USER MOD reduce.3.24.130724 H: found=0, std=0, add=603, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 603 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 73 SER OG : rot 130:sc= 0.179 USER MOD Single : A 79 ASN : amide:sc= -0.0196 X(o=-0.02,f=0.17) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= -0.587 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 HIS : no HD1:sc= -2.31! K(o=-2.3!,f=-3.7) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -142:sc= -0.204 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -0.144 K(o=-0.14,f=-2.1!) USER MOD Single : A 131 MET CE :methyl 161:sc= -0.0652 (180deg=-1.09) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.41) USER MOD ----------------------------------------------------------------- ATOM 199 N SER A 73 -4.872 3.672 6.517 1.00 0.00 N ATOM 200 CA SER A 73 -3.580 3.028 6.316 1.00 0.00 C ATOM 201 C SER A 73 -3.527 2.326 4.962 1.00 0.00 C ATOM 202 O SER A 73 -3.026 1.207 4.850 1.00 0.00 O ATOM 203 CB SER A 73 -3.309 2.021 7.436 1.00 0.00 C ATOM 204 OG SER A 73 -4.408 1.144 7.610 1.00 0.00 O ATOM 0 HA SER A 73 -2.810 3.800 6.336 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.414 1.445 7.203 1.00 0.00 H new ATOM 0 HB3 SER A 73 -3.113 2.552 8.367 1.00 0.00 H new ATOM 0 HG SER A 73 -4.090 0.217 7.612 1.00 0.00 H new ATOM 210 N ARG A 74 -4.048 2.993 3.937 1.00 0.00 N ATOM 211 CA ARG A 74 -4.061 2.434 2.591 1.00 0.00 C ATOM 212 C ARG A 74 -2.919 3.002 1.754 1.00 0.00 C ATOM 213 O ARG A 74 -2.705 4.215 1.718 1.00 0.00 O ATOM 214 CB ARG A 74 -5.400 2.723 1.909 1.00 0.00 C ATOM 215 CG ARG A 74 -5.573 2.009 0.578 1.00 0.00 C ATOM 216 CD ARG A 74 -7.041 1.783 0.254 1.00 0.00 C ATOM 217 NE ARG A 74 -7.225 1.191 -1.068 1.00 0.00 N ATOM 218 CZ ARG A 74 -8.366 1.245 -1.745 1.00 0.00 C ATOM 219 NH1 ARG A 74 -9.420 1.861 -1.227 1.00 0.00 N ATOM 220 NH2 ARG A 74 -8.455 0.682 -2.944 1.00 0.00 N ATOM 0 H ARG A 74 -4.466 3.920 4.013 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.927 1.355 2.672 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.209 2.429 2.577 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.493 3.797 1.750 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.111 2.597 -0.215 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.054 1.051 0.608 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.482 1.131 1.008 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.573 2.733 0.303 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.434 0.710 -1.495 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.356 2.295 -0.306 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.295 1.901 -1.749 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.646 0.207 -3.346 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.332 0.724 -3.463 1.00 0.00 H new ATOM 234 N LEU A 75 -2.187 2.119 1.084 1.00 0.00 N ATOM 235 CA LEU A 75 -1.065 2.532 0.248 1.00 0.00 C ATOM 236 C LEU A 75 -1.361 2.276 -1.226 1.00 0.00 C ATOM 237 O LEU A 75 -1.776 1.181 -1.606 1.00 0.00 O ATOM 238 CB LEU A 75 0.206 1.788 0.661 1.00 0.00 C ATOM 239 CG LEU A 75 0.916 2.314 1.909 1.00 0.00 C ATOM 240 CD1 LEU A 75 1.859 1.261 2.471 1.00 0.00 C ATOM 241 CD2 LEU A 75 1.674 3.595 1.591 1.00 0.00 C ATOM 0 H LEU A 75 -2.350 1.112 1.103 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.914 3.602 0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.047 0.741 0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.908 1.819 -0.172 1.00 0.00 H new ATOM 0 HG LEU A 75 0.163 2.538 2.664 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.355 1.653 3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.292 0.369 2.737 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.607 1.005 1.721 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.173 3.955 2.491 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.417 3.396 0.819 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.975 4.353 1.236 1.00 0.00 H new ATOM 253 N PHE A 76 -1.143 3.293 -2.053 1.00 0.00 N ATOM 254 CA PHE A 76 -1.386 3.178 -3.487 1.00 0.00 C ATOM 255 C PHE A 76 -0.102 2.816 -4.228 1.00 0.00 C ATOM 256 O PHE A 76 0.856 3.589 -4.248 1.00 0.00 O ATOM 257 CB PHE A 76 -1.953 4.489 -4.036 1.00 0.00 C ATOM 258 CG PHE A 76 -2.043 4.521 -5.535 1.00 0.00 C ATOM 259 CD1 PHE A 76 -3.009 3.784 -6.201 1.00 0.00 C ATOM 260 CD2 PHE A 76 -1.160 5.288 -6.279 1.00 0.00 C ATOM 261 CE1 PHE A 76 -3.095 3.812 -7.580 1.00 0.00 C ATOM 262 CE2 PHE A 76 -1.241 5.320 -7.658 1.00 0.00 C ATOM 263 CZ PHE A 76 -2.209 4.580 -8.310 1.00 0.00 C ATOM 0 H PHE A 76 -0.799 4.206 -1.755 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.113 2.381 -3.645 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.946 4.650 -3.617 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.327 5.316 -3.700 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.703 3.180 -5.635 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -0.400 5.867 -5.775 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.854 3.234 -8.086 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.548 5.923 -8.226 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.273 4.602 -9.388 1.00 0.00 H new ATOM 273 N VAL A 77 -0.090 1.634 -4.836 1.00 0.00 N ATOM 274 CA VAL A 77 1.074 1.168 -5.579 1.00 0.00 C ATOM 275 C VAL A 77 0.804 1.168 -7.080 1.00 0.00 C ATOM 276 O VAL A 77 -0.049 0.428 -7.568 1.00 0.00 O ATOM 277 CB VAL A 77 1.488 -0.250 -5.143 1.00 0.00 C ATOM 278 CG1 VAL A 77 2.662 -0.744 -5.975 1.00 0.00 C ATOM 279 CG2 VAL A 77 1.827 -0.273 -3.660 1.00 0.00 C ATOM 0 H VAL A 77 -0.874 0.982 -4.828 1.00 0.00 H new ATOM 0 HA VAL A 77 1.887 1.859 -5.359 1.00 0.00 H new ATOM 0 HB VAL A 77 0.647 -0.923 -5.311 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.940 -1.747 -5.652 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.378 -0.767 -7.027 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.510 -0.072 -5.843 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.117 -1.282 -3.369 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.652 0.412 -3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.955 0.035 -3.083 1.00 0.00 H new ATOM 289 N GLY A 78 1.539 2.004 -7.808 1.00 0.00 N ATOM 290 CA GLY A 78 1.364 2.085 -9.246 1.00 0.00 C ATOM 291 C GLY A 78 2.605 1.657 -10.006 1.00 0.00 C ATOM 292 O GLY A 78 3.682 1.527 -9.426 1.00 0.00 O ATOM 0 H GLY A 78 2.252 2.626 -7.427 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.525 1.456 -9.543 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.108 3.108 -9.521 1.00 0.00 H new ATOM 296 N ASN A 79 2.452 1.435 -11.307 1.00 0.00 N ATOM 297 CA ASN A 79 3.569 1.016 -12.147 1.00 0.00 C ATOM 298 C ASN A 79 4.117 -0.333 -11.691 1.00 0.00 C ATOM 299 O ASN A 79 5.326 -0.500 -11.524 1.00 0.00 O ATOM 300 CB ASN A 79 4.680 2.068 -12.115 1.00 0.00 C ATOM 301 CG ASN A 79 5.521 2.058 -13.377 1.00 0.00 C ATOM 302 OD1 ASN A 79 6.429 1.240 -13.525 1.00 0.00 O ATOM 303 ND2 ASN A 79 5.222 2.970 -14.294 1.00 0.00 N ATOM 0 H ASN A 79 1.567 1.538 -11.803 1.00 0.00 H new ATOM 0 HA ASN A 79 3.204 0.913 -13.169 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.238 3.056 -11.984 1.00 0.00 H new ATOM 0 HB3 ASN A 79 5.322 1.889 -11.252 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.753 3.012 -15.164 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.461 3.629 -14.129 1.00 0.00 H new ATOM 310 N LEU A 80 3.220 -1.292 -11.491 1.00 0.00 N ATOM 311 CA LEU A 80 3.613 -2.628 -11.055 1.00 0.00 C ATOM 312 C LEU A 80 4.061 -3.478 -12.239 1.00 0.00 C ATOM 313 O LEU A 80 3.476 -3.434 -13.322 1.00 0.00 O ATOM 314 CB LEU A 80 2.452 -3.311 -10.331 1.00 0.00 C ATOM 315 CG LEU A 80 2.238 -2.907 -8.872 1.00 0.00 C ATOM 316 CD1 LEU A 80 0.894 -3.411 -8.370 1.00 0.00 C ATOM 317 CD2 LEU A 80 3.368 -3.437 -8.001 1.00 0.00 C ATOM 0 H LEU A 80 2.216 -1.170 -11.624 1.00 0.00 H new ATOM 0 HA LEU A 80 4.453 -2.527 -10.367 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.535 -3.104 -10.882 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.611 -4.389 -10.369 1.00 0.00 H new ATOM 0 HG LEU A 80 2.240 -1.819 -8.812 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.759 -3.114 -7.330 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.095 -2.983 -8.976 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.862 -4.498 -8.444 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.199 -3.140 -6.966 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.398 -4.525 -8.066 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.317 -3.026 -8.346 1.00 0.00 H new ATOM 329 N PRO A 81 5.121 -4.273 -12.031 1.00 0.00 N ATOM 330 CA PRO A 81 5.668 -5.151 -13.069 1.00 0.00 C ATOM 331 C PRO A 81 4.737 -6.314 -13.395 1.00 0.00 C ATOM 332 O PRO A 81 3.945 -6.758 -12.564 1.00 0.00 O ATOM 333 CB PRO A 81 6.969 -5.666 -12.449 1.00 0.00 C ATOM 334 CG PRO A 81 6.750 -5.574 -10.978 1.00 0.00 C ATOM 335 CD PRO A 81 5.866 -4.376 -10.765 1.00 0.00 C ATOM 0 HA PRO A 81 5.808 -4.626 -14.014 