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 -164:sc= -2.38 (180deg=-1.6) USER MOD Set 1.2: A 53 ASN :FLIP amide:sc= -2.84! C(o=-21!,f=-12!) USER MOD Set 1.3: B 49 MET CE :methyl -158:sc= -1.58 (180deg=-1.77) USER MOD Set 1.4: B 53 ASN :FLIP amide:sc= -4.93! C(o=-21!,f=-12!) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.177 USER MOD Single : A 26 SER OG : rot 180:sc= 0.124 USER MOD Single : A 28 GLN :FLIP amide:sc= -5.79! C(o=-14!,f=-5.8!) USER MOD Single : A 29 ASN : amide:sc= -0.216 K(o=-0.22,f=-1.5!) USER MOD Single : A 30 MET CE :methyl -138:sc=-0.00106 (180deg=-1.22) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -166:sc= 0.936! (180deg=0.457!) USER MOD Single : A 33 GLN : amide:sc= -0.694! C(o=-0.69!,f=-9.2!) USER MOD Single : A 37 LYS NZ :NH3+ 140:sc= -0.447 (180deg=-1.97!) USER MOD Single : A 39 TYR OH : rot 112:sc= -0.0274 USER MOD Single : A 44 LYS NZ :NH3+ -150:sc= -0.299 (180deg=-1.15!) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 78:sc= 0.462 USER MOD Single : A 54 ASN : amide:sc= -0.0428 K(o=-0.043,f=-1.9!) USER MOD Single : A 60 SER OG : rot -93:sc= 0.782 USER MOD Single : A 61 LYS NZ :NH3+ 162:sc= 0.347 (180deg=-1.56!) USER MOD Single : B 23 HIS : no HD1:sc= 0 X(o=0,f=-0.00043) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.113 USER MOD Single : B 26 SER OG : rot -61:sc= 0.132 USER MOD Single : B 28 GLN :FLIP amide:sc= -16.6! C(o=-19!,f=-17!) USER MOD Single : B 29 ASN : amide:sc= -0.283 K(o=-0.28,f=-1.2!) USER MOD Single : B 30 MET CE :methyl -136:sc= -0.162 (180deg=-1.85!) USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ -172:sc= 0.748 (180deg=0.204!) USER MOD Single : B 33 GLN : amide:sc= -0.391! C(o=-0.39!,f=-8.7!) USER MOD Single : B 37 LYS NZ :NH3+ 145:sc= -0.484 (180deg=-2.28!) USER MOD Single : B 39 TYR OH : rot 114:sc= -0.317 USER MOD Single : B 44 LYS NZ :NH3+ -148:sc= -0.273 (180deg=-1.14) USER MOD Single : B 45 CYS SG : rot 180:sc= 0 USER MOD Single : B 47 SER OG : rot 87:sc= 0.643 USER MOD Single : B 54 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.2) USER MOD Single : B 60 SER OG : rot -86:sc= 0.571 USER MOD Single : B 61 LYS NZ :NH3+ 160:sc= 0.379 (180deg=-1.5) USER MOD Single : B 84 ASN : amide:sc= 0.82 K(o=0.82,f=-0.66) USER MOD Single : B 86 GLN : amide:sc= -0.482! X(o=-0.48!,f=-0.52) USER MOD ----------------------------------------------------------------- ATOM 332 N HIS A 23 153.645 -6.171 12.548 1.00 0.00 N ATOM 333 CA HIS A 23 154.968 -5.493 12.870 1.00 0.00 C ATOM 334 C HIS A 23 154.983 -4.210 12.057 1.00 0.00 C ATOM 335 O HIS A 23 154.978 -3.117 12.573 1.00 0.00 O ATOM 336 CB HIS A 23 156.206 -6.360 12.485 1.00 0.00 C ATOM 337 CG HIS A 23 155.887 -7.835 12.482 1.00 0.00 C ATOM 338 ND1 HIS A 23 155.511 -8.499 11.327 1.00 0.00 N ATOM 339 CD2 HIS A 23 155.930 -8.791 13.465 1.00 0.00 C ATOM 340 CE1 HIS A 23 155.351 -9.793 11.633 1.00 0.00 C ATOM 341 NE2 HIS A 23 155.592 -10.030 12.924 1.00 0.00 N ATOM 0 HA HIS A 23 155.040 -5.323 13.944 1.00 0.00 H new ATOM 0 HB2 HIS A 23 156.562 -6.065 11.498 1.00 0.00 H new ATOM 0 HB3 HIS A 23 157.016 -6.166 13.188 1.00 0.00 H new ATOM 0 HD2 HIS A 23 156.186 -8.611 14.499 1.00 0.00 H new ATOM 0 HE1 HIS A 23 155.062 -10.552 10.921 1.00 0.00 H new ATOM 0 HE2 HIS A 23 155.540 -10.925 13.410 1.00 0.00 H new ATOM 350 N THR A 24 154.825 -4.379 10.798 1.00 0.00 N ATOM 351 CA THR A 24 154.635 -3.298 9.815 1.00 0.00 C ATOM 352 C THR A 24 153.521 -2.356 10.299 1.00 0.00 C ATOM 353 O THR A 24 153.360 -1.248 9.805 1.00 0.00 O ATOM 354 CB THR A 24 154.149 -3.980 8.558 1.00 0.00 C ATOM 355 OG1 THR A 24 154.808 -5.244 8.395 1.00 0.00 O ATOM 356 CG2 THR A 24 154.390 -3.097 7.367 1.00 0.00 C ATOM 0 H THR A 24 154.819 -5.305 10.371 1.00 0.00 H new ATOM 0 HA THR A 24 155.551 -2.727 9.665 1.00 0.00 H new ATOM 0 HB THR A 24 153.077 -4.160 8.643 1.00 0.00 H new ATOM 0 HG1 THR A 24 154.485 -5.679 7.578 1.00 0.00 H new ATOM 0 HG21 THR A 24 154.036 -3.597 6.466 1.00 0.00 H new ATOM 0 HG22 THR A 24 153.852 -2.158 7.496 1.00 0.00 H new ATOM 0 HG23 THR A 24 155.457 -2.894 7.274 1.00 0.00 H new ATOM 364 N GLU A 25 152.743 -2.812 11.224 1.00 0.00 N ATOM 365 CA GLU A 25 151.654 -2.027 11.799 1.00 0.00 C ATOM 366 C GLU A 25 152.029 -0.553 11.869 1.00 0.00 C ATOM 367 O GLU A 25 151.371 0.279 11.273 1.00 0.00 O ATOM 368 CB GLU A 25 151.451 -2.592 13.205 1.00 0.00 C ATOM 369 CG GLU A 25 150.880 -4.017 13.049 1.00 0.00 C ATOM 370 CD GLU A 25 151.002 -4.758 14.332 1.00 0.00 C ATOM 371 OE1 GLU A 25 150.232 -4.486 15.213 1.00 0.00 O ATOM 372 OE2 GLU A 25 151.865 -5.590 14.427 1.00 0.00 O ATOM 0 H GLU A 25 152.830 -3.748 11.619 1.00 0.00 H new ATOM 0 HA GLU A 25 150.748 -2.091 11.196 1.00 0.00 H new ATOM 0 HB2 GLU A 25 152.395 -2.614 13.750 1.00 0.00 H new ATOM 0 HB3 GLU A 25 150.767 -1.964 13.776 1.00 0.00 H new ATOM 0 HG2 GLU A 25 149.834 -3.967 12.747 1.00 0.00 H new ATOM 0 HG3 GLU A 25 151.415 -4.547 12.261 1.00 0.00 H new ATOM 379 N SER A 26 153.049 -0.212 12.578 1.00 0.00 N ATOM 380 CA SER A 26 153.460 1.219 12.670 1.00 0.00 C ATOM 381 C SER A 26 153.437 1.877 11.270 1.00 0.00 C ATOM 382 O SER A 26 152.925 2.971 11.102 1.00 0.00 O ATOM 383 CB SER A 26 154.859 1.293 13.264 1.00 0.00 C ATOM 384 OG SER A 26 155.312 -0.043 13.563 1.00 0.00 O ATOM 0 H SER A 26 153.629 -0.862 13.108 1.00 0.00 H new ATOM 0 HA SER A 26 152.761 1.758 13.310 1.00 0.00 H new ATOM 0 HB2 SER A 26 155.541 1.774 12.563 1.00 0.00 H new ATOM 0 HB3 SER A 26 154.852 1.900 14.169 1.00 0.00 H new ATOM 0 HG SER A 26 156.214 -0.005 13.945 1.00 0.00 H new ATOM 390 N LEU A 27 153.910 1.193 10.254 1.00 0.00 N ATOM 391 CA LEU A 27 153.865 1.768 8.881 1.00 0.00 C ATOM 392 C LEU A 27 152.413 1.963 8.480 1.00 0.00 C ATOM 393 O LEU A 27 152.043 2.980 7.915 1.00 0.00 O ATOM 394 CB LEU A 27 154.539 0.823 7.891 1.00 0.00 C ATOM 395 CG LEU A 27 156.062 0.941 7.986 1.00 0.00 C ATOM 396 CD1 LEU A 27 156.713 -0.276 7.310 1.00 0.00 C ATOM 397 CD2 LEU A 27 156.529 2.227 7.280 1.00 0.00 C ATOM 0 H LEU A 27 154.324 0.263 10.321 1.00 0.00 H new ATOM 0 HA LEU A 27 154.392 2.722 8.871 1.00 0.00 H new ATOM 0 HB2 LEU A 27 154.235 -0.204 8.095 1.00 0.00 H new ATOM 0 HB3 LEU A 27 154.213 1.057 6.877 1.00 0.00 H new ATOM 0 HG LEU A 27 156.355 0.978 9.035 1.00 0.00 H new ATOM 0 HD11 LEU A 27 157.798 -0.193 7.377 1.00 0.00 H new ATOM 0 HD12 LEU A 27 156.387 -1.188 7.811 1.00 0.00 H new ATOM 0 HD13 LEU A 27 156.416 -0.312 6.262 1.00 0.00 H new ATOM 0 HD21 LEU A 27 157.614 2.307 7.350 1.00 0.00 H new ATOM 0 HD22 LEU A 27 156.235 2.194 6.231 1.00 0.00 H new ATOM 0 HD23 LEU A 27 156.070 3.092 7.758 1.00 0.00 H new ATOM 409 N GLN A 28 151.570 1.019 8.791 1.00 0.00 N ATOM 410 CA GLN A 28 150.133 1.190 8.446 1.00 0.00 C ATOM 411 C GLN A 28 149.476 2.126 9.454 1.00 0.00 C ATOM 412 O GLN A 28 148.486 2.775 9.145 1.00 0.00 O ATOM 413 CB GLN A 28 149.320 -0.150 8.350 1.00 0.00 C ATOM 414 CG GLN A 28 150.080 -1.373 8.883 1.00 0.00 C ATOM 415 CD GLN A 28 150.799 -2.064 7.772 1.00 0.00 C ATOM 416 OE1 GLN A 28 151.877 -1.570 7.343 1.00 0.00 O flip ATOM 417 NE2 GLN A 28 150.367 -3.076 7.285 1.00 0.00 N flip ATOM 0 H GLN A 28 151.810 0.147 9.263 1.00 0.00 H new ATOM 0 HA GLN A 28 150.112 1.617 7.443 1.00 0.00 H new ATOM 0 HB2 GLN A 28 148.389 -0.041 8.907 1.00 0.00 H new ATOM 0 HB3 GLN A 28 149.050 -0.327 7.309 1.00 0.00 H new ATOM 0 HG2 GLN A 28 150.792 -1.062 9.647 1.00 0.00 H new ATOM 0 HG3 GLN A 28 149.383 -2.063 9.359 1.00 0.00 H new ATOM 0 HE21 GLN A 28 149.495 -3.477 7.631 1.00 0.00 H new ATOM 0 HE22 GLN A 28 150.873 -3.533 6.526 1.00 0.00 H new ATOM 426 N ASN A 29 149.967 2.169 10.663 1.00 0.00 N ATOM 427 CA ASN A 29 149.311 3.003 11.711 1.00 0.00 C ATOM 428 C ASN A 29 149.669 4.475 11.520 1.00 0.00 C ATOM 429 O ASN A 29 149.127 5.332 12.179 1.00 0.00 O ATOM 430 CB ASN A 29 149.745 2.542 13.096 1.00 0.00 C ATOM 431 CG ASN A 29 149.165 1.168 13.406 1.00 0.00 C ATOM 432 OD1 ASN A 29 148.115 0.803 12.893 1.00 0.00 O ATOM 433 ND2 ASN A 29 149.783 0.385 14.226 1.00 0.00 N ATOM 0 H ASN A 29 150.796 1.661 10.971 1.00 0.00 H new ATOM 0 HA ASN A 29 148.231 2.888 11.619 1.00 0.00 H new ATOM 0 HB2 ASN A 29 150.833 2.505 13.149 1.00 0.00 H new ATOM 0 HB3 ASN A 29 149.414 3.261 13.846 1.00 0.00 H new ATOM 0 HD21 ASN A 29 149.396 -0.533 14.444 1.00 0.00 H new ATOM 0 HD22 ASN A 29 150.658 0.685 14.656 1.00 0.00 H new ATOM 440 N MET A 30 150.543 4.783 10.606 1.00 0.00 N ATOM 441 CA MET A 30 150.888 6.195 10.351 1.00 0.00 C ATOM 442 C MET A 30 149.915 6.724 9.319 1.00 0.00 C ATOM 443 O MET A 30 149.303 5.956 8.598 1.00 0.00 O ATOM 444 CB MET A 30 152.310 6.281 9.753 1.00 0.00 C ATOM 445 CG MET A 30 153.360 5.896 10.803 1.00 0.00 C ATOM 446 SD MET A 30 154.659 7.158 10.842 1.00 0.00 S ATOM 447 CE MET A 30 155.429 6.761 9.247 1.00 0.00 C ATOM 0 H MET A 30 151.035 4.106 10.022 1.00 0.00 H new ATOM 0 HA MET A 30 150.843 6.766 11.278 1.00 0.00 H new ATOM 0 HB2 MET A 30 152.389 5.618 8.891 1.00 0.00 H new ATOM 0 HB3 MET A 30 152.500 7.293 9.395 1.00 0.00 H new ATOM 0 HG2 MET A 30 152.894 5.807 11.784 1.00 0.00 H new ATOM 0 HG3 MET A 30 153.789 4.923 10.565 1.00 0.00 H new ATOM 0 HE1 MET A 30 156.514 6.797 9.348 1.00 0.00 H new ATOM 0 HE2 MET A 30 155.126 5.761 8.936 1.00 0.00 H new ATOM 0 HE3 MET A 30 155.110 7.486 8.498 1.00 0.00 H new ATOM 457 N SER A 31 149.800 7.990 9.180 1.00 0.00 N ATOM 458 CA SER A 31 148.896 8.517 8.130 1.00 0.00 C ATOM 459 C SER A 31 149.711 8.639 6.852 1.00 0.00 C ATOM 460 O SER A 31 150.869 9.049 6.872 1.00 0.00 O ATOM 461 CB SER A 31 148.364 9.886 8.541 1.00 0.00 C ATOM 462 OG SER A 31 148.295 9.943 9.971 1.00 0.00 O ATOM 0 H SER A 31 150.285 8.692 9.739 1.00 0.00 H new ATOM 0 HA SER A 31 148.045 7.852 7.983 1.00 0.00 H new ATOM 0 HB2 SER A 31 149.016 10.674 8.163 1.00 0.00 H new ATOM 0 HB3 SER A 31 147.378 10.053 8.108 1.00 0.00 H new ATOM 0 HG SER A 31 147.956 10.820 10.247 1.00 0.00 H new ATOM 468 N LYS A 32 149.152 8.192 5.766 1.00 0.00 N ATOM 469 CA LYS A 32 149.851 8.172 4.441 1.00 0.00 C ATOM 470 C LYS A 32 150.694 9.433 4.279 1.00 0.00 C ATOM 471 O LYS A 32 151.811 9.390 3.810 1.00 0.00 O ATOM 472 CB LYS A 32 148.782 8.131 3.327 1.00 0.00 C ATOM 473 CG LYS A 32 149.217 7.224 2.160 1.00 0.00 C ATOM 474 CD LYS A 32 148.990 7.957 0.820 1.00 0.00 C ATOM 475 CE LYS A 32 148.780 6.933 -0.312 1.00 0.00 C ATOM 476 NZ LYS A 32 147.446 7.091 -0.927 1.00 0.00 N ATOM 0 H LYS A 32 148.201 7.824 5.736 1.00 0.00 H new ATOM 0 HA LYS A 32 150.501 7.299 4.380 1.00 0.00 H new ATOM 0 HB2 LYS A 32 147.840 7.769 3.739 1.00 0.00 H new ATOM 0 HB3 LYS A 32 148.602 9.140 2.957 1.00 0.00 H new ATOM 0 HG2 LYS A 32 150.268 6.957 2.266 1.00 0.00 H new ATOM 0 HG3 LYS A 32 148.649 6.294 2.178 1.00 0.00 H new ATOM 0 HD2 LYS A 32 148.121 8.610 0.896 1.00 0.00 H new ATOM 0 HD3 LYS A 32 149.847 8.591 0.593 1.00 0.00 H new ATOM 0 HE2 LYS A 32 149.552 7.061 -1.071 1.00 0.00 H new ATOM 0 HE3 LYS A 32 148.885 5.922 0.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 147.233 6.258 -1.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 146.728 7.183 -0.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 147.437 7.944 -1.522 1.00 0.00 H new ATOM 490 N GLN A 33 150.158 10.530 4.651 1.00 0.00 N ATOM 491 CA GLN A 33 150.850 11.829 4.487 1.00 0.00 C ATOM 492 C GLN A 33 152.214 11.823 5.205 1.00 0.00 C ATOM 493 O GLN A 33 153.193 12.366 4.705 1.00 0.00 O ATOM 494 CB GLN A 33 149.957 12.929 5.065 1.00 0.00 C ATOM 495 CG GLN A 33 148.571 12.936 4.361 1.00 0.00 C ATOM 496 CD GLN A 33 147.658 11.853 4.959 1.00 0.00 C ATOM 497 OE1 GLN A 33 148.072 11.101 5.830 1.00 0.00 O ATOM 498 NE2 GLN A 33 146.451 11.721 4.525 1.00 0.00 N ATOM 0 H GLN A 33 149.235 10.596 5.079 1.00 0.00 H new ATOM 0 HA GLN A 33 151.034 12.009 3.428 1.00 0.00 H new ATOM 0 HB2 GLN A 33 149.826 12.773 6.136 1.00 0.00 H new ATOM 0 HB3 GLN A 33 150.439 13.899 4.941 1.00 0.00 H new ATOM 0 HG2 GLN A 33 148.105 13.915 4.472 1.00 0.00 H new ATOM 0 HG3 GLN A 33 148.698 12.763 3.292 1.00 0.00 H new ATOM 0 HE21 GLN A 33 146.099 12.345 3.799 1.00 0.00 H new ATOM 0 HE22 GLN A 33 145.848 10.993 4.908 1.00 0.00 H new ATOM 507 N GLU A 34 152.287 11.228 6.357 1.00 0.00 N ATOM 508 CA GLU A 34 153.575 11.221 7.118 1.00 0.00 C ATOM 509 C GLU A 34 154.568 10.304 6.419 1.00 0.00 C ATOM 510 O GLU A 34 155.729 10.647 6.241 1.00 0.00 O ATOM 511 CB GLU A 34 153.332 10.751 8.561 1.00 0.00 C ATOM 512 CG GLU A 34 152.040 11.390 9.110 1.00 0.00 C ATOM 513 CD GLU A 34 152.171 12.905 9.083 1.00 0.00 C ATOM 514 OE1 GLU A 34 152.790 13.438 9.963 1.00 0.00 O ATOM 515 OE2 GLU A 34 151.642 13.514 8.198 1.00 0.00 O ATOM 0 H GLU A 34 151.513 10.743 6.811 1.00 0.00 H new ATOM 0 HA GLU A 34 153.984 12.231 7.151 1.00 0.00 H new ATOM 0 HB2 GLU A 34 153.252 9.664 8.590 1.00 0.00 H new ATOM 0 HB3 GLU A 34 154.179 11.025 9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 34 151.185 11.078 8.511 1.00 0.00 H new ATOM 0 HG3 GLU A 34 151.857 11.048 10.129 1.00 0.00 H new ATOM 522 N LEU A 35 154.126 9.155 6.003 1.00 0.00 N ATOM 523 CA LEU