USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=30 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 157:sc= -2.59! (180deg=-4.8!) USER MOD Set 1.2: A 53 ASN :FLIP amide:sc= -4.89! C(o=-27!,f=-13!) USER MOD Set 1.3: B 49 MET CE :methyl 163:sc= -2.31 (180deg=-3.13!) USER MOD Set 1.4: B 53 ASN :FLIP amide:sc= -2.86! C(o=-27!,f=-13!) USER MOD Single : A 23 HIS : no HD1:sc= -1.02 K(o=-1,f=-7.7!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.00886 USER MOD Single : A 26 SER OG : rot 180:sc= 0.094 USER MOD Single : A 28 GLN :FLIP amide:sc= -14.2! C(o=-17!,f=-14!) USER MOD Single : A 29 ASN : amide:sc= -0.147 K(o=-0.15,f=-2.4!) USER MOD Single : A 30 MET CE :methyl -120:sc= -2.4 (180deg=-8.91!) USER MOD Single : A 31 SER OG : rot 75:sc= -0.345! USER MOD Single : A 32 LYS NZ :NH3+ -154:sc= 0.914! (180deg=-0.56!) USER MOD Single : A 33 GLN : amide:sc= -0.0622 X(o=-0.062,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 159:sc= -0.0078 (180deg=-0.136) USER MOD Single : A 39 TYR OH : rot 123:sc= -1.02 USER MOD Single : A 44 LYS NZ :NH3+ -153:sc= -0.1 (180deg=-0.606) USER MOD Single : A 45 CYS SG : rot 70:sc= 1.14 USER MOD Single : A 47 SER OG : rot 73:sc= 0.81 USER MOD Single : A 54 ASN : amide:sc= -0.105 K(o=-0.1,f=-2.1!) USER MOD Single : A 60 SER OG : rot -76:sc= 0.488 USER MOD Single : A 61 LYS NZ :NH3+ 155:sc= -0.0129 (180deg=-0.253) USER MOD Single : B 23 HIS : no HD1:sc= -1.41! C(o=-1.4!,f=-6.3!) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 SER OG : rot 180:sc= 0.094 USER MOD Single : B 28 GLN :FLIP amide:sc= -16.3! C(o=-17!,f=-16!) USER MOD Single : B 29 ASN : amide:sc= -0.48 K(o=-0.48,f=-3.5!) USER MOD Single : B 30 MET CE :methyl -124:sc= -2.31 (180deg=-10.1!) USER MOD Single : B 31 SER OG : rot 89:sc= 1.02 USER MOD Single : B 32 LYS NZ :NH3+ -153:sc= 0.828! (180deg=-0.795!) USER MOD Single : B 33 GLN : amide:sc= -0.0303 X(o=-0.03,f=0) USER MOD Single : B 37 LYS NZ :NH3+ 156:sc= -0.0139 (180deg=-0.167) USER MOD Single : B 39 TYR OH : rot 142:sc= -0.727 USER MOD Single : B 44 LYS NZ :NH3+ -148:sc= -0.29 (180deg=-1.33!) USER MOD Single : B 45 CYS SG : rot 68:sc= 1.14 USER MOD Single : B 47 SER OG : rot 84:sc= 0.805 USER MOD Single : B 54 ASN : amide:sc= -0.0897 K(o=-0.09,f=-2.1!) USER MOD Single : B 60 SER OG : rot -83:sc= 0.277 USER MOD Single : B 61 LYS NZ :NH3+ 145:sc= -0.0788 (180deg=-0.808) USER MOD Single : B 84 ASN : amide:sc= 0.886 K(o=0.89,f=-0.44) USER MOD Single : B 86 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 150.856 -9.259 1.761 1.00 0.00 N ATOM 333 CA HIS A 23 149.812 -8.953 2.780 1.00 0.00 C ATOM 334 C HIS A 23 149.350 -7.510 2.615 1.00 0.00 C ATOM 335 O HIS A 23 149.886 -6.582 3.211 1.00 0.00 O ATOM 336 CB HIS A 23 150.320 -9.203 4.203 1.00 0.00 C ATOM 337 CG HIS A 23 149.190 -9.788 4.977 1.00 0.00 C ATOM 338 ND1 HIS A 23 149.035 -11.151 5.127 1.00 0.00 N ATOM 339 CD2 HIS A 23 148.095 -9.215 5.563 1.00 0.00 C ATOM 340 CE1 HIS A 23 147.877 -11.355 5.771 1.00 0.00 C ATOM 341 NE2 HIS A 23 147.262 -10.207 6.056 1.00 0.00 N ATOM 0 HA HIS A 23 148.967 -9.623 2.621 1.00 0.00 H new ATOM 0 HB2 HIS A 23 151.172 -9.882 4.194 1.00 0.00 H new ATOM 0 HB3 HIS A 23 150.659 -8.273 4.660 1.00 0.00 H new ATOM 0 HD2 HIS A 23 147.908 -8.153 5.631 1.00 0.00 H new ATOM 0 HE1 HIS A 23 147.490 -12.330 6.028 1.00 0.00 H new ATOM 0 HE2 HIS A 23 146.369 -10.085 6.534 1.00 0.00 H new ATOM 350 N THR A 24 148.415 -7.315 1.763 1.00 0.00 N ATOM 351 CA THR A 24 147.926 -5.975 1.448 1.00 0.00 C ATOM 352 C THR A 24 146.918 -5.539 2.510 1.00 0.00 C ATOM 353 O THR A 24 146.727 -4.346 2.737 1.00 0.00 O ATOM 354 CB THR A 24 147.241 -6.030 0.073 1.00 0.00 C ATOM 355 OG1 THR A 24 147.882 -7.000 -0.770 1.00 0.00 O ATOM 356 CG2 THR A 24 147.290 -4.665 -0.609 1.00 0.00 C ATOM 0 H THR A 24 147.949 -8.063 1.250 1.00 0.00 H new ATOM 0 HA THR A 24 148.750 -5.261 1.431 1.00 0.00 H new ATOM 0 HB THR A 24 146.201 -6.316 0.230 1.00 0.00 H new ATOM 0 HG1 THR A 24 147.433 -7.024 -1.641 1.00 0.00 H new ATOM 0 HG21 THR A 24 146.800 -4.726 -1.581 1.00 0.00 H new ATOM 0 HG22 THR A 24 146.777 -3.930 0.011 1.00 0.00 H new ATOM 0 HG23 THR A 24 148.329 -4.363 -0.745 1.00 0.00 H new ATOM 364 N GLU A 25 146.227 -6.480 3.112 1.00 0.00 N ATOM 365 CA GLU A 25 145.151 -6.139 4.096 1.00 0.00 C ATOM 366 C GLU A 25 145.519 -4.895 4.867 1.00 0.00 C ATOM 367 O GLU A 25 144.835 -3.893 4.786 1.00 0.00 O ATOM 368 CB GLU A 25 144.972 -7.298 5.088 1.00 0.00 C ATOM 369 CG GLU A 25 145.035 -8.632 4.347 1.00 0.00 C ATOM 370 CD GLU A 25 144.347 -9.677 5.172 1.00 0.00 C ATOM 371 OE1 GLU A 25 144.807 -9.952 6.260 1.00 0.00 O ATOM 372 OE2 GLU A 25 143.372 -10.190 4.719 1.00 0.00 O ATOM 0 H GLU A 25 146.365 -7.479 2.961 1.00 0.00 H new ATOM 0 HA GLU A 25 144.224 -5.966 3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 25 145.750 -7.259 5.851 1.00 0.00 H new ATOM 0 HB3 GLU A 25 144.016 -7.203 5.603 1.00 0.00 H new ATOM 0 HG2 GLU A 25 144.555 -8.545 3.372 1.00 0.00 H new ATOM 0 HG3 GLU A 25 146.072 -8.915 4.168 1.00 0.00 H new ATOM 379 N SER A 26 146.531 -4.968 5.674 1.00 0.00 N ATOM 380 CA SER A 26 146.907 -3.810 6.524 1.00 0.00 C ATOM 381 C SER A 26 146.805 -2.497 5.718 1.00 0.00 C ATOM 382 O SER A 26 146.384 -1.489 6.244 1.00 0.00 O ATOM 383 CB SER A 26 148.293 -4.009 7.116 1.00 0.00 C ATOM 384 OG SER A 26 148.863 -5.214 6.568 1.00 0.00 O ATOM 0 H SER A 26 147.123 -5.791 5.784 1.00 0.00 H new ATOM 0 HA SER A 26 146.207 -3.739 7.357 1.00 0.00 H new ATOM 0 HB2 SER A 26 148.928 -3.153 6.887 1.00 0.00 H new ATOM 0 HB3 SER A 26 148.233 -4.080 8.202 1.00 0.00 H new ATOM 0 HG SER A 26 149.758 -5.352 6.942 1.00 0.00 H new ATOM 390 N LEU A 27 147.098 -2.516 4.451 1.00 0.00 N ATOM 391 CA LEU A 27 146.958 -1.283 3.653 1.00 0.00 C ATOM 392 C LEU A 27 145.468 -0.976 3.441 1.00 0.00 C ATOM 393 O LEU A 27 145.028 0.135 3.658 1.00 0.00 O ATOM 394 CB LEU A 27 147.684 -1.447 2.328 1.00 0.00 C ATOM 395 CG LEU A 27 149.194 -1.561 2.581 1.00 0.00 C ATOM 396 CD1 LEU A 27 149.872 -2.235 1.390 1.00 0.00 C ATOM 397 CD2 LEU A 27 149.791 -0.163 2.775 1.00 0.00 C ATOM 0 H LEU A 27 147.428 -3.334 3.939 1.00 0.00 H new ATOM 0 HA LEU A 27 147.407 -0.443 4.183 1.00 0.00 H new ATOM 0 HB2 LEU A 27 147.323 -2.336 1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 27 147.477 -0.596 1.680 1.00 0.00 H new ATOM 0 HG LEU A 27 149.358 -2.159 3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 27 150.943 -2.312 1.577 1.00 0.00 H new ATOM 0 HD12 LEU A 27 149.455 -3.232 1.251 1.00 0.00 H new ATOM 0 HD13 LEU A 27 149.702 -1.642 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 27 150.863 -0.247 2.954 1.00 0.00 H new ATOM 0 HD22 LEU A 27 149.619 0.434 1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 27 149.317 0.320 3.629 1.00 0.00 H new ATOM 409 N GLN A 28 144.659 -1.959 3.127 1.00 0.00 N ATOM 410 CA GLN A 28 143.192 -1.708 3.039 1.00 0.00 C ATOM 411 C GLN A 28 142.660 -1.469 4.435 1.00 0.00 C ATOM 412 O GLN A 28 141.772 -0.670 4.633 1.00 0.00 O ATOM 413 CB GLN A 28 142.463 -2.903 2.430 1.00 0.00 C ATOM 414 CG GLN A 28 142.996 -3.159 1.043 1.00 0.00 C ATOM 415 CD GLN A 28 144.235 -3.978 1.143 1.00 0.00 C ATOM 416 OE1 GLN A 28 145.358 -3.393 1.038 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 144.178 -5.176 1.336 1.00 0.00 N flip ATOM 0 H GLN A 28 144.951 -2.916 2.930 1.00 0.00 H new ATOM 0 HA GLN A 28 143.023 -0.840 2.401 1.00 0.00 H new ATOM 0 HB2 GLN A 28 142.603 -3.785 3.054 1.00 0.00 H new ATOM 0 HB3 GLN A 28 141.391 -2.708 2.390 1.00 0.00 H new ATOM 0 HG2 GLN A 28 142.249 -3.678 0.443 1.00 0.00 H new ATOM 0 HG3 GLN A 28 143.208 -2.215 0.541 1.00 0.00 H new ATOM 0 HE21 GLN A 28 143.272 -5.637 1.419 1.00 0.00 H new ATOM 0 HE22 GLN A 28 145.036 -5.721 1.415 1.00 0.00 H new ATOM 426 N ASN A 29 143.180 -2.160 5.382 1.00 0.00 N ATOM 427 CA ASN A 29 142.731 -2.019 6.784 1.00 0.00 C ATOM 428 C ASN A 29 142.865 -0.582 7.244 1.00 0.00 C ATOM 429 O ASN A 29 142.375 -0.220 8.298 1.00 0.00 O ATOM 430 CB ASN A 29 143.665 -2.848 7.659 1.00 0.00 C ATOM 431 CG ASN A 29 143.426 -4.345 7.444 1.00 0.00 C ATOM 432 OD1 ASN A 29 142.802 -4.747 6.477 1.00 0.00 O ATOM 433 ND2 ASN A 29 143.905 -5.196 8.290 1.00 0.00 N ATOM 0 H ASN A 29 143.925 -2.843 5.245 1.00 0.00 H new ATOM 0 HA ASN A 29 141.692 -2.339 6.857 1.00 0.00 H new ATOM 0 HB2 ASN A 29 144.701 -2.604 7.426 1.00 0.00 H new ATOM 0 HB3 ASN A 29 143.506 -2.597 8.708 1.00 0.00 H new ATOM 0 HD21 ASN A 29 143.760 -6.195 8.146 1.00 0.00 H new ATOM 0 HD22 ASN A 29 144.428 -4.869 9.102 1.00 0.00 H new ATOM 440 N MET A 30 143.595 0.228 6.522 1.00 0.00 N ATOM 441 CA MET A 30 143.832 1.612 6.970 1.00 0.00 C ATOM 442 C MET A 30 142.914 2.561 6.251 1.00 0.00 C ATOM 443 O MET A 30 142.459 2.294 5.153 1.00 0.00 O ATOM 444 CB MET A 30 145.269 2.004 6.657 1.00 0.00 C ATOM 445 CG MET A 30 146.224 1.232 7.564 1.00 0.00 C ATOM 446 SD MET A 30 147.465 2.365 8.185 1.00 0.00 S ATOM 447 CE MET A 30 148.326 2.573 6.608 1.00 0.00 C ATOM 0 H MET A 30 144.036 -0.021 5.637 1.00 0.00 H new ATOM 0 HA MET A 30 143.644 1.667 8.042 1.00 0.00 H new ATOM 0 HB2 MET A 30 145.494 1.792 5.612 1.00 0.00 H new ATOM 0 HB3 MET A 30 145.403 3.076 6.801 1.00 0.00 H new ATOM 0 HG2 MET A 30 145.677 0.780 8.391 1.00 0.00 H new ATOM 0 HG3 MET A 30 146.696 0.419 7.012 1.00 0.00 H new ATOM 0 HE1 MET A 30 149.361 2.248 6.713 1.00 0.00 H new ATOM 0 HE2 MET A 30 147.833 1.974 5.843 1.00 0.00 H new ATOM 0 HE3 MET A 30 148.304 3.623 6.317 1.00 0.00 H new ATOM 457 N SER A 31 142.697 3.682 6.811 1.00 0.00 N ATOM 458 CA SER A 31 141.835 4.690 6.172 1.00 0.00 C ATOM 459 C SER A 31 142.720 5.560 5.259 1.00 0.00 C ATOM 460 O SER A 31 143.913 5.712 5.495 1.00 0.00 O ATOM 461 CB SER A 31 141.183 5.534 7.282 1.00 0.00 C ATOM 462 OG SER A 31 141.191 4.770 8.526 1.00 0.00 O ATOM 0 H SER A 31 143.087 3.961 7.711 1.00 0.00 H new ATOM 0 HA SER A 31 141.049 4.233 5.571 1.00 0.00 H new ATOM 0 HB2 SER A 31 141.726 6.470 7.411 1.00 0.00 H new ATOM 0 HB3 SER A 31 140.161 5.794 7.006 1.00 0.00 H new ATOM 0 HG SER A 31 142.099 4.753 8.894 1.00 0.00 H new ATOM 468 N LYS A 32 142.178 6.028 4.170 1.00 0.00 N ATOM 469 CA LYS A 32 142.978 6.790 3.165 1.00 0.00 C ATOM 470 C LYS A 32 143.819 7.862 3.842 1.00 0.00 C ATOM 471 O LYS A 32 144.995 7.997 3.563 1.00 0.00 O ATOM 472 CB LYS A 32 142.037 7.445 2.129 1.00 0.00 C ATOM 473 CG LYS A 32 142.763 7.566 0.770 1.00 0.00 C ATOM 474 CD LYS A 32 141.760 7.895 -0.353 1.00 0.00 C ATOM 475 CE LYS A 32 141.583 9.421 -0.505 1.00 0.00 C ATOM 476 NZ LYS A 32 141.191 9.739 -1.899 1.00 0.00 N ATOM 0 H LYS A 32 141.194 5.913 3.927 1.00 0.00 H new ATOM 0 HA LYS A 32 143.646 6.092 2.660 1.00 0.00 H new ATOM 0 HB2 LYS A 32 141.132 6.848 2.017 1.00 0.00 H new ATOM 0 HB3 LYS A 32 141.728 8.431 2.476 1.00 0.00 H new ATOM 0 HG2 LYS A 32 143.523 8.345 0.826 1.00 0.00 H new ATOM 0 HG3 LYS A 32 143.279 6.633 0.543 1.00 0.00 H new ATOM 0 HD2 LYS A 32 142.109 7.470 -1.294 1.00 0.00 H new ATOM 0 HD3 LYS A 32 140.797 7.433 -0.133 1.00 0.00 H new ATOM 0 HE2 LYS A 32 140.822 9.780 0.188 1.00 0.00 H new ATOM 0 HE3 LYS A 32 142.512 9.932 -0.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 141.489 10.708 -2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 141.650 9.070 -2.