USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 631 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 15 TYR OH : rot 86:sc= 1.22 USER MOD Single : A 17 CYS SG : rot 180:sc= -0.379! USER MOD Single : A 21 TYR OH : rot 92:sc= -0.761 USER MOD Single : A 25 MET CE :methyl -145:sc= -0.185 (180deg=-0.763) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.0084 USER MOD Single : A 27 THR OG1 : rot 150:sc= 0.572 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0562 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -58:sc= 1.13 USER MOD Single : A 40 TYR OH : rot 70:sc= -0.576 USER MOD Single : A 41 GLN : amide:sc= -0.182 K(o=-0.18,f=-0.71) USER MOD Single : A 45 LYS NZ :NH3+ -170:sc= -0.025 (180deg=-0.159) USER MOD Single : A 49 LYS NZ :NH3+ -175:sc= 0.535 (180deg=0.49) USER MOD Single : A 50 ASN : amide:sc= -0.0977 X(o=-0.098,f=-0.1) USER MOD Single : A 51 THR OG1 : rot 28:sc= 0.651 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.217 K(o=-0.22,f=-2.8!) USER MOD Single : A 56 LYS NZ :NH3+ -123:sc= -1.61 (180deg=-2.8!) USER MOD Single : A 58 TYR OH : rot -79:sc= 0.465 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0.285 K(o=0.28,f=-7.1!) USER MOD Single : A 63 SER OG : rot 90:sc= -3.22! USER MOD Single : A 64 MET CE :methyl -130:sc= -2.21! (180deg=-2.76!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -1.43 K(o=-1.4,f=-12!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 77 GLN : amide:sc= -0.995 K(o=-1,f=-0.0054) USER MOD Single : A 78 LYS NZ :NH3+ -157:sc= 0.847 (180deg=0.183) USER MOD Single : A 80 SER OG : rot -7:sc= 1.09 USER MOD Single : A 81 GLN : amide:sc= -1.07 K(o=-1.1,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 142:sc= 1.22 (180deg=-0.0942) USER MOD Single : A 87 GLN : amide:sc= 0.104 K(o=0.1,f=-4.3!) USER MOD Single : A 88 THR OG1 : rot 44:sc= 0.135 USER MOD ----------------------------------------------------------------- ATOM 220 N TYR A 15 -5.067 -27.274 1.059 1.00 0.00 N ATOM 221 CA TYR A 15 -6.374 -27.448 1.686 1.00 0.00 C ATOM 222 C TYR A 15 -7.399 -27.880 0.635 1.00 0.00 C ATOM 223 O TYR A 15 -7.450 -27.296 -0.451 1.00 0.00 O ATOM 224 CB TYR A 15 -6.837 -26.150 2.365 1.00 0.00 C ATOM 225 CG TYR A 15 -6.046 -25.793 3.610 1.00 0.00 C ATOM 226 CD1 TYR A 15 -6.285 -26.446 4.812 1.00 0.00 C ATOM 227 CD2 TYR A 15 -5.064 -24.808 3.583 1.00 0.00 C ATOM 228 CE1 TYR A 15 -5.570 -26.132 5.951 1.00 0.00 C ATOM 229 CE2 TYR A 15 -4.345 -24.488 4.721 1.00 0.00 C ATOM 230 CZ TYR A 15 -4.604 -25.153 5.901 1.00 0.00 C ATOM 231 OH TYR A 15 -3.887 -24.848 7.037 1.00 0.00 O ATOM 0 HA TYR A 15 -6.288 -28.221 2.450 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -6.761 -25.330 1.650 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -7.890 -26.245 2.630 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -7.044 -27.213 4.857 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -4.860 -24.285 2.660 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -5.768 -26.652 6.877 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -3.585 -23.722 4.685 1.00 0.00 H new ATOM 0 HH TYR A 15 -3.124 -25.458 7.116 1.00 0.00 H new ATOM 241 N PRO A 16 -8.224 -28.910 0.926 1.00 0.00 N ATOM 242 CA PRO A 16 -8.186 -29.661 2.187 1.00 0.00 C ATOM 243 C PRO A 16 -7.064 -30.705 2.206 1.00 0.00 C ATOM 244 O PRO A 16 -6.728 -31.293 1.173 1.00 0.00 O ATOM 245 CB PRO A 16 -9.570 -30.347 2.250 1.00 0.00 C ATOM 246 CG PRO A 16 -10.321 -29.872 1.040 1.00 0.00 C ATOM 247 CD PRO A 16 -9.284 -29.417 0.051 1.00 0.00 C ATOM 0 HA PRO A 16 -7.986 -29.012 3.040 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -9.468 -31.432 2.245 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -10.097 -30.080 3.166 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -10.932 -30.673 0.622 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -10.997 -29.057 1.297 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.935 -30.235 -0.579 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -9.668 -28.644 -0.614 1.00 0.00 H new ATOM 255 N CYS A 17 -6.491 -30.928 3.384 1.00 0.00 N ATOM 256 CA CYS A 17 -5.399 -31.883 3.548 1.00 0.00 C ATOM 257 C CYS A 17 -5.280 -32.313 5.006 1.00 0.00 C ATOM 258 O CYS A 17 -5.974 -31.785 5.878 1.00 0.00 O ATOM 259 CB CYS A 17 -4.077 -31.268 3.065 1.00 0.00 C ATOM 260 SG CYS A 17 -2.656 -32.382 3.161 1.00 0.00 S ATOM 0 H CYS A 17 -6.767 -30.457 4.246 1.00 0.00 H new ATOM 0 HA CYS A 17 -5.617 -32.764 2.944 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -4.198 -30.942 2.032 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -3.866 -30.378 3.658 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.594 -31.769 2.729 1.00 0.00 H new ATOM 266 N LEU A 18 -4.406 -33.278 5.259 1.00 0.00 N ATOM 267 CA LEU A 18 -4.155 -33.769 6.609 1.00 0.00 C ATOM 268 C LEU A 18 -3.179 -32.852 7.342 1.00 0.00 C ATOM 269 O LEU A 18 -2.068 -32.604 6.866 1.00 0.00 O ATOM 270 CB LEU A 18 -3.596 -35.198 6.553 1.00 0.00 C ATOM 271 CG LEU A 18 -4.554 -36.248 5.972 1.00 0.00 C ATOM 272 CD1 LEU A 18 -3.823 -37.559 5.700 1.00 0.00 C ATOM 273 CD2 LEU A 18 -5.736 -36.476 6.914 1.00 0.00 C ATOM 0 H LEU A 18 -3.853 -33.741 4.538 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.098 -33.777 7.156 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.683 -35.192 5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.316 -35.502 7.562 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.937 -35.871 5.024 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.522 -38.287 5.289 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.018 -37.385 4.986 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.405 -37.943 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.404 -37.223 6.485 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.370 -36.827 7.879 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.278 -35.540 7.051 1.00 0.00 H new ATOM 285 N TRP A 19 -3.604 -32.346 8.493 1.00 0.00 N ATOM 286 CA TRP A 19 -2.748 -31.522 9.340 1.00 0.00 C ATOM 287 C TRP A 19 -2.326 -32.328 10.565 1.00 0.00 C ATOM 288 O TRP A 19 -3.119 -33.105 11.108 1.00 0.00 O ATOM 289 CB TRP A 19 -3.473 -30.235 9.762 1.00 0.00 C ATOM 290 CG TRP A 19 -2.567 -29.212 10.387 1.00 0.00 C ATOM 291 CD1 TRP A 19 -2.264 -29.077 11.711 1.00 0.00 C ATOM 292 CD2 TRP A 19 -1.837 -28.183 9.703 1.00 0.00 C ATOM 293 NE1 TRP A 19 -1.400 -28.027 11.893 1.00 0.00 N ATOM 294 CE2 TRP A 19 -1.123 -27.463 10.678 1.00 0.00 C ATOM 295 CE3 TRP A 19 -1.723 -27.797 8.364 1.00 0.00 C ATOM 296 CZ2 TRP A 19 -0.304 -26.383 10.358 1.00 0.00 C ATOM 297 CZ3 TRP A 19 -0.908 -26.727 8.048 1.00 0.00 C ATOM 298 CH2 TRP A 19 -0.208 -26.030 9.039 1.00 0.00 C ATOM 0 H TRP A 19 -4.543 -32.493 8.864 1.00 0.00 H new ATOM 0 HA TRP A 19 -1.861 -31.233 8.776 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -3.955 -29.796 8.888 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -4.264 -30.488 10.468 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -2.649 -29.705 12.501 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -1.025 -27.717 12.789 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -2.262 -28.325 7.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 0.236 -25.844 11.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -0.809 -26.423 7.016 1.00 0.00 H new ATOM 0 HH2 TRP A 19 0.420 -25.198 8.758 1.00 0.00 H new ATOM 309 N ASP A 20 -1.079 -32.149 10.987 1.00 0.00 N ATOM 310 CA ASP A 20 -0.515 -32.928 12.087 1.00 0.00 C ATOM 311 C ASP A 20 -0.480 -32.099 13.374 1.00 0.00 C ATOM 312 O ASP A 20 0.161 -31.046 13.434 1.00 0.00 O ATOM 313 CB ASP A 20 0.900 -33.398 11.713 1.00 0.00 C ATOM 314 CG ASP A 20 1.465 -34.421 12.687 1.00 0.00 C ATOM 315 OD1 ASP A 20 1.264 -35.638 12.463 1.00 0.00 O ATOM 316 OD2 ASP A 20 2.130 -34.022 13.664 1.00 0.00 O ATOM 0 H ASP A 20 -0.436 -31.468 10.583 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.146 -33.799 12.263 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.881 -33.830 10.712 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.565 -32.535 11.675 1.00 0.00 H new ATOM 321 N TYR A 21 -1.190 -32.579 14.393 1.00 0.00 N ATOM 322 CA TYR A 21 -1.239 -31.937 15.705 1.00 0.00 C ATOM 323 C TYR A 21 -0.515 -32.800 16.737 1.00 0.00 C ATOM 324 O TYR A 21 -0.834 -33.982 16.897 1.00 0.00 O ATOM 325 CB TYR A 21 -2.695 -31.735 16.154 1.00 0.00 C ATOM 326 CG TYR A 21 -3.529 -30.855 15.235 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.573 -29.476 15.410 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.283 -31.408 14.204 1.00 0.00 C ATOM 329 CE1 TYR A 21 -4.342 -28.674 14.588 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.052 -30.611 13.376 1.00 0.00 C ATOM 331 CZ TYR A 21 -5.078 -29.246 13.571 1.00 0.00 C ATOM 332 OH TYR A 21 -5.846 -28.451 12.751 1.00 0.00 O ATOM 0 H TYR A 21 -1.751 -33.429 14.331 1.00 0.00 H new ATOM 0 HA TYR A 21 -0.750 -30.966 15.627 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.175 -32.711 16.234 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.695 -31.297 17.152 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.996 -29.024 16.203 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.267 -32.477 14.048 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -4.367 -27.605 14.741 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.630 -31.056 12.580 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.322 -28.188 11.966 1.00 0.00 H new ATOM 342 N ARG A 22 0.465 -32.223 17.423 1.00 0.00 N ATOM 343 CA ARG A 22 1.206 -32.940 18.461 1.00 0.00 C ATOM 344 C ARG A 22 0.639 -32.587 19.834 1.00 0.00 C ATOM 345 O ARG A 22 0.738 -31.442 20.284 1.00 0.00 O ATOM 346 CB ARG A 22 2.705 -32.601 18.377 1.00 0.00 C ATOM 347 CG ARG A 22 3.595 -33.358 19.365 1.00 0.00 C ATOM 348 CD ARG A 22 3.473 -34.878 19.223 1.00 0.00 C ATOM 349 NE ARG A 22 3.491 -35.314 17.823 1.00 0.00 N ATOM 350 CZ ARG A 22 4.588 -35.632 17.135 1.00 0.00 C ATOM 351 NH1 ARG A 22 5.784 -35.606 17.712 1.00 0.00 N ATOM 352 NH2 ARG A 22 4.477 -36.008 15.867 1.00 0.00 N ATOM 0 H ARG A 22 0.767 -31.259 17.281 1.00 0.00 H new ATOM 0 HA ARG A 22 1.096 -34.013 18.307 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.053 -32.808 17.365 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.830 -31.531 18.544 1.00 0.00 H new ATOM 0 HG2 ARG A 22 4.633 -33.065 19.211 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.330 -33.069 20.382 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.292 -35.357 19.760 1.00 0.00 H new ATOM 0 HD3 ARG A 22 2.547 -35.210 19.692 1.00 0.00 H new ATOM 0 HE ARG A 22 2.596 -35.379 17.338 1.00 0.00 H new ATOM 0 HH11 ARG A 22 5.871 -35.340 18.693 1.00 0.00 H new ATOM 0 HH12 ARG A 22 6.615 -35.852 17.174 1.00 0.00 H new ATOM 0 HH21 ARG A 22 3.558 -36.052 15.427 1.00 0.00 H new ATOM 0 HH22 ARG A 22 5.311 -36.253 15.333 1.00 0.00 H new ATOM 366 N VAL A 23 0.029 -33.574 20.485 1.00 0.00 N ATOM 367 CA VAL A 23 -0.662 -33.364 21.755 1.00 0.00 C ATOM 368 C VAL A 23 0.079 -34.056 22.896 1.00 0.00 C ATOM 369 O VAL A 23 0.207 -35.279 22.905 1.00 0.00 O ATOM 370 CB VAL A 23 -2.111 -33.909 21.693 1.00 0.00 C ATOM 371 CG1 VAL A 23 -2.880 -33.568 22.971 1.00 0.00 C ATOM 372 CG2 VAL A 23 -2.832 -33.380 20.453 1.00 0.00 C ATOM 0 H VAL A 23 -0.001 -34.537 20.150 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.688 -32.290 21.938 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.065 -34.995 21.617 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.894 -33.962 22.902 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.376 -34.013 23.829 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -2.919 -32.486 23.094 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.848 -33.774 20.427 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.866 -32.291 20.489 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.297 -33.697 19.558 1.00 0.00 H new ATOM 382 N ILE A 24 0.568 -33.276 23.852 1.00 0.00 N ATOM 383 CA ILE A 24 1.276 -33.827 25.005 1.00 0.00 C ATOM 384 C ILE A 24 0.403 -33.736 26.255 1.00 0.00 C ATOM 385 O ILE A 24 0.056 -32.638 26.700 1.00 0.00 O ATOM 386 CB ILE A 24 2.616 -33.091 25.253 1.00 0.00 C ATOM 387 CG1 ILE A 24 3.495 -33.150 23.991 1.00 0.00 C ATOM 388 CG2 ILE A 24 3.352 -33.691 26.456 1.00 0.00 C ATOM 389 CD1 ILE A 24 4.820 -32.430 24.130 1.00 0.00 C ATOM 0 H ILE A 24 0.488 -32.259 23.853 1.00 0.00 H new ATOM 0 HA ILE A 24 1.495 -34.872 24.788 1.00 0.00 H new ATOM 0 HB ILE A 24 2.401 -32.046 25.478 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.685 -34.194 23.741 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.944 -32.717 23.156 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.290 -33.158 26.611 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.730 -33.598 27.346 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.560 -34.744 26.267 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.381 -32.517 23.199 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.641 -31.377 24.348 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.393 -32.877 24.942 1.00 0.00 H new ATOM 401 N MET A 25 0.047 -34.892 26.813 1.00 0.00 N ATOM 402 CA MET A 25 -0.802 -34.953 28.004 1.00 0.00 C ATOM 403 C MET A 25 -0.084 -35.681 29.138 1.00 0.00 C ATOM 404 O MET A 25 0.940 -36.325 28.922 1.00 0.00 O ATOM 405 CB MET A 25 -2.138 -35.654 27.694 1.00 0.00 C ATOM 406 CG MET A 25 -2.973 -34.952 26.627 1.00 0.00 C ATOM 407 SD MET A 25 -4.694 -35.501 26.600 1.00 0.00 S ATOM 408 CE MET A 25 -4.515 -37.232 26.176 1.00 0.00 C ATOM 0 H MET A 25 0.335 -35.804 26.458 1.00 0.00 H new ATOM 0 HA MET A 25 -1.012 -33.930 28.317 1.00 0.00 H new ATOM 0 HB2 MET A 25 -1.935 -36.674 27.369 1.00 0.00 H new ATOM 0 HB3 MET A 25 -2.722 -35.722 28.612 1.00 0.00 H new ATOM 0 HG2 MET A 25 -2.944 -33.876 26.800 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.526 -35.129 25.649 1.00 0.00 H new ATOM 0 HE1 MET A 25 -5.349 -37.540 25.546 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.579 -37.380 25.637 1.00 0.00 H new ATOM 0 HE3 MET A 25 -4.508 -37.831 27.087 1.00 0.00 H new ATOM 418 N THR A 26 -0.631 -35.568 30.345 1.00 0.00 N ATOM 419 CA THR A 26 -0.068 -36.223 31.525 1.00 0.00 C ATOM 420 C THR A 26 -0.810 -37.527 31.838 1.00 0.00 C ATOM 421 O THR A 26 -0.681 -38.089 32.929 1.00 0.00 O ATOM 422 CB THR A 26 -0.131 -35.278 32.750 1.00 0.00 C ATOM 423 OG1 THR A 26 -1.434 -34.676 32.837 1.00 0.00 O ATOM 424 CG2 THR A 26 0.931 -34.186 32.658 1.00 0.00 C ATOM 0 H THR A 26 -1.472 -35.023 30.534 1.00 0.00 H new ATOM 0 HA THR A 26 0.974 -36.460 31.309 1.00 0.00 H new ATOM 0 HB THR A 26 0.061 -35.871 33.645 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.468 -34.081 33.615 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.863 -33.538 33.532 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.920 -34.643 32.621 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.770 -33.597 31.755 1.00 0.00 H new ATOM 432 N THR A 27 -1.565 -38.020 30.859 1.00 0.00 N ATOM 433 CA THR A 27 -2.363 -39.225 31.033 1.00 0.00 C ATOM 434 C THR A 27 -2.217 -40.146 29.826 1.00 0.00 C ATOM 435 O THR A 27 -1.830 -39.705 28.741 1.00 0.00 O ATOM 436 CB THR A 27 -3.864 -38.888 31.215 1.00 0.00 C ATOM 437 OG1 THR A 27 -4.602 -40.076 31.528 1.00 0.00 O ATOM 438 CG2 THR A 27 -4.442 -38.257 29.952 1.00 0.00 C ATOM 0 H THR A 27 -1.639 -37.599 29.933 1.00 0.00 H new ATOM 0 HA THR A 27 -1.996 -39.724 31.930 1.00 0.00 H new ATOM 0 HB THR A 27 -3.949 -38.174 32.035 1.00 0.00 H new ATOM 0 HG1 THR A 27 -5.373 -39.844 32.087 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.497 -38.031 30.108 1.00 0.00 H new ATOM 0 HG22 THR A 27 -3.903 -37.337 29.726 1.00 0.00 H new ATOM 0 HG23 THR A 27 -4.340 -38.952 29.118 1.00 0.00 H new ATOM 446 N LYS A 28 -2.523 -41.424 30.030 1.00 0.00 N ATOM 447 CA LYS A 28 -2.619 -42.379 28.933 1.00 0.00 C ATOM 448 C LYS A 28 -4.056 -42.410 28.421 1.00 0.00 C ATOM 449 O LYS A 28 -4.337 -42.922 27.334 1.00 0.00 O ATOM 450 CB LYS A 28 -2.213 -43.785 29.393 1.00 0.00 C ATOM 451 CG LYS A 28 -0.807 -43.880 29.975 1.00 0.00 C ATOM 452 CD LYS A 28 -0.449 -45.321 30.339 1.00 0.00 C ATOM 453 CE LYS A 28 -1.435 -45.913 31.345 1.00 0.00 C ATOM 454 NZ LYS A 28 -1.190 -47.361 31.594 1.00 0.00 N ATOM 0 H LYS A 28 -2.709 -41.823 30.950 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.941 -42.067 28.138 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.926 -44.128 30.142 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.288 -44.466 28.546 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.086 -43.496 29.253 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.736 -43.251 30.862 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.439 -45.932 29.437 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.558 -45.351 30.756 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.362 -45.368 32.286 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.452 -45.777 30.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.883 -47.717 32.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.286 -47.888 30.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.230 -47.491 31.971 1.00 0.00 H new ATOM 468 N ASP A 29 -4.961 -41.844 29.220 1.00 0.00 N ATOM 469 CA ASP A 29 -6.381 -41.847 28.910 1.00 0.00 C ATOM 470 C ASP A 29 -6.684 -40.797 27.860 1.00 0.00 C ATOM 471 O ASP A 29 -7.012 -39.648 28.177 1.00 0.00 O ATOM 472 CB ASP A 29 -7.225 -41.595 30.172 1.00 0.00 C ATOM 473 CG ASP A 29 -8.713 -41.475 29.865 1.00 0.00 C ATOM 474 OD1 ASP A 29 -9.362 -42.516 29.623 1.00 0.00 O ATOM 475 OD2 ASP A 29 -9.243 -40.338 29.865 1.00 0.00 O ATOM 0 H ASP A 29 -4.727 -41.374 30.095 1.00 0.00 H new ATOM 0 HA ASP A 29 -6.643 -42.831 28.520 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -7.068 -42.410 30.879 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -6.883 -40.681 30.658 1.00 0.00 H new ATOM 480 N THR A 30 -6.513 -41.172 26.607 1.00 0.00 N ATOM 481 CA THR A 30 -6.860 -40.297 25.513 1.00 0.00 C ATOM 482 C THR A 30 -8.300 -40.571 25.083 1.00 0.00 C ATOM 483 O THR A 30 -8.588 -41.546 24.382 1.00 0.00 O ATOM 484 CB THR A 30 -5.878 -40.445 24.321 1.00 0.00 C ATOM 485 OG1 THR A 30 -6.341 -39.685 23.195 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.682 -41.906 23.922 1.00 0.00 C ATOM 0 H THR A 30 -6.136 -42.077 26.325 1.00 0.00 H new ATOM 0 HA THR A 30 -6.779 -39.265 25.855 1.00 0.00 H new ATOM 0 HB THR A 30 -4.912 -40.058 24.645 1.00 0.00 H new ATOM 0 HG1 THR A 30 -5.711 -39.786 22.451 1.00 0.00 H new ATOM 0 HG21 THR A 30 -4.987 -41.964 23.084 1.00 0.00 H new ATOM 0 HG22 THR A 30 -5.278 -42.463 24.767 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.640 -42.335 23.629 1.00 0.00 H new ATOM 494 N SER A 31 -9.208 -39.721 25.548 1.00 0.00 N ATOM 495 CA SER A 31 -10.627 -39.854 25.243 1.00 0.00 C ATOM 496 C SER A 31 -11.162 -38.531 24.707 1.00 0.00 C ATOM 497 O SER A 31 -11.547 -38.430 23.538 1.00 0.00 O ATOM 498 CB SER A 31 -11.393 -40.274 26.506 1.00 0.00 C ATOM 499 OG SER A 31 -10.790 -41.408 27.111 1.00 0.00 O ATOM 0 H SER A 31 -8.983 -38.924 26.144 1.00 0.00 H new ATOM 0 HA SER A 31 -10.766 -40.622 24.482 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.414 -39.447 27.215 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.428 -40.501 26.250 1.00 0.00 H new ATOM 0 HG SER A 31 -11.293 -41.657 27.914 1.00 0.00 H new ATOM 505 N THR A 32 -11.137 -37.511 25.566 1.00 0.00 N ATOM 506 CA THR A 32 -11.592 -36.166 25.219 1.00 0.00 C ATOM 507 C THR A 32 -10.970 -35.695 23.902 1.00 0.00 C ATOM 508 O THR A 32 -11.619 -35.025 23.094 1.00 0.00 O ATOM 509 CB THR A 32 -11.210 -35.182 26.346 1.00 0.00 C ATOM 510 OG1 THR A 32 -11.417 -35.815 27.618 1.00 0.00 O ATOM 511 CG2 THR A 32 -12.033 -33.897 26.268 1.00 0.00 C ATOM 0 H THR A 32 -10.799 -37.596 26.525 1.00 0.00 H new ATOM 0 HA THR A 32 -12.675 -36.194 25.099 1.00 0.00 H new ATOM 0 HB THR A 32 -10.160 -34.914 26.227 1.00 0.00 H new ATOM 0 HG1 THR A 32 -11.174 -35.194 28.336 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.739 -33.227 27.076 1.00 0.00 H new ATOM 0 HG22 THR A 32 -11.856 -33.409 25.309 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.092 -34.137 26.363 1.00 0.00 H new ATOM 519 N LEU A 33 -9.710 -36.075 23.698 1.00 0.00 N ATOM 520 CA LEU A 33 -8.966 -35.714 22.496 1.00 0.00 C ATOM 521 C LEU A 33 -9.662 -36.243 21.242 1.00 0.00 C ATOM 522 O LEU A 33 -9.769 -35.543 20.241 1.00 0.00 O ATOM 523 CB LEU A 33 -7.535 -36.265 22.588 1.00 0.00 C ATOM 524 CG LEU A 33 -6.629 -35.981 21.376 1.00 0.00 C ATOM 525 CD1 LEU A 33 -6.501 -34.477 21.127 1.00 0.00 C ATOM 526 CD2 LEU A 33 -5.255 -36.616 21.582 1.00 0.00 C ATOM 0 H LEU A 33 -9.179 -36.640 24.360 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.928 -34.627 22.424 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.062 -35.848 23.477 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.590 -37.344 22.732 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.088 -36.426 20.493 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.856 -34.304 20.266 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.487 -34.055 20.932 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.069 -33.998 22.006 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.625 -36.407 20.718 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.793 -36.200 22.477 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.366 -37.694 21.698 1.00 0.00 H new ATOM 538 N LYS A 34 -10.147 -37.479 21.310 1.00 0.00 N ATOM 539 CA LYS A 34 -10.812 -38.103 20.169 1.00 0.00 C ATOM 540 C LYS A 34 -12.215 -37.533 19.985 1.00 0.00 C ATOM 541 O LYS A 34 -12.692 -37.387 18.858 1.00 0.00 O ATOM 542 CB LYS A 34 -10.882 -39.624 20.352 1.00 0.00 C ATOM 543 CG LYS A 34 -9.514 -40.294 20.448 1.00 0.00 C ATOM 544 CD LYS A 34 -9.633 -41.813 20.548 1.00 0.00 C ATOM 545 CE LYS A 34 -10.415 -42.243 21.781 1.00 0.00 C ATOM 546 NZ LYS A 34 -10.536 -43.721 21.875 1.00 0.00 N ATOM 0 H LYS A 34 -10.093 -38.068 22.141 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.228 -37.884 19.275 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.450 -39.847 21.255 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.431 -40.057 19.516 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.919 -40.033 19.573 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.983 -39.913 21.320 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.124 -42.198 19.654 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.637 -42.254 20.579 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -9.921 -41.862 22.675 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.410 -41.799 21.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.075 -43.972 22.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.030 -44.083 21.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.588 -44.144 21.928 1.00 0.00 H new ATOM 560 N GLU A 35 -12.861 -37.201 21.100 1.00 0.00 N ATOM 561 CA GLU A 35 -14.225 -36.675 21.076 1.00 0.00 C ATOM 562 C GLU A 35 -14.313 -35.437 20.186 1.00 0.00 C ATOM 563 O GLU A 35 -15.153 -35.362 19.285 1.00 0.00 O ATOM 564 CB GLU A 35 -14.690 -36.324 22.497 1.00 0.00 C ATOM 565 CG GLU A 35 -14.587 -37.478 23.490 1.00 0.00 C ATOM 566 CD GLU A 35 -15.407 -38.689 23.078 1.00 0.00 C ATOM 567 OE1 GLU A 35 -16.622 -38.715 23.364 1.00 0.00 O ATOM 568 OE2 GLU A 35 -14.843 -39.625 22.477 1.00 0.00 O ATOM 0 H GLU A 35 -12.461 -37.287 22.034 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.876 -37.448 20.668 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.096 -35.488 22.866 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.725 -35.986 22.456 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.542 -37.771 23.592 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.919 -37.137 24.471 1.00 0.00 H new ATOM 575 N LEU A 36 -13.417 -34.479 20.428 1.00 0.00 N ATOM 576 CA LEU A 36 -13.411 -33.227 19.677 1.00 0.00 C ATOM 577 C LEU A 36 -13.152 -33.493 18.194 1.00 0.00 C ATOM 578 O LEU A 36 -13.653 -32.778 17.332 1.00 0.00 O ATOM 579 CB LEU A 36 -12.372 -32.247 20.263 1.00 0.00 C ATOM 580 CG LEU A 36 -10.889 -32.656 20.121 1.00 0.00 C ATOM 581 CD1 LEU A 36 -10.281 -32.119 18.824 1.00 0.00 C ATOM 582 CD2 LEU A 36 -10.078 -32.190 21.330 1.00 0.00 C ATOM 0 H LEU A 36 -12.688 -34.548 21.138 1.00 0.00 H new ATOM 0 HA LEU A 36 -14.393 -32.762 19.766 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.507 -31.278 19.783 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.589 -32.111 21.322 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.851 -33.745 20.080 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.237 -32.426 18.757 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.832 -32.517 17.972 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.340 -31.031 18.818 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.037 -32.489 21.207 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.136 -31.105 21.411 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.482 -32.643 22.235 1.00 0.00 H new ATOM 594 N LEU A 37 -12.387 -34.543 17.907 1.00 0.00 N ATOM 595 CA LEU A 37 -12.087 -34.926 16.531 1.00 0.00 C ATOM 596 C LEU A 37 -13.340 -35.474 15.845 1.00 0.00 C ATOM 597 O LEU A 37 -13.633 -35.137 14.694 1.00 0.00 O ATOM 598 CB LEU A 37 -10.971 -35.985 16.505 1.00 0.00 C ATOM 599 CG LEU A 37 -9.649 -35.568 17.173 1.00 0.00 C ATOM 600 CD1 LEU A 37 -8.680 -36.743 17.247 1.00 0.00 C ATOM 601 CD2 LEU A 37 -9.012 -34.396 16.435 1.00 0.00 C ATOM 0 H LEU A 37 -11.962 -35.145 18.612 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.749 -34.041 15.992 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.338 -36.887 16.996 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -10.767 -36.248 15.467 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.876 -35.249 18.190 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.754 -36.421 17.723 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.128 -37.548 17.830 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.465 -37.101 16.240 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.079 -34.120 16.927 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.808 -34.683 15.404 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.693 -33.545 16.446 1.00 0.00 H new ATOM 613 N GLU A 38 -14.088 -36.302 16.574 1.00 0.00 N ATOM 614 CA GLU A 38 -15.258 -36.982 16.021 1.00 0.00 C ATOM 615 C GLU A 38 -16.424 -36.023 15.798 1.00 0.00 C ATOM 616 O GLU A 38 -17.295 -36.293 14.970 1.00 0.00 O ATOM 617 CB GLU A 38 -15.696 -38.137 16.931 1.00 0.00 C ATOM 618 CG GLU A 38 -14.654 -39.244 17.062 1.00 0.00 C ATOM 619 CD GLU A 38 -15.244 -40.542 17.587 1.00 0.00 C ATOM 620 OE1 GLU A 38 -16.018 -41.187 16.845 1.00 0.00 O ATOM 621 OE2 GLU A 38 -14.954 -40.921 18.739 1.00 0.00 O ATOM 0 H GLU A 38 -13.903 -36.518 17.553 1.00 0.00 H new ATOM 0 HA GLU A 38 -14.965 -37.383 15.051 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -15.920 -37.742 17.922 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.620 -38.564 16.542 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -14.197 -39.424 16.089 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.860 -38.913 17.731 1.00 0.00 H new ATOM 628 N THR A 39 -16.443 -34.904 16.519 1.00 0.00 N ATOM 629 CA THR A 39 -17.528 -33.932 16.375 1.00 0.00 C ATOM 630 C THR A 39 -17.536 -33.320 14.970 1.00 0.00 C ATOM 631 O THR A 39 -18.558 -32.800 14.515 1.00 0.00 O ATOM 632 CB THR A 39 -17.445 -32.806 17.434 1.00 0.00 C ATOM 633 OG1 THR A 39 -16.200 -32.106 17.323 1.00 0.00 O ATOM 634 CG2 THR A 39 -17.596 -33.365 18.847 1.00 0.00 C ATOM 0 H THR A 39 -15.729 -34.648 17.201 1.00 0.00 H new ATOM 0 HA THR A 39 -18.458 -34.477 16.533 1.00 0.00 H new ATOM 0 HB THR A 39 -18.266 -32.113 17.247 1.00 0.00 H new ATOM 0 HG1 THR A 39 -15.459 -32.736 17.440 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.533 -32.551 19.569 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.563 -33.860 18.941 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.800 -34.084 19.041 1.00 0.00 H new ATOM 642 N TYR A 40 -16.391 -33.387 14.283 1.00 0.00 N ATOM 643 CA TYR A 40 -16.281 -32.896 12.908 1.00 0.00 C ATOM 644 C TYR A 40 -16.752 -33.961 11.916 1.00 0.00 C ATOM 645 O TYR A 40 -16.883 -33.692 10.721 1.00 0.00 O ATOM 646 CB TYR A 40 -14.835 -32.491 12.585 1.00 0.00 C ATOM 647 CG TYR A 40 -14.278 -31.406 13.489 1.00 0.00 C ATOM 648 CD1 TYR A 40 -14.684 -30.082 13.357 1.00 0.00 C ATOM 649 CD2 TYR A 40 -13.343 -31.709 14.470 1.00 0.00 C ATOM 650 CE1 TYR A 40 -14.173 -29.094 14.176 1.00 0.00 C ATOM 651 CE2 TYR A 40 -12.828 -30.726 15.295 1.00 0.00 C ATOM 652 CZ TYR A 40 -13.248 -29.421 15.144 1.00 0.00 C ATOM 653 OH TYR A 40 -12.740 -28.438 15.963 1.00 0.00 O ATOM 0 H TYR A 40 -15.527 -33.777 14.659 1.00 0.00 H new ATOM 0 HA TYR A 40 -16.920 -32.018 12.816 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.197 -33.372 12.658 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.788 -32.148 11.552 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -15.411 -29.822 12.602 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.012 -32.730 14.591 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -14.497 -28.070 14.058 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.101 -30.979 16.053 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.440 -28.129 16.575 1.00 0.00 H new ATOM 663 N GLN A 41 -16.989 -35.172 12.426 1.00 0.00 N ATOM 664 CA GLN A 41 -17.467 -36.296 11.613 1.00 0.00 C ATOM 665 C GLN A 41 -16.477 -36.644 10.501 1.00 0.00 C ATOM 666 O GLN A 41 -16.869 -37.100 9.424 1.00 0.00 O ATOM 667 CB GLN A 41 -18.856 -35.983 11.030 1.00 0.00 C ATOM 668 CG GLN A 41 -19.928 -35.808 12.098 1.00 0.00 C ATOM 669 CD GLN A 41 -20.116 -37.061 12.935 1.00 0.00 C ATOM 670 OE1 GLN A 41 -19.965 -38.182 12.445 1.00 0.00 O ATOM 671 NE2 GLN A 41 -20.416 -36.882 14.210 1.00 0.00 N ATOM 0 H GLN A 41 -16.856 -35.402 13.411 1.00 0.00 H new ATOM 0 HA GLN A 41 -17.550 -37.168 12.262 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -18.796 -35.074 10.432 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -19.151 -36.788 10.357 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -19.658 -34.976 12.748 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -20.873 -35.546 11.622 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -20.533 -35.938 14.579 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -20.530 -37.688 14.825 1.00 0.00 H new ATOM 680 N ARG A 42 -15.191 -36.460 10.784 1.00 0.00 N ATOM 681 CA ARG A 42 -14.131 -36.757 9.822 1.00 0.00 C ATOM 682 C ARG A 42 -13.133 -37.744 10.433 1.00 0.00 C ATOM 683 O ARG A 42 -12.998 -37.814 11.659 1.00 0.00 O ATOM 684 CB ARG A 42 -13.419 -35.463 9.400 1.00 0.00 C ATOM 685 CG ARG A 42 -12.679 -34.764 10.537 1.00 0.00 C ATOM 686 CD ARG A 42 -12.077 -33.438 10.090 1.00 0.00 C ATOM 687 NE ARG A 42 -13.106 -32.483 9.672 1.00 0.00 N ATOM 688 CZ ARG A 42 -12.863 -31.215 9.341 1.00 0.00 C ATOM 689 NH1 ARG A 42 -11.630 -30.730 9.382 1.00 0.00 N ATOM 690 NH2 ARG A 42 -13.861 -30.431 8.960 1.00 0.00 N ATOM 0 H ARG A 42 -14.854 -36.104 11.679 1.00 0.00 H new ATOM 0 HA ARG A 42 -14.573 -37.211 8.935 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.709 -35.693 8.605 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -14.154 -34.776 8.982 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -13.366 -34.590 11.365 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.888 -35.415 10.910 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.495 -33.010 10.906 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.387 -33.613 9.264 1.00 0.00 H new ATOM 0 HE ARG A 42 -14.071 -32.810 9.632 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.856 -31.329 9.669 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.456 -29.758 9.127 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -14.812 -30.798 8.921 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.678 -29.460 8.706 1.00 0.00 H new ATOM 704 N PRO A 43 -12.434 -38.533 9.593 1.00 0.00 N ATOM 705 CA PRO A 43 -11.443 -39.507 10.068 1.00 0.00 C ATOM 706 C PRO A 43 -10.201 -38.836 10.659 1.00 0.00 C ATOM 707 O PRO A 43 -9.869 -37.695 10.317 1.00 0.00 O ATOM 708 CB PRO A 43 -11.082 -40.299 8.802 1.00 0.00 C ATOM 709 CG PRO A 43 -11.378 -39.369 7.677 1.00 0.00 C ATOM 710 CD PRO A 43 -12.560 -38.550 8.120 1.00 0.00 C ATOM 0 HA PRO A 43 -11.836 -40.127 10.873 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.033 -40.595 8.806 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.671 -41.213 8.725 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.520 -38.732 7.461 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -11.604 -39.920 6.764 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.530 -37.543 7.703 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -13.501 -38.999 7.803 1.00 0.00 H new ATOM 718 N PHE A 44 -9.528 -39.553 11.553 1.00 0.00 N ATOM 719 CA PHE A 44 -8.297 -39.074 12.172 1.00 0.00 C ATOM 720 C PHE A 44 -7.384 -40.255 12.491 1.00 0.00 C ATOM 721 O PHE A 44 -7.840 -41.400 12.571 1.00 0.00 O ATOM 722 CB PHE A 44 -8.604 -38.276 13.451 1.00 0.00 C ATOM 723 CG PHE A 44 -9.332 -39.065 14.517 1.00 0.00 C ATOM 724 CD1 PHE A 44 -8.629 -39.798 15.466 1.00 0.00 C ATOM 725 CD2 PHE A 44 -10.718 -39.069 14.571 1.00 0.00 C ATOM 726 CE1 PHE A 44 -9.293 -40.514 16.443 1.00 0.00 C ATOM 727 CE2 PHE A 44 -11.386 -39.786 15.546 1.00 0.00 C ATOM 728 CZ PHE A 44 -10.674 -40.508 16.483 1.00 0.00 C ATOM 0 H PHE A 44 -9.819 -40.479 11.868 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.790 -38.410 11.471 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.668 -37.904 13.867 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.204 -37.405 13.187 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -7.549 -39.808 15.439 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.282 -38.505 13.843 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -8.733 -41.078 17.175 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -12.466 -39.781 15.575 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.196 -41.067 17.246 1.00 0.00 H new ATOM 738 N LYS A 45 -6.100 -39.977 12.671 1.00 0.00 N ATOM 739 CA LYS A 45 -5.124 -41.005 13.004 1.00 0.00 C ATOM 740 C LYS A 45 -4.529 -40.705 14.376 1.00 0.00 C ATOM 741 O LYS A 45 -3.804 -39.722 14.541 1.00 0.00 O ATOM 742 CB LYS A 45 -4.021 -41.059 11.930 1.00 0.00 C ATOM 743 CG LYS A 45 -3.169 -42.332 11.944 1.00 0.00 C ATOM 744 CD LYS A 45 -2.096 -42.311 13.030 1.00 0.00 C ATOM 745 CE LYS A 45 -1.064 -41.207 12.797 1.00 0.00 C ATOM 746 NZ LYS A 45 -0.317 -41.395 11.524 1.00 0.00 N ATOM 0 H LYS A 45 -5.708 -39.039 12.591 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.613 -41.979 13.034 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.485 -40.960 10.948 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -3.365 -40.199 12.060 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -3.816 -43.196 12.095 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.693 -42.457 10.971 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -2.567 -42.167 14.002 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -1.592 -43.277 13.060 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -1.566 -40.240 12.782 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -0.361 -41.188 13.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.480 -40.728 11.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.044 -42.369 11.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.952 -41.219 10.720 1.00 0.00 H new ATOM 760 N LEU A 46 -4.859 -41.538 15.353 1.00 0.00 N ATOM 761 CA LEU A 46 -4.319 -41.400 16.701 1.00 0.00 C ATOM 762 C LEU A 46 -3.105 -42.303 16.861 1.00 0.00 C ATOM 763 O LEU A 46 -3.130 -43.468 16.454 1.00 0.00 O ATOM 764 CB LEU A 46 -5.385 -41.751 17.750 1.00 0.00 C ATOM 765 CG LEU A 46 -4.936 -41.610 19.218 1.00 0.00 C ATOM 766 CD1 LEU A 46 -4.601 -40.156 19.549 1.00 0.00 C ATOM 767 CD2 LEU A 46 -6.008 -42.149 20.164 1.00 0.00 C ATOM 0 H LEU A 46 -5.502 -42.321 15.237 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.018 -40.364 16.855 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.253 -41.112 17.590 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.710 -42.778 17.584 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.032 -42.203 19.354 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.287 -40.083 20.590 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.794 -39.812 18.902 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.483 -39.535 19.391 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.671 -42.040 21.195 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.933 -41.589 20.023 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.186 -43.203 19.950 1.00 0.00 H new ATOM 779 N GLU A 47 -2.043 -41.765 17.442 1.00 0.00 N ATOM 780 CA GLU A 47 -0.802 -42.506 17.608 1.00 0.00 C ATOM 781 C GLU A 47 -0.083 -42.072 18.880 1.00 0.00 C ATOM 782 O GLU A 47 -0.303 -40.971 19.383 1.00 0.00 O ATOM 783 CB GLU A 47 0.102 -42.291 16.379 1.00 0.00 C ATOM 784 CG GLU A 47 0.508 -43.581 15.682 1.00 0.00 C ATOM 785 CD GLU A 47 1.349 -44.487 16.568 1.00 0.00 C ATOM 786 OE1 GLU A 47 2.592 -44.360 16.551 1.00 0.00 O ATOM 787 OE2 GLU A 47 0.772 -45.322 17.298 1.00 0.00 O ATOM 0 H GLU A 47 -2.016 -40.813 17.808 1.00 0.00 H new ATOM 0 HA GLU A 47 -1.036 -43.567 17.696 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -0.417 -41.651 15.665 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.001 -41.758 16.690 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.388 -44.117 15.368 1.00 0.00 H new ATOM 0 HG3 GLU A 47 1.069 -43.340 14.779 1.00 0.00 H new ATOM 794 N PHE A 48 0.759 -42.952 19.402 1.00 0.00 N ATOM 795 CA PHE A 48 1.615 -42.632 20.539 1.00 0.00 C ATOM 796 C PHE A 48 3.059 -42.534 20.061 1.00 0.00 C ATOM 797 O PHE A 48 3.509 -43.360 19.266 1.00 0.00 O ATOM 798 CB PHE A 48 1.479 -43.701 21.631 1.00 0.00 C ATOM 799 CG PHE A 48 2.314 -43.433 22.859 1.00 0.00 C ATOM 800 CD1 PHE A 48 1.911 -42.492 23.796 1.00 0.00 C ATOM 801 CD2 PHE A 48 3.501 -44.120 23.077 1.00 0.00 C ATOM 802 CE1 PHE A 48 2.672 -42.241 24.920 1.00 0.00 C ATOM 803 CE2 PHE A 48 4.264 -43.872 24.200 1.00 0.00 C ATOM 804 CZ PHE A 48 3.849 -42.934 25.123 1.00 0.00 C ATOM 0 H PHE A 48 0.869 -43.904 19.053 1.00 0.00 H new ATOM 0 HA PHE A 48 1.310 -41.677 20.967 1.00 0.00 H new ATOM 0 HB2 PHE A 48 0.432 -43.774 21.925 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.762 -44.668 21.216 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.990 -41.949 23.644 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.831 -44.857 22.360 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.347 -41.504 25.639 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.186 -44.412 24.356 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.444 -42.742 26.003 1.00 0.00 H new ATOM 814 N LYS A 49 3.775 -41.515 20.515 1.00 0.00 N ATOM 815 CA LYS A 49 5.151 -41.289 20.076 1.00 0.00 C ATOM 816 C LYS A 49 6.148 -41.688 21.162 1.00 0.00 C ATOM 817 O LYS A 49 6.811 -42.721 21.053 1.00 0.00 O ATOM 818 CB LYS A 49 5.344 -39.821 19.668 1.00 0.00 C ATOM 819 CG LYS A 49 4.584 -39.426 18.399 1.00 0.00 C ATOM 820 CD LYS A 49 5.249 -39.963 17.118 1.00 0.00 C ATOM 821 CE LYS A 49 4.359 -40.941 16.341 1.00 0.00 C ATOM 822 NZ LYS A 49 4.321 -42.297 16.957 1.00 0.00 N ATOM 0 H LYS A 49 3.429 -40.830 21.187 1.00 0.00 H new ATOM 0 HA LYS A 49 5.341 -41.919 19.207 1.00 0.00 H new ATOM 0 HB2 LYS A 49 5.020 -39.180 20.488 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.407 -39.633 19.517 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.563 -39.803 18.459 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.519 -38.339 18.342 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.507 -39.124 16.471 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.182 -40.461 17.382 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.346 -40.541 16.289 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.723 -41.022 15.