A 35 155.020 8.221 5.263 1.00 0.00 C ATOM 524 C LEU A 35 155.556 8.970 4.043 1.00 0.00 C ATOM 525 O LEU A 35 156.735 9.013 3.760 1.00 0.00 O ATOM 526 CB LEU A 35 154.178 7.032 4.773 1.00 0.00 C ATOM 527 CG LEU A 35 153.573 6.271 5.978 1.00 0.00 C ATOM 528 CD1 LEU A 35 152.136 5.852 5.679 1.00 0.00 C ATOM 529 CD2 LEU A 35 154.403 5.025 6.264 1.00 0.00 C ATOM 0 H LEU A 35 153.174 8.817 6.144 1.00 0.00 H new ATOM 0 HA LEU A 35 155.835 7.870 5.897 1.00 0.00 H new ATOM 0 HB2 LEU A 35 153.380 7.387 4.120 1.00 0.00 H new ATOM 0 HB3 LEU A 35 154.798 6.358 4.182 1.00 0.00 H new ATOM 0 HG LEU A 35 153.580 6.932 6.844 1.00 0.00 H new ATOM 0 HD11 LEU A 35 151.727 5.318 6.537 1.00 0.00 H new ATOM 0 HD12 LEU A 35 151.532 6.738 5.481 1.00 0.00 H new ATOM 0 HD13 LEU A 35 152.121 5.200 4.806 1.00 0.00 H new ATOM 0 HD21 LEU A 35 153.976 4.490 7.112 1.00 0.00 H new ATOM 0 HD22 LEU A 35 154.400 4.377 5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 35 155.427 5.316 6.497 1.00 0.00 H new ATOM 541 N ILE A 36 154.688 9.641 3.384 1.00 0.00 N ATOM 542 CA ILE A 36 155.088 10.445 2.212 1.00 0.00 C ATOM 543 C ILE A 36 156.193 11.448 2.624 1.00 0.00 C ATOM 544 O ILE A 36 157.183 11.594 1.937 1.00 0.00 O ATOM 545 CB ILE A 36 153.840 11.120 1.654 1.00 0.00 C ATOM 546 CG1 ILE A 36 152.877 10.030 1.169 1.00 0.00 C ATOM 547 CG2 ILE A 36 154.181 12.025 0.483 1.00 0.00 C ATOM 548 CD1 ILE A 36 151.504 10.624 0.943 1.00 0.00 C ATOM 0 H ILE A 36 153.693 9.673 3.606 1.00 0.00 H new ATOM 0 HA ILE A 36 155.515 9.825 1.424 1.00 0.00 H new ATOM 0 HB ILE A 36 153.388 11.727 2.439 1.00 0.00 H new ATOM 0 HG12 ILE A 36 153.249 9.588 0.245 1.00 0.00 H new ATOM 0 HG13 ILE A 36 152.820 9.228 1.905 1.00 0.00 H new ATOM 0 HG21 ILE A 36 153.271 12.492 0.107 1.00 0.00 H new ATOM 0 HG22 ILE A 36 154.876 12.798 0.811 1.00 0.00 H new ATOM 0 HG23 ILE A 36 154.641 11.436 -0.310 1.00 0.00 H new ATOM 0 HD11 ILE A 36 150.823 9.846 0.598 1.00 0.00 H new ATOM 0 HD12 ILE A 36 151.131 11.045 1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 36 151.567 11.410 0.191 1.00 0.00 H new ATOM 560 N LYS A 37 156.034 12.127 3.715 1.00 0.00 N ATOM 561 CA LYS A 37 157.076 13.090 4.150 1.00 0.00 C ATOM 562 C LYS A 37 158.418 12.357 4.332 1.00 0.00 C ATOM 563 O LYS A 37 159.454 12.736 3.751 1.00 0.00 O ATOM 564 CB LYS A 37 156.646 13.697 5.478 1.00 0.00 C ATOM 565 CG LYS A 37 155.614 14.813 5.247 1.00 0.00 C ATOM 566 CD LYS A 37 156.263 16.201 5.447 1.00 0.00 C ATOM 567 CE LYS A 37 155.265 17.168 6.124 1.00 0.00 C ATOM 568 NZ LYS A 37 154.711 16.548 7.347 1.00 0.00 N ATOM 0 H LYS A 37 155.223 12.058 4.330 1.00 0.00 H new ATOM 0 HA LYS A 37 157.198 13.871 3.400 1.00 0.00 H new ATOM 0 HB2 LYS A 37 156.219 12.924 6.117 1.00 0.00 H new ATOM 0 HB3 LYS A 37 157.515 14.098 6.000 1.00 0.00 H new ATOM 0 HG2 LYS A 37 155.207 14.737 4.239 1.00 0.00 H new ATOM 0 HG3 LYS A 37 154.779 14.693 5.937 1.00 0.00 H new ATOM 0 HD2 LYS A 37 157.160 16.106 6.059 1.00 0.00 H new ATOM 0 HD3 LYS A 37 156.576 16.606 4.484 1.00 0.00 H new ATOM 0 HE2 LYS A 37 155.765 18.103 6.375 1.00 0.00 H new ATOM 0 HE3 LYS A 37 154.458 17.414 5.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 154.637 17.265 8.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 153.767 16.162 7.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 155.338 15.781 7.662 1.00 0.00 H new ATOM 582 N GLU A 38 158.420 11.300 5.100 1.00 0.00 N ATOM 583 CA GLU A 38 159.692 10.578 5.299 1.00 0.00 C ATOM 584 C GLU A 38 160.184 10.043 3.974 1.00 0.00 C ATOM 585 O GLU A 38 161.356 10.067 3.718 1.00 0.00 O ATOM 586 CB GLU A 38 159.578 9.472 6.351 1.00 0.00 C ATOM 587 CG GLU A 38 158.416 8.538 6.040 1.00 0.00 C ATOM 588 CD GLU A 38 158.360 7.420 7.059 1.00 0.00 C ATOM 589 OE1 GLU A 38 158.776 7.636 8.174 1.00 0.00 O ATOM 590 OE2 GLU A 38 157.908 6.381 6.728 1.00 0.00 O ATOM 0 H GLU A 38 157.609 10.917 5.586 1.00 0.00 H new ATOM 0 HA GLU A 38 160.426 11.284 5.689 1.00 0.00 H new ATOM 0 HB2 GLU A 38 160.507 8.903 6.387 1.00 0.00 H new ATOM 0 HB3 GLU A 38 159.438 9.916 7.337 1.00 0.00 H new ATOM 0 HG2 GLU A 38 157.479 9.095 6.048 1.00 0.00 H new ATOM 0 HG3 GLU A 38 158.531 8.123 5.039 1.00 0.00 H new ATOM 597 N TYR A 39 159.305 9.642 3.080 1.00 0.00 N ATOM 598 CA TYR A 39 159.780 9.218 1.729 1.00 0.00 C ATOM 599 C TYR A 39 160.687 10.259 1.144 1.00 0.00 C ATOM 600 O TYR A 39 161.717 9.948 0.611 1.00 0.00 O ATOM 601 CB TYR A 39 158.619 9.030 0.755 1.00 0.00 C ATOM 602 CG TYR A 39 158.134 7.620 0.744 1.00 0.00 C ATOM 603 CD1 TYR A 39 158.942 6.628 0.183 1.00 0.00 C ATOM 604 CD2 TYR A 39 156.871 7.301 1.222 1.00 0.00 C ATOM 605 CE1 TYR A 39 158.487 5.329 0.118 1.00 0.00 C ATOM 606 CE2 TYR A 39 156.411 6.006 1.140 1.00 0.00 C ATOM 607 CZ TYR A 39 157.217 5.019 0.591 1.00 0.00 C ATOM 608 OH TYR A 39 156.752 3.755 0.485 1.00 0.00 O ATOM 0 H TYR A 39 158.297 9.592 3.228 1.00 0.00 H new ATOM 0 HA TYR A 39 160.304 8.272 1.866 1.00 0.00 H new ATOM 0 HB2 TYR A 39 157.800 9.695 1.031 1.00 0.00 H new ATOM 0 HB3 TYR A 39 158.936 9.314 -0.249 1.00 0.00 H new ATOM 0 HD1 TYR A 39 159.921 6.879 -0.199 1.00 0.00 H new ATOM 0 HD2 TYR A 39 156.249 8.068 1.658 1.00 0.00 H new ATOM 0 HE1 TYR A 39 159.114 4.555 -0.299 1.00 0.00 H new ATOM 0 HE2 TYR A 39 155.424 5.759 1.502 1.00 0.00 H new ATOM 0 HH TYR A 39 156.675 3.359 1.378 1.00 0.00 H new ATOM 618 N LEU A 40 160.307 11.487 1.199 1.00 0.00 N ATOM 619 CA LEU A 40 161.147 12.534 0.572 1.00 0.00 C ATOM 620 C LEU A 40 162.498 12.581 1.257 1.00 0.00 C ATOM 621 O LEU A 40 163.526 12.749 0.608 1.00 0.00 O ATOM 622 CB LEU A 40 160.427 13.882 0.645 1.00 0.00 C ATOM 623 CG LEU A 40 158.965 13.697 0.171 1.00 0.00 C ATOM 624 CD1 LEU A 40 158.280 15.041 0.027 1.00 0.00 C ATOM 625 CD2 LEU A 40 158.920 12.958 -1.176 1.00 0.00 C ATOM 0 H LEU A 40 159.454 11.819 1.649 1.00 0.00 H new ATOM 0 HA LEU A 40 161.313 12.300 -0.479 1.00 0.00 H new ATOM 0 HB2 LEU A 40 160.447 14.265 1.665 1.00 0.00 H new ATOM 0 HB3 LEU A 40 160.936 14.615 0.019 1.00 0.00 H new ATOM 0 HG LEU A 40 158.442 13.104 0.922 1.00 0.00 H new ATOM 0 HD11 LEU A 40 157.253 14.892 -0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 40 158.278 15.553 0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 40 158.815 15.646 -0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 40 157.883 12.838 -1.491 1.00 0.00 H new ATOM 0 HD22 LEU A 40 159.463 13.534 -1.925 1.00 0.00 H new ATOM 0 HD23 LEU A 40 159.382 11.977 -1.068 1.00 0.00 H new ATOM 637 N GLU A 41 162.529 12.408 2.537 1.00 0.00 N ATOM 638 CA GLU A 41 163.849 12.399 3.241 1.00 0.00 C ATOM 639 C GLU A 41 164.567 11.067 2.919 1.00 0.00 C ATOM 640 O GLU A 41 165.664 11.036 2.352 1.00 0.00 O ATOM 641 CB GLU A 41 163.608 12.521 4.755 1.00 0.00 C ATOM 642 CG GLU A 41 162.576 13.635 5.028 1.00 0.00 C ATOM 643 CD GLU A 41 162.916 14.328 6.313 1.00 0.00 C ATOM 644 OE1 GLU A 41 163.683 15.232 6.279 1.00 0.00 O ATOM 645 OE2 GLU A 41 162.418 13.942 7.316 1.00 0.00 O ATOM 0 H GLU A 41 161.712 12.273 3.132 1.00 0.00 H new ATOM 0 HA GLU A 41 164.468 13.234 2.912 1.00 0.00 H new ATOM 0 HB2 GLU A 41 163.248 11.573 5.153 1.00 0.00 H new ATOM 0 HB3 GLU A 41 164.544 12.746 5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 41 162.572 14.351 4.206 1.00 0.00 H new ATOM 0 HG3 GLU A 41 161.574 13.211 5.086 1.00 0.00 H new ATOM 652 N LEU A 42 163.942 9.988 3.283 1.00 0.00 N ATOM 653 CA LEU A 42 164.470 8.612 3.062 1.00 0.00 C ATOM 654 C LEU A 42 164.948 8.475 1.614 1.00 0.00 C ATOM 655 O LEU A 42 166.095 8.126 1.351 1.00 0.00 O ATOM 656 CB LEU A 42 163.312 7.611 3.318 1.00 0.00 C ATOM 657 CG LEU A 42 163.833 6.264 3.852 1.00 0.00 C ATOM 658 CD1 LEU A 42 164.889 5.685 2.923 1.00 0.00 C ATOM 659 CD2 LEU A 42 164.420 6.444 5.252 1.00 0.00 C ATOM 0 H LEU A 42 163.036 10.004 3.751 1.00 0.00 H new ATOM 0 HA LEU A 42 165.306 8.412 3.733 1.00 0.00 H new ATOM 0 HB2 LEU A 42 162.611 8.040 4.034 1.00 0.00 H new ATOM 0 HB3 LEU A 42 162.761 7.447 2.392 1.00 0.00 H new ATOM 0 HG LEU A 42 162.994 5.570 3.899 1.00 0.00 H new ATOM 0 HD11 LEU A 42 165.242 4.734 3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 42 164.457 5.527 1.935 1.00 0.00 H new ATOM 0 HD13 LEU A 42 165.726 6.379 2.846 1.00 0.00 H new ATOM 0 HD21 LEU A 42 164.785 5.485 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 42 165.245 7.155 5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 42 163.649 6.820 5.924 1.00 0.00 H new ATOM 671 N GLU A 43 164.078 8.722 0.677 1.00 0.00 N ATOM 672 CA GLU A 43 164.458 8.593 -0.758 1.00 0.00 C ATOM 673 C GLU A 43 165.688 9.419 -1.007 1.00 0.00 C ATOM 674 O GLU A 43 166.644 8.951 -1.558 1.00 0.00 O ATOM 675 CB GLU A 43 163.343 9.107 -1.672 1.00 0.00 C ATOM 676 CG GLU A 43 162.356 7.980 -2.013 1.00 0.00 C ATOM 677 CD GLU A 43 162.178 7.944 -3.513 1.00 0.00 C ATOM 678 OE1 GLU A 43 161.616 8.880 -4.042 1.00 0.00 O ATOM 679 OE2 GLU A 43 162.637 7.014 -4.118 1.00 0.00 O ATOM 0 H GLU A 43 163.114 9.010 0.843 1.00 0.00 H new ATOM 0 HA GLU A 43 164.637 7.540 -0.975 1.00 0.00 H new ATOM 0 HB2 GLU A 43 162.814 9.925 -1.183 1.00 0.00 H new ATOM 0 HB3 GLU A 43 163.774 9.509 -2.589 1.00 0.00 H new ATOM 0 HG2 GLU A 43 162.733 7.023 -1.652 1.00 0.00 H new ATOM 0 HG3 GLU A 43 161.399 8.152 -1.521 1.00 0.00 H new ATOM 686 N LYS A 44 165.660 10.665 -0.660 1.00 0.00 N ATOM 687 CA LYS A 44 166.828 11.511 -0.931 1.00 0.00 C ATOM 688 C LYS A 44 168.043 10.919 -0.228 1.00 0.00 C ATOM 689 O LYS A 44 169.127 10.883 -0.786 1.00 0.00 O ATOM 690 CB LYS A 44 166.550 12.931 -0.458 1.00 0.00 C ATOM 691 CG LYS A 44 165.547 13.609 -1.417 1.00 0.00 C ATOM 692 CD LYS A 44 166.234 13.955 -2.756 1.00 0.00 C ATOM 693 CE LYS A 44 165.168 14.279 -3.823 1.00 0.00 C ATOM 694 NZ LYS A 44 164.248 13.123 -3.986 1.00 0.00 N ATOM 0 H LYS A 44 164.877 11.130 -0.201 1.00 0.00 H new ATOM 0 HA LYS A 44 167.031 11.547 -2.001 1.00 0.00 H new ATOM 0 HB2 LYS A 44 166.147 12.916 0.555 1.00 0.00 H new ATOM 0 HB3 LYS A 44 167.478 13.502 -0.423 1.00 0.00 H new ATOM 0 HG2 LYS A 44 164.700 12.947 -1.596 1.00 0.00 H new ATOM 0 HG3 LYS A 44 165.151 14.515 -0.959 1.00 0.00 H new ATOM 0 HD2 LYS A 44 166.900 14.808 -2.624 1.00 0.00 H new ATOM 0 HD3 LYS A 44 166.849 13.118 -3.086 1.00 0.00 H new ATOM 0 HE2 LYS A 44 164.605 15.165 -3.530 1.00 0.00 H new ATOM 0 HE3 LYS A 44 165.650 14.508 -4.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 163.892 13.098 -4.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 164.759 12.241 -3.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 163.448 13.220 -3.328 1.00 0.00 H new ATOM 708 N CYS A 45 167.861 10.369 0.946 1.00 0.00 N ATOM 709 CA CYS A 45 169.000 9.708 1.637 1.00 0.00 C ATOM 710 C CYS A 45 169.503 8.585 0.743 1.00 0.00 C ATOM 711 O CYS A 45 170.656 8.563 0.349 1.00 0.00 O ATOM 712 CB CYS A 45 168.537 9.120 2.984 1.00 0.00 C ATOM 713 SG CYS A 45 168.731 10.340 4.303 1.00 0.00 S ATOM 0 H CYS A 45 166.975 10.351 1.451 1.00 0.00 H new ATOM 0 HA CYS A 45 169.790 10.434 1.829 1.00 0.00 H new ATOM 0 HB2 CYS A 45 167.494 8.813 2.915 1.00 0.00 H new ATOM 0 HB3 CYS A 45 169.117 8.227 3.217 1.00 0.00 H new ATOM 0 HG CYS A 45 168.334 9.828 5.430 1.00 0.00 H new ATOM 719 N LEU A 46 168.657 7.635 0.438 1.00 0.00 N ATOM 720 CA LEU A 46 169.113 6.494 -0.412 1.00 0.00 C ATOM 721 C LEU A 46 169.616 7.021 -1.747 1.00 0.00 C ATOM 722 O LEU A 46 170.555 6.535 -2.271 1.00 0.00 O ATOM 723 CB LEU A 46 167.987 5.455 -0.630 1.00 0.00 C ATOM 724 CG LEU A 46 168.604 4.111 -1.122 1.00 0.00 C ATOM 725 CD1 LEU A 46 169.460 3.485 -0.037 1.00 0.00 C ATOM 726 CD2 LEU A 46 167.508 3.114 -1.472 1.00 0.00 C ATOM 0 H LEU A 46 167.682 7.599 0.736 1.00 0.00 H new ATOM 0 HA LEU A 46 169.925 5.986 0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 46 167.439 5.297 0.299 1.00 0.00 H new ATOM 0 HB3 LEU A 46 167.271 5.828 -1.362 1.00 0.00 H new ATOM 0 HG LEU A 46 169.209 4.336 -2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 46 169.881 2.548 -0.401 1.00 0.00 H new ATOM 0 HD12 LEU A 46 170.268 4.167 0.228 1.00 0.00 H new ATOM 0 HD13 LEU A 46 168.847 3.290 0.843 1.00 0.00 H new ATOM 0 HD21 LEU A 46 167.959 2.182 -1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 46 166.898 2.920 -0.590 1.00 0.00 H new ATOM 0 HD23 LEU A 46 166.881 3.525 -2.264 1.00 0.00 H new ATOM 738 N SER A 47 169.014 8.030 -2.270 1.00 0.00 N ATOM 739 CA SER A 47 169.475 8.586 -3.564 1.00 0.00 C ATOM 740 C SER A 47 170.895 9.121 -3.399 1.00 0.00 C ATOM 741 O SER A 47 171.807 8.773 -4.149 1.00 0.00 O ATOM 742 CB SER A 47 168.539 9.714 -4.008 1.00 0.00 C ATOM 743 OG SER A 47 167.176 9.292 -3.853 1.00 0.00 O ATOM 0 H SER A 47 168.211 8.505 -1.857 1.00 0.00 H new ATOM 0 HA SER A 47 169.466 7.804 -4.323 1.00 0.00 H new ATOM 0 HB2 SER A 47 168.724 10.609 -3.414 1.00 0.00 H new ATOM 0 HB3 SER A 47 168.734 9.975 -5.048 1.00 0.00 H new ATOM 0 HG SER A 47 166.919 9.356 -2.909 1.00 0.00 H new ATOM 749 N ARG A 48 171.102 9.943 -2.421 1.00 0.00 N ATOM 750 CA ARG A 48 172.457 10.493 -2.186 1.00 0.00 C ATOM 751 C ARG A 48 173.391 9.342 -1.886 1.00 0.00 C ATOM 