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.175 -6.692 -12.755 1.00 0.00 H new ATOM 0 HB3 PRO A 81 7.822 -5.063 -12.761 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.279 -6.480 -10.596 1.00 0.00 H new ATOM 0 HG3 PRO A 81 7.696 -5.460 -10.449 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.197 -4.516 -9.915 1.00 0.00 H new ATOM 0 HD3 PRO A 81 6.449 -3.476 -10.567 1.00 0.00 H new ATOM 343 N PRO A 82 4.833 -6.820 -14.634 1.00 0.00 N ATOM 344 CA PRO A 82 4.007 -7.938 -15.098 1.00 0.00 C ATOM 345 C PRO A 82 4.383 -9.254 -14.425 1.00 0.00 C ATOM 346 O PRO A 82 3.797 -10.298 -14.712 1.00 0.00 O ATOM 347 CB PRO A 82 4.304 -8.000 -16.598 1.00 0.00 C ATOM 348 CG PRO A 82 5.658 -7.396 -16.741 1.00 0.00 C ATOM 349 CD PRO A 82 5.754 -6.339 -15.677 1.00 0.00 C ATOM 0 HA PRO A 82 2.953 -7.791 -14.865 1.00 0.00 H new ATOM 0 HB2 PRO A 82 4.288 -9.027 -16.963 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.561 -7.446 -17.172 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.436 -8.149 -16.615 1.00 0.00 H new ATOM 0 HG3 PRO A 82 5.790 -6.964 -17.733 1.00 0.00 H new ATOM 0 HD2 PRO A 82 6.772 -6.240 -15.300 1.00 0.00 H new ATOM 0 HD3 PRO A 82 5.457 -5.361 -16.055 1.00 0.00 H new ATOM 357 N ASP A 83 5.362 -9.197 -13.530 1.00 0.00 N ATOM 358 CA ASP A 83 5.816 -10.385 -12.815 1.00 0.00 C ATOM 359 C ASP A 83 5.560 -10.248 -11.318 1.00 0.00 C ATOM 360 O ASP A 83 6.324 -10.758 -10.499 1.00 0.00 O ATOM 361 CB ASP A 83 7.305 -10.623 -13.071 1.00 0.00 C ATOM 362 CG ASP A 83 7.559 -11.346 -14.379 1.00 0.00 C ATOM 363 OD1 ASP A 83 7.260 -12.556 -14.455 1.00 0.00 O ATOM 364 OD2 ASP A 83 8.058 -10.703 -15.326 1.00 0.00 O ATOM 0 H ASP A 83 5.857 -8.341 -13.282 1.00 0.00 H new ATOM 0 HA ASP A 83 5.251 -11.240 -13.186 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.827 -9.666 -13.081 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.723 -11.205 -12.250 1.00 0.00 H new ATOM 369 N ILE A 84 4.481 -9.556 -10.968 1.00 0.00 N ATOM 370 CA ILE A 84 4.125 -9.353 -9.569 1.00 0.00 C ATOM 371 C ILE A 84 2.895 -10.172 -9.190 1.00 0.00 C ATOM 372 O ILE A 84 1.880 -10.148 -9.887 1.00 0.00 O ATOM 373 CB ILE A 84 3.851 -7.868 -9.268 1.00 0.00 C ATOM 374 CG1 ILE A 84 3.567 -7.672 -7.777 1.00 0.00 C ATOM 375 CG2 ILE A 84 2.686 -7.364 -10.106 1.00 0.00 C ATOM 376 CD1 ILE A 84 4.814 -7.471 -6.945 1.00 0.00 C ATOM 0 H ILE A 84 3.838 -9.127 -11.634 1.00 0.00 H new ATOM 0 HA ILE A 84 4.977 -9.685 -8.975 1.00 0.00 H new ATOM 0 HB ILE A 84 4.737 -7.289 -9.529 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.913 -6.809 -7.651 1.00 0.00 H new ATOM 0 HG13 ILE A 84 3.026 -8.540 -7.401 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.505 -6.313 -9.882 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.925 -7.474 -11.164 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.793 -7.944 -9.874 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.536 -7.339 -5.899 1.00 0.00 H new ATOM 0 HD12 ILE A 84 5.460 -8.344 -7.041 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.346 -6.586 -7.294 1.00 0.00 H new ATOM 388 N THR A 85 2.992 -10.897 -8.080 1.00 0.00 N ATOM 389 CA THR A 85 1.889 -11.723 -7.607 1.00 0.00 C ATOM 390 C THR A 85 1.590 -11.452 -6.137 1.00 0.00 C ATOM 391 O THR A 85 2.417 -10.891 -5.420 1.00 0.00 O ATOM 392 CB THR A 85 2.190 -13.222 -7.791 1.00 0.00 C ATOM 393 OG1 THR A 85 3.333 -13.591 -7.010 1.00 0.00 O ATOM 394 CG2 THR A 85 2.443 -13.548 -9.255 1.00 0.00 C ATOM 0 H THR A 85 3.824 -10.929 -7.491 1.00 0.00 H new ATOM 0 HA THR A 85 1.018 -11.460 -8.206 1.00 0.00 H new ATOM 0 HB THR A 85 1.322 -13.789 -7.455 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.517 -14.546 -7.131 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.653 -14.612 -9.360 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.561 -13.293 -9.842 1.00 0.00 H new ATOM 0 HG23 THR A 85 3.296 -12.973 -9.614 1.00 0.00 H new ATOM 402 N GLU A 86 0.403 -11.857 -5.694 1.00 0.00 N ATOM 403 CA GLU A 86 -0.003 -11.657 -4.308 1.00 0.00 C ATOM 404 C GLU A 86 1.137 -11.997 -3.353 1.00 0.00 C ATOM 405 O GLU A 86 1.353 -11.306 -2.358 1.00 0.00 O ATOM 406 CB GLU A 86 -1.228 -12.515 -3.984 1.00 0.00 C ATOM 407 CG GLU A 86 -2.544 -11.879 -4.400 1.00 0.00 C ATOM 408 CD GLU A 86 -3.651 -12.899 -4.587 1.00 0.00 C ATOM 409 OE1 GLU A 86 -3.472 -13.824 -5.406 1.00 0.00 O ATOM 410 OE2 GLU A 86 -4.695 -12.771 -3.915 1.00 0.00 O ATOM 0 H GLU A 86 -0.293 -12.325 -6.275 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.260 -10.606 -4.179 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.127 -13.480 -4.481 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -1.251 -12.710 -2.912 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.847 -11.153 -3.645 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.400 -11.330 -5.330 1.00 0.00 H new ATOM 417 N GLU A 87 1.863 -13.067 -3.663 1.00 0.00 N ATOM 418 CA GLU A 87 2.979 -13.499 -2.831 1.00 0.00 C ATOM 419 C GLU A 87 4.056 -12.421 -2.763 1.00 0.00 C ATOM 420 O GLU A 87 4.446 -11.987 -1.679 1.00 0.00 O ATOM 421 CB GLU A 87 3.577 -14.798 -3.376 1.00 0.00 C ATOM 422 CG GLU A 87 4.674 -15.378 -2.499 1.00 0.00 C ATOM 423 CD GLU A 87 4.876 -16.864 -2.724 1.00 0.00 C ATOM 424 OE1 GLU A 87 3.893 -17.623 -2.598 1.00 0.00 O ATOM 425 OE2 GLU A 87 6.019 -17.268 -3.027 1.00 0.00 O ATOM 0 H GLU A 87 1.698 -13.650 -4.484 1.00 0.00 H new ATOM 0 HA GLU A 87 2.601 -13.675 -1.824 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.782 -15.536 -3.485 1.00 0.00 H new ATOM 0 HB3 GLU A 87 3.979 -14.613 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 87 5.609 -14.854 -2.698 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.427 -15.203 -1.452 1.00 0.00 H new ATOM 432 N GLU A 88 4.533 -11.993 -3.928 1.00 0.00 N ATOM 433 CA GLU A 88 5.565 -10.966 -4.000 1.00 0.00 C ATOM 434 C GLU A 88 5.195 -9.761 -3.140 1.00 0.00 C ATOM 435 O GLU A 88 6.042 -9.195 -2.449 1.00 0.00 O ATOM 436 CB GLU A 88 5.778 -10.526 -5.450 1.00 0.00 C ATOM 437 CG GLU A 88 6.338 -11.620 -6.343 1.00 0.00 C ATOM 438 CD GLU A 88 7.826 -11.833 -6.142 1.00 0.00 C ATOM 439 OE1 GLU A 88 8.548 -10.831 -5.957 1.00 0.00 O ATOM 440 OE2 GLU A 88 8.268 -13.000 -6.169 1.00 0.00 O ATOM 0 H GLU A 88 4.221 -12.342 -4.834 1.00 0.00 H new ATOM 0 HA GLU A 88 6.492 -11.392 -3.617 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.828 -10.185 -5.860 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.457 -9.673 -5.466 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.811 -12.553 -6.142 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.149 -11.365 -7.386 1.00 0.00 H new ATOM 447 N MET A 89 3.925 -9.375 -3.189 1.00 0.00 N ATOM 448 CA MET A 89 3.442 -8.237 -2.414 1.00 0.00 C ATOM 449 C MET A 89 3.631 -8.478 -0.919 1.00 0.00 C ATOM 450 O MET A 89 4.173 -7.632 -0.208 1.00 0.00 O ATOM 451 CB MET A 89 1.966 -7.976 -2.717 1.00 0.00 C ATOM 452 CG MET A 89 1.566 -6.516 -2.579 1.00 0.00 C ATOM 453 SD MET A 89 1.763 -5.594 -4.116 1.00 0.00 S ATOM 454 CE MET A 89 0.857 -4.097 -3.731 1.00 0.00 C ATOM 0 H MET A 89 3.212 -9.833 -3.756 1.00 0.00 H new ATOM 0 HA MET A 89 4.025 -7.361 -2.700 1.00 0.00 H new ATOM 0 HB2 MET A 89 1.747 -8.310 -3.731 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.354 -8.577 -2.045 1.00 0.00 H new ATOM 0 HG2 MET A 89 0.527 -6.457 -2.255 1.00 0.00 H new ATOM 0 HG3 MET A 89 2.170 -6.050 -1.800 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.887 -3.423 -4.587 1.00 0.00 H new ATOM 0 HE2 MET A 89 -0.179 -4.347 -3.503 1.00 0.00 H new ATOM 0 HE3 MET A 89 1.311 -3.609 -2.869 1.00 0.00 H new ATOM 464 N ARG A 90 3.181 -9.637 -0.450 1.00 0.00 N ATOM 465 CA ARG A 90 3.299 -9.988 0.961 1.00 0.00 C ATOM 466 C ARG A 90 4.748 -9.881 1.427 1.00 0.00 C ATOM 467 O ARG A 90 5.027 -9.367 2.511 1.00 0.00 O ATOM 468 CB ARG A 90 2.778 -11.406 1.201 1.00 0.00 C ATOM 469 CG ARG A 90 1.298 -11.461 1.542 1.00 0.00 C ATOM 470 CD ARG A 90 0.675 -12.779 1.111 1.00 0.00 C ATOM 471 NE ARG A 90 0.993 -13.864 2.036 1.00 0.00 N ATOM 472 CZ ARG A 90 0.502 -15.093 1.924 1.00 0.00 C ATOM 473 NH1 ARG A 90 -0.324 -15.393 0.931 1.00 0.00 N ATOM 474 NH2 ARG A 90 0.838 -16.026 2.806 1.00 0.00 N ATOM 0 H ARG A 90 2.731 -10.349 -1.026 1.00 0.00 H new ATOM 0 HA ARG A 90 2.697 -9.285 1.537 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.959 -12.006 0.310 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.346 -11.860 2.013 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.166 -11.329 2.616 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.780 -10.636 1.053 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.407 -12.664 1.045 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.029 -13.038 0.113 1.00 0.00 H new ATOM 0 HE ARG A 90 1.627 -13.667 2.810 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.584 -14.679 0.250 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.699 -16.338 0.848 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.474 -15.800 3.571 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.460 -16.970 2.719 1.00 0.00 H new ATOM 488 N LYS A 91 5.668 -10.371 0.603 1.00 0.00 N ATOM 489 CA LYS A 91 7.088 -10.331 0.929 1.00 0.00 C ATOM 490 C LYS A 91 7.618 -8.901 0.879 1.00 0.00 C ATOM 491 O LYS A 91 8.402 -8.488 1.734 1.00 0.00 O ATOM 492 CB LYS A 91 7.880 -11.214 -0.038 1.00 0.00 C ATOM 493 CG LYS A 91 9.175 -11.749 0.548 1.00 0.00 C ATOM 494 CD LYS A 91 10.190 -12.063 -0.537 1.00 0.00 C ATOM 495 CE LYS A 91 11.452 -12.685 0.043 1.00 0.00 C ATOM 496 NZ LYS A 91 12.648 -12.400 -0.798 1.00 0.00 N ATOM 0 H LYS A 91 5.455 -10.801 -0.297 1.00 0.00 H new ATOM 0 HA LYS A 91 7.213 -10.711 1.943 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.256 -12.053 -0.344 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.107 -10.641 -0.937 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.593 -11.016 1.238 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.969 -12.650 1.126 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.748 -12.745 -1.264 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.447 -11.149 -1.072 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.616 -12.301 1.050 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.318 -13.763 0.