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 3.776 -42.940 16.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.291 -42.658 17.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 3.870 -42.241 17.893 1.00 0.00 H new ATOM 836 N ASN A 50 6.242 -40.882 22.218 1.00 0.00 N ATOM 837 CA ASN A 50 7.219 -41.117 23.285 1.00 0.00 C ATOM 838 C ASN A 50 6.664 -40.690 24.637 1.00 0.00 C ATOM 839 O ASN A 50 5.635 -40.015 24.717 1.00 0.00 O ATOM 840 CB ASN A 50 8.529 -40.352 23.013 1.00 0.00 C ATOM 841 CG ASN A 50 9.275 -40.848 21.786 1.00 0.00 C ATOM 842 OD1 ASN A 50 9.051 -40.371 20.672 1.00 0.00 O ATOM 843 ND2 ASN A 50 10.170 -41.807 21.978 1.00 0.00 N ATOM 0 H ASN A 50 5.655 -40.060 22.360 1.00 0.00 H new ATOM 0 HA ASN A 50 7.426 -42.187 23.304 1.00 0.00 H new ATOM 0 HB2 ASN A 50 8.303 -39.293 22.888 1.00 0.00 H new ATOM 0 HB3 ASN A 50 9.179 -40.439 23.884 1.00 0.00 H new ATOM 0 HD21 ASN A 50 10.701 -42.175 21.188 1.00 0.00 H new ATOM 0 HD22 ASN A 50 10.328 -42.177 22.915 1.00 0.00 H new ATOM 850 N THR A 51 7.357 -41.099 25.694 1.00 0.00 N ATOM 851 CA THR A 51 7.037 -40.685 27.052 1.00 0.00 C ATOM 852 C THR A 51 8.313 -40.211 27.749 1.00 0.00 C ATOM 853 O THR A 51 9.409 -40.704 27.452 1.00 0.00 O ATOM 854 CB THR A 51 6.379 -41.828 27.869 1.00 0.00 C ATOM 855 OG1 THR A 51 5.868 -41.320 29.109 1.00 0.00 O ATOM 856 CG2 THR A 51 7.366 -42.957 28.156 1.00 0.00 C ATOM 0 H THR A 51 8.158 -41.728 25.631 1.00 0.00 H new ATOM 0 HA THR A 51 6.315 -39.870 26.996 1.00 0.00 H new ATOM 0 HB THR A 51 5.563 -42.230 27.268 1.00 0.00 H new ATOM 0 HG1 THR A 51 5.640 -40.372 29.005 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.868 -43.739 28.730 1.00 0.00 H new ATOM 0 HG22 THR A 51 7.728 -43.372 27.215 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.208 -42.567 28.728 1.00 0.00 H new ATOM 864 N SER A 52 8.176 -39.230 28.635 1.00 0.00 N ATOM 865 CA SER A 52 9.313 -38.705 29.385 1.00 0.00 C ATOM 866 C SER A 52 9.924 -39.802 30.270 1.00 0.00 C ATOM 867 O SER A 52 9.300 -40.839 30.504 1.00 0.00 O ATOM 868 CB SER A 52 8.872 -37.500 30.228 1.00 0.00 C ATOM 869 OG SER A 52 9.983 -36.838 30.811 1.00 0.00 O ATOM 0 H SER A 52 7.286 -38.781 28.852 1.00 0.00 H new ATOM 0 HA SER A 52 10.079 -38.374 28.684 1.00 0.00 H new ATOM 0 HB2 SER A 52 8.318 -36.800 29.602 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.193 -37.833 31.013 1.00 0.00 H new ATOM 0 HG SER A 52 9.669 -36.075 31.340 1.00 0.00 H new ATOM 875 N LYS A 53 11.135 -39.559 30.767 1.00 0.00 N ATOM 876 CA LYS A 53 11.895 -40.566 31.520 1.00 0.00 C ATOM 877 C LYS A 53 11.129 -41.086 32.740 1.00 0.00 C ATOM 878 O LYS A 53 11.162 -42.284 33.037 1.00 0.00 O ATOM 879 CB LYS A 53 13.253 -39.996 31.958 1.00 0.00 C ATOM 880 CG LYS A 53 14.149 -39.592 30.793 1.00 0.00 C ATOM 881 CD LYS A 53 14.379 -40.758 29.833 1.00 0.00 C ATOM 882 CE LYS A 53 15.225 -40.355 28.635 1.00 0.00 C ATOM 883 NZ LYS A 53 15.374 -41.473 27.667 1.00 0.00 N ATOM 0 H LYS A 53 11.618 -38.667 30.663 1.00 0.00 H new ATOM 0 HA LYS A 53 12.052 -41.411 30.849 1.00 0.00 H new ATOM 0 HB2 LYS A 53 13.085 -39.127 32.595 1.00 0.00 H new ATOM 0 HB3 LYS A 53 13.771 -40.739 32.564 1.00 0.00 H new ATOM 0 HG2 LYS A 53 13.695 -38.760 30.255 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.107 -39.239 31.175 1.00 0.00 H new ATOM 0 HD2 LYS A 53 14.870 -41.573 30.365 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.417 -41.137 29.486 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.767 -39.501 28.137 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.210 -40.035 28.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.957 -41.161 26.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.834 -42.279 28.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.436 -41.762 27.323 1.00 0.00 H new ATOM 897 N ASN A 54 10.446 -40.190 33.444 1.00 0.00 N ATOM 898 CA ASN A 54 9.669 -40.566 34.629 1.00 0.00 C ATOM 899 C ASN A 54 8.228 -40.890 34.240 1.00 0.00 C ATOM 900 O ASN A 54 7.366 -41.057 35.103 1.00 0.00 O ATOM 901 CB ASN A 54 9.700 -39.443 35.681 1.00 0.00 C ATOM 902 CG ASN A 54 11.095 -39.182 36.226 1.00 0.00 C ATOM 903 OD1 ASN A 54 12.097 -39.388 35.537 1.00 0.00 O ATOM 904 ND2 ASN A 54 11.174 -38.727 37.468 1.00 0.00 N ATOM 0 H ASN A 54 10.412 -39.196 33.218 1.00 0.00 H new ATOM 0 HA ASN A 54 10.121 -41.456 35.066 1.00 0.00 H new ATOM 0 HB2 ASN A 54 9.311 -38.526 35.238 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.037 -39.705 36.505 1.00 0.00 H new ATOM 0 HD21 ASN A 54 12.085 -38.535 37.884 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.323 -38.568 38.008 1.00 0.00 H new ATOM 911 N ALA A 55 7.984 -40.975 32.927 1.00 0.00 N ATOM 912 CA ALA A 55 6.663 -41.307 32.384 1.00 0.00 C ATOM 913 C ALA A 55 5.600 -40.314 32.857 1.00 0.00 C ATOM 914 O ALA A 55 4.414 -40.635 32.920 1.00 0.00 O ATOM 915 CB ALA A 55 6.283 -42.737 32.760 1.00 0.00 C ATOM 0 H ALA A 55 8.695 -40.816 32.213 1.00 0.00 H new ATOM 0 HA ALA A 55 6.713 -41.235 31.298 1.00 0.00 H new ATOM 0 HB1 ALA A 55 5.300 -42.972 32.351 1.00 0.00 H new ATOM 0 HB2 ALA A 55 7.020 -43.429 32.352 1.00 0.00 H new ATOM 0 HB3 ALA A 55 6.257 -42.833 33.845 1.00 0.00 H new ATOM 921 N LYS A 56 6.037 -39.097 33.175 1.00 0.00 N ATOM 922 CA LYS A 56 5.135 -38.051 33.648 1.00 0.00 C ATOM 923 C LYS A 56 4.408 -37.388 32.476 1.00 0.00 C ATOM 924 O LYS A 56 3.285 -36.903 32.623 1.00 0.00 O ATOM 925 CB LYS A 56 5.923 -36.999 34.451 1.00 0.00 C ATOM 926 CG LYS A 56 5.065 -35.886 35.067 1.00 0.00 C ATOM 927 CD LYS A 56 4.541 -36.212 36.477 1.00 0.00 C ATOM 928 CE LYS A 56 3.590 -37.411 36.518 1.00 0.00 C ATOM 929 NZ LYS A 56 4.312 -38.708 36.631 1.00 0.00 N ATOM 0 H LYS A 56 7.014 -38.811 33.113 1.00 0.00 H new ATOM 0 HA LYS A 56 4.388 -38.508 34.297 1.00 0.00 H new ATOM 0 HB2 LYS A 56 6.466 -37.504 35.250 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.667 -36.545 33.797 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.653 -34.969 35.111 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.217 -35.689 34.411 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.389 -36.409 37.133 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.026 -35.337 36.875 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.910 -37.303 37.363 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.979 -37.417 35.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.046 -39.324 35.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.338 -38.537 36.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 4.057 -39.170 37.527 1.00 0.00 H new ATOM 943 N PHE A 57 5.054 -37.378 31.312 1.00 0.00 N ATOM 944 CA PHE A 57 4.492 -36.748 30.119 1.00 0.00 C ATOM 945 C PHE A 57 4.369 -37.769 28.991 1.00 0.00 C ATOM 946 O PHE A 57 5.263 -38.598 28.795 1.00 0.00 O ATOM 947 CB PHE A 57 5.366 -35.569 29.673 1.00 0.00 C ATOM 948 CG PHE A 57 5.513 -34.493 30.723 1.00 0.00 C ATOM 949 CD1 PHE A 57 4.491 -33.580 30.948 1.00 0.00 C ATOM 950 CD2 PHE A 57 6.670 -34.397 31.486 1.00 0.00 C ATOM 951 CE1 PHE A 57 4.621 -32.596 31.909 1.00 0.00 C ATOM 952 CE2 PHE A 57 6.802 -33.414 32.449 1.00 0.00 C ATOM 953 CZ PHE A 57 5.777 -32.513 32.661 1.00 0.00 C ATOM 0 H PHE A 57 5.971 -37.801 31.169 1.00 0.00 H new ATOM 0 HA PHE A 57 3.498 -36.371 30.362 1.00 0.00 H new ATOM 0 HB2 PHE A 57 6.355 -35.942 29.406 1.00 0.00 H new ATOM 0 HB3 PHE A 57 4.937 -35.130 28.772 1.00 0.00 H new ATOM 0 HD1 PHE A 57 3.584 -33.640 30.365 1.00 0.00 H new ATOM 0 HD2 PHE A 57 7.475 -35.098 31.325 1.00 0.00 H new ATOM 0 HE1 PHE A 57 3.819 -31.892 32.072 1.00 0.00 H new ATOM 0 HE2 PHE A 57 7.707 -33.351 33.036 1.00 0.00 H new ATOM 0 HZ PHE A 57 5.879 -31.745 33.413 1.00 0.00 H new ATOM 963 N TYR A 58 3.257 -37.708 28.267 1.00 0.00 N ATOM 964 CA TYR A 58 2.984 -38.623 27.161 1.00 0.00 C ATOM 965 C TYR A 58 2.730 -37.825 25.885 1.00 0.00 C ATOM 966 O TYR A 58 1.831 -36.984 25.843 1.00 0.00 O ATOM 967 CB TYR A 58 1.756 -39.492 27.477 1.00 0.00 C ATOM 968 CG TYR A 58 1.834 -40.218 28.807 1.00 0.00 C ATOM 969 CD1 TYR A 58 1.423 -39.594 29.980 1.00 0.00 C ATOM 970 CD2 TYR A 58 2.318 -41.519 28.893 1.00 0.00 C ATOM 971 CE1 TYR A 58 1.485 -40.243 31.195 1.00 0.00 C ATOM 972 CE2 TYR A 58 2.381 -42.176 30.107 1.00 0.00 C ATOM 973 CZ TYR A 58 1.965 -41.534 31.255 1.00 0.00 C ATOM 974 OH TYR A 58 2.025 -42.183 32.468 1.00 0.00 O ATOM 0 H TYR A 58 2.518 -37.023 28.429 1.00 0.00 H new ATOM 0 HA TYR A 58 3.849 -39.271 27.020 1.00 0.00 H new ATOM 0 HB2 TYR A 58 0.867 -38.861 27.472 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.630 -40.227 26.682 1.00 0.00 H new ATOM 0 HD1 TYR A 58 1.048 -38.582 29.938 1.00 0.00 H new ATOM 0 HD2 TYR A 58 2.650 -42.023 27.997 1.00 0.00 H new ATOM 0 HE1 TYR A 58 1.159 -39.743 32.095 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.754 -43.188 30.157 1.00 0.00 H new ATOM 0 HH TYR A 58 2.811 -41.875 32.965 1.00 0.00 H new ATOM 984 N SER A 59 3.525 -38.084 24.854 1.00 0.00 N ATOM 985 CA SER A 59 3.396 -37.373 23.587 1.00 0.00 C ATOM 986 C SER A 59 2.582 -38.195 22.584 1.00 0.00 C ATOM 987 O SER A 59 3.006 -39.276 22.156 1.00 0.00 O ATOM 988 CB SER A 59 4.787 -37.062 23.024 1.00 0.00 C ATOM 989 OG SER A 59 5.551 -36.307 23.952 1.00 0.00 O ATOM 0 H SER A 59 4.268 -38.783 24.870 1.00 0.00 H new ATOM 0 HA SER A 59 2.866 -36.437 23.762 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.306 -37.992 22.791 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.690 -36.508 22.090 1.00 0.00 H new ATOM 0 HG SER A 59 6.435 -36.121 23.573 1.00 0.00 H new ATOM 995 N PHE A 60 1.411 -37.677 22.220 1.00 0.00 N ATOM 996 CA PHE A 60 0.525 -38.334 21.262 1.00 0.00 C ATOM 997 C PHE A 60 0.570 -37.619 19.912 1.00 0.00 C ATOM 998 O PHE A 60 0.705 -36.394 19.845 1.00 0.00 O ATOM 999 CB PHE A 60 -0.922 -38.355 21.784 1.00 0.00 C ATOM 1000 CG PHE A 60 -1.101 -39.108 23.082 1.00 0.00 C ATOM 1001 CD1 PHE A 60 -1.168 -40.497 23.094 1.00 0.00 C ATOM 1002 CD2 PHE A 60 -1.208 -38.429 24.288 1.00 0.00 C ATOM 1003 