ATOM 3064 NE ARG B 81 213.264 -3.568 6.634 1.00 0.00 N ATOM 3065 CZ ARG B 81 212.541 -3.836 7.689 1.00 0.00 C ATOM 3066 NH1 ARG B 81 212.358 -2.930 8.609 1.00 0.00 N ATOM 3067 NH2 ARG B 81 212.031 -5.017 7.817 1.00 0.00 N ATOM 0 H ARG B 81 215.162 -2.196 3.292 1.00 0.00 H new ATOM 0 HA ARG B 81 217.355 -1.670 5.066 1.00 0.00 H new ATOM 0 HB2 ARG B 81 215.104 -3.681 4.945 1.00 0.00 H new ATOM 0 HB3 ARG B 81 216.369 -3.855 6.146 1.00 0.00 H new ATOM 0 HG2 ARG B 81 215.560 -2.100 7.383 1.00 0.00 H new ATOM 0 HG3 ARG B 81 215.506 -1.050 5.981 1.00 0.00 H new ATOM 0 HD2 ARG B 81 213.238 -1.468 7.040 1.00 0.00 H new ATOM 0 HD3 ARG B 81 213.310 -1.869 5.335 1.00 0.00 H new ATOM 0 HE ARG B 81 213.550 -4.326 6.015 1.00 0.00 H new ATOM 0 HH11 ARG B 81 212.780 -2.007 8.507 1.00 0.00 H new ATOM 0 HH12 ARG B 81 211.793 -3.144 9.431 1.00 0.00 H new ATOM 0 HH21 ARG B 81 212.195 -5.724 7.100 1.00 0.00 H new ATOM 0 HH22 ARG B 81 211.464 -5.242 8.635 1.00 0.00 H new ATOM 3081 N ALA B 82 217.598 -4.258 3.084 1.00 0.00 N ATOM 3082 CA ALA B 82 218.591 -5.209 2.535 1.00 0.00 C ATOM 3083 C ALA B 82 219.794 -4.388 2.068 1.00 0.00 C ATOM 3084 O ALA B 82 220.927 -4.623 2.474 1.00 0.00 O ATOM 3085 CB ALA B 82 217.981 -5.969 1.341 1.00 0.00 C ATOM 0 H ALA B 82 216.693 -4.260 2.613 1.00 0.00 H new ATOM 0 HA ALA B 82 218.889 -5.938 3.289 1.00 0.00 H new ATOM 0 HB1 ALA B 82 218.716 -6.668 0.941 1.00 0.00 H new ATOM 0 HB2 ALA B 82 217.100 -6.519 1.672 1.00 0.00 H new ATOM 0 HB3 ALA B 82 217.695 -5.259 0.565 1.00 0.00 H new ATOM 3091 N GLU B 83 219.544 -3.390 1.255 1.00 0.00 N ATOM 3092 CA GLU B 83 220.653 -2.507 0.780 1.00 0.00 C ATOM 3093 C GLU B 83 221.362 -1.918 1.998 1.00 0.00 C ATOM 3094 O GLU B 83 222.548 -2.028 2.147 1.00 0.00 O ATOM 3095 CB GLU B 83 220.084 -1.352 -0.072 1.00 0.00 C ATOM 3096 CG GLU B 83 220.127 -1.702 -1.565 1.00 0.00 C ATOM 3097 CD GLU B 83 218.891 -1.153 -2.236 1.00 0.00 C ATOM 3098 OE1 GLU B 83 217.922 -1.844 -2.296 1.00 0.00 O ATOM 3099 OE2 GLU B 83 218.937 -0.050 -2.697 1.00 0.00 O ATOM 0 H GLU B 83 218.618 -3.149 0.900 1.00 0.00 H new ATOM 0 HA GLU B 83 221.347 -3.090 0.175 1.00 0.00 H new ATOM 0 HB2 GLU B 83 219.057 -1.145 0.228 1.00 0.00 H new ATOM 0 HB3 GLU B 83 220.658 -0.443 0.110 1.00 0.00 H new ATOM 0 HG2 GLU B 83 221.022 -1.282 -2.024 1.00 0.00 H new ATOM 0 HG3 GLU B 83 220.178 -2.783 -1.697 1.00 0.00 H new ATOM 3106 N ASN B 84 220.618 -1.302 2.865 1.00 0.00 N ATOM 3107 CA ASN B 84 221.186 -0.680 4.093 1.00 0.00 C ATOM 3108 C ASN B 84 222.059 -1.677 4.792 1.00 0.00 C ATOM 3109 O ASN B 84 223.150 -1.380 5.181 1.00 0.00 O ATOM 3110 CB ASN B 84 220.052 -0.330 5.046 1.00 0.00 C ATOM 3111 CG ASN B 84 219.458 1.016 4.694 1.00 0.00 C ATOM 3112 OD1 ASN B 84 219.869 2.026 5.219 1.00 0.00 O ATOM 3113 ND2 ASN B 84 218.510 1.086 3.831 1.00 0.00 N ATOM 0 H ASN B 84 219.607 -1.199 2.773 1.00 0.00 H new ATOM 0 HA ASN B 84 221.752 0.209 3.814 1.00 0.00 H new ATOM 0 HB2 ASN B 84 219.280 -1.098 4.999 1.00 0.00 H new ATOM 0 HB3 ASN B 84 220.423 -0.313 6.071 1.00 0.00 H new ATOM 0 HD21 ASN B 84 218.106 1.991 3.590 1.00 0.00 H new ATOM 0 HD22 ASN B 84 218.161 0.237 3.387 