752 O ARG A 48 174.523 9.300 -2.355 1.00 0.00 O ATOM 753 CB ARG A 48 172.425 11.464 -0.995 1.00 0.00 C ATOM 754 CG ARG A 48 171.965 12.858 -1.460 1.00 0.00 C ATOM 755 CD ARG A 48 173.031 13.499 -2.384 1.00 0.00 C ATOM 756 NE ARG A 48 172.554 13.431 -3.809 1.00 0.00 N ATOM 757 CZ ARG A 48 173.233 12.805 -4.755 1.00 0.00 C ATOM 758 NH1 ARG A 48 174.369 12.213 -4.487 1.00 0.00 N ATOM 759 NH2 ARG A 48 172.767 12.773 -5.963 1.00 0.00 N ATOM 0 H ARG A 48 170.386 10.261 -1.768 1.00 0.00 H new ATOM 0 HA ARG A 48 172.801 11.035 -3.067 1.00 0.00 H new ATOM 0 HB2 ARG A 48 171.750 11.087 -0.227 1.00 0.00 H new ATOM 0 HB3 ARG A 48 173.415 11.531 -0.544 1.00 0.00 H new ATOM 0 HG2 ARG A 48 171.016 12.777 -1.991 1.00 0.00 H new ATOM 0 HG3 ARG A 48 171.792 13.498 -0.595 1.00 0.00 H new ATOM 0 HD2 ARG A 48 173.205 14.536 -2.095 1.00 0.00 H new ATOM 0 HD3 ARG A 48 173.982 12.976 -2.281 1.00 0.00 H new ATOM 0 HE ARG A 48 171.674 13.885 -4.055 1.00 0.00 H new ATOM 0 HH11 ARG A 48 174.742 12.231 -3.538 1.00 0.00 H new ATOM 0 HH12 ARG A 48 174.882 11.734 -5.227 1.00 0.00 H new ATOM 0 HH21 ARG A 48 171.881 13.229 -6.180 1.00 0.00 H new ATOM 0 HH22 ARG A 48 173.286 12.292 -6.697 1.00 0.00 H new ATOM 773 N MET A 49 172.954 8.423 -1.095 1.00 0.00 N ATOM 774 CA MET A 49 173.812 7.298 -0.746 1.00 0.00 C ATOM 775 C MET A 49 173.966 6.377 -1.945 1.00 0.00 C ATOM 776 O MET A 49 174.950 5.771 -2.091 1.00 0.00 O ATOM 777 CB MET A 49 173.230 6.552 0.459 1.00 0.00 C ATOM 778 CG MET A 49 173.465 7.409 1.718 1.00 0.00 C ATOM 779 SD MET A 49 172.369 6.891 3.054 1.00 0.00 S ATOM 780 CE MET A 49 173.066 5.243 3.318 1.00 0.00 C ATOM 0 H MET A 49 172.025 8.410 -0.673 1.00 0.00 H new ATOM 0 HA MET A 49 174.801 7.664 -0.470 1.00 0.00 H new ATOM 0 HB2 MET A 49 172.165 6.372 0.316 1.00 0.00 H new ATOM 0 HB3 MET A 49 173.706 5.578 0.569 1.00 0.00 H new ATOM 0 HG2 MET A 49 174.503 7.319 2.037 1.00 0.00 H new ATOM 0 HG3 MET A 49 173.293 8.460 1.486 1.00 0.00 H new ATOM 0 HE1 MET A 49 172.368 4.641 3.900 1.00 0.00 H new ATOM 0 HE2 MET A 49 173.243 4.764 2.355 1.00 0.00 H new ATOM 0 HE3 MET A 49 174.008 5.329 3.859 1.00 0.00 H new ATOM 790 N GLU A 50 173.061 6.379 -2.854 1.00 0.00 N ATOM 791 CA GLU A 50 173.226 5.547 -4.071 1.00 0.00 C ATOM 792 C GLU A 50 174.383 6.104 -4.883 1.00 0.00 C ATOM 793 O GLU A 50 175.258 5.376 -5.344 1.00 0.00 O ATOM 794 CB GLU A 50 171.944 5.583 -4.890 1.00 0.00 C ATOM 795 CG GLU A 50 170.971 4.465 -4.437 1.00 0.00 C ATOM 796 CD GLU A 50 170.432 3.736 -5.640 1.00 0.00 C ATOM 797 OE1 GLU A 50 171.204 3.162 -6.345 1.00 0.00 O ATOM 798 OE2 GLU A 50 169.258 3.766 -5.853 1.00 0.00 O ATOM 0 H GLU A 50 172.200 6.924 -2.815 1.00 0.00 H new ATOM 0 HA GLU A 50 173.435 4.513 -3.797 1.00 0.00 H new ATOM 0 HB2 GLU A 50 171.464 6.556 -4.780 1.00 0.00 H new ATOM 0 HB3 GLU A 50 172.179 5.461 -5.947 1.00 0.00 H new ATOM 0 HG2 GLU A 50 171.487 3.766 -3.779 1.00 0.00 H new ATOM 0 HG3 GLU A 50 170.150 4.896 -3.864 1.00 0.00 H new ATOM 805 N ASP A 51 174.417 7.394 -5.026 1.00 0.00 N ATOM 806 CA ASP A 51 175.504 8.048 -5.792 1.00 0.00 C ATOM 807 C ASP A 51 176.839 7.695 -5.165 1.00 0.00 C ATOM 808 O ASP A 51 177.756 7.204 -5.827 1.00 0.00 O ATOM 809 CB ASP A 51 175.307 9.573 -5.750 1.00 0.00 C ATOM 810 CG ASP A 51 174.449 10.063 -6.911 1.00 0.00 C ATOM 811 OD1 ASP A 51 173.887 9.261 -7.624 1.00 0.00 O ATOM 812 OD2 ASP A 51 174.359 11.249 -7.063 1.00 0.00 O ATOM 0 H ASP A 51 173.724 8.034 -4.637 1.00 0.00 H new ATOM 0 HA ASP A 51 175.484 7.705 -6.827 1.00 0.00 H new ATOM 0 HB2 ASP A 51 174.838 9.853 -4.807 1.00 0.00 H new ATOM 0 HB3 ASP A 51 176.278 10.066 -5.782 1.00 0.00 H new ATOM 817 N GLU A 52 176.983 7.980 -3.913 1.00 0.00 N ATOM 818 CA GLU A 52 178.263 7.697 -3.237 1.00 0.00 C ATOM 819 C GLU A 52 178.456 6.197 -3.131 1.00 0.00 C ATOM 820 O GLU A 52 179.532 5.723 -3.252 1.00 0.00 O ATOM 821 CB GLU A 52 178.285 8.323 -1.834 1.00 0.00 C ATOM 822 CG GLU A 52 178.986 9.686 -1.883 1.00 0.00 C ATOM 823 CD GLU A 52 178.886 10.342 -0.537 1.00 0.00 C ATOM 824 OE1 GLU A 52 179.686 10.022 0.319 1.00 0.00 O ATOM 825 OE2 GLU A 52 177.998 11.135 -0.355 1.00 0.00 O ATOM 0 H GLU A 52 176.264 8.400 -3.324 1.00 0.00 H new ATOM 0 HA GLU A 52 179.073 8.132 -3.822 1.00 0.00 H new ATOM 0 HB2 GLU A 52 177.267 8.441 -1.463 1.00 0.00 H new ATOM 0 HB3 GLU A 52 178.803 7.662 -1.139 1.00 0.00 H new ATOM 0 HG2 GLU A 52 180.032 9.560 -2.163 1.00 0.00 H new ATOM 0 HG3 GLU A 52 178.526 10.317 -2.643 1.00 0.00 H new ATOM 832 N ASN A 53 177.418 5.459 -2.873 1.00 0.00 N ATOM 833 CA ASN A 53 177.552 3.981 -2.710 1.00 0.00 C ATOM 834 C ASN A 53 178.194 3.428 -3.936 1.00 0.00 C ATOM 835 O ASN A 53 179.141 2.661 -3.866 1.00 0.00 O ATOM 836 CB ASN A 53 176.167 3.344 -2.534 1.00 0.00 C ATOM 837 CG ASN A 53 175.829 3.312 -1.062 1.00 0.00 C ATOM 838 OD1 ASN A 53 175.826 4.410 -0.402 1.00 0.00 O flip ATOM 839 ND2 ASN A 53 175.569 2.265 -0.502 1.00 0.00 N flip ATOM 0 H ASN A 53 176.469 5.817 -2.766 1.00 0.00 H new ATOM 0 HA ASN A 53 178.157 3.762 -1.830 1.00 0.00 H new ATOM 0 HB2 ASN A 53 175.417 3.915 -3.081 1.00 0.00 H new ATOM 0 HB3 ASN A 53 176.161 2.334 -2.945 1.00 0.00 H new ATOM 0 HD21 ASN A 53 175.571 1.391 -1.028 1.00 0.00 H new ATOM 0 HD22 ASN A 53 175.348 2.260 0.494 1.00 0.00 H new ATOM 846 N ASN A 54 177.704 3.837 -5.068 1.00 0.00 N ATOM 847 CA ASN A 54 178.271 3.383 -6.351 1.00 0.00 C ATOM 848 C ASN A 54 179.748 3.669 -6.353 1.00 0.00 C ATOM 849 O ASN A 54 180.565 2.778 -6.429 1.00 0.00 O ATOM 850 CB ASN A 54 177.646 4.180 -7.488 1.00 0.00 C ATOM 851 CG ASN A 54 176.320 3.584 -7.918 1.00 0.00 C ATOM 852 OD1 ASN A 54 175.895 2.540 -7.438 1.00 0.00 O ATOM 853 ND2 ASN A 54 175.654 4.184 -8.818 1.00 0.00 N ATOM 0 H ASN A 54 176.917 4.481 -5.154 1.00 0.00 H new ATOM 0 HA ASN A 54 178.076 2.318 -6.478 1.00 0.00 H new ATOM 0 HB2 ASN A 54 177.497 5.212 -7.172 1.00 0.00 H new ATOM 0 HB3 ASN A 54 178.329 4.202 -8.337 1.00 0.00 H new ATOM 0 HD21 ASN A 54 174.767 3.796 -9.140 1.00 0.00 H new ATOM 0 HD22 ASN A 54 176.006 5.053 -9.219 1.00 0.00 H new ATOM 860 N ARG A 55 180.106 4.917 -6.282 1.00 0.00 N ATOM 861 CA ARG A 55 181.539 5.270 -6.313 1.00 0.00 C ATOM 862 C ARG A 55 182.252 4.576 -5.166 1.00 0.00 C ATOM 863 O ARG A 55 183.097 3.756 -5.382 1.00 0.00 O ATOM 864 CB ARG A 55 181.704 6.794 -6.214 1.00 0.00 C ATOM 865 CG ARG A 55 180.857 7.499 -7.297 1.00 0.00 C ATOM 866 CD ARG A 55 181.252 7.027 -8.721 1.00 0.00 C ATOM 867 NE ARG A 55 181.896 8.147 -9.474 1.00 0.00 N ATOM 868 CZ ARG A 55 181.182 9.133 -9.976 1.00 0.00 C ATOM 869 NH1 ARG A 55 179.896 9.185 -9.758 1.00 0.00 N ATOM 870 NH2 ARG A 55 181.766 10.067 -10.665 1.00 0.00 N ATOM 0 H ARG A 55 179.464 5.706 -6.204 1.00 0.00 H new ATOM 0 HA ARG A 55 181.979 4.939 -7.253 1.00 0.00 H new ATOM 0 HB2 ARG A 55 181.399 7.136 -5.225 1.00 0.00 H new ATOM 0 HB3 ARG A 55 182.754 7.061 -6.333 1.00 0.00 H new ATOM 0 HG2 ARG A 55 179.800 7.295 -7.125 1.00 0.00 H new ATOM 0 HG3 ARG A 55 180.990 8.578 -7.220 1.00 0.00 H new ATOM 0 HD2 ARG A 55 181.937 6.182 -8.655 1.00 0.00 H new ATOM 0 HD3 ARG A 55 180.368 6.680 -9.256 1.00 0.00 H new ATOM 0 HE ARG A 55 182.908 8.147 -9.601 1.00 0.00 H new ATOM 0 HH11 ARG A 55 179.444 8.462 -9.199 1.00 0.00 H new ATOM 0 HH12 ARG A 55 179.343 9.949 -10.147 1.00 0.00 H new ATOM 0 HH21 ARG A 55 182.774 10.035 -10.816 1.00 0.00 H new ATOM 0 HH22 ARG A 55 181.216 10.832 -11.055 1.00 0.00 H new ATOM 884 N LEU A 56 181.890 4.885 -3.967 1.00 0.00 N ATOM 885 CA LEU A 56 182.515 4.280 -2.758 1.00 0.00 C ATOM 886 C LEU A 56 182.901 2.848 -2.995 1.00 0.00 C ATOM 887 O LEU A 56 184.053 2.474 -2.852 1.00 0.00 O ATOM 888 CB LEU A 56 181.469 4.259 -1.629 1.00 0.00 C ATOM 889 CG LEU A 56 181.481 5.586 -0.863 1.00 0.00 C ATOM 890 CD1 LEU A 56 180.305 5.605 0.109 1.00 0.00 C ATOM 891 CD2 LEU A 56 182.794 5.724 -0.069 1.00 0.00 C ATOM 0 H LEU A 56 181.155 5.561 -3.759 1.00 0.00 H new ATOM 0 HA LEU A 56 183.399 4.868 -2.510 1.00 0.00 H new ATOM 0 HB2 LEU A 56 180.478 4.082 -2.047 1.00 0.00 H new ATOM 0 HB3 LEU A 56 181.679 3.436 -0.946 1.00 0.00 H new ATOM 0 HG LEU A 56 181.401 6.413 -1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 56 180.304 6.545 0.660 1.00 0.00 H new ATOM 0 HD12 LEU A 56 179.372 5.509 -0.447 1.00 0.00 H new ATOM 0 HD13 LEU A 56 180.398 4.775 0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 56 182.794 6.670 0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 56 182.879 4.900 0.640 1.00 0.00 H new ATOM 0 HD23 LEU A 56 183.639 5.700 -0.757 1.00 0.00 H new ATOM 903 N ARG A 57 181.930 2.022 -3.282 1.00 0.00 N ATOM 904 CA ARG A 57 182.181 0.578 -3.460 1.00 0.00 C ATOM 905 C ARG A 57 183.176 0.355 -4.579 1.00 0.00 C ATOM 906 O ARG A 57 183.940 -0.587 -4.530 1.00 0.00 O ATOM 907 CB ARG A 57 180.855 -0.164 -3.720 1.00 0.00 C ATOM 908 CG ARG A 57 179.972 -0.056 -2.453 1.00 0.00 C ATOM 909 CD ARG A 57 179.424 -1.438 -2.033 1.00 0.00 C ATOM 910 NE ARG A 57 178.241 -1.771 -2.886 1.00 0.00 N ATOM 911 CZ ARG A 57 177.158 -2.342 -2.374 1.00 0.00 C ATOM 912 NH1 ARG A 57 177.165 -2.811 -1.159 1.00 0.00 N ATOM 913 NH2 ARG A 57 176.095 -2.479 -3.103 1.00 0.00 N ATOM 0 H ARG A 57 180.956 2.302 -3.401 1.00 0.00 H new ATOM 0 HA ARG A 57 182.614 0.172 -2.546 1.00 0.00 H new ATOM 0 HB2 ARG A 57 180.341 0.270 -4.578 1.00 0.00 H new ATOM 0 HB3 ARG A 57 181.047 -1.210 -3.959 1.00 0.00 H new ATOM 0 HG2 ARG A 57 180.554 0.370 -1.636 1.00 0.00 H new ATOM 0 HG3 ARG A 57 179.142 0.625 -2.642 1.00 0.00 H new ATOM 0 HD2 ARG A 57 180.196 -2.199 -2.145 1.00 0.00 H new ATOM 0 HD3 ARG A 57 179.139 -1.426 -0.981 1.00 0.00 H new ATOM 0 HE ARG A 57 178.267 -1.555 -3.882 1.00 0.00 H new ATOM 0 HH11 ARG A 57 178.009 -2.741 -0.590 1.00 0.00 H new ATOM 0 HH12 ARG A 57 176.327 -3.248 -0.776 1.00 0.00 H new ATOM 0 HH21 ARG A 57 176.092 -2.148 -4.068 1.00 0.00 H new ATOM 0 HH22 ARG A 57 175.261 -2.918 -2.712 1.00 0.00 H new ATOM 927 N LEU A 58 183.208 1.201 -5.559 1.00 0.00 N ATOM 928 CA LEU A 58 184.186 1.043 -6.642 1.00 0.00 C ATOM 929 C LEU A 58 185.542 1.623 -6.174 1.00 0.00 C ATOM 930 O LEU A 58 186.561 0.940 -6.184 1.00 0.00 O ATOM 931 CB LEU A 58 183.676 1.752 -7.891 1.00 0.00 C ATOM 932 CG LEU A 58 182.275 1.217 -8.261 1.00 0.00 C ATOM 933 CD1 LEU A 58 181.561 2.183 -9.229 1.00 0.00 C ATOM 934 CD2 LEU A 58 182.409 -0.163 -8.909 1.00 0.00 C ATOM 0 H LEU A 58 182.587 2.005 -5.652 1.00 0.00 H new ATOM 0 HA LEU A 58 184.324 -0.010 -6.887 1.00 0.00 H new ATOM 0 HB2 LEU A 58 183.631 2.827 -7.717 1.00 0.00 H new ATOM 0 HB3 LEU A 58 184.367 1.592 -8.719 1.00 0.00 H new ATOM 0 HG LEU A 58 181.679 1.138 -7.352 1.00 0.00 H new ATOM 0 HD11 LEU A 58 180.576 1.788 -9.477 1.00 0.00 H new ATOM 0 HD12 LEU A 58 181.452 3.158 -8.755 1.00 0.00 H new ATOM 0 HD13 LEU A 58 182.150 2.287 -10.140 1.00 0.00 H new ATOM 0 HD21 LEU A 58 181.420 -0.540 -9.170 1.00 0.00 H new ATOM 0 HD22 LEU A 58 183.017 -0.084 -9.810 1.00 0.00 H new ATOM 0 HD23 LEU A 58 182.886 -0.849 -8.209 1.00 0.00 H new ATOM 946 N GLU A 59 185.550 2.848 -5.733 1.00 0.00 N ATOM 947 CA GLU A 59 186.793 3.496 -5.237 1.00 0.00 C ATOM 948 C GLU A 59 187.448 2.587 -4.217 1.00 0.00 C ATOM 949 O GLU A 59 188.606 2.257 -4.316 1.00 0.00 O ATOM 950 CB GLU A 59 186.431 4.845 -4.557 1.00 0.00 C ATOM 951 CG GLU A 59 185.648 5.738 -5.535 1.00 0.00 C ATOM 952 CD GLU A 59 185.403 7.097 -4.908 1.00 0.00 C ATOM 953 OE1 GLU A 59 184.731 7.168 -3.904 1.00 0.00 O ATOM 954 OE2 GLU A 59 185.902 8.054 -5.437 1.00 0.00 O ATOM 0 H GLU A 59 184.723 3.443 -5.695 1.00 0.00 H new ATOM 0 HA GLU A 59 187.474 3.675 -6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 59 185.835 4.662 -3.663 1.00 0.00 H new ATOM 0 HB3 GLU A 59 187.340 5.354 -4.235 1.00 0.00 H new ATOM 0 HG2 GLU A 59 186.206 5.852 -6.464 1.00 0.00 H new ATOM 0 HG3 GLU A 59 184.698 5.268 -5.789 1.00 0.00 H new ATOM 961 N SER A 60 186.710 2.197 -3.229 1.00 0.00 N ATOM 962 CA SER A 60 187.284 1.341 -2.162 1.00 0.00 C ATOM 963 C SER A 60 187.994 0.133 -2.770 1.00 0.00 C ATOM 964 O SER A 60 189.032 -0.293 -2.286 1.00 0.00 O ATOM 965 CB SER A 60 186.165 0.862 -1.232 1.00 0.00 C ATOM 966 OG SER A 60 185.014 0.517 -2.004 1.00 0.00 O ATOM 0 H SER A 60 185.725 2.435 -3.111 1.00 0.00 H new ATOM 0 HA SER A 60 188.009 1.926 -1.595 1.00 0.00 H new ATOM 0 HB2 SER A 60 186.501 -0.001 -0.657 1.00 0.00 H new ATOM 0 HB3 SER A 60 185.914 1.645 -0.516 1.00 0.00 H new ATOM 0 HG SER A 60 184.418 1.292 -2.066 1.00 0.00 H new ATOM 972 N LYS A 61 187.443 -0.444 -3.821 1.00 0.00 N ATOM 973 CA LYS A 61 188.100 -1.650 -4.422 1.00 0.00 C ATOM 974 C LYS A 61 189.345 -1.197 -5.151 1.00 0.00 C ATOM 975 O LYS A 61 190.377 -1.849 -5.116 1.00 0.00 O ATOM 976 CB LYS A 61 187.171 -2.365 -5.404 1.00 0.00 C ATOM 977 CG LYS A 61 185.886 -2.816 -4.701 1.00 0.00 C ATOM 978 CD LYS A 61 184.781 -3.017 -5.757 1.00 0.00 C ATOM 979 CE LYS A 61 183.497 -3.524 -5.096 1.00 0.00 C ATOM 980 NZ LYS A 61 183.288 -2.797 -3.827 1.00 0.00 N ATOM 0 H LYS A 61 186.584 -0.137 -4.278 1.00 0.00 H new ATOM 0 HA LYS A 61 188.345 -2.352 -3.625 1.00 0.00 H new ATOM 0 HB2 LYS A 61 186.925 -1.699 -6.231 1.00 0.00 H new ATOM 0 HB3 LYS A 61 187.680 -3.229 -5.831 1.00 0.00 H new ATOM 0 HG2 LYS A 61 186.060 -3.744 -4.157 1.00 0.00 H new ATOM 0 HG3 LYS A 61 185.576 -2.071 -3.969 1.00 0.00 H new ATOM 0 HD2 LYS A 61 184.586 -2.076 -6.272 1.00 0.00 H new ATOM 0 HD3 LYS A 61 185.115 -3.730 -6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 61 182.647 -3.373 -5.761 1.00 0.00 H new ATOM 0 HE3 LYS A 61 183.568 -4.595 -4.