CE1 PHE A 60 -1.337 -41.187 24.282 1.00 0.00 C ATOM 1004 CE2 PHE A 60 -1.377 -39.116 25.475 1.00 0.00 C ATOM 1005 CZ PHE A 60 -1.441 -40.495 25.472 1.00 0.00 C ATOM 0 H PHE A 60 1.051 -36.793 22.579 1.00 0.00 H new ATOM 0 HA PHE A 60 0.871 -39.360 21.135 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -1.261 -37.328 21.923 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -1.564 -38.803 21.025 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.087 -41.043 22.166 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.159 -37.350 24.299 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.387 -42.266 24.278 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.459 -38.574 26.405 1.00 0.00 H new ATOM 0 HZ PHE A 60 -1.572 -41.032 26.400 1.00 0.00 H new ATOM 1015 N ASN A 61 0.456 -38.399 18.845 1.00 0.00 N ATOM 1016 CA ASN A 61 0.449 -37.882 17.480 1.00 0.00 C ATOM 1017 C ASN A 61 -0.964 -37.968 16.908 1.00 0.00 C ATOM 1018 O ASN A 61 -1.548 -39.054 16.861 1.00 0.00 O ATOM 1019 CB ASN A 61 1.409 -38.701 16.605 1.00 0.00 C ATOM 1020 CG ASN A 61 1.533 -38.162 15.188 1.00 0.00 C ATOM 1021 OD1 ASN A 61 2.458 -37.415 14.876 1.00 0.00 O ATOM 1022 ND2 ASN A 61 0.597 -38.528 14.323 1.00 0.00 N ATOM 0 H ASN A 61 0.365 -39.413 18.901 1.00 0.00 H new ATOM 0 HA ASN A 61 0.775 -36.842 17.490 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.395 -38.713 17.070 1.00 0.00 H new ATOM 0 HB3 ASN A 61 1.063 -39.734 16.565 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.630 -38.188 13.362 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.156 -39.150 14.619 1.00 0.00 H new ATOM 1029 N VAL A 62 -1.513 -36.833 16.483 1.00 0.00 N ATOM 1030 CA VAL A 62 -2.862 -36.787 15.919 1.00 0.00 C ATOM 1031 C VAL A 62 -2.836 -36.152 14.532 1.00 0.00 C ATOM 1032 O VAL A 62 -2.428 -35.005 14.381 1.00 0.00 O ATOM 1033 CB VAL A 62 -3.828 -35.983 16.826 1.00 0.00 C ATOM 1034 CG1 VAL A 62 -5.230 -35.934 16.221 1.00 0.00 C ATOM 1035 CG2 VAL A 62 -3.861 -36.572 18.234 1.00 0.00 C ATOM 0 H VAL A 62 -1.043 -35.928 16.518 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.221 -37.814 15.849 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.458 -34.960 16.895 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.889 -35.364 16.876 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.188 -35.455 15.243 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.615 -36.948 16.112 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.545 -35.993 18.855 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.201 -37.607 18.188 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.861 -36.537 18.666 1.00 0.00 H new ATOM 1045 N SER A 63 -3.262 -36.899 13.523 1.00 0.00 N ATOM 1046 CA SER A 63 -3.343 -36.379 12.162 1.00 0.00 C ATOM 1047 C SER A 63 -4.780 -36.465 11.648 1.00 0.00 C ATOM 1048 O SER A 63 -5.354 -37.554 11.562 1.00 0.00 O ATOM 1049 CB SER A 63 -2.390 -37.159 11.251 1.00 0.00 C ATOM 1050 OG SER A 63 -2.630 -38.550 11.334 1.00 0.00 O ATOM 0 H SER A 63 -3.558 -37.870 13.620 1.00 0.00 H new ATOM 0 HA SER A 63 -3.045 -35.331 12.160 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.514 -36.826 10.220 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.358 -36.947 11.533 1.00 0.00 H new ATOM 0 HG SER A 63 -3.296 -38.808 10.663 1.00 0.00 H new ATOM 1056 N MET A 64 -5.362 -35.319 11.312 1.00 0.00 N ATOM 1057 CA MET A 64 -6.755 -35.263 10.867 1.00 0.00 C ATOM 1058 C MET A 64 -6.896 -34.317 9.683 1.00 0.00 C ATOM 1059 O MET A 64 -6.013 -33.496 9.430 1.00 0.00 O ATOM 1060 CB MET A 64 -7.665 -34.800 12.014 1.00 0.00 C ATOM 1061 CG MET A 64 -7.452 -33.346 12.423 1.00 0.00 C ATOM 1062 SD MET A 64 -8.501 -32.850 13.803 1.00 0.00 S ATOM 1063 CE MET A 64 -10.135 -33.174 13.140 1.00 0.00 C ATOM 0 H MET A 64 -4.892 -34.414 11.338 1.00 0.00 H new ATOM 0 HA MET A 64 -7.057 -36.264 10.558 1.00 0.00 H new ATOM 0 HB2 MET A 64 -8.705 -34.935 11.717 1.00 0.00 H new ATOM 0 HB3 MET A 64 -7.495 -35.440 12.880 1.00 0.00 H new ATOM 0 HG2 MET A 64 -6.407 -33.199 12.695 1.00 0.00 H new ATOM 0 HG3 MET A 64 -7.653 -32.699 11.569 1.00 0.00 H new ATOM 0 HE1 MET A 64 -10.767 -32.298 13.285 1.00 0.00 H new ATOM 0 HE2 MET A 64 -10.058 -33.395 12.075 1.00 0.00 H new ATOM 0 HE3 MET A 64 -10.575 -34.027 13.657 1.00 0.00 H new ATOM 1073 N GLU A 65 -8.006 -34.437 8.964 1.00 0.00 N ATOM 1074 CA GLU A 65 -8.277 -33.575 7.820 1.00 0.00 C ATOM 1075 C GLU A 65 -8.638 -32.163 8.269 1.00 0.00 C ATOM 1076 O GLU A 65 -9.299 -31.973 9.295 1.00 0.00 O ATOM 1077 CB GLU A 65 -9.416 -34.141 6.966 1.00 0.00 C ATOM 1078 CG GLU A 65 -9.102 -35.476 6.309 1.00 0.00 C ATOM 1079 CD GLU A 65 -10.171 -35.887 5.313 1.00 0.00 C ATOM 1080 OE1 GLU A 65 -10.192 -35.323 4.198 1.00 0.00 O ATOM 1081 OE2 GLU A 65 -11.007 -36.753 5.641 1.00 0.00 O ATOM 0 H GLU A 65 -8.735 -35.125 9.154 1.00 0.00 H new ATOM 0 HA GLU A 65 -7.367 -33.535 7.222 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.301 -34.257 7.592 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.667 -33.418 6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -8.139 -35.412 5.802 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -9.008 -36.244 7.077 1.00 0.00 H new ATOM 1088 N VAL A 66 -8.188 -31.185 7.493 1.00 0.00 N ATOM 1089 CA VAL A 66 -8.564 -29.789 7.677 1.00 0.00 C ATOM 1090 C VAL A 66 -8.929 -29.183 6.321 1.00 0.00 C ATOM 1091 O VAL A 66 -8.174 -29.303 5.350 1.00 0.00 O ATOM 1092 CB VAL A 66 -7.433 -28.960 8.346 1.00 0.00 C ATOM 1093 CG1 VAL A 66 -7.259 -29.357 9.812 1.00 0.00 C ATOM 1094 CG2 VAL A 66 -6.115 -29.120 7.586 1.00 0.00 C ATOM 0 H VAL A 66 -7.548 -31.339 6.714 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.423 -29.757 8.347 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.722 -27.910 8.309 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.462 -28.763 10.258 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.190 -29.178 10.350 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.002 -30.414 9.875 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.339 -28.530 8.074 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.823 -30.170 7.581 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.242 -28.774 6.560 1.00 0.00 H new ATOM 1104 N SER A 67 -10.100 -28.565 6.255 1.00 0.00 N ATOM 1105 CA SER A 67 -10.618 -28.005 5.014 1.00 0.00 C ATOM 1106 C SER A 67 -10.084 -26.590 4.795 1.00 0.00 C ATOM 1107 O SER A 67 -9.938 -26.139 3.658 1.00 0.00 O ATOM 1108 CB SER A 67 -12.154 -28.003 5.046 1.00 0.00 C ATOM 1109 OG SER A 67 -12.700 -27.578 3.810 1.00 0.00 O ATOM 0 H SER A 67 -10.716 -28.438 7.058 1.00 0.00 H new ATOM 0 HA SER A 67 -10.282 -28.624 4.182 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.515 -29.005 5.279 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.501 -27.346 5.843 1.00 0.00 H new ATOM 0 HG SER A 67 -13.678 -27.590 3.863 1.00 0.00 H new ATOM 1115 N ASN A 68 -9.775 -25.897 5.888 1.00 0.00 N ATOM 1116 CA ASN A 68 -9.305 -24.519 5.808 1.00 0.00 C ATOM 1117 C ASN A 68 -8.414 -24.167 6.996 1.00 0.00 C ATOM 1118 O ASN A 68 -8.172 -24.995 7.878 1.00 0.00 O ATOM 1119 CB ASN A 68 -10.498 -23.551 5.724 1.00 0.00 C ATOM 1120 CG ASN A 68 -11.427 -23.625 6.930 1.00 0.00 C ATOM 1121 OD1 ASN A 68 -10.995 -23.863 8.057 1.00 0.00 O ATOM 1122 ND2 ASN A 68 -12.713 -23.424 6.700 1.00 0.00 N ATOM 0 H ASN A 68 -9.842 -26.267 6.836 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.707 -24.420 4.902 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -10.123 -22.532 5.626 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.069 -23.768 4.821 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.381 -23.464 7.470 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.037 -23.229 5.753 1.00 0.00 H new ATOM 1129 N GLU A 69 -7.943 -22.925 7.011 1.00 0.00 N ATOM 1130 CA GLU A 69 -7.050 -22.438 8.057 1.00 0.00 C ATOM 1131 C GLU A 69 -7.826 -22.185 9.350 1.00 0.00 C ATOM 1132 O GLU A 69 -7.281 -22.299 10.450 1.00 0.00 O ATOM 1133 CB GLU A 69 -6.363 -21.149 7.582 1.00 0.00 C ATOM 1134 CG GLU A 69 -5.367 -20.562 8.575 1.00 0.00 C ATOM 1135 CD GLU A 69 -4.744 -19.272 8.070 1.00 0.00 C ATOM 1136 OE1 GLU A 69 -5.314 -18.190 8.323 1.00 0.00 O ATOM 1137 OE2 GLU A 69 -3.692 -19.333 7.402 1.00 0.00 O ATOM 0 H GLU A 69 -8.168 -22.229 6.301 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.292 -23.194 8.261 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.845 -21.352 6.644 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -7.128 -20.402 7.369 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.871 -20.373 9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.580 -21.291 8.771 1.00 0.00 H new ATOM 1144 N SER A 70 -9.107 -21.860 9.207 1.00 0.00 N ATOM 1145 CA SER A 70 -9.969 -21.586 10.351 1.00 0.00 C ATOM 1146 C SER A 70 -10.029 -22.805 11.277 1.00 0.00 C ATOM 1147 O SER A 70 -10.002 -22.670 12.504 1.00 0.00 O ATOM 1148 CB SER A 70 -11.378 -21.202 9.873 1.00 0.00 C ATOM 1149 OG SER A 70 -12.186 -20.746 10.947 1.00 0.00 O ATOM 0 H SER A 70 -9.573 -21.780 8.303 1.00 0.00 H new ATOM 0 HA SER A 70 -9.553 -20.749 10.911 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.306 -20.423 9.114 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.851 -22.064 9.401 1.00 0.00 H new ATOM 0 HG SER A 70 -13.075 -20.508 10.610 1.00 0.00 H new ATOM 1155 N GLU A 71 -10.089 -23.997 10.682 1.00 0.00 N ATOM 1156 CA GLU A 71 -10.153 -25.237 11.451 1.00 0.00 C ATOM 1157 C GLU A 71 -8.806 -25.545 12.100 1.00 0.00 C ATOM 1158 O GLU A 71 -8.751 -26.193 13.143 1.00 0.00 O ATOM 1159 CB GLU A 71 -10.602 -26.406 10.567 1.00 0.00 C ATOM 1160 CG GLU A 71 -11.997 -26.222 9.979 1.00 0.00 C ATOM 1161 CD GLU A 71 -12.477 -27.435 9.201 1.00 0.00 C ATOM 1162 OE1 GLU A 71 -11.644 -28.115 8.575 1.00 0.00 O ATOM 1163 OE2 GLU A 71 -13.696 -27.708 9.203 1.00 0.00 O ATOM 0 H GLU A 71 -10.095 -24.128 9.671 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.891 -25.103 12.242 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.887 -26.532 9.754 