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 140.158 9.662 -1.995 1.00 0.00 H new ATOM 490 N GLN A 33 143.244 8.609 4.739 1.00 0.00 N ATOM 491 CA GLN A 33 144.022 9.682 5.417 1.00 0.00 C ATOM 492 C GLN A 33 145.262 9.082 6.053 1.00 0.00 C ATOM 493 O GLN A 33 146.339 9.639 5.964 1.00 0.00 O ATOM 494 CB GLN A 33 143.175 10.348 6.499 1.00 0.00 C ATOM 495 CG GLN A 33 142.303 11.443 5.889 1.00 0.00 C ATOM 496 CD GLN A 33 141.316 11.909 6.943 1.00 0.00 C ATOM 497 OE1 GLN A 33 141.345 13.061 7.351 1.00 0.00 O ATOM 498 NE2 GLN A 33 140.456 11.073 7.413 1.00 0.00 N ATOM 0 H GLN A 33 142.271 8.524 5.033 1.00 0.00 H new ATOM 0 HA GLN A 33 144.308 10.430 4.678 1.00 0.00 H new ATOM 0 HB2 GLN A 33 142.547 9.604 6.988 1.00 0.00 H new ATOM 0 HB3 GLN A 33 143.822 10.774 7.266 1.00 0.00 H new ATOM 0 HG2 GLN A 33 142.920 12.276 5.552 1.00 0.00 H new ATOM 0 HG3 GLN A 33 141.774 11.064 5.015 1.00 0.00 H new ATOM 0 HE21 GLN A 33 140.437 10.113 7.068 1.00 0.00 H new ATOM 0 HE22 GLN A 33 139.794 11.371 8.130 1.00 0.00 H new ATOM 507 N GLU A 34 145.125 7.951 6.680 1.00 0.00 N ATOM 508 CA GLU A 34 146.296 7.322 7.333 1.00 0.00 C ATOM 509 C GLU A 34 147.326 7.029 6.264 1.00 0.00 C ATOM 510 O GLU A 34 148.410 7.592 6.274 1.00 0.00 O ATOM 511 CB GLU A 34 145.891 6.023 8.071 1.00 0.00 C ATOM 512 CG GLU A 34 144.475 6.160 8.668 1.00 0.00 C ATOM 513 CD GLU A 34 144.191 4.983 9.557 1.00 0.00 C ATOM 514 OE1 GLU A 34 144.613 5.003 10.670 1.00 0.00 O ATOM 515 OE2 GLU A 34 143.547 4.079 9.119 1.00 0.00 O ATOM 0 H GLU A 34 144.249 7.435 6.767 1.00 0.00 H new ATOM 0 HA GLU A 34 146.710 7.999 8.080 1.00 0.00 H new ATOM 0 HB2 GLU A 34 145.921 5.181 7.380 1.00 0.00 H new ATOM 0 HB3 GLU A 34 146.608 5.810 8.864 1.00 0.00 H new ATOM 0 HG2 GLU A 34 144.397 7.086 9.237 1.00 0.00 H new ATOM 0 HG3 GLU A 34 143.735 6.213 7.869 1.00 0.00 H new ATOM 522 N LEU A 35 146.974 6.192 5.328 1.00 0.00 N ATOM 523 CA LEU A 35 147.889 5.836 4.195 1.00 0.00 C ATOM 524 C LEU A 35 148.497 7.114 3.616 1.00 0.00 C ATOM 525 O LEU A 35 149.634 7.132 3.144 1.00 0.00 O ATOM 526 CB LEU A 35 147.058 5.143 3.106 1.00 0.00 C ATOM 527 CG LEU A 35 146.480 3.815 3.638 1.00 0.00 C ATOM 528 CD1 LEU A 35 145.105 3.562 3.030 1.00 0.00 C ATOM 529 CD2 LEU A 35 147.401 2.662 3.257 1.00 0.00 C ATOM 0 H LEU A 35 146.068 5.725 5.296 1.00 0.00 H new ATOM 0 HA LEU A 35 148.685 5.179 4.546 1.00 0.00 H new ATOM 0 HB2 LEU A 35 146.248 5.798 2.785 1.00 0.00 H new ATOM 0 HB3 LEU A 35 147.679 4.953 2.231 1.00 0.00 H new ATOM 0 HG LEU A 35 146.396 3.882 4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 35 144.706 2.622 3.412 1.00 0.00 H new ATOM 0 HD12 LEU A 35 144.433 4.377 3.298 1.00 0.00 H new ATOM 0 HD13 LEU A 35 145.192 3.505 1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 35 146.988 1.727 3.635 1.00 0.00 H new ATOM 0 HD22 LEU A 35 147.487 2.608 2.172 1.00 0.00 H new ATOM 0 HD23 LEU A 35 148.387 2.825 3.691 1.00 0.00 H new ATOM 541 N ILE A 36 147.738 8.157 3.598 1.00 0.00 N ATOM 542 CA ILE A 36 148.226 9.431 3.040 1.00 0.00 C ATOM 543 C ILE A 36 149.257 10.038 4.010 1.00 0.00 C ATOM 544 O ILE A 36 150.353 10.394 3.610 1.00 0.00 O ATOM 545 CB ILE A 36 147.013 10.366 2.825 1.00 0.00 C ATOM 546 CG1 ILE A 36 146.172 9.831 1.644 1.00 0.00 C ATOM 547 CG2 ILE A 36 147.464 11.799 2.528 1.00 0.00 C ATOM 548 CD1 ILE A 36 144.800 10.495 1.628 1.00 0.00 C ATOM 0 H ILE A 36 146.782 8.182 3.953 1.00 0.00 H new ATOM 0 HA ILE A 36 148.719 9.283 2.079 1.00 0.00 H new ATOM 0 HB ILE A 36 146.417 10.383 3.738 1.00 0.00 H new ATOM 0 HG12 ILE A 36 146.688 10.025 0.704 1.00 0.00 H new ATOM 0 HG13 ILE A 36 146.060 8.750 1.729 1.00 0.00 H new ATOM 0 HG21 ILE A 36 146.589 12.433 2.382 1.00 0.00 H new ATOM 0 HG22 ILE A 36 148.050 12.177 3.366 1.00 0.00 H new ATOM 0 HG23 ILE A 36 148.074 11.809 1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 36 144.219 10.109 0.791 1.00 0.00 H new ATOM 0 HD12 ILE A 36 144.280 10.279 2.561 1.00 0.00 H new ATOM 0 HD13 ILE A 36 144.919 11.573 1.520 1.00 0.00 H new ATOM 560 N LYS A 37 148.928 10.164 5.271 1.00 0.00 N ATOM 561 CA LYS A 37 149.886 10.750 6.239 1.00 0.00 C ATOM 562 C LYS A 37 151.196 9.951 6.205 1.00 0.00 C ATOM 563 O LYS A 37 152.307 10.527 6.127 1.00 0.00 O ATOM 564 CB LYS A 37 149.282 10.692 7.642 1.00 0.00 C ATOM 565 CG LYS A 37 147.853 11.309 7.665 1.00 0.00 C ATOM 566 CD LYS A 37 147.813 12.574 8.559 1.00 0.00 C ATOM 567 CE LYS A 37 146.567 12.544 9.480 1.00 0.00 C ATOM 568 NZ LYS A 37 146.725 11.498 10.510 1.00 0.00 N ATOM 0 H LYS A 37 148.031 9.883 5.667 1.00 0.00 H new ATOM 0 HA LYS A 37 150.090 11.788 5.975 1.00 0.00 H new ATOM 0 HB2 LYS A 37 149.240 9.657 7.980 1.00 0.00 H new ATOM 0 HB3 LYS A 37 149.924 11.229 8.340 1.00 0.00 H new ATOM 0 HG2 LYS A 37 147.547 11.565 6.651 1.00 0.00 H new ATOM 0 HG3 LYS A 37 147.140 10.573 8.037 1.00 0.00 H new ATOM 0 HD2 LYS A 37 148.719 12.629 9.163 1.00 0.00 H new ATOM 0 HD3 LYS A 37 147.791 13.468 7.935 1.00 0.00 H new ATOM 0 HE2 LYS A 37 146.432 13.516 9.955 1.00 0.00 H new ATOM 0 HE3 LYS A 37 145.672 12.351 8.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 146.096 11.703 11.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 146.479 10.572 10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 147.711 11.481 10.839 1.00 0.00 H new ATOM 582 N GLU A 38 151.100 8.642 6.240 1.00 0.00 N ATOM 583 CA GLU A 38 152.323 7.840 6.202 1.00 0.00 C ATOM 584 C GLU A 38 153.025 8.032 4.863 1.00 0.00 C ATOM 585 O GLU A 38 154.228 8.089 4.819 1.00 0.00 O ATOM 586 CB GLU A 38 152.056 6.363 6.535 1.00 0.00 C ATOM 587 CG GLU A 38 150.785 5.838 5.886 1.00 0.00 C ATOM 588 CD GLU A 38 150.794 4.335 5.945 1.00 0.00 C ATOM 589 OE1 GLU A 38 151.103 3.808 6.987 1.00 0.00 O ATOM 590 OE2 GLU A 38 150.515 3.724 4.962 1.00 0.00 O ATOM 0 H GLU A 38 150.228 8.116 6.293 1.00 0.00 H new ATOM 0 HA GLU A 38 152.997 8.192 6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 38 152.903 5.761 6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 38 151.983 6.246 7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 38 149.908 6.230 6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 38 150.723 6.174 4.851 1.00 0.00 H new ATOM 597 N TYR A 39 152.296 8.272 3.787 1.00 0.00 N ATOM 598 CA TYR A 39 152.991 8.618 2.516 1.00 0.00 C ATOM 599 C TYR A 39 153.865 9.814 2.679 1.00 0.00 C ATOM 600 O TYR A 39 154.940 9.848 2.152 1.00 0.00 O ATOM 601 CB TYR A 39 152.036 8.834 1.331 1.00 0.00 C ATOM 602 CG TYR A 39 151.866 7.563 0.541 1.00 0.00 C ATOM 603 CD1 TYR A 39 153.010 6.903 0.079 1.00 0.00 C ATOM 604 CD2 TYR A 39 150.603 7.068 0.225 1.00 0.00 C ATOM 605 CE1 TYR A 39 152.898 5.764 -0.684 1.00 0.00 C ATOM 606 CE2 TYR A 39 150.495 5.906 -0.549 1.00 0.00 C ATOM 607 CZ TYR A 39 151.651 5.260 -1.002 1.00 0.00 C ATOM 608 OH TYR A 39 151.567 4.129 -1.765 1.00 0.00 O ATOM 0 H TYR A 39 151.277 8.242 3.743 1.00 0.00 H new ATOM 0 HA TYR A 39 153.605 7.748 2.281 1.00 0.00 H new ATOM 0 HB2 TYR A 39 151.067 9.172 1.697 1.00 0.00 H new ATOM 0 HB3 TYR A 39 152.425 9.620 0.684 1.00 0.00 H new ATOM 0 HD1 TYR A 39 153.988 7.291 0.323 1.00 0.00 H new ATOM 0 HD2 TYR A 39 149.716 7.575 0.574 1.00 0.00 H new ATOM 0 HE1 TYR A 39 153.787 5.262 -1.036 1.00 0.00 H new ATOM 0 HE2 TYR A 39 149.521 5.509 -0.796 1.00 0.00 H new ATOM 0 HH TYR A 39 151.062 3.443 -1.279 1.00 0.00 H new ATOM 618 N LEU A 40 153.440 10.800 3.382 1.00 0.00 N ATOM 619 CA LEU A 40 154.311 11.994 3.521 1.00 0.00 C ATOM 620 C LEU A 40 155.606 11.566 4.183 1.00 0.00 C ATOM 621 O LEU A 40 156.684 11.855 3.699 1.00 0.00 O ATOM 622 CB LEU A 40 153.608 13.079 4.352 1.00 0.00 C ATOM 623 CG LEU A 40 152.119 13.160 3.956 1.00 0.00 C ATOM 624 CD1 LEU A 40 151.459 14.354 4.623 1.00 0.00 C ATOM 625 CD2 LEU A 40 151.985 13.293 2.437 1.00 0.00 C ATOM 0 H LEU A 40 152.542 10.843 3.865 1.00 0.00 H new ATOM 0 HA LEU A 40 154.522 12.417 2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 40 153.699 12.852 5.414 1.00 0.00 H new ATOM 0 HB3 LEU A 40 154.090 14.043 4.190 1.00 0.00 H new ATOM 0 HG LEU A 40 151.626 12.246 4.286 1.00 0.00 H new ATOM 0 HD11 LEU A 40 150.409 14.398 4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 40 151.533 14.253 5.706 1.00 0.00 H new ATOM 0 HD13 LEU A 40 151.960 15.269 4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 40 150.930 13.349 2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 40 152.493 14.198 2.105 1.00 0.00 H new ATOM 0 HD23 LEU A 40 152.436 12.426 1.955 1.00 0.00 H new ATOM 637 N GLU A 41 155.516 10.841 5.255 1.00 0.00 N ATOM 638 CA GLU A 41 156.771 10.372 5.919 1.00 0.00 C ATOM 639 C GLU A 41 157.510 9.402 4.972 1.00 0.00 C ATOM 640 O GLU A 41 158.658 9.613 4.607 1.00 0.00 O ATOM 641 CB GLU A 41 156.420 9.670 7.248 1.00 0.00 C ATOM 642 CG GLU A 41 155.266 10.430 7.949 1.00 0.00 C ATOM 643 CD GLU A 41 155.495 10.452 9.433 1.00 0.00 C ATOM 644 OE1 GLU A 41 156.352 11.167 9.863 1.00 0.00 O ATOM 645 OE2 GLU A 41 154.805 9.759 10.127 1.00 0.00 O ATOM 0 H GLU A 41 154.645 10.552 5.701 1.00 0.00 H new ATOM 0 HA GLU A 41 157.420 11.221 6.136 1.00 0.00 H new ATOM 0 HB2 GLU A 41 156.127 8.637 7.059 1.00 0.00 H new ATOM 0 HB3 GLU A 41 157.295 9.639 7.897 1.00 0.00 H new ATOM 0 HG2 GLU A 41 155.205 11.449 7.567 1.00 0.00 H new ATOM 0 HG3 GLU A 41 154.314 9.948 7.726 1.00 0.00 H new ATOM 652 N LEU A 42 156.862 8.337 4.605 1.00 0.00 N ATOM 653 CA LEU A 42 157.465 7.297 3.715 1.00 0.00 C ATOM 654 C LEU A 42 158.095 7.966 2.491 1.00 0.00 C ATOM 655 O LEU A 42 159.262 7.753 2.176 1.00 0.00 O ATOM 656 CB LEU A 42 156.345 6.336 3.255 1.00 0.00 C ATOM 657 CG LEU A 42 156.885 4.913 3.010 1.00 0.00 C ATOM 658 CD1 LEU A 42 157.959 4.912 1.942 1.00 0.00 C ATOM 659 CD2 LEU A 42 157.453 4.334 4.300 1.00 0.00 C ATOM 0 H LEU A 42 155.905 8.133 4.893 1.00 0.00 H new ATOM 0 HA LEU A 42 158.236 6.747 4.256 1.00 0.00 H new ATOM 0 HB2 LEU A 42 155.560 6.303 4.010 1.00 0.00 H new ATOM 0 HB3 LEU A 42 155.891 6.716 2.340 1.00 0.00 H new ATOM 0 HG LEU A 42 156.053 4.296 2.669 1.00 0.00 H new ATOM 0 HD11 LEU A 42 158.321 3.895 1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 42 157.544 5.292 1.008 1.00 0.00 H new ATOM 0 HD13 LEU A 42 158.786 5.548 2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 42 157.831 3.329 4.112 1.00 0.00 H new ATOM 0 HD22 LEU A 42 158.266 4.967 4.656 1.00 0.00 H new ATOM 0 HD23 LEU A 42 156.669 4.292 5.056 1.00 0.00 H new ATOM 671 N GLU A 43 157.333 8.745 1.788 1.00 0.00 N ATOM 672 CA GLU A 43 157.861 9.417 0.579 1.00 0.00 C ATOM 673 C GLU A 43 159.067 10.238 0.969 1.00 0.00 C ATOM 674 O GLU A 43 160.093 10.165 0.333 1.00 0.00 O ATOM 675 CB GLU A 43 156.808 10.343 -0.025 1.00 0.00 C ATOM 676 CG GLU A 43 155.778 9.541 -0.848 1.00 0.00 C ATOM 677 CD GLU A 43 155.219 10.435 -1.947 1.00 0.00 C ATOM 678 OE1 GLU A 43 155.099 11.624 -1.726 1.00 0.00 O ATOM 679 OE2 GLU A 43 154.948 9.935 -3.009 1.00 0.00 O ATOM 0 H GLU A 43 156.356 8.947 2.002 1.00 0.00 H new ATOM 0 HA GLU A 43 158.130 8.661 -0.159 1.00 0.00 H new ATOM 0 HB2 GLU A 43 156.299 10.889 0.769 1.00 0.00 H new ATOM 0 HB3 GLU A 43 157.291 11.084 -0.662 1.00 0.00 H new ATOM 0 HG2 GLU A 43 156.248 8.659 -1.283 1.00 0.00 H new ATOM 0 HG3 GLU A 43 154.973 9.188 -0.203 1.00 0.00 H new ATOM 686 N LYS A 44 158.957 11.043 1.987 1.00 0.00 N ATOM 687 CA LYS A 44 160.111 11.861 2.391 1.00 0.00 C ATOM 688 C LYS A 44 161.293 10.930 2.651 1.00 0.00 C ATOM 689 O LYS A 44 162.398 11.163 2.181 1.00 0.00 O ATOM 690 CB LYS A 44 159.751 12.656 3.646 1.00 0.00 C ATOM 691 CG LYS A 44 158.734 13.767 3.279 1.00 0.00 C ATOM 692 CD LYS A 44 159.473 15.078 2.938 1.00 0.00 C ATOM 693 CE LYS A 44 158.550 16.011 2.126 1.00 0.00 C ATOM 694 NZ LYS A 44 158.285 15.427 0.794 1.00 0.00 N ATOM 0 H LYS A 44 158.115 11.164 2.551 1.00 0.00 H new ATOM 0 HA LYS A 44 160.380 12.568 1.606 1.00 0.00 H new ATOM 0 HB2 LYS A 44 159.326 11.993 4.400 1.00 0.00 H new ATOM 0 HB3 LYS A 44 160.648 13.098 4.079 1.00 0.00 H new ATOM 0 HG2 LYS A 44 158.130 13.450 2.429 1.00 0.00 H new ATOM 0 HG3 LYS A 44 158.050 13.933 4.111 1.00 0.00 H new ATOM 0 HD2 LYS A 44 159.790 15.575 3.855 1.00 0.00 H new ATOM 0 HD3 LYS A 44 160.375 14.858 2.366 1.00 0.00 H new ATOM 0 HE2 LYS A 44 157.611 16.161 2.659 1.00 0.00 H new ATOM 0 HE3 LYS A 44 159.015 16.991 2.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 158.080 16.188 0.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 159.120 14.895 0.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 157.468 14.786 0.852 1.00 0.00 H new ATOM 708 N CYS A 45 161.053 9.837 3.320 1.00 0.00 N ATOM 709 CA CYS A 45 162.127 8.851 3.568 1.00 0.00 C ATOM 710 C CYS A 45 162.701 8.380 2.236 1.00 0.00 C ATOM 711 O CYS A 45 163.874 8.558 1.959 1.00 0.00 O ATOM 712 CB CYS A 45 161.547 7.661 4.325 1.00 0.00 C ATOM 713 SG CYS A 45 160.932 8.215 5.927 1.00 0.00 S ATOM 0 H CYS A 45 160.144 9.587 3.708 1.00 0.00 H new ATOM 0 HA CYS A 45 162.920 9.310 4.159 1.00 0.00 H new ATOM 0 HB2 CYS A 45 160.740 7.208 3.750 1.00 0.00 H new ATOM 0 HB3 CYS A 45 162.310 6.895 4.461 1.00 0.00 H new ATOM 0 HG CYS A 45 159.866 8.939 5.756 1.00 0.00 H new ATOM 719 N LEU A 46 161.897 7.764 1.411 1.00 0.00 N ATOM 720 CA LEU A 46 162.422 7.256 0.100 1.00 0.00 C ATOM 721 C LEU A 46 163.055 8.408 -0.670 1.00 0.00 C ATOM 722 O LEU A 46 164.058 8.242 -1.291 1.00 0.00 O ATOM 723 CB LEU A 46 161.292 6.608 -0.739 1.00 0.00 C ATOM 724 CG LEU A 46 161.882 5.926 -2.013 1.00 0.00 C ATOM 725 CD1 LEU A 46 163.148 5.145 -1.675 1.00 0.00 C ATOM 726 CD2 LEU A 46 160.872 4.947 -2.606 1.00 0.00 C ATOM 0 H LEU A 46 160.907 7.589 1.582 1.00 0.00 H new ATOM 0 HA LEU A 46 163.173 6.491 0.296 1.00 0.00 H new ATOM 0 HB2 LEU A 46 160.761 5.871 -0.137 1.00 0.00 H new ATOM 0 HB3 LEU A 46 160.565 7.367 -1.029 1.00 0.00 H new ATOM 0 HG LEU A 46 162.113 6.715 -2.728 1.00 0.00 H new ATOM 0 HD11 LEU A 46 163.540 4.679 -2.579 1.00 0.00 H new ATOM 0 HD12 LEU A 46 163.895 5.824 -1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 46 162.915 4.374 -0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 46 161.297 4.479 -3.494 1.00 0.00 H new ATOM 0 HD22 LEU A 46 160.634 4.179 -1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 46 159.963 5.483 -2.878 1.00 0.00 H new ATOM 738 N SER A 47 162.502 9.576 -0.587 1.00 0.00 N ATOM 739 CA SER A 47 163.102 10.738 -1.293 1.00 0.00 C ATOM 740 C SER A 47 164.514 10.951 -0.758 1.00 0.00 C ATOM 741 O SER A 47 165.492 10.953 -1.509 1.00 0.00 O ATOM 742 CB SER A 47 162.268 12.001 -1.050 1.00 0.00 C ATOM 743 OG SER A 47 160.868 11.737 -1.299 1.00 0.00 O ATOM 0 H SER A 47 161.654 9.781 -0.058 1.00 0.00 H new ATOM 0 HA SER A 47 163.126 10.540 -2.365 1.00 0.00 H new ATOM 0 HB2 SER A 47 162.403 12.342 -0.024 1.00 0.00 H new ATOM 0 HB3 SER A 47 162.614 12.804 -1.701 1.00 0.00 H new ATOM 0 HG SER A 47 160.506 11.182 -0.577 1.00 0.00 H new ATOM 749 N ARG A 48 164.636 11.092 0.531 1.00 0.00 N ATOM 750 CA ARG A 48 165.973 11.277 1.152 1.00 0.00 C