1.00 0.00 H new ATOM 3120 N LEU B 85 221.568 -2.859 4.968 1.00 0.00 N ATOM 3121 CA LEU B 85 222.356 -3.911 5.662 1.00 0.00 C ATOM 3122 C LEU B 85 223.668 -4.086 4.920 1.00 0.00 C ATOM 3123 O LEU B 85 224.741 -4.007 5.495 1.00 0.00 O ATOM 3124 CB LEU B 85 221.537 -5.235 5.673 1.00 0.00 C ATOM 3125 CG LEU B 85 222.451 -6.478 5.579 1.00 0.00 C ATOM 3126 CD1 LEU B 85 223.466 -6.496 6.728 1.00 0.00 C ATOM 3127 CD2 LEU B 85 221.593 -7.743 5.643 1.00 0.00 C ATOM 0 H LEU B 85 220.641 -3.151 4.658 1.00 0.00 H new ATOM 0 HA LEU B 85 222.564 -3.630 6.694 1.00 0.00 H new ATOM 0 HB2 LEU B 85 220.945 -5.288 6.586 1.00 0.00 H new ATOM 0 HB3 LEU B 85 220.836 -5.236 4.838 1.00 0.00 H new ATOM 0 HG LEU B 85 222.994 -6.440 4.635 1.00 0.00 H new ATOM 0 HD11 LEU B 85 224.098 -7.380 6.641 1.00 0.00 H new ATOM 0 HD12 LEU B 85 224.085 -5.600 6.680 1.00 0.00 H new ATOM 0 HD13 LEU B 85 222.937 -6.521 7.681 1.00 0.00 H new ATOM 0 HD21 LEU B 85 222.235 -8.622 5.577 1.00 0.00 H new ATOM 0 HD22 LEU B 85 221.045 -7.764 6.585 1.00 0.00 H new ATOM 0 HD23 LEU B 85 220.887 -7.746 4.813 1.00 0.00 H new ATOM 3139 N GLN B 86 223.590 -4.311 3.656 1.00 0.00 N ATOM 3140 CA GLN B 86 224.816 -4.496 2.844 1.00 0.00 C ATOM 3141 C GLN B 86 225.712 -3.263 2.979 1.00 0.00 C ATOM 3142 O GLN B 86 226.885 -3.358 3.284 1.00 0.00 O ATOM 3143 CB GLN B 86 224.399 -4.669 1.388 1.00 0.00 C ATOM 3144 CG GLN B 86 223.712 -6.033 1.208 1.00 0.00 C ATOM 3145 CD GLN B 86 222.535 -5.893 0.247 1.00 0.00 C ATOM 3146 OE1 GLN B 86 222.542 -5.038 -0.627 1.00 0.00 O ATOM 3147 NE2 GLN B 86 221.523 -6.683 0.362 1.00 0.00 N ATOM 0 H GLN B 86 222.716 -4.377 3.134 1.00 0.00 H new ATOM 0 HA GLN B 86 225.368 -5.372 3.186 1.00 0.00 H new ATOM 0 HB2 GLN B 86 223.721 -3.867 1.095 1.00 0.00 H new ATOM 0 HB3 GLN B 86 225.272 -4.601 0.738 1.00 0.00 H new ATOM 0 HG2 GLN B 86 224.425 -6.762 0.822 1.00 0.00 H new ATOM 0 HG3 GLN B 86 223.365 -6.406 2.172 1.00 0.00 H new ATOM 0 HE21 GLN B 86 221.514 -7.397 1.090 1.00 0.00 H new ATOM 0 HE22 GLN B 86 220.731 -6.594 -0.275 1.00 0.00 H new ATOM 3156 N LEU B 87 225.173 -2.121 2.729 1.00 0.00 N ATOM 3157 CA LEU B 87 225.977 -0.875 2.786 1.00 0.00 C ATOM 3158 C LEU B 87 226.560 -0.691 4.181 1.00 0.00 C ATOM 3159 O LEU B 87 227.731 -0.415 4.333 1.00 0.00 O ATOM 3160 CB LEU B 87 225.104 0.324 2.426 1.00 0.00 C ATOM 3161 CG LEU B 87 224.448 0.105 1.051 1.00 0.00 C ATOM 3162 CD1 LEU B 87 223.244 1.032 0.895 1.00 0.00 C ATOM 3163 CD2 LEU B 87 225.462 0.411 -0.049 1.00 0.00 C ATOM 0 H LEU B 87 224.192 -1.988 2.482 1.00 0.00 H new ATOM 0 HA LEU B 87 226.794 -0.950 2.069 1.00 0.00 H new ATOM 0 HB2 LEU B 87 224.336 0.466 3.186 1.00 0.00 H new ATOM 0 HB3 LEU B 87 225.707 1.232 2.410 1.00 0.00 H new ATOM 0 HG LEU B 87 224.118 -0.931 0.974 1.00 0.00 H new ATOM 0 HD11 LEU B 87 222.785 0.871 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU B 87 222.516 0.818 1.678 1.00 0.00 H new ATOM 0 HD13 LEU B 87 223.570 2.069 0.976 1.00 0.00 H new ATOM 0 HD21 LEU B 87 224.999 0.256 -1.024 1.00 0.00 H new ATOM 0 HD22 LEU B 87 225.790 1.447 0.037 1.00 0.00 H new ATOM 0 HD23 LEU B 87 226.321 -0.252 0.054 1.00 0.00 H new