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 182.298 -2.900 -3.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 183.914 -3.189 -3.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 183.505 -1.789 -3.964 1.00 0.00 H new ATOM 994 N ARG A 62 189.263 -0.096 -5.824 1.00 0.00 N ATOM 995 CA ARG A 62 190.430 0.415 -6.568 1.00 0.00 C ATOM 996 C ARG A 62 191.282 1.269 -5.643 1.00 0.00 C ATOM 997 O ARG A 62 192.133 2.022 -6.086 1.00 0.00 O ATOM 998 CB ARG A 62 189.963 1.228 -7.783 1.00 0.00 C ATOM 999 CG ARG A 62 189.308 0.284 -8.817 1.00 0.00 C ATOM 1000 CD ARG A 62 190.348 -0.726 -9.355 1.00 0.00 C ATOM 1001 NE ARG A 62 191.624 0.004 -9.677 1.00 0.00 N ATOM 1002 CZ ARG A 62 192.819 -0.517 -9.430 1.00 0.00 C ATOM 1003 NH1 ARG A 62 192.930 -1.708 -8.894 1.00 0.00 N ATOM 1004 NH2 ARG A 62 193.892 0.171 -9.722 1.00 0.00 N ATOM 0 H ARG A 62 188.424 0.480 -5.891 1.00 0.00 H new ATOM 0 HA ARG A 62 191.030 -0.421 -6.928 1.00 0.00 H new ATOM 0 HB2 ARG A 62 189.251 1.992 -7.470 1.00 0.00 H new ATOM 0 HB3 ARG A 62 190.809 1.746 -8.234 1.00 0.00 H new ATOM 0 HG2 ARG A 62 188.477 -0.250 -8.357 1.00 0.00 H new ATOM 0 HG3 ARG A 62 188.896 0.866 -9.641 1.00 0.00 H new ATOM 0 HD2 ARG A 62 190.536 -1.503 -8.614 1.00 0.00 H new ATOM 0 HD3 ARG A 62 189.964 -1.222 -10.246 1.00 0.00 H new ATOM 0 HE ARG A 62 191.568 0.931 -10.099 1.00 0.00 H new ATOM 0 HH11 ARG A 62 192.093 -2.243 -8.663 1.00 0.00 H new ATOM 0 HH12 ARG A 62 193.853 -2.100 -8.708 1.00 0.00 H new ATOM 0 HH21 ARG A 62 193.806 1.099 -10.136 1.00 0.00 H new ATOM 0 HH22 ARG A 62 194.815 -0.221 -9.536 1.00 0.00 H new ATOM 1018 N LEU A 63 191.107 1.114 -4.366 1.00 0.00 N ATOM 1019 CA LEU A 63 191.916 1.847 -3.394 1.00 0.00 C ATOM 1020 C LEU A 63 192.850 0.857 -2.703 1.00 0.00 C ATOM 1021 O LEU A 63 192.528 -0.318 -2.553 1.00 0.00 O ATOM 1022 CB LEU A 63 191.004 2.505 -2.358 1.00 0.00 C ATOM 1023 CG LEU A 63 190.584 3.921 -2.815 1.00 0.00 C ATOM 1024 CD1 LEU A 63 189.393 4.397 -1.987 1.00 0.00 C ATOM 1025 CD2 LEU A 63 191.740 4.904 -2.609 1.00 0.00 C ATOM 0 H LEU A 63 190.414 0.489 -3.955 1.00 0.00 H new ATOM 0 HA LEU A 63 192.496 2.622 -3.895 1.00 0.00 H new ATOM 0 HB2 LEU A 63 190.117 1.890 -2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 63 191.520 2.566 -1.400 1.00 0.00 H new ATOM 0 HG LEU A 63 190.316 3.880 -3.871 1.00 0.00 H new ATOM 0 HD11 LEU A 63 189.100 5.395 -2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 63 188.557 3.711 -2.124 1.00 0.00 H new ATOM 0 HD13 LEU A 63 189.670 4.425 -0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 63 191.434 5.899 -2.934 1.00 0.00 H new ATOM 0 HD22 LEU A 63 192.008 4.934 -1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 63 192.601 4.580 -3.193 1.00 0.00 H new ATOM 2083 N HIS B 23 153.562 16.908 -7.011 1.00 0.00 N ATOM 2084 CA HIS B 23 154.675 16.053 -7.590 1.00 0.00 C ATOM 2085 C HIS B 23 154.633 14.749 -6.825 1.00 0.00 C ATOM 2086 O HIS B 23 154.320 13.700 -7.348 1.00 0.00 O ATOM 2087 CB HIS B 23 156.075 16.722 -7.410 1.00 0.00 C ATOM 2088 CG HIS B 23 155.943 18.223 -7.358 1.00 0.00 C ATOM 2089 ND1 HIS B 23 155.960 18.924 -6.158 1.00 0.00 N ATOM 2090 CD2 HIS B 23 155.765 19.163 -8.340 1.00 0.00 C ATOM 2091 CE1 HIS B 23 155.796 20.227 -6.451 1.00 0.00 C ATOM 2092 NE2 HIS B 23 155.670 20.426 -7.766 1.00 0.00 N ATOM 0 HA HIS B 23 154.530 15.915 -8.661 1.00 0.00 H new ATOM 0 HB2 HIS B 23 156.542 16.361 -6.494 1.00 0.00 H new ATOM 0 HB3 HIS B 23 156.729 16.437 -8.234 1.00 0.00 H new ATOM 0 HD2 HIS B 23 155.707 18.954 -9.398 1.00 0.00 H new ATOM 0 HE1 HIS B 23 155.769 21.015 -5.713 1.00 0.00 H new ATOM 0 HE2 HIS B 23 155.533 21.315 -8.247 1.00 0.00 H new ATOM 2101 N THR B 24 154.770 14.881 -5.565 1.00 0.00 N ATOM 2102 CA THR B 24 154.612 13.815 -4.568 1.00 0.00 C ATOM 2103 C THR B 24 153.308 13.034 -4.826 1.00 0.00 C ATOM 2104 O THR B 24 153.135 11.922 -4.339 1.00 0.00 O ATOM 2105 CB THR B 24 154.509 14.553 -3.240 1.00 0.00 C ATOM 2106 OG1 THR B 24 155.507 15.588 -3.190 1.00 0.00 O ATOM 2107 CG2 THR B 24 154.692 13.607 -2.077 1.00 0.00 C ATOM 0 H THR B 24 155.010 15.777 -5.141 1.00 0.00 H new ATOM 0 HA THR B 24 155.433 13.098 -4.594 1.00 0.00 H new ATOM 0 HB THR B 24 153.515 14.994 -3.164 1.00 0.00 H new ATOM 0 HG1 THR B 24 155.441 16.065 -2.337 1.00 0.00 H new ATOM 0 HG21 THR B 24 154.614 14.161 -1.142 1.00 0.00 H new ATOM 0 HG22 THR B 24 153.920 12.838 -2.109 1.00 0.00 H new ATOM 0 HG23 THR B 24 155.674 13.139 -2.140 1.00 0.00 H new ATOM 2115 N GLU B 25 152.420 13.599 -5.583 1.00 0.00 N ATOM 2116 CA GLU B 25 151.135 12.957 -5.909 1.00 0.00 C ATOM 2117 C GLU B 25 151.283 11.457 -6.010 1.00 0.00 C ATOM 2118 O GLU B 25 150.616 10.729 -5.304 1.00 0.00 O ATOM 2119 CB GLU B 25 150.736 13.502 -7.281 1.00 0.00 C ATOM 2120 CG GLU B 25 150.412 14.997 -7.128 1.00 0.00 C ATOM 2121 CD GLU B 25 150.719 15.718 -8.404 1.00 0.00 C ATOM 2122 OE1 GLU B 25 150.160 15.354 -9.399 1.00 0.00 O ATOM 2123 OE2 GLU B 25 151.478 16.629 -8.373 1.00 0.00 O ATOM 0 H GLU B 25 152.543 14.520 -6.005 1.00 0.00 H new ATOM 0 HA GLU B 25 150.396 13.166 -5.135 1.00 0.00 H new ATOM 0 HB2 GLU B 25 151.546 13.360 -7.997 1.00 0.00 H new ATOM 0 HB3 GLU B 25 149.871 12.963 -7.667 1.00 0.00 H new ATOM 0 HG2 GLU B 25 149.361 15.126 -6.871 1.00 0.00 H new ATOM 0 HG3 GLU B 25 150.994 15.422 -6.311 1.00 0.00 H new ATOM 2130 N SER B 26 152.096 10.981 -6.890 1.00 0.00 N ATOM 2131 CA SER B 26 152.265 9.511 -7.045 1.00 0.00 C ATOM 2132 C SER B 26 152.380 8.838 -5.663 1.00 0.00 C ATOM 2133 O SER B 26 151.725 7.846 -5.398 1.00 0.00 O ATOM 2134 CB SER B 26 153.513 9.248 -7.866 1.00 0.00 C ATOM 2135 OG SER B 26 153.857 10.440 -8.592 1.00 0.00 O ATOM 0 H SER B 26 152.662 11.548 -7.521 1.00 0.00 H new ATOM 0 HA SER B 26 151.397 9.092 -7.554 1.00 0.00 H new ATOM 0 HB2 SER B 26 154.336 8.953 -7.215 1.00 0.00 H new ATOM 0 HB3 SER B 26 153.342 8.423 -8.557 1.00 0.00 H new ATOM 0 HG SER B 26 153.125 10.676 -9.199 1.00 0.00 H new ATOM 2141 N LEU B 27 153.103 9.433 -4.745 1.00 0.00 N ATOM 2142 CA LEU B 27 153.182 8.865 -3.380 1.00 0.00 C ATOM 2143 C LEU B 27 151.781 8.884 -2.772 1.00 0.00 C ATOM 2144 O LEU B 27 151.317 7.897 -2.224 1.00 0.00 O ATOM 2145 CB LEU B 27 154.148 9.694 -2.523 1.00 0.00 C ATOM 2146 CG LEU B 27 155.601 9.445 -2.960 1.00 0.00 C ATOM 2147 CD1 LEU B 27 156.507 10.593 -2.478 1.00 0.00 C ATOM 2148 CD2 LEU B 27 156.101 8.126 -2.360 1.00 0.00 C ATOM 0 H LEU B 27 153.639 10.288 -4.891 1.00 0.00 H new ATOM 0 HA LEU B 27 153.555 7.841 -3.418 1.00 0.00 H new ATOM 0 HB2 LEU B 27 153.910 10.754 -2.617 1.00 0.00 H new ATOM 0 HB3 LEU B 27 154.028 9.432 -1.472 1.00 0.00 H new ATOM 0 HG LEU B 27 155.634 9.393 -4.048 1.00 0.00 H new ATOM 0 HD11 LEU B 27 157.533 10.404 -2.794 1.00 0.00 H new ATOM 0 HD12 LEU B 27 156.162 11.534 -2.908 1.00 0.00 H new ATOM 0 HD13 LEU B 27 156.468 10.655 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU B 27 157.131 7.952 -2.671 1.00 0.00 H new ATOM 0 HD22 LEU B 27 156.055 8.180 -1.272 1.00 0.00 H new ATOM 0 HD23 LEU B 27 155.473 7.306 -2.709 1.00 0.00 H new ATOM 2160 N GLN B 28 151.071 9.979 -2.897 1.00 0.00 N ATOM 2161 CA GLN B 28 149.680 10.018 -2.391 1.00 0.00 C ATOM 2162 C GLN B 28 148.795 9.120 -3.264 1.00 0.00 C ATOM 2163 O GLN B 28 147.814 8.573 -2.780 1.00 0.00 O ATOM 2164 CB GLN B 28 149.097 11.444 -2.422 1.00 0.00 C ATOM 2165 CG GLN B 28 149.934 12.400 -1.594 1.00 0.00 C ATOM 2166 CD GLN B 28 151.140 12.836 -2.343 1.00 0.00 C ATOM 2167 OE1 GLN B 28 152.222 12.211 -2.144 1.00 0.00 O flip ATOM 2168 NE2 GLN B 28 151.102 13.769 -3.105 1.00 0.00 N flip ATOM 0 H GLN B 28 151.402 10.842 -3.328 1.00 0.00 H new ATOM 0 HA GLN B 28 149.698 9.670 -1.358 1.00 0.00 H new ATOM 0 HB2 GLN B 28 149.050 11.797 -3.452 1.00 0.00 H new ATOM 0 HB3 GLN B 28 148.075 11.430 -2.043 1.00 0.00 H new ATOM 0 HG2 GLN B 28 149.336 13.270 -1.321 1.00 0.00 H new ATOM 0 HG3 GLN B 28 150.234 11.915 -0.665 1.00 0.00 H new ATOM 0 HE21 GLN B 28 150.225 14.266 -3.259 1.00 0.00 H new ATOM 0 HE22 GLN B 28 151.947 14.061 -3.596 1.00 0.00 H new ATOM 2177 N ASN B 29 149.062 9.037 -4.535 1.00 0.00 N ATOM 2178 CA ASN B 29 148.144 8.288 -5.436 1.00 0.00 C ATOM 2179 C ASN B 29 148.361 6.781 -5.296 1.00 0.00 C ATOM 2180 O ASN B 29 147.630 5.984 -5.875 1.00 0.00 O ATOM 2181 CB ASN B 29 148.340 8.728 -6.880 1.00 0.00 C ATOM 2182 CG ASN B 29 147.734 10.116 -7.109 1.00 0.00 C ATOM 2183 OD1 ASN B 29 146.698 10.456 -6.537 1.00 0.00 O ATOM 2184 ND2 ASN B 29 148.317 10.937 -7.925 1.00 0.00 N ATOM 0 H ASN B 29 149.874 9.454 -4.989 1.00 0.00 H new ATOM 0 HA ASN B 29 147.118 8.512 -5.145 1.00 0.00 H new ATOM 0 HB2 ASN B 29 149.403 8.746 -7.119 1.00 0.00 H new ATOM 0 HB3 ASN B 29 147.874 8.007 -7.552 1.00 0.00 H new ATOM 0 HD21 ASN B 29 147.917 11.861 -8.091 1.00 0.00 H new ATOM 0 HD22 ASN B 29 149.175 10.659 -8.401 1.00 0.00 H new ATOM 2191 N MET B 30 149.328 6.369 -4.534 1.00 0.00 N ATOM 2192 CA MET B 30 149.550 4.928 -4.324 1.00 0.00 C ATOM 2193 C MET B 30 148.711 4.514 -3.131 1.00 0.00 C ATOM 2194 O MET B 30 148.338 5.344 -2.328 1.00 0.00 O ATOM 2195 CB MET B 30 151.031 4.681 -3.983 1.00 0.00 C ATOM 2196 CG MET B 30 151.909 4.882 -5.228 1.00 0.00 C ATOM 2197 SD MET B 30 153.019 3.468 -5.402 1.00 0.00 S ATOM 2198 CE MET B 30 154.052 3.804 -3.952 1.00 0.00 C ATOM 0 H MET B 30 149.980 6.981 -4.044 1.00 0.00 H new ATOM 0 HA MET B 30 149.284 4.365 -5.219 1.00 0.00 H new ATOM 0 HB2 MET B 30 151.347 5.363 -3.193 1.00 0.00 H new ATOM 0 HB3 MET B 30 151.158 3.668 -3.600 1.00 0.00 H new ATOM 0 HG2 MET B 30 151.285 4.982 -6.116 1.00 0.00 H new ATOM 0 HG3 MET B 30 152.485 5.803 -5.138 1.00 0.00 H new ATOM 0 HE1 MET B 30 155.101 3.664 -4.212 1.00 0.00 H new ATOM 0 HE2 MET B 30 153.894 4.831 -3.623 1.00 0.00 H new ATOM 0 HE3 MET B 30 153.783 3.120 -3.147 1.00 0.00 H new ATOM 2208 N SER B 31 148.442 3.273 -2.968 1.00 0.00 N ATOM 2209 CA SER B 31 147.650 2.862 -1.780 1.00 0.00 C ATOM 2210 C SER B 31 148.624 2.607 -0.640 1.00 0.00 C ATOM 2211 O SER B 31 149.698 2.053 -0.840 1.00 0.00 O ATOM 2212 CB SER B 31 146.859 1.594 -2.098 1.00 0.00 C ATOM 2213 OG SER B 31 146.403 1.664 -3.459 1.00 0.00 O ATOM 0 H SER B 31 148.727 2.519 -3.593 1.00 0.00 H new ATOM 0 HA SER B 31 146.941 3.641 -1.501 1.00 0.00 H new ATOM 0 HB2 SER B 31 147.484 0.713 -1.954 1.00 0.00 H new ATOM 0 HB3 SER B 31 146.011 1.498 -1.420 1.00 0.00 H new ATOM 0 HG SER B 31 145.895 0.854 -3.676 1.00 0.00 H new ATOM 2219 N LYS B 32 148.311 3.117 0.524 1.00 0.00 N ATOM 2220 CA LYS B 32 149.222 3.021 1.717 1.00 0.00 C ATOM 2221 C LYS B 32 149.929 1.665 1.736 1.00 0.00 C ATOM 2222 O LYS B 32 151.111 1.569 2.003 1.00 0.00 O ATOM 2223 CB LYS B 32 148.377 3.174 2.999 1.00 0.00 C ATOM 2224 CG LYS B 32 149.112 4.025 4.051 1.00 0.00 C ATOM 2225 CD LYS B 32 149.156 3.274 5.395 1.00 0.00 C ATOM 2226 CE LYS B 32 149.326 4.282 6.544 1.00 0.00 C ATOM 2227 NZ LYS B 32 148.099 4.354 7.358 1.00 0.00 N ATOM 0 H LYS B 32 147.438 3.611 0.707 1.00 0.00 H new ATOM 0 HA LYS B 32 149.974 3.808 1.662 1.00 0.00 H new ATOM 0 HB2 LYS B 32 147.421 3.638 2.755 1.00 0.00 H new ATOM 0 HB3 LYS B 32 148.157 2.190 3.413 1.00 0.00 H new ATOM 0 HG2 LYS B 32 150.125 4.242 3.712 1.00 0.00 H new ATOM 0 HG3 LYS B 32 148.606 4.982 4.176 1.00 0.00 H new ATOM 0 HD2 LYS B 32 148.239 2.701 5.533 1.00 0.00 H new ATOM 0 HD3 LYS B 32 149.981 2.561 5.398 1.00 0.00 H new ATOM 0 HE2 LYS B 32 150.168 3.988 7.171 1.00 0.00 H new ATOM 0 HE3 LYS B 32 149.558 5.267 6.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 148.182 5.133 8.