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 Set 1.1: A 67 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 68 ASN : amide:sc= 1.93 K(o=3.1,f=-3.5!) USER MOD Set 1.3: A 70 SER OG : rot 77:sc= 1.22 USER MOD Set 2.1: A 61 ASN : amide:sc= -1.32 K(o=-0.69,f=-3.9!) USER MOD Set 2.2: A 63 SER OG : rot -64:sc= 0.626 USER MOD Set 3.1: A 40 TYR OH : rot -155:sc= 1.15 USER MOD Set 3.2: A 78 LYS NZ :NH3+ -179:sc= 0.656 (180deg=-0.203) USER MOD Set 4.1: A 31 SER OG : rot -112:sc= 0.395 USER MOD Set 4.2: A 32 THR OG1 : rot -160:sc= 0.924 USER MOD Set 4.3: A 84 LYS NZ :NH3+ 180:sc= 2.11 (180deg=1.16) USER MOD Single : A 15 TYR OH : rot -115:sc= 0.935 USER MOD Single : A 17 CYS SG : rot 180:sc= -0.719 USER MOD Single : A 21 TYR OH : rot -96:sc= -1.31 USER MOD Single : A 25 MET CE :methyl -111:sc= -0.145 (180deg=-1.33) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00906 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0469 USER MOD Single : A 28 LYS NZ :NH3+ 168:sc= -0.0588 (180deg=-0.24) USER MOD Single : A 30 THR OG1 : rot -120:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -109:sc= -0.253 (180deg=-2.59!) USER MOD Single : A 39 THR OG1 : rot -71:sc= 1.36 USER MOD Single : A 41 GLN : amide:sc= 0.575 K(o=0.58,f=-0.036) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.124 X(o=-0.12,f=-0.18) USER MOD Single : A 51 THR OG1 : rot 118:sc= -0.636 USER MOD Single : A 52 SER OG : rot 180:sc= -0.215 USER MOD Single : A 53 LYS NZ :NH3+ -162:sc= -1.8! (180deg=-3!) USER MOD Single : A 54 ASN : amide:sc= -1.02 K(o=-1,f=-0.47) USER MOD Single : A 56 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0592) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl -145:sc= -0.503 (180deg=-1.56) USER MOD Single : A 73 ASN : amide:sc= 0.946 K(o=0.95,f=-0.054) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -1.01 K(o=-1,f=-0.17) USER MOD Single : A 87 GLN : amide:sc= -1.59 X(o=-1.6,f=-1.5) USER MOD Single : A 88 THR OG1 : rot 98:sc= 0.181 USER MOD ----------------------------------------------------------------- ATOM 220 N TYR A 15 -8.248 -26.996 0.510 1.00 0.00 N ATOM 221 CA TYR A 15 -9.250 -27.552 1.415 1.00 0.00 C ATOM 222 C TYR A 15 -10.369 -28.225 0.609 1.00 0.00 C ATOM 223 O TYR A 15 -10.678 -27.788 -0.500 1.00 0.00 O ATOM 224 CB TYR A 15 -9.835 -26.441 2.302 1.00 0.00 C ATOM 225 CG TYR A 15 -8.824 -25.766 3.222 1.00 0.00 C ATOM 226 CD1 TYR A 15 -7.964 -24.781 2.745 1.00 0.00 C ATOM 227 CD2 TYR A 15 -8.745 -26.101 4.572 1.00 0.00 C ATOM 228 CE1 TYR A 15 -7.057 -24.155 3.582 1.00 0.00 C ATOM 229 CE2 TYR A 15 -7.844 -25.472 5.414 1.00 0.00 C ATOM 230 CZ TYR A 15 -7.003 -24.501 4.914 1.00 0.00 C ATOM 231 OH TYR A 15 -6.112 -23.866 5.752 1.00 0.00 O ATOM 0 HA TYR A 15 -8.775 -28.298 2.052 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -10.287 -25.683 1.662 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -10.635 -26.863 2.910 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -8.005 -24.500 1.703 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -9.398 -26.865 4.968 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -6.393 -23.397 3.192 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -7.800 -25.741 6.459 1.00 0.00 H new ATOM 0 HH TYR A 15 -5.454 -24.513 6.081 1.00 0.00 H new ATOM 241 N PRO A 16 -11.004 -29.293 1.140 1.00 0.00 N ATOM 242 CA PRO A 16 -10.693 -29.874 2.455 1.00 0.00 C ATOM 243 C PRO A 16 -9.421 -30.722 2.420 1.00 0.00 C ATOM 244 O PRO A 16 -8.984 -31.155 1.352 1.00 0.00 O ATOM 245 CB PRO A 16 -11.926 -30.750 2.775 1.00 0.00 C ATOM 246 CG PRO A 16 -12.907 -30.498 1.669 1.00 0.00 C ATOM 247 CD PRO A 16 -12.098 -30.026 0.493 1.00 0.00 C ATOM 0 HA PRO A 16 -10.506 -29.106 3.206 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -11.654 -31.804 2.823 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -12.352 -30.486 3.743 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -13.459 -31.405 1.423 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -13.641 -29.748 1.963 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -11.731 -30.858 -0.108 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -12.680 -29.386 -0.170 1.00 0.00 H new ATOM 255 N CYS A 17 -8.832 -30.950 3.589 1.00 0.00 N ATOM 256 CA CYS A 17 -7.582 -31.696 3.694 1.00 0.00 C ATOM 257 C CYS A 17 -7.352 -32.151 5.131 1.00 0.00 C ATOM 258 O CYS A 17 -7.955 -31.618 6.064 1.00 0.00 O ATOM 259 CB CYS A 17 -6.405 -30.824 3.225 1.00 0.00 C ATOM 260 SG CYS A 17 -4.792 -31.642 3.296 1.00 0.00 S ATOM 0 H CYS A 17 -9.203 -30.627 4.483 1.00 0.00 H new ATOM 0 HA CYS A 17 -7.649 -32.577 3.055 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -6.592 -30.504 2.200 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -6.369 -29.923 3.838 1.00 0.00 H new ATOM 0 HG CYS A 17 -3.872 -30.824 2.879 1.00 0.00 H new ATOM 266 N LEU A 18 -6.490 -33.148 5.296 1.00 0.00 N ATOM 267 CA LEU A 18 -6.092 -33.615 6.616 1.00 0.00 C ATOM 268 C LEU A 18 -5.116 -32.626 7.236 1.00 0.00 C ATOM 269 O LEU A 18 -3.989 -32.475 6.761 1.00 0.00 O ATOM 270 CB LEU A 18 -5.449 -35.004 6.517 1.00 0.00 C ATOM 271 CG LEU A 18 -6.401 -36.131 6.092 1.00 0.00 C ATOM 272 CD1 LEU A 18 -5.620 -37.387 5.722 1.00 0.00 C ATOM 273 CD2 LEU A 18 -7.406 -36.431 7.202 1.00 0.00 C ATOM 0 H LEU A 18 -6.051 -33.651 4.525 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.976 -33.688 7.249 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.625 -34.957 5.805 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.018 -35.258 7.486 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.950 -35.800 5.211 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.314 -38.173 5.424 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.946 -37.166 4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.041 -37.722 6.582 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.072 -37.232 6.883 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.873 -36.739 8.102 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -7.991 -35.536 7.415 1.00 0.00 H new ATOM 285 N TRP A 19 -5.565 -31.931 8.270 1.00 0.00 N ATOM 286 CA TRP A 19 -4.727 -30.965 8.963 1.00 0.00 C ATOM 287 C TRP A 19 -4.050 -31.640 10.149 1.00 0.00 C ATOM 288 O TRP A 19 -4.659 -32.475 10.825 1.00 0.00 O ATOM 289 CB TRP A 19 -5.558 -29.762 9.432 1.00 0.00 C ATOM 290 CG TRP A 19 -4.732 -28.530 9.651 1.00 0.00 C ATOM 291 CD1 TRP A 19 -4.139 -28.124 10.813 1.00 0.00 C ATOM 292 CD2 TRP A 19 -4.397 -27.550 8.663 1.00 0.00 C ATOM 293 NE1 TRP A 19 -3.460 -26.949 10.606 1.00 0.00 N ATOM 294 CE2 TRP A 19 -3.602 -26.579 9.292 1.00 0.00 C ATOM 295 CE3 TRP A 19 -4.692 -27.403 7.305 1.00 0.00 C ATOM 296 CZ2 TRP A 19 -3.100 -25.476 8.610 1.00 0.00 C ATOM 297 CZ3 TRP A 19 -4.193 -26.308 6.632 1.00 0.00 C ATOM 298 CH2 TRP A 19 -3.403 -25.357 7.283 1.00 0.00 C ATOM 0 H TRP A 19 -6.508 -32.019 8.648 1.00 0.00 H new ATOM 0 HA TRP A 19 -3.965 -30.598 8.275 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -6.329 -29.549 8.692 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -6.069 -30.020 10.360 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -4.196 -28.650 11.755 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -2.935 -26.435 11.314 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -5.300 -28.134 6.792 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -2.491 -24.739 9.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -4.417 -26.183 5.583 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -3.025 -24.512 6.727 1.00 0.00 H new ATOM 309 N ASP A 20 -2.793 -31.287 10.391 1.00 0.00 N ATOM 310 CA ASP A 20 -2.009 -31.914 11.448 1.00 0.00 C ATOM 311 C ASP A 20 -1.886 -30.981 12.648 1.00 0.00 C ATOM 312 O ASP A 20 -1.591 -29.792 12.500 1.00 0.00 O ATOM 313 CB ASP A 20 -0.618 -32.298 10.927 1.00 0.00 C ATOM 314 CG ASP A 20 0.147 -33.177 11.904 1.00 0.00 C ATOM 315 OD1 ASP A 20 -0.219 -34.362 12.047 1.00 0.00 O ATOM 316 OD2 ASP A 20 1.119 -32.693 12.527 1.00 0.00 O ATOM 0 H ASP A 20 -2.294 -30.568 9.868 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.524 -32.821 11.766 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.721 -32.821 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.044 -31.392 10.732 1.00 0.00 H new ATOM 321 N TYR A 21 -2.131 -31.529 13.831 1.00 0.00 N ATOM 322 CA TYR A 21 -2.070 -30.780 15.079 1.00 0.00 C ATOM 323 C TYR A 21 -1.100 -31.463 16.037 1.00 0.00 C ATOM 324 O TYR A 21 -1.026 -32.696 16.082 1.00 0.00 O ATOM 325 CB TYR A 21 -3.459 -30.703 15.735 1.00 0.00 C ATOM 326 CG TYR A 21 -4.528 -30.065 14.867 1.00 0.00 C ATOM 327 CD1 TYR A 21 -5.297 -30.833 13.997 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.775 -28.697 14.924 1.00 0.00 C ATOM 329 CE1 TYR A 21 -6.274 -30.256 13.210 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.752 -28.115 14.140 1.00 0.00 C ATOM 331 CZ TYR A 21 -6.498 -28.899 13.286 1.00 0.00 C ATOM 332 OH TYR A 21 -7.469 -28.321 12.503 1.00 0.00 O ATOM 0 H TYR A 21 -2.379 -32.511 13.952 1.00 0.00 H new ATOM 0 HA TYR A 21 -1.728 -29.769 14.859 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.778 -31.711 16.001 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.378 -30.139 16.664 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -5.127 -31.898 13.937 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.193 -28.080 15.592 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -6.860 -30.866 12.538 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.931 -27.051 14.196 1.00 0.00 H new ATOM 0 HH TYR A 21 -7.060 -27.958 11.690 1.00 0.00 H new ATOM 342 N ARG A 22 -0.357 -30.674 16.798 1.00 0.00 N ATOM 343 CA ARG A 22 0.555 -31.219 17.794 1.00 0.00 C ATOM 344 C ARG A 22 0.030 -30.900 19.191 1.00 0.00 C ATOM 345 O ARG A 22 0.001 -29.740 19.606 1.00 0.00 O ATOM 346 CB ARG A 22 1.972 -30.658 17.607 1.00 0.00 C ATOM 347 CG ARG A 22 3.046 -31.489 18.298 1.00 0.00 C ATOM 348 CD ARG A 22 3.159 -32.879 17.674 1.00 0.00 C ATOM 349 NE ARG A 22 3.686 -32.824 16.304 1.00 0.00 N