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 13.487 -12.841 -0.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.502 -12.788 -1.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.791 -11.372 -0.861 1.00 0.00 H new ATOM 510 N LEU A 92 7.184 -8.149 -0.127 1.00 0.00 N ATOM 511 CA LEU A 92 7.613 -6.764 -0.288 1.00 0.00 C ATOM 512 C LEU A 92 7.346 -5.961 0.981 1.00 0.00 C ATOM 513 O LEU A 92 8.137 -5.095 1.358 1.00 0.00 O ATOM 514 CB LEU A 92 6.892 -6.121 -1.474 1.00 0.00 C ATOM 515 CG LEU A 92 7.454 -6.448 -2.858 1.00 0.00 C ATOM 516 CD1 LEU A 92 6.445 -6.095 -3.940 1.00 0.00 C ATOM 517 CD2 LEU A 92 8.766 -5.712 -3.088 1.00 0.00 C ATOM 0 H LEU A 92 6.535 -8.475 -0.843 1.00 0.00 H new ATOM 0 HA LEU A 92 8.686 -6.761 -0.479 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.846 -6.427 -1.447 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.911 -5.039 -1.342 1.00 0.00 H new ATOM 0 HG LEU A 92 7.649 -7.519 -2.907 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.862 -6.334 -4.918 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.530 -6.667 -3.785 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.219 -5.030 -3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.152 -5.956 -4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.597 -4.637 -3.020 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.490 -6.014 -2.332 1.00 0.00 H new ATOM 529 N PHE A 93 6.229 -6.255 1.637 1.00 0.00 N ATOM 530 CA PHE A 93 5.858 -5.560 2.865 1.00 0.00 C ATOM 531 C PHE A 93 5.963 -6.491 4.069 1.00 0.00 C ATOM 532 O PHE A 93 5.185 -6.386 5.017 1.00 0.00 O ATOM 533 CB PHE A 93 4.435 -5.009 2.754 1.00 0.00 C ATOM 534 CG PHE A 93 4.262 -4.014 1.642 1.00 0.00 C ATOM 535 CD1 PHE A 93 4.288 -4.423 0.319 1.00 0.00 C ATOM 536 CD2 PHE A 93 4.073 -2.670 1.921 1.00 0.00 C ATOM 537 CE1 PHE A 93 4.130 -3.509 -0.706 1.00 0.00 C ATOM 538 CE2 PHE A 93 3.914 -1.752 0.900 1.00 0.00 C ATOM 539 CZ PHE A 93 3.942 -2.172 -0.415 1.00 0.00 C ATOM 0 H PHE A 93 5.565 -6.969 1.339 1.00 0.00 H new ATOM 0 HA PHE A 93 6.551 -4.731 3.008 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.744 -5.838 2.600 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.162 -4.538 3.698 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.433 -5.467 0.086 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.050 -2.336 2.948 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.154 -3.840 -1.734 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.768 -0.707 1.131 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.817 -1.457 -1.214 1.00 0.00 H new ATOM 549 N GLU A 94 6.930 -7.402 4.023 1.00 0.00 N ATOM 550 CA GLU A 94 7.135 -8.353 5.110 1.00 0.00 C ATOM 551 C GLU A 94 7.821 -7.682 6.297 1.00 0.00 C ATOM 552 O GLU A 94 7.504 -7.965 7.452 1.00 0.00 O ATOM 553 CB GLU A 94 7.972 -9.540 4.627 1.00 0.00 C ATOM 554 CG GLU A 94 9.470 -9.321 4.756 1.00 0.00 C ATOM 555 CD GLU A 94 10.278 -10.364 4.010 1.00 0.00 C ATOM 556 OE1 GLU A 94 10.266 -11.539 4.435 1.00 0.00 O ATOM 557 OE2 GLU A 94 10.923 -10.008 3.002 1.00 0.00 O ATOM 0 H GLU A 94 7.583 -7.502 3.246 1.00 0.00 H new ATOM 0 HA GLU A 94 6.158 -8.714 5.433 1.00 0.00 H new ATOM 0 HB2 GLU A 94 7.693 -10.426 5.196 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.731 -9.743 3.583 1.00 0.00 H new ATOM 0 HG2 GLU A 94 9.723 -8.331 4.376 1.00 0.00 H new ATOM 0 HG3 GLU A 94 9.747 -9.338 5.810 1.00 0.00 H new ATOM 564 N LYS A 95 8.763 -6.792 6.003 1.00 0.00 N ATOM 565 CA LYS A 95 9.494 -6.080 7.044 1.00 0.00 C ATOM 566 C LYS A 95 8.535 -5.382 8.002 1.00 0.00 C ATOM 567 O LYS A 95 8.856 -5.169 9.172 1.00 0.00 O ATOM 568 CB LYS A 95 10.443 -5.055 6.419 1.00 0.00 C ATOM 569 CG LYS A 95 11.604 -4.672 7.320 1.00 0.00 C ATOM 570 CD LYS A 95 11.251 -3.496 8.215 1.00 0.00 C ATOM 571 CE LYS A 95 11.567 -2.169 7.542 1.00 0.00 C ATOM 572 NZ LYS A 95 11.715 -1.066 8.532 1.00 0.00 N ATOM 0 H LYS A 95 9.038 -6.547 5.052 1.00 0.00 H new ATOM 0 HA LYS A 95 10.076 -6.809 7.608 1.00 0.00 H new ATOM 0 HB2 LYS A 95 10.836 -5.458 5.486 1.00 0.00 H new ATOM 0 HB3 LYS A 95 9.879 -4.157 6.166 1.00 0.00 H new ATOM 0 HG2 LYS A 95 11.886 -5.527 7.935 1.00 0.00 H new ATOM 0 HG3 LYS A 95 12.471 -4.419 6.710 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.191 -3.534 8.467 1.00 0.00 H new ATOM 0 HD3 LYS A 95 11.804 -3.571 9.151 1.00 0.00 H new ATOM 0 HE2 LYS A 95 12.487 -2.265 6.965 1.00 0.00 H new ATOM 0 HE3 LYS A 95 10.773 -1.921 6.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 11.930 -0.179 8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 10.829 -0.957 9.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 12.490 -1.291 9.189 1.00 0.00 H new ATOM 586 N TYR A 96 7.356 -5.030 7.500 1.00 0.00 N ATOM 587 CA TYR A 96 6.350 -4.355 8.312 1.00 0.00 C ATOM 588 C TYR A 96 5.221 -5.311 8.686 1.00 0.00 C ATOM 589 O TYR A 96 4.062 -4.911 8.786 1.00 0.00 O ATOM 590 CB TYR A 96 5.785 -3.148 7.562 1.00 0.00 C ATOM 591 CG TYR A 96 6.782 -2.489 6.637 1.00 0.00 C ATOM 592 CD1 TYR A 96 7.657 -1.516 7.105 1.00 0.00 C ATOM 593 CD2 TYR A 96 6.851 -2.839 5.294 1.00 0.00 C ATOM 594 CE1 TYR A 96 8.569 -0.910 6.263 1.00 0.00 C ATOM 595 CE2 TYR A 96 7.761 -2.240 4.445 1.00 0.00 C ATOM 596 CZ TYR A 96 8.617 -1.276 4.934 1.00 0.00 C ATOM 597 OH TYR A 96 9.526 -0.676 4.092 1.00 0.00 O ATOM 0 H TYR A 96 7.074 -5.201 6.535 1.00 0.00 H new ATOM 0 HA TYR A 96 6.830 -4.012 9.229 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.918 -3.465 6.982 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.433 -2.413 8.286 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.623 -1.229 8.146 1.00 0.00 H new ATOM 0 HD2 TYR A 96 6.181 -3.593 4.907 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.240 -0.154 6.643 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.802 -2.525 3.404 1.00 0.00 H new ATOM 0 HH TYR A 96 9.431 -1.047 3.190 1.00 0.00 H new ATOM 607 N GLY A 97 5.570 -6.577 8.891 1.00 0.00 N ATOM 608 CA GLY A 97 4.576 -7.571 9.252 1.00 0.00 C ATOM 609 C GLY A 97 3.744 -8.016 8.066 1.00 0.00 C ATOM 610 O GLY A 97 4.055 -7.687 6.921 1.00 0.00 O ATOM 0 H GLY A 97 6.523 -6.932 8.814 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.074 -8.437 9.688 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.919 -7.162 10.019 1.00 0.00 H new ATOM 614 N LYS A 98 2.684 -8.770 8.338 1.00 0.00 N ATOM 615 CA LYS A 98 1.804 -9.262 7.285 1.00 0.00 C ATOM 616 C LYS A 98 0.810 -8.186 6.859 1.00 0.00 C ATOM 617 O LYS A 98 0.213 -7.512 7.698 1.00 0.00 O ATOM 618 CB LYS A 98 1.051 -10.506 7.761 1.00 0.00 C ATOM 619 CG LYS A 98 -0.260 -10.740 7.031 1.00 0.00 C ATOM 620 CD LYS A 98 -0.631 -12.214 7.009 1.00 0.00 C ATOM 621 CE LYS A 98 0.026 -12.936 5.843 1.00 0.00 C ATOM 622 NZ LYS A 98 -0.327 -14.383 5.817 1.00 0.00 N ATOM 0 H LYS A 98 2.414 -9.054 9.280 1.00 0.00 H new ATOM 0 HA LYS A 98 2.420 -9.524 6.425 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.690 -11.379 7.631 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.851 -10.413 8.828 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -1.054 -10.171 7.515 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.180 -10.369 6.009 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.327 -12.681 7.946 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.714 -12.317 6.939 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -0.282 -12.470 4.907 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.108 -12.827 5.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.140 -14.840 5.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.010 -14.833 6.