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 147.281 4.523 6.739 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 147.968 3.457 7.868 1.00 0.00 H new ATOM 2241 N GLN B 33 149.215 0.645 1.465 1.00 0.00 N ATOM 2242 CA GLN B 33 149.768 -0.728 1.505 1.00 0.00 C ATOM 2243 C GLN B 33 150.955 -0.874 0.543 1.00 0.00 C ATOM 2244 O GLN B 33 151.936 -1.547 0.843 1.00 0.00 O ATOM 2245 CB GLN B 33 148.659 -1.704 1.111 1.00 0.00 C ATOM 2246 CG GLN B 33 147.442 -1.551 2.058 1.00 0.00 C ATOM 2247 CD GLN B 33 146.553 -0.372 1.623 1.00 0.00 C ATOM 2248 OE1 GLN B 33 146.904 0.385 0.727 1.00 0.00 O ATOM 2249 NE2 GLN B 33 145.433 -0.169 2.217 1.00 0.00 N ATOM 0 H GLN B 33 148.230 0.694 1.205 1.00 0.00 H new ATOM 0 HA GLN B 33 150.127 -0.942 2.512 1.00 0.00 H new ATOM 0 HB2 GLN B 33 148.352 -1.519 0.082 1.00 0.00 H new ATOM 0 HB3 GLN B 33 149.034 -2.727 1.153 1.00 0.00 H new ATOM 0 HG2 GLN B 33 146.858 -2.471 2.058 1.00 0.00 H new ATOM 0 HG3 GLN B 33 147.788 -1.393 3.079 1.00 0.00 H new ATOM 0 HE21 GLN B 33 145.132 -0.794 2.965 1.00 0.00 H new ATOM 0 HE22 GLN B 33 144.845 0.617 1.941 1.00 0.00 H new ATOM 2258 N GLU B 34 150.876 -0.270 -0.602 1.00 0.00 N ATOM 2259 CA GLU B 34 151.973 -0.404 -1.598 1.00 0.00 C ATOM 2260 C GLU B 34 153.186 0.355 -1.102 1.00 0.00 C ATOM 2261 O GLU B 34 154.309 -0.132 -1.162 1.00 0.00 O ATOM 2262 CB GLU B 34 151.518 0.134 -2.965 1.00 0.00 C ATOM 2263 CG GLU B 34 150.074 -0.332 -3.262 1.00 0.00 C ATOM 2264 CD GLU B 34 150.037 -1.844 -3.300 1.00 0.00 C ATOM 2265 OE1 GLU B 34 150.352 -2.396 -4.317 1.00 0.00 O ATOM 2266 OE2 GLU B 34 149.713 -2.434 -2.303 1.00 0.00 O ATOM 0 H GLU B 34 150.094 0.316 -0.896 1.00 0.00 H new ATOM 0 HA GLU B 34 152.233 -1.456 -1.719 1.00 0.00 H new ATOM 0 HB2 GLU B 34 151.566 1.223 -2.971 1.00 0.00 H new ATOM 0 HB3 GLU B 34 152.191 -0.219 -3.746 1.00 0.00 H new ATOM 0 HG2 GLU B 34 149.394 0.041 -2.496 1.00 0.00 H new ATOM 0 HG3 GLU B 34 149.736 0.076 -4.215 1.00 0.00 H new ATOM 2273 N LEU B 35 152.980 1.530 -0.604 1.00 0.00 N ATOM 2274 CA LEU B 35 154.108 2.324 -0.055 1.00 0.00 C ATOM 2275 C LEU B 35 154.762 1.500 1.054 1.00 0.00 C ATOM 2276 O LEU B 35 155.956 1.297 1.098 1.00 0.00 O ATOM 2277 CB LEU B 35 153.537 3.609 0.561 1.00 0.00 C ATOM 2278 CG LEU B 35 152.786 4.435 -0.514 1.00 0.00 C ATOM 2279 CD1 LEU B 35 151.490 5.000 0.056 1.00 0.00 C ATOM 2280 CD2 LEU B 35 153.661 5.593 -0.980 1.00 0.00 C ATOM 0 H LEU B 35 152.068 1.984 -0.551 1.00 0.00 H new ATOM 0 HA LEU B 35 154.831 2.567 -0.833 1.00 0.00 H new ATOM 0 HB2 LEU B 35 152.858 3.359 1.376 1.00 0.00 H new ATOM 0 HB3 LEU B 35 154.343 4.205 0.989 1.00 0.00 H new ATOM 0 HG LEU B 35 152.557 3.778 -1.353 1.00 0.00 H new ATOM 0 HD11 LEU B 35 150.976 5.577 -0.712 1.00 0.00 H new ATOM 0 HD12 LEU B 35 150.850 4.181 0.385 1.00 0.00 H new ATOM 0 HD13 LEU B 35 151.717 5.646 0.904 1.00 0.00 H new ATOM 0 HD21 LEU B 35 153.128 6.170 -1.736 1.00 0.00 H new ATOM 0 HD22 LEU B 35 153.896 6.236 -0.132 1.00 0.00 H new ATOM 0 HD23 LEU B 35 154.585 5.202 -1.407 1.00 0.00 H new ATOM 2292 N ILE B 36 153.957 0.931 1.880 1.00 0.00 N ATOM 2293 CA ILE B 36 154.484 0.069 2.958 1.00 0.00 C ATOM 2294 C ILE B 36 155.358 -1.055 2.352 1.00 0.00 C ATOM 2295 O ILE B 36 156.446 -1.314 2.822 1.00 0.00 O ATOM 2296 CB ILE B 36 153.323 -0.496 3.767 1.00 0.00 C ATOM 2297 CG1 ILE B 36 152.556 0.655 4.444 1.00 0.00 C ATOM 2298 CG2 ILE B 36 153.845 -1.436 4.841 1.00 0.00 C ATOM 2299 CD1 ILE B 36 151.197 0.148 4.935 1.00 0.00 C ATOM 0 H ILE B 36 152.942 1.024 1.858 1.00 0.00 H new ATOM 0 HA ILE B 36 155.114 0.653 3.629 1.00 0.00 H new ATOM 0 HB ILE B 36 152.660 -1.041 3.095 1.00 0.00 H new ATOM 0 HG12 ILE B 36 153.133 1.047 5.281 1.00 0.00 H new ATOM 0 HG13 ILE B 36 152.417 1.476 3.741 1.00 0.00 H new ATOM 0 HG21 ILE B 36 153.008 -1.835 5.414 1.00 0.00 H new ATOM 0 HG22 ILE B 36 154.388 -2.257 4.373 1.00 0.00 H new ATOM 0 HG23 ILE B 36 154.514 -0.891 5.507 1.00 0.00 H new ATOM 0 HD11 ILE B 36 150.656 0.964 5.414 1.00 0.00 H new ATOM 0 HD12 ILE B 36 150.620 -0.223 4.088 1.00 0.00 H new ATOM 0 HD13 ILE B 36 151.347 -0.658 5.653 1.00 0.00 H new ATOM 2311 N LYS B 37 154.893 -1.724 1.341 1.00 0.00 N ATOM 2312 CA LYS B 37 155.700 -2.821 0.739 1.00 0.00 C ATOM 2313 C LYS B 37 157.078 -2.287 0.324 1.00 0.00 C ATOM 2314 O LYS B 37 158.139 -2.840 0.696 1.00 0.00 O ATOM 2315 CB LYS B 37 154.972 -3.338 -0.495 1.00 0.00 C ATOM 2316 CG LYS B 37 153.894 -4.362 -0.094 1.00 0.00 C ATOM 2317 CD LYS B 37 154.301 -5.784 -0.550 1.00 0.00 C ATOM 2318 CE LYS B 37 153.097 -6.510 -1.186 1.00 0.00 C ATOM 2319 NZ LYS B 37 152.426 -5.609 -2.161 1.00 0.00 N ATOM 0 H LYS B 37 153.987 -1.560 0.902 1.00 0.00 H new ATOM 0 HA LYS B 37 155.831 -3.622 1.466 1.00 0.00 H new ATOM 0 HB2 LYS B 37 154.512 -2.506 -1.028 1.00 0.00 H new ATOM 0 HB3 LYS B 37 155.685 -3.800 -1.178 1.00 0.00 H new ATOM 0 HG2 LYS B 37 153.753 -4.347 0.987 1.00 0.00 H new ATOM 0 HG3 LYS B 37 152.939 -4.089 -0.544 1.00 0.00 H new ATOM 0 HD2 LYS B 37 155.118 -5.722 -1.269 1.00 0.00 H new ATOM 0 HD3 LYS B 37 154.669 -6.355 0.303 1.00 0.00 H new ATOM 0 HE2 LYS B 37 153.431 -7.419 -1.686 1.00 0.00 H new ATOM 0 HE3 LYS B 37 152.392 -6.813 -0.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 152.067 -6.169 -2.961 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 151.634 -5.122 -1.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 153.108 -4.905 -2.510 1.00 0.00 H new ATOM 2333 N GLU B 38 157.094 -1.224 -0.427 1.00 0.00 N ATOM 2334 CA GLU B 38 158.390 -0.689 -0.861 1.00 0.00 C ATOM 2335 C GLU B 38 159.169 -0.210 0.346 1.00 0.00 C ATOM 2336 O GLU B 38 160.352 -0.364 0.386 1.00 0.00 O ATOM 2337 CB GLU B 38 158.237 0.403 -1.919 1.00 0.00 C ATOM 2338 CG GLU B 38 157.270 1.475 -1.453 1.00 0.00 C ATOM 2339 CD GLU B 38 157.239 2.590 -2.462 1.00 0.00 C ATOM 2340 OE1 GLU B 38 157.161 2.305 -3.628 1.00 0.00 O ATOM 2341 OE2 GLU B 38 157.317 3.699 -2.068 1.00 0.00 O ATOM 0 H GLU B 38 156.272 -0.715 -0.751 1.00 0.00 H new ATOM 0 HA GLU B 38 158.953 -1.489 -1.342 1.00 0.00 H new ATOM 0 HB2 GLU B 38 159.209 0.850 -2.129 1.00 0.00 H new ATOM 0 HB3 GLU B 38 157.879 -0.035 -2.851 1.00 0.00 H new ATOM 0 HG2 GLU B 38 156.273 1.053 -1.330 1.00 0.00 H new ATOM 0 HG3 GLU B 38 157.576 1.858 -0.480 1.00 0.00 H new ATOM 2348 N TYR B 39 158.515 0.283 1.378 1.00 0.00 N ATOM 2349 CA TYR B 39 159.278 0.643 2.614 1.00 0.00 C ATOM 2350 C TYR B 39 160.125 -0.512 3.051 1.00 0.00 C ATOM 2351 O TYR B 39 161.269 -0.349 3.359 1.00 0.00 O ATOM 2352 CB TYR B 39 158.347 0.984 3.778 1.00 0.00 C ATOM 2353 CG TYR B 39 158.060 2.448 3.841 1.00 0.00 C ATOM 2354 CD1 TYR B 39 159.064 3.324 4.265 1.00 0.00 C ATOM 2355 CD2 TYR B 39 156.795 2.932 3.542 1.00 0.00 C ATOM 2356 CE1 TYR B 39 158.796 4.672 4.373 1.00 0.00 C ATOM 2357 CE2 TYR B 39 156.526 4.274 3.665 1.00 0.00 C ATOM 2358 CZ TYR B 39 157.522 5.145 4.076 1.00 0.00 C ATOM 2359 OH TYR B 39 157.242 6.456 4.222 1.00 0.00 O ATOM 0 H TYR B 39 157.509 0.447 1.415 1.00 0.00 H new ATOM 0 HA TYR B 39 159.887 1.512 2.364 1.00 0.00 H new ATOM 0 HB2 TYR B 39 157.412 0.434 3.670 1.00 0.00 H new ATOM 0 HB3 TYR B 39 158.801 0.661 4.715 1.00 0.00 H new ATOM 0 HD1 TYR B 39 160.046 2.946 4.507 1.00 0.00 H new ATOM 0 HD2 TYR B 39 156.021 2.254 3.213 1.00 0.00 H new ATOM 0 HE1 TYR B 39 159.570 5.357 4.686 1.00 0.00 H new ATOM 0 HE2 TYR B 39 155.538 4.650 3.441 1.00 0.00 H new ATOM 0 HH TYR B 39 157.068 6.853 3.343 1.00 0.00 H new ATOM 2369 N LEU B 40 159.576 -1.677 3.101 1.00 0.00 N ATOM 2370 CA LEU B 40 160.368 -2.833 3.585 1.00 0.00 C ATOM 2371 C LEU B 40 161.550 -3.053 2.663 1.00 0.00 C ATOM 2372 O LEU B 40 162.640 -3.398 3.105 1.00 0.00 O ATOM 2373 CB LEU B 40 159.475 -4.075 3.673 1.00 0.00 C ATOM 2374 CG LEU B 40 158.136 -3.686 4.348 1.00 0.00 C ATOM 2375 CD1 LEU B 40 157.298 -4.920 4.618 1.00 0.00 C ATOM 2376 CD2 LEU B 40 158.398 -2.955 5.675 1.00 0.00 C ATOM 0 H LEU B 40 158.615 -1.885 2.830 1.00 0.00 H new ATOM 0 HA LEU B 40 160.752 -2.632 4.585 1.00 0.00 H new ATOM 0 HB2 LEU B 40 159.291 -4.478 2.677 1.00 0.00 H new ATOM 0 HB3 LEU B 40 159.973 -4.857 4.247 1.00 0.00 H new ATOM 0 HG LEU B 40 157.596 -3.025 3.670 1.00 0.00 H new ATOM 0 HD11 LEU B 40 156.361 -4.627 5.092 1.00 0.00 H new ATOM 0 HD12 LEU B 40 157.085 -5.428 3.677 1.00 0.00 H new ATOM 0 HD13 LEU B 40 157.844 -5.593 5.279 1.00 0.00 H new ATOM 0 HD21 LEU B 40 157.448 -2.688 6.137 1.00 0.00 H new ATOM 0 HD22 LEU B 40 158.957 -3.607 6.346 1.00 0.00 H new ATOM 0 HD23 LEU B 40 158.975 -2.050 5.484 1.00 0.00 H new ATOM 2388 N GLU B 41 161.380 -2.837 1.398 1.00 0.00 N ATOM 2389 CA GLU B 41 162.551 -2.990 0.475 1.00 0.00 C ATOM 2390 C GLU B 41 163.478 -1.771 0.657 1.00 0.00 C ATOM 2391 O GLU B 41 164.626 -1.887 1.053 1.00 0.00 O ATOM 2392 CB GLU B 41 162.053 -3.075 -0.982 1.00 0.00 C ATOM 2393 CG GLU B 41 160.844 -4.037 -1.067 1.00 0.00 C ATOM 2394 CD GLU B 41 160.934 -4.851 -2.329 1.00 0.00 C ATOM 2395 OE1 GLU B 41 161.822 -5.640 -2.429 1.00 0.00 O ATOM 2396 OE2 GLU B 41 160.116 -4.668 -3.185 1.00 0.00 O ATOM 0 H GLU B 41 160.501 -2.565 0.958 1.00 0.00 H new ATOM 0 HA GLU B 41 163.100 -3.903 0.705 1.00 0.00 H new ATOM 0 HB2 GLU B 41 161.767 -2.085 -1.337 1.00 0.00 H new ATOM 0 HB3 GLU B 41 162.856 -3.427 -1.630 1.00 0.00 H new ATOM 0 HG2 GLU B 41 160.828 -4.695 -0.198 1.00 0.00 H new ATOM 0 HG3 GLU B 41 159.913 -3.470 -1.054 1.00 0.00 H new ATOM 2403 N LEU B 42 162.959 -0.623 0.388 1.00 0.00 N ATOM 2404 CA LEU B 42 163.700 0.665 0.510 1.00 0.00 C ATOM 2405 C LEU B 42 164.451 0.700 1.850 1.00 0.00 C ATOM 2406 O LEU B 42 165.655 0.920 1.903 1.00 0.00 O ATOM 2407 CB LEU B 42 162.659 1.812 0.473 1.00 0.00 C ATOM 2408 CG LEU B 42 163.247 3.086 -0.157 1.00 0.00 C ATOM 2409 CD1 LEU B 42 164.517 3.512 0.563 1.00 0.00 C ATOM 2410 CD2 LEU B 42 163.556 2.840 -1.634 1.00 0.00 C ATOM 0 H LEU B 42 161.997 -0.510 0.070 1.00 0.00 H new ATOM 0 HA LEU B 42 164.420 0.772 -0.301 1.00 0.00 H new ATOM 0 HB2 LEU B 42 161.785 1.494 -0.095 1.00 0.00 H new ATOM 0 HB3 LEU B 42 162.319 2.029 1.486 1.00 0.00 H new ATOM 0 HG LEU B 42 162.510 3.884 -0.064 1.00 0.00 H new ATOM 0 HD11 LEU B 42 164.913 4.415 0.099 1.00 0.00 H new ATOM 0 HD12 LEU B 42 164.292 3.712 1.611 1.00 0.00 H new ATOM 0 HD13 LEU B 42 165.258 2.715 0.497 1.00 0.00 H new ATOM 0 HD21 LEU B 42 163.972 3.746 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU B 42 164.278 2.028 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU B 42 162.639 2.570 -2.158 1.00 0.00 H new ATOM 2422 N GLU B 43 163.748 0.513 2.928 1.00 0.00 N ATOM 2423 CA GLU B 43 164.394 0.553 4.272 1.00 0.00 C ATOM 2424 C GLU B 43 165.509 -0.463 4.311 1.00 0.00 C ATOM 2425 O GLU B 43 166.622 -0.152 4.676 1.00 0.00 O ATOM 2426 CB GLU B 43 163.375 0.222 5.382 1.00 0.00 C ATOM 2427 CG GLU B 43 162.839 1.518 6.016 1.00 0.00 C ATOM 2428 CD GLU B 43 163.332 1.606 7.442 1.00 0.00 C ATOM 2429 OE1 GLU B 43 164.531 1.673 7.635 1.00 0.00 O ATOM 2430 OE2 GLU B 43 162.517 1.578 8.328 1.00 0.00 O ATOM 0 H GLU B 43 162.744 0.332 2.939 1.00 0.00 H new ATOM 0 HA GLU B 43 164.783 1.557 4.443 1.00 0.00 H new ATOM 0 HB2 GLU B 43 162.550 -0.357 4.967 1.00 0.00 H new ATOM 0 HB3 GLU B 43 163.846 -0.397 6.145 1.00 0.00 H new ATOM 0 HG2 GLU B 43 163.177 2.384 5.446 1.00 0.00 H new ATOM 0 HG3 GLU B 43 161.749 1.526 5.993 1.00 0.00 H new ATOM 2437 N LYS B 44 165.227 -1.683 3.980 1.00 0.00 N ATOM 2438 CA LYS B 44 166.282 -2.705 4.032 1.00 0.00 C ATOM 2439 C LYS B 44 167.444 -2.256 3.149 1.00 0.00 C ATOM 2440 O LYS B 44 168.597 -2.371 3.530 1.00 0.00 O ATOM 2441 CB LYS B 44 165.718 -4.045 3.567 1.00 0.00 C ATOM 2442 CG LYS B 44 164.793 -4.632 4.663 1.00 0.00 C ATOM 2443 CD LYS B 44 165.634 -5.147 5.859 1.00 0.00 C ATOM 2444 CE LYS B 44 164.799 -5.116 7.155 1.00 0.00 C ATOM 2445 NZ LYS B 44 164.364 -3.725 7.451 1.00 0.00 N ATOM 0 H LYS B 44 164.311 -2.012 3.676 1.00 0.00 H new ATOM 0 HA LYS B 44 166.645 -2.829 5.052 1.00 0.00 H new ATOM 0 HB2 LYS B 44 165.161 -3.914 2.640 1.00 0.00 H new ATOM 0 HB3 LYS B 44 166.531 -4.739 3.354 1.00 0.00 H new ATOM 0 HG2 LYS B 44 164.093 -3.869 5.004 1.00 0.00 H new ATOM 0 HG3 LYS B 44 164.200 -5.447 4.249 1.00 0.00 H new ATOM 0 HD2 LYS B 44 165.974 -6.164 5.662 1.00 0.00 H new ATOM 0 HD3 LYS B 44 166.525 -4.530 5.978 1.00 0.00 H new ATOM 0 HE2 LYS B 44 163.928 -5.763 7.051 1.00 0.00 H new ATOM 0 HE3 LYS B 44 165.388 -5.505 7.985 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 164.305 -3.591 8.481 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 165.052 -3.054 7.054 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 163.430 -3.555 7.026 1.00 0.00 H new ATOM 2459 N CYS B 45 167.152 -1.671 2.016 1.00 0.00 N ATOM 2460 CA CYS B 45 168.230 -1.149 1.141 1.00 0.00 C ATOM 2461 C CYS B 45 169.013 -0.086 1.904 1.00 0.00 C ATOM 2462 O CYS B 45 170.207 -0.221 2.123 1.00 0.00 O ATOM 2463 CB CYS B 45 167.617 -0.536 -0.127 1.00 0.00 C ATOM 2464 SG CYS B 45 167.369 -1.831 -1.368 1.00 0.00 S ATOM 0 H CYS B 45 166.205 -1.534 1.662 1.00 0.00 H new ATOM 0 HA CYS B 45 168.898 -1.961 0.852 1.00 0.00 H new ATOM 0 HB2 CYS B 45 166.666 -0.059 0.110 1.00 0.00 H new ATOM 0 HB3 CYS B 45 168.273 0.240 -0.522 1.00 0.00 H new ATOM 0 HG CYS B 45 166.848 -1.311 -2.440 1.00 0.00 H new ATOM 2470 N LEU B 46 168.366 0.979 2.303 1.00 0.00 N ATOM 2471 CA LEU B 46 169.110 2.058 3.027 1.00 0.00 C ATOM 2472 C LEU B 46 169.784 1.485 4.260 1.00 0.00 C ATOM 2473 O LEU B 46 170.841 1.895 4.618 1.00 0.00 O ATOM 2474 CB LEU B 46 168.184 3.230 3.419 1.00 0.00 C ATOM 2475 CG LEU B 46 169.043 4.462 3.835 1.00 0.00 C ATOM 2476 CD1 LEU B 46 169.820 5.009 2.645 1.00 0.00 C ATOM 2477 CD2 LEU B 46 168.152 5.576 4.353 1.00 0.00 C ATOM 0 H LEU B 46 167.370 1.149 2.163 1.00 0.00 H new ATOM 0 HA LEU B 46 169.868 2.452 2.350 1.00 0.00 H new ATOM 0 HB2 LEU B 46 167.538 3.491 2.581 1.00 0.00 H new ATOM 0 HB3 LEU B 46 167.534 2.933 4.242 1.00 0.00 H new ATOM 0 HG LEU B 46 169.732 4.130 4.611 1.00 0.00 H new ATOM 0 HD11 LEU B 46 170.412 5.868 2.961 1.00 0.00 H new ATOM 0 HD12 LEU B 46 170.482 4.235 2.256 1.00 0.00 H new ATOM 0 HD13 LEU B 46 169.123 5.315 1.865 1.00 0.00 H