ATOM 350 CZ ARG A 22 2.960 -33.004 15.192 1.00 0.00 C ATOM 351 NH1 ARG A 22 1.652 -33.214 15.258 1.00 0.00 N ATOM 352 NH2 ARG A 22 3.545 -32.962 14.004 1.00 0.00 N ATOM 0 H ARG A 22 -0.367 -29.655 16.746 1.00 0.00 H new ATOM 0 HA ARG A 22 0.609 -32.300 17.669 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.195 -30.602 16.542 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.006 -29.639 17.994 1.00 0.00 H new ATOM 0 HG2 ARG A 22 4.006 -30.977 18.228 1.00 0.00 H new ATOM 0 HG3 ARG A 22 2.811 -31.582 19.358 1.00 0.00 H new ATOM 0 HD2 ARG A 22 3.810 -33.501 18.289 1.00 0.00 H new ATOM 0 HD3 ARG A 22 2.178 -33.354 17.667 1.00 0.00 H new ATOM 0 HE ARG A 22 4.682 -32.634 16.190 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.185 -33.240 16.164 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.113 -33.349 14.402 1.00 0.00 H new ATOM 0 HH21 ARG A 22 4.548 -32.793 13.935 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.992 -33.099 13.158 1.00 0.00 H new ATOM 366 N VAL A 23 -0.403 -31.934 19.900 1.00 0.00 N ATOM 367 CA VAL A 23 -1.008 -31.778 21.217 1.00 0.00 C ATOM 368 C VAL A 23 -0.028 -32.205 22.308 1.00 0.00 C ATOM 369 O VAL A 23 0.233 -33.394 22.482 1.00 0.00 O ATOM 370 CB VAL A 23 -2.304 -32.622 21.329 1.00 0.00 C ATOM 371 CG1 VAL A 23 -3.003 -32.379 22.663 1.00 0.00 C ATOM 372 CG2 VAL A 23 -3.242 -32.330 20.158 1.00 0.00 C ATOM 0 H VAL A 23 -0.345 -32.901 19.580 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.258 -30.725 21.349 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.026 -33.675 21.286 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.909 -32.983 22.715 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.335 -32.655 23.479 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.265 -31.325 22.750 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -4.145 -32.933 20.256 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.509 -31.273 20.160 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.742 -32.576 19.221 1.00 0.00 H new ATOM 382 N ILE A 24 0.533 -31.235 23.023 1.00 0.00 N ATOM 383 CA ILE A 24 1.467 -31.527 24.106 1.00 0.00 C ATOM 384 C ILE A 24 0.739 -31.516 25.449 1.00 0.00 C ATOM 385 O ILE A 24 0.333 -30.458 25.945 1.00 0.00 O ATOM 386 CB ILE A 24 2.647 -30.524 24.131 1.00 0.00 C ATOM 387 CG1 ILE A 24 3.408 -30.575 22.794 1.00 0.00 C ATOM 388 CG2 ILE A 24 3.587 -30.822 25.301 1.00 0.00 C ATOM 389 CD1 ILE A 24 4.599 -29.641 22.724 1.00 0.00 C ATOM 0 H ILE A 24 0.358 -30.241 22.873 1.00 0.00 H new ATOM 0 HA ILE A 24 1.879 -32.520 23.928 1.00 0.00 H new ATOM 0 HB ILE A 24 2.249 -29.519 24.269 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.750 -31.596 22.621 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.719 -30.329 21.986 1.00 0.00 H new ATOM 0 HG21 ILE A 24 4.408 -30.106 25.299 1.00 0.00 H new ATOM 0 HG22 ILE A 24 3.037 -30.742 26.239 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.986 -31.831 25.199 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.080 -29.737 21.751 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.264 -28.613 22.863 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.311 -29.900 23.508 1.00 0.00 H new ATOM 401 N MET A 25 0.565 -32.705 26.016 1.00 0.00 N ATOM 402 CA MET A 25 -0.152 -32.887 27.277 1.00 0.00 C ATOM 403 C MET A 25 0.795 -33.436 28.337 1.00 0.00 C ATOM 404 O MET A 25 1.696 -34.211 28.023 1.00 0.00 O ATOM 405 CB MET A 25 -1.331 -33.854 27.068 1.00 0.00 C ATOM 406 CG MET A 25 -2.342 -33.369 26.034 1.00 0.00 C ATOM 407 SD MET A 25 -3.477 -34.661 25.481 1.00 0.00 S ATOM 408 CE MET A 25 -4.327 -35.077 27.001 1.00 0.00 C ATOM 0 H MET A 25 0.918 -33.574 25.614 1.00 0.00 H new ATOM 0 HA MET A 25 -0.537 -31.925 27.614 1.00 0.00 H new ATOM 0 HB2 MET A 25 -0.944 -34.824 26.758 1.00 0.00 H new ATOM 0 HB3 MET A 25 -1.841 -34.004 28.020 1.00 0.00 H new ATOM 0 HG2 MET A 25 -2.918 -32.546 26.458 1.00 0.00 H new ATOM 0 HG3 MET A 25 -1.807 -32.972 25.171 1.00 0.00 H new ATOM 0 HE1 MET A 25 -4.035 -36.078 27.319 1.00 0.00 H new ATOM 0 HE2 MET A 25 -4.061 -34.358 27.775 1.00 0.00 H new ATOM 0 HE3 MET A 25 -5.404 -35.049 26.835 1.00 0.00 H new ATOM 418 N THR A 26 0.604 -33.029 29.588 1.00 0.00 N ATOM 419 CA THR A 26 1.424 -33.538 30.682 1.00 0.00 C ATOM 420 C THR A 26 0.899 -34.890 31.169 1.00 0.00 C ATOM 421 O THR A 26 1.522 -35.552 32.006 1.00 0.00 O ATOM 422 CB THR A 26 1.497 -32.529 31.857 1.00 0.00 C ATOM 423 OG1 THR A 26 0.187 -32.034 32.171 1.00 0.00 O ATOM 424 CG2 THR A 26 2.417 -31.358 31.523 1.00 0.00 C ATOM 0 H THR A 26 -0.106 -32.353 29.868 1.00 0.00 H new ATOM 0 HA THR A 26 2.435 -33.675 30.298 1.00 0.00 H new ATOM 0 HB THR A 26 1.904 -33.055 32.721 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.247 -31.399 32.915 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.448 -30.668 32.366 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.422 -31.730 31.322 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.040 -30.839 30.642 1.00 0.00 H new ATOM 432 N THR A 27 -0.244 -35.298 30.624 1.00 0.00 N ATOM 433 CA THR A 27 -0.831 -36.595 30.924 1.00 0.00 C ATOM 434 C THR A 27 -0.788 -37.462 29.674 1.00 0.00 C ATOM 435 O THR A 27 -0.734 -36.944 28.556 1.00 0.00 O ATOM 436 CB THR A 27 -2.301 -36.469 31.409 1.00 0.00 C ATOM 437 OG1 THR A 27 -2.751 -37.720 31.943 1.00 0.00 O ATOM 438 CG2 THR A 27 -3.231 -36.048 30.273 1.00 0.00 C ATOM 0 H THR A 27 -0.786 -34.739 29.965 1.00 0.00 H new ATOM 0 HA THR A 27 -0.252 -37.048 31.729 1.00 0.00 H new ATOM 0 HB THR A 27 -2.328 -35.701 32.182 1.00 0.00 H new ATOM 0 HG1 THR A 27 -3.678 -37.631 32.248 1.00 0.00 H new ATOM 0 HG21 THR A 27 -4.251 -35.970 30.648 1.00 0.00 H new ATOM 0 HG22 THR A 27 -2.913 -35.082 29.882 1.00 0.00 H new ATOM 0 HG23 THR A 27 -3.193 -36.792 29.477 1.00 0.00 H new ATOM 446 N LYS A 28 -0.803 -38.773 29.862 1.00 0.00 N ATOM 447 CA LYS A 28 -0.833 -39.706 28.742 1.00 0.00 C ATOM 448 C LYS A 28 -2.274 -40.158 28.499 1.00 0.00 C ATOM 449 O LYS A 28 -2.549 -40.972 27.613 1.00 0.00 O ATOM 450 CB LYS A 28 0.070 -40.917 29.026 1.00 0.00 C ATOM 451 CG LYS A 28 0.315 -41.797 27.801 1.00 0.00 C ATOM 452 CD LYS A 28 0.969 -43.127 28.168 1.00 0.00 C ATOM 453 CE LYS A 28 0.104 -43.936 29.132 1.00 0.00 C ATOM 454 NZ LYS A 28 -1.285 -44.103 28.626 1.00 0.00 N ATOM 0 H LYS A 28 -0.795 -39.217 30.780 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.457 -39.207 27.849 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.028 -40.564 29.407 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.383 -41.521 29.812 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.633 -41.987 27.297 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.951 -41.264 27.094 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.145 -43.708 27.263 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.942 -42.941 28.622 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.554 -44.917 29.287 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.080 -43.439 30.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.779 -44.818 29.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.790 -43.197 28.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.258 -44.411 27.633 1.00 0.00 H new ATOM 468 N ASP A 29 -3.194 -39.620 29.299 1.00 0.00 N ATOM 469 CA ASP A 29 -4.607 -39.955 29.186 1.00 0.00 C ATOM 470 C ASP A 29 -5.225 -39.201 28.022 1.00 0.00 C ATOM 471 O ASP A 29 -5.774 -38.106 28.188 1.00 0.00 O ATOM 472 CB ASP A 29 -5.363 -39.635 30.486 1.00 0.00 C ATOM 473 CG ASP A 29 -6.872 -39.823 30.348 1.00 0.00 C ATOM 474 OD1 ASP A 29 -7.322 -40.976 30.176 1.00 0.00 O ATOM 475 OD2 ASP A 29 -7.619 -38.819 30.419 1.00 0.00 O ATOM 0 H ASP A 29 -2.981 -38.947 30.035 1.00 0.00 H new ATOM 0 HA ASP A 29 -4.689 -41.027 29.007 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -4.992 -40.277 31.285 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.154 -38.606 30.780 1.00 0.00 H new ATOM 480 N THR A 30 -5.081 -39.756 26.832 1.00 0.00 N ATOM 481 CA THR A 30 -5.708 -39.182 25.664 1.00 0.00 C ATOM 482 C THR A 30 -7.108 -39.779 25.495 1.00 0.00 C ATOM 483 O THR A 30 -7.280 -40.897 25.010 1.00 0.00 O ATOM 484 CB THR A 30 -4.846 -39.385 24.389 1.00 0.00 C ATOM 485 OG1 THR A 30 -5.531 -38.870 23.239 1.00 0.00 O ATOM 486 CG2 THR A 30 -4.489 -40.855 24.164 1.00 0.00 C ATOM 0 H THR A 30 -4.537 -40.600 26.653 1.00 0.00 H new ATOM 0 HA THR A 30 -5.796 -38.105 25.808 1.00 0.00 H new ATOM 0 HB THR A 30 -3.916 -38.837 24.538 1.00 0.00 H new ATOM 0 HG1 THR A 30 -5.672 -39.592 22.592 1.00 0.00 H new ATOM 0 HG21 THR A 30 -3.886 -40.949 23.261 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.924 -41.227 25.018 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.403 -41.438 24.052 1.00 0.00 H new ATOM 494 N SER A 31 -8.106 -39.025 25.935 1.00 0.00 N ATOM 495 CA SER A 31 -9.494 -39.463 25.889 1.00 0.00 C ATOM 496 C SER A 31 -10.375 -38.309 25.431 1.00 0.00 C ATOM 497 O SER A 31 -10.983 -38.359 24.360 1.00 0.00 O ATOM 498 CB SER A 31 -9.919 -39.959 27.279 1.00 0.00 C ATOM 499 OG SER A 31 -9.619 -38.989 28.276 1.00 0.00 O ATOM 0 H SER A 31 -7.977 -38.095 26.333 1.00 0.00 H new ATOM 0 HA SER A 31 -9.603 -40.284 25.180 1.00 0.00 H new ATOM 0 HB2 SER A 31 -10.988 -40.172 27.283 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.407 -40.893 27.509 1.00 0.00 H new ATOM 0 HG SER A 31 -8.907 -39.328 28.858 1.00 0.00 H new ATOM 505 N THR A 32 -10.403 -37.256 26.244 1.00 0.00 N ATOM 506 CA THR A 32 -11.131 -36.032 25.929 1.00 0.00 C ATOM 507 C THR A 32 -10.729 -35.509 24.543 1.00 0.00 C ATOM 508 O THR A 32 -11.533 -34.913 23.823 1.00 0.00 O ATOM 509 CB THR A 32 -10.840 -34.948 26.995 1.00 0.00 C ATOM 510 OG1 THR A 32 -10.631 -35.572 28.275 1.00 0.00 O ATOM 511 CG2 THR A 32 -11.992 -33.950 27.097 1.00 0.00 C ATOM 0 H THR A 32 -9.920 -37.229 27.142 1.00 0.00 H new ATOM 0 HA THR A 32 -12.197 -36.259 25.927 1.00 0.00 H new ATOM 0 HB THR A 32 -9.943 -34.407 26.694 1.00 0.00 H new ATOM 0 HG1 THR A 32 -10.763 -34.911 