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.358 -14.487 5.726 1.00 0.00 H new ATOM 636 N ALA A 99 0.638 -8.031 5.550 1.00 0.00 N ATOM 637 CA ALA A 99 -0.286 -7.040 5.014 1.00 0.00 C ATOM 638 C ALA A 99 -1.735 -7.465 5.230 1.00 0.00 C ATOM 639 O ALA A 99 -2.062 -8.649 5.157 1.00 0.00 O ATOM 640 CB ALA A 99 -0.016 -6.813 3.533 1.00 0.00 C ATOM 0 H ALA A 99 1.126 -8.579 4.842 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.126 -6.104 5.550 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.714 -6.070 3.146 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.005 -6.456 3.400 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -0.146 -7.750 2.992 1.00 0.00 H new ATOM 646 N GLY A 100 -2.599 -6.491 5.498 1.00 0.00 N ATOM 647 CA GLY A 100 -4.002 -6.785 5.723 1.00 0.00 C ATOM 648 C GLY A 100 -4.756 -7.035 4.431 1.00 0.00 C ATOM 649 O GLY A 100 -5.306 -8.116 4.226 1.00 0.00 O ATOM 0 H GLY A 100 -2.352 -5.503 5.563 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.088 -7.661 6.366 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.464 -5.953 6.255 1.00 0.00 H new ATOM 653 N GLU A 101 -4.782 -6.031 3.560 1.00 0.00 N ATOM 654 CA GLU A 101 -5.477 -6.147 2.283 1.00 0.00 C ATOM 655 C GLU A 101 -4.495 -6.047 1.119 1.00 0.00 C ATOM 656 O GLU A 101 -3.778 -5.056 0.980 1.00 0.00 O ATOM 657 CB GLU A 101 -6.546 -5.060 2.158 1.00 0.00 C ATOM 658 CG GLU A 101 -7.416 -5.201 0.920 1.00 0.00 C ATOM 659 CD GLU A 101 -8.079 -3.896 0.521 1.00 0.00 C ATOM 660 OE1 GLU A 101 -7.507 -2.826 0.817 1.00 0.00 O ATOM 661 OE2 GLU A 101 -9.169 -3.946 -0.086 1.00 0.00 O ATOM 0 H GLU A 101 -4.331 -5.130 3.715 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.958 -7.124 2.247 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.182 -5.084 3.043 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -6.060 -4.085 2.141 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -6.807 -5.563 0.092 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.183 -5.953 1.104 1.00 0.00 H new ATOM 668 N VAL A 102 -4.468 -7.081 0.284 1.00 0.00 N ATOM 669 CA VAL A 102 -3.576 -7.111 -0.868 1.00 0.00 C ATOM 670 C VAL A 102 -4.346 -7.404 -2.151 1.00 0.00 C ATOM 671 O VAL A 102 -4.863 -8.505 -2.340 1.00 0.00 O ATOM 672 CB VAL A 102 -2.469 -8.167 -0.694 1.00 0.00 C ATOM 673 CG1 VAL A 102 -1.733 -8.392 -2.006 1.00 0.00 C ATOM 674 CG2 VAL A 102 -1.502 -7.749 0.404 1.00 0.00 C ATOM 0 H VAL A 102 -5.054 -7.909 0.384 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.118 -6.125 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.933 -9.108 -0.400 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.955 -9.141 -1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -2.436 -8.739 -2.763 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.280 -7.457 -2.334 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.726 -8.507 0.513 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.044 -6.796 0.141 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.043 -7.645 1.345 1.00 0.00 H new ATOM 684 N PHE A 103 -4.416 -6.411 -3.032 1.00 0.00 N ATOM 685 CA PHE A 103 -5.123 -6.562 -4.299 1.00 0.00 C ATOM 686 C PHE A 103 -4.290 -6.017 -5.455 1.00 0.00 C ATOM 687 O PHE A 103 -4.084 -4.808 -5.570 1.00 0.00 O ATOM 688 CB PHE A 103 -6.472 -5.842 -4.243 1.00 0.00 C ATOM 689 CG PHE A 103 -7.516 -6.584 -3.460 1.00 0.00 C ATOM 690 CD1 PHE A 103 -7.861 -7.883 -3.796 1.00 0.00 C ATOM 691 CD2 PHE A 103 -8.154 -5.983 -2.386 1.00 0.00 C ATOM 692 CE1 PHE A 103 -8.821 -8.569 -3.077 1.00 0.00 C ATOM 693 CE2 PHE A 103 -9.114 -6.664 -1.663 1.00 0.00 C ATOM 694 CZ PHE A 103 -9.449 -7.958 -2.010 1.00 0.00 C ATOM 0 H PHE A 103 -3.992 -5.494 -2.892 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.293 -7.625 -4.467 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.330 -4.856 -3.801 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.834 -5.686 -5.259 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.374 -8.365 -4.630 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.897 -4.970 -2.111 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.080 -9.582 -3.349 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.602 -6.185 -0.827 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.201 -8.491 -1.448 1.00 0.00 H new ATOM 704 N ILE A 104 -3.812 -6.917 -6.308 1.00 0.00 N ATOM 705 CA ILE A 104 -3.002 -6.527 -7.455 1.00 0.00 C ATOM 706 C ILE A 104 -3.798 -6.633 -8.752 1.00 0.00 C ATOM 707 O ILE A 104 -4.275 -7.709 -9.114 1.00 0.00 O ATOM 708 CB ILE A 104 -1.735 -7.394 -7.571 1.00 0.00 C ATOM 709 CG1 ILE A 104 -0.836 -7.188 -6.350 1.00 0.00 C ATOM 710 CG2 ILE A 104 -0.983 -7.065 -8.851 1.00 0.00 C ATOM 711 CD1 ILE A 104 0.195 -8.280 -6.167 1.00 0.00 C ATOM 0 H ILE A 104 -3.972 -7.921 -6.226 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.708 -5.489 -7.295 1.00 0.00 H new ATOM 0 HB ILE A 104 -2.032 -8.442 -7.607 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.325 -6.229 -6.443 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.458 -7.133 -5.456 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.090 -7.686 -8.918 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -1.625 -7.259 -9.710 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.694 -6.014 -8.843 1.00 0.00 H new ATOM 0 HD11 ILE A 104 0.796 -8.068 -5.283 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.309 -9.239 -6.042 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.841 -8.321 -7.044 1.00 0.00 H new ATOM 723 N HIS A 105 -3.935 -5.510 -9.449 1.00 0.00 N ATOM 724 CA HIS A 105 -4.671 -5.477 -10.708 1.00 0.00 C ATOM 725 C HIS A 105 -3.719 -5.322 -11.890 1.00 0.00 C ATOM 726 O HIS A 105 -3.001 -4.328 -11.997 1.00 0.00 O ATOM 727 CB HIS A 105 -5.684 -4.332 -10.701 1.00 0.00 C ATOM 728 CG HIS A 105 -6.728 -4.449 -11.769 1.00 0.00 C ATOM 729 ND1 HIS A 105 -7.238 -3.361 -12.446 1.00 0.00 N ATOM 730 CD2 HIS A 105 -7.357 -5.534 -12.277 1.00 0.00 C ATOM 731 CE1 HIS A 105 -8.136 -3.772 -13.323 1.00 0.00 C ATOM 732 NE2 HIS A 105 -8.227 -5.087 -13.241 1.00 0.00 N ATOM 0 H HIS A 105 -3.546 -4.611 -9.164 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.203 -6.422 -10.814 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -6.174 -4.297 -9.728 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -5.154 -3.388 -10.825 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -7.203 -6.561 -11.980 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -8.700 -3.140 -13.993 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -8.843 -5.675 -13.802 1.00 0.00 H new ATOM 740 N LYS A 106 -3.718 -6.313 -12.776 1.00 0.00 N ATOM 741 CA LYS A 106 -2.855 -6.288 -13.951 1.00 0.00 C ATOM 742 C LYS A 106 -3.520 -5.535 -15.099 1.00 0.00 C ATOM 743 O LYS A 106 -2.900 -4.684 -15.737 1.00 0.00 O ATOM 744 CB LYS A 106 -2.516 -7.715 -14.390 1.00 0.00 C ATOM 745 CG LYS A 106 -1.411 -7.784 -15.431 1.00 0.00 C ATOM 746 CD LYS A 106 -1.169 -9.212 -15.891 1.00 0.00 C ATOM 747 CE LYS A 106 -0.644 -9.255 -17.318 1.00 0.00 C ATOM 748 NZ LYS A 106 -0.704 -10.629 -17.889 1.00 0.00 N ATOM 0 H LYS A 106 -4.306 -7.144 -12.702 1.00 0.00 H new ATOM 0 HA LYS A 106 -1.935 -5.768 -13.685 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -2.217 -8.294 -13.516 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.413 -8.185 -14.793 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -1.677 -7.165 -16.288 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -0.491 -7.374 -15.015 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -0.454 -9.694 -15.224 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.098 -9.779 -15.826 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.228 -8.577 -17.941 1.00 0.00 H new ATOM 0 HE3 LYS A 106 0.386 -8.898 -17.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.338 -10.617 -18.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -0.126 -11.271 -17.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.690 -10.960 -17.894 1.00 0.00 H new ATOM 762 N ASP A 107 -4.784 -5.854 -15.355 1.00 0.00 N ATOM 763 CA ASP A 107 -5.534 -5.205 -16.424 1.00 0.00 C ATOM 764 C ASP A 107 -5.142 -3.736 -16.549 1.00 0.00 C ATOM 765 O ASP A 107 -4.692 -3.290 -17.605 1.00 0.00 O ATOM 766 CB ASP A 107 -7.037 -5.325 -16.167 1.00 0.00 C ATOM 767 CG ASP A 107 -7.850 -5.243 -17.444 1.00 0.00 C ATOM 768 OD1 ASP A 107 -7.646 -6.095 -18.333 1.00 0.00 O ATOM 769 OD2 ASP A 107 -8.692 -4.326 -17.554 1.00 0.00 O ATOM 0 H ASP A 107 -5.310 -6.558 -14.837 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.292 -5.707 -17.361 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.243 -6.272 -15.668 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.351 -4.532 -15.488 1.00 0.00 H new ATOM 774 N LYS A 108 -5.317 -2.988 -15.465 1.00 0.00 N ATOM 775 CA LYS A 108 -4.982 -1.569 -15.452 1.00 0.00 C ATOM 776 C LYS A 108 -3.513 -1.360 -15.098 1.00 0.00 C ATOM 777 O LYS A 108 -2.925 -0.331 -15.428 1.00 0.00 O ATOM 778 CB LYS A 108 -5.869 -0.824 -14.452 1.00 0.00 C ATOM 779 CG LYS A 108 -7.265 -0.535 -14.976 1.00 0.00 C ATOM 780 CD LYS A 108 -8.227 -0.203 -13.847 1.00 0.00 C ATOM 781 CE LYS A 108 -9.673 -0.420 -14.265 1.00 0.00 C ATOM 782 NZ LYS A 108 -10.541 -0.759 -13.103 1.00 0.00 N ATOM 0 H LYS A 108 -5.689 -3.341 -14.583 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.157 -1.171 -16.451 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -5.948 -1.414 -13.539 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -5.389 0.117 -14.183 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -7.226 0.298 -15.678 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -7.634 -1.400 -15.527 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -8.001 -0.824 -12.980 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -8.087 0.834 -13.541 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -10.050 0.481 -14.750 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -9.722 -1.222 -15.