new ATOM 0 HD21 LEU B 46 168.766 6.430 4.640 1.00 0.00 H new ATOM 0 HD22 LEU B 46 167.454 5.877 3.572 1.00 0.00 H new ATOM 0 HD23 LEU B 46 167.595 5.223 5.220 1.00 0.00 H new ATOM 2489 N SER B 47 169.187 0.544 4.898 1.00 0.00 N ATOM 2490 CA SER B 47 169.816 -0.048 6.098 1.00 0.00 C ATOM 2491 C SER B 47 171.077 -0.805 5.675 1.00 0.00 C ATOM 2492 O SER B 47 172.176 -0.521 6.136 1.00 0.00 O ATOM 2493 CB SER B 47 168.823 -0.984 6.784 1.00 0.00 C ATOM 2494 OG SER B 47 167.539 -0.342 6.823 1.00 0.00 O ATOM 0 H SER B 47 168.281 0.151 4.643 1.00 0.00 H new ATOM 0 HA SER B 47 170.094 0.734 6.805 1.00 0.00 H new ATOM 0 HB2 SER B 47 168.757 -1.928 6.243 1.00 0.00 H new ATOM 0 HB3 SER B 47 169.160 -1.218 7.794 1.00 0.00 H new ATOM 0 HG SER B 47 167.057 -0.524 5.990 1.00 0.00 H new ATOM 2500 N ARG B 48 170.951 -1.718 4.754 1.00 0.00 N ATOM 2501 CA ARG B 48 172.152 -2.452 4.272 1.00 0.00 C ATOM 2502 C ARG B 48 173.169 -1.440 3.789 1.00 0.00 C ATOM 2503 O ARG B 48 174.371 -1.603 3.972 1.00 0.00 O ATOM 2504 CB ARG B 48 171.772 -3.395 3.118 1.00 0.00 C ATOM 2505 CG ARG B 48 171.261 -4.737 3.669 1.00 0.00 C ATOM 2506 CD ARG B 48 172.383 -5.450 4.459 1.00 0.00 C ATOM 2507 NE ARG B 48 172.129 -5.304 5.933 1.00 0.00 N ATOM 2508 CZ ARG B 48 173.049 -4.848 6.765 1.00 0.00 C ATOM 2509 NH1 ARG B 48 174.243 -4.528 6.333 1.00 0.00 N ATOM 2510 NH2 ARG B 48 172.772 -4.730 8.031 1.00 0.00 N ATOM 0 H ARG B 48 170.070 -1.987 4.315 1.00 0.00 H new ATOM 0 HA ARG B 48 172.568 -3.049 5.083 1.00 0.00 H new ATOM 0 HB2 ARG B 48 171.003 -2.932 2.500 1.00 0.00 H new ATOM 0 HB3 ARG B 48 172.638 -3.563 2.477 1.00 0.00 H new ATOM 0 HG2 ARG B 48 170.400 -4.569 4.316 1.00 0.00 H new ATOM 0 HG3 ARG B 48 170.924 -5.371 2.849 1.00 0.00 H new ATOM 0 HD2 ARG B 48 172.419 -6.505 4.188 1.00 0.00 H new ATOM 0 HD3 ARG B 48 173.352 -5.022 4.202 1.00 0.00 H new ATOM 0 HE ARG B 48 171.216 -5.566 6.304 1.00 0.00 H new ATOM 0 HH11 ARG B 48 174.472 -4.630 5.344 1.00 0.00 H new ATOM 0 HH12 ARG B 48 174.944 -4.177 6.985 1.00 0.00 H new ATOM 0 HH21 ARG B 48 171.848 -4.989 8.377 1.00 0.00 H new ATOM 0 HH22 ARG B 48 173.479 -4.379 8.677 1.00 0.00 H new ATOM 2524 N MET B 49 172.719 -0.417 3.143 1.00 0.00 N ATOM 2525 CA MET B 49 173.643 0.588 2.641 1.00 0.00 C ATOM 2526 C MET B 49 174.117 1.464 3.787 1.00 0.00 C ATOM 2527 O MET B 49 175.175 1.964 3.746 1.00 0.00 O ATOM 2528 CB MET B 49 172.966 1.421 1.555 1.00 0.00 C ATOM 2529 CG MET B 49 172.787 0.539 0.307 1.00 0.00 C ATOM 2530 SD MET B 49 171.582 1.275 -0.815 1.00 0.00 S ATOM 2531 CE MET B 49 172.522 2.756 -1.257 1.00 0.00 C ATOM 0 H MET B 49 171.734 -0.241 2.944 1.00 0.00 H new ATOM 0 HA MET B 49 174.512 0.099 2.200 1.00 0.00 H new ATOM 0 HB2 MET B 49 172.000 1.785 1.904 1.00 0.00 H new ATOM 0 HB3 MET B 49 173.570 2.297 1.317 1.00 0.00 H new ATOM 0 HG2 MET B 49 173.743 0.421 -0.203 1.00 0.00 H new ATOM 0 HG3 MET B 49 172.458 -0.457 0.602 1.00 0.00 H new ATOM 0 HE1 MET B 49 171.840 3.526 -1.617 1.00 0.00 H new ATOM 0 HE2 MET B 49 173.055 3.124 -0.380 1.00 0.00 H new ATOM 0 HE3 MET B 49 173.239 2.512 -2.041 1.00 0.00 H new ATOM 2541 N GLU B 50 173.404 1.531 4.857 1.00 0.00 N ATOM 2542 CA GLU B 50 173.895 2.310 6.016 1.00 0.00 C ATOM 2543 C GLU B 50 175.084 1.584 6.606 1.00 0.00 C ATOM 2544 O GLU B 50 176.105 2.179 6.911 1.00 0.00 O ATOM 2545 CB GLU B 50 172.798 2.453 7.059 1.00 0.00 C ATOM 2546 CG GLU B 50 171.962 3.726 6.806 1.00 0.00 C ATOM 2547 CD GLU B 50 171.878 4.521 8.078 1.00 0.00 C ATOM 2548 OE1 GLU B 50 172.733 5.336 8.294 1.00 0.00 O ATOM 2549 OE2 GLU B 50 170.969 4.287 8.842 1.00 0.00 O ATOM 0 H GLU B 50 172.498 1.080 4.985 1.00 0.00 H new ATOM 0 HA GLU B 50 174.188 3.310 5.695 1.00 0.00 H new ATOM 0 HB2 GLU B 50 172.150 1.577 7.034 1.00 0.00 H new ATOM 0 HB3 GLU B 50 173.240 2.495 8.054 1.00 0.00 H new ATOM 0 HG2 GLU B 50 172.418 4.325 6.018 1.00 0.00 H new ATOM 0 HG3 GLU B 50 170.963 3.457 6.464 1.00 0.00 H new ATOM 2556 N ASP B 51 174.974 0.295 6.721 1.00 0.00 N ATOM 2557 CA ASP B 51 176.084 -0.521 7.265 1.00 0.00 C ATOM 2558 C ASP B 51 177.317 -0.272 6.420 1.00 0.00 C ATOM 2559 O ASP B 51 178.347 0.193 6.892 1.00 0.00 O ATOM 2560 CB ASP B 51 175.711 -2.017 7.160 1.00 0.00 C ATOM 2561 CG ASP B 51 174.992 -2.513 8.399 1.00 0.00 C ATOM 2562 OD1 ASP B 51 174.352 -1.742 9.067 1.00 0.00 O ATOM 2563 OD2 ASP B 51 175.066 -3.692 8.648 1.00 0.00 O ATOM 0 H ASP B 51 174.145 -0.236 6.455 1.00 0.00 H new ATOM 0 HA ASP B 51 176.270 -0.256 8.306 1.00 0.00 H new ATOM 0 HB2 ASP B 51 175.077 -2.172 6.287 1.00 0.00 H new ATOM 0 HB3 ASP B 51 176.615 -2.606 7.006 1.00 0.00 H new ATOM 2568 N GLU B 52 177.230 -0.611 5.174 1.00 0.00 N ATOM 2569 CA GLU B 52 178.393 -0.451 4.281 1.00 0.00 C ATOM 2570 C GLU B 52 178.748 1.020 4.140 1.00 0.00 C ATOM 2571 O GLU B 52 179.879 1.353 4.076 1.00 0.00 O ATOM 2572 CB GLU B 52 178.110 -1.069 2.898 1.00 0.00 C ATOM 2573 CG GLU B 52 178.539 -2.543 2.902 1.00 0.00 C ATOM 2574 CD GLU B 52 178.070 -3.209 1.639 1.00 0.00 C ATOM 2575 OE1 GLU B 52 178.789 -3.184 0.671 1.00 0.00 O ATOM 2576 OE2 GLU B 52 176.995 -3.734 1.643 1.00 0.00 O ATOM 0 H GLU B 52 176.395 -0.996 4.733 1.00 0.00 H new ATOM 0 HA GLU B 52 179.240 -0.977 4.722 1.00 0.00 H new ATOM 0 HB2 GLU B 52 177.049 -0.988 2.661 1.00 0.00 H new ATOM 0 HB3 GLU B 52 178.652 -0.523 2.126 1.00 0.00 H new ATOM 0 HG2 GLU B 52 179.624 -2.616 2.982 1.00 0.00 H new ATOM 0 HG3 GLU B 52 178.120 -3.052 3.770 1.00 0.00 H new ATOM 2583 N ASN B 53 177.785 1.891 4.055 1.00 0.00 N ATOM 2584 CA ASN B 53 178.095 3.339 3.863 1.00 0.00 C ATOM 2585 C ASN B 53 178.994 3.790 4.963 1.00 0.00 C ATOM 2586 O ASN B 53 180.010 4.422 4.733 1.00 0.00 O ATOM 2587 CB ASN B 53 176.797 4.156 3.891 1.00 0.00 C ATOM 2588 CG ASN B 53 176.201 4.129 2.499 1.00 0.00 C ATOM 2589 OD1 ASN B 53 176.169 3.009 1.853 1.00 0.00 O flip ATOM 2590 ND2 ASN B 53 175.768 5.134 1.979 1.00 0.00 N flip ATOM 0 H ASN B 53 176.792 1.665 4.110 1.00 0.00 H new ATOM 0 HA ASN B 53 178.585 3.485 2.900 1.00 0.00 H new ATOM 0 HB2 ASN B 53 176.097 3.736 4.614 1.00 0.00 H new ATOM 0 HB3 ASN B 53 176.998 5.182 4.200 1.00 0.00 H new ATOM 0 HD21 ASN B 53 175.791 6.020 2.484 1.00 0.00 H new ATOM 0 HD22 ASN B 53 175.381 5.094 1.036 1.00 0.00 H new ATOM 2597 N ASN B 54 178.646 3.434 6.163 1.00 0.00 N ATOM 2598 CA ASN B 54 179.462 3.790 7.335 1.00 0.00 C ATOM 2599 C ASN B 54 180.881 3.333 7.088 1.00 0.00 C ATOM 2600 O ASN B 54 181.808 4.132 7.008 1.00 0.00 O ATOM 2601 CB ASN B 54 178.962 3.018 8.538 1.00 0.00 C ATOM 2602 CG ASN B 54 177.630 3.530 9.045 1.00 0.00 C ATOM 2603 OD1 ASN B 54 176.973 4.386 8.438 1.00 0.00 O ATOM 2604 ND2 ASN B 54 177.189 3.038 10.136 1.00 0.00 N ATOM 0 H ASN B 54 177.806 2.897 6.379 1.00 0.00 H new ATOM 0 HA ASN B 54 179.406 4.865 7.504 1.00 0.00 H new ATOM 0 HB2 ASN B 54 178.866 1.965 8.275 1.00 0.00 H new ATOM 0 HB3 ASN B 54 179.700 3.081 9.338 1.00 0.00 H new ATOM 0 HD21 ASN B 54 176.293 3.350 10.511 1.00 0.00 H new ATOM 0 HD22 ASN B 54 177.732 2.333 10.634 1.00 0.00 H new ATOM 2611 N ARG B 55 181.064 2.040 6.985 1.00 0.00 N ATOM 2612 CA ARG B 55 182.416 1.481 6.779 1.00 0.00 C ATOM 2613 C ARG B 55 183.015 2.083 5.522 1.00 0.00 C ATOM 2614 O ARG B 55 183.981 2.780 5.585 1.00 0.00 O ATOM 2615 CB ARG B 55 182.336 -0.059 6.646 1.00 0.00 C ATOM 2616 CG ARG B 55 181.537 -0.676 7.824 1.00 0.00 C ATOM 2617 CD ARG B 55 182.203 -0.347 9.184 1.00 0.00 C ATOM 2618 NE ARG B 55 182.720 -1.603 9.831 1.00 0.00 N ATOM 2619 CZ ARG B 55 181.950 -2.341 10.608 1.00 0.00 C ATOM 2620 NH1 ARG B 55 180.675 -2.089 10.695 1.00 0.00 N ATOM 2621 NH2 ARG B 55 182.457 -3.348 11.249 1.00 0.00 N ATOM 0 H ARG B 55 180.318 1.347 7.037 1.00 0.00 H new ATOM 0 HA ARG B 55 183.047 1.723 7.634 1.00 0.00 H new ATOM 0 HB2 ARG B 55 181.860 -0.322 5.701 1.00 0.00 H new ATOM 0 HB3 ARG B 55 183.342 -0.479 6.624 1.00 0.00 H new ATOM 0 HG2 ARG B 55 180.516 -0.295 7.814 1.00 0.00 H new ATOM 0 HG3 ARG B 55 181.475 -1.757 7.698 1.00 0.00 H new ATOM 0 HD2 ARG B 55 183.022 0.357 9.035 1.00 0.00 H new ATOM 0 HD3 ARG B 55 181.482 0.138 9.842 1.00 0.00 H new ATOM 0 HE ARG B 55 183.685 -1.890 9.666 1.00 0.00 H new ATOM 0 HH11 ARG B 55 180.270 -1.320 10.162 1.00 0.00 H new ATOM 0 HH12 ARG B 55 180.082 -2.661 11.296 1.00 0.00 H new ATOM 0 HH21 ARG B 55 183.448 -3.568 11.152 1.00 0.00 H new ATOM 0 HH22 ARG B 55 181.864 -3.920 11.850 1.00 0.00 H new ATOM 2635 N LEU B 56 182.422 1.828 4.397 1.00 0.00 N ATOM 2636 CA LEU B 56 182.920 2.345 3.090 1.00 0.00 C ATOM 2637 C LEU B 56 183.538 3.707 3.239 1.00 0.00 C ATOM 2638 O LEU B 56 184.699 3.919 2.908 1.00 0.00 O ATOM 2639 CB LEU B 56 181.708 2.521 2.154 1.00 0.00 C ATOM 2640 CG LEU B 56 181.387 1.203 1.437 1.00 0.00 C ATOM 2641 CD1 LEU B 56 180.068 1.358 0.680 1.00 0.00 C ATOM 2642 CD2 LEU B 56 182.507 0.866 0.435 1.00 0.00 C ATOM 0 H LEU B 56 181.578 1.260 4.323 1.00 0.00 H new ATOM 0 HA LEU B 56 183.660 1.642 2.706 1.00 0.00 H new ATOM 0 HB2 LEU B 56 180.842 2.850 2.729 1.00 0.00 H new ATOM 0 HB3 LEU B 56 181.918 3.299 1.420 1.00 0.00 H new ATOM 0 HG LEU B 56 181.307 0.401 2.171 1.00 0.00 H new ATOM 0 HD11 LEU B 56 179.831 0.426 0.167 1.00 0.00 H new ATOM 0 HD12 LEU B 56 179.271 1.598 1.384 1.00 0.00 H new ATOM 0 HD13 LEU B 56 180.160 2.161 -0.051 1.00 0.00 H new ATOM 0 HD21 LEU B 56 182.273 -0.071 -0.071 1.00 0.00 H new ATOM 0 HD22 LEU B 56 182.589 1.665 -0.302 1.00 0.00 H new ATOM 0 HD23 LEU B 56 183.453 0.765 0.967 1.00 0.00 H new ATOM 2654 N ARG B 57 182.753 4.656 3.671 1.00 0.00 N ATOM 2655 CA ARG B 57 183.232 6.047 3.785 1.00 0.00 C ATOM 2656 C ARG B 57 184.415 6.121 4.734 1.00 0.00 C ATOM 2657 O ARG B 57 185.279 6.967 4.564 1.00 0.00 O ATOM 2658 CB ARG B 57 182.082 6.956 4.236 1.00 0.00 C ATOM 2659 CG ARG B 57 180.998 6.947 3.142 1.00 0.00 C ATOM 2660 CD ARG B 57 180.542 8.371 2.803 1.00 0.00 C ATOM 2661 NE ARG B 57 179.667 8.871 3.899 1.00 0.00 N ATOM 2662 CZ ARG B 57 178.609 9.600 3.641 1.00 0.00 C ATOM 2663 NH1 ARG B 57 178.420 10.082 2.441 1.00 0.00 N ATOM 2664 NH2 ARG B 57 177.772 9.884 4.601 1.00 0.00 N ATOM 0 H ARG B 57 181.783 4.515 3.953 1.00 0.00 H new ATOM 0 HA ARG B 57 183.574 6.396 2.811 1.00 0.00 H new ATOM 0 HB2 ARG B 57 181.669 6.605 5.182 1.00 0.00 H new ATOM 0 HB3 ARG B 57 182.444 7.971 4.403 1.00 0.00 H new ATOM 0 HG2 ARG B 57 181.386 6.463 2.246 1.00 0.00 H new ATOM 0 HG3 ARG B 57 180.144 6.359 3.477 1.00 0.00 H new ATOM 0 HD2 ARG B 57 181.406 9.025 2.682 1.00 0.00 H new ATOM 0 HD3 ARG B 57 180.002 8.379 1.856 1.00 0.00 H new ATOM 0 HE ARG B 57 179.895 8.642 4.867 1.00 0.00 H new ATOM 0 HH11 ARG B 57 179.097 9.891 1.702 1.00 0.00 H new ATOM 0 HH12 ARG B 57 177.596 10.649 2.243 1.00 0.00 H new ATOM 0 HH21 ARG B 57 177.943 9.539 5.546 1.00 0.00 H new ATOM 0 HH22 ARG B 57 176.947 10.451 4.407 1.00 0.00 H new ATOM 2678 N LEU B 58 184.489 5.253 5.704 1.00 0.00 N ATOM 2679 CA LEU B 58 185.637 5.247 6.622 1.00 0.00 C ATOM 2680 C LEU B 58 186.798 4.496 5.946 1.00 0.00 C ATOM 2681 O LEU B 58 187.914 5.000 5.868 1.00 0.00 O ATOM 2682 CB LEU B 58 185.249 4.579 7.931 1.00 0.00 C ATOM 2683 CG LEU B 58 184.065 5.320 8.563 1.00 0.00 C ATOM 2684 CD1 LEU B 58 183.374 4.448 9.624 1.00 0.00 C ATOM 2685 CD2 LEU B 58 184.552 6.619 9.195 1.00 0.00 C ATOM 0 H LEU B 58 183.785 4.540 5.894 1.00 0.00 H new ATOM 0 HA LEU B 58 185.949 6.267 6.846 1.00 0.00 H new ATOM 0 HB2 LEU B 58 184.984 3.537 7.753 1.00 0.00 H new ATOM 0 HB3 LEU B 58 186.097 4.580 8.615 1.00 0.00 H new ATOM 0 HG LEU B 58 183.340 5.544 7.781 1.00 0.00 H new ATOM 0 HD11 LEU B 58 182.538 4.996 10.057 1.00 0.00 H new ATOM 0 HD12 LEU B 58 183.006 3.533 9.160 1.00 0.00 H new ATOM 0 HD13 LEU B 58 184.088 4.196 10.408 1.00 0.00 H new ATOM 0 HD21 LEU B 58 183.709 7.144 9.644 1.00 0.00 H new ATOM 0 HD22 LEU B 58 185.291 6.395 9.965 1.00 0.00 H new ATOM 0 HD23 LEU B 58 185.005 7.248 8.429 1.00 0.00 H new ATOM 2697 N GLU B 59 186.557 3.312 5.461 1.00 0.00 N ATOM 2698 CA GLU B 59 187.617 2.526 4.775 1.00 0.00 C ATOM 2699 C GLU B 59 188.227 3.399 3.713 1.00 0.00 C ATOM 2700 O GLU B 59 189.416 3.629 3.686 1.00 0.00 O ATOM 2701 CB GLU B 59 186.990 1.297 4.065 1.00 0.00 C ATOM 2702 CG GLU B 59 186.193 0.428 5.042 1.00 0.00 C ATOM 2703 CD GLU B 59 185.567 -0.719 4.267 1.00 0.00 C ATOM 2704 OE1 GLU B 59 184.839 -0.460 3.336 1.00 0.00 O ATOM 2705 OE2 GLU B 59 185.838 -1.845 4.601 1.00 0.00 O ATOM 0 H GLU B 59 185.651 2.847 5.513 1.00 0.00 H new ATOM 0 HA GLU B 59 188.356 2.197 5.505 1.00 0.00 H new ATOM 0 HB2 GLU B 59 186.336 1.635 3.261 1.00 0.00 H new ATOM 0 HB3 GLU B 59 187.778 0.700 3.606 1.00 0.00 H new ATOM 0 HG2 GLU B 59 186.845 0.044 5.826 1.00 0.00 H new ATOM 0 HG3 GLU B 59 185.420 1.020 5.532 1.00 0.00 H new ATOM 2712 N SER B 60 187.407 3.862 2.820 1.00 0.00 N ATOM 2713 CA SER B 60 187.898 4.680 1.697 1.00 0.00 C ATOM 2714 C SER B 60 188.844 5.770 2.206 1.00 0.00 C ATOM 2715 O SER B 60 189.813 6.109 1.554 1.00 0.00 O ATOM 2716 CB SER B 60 186.708 5.328 0.980 1.00 0.00 C ATOM 2717 OG SER B 60 185.750 5.772 1.943 1.00 0.00 O ATOM 0 H SER B 60 186.400 3.703 2.825 1.00 0.00 H new ATOM 0 HA SER B 60 188.442 4.039 1.003 1.00 0.00 H new ATOM 0 HB2 SER B 60 187.049 6.170 0.377 1.00 0.00 H new ATOM 0 HB3 SER B 60 186.248 4.613 0.298 1.00 0.00 H new ATOM 0 HG SER B 60 185.148 5.033 2.171 1.00 0.00 H new ATOM 2723 N LYS B 61 188.552 6.356 3.355 1.00 0.00 N ATOM 2724 CA LYS B 61 189.431 7.465 3.860 1.00 0.00 C ATOM 2725 C LYS B 61 190.714 6.866 4.394 1.00 0.00 C ATOM 2726 O LYS B 61 191.758 7.494 4.377 1.00 0.00 O ATOM 2727 CB LYS B 61 188.744 8.256 4.975 1.00 0.00 C ATOM 2728 CG LYS B 61 187.519 8.984 4.428 1.00 0.00 C ATOM 2729 CD LYS B 61 186.545 9.325 5.576 1.00 0.00 C ATOM 2730 CE LYS B 61 185.281 9.983 5.001 1.00 0.00 C ATOM 2731 NZ LYS B 61 184.866 9.244 3.790 1.00 0.00 N ATOM 0 H LYS B 61 187.759 6.118 3.951 1.00 0.00 H new ATOM 0 HA LYS B 61 189.637 8.147 3.035 1.00 0.00 H new ATOM 0 HB2 LYS B 61 188.447 7.582 5.779 1.00 0.00 H new ATOM 0 HB3 LYS B 61 189.442 8.975 5.404 1.00 0.00 H new ATOM 0 HG2 LYS B 61 187.827 9.897 3.919 1.00 0.00 H new ATOM 0 HG3 LYS B 61 187.017 8.361 3.688 1.00 0.00 H new ATOM 0 HD2 LYS B 61 186.280 8.420 6.122 1.00 0.00 H new ATOM 0 HD3 LYS B 61 187.026 9.997 6.287 1.00 0.00 H new ATOM 0 HE2 LYS B 61 184.481 9.974 5.741 1.00 0.00 H new ATOM 0 HE3 LYS B 61 185.477 11.027 4.