28.987 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.759 -33.201 27.854 1.00 0.00 H new ATOM 0 HG22 THR A 32 -12.136 -33.460 26.134 1.00 0.00 H new ATOM 0 HG23 THR A 32 -12.905 -34.476 27.376 1.00 0.00 H new ATOM 519 N LEU A 33 -9.470 -35.763 24.184 1.00 0.00 N ATOM 520 CA LEU A 33 -8.922 -35.364 22.892 1.00 0.00 C ATOM 521 C LEU A 33 -9.657 -36.070 21.752 1.00 0.00 C ATOM 522 O LEU A 33 -9.949 -35.468 20.721 1.00 0.00 O ATOM 523 CB LEU A 33 -7.421 -35.690 22.851 1.00 0.00 C ATOM 524 CG LEU A 33 -6.675 -35.279 21.570 1.00 0.00 C ATOM 525 CD1 LEU A 33 -6.792 -33.775 21.325 1.00 0.00 C ATOM 526 CD2 LEU A 33 -5.209 -35.702 21.653 1.00 0.00 C ATOM 0 H LEU A 33 -8.804 -36.251 24.782 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.059 -34.290 22.764 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -6.941 -35.203 23.699 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.299 -36.764 22.990 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.137 -35.790 20.726 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.256 -33.512 20.413 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.843 -33.504 21.219 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.361 -33.234 22.168 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.692 -35.405 20.740 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.739 -35.219 22.509 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.149 -36.784 21.769 1.00 0.00 H new ATOM 538 N LYS A 34 -9.964 -37.350 21.955 1.00 0.00 N ATOM 539 CA LYS A 34 -10.685 -38.135 20.955 1.00 0.00 C ATOM 540 C LYS A 34 -12.124 -37.641 20.846 1.00 0.00 C ATOM 541 O LYS A 34 -12.664 -37.499 19.747 1.00 0.00 O ATOM 542 CB LYS A 34 -10.685 -39.625 21.332 1.00 0.00 C ATOM 543 CG LYS A 34 -9.298 -40.225 21.539 1.00 0.00 C ATOM 544 CD LYS A 34 -9.389 -41.693 21.957 1.00 0.00 C ATOM 545 CE LYS A 34 -8.025 -42.295 22.274 1.00 0.00 C ATOM 546 NZ LYS A 34 -7.175 -42.434 21.063 1.00 0.00 N ATOM 0 H LYS A 34 -9.725 -37.865 22.802 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.182 -38.014 19.996 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.264 -39.755 22.247 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.196 -40.185 20.549 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.721 -40.141 20.618 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.764 -39.659 22.302 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.033 -41.779 22.832 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -9.859 -42.267 21.158 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.514 -41.667 23.004 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.160 -43.274 22.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.085 -43.440 20.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.612 -41.921 20.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.232 -42.038 21.253 1.00 0.00 H new ATOM 560 N GLU A 35 -12.720 -37.365 22.005 1.00 0.00 N ATOM 561 CA GLU A 35 -14.120 -36.957 22.097 1.00 0.00 C ATOM 562 C GLU A 35 -14.427 -35.800 21.145 1.00 0.00 C ATOM 563 O GLU A 35 -15.367 -35.874 20.348 1.00 0.00 O ATOM 564 CB GLU A 35 -14.453 -36.535 23.538 1.00 0.00 C ATOM 565 CG GLU A 35 -14.156 -37.600 24.591 1.00 0.00 C ATOM 566 CD GLU A 35 -15.055 -38.819 24.482 1.00 0.00 C ATOM 567 OE1 GLU A 35 -16.178 -38.781 25.025 1.00 0.00 O ATOM 568 OE2 GLU A 35 -14.644 -39.824 23.868 1.00 0.00 O ATOM 0 H GLU A 35 -12.246 -37.418 22.906 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.734 -37.811 21.811 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.888 -35.635 23.780 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.510 -36.273 23.592 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.116 -37.914 24.497 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.268 -37.162 25.583 1.00 0.00 H new ATOM 575 N LEU A 36 -13.618 -34.744 21.217 1.00 0.00 N ATOM 576 CA LEU A 36 -13.854 -33.540 20.422 1.00 0.00 C ATOM 577 C LEU A 36 -13.739 -33.849 18.929 1.00 0.00 C ATOM 578 O LEU A 36 -14.443 -33.265 18.112 1.00 0.00 O ATOM 579 CB LEU A 36 -12.880 -32.415 20.837 1.00 0.00 C ATOM 580 CG LEU A 36 -11.403 -32.594 20.421 1.00 0.00 C ATOM 581 CD1 LEU A 36 -11.133 -31.970 19.051 1.00 0.00 C ATOM 582 CD2 LEU A 36 -10.463 -32.009 21.472 1.00 0.00 C ATOM 0 H LEU A 36 -12.794 -34.698 21.817 1.00 0.00 H new ATOM 0 HA LEU A 36 -14.869 -33.192 20.614 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -13.242 -31.477 20.415 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.919 -32.313 21.921 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.210 -33.664 20.348 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -10.085 -32.112 18.786 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -11.765 -32.448 18.302 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.357 -30.904 19.086 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.430 -32.149 21.154 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.666 -30.945 21.589 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.621 -32.516 22.424 1.00 0.00 H new ATOM 594 N LEU A 37 -12.866 -34.787 18.585 1.00 0.00 N ATOM 595 CA LEU A 37 -12.658 -35.171 17.192 1.00 0.00 C ATOM 596 C LEU A 37 -13.882 -35.914 16.658 1.00 0.00 C ATOM 597 O LEU A 37 -14.326 -35.684 15.531 1.00 0.00 O ATOM 598 CB LEU A 37 -11.407 -36.052 17.071 1.00 0.00 C ATOM 599 CG LEU A 37 -10.100 -35.401 17.553 1.00 0.00 C ATOM 600 CD1 LEU A 37 -8.960 -36.416 17.575 1.00 0.00 C ATOM 601 CD2 LEU A 37 -9.741 -34.204 16.674 1.00 0.00 C ATOM 0 H LEU A 37 -12.288 -35.298 19.253 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.513 -34.269 16.597 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.570 -36.967 17.640 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.286 -36.343 16.027 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.254 -35.046 18.572 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.047 -35.930 17.919 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.213 -37.233 18.250 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.804 -36.810 16.571 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.813 -33.756 17.030 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.612 -34.535 15.644 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.541 -33.466 16.720 1.00 0.00 H new ATOM 613 N GLU A 38 -14.438 -36.782 17.496 1.00 0.00 N ATOM 614 CA GLU A 38 -15.560 -37.632 17.109 1.00 0.00 C ATOM 615 C GLU A 38 -16.847 -36.829 16.906 1.00 0.00 C ATOM 616 O GLU A 38 -17.785 -37.309 16.262 1.00 0.00 O ATOM 617 CB GLU A 38 -15.775 -38.734 18.152 1.00 0.00 C ATOM 618 CG GLU A 38 -14.579 -39.667 18.301 1.00 0.00 C ATOM 619 CD GLU A 38 -14.881 -40.876 19.167 1.00 0.00 C ATOM 620 OE1 GLU A 38 -15.635 -41.760 18.712 1.00 0.00 O ATOM 621 OE2 GLU A 38 -14.360 -40.955 20.298 1.00 0.00 O ATOM 0 H GLU A 38 -14.126 -36.917 18.458 1.00 0.00 H new ATOM 0 HA GLU A 38 -15.310 -38.089 16.152 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -15.990 -38.274 19.117 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.651 -39.320 17.875 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -14.261 -40.003 17.314 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.745 -39.115 18.734 1.00 0.00 H new ATOM 628 N THR A 39 -16.905 -35.617 17.461 1.00 0.00 N ATOM 629 CA THR A 39 -18.090 -34.768 17.310 1.00 0.00 C ATOM 630 C THR A 39 -18.321 -34.410 15.838 1.00 0.00 C ATOM 631 O THR A 39 -19.450 -34.150 15.419 1.00 0.00 O ATOM 632 CB THR A 39 -17.990 -33.469 18.151 1.00 0.00 C ATOM 633 OG1 THR A 39 -16.909 -32.645 17.690 1.00 0.00 O ATOM 634 CG2 THR A 39 -17.786 -33.790 19.627 1.00 0.00 C ATOM 0 H THR A 39 -16.154 -35.204 18.014 1.00 0.00 H new ATOM 0 HA THR A 39 -18.937 -35.345 17.680 1.00 0.00 H new ATOM 0 HB THR A 39 -18.929 -32.928 18.031 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.055 -33.058 17.936 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.719 -32.862 20.195 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.628 -34.379 19.991 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.865 -34.359 19.752 1.00 0.00 H new ATOM 642 N TYR A 40 -17.243 -34.426 15.053 1.00 0.00 N ATOM 643 CA TYR A 40 -17.315 -34.106 13.626 1.00 0.00 C ATOM 644 C TYR A 40 -17.781 -35.325 12.821 1.00 0.00 C ATOM 645 O TYR A 40 -17.968 -35.239 11.604 1.00 0.00 O ATOM 646 CB TYR A 40 -15.946 -33.625 13.117 1.00 0.00 C ATOM 647 CG TYR A 40 -15.420 -32.391 13.833 1.00 0.00 C ATOM 648 CD1 TYR A 40 -14.878 -32.487 15.107 1.00 0.00 C ATOM 649 CD2 TYR A 40 -15.472 -31.132 13.241 1.00 0.00 C ATOM 650 CE1 TYR A 40 -14.404 -31.372 15.774 1.00 0.00 C ATOM 651 CE2 TYR A 40 -15.002 -30.011 13.901 1.00 0.00 C ATOM 652 CZ TYR A 40 -14.468 -30.136 15.168 1.00 0.00 C ATOM 653 OH TYR A 40 -14.010 -29.016 15.830 1.00 0.00 O ATOM 0 H TYR A 40 -16.306 -34.658 15.383 1.00 0.00 H new ATOM 0 HA TYR A 40 -18.042 -33.305 13.490 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.223 -34.433 13.229 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -16.021 -33.410 12.051 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.825 -33.453 15.588 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -15.887 -31.029 12.249 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.986 -31.470 16.765 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -15.053 -29.042 13.427 1.00 0.00 H new ATOM 0 HH TYR A 40 -14.458 -28.220 15.475 1.00 0.00 H new ATOM 663 N GLN A 41 -17.949 -36.460 13.516 1.00 0.00 N ATOM 664 CA GLN A 41 -18.441 -37.703 12.906 1.00 0.00 C ATOM 665 C GLN A 41 -17.534 -38.155 11.758 1.00 0.00 C ATOM 666 O GLN A 41 -17.985 -38.813 10.817 1.00 0.00 O ATOM 667 CB GLN A 41 -19.887 -37.517 12.407 1.00 0.00 C ATOM 668 CG GLN A 41 -20.898 -37.232 13.516 1.00 0.00 C ATOM 669 CD GLN A 41 -21.083 -38.402 14.470 1.00 0.00 C ATOM 670 OE1 GLN A 41 -21.934 -39.266 14.254 1.00 0.00 O ATOM 671 NE2 GLN A 41 -20.296 -38.435 15.533 1.00 0.00 N ATOM 0 H GLN A 41 -17.748 -36.541 14.513 1.00 0.00 H new ATOM 0 HA GLN A 41 -18.428 -38.481 13.669 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -19.910 -36.696 11.690 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -20.194 -38.416 11.873 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -20.572 -36.359 14.081 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -21.859 -36.981 13.067 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -19.603 -37.701 15.677 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -20.382 -39.195 16.208 1.00 0.00 H new ATOM 680 N ARG A 42 -16.250 -37.827 11.855 1.00 0.00 N ATOM 681 CA ARG A 42 -15.289 -38.146 10.802 1.00 0.00 C ATOM 682 C ARG A 42 -14.080 -38.884 11.383 1.00 0.00 C ATOM 683 O ARG A 42 -13.790 -38.759 12.577 1.00 0.00 O ATOM 684 CB ARG A 42 -14.839 -36.860 10.092 1.00 0.00 C ATOM 685 CG ARG A 42 -14.066 -35.895 10.986 1.00 0.00 C ATOM 686 CD ARG A 42 -13.685 -34.617 10.244 1.00 0.00 C ATOM 687 NE ARG A 42 -14.863 -33.851 9.816 1.00 0.00 N ATOM 688 CZ ARG A 42 -15.306 -33.786 8.553 1.00 0.00 C ATOM 689 NH1 ARG A 42 -14.736 -34.509 7.595 1.00 0.00 N ATOM 690 NH2 ARG A 42 -16.345 -33.023 8.250 1.00 0.00 N ATOM 0 H ARG A 42 -15.848 -37.338 12.655 1.00 0.00 H new ATOM 0 HA ARG A 42 -15.773 -38.799 10.075 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -14.215 -37.127 9.239 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -15.717 -36.349 9.697 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.671 -35.643 11.857 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.164 -36.384 11.355 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.065 -33.995 10.890 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.083 -34.871 9.372 1.00 0.00 H new ATOM 0 HE ARG A 42 -15.379 -33.334 10.528 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.952 -35.122 7.817 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -15.083 -34.451 6.637 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -16.811 -32.482 8.979 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.680 -32.976 7.288 1.00 0.00 H new ATOM 704 N PRO A 43 -13.367 -39.670 10.550 1.00 0.00 N ATOM 705 CA PRO A 43 -12.169 -40.396 10.985 1.00 0.00 C ATOM 706 C PRO A 43 -11.001 -39.453 11.277 1.00 0.00 C ATOM 707 O PRO A 43 -10.942 -38.336 10.755 1.00 0.00 O ATOM 708 CB PRO A 43 -11.850 -41.313 9.794 1.00 0.00 C ATOM 709 CG PRO A 43 -12.436 -40.613 8.615 1.00 0.00 C ATOM 710 CD PRO A 43 -13.671 -39.915 9.122 1.00 0.00 C ATOM 0 HA PRO A 43 -12.332 -40.940 11.915 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.775 -41.453 9.678 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -12.288 -42.302 9.926 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -11.729 -39.899 8.193 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.684 -41.321 7.824 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -13.855 -38.984 8.585 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -14.560 -40.534 9.001 1.00 0.00 H new ATOM 718 N PHE A 44 -10.073 -39.913 12.108 1.00 0.00 N ATOM 719 CA PHE A 44 -8.914 -39.117 12.495 1.00 0.00 C ATOM 720 C PHE A 44 -7.736 -40.029 12.825 1.00 0.00 C ATOM 721 O PHE A 44 -7.925 -41.182 13.218 1.00 0.00 O ATOM 722 CB PHE A 44 -9.251 -38.225 13.702 1.00 0.00 C ATOM 723 CG PHE A 44 -9.688 -38.991 14.929 1.00 0.00 C ATOM 724 CD1 PHE A 44 -8.757 -39.422 15.866 1.00 0.00 C ATOM 725 CD2 PHE A 44 -11.029 -39.278 15.146 1.00 0.00 C ATOM 726 CE1 PHE A 44 -9.153 -40.120 16.989 1.00 0.00 C ATOM 727 CE2 PHE A 44 -11.430 -39.976 16.270 1.00 0.00 C ATOM 728 CZ PHE A 44 -10.492 -40.397 17.192 1.00 0.00 C ATOM 0 H PHE A 44 -10.102 -40.841 12.530 1.00 0.00 H new ATOM 0 HA PHE A 44 -8.639 -38.476 11.658 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.376 -37.625 13.953 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.042 -37.531 13.418 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -7.709 -39.208 15.714 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.767 -38.952 14.428 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -8.418 -40.449 17.708 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -12.476 -40.192 16.427 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.804 -40.942 18.071 1.00 0.00 H new ATOM 738 N LYS A 45 -6.529 -39.510 12.662 1.00 0.00 N ATOM 739 CA LYS A 45 -5.314 -40.249 12.989 1.00 0.00 C ATOM 740 C LYS A 45 -4.694 -39.679 14.258 1.00 0.00 C ATOM 741 O LYS A 45 -4.139 -38.578 14.242 1.00 0.00 O ATOM 742 CB LYS A 45 -4.302 -40.168 11.834 1.00 0.00 C ATOM 743 CG LYS A 45 -3.036 -40.996 12.063 1.00 0.00 C ATOM 744 CD LYS A 45 -1.978 -40.749 10.986 1.00 0.00 C ATOM 745 CE LYS A 45 -1.460 -39.314 11.016 1.00 0.00 C ATOM 746 NZ LYS A 45 -0.409 -39.072 9.990 1.00 0.00 N ATOM 0 H LYS A 45 -6.362 -38.571 12.302 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.575 -41.295 13.148 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.784 -40.505 10.916 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.021 -39.126 11.682 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.619 -40.755 13.041 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -3.295 -42.055 12.079 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -1.146 -41.438 11.130 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -2.402 -40.961 10.005 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -2.290 -38.627 10.852 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -1.057 -39.096 12.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -0.088 -38.085 10.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.396 -39.709 10.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.800 -39.254 9.043 1.00 0.00 H new ATOM 760 N LEU A 46 -4.807 -40.416 15.358 1.00 0.00 N ATOM 761 CA LEU A 46 -4.219 -39.997 16.625 1.00 0.00 C ATOM 762 C LEU A 46 -3.027 -40.900 16.936 1.00 0.00 C ATOM 763 O LEU A 46 -3.191 -42.069 17.293 1.00 0.00 O ATOM 764 CB LEU A 46 -5.269 -40.047 17.757 1.00 0.00 C ATOM 765 CG LEU A 46 -5.036 -39.072 18.934 1.00 0.00 C ATOM 766 CD1 LEU A 46 -6.199 -39.134 19.921 1.00 0.00 C ATOM 767 CD2 LEU A 46 -3.714 -39.356 19.649 1.00 0.00 C ATOM 0 H LEU A 46 -5.301 -41.308 15.397 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.876 -38.965 16.548 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.249 -39.840 17.327 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.302 -41.062 18.152 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.979 -38.065 18.520 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.017 -38.441 20.742 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.123 -38.859 19.412 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.289 -40.147 20.314 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -3.586 -38.651 20.470 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.724 -40.373 20.042 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.889 -39.248 18.945 1.00 0.00 H new ATOM 779 N GLU A 47 -1.831 -40.347 16.783 1.00 0.00 N ATOM 780 CA GLU A 47 -0.590 -41.091 16.985 1.00 0.00 C ATOM 781 C GLU A 47 0.231 -40.451 18.102 1.00 0.00 C ATOM 782 O GLU A 47 0.092 -39.260 18.379 1.00 0.00 O ATOM 783 CB GLU A 47 0.227 -41.118 15.683 1.00 0.00 C ATOM 784 CG GLU A 47 -0.461 -41.834 14.521 1.00 0.00 C ATOM 785 CD GLU A 47 -0.672 -43.320 14.777 1.00 0.00 C ATOM 786 OE1 GLU A 47 0.331 -44.043 14.962 1.00 0.00 O ATOM 787 OE2 GLU A 47 -1.835 -43.776 14.795 1.00 0.00 O ATOM 0 H GLU A 47 -1.691 -39.372 16.516 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.837 -42.114 17.270 1.00 0.00 H new ATOM 0 HB2 GLU A 47 0.445 -40.093 15.384 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.183 -41.604 15.878 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.426 -41.363 14.332 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.137 -41.708 13.619 1.00 0.00 H new ATOM 794 N PHE A 48 1.080 -41.242 18.742 1.00 0.00 N ATOM 795 CA PHE A 48 1.956 -40.740 19.796 1.00 0.00 C ATOM 796 C PHE A 48 3.335 -40.428 19.215 1.00 0.00 C ATOM 797 O PHE A 48 4.017 -41.318 18.704 1.00 0.00 O ATOM 798 CB PHE A 48 2.057 -41.771 20.931 1.00 0.00 C ATOM 799 CG PHE A 48 2.977 -41.363 22.058 1.00 0.00 C ATOM 800 CD1 PHE A 48 2.587 -40.392 22.970 1.00 0.00 C ATOM 801 CD2 PHE A 48 4.227 -41.952 22.207 1.00 0.00 C ATOM 802 CE1 PHE A 48 3.421 -40.019 24.004 1.00 0.00 C ATOM 803 CE2 PHE A 48 5.063 -41.581 23.241 1.00 0.00 C ATOM 804 CZ PHE A 48 4.659 -40.613 24.140 1.00 0.00 C ATOM 0 H PHE A 48 1.182 -42.239 18.550 1.00 0.00 H new ATOM 0 HA PHE A 48 1.539 -39.821 20.208 1.00 0.00 H new ATOM 0 HB2 PHE A 48 1.061 -41.948 21.336 1.00 0.00 H new ATOM 0 HB3 PHE A 48 2.405 -42.717 20.517 1.00 0.00 H new ATOM 0 HD1 PHE A 48 1.619 -39.923 22.869 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.548 -42.708 21.506 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.105 -39.262 24.707 1.00 0.00 H new ATOM 0 HE2 PHE A 48 6.032 -42.047 23.347 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.312 -40.321 24.949 1.00 0.00 H new ATOM 814 N LYS A 49 3.731 -39.159 19.277 1.00 0.00 N ATOM 815 CA LYS A 49 5.010 -38.716 18.715 1.00 0.00 C ATOM 816 C LYS A 49 6.176 -39.106 19.623 1.00 0.00 C ATOM 817 O LYS A 49 6.853 -40.107 19.384 1.00 0.00 O ATOM 818 CB LYS A 49 5.004 -37.192 18.489 1.00 0.00 C ATOM 819 CG LYS A 49 4.192 -36.736 17.279 1.00 0.00 C ATOM 820 CD LYS A 49 4.848 -37.158 15.964 1.00 0.00 C ATOM 821 CE LYS A 49 4.089 -36.623 14.755 1.00 0.00 C ATOM 822 NZ LYS A 49 4.732 -37.005 13.470 1.00 0.00 N ATOM 0 H LYS A 49 3.185 -38.415 19.712 1.00 0.00 H new ATOM 0 HA LYS A 49 5.141 -39.215 17.755 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.608 -36.706 19.381 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.032 -36.851 18.370 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.188 -37.156 17.336 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.085 -35.651 17.300 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.876 -36.795 15.938 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.893 -38.246 15.913 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.067 -37.002 14.774 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.028 -35.537 14.