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -11.519 -0.899 -13.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -10.197 -1.632 -12.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -10.515 0.018 -12.412 1.00 0.00 H new ATOM 796 N GLY A 109 -2.925 -2.345 -14.425 1.00 0.00 N ATOM 797 CA GLY A 109 -1.529 -2.249 -14.039 1.00 0.00 C ATOM 798 C GLY A 109 -1.332 -1.445 -12.769 1.00 0.00 C ATOM 799 O GLY A 109 -0.468 -0.570 -12.708 1.00 0.00 O ATOM 0 H GLY A 109 -3.390 -3.207 -14.140 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.125 -3.251 -13.897 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.962 -1.789 -14.848 1.00 0.00 H new ATOM 803 N PHE A 110 -2.136 -1.740 -11.753 1.00 0.00 N ATOM 804 CA PHE A 110 -2.049 -1.036 -10.479 1.00 0.00 C ATOM 805 C PHE A 110 -2.375 -1.970 -9.318 1.00 0.00 C ATOM 806 O PHE A 110 -3.029 -2.997 -9.498 1.00 0.00 O ATOM 807 CB PHE A 110 -3.000 0.162 -10.468 1.00 0.00 C ATOM 808 CG PHE A 110 -2.509 1.326 -11.280 1.00 0.00 C ATOM 809 CD1 PHE A 110 -1.663 2.270 -10.721 1.00 0.00 C ATOM 810 CD2 PHE A 110 -2.892 1.476 -12.603 1.00 0.00 C ATOM 811 CE1 PHE A 110 -1.209 3.342 -11.466 1.00 0.00 C ATOM 812 CE2 PHE A 110 -2.441 2.546 -13.353 1.00 0.00 C ATOM 813 CZ PHE A 110 -1.598 3.479 -12.784 1.00 0.00 C ATOM 0 H PHE A 110 -2.856 -2.462 -11.787 1.00 0.00 H new ATOM 0 HA PHE A 110 -1.026 -0.680 -10.359 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.972 -0.152 -10.849 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -3.151 0.486 -9.438 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.355 2.167 -9.691 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.551 0.748 -13.054 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.551 4.072 -11.018 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -2.748 2.652 -14.383 1.00 0.00 H new ATOM 0 HZ PHE A 110 -1.243 4.315 -13.369 1.00 0.00 H new ATOM 823 N GLY A 111 -1.914 -1.606 -8.125 1.00 0.00 N ATOM 824 CA GLY A 111 -2.165 -2.422 -6.952 1.00 0.00 C ATOM 825 C GLY A 111 -2.300 -1.595 -5.689 1.00 0.00 C ATOM 826 O GLY A 111 -1.805 -0.469 -5.619 1.00 0.00 O ATOM 0 H GLY A 111 -1.371 -0.760 -7.950 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.077 -3.000 -7.103 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.351 -3.137 -6.829 1.00 0.00 H new ATOM 830 N PHE A 112 -2.973 -2.152 -4.687 1.00 0.00 N ATOM 831 CA PHE A 112 -3.174 -1.457 -3.421 1.00 0.00 C ATOM 832 C PHE A 112 -2.933 -2.395 -2.242 1.00 0.00 C ATOM 833 O PHE A 112 -3.348 -3.554 -2.262 1.00 0.00 O ATOM 834 CB PHE A 112 -4.590 -0.883 -3.349 1.00 0.00 C ATOM 835 CG PHE A 112 -5.008 -0.160 -4.598 1.00 0.00 C ATOM 836 CD1 PHE A 112 -5.132 -0.840 -5.799 1.00 0.00 C ATOM 837 CD2 PHE A 112 -5.276 1.199 -4.571 1.00 0.00 C ATOM 838 CE1 PHE A 112 -5.517 -0.178 -6.950 1.00 0.00 C ATOM 839 CE2 PHE A 112 -5.662 1.866 -5.719 1.00 0.00 C ATOM 840 CZ PHE A 112 -5.781 1.177 -6.910 1.00 0.00 C ATOM 0 H PHE A 112 -3.388 -3.083 -4.728 1.00 0.00 H new ATOM 0 HA PHE A 112 -2.455 -0.640 -3.366 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.293 -1.694 -3.156 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -4.653 -0.198 -2.504 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -4.925 -1.899 -5.836 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -5.182 1.743 -3.643 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -5.611 -0.720 -7.879 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -5.870 2.925 -5.684 1.00 0.00 H new ATOM 0 HZ PHE A 112 -6.080 1.697 -7.808 1.00 0.00 H new ATOM 850 N ILE A 113 -2.260 -1.885 -1.216 1.00 0.00 N ATOM 851 CA ILE A 113 -1.964 -2.676 -0.028 1.00 0.00 C ATOM 852 C ILE A 113 -2.376 -1.937 1.241 1.00 0.00 C ATOM 853 O ILE A 113 -2.052 -0.763 1.421 1.00 0.00 O ATOM 854 CB ILE A 113 -0.466 -3.024 0.058 1.00 0.00 C ATOM 855 CG1 ILE A 113 -0.211 -3.993 1.214 1.00 0.00 C ATOM 856 CG2 ILE A 113 0.363 -1.760 0.226 1.00 0.00 C ATOM 857 CD1 ILE A 113 0.995 -4.881 1.004 1.00 0.00 C ATOM 0 H ILE A 113 -1.909 -0.928 -1.184 1.00 0.00 H new ATOM 0 HA ILE A 113 -2.539 -3.598 -0.112 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.167 -3.510 -0.871 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.076 -3.422 2.133 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.093 -4.619 1.354 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.419 -2.023 0.285 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.200 -1.102 -0.628 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.065 -1.248 1.141 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.115 -5.541 1.863 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.854 -5.479 0.103 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.887 -4.264 0.894 1.00 0.00 H new ATOM 869 N ARG A 114 -3.091 -2.634 2.119 1.00 0.00 N ATOM 870 CA ARG A 114 -3.547 -2.044 3.372 1.00 0.00 C ATOM 871 C ARG A 114 -2.836 -2.680 4.562 1.00 0.00 C ATOM 872 O ARG A 114 -2.969 -3.880 4.810 1.00 0.00 O ATOM 873 CB ARG A 114 -5.061 -2.213 3.518 1.00 0.00 C ATOM 874 CG ARG A 114 -5.685 -1.260 4.524 1.00 0.00 C ATOM 875 CD ARG A 114 -6.936 -1.854 5.152 1.00 0.00 C ATOM 876 NE ARG A 114 -6.665 -3.127 5.814 1.00 0.00 N ATOM 877 CZ ARG A 114 -6.194 -3.226 7.052 1.00 0.00 C ATOM 878 NH1 ARG A 114 -5.943 -2.133 7.758 1.00 0.00 N ATOM 879 NH2 ARG A 114 -5.973 -4.421 7.585 1.00 0.00 N ATOM 0 H ARG A 114 -3.367 -3.607 1.986 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.307 -0.981 3.353 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.531 -2.061 2.546 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.276 -3.238 3.819 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.960 -1.027 5.304 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -5.935 -0.321 4.031 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -7.348 -1.150 5.875 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -7.694 -2.000 4.382 1.00 0.00 H new ATOM 0 HE ARG A 114 -6.847 -3.987 5.297 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -6.111 -1.213 7.351 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.581 -2.212 8.708 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -6.165 -5.264 7.044 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -5.611 -4.496 8.536 1.00 0.00 H new ATOM 893 N LEU A 115 -2.081 -1.870 5.296 1.00 0.00 N ATOM 894 CA LEU A 115 -1.348 -2.353 6.461 1.00 0.00 C ATOM 895 C LEU A 115 -2.196 -2.239 7.724 1.00 0.00 C ATOM 896 O LEU A 115 -3.353 -1.823 7.670 1.00 0.00 O ATOM 897 CB LEU A 115 -0.048 -1.566 6.633 1.00 0.00 C ATOM 898 CG LEU A 115 0.771 -1.336 5.362 1.00 0.00 C ATOM 899 CD1 LEU A 115 1.976 -0.457 5.655 1.00 0.00 C ATOM 900 CD2 LEU A 115 1.209 -2.664 4.763 1.00 0.00 C ATOM 0 H LEU A 115 -1.960 -0.875 5.105 1.00 0.00 H new ATOM 0 HA LEU A 115 -1.110 -3.404 6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.289 -0.595 7.066 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.578 -2.091 7.355 1.00 0.00 H new ATOM 0 HG LEU A 115 0.142 -0.822 4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.547 -0.305 4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.639 0.507 6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.608 -0.942 6.399 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.791 -2.481 3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.821 -3.205 5.485 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.330 -3.259 4.515 1.00 0.00 H new ATOM 912 N GLU A 116 -1.611 -2.609 8.859 1.00 0.00 N ATOM 913 CA GLU A 116 -2.313 -2.547 10.135 1.00 0.00 C ATOM 914 C GLU A 116 -2.118 -1.186 10.797 1.00 0.00 C ATOM 915 O GLU A 116 -3.065 -0.414 10.951 1.00 0.00 O ATOM 916 CB GLU A 116 -1.822 -3.655 11.068 1.00 0.00 C ATOM 917 CG GLU A 116 -2.584 -3.729 12.380 1.00 0.00 C ATOM 918 CD GLU A 116 -2.300 -5.004 13.149 1.00 0.00 C ATOM 919 OE1 GLU A 116 -1.142 -5.194 13.578 1.00 0.00 O ATOM 920 OE2 GLU A 116 -3.235 -5.813 13.323 1.00 0.00 O ATOM 0 H GLU A 116 -0.653 -2.955 8.921 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.376 -2.690 9.942 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -1.905 -4.613 10.555 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -0.765 -3.497 11.280 