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 183.866 9.443 3.588 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 185.449 9.545 2.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 184.991 8.223 3.946 1.00 0.00 H new ATOM 2745 N ARG B 62 190.641 5.681 4.912 1.00 0.00 N ATOM 2746 CA ARG B 62 191.833 5.024 5.485 1.00 0.00 C ATOM 2747 C ARG B 62 192.431 4.093 4.451 1.00 0.00 C ATOM 2748 O ARG B 62 193.213 3.198 4.773 1.00 0.00 O ATOM 2749 CB ARG B 62 191.449 4.257 6.752 1.00 0.00 C ATOM 2750 CG ARG B 62 191.044 5.255 7.860 1.00 0.00 C ATOM 2751 CD ARG B 62 192.235 6.172 8.213 1.00 0.00 C ATOM 2752 NE ARG B 62 193.488 5.348 8.287 1.00 0.00 N ATOM 2753 CZ ARG B 62 194.641 5.765 7.793 1.00 0.00 C ATOM 2754 NH1 ARG B 62 194.746 6.951 7.233 1.00 0.00 N ATOM 2755 NH2 ARG B 62 195.677 4.990 7.880 1.00 0.00 N ATOM 0 H ARG B 62 189.785 5.129 4.963 1.00 0.00 H new ATOM 0 HA ARG B 62 192.575 5.775 5.757 1.00 0.00 H new ATOM 0 HB2 ARG B 62 190.623 3.577 6.541 1.00 0.00 H new ATOM 0 HB3 ARG B 62 192.287 3.646 7.087 1.00 0.00 H new ATOM 0 HG2 ARG B 62 190.199 5.857 7.526 1.00 0.00 H new ATOM 0 HG3 ARG B 62 190.718 4.712 8.747 1.00 0.00 H new ATOM 0 HD2 ARG B 62 192.343 6.953 7.461 1.00 0.00 H new ATOM 0 HD3 ARG B 62 192.056 6.670 9.166 1.00 0.00 H new ATOM 0 HE ARG B 62 193.448 4.433 8.735 1.00 0.00 H new ATOM 0 HH11 ARG B 62 193.931 7.562 7.176 1.00 0.00 H new ATOM 0 HH12 ARG B 62 195.642 7.259 6.856 1.00 0.00 H new ATOM 0 HH21 ARG B 62 195.594 4.075 8.324 1.00 0.00 H new ATOM 0 HH22 ARG B 62 196.575 5.295 7.504 1.00 0.00 H new ATOM 2769 N LEU B 63 192.108 4.315 3.219 1.00 0.00 N ATOM 2770 CA LEU B 63 192.658 3.522 2.131 1.00 0.00 C ATOM 2771 C LEU B 63 193.598 4.418 1.317 1.00 0.00 C ATOM 2772 O LEU B 63 193.589 5.638 1.450 1.00 0.00 O ATOM 2773 CB LEU B 63 191.525 3.019 1.230 1.00 0.00 C ATOM 2774 CG LEU B 63 190.920 1.698 1.777 1.00 0.00 C ATOM 2775 CD1 LEU B 63 189.549 1.449 1.141 1.00 0.00 C ATOM 2776 CD2 LEU B 63 191.834 0.519 1.426 1.00 0.00 C ATOM 0 H LEU B 63 191.459 5.044 2.923 1.00 0.00 H new ATOM 0 HA LEU B 63 193.198 2.663 2.529 1.00 0.00 H new ATOM 0 HB2 LEU B 63 190.746 3.778 1.162 1.00 0.00 H new ATOM 0 HB3 LEU B 63 191.903 2.859 0.220 1.00 0.00 H new ATOM 0 HG LEU B 63 190.821 1.786 2.859 1.00 0.00 H new ATOM 0 HD11 LEU B 63 189.131 0.520 1.530 1.00 0.00 H new ATOM 0 HD12 LEU B 63 188.881 2.276 1.381 1.00 0.00 H new ATOM 0 HD13 LEU B 63 189.658 1.373 0.059 1.00 0.00 H new ATOM 0 HD21 LEU B 63 191.402 -0.404 1.813 1.00 0.00 H new ATOM 0 HD22 LEU B 63 191.934 0.446 0.343 1.00 0.00 H new ATOM 0 HD23 LEU B 63 192.816 0.675 1.872 1.00 0.00 H new ATOM 2788 N GLY B 64 194.374 3.837 0.478 1.00 0.00 N ATOM 2789 CA GLY B 64 195.314 4.599 -0.400 1.00 0.00 C ATOM 2790 C GLY B 64 195.305 3.932 -1.765 1.00 0.00 C ATOM 2791 O GLY B 64 194.263 3.722 -2.341 1.00 0.00 O ATOM 0 H GLY B 64 194.409 2.826 0.347 1.00 0.00 H new ATOM 0 HA2 GLY B 64 195.004 5.641 -0.480 1.00 0.00 H new ATOM 0 HA3 GLY B 64 196.319 4.597 0.021 1.00 0.00 H new ATOM 2795 N GLY B 65 196.419 3.527 -2.271 1.00 0.00 N ATOM 2796 CA GLY B 65 196.424 2.831 -3.609 1.00 0.00 C ATOM 2797 C GLY B 65 197.799 2.976 -4.169 1.00 0.00 C ATOM 2798 O GLY B 65 198.004 3.554 -5.232 1.00 0.00 O ATOM 0 H GLY B 65 197.334 3.638 -1.833 1.00 0.00 H new ATOM 0 HA2 GLY B 65 196.162 1.779 -3.498 1.00 0.00 H new ATOM 0 HA3 GLY B 65 195.686 3.275 -4.278 1.00 0.00 H new ATOM 2802 N ASP B 66 198.750 2.617 -3.396 1.00 0.00 N ATOM 2803 CA ASP B 66 200.149 2.871 -3.733 1.00 0.00 C ATOM 2804 C ASP B 66 200.877 1.557 -3.974 1.00 0.00 C ATOM 2805 O ASP B 66 202.045 1.545 -4.319 1.00 0.00 O ATOM 2806 CB ASP B 66 200.792 3.607 -2.536 1.00 0.00 C ATOM 2807 CG ASP B 66 199.733 4.344 -1.700 1.00 0.00 C ATOM 2808 OD1 ASP B 66 198.937 3.693 -1.032 1.00 0.00 O ATOM 2809 OD2 ASP B 66 199.716 5.547 -1.751 1.00 0.00 O ATOM 0 H ASP B 66 198.611 2.138 -2.506 1.00 0.00 H new ATOM 0 HA ASP B 66 200.216 3.472 -4.640 1.00 0.00 H new ATOM 0 HB2 ASP B 66 201.321 2.891 -1.907 1.00 0.00 H new ATOM 0 HB3 ASP B 66 201.532 4.320 -2.899 1.00 0.00 H new ATOM 2814 N ASP B 67 200.215 0.450 -3.755 1.00 0.00 N ATOM 2815 CA ASP B 67 200.858 -0.912 -3.924 1.00 0.00 C ATOM 2816 C ASP B 67 201.701 -0.968 -5.189 1.00 0.00 C ATOM 2817 O ASP B 67 202.752 -1.596 -5.231 1.00 0.00 O ATOM 2818 CB ASP B 67 199.775 -1.984 -4.026 1.00 0.00 C ATOM 2819 CG ASP B 67 200.395 -3.298 -4.427 1.00 0.00 C ATOM 2820 OD1 ASP B 67 200.876 -3.981 -3.575 1.00 0.00 O ATOM 2821 OD2 ASP B 67 200.371 -3.617 -5.596 1.00 0.00 O ATOM 0 H ASP B 67 199.239 0.420 -3.461 1.00 0.00 H new ATOM 0 HA ASP B 67 201.496 -1.088 -3.058 1.00 0.00 H new ATOM 0 HB2 ASP B 67 199.263 -2.090 -3.069 1.00 0.00 H new ATOM 0 HB3 ASP B 67 199.024 -1.687 -4.758 1.00 0.00 H new ATOM 2826 N ALA B 68 201.269 -0.321 -6.217 1.00 0.00 N ATOM 2827 CA ALA B 68 202.063 -0.335 -7.471 1.00 0.00 C ATOM 2828 C ALA B 68 203.255 0.588 -7.283 1.00 0.00 C ATOM 2829 O ALA B 68 204.366 0.244 -7.644 1.00 0.00 O ATOM 2830 CB ALA B 68 201.218 0.085 -8.657 1.00 0.00 C ATOM 0 H ALA B 68 200.404 0.218 -6.251 1.00 0.00 H new ATOM 0 HA ALA B 68 202.411 -1.346 -7.681 1.00 0.00 H new ATOM 0 HB1 ALA B 68 201.826 0.066 -9.562 1.00 0.00 H new ATOM 0 HB2 ALA B 68 200.380 -0.603 -8.768 1.00 0.00 H new ATOM 0 HB3 ALA B 68 200.840 1.095 -8.495 1.00 0.00 H new ATOM 2836 N ARG B 69 203.069 1.695 -6.620 1.00 0.00 N ATOM 2837 CA ARG B 69 204.225 2.559 -6.304 1.00 0.00 C ATOM 2838 C ARG B 69 205.142 1.746 -5.416 1.00 0.00 C ATOM 2839 O ARG B 69 206.339 1.677 -5.635 1.00 0.00 O ATOM 2840 CB ARG B 69 203.776 3.833 -5.560 1.00 0.00 C ATOM 2841 CG ARG B 69 204.976 4.792 -5.383 1.00 0.00 C ATOM 2842 CD ARG B 69 205.404 5.354 -6.748 1.00 0.00 C ATOM 2843 NE ARG B 69 204.201 5.897 -7.454 1.00 0.00 N ATOM 2844 CZ ARG B 69 204.041 5.763 -8.756 1.00 0.00 C ATOM 2845 NH1 ARG B 69 204.956 5.174 -9.471 1.00 0.00 N ATOM 2846 NH2 ARG B 69 202.974 6.244 -9.321 1.00 0.00 N ATOM 0 H ARG B 69 202.166 2.033 -6.287 1.00 0.00 H new ATOM 0 HA ARG B 69 204.725 2.876 -7.219 1.00 0.00 H new ATOM 0 HB2 ARG B 69 202.982 4.329 -6.118 1.00 0.00 H new ATOM 0 HB3 ARG B 69 203.364 3.569 -4.586 1.00 0.00 H new ATOM 0 HG2 ARG B 69 204.705 5.608 -4.713 1.00 0.00 H new ATOM 0 HG3 ARG B 69 205.810 4.264 -4.920 1.00 0.00 H new ATOM 0 HD2 ARG B 69 206.148 6.139 -6.615 1.00 0.00 H new ATOM 0 HD3 ARG B 69 205.870 4.572 -7.347 1.00 0.00 H new ATOM 0 HE ARG B 69 203.486 6.384 -6.914 1.00 0.00 H new ATOM 0 HH11 ARG B 69 205.800 4.815 -9.024 1.00 0.00 H new ATOM 0 HH12 ARG B 69 204.829 5.072 -10.478 1.00 0.00 H new ATOM 0 HH21 ARG B 69 202.269 6.720 -8.758 1.00 0.00 H new ATOM 0 HH22 ARG B 69 202.841 6.145 -10.328 1.00 0.00 H new ATOM 2860 N VAL B 70 204.576 1.078 -4.451 1.00 0.00 N ATOM 2861 CA VAL B 70 205.382 0.195 -3.572 1.00 0.00 C ATOM 2862 C VAL B 70 206.191 -0.704 -4.479 1.00 0.00 C ATOM 2863 O VAL B 70 207.385 -0.781 -4.388 1.00 0.00 O ATOM 2864 CB VAL B 70 204.435 -0.677 -2.716 1.00 0.00 C ATOM 2865 CG1 VAL B 70 205.215 -1.585 -1.766 1.00 0.00 C ATOM 2866 CG2 VAL B 70 203.510 0.202 -1.904 1.00 0.00 C ATOM 0 H VAL B 70 203.580 1.108 -4.234 1.00 0.00 H new ATOM 0 HA VAL B 70 206.024 0.778 -2.912 1.00 0.00 H new ATOM 0 HB VAL B 70 203.857 -1.300 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL B 70 204.517 -2.183 -1.180 1.00 0.00 H new ATOM 0 HG12 VAL B 70 205.863 -2.245 -2.343 1.00 0.00 H new ATOM 0 HG13 VAL B 70 205.822 -0.975 -1.096 1.00 0.00 H new ATOM 0 HG21 VAL B 70 202.847 -0.423 -1.305 1.00 0.00 H new ATOM 0 HG22 VAL B 70 204.099 0.841 -1.246 1.00 0.00 H new ATOM 0 HG23 VAL B 70 202.916 0.822 -2.575 1.00 0.00 H new ATOM 2876 N ARG B 71 205.526 -1.368 -5.359 1.00 0.00 N ATOM 2877 CA ARG B 71 206.210 -2.296 -6.290 1.00 0.00 C ATOM 2878 C ARG B 71 207.288 -1.555 -7.056 1.00 0.00 C ATOM 2879 O ARG B 71 208.398 -2.034 -7.190 1.00 0.00 O ATOM 2880 CB ARG B 71 205.177 -2.875 -7.264 1.00 0.00 C ATOM 2881 CG ARG B 71 205.645 -4.236 -7.816 1.00 0.00 C ATOM 2882 CD ARG B 71 204.448 -4.958 -8.461 1.00 0.00 C ATOM 2883 NE ARG B 71 203.260 -4.851 -7.551 1.00 0.00 N ATOM 2884 CZ ARG B 71 203.236 -5.492 -6.397 1.00 0.00 C ATOM 2885 NH1 ARG B 71 204.135 -6.418 -6.143 1.00 0.00 N ATOM 2886 NH2 ARG B 71 202.303 -5.231 -5.535 1.00 0.00 N ATOM 0 H ARG B 71 204.515 -1.310 -5.480 1.00 0.00 H new ATOM 0 HA ARG B 71 206.676 -3.105 -5.728 1.00 0.00 H new ATOM 0 HB2 ARG B 71 204.219 -2.993 -6.757 1.00 0.00 H new ATOM 0 HB3 ARG B 71 205.018 -2.179 -8.088 1.00 0.00 H new ATOM 0 HG2 ARG B 71 206.437 -4.091 -8.551 1.00 0.00 H new ATOM 0 HG3 ARG B 71 206.062 -4.844 -7.013 1.00 0.00 H new ATOM 0 HD2 ARG B 71 204.220 -4.515 -9.430 1.00 0.00 H new ATOM 0 HD3 ARG B 71 204.692 -6.005 -8.639 1.00 0.00 H new ATOM 0 HE ARG B 71 202.463 -4.277 -7.827 1.00 0.00 H new ATOM 0 HH11 ARG B 71 204.849 -6.640 -6.837 1.00 0.00 H new ATOM 0 HH12 ARG B 71 204.118 -6.914 -5.252 1.00 0.00 H new ATOM 0 HH21 ARG B 71 201.591 -4.533 -5.750 1.00 0.00 H new ATOM 0 HH22 ARG B 71 202.281 -5.724 -4.642 1.00 0.00 H new ATOM 2900 N GLU B 72 206.996 -0.386 -7.540 1.00 0.00 N ATOM 2901 CA GLU B 72 208.034 0.377 -8.272 1.00 0.00 C ATOM 2902 C GLU B 72 209.211 0.604 -7.338 1.00 0.00 C ATOM 2903 O GLU B 72 210.374 0.437 -7.716 1.00 0.00 O ATOM 2904 CB GLU B 72 207.474 1.720 -8.742 1.00 0.00 C ATOM 2905 CG GLU B 72 206.440 1.485 -9.860 1.00 0.00 C ATOM 2906 CD GLU B 72 206.262 2.747 -10.683 1.00 0.00 C ATOM 2907 OE1 GLU B 72 207.229 3.379 -10.970 1.00 0.00 O ATOM 2908 OE2 GLU B 72 205.168 3.049 -11.034 1.00 0.00 O ATOM 0 H GLU B 72 206.088 0.072 -7.461 1.00 0.00 H new ATOM 0 HA GLU B 72 208.354 -0.185 -9.150 1.00 0.00 H new ATOM 0 HB2 GLU B 72 207.009 2.244 -7.907 1.00 0.00 H new ATOM 0 HB3 GLU B 72 208.282 2.355 -9.107 1.00 0.00 H new ATOM 0 HG2 GLU B 72 206.767 0.667 -10.502 1.00 0.00 H new ATOM 0 HG3 GLU B 72 205.485 1.188 -9.426 1.00 0.00 H new ATOM 2915 N LEU B 73 208.937 0.958 -6.125 1.00 0.00 N ATOM 2916 CA LEU B 73 210.025 1.172 -5.165 1.00 0.00 C ATOM 2917 C LEU B 73 210.711 -0.145 -4.884 1.00 0.00 C ATOM 2918 O LEU B 73 211.911 -0.203 -4.812 1.00 0.00 O ATOM 2919 CB LEU B 73 209.506 1.795 -3.887 1.00 0.00 C ATOM 2920 CG LEU B 73 208.871 3.163 -4.199 1.00 0.00 C ATOM 2921 CD1 LEU B 73 208.199 3.680 -2.960 1.00 0.00 C ATOM 2922 CD2 LEU B 73 209.939 4.180 -4.630 1.00 0.00 C ATOM 0 H LEU B 73 207.997 1.108 -5.759 1.00 0.00 H new ATOM 0 HA LEU B 73 210.747 1.866 -5.595 1.00 0.00 H new ATOM 0 HB2 LEU B 73 208.770 1.138 -3.424 1.00 0.00 H new ATOM 0 HB3 LEU B 73 210.320 1.915 -3.173 1.00 0.00 H new ATOM 0 HG LEU B 73 208.155 3.035 -5.010 1.00 0.00 H new ATOM 0 HD11 LEU B 73 207.746 4.649 -3.169 1.00 0.00 H new ATOM 0 HD12 LEU B 73 207.427 2.978 -2.645 1.00 0.00 H new ATOM 0 HD13 LEU B 73 208.936 3.789 -2.165 1.00 0.00 H new ATOM 0 HD21 LEU B 73 209.464 5.137 -4.844 1.00 0.00 H new ATOM 0 HD22 LEU B 73 210.665 4.307 -3.827 1.00 0.00 H new ATOM 0 HD23 LEU B 73 210.446 3.818 -5.524 1.00 0.00 H new ATOM 2934 N GLU B 74 209.975 -1.212 -4.775 1.00 0.00 N ATOM 2935 CA GLU B 74 210.608 -2.525 -4.566 1.00 0.00 C ATOM 2936 C GLU B 74 211.533 -2.800 -5.756 1.00 0.00 C ATOM 2937 O GLU B 74 212.691 -3.178 -5.591 1.00 0.00 O ATOM 2938 CB GLU B 74 209.523 -3.593 -4.494 1.00 0.00 C ATOM 2939 CG GLU B 74 208.736 -3.453 -3.179 1.00 0.00 C ATOM 2940 CD GLU B 74 208.125 -4.779 -2.820 1.00 0.00 C ATOM 2941 OE1 GLU B 74 208.836 -5.630 -2.348 1.00 0.00 O ATOM 2942 OE2 GLU B 74 206.955 -4.945 -3.043 1.00 0.00 O ATOM 0 H GLU B 74 208.956 -1.224 -4.823 1.00 0.00 H new ATOM 0 HA GLU B 74 211.181 -2.537 -3.639 1.00 0.00 H new ATOM 0 HB2 GLU B 74 208.848 -3.496 -5.344 1.00 0.00 H new ATOM 0 HB3 GLU B 74 209.972 -4.584 -4.555 1.00 0.00 H new ATOM 0 HG2 GLU B 74 209.397 -3.117 -2.380 1.00 0.00 H new ATOM 0 HG3 GLU B 74 207.957 -2.698 -3.287 