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.180 -36.619 12.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.698 -36.622 13.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.768 -38.042 13.394 1.00 0.00 H new ATOM 836 N ASN A 50 6.389 -38.320 20.674 1.00 0.00 N ATOM 837 CA ASN A 50 7.537 -38.497 21.563 1.00 0.00 C ATOM 838 C ASN A 50 7.162 -38.114 22.989 1.00 0.00 C ATOM 839 O ASN A 50 6.037 -37.685 23.252 1.00 0.00 O ATOM 840 CB ASN A 50 8.726 -37.631 21.104 1.00 0.00 C ATOM 841 CG ASN A 50 9.280 -38.030 19.745 1.00 0.00 C ATOM 842 OD1 ASN A 50 8.840 -37.530 18.710 1.00 0.00 O ATOM 843 ND2 ASN A 50 10.250 -38.930 19.738 1.00 0.00 N ATOM 0 H ASN A 50 5.776 -37.547 20.934 1.00 0.00 H new ATOM 0 HA ASN A 50 7.828 -39.547 21.529 1.00 0.00 H new ATOM 0 HB2 ASN A 50 8.412 -36.588 21.067 1.00 0.00 H new ATOM 0 HB3 ASN A 50 9.522 -37.699 21.846 1.00 0.00 H new ATOM 0 HD21 ASN A 50 10.659 -39.232 18.854 1.00 0.00 H new ATOM 0 HD22 ASN A 50 10.588 -39.322 20.617 1.00 0.00 H new ATOM 850 N THR A 51 8.114 -38.263 23.900 1.00 0.00 N ATOM 851 CA THR A 51 7.934 -37.864 25.288 1.00 0.00 C ATOM 852 C THR A 51 9.225 -37.251 25.824 1.00 0.00 C ATOM 853 O THR A 51 10.324 -37.651 25.427 1.00 0.00 O ATOM 854 CB THR A 51 7.505 -39.057 26.176 1.00 0.00 C ATOM 855 OG1 THR A 51 7.302 -38.623 27.526 1.00 0.00 O ATOM 856 CG2 THR A 51 8.541 -40.176 26.147 1.00 0.00 C ATOM 0 H THR A 51 9.030 -38.663 23.698 1.00 0.00 H new ATOM 0 HA THR A 51 7.136 -37.122 25.321 1.00 0.00 H new ATOM 0 HB THR A 51 6.570 -39.447 25.775 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.368 -38.774 27.781 1.00 0.00 H new ATOM 0 HG21 THR A 51 8.207 -40.997 26.781 1.00 0.00 H new ATOM 0 HG22 THR A 51 8.662 -40.533 25.124 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.495 -39.798 26.515 1.00 0.00 H new ATOM 864 N SER A 52 9.085 -36.264 26.700 1.00 0.00 N ATOM 865 CA SER A 52 10.230 -35.560 27.262 1.00 0.00 C ATOM 866 C SER A 52 11.017 -36.458 28.228 1.00 0.00 C ATOM 867 O SER A 52 10.583 -37.569 28.554 1.00 0.00 O ATOM 868 CB SER A 52 9.757 -34.283 27.963 1.00 0.00 C ATOM 869 OG SER A 52 10.847 -33.562 28.510 1.00 0.00 O ATOM 0 H SER A 52 8.182 -35.931 27.039 1.00 0.00 H new ATOM 0 HA SER A 52 10.905 -35.289 26.450 1.00 0.00 H new ATOM 0 HB2 SER A 52 9.221 -33.653 27.253 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.054 -34.540 28.755 1.00 0.00 H new ATOM 0 HG SER A 52 10.515 -32.751 28.950 1.00 0.00 H new ATOM 875 N LYS A 53 12.166 -35.953 28.689 1.00 0.00 N ATOM 876 CA LYS A 53 13.091 -36.708 29.544 1.00 0.00 C ATOM 877 C LYS A 53 12.384 -37.301 30.767 1.00 0.00 C ATOM 878 O LYS A 53 12.462 -38.504 31.020 1.00 0.00 O ATOM 879 CB LYS A 53 14.242 -35.797 30.003 1.00 0.00 C ATOM 880 CG LYS A 53 15.279 -36.496 30.884 1.00 0.00 C ATOM 881 CD LYS A 53 16.135 -37.500 30.105 1.00 0.00 C ATOM 882 CE LYS A 53 17.290 -36.830 29.356 1.00 0.00 C ATOM 883 NZ LYS A 53 16.830 -35.834 28.348 1.00 0.00 N ATOM 0 H LYS A 53 12.483 -35.006 28.480 1.00 0.00 H new ATOM 0 HA LYS A 53 13.485 -37.535 28.953 1.00 0.00 H new ATOM 0 HB2 LYS A 53 14.742 -35.391 29.124 1.00 0.00 H new ATOM 0 HB3 LYS A 53 13.826 -34.952 30.551 1.00 0.00 H new ATOM 0 HG2 LYS A 53 15.928 -35.747 31.339 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.770 -37.013 31.697 1.00 0.00 H new ATOM 0 HD2 LYS A 53 16.536 -38.243 30.795 1.00 0.00 H new ATOM 0 HD3 LYS A 53 15.505 -38.034 29.393 1.00 0.00 H new ATOM 0 HE2 LYS A 53 17.944 -36.336 30.075 1.00 0.00 H new ATOM 0 HE3 LYS A 53 17.885 -37.595 28.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 17.599 -35.641 27.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 16.008 -36.213 27.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 16.561 -34.952 28.829 1.00 0.00 H new ATOM 897 N ASN A 54 11.689 -36.449 31.515 1.00 0.00 N ATOM 898 CA ASN A 54 11.007 -36.868 32.744 1.00 0.00 C ATOM 899 C ASN A 54 9.566 -37.276 32.430 1.00 0.00 C ATOM 900 O ASN A 54 8.734 -37.414 33.327 1.00 0.00 O ATOM 901 CB ASN A 54 11.038 -35.718 33.773 1.00 0.00 C ATOM 902 CG ASN A 54 10.572 -36.134 35.163 1.00 0.00 C ATOM 903 OD1 ASN A 54 11.365 -36.609 35.978 1.00 0.00 O ATOM 904 ND2 ASN A 54 9.293 -35.944 35.455 1.00 0.00 N ATOM 0 H ASN A 54 11.581 -35.459 31.294 1.00 0.00 H new ATOM 0 HA ASN A 54 11.522 -37.730 33.169 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.054 -35.328 33.840 1.00 0.00 H new ATOM 0 HB3 ASN A 54 10.408 -34.904 33.415 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.938 -36.193 36.378 1.00 0.00 H new ATOM 0 HD22 ASN A 54 8.664 -35.548 34.756 1.00 0.00 H new ATOM 911 N ALA A 55 9.283 -37.461 31.137 1.00 0.00 N ATOM 912 CA ALA A 55 7.946 -37.832 30.665 1.00 0.00 C ATOM 913 C ALA A 55 6.913 -36.767 31.039 1.00 0.00 C ATOM 914 O ALA A 55 5.705 -37.014 30.993 1.00 0.00 O ATOM 915 CB ALA A 55 7.540 -39.202 31.213 1.00 0.00 C ATOM 0 H ALA A 55 9.971 -37.358 30.391 1.00 0.00 H new ATOM 0 HA ALA A 55 7.979 -37.895 29.577 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.544 -39.458 30.851 1.00 0.00 H new ATOM 0 HB2 ALA A 55 8.253 -39.954 30.877 1.00 0.00 H new ATOM 0 HB3 ALA A 55 7.533 -39.170 32.303 1.00 0.00 H new ATOM 921 N LYS A 56 7.396 -35.572 31.383 1.00 0.00 N ATOM 922 CA LYS A 56 6.525 -34.476 31.797 1.00 0.00 C ATOM 923 C LYS A 56 5.639 -34.035 30.638 1.00 0.00 C ATOM 924 O LYS A 56 4.486 -33.659 30.834 1.00 0.00 O ATOM 925 CB LYS A 56 7.361 -33.289 32.302 1.00 0.00 C ATOM 926 CG LYS A 56 6.527 -32.137 32.865 1.00 0.00 C ATOM 927 CD LYS A 56 7.391 -30.941 33.265 1.00 0.00 C ATOM 928 CE LYS A 56 8.409 -31.295 34.347 1.00 0.00 C ATOM 929 NZ LYS A 56 7.759 -31.732 35.611 1.00 0.00 N ATOM 0 H LYS A 56 8.389 -35.340 31.382 1.00 0.00 H new ATOM 0 HA LYS A 56 5.890 -34.829 32.610 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.044 -33.641 33.075 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.974 -32.914 31.482 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.796 -31.822 32.120 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.968 -32.486 33.733 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.915 -30.564 32.386 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.749 -30.136 33.623 1.00 0.00 H new ATOM 0 HE2 LYS A 56 9.062 -32.089 33.983 1.00 0.00 H new ATOM 0 HE3 LYS A 56 9.041 -30.429 34.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.481 -31.847 36.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.067 -31.016 35.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.274 -32.639 35.456 1.00 0.00 H new ATOM 943 N PHE A 57 6.186 -34.094 29.430 1.00 0.00 N ATOM 944 CA PHE A 57 5.462 -33.678 28.236 1.00 0.00 C ATOM 945 C PHE A 57 5.300 -34.845 27.269 1.00 0.00 C ATOM 946 O PHE A 57 6.281 -35.337 26.704 1.00 0.00 O ATOM 947 CB PHE A 57 6.189 -32.520 27.539 1.00 0.00 C ATOM 948 CG PHE A 57 6.353 -31.296 28.407 1.00 0.00 C ATOM 949 CD1 PHE A 57 5.266 -30.482 28.696 1.00 0.00 C ATOM 950 CD2 PHE A 57 7.592 -30.962 28.936 1.00 0.00 C ATOM 951 CE1 PHE A 57 5.412 -29.363 29.494 1.00 0.00 C ATOM 952 CE2 PHE A 57 7.741 -29.844 29.733 1.00 0.00 C ATOM 953 CZ PHE A 57 6.651 -29.044 30.012 1.00 0.00 C ATOM 0 H PHE A 57 7.133 -34.428 29.251 1.00 0.00 H new ATOM 0 HA PHE A 57 4.473 -33.339 28.544 1.00 0.00 H new ATOM 0 HB2 PHE A 57 7.173 -32.861 27.218 1.00 0.00 H new ATOM 0 HB3 PHE A 57 5.638 -32.245 26.640 1.00 0.00 H new ATOM 0 HD1 PHE A 57 4.295 -30.726 28.292 1.00 0.00 H new ATOM 0 HD2 PHE A 57 8.449 -31.583 28.722 1.00 0.00 H new ATOM 0 HE1 PHE A 57 4.558 -28.739 29.712 1.00 0.00 H new ATOM 0 HE2 PHE A 57 8.711 -29.595 30.138 1.00 0.00 H new ATOM 0 HZ PHE A 57 6.768 -28.169 30.635 1.00 0.00 H new ATOM 963 N TYR A 58 4.064 -35.304 27.113 1.00 0.00 N ATOM 964 CA TYR A 58 3.724 -36.304 26.110 1.00 0.00 C ATOM 965 C TYR A 58 3.267 -35.598 24.836 1.00 0.00 C ATOM 966 O TYR A 58 2.294 -34.840 24.853 1.00 0.00 O ATOM 967 CB TYR A 58 2.616 -37.241 26.620 1.00 0.00 C ATOM 968 CG TYR A 58 3.015 -38.093 27.814 1.00 0.00 C ATOM 969 CD1 TYR A 58 3.810 -39.224 27.651 1.00 0.00 C ATOM 970 CD2 TYR A 58 2.585 -37.775 29.099 1.00 0.00 C ATOM 971 CE1 TYR A 58 4.165 -40.009 28.733 1.00 0.00 C ATOM 972 CE2 TYR A 58 2.939 -38.555 30.185 1.00 0.00 C ATOM 973 CZ TYR A 58 3.728 -39.671 29.996 1.00 0.00 C ATOM 974 OH TYR A 58 4.076 -40.455 31.075 1.00 0.00 O ATOM 0 H TYR A 58 3.272 -34.994 27.676 1.00 0.00 H new ATOM 0 HA TYR A 58 4.606 -36.910 25.902 1.00 0.00 H new ATOM 0 HB2 TYR A 58 1.746 -36.642 26.891 1.00 0.00 H new ATOM 0 HB3 TYR A 58 2.310 -37.898 25.806 1.00 0.00 H new ATOM 0 HD1 TYR A 58 4.155 -39.493 26.664 1.00 0.00 H new ATOM 0 HD2 TYR A 58 1.964 -36.904 29.251 1.00 0.00 H new ATOM 0 HE1 TYR A 58 4.782 -40.883 28.589 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.600 -38.292 31.176 1.00 0.00 H new ATOM 0 HH TYR A 58 3.688 -40.078 31.892 1.00 0.00 H new ATOM 984 N SER A 59 3.985 -35.822 23.745 1.00 0.00 N ATOM 985 CA SER A 59 3.666 -35.190 22.473 1.00 0.00 C ATOM 986 C SER A 59 2.745 -36.089 21.648 1.00 0.00 C ATOM 987 O SER A 59 3.149 -37.166 21.198 1.00 0.00 O ATOM 988 CB SER A 59 4.957 -34.891 21.704 1.00 0.00 C ATOM 989 OG SER A 59 5.837 -34.091 22.482 1.00 0.00 O ATOM 0 H SER A 59 4.796 -36.440 23.715 1.00 0.00 H new ATOM 0 HA SER A 59 3.145 -34.252 22.663 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.450 -35.825 21.436 1.00 0.00 H new ATOM 0 HB3 SER A 59 4.719 -34.377 20.773 1.00 0.00 H new ATOM 0 HG SER A 59 6.655 -33.914 21.972 1.00 0.00 H new ATOM 995 N PHE A 60 1.508 -35.643 21.457 1.00 0.00 N ATOM 996 CA PHE A 60 0.520 -36.389 20.685 1.00 0.00 C ATOM 997 C PHE A 60 0.325 -35.751 19.312 1.00 0.00 C ATOM 998 O PHE A 60 0.570 -34.554 19.126 1.00 0.00 O ATOM 999 CB PHE A 60 -0.821 -36.445 21.437 1.00 0.00 C ATOM 1000 CG PHE A 60 -0.760 -37.222 22.728 1.00 0.00 C ATOM 1001 CD1 PHE A 60 -0.705 -38.609 22.711 1.00 0.00 C ATOM 1002 CD2 PHE A 60 -0.758 -36.572 23.956 1.00 0.00 C