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.582 -27.324 11.154 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.700 -26.012 10.785 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.997 -25.352 9.322 1.00 0.00 H new ATOM 1170 N ARG A 72 -7.726 -25.066 11.485 1.00 0.00 N ATOM 1171 CA ARG A 72 -6.384 -25.224 12.050 1.00 0.00 C ATOM 1172 C ARG A 72 -6.352 -24.637 13.461 1.00 0.00 C ATOM 1173 O ARG A 72 -5.835 -25.243 14.400 1.00 0.00 O ATOM 1174 CB ARG A 72 -5.339 -24.514 11.169 1.00 0.00 C ATOM 1175 CG ARG A 72 -3.891 -24.722 11.622 1.00 0.00 C ATOM 1176 CD ARG A 72 -2.949 -23.668 11.041 1.00 0.00 C ATOM 1177 NE ARG A 72 -3.022 -23.582 9.579 1.00 0.00 N ATOM 1178 CZ ARG A 72 -2.363 -22.677 8.848 1.00 0.00 C ATOM 1179 NH1 ARG A 72 -1.574 -21.785 9.434 1.00 0.00 N ATOM 1180 NH2 ARG A 72 -2.496 -22.666 7.528 1.00 0.00 N ATOM 0 H ARG A 72 -7.752 -24.566 10.597 1.00 0.00 H new ATOM 0 HA ARG A 72 -6.142 -26.286 12.089 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -5.442 -24.870 10.144 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -5.555 -23.446 11.158 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -3.844 -24.689 12.710 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -3.556 -25.714 11.319 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -3.191 -22.696 11.470 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -1.926 -23.900 11.336 1.00 0.00 H new ATOM 0 HE ARG A 72 -3.612 -24.254 9.089 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -1.467 -21.787 10.448 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -1.074 -21.098 8.870 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -3.101 -23.348 7.071 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.993 -21.976 6.971 1.00 0.00 H new ATOM 1194 N ASN A 73 -6.937 -23.449 13.590 1.00 0.00 N ATOM 1195 CA ASN A 73 -7.002 -22.742 14.866 1.00 0.00 C ATOM 1196 C ASN A 73 -8.092 -23.338 15.749 1.00 0.00 C ATOM 1197 O ASN A 73 -7.930 -23.461 16.963 1.00 0.00 O ATOM 1198 CB ASN A 73 -7.285 -21.252 14.630 1.00 0.00 C ATOM 1199 CG ASN A 73 -6.236 -20.588 13.755 1.00 0.00 C ATOM 1200 OD1 ASN A 73 -5.070 -20.981 13.752 1.00 0.00 O ATOM 1201 ND2 ASN A 73 -6.645 -19.576 13.004 1.00 0.00 N ATOM 0 H ASN A 73 -7.378 -22.951 12.816 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.041 -22.849 15.370 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.264 -21.142 14.164 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.330 -20.738 15.590 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -5.984 -19.093 12.395 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -7.621 -19.280 13.035 1.00 0.00 H new ATOM 1208 N GLU A 74 -9.206 -23.701 15.120 1.00 0.00 N ATOM 1209 CA GLU A 74 -10.359 -24.266 15.818 1.00 0.00 C ATOM 1210 C GLU A 74 -9.963 -25.511 16.609 1.00 0.00 C ATOM 1211 O GLU A 74 -10.115 -25.569 17.832 1.00 0.00 O ATOM 1212 CB GLU A 74 -11.448 -24.628 14.801 1.00 0.00 C ATOM 1213 CG GLU A 74 -12.712 -25.207 15.420 1.00 0.00 C ATOM 1214 CD GLU A 74 -13.423 -24.208 16.318 1.00 0.00 C ATOM 1215 OE1 GLU A 74 -14.001 -23.234 15.785 1.00 0.00 O ATOM 1216 OE2 GLU A 74 -13.391 -24.376 17.555 1.00 0.00 O ATOM 0 H GLU A 74 -9.336 -23.612 14.112 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.738 -23.520 16.517 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.711 -23.735 14.234 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.042 -25.348 14.091 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.389 -25.526 14.628 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.457 -26.095 15.998 1.00 0.00 H new ATOM 1223 N ILE A 75 -9.436 -26.491 15.891 1.00 0.00 N ATOM 1224 CA ILE A 75 -9.057 -27.769 16.473 1.00 0.00 C ATOM 1225 C ILE A 75 -7.947 -27.579 17.504 1.00 0.00 C ATOM 1226 O ILE A 75 -7.922 -28.254 18.532 1.00 0.00 O ATOM 1227 CB ILE A 75 -8.613 -28.748 15.360 1.00 0.00 C ATOM 1228 CG1 ILE A 75 -9.744 -28.880 14.321 1.00 0.00 C ATOM 1229 CG2 ILE A 75 -8.241 -30.114 15.943 1.00 0.00 C ATOM 1230 CD1 ILE A 75 -9.354 -29.601 13.050 1.00 0.00 C ATOM 0 H ILE A 75 -9.259 -26.423 14.889 1.00 0.00 H new ATOM 0 HA ILE A 75 -9.922 -28.194 16.983 1.00 0.00 H new ATOM 0 HB ILE A 75 -7.722 -28.353 14.872 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -10.580 -29.407 14.780 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -10.099 -27.883 14.062 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -7.933 -30.781 15.138 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -7.420 -29.996 16.651 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -9.104 -30.538 16.456 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -10.212 -29.646 12.379 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -8.540 -29.065 12.563 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.029 -30.613 13.291 1.00 0.00 H new ATOM 1242 N PHE A 76 -7.051 -26.631 17.232 1.00 0.00 N ATOM 1243 CA PHE A 76 -5.987 -26.276 18.170 1.00 0.00 C ATOM 1244 C PHE A 76 -6.583 -25.888 19.526 1.00 0.00 C ATOM 1245 O PHE A 76 -6.125 -26.343 20.578 1.00 0.00 O ATOM 1246 CB PHE A 76 -5.149 -25.122 17.600 1.00 0.00 C ATOM 1247 CG PHE A 76 -4.055 -24.633 18.519 1.00 0.00 C ATOM 1248 CD1 PHE A 76 -2.921 -25.400 18.740 1.00 0.00 C ATOM 1249 CD2 PHE A 76 -4.161 -23.404 19.160 1.00 0.00 C ATOM 1250 CE1 PHE A 76 -1.917 -24.953 19.578 1.00 0.00 C ATOM 1251 CE2 PHE A 76 -3.158 -22.955 19.998 1.00 0.00 C ATOM 1252 CZ PHE A 76 -2.034 -23.731 20.207 1.00 0.00 C ATOM 0 H PHE A 76 -7.041 -26.093 16.366 1.00 0.00 H new ATOM 0 HA PHE A 76 -5.339 -27.140 18.314 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.700 -25.444 16.660 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.811 -24.288 17.368 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.821 -26.358 18.251 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -5.037 -22.793 19.001 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.040 -25.561 19.741 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.253 -21.998 20.489 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.249 -23.382 20.861 1.00 0.00 H new ATOM 1262 N GLN A 77 -7.621 -25.056 19.485 1.00 0.00 N ATOM 1263 CA GLN A 77 -8.317 -24.619 20.693 1.00 0.00 C ATOM 1264 C GLN A 77 -8.970 -25.809 21.393 1.00 0.00 C ATOM 1265 O GLN A 77 -8.896 -25.942 22.614 1.00 0.00 O ATOM 1266 CB GLN A 77 -9.377 -23.569 20.344 1.00 0.00 C ATOM 1267 CG GLN A 77 -8.800 -22.299 19.732 1.00 0.00 C ATOM 1268 CD GLN A 77 -9.872 -21.346 19.238 1.00 0.00 C ATOM 1269 OE1 GLN A 77 -10.349 -20.487 19.981 1.00 0.00 O ATOM 1270 NE2 GLN A 77 -10.261 -21.495 17.983 1.00 0.00 N ATOM 0 H GLN A 77 -8.001 -24.668 18.621 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.588 -24.173 21.369 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -10.093 -24.005 19.647 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -9.929 -23.309 21.247 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.183 -21.792 20.473 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.146 -22.566 18.902 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.840 -22.219 17.401 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -10.982 -20.886 17.597 1.00 0.00 H new ATOM 1279 N LYS A 78 -9.602 -26.672 20.603 1.00 0.00 N ATOM 1280 CA LYS A 78 -10.240 -27.882 21.120 1.00 0.00 C ATOM 1281 C LYS A 78 -9.239 -28.728 21.909 1.00 0.00 C ATOM 1282 O LYS A 78 -9.535 -29.206 23.006 1.00 0.00 O ATOM 1283 CB LYS A 78 -10.820 -28.704 19.958 1.00 0.00 C ATOM 1284 CG LYS A 78 -12.035 -28.071 19.283 1.00 0.00 C ATOM 1285 CD LYS A 78 -13.276 -28.151 20.170 1.00 0.00 C ATOM 1286 CE LYS A 78 -14.499 -27.536 19.498 1.00 0.00 C ATOM 1287 NZ LYS A 78 -14.352 -26.071 19.303 1.00 0.00 N ATOM 0 H LYS A 78 -9.687 -26.555 19.593 1.00 0.00 H new ATOM 0 HA LYS A 78 -11.047 -27.588 21.791 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.041 -28.854 19.210 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -11.099 -29.690 20.330 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -11.820 -27.028 19.050 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.230 -28.575 18.337 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -13.482 -29.194 20.413 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.083 -27.637 21.111 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.661 -28.015 18.533 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.383 -27.734 20.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.293 -25.636 19.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.851 -25.661 20.