ATOM 751 C ARG A 48 166.853 10.105 0.753 1.00 0.00 C ATOM 752 O ARG A 48 168.029 10.260 0.434 1.00 0.00 O ATOM 753 CB ARG A 48 165.806 11.279 2.666 1.00 0.00 C ATOM 754 CG ARG A 48 165.101 12.571 3.109 1.00 0.00 C ATOM 755 CD ARG A 48 165.027 12.647 4.646 1.00 0.00 C ATOM 756 NE ARG A 48 165.201 11.280 5.260 1.00 0.00 N ATOM 757 CZ ARG A 48 165.095 11.115 6.558 1.00 0.00 C ATOM 758 NH1 ARG A 48 164.906 12.142 7.332 1.00 0.00 N ATOM 759 NH2 ARG A 48 165.196 9.928 7.063 1.00 0.00 N ATOM 0 H ARG A 48 163.856 11.087 1.188 1.00 0.00 H new ATOM 0 HA ARG A 48 166.423 12.214 0.824 1.00 0.00 H new ATOM 0 HB2 ARG A 48 165.225 10.411 2.978 1.00 0.00 H new ATOM 0 HB3 ARG A 48 166.780 11.201 3.149 1.00 0.00 H new ATOM 0 HG2 ARG A 48 165.639 13.436 2.722 1.00 0.00 H new ATOM 0 HG3 ARG A 48 164.096 12.606 2.689 1.00 0.00 H new ATOM 0 HD2 ARG A 48 165.800 13.319 5.019 1.00 0.00 H new ATOM 0 HD3 ARG A 48 164.067 13.067 4.948 1.00 0.00 H new ATOM 0 HE ARG A 48 165.402 10.478 4.662 1.00 0.00 H new ATOM 0 HH11 ARG A 48 164.840 13.078 6.931 1.00 0.00 H new ATOM 0 HH12 ARG A 48 164.824 12.012 8.340 1.00 0.00 H new ATOM 0 HH21 ARG A 48 165.357 9.126 6.453 1.00 0.00 H new ATOM 0 HH22 ARG A 48 165.114 9.794 8.071 1.00 0.00 H new ATOM 773 N MET A 49 166.314 8.930 0.798 1.00 0.00 N ATOM 774 CA MET A 49 167.098 7.746 0.445 1.00 0.00 C ATOM 775 C MET A 49 167.393 7.771 -1.054 1.00 0.00 C ATOM 776 O MET A 49 168.364 7.257 -1.487 1.00 0.00 O ATOM 777 CB MET A 49 166.308 6.473 0.799 1.00 0.00 C ATOM 778 CG MET A 49 165.855 6.523 2.275 1.00 0.00 C ATOM 779 SD MET A 49 166.982 5.546 3.292 1.00 0.00 S ATOM 780 CE MET A 49 166.315 3.914 2.903 1.00 0.00 C ATOM 0 H MET A 49 165.348 8.744 1.069 1.00 0.00 H new ATOM 0 HA MET A 49 168.034 7.748 1.003 1.00 0.00 H new ATOM 0 HB2 MET A 49 165.439 6.381 0.147 1.00 0.00 H new ATOM 0 HB3 MET A 49 166.928 5.592 0.630 1.00 0.00 H new ATOM 0 HG2 MET A 49 165.837 7.555 2.625 1.00 0.00 H new ATOM 0 HG3 MET A 49 164.840 6.137 2.367 1.00 0.00 H new ATOM 0 HE1 MET A 49 167.079 3.157 3.081 1.00 0.00 H new ATOM 0 HE2 MET A 49 165.451 3.714 3.536 1.00 0.00 H new ATOM 0 HE3 MET A 49 166.012 3.885 1.856 1.00 0.00 H new ATOM 790 N GLU A 50 166.598 8.412 -1.826 1.00 0.00 N ATOM 791 CA GLU A 50 166.872 8.470 -3.275 1.00 0.00 C ATOM 792 C GLU A 50 168.085 9.357 -3.505 1.00 0.00 C ATOM 793 O GLU A 50 168.934 9.074 -4.348 1.00 0.00 O ATOM 794 CB GLU A 50 165.650 8.982 -4.006 1.00 0.00 C ATOM 795 CG GLU A 50 164.743 7.807 -4.405 1.00 0.00 C ATOM 796 CD GLU A 50 163.662 8.308 -5.324 1.00 0.00 C ATOM 797 OE1 GLU A 50 163.977 8.643 -6.430 1.00 0.00 O ATOM 798 OE2 GLU A 50 162.538 8.365 -4.914 1.00 0.00 O ATOM 0 H GLU A 50 165.759 8.906 -1.521 1.00 0.00 H new ATOM 0 HA GLU A 50 167.092 7.477 -3.666 1.00 0.00 H new ATOM 0 HB2 GLU A 50 165.101 9.676 -3.370 1.00 0.00 H new ATOM 0 HB3 GLU A 50 165.953 9.536 -4.895 1.00 0.00 H new ATOM 0 HG2 GLU A 50 165.328 7.032 -4.900 1.00 0.00 H new ATOM 0 HG3 GLU A 50 164.302 7.355 -3.517 1.00 0.00 H new ATOM 805 N ASP A 51 168.223 10.381 -2.719 1.00 0.00 N ATOM 806 CA ASP A 51 169.428 11.238 -2.807 1.00 0.00 C ATOM 807 C ASP A 51 170.620 10.375 -2.436 1.00 0.00 C ATOM 808 O ASP A 51 171.548 10.186 -3.208 1.00 0.00 O ATOM 809 CB ASP A 51 169.329 12.383 -1.775 1.00 0.00 C ATOM 810 CG ASP A 51 168.667 13.593 -2.367 1.00 0.00 C ATOM 811 OD1 ASP A 51 169.230 14.169 -3.271 1.00 0.00 O ATOM 812 OD2 ASP A 51 167.622 13.945 -1.914 1.00 0.00 O ATOM 0 H ASP A 51 167.544 10.663 -2.012 1.00 0.00 H new ATOM 0 HA ASP A 51 169.523 11.656 -3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 51 168.764 12.045 -0.906 1.00 0.00 H new ATOM 0 HB3 ASP A 51 170.327 12.647 -1.424 1.00 0.00 H new ATOM 817 N GLU A 52 170.601 9.874 -1.238 1.00 0.00 N ATOM 818 CA GLU A 52 171.719 9.045 -0.727 1.00 0.00 C ATOM 819 C GLU A 52 171.969 7.865 -1.642 1.00 0.00 C ATOM 820 O GLU A 52 173.072 7.598 -2.003 1.00 0.00 O ATOM 821 CB GLU A 52 171.365 8.499 0.666 1.00 0.00 C ATOM 822 CG GLU A 52 171.472 9.601 1.720 1.00 0.00 C ATOM 823 CD GLU A 52 172.893 9.673 2.224 1.00 0.00 C ATOM 824 OE1 GLU A 52 173.317 8.754 2.869 1.00 0.00 O ATOM 825 OE2 GLU A 52 173.543 10.637 1.958 1.00 0.00 O ATOM 0 H GLU A 52 169.837 10.008 -0.575 1.00 0.00 H new ATOM 0 HA GLU A 52 172.610 9.671 -0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 52 170.353 8.094 0.657 1.00 0.00 H new ATOM 0 HB3 GLU A 52 172.035 7.678 0.922 1.00 0.00 H new ATOM 0 HG2 GLU A 52 171.177 10.559 1.292 1.00 0.00 H new ATOM 0 HG3 GLU A 52 170.791 9.397 2.546 1.00 0.00 H new ATOM 832 N ASN A 53 170.958 7.111 -1.938 1.00 0.00 N ATOM 833 CA ASN A 53 171.140 5.865 -2.721 1.00 0.00 C ATOM 834 C ASN A 53 171.871 6.175 -3.982 1.00 0.00 C ATOM 835 O ASN A 53 172.822 5.512 -4.338 1.00 0.00 O ATOM 836 CB ASN A 53 169.761 5.252 -3.021 1.00 0.00 C ATOM 837 CG ASN A 53 169.335 4.486 -1.779 1.00 0.00 C ATOM 838 OD1 ASN A 53 168.967 5.153 -0.741 1.00 0.00 O flip ATOM 839 ND2 ASN A 53 169.357 3.265 -1.744 1.00 0.00 N flip ATOM 0 H ASN A 53 169.995 7.308 -1.666 1.00 0.00 H new ATOM 0 HA ASN A 53 171.726 5.144 -2.152 1.00 0.00 H new ATOM 0 HB2 ASN A 53 169.037 6.031 -3.261 1.00 0.00 H new ATOM 0 HB3 ASN A 53 169.814 4.588 -3.884 1.00 0.00 H new ATOM 0 HD21 ASN A 53 169.648 2.736 -2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 53 169.084 2.774 -0.893 1.00 0.00 H new ATOM 846 N ASN A 54 171.473 7.226 -4.630 1.00 0.00 N ATOM 847 CA ASN A 54 172.153 7.654 -5.872 1.00 0.00 C ATOM 848 C ASN A 54 173.635 7.792 -5.598 1.00 0.00 C ATOM 849 O ASN A 54 174.458 7.125 -6.204 1.00 0.00 O ATOM 850 CB ASN A 54 171.626 9.019 -6.296 1.00 0.00 C ATOM 851 CG ASN A 54 170.420 8.883 -7.201 1.00 0.00 C ATOM 852 OD1 ASN A 54 169.992 7.787 -7.539 1.00 0.00 O ATOM 853 ND2 ASN A 54 169.841 9.939 -7.598 1.00 0.00 N ATOM 0 H ASN A 54 170.691 7.816 -4.345 1.00 0.00 H new ATOM 0 HA ASN A 54 171.970 6.918 -6.655 1.00 0.00 H new ATOM 0 HB2 ASN A 54 171.358 9.599 -5.413 1.00 0.00 H new ATOM 0 HB3 ASN A 54 172.411 9.571 -6.813 1.00 0.00 H new ATOM 0 HD21 ASN A 54 169.019 9.875 -8.199 1.00 0.00 H new ATOM 0 HD22 ASN A 54 170.197 10.852 -7.317 1.00 0.00 H new ATOM 860 N ARG A 55 173.979 8.681 -4.702 1.00 0.00 N ATOM 861 CA ARG A 55 175.399 8.937 -4.377 1.00 0.00 C ATOM 862 C ARG A 55 176.019 7.675 -3.818 1.00 0.00 C ATOM 863 O ARG A 55 176.892 7.106 -4.407 1.00 0.00 O ATOM 864 CB ARG A 55 175.483 10.063 -3.332 1.00 0.00 C ATOM 865 CG ARG A 55 175.691 11.414 -4.035 1.00 0.00 C ATOM 866 CD ARG A 55 174.385 11.878 -4.698 1.00 0.00 C ATOM 867 NE ARG A 55 173.479 12.465 -3.664 1.00 0.00 N ATOM 868 CZ ARG A 55 172.346 13.049 -4.011 1.00 0.00 C ATOM 869 NH1 ARG A 55 171.980 13.079 -5.261 1.00 0.00 N ATOM 870 NH2 ARG A 55 171.604 13.599 -3.107 1.00 0.00 N ATOM 0 H ARG A 55 173.315 9.248 -4.175 1.00 0.00 H new ATOM 0 HA ARG A 55 175.937 9.236 -5.277 1.00 0.00 H new ATOM 0 HB2 ARG A 55 174.569 10.089 -2.738 1.00 0.00 H new ATOM 0 HB3 ARG A 55 176.306 9.871 -2.643 1.00 0.00 H new ATOM 0 HG2 ARG A 55 176.025 12.159 -3.313 1.00 0.00 H new ATOM 0 HG3 ARG A 55 176.476 11.324 -4.786 1.00 0.00 H new ATOM 0 HD2 ARG A 55 174.600 12.617 -5.470 1.00 0.00 H new ATOM 0 HD3 ARG A 55 173.896 11.037 -5.189 1.00 0.00 H new ATOM 0 HE ARG A 55 173.739 12.414 -2.679 1.00 0.00 H new ATOM 0 HH11 ARG A 55 172.569 12.651 -5.975 1.00 0.00 H new ATOM 0 HH12 ARG A 55 171.105 13.531 -5.525 1.00 0.00 H new ATOM 0 HH21 ARG A 55 171.894 13.581 -2.129 1.00 0.00 H new ATOM 0 HH22 ARG A 55 170.729 14.051 -3.371 1.00 0.00 H new ATOM 884 N LEU A 56 175.553 7.246 -2.692 1.00 0.00 N ATOM 885 CA LEU A 56 176.074 6.032 -2.017 1.00 0.00 C ATOM 886 C LEU A 56 176.492 4.980 -3.008 1.00 0.00 C ATOM 887 O LEU A 56 177.604 4.484 -2.967 1.00 0.00 O ATOM 888 CB LEU A 56 174.927 5.429 -1.179 1.00 0.00 C ATOM 889 CG LEU A 56 174.836 6.146 0.182 1.00 0.00 C ATOM 890 CD1 LEU A 56 173.624 5.624 0.956 1.00 0.00 C ATOM 891 CD2 LEU A 56 176.114 5.880 1.001 1.00 0.00 C ATOM 0 H LEU A 56 174.797 7.707 -2.186 1.00 0.00 H new ATOM 0 HA LEU A 56 176.936 6.319 -1.415 1.00 0.00 H new ATOM 0 HB2 LEU A 56 173.983 5.527 -1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 56 175.098 4.363 -1.027 1.00 0.00 H new ATOM 0 HG LEU A 56 174.731 7.218 0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 56 173.561 6.132 1.918 1.00 0.00 H new ATOM 0 HD12 LEU A 56 172.716 5.816 0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 56 173.730 4.551 1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 56 176.043 6.390 1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 56 176.224 4.808 1.166 1.00 0.00 H new ATOM 0 HD23 LEU A 56 176.980 6.254 0.455 1.00 0.00 H new ATOM 903 N ARG A 57 175.598 4.587 -3.860 1.00 0.00 N ATOM 904 CA ARG A 57 175.898 3.524 -4.833 1.00 0.00 C ATOM 905 C ARG A 57 177.018 3.979 -5.771 1.00 0.00 C ATOM 906 O ARG A 57 177.909 3.207 -6.105 1.00 0.00 O ATOM 907 CB ARG A 57 174.635 3.192 -5.634 1.00 0.00 C ATOM 908 CG ARG A 57 173.491 2.796 -4.671 1.00 0.00 C ATOM 909 CD ARG A 57 173.269 1.282 -4.707 1.00 0.00 C ATOM 910 NE ARG A 57 173.026 0.863 -6.114 1.00 0.00 N ATOM 911 CZ ARG A 57 172.580 -0.331 -6.394 1.00 0.00 C ATOM 912 NH1 ARG A 57 172.335 -1.183 -5.443 1.00 0.00 N ATOM 913 NH2 ARG A 57 172.379 -0.655 -7.629 1.00 0.00 N ATOM 0 H ARG A 57 174.654 4.968 -3.921 1.00 0.00 H new ATOM 0 HA ARG A 57 176.228 2.630 -4.304 1.00 0.00 H new ATOM 0 HB2 ARG A 57 174.337 4.053 -6.233 1.00 0.00 H new ATOM 0 HB3 ARG A 57 174.837 2.376 -6.328 1.00 0.00 H new ATOM 0 HG2 ARG A 57 173.735 3.111 -3.656 1.00 0.00 H new ATOM 0 HG3 ARG A 57 172.573 3.312 -4.953 1.00 0.00 H new ATOM 0 HD2 ARG A 57 174.139 0.764 -4.305 1.00 0.00 H new ATOM 0 HD3 ARG A 57 172.419 1.011 -4.081 1.00 0.00 H new ATOM 0 HE ARG A 57 173.211 1.520 -6.872 1.00 0.00 H new ATOM 0 HH11 ARG A 57 172.491 -0.920 -4.470 1.00 0.00 H new ATOM 0 HH12 ARG A 57 171.987 -2.114 -5.670 1.00 0.00 H new ATOM 0 HH21 ARG A 57 172.569 0.019 -8.371 1.00 0.00 H new ATOM 0 HH22 ARG A 57 172.031 -1.585 -7.862 1.00 0.00 H new ATOM 927 N LEU A 58 176.986 5.200 -6.212 1.00 0.00 N ATOM 928 CA LEU A 58 178.030 5.694 -7.137 1.00 0.00 C ATOM 929 C LEU A 58 179.351 5.785 -6.372 1.00 0.00 C ATOM 930 O LEU A 58 180.414 5.443 -6.886 1.00 0.00 O ATOM 931 CB LEU A 58 177.627 7.044 -7.691 1.00 0.00 C ATOM 932 CG LEU A 58 176.346 6.912 -8.530 1.00 0.00 C ATOM 933 CD1 LEU A 58 175.671 8.284 -8.713 1.00 0.00 C ATOM 934 CD2 LEU A 58 176.681 6.319 -9.891 1.00 0.00 C ATOM 0 H LEU A 58 176.271 5.884 -5.967 1.00 0.00 H new ATOM 0 HA LEU A 58 178.149 5.011 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 58 177.465 7.747 -6.874 1.00 0.00 H new ATOM 0 HB3 LEU A 58 178.432 7.449 -8.304 1.00 0.00 H new ATOM 0 HG LEU A 58 175.655 6.252 -8.005 1.00 0.00 H new ATOM 0 HD11 LEU A 58 174.766 8.168 -9.310 1.00 0.00 H new ATOM 0 HD12 LEU A 58 175.412 8.695 -7.737 1.00 0.00 H new ATOM 0 HD13 LEU A 58 176.357 8.962 -9.222 1.00 0.00 H new ATOM 0 HD21 LEU A 58 175.770 6.227 -10.482 1.00 0.00 H new ATOM 0 HD22 LEU A 58 177.385 6.971 -10.408 1.00 0.00 H new ATOM 0 HD23 LEU A 58 177.128 5.334 -9.759 1.00 0.00 H new ATOM 946 N GLU A 59 179.295 6.237 -5.182 1.00 0.00 N ATOM 947 CA GLU A 59 180.504 6.367 -4.345 1.00 0.00 C ATOM 948 C GLU A 59 181.022 4.973 -3.976 1.00 0.00 C ATOM 949 O GLU A 59 182.114 4.593 -4.327 1.00 0.00 O ATOM 950 CB GLU A 59 180.133 7.133 -3.056 1.00 0.00 C ATOM 951 CG GLU A 59 179.629 8.555 -3.396 1.00 0.00 C ATOM 952 CD GLU A 59 179.173 9.252 -2.119 1.00 0.00 C ATOM 953 OE1 GLU A 59 178.585 8.610 -1.294 1.00 0.00 O ATOM 954 OE2 GLU A 59 179.434 10.422 -1.978 1.00 0.00 O ATOM 0 H GLU A 59 178.433 6.537 -4.727 1.00 0.00 H new ATOM 0 HA GLU A 59 181.278 6.906 -4.891 1.00 0.00 H new ATOM 0 HB2 GLU A 59 179.362 6.588 -2.512 1.00 0.00 H new ATOM 0 HB3 GLU A 59 181.002 7.196 -2.401 1.00 0.00 H new ATOM 0 HG2 GLU A 59 180.423 9.129 -3.873 1.00 0.00 H new ATOM 0 HG3 GLU A 59 178.805 8.500 -4.107 1.00 0.00 H new ATOM 961 N SER A 60 180.250 4.243 -3.227 1.00 0.00 N ATOM 962 CA SER A 60 180.672 2.895 -2.723 1.00 0.00 C ATOM 963 C SER A 60 181.420 2.089 -3.799 1.00 0.00 C ATOM 964 O SER A 60 182.435 1.452 -3.526 1.00 0.00 O ATOM 965 CB SER A 60 179.432 2.120 -2.288 1.00 0.00 C ATOM 966 OG SER A 60 178.403 2.277 -3.274 1.00 0.00 O ATOM 0 H SER A 60 179.316 4.526 -2.931 1.00 0.00 H new ATOM 0 HA SER A 60 181.352 3.044 -1.884 1.00 0.00 H new ATOM 0 HB2 SER A 60 179.674 1.065 -2.164 1.00 0.00 H new ATOM 0 HB3 SER A 60 179.083 2.483 -1.321 1.00 0.00 H new ATOM 0 HG SER A 60 177.998 3.165 -3.186 1.00 0.00 H new ATOM 972 N LYS A 61 180.908 2.048 -5.005 1.00 0.00 N ATOM 973 CA LYS A 61 181.595 1.242 -6.063 1.00 0.00 C ATOM 974 C LYS A 61 182.903 1.933 -6.429 1.00 0.00 C ATOM 975 O LYS A 61 183.942 1.304 -6.569 1.00 0.00 O ATOM 976 CB LYS A 61 180.696 1.088 -7.310 1.00 0.00 C ATOM 977 CG LYS A 61 180.400 2.463 -7.949 1.00 0.00 C ATOM 978 CD LYS A 61 179.166 2.367 -8.868 1.00 0.00 C ATOM 979 CE LYS A 61 179.528 2.796 -10.292 1.00 0.00 C ATOM 980 NZ LYS A 61 180.512 1.849 -10.856 1.00 0.00 N ATOM 0 H LYS A 61 180.058 2.529 -5.300 1.00 0.00 H new ATOM 0 HA LYS A 61 181.800 0.242 -5.681 1.00 0.00 H new ATOM 0 HB2 LYS A 61 181.185 0.442 -8.039 1.00 0.00 H new ATOM 0 HB3 LYS A 61 179.760 0.603 -7.031 1.00 0.00 H new ATOM 0 HG2 LYS A 61 180.225 3.205 -7.170 1.00 0.00 H new ATOM 0 HG3 LYS A 61 181.264 2.800 -8.522 1.00 0.00 H new ATOM 0 HD2 LYS A 61 178.788 1.345 -8.874 1.00 0.00 H new ATOM 0 HD3 LYS A 61 178.367 3.000 -8.482 1.00 0.00 H new ATOM 0 HE2 LYS A 61 178.633 2.821 -10.914 1.00 0.00 H new ATOM 0 HE3 LYS A 61 179.940 3.805 -10.