ATOM 1003 CE1 PHE A 60 -0.648 -39.331 23.887 1.00 0.00 C ATOM 1004 CE2 PHE A 60 -0.702 -37.291 25.135 1.00 0.00 C ATOM 1005 CZ PHE A 60 -0.647 -38.672 25.101 1.00 0.00 C ATOM 0 H PHE A 60 1.163 -34.759 21.831 1.00 0.00 H new ATOM 0 HA PHE A 60 0.887 -37.406 20.550 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -1.150 -35.428 21.650 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -1.573 -36.894 20.788 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.707 -39.131 21.765 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -0.801 -35.493 23.990 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.604 -40.410 23.857 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.701 -36.774 26.083 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.603 -39.235 26.022 1.00 0.00 H new ATOM 1015 N ASN A 61 -0.112 -36.561 18.357 1.00 0.00 N ATOM 1016 CA ASN A 61 -0.324 -36.119 16.982 1.00 0.00 C ATOM 1017 C ASN A 61 -1.773 -36.347 16.583 1.00 0.00 C ATOM 1018 O ASN A 61 -2.261 -37.477 16.640 1.00 0.00 O ATOM 1019 CB ASN A 61 0.585 -36.896 16.023 1.00 0.00 C ATOM 1020 CG ASN A 61 0.458 -36.422 14.583 1.00 0.00 C ATOM 1021 OD1 ASN A 61 1.228 -35.578 14.133 1.00 0.00 O ATOM 1022 ND2 ASN A 61 -0.519 -36.949 13.857 1.00 0.00 N ATOM 0 H ASN A 61 -0.330 -37.545 18.513 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.086 -35.057 16.922 1.00 0.00 H new ATOM 0 HB2 ASN A 61 1.621 -36.792 16.346 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.340 -37.957 16.075 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.651 -36.655 12.889 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.139 -37.648 14.267 1.00 0.00 H new ATOM 1029 N VAL A 62 -2.452 -35.283 16.178 1.00 0.00 N ATOM 1030 CA VAL A 62 -3.830 -35.380 15.717 1.00 0.00 C ATOM 1031 C VAL A 62 -3.933 -34.908 14.273 1.00 0.00 C ATOM 1032 O VAL A 62 -3.623 -33.760 13.967 1.00 0.00 O ATOM 1033 CB VAL A 62 -4.789 -34.542 16.598 1.00 0.00 C ATOM 1034 CG1 VAL A 62 -6.215 -34.587 16.046 1.00 0.00 C ATOM 1035 CG2 VAL A 62 -4.751 -35.024 18.048 1.00 0.00 C ATOM 0 H VAL A 62 -2.069 -34.338 16.159 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.126 -36.427 15.789 1.00 0.00 H new ATOM 0 HB VAL A 62 -4.452 -33.506 16.576 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.870 -33.991 16.682 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.226 -34.183 15.034 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.566 -35.619 16.029 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.432 -34.422 18.650 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.056 -36.070 18.092 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -3.738 -34.925 18.438 1.00 0.00 H new ATOM 1045 N SER A 63 -4.361 -35.799 13.392 1.00 0.00 N ATOM 1046 CA SER A 63 -4.565 -35.462 11.991 1.00 0.00 C ATOM 1047 C SER A 63 -6.020 -35.729 11.614 1.00 0.00 C ATOM 1048 O SER A 63 -6.459 -36.881 11.605 1.00 0.00 O ATOM 1049 CB SER A 63 -3.620 -36.294 11.116 1.00 0.00 C ATOM 1050 OG SER A 63 -2.295 -36.264 11.624 1.00 0.00 O ATOM 0 H SER A 63 -4.575 -36.769 13.625 1.00 0.00 H new ATOM 0 HA SER A 63 -4.346 -34.406 11.830 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.973 -37.324 11.072 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.631 -35.910 10.096 1.00 0.00 H new ATOM 0 HG SER A 63 -1.946 -35.350 11.574 1.00 0.00 H new ATOM 1056 N MET A 64 -6.771 -34.672 11.321 1.00 0.00 N ATOM 1057 CA MET A 64 -8.193 -34.806 11.005 1.00 0.00 C ATOM 1058 C MET A 64 -8.570 -33.946 9.803 1.00 0.00 C ATOM 1059 O MET A 64 -7.849 -33.017 9.438 1.00 0.00 O ATOM 1060 CB MET A 64 -9.061 -34.424 12.215 1.00 0.00 C ATOM 1061 CG MET A 64 -8.980 -32.952 12.604 1.00 0.00 C ATOM 1062 SD MET A 64 -10.091 -32.534 13.962 1.00 0.00 S ATOM 1063 CE MET A 64 -11.676 -32.992 13.262 1.00 0.00 C ATOM 0 H MET A 64 -6.422 -33.714 11.295 1.00 0.00 H new ATOM 0 HA MET A 64 -8.378 -35.851 10.756 1.00 0.00 H new ATOM 0 HB2 MET A 64 -10.099 -34.674 11.996 1.00 0.00 H new ATOM 0 HB3 MET A 64 -8.761 -35.031 13.069 1.00 0.00 H new ATOM 0 HG2 MET A 64 -7.956 -32.711 12.889 1.00 0.00 H new ATOM 0 HG3 MET A 64 -9.223 -32.337 11.738 1.00 0.00 H new ATOM 0 HE1 MET A 64 -12.442 -32.300 13.612 1.00 0.00 H new ATOM 0 HE2 MET A 64 -11.619 -32.950 12.174 1.00 0.00 H new ATOM 0 HE3 MET A 64 -11.932 -34.005 13.573 1.00 0.00 H new ATOM 1073 N GLU A 65 -9.708 -34.266 9.201 1.00 0.00 N ATOM 1074 CA GLU A 65 -10.185 -33.569 8.010 1.00 0.00 C ATOM 1075 C GLU A 65 -10.759 -32.200 8.377 1.00 0.00 C ATOM 1076 O GLU A 65 -11.679 -32.105 9.191 1.00 0.00 O ATOM 1077 CB GLU A 65 -11.266 -34.408 7.317 1.00 0.00 C ATOM 1078 CG GLU A 65 -10.894 -35.876 7.141 1.00 0.00 C ATOM 1079 CD GLU A 65 -12.032 -36.702 6.565 1.00 0.00 C ATOM 1080 OE1 GLU A 65 -13.135 -36.684 7.152 1.00 0.00 O ATOM 1081 OE2 GLU A 65 -11.829 -37.371 5.527 1.00 0.00 O ATOM 0 H GLU A 65 -10.325 -35.012 9.521 1.00 0.00 H new ATOM 0 HA GLU A 65 -9.342 -33.425 7.334 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -12.187 -34.344 7.896 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -11.474 -33.977 6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -10.027 -35.951 6.485 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -10.601 -36.291 8.105 1.00 0.00 H new ATOM 1088 N VAL A 66 -10.207 -31.146 7.783 1.00 0.00 N ATOM 1089 CA VAL A 66 -10.740 -29.797 7.954 1.00 0.00 C ATOM 1090 C VAL A 66 -11.425 -29.341 6.668 1.00 0.00 C ATOM 1091 O VAL A 66 -10.891 -29.530 5.571 1.00 0.00 O ATOM 1092 CB VAL A 66 -9.637 -28.780 8.356 1.00 0.00 C ATOM 1093 CG1 VAL A 66 -9.071 -29.121 9.733 1.00 0.00 C ATOM 1094 CG2 VAL A 66 -8.522 -28.725 7.310 1.00 0.00 C ATOM 0 H VAL A 66 -9.388 -31.200 7.177 1.00 0.00 H new ATOM 0 HA VAL A 66 -11.466 -29.832 8.766 1.00 0.00 H new ATOM 0 HB VAL A 66 -10.094 -27.792 8.404 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -8.300 -28.398 9.998 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.870 -29.087 10.473 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.639 -30.121 9.711 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -7.766 -28.004 7.621 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -8.066 -29.710 7.213 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.939 -28.422 6.350 1.00 0.00 H new ATOM 1104 N SER A 67 -12.611 -28.756 6.807 1.00 0.00 N ATOM 1105 CA SER A 67 -13.405 -28.320 5.661 1.00 0.00 C ATOM 1106 C SER A 67 -12.784 -27.079 5.018 1.00 0.00 C ATOM 1107 O SER A 67 -12.551 -27.041 3.806 1.00 0.00 O ATOM 1108 CB SER A 67 -14.846 -28.033 6.106 1.00 0.00 C ATOM 1109 OG SER A 67 -15.667 -27.654 5.014 1.00 0.00 O ATOM 0 H SER A 67 -13.047 -28.571 7.710 1.00 0.00 H new ATOM 0 HA SER A 67 -13.417 -29.116 4.917 1.00 0.00 H new ATOM 0 HB2 SER A 67 -15.263 -28.920 6.584 1.00 0.00 H new ATOM 0 HB3 SER A 67 -14.845 -27.239 6.853 1.00 0.00 H new ATOM 0 HG SER A 67 -16.577 -27.481 5.334 1.00 0.00 H new ATOM 1115 N ASN A 68 -12.523 -26.073 5.842 1.00 0.00 N ATOM 1116 CA ASN A 68 -11.892 -24.833 5.402 1.00 0.00 C ATOM 1117 C ASN A 68 -11.101 -24.230 6.564 1.00 0.00 C ATOM 1118 O ASN A 68 -10.781 -24.931 7.528 1.00 0.00 O ATOM 1119 CB ASN A 68 -12.940 -23.842 4.860 1.00 0.00 C ATOM 1120 CG ASN A 68 -13.964 -23.422 5.898 1.00 0.00 C ATOM 1121 OD1 ASN A 68 -13.769 -22.446 6.621 1.00 0.00 O ATOM 1122 ND2 ASN A 68 -15.067 -24.151 5.971 1.00 0.00 N ATOM 0 H ASN A 68 -12.743 -26.093 6.838 1.00 0.00 H new ATOM 0 HA ASN A 68 -11.205 -25.049 4.584 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.430 -22.955 4.483 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.456 -24.296 4.014 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -15.794 -23.910 6.645 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.190 -24.953 5.353 1.00 0.00 H new ATOM 1129 N GLU A 69 -10.777 -22.943 6.479 1.00 0.00 N ATOM 1130 CA GLU A 69 -9.916 -22.309 7.475 1.00 0.00 C ATOM 1131 C GLU A 69 -10.637 -22.135 8.818 1.00 0.00 C ATOM 1132 O GLU A 69 -9.997 -21.999 9.862 1.00 0.00 O ATOM 1133 CB GLU A 69 -9.396 -20.962 6.952 1.00 0.00 C ATOM 1134 CG GLU A 69 -8.417 -20.271 7.899 1.00 0.00 C ATOM 1135 CD GLU A 69 -7.664 -19.129 7.241 1.00 0.00 C ATOM 1136 OE1 GLU A 69 -8.148 -17.976 7.289 1.00 0.00 O ATOM 1137 OE2 GLU A 69 -6.574 -19.384 6.683 1.00 0.00 O ATOM 0 H GLU A 69 -11.095 -22.321 5.736 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.064 -22.967 7.648 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.907 -21.120 5.991 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.243 -20.300 6.774 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.962 -19.890 8.762 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.702 -21.004 8.272 1.00 0.00 H new ATOM 1144 N SER A 70 -11.964 -22.161 8.796 1.00 0.00 N ATOM 1145 CA SER A 70 -12.750 -22.020 10.018 1.00 0.00 C ATOM 1146 C SER A 70 -12.468 -23.183 10.981 1.00 0.00 C ATOM 1147 O SER A 70 -12.283 -22.980 12.187 1.00 0.00 O ATOM 1148 CB SER A 70 -14.245 -21.949 9.676 1.00 0.00 C ATOM 1149 OG SER A 70 -14.499 -20.919 8.727 1.00 0.00 O ATOM 0 H SER A 70 -12.519 -22.278 7.948 1.00 0.00 H new ATOM 0 HA SER A 70 -12.461 -21.094 10.515 1.00 0.00 H new ATOM 0 HB2 SER A 70 -14.577 -22.907 9.277 1.00 0.00 H new ATOM 0 HB3 SER A 70 -14.821 -21.764 10.582 1.00 0.00 H new ATOM 0 HG SER A 70 -14.220 -21.219 7.836 1.00 0.00 H new ATOM 1155 N GLU A 71 -12.399 -24.394 10.431 1.00 0.00 N ATOM 1156 CA GLU A 71 -12.172 -25.597 11.228 1.00 0.00 C ATOM 1157 C GLU A 71 -10.797 -25.568 11.896 1.00 0.00 C ATOM 1158 O GLU A 71 -10.684 -25.794 13.101 1.00 0.00 O ATOM 1159 CB GLU A 71 -12.306 -26.863 10.363 1.00 0.00 C ATOM 1160 CG GLU A 71 -13.741 -27.216 9.969 1.00 0.00 C ATOM 1161 CD GLU A 71 -14.426 -26.145 9.133 1.00 0.00 C ATOM 1162 OE1 GLU A 71 -13.753 -25.529 8.285 1.00 0.00 O ATOM 1163 OE2 GLU A 71 -15.643 -25.923 9.318 1.00 0.00 O ATOM 0 H GLU A 71 -12.498 -24.568 9.431 1.00 0.00 H new ATOM 0 HA GLU A 71 -12.934 -25.620 12.007 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.716 -26.731 9.456 