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.320 -2.870 12.998 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.653 -3.661 12.179 1.00 0.00 H new ATOM 927 N THR A 117 -0.880 -0.897 11.189 1.00 0.00 N ATOM 928 CA THR A 117 -0.559 0.368 11.837 1.00 0.00 C ATOM 929 C THR A 117 -0.296 1.461 10.807 1.00 0.00 C ATOM 930 O THR A 117 -0.106 1.179 9.624 1.00 0.00 O ATOM 931 CB THR A 117 0.672 0.234 12.753 1.00 0.00 C ATOM 932 OG1 THR A 117 1.820 -0.131 11.980 1.00 0.00 O ATOM 933 CG2 THR A 117 0.430 -0.807 13.835 1.00 0.00 C ATOM 0 H THR A 117 -0.084 -1.523 11.068 1.00 0.00 H new ATOM 0 HA THR A 117 -1.423 0.642 12.442 1.00 0.00 H new ATOM 0 HB THR A 117 0.849 1.197 13.231 1.00 0.00 H new ATOM 0 HG1 THR A 117 2.370 -0.763 12.489 1.00 0.00 H new ATOM 0 HG21 THR A 117 1.313 -0.884 14.470 1.00 0.00 H new ATOM 0 HG22 THR A 117 -0.427 -0.511 14.440 1.00 0.00 H new ATOM 0 HG23 THR A 117 0.230 -1.773 13.372 1.00 0.00 H new ATOM 941 N ARG A 118 -0.285 2.709 11.265 1.00 0.00 N ATOM 942 CA ARG A 118 -0.045 3.844 10.383 1.00 0.00 C ATOM 943 C ARG A 118 1.450 4.123 10.249 1.00 0.00 C ATOM 944 O ARG A 118 1.940 4.432 9.163 1.00 0.00 O ATOM 945 CB ARG A 118 -0.761 5.088 10.911 1.00 0.00 C ATOM 946 CG ARG A 118 -0.621 6.302 10.007 1.00 0.00 C ATOM 947 CD ARG A 118 0.616 7.115 10.354 1.00 0.00 C ATOM 948 NE ARG A 118 0.541 7.680 11.699 1.00 0.00 N ATOM 949 CZ ARG A 118 1.381 8.601 12.157 1.00 0.00 C ATOM 950 NH1 ARG A 118 2.355 9.059 11.383 1.00 0.00 N ATOM 951 NH2 ARG A 118 1.248 9.067 13.393 1.00 0.00 N ATOM 0 H ARG A 118 -0.440 2.959 12.242 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.440 3.596 9.398 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -1.819 4.861 11.038 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -0.366 5.333 11.897 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -0.565 5.979 8.968 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -1.508 6.929 10.099 1.00 0.00 H new ATOM 0 HD2 ARG A 118 1.500 6.482 10.276 1.00 0.00 H new ATOM 0 HD3 ARG A 118 0.736 7.920 9.629 1.00 0.00 H new ATOM 0 HE ARG A 118 -0.197 7.349 12.320 1.00 0.00 H new ATOM 0 HH11 ARG A 118 2.461 8.704 10.433 1.00 0.00 H new ATOM 0 HH12 ARG A 118 2.998 9.766 11.738 1.00 0.00 H new ATOM 0 HH21 ARG A 118 0.500 8.718 13.992 1.00 0.00 H new ATOM 0 HH22 ARG A 118 1.894 9.774 13.744 1.00 0.00 H new ATOM 965 N THR A 119 2.169 4.011 11.362 1.00 0.00 N ATOM 966 CA THR A 119 3.606 4.252 11.370 1.00 0.00 C ATOM 967 C THR A 119 4.311 3.408 10.314 1.00 0.00 C ATOM 968 O THR A 119 5.084 3.924 9.505 1.00 0.00 O ATOM 969 CB THR A 119 4.219 3.947 12.749 1.00 0.00 C ATOM 970 OG1 THR A 119 3.449 4.578 13.778 1.00 0.00 O ATOM 971 CG2 THR A 119 5.661 4.429 12.820 1.00 0.00 C ATOM 0 H THR A 119 1.779 3.755 12.269 1.00 0.00 H new ATOM 0 HA THR A 119 3.751 5.308 11.142 1.00 0.00 H new ATOM 0 HB THR A 119 4.206 2.867 12.896 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.845 4.378 14.652 1.00 0.00 H new ATOM 0 HG21 THR A 119 6.072 4.202 13.804 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.251 3.925 12.055 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.693 5.506 12.652 1.00 0.00 H new ATOM 979 N LEU A 120 4.041 2.107 10.327 1.00 0.00 N ATOM 980 CA LEU A 120 4.650 1.190 9.369 1.00 0.00 C ATOM 981 C LEU A 120 4.432 1.673 7.939 1.00 0.00 C ATOM 982 O LEU A 120 5.349 1.649 7.119 1.00 0.00 O ATOM 983 CB LEU A 120 4.069 -0.215 9.539 1.00 0.00 C ATOM 984 CG LEU A 120 4.527 -0.984 10.779 1.00 0.00 C ATOM 985 CD1 LEU A 120 3.823 -2.330 10.861 1.00 0.00 C ATOM 986 CD2 LEU A 120 6.037 -1.171 10.763 1.00 0.00 C ATOM 0 H LEU A 120 3.405 1.664 10.990 1.00 0.00 H new ATOM 0 HA LEU A 120 5.722 1.160 9.563 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.982 -0.137 9.565 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.325 -0.802 8.657 1.00 0.00 H new ATOM 0 HG LEU A 120 4.262 -0.403 11.662 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.161 -2.864 11.749 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.746 -2.174 10.919 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.057 -2.918 9.973 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.345 -1.720 11.653 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.325 -1.731 9.873 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.524 -0.196 10.752 1.00 0.00 H new ATOM 998 N ALA A 121 3.212 2.113 7.648 1.00 0.00 N ATOM 999 CA ALA A 121 2.875 2.606 6.318 1.00 0.00 C ATOM 1000 C ALA A 121 3.801 3.743 5.903 1.00 0.00 C ATOM 1001 O ALA A 121 4.380 3.719 4.817 1.00 0.00 O ATOM 1002 CB ALA A 121 1.424 3.062 6.276 1.00 0.00 C ATOM 0 H ALA A 121 2.441 2.138 8.315 1.00 0.00 H new ATOM 0 HA ALA A 121 3.008 1.788 5.610 1.00 0.00 H new ATOM 0 HB1 ALA A 121 1.186 3.428 5.277 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.772 2.223 6.520 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.273 3.862 7.001 1.00 0.00 H new ATOM 1008 N GLU A 122 3.937 4.738 6.774 1.00 0.00 N ATOM 1009 CA GLU A 122 4.793 5.886 6.495 1.00 0.00 C ATOM 1010 C GLU A 122 6.203 5.435 6.124 1.00 0.00 C ATOM 1011 O GLU A 122 6.724 5.798 5.070 1.00 0.00 O ATOM 1012 CB GLU A 122 4.845 6.817 7.708 1.00 0.00 C ATOM 1013 CG GLU A 122 3.556 7.588 7.940 1.00 0.00 C ATOM 1014 CD GLU A 122 3.448 8.821 7.064 1.00 0.00 C ATOM 1015 OE1 GLU A 122 4.501 9.365 6.671 1.00 0.00 O ATOM 1016 OE2 GLU A 122 2.309 9.242 6.772 1.00 0.00 O ATOM 0 H GLU A 122 3.466 4.773 7.678 1.00 0.00 H new ATOM 0 HA GLU A 122 4.369 6.427 5.649 1.00 0.00 H new ATOM 0 HB2 GLU A 122 5.072 6.229 8.597 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.663 7.525 7.577 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.706 6.934 7.746 1.00 0.00 H new ATOM 0 HG3 GLU A 122 3.498 7.885 8.987 1.00 0.00 H new ATOM 1023 N ILE A 123 6.813 4.643 6.999 1.00 0.00 N ATOM 1024 CA ILE A 123 8.162 4.143 6.764 1.00 0.00 C ATOM 1025 C ILE A 123 8.254 3.419 5.425 1.00 0.00 C ATOM 1026 O ILE A 123 9.110 3.730 4.598 1.00 0.00 O ATOM 1027 CB ILE A 123 8.611 3.186 7.884 1.00 0.00 C ATOM 1028 CG1 ILE A 123 8.620 3.912 9.231 1.00 0.00 C ATOM 1029 CG2 ILE A 123 9.987 2.616 7.574 1.00 0.00 C ATOM 1030 CD1 ILE A 123 8.753 2.983 10.418 1.00 0.00 C ATOM 0 H ILE A 123 6.395 4.334 7.877 1.00 0.00 H new ATOM 0 HA ILE A 123 8.822 5.010 6.752 1.00 0.00 H new ATOM 0 HB ILE A 123 7.902 2.360 7.942 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.444 4.626 9.244 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.699 4.486 9.331 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.290 1.942 8.375 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.950 2.068 6.633 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.708 3.430 7.492 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.752 3.567 11.339 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.915 2.285 10.430 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.687 2.427 10.342 1.00 0.00 H new ATOM 1042 N ALA A 124 7.365 2.453 5.219 1.00 0.00 N ATOM 1043 CA ALA A 124 7.344 1.687 3.979 1.00 0.00 C ATOM 1044 C ALA A 124 6.978 2.573 2.793 1.00 0.00 C ATOM 1045 O ALA A 124 7.257 2.234 1.642 1.00 0.00 O ATOM 1046 CB ALA A 124 6.367 0.525 4.093 1.00 0.00 C ATOM 0 H ALA A 124 6.650 2.182 5.894 1.00 0.00 H new ATOM 0 HA ALA A 124 8.345 1.291 3.808 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.361 -0.039 3.160 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.673 -0.129 4.910 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.366 0.909 4.291 1.00 0.00 H new ATOM 1052 N LYS A 125 6.352 3.709 3.080 1.00 0.00 N ATOM 1053 CA LYS A 125 5.949 4.645 2.037 1.00 0.00 C ATOM 1054 C LYS A 125 7.159 5.370 1.459 1.00 0.00 C ATOM 1055 O LYS A 125 7.348 5.413 0.243 1.00 0.00 O ATOM 1056 CB LYS A 125 4.950 5.662 2.594 1.00 0.00 C ATOM 1057 CG LYS A 125 4.273 6.500 1.523 1.00 0.00 C ATOM 1058 CD LYS A 125 5.163 7.644 1.066 1.00 0.00 C ATOM 1059 CE LYS A 125 4.342 8.813 0.544 1.00 0.00 C ATOM 1060 NZ LYS A 125 5.097 10.095 0.613 1.00 0.00 N ATOM 0 H LYS A 125 6.113 4.004 4.027 1.00 0.00 H new ATOM 0 HA LYS A 125 5.473 4.077 1.238 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.187 5.134 3.166 1.00 0.00 H new ATOM 0 HB3 LYS A 125 5.467 6.324 3.288 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.023 5.869 0.670 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.336 6.899 1.910 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.785 7.977 1.897 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.836 7.293 0.284 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.049 8.619 -0.488 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.424 8.900 1.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.504 10.867 0.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.355 10.293 1.