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 180.448 1.859 -11.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 181.470 2.130 -10.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 180.311 0.890 -10.506 1.00 0.00 H new ATOM 994 N ARG A 62 182.878 3.226 -6.525 1.00 0.00 N ATOM 995 CA ARG A 62 184.102 3.996 -6.826 1.00 0.00 C ATOM 996 C ARG A 62 184.899 4.177 -5.526 1.00 0.00 C ATOM 997 O ARG A 62 185.574 5.175 -5.333 1.00 0.00 O ATOM 998 CB ARG A 62 183.707 5.368 -7.423 1.00 0.00 C ATOM 999 CG ARG A 62 184.949 6.102 -7.968 1.00 0.00 C ATOM 1000 CD ARG A 62 184.521 7.159 -8.996 1.00 0.00 C ATOM 1001 NE ARG A 62 184.176 6.490 -10.294 1.00 0.00 N ATOM 1002 CZ ARG A 62 183.436 7.111 -11.193 1.00 0.00 C ATOM 1003 NH1 ARG A 62 183.010 8.323 -10.961 1.00 0.00 N ATOM 1004 NH2 ARG A 62 183.149 6.522 -12.319 1.00 0.00 N ATOM 0 H ARG A 62 182.039 3.793 -6.404 1.00 0.00 H new ATOM 0 HA ARG A 62 184.720 3.468 -7.553 1.00 0.00 H new ATOM 0 HB2 ARG A 62 182.981 5.227 -8.224 1.00 0.00 H new ATOM 0 HB3 ARG A 62 183.224 5.977 -6.659 1.00 0.00 H new ATOM 0 HG2 ARG A 62 185.490 6.576 -7.149 1.00 0.00 H new ATOM 0 HG3 ARG A 62 185.631 5.388 -8.430 1.00 0.00 H new ATOM 0 HD2 ARG A 62 183.662 7.716 -8.623 1.00 0.00 H new ATOM 0 HD3 ARG A 62 185.325 7.878 -9.149 1.00 0.00 H new ATOM 0 HE ARG A 62 184.516 5.547 -10.483 1.00 0.00 H new ATOM 0 HH11 ARG A 62 183.249 8.789 -10.086 1.00 0.00 H new ATOM 0 HH12 ARG A 62 182.438 8.804 -11.655 1.00 0.00 H new ATOM 0 HH21 ARG A 62 183.496 5.581 -12.505 1.00 0.00 H new ATOM 0 HH22 ARG A 62 182.577 7.002 -13.014 1.00 0.00 H new ATOM 1018 N LEU A 63 184.756 3.272 -4.594 1.00 0.00 N ATOM 1019 CA LEU A 63 185.423 3.425 -3.303 1.00 0.00 C ATOM 1020 C LEU A 63 186.215 2.153 -2.929 1.00 0.00 C ATOM 1021 O LEU A 63 185.795 1.029 -3.186 1.00 0.00 O ATOM 1022 CB LEU A 63 184.377 3.707 -2.232 1.00 0.00 C ATOM 1023 CG LEU A 63 184.083 5.222 -2.102 1.00 0.00 C ATOM 1024 CD1 LEU A 63 182.927 5.428 -1.135 1.00 0.00 C ATOM 1025 CD2 LEU A 63 185.299 5.965 -1.548 1.00 0.00 C ATOM 0 H LEU A 63 184.193 2.427 -4.690 1.00 0.00 H new ATOM 0 HA LEU A 63 186.127 4.255 -3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 63 183.456 3.177 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 63 184.724 3.320 -1.274 1.00 0.00 H new ATOM 0 HG LEU A 63 183.839 5.608 -3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 63 182.717 6.493 -1.041 1.00 0.00 H new ATOM 0 HD12 LEU A 63 182.042 4.916 -1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 63 183.193 5.023 -0.159 1.00 0.00 H new ATOM 0 HD21 LEU A 63 185.070 7.027 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 63 185.549 5.570 -0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 63 186.146 5.828 -2.220 1.00 0.00 H new ATOM 2083 N HIS B 23 152.200 19.279 -0.618 1.00 0.00 N ATOM 2084 CA HIS B 23 151.086 19.090 -1.593 1.00 0.00 C ATOM 2085 C HIS B 23 150.507 17.697 -1.407 1.00 0.00 C ATOM 2086 O HIS B 23 150.885 16.752 -2.070 1.00 0.00 O ATOM 2087 CB HIS B 23 151.572 19.281 -3.041 1.00 0.00 C ATOM 2088 CG HIS B 23 150.439 19.856 -3.829 1.00 0.00 C ATOM 2089 ND1 HIS B 23 150.283 21.221 -4.003 1.00 0.00 N ATOM 2090 CD2 HIS B 23 149.354 19.271 -4.429 1.00 0.00 C ATOM 2091 CE1 HIS B 23 149.135 21.406 -4.681 1.00 0.00 C ATOM 2092 NE2 HIS B 23 148.529 20.251 -4.958 1.00 0.00 N ATOM 0 HA HIS B 23 150.318 19.841 -1.407 1.00 0.00 H new ATOM 0 HB2 HIS B 23 152.435 19.947 -3.070 1.00 0.00 H new ATOM 0 HB3 HIS B 23 151.889 18.329 -3.467 1.00 0.00 H new ATOM 0 HD2 HIS B 23 149.170 18.208 -4.481 1.00 0.00 H new ATOM 0 HE1 HIS B 23 148.751 22.374 -4.966 1.00 0.00 H new ATOM 0 HE2 HIS B 23 147.647 20.117 -5.453 1.00 0.00 H new ATOM 2101 N THR B 24 149.656 17.558 -0.472 1.00 0.00 N ATOM 2102 CA THR B 24 149.086 16.251 -0.138 1.00 0.00 C ATOM 2103 C THR B 24 147.967 15.912 -1.125 1.00 0.00 C ATOM 2104 O THR B 24 147.644 14.735 -1.329 1.00 0.00 O ATOM 2105 CB THR B 24 148.536 16.336 1.296 1.00 0.00 C ATOM 2106 OG1 THR B 24 149.397 17.155 2.105 1.00 0.00 O ATOM 2107 CG2 THR B 24 148.451 14.946 1.923 1.00 0.00 C ATOM 0 H THR B 24 149.313 18.327 0.104 1.00 0.00 H new ATOM 0 HA THR B 24 149.841 15.467 -0.202 1.00 0.00 H new ATOM 0 HB THR B 24 147.539 16.774 1.251 1.00 0.00 H new ATOM 0 HG1 THR B 24 149.039 17.206 3.016 1.00 0.00 H new ATOM 0 HG21 THR B 24 148.060 15.028 2.937 1.00 0.00 H new ATOM 0 HG22 THR B 24 147.788 14.318 1.328 1.00 0.00 H new ATOM 0 HG23 THR B 24 149.445 14.499 1.952 1.00 0.00 H new ATOM 2115 N GLU B 25 147.354 16.916 -1.716 1.00 0.00 N ATOM 2116 CA GLU B 25 146.201 16.685 -2.643 1.00 0.00 C ATOM 2117 C GLU B 25 146.385 15.386 -3.414 1.00 0.00 C ATOM 2118 O GLU B 25 145.606 14.463 -3.262 1.00 0.00 O ATOM 2119 CB GLU B 25 146.086 17.858 -3.641 1.00 0.00 C ATOM 2120 CG GLU B 25 146.325 19.198 -2.923 1.00 0.00 C ATOM 2121 CD GLU B 25 145.637 20.298 -3.695 1.00 0.00 C ATOM 2122 OE1 GLU B 25 146.065 20.594 -4.790 1.00 0.00 O ATOM 2123 OE2 GLU B 25 144.679 20.822 -3.188 1.00 0.00 O ATOM 0 H GLU B 25 147.609 17.896 -1.592 1.00 0.00 H new ATOM 0 HA GLU B 25 145.290 16.618 -2.048 1.00 0.00 H new ATOM 0 HB2 GLU B 25 146.813 17.734 -4.444 1.00 0.00 H new ATOM 0 HB3 GLU B 25 145.098 17.856 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU B 25 145.938 19.154 -1.905 1.00 0.00 H new ATOM 0 HG3 GLU B 25 147.393 19.401 -2.850 1.00 0.00 H new ATOM 2130 N SER B 26 147.353 15.327 -4.287 1.00 0.00 N ATOM 2131 CA SER B 26 147.537 14.103 -5.126 1.00 0.00 C ATOM 2132 C SER B 26 147.339 12.828 -4.281 1.00 0.00 C ATOM 2133 O SER B 26 146.795 11.865 -4.755 1.00 0.00 O ATOM 2134 CB SER B 26 148.894 14.098 -5.818 1.00 0.00 C ATOM 2135 OG SER B 26 149.445 15.434 -5.828 1.00 0.00 O ATOM 0 H SER B 26 148.027 16.073 -4.458 1.00 0.00 H new ATOM 0 HA SER B 26 146.775 14.117 -5.906 1.00 0.00 H new ATOM 0 HB2 SER B 26 149.573 13.419 -5.302 1.00 0.00 H new ATOM 0 HB3 SER B 26 148.790 13.730 -6.839 1.00 0.00 H new ATOM 0 HG SER B 26 150.318 15.424 -6.273 1.00 0.00 H new ATOM 2141 N LEU B 27 147.702 12.837 -3.032 1.00 0.00 N ATOM 2142 CA LEU B 27 147.473 11.634 -2.211 1.00 0.00 C ATOM 2143 C LEU B 27 145.972 11.504 -1.915 1.00 0.00 C ATOM 2144 O LEU B 27 145.397 10.447 -2.080 1.00 0.00 O ATOM 2145 CB LEU B 27 148.287 11.718 -0.933 1.00 0.00 C ATOM 2146 CG LEU B 27 149.780 11.659 -1.271 1.00 0.00 C ATOM 2147 CD1 LEU B 27 150.589 12.315 -0.157 1.00 0.00 C ATOM 2148 CD2 LEU B 27 150.220 10.200 -1.416 1.00 0.00 C ATOM 0 H LEU B 27 148.144 13.621 -2.552 1.00 0.00 H new ATOM 0 HA LEU B 27 147.796 10.744 -2.752 1.00 0.00 H new ATOM 0 HB2 LEU B 27 148.060 12.644 -0.405 1.00 0.00 H new ATOM 0 HB3 LEU B 27 148.022 10.898 -0.266 1.00 0.00 H new ATOM 0 HG LEU B 27 149.951 12.189 -2.208 1.00 0.00 H new ATOM 0 HD11 LEU B 27 151.650 12.270 -0.403 1.00 0.00 H new ATOM 0 HD12 LEU B 27 150.285 13.356 -0.051 1.00 0.00 H new ATOM 0 HD13 LEU B 27 150.411 11.788 0.780 1.00 0.00 H new ATOM 0 HD21 LEU B 27 151.282 10.163 -1.656 1.00 0.00 H new ATOM 0 HD22 LEU B 27 150.041 9.671 -0.480 1.00 0.00 H new ATOM 0 HD23 LEU B 27 149.650 9.726 -2.215 1.00 0.00 H new ATOM 2160 N GLN B 28 145.302 12.578 -1.576 1.00 0.00 N ATOM 2161 CA GLN B 28 143.825 12.503 -1.397 1.00 0.00 C ATOM 2162 C GLN B 28 143.177 12.322 -2.757 1.00 0.00 C ATOM 2163 O GLN B 28 142.161 11.664 -2.881 1.00 0.00 O ATOM 2164 CB GLN B 28 143.284 13.779 -0.751 1.00 0.00 C ATOM 2165 CG GLN B 28 143.939 13.973 0.597 1.00 0.00 C ATOM 2166 CD GLN B 28 145.287 14.589 0.406 1.00 0.00 C ATOM 2167 OE1 GLN B 28 146.307 13.836 0.435 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 145.413 15.773 0.216 1.00 0.00 N flip ATOM 0 H GLN B 28 145.714 13.497 -1.417 1.00 0.00 H new ATOM 0 HA GLN B 28 143.593 11.661 -0.744 1.00 0.00 H new ATOM 0 HB2 GLN B 28 143.484 14.638 -1.392 1.00 0.00 H new ATOM 0 HB3 GLN B 28 142.202 13.712 -0.636 1.00 0.00 H new ATOM 0 HG2 GLN B 28 143.320 14.612 1.226 1.00 0.00 H new ATOM 0 HG3 GLN B 28 144.033 13.016 1.110 1.00 0.00 H new ATOM 0 HE21 GLN B 28 144.591 16.376 0.193 1.00 0.00 H new ATOM 0 HE22 GLN B 28 146.342 16.171 0.078 1.00 0.00 H new ATOM 2177 N ASN B 29 143.722 12.929 -3.749 1.00 0.00 N ATOM 2178 CA ASN B 29 143.153 12.855 -5.111 1.00 0.00 C ATOM 2179 C ASN B 29 143.087 11.423 -5.592 1.00 0.00 C ATOM 2180 O ASN B 29 142.482 11.143 -6.603 1.00 0.00 O ATOM 2181 CB ASN B 29 144.094 13.594 -6.061 1.00 0.00 C ATOM 2182 CG ASN B 29 144.087 15.103 -5.770 1.00 0.00 C ATOM 2183 OD1 ASN B 29 143.609 15.540 -4.739 1.00 0.00 O ATOM 2184 ND2 ASN B 29 144.589 15.919 -6.628 1.00 0.00 N ATOM 0 H ASN B 29 144.568 13.494 -3.676 1.00 0.00 H new ATOM 0 HA ASN B 29 142.152 13.287 -5.092 1.00 0.00 H new ATOM 0 HB2 ASN B 29 145.106 13.203 -5.955 1.00 0.00 H new ATOM 0 HB3 ASN B 29 143.790 13.416 -7.093 1.00 0.00 H new ATOM 0 HD21 ASN B 29 144.584 16.922 -6.442 1.00 0.00 H new ATOM 0 HD22 ASN B 29 144.992 15.563 -7.495 1.00 0.00 H new ATOM 2191 N MET B 30 143.765 10.517 -4.939 1.00 0.00 N ATOM 2192 CA MET B 30 143.795 9.120 -5.422 1.00 0.00 C ATOM 2193 C MET B 30 142.853 8.257 -4.621 1.00 0.00 C ATOM 2194 O MET B 30 142.475 8.590 -3.505 1.00 0.00 O ATOM 2195 CB MET B 30 145.206 8.564 -5.269 1.00 0.00 C ATOM 2196 CG MET B 30 146.120 9.196 -6.322 1.00 0.00 C ATOM 2197 SD MET B 30 147.416 8.027 -6.770 1.00 0.00 S ATOM 2198 CE MET B 30 148.122 7.815 -5.117 1.00 0.00 C ATOM 0 H MET B 30 144.300 10.693 -4.088 1.00 0.00 H new ATOM 0 HA MET B 30 143.489 9.111 -6.468 1.00 0.00 H new ATOM 0 HB2 MET B 30 145.585 8.775 -4.269 1.00 0.00 H new ATOM 0 HB3 MET B 30 145.196 7.480 -5.384 1.00 0.00 H new ATOM 0 HG2 MET B 30 145.541 9.470 -7.204 1.00 0.00 H new ATOM 0 HG3 MET B 30 146.561 10.113 -5.933 1.00 0.00 H new ATOM 0 HE1 MET B 30 149.185 8.053 -5.142 1.00 0.00 H new ATOM 0 HE2 MET B 30 147.617 8.482 -4.418 1.00 0.00 H new ATOM 0 HE3 MET B 30 147.989 6.782 -4.794 1.00 0.00 H new ATOM 2208 N SER B 31 142.515 7.138 -5.137 1.00 0.00 N ATOM 2209 CA SER B 31 141.619 6.217 -4.410 1.00 0.00 C ATOM 2210 C SER B 31 142.481 5.309 -3.536 1.00 0.00 C ATOM 2211 O SER B 31 143.657 5.093 -3.816 1.00 0.00 O ATOM 2212 CB SER B 31 140.830 5.386 -5.428 1.00 0.00 C ATOM 2213 OG SER B 31 140.736 6.120 -6.667 1.00 0.00 O ATOM 0 H SER B 31 142.823 6.806 -6.051 1.00 0.00 H new ATOM 0 HA SER B 31 140.916 6.766 -3.784 1.00 0.00 H new ATOM 0 HB2 SER B 31 141.324 4.429 -5.595 1.00 0.00 H new ATOM 0 HB3 SER B 31 139.834 5.168 -5.044 1.00 0.00 H new ATOM 0 HG SER B 31 141.511 5.913 -7.229 1.00 0.00 H new ATOM 2219 N LYS B 32 141.946 4.850 -2.444 1.00 0.00 N ATOM 2220 CA LYS B 32 142.739 4.033 -1.491 1.00 0.00 C ATOM 2221 C LYS B 32 143.410 2.877 -2.214 1.00 0.00 C ATOM 2222 O LYS B 32 144.572 2.599 -1.990 1.00 0.00 O ATOM 2223 CB LYS B 32 141.823 3.487 -0.376 1.00 0.00 C ATOM 2224 CG LYS B 32 142.631 3.340 0.933 1.00 0.00 C ATOM 2225 CD LYS B 32 141.685 3.119 2.128 1.00 0.00 C ATOM 2226 CE LYS B 32 141.302 1.630 2.249 1.00 0.00 C ATOM 2227 NZ LYS B 32 140.944 1.320 3.649 1.00 0.00 N ATOM 0 H LYS B 32 140.977 5.009 -2.167 1.00 0.00 H new ATOM 0 HA LYS B 32 143.508 4.666 -1.048 1.00 0.00 H new ATOM 0 HB2 LYS B 32 140.980 4.161 -0.221 1.00 0.00 H new ATOM 0 HB3 LYS B 32 141.410 2.522 -0.671 1.00 0.00 H new ATOM 0 HG2 LYS B 32 143.322 2.501 0.849 1.00 0.00 H new ATOM 0 HG3 LYS B 32 143.233 4.234 1.098 1.00 0.00 H new ATOM 0 HD2 LYS B 32 142.167 3.452 3.047 1.00 0.00 H new ATOM 0 HD3 LYS B 32 140.786 3.722 2.003 1.00 0.00 H new ATOM 0 HE2 LYS B 32 140.463 1.406 1.591 1.00 0.00 H new ATOM 0 HE3 LYS B 32 142.134 1.003 1.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 141.130 0.315 3.