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.874 -27.705 10.905 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.735 -28.152 9.411 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -14.325 -27.388 10.873 1.00 0.00 H new ATOM 1170 N ARG A 72 -9.756 -25.260 11.120 1.00 0.00 N ATOM 1171 CA ARG A 72 -8.377 -25.315 11.625 1.00 0.00 C ATOM 1172 C ARG A 72 -8.172 -24.367 12.811 1.00 0.00 C ATOM 1173 O ARG A 72 -7.184 -24.480 13.535 1.00 0.00 O ATOM 1174 CB ARG A 72 -7.360 -25.028 10.497 1.00 0.00 C ATOM 1175 CG ARG A 72 -7.463 -23.633 9.875 1.00 0.00 C ATOM 1176 CD ARG A 72 -6.560 -22.602 10.558 1.00 0.00 C ATOM 1177 NE ARG A 72 -5.143 -22.812 10.243 1.00 0.00 N ATOM 1178 CZ ARG A 72 -4.507 -22.232 9.220 1.00 0.00 C ATOM 1179 NH1 ARG A 72 -5.147 -21.384 8.418 1.00 0.00 N ATOM 1180 NH2 ARG A 72 -3.226 -22.492 9.008 1.00 0.00 N ATOM 0 H ARG A 72 -9.837 -24.971 10.145 1.00 0.00 H new ATOM 0 HA ARG A 72 -8.201 -26.328 11.985 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -6.353 -25.160 10.893 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -7.493 -25.771 9.711 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -7.202 -23.693 8.819 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -8.497 -23.293 9.929 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -6.855 -21.600 10.247 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -6.702 -22.655 11.637 1.00 0.00 H new ATOM 0 HE ARG A 72 -4.609 -23.441 10.843 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -6.131 -21.172 8.581 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -4.653 -20.946 7.640 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -2.727 -23.133 9.624 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -2.738 -22.051 8.228 1.00 0.00 H new ATOM 1194 N ASN A 73 -9.107 -23.434 13.005 1.00 0.00 N ATOM 1195 CA ASN A 73 -9.058 -22.528 14.153 1.00 0.00 C ATOM 1196 C ASN A 73 -9.885 -23.077 15.315 1.00 0.00 C ATOM 1197 O ASN A 73 -9.425 -23.084 16.459 1.00 0.00 O ATOM 1198 CB ASN A 73 -9.544 -21.118 13.777 1.00 0.00 C ATOM 1199 CG ASN A 73 -8.533 -20.350 12.938 1.00 0.00 C ATOM 1200 OD1 ASN A 73 -7.622 -19.716 13.471 1.00 0.00 O ATOM 1201 ND2 ASN A 73 -8.695 -20.378 11.624 1.00 0.00 N ATOM 0 H ASN A 73 -9.903 -23.287 12.385 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.017 -22.456 14.467 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -10.481 -21.197 13.226 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.755 -20.557 14.687 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.054 -19.864 11.020 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -9.461 -20.914 11.216 1.00 0.00 H new ATOM 1208 N GLU A 74 -11.098 -23.555 15.025 1.00 0.00 N ATOM 1209 CA GLU A 74 -11.993 -24.034 16.081 1.00 0.00 C ATOM 1210 C GLU A 74 -11.397 -25.261 16.769 1.00 0.00 C ATOM 1211 O GLU A 74 -11.397 -25.361 17.997 1.00 0.00 O ATOM 1212 CB GLU A 74 -13.397 -24.357 15.533 1.00 0.00 C ATOM 1213 CG GLU A 74 -13.493 -25.634 14.706 1.00 0.00 C ATOM 1214 CD GLU A 74 -14.932 -26.034 14.427 1.00 0.00 C ATOM 1215 OE1 GLU A 74 -15.558 -26.671 15.306 1.00 0.00 O ATOM 1216 OE2 GLU A 74 -15.451 -25.709 13.342 1.00 0.00 O ATOM 0 H GLU A 74 -11.479 -23.620 14.081 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.098 -23.233 16.813 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -14.088 -24.434 16.372 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -13.732 -23.520 14.920 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.968 -25.493 13.761 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.989 -26.444 15.233 1.00 0.00 H new ATOM 1223 N ILE A 75 -10.863 -26.176 15.966 1.00 0.00 N ATOM 1224 CA ILE A 75 -10.288 -27.418 16.472 1.00 0.00 C ATOM 1225 C ILE A 75 -9.085 -27.120 17.362 1.00 0.00 C ATOM 1226 O ILE A 75 -8.871 -27.781 18.380 1.00 0.00 O ATOM 1227 CB ILE A 75 -9.879 -28.343 15.301 1.00 0.00 C ATOM 1228 CG1 ILE A 75 -11.106 -28.618 14.412 1.00 0.00 C ATOM 1229 CG2 ILE A 75 -9.276 -29.651 15.819 1.00 0.00 C ATOM 1230 CD1 ILE A 75 -10.782 -29.260 13.084 1.00 0.00 C ATOM 0 H ILE A 75 -10.817 -26.079 14.952 1.00 0.00 H new ATOM 0 HA ILE A 75 -11.042 -27.932 17.068 1.00 0.00 H new ATOM 0 HB ILE A 75 -9.114 -27.844 14.707 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.796 -29.264 14.955 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.626 -27.677 14.230 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.997 -30.282 14.975 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -8.391 -29.432 16.416 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -10.010 -30.171 16.435 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.703 -29.418 12.522 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -10.118 -28.607 12.517 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -10.291 -30.218 13.253 1.00 0.00 H new ATOM 1242 N PHE A 76 -8.329 -26.094 16.985 1.00 0.00 N ATOM 1243 CA PHE A 76 -7.195 -25.632 17.777 1.00 0.00 C ATOM 1244 C PHE A 76 -7.660 -25.246 19.183 1.00 0.00 C ATOM 1245 O PHE A 76 -6.962 -25.483 20.172 1.00 0.00 O ATOM 1246 CB PHE A 76 -6.529 -24.436 17.078 1.00 0.00 C ATOM 1247 CG PHE A 76 -5.379 -23.830 17.844 1.00 0.00 C ATOM 1248 CD1 PHE A 76 -4.145 -24.461 17.884 1.00 0.00 C ATOM 1249 CD2 PHE A 76 -5.533 -22.627 18.521 1.00 0.00 C ATOM 1250 CE1 PHE A 76 -3.090 -23.906 18.581 1.00 0.00 C ATOM 1251 CE2 PHE A 76 -4.479 -22.070 19.219 1.00 0.00 C ATOM 1252 CZ PHE A 76 -3.257 -22.709 19.249 1.00 0.00 C ATOM 0 H PHE A 76 -8.483 -25.563 16.128 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.465 -26.436 17.866 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -6.170 -24.756 16.100 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -7.281 -23.666 16.906 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.007 -25.397 17.364 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.487 -22.122 18.501 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -2.134 -24.408 18.604 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.612 -21.134 19.741 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.432 -22.274 19.794 1.00 0.00 H new ATOM 1262 N GLN A 77 -8.854 -24.665 19.258 1.00 0.00 N ATOM 1263 CA GLN A 77 -9.443 -24.267 20.534 1.00 0.00 C ATOM 1264 C GLN A 77 -9.989 -25.481 21.283 1.00 0.00 C ATOM 1265 O GLN A 77 -9.864 -25.575 22.508 1.00 0.00 O ATOM 1266 CB GLN A 77 -10.568 -23.251 20.316 1.00 0.00 C ATOM 1267 CG GLN A 77 -10.118 -21.959 19.645 1.00 0.00 C ATOM 1268 CD GLN A 77 -11.242 -20.942 19.539 1.00 0.00 C ATOM 1269 OE1 GLN A 77 -11.976 -20.907 18.550 1.00 0.00 O ATOM 1270 NE2 GLN A 77 -11.386 -20.108 20.558 1.00 0.00 N ATOM 0 H GLN A 77 -9.436 -24.458 18.446 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.658 -23.806 21.133 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -11.346 -23.712 19.708 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -11.017 -23.010 21.279 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -9.292 -21.527 20.211 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.739 -22.183 18.648 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.758 -20.169 21.359 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.125 -19.405 20.541 1.00 0.00 H new ATOM 1279 N LYS A 78 -10.596 -26.408 20.539 1.00 0.00 N ATOM 1280 CA LYS A 78 -11.171 -27.623 21.123 1.00 0.00 C ATOM 1281 C LYS A 78 -10.115 -28.371 21.930 1.00 0.00 C ATOM 1282 O LYS A 78 -10.380 -28.862 23.027 1.00 0.00 O ATOM 1283 CB LYS A 78 -11.722 -28.549 20.027 1.00 0.00 C ATOM 1284 CG LYS A 78 -12.773 -27.911 19.121 1.00 0.00 C ATOM 1285 CD LYS A 78 -14.027 -27.501 19.885 1.00 0.00 C ATOM 1286 CE LYS A 78 -15.063 -26.867 18.961 1.00 0.00 C ATOM 1287 NZ LYS A 78 -15.487 -27.794 17.876 1.00 0.00 N ATOM 0 H LYS A 78 -10.703 -26.340 19.527 1.00 0.00 H new ATOM 0 HA LYS A 78 -11.989 -27.326 21.779 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.892 -28.894 19.411 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -12.156 -29.430 20.499 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -12.345 -27.035 18.634 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -13.044 -28.614 18.333 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.459 -28.375 20.373 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.760 -26.796 20.672 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -15.934 -26.569 19.544 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -14.649 -25.960 18.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -16.178 -27.317 17.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.658 -28.072 17.