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.960 10.021 0.038 1.00 0.00 H new ATOM 1074 N VAL A 126 7.979 5.939 2.338 1.00 0.00 N ATOM 1075 CA VAL A 126 9.173 6.660 1.914 1.00 0.00 C ATOM 1076 C VAL A 126 10.212 5.709 1.333 1.00 0.00 C ATOM 1077 O VAL A 126 10.939 6.061 0.405 1.00 0.00 O ATOM 1078 CB VAL A 126 9.803 7.439 3.085 1.00 0.00 C ATOM 1079 CG1 VAL A 126 11.130 8.053 2.665 1.00 0.00 C ATOM 1080 CG2 VAL A 126 8.846 8.509 3.588 1.00 0.00 C ATOM 0 H VAL A 126 7.838 5.914 3.348 1.00 0.00 H new ATOM 0 HA VAL A 126 8.860 7.365 1.144 1.00 0.00 H new ATOM 0 HB VAL A 126 9.995 6.743 3.901 1.00 0.00 H new ATOM 0 HG11 VAL A 126 11.560 8.599 3.505 1.00 0.00 H new ATOM 0 HG12 VAL A 126 11.815 7.263 2.357 1.00 0.00 H new ATOM 0 HG13 VAL A 126 10.967 8.737 1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.307 9.050 4.415 1.00 0.00 H new ATOM 0 HG22 VAL A 126 8.621 9.205 2.780 1.00 0.00 H new ATOM 0 HG23 VAL A 126 7.923 8.040 3.930 1.00 0.00 H new ATOM 1090 N GLU A 127 10.277 4.502 1.886 1.00 0.00 N ATOM 1091 CA GLU A 127 11.228 3.499 1.422 1.00 0.00 C ATOM 1092 C GLU A 127 10.816 2.946 0.061 1.00 0.00 C ATOM 1093 O GLU A 127 11.544 3.081 -0.923 1.00 0.00 O ATOM 1094 CB GLU A 127 11.337 2.359 2.436 1.00 0.00 C ATOM 1095 CG GLU A 127 12.408 2.581 3.490 1.00 0.00 C ATOM 1096 CD GLU A 127 13.801 2.258 2.985 1.00 0.00 C ATOM 1097 OE1 GLU A 127 14.360 3.076 2.225 1.00 0.00 O ATOM 1098 OE2 GLU A 127 14.331 1.188 3.348 1.00 0.00 O ATOM 0 H GLU A 127 9.682 4.195 2.656 1.00 0.00 H new ATOM 0 HA GLU A 127 12.201 3.979 1.320 1.00 0.00 H new ATOM 0 HB2 GLU A 127 10.374 2.231 2.930 1.00 0.00 H new ATOM 0 HB3 GLU A 127 11.549 1.431 1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 127 12.377 3.619 3.820 1.00 0.00 H new ATOM 0 HG3 GLU A 127 12.189 1.963 4.361 1.00 0.00 H new ATOM 1105 N LEU A 128 9.643 2.324 0.012 1.00 0.00 N ATOM 1106 CA LEU A 128 9.132 1.750 -1.228 1.00 0.00 C ATOM 1107 C LEU A 128 8.890 2.836 -2.271 1.00 0.00 C ATOM 1108 O LEU A 128 8.944 2.578 -3.474 1.00 0.00 O ATOM 1109 CB LEU A 128 7.835 0.984 -0.961 1.00 0.00 C ATOM 1110 CG LEU A 128 7.934 -0.180 0.026 1.00 0.00 C ATOM 1111 CD1 LEU A 128 6.557 -0.545 0.559 1.00 0.00 C ATOM 1112 CD2 LEU A 128 8.590 -1.384 -0.632 1.00 0.00 C ATOM 0 H LEU A 128 9.028 2.204 0.817 1.00 0.00 H new ATOM 0 HA LEU A 128 9.881 1.060 -1.617 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.091 1.688 -0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 128 7.462 0.599 -1.910 1.00 0.00 H new ATOM 0 HG LEU A 128 8.555 0.132 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 128 6.646 -1.375 1.260 1.00 0.00 H new ATOM 0 HD12 LEU A 128 6.124 0.316 1.069 1.00 0.00 H new ATOM 0 HD13 LEU A 128 5.912 -0.838 -0.270 1.00 0.00 H new ATOM 0 HD21 LEU A 128 8.652 -2.202 0.086 1.00 0.00 H new ATOM 0 HD22 LEU A 128 7.996 -1.698 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.593 -1.116 -0.964 1.00 0.00 H new ATOM 1124 N ASP A 129 8.624 4.050 -1.803 1.00 0.00 N ATOM 1125 CA ASP A 129 8.377 5.176 -2.696 1.00 0.00 C ATOM 1126 C ASP A 129 9.424 5.232 -3.804 1.00 0.00 C ATOM 1127 O ASP A 129 10.617 5.064 -3.553 1.00 0.00 O ATOM 1128 CB ASP A 129 8.379 6.488 -1.909 1.00 0.00 C ATOM 1129 CG ASP A 129 8.829 7.667 -2.749 1.00 0.00 C ATOM 1130 OD1 ASP A 129 8.005 8.187 -3.530 1.00 0.00 O ATOM 1131 OD2 ASP A 129 10.005 8.068 -2.627 1.00 0.00 O ATOM 0 H ASP A 129 8.574 4.280 -0.810 1.00 0.00 H new ATOM 0 HA ASP A 129 7.398 5.037 -3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.377 6.680 -1.526 1.00 0.00 H new ATOM 0 HB3 ASP A 129 9.037 6.389 -1.045 1.00 0.00 H new ATOM 1136 N ASN A 130 8.969 5.468 -5.030 1.00 0.00 N ATOM 1137 CA ASN A 130 9.866 5.544 -6.177 1.00 0.00 C ATOM 1138 C ASN A 130 10.991 4.519 -6.056 1.00 0.00 C ATOM 1139 O ASN A 130 12.169 4.863 -6.146 1.00 0.00 O ATOM 1140 CB ASN A 130 10.454 6.951 -6.299 1.00 0.00 C ATOM 1141 CG ASN A 130 9.544 7.893 -7.062 1.00 0.00 C ATOM 1142 OD1 ASN A 130 8.587 7.464 -7.706 1.00 0.00 O ATOM 1143 ND2 ASN A 130 9.841 9.186 -6.994 1.00 0.00 N ATOM 0 H ASN A 130 7.984 5.610 -5.255 1.00 0.00 H new ATOM 0 HA ASN A 130 9.289 5.320 -7.074 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.636 7.354 -5.303 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.420 6.896 -6.802 1.00 0.00 H new ATOM 0 HD21 ASN A 130 9.266 9.868 -7.488 1.00 0.00 H new ATOM 0 HD22 ASN A 130 10.644 9.497 -6.448 1.00 0.00 H new ATOM 1150 N MET A 131 10.617 3.260 -5.853 1.00 0.00 N ATOM 1151 CA MET A 131 11.594 2.185 -5.723 1.00 0.00 C ATOM 1152 C MET A 131 11.682 1.371 -7.009 1.00 0.00 C ATOM 1153 O MET A 131 10.672 0.998 -7.607 1.00 0.00 O ATOM 1154 CB MET A 131 11.226 1.272 -4.552 1.00 0.00 C ATOM 1155 CG MET A 131 12.069 0.009 -4.478 1.00 0.00 C ATOM 1156 SD MET A 131 11.563 -1.085 -3.137 1.00 0.00 S ATOM 1157 CE MET A 131 10.451 -2.191 -4.003 1.00 0.00 C ATOM 0 H MET A 131 9.645 2.959 -5.775 1.00 0.00 H new ATOM 0 HA MET A 131 12.568 2.635 -5.532 1.00 0.00 H new ATOM 0 HB2 MET A 131 11.336 1.827 -3.621 1.00 0.00 H new ATOM 0 HB3 MET A 131 10.175 0.994 -4.635 1.00 0.00 H new ATOM 0 HG2 MET A 131 11.999 -0.526 -5.425 1.00 0.00 H new ATOM 0 HG3 MET A 131 13.116 0.282 -4.344 1.00 0.00 H new ATOM 0 HE1 MET A 131 10.320 -3.104 -3.422 1.00 0.00 H new ATOM 0 HE2 MET A 131 9.485 -1.704 -4.137 1.00 0.00 H new ATOM 0 HE3 MET A 131 10.871 -2.439 -4.978 1.00 0.00 H new ATOM 1167 N PRO A 132 12.917 1.087 -7.448 1.00 0.00 N ATOM 1168 CA PRO A 132 13.166 0.314 -8.669 1.00 0.00 C ATOM 1169 C PRO A 132 12.778 -1.153 -8.515 1.00 0.00 C ATOM 1170 O PRO A 132 13.235 -1.833 -7.595 1.00 0.00 O ATOM 1171 CB PRO A 132 14.677 0.449 -8.873 1.00 0.00 C ATOM 1172 CG PRO A 132 15.221 0.709 -7.511 1.00 0.00 C ATOM 1173 CD PRO A 132 14.167 1.500 -6.787 1.00 0.00 C ATOM 0 HA PRO A 132 12.575 0.678 -9.509 1.00 0.00 H new ATOM 0 HB2 PRO A 132 15.101 -0.459 -9.302 1.00 0.00 H new ATOM 0 HB3 PRO A 132 14.913 1.265 -9.556 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.434 -0.225 -6.991 1.00 0.00 H new ATOM 0 HG3 PRO A 132 16.157 1.264 -7.564 1.00 0.00 H new ATOM 0 HD2 PRO A 132 14.153 1.270 -5.722 1.00 0.00 H new ATOM 0 HD3 PRO A 132 14.335 2.573 -6.880 1.00 0.00 H new ATOM 1181 N LEU A 133 11.933 -1.634 -9.420 1.00 0.00 N ATOM 1182 CA LEU A 133 11.484 -3.022 -9.384 1.00 0.00 C ATOM 1183 C LEU A 133 11.502 -3.636 -10.781 1.00 0.00 C ATOM 1184 O LEU A 133 10.779 -3.192 -11.673 1.00 0.00 O ATOM 1185 CB LEU A 133 10.075 -3.108 -8.795 1.00 0.00 C ATOM 1186 CG LEU A 133 9.455 -4.504 -8.739 1.00 0.00 C ATOM 1187 CD1 LEU A 133 10.238 -5.398 -7.789 1.00 0.00 C ATOM 1188 CD2 LEU A 133 7.995 -4.423 -8.317 1.00 0.00 C ATOM 0 H LEU A 133 11.545 -1.085 -10.187 1.00 0.00 H new ATOM 0 HA LEU A 133 12.170 -3.584 -8.751 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.100 -2.703 -7.783 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.418 -2.464 -9.380 1.00 0.00 H new ATOM 0 HG LEU A 133 9.500 -4.941 -9.737 1.00 0.00 H new ATOM 0 HD11 LEU A 133 9.782 -6.388 -7.762 1.00 0.00 H new ATOM 0 HD12 LEU A 133 11.268 -5.482 -8.135 1.00 0.00 H new ATOM 0 HD13 LEU A 133 10.225 -4.965 -6.789 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.570 -5.426 -8.283 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.926 -3.966 -7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.441 -3.819 -9.036 1.00 0.00 H new ATOM 1200 N ARG A 134 12.331 -4.659 -10.962 1.00 0.00 N ATOM 1201 CA ARG A 134 12.441 -5.334 -12.249 1.00 0.00 C ATOM 1202 C ARG A 134 12.690 -4.329 -13.370 1.00 0.00 C ATOM 1203 O ARG A 134 12.096 -4.422 -14.444 1.00 0.00 O ATOM 1204 CB ARG A 134 11.171 -6.135 -12.540 1.00 0.00 C ATOM 1205 CG ARG A 134 11.114 -7.470 -11.817 1.00 0.00 C ATOM 1206 CD ARG A 134 12.212 -8.408 -12.292 1.00 0.00 C ATOM 1207 NE ARG A 134 13.435 -8.263 -11.507 1.00 0.00 N ATOM 1208 CZ ARG A 134 14.457 -9.108 -11.575 1.00 0.00 C ATOM 1209 NH1 ARG A 134 14.405 -10.153 -12.390 1.00 0.00 N ATOM 1210 NH2 ARG A 134 15.536 -8.908 -10.829 1.00 0.00 N ATOM 0 H ARG A 134 12.936 -5.038 -10.234 1.00 0.00 H new ATOM 0 HA ARG A 134 13.289 -6.017 -12.201 1.00 0.00 H new ATOM 0 HB2 ARG A 134 10.303 -5.540 -12.255 1.00 0.00 H new ATOM 0 HB3 ARG A 134 11.100 -6.310 -13.614 1.00 0.00 H new ATOM 0 HG2 ARG A 134 11.212 -7.308 -10.744 1.00 0.00 H new ATOM 0 HG3 ARG A 134 10.141 -7.933 -11.982 1.00 0.00 H new ATOM 0 HD2 ARG A 134 11.861 -9.438 -12.229 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.429 -8.209 -13.341 1.00 0.00 H new ATOM 0 HE ARG A 134 13.508 -7.469 -10.871 1.00 0.00 H new ATOM 0 HH11 ARG A 134 13.578 -10.309 -12.967 1.00 0.00 H new ATOM 0 HH12 ARG A 134 15.192 -10.800 -12.440 1.00 0.00 H new ATOM 0 HH21 ARG A 134 15.581 -8.104 -10.202 1.00 0.00 H new ATOM 0 HH22 ARG A 134 16.320 -9.558 -10.882 1.00 0.00 H new ATOM 1224 N GLY A 135 13.571 -3.368 -13.112 1.00 0.00 N ATOM 1225 CA GLY A 135 13.882 -2.359 -14.108 1.00 0.00 C ATOM 1226 C GLY A 135 12.720 -1.422 -14.367 1.00 0.00 C ATOM 1227 O GLY A 135 12.643 -0.791 -15.422 1.00 0.00 O ATOM 0 H GLY A 135 14.075 -3.270 -12.231 1.00 0.00 H new ATOM 0 HA2 GLY A 135 14.744 -1.780 -13.777 1.00 0.00 H new ATOM 0 HA3 GLY A 135 14.165 -2.848 -15.040 1.00 0.00 H new ATOM 1231 N LYS A 136 11.810 -1.329 -13.402 1.00 0.00 N ATOM 1232 CA LYS A 136 10.645 -0.463 -13.529 1.00 0.00 C ATOM 1233 C LYS A 136 10.520 0.461 -12.322 1.00 0.00 C ATOM 1234 O LYS A 136 11.167 0.248 -11.297 1.00 0.00 O ATOM 1235 CB LYS A 136 9.373 -1.301 -13.677 1.00 0.00 C ATOM 1236 CG LYS A 136 9.470 -2.369 -14.753 1.00 0.00 C ATOM 1237 CD LYS A 136 9.013 -1.842 -16.103 1.00 0.00 C ATOM 1238 CE LYS A 136 8.577 -2.972 -17.023 1.00 0.00 C ATOM 1239 NZ LYS A 136 8.101 -2.463 -18.339 1.00 0.00 N ATOM 0 H LYS A 136 11.858 -1.844 -12.523 1.00 0.00 H new ATOM 0 HA LYS A 136 10.775 0.149 -14.422 1.00 0.00 H new ATOM 0 HB2 LYS A 136 9.149 -1.778 -12.723 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.537 -0.640 -13.907 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.499 -2.720 -14.828 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.861 -3.228 -14.471 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.186 -1.146 -15.962 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.824 -1.283 -16.570 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.411 -3.656 -17.178 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.781 -3.543 -16.