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 141.515 1.906 4.291 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 139.935 1.521 3.802 1.00 0.00 H new ATOM 2241 N GLN B 33 142.706 2.208 -3.084 1.00 0.00 N ATOM 2242 CA GLN B 33 143.322 1.056 -3.796 1.00 0.00 C ATOM 2243 C GLN B 33 144.588 1.513 -4.511 1.00 0.00 C ATOM 2244 O GLN B 33 145.605 0.854 -4.452 1.00 0.00 O ATOM 2245 CB GLN B 33 142.338 0.470 -4.809 1.00 0.00 C ATOM 2246 CG GLN B 33 141.338 -0.453 -4.097 1.00 0.00 C ATOM 2247 CD GLN B 33 140.242 -0.831 -5.080 1.00 0.00 C ATOM 2248 OE1 GLN B 33 140.078 -1.995 -5.415 1.00 0.00 O ATOM 2249 NE2 GLN B 33 139.492 0.093 -5.565 1.00 0.00 N ATOM 0 H GLN B 33 141.737 2.408 -3.331 1.00 0.00 H new ATOM 0 HA GLN B 33 143.575 0.286 -3.068 1.00 0.00 H new ATOM 0 HB2 GLN B 33 141.805 1.274 -5.318 1.00 0.00 H new ATOM 0 HB3 GLN B 33 142.879 -0.087 -5.574 1.00 0.00 H new ATOM 0 HG2 GLN B 33 141.843 -1.347 -3.731 1.00 0.00 H new ATOM 0 HG3 GLN B 33 140.911 0.050 -3.229 1.00 0.00 H new ATOM 0 HE21 GLN B 33 139.631 1.063 -5.283 1.00 0.00 H new ATOM 0 HE22 GLN B 33 138.757 -0.144 -6.232 1.00 0.00 H new ATOM 2258 N GLU B 34 144.541 2.651 -5.145 1.00 0.00 N ATOM 2259 CA GLU B 34 145.747 3.167 -5.853 1.00 0.00 C ATOM 2260 C GLU B 34 146.850 3.359 -4.825 1.00 0.00 C ATOM 2261 O GLU B 34 147.865 2.685 -4.856 1.00 0.00 O ATOM 2262 CB GLU B 34 145.433 4.514 -6.546 1.00 0.00 C ATOM 2263 CG GLU B 34 144.018 4.496 -7.161 1.00 0.00 C ATOM 2264 CD GLU B 34 143.796 5.770 -7.944 1.00 0.00 C ATOM 2265 OE1 GLU B 34 144.423 5.931 -8.952 1.00 0.00 O ATOM 2266 OE2 GLU B 34 142.996 6.566 -7.524 1.00 0.00 O ATOM 0 H GLU B 34 143.717 3.249 -5.204 1.00 0.00 H new ATOM 0 HA GLU B 34 146.059 2.458 -6.620 1.00 0.00 H new ATOM 0 HB2 GLU B 34 145.510 5.327 -5.824 1.00 0.00 H new ATOM 0 HB3 GLU B 34 146.171 4.708 -7.325 1.00 0.00 H new ATOM 0 HG2 GLU B 34 143.904 3.630 -7.813 1.00 0.00 H new ATOM 0 HG3 GLU B 34 143.269 4.404 -6.375 1.00 0.00 H new ATOM 2273 N LEU B 35 146.625 4.244 -3.890 1.00 0.00 N ATOM 2274 CA LEU B 35 147.617 4.514 -2.799 1.00 0.00 C ATOM 2275 C LEU B 35 148.129 3.184 -2.247 1.00 0.00 C ATOM 2276 O LEU B 35 149.286 3.056 -1.850 1.00 0.00 O ATOM 2277 CB LEU B 35 146.903 5.278 -1.672 1.00 0.00 C ATOM 2278 CG LEU B 35 146.439 6.662 -2.172 1.00 0.00 C ATOM 2279 CD1 LEU B 35 145.136 7.057 -1.482 1.00 0.00 C ATOM 2280 CD2 LEU B 35 147.498 7.708 -1.850 1.00 0.00 C ATOM 0 H LEU B 35 145.776 4.806 -3.833 1.00 0.00 H new ATOM 0 HA LEU B 35 148.452 5.098 -3.186 1.00 0.00 H new ATOM 0 HB2 LEU B 35 146.045 4.704 -1.322 1.00 0.00 H new ATOM 0 HB3 LEU B 35 147.575 5.398 -0.822 1.00 0.00 H new ATOM 0 HG LEU B 35 146.284 6.609 -3.250 1.00 0.00 H new ATOM 0 HD11 LEU B 35 144.816 8.035 -1.841 1.00 0.00 H new ATOM 0 HD12 LEU B 35 144.367 6.318 -1.707 1.00 0.00 H new ATOM 0 HD13 LEU B 35 145.293 7.100 -0.404 1.00 0.00 H new ATOM 0 HD21 LEU B 35 147.166 8.683 -2.205 1.00 0.00 H new ATOM 0 HD22 LEU B 35 147.654 7.748 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU B 35 148.433 7.442 -2.342 1.00 0.00 H new ATOM 2292 N ILE B 36 147.273 2.220 -2.169 1.00 0.00 N ATOM 2293 CA ILE B 36 147.669 0.904 -1.631 1.00 0.00 C ATOM 2294 C ILE B 36 148.585 0.205 -2.653 1.00 0.00 C ATOM 2295 O ILE B 36 149.647 -0.288 -2.305 1.00 0.00 O ATOM 2296 CB ILE B 36 146.389 0.089 -1.345 1.00 0.00 C ATOM 2297 CG1 ILE B 36 145.671 0.699 -0.123 1.00 0.00 C ATOM 2298 CG2 ILE B 36 146.713 -1.384 -1.071 1.00 0.00 C ATOM 2299 CD1 ILE B 36 144.244 0.174 -0.032 1.00 0.00 C ATOM 0 H ILE B 36 146.298 2.289 -2.460 1.00 0.00 H new ATOM 0 HA ILE B 36 148.225 1.003 -0.699 1.00 0.00 H new ATOM 0 HB ILE B 36 145.746 0.131 -2.224 1.00 0.00 H new ATOM 0 HG12 ILE B 36 146.216 0.452 0.788 1.00 0.00 H new ATOM 0 HG13 ILE B 36 145.661 1.786 -0.203 1.00 0.00 H new ATOM 0 HG21 ILE B 36 145.790 -1.929 -0.874 1.00 0.00 H new ATOM 0 HG22 ILE B 36 147.210 -1.815 -1.940 1.00 0.00 H new ATOM 0 HG23 ILE B 36 147.370 -1.457 -0.204 1.00 0.00 H new ATOM 0 HD11 ILE B 36 143.749 0.613 0.835 1.00 0.00 H new ATOM 0 HD12 ILE B 36 143.699 0.444 -0.936 1.00 0.00 H new ATOM 0 HD13 ILE B 36 144.261 -0.911 0.071 1.00 0.00 H new ATOM 2311 N LYS B 37 148.187 0.145 -3.895 1.00 0.00 N ATOM 2312 CA LYS B 37 149.024 -0.518 -4.917 1.00 0.00 C ATOM 2313 C LYS B 37 150.392 0.156 -4.965 1.00 0.00 C ATOM 2314 O LYS B 37 151.447 -0.515 -4.936 1.00 0.00 O ATOM 2315 CB LYS B 37 148.349 -0.385 -6.272 1.00 0.00 C ATOM 2316 CG LYS B 37 146.890 -0.888 -6.201 1.00 0.00 C ATOM 2317 CD LYS B 37 146.670 -2.072 -7.161 1.00 0.00 C ATOM 2318 CE LYS B 37 145.393 -1.829 -7.971 1.00 0.00 C ATOM 2319 NZ LYS B 37 145.624 -0.751 -8.946 1.00 0.00 N ATOM 0 H LYS B 37 147.309 0.532 -4.241 1.00 0.00 H new ATOM 0 HA LYS B 37 149.147 -1.572 -4.667 1.00 0.00 H new ATOM 0 HB2 LYS B 37 148.366 0.657 -6.593 1.00 0.00 H new ATOM 0 HB3 LYS B 37 148.901 -0.957 -7.018 1.00 0.00 H new ATOM 0 HG2 LYS B 37 146.655 -1.193 -5.181 1.00 0.00 H new ATOM 0 HG3 LYS B 37 146.208 -0.076 -6.456 1.00 0.00 H new ATOM 0 HD2 LYS B 37 147.525 -2.178 -7.829 1.00 0.00 H new ATOM 0 HD3 LYS B 37 146.587 -3.002 -6.599 1.00 0.00 H new ATOM 0 HE2 LYS B 37 145.098 -2.743 -8.487 1.00 0.00 H new ATOM 0 HE3 LYS B 37 144.573 -1.561 -7.305 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 144.955 -0.849 -9.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 145.483 0.170 -8.485 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 146.598 -0.812 -9.307 1.00 0.00 H new ATOM 2333 N GLU B 38 150.412 1.470 -5.024 1.00 0.00 N ATOM 2334 CA GLU B 38 151.708 2.146 -5.068 1.00 0.00 C ATOM 2335 C GLU B 38 152.475 1.859 -3.779 1.00 0.00 C ATOM 2336 O GLU B 38 153.669 1.669 -3.815 1.00 0.00 O ATOM 2337 CB GLU B 38 151.575 3.651 -5.381 1.00 0.00 C ATOM 2338 CG GLU B 38 150.408 4.306 -4.653 1.00 0.00 C ATOM 2339 CD GLU B 38 150.568 5.806 -4.727 1.00 0.00 C ATOM 2340 OE1 GLU B 38 150.710 6.315 -5.821 1.00 0.00 O ATOM 2341 OE2 GLU B 38 150.568 6.430 -3.710 1.00 0.00 O ATOM 0 H GLU B 38 149.592 2.076 -5.042 1.00 0.00 H new ATOM 0 HA GLU B 38 152.289 1.744 -5.898 1.00 0.00 H new ATOM 0 HB2 GLU B 38 152.500 4.158 -5.105 1.00 0.00 H new ATOM 0 HB3 GLU B 38 151.447 3.784 -6.455 1.00 0.00 H new ATOM 0 HG2 GLU B 38 149.464 4.004 -5.106 1.00 0.00 H new ATOM 0 HG3 GLU B 38 150.381 3.980 -3.613 1.00 0.00 H new ATOM 2348 N TYR B 39 151.793 1.673 -2.660 1.00 0.00 N ATOM 2349 CA TYR B 39 152.520 1.231 -1.436 1.00 0.00 C ATOM 2350 C TYR B 39 153.240 -0.054 -1.658 1.00 0.00 C ATOM 2351 O TYR B 39 154.333 -0.219 -1.193 1.00 0.00 O ATOM 2352 CB TYR B 39 151.617 1.101 -0.199 1.00 0.00 C ATOM 2353 CG TYR B 39 151.631 2.367 0.612 1.00 0.00 C ATOM 2354 CD1 TYR B 39 152.864 2.898 1.008 1.00 0.00 C ATOM 2355 CD2 TYR B 39 150.448 2.982 1.014 1.00 0.00 C ATOM 2356 CE1 TYR B 39 152.919 4.027 1.793 1.00 0.00 C ATOM 2357 CE2 TYR B 39 150.508 4.134 1.807 1.00 0.00 C ATOM 2358 CZ TYR B 39 151.750 4.650 2.196 1.00 0.00 C ATOM 2359 OH TYR B 39 151.827 5.764 2.983 1.00 0.00 O ATOM 0 H TYR B 39 150.788 1.807 -2.553 1.00 0.00 H new ATOM 0 HA TYR B 39 153.241 2.023 -1.235 1.00 0.00 H new ATOM 0 HB2 TYR B 39 150.597 0.875 -0.511 1.00 0.00 H new ATOM 0 HB3 TYR B 39 151.954 0.267 0.416 1.00 0.00 H new ATOM 0 HD1 TYR B 39 153.779 2.418 0.695 1.00 0.00 H new ATOM 0 HD2 TYR B 39 149.493 2.574 0.717 1.00 0.00 H new ATOM 0 HE1 TYR B 39 153.875 4.428 2.095 1.00 0.00 H new ATOM 0 HE2 TYR B 39 149.597 4.624 2.118 1.00 0.00 H new ATOM 0 HH TYR B 39 151.129 6.399 2.720 1.00 0.00 H new ATOM 2369 N LEU B 40 152.660 -0.978 -2.332 1.00 0.00 N ATOM 2370 CA LEU B 40 153.374 -2.263 -2.520 1.00 0.00 C ATOM 2371 C LEU B 40 154.684 -1.980 -3.228 1.00 0.00 C ATOM 2372 O LEU B 40 155.746 -2.349 -2.755 1.00 0.00 O ATOM 2373 CB LEU B 40 152.510 -3.238 -3.331 1.00 0.00 C ATOM 2374 CG LEU B 40 151.051 -3.172 -2.834 1.00 0.00 C ATOM 2375 CD1 LEU B 40 150.234 -4.285 -3.460 1.00 0.00 C ATOM 2376 CD2 LEU B 40 151.001 -3.306 -1.306 1.00 0.00 C ATOM 0 H LEU B 40 151.736 -0.912 -2.760 1.00 0.00 H new ATOM 0 HA LEU B 40 153.575 -2.728 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU B 40 152.556 -2.986 -4.390 1.00 0.00 H new ATOM 0 HB3 LEU B 40 152.894 -4.253 -3.228 1.00 0.00 H new ATOM 0 HG LEU B 40 150.634 -2.208 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU B 40 149.206 -4.228 -3.101 1.00 0.00 H new ATOM 0 HD12 LEU B 40 150.246 -4.179 -4.545 1.00 0.00 H new ATOM 0 HD13 LEU B 40 150.661 -5.249 -3.184 1.00 0.00 H new ATOM 0 HD21 LEU B 40 149.965 -3.258 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU B 40 151.434 -4.262 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU B 40 151.568 -2.494 -0.851 1.00 0.00 H new ATOM 2388 N GLU B 41 154.633 -1.267 -4.311 1.00 0.00 N ATOM 2389 CA GLU B 41 155.903 -0.924 -5.022 1.00 0.00 C ATOM 2390 C GLU B 41 156.776 -0.044 -4.109 1.00 0.00 C ATOM 2391 O GLU B 41 157.906 -0.378 -3.791 1.00 0.00 O ATOM 2392 CB GLU B 41 155.579 -0.168 -6.321 1.00 0.00 C ATOM 2393 CG GLU B 41 154.517 -0.942 -7.131 1.00 0.00 C ATOM 2394 CD GLU B 41 154.802 -0.777 -8.601 1.00 0.00 C ATOM 2395 OE1 GLU B 41 155.818 -1.236 -9.041 1.00 0.00 O ATOM 2396 OE2 GLU B 41 154.012 -0.173 -9.269 1.00 0.00 O ATOM 0 H GLU B 41 153.779 -0.906 -4.737 1.00 0.00 H new ATOM 0 HA GLU B 41 156.443 -1.838 -5.267 1.00 0.00 H new ATOM 0 HB2 GLU B 41 155.213 0.832 -6.088 1.00 0.00 H new ATOM 0 HB3 GLU B 41 156.484 -0.046 -6.916 1.00 0.00 H new ATOM 0 HG2 GLU B 41 154.534 -1.998 -6.861 1.00 0.00 H new ATOM 0 HG3 GLU B 41 153.520 -0.569 -6.897 1.00 0.00 H new ATOM 2403 N LEU B 42 156.261 1.080 -3.723 1.00 0.00 N ATOM 2404 CA LEU B 42 157.007 2.052 -2.867 1.00 0.00 C ATOM 2405 C LEU B 42 157.647 1.314 -1.689 1.00 0.00 C ATOM 2406 O LEU B 42 158.845 1.421 -1.443 1.00 0.00 O ATOM 2407 CB LEU B 42 156.006 3.105 -2.337 1.00 0.00 C ATOM 2408 CG LEU B 42 156.683 4.469 -2.121 1.00 0.00 C ATOM 2409 CD1 LEU B 42 157.854 4.351 -1.164 1.00 0.00 C ATOM 2410 CD2 LEU B 42 157.175 5.029 -3.447 1.00 0.00 C ATOM 0 H LEU B 42 155.319 1.383 -3.971 1.00 0.00 H new ATOM 0 HA LEU B 42 157.791 2.538 -3.448 1.00 0.00 H new ATOM 0 HB2 LEU B 42 155.183 3.214 -3.044 1.00 0.00 H new ATOM 0 HB3 LEU B 42 155.576 2.759 -1.397 1.00 0.00 H new ATOM 0 HG LEU B 42 155.943 5.143 -1.690 1.00 0.00 H new ATOM 0 HD11 LEU B 42 158.314 5.330 -1.030 1.00 0.00 H new ATOM 0 HD12 LEU B 42 157.501 3.980 -0.201 1.00 0.00 H new ATOM 0 HD13 LEU B 42 158.589 3.658 -1.572 1.00 0.00 H new ATOM 0 HD21 LEU B 42 157.652 5.995 -3.280 1.00 0.00 H new ATOM 0 HD22 LEU B 42 157.895 4.340 -3.888 1.00 0.00 H new ATOM 0 HD23 LEU B 42 156.331 5.154 -4.125 1.00 0.00 H new ATOM 2422 N GLU B 43 156.861 0.590 -0.955 1.00 0.00 N ATOM 2423 CA GLU B 43 157.388 -0.157 0.221 1.00 0.00 C ATOM 2424 C GLU B 43 158.500 -1.078 -0.242 1.00 0.00 C ATOM 2425 O GLU B 43 159.578 -1.081 0.318 1.00 0.00 O ATOM 2426 CB GLU B 43 156.276 -1.005 0.853 1.00 0.00 C ATOM 2427 CG GLU B 43 155.419 -0.163 1.815 1.00 0.00 C ATOM 2428 CD GLU B 43 155.077 -1.014 3.029 1.00 0.00 C ATOM 2429 OE1 GLU B 43 154.460 -2.053 2.863 1.00 0.00 O ATOM 2430 OE2 GLU B 43 155.461 -0.641 4.099 1.00 0.00 O ATOM 0 H GLU B 43 155.860 0.480 -1.119 1.00 0.00 H new ATOM 0 HA GLU B 43 157.761 0.554 0.958 1.00 0.00 H new ATOM 0 HB2 GLU B 43 155.644 -1.425 0.070 1.00 0.00 H new ATOM 0 HB3 GLU B 43 156.716 -1.844 1.392 1.00 0.00 H new ATOM 0 HG2 GLU B 43 155.961 0.732 2.121 1.00 0.00 H new ATOM 0 HG3 GLU B 43 154.508 0.170 1.318 1.00 0.00 H new ATOM 2437 N LYS B 44 158.253 -1.879 -1.236 1.00 0.00 N ATOM 2438 CA LYS B 44 159.301 -2.801 -1.704 1.00 0.00 C ATOM 2439 C LYS B 44 160.547 -1.982 -2.039 1.00 0.00 C ATOM 2440 O LYS B 44 161.647 -2.307 -1.615 1.00 0.00 O ATOM 2441 CB LYS B 44 158.795 -3.549 -2.938 1.00 0.00 C ATOM 2442 CG LYS B 44 157.605 -4.462 -2.547 1.00 0.00 C ATOM 2443 CD LYS B 44 158.105 -5.869 -2.163 1.00 0.00 C ATOM 2444 CE LYS B 44 157.092 -6.551 -1.222 1.00 0.00 C ATOM 2445 NZ LYS B 44 156.922 -5.742 0.010 1.00 0.00 N ATOM 0 H LYS B 44 157.368 -1.930 -1.741 1.00 0.00 H new ATOM 0 HA LYS B 44 159.548 -3.532 -0.934 1.00 0.00 H new ATOM 0 HB2 LYS B 44 158.484 -2.838 -3.703 1.00 0.00 H new ATOM 0 HB3 LYS B 44 159.599 -4.147 -3.367 1.00 0.00 H new ATOM 0 HG2 LYS B 44 157.062 -4.022 -1.711 1.00 0.00 H new ATOM 0 HG3 LYS B 44 156.905 -4.533 -3.380 1.00 0.00 H new ATOM 0 HD2 LYS B 44 158.243 -6.472 -3.060 1.00 0.00 H new ATOM 0 HD3 LYS B 44 159.077 -5.798 -1.674 1.00 0.00 H new ATOM 0 HE2 LYS B 44 156.133 -6.665 -1.727 1.00 0.00 H new ATOM 0 HE3 LYS B 44 157.438 -7.552 -0.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 156.723 -6.371 0.