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.922 -28.641 18.294 1.00 0.00 H new ATOM 1301 N ILE A 79 -8.909 -28.426 21.376 1.00 0.00 N ATOM 1302 CA ILE A 79 -7.790 -29.126 22.003 1.00 0.00 C ATOM 1303 C ILE A 79 -7.447 -28.513 23.365 1.00 0.00 C ATOM 1304 O ILE A 79 -6.962 -29.200 24.262 1.00 0.00 O ATOM 1305 CB ILE A 79 -6.539 -29.107 21.087 1.00 0.00 C ATOM 1306 CG1 ILE A 79 -6.856 -29.776 19.738 1.00 0.00 C ATOM 1307 CG2 ILE A 79 -5.357 -29.799 21.766 1.00 0.00 C ATOM 1308 CD1 ILE A 79 -5.711 -29.740 18.743 1.00 0.00 C ATOM 0 H ILE A 79 -8.678 -27.989 20.484 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.097 -30.161 22.155 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.262 -28.069 20.904 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -7.135 -30.814 19.917 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.723 -29.284 19.296 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.491 -29.773 21.104 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.119 -29.283 22.696 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.617 -30.835 21.982 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -6.016 -30.232 17.819 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.445 -28.704 18.532 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.848 -30.258 19.162 1.00 0.00 H new ATOM 1320 N SER A 80 -7.703 -27.219 23.516 1.00 0.00 N ATOM 1321 CA SER A 80 -7.395 -26.513 24.757 1.00 0.00 C ATOM 1322 C SER A 80 -8.453 -26.796 25.828 1.00 0.00 C ATOM 1323 O SER A 80 -8.195 -26.643 27.025 1.00 0.00 O ATOM 1324 CB SER A 80 -7.304 -25.009 24.488 1.00 0.00 C ATOM 1325 OG SER A 80 -6.837 -24.295 25.627 1.00 0.00 O ATOM 0 H SER A 80 -8.124 -26.635 22.794 1.00 0.00 H new ATOM 0 HA SER A 80 -6.435 -26.872 25.129 1.00 0.00 H new ATOM 0 HB2 SER A 80 -6.634 -24.830 23.647 1.00 0.00 H new ATOM 0 HB3 SER A 80 -8.285 -24.631 24.200 1.00 0.00 H new ATOM 0 HG SER A 80 -6.790 -23.339 25.417 1.00 0.00 H new ATOM 1331 N GLN A 81 -9.633 -27.238 25.393 1.00 0.00 N ATOM 1332 CA GLN A 81 -10.768 -27.454 26.296 1.00 0.00 C ATOM 1333 C GLN A 81 -10.542 -28.659 27.211 1.00 0.00 C ATOM 1334 O GLN A 81 -11.341 -28.921 28.108 1.00 0.00 O ATOM 1335 CB GLN A 81 -12.060 -27.655 25.492 1.00 0.00 C ATOM 1336 CG GLN A 81 -12.431 -26.467 24.610 1.00 0.00 C ATOM 1337 CD GLN A 81 -13.712 -26.681 23.817 1.00 0.00 C ATOM 1338 OE1 GLN A 81 -14.440 -25.733 23.530 1.00 0.00 O ATOM 1339 NE2 GLN A 81 -13.993 -27.923 23.446 1.00 0.00 N ATOM 0 H GLN A 81 -9.830 -27.455 24.416 1.00 0.00 H new ATOM 0 HA GLN A 81 -10.860 -26.565 26.920 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.952 -28.540 24.865 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -12.880 -27.852 26.183 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.543 -25.581 25.235 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -11.613 -26.268 23.918 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -13.366 -28.686 23.702 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -14.836 -28.115 22.905 1.00 0.00 H new ATOM 1348 N LEU A 82 -9.453 -29.388 26.984 1.00 0.00 N ATOM 1349 CA LEU A 82 -9.177 -30.606 27.746 1.00 0.00 C ATOM 1350 C LEU A 82 -8.561 -30.275 29.100 1.00 0.00 C ATOM 1351 O LEU A 82 -8.591 -31.104 30.010 1.00 0.00 O ATOM 1352 CB LEU A 82 -8.224 -31.533 26.970 1.00 0.00 C ATOM 1353 CG LEU A 82 -8.400 -31.524 25.444 1.00 0.00 C ATOM 1354 CD1 LEU A 82 -7.394 -32.453 24.773 1.00 0.00 C ATOM 1355 CD2 LEU A 82 -9.828 -31.887 25.057 1.00 0.00 C ATOM 0 H LEU A 82 -8.749 -29.160 26.282 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.128 -31.116 27.901 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.198 -31.249 27.203 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.362 -32.553 27.329 1.00 0.00 H new ATOM 0 HG LEU A 82 -8.207 -30.512 25.089 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.540 -32.428 23.693 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.382 -32.125 25.010 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.540 -33.470 25.136 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.925 -31.873 23.971 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.064 -32.884 25.430 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.518 -31.164 25.492 1.00 0.00 H new ATOM 1367 N ASP A 83 -7.972 -29.074 29.207 1.00 0.00 N ATOM 1368 CA ASP A 83 -7.238 -28.637 30.412 1.00 0.00 C ATOM 1369 C ASP A 83 -5.901 -29.378 30.550 1.00 0.00 C ATOM 1370 O ASP A 83 -4.886 -28.793 30.935 1.00 0.00 O ATOM 1371 CB ASP A 83 -8.088 -28.831 31.682 1.00 0.00 C ATOM 1372 CG ASP A 83 -7.332 -28.494 32.961 1.00 0.00 C ATOM 1373 OD1 ASP A 83 -7.304 -27.306 33.347 1.00 0.00 O ATOM 1374 OD2 ASP A 83 -6.773 -29.419 33.595 1.00 0.00 O ATOM 0 H ASP A 83 -7.989 -28.376 28.463 1.00 0.00 H new ATOM 0 HA ASP A 83 -7.029 -27.573 30.296 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.978 -28.205 31.616 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.429 -29.865 31.730 1.00 0.00 H new ATOM 1379 N LYS A 84 -5.916 -30.664 30.221 1.00 0.00 N ATOM 1380 CA LYS A 84 -4.751 -31.536 30.317 1.00 0.00 C ATOM 1381 C LYS A 84 -3.602 -31.060 29.424 1.00 0.00 C ATOM 1382 O LYS A 84 -2.430 -31.307 29.718 1.00 0.00 O ATOM 1383 CB LYS A 84 -5.170 -32.956 29.917 1.00 0.00 C ATOM 1384 CG LYS A 84 -6.292 -33.526 30.783 1.00 0.00 C ATOM 1385 CD LYS A 84 -6.983 -34.715 30.119 1.00 0.00 C ATOM 1386 CE LYS A 84 -8.054 -35.320 31.024 1.00 0.00 C ATOM 1387 NZ LYS A 84 -8.835 -36.391 30.345 1.00 0.00 N ATOM 0 H LYS A 84 -6.750 -31.138 29.875 1.00 0.00 H new ATOM 0 HA LYS A 84 -4.388 -31.517 31.345 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -5.492 -32.952 28.876 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.303 -33.614 29.980 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -5.885 -33.835 31.746 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -7.027 -32.746 30.983 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -7.437 -34.395 29.181 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -6.242 -35.476 29.872 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -7.582 -35.730 31.917 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -8.733 -34.534 31.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -9.548 -36.769 31.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.309 -35.997 29.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.194 -37.156 30.052 1.00 0.00 H new ATOM 1401 N VAL A 85 -3.943 -30.391 28.328 1.00 0.00 N ATOM 1402 CA VAL A 85 -2.943 -29.920 27.378 1.00 0.00 C ATOM 1403 C VAL A 85 -2.258 -28.656 27.898 1.00 0.00 C ATOM 1404 O VAL A 85 -2.913 -27.752 28.423 1.00 0.00 O ATOM 1405 CB VAL A 85 -3.572 -29.643 25.988 1.00 0.00 C ATOM 1406 CG1 VAL A 85 -4.609 -28.525 26.067 1.00 0.00 C ATOM 1407 CG2 VAL A 85 -2.492 -29.317 24.956 1.00 0.00 C ATOM 0 H VAL A 85 -4.905 -30.163 28.076 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.199 -30.709 27.268 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.084 -30.550 25.665 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.034 -28.352 25.078 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.402 -28.812 26.757 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -4.133 -27.611 26.422 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.958 -29.127 23.989 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.941 -28.432 25.274 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.806 -30.160 24.868 1.00 0.00 H new ATOM 1417 N VAL A 86 -0.938 -28.607 27.767 1.00 0.00 N ATOM 1418 CA VAL A 86 -0.163 -27.450 28.208 1.00 0.00 C ATOM 1419 C VAL A 86 0.273 -26.604 27.016 1.00 0.00 C ATOM 1420 O VAL A 86 0.412 -25.385 27.127 1.00 0.00 O ATOM 1421 CB VAL A 86 1.081 -27.872 29.029 1.00 0.00 C ATOM 1422 CG1 VAL A 86 0.658 -28.541 30.336 1.00 0.00 C ATOM 1423 CG2 VAL A 86 1.988 -28.793 28.212 1.00 0.00 C ATOM 0 H VAL A 86 -0.379 -29.356 27.358 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.813 -26.857 28.852 1.00 0.00 H new ATOM 0 HB VAL A 86 1.650 -26.975 29.273 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.545 -28.831 30.900 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.065 -27.843 30.927 1.00 0.00 H new ATOM 0 HG13 VAL A 86 0.063 -29.427 30.115 1.00 0.00 H new ATOM 0 HG21 VAL A 86 2.854 -29.075 28.811 1.00 0.00 H new ATOM 0 HG22 VAL A 86 1.436 -29.689 27.928 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.321 -28.272 27.314 1.00 0.00 H new ATOM 1433 N GLN A 87 0.472 -27.251 25.871 1.00 0.00 N ATOM 1434 CA GLN A 87 0.916 -26.558 24.666 1.00 0.00 C ATOM 1435 C GLN A 87 0.156 -27.082 23.449 1.00 0.00 C ATOM 1436 O GLN A 87 0.271 -28.258 23.090 1.00 0.00 O ATOM 1437 CB GLN A 87 2.431 -26.735 24.473 1.00 0.00 C ATOM 1438 CG GLN A 87 3.017 -25.872 23.357 1.00 0.00 C ATOM 1439 CD GLN A 87 4.507 -26.099 23.147 1.00 0.00 C ATOM 1440 OE1 GLN A 87 5.237 -26.459 24.074 1.00 0.00 O ATOM 1441 NE2 GLN A 87 4.973 -25.883 21.925 1.00 0.00 N ATOM 0 H GLN A 87 0.333 -28.254 25.753 1.00 0.00 H new ATOM 0 HA GLN A 87 0.707 -25.494 24.776 1.00 0.00 H new ATOM 0 HB2 GLN A 87 2.937 -26.495 25.408 1.00 0.00 H new ATOM 0 HB3 GLN A 87 2.640 -27.783 24.257 1.00 0.00 H new ATOM 0 HG2 GLN A 87 2.489 -26.083 22.427 1.00 0.00 H new ATOM 0 HG3 GLN A 87 2.845 -24.821 23.590 1.00 0.00 H new ATOM 0 HE21 GLN A 87 4.340 -25.586 21.183 1.00 0.00 H new ATOM 0 HE22 GLN A 87 5.965 -26.014 21.727 1.00 0.00 H new ATOM 1450 N THR A 88 -0.638 -26.210 22.838 1.00 0.00 N ATOM 1451 CA THR A 88 -1.415 -26.558 21.656 1.00 0.00 C ATOM 1452 C THR A 88 -0.751 -26.006 20.398 1.00 0.00 C ATOM 1453 O THR A 88 -0.490 -24.805 20.301 1.00 0.00 O ATOM 1454 CB THR A 88 -2.859 -26.008 21.766 1.00 0.00 C ATOM 1455 OG1 THR A 88 -2.829 -24.626 22.152 1.00 0.00 O ATOM 1456 CG2 THR A 88 -3.676 -26.794 22.784 1.00 0.00 C ATOM 0 H THR A 88 -0.760 -25.246 23.147 1.00 0.00 H new ATOM 0 HA THR A 88 -1.456 -27.645 21.590 1.00 0.00 H new ATOM 0 HB THR A 88 -3.330 -26.112 20.788 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.929 -24.062 21.357 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.684 -26.383 22.837 1.00 0.00 H new ATOM 0 HG22 THR A 88 -3.726 -27.840 22.481 1.00 0.00 H new ATOM 0 HG23 THR A 88 -3.203 -26.722 23.763 1.00 0.00 H new ATOM 1464 N LEU A 89 -0.444 -26.887 19.451 1.00 0.00 N ATOM 1465 CA LEU A 89 0.111 -26.472 18.168 1.00 0.00 C ATOM 1466 C LEU A 89 -0.863 -26.810 17.047 1.00 0.00 C ATOM 1467 O LEU A 89 -1.171 -27.978 16.812 1.00 0.00 O ATOM 1468 CB LEU A 89 1.468 -27.141 17.890 1.00 0.00 C ATOM 1469 CG LEU A 89 2.601 -26.817 18.882 1.00 0.00 C ATOM 1470 CD1 LEU A 89 2.406 -27.554 20.206 1.00 0.00 C ATOM 1471 CD2 LEU A 89 3.956 -27.153 18.269 1.00 0.00 C ATOM 0 H LEU A 89 -0.571 -27.894 19.549 1.00 0.00 H new ATOM 0 HA LEU A 89 0.269 -25.394 18.210 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.322 -28.221 17.878 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.794 -26.852 16.891 1.00 0.00 H new ATOM 0 HG LEU A 89 2.571 -25.748 19.092 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.222 -27.305 20.885 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.458 -27.255 20.653 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.399 -28.629 20.026 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.746 -26.918 18.982 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.991 -28.215 18.024 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.100 -26.566 17.362 1.00 0.00 H new