1.00 0.00 H new ATOM 2949 N LEU B 75 211.052 -2.578 -6.946 1.00 0.00 N ATOM 2950 CA LEU B 75 211.890 -2.778 -8.152 1.00 0.00 C ATOM 2951 C LEU B 75 213.093 -1.851 -8.047 1.00 0.00 C ATOM 2952 O LEU B 75 214.223 -2.236 -8.340 1.00 0.00 O ATOM 2953 CB LEU B 75 211.073 -2.431 -9.393 1.00 0.00 C ATOM 2954 CG LEU B 75 209.894 -3.411 -9.544 1.00 0.00 C ATOM 2955 CD1 LEU B 75 208.679 -2.697 -10.161 1.00 0.00 C ATOM 2956 CD2 LEU B 75 210.310 -4.579 -10.445 1.00 0.00 C ATOM 0 H LEU B 75 210.100 -2.262 -7.133 1.00 0.00 H new ATOM 0 HA LEU B 75 212.221 -3.814 -8.226 1.00 0.00 H new ATOM 0 HB2 LEU B 75 210.699 -1.410 -9.318 1.00 0.00 H new ATOM 0 HB3 LEU B 75 211.707 -2.474 -10.279 1.00 0.00 H new ATOM 0 HG LEU B 75 209.621 -3.785 -8.558 1.00 0.00 H new ATOM 0 HD11 LEU B 75 207.854 -3.403 -10.261 1.00 0.00 H new ATOM 0 HD12 LEU B 75 208.375 -1.873 -9.516 1.00 0.00 H new ATOM 0 HD13 LEU B 75 208.946 -2.309 -11.144 1.00 0.00 H new ATOM 0 HD21 LEU B 75 209.475 -5.272 -10.551 1.00 0.00 H new ATOM 0 HD22 LEU B 75 210.593 -4.199 -11.426 1.00 0.00 H new ATOM 0 HD23 LEU B 75 211.158 -5.098 -9.999 1.00 0.00 H new ATOM 2968 N GLU B 76 212.878 -0.652 -7.604 1.00 0.00 N ATOM 2969 CA GLU B 76 213.998 0.295 -7.427 1.00 0.00 C ATOM 2970 C GLU B 76 214.959 -0.293 -6.391 1.00 0.00 C ATOM 2971 O GLU B 76 216.170 -0.249 -6.544 1.00 0.00 O ATOM 2972 CB GLU B 76 213.442 1.643 -6.919 1.00 0.00 C ATOM 2973 CG GLU B 76 214.321 2.806 -7.406 1.00 0.00 C ATOM 2974 CD GLU B 76 213.744 3.364 -8.679 1.00 0.00 C ATOM 2975 OE1 GLU B 76 212.728 3.988 -8.616 1.00 0.00 O ATOM 2976 OE2 GLU B 76 214.320 3.149 -9.706 1.00 0.00 O ATOM 0 H GLU B 76 211.960 -0.284 -7.354 1.00 0.00 H new ATOM 0 HA GLU B 76 214.520 0.457 -8.370 1.00 0.00 H new ATOM 0 HB2 GLU B 76 212.420 1.778 -7.274 1.00 0.00 H new ATOM 0 HB3 GLU B 76 213.404 1.640 -5.830 1.00 0.00 H new ATOM 0 HG2 GLU B 76 214.371 3.584 -6.644 1.00 0.00 H new ATOM 0 HG3 GLU B 76 215.341 2.460 -7.576 1.00 0.00 H new ATOM 2983 N LEU B 77 214.428 -0.835 -5.340 1.00 0.00 N ATOM 2984 CA LEU B 77 215.282 -1.409 -4.279 1.00 0.00 C ATOM 2985 C LEU B 77 216.053 -2.570 -4.843 1.00 0.00 C ATOM 2986 O LEU B 77 217.224 -2.677 -4.628 1.00 0.00 O ATOM 2987 CB LEU B 77 214.438 -1.857 -3.082 1.00 0.00 C ATOM 2988 CG LEU B 77 214.014 -0.620 -2.270 1.00 0.00 C ATOM 2989 CD1 LEU B 77 212.859 -0.971 -1.345 1.00 0.00 C ATOM 2990 CD2 LEU B 77 215.195 -0.111 -1.434 1.00 0.00 C ATOM 0 H LEU B 77 213.425 -0.905 -5.170 1.00 0.00 H new ATOM 0 HA LEU B 77 215.977 -0.646 -3.928 1.00 0.00 H new ATOM 0 HB2 LEU B 77 213.558 -2.400 -3.426 1.00 0.00 H new ATOM 0 HB3 LEU B 77 215.010 -2.540 -2.454 1.00 0.00 H new ATOM 0 HG LEU B 77 213.697 0.159 -2.964 1.00 0.00 H new ATOM 0 HD11 LEU B 77 212.568 -0.088 -0.776 1.00 0.00 H new ATOM 0 HD12 LEU B 77 212.011 -1.317 -1.936 1.00 0.00 H new ATOM 0 HD13 LEU B 77 213.169 -1.759 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU B 77 214.886 0.764 -0.863 1.00 0.00 H new ATOM 0 HD22 LEU B 77 215.521 -0.894 -0.750 1.00 0.00 H new ATOM 0 HD23 LEU B 77 216.019 0.159 -2.095 1.00 0.00 H new ATOM 3002 N ASP B 78 215.425 -3.432 -5.597 1.00 0.00 N ATOM 3003 CA ASP B 78 216.190 -4.551 -6.208 1.00 0.00 C ATOM 3004 C ASP B 78 217.247 -3.977 -7.125 1.00 0.00 C ATOM 3005 O ASP B 78 218.351 -4.494 -7.226 1.00 0.00 O ATOM 3006 CB ASP B 78 215.270 -5.472 -7.004 1.00 0.00 C ATOM 3007 CG ASP B 78 214.758 -6.584 -6.120 1.00 0.00 C ATOM 3008 OD1 ASP B 78 215.550 -7.308 -5.582 1.00 0.00 O ATOM 3009 OD2 ASP B 78 213.580 -6.723 -6.012 1.00 0.00 O ATOM 0 H ASP B 78 214.428 -3.409 -5.813 1.00 0.00 H new ATOM 0 HA ASP B 78 216.654 -5.136 -5.414 1.00 0.00 H new ATOM 0 HB2 ASP B 78 214.433 -4.902 -7.407 1.00 0.00 H new ATOM 0 HB3 ASP B 78 215.809 -5.891 -7.854 1.00 0.00 H new ATOM 3014 N ARG B 79 216.930 -2.907 -7.789 1.00 0.00 N ATOM 3015 CA ARG B 79 217.901 -2.255 -8.678 1.00 0.00 C ATOM 3016 C ARG B 79 219.072 -1.802 -7.810 1.00 0.00 C ATOM 3017 O ARG B 79 220.225 -2.156 -8.038 1.00 0.00 O ATOM 3018 CB ARG B 79 217.228 -1.031 -9.307 1.00 0.00 C ATOM 3019 CG ARG B 79 217.766 -0.711 -10.723 1.00 0.00 C ATOM 3020 CD ARG B 79 219.303 -0.813 -10.790 1.00 0.00 C ATOM 3021 NE ARG B 79 219.689 -2.116 -11.419 1.00 0.00 N ATOM 3022 CZ ARG B 79 220.960 -2.428 -11.575 1.00 0.00 C ATOM 3023 NH1 ARG B 79 221.888 -1.658 -11.088 1.00 0.00 N ATOM 3024 NH2 ARG B 79 221.282 -3.519 -12.191 1.00 0.00 N ATOM 0 H ARG B 79 216.017 -2.453 -7.747 1.00 0.00 H new ATOM 0 HA ARG B 79 218.244 -2.927 -9.465 1.00 0.00 H new ATOM 0 HB2 ARG B 79 216.153 -1.202 -9.362 1.00 0.00 H new ATOM 0 HB3 ARG B 79 217.381 -0.166 -8.661 1.00 0.00 H new ATOM 0 HG2 ARG B 79 217.325 -1.400 -11.443 1.00 0.00 H new ATOM 0 HG3 ARG B 79 217.456 0.293 -11.011 1.00 0.00 H new ATOM 0 HD2 ARG B 79 219.708 0.017 -11.369 1.00 0.00 H new ATOM 0 HD3 ARG B 79 219.727 -0.740 -9.789 1.00 0.00 H new ATOM 0 HE ARG B 79 218.965 -2.765 -11.728 1.00 0.00 H new ATOM 0 HH11 ARG B 79 221.633 -0.809 -10.583 1.00 0.00 H new ATOM 0 HH12 ARG B 79 222.870 -1.903 -11.211 1.00 0.00 H new ATOM 0 HH21 ARG B 79 220.553 -4.134 -12.554 1.00 0.00 H new ATOM 0 HH22 ARG B 79 222.264 -3.764 -12.314 1.00 0.00 H new ATOM 3038 N LEU B 80 218.786 -1.021 -6.810 1.00 0.00 N ATOM 3039 CA LEU B 80 219.856 -0.524 -5.931 1.00 0.00 C ATOM 3040 C LEU B 80 220.573 -1.704 -5.311 1.00 0.00 C ATOM 3041 O LEU B 80 221.758 -1.670 -5.127 1.00 0.00 O ATOM 3042 CB LEU B 80 219.271 0.376 -4.847 1.00 0.00 C ATOM 3043 CG LEU B 80 219.102 1.819 -5.377 1.00 0.00 C ATOM 3044 CD1 LEU B 80 218.703 2.752 -4.235 1.00 0.00 C ATOM 3045 CD2 LEU B 80 220.415 2.326 -6.005 1.00 0.00 C ATOM 0 H LEU B 80 217.846 -0.707 -6.568 1.00 0.00 H new ATOM 0 HA LEU B 80 220.566 0.064 -6.513 1.00 0.00 H new ATOM 0 HB2 LEU B 80 218.306 -0.014 -4.523 1.00 0.00 H new ATOM 0 HB3 LEU B 80 219.924 0.377 -3.974 1.00 0.00 H new ATOM 0 HG LEU B 80 218.322 1.812 -6.138 1.00 0.00 H new ATOM 0 HD11 LEU B 80 218.586 3.766 -4.617 1.00 0.00 H new ATOM 0 HD12 LEU B 80 217.760 2.416 -3.803 1.00 0.00 H new ATOM 0 HD13 LEU B 80 219.478 2.740 -3.468 1.00 0.00 H new ATOM 0 HD21 LEU B 80 220.274 3.343 -6.371 1.00 0.00 H new ATOM 0 HD22 LEU B 80 221.205 2.317 -5.254 1.00 0.00 H new ATOM 0 HD23 LEU B 80 220.696 1.677 -6.834 1.00 0.00 H new ATOM 3057 N ARG B 81 219.859 -2.709 -4.918 1.00 0.00 N ATOM 3058 CA ARG B 81 220.506 -3.897 -4.297 1.00 0.00 C ATOM 3059 C ARG B 81 221.415 -4.516 -5.331 1.00 0.00 C ATOM 3060 O ARG B 81 222.540 -4.858 -5.042 1.00 0.00 O ATOM 3061 CB ARG B 81 219.448 -4.919 -3.851 1.00 0.00 C ATOM 3062 CG ARG B 81 218.686 -4.380 -2.623 1.00 0.00 C ATOM 3063 CD ARG B 81 217.379 -5.166 -2.427 1.00 0.00 C ATOM 3064 NE ARG B 81 217.658 -6.638 -2.493 1.00 0.00 N ATOM 3065 CZ ARG B 81 216.670 -7.510 -2.419 1.00 0.00 C ATOM 3066 NH1 ARG B 81 215.438 -7.090 -2.318 1.00 0.00 N ATOM 3067 NH2 ARG B 81 216.923 -8.787 -2.444 1.00 0.00 N ATOM 0 H ARG B 81 218.844 -2.764 -4.999 1.00 0.00 H new ATOM 0 HA ARG B 81 221.072 -3.596 -3.415 1.00 0.00 H new ATOM 0 HB2 ARG B 81 218.751 -5.114 -4.666 1.00 0.00 H new ATOM 0 HB3 ARG B 81 219.926 -5.868 -3.606 1.00 0.00 H new ATOM 0 HG2 ARG B 81 219.308 -4.466 -1.732 1.00 0.00 H new ATOM 0 HG3 ARG B 81 218.466 -3.321 -2.757 1.00 0.00 H new ATOM 0 HD2 ARG B 81 216.933 -4.914 -1.465 1.00 0.00 H new ATOM 0 HD3 ARG B 81 216.658 -4.888 -3.196 1.00 0.00 H new ATOM 0 HE ARG B 81 218.618 -6.968 -2.596 1.00 0.00 H new ATOM 0 HH11 ARG B 81 215.240 -6.090 -2.296 1.00 0.00 H new ATOM 0 HH12 ARG B 81 214.673 -7.762 -2.261 1.00 0.00 H new ATOM 0 HH21 ARG B 81 217.886 -9.115 -2.521 1.00 0.00 H new ATOM 0 HH22 ARG B 81 216.158 -9.460 -2.387 1.00 0.00 H new ATOM 3081 N ALA B 82 220.964 -4.598 -6.551 1.00 0.00 N ATOM 3082 CA ALA B 82 221.832 -5.133 -7.631 1.00 0.00 C ATOM 3083 C ALA B 82 223.109 -4.303 -7.659 1.00 0.00 C ATOM 3084 O ALA B 82 224.217 -4.828 -7.675 1.00 0.00 O ATOM 3085 CB ALA B 82 221.118 -5.020 -8.989 1.00 0.00 C ATOM 0 H ALA B 82 220.029 -4.316 -6.846 1.00 0.00 H new ATOM 0 HA ALA B 82 222.058 -6.183 -7.444 1.00 0.00 H new ATOM 0 HB1 ALA B 82 221.763 -5.415 -9.773 1.00 0.00 H new ATOM 0 HB2 ALA B 82 220.190 -5.591 -8.961 1.00 0.00 H new ATOM 0 HB3 ALA B 82 220.894 -3.974 -9.196 1.00 0.00 H new ATOM 3091 N GLU B 83 222.973 -3.009 -7.665 1.00 0.00 N ATOM 3092 CA GLU B 83 224.182 -2.143 -7.684 1.00 0.00 C ATOM 3093 C GLU B 83 224.972 -2.361 -6.389 1.00 0.00 C ATOM 3094 O GLU B 83 226.149 -2.549 -6.412 1.00 0.00 O ATOM 3095 CB GLU B 83 223.775 -0.659 -7.820 1.00 0.00 C ATOM 3096 CG GLU B 83 224.096 -0.164 -9.247 1.00 0.00 C ATOM 3097 CD GLU B 83 223.034 0.797 -9.707 1.00 0.00 C ATOM 3098 OE1 GLU B 83 221.902 0.402 -9.789 1.00 0.00 O ATOM 3099 OE2 GLU B 83 223.362 1.916 -9.974 1.00 0.00 O ATOM 0 H GLU B 83 222.081 -2.514 -7.658 1.00 0.00 H new ATOM 0 HA GLU B 83 224.805 -2.405 -8.539 1.00 0.00 H new ATOM 0 HB2 GLU B 83 222.711 -0.543 -7.614 1.00 0.00 H new ATOM 0 HB3 GLU B 83 224.309 -0.056 -7.086 1.00 0.00 H new ATOM 0 HG2 GLU B 83 225.071 0.324 -9.261 1.00 0.00 H new ATOM 0 HG3 GLU B 83 224.153 -1.011 -9.931 1.00 0.00 H new ATOM 3106 N ASN B 84 224.311 -2.358 -5.276 1.00 0.00 N ATOM 3107 CA ASN B 84 224.986 -2.563 -3.959 1.00 0.00 C ATOM 3108 C ASN B 84 225.782 -3.836 -4.006 1.00 0.00 C ATOM 3109 O ASN B 84 226.921 -3.870 -3.647 1.00 0.00 O ATOM 3110 CB ASN B 84 223.931 -2.725 -2.865 1.00 0.00 C ATOM 3111 CG ASN B 84 223.515 -1.374 -2.324 1.00 0.00 C ATOM 3112 OD1 ASN B 84 223.999 -0.943 -1.297 1.00 0.00 O ATOM 3113 ND2 ASN B 84 222.629 -0.683 -2.954 1.00 0.00 N ATOM 0 H ASN B 84 223.302 -2.219 -5.214 1.00 0.00 H new ATOM 0 HA ASN B 84 225.628 -1.707 -3.752 1.00 0.00 H new ATOM 0 HB2 ASN B 84 223.061 -3.246 -3.265 1.00 0.00 H new ATOM 0 HB3 ASN B 84 224.328 -3.340 -2.057 1.00 0.00 H new ATOM 0 HD21 ASN B 84 222.336 0.224 -2.590 1.00 0.00 H new ATOM 0 HD22 ASN B 84 222.221 -1.042 -3.817 1.00 0.00 H new ATOM 3120 N LEU B 85 225.166 -4.888 -4.425 1.00 0.00 N ATOM 3121 CA LEU B 85 225.854 -6.201 -4.487 1.00 0.00 C ATOM 3122 C LEU B 85 227.086 -6.053 -5.359 1.00 0.00 C ATOM 3123 O LEU B 85 228.189 -6.385 -4.966 1.00 0.00 O ATOM 3124 CB LEU B 85 224.875 -7.247 -5.087 1.00 0.00 C ATOM 3125 CG LEU B 85 225.619 -8.373 -5.843 1.00 0.00 C ATOM 3126 CD1 LEU B 85 226.660 -9.054 -4.938 1.00 0.00 C ATOM 3127 CD2 LEU B 85 224.604 -9.415 -6.313 1.00 0.00 C ATOM 0 H LEU B 85 224.194 -4.900 -4.735 1.00 0.00 H new ATOM 0 HA LEU B 85 226.158 -6.535 -3.495 1.00 0.00 H new ATOM 0 HB2 LEU B 85 224.276 -7.682 -4.287 1.00 0.00 H new ATOM 0 HB3 LEU B 85 224.185 -6.748 -5.768 1.00 0.00 H new ATOM 0 HG LEU B 85 226.138 -7.934 -6.695 1.00 0.00 H new ATOM 0 HD11 LEU B 85 227.167 -9.841 -5.496 1.00 0.00 H new ATOM 0 HD12 LEU B 85 227.390 -8.317 -4.605 1.00 0.00 H new ATOM 0 HD13 LEU B 85 226.161 -9.487 -4.071 1.00 0.00 H new ATOM 0 HD21 LEU B 85 225.121 -10.212 -6.847 1.00 0.00 H new ATOM 0 HD22 LEU B 85 224.086 -9.833 -5.450 1.00 0.00 H new ATOM 0 HD23 LEU B 85 223.880 -8.944 -6.978 1.00 0.00 H new ATOM 3139 N GLN B 86 226.905 -5.566 -6.532 1.00 0.00 N ATOM 3140 CA GLN B 86 228.039 -5.402 -7.464 1.00 0.00 C ATOM 3141 C GLN B 86 229.103 -4.487 -6.833 1.00 0.00 C ATOM 3142 O GLN B 86 230.289 -4.805 -6.813 1.00 0.00 O ATOM 3143 CB GLN B 86 227.507 -4.798 -8.761 1.00 0.00 C ATOM 3144 CG GLN B 86 226.745 -5.882 -9.546 1.00 0.00 C ATOM 3145 CD GLN B 86 225.824 -5.230 -10.566 1.00 0.00 C ATOM 3146 OE1 GLN B 86 225.997 -5.398 -11.766 1.00 0.00 O ATOM 3147 NE2 GLN B 86 224.844 -4.513 -10.155 1.00 0.00 N ATOM 0 H GLN B 86 226.002 -5.266 -6.899 1.00 0.00 H new ATOM 0 HA GLN B 86 228.504 -6.365 -7.674 1.00 0.00 H new ATOM 0 HB2 GLN B 86 226.847 -3.958 -8.542 1.00 0.00 H new ATOM 0 HB3 GLN B 86 228.330 -4.409 -9.360 1.00 0.00 H new ATOM 0 HG2 GLN B 86 227.451 -6.542 -10.050 1.00 0.00 H new ATOM 0 HG3 GLN B 86 226.164 -6.499 -8.861 1.00 0.00 H new ATOM 0 HE21 GLN B 86 224.699 -4.372 -9.155 1.00 0.00 H new ATOM 0 HE22 GLN B 86 224.209 -4.083 -10.828 1.00 0.00 H new ATOM 3156 N LEU B 87 228.694 -3.366 -6.334 1.00 0.00 N ATOM 3157 CA LEU B 87 229.637 -2.400 -5.714 1.00 0.00 C ATOM 3158 C LEU B 87 230.328 -3.043 -4.525 1.00 0.00 C ATOM 3159 O LEU B 87 231.530 -3.011 -4.414 1.00 0.00 O ATOM 3160 CB LEU B 87 228.867 -1.169 -5.227 1.00 0.00 C ATOM 3161 CG LEU B 87 228.218 -0.435 -6.411 1.00 0.00 C ATOM 3162 CD1 LEU B 87 227.096 0.473 -5.907 1.00 0.00 C ATOM 3163 CD2 LEU B 87 229.267 0.416 -7.120 1.00 0.00 C ATOM 0 H LEU B 87 227.719 -3.067 -6.328 1.00 0.00 H new ATOM 0 HA LEU B 87 230.379 -2.107 -6.457 1.00 0.00 H new ATOM 0 HB2 LEU B 87 228.100 -1.472 -4.515 1.00 0.00 H new ATOM 0 HB3 LEU B 87 229.543 -0.495 -4.700 1.00 0.00 H new ATOM 0 HG LEU B 87 227.808 -1.170 -7.104 1.00 0.00 H new ATOM 0 HD11 LEU B 87 226.640 0.991 -6.751 1.00 0.00 H new ATOM 0 HD12 LEU B 87 226.342 -0.128 -5.399 1.00 0.00 H new ATOM 0 HD13 LEU B 87 227.505 1.205 -5.211 1.00 0.00 H new ATOM 0 HD21 LEU B 87 228.806 0.936 -7.960 1.00 0.00 H new ATOM 0 HD22 LEU B 87 229.676 1.146 -6.421 1.00 0.00 H new ATOM 0 HD23 LEU B 87 230.069 -0.225 -7.486 1.00 0.00 H new