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 157.794 -5.207 0.197 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 156.130 -5.080 -0.116 1.00 0.00 H new ATOM 2459 N CYS B 45 160.375 -0.888 -2.734 1.00 0.00 N ATOM 2460 CA CYS B 45 161.519 -0.013 -3.060 1.00 0.00 C ATOM 2461 C CYS B 45 162.209 0.420 -1.770 1.00 0.00 C ATOM 2462 O CYS B 45 163.369 0.126 -1.549 1.00 0.00 O ATOM 2463 CB CYS B 45 161.015 1.218 -3.818 1.00 0.00 C ATOM 2464 SG CYS B 45 160.183 0.697 -5.338 1.00 0.00 S ATOM 0 H CYS B 45 159.475 -0.567 -3.090 1.00 0.00 H new ATOM 0 HA CYS B 45 162.231 -0.554 -3.684 1.00 0.00 H new ATOM 0 HB2 CYS B 45 160.328 1.787 -3.192 1.00 0.00 H new ATOM 0 HB3 CYS B 45 161.849 1.878 -4.056 1.00 0.00 H new ATOM 0 HG CYS B 45 159.082 0.075 -5.038 1.00 0.00 H new ATOM 2470 N LEU B 46 161.515 1.116 -0.913 1.00 0.00 N ATOM 2471 CA LEU B 46 162.164 1.578 0.354 1.00 0.00 C ATOM 2472 C LEU B 46 162.755 0.381 1.094 1.00 0.00 C ATOM 2473 O LEU B 46 163.795 0.474 1.665 1.00 0.00 O ATOM 2474 CB LEU B 46 161.154 2.322 1.260 1.00 0.00 C ATOM 2475 CG LEU B 46 161.883 2.916 2.506 1.00 0.00 C ATOM 2476 CD1 LEU B 46 163.196 3.575 2.105 1.00 0.00 C ATOM 2477 CD2 LEU B 46 161.016 3.974 3.173 1.00 0.00 C ATOM 0 H LEU B 46 160.538 1.384 -1.029 1.00 0.00 H new ATOM 0 HA LEU B 46 162.961 2.276 0.099 1.00 0.00 H new ATOM 0 HB2 LEU B 46 160.670 3.121 0.698 1.00 0.00 H new ATOM 0 HB3 LEU B 46 160.369 1.637 1.581 1.00 0.00 H new ATOM 0 HG LEU B 46 162.075 2.092 3.193 1.00 0.00 H new ATOM 0 HD11 LEU B 46 163.685 3.981 2.991 1.00 0.00 H new ATOM 0 HD12 LEU B 46 163.847 2.835 1.638 1.00 0.00 H new ATOM 0 HD13 LEU B 46 162.998 4.381 1.398 1.00 0.00 H new ATOM 0 HD21 LEU B 46 161.538 4.379 4.040 1.00 0.00 H new ATOM 0 HD22 LEU B 46 160.812 4.777 2.465 1.00 0.00 H new ATOM 0 HD23 LEU B 46 160.076 3.525 3.493 1.00 0.00 H new ATOM 2489 N SER B 47 162.116 -0.740 1.048 1.00 0.00 N ATOM 2490 CA SER B 47 162.657 -1.942 1.731 1.00 0.00 C ATOM 2491 C SER B 47 163.989 -2.315 1.093 1.00 0.00 C ATOM 2492 O SER B 47 165.004 -2.453 1.764 1.00 0.00 O ATOM 2493 CB SER B 47 161.662 -3.092 1.603 1.00 0.00 C ATOM 2494 OG SER B 47 160.354 -2.615 1.961 1.00 0.00 O ATOM 0 H SER B 47 161.231 -0.882 0.562 1.00 0.00 H new ATOM 0 HA SER B 47 162.813 -1.734 2.790 1.00 0.00 H new ATOM 0 HB2 SER B 47 161.658 -3.475 0.583 1.00 0.00 H new ATOM 0 HB3 SER B 47 161.954 -3.917 2.252 1.00 0.00 H new ATOM 0 HG SER B 47 159.941 -2.180 1.186 1.00 0.00 H new ATOM 2500 N ARG B 48 164.018 -2.416 -0.199 1.00 0.00 N ATOM 2501 CA ARG B 48 165.299 -2.712 -0.890 1.00 0.00 C ATOM 2502 C ARG B 48 166.291 -1.623 -0.510 1.00 0.00 C ATOM 2503 O ARG B 48 167.443 -1.884 -0.176 1.00 0.00 O ATOM 2504 CB ARG B 48 165.062 -2.696 -2.402 1.00 0.00 C ATOM 2505 CG ARG B 48 164.182 -3.897 -2.795 1.00 0.00 C ATOM 2506 CD ARG B 48 164.012 -3.972 -4.324 1.00 0.00 C ATOM 2507 NE ARG B 48 164.094 -2.603 -4.939 1.00 0.00 N ATOM 2508 CZ ARG B 48 163.896 -2.443 -6.229 1.00 0.00 C ATOM 2509 NH1 ARG B 48 163.596 -3.472 -6.983 1.00 0.00 N ATOM 2510 NH2 ARG B 48 163.995 -1.264 -6.752 1.00 0.00 N ATOM 0 H ARG B 48 163.209 -2.306 -0.811 1.00 0.00 H new ATOM 0 HA ARG B 48 165.685 -3.690 -0.602 1.00 0.00 H new ATOM 0 HB2 ARG B 48 164.577 -1.765 -2.695 1.00 0.00 H new ATOM 0 HB3 ARG B 48 166.014 -2.740 -2.931 1.00 0.00 H new ATOM 0 HG2 ARG B 48 164.633 -4.819 -2.429 1.00 0.00 H new ATOM 0 HG3 ARG B 48 163.205 -3.809 -2.320 1.00 0.00 H new ATOM 0 HD2 ARG B 48 164.784 -4.613 -4.749 1.00 0.00 H new ATOM 0 HD3 ARG B 48 163.051 -4.427 -4.566 1.00 0.00 H new ATOM 0 HE ARG B 48 164.304 -1.795 -4.353 1.00 0.00 H new ATOM 0 HH11 ARG B 48 163.515 -4.401 -6.570 1.00 0.00 H new ATOM 0 HH12 ARG B 48 163.443 -3.344 -7.983 1.00 0.00 H new ATOM 0 HH21 ARG B 48 164.226 -0.463 -6.164 1.00 0.00 H new ATOM 0 HH22 ARG B 48 163.842 -1.135 -7.752 1.00 0.00 H new ATOM 2524 N MET B 49 165.852 -0.405 -0.542 1.00 0.00 N ATOM 2525 CA MET B 49 166.733 0.705 -0.184 1.00 0.00 C ATOM 2526 C MET B 49 167.112 0.604 1.287 1.00 0.00 C ATOM 2527 O MET B 49 168.145 1.018 1.661 1.00 0.00 O ATOM 2528 CB MET B 49 166.014 2.031 -0.437 1.00 0.00 C ATOM 2529 CG MET B 49 165.530 2.079 -1.891 1.00 0.00 C ATOM 2530 SD MET B 49 166.788 2.863 -2.911 1.00 0.00 S ATOM 2531 CE MET B 49 166.237 4.563 -2.666 1.00 0.00 C ATOM 0 H MET B 49 164.904 -0.137 -0.806 1.00 0.00 H new ATOM 0 HA MET B 49 167.636 0.660 -0.793 1.00 0.00 H new ATOM 0 HB2 MET B 49 165.168 2.134 0.243 1.00 0.00 H new ATOM 0 HB3 MET B 49 166.686 2.866 -0.238 1.00 0.00 H new ATOM 0 HG2 MET B 49 165.329 1.071 -2.253 1.00 0.00 H new ATOM 0 HG3 MET B 49 164.594 2.634 -1.957 1.00 0.00 H new ATOM 0 HE1 MET B 49 167.034 5.249 -2.954 1.00 0.00 H new ATOM 0 HE2 MET B 49 165.356 4.752 -3.279 1.00 0.00 H new ATOM 0 HE3 MET B 49 165.988 4.717 -1.616 1.00 0.00 H new ATOM 2541 N GLU B 50 166.322 0.012 2.099 1.00 0.00 N ATOM 2542 CA GLU B 50 166.700 -0.100 3.520 1.00 0.00 C ATOM 2543 C GLU B 50 167.870 -1.051 3.635 1.00 0.00 C ATOM 2544 O GLU B 50 168.882 -0.747 4.264 1.00 0.00 O ATOM 2545 CB GLU B 50 165.519 -0.584 4.323 1.00 0.00 C ATOM 2546 CG GLU B 50 164.633 0.603 4.733 1.00 0.00 C ATOM 2547 CD GLU B 50 163.431 0.091 5.480 1.00 0.00 C ATOM 2548 OE1 GLU B 50 163.566 -0.181 6.643 1.00 0.00 O ATOM 2549 OE2 GLU B 50 162.392 -0.039 4.889 1.00 0.00 O ATOM 0 H GLU B 50 165.425 -0.404 1.848 1.00 0.00 H new ATOM 0 HA GLU B 50 166.996 0.872 3.915 1.00 0.00 H new ATOM 0 HB2 GLU B 50 164.938 -1.295 3.736 1.00 0.00 H new ATOM 0 HB3 GLU B 50 165.866 -1.112 5.211 1.00 0.00 H new ATOM 0 HG2 GLU B 50 165.198 1.294 5.359 1.00 0.00 H new ATOM 0 HG3 GLU B 50 164.317 1.158 3.850 1.00 0.00 H new ATOM 2556 N ASP B 51 167.789 -2.157 2.962 1.00 0.00 N ATOM 2557 CA ASP B 51 168.920 -3.116 2.955 1.00 0.00 C ATOM 2558 C ASP B 51 170.160 -2.392 2.464 1.00 0.00 C ATOM 2559 O ASP B 51 171.183 -2.328 3.137 1.00 0.00 O ATOM 2560 CB ASP B 51 168.600 -4.264 1.989 1.00 0.00 C ATOM 2561 CG ASP B 51 167.907 -5.367 2.723 1.00 0.00 C ATOM 2562 OD1 ASP B 51 168.555 -6.042 3.491 1.00 0.00 O ATOM 2563 OD2 ASP B 51 166.741 -5.539 2.515 1.00 0.00 O ATOM 0 H ASP B 51 166.979 -2.441 2.410 1.00 0.00 H new ATOM 0 HA ASP B 51 169.083 -3.513 3.957 1.00 0.00 H new ATOM 0 HB2 ASP B 51 167.969 -3.903 1.177 1.00 0.00 H new ATOM 0 HB3 ASP B 51 169.519 -4.637 1.537 1.00 0.00 H new ATOM 2568 N GLU B 52 170.083 -1.874 1.279 1.00 0.00 N ATOM 2569 CA GLU B 52 171.242 -1.176 0.681 1.00 0.00 C ATOM 2570 C GLU B 52 171.666 -0.020 1.557 1.00 0.00 C ATOM 2571 O GLU B 52 172.813 0.172 1.780 1.00 0.00 O ATOM 2572 CB GLU B 52 170.859 -0.603 -0.685 1.00 0.00 C ATOM 2573 CG GLU B 52 170.701 -1.714 -1.718 1.00 0.00 C ATOM 2574 CD GLU B 52 172.032 -1.986 -2.358 1.00 0.00 C ATOM 2575 OE1 GLU B 52 172.535 -1.108 -3.011 1.00 0.00 O ATOM 2576 OE2 GLU B 52 172.540 -3.057 -2.189 1.00 0.00 O ATOM 0 H GLU B 52 169.251 -1.905 0.689 1.00 0.00 H new ATOM 0 HA GLU B 52 172.054 -1.896 0.583 1.00 0.00 H new ATOM 0 HB2 GLU B 52 169.927 -0.044 -0.601 1.00 0.00 H new ATOM 0 HB3 GLU B 52 171.623 0.100 -1.016 1.00 0.00 H new ATOM 0 HG2 GLU B 52 170.321 -2.618 -1.242 1.00 0.00 H new ATOM 0 HG3 GLU B 52 169.973 -1.422 -2.475 1.00 0.00 H new ATOM 2583 N ASN B 53 170.752 0.810 1.943 1.00 0.00 N ATOM 2584 CA ASN B 53 171.110 2.048 2.676 1.00 0.00 C ATOM 2585 C ASN B 53 171.888 1.694 3.892 1.00 0.00 C ATOM 2586 O ASN B 53 172.933 2.247 4.150 1.00 0.00 O ATOM 2587 CB ASN B 53 169.826 2.814 3.038 1.00 0.00 C ATOM 2588 CG ASN B 53 169.417 3.606 1.803 1.00 0.00 C ATOM 2589 OD1 ASN B 53 168.992 2.965 0.777 1.00 0.00 O flip ATOM 2590 ND2 ASN B 53 169.493 4.819 1.769 1.00 0.00 N flip ATOM 0 H ASN B 53 169.753 0.683 1.780 1.00 0.00 H new ATOM 0 HA ASN B 53 171.728 2.692 2.050 1.00 0.00 H new ATOM 0 HB2 ASN B 53 169.035 2.124 3.333 1.00 0.00 H new ATOM 0 HB3 ASN B 53 170.000 3.480 3.883 1.00 0.00 H new ATOM 0 HD21 ASN B 53 169.831 5.332 2.583 1.00 0.00 H new ATOM 0 HD22 ASN B 53 169.219 5.324 0.926 1.00 0.00 H new ATOM 2597 N ASN B 54 171.424 0.713 4.603 1.00 0.00 N ATOM 2598 CA ASN B 54 172.146 0.237 5.803 1.00 0.00 C ATOM 2599 C ASN B 54 173.575 -0.082 5.426 1.00 0.00 C ATOM 2600 O ASN B 54 174.507 0.485 5.953 1.00 0.00 O ATOM 2601 CB ASN B 54 171.491 -1.042 6.306 1.00 0.00 C ATOM 2602 CG ASN B 54 170.305 -0.726 7.193 1.00 0.00 C ATOM 2603 OD1 ASN B 54 170.006 0.435 7.476 1.00 0.00 O ATOM 2604 ND2 ASN B 54 169.601 -1.697 7.638 1.00 0.00 N ATOM 0 H ASN B 54 170.559 0.213 4.398 1.00 0.00 H new ATOM 0 HA ASN B 54 172.118 1.007 6.574 1.00 0.00 H new ATOM 0 HB2 ASN B 54 171.167 -1.647 5.459 1.00 0.00 H new ATOM 0 HB3 ASN B 54 172.218 -1.634 6.861 1.00 0.00 H new ATOM 0 HD21 ASN B 54 168.790 -1.511 8.228 1.00 0.00 H new ATOM 0 HD22 ASN B 54 169.850 -2.658 7.402 1.00 0.00 H new ATOM 2611 N ARG B 55 173.755 -1.007 4.527 1.00 0.00 N ATOM 2612 CA ARG B 55 175.122 -1.402 4.131 1.00 0.00 C ATOM 2613 C ARG B 55 175.832 -0.213 3.511 1.00 0.00 C ATOM 2614 O ARG B 55 176.807 0.257 4.024 1.00 0.00 O ATOM 2615 CB ARG B 55 175.051 -2.573 3.131 1.00 0.00 C ATOM 2616 CG ARG B 55 175.182 -3.898 3.907 1.00 0.00 C ATOM 2617 CD ARG B 55 173.832 -4.283 4.524 1.00 0.00 C ATOM 2618 NE ARG B 55 172.943 -4.850 3.460 1.00 0.00 N ATOM 2619 CZ ARG B 55 171.701 -5.204 3.740 1.00 0.00 C ATOM 2620 NH1 ARG B 55 171.225 -5.018 4.936 1.00 0.00 N ATOM 2621 NH2 ARG B 55 170.957 -5.731 2.824 1.00 0.00 N ATOM 0 H ARG B 55 173.005 -1.507 4.049 1.00 0.00 H new ATOM 0 HA ARG B 55 175.682 -1.726 5.008 1.00 0.00 H new ATOM 0 HB2 ARG B 55 174.108 -2.547 2.586 1.00 0.00 H new ATOM 0 HB3 ARG B 55 175.848 -2.488 2.393 1.00 0.00 H new ATOM 0 HG2 ARG B 55 175.523 -4.688 3.238 1.00 0.00 H new ATOM 0 HG3 ARG B 55 175.933 -3.797 4.690 1.00 0.00 H new ATOM 0 HD2 ARG B 55 173.978 -5.014 5.319 1.00 0.00 H new ATOM 0 HD3 ARG B 55 173.364 -3.409 4.977 1.00 0.00 H new ATOM 0 HE ARG B 55 173.299 -4.964 2.511 1.00 0.00 H new ATOM 0 HH11 ARG B 55 171.810 -4.599 5.658 1.00 0.00 H new ATOM 0 HH12 ARG B 55 170.266 -5.291 5.152 1.00 0.00 H new ATOM 0 HH21 ARG B 55 171.328 -5.874 1.885 1.00 0.00 H new ATOM 0 HH22 ARG B 55 169.998 -6.004 3.040 1.00 0.00 H new ATOM 2635 N LEU B 56 175.325 0.264 2.423 1.00 0.00 N ATOM 2636 CA LEU B 56 175.920 1.405 1.691 1.00 0.00 C ATOM 2637 C LEU B 56 176.531 2.408 2.632 1.00 0.00 C ATOM 2638 O LEU B 56 177.694 2.738 2.511 1.00 0.00 O ATOM 2639 CB LEU B 56 174.786 2.123 0.924 1.00 0.00 C ATOM 2640 CG LEU B 56 174.521 1.404 -0.416 1.00 0.00 C ATOM 2641 CD1 LEU B 56 173.334 2.053 -1.128 1.00 0.00 C ATOM 2642 CD2 LEU B 56 175.766 1.499 -1.314 1.00 0.00 C ATOM 0 H LEU B 56 174.480 -0.108 1.989 1.00 0.00 H new ATOM 0 HA LEU B 56 176.696 1.022 1.028 1.00 0.00 H new ATOM 0 HB2 LEU B 56 173.878 2.134 1.527 1.00 0.00 H new ATOM 0 HB3 LEU B 56 175.060 3.162 0.741 1.00 0.00 H new ATOM 0 HG LEU B 56 174.296 0.356 -0.216 1.00 0.00 H new ATOM 0 HD11 LEU B 56 173.152 1.541 -2.073 1.00 0.00 H new ATOM 0 HD12 LEU B 56 172.447 1.979 -0.499 1.00 0.00 H new ATOM 0 HD13 LEU B 56 173.555 3.103 -1.321 1.00 0.00 H new ATOM 0 HD21 LEU B 56 175.573 0.990 -2.258 1.00 0.00 H new ATOM 0 HD22 LEU B 56 175.996 2.547 -1.507 1.00 0.00 H new ATOM 0 HD23 LEU B 56 176.612 1.028 -0.814 1.00 0.00 H new ATOM 2654 N ARG B 57 175.754 2.934 3.536 1.00 0.00 N ATOM 2655 CA ARG B 57 176.266 3.960 4.474 1.00 0.00 C ATOM 2656 C ARG B 57 177.381 3.363 5.327 1.00 0.00 C ATOM 2657 O ARG B 57 178.407 3.983 5.554 1.00 0.00 O ATOM 2658 CB ARG B 57 175.127 4.455 5.389 1.00 0.00 C ATOM 2659 CG ARG B 57 173.912 4.895 4.541 1.00 0.00 C ATOM 2660 CD ARG B 57 173.750 6.420 4.591 1.00 0.00 C ATOM 2661 NE ARG B 57 173.480 6.851 5.999 1.00 0.00 N ATOM 2662 CZ ARG B 57 173.067 8.082 6.253 1.00 0.00 C ATOM 2663 NH1 ARG B 57 172.931 8.946 5.274 1.00 0.00 N ATOM 2664 NH2 ARG B 57 172.800 8.435 7.481 1.00 0.00 N ATOM 0 H ARG B 57 174.772 2.690 3.663 1.00 0.00 H new ATOM 0 HA ARG B 57 176.655 4.802 3.901 1.00 0.00 H new ATOM 0 HB2 ARG B 57 174.832 3.662 6.076 1.00 0.00 H new ATOM 0 HB3 ARG B 57 175.476 5.289 5.997 1.00 0.00 H new ATOM 0 HG2 ARG B 57 174.044 4.570 3.509 1.00 0.00 H new ATOM 0 HG3 ARG B 57 173.007 4.414 4.913 1.00 0.00 H new ATOM 0 HD2 ARG B 57 174.653 6.904 4.219 1.00 0.00 H new ATOM 0 HD3 ARG B 57 172.931 6.730 3.942 1.00 0.00 H new ATOM 0 HE ARG B 57 173.615 6.192 6.766 1.00 0.00 H new ATOM 0 HH11 ARG B 57 173.144 8.669 4.316 1.00 0.00 H new ATOM 0 HH12 ARG B 57 172.612 9.895 5.472 1.00 0.00 H new ATOM 0 HH21 ARG B 57 172.910 7.763 8.240 1.00 0.00 H new ATOM 0 HH22 ARG B 57 172.481 9.383 7.681 1.00 0.00 H new ATOM 2678 N LEU B 58 177.192 2.179 5.817 1.00 0.00 N ATOM 2679 CA LEU B 58 178.213 1.558 6.685 1.00 0.00 C ATOM 2680 C LEU B 58 179.472 1.305 5.862 1.00 0.00 C ATOM 2681 O LEU B 58 180.588 1.391 6.361 1.00 0.00 O ATOM 2682 CB LEU B 58 177.677 0.279 7.264 1.00 0.00 C ATOM 2683 CG LEU B 58 176.472 0.569 8.180 1.00 0.00 C ATOM 2684 CD1 LEU B 58 175.649 -0.710 8.413 1.00 0.00 C ATOM 2685 CD2 LEU B 58 176.959 1.121 9.515 1.00 0.00 C ATOM 0 H LEU B 58 176.363 1.609 5.650 1.00 0.00 H new ATOM 0 HA LEU B 58 178.461 2.223 7.512 1.00 0.00 H new ATOM 0 HB2 LEU B 58 177.378 -0.394 6.461 1.00 0.00 H new ATOM 0 HB3 LEU B 58 178.459 -0.228 7.830 1.00 0.00 H new ATOM 0 HG LEU B 58 175.835 1.308 7.694 1.00 0.00 H new ATOM 0 HD11 LEU B 58 174.803 -0.485 9.062 1.00 0.00 H new ATOM 0 HD12 LEU B 58 175.284 -1.087 7.458 1.00 0.00 H new ATOM 0 HD13 LEU B 58 176.277 -1.466 8.885 1.00 0.00 H new ATOM 0 HD21 LEU B 58 176.103 1.324 10.159 1.00 0.00 H new ATOM 0 HD22 LEU B 58 177.609 0.390 9.996 1.00 0.00 H new ATOM 0 HD23 LEU B 58 177.514 2.044 9.346 1.00 0.00 H new ATOM 2697 N GLU B 59 179.301 0.974 4.657 1.00 0.00 N ATOM 2698 CA GLU B 59 180.439 0.701 3.754 1.00 0.00 C ATOM 2699 C GLU B 59 181.084 2.030 3.337 1.00 0.00 C ATOM 2700 O GLU B 59 182.224 2.302 3.643 1.00 0.00 O ATOM 2701 CB GLU B 59 179.900 -0.034 2.506 1.00 0.00 C ATOM 2702 CG GLU B 59 179.258 -1.366 2.929 1.00 0.00 C ATOM 2703 CD GLU B 59 178.519 -1.959 1.757 1.00 0.00 C ATOM 2704 OE1 GLU B 59 177.608 -1.335 1.276 1.00 0.00 O ATOM 2705 OE2 GLU B 59 178.883 -3.023 1.338 1.00 0.00 O ATOM 0 H GLU B 59 178.385 0.871 4.221 1.00 0.00 H new ATOM 0 HA GLU B 59 181.186 0.086 4.255 1.00 0.00 H new ATOM 0 HB2 GLU B 59 179.166 0.588 1.994 1.00 0.00 H new ATOM 0 HB3 GLU B 59 180.711 -0.217 1.801 1.00 0.00 H new ATOM 0 HG2 GLU B 59 180.025 -2.058 3.277 1.00 0.00 H new ATOM 0 HG3 GLU B 59 178.573 -1.204 3.761 1.00 0.00 H new ATOM 2712 N SER B 60 180.358 2.834 2.617 1.00 0.00 N ATOM 2713 CA SER B 60 180.890 4.138 2.090 1.00 0.00 C ATOM 2714 C SER B 60 181.801 4.839 3.115 1.00 0.00 C ATOM 2715 O SER B 60 182.884 5.326 2.784 1.00 0.00 O ATOM 2716 CB SER B 60 179.717 5.062 1.745 1.00 0.00 C ATOM 2717 OG SER B 60 178.658 4.878 2.679 1.00 0.00 O ATOM 0 H SER B 60 179.389 2.644 2.360 1.00 0.00 H new ATOM 0 HA SER B 60 181.483 3.923 1.201 1.00 0.00 H new ATOM 0 HB2 SER B 60 180.047 6.101 1.757 1.00 0.00 H new ATOM 0 HB3 SER B 60 179.363 4.852 0.736 1.00 0.00 H new ATOM 0 HG SER B 60 178.113 4.109 2.409 1.00 0.00 H new ATOM 2723 N LYS B 61 181.364 4.952 4.343 1.00 0.00 N ATOM 2724 CA LYS B 61 182.204 5.662 5.356 1.00 0.00 C ATOM 2725 C LYS B 61 183.462 4.836 5.629 1.00 0.00 C ATOM 2726 O LYS B 61 184.579 5.346 5.658 1.00 0.00 O ATOM 2727 CB LYS B 61 181.411 5.887 6.662 1.00 0.00 C ATOM 2728 CG LYS B 61 180.939 4.543 7.261 1.00 0.00 C ATOM 2729 CD LYS B 61 179.759 4.784 8.230 1.00 0.00 C ATOM 2730 CE LYS B 61 180.147 4.359 9.650 1.00 0.00 C ATOM 2731 NZ LYS B 61 181.380 5.068 10.067 1.00 0.00 N ATOM 0 H LYS B 61 180.474 4.589 4.686 1.00 0.00 H new ATOM 0 HA LYS B 61 182.488 6.639 4.966 1.00 0.00 H new ATOM 0 HB2 LYS B 61 182.035 6.412 7.385 1.00 0.00 H new ATOM 0 HB3 LYS B 61 180.549 6.524 6.463 1.00 0.00 H new ATOM 0 HG2 LYS B 61 180.633 3.867 6.463 1.00 0.00 H new ATOM 0 HG3 LYS B 61 181.762 4.061 7.789 1.00 0.00 H new ATOM 0 HD2 LYS B 61 179.481 5.838 8.221 1.00 0.00 H new ATOM 0 HD3 LYS B 61 178.886 4.221 7.899 1.00 0.00 H new ATOM 0 HE2 LYS B 61 179.335 4.585 10.342 1.00 0.00 H new ATOM 0 HE3 LYS B 61 180.306 3.281 9.