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.813 -3.263 -18.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.289 -1.830 -18.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.868 -1.940 -18.807 1.00 0.00 H new ATOM 1253 N GLN A 137 9.683 1.486 -12.450 1.00 0.00 N ATOM 1254 CA GLN A 137 9.473 2.441 -11.369 1.00 0.00 C ATOM 1255 C GLN A 137 8.273 2.042 -10.516 1.00 0.00 C ATOM 1256 O GLN A 137 7.413 1.277 -10.954 1.00 0.00 O ATOM 1257 CB GLN A 137 9.268 3.847 -11.934 1.00 0.00 C ATOM 1258 CG GLN A 137 10.559 4.633 -12.095 1.00 0.00 C ATOM 1259 CD GLN A 137 11.356 4.716 -10.808 1.00 0.00 C ATOM 1260 OE1 GLN A 137 12.408 4.089 -10.674 1.00 0.00 O ATOM 1261 NE2 GLN A 137 10.858 5.491 -9.852 1.00 0.00 N ATOM 0 H GLN A 137 9.139 1.676 -13.292 1.00 0.00 H new ATOM 0 HA GLN A 137 10.362 2.438 -10.738 1.00 0.00 H new ATOM 0 HB2 GLN A 137 8.775 3.772 -12.903 1.00 0.00 H new ATOM 0 HB3 GLN A 137 8.596 4.399 -11.277 1.00 0.00 H new ATOM 0 HG2 GLN A 137 11.170 4.166 -12.867 1.00 0.00 H new ATOM 0 HG3 GLN A 137 10.326 5.641 -12.439 1.00 0.00 H new ATOM 0 HE21 GLN A 137 9.983 5.992 -10.006 1.00 0.00 H new ATOM 0 HE22 GLN A 137 11.350 5.585 -8.964 1.00 0.00 H new ATOM 1270 N LEU A 138 8.222 2.565 -9.296 1.00 0.00 N ATOM 1271 CA LEU A 138 7.126 2.264 -8.380 1.00 0.00 C ATOM 1272 C LEU A 138 6.595 3.537 -7.729 1.00 0.00 C ATOM 1273 O LEU A 138 7.349 4.293 -7.116 1.00 0.00 O ATOM 1274 CB LEU A 138 7.591 1.283 -7.303 1.00 0.00 C ATOM 1275 CG LEU A 138 7.909 -0.135 -7.779 1.00 0.00 C ATOM 1276 CD1 LEU A 138 8.417 -0.985 -6.624 1.00 0.00 C ATOM 1277 CD2 LEU A 138 6.681 -0.773 -8.412 1.00 0.00 C ATOM 0 H LEU A 138 8.926 3.199 -8.918 1.00 0.00 H new ATOM 0 HA LEU A 138 6.320 1.808 -8.955 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.481 1.693 -6.826 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.818 1.223 -6.537 1.00 0.00 H new ATOM 0 HG LEU A 138 8.694 -0.077 -8.533 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.638 -1.991 -6.982 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.323 -0.538 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.654 -1.036 -5.847 1.00 0.00 H new ATOM 0 HD21 LEU A 138 6.926 -1.782 -8.745 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.876 -0.818 -7.679 1.00 0.00 H new ATOM 0 HD23 LEU A 138 6.361 -0.177 -9.266 1.00 0.00 H new ATOM 1289 N ARG A 139 5.293 3.766 -7.865 1.00 0.00 N ATOM 1290 CA ARG A 139 4.661 4.947 -7.289 1.00 0.00 C ATOM 1291 C ARG A 139 3.890 4.588 -6.022 1.00 0.00 C ATOM 1292 O ARG A 139 2.826 3.972 -6.083 1.00 0.00 O ATOM 1293 CB ARG A 139 3.719 5.594 -8.306 1.00 0.00 C ATOM 1294 CG ARG A 139 3.591 7.100 -8.145 1.00 0.00 C ATOM 1295 CD ARG A 139 2.453 7.466 -7.206 1.00 0.00 C ATOM 1296 NE ARG A 139 1.913 8.793 -7.490 1.00 0.00 N ATOM 1297 CZ ARG A 139 2.553 9.922 -7.206 1.00 0.00 C ATOM 1298 NH1 ARG A 139 3.748 9.885 -6.634 1.00 0.00 N ATOM 1299 NH2 ARG A 139 1.997 11.092 -7.495 1.00 0.00 N ATOM 0 H ARG A 139 4.655 3.150 -8.369 1.00 0.00 H new ATOM 0 HA ARG A 139 5.445 5.657 -7.027 1.00 0.00 H new ATOM 0 HB2 ARG A 139 4.077 5.374 -9.312 1.00 0.00 H new ATOM 0 HB3 ARG A 139 2.732 5.142 -8.213 1.00 0.00 H new ATOM 0 HG2 ARG A 139 4.526 7.506 -7.760 1.00 0.00 H new ATOM 0 HG3 ARG A 139 3.421 7.558 -9.120 1.00 0.00 H new ATOM 0 HD2 ARG A 139 1.658 6.725 -7.294 1.00 0.00 H new ATOM 0 HD3 ARG A 139 2.808 7.432 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 139 0.995 8.856 -7.930 1.00 0.00 H new ATOM 0 HH11 ARG A 139 4.179 8.988 -6.411 1.00 0.00 H new ATOM 0 HH12 ARG A 139 4.237 10.754 -6.417 1.00 0.00 H new ATOM 0 HH21 ARG A 139 1.078 11.125 -7.935 1.00 0.00 H new ATOM 0 HH22 ARG A 139 2.489 11.958 -7.277 1.00 0.00 H new ATOM 1313 N VAL A 140 4.436 4.976 -4.873 1.00 0.00 N ATOM 1314 CA VAL A 140 3.800 4.695 -3.592 1.00 0.00 C ATOM 1315 C VAL A 140 3.311 5.978 -2.929 1.00 0.00 C ATOM 1316 O VAL A 140 4.109 6.787 -2.455 1.00 0.00 O ATOM 1317 CB VAL A 140 4.764 3.971 -2.634 1.00 0.00 C ATOM 1318 CG1 VAL A 140 4.065 3.634 -1.326 1.00 0.00 C ATOM 1319 CG2 VAL A 140 5.322 2.715 -3.288 1.00 0.00 C ATOM 0 H VAL A 140 5.317 5.486 -4.804 1.00 0.00 H new ATOM 0 HA VAL A 140 2.948 4.047 -3.797 1.00 0.00 H new ATOM 0 HB VAL A 140 5.597 4.639 -2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.762 3.123 -0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 140 3.719 4.552 -0.851 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.212 2.985 -1.526 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.001 2.216 -2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 140 4.503 2.042 -3.541 1.00 0.00 H new ATOM 0 HG23 VAL A 140 5.862 2.986 -4.195 1.00 0.00 H new ATOM 1329 N ARG A 141 1.994 6.157 -2.898 1.00 0.00 N ATOM 1330 CA ARG A 141 1.398 7.342 -2.294 1.00 0.00 C ATOM 1331 C ARG A 141 0.237 6.960 -1.379 1.00 0.00 C ATOM 1332 O ARG A 141 -0.362 5.895 -1.531 1.00 0.00 O ATOM 1333 CB ARG A 141 0.911 8.304 -3.379 1.00 0.00 C ATOM 1334 CG ARG A 141 2.038 8.991 -4.133 1.00 0.00 C ATOM 1335 CD ARG A 141 2.665 10.103 -3.306 1.00 0.00 C ATOM 1336 NE ARG A 141 1.929 11.359 -3.430 1.00 0.00 N ATOM 1337 CZ ARG A 141 0.944 11.717 -2.614 1.00 0.00 C ATOM 1338 NH1 ARG A 141 0.578 10.919 -1.620 1.00 0.00 N ATOM 1339 NH2 ARG A 141 0.322 12.876 -2.791 1.00 0.00 N ATOM 0 H ARG A 141 1.320 5.496 -3.284 1.00 0.00 H new ATOM 0 HA ARG A 141 2.162 7.838 -1.696 1.00 0.00 H new ATOM 0 HB2 ARG A 141 0.292 7.755 -4.089 1.00 0.00 H new ATOM 0 HB3 ARG A 141 0.276 9.062 -2.922 1.00 0.00 H new ATOM 0 HG2 ARG A 141 2.800 8.258 -4.397 1.00 0.00 H new ATOM 0 HG3 ARG A 141 1.655 9.402 -5.067 1.00 0.00 H new ATOM 0 HD2 ARG A 141 2.696 9.803 -2.259 1.00 0.00 H new ATOM 0 HD3 ARG A 141 3.696 10.254 -3.625 1.00 0.00 H new ATOM 0 HE ARG A 141 2.186 11.996 -4.184 1.00 0.00 H new ATOM 0 HH11 ARG A 141 1.053 10.027 -1.480 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -0.179 11.197 -0.995 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.600 13.493 -3.554 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -0.434 13.150 -2.164 1.00 0.00 H new ATOM 1353 N PHE A 142 -0.074 7.836 -0.430 1.00 0.00 N ATOM 1354 CA PHE A 142 -1.161 7.591 0.510 1.00 0.00 C ATOM 1355 C PHE A 142 -2.514 7.668 -0.191 1.00 0.00 C ATOM 1356 O PHE A 142 -2.878 8.702 -0.750 1.00 0.00 O ATOM 1357 CB PHE A 142 -1.111 8.602 1.657 1.00 0.00 C ATOM 1358 CG PHE A 142 -0.080 8.275 2.700 1.00 0.00 C ATOM 1359 CD1 PHE A 142 -0.297 7.253 3.610 1.00 0.00 C ATOM 1360 CD2 PHE A 142 1.105 8.989 2.769 1.00 0.00 C ATOM 1361 CE1 PHE A 142 0.649 6.950 4.571 1.00 0.00 C ATOM 1362 CE2 PHE A 142 2.055 8.690 3.728 1.00 0.00 C ATOM 1363 CZ PHE A 142 1.827 7.669 4.629 1.00 0.00 C ATOM 0 H PHE A 142 0.412 8.722 -0.291 1.00 0.00 H new ATOM 0 HA PHE A 142 -1.037 6.587 0.915 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -0.903 9.591 1.250 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.092 8.652 2.130 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.216 6.687 3.568 1.00 0.00 H new ATOM 0 HD2 PHE A 142 1.289 9.788 2.066 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.467 6.152 5.276 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.975 9.255 3.772 1.00 0.00 H new ATOM 0 HZ PHE A 142 2.568 7.433 5.378 1.00 0.00 H new ATOM 1373 N ALA A 143 -3.255 6.565 -0.158 1.00 0.00 N ATOM 1374 CA ALA A 143 -4.568 6.507 -0.789 1.00 0.00 C ATOM 1375 C ALA A 143 -5.622 7.194 0.073 1.00 0.00 C ATOM 1376 O ALA A 143 -6.052 6.653 1.093 1.00 0.00 O ATOM 1377 CB ALA A 143 -4.962 5.062 -1.056 1.00 0.00 C ATOM 0 H ALA A 143 -2.968 5.699 0.299 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.511 7.038 -1.739 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -5.944 5.034 -1.527 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -4.229 4.601 -1.718 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -4.996 4.514 -0.114 1.00 0.00 H new