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.809 -25.889 18.435 1.00 0.00 H new ATOM 1301 N ILE A 79 -8.048 -28.880 21.346 1.00 0.00 N ATOM 1302 CA ILE A 79 -7.000 -29.711 21.937 1.00 0.00 C ATOM 1303 C ILE A 79 -6.558 -29.183 23.307 1.00 0.00 C ATOM 1304 O ILE A 79 -6.133 -29.948 24.170 1.00 0.00 O ATOM 1305 CB ILE A 79 -5.774 -29.814 20.991 1.00 0.00 C ATOM 1306 CG1 ILE A 79 -6.176 -30.503 19.677 1.00 0.00 C ATOM 1307 CG2 ILE A 79 -4.624 -30.565 21.661 1.00 0.00 C ATOM 1308 CD1 ILE A 79 -5.060 -30.580 18.656 1.00 0.00 C ATOM 0 H ILE A 79 -7.779 -28.434 20.469 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.425 -30.705 22.078 1.00 0.00 H new ATOM 0 HB ILE A 79 -5.428 -28.805 20.768 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.522 -31.513 19.899 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.018 -29.966 19.240 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.778 -30.622 20.976 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -4.323 -30.037 22.566 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -4.950 -31.572 21.920 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.423 -31.079 17.758 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.728 -29.573 18.403 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.225 -31.143 19.072 1.00 0.00 H new ATOM 1320 N SER A 80 -6.654 -27.879 23.516 1.00 0.00 N ATOM 1321 CA SER A 80 -6.223 -27.290 24.782 1.00 0.00 C ATOM 1322 C SER A 80 -7.329 -27.348 25.840 1.00 0.00 C ATOM 1323 O SER A 80 -7.153 -26.862 26.957 1.00 0.00 O ATOM 1324 CB SER A 80 -5.754 -25.850 24.563 1.00 0.00 C ATOM 1325 OG SER A 80 -6.765 -25.049 23.965 1.00 0.00 O ATOM 0 H SER A 80 -7.021 -27.212 22.837 1.00 0.00 H new ATOM 0 HA SER A 80 -5.386 -27.879 25.157 1.00 0.00 H new ATOM 0 HB2 SER A 80 -5.463 -25.414 25.518 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.868 -25.849 23.929 1.00 0.00 H new ATOM 0 HG SER A 80 -7.526 -25.614 23.717 1.00 0.00 H new ATOM 1331 N GLN A 81 -8.461 -27.964 25.495 1.00 0.00 N ATOM 1332 CA GLN A 81 -9.597 -28.065 26.415 1.00 0.00 C ATOM 1333 C GLN A 81 -9.648 -29.445 27.081 1.00 0.00 C ATOM 1334 O GLN A 81 -10.660 -29.816 27.677 1.00 0.00 O ATOM 1335 CB GLN A 81 -10.911 -27.804 25.661 1.00 0.00 C ATOM 1336 CG GLN A 81 -10.965 -26.454 24.950 1.00 0.00 C ATOM 1337 CD GLN A 81 -12.262 -26.228 24.181 1.00 0.00 C ATOM 1338 OE1 GLN A 81 -12.708 -25.092 24.012 1.00 0.00 O ATOM 1339 NE2 GLN A 81 -12.878 -27.303 23.708 1.00 0.00 N ATOM 0 H GLN A 81 -8.616 -28.400 24.586 1.00 0.00 H new ATOM 0 HA GLN A 81 -9.469 -27.313 27.193 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.059 -28.595 24.926 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.740 -27.864 26.366 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -10.844 -25.659 25.686 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -10.124 -26.381 24.260 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -12.481 -28.229 23.866 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -13.749 -27.204 23.186 1.00 0.00 H new ATOM 1348 N LEU A 82 -8.552 -30.196 26.991 1.00 0.00 N ATOM 1349 CA LEU A 82 -8.515 -31.566 27.511 1.00 0.00 C ATOM 1350 C LEU A 82 -8.239 -31.592 29.011 1.00 0.00 C ATOM 1351 O LEU A 82 -8.564 -32.576 29.677 1.00 0.00 O ATOM 1352 CB LEU A 82 -7.440 -32.388 26.787 1.00 0.00 C ATOM 1353 CG LEU A 82 -7.480 -32.301 25.256 1.00 0.00 C ATOM 1354 CD1 LEU A 82 -6.299 -33.044 24.639 1.00 0.00 C ATOM 1355 CD2 LEU A 82 -8.801 -32.836 24.721 1.00 0.00 C ATOM 0 H LEU A 82 -7.680 -29.883 26.565 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.497 -32.004 27.331 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.459 -32.058 27.129 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -7.544 -33.433 27.080 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.401 -31.252 24.972 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.349 -32.968 23.553 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -5.367 -32.602 24.991 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.336 -34.093 24.932 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.809 -32.765 23.633 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.918 -33.878 25.018 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.623 -32.248 25.129 1.00 0.00 H new ATOM 1367 N ASP A 83 -7.621 -30.519 29.524 1.00 0.00 N ATOM 1368 CA ASP A 83 -7.185 -30.436 30.931 1.00 0.00 C ATOM 1369 C ASP A 83 -5.955 -31.317 31.175 1.00 0.00 C ATOM 1370 O ASP A 83 -4.969 -30.880 31.777 1.00 0.00 O ATOM 1371 CB ASP A 83 -8.323 -30.811 31.897 1.00 0.00 C ATOM 1372 CG ASP A 83 -7.892 -30.795 33.359 1.00 0.00 C ATOM 1373 OD1 ASP A 83 -7.881 -29.706 33.971 1.00 0.00 O ATOM 1374 OD2 ASP A 83 -7.572 -31.872 33.906 1.00 0.00 O ATOM 0 H ASP A 83 -7.408 -29.684 28.979 1.00 0.00 H new ATOM 0 HA ASP A 83 -6.910 -29.400 31.129 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.152 -30.116 31.761 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.694 -31.804 31.644 1.00 0.00 H new ATOM 1379 N LYS A 84 -6.024 -32.555 30.694 1.00 0.00 N ATOM 1380 CA LYS A 84 -4.918 -33.508 30.787 1.00 0.00 C ATOM 1381 C LYS A 84 -3.694 -33.014 30.010 1.00 0.00 C ATOM 1382 O LYS A 84 -2.560 -33.413 30.291 1.00 0.00 O ATOM 1383 CB LYS A 84 -5.358 -34.865 30.224 1.00 0.00 C ATOM 1384 CG LYS A 84 -6.528 -35.505 30.975 1.00 0.00 C ATOM 1385 CD LYS A 84 -7.639 -35.948 30.024 1.00 0.00 C ATOM 1386 CE LYS A 84 -8.750 -36.697 30.753 1.00 0.00 C ATOM 1387 NZ LYS A 84 -8.358 -38.083 31.126 1.00 0.00 N ATOM 0 H LYS A 84 -6.850 -32.928 30.227 1.00 0.00 H new ATOM 0 HA LYS A 84 -4.645 -33.608 31.838 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -5.638 -34.739 29.178 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.509 -35.548 30.247 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -6.170 -36.365 31.541 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -6.930 -34.793 31.697 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -8.058 -35.075 29.524 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -7.219 -36.588 29.248 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -9.024 -36.146 31.653 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.636 -36.732 30.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -8.751 -38.315 32.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -8.728 -38.750 30.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -7.321 -38.153 31.159 1.00 0.00 H new ATOM 1401 N VAL A 85 -3.939 -32.153 29.027 1.00 0.00 N ATOM 1402 CA VAL A 85 -2.893 -31.671 28.130 1.00 0.00 C ATOM 1403 C VAL A 85 -2.056 -30.573 28.789 1.00 0.00 C ATOM 1404 O VAL A 85 -2.581 -29.728 29.516 1.00 0.00 O ATOM 1405 CB VAL A 85 -3.503 -31.146 26.803 1.00 0.00 C ATOM 1406 CG1 VAL A 85 -4.427 -29.953 27.053 1.00 0.00 C ATOM 1407 CG2 VAL A 85 -2.408 -30.788 25.802 1.00 0.00 C ATOM 0 H VAL A 85 -4.864 -31.771 28.830 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.239 -32.515 27.909 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.103 -31.948 26.373 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.839 -29.607 26.105 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.240 -30.254 27.714 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.861 -29.146 27.519 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.862 -30.423 24.881 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.769 -30.012 26.224 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.810 -31.673 25.585 1.00 0.00 H new ATOM 1417 N VAL A 86 -0.748 -30.606 28.541 1.00 0.00 N ATOM 1418 CA VAL A 86 0.176 -29.604 29.074 1.00 0.00 C ATOM 1419 C VAL A 86 0.861 -28.831 27.944 1.00 0.00 C ATOM 1420 O VAL A 86 1.338 -27.711 28.146 1.00 0.00 O ATOM 1421 CB VAL A 86 1.258 -30.251 29.978 1.00 0.00 C ATOM 1422 CG1 VAL A 86 0.620 -30.895 31.208 1.00 0.00 C ATOM 1423 CG2 VAL A 86 2.082 -31.274 29.196 1.00 0.00 C ATOM 0 H VAL A 86 -0.300 -31.322 27.969 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.417 -28.914 29.674 1.00 0.00 H new ATOM 0 HB VAL A 86 1.931 -29.463 30.316 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.396 -31.343 31.828 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.090 -30.136 31.782 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.082 -31.667 30.892 1.00 0.00 H new ATOM 0 HG21 VAL A 86 2.834 -31.713 29.852 1.00 0.00 H new ATOM 0 HG22 VAL A 86 1.426 -32.059 28.819 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.575 -30.780 28.359 1.00 0.00 H new ATOM 1433 N GLN A 87 0.909 -29.432 26.757 1.00 0.00 N ATOM 1434 CA GLN A 87 1.550 -28.806 25.602 1.00 0.00 C ATOM 1435 C GLN A 87 0.757 -29.099 24.331 1.00 0.00 C ATOM 1436 O GLN A 87 0.379 -30.247 24.071 1.00 0.00 O ATOM 1437 CB GLN A 87 3.001 -29.295 25.467 1.00 0.00 C ATOM 1438 CG GLN A 87 3.761 -28.655 24.310 1.00 0.00 C ATOM 1439 CD GLN A 87 3.786 -27.137 24.389 1.00 0.00 C ATOM 1440 OE1 GLN A 87 2.904 -26.458 23.860 1.00 0.00 O ATOM 1441 NE2 GLN A 87 4.797 -26.592 25.038 1.00 0.00 N ATOM 0 H GLN A 87 0.511 -30.352 26.569 1.00 0.00 H new ATOM 0 HA GLN A 87 1.566 -27.726 25.752 1.00 0.00 H new ATOM 0 HB2 GLN A 87 3.532 -29.089 26.396 1.00 0.00 H new ATOM 0 HB3 GLN A 87 2.999 -30.377 25.334 1.00 0.00 H new ATOM 0 HG2 GLN A 87 4.784 -29.031 24.302 1.00 0.00 H new ATOM 0 HG3 GLN A 87 3.303 -28.958 23.369 1.00 0.00 H new ATOM 0 HE21 GLN A 87 5.509 -27.185 25.464 1.00 0.00 H new ATOM 0 HE22 GLN A 87 4.867 -25.577 25.114 1.00 0.00 H new ATOM 1450 N THR A 88 0.508 -28.053 23.548 1.00 0.00 N ATOM 1451 CA THR A 88 -0.312 -28.148 22.346 1.00 0.00 C ATOM 1452 C THR A 88 0.428 -27.586 21.128 1.00 0.00 C ATOM 1453 O THR A 88 0.660 -26.380 21.036 1.00 0.00 O ATOM 1454 CB THR A 88 -1.651 -27.387 22.540 1.00 0.00 C ATOM 1455 OG1 THR A 88 -1.404 -26.093 23.116 1.00 0.00 O ATOM 1456 CG2 THR A 88 -2.604 -28.163 23.442 1.00 0.00 C ATOM 0 H THR A 88 0.869 -27.117 23.730 1.00 0.00 H new ATOM 0 HA THR A 88 -0.521 -29.203 22.170 1.00 0.00 H new ATOM 0 HB THR A 88 -2.114 -27.275 21.559 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.637 -25.677 22.670 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.532 -27.603 23.558 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.819 -29.134 22.995 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.143 -28.308 24.419 1.00 0.00 H new ATOM 1464 N LEU A 89 0.820 -28.468 20.206 1.00 0.00 N ATOM 1465 CA LEU A 89 1.460 -28.044 18.959 1.00 0.00 C ATOM 1466 C LEU A 89 0.472 -28.178 17.802 1.00 0.00 C ATOM 1467 O LEU A 89 0.187 -29.287 17.338 1.00 0.00 O ATOM 1468 CB LEU A 89 2.728 -28.872 18.663 1.00 0.00 C ATOM 1469 CG LEU A 89 3.856 -28.796 19.712 1.00 0.00 C ATOM 1470 CD1 LEU A 89 4.167 -27.347 20.086 1.00 0.00 C ATOM 1471 CD2 LEU A 89 3.511 -29.622 20.950 1.00 0.00 C ATOM 0 H LEU A 89 0.706 -29.477 20.299 1.00 0.00 H new ATOM 0 HA LEU A 89 1.759 -27.002 19.071 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.436 -29.916 18.550 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.131 -28.548 17.703 1.00 0.00 H new ATOM 0 HG LEU A 89 4.754 -29.223 19.265 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.966 -27.326 20.827 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.482 -26.801 19.197 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.275 -26.879 20.501 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.323 -29.551 21.673 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.593 -29.241 21.397 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.370 -30.664 20.664 1.00 0.00 H new