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 181.333 5.277 11.085 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 182.207 4.468 9.875 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 181.466 5.957 9.534 1.00 0.00 H new ATOM 2745 N ARG B 62 183.303 3.565 5.779 1.00 0.00 N ATOM 2746 CA ARG B 62 184.453 2.680 6.019 1.00 0.00 C ATOM 2747 C ARG B 62 185.165 2.403 4.684 1.00 0.00 C ATOM 2748 O ARG B 62 185.784 1.361 4.505 1.00 0.00 O ATOM 2749 CB ARG B 62 183.955 1.371 6.650 1.00 0.00 C ATOM 2750 CG ARG B 62 185.137 0.589 7.234 1.00 0.00 C ATOM 2751 CD ARG B 62 184.621 -0.466 8.207 1.00 0.00 C ATOM 2752 NE ARG B 62 184.387 0.148 9.552 1.00 0.00 N ATOM 2753 CZ ARG B 62 183.549 -0.414 10.399 1.00 0.00 C ATOM 2754 NH1 ARG B 62 182.890 -1.476 10.047 1.00 0.00 N ATOM 2755 NH2 ARG B 62 183.386 0.089 11.587 1.00 0.00 N ATOM 0 H ARG B 62 182.400 3.091 5.744 1.00 0.00 H new ATOM 0 HA ARG B 62 185.160 3.153 6.701 1.00 0.00 H new ATOM 0 HB2 ARG B 62 183.229 1.588 7.434 1.00 0.00 H new ATOM 0 HB3 ARG B 62 183.444 0.767 5.900 1.00 0.00 H new ATOM 0 HG2 ARG B 62 185.703 0.114 6.433 1.00 0.00 H new ATOM 0 HG3 ARG B 62 185.818 1.268 7.746 1.00 0.00 H new ATOM 0 HD2 ARG B 62 183.694 -0.898 7.829 1.00 0.00 H new ATOM 0 HD3 ARG B 62 185.342 -1.279 8.290 1.00 0.00 H new ATOM 0 HE ARG B 62 184.877 1.003 9.813 1.00 0.00 H new ATOM 0 HH11 ARG B 62 183.022 -1.873 9.117 1.00 0.00 H new ATOM 0 HH12 ARG B 62 182.241 -1.913 10.701 1.00 0.00 H new ATOM 0 HH21 ARG B 62 183.908 0.920 11.865 1.00 0.00 H new ATOM 0 HH22 ARG B 62 182.737 -0.348 12.241 1.00 0.00 H new ATOM 2769 N LEU B 63 185.034 3.280 3.731 1.00 0.00 N ATOM 2770 CA LEU B 63 185.633 3.051 2.422 1.00 0.00 C ATOM 2771 C LEU B 63 186.557 4.222 2.029 1.00 0.00 C ATOM 2772 O LEU B 63 186.481 5.320 2.568 1.00 0.00 O ATOM 2773 CB LEU B 63 184.527 2.904 1.382 1.00 0.00 C ATOM 2774 CG LEU B 63 184.006 1.448 1.310 1.00 0.00 C ATOM 2775 CD1 LEU B 63 182.769 1.384 0.414 1.00 0.00 C ATOM 2776 CD2 LEU B 63 185.071 0.528 0.719 1.00 0.00 C ATOM 0 H LEU B 63 184.524 4.159 3.822 1.00 0.00 H new ATOM 0 HA LEU B 63 186.230 2.140 2.465 1.00 0.00 H new ATOM 0 HB2 LEU B 63 183.704 3.574 1.628 1.00 0.00 H new ATOM 0 HB3 LEU B 63 184.903 3.206 0.404 1.00 0.00 H new ATOM 0 HG LEU B 63 183.760 1.125 2.322 1.00 0.00 H new ATOM 0 HD11 LEU B 63 182.407 0.357 0.367 1.00 0.00 H new ATOM 0 HD12 LEU B 63 181.989 2.026 0.824 1.00 0.00 H new ATOM 0 HD13 LEU B 63 183.028 1.724 -0.589 1.00 0.00 H new ATOM 0 HD21 LEU B 63 184.688 -0.492 0.676 1.00 0.00 H new ATOM 0 HD22 LEU B 63 185.324 0.863 -0.287 1.00 0.00 H new ATOM 0 HD23 LEU B 63 185.963 0.554 1.345 1.00 0.00 H new ATOM 2788 N GLY B 64 187.388 3.989 1.064 1.00 0.00 N ATOM 2789 CA GLY B 64 188.343 5.011 0.506 1.00 0.00 C ATOM 2790 C GLY B 64 188.572 4.659 -0.971 1.00 0.00 C ATOM 2791 O GLY B 64 187.653 4.668 -1.739 1.00 0.00 O ATOM 0 H GLY B 64 187.457 3.081 0.604 1.00 0.00 H new ATOM 0 HA2 GLY B 64 187.931 6.016 0.603 1.00 0.00 H new ATOM 0 HA3 GLY B 64 189.284 4.998 1.055 1.00 0.00 H new ATOM 2795 N GLY B 65 189.746 4.272 -1.379 1.00 0.00 N ATOM 2796 CA GLY B 65 189.933 3.873 -2.833 1.00 0.00 C ATOM 2797 C GLY B 65 191.340 4.175 -3.209 1.00 0.00 C ATOM 2798 O GLY B 65 191.632 5.242 -3.745 1.00 0.00 O ATOM 0 H GLY B 65 190.580 4.209 -0.795 1.00 0.00 H new ATOM 0 HA2 GLY B 65 189.720 2.813 -2.969 1.00 0.00 H new ATOM 0 HA3 GLY B 65 189.241 4.421 -3.472 1.00 0.00 H new ATOM 2802 N ASP B 66 192.248 3.331 -2.813 1.00 0.00 N ATOM 2803 CA ASP B 66 193.684 3.650 -2.987 1.00 0.00 C ATOM 2804 C ASP B 66 194.505 2.358 -3.115 1.00 0.00 C ATOM 2805 O ASP B 66 195.681 2.392 -3.449 1.00 0.00 O ATOM 2806 CB ASP B 66 194.145 4.443 -1.738 1.00 0.00 C ATOM 2807 CG ASP B 66 192.940 5.117 -1.062 1.00 0.00 C ATOM 2808 OD1 ASP B 66 192.236 4.458 -0.294 1.00 0.00 O ATOM 2809 OD2 ASP B 66 192.713 6.270 -1.336 1.00 0.00 O ATOM 0 H ASP B 66 192.054 2.431 -2.375 1.00 0.00 H new ATOM 0 HA ASP B 66 193.832 4.237 -3.893 1.00 0.00 H new ATOM 0 HB2 ASP B 66 194.638 3.772 -1.034 1.00 0.00 H new ATOM 0 HB3 ASP B 66 194.878 5.197 -2.027 1.00 0.00 H new ATOM 2814 N ASP B 67 193.918 1.235 -2.798 1.00 0.00 N ATOM 2815 CA ASP B 67 194.636 -0.102 -2.817 1.00 0.00 C ATOM 2816 C ASP B 67 195.496 -0.248 -4.071 1.00 0.00 C ATOM 2817 O ASP B 67 196.575 -0.831 -4.050 1.00 0.00 O ATOM 2818 CB ASP B 67 193.579 -1.230 -2.793 1.00 0.00 C ATOM 2819 CG ASP B 67 194.102 -2.483 -3.457 1.00 0.00 C ATOM 2820 OD1 ASP B 67 194.050 -2.568 -4.652 1.00 0.00 O ATOM 2821 OD2 ASP B 67 194.537 -3.355 -2.759 1.00 0.00 O ATOM 0 H ASP B 67 192.940 1.174 -2.516 1.00 0.00 H new ATOM 0 HA ASP B 67 195.288 -0.163 -1.946 1.00 0.00 H new ATOM 0 HB2 ASP B 67 193.302 -1.450 -1.762 1.00 0.00 H new ATOM 0 HB3 ASP B 67 192.675 -0.896 -3.302 1.00 0.00 H new ATOM 2826 N ALA B 68 195.033 0.268 -5.156 1.00 0.00 N ATOM 2827 CA ALA B 68 195.810 0.154 -6.422 1.00 0.00 C ATOM 2828 C ALA B 68 197.035 1.064 -6.311 1.00 0.00 C ATOM 2829 O ALA B 68 198.133 0.678 -6.699 1.00 0.00 O ATOM 2830 CB ALA B 68 194.953 0.485 -7.629 1.00 0.00 C ATOM 0 H ALA B 68 194.147 0.768 -5.232 1.00 0.00 H new ATOM 0 HA ALA B 68 196.141 -0.874 -6.568 1.00 0.00 H new ATOM 0 HB1 ALA B 68 195.550 0.392 -8.536 1.00 0.00 H new ATOM 0 HB2 ALA B 68 194.110 -0.205 -7.677 1.00 0.00 H new ATOM 0 HB3 ALA B 68 194.581 1.506 -7.542 1.00 0.00 H new ATOM 2836 N ARG B 69 196.912 2.177 -5.664 1.00 0.00 N ATOM 2837 CA ARG B 69 198.105 2.987 -5.415 1.00 0.00 C ATOM 2838 C ARG B 69 198.960 2.219 -4.422 1.00 0.00 C ATOM 2839 O ARG B 69 200.158 2.073 -4.598 1.00 0.00 O ATOM 2840 CB ARG B 69 197.731 4.361 -4.834 1.00 0.00 C ATOM 2841 CG ARG B 69 199.009 5.215 -4.658 1.00 0.00 C ATOM 2842 CD ARG B 69 199.559 5.644 -6.038 1.00 0.00 C ATOM 2843 NE ARG B 69 198.512 6.439 -6.747 1.00 0.00 N ATOM 2844 CZ ARG B 69 198.139 6.173 -7.986 1.00 0.00 C ATOM 2845 NH1 ARG B 69 198.760 5.269 -8.700 1.00 0.00 N ATOM 2846 NH2 ARG B 69 197.174 6.856 -8.514 1.00 0.00 N ATOM 0 H ARG B 69 196.037 2.555 -5.300 1.00 0.00 H new ATOM 0 HA ARG B 69 198.641 3.166 -6.347 1.00 0.00 H new ATOM 0 HB2 ARG B 69 197.030 4.869 -5.497 1.00 0.00 H new ATOM 0 HB3 ARG B 69 197.229 4.237 -3.874 1.00 0.00 H new ATOM 0 HG2 ARG B 69 198.786 6.097 -4.057 1.00 0.00 H new ATOM 0 HG3 ARG B 69 199.765 4.644 -4.118 1.00 0.00 H new ATOM 0 HD2 ARG B 69 200.465 6.237 -5.915 1.00 0.00 H new ATOM 0 HD3 ARG B 69 199.830 4.767 -6.626 1.00 0.00 H new ATOM 0 HE ARG B 69 198.069 7.216 -6.257 1.00 0.00 H new ATOM 0 HH11 ARG B 69 199.546 4.756 -8.301 1.00 0.00 H new ATOM 0 HH12 ARG B 69 198.458 5.077 -9.655 1.00 0.00 H new ATOM 0 HH21 ARG B 69 196.713 7.588 -7.974 1.00 0.00 H new ATOM 0 HH22 ARG B 69 196.875 6.662 -9.470 1.00 0.00 H new ATOM 2860 N VAL B 70 198.343 1.696 -3.392 1.00 0.00 N ATOM 2861 CA VAL B 70 199.103 0.891 -2.383 1.00 0.00 C ATOM 2862 C VAL B 70 199.945 -0.112 -3.140 1.00 0.00 C ATOM 2863 O VAL B 70 201.126 -0.251 -2.918 1.00 0.00 O ATOM 2864 CB VAL B 70 198.117 0.121 -1.471 1.00 0.00 C ATOM 2865 CG1 VAL B 70 198.871 -0.710 -0.433 1.00 0.00 C ATOM 2866 CG2 VAL B 70 197.209 1.093 -0.748 1.00 0.00 C ATOM 0 H VAL B 70 197.345 1.791 -3.205 1.00 0.00 H new ATOM 0 HA VAL B 70 199.721 1.546 -1.768 1.00 0.00 H new ATOM 0 HB VAL B 70 197.526 -0.542 -2.103 1.00 0.00 H new ATOM 0 HG11 VAL B 70 198.157 -1.242 0.196 1.00 0.00 H new ATOM 0 HG12 VAL B 70 199.514 -1.429 -0.940 1.00 0.00 H new ATOM 0 HG13 VAL B 70 199.481 -0.052 0.187 1.00 0.00 H new ATOM 0 HG21 VAL B 70 196.520 0.541 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL B 70 197.810 1.766 -0.137 1.00 0.00 H new ATOM 0 HG23 VAL B 70 196.643 1.673 -1.477 1.00 0.00 H new ATOM 2876 N ARG B 71 199.326 -0.817 -4.013 1.00 0.00 N ATOM 2877 CA ARG B 71 200.038 -1.857 -4.789 1.00 0.00 C ATOM 2878 C ARG B 71 201.191 -1.227 -5.551 1.00 0.00 C ATOM 2879 O ARG B 71 202.305 -1.716 -5.503 1.00 0.00 O ATOM 2880 CB ARG B 71 199.067 -2.533 -5.752 1.00 0.00 C ATOM 2881 CG ARG B 71 199.591 -3.912 -6.175 1.00 0.00 C ATOM 2882 CD ARG B 71 198.410 -4.825 -6.521 1.00 0.00 C ATOM 2883 NE ARG B 71 197.715 -5.251 -5.254 1.00 0.00 N ATOM 2884 CZ ARG B 71 196.647 -4.613 -4.795 1.00 0.00 C ATOM 2885 NH1 ARG B 71 196.097 -3.657 -5.491 1.00 0.00 N ATOM 2886 NH2 ARG B 71 196.131 -4.958 -3.657 1.00 0.00 N ATOM 0 H ARG B 71 198.335 -0.722 -4.233 1.00 0.00 H new ATOM 0 HA ARG B 71 200.438 -2.610 -4.110 1.00 0.00 H new ATOM 0 HB2 ARG B 71 198.092 -2.640 -5.277 1.00 0.00 H new ATOM 0 HB3 ARG B 71 198.926 -1.907 -6.633 1.00 0.00 H new ATOM 0 HG2 ARG B 71 200.252 -3.813 -7.036 1.00 0.00 H new ATOM 0 HG3 ARG B 71 200.180 -4.351 -5.370 1.00 0.00 H new ATOM 0 HD2 ARG B 71 197.711 -4.301 -7.173 1.00 0.00 H new ATOM 0 HD3 ARG B 71 198.761 -5.700 -7.067 1.00 0.00 H new ATOM 0 HE ARG B 71 198.076 -6.052 -4.735 1.00 0.00 H new ATOM 0 HH11 ARG B 71 196.488 -3.395 -6.396 1.00 0.00 H new ATOM 0 HH12 ARG B 71 195.276 -3.171 -5.131 1.00 0.00 H new ATOM 0 HH21 ARG B 71 196.547 -5.718 -3.118 1.00 0.00 H new ATOM 0 HH22 ARG B 71 195.310 -4.470 -3.301 1.00 0.00 H new ATOM 2900 N GLU B 72 200.964 -0.143 -6.216 1.00 0.00 N ATOM 2901 CA GLU B 72 202.078 0.506 -6.954 1.00 0.00 C ATOM 2902 C GLU B 72 203.194 0.804 -5.980 1.00 0.00 C ATOM 2903 O GLU B 72 204.378 0.571 -6.258 1.00 0.00 O ATOM 2904 CB GLU B 72 201.597 1.806 -7.572 1.00 0.00 C ATOM 2905 CG GLU B 72 200.649 1.498 -8.734 1.00 0.00 C ATOM 2906 CD GLU B 72 200.226 2.790 -9.424 1.00 0.00 C ATOM 2907 OE1 GLU B 72 200.757 3.829 -9.094 1.00 0.00 O ATOM 2908 OE2 GLU B 72 199.386 2.733 -10.267 1.00 0.00 O ATOM 0 H GLU B 72 200.060 0.325 -6.284 1.00 0.00 H new ATOM 0 HA GLU B 72 202.431 -0.157 -7.744 1.00 0.00 H new ATOM 0 HB2 GLU B 72 201.086 2.411 -6.822 1.00 0.00 H new ATOM 0 HB3 GLU B 72 202.447 2.389 -7.927 1.00 0.00 H new ATOM 0 HG2 GLU B 72 201.141 0.839 -9.450 1.00 0.00 H new ATOM 0 HG3 GLU B 72 199.770 0.969 -8.366 1.00 0.00 H new ATOM 2915 N LEU B 73 202.843 1.321 -4.846 1.00 0.00 N ATOM 2916 CA LEU B 73 203.859 1.644 -3.843 1.00 0.00 C ATOM 2917 C LEU B 73 204.493 0.361 -3.351 1.00 0.00 C ATOM 2918 O LEU B 73 205.670 0.309 -3.141 1.00 0.00 O ATOM 2919 CB LEU B 73 203.250 2.425 -2.696 1.00 0.00 C ATOM 2920 CG LEU B 73 202.561 3.691 -3.241 1.00 0.00 C ATOM 2921 CD1 LEU B 73 201.783 4.339 -2.131 1.00 0.00 C ATOM 2922 CD2 LEU B 73 203.597 4.701 -3.767 1.00 0.00 C ATOM 0 H LEU B 73 201.883 1.533 -4.575 1.00 0.00 H new ATOM 0 HA LEU B 73 204.628 2.272 -4.293 1.00 0.00 H new ATOM 0 HB2 LEU B 73 202.528 1.806 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU B 73 204.023 2.700 -1.979 1.00 0.00 H new ATOM 0 HG LEU B 73 201.904 3.401 -4.061 1.00 0.00 H new ATOM 0 HD11 LEU B 73 201.291 5.236 -2.507 1.00 0.00 H new ATOM 0 HD12 LEU B 73 201.032 3.643 -1.759 1.00 0.00 H new ATOM 0 HD13 LEU B 73 202.461 4.609 -1.321 1.00 0.00 H new ATOM 0 HD21 LEU B 73 203.084 5.585 -4.146 1.00 0.00 H new ATOM 0 HD22 LEU B 73 204.267 4.990 -2.957 1.00 0.00 H new ATOM 0 HD23 LEU B 73 204.175 4.245 -4.571 1.00 0.00 H new ATOM 2934 N GLU B 74 203.738 -0.689 -3.214 1.00 0.00 N ATOM 2935 CA GLU B 74 204.336 -1.978 -2.802 1.00 0.00 C ATOM 2936 C GLU B 74 205.341 -2.405 -3.872 1.00 0.00 C ATOM 2937 O GLU B 74 206.474 -2.777 -3.573 1.00 0.00 O ATOM 2938 CB GLU B 74 203.233 -3.026 -2.704 1.00 0.00 C ATOM 2939 CG GLU B 74 202.333 -2.734 -1.483 1.00 0.00 C ATOM 2940 CD GLU B 74 202.340 -3.904 -0.529 1.00 0.00 C ATOM 2941 OE1 GLU B 74 203.368 -4.506 -0.364 1.00 0.00 O ATOM 2942 OE2 GLU B 74 201.327 -4.187 0.023 1.00 0.00 O ATOM 0 H GLU B 74 202.730 -0.707 -3.371 1.00 0.00 H new ATOM 0 HA GLU B 74 204.833 -1.877 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU B 74 202.635 -3.023 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU B 74 203.671 -4.020 -2.614 1.00 0.00 H new ATOM 0 HG2 GLU B 74 202.684 -1.838 -0.971 1.00 0.00 H new ATOM 0 HG3 GLU B 74 201.314 -2.534 -1.814 1.00 0.00 H new ATOM 2949 N LEU B 75 204.936 -2.358 -5.111 1.00 0.00 N ATOM 2950 CA LEU B 75 205.833 -2.749 -6.227 1.00 0.00 C ATOM 2951 C LEU B 75 207.052 -1.817 -6.209 1.00 0.00 C ATOM 2952 O LEU B 75 208.191 -2.248 -6.400 1.00 0.00 O ATOM 2953 CB LEU B 75 205.071 -2.627 -7.558 1.00 0.00 C ATOM 2954 CG LEU B 75 203.759 -3.459 -7.509 1.00 0.00 C ATOM 2955 CD1 LEU B 75 202.647 -2.797 -8.363 1.00 0.00 C ATOM 2956 CD2 LEU B 75 204.031 -4.871 -8.040 1.00 0.00 C ATOM 0 H LEU B 75 204.004 -2.059 -5.399 1.00 0.00 H new ATOM 0 HA LEU B 75 206.165 -3.781 -6.117 1.00 0.00 H new ATOM 0 HB2 LEU B 75 204.839 -1.581 -7.757 1.00 0.00 H new ATOM 0 HB3 LEU B 75 205.700 -2.975 -8.378 1.00 0.00 H new ATOM 0 HG LEU B 75 203.420 -3.505 -6.474 1.00 0.00 H new ATOM 0 HD11 LEU B 75 201.741 -3.400 -8.311 1.00 0.00 H new ATOM 0 HD12 LEU B 75 202.441 -1.798 -7.980 1.00 0.00 H new ATOM 0 HD13 LEU B 75 202.977 -2.727 -9.399 1.00 0.00 H new ATOM 0 HD21 LEU B 75 203.112 -5.456 -8.006 1.00 0.00 H new ATOM 0 HD22 LEU B 75 204.385 -4.811 -9.069 1.00 0.00 H new ATOM 0 HD23 LEU B 75 204.790 -5.352 -7.423 1.00 0.00 H new ATOM 2968 N GLU B 76 206.834 -0.565 -5.927 1.00 0.00 N ATOM 2969 CA GLU B 76 207.950 0.400 -5.838 1.00 0.00 C ATOM 2970 C GLU B 76 208.827 0.047 -4.628 1.00 0.00 C ATOM 2971 O GLU B 76 210.044 0.075 -4.695 1.00 0.00 O ATOM 2972 CB GLU B 76 207.378 1.828 -5.676 1.00 0.00 C ATOM 2973 CG GLU B 76 208.330 2.861 -6.297 1.00 0.00 C ATOM 2974 CD GLU B 76 208.077 2.949 -7.778 1.00 0.00 C ATOM 2975 OE1 GLU B 76 208.481 2.057 -8.482 1.00 0.00 O ATOM 2976 OE2 GLU B 76 207.475 3.896 -8.194 1.00 0.00 O ATOM 0 H GLU B 76 205.911 -0.167 -5.752 1.00 0.00 H new ATOM 0 HA GLU B 76 208.553 0.356 -6.745 1.00 0.00 H new ATOM 0 HB2 GLU B 76 206.401 1.891 -6.154 1.00 0.00 H new ATOM 0 HB3 GLU B 76 207.230 2.050 -4.619 1.00 0.00 H new ATOM 0 HG2 GLU B 76 208.179 3.836 -5.833 1.00 0.00 H new ATOM 0 HG3 GLU B 76 209.365 2.576 -6.110 1.00 0.00 H new ATOM 2983 N LEU B 77 208.223 -0.265 -3.525 1.00 0.00 N ATOM 2984 CA LEU B 77 209.004 -0.596 -2.309 1.00 0.00 C ATOM 2985 C LEU B 77 209.819 -1.823 -2.589 1.00 0.00 C ATOM 2986 O LEU B 77 210.976 -1.882 -2.260 1.00 0.00 O ATOM 2987 CB LEU B 77 208.073 -0.847 -1.122 1.00 0.00 C ATOM 2988 CG LEU B 77 207.566 0.500 -0.576 1.00 0.00 C ATOM 2989 CD1 LEU B 77 206.367 0.271 0.329 1.00 0.00 C ATOM 2990 CD2 LEU B 77 208.677 1.198 0.223 1.00 0.00 C ATOM 0 H LEU B 77 207.210 -0.306 -3.411 1.00 0.00 H new ATOM 0 HA LEU B 77 209.656 0.240 -2.055 1.00 0.00 H new ATOM 0 HB2 LEU B 77 207.231 -1.467 -1.431 1.00 0.00 H new ATOM 0 HB3 LEU B 77 208.601 -1.393 -0.340 1.00 0.00 H new ATOM 0 HG LEU B 77 207.275 1.131 -1.416 1.00 0.00 H new ATOM 0 HD11 LEU B 77 206.013 1.228 0.712 1.00 0.00 H new ATOM 0 HD12 LEU B 77 205.570 -0.210 -0.238 1.00 0.00 H new ATOM 0 HD13 LEU B 77 206.657 -0.369 1.162 1.00 0.00 H new ATOM 0 HD21 LEU B 77 208.308 2.150 0.605 1.00 0.00 H new ATOM 0 HD22 LEU B 77 208.978 0.565 1.058 1.00 0.00 H new ATOM 0 HD23 LEU B 77 209.535 1.375 -0.425 1.00 0.00 H new ATOM 3002 N ASP B 78 209.242 -2.798 -3.229 1.00 0.00 N ATOM 3003 CA ASP B 78 210.019 -4.004 -3.575 1.00 0.00 C ATOM 3004 C ASP B 78 211.186 -3.588 -4.450 1.00 0.00 C ATOM 3005 O ASP B 78 212.314 -4.032 -4.257 1.00 0.00 O ATOM 3006 CB ASP B 78 209.128 -5.020 -4.298 1.00 0.00 C ATOM 3007 CG ASP B 78 208.497 -5.942 -3.284 1.00 0.00 C ATOM 3008 OD1 ASP B 78 207.699 -5.484 -2.499 1.00 0.00 O ATOM 3009 OD2 ASP B 78 208.853 -7.089 -3.256 1.00 0.00 O ATOM 0 H ASP B 78 208.266 -2.807 -3.525 1.00 0.00 H new ATOM 0 HA ASP B 78 210.395 -4.480 -2.670 1.00 0.00 H new ATOM 0 HB2 ASP B 78 208.355 -4.503 -4.867 1.00 0.00 H new ATOM 0 HB3 ASP B 78 209.718 -5.595 -5.012 1.00 0.00 H new ATOM 3014 N ARG B 79 210.945 -2.701 -5.369 1.00 0.00 N ATOM 3015 CA ARG B 79 212.035 -2.195 -6.231 1.00 0.00 C ATOM 3016 C ARG B 79 213.091 -1.554 -5.352 1.00 0.00 C ATOM 3017 O ARG B 79 214.261 -1.908 -5.392 1.00 0.00 O ATOM 3018 CB ARG B 79 211.489 -1.147 -7.190 1.00 0.00 C ATOM 3019 CG ARG B 79 212.576 -0.713 -8.202 1.00 0.00 C ATOM 3020 CD ARG B 79 212.975 -1.887 -9.095 1.00 0.00 C ATOM 3021 NE ARG B 79 211.748 -2.590 -9.576 1.00 0.00 N ATOM 3022 CZ ARG B 79 211.842 -3.571 -10.436 1.00 0.00 C ATOM 3023 NH1 ARG B 79 213.016 -3.959 -10.849 1.00 0.00 N ATOM 3024 NH2 ARG B 79 210.766 -4.157 -10.865 1.00 0.00 N ATOM 0 H ARG B 79 210.026 -2.302 -5.560 1.00 0.00 H new ATOM 0 HA ARG B 79 212.463 -3.019 -6.802 1.00 0.00 H new ATOM 0 HB2 ARG B 79 210.628 -1.549 -7.724 1.00 0.00 H new ATOM 0 HB3 ARG B 79 211.140 -0.280 -6.629 1.00 0.00 H new ATOM 0 HG2 ARG B 79 212.204 0.108 -8.815 1.00 0.00 H new ATOM 0 HG3 ARG B 79 213.450 -0.341 -7.668 1.00 0.00 H new ATOM 0 HD2 ARG B 79 213.558 -1.530 -9.944 1.00 0.00 H new ATOM 0 HD3 ARG B 79 213.609 -2.579 -8.541 1.00 0.00 H new ATOM 0 HE ARG B 79 210.832 -2.303 -9.232 1.00 0.00 H new ATOM 0 HH11 ARG B 79 213.857 -3.498 -10.502 1.00 0.00 H new ATOM 0 HH12 ARG B 79 213.094 -4.724 -11.520 1.00 0.00 H new ATOM 0 HH21 ARG B 79 209.852 -3.852 -10.531 1.00 0.00 H new ATOM 0 HH22 ARG B 79 210.835 -4.922 -11.536 1.00 0.00 H new ATOM 3038 N LEU B 80 212.700 -0.591 -4.575 1.00 0.00 N ATOM 3039 CA LEU B 80 213.672 0.109 -3.723 1.00 0.00 C ATOM 3040 C LEU B 80 214.367 -0.895 -2.821 1.00 0.00 C ATOM 3041 O LEU B 80 215.542 -0.777 -2.555 1.00 0.00 O ATOM 3042 CB LEU B 80 212.972 1.177 -2.901 1.00 0.00 C ATOM 3043 CG LEU B 80 212.661 2.430 -3.760 1.00 0.00 C ATOM 3044 CD1 LEU B 80 212.310 3.601 -2.848 1.00 0.00 C ATOM 3045 CD2 LEU B 80 213.877 2.827 -4.620 1.00 0.00 C ATOM 0 H LEU B 80 211.738 -0.260 -4.497 1.00 0.00 H new ATOM 0 HA LEU B 80 214.419 0.598 -4.348 1.00 0.00 H new ATOM 0 HB2 LEU B 80 212.046 0.775 -2.490 1.00 0.00 H new ATOM 0 HB3 LEU B 80 213.600 1.459 -2.056 1.00 0.00 H new ATOM 0 HG LEU B 80 211.823 2.190 -4.415 1.00 0.00 H new ATOM 0 HD11 LEU B 80 212.092 4.481 -3.453 1.00 0.00 H new ATOM 0 HD12 LEU B 80 211.436 3.346 -2.249 1.00 0.00 H new ATOM 0 HD13 LEU B 80 213.152 3.814 -2.189 1.00 0.00 H new ATOM 0 HD21 LEU B 80 213.631 3.708 -5.212 1.00 0.00 H new ATOM 0 HD22 LEU B 80 214.724 3.050 -3.971 1.00 0.00 H new ATOM 0 HD23 LEU B 80 214.137 2.004 -5.285 1.00 0.00 H new ATOM 3057 N ARG B 81 213.651 -1.840 -2.290 1.00 0.00 N ATOM 3058 CA ARG B 81 214.297 -2.864 -1.419 1.00 0.00 C ATOM 3059 C ARG B 81 215.283 -3.626 -2.286 1.00 0.00 C ATOM 3060 O ARG B 81 216.371 -3.940 -1.860 1.00 0.00 O ATOM 3061 CB ARG B 81 213.245 -3.833 -0.848 1.00 0.00 C ATOM 3062 CG ARG B 81 212.414 -3.138 0.262 1.00 0.00 C ATOM 3063 CD ARG B 81 211.507 -4.170 0.986 1.00 0.00 C ATOM 3064 NE ARG B 81 211.449 -5.449 0.194 1.00 0.00 N ATOM 3065 CZ ARG B 81 210.466 -5.707 -0.648 1.00 0.00 C ATOM 3066 NH1 ARG B 81 209.387 -4.954 -0.669 1.00 0.00 N ATOM 3067 NH2 ARG B 81 210.566 -6.726 -1.448 1.00 0.00 N ATOM 0 H ARG B 81 212.645 -1.951 -2.419 1.00 0.00 H new ATOM 0 HA ARG B 81 214.798 -2.387 -0.577 1.00 0.00 H new ATOM 0 HB2 ARG B 81 212.585 -4.174 -1.646 1.00 0.00 H new ATOM 0 HB3 ARG B 81 213.738 -4.717 -0.443 1.00 0.00 H new ATOM 0 HG2 ARG B 81 213.081 -2.663 0.981 1.00 0.00 H new ATOM 0 HG3 ARG B 81 211.801 -2.349 -0.174 1.00 0.00 H new ATOM 0 HD2 ARG B 81 211.894 -4.369 1.985 1.00 0.00 H new ATOM 0 HD3 ARG B 81 210.504 -3.762 1.108 1.00 0.00 H new ATOM 0 HE ARG B 81 212.192 -6.137 0.312 1.00 0.00 H new ATOM 0 HH11 ARG B 81 209.305 -4.163 -0.031 1.00 0.00 H new ATOM 0 HH12 ARG B 81 208.633 -5.162 -1.324 1.00 0.00 H new ATOM 0 HH21 ARG B 81 211.397 -7.316 -1.421 1.00 0.00 H new ATOM 0 HH22 ARG B 81 209.813 -6.936 -2.103 1.00 0.00 H new ATOM 3081 N ALA B 82 214.931 -3.871 -3.520 1.00 0.00 N ATOM 3082 CA ALA B 82 215.868 -4.558 -4.444 1.00 0.00 C ATOM 3083 C ALA B 82 217.122 -3.709 -4.537 1.00 0.00 C ATOM 3084 O ALA B 82 218.235 -4.185 -4.341 1.00 0.00 O ATOM 3085 CB ALA B 82 215.235 -4.695 -5.840 1.00 0.00 C ATOM 0 H ALA B 82 214.029 -3.622 -3.926 1.00 0.00 H new ATOM 0 HA ALA B 82 216.099 -5.557 -4.074 1.00 0.00 H new ATOM 0 HB1 ALA B 82 215.933 -5.200 -6.508 1.00 0.00 H new ATOM 0 HB2 ALA B 82 214.316 -5.277 -5.767 1.00 0.00 H new ATOM 0 HB3 ALA B 82 215.007 -3.705 -6.235 1.00 0.00 H new ATOM 3091 N GLU B 83 216.947 -2.440 -4.795 1.00 0.00 N ATOM 3092 CA GLU B 83 218.116 -1.523 -4.868 1.00 0.00 C ATOM 3093 C GLU B 83 218.857 -1.580 -3.530 1.00 0.00 C ATOM 3094 O GLU B 83 220.036 -1.784 -3.472 1.00 0.00 O ATOM 3095 CB GLU B 83 217.635 -0.083 -5.093 1.00 0.00 C ATOM 3096 CG GLU B 83 217.098 0.129 -6.519 1.00 0.00 C ATOM 3097 CD GLU B 83 218.110 -0.327 -7.541 1.00 0.00 C ATOM 3098 OE1 GLU B 83 219.239 0.046 -7.427 1.00 0.00 O ATOM 3099 OE2 GLU B 83 217.736 -1.032 -8.438 1.00 0.00 O ATOM 0 H GLU B 83 216.041 -2.000 -4.958 1.00 0.00 H new ATOM 0 HA GLU B 83 218.766 -1.824 -5.689 1.00 0.00 H new ATOM 0 HB2 GLU B 83 216.853 0.155 -4.372 1.00 0.00 H new ATOM 0 HB3 GLU B 83 218.458 0.607 -4.909 1.00 0.00 H new ATOM 0 HG2 GLU B 83 216.168 -0.424 -6.649 1.00 0.00 H new ATOM 0 HG3 GLU B 83 216.867 1.183 -6.673 1.00 0.00 H new ATOM 3106 N ASN B 84 218.141 -1.393 -2.461 1.00 0.00 N ATOM 3107 CA ASN B 84 218.732 -1.410 -1.087 1.00 0.00 C ATOM 3108 C ASN B 84 219.548 -2.656 -0.923 1.00 0.00 C ATOM 3109 O ASN B 84 220.658 -2.615 -0.493 1.00 0.00 O ATOM 3110 CB ASN B 84 217.606 -1.464 -0.057 1.00 0.00 C ATOM 3111 CG ASN B 84 217.149 -0.071 0.304 1.00 0.00 C ATOM 3112 OD1 ASN B 84 217.547 0.461 1.317 1.00 0.00 O ATOM 3113 ND2 ASN B 84 216.313 0.545 -0.467 1.00 0.00 N ATOM 0 H ASN B 84 217.135 -1.223 -2.479 1.00 0.00 H new ATOM 0 HA ASN B 84 219.344 -0.519 -0.947 1.00 0.00 H new ATOM 0 HB2 ASN B 84 216.768 -2.036 -0.456 1.00 0.00 H new ATOM 0 HB3 ASN B 84 217.949 -1.983 0.838 1.00 0.00 H new ATOM 0 HD21 ASN B 84 215.988 1.480 -0.223 1.00 0.00 H new ATOM 0 HD22 ASN B 84 215.979 0.095 -1.320 1.00 0.00 H new ATOM 3120 N LEU B 85 218.983 -3.767 -1.238 1.00 0.00 N ATOM 3121 CA LEU B 85 219.711 -5.053 -1.086 1.00 0.00 C ATOM 3122 C LEU B 85 221.005 -4.959 -1.880 1.00 0.00 C ATOM 3123 O LEU B 85 222.099 -5.153 -1.357 1.00 0.00 O ATOM 3124 CB LEU B 85 218.810 -6.196 -1.632 1.00 0.00 C ATOM 3125 CG LEU B 85 219.647 -7.378 -2.179 1.00 0.00 C ATOM 3126 CD1 LEU B 85 220.584 -7.931 -1.094 1.00 0.00 C ATOM 3127 CD2 LEU B 85 218.702 -8.489 -2.646 1.00 0.00 C ATOM 0 H LEU B 85 218.033 -3.850 -1.601 1.00 0.00 H new ATOM 0 HA LEU B 85 219.945 -5.259 -0.042 1.00 0.00 H new ATOM 0 HB2 LEU B 85 218.154 -6.552 -0.838 1.00 0.00 H new ATOM 0 HB3 LEU B 85 218.170 -5.807 -2.424 1.00 0.00 H new ATOM 0 HG LEU B 85 220.252 -7.022 -3.013 1.00 0.00 H new ATOM 0 HD11 LEU B 85 221.162 -8.761 -1.501 1.00 0.00 H new ATOM 0 HD12 LEU B 85 221.262 -7.144 -0.763 1.00 0.00 H new ATOM 0 HD13 LEU B 85 219.994 -8.281 -0.247 1.00 0.00 H new ATOM 0 HD21 LEU B 85 219.286 -9.325 -3.032 1.00 0.00 H new ATOM 0 HD22 LEU B 85 218.096 -8.828 -1.806 1.00 0.00 H new ATOM 0 HD23 LEU B 85 218.051 -8.107 -3.432 1.00 0.00 H new ATOM 3139 N GLN B 86 220.890 -4.660 -3.127 1.00 0.00 N ATOM 3140 CA GLN B 86 222.083 -4.555 -3.997 1.00 0.00 C ATOM 3141 C GLN B 86 223.072 -3.554 -3.399 1.00 0.00 C ATOM 3142 O GLN B 86 224.233 -3.862 -3.174 1.00 0.00 O ATOM 3143 CB GLN B 86 221.639 -4.073 -5.383 1.00 0.00 C ATOM 3144 CG GLN B 86 220.957 -5.220 -6.142 1.00 0.00 C ATOM 3145 CD GLN B 86 222.006 -6.240 -6.564 1.00 0.00 C ATOM 3146 OE1 GLN B 86 221.909 -7.404 -6.228 1.00 0.00 O ATOM 3147 NE2 GLN B 86 223.007 -5.866 -7.273 1.00 0.00 N ATOM 0 H GLN B 86 220.002 -4.479 -3.596 1.00 0.00 H new ATOM 0 HA GLN B 86 222.569 -5.527 -4.078 1.00 0.00 H new ATOM 0 HB2 GLN B 86 220.952 -3.233 -5.282 1.00 0.00 H new ATOM 0 HB3 GLN B 86 222.501 -3.714 -5.946 1.00 0.00 H new ATOM 0 HG2 GLN B 86 220.206 -5.694 -5.509 1.00 0.00 H new ATOM 0 HG3 GLN B 86 220.437 -4.833 -7.018 1.00 0.00 H new ATOM 0 HE21 GLN B 86 223.094 -4.891 -7.558 1.00 0.00 H new ATOM 0 HE22 GLN B 86 223.716 -6.544 -7.552 1.00 0.00 H new ATOM 3156 N LEU B 87 222.636 -2.360 -3.199 1.00 0.00 N ATOM 3157 CA LEU B 87 223.529 -1.288 -2.702 1.00 0.00 C ATOM 3158 C LEU B 87 224.074 -1.636 -1.333 1.00 0.00 C ATOM 3159 O LEU B 87 225.253 -1.559 -1.108 1.00 0.00 O ATOM 3160 CB LEU B 87 222.768 0.028 -2.631 1.00 0.00 C ATOM 3161 CG LEU B 87 222.141 0.346 -3.994 1.00 0.00 C ATOM 3162 CD1 LEU B 87 220.929 1.254 -3.807 1.00 0.00 C ATOM 3163 CD2 LEU B 87 223.175 1.053 -4.870 1.00 0.00 C ATOM 0 H LEU B 87 221.672 -2.068 -3.362 1.00 0.00 H new ATOM 0 HA LEU B 87 224.365 -1.188 -3.394 1.00 0.00 H new ATOM 0 HB2 LEU B 87 221.991 -0.033 -1.869 1.00 0.00 H new ATOM 0 HB3 LEU B 87 223.442 0.832 -2.335 1.00 0.00 H new ATOM 0 HG LEU B 87 221.824 -0.581 -4.472 1.00 0.00 H new ATOM 0 HD11 LEU B 87 220.488 1.477 -4.779 1.00 0.00 H new ATOM 0 HD12 LEU B 87 220.192 0.752 -3.180 1.00 0.00 H new ATOM 0 HD13 LEU B 87 221.240 2.183 -3.329 1.00 0.00 H new ATOM 0 HD21 LEU B 87 222.734 1.281 -5.840 1.00 0.00 H new ATOM 0 HD22 LEU B 87 223.489 1.978 -4.387 1.00 0.00 H new ATOM 0 HD23 LEU B 87 224.040 0.404 -5.008 1.00 0.00 H new