USER MOD reduce.3.24.130724 H: found=0, std=0, add=603, rem=0, adj=7 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 25:sc= 0.0361 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc=-0.00517 USER MOD Single : A 89 MET CE :methyl -173:sc= 0 (180deg=-0.0575) 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= -0.2 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 HIS : no HD1:sc= -1.48 X(o=-1.5,f=-1.8) 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 -160:sc= -0.31 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.00222 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 131 MET CE :methyl 139:sc= -2.74! (180deg=-3.81!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= -0.113 K(o=-0.11,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 199 N SER A 73 -5.005 2.792 6.968 1.00 0.00 N ATOM 200 CA SER A 73 -3.685 2.600 6.380 1.00 0.00 C ATOM 201 C SER A 73 -3.793 1.946 5.005 1.00 0.00 C ATOM 202 O SER A 73 -3.588 0.741 4.862 1.00 0.00 O ATOM 203 CB SER A 73 -2.813 1.742 7.298 1.00 0.00 C ATOM 204 OG SER A 73 -2.651 2.354 8.566 1.00 0.00 O ATOM 0 HA SER A 73 -3.221 3.579 6.263 1.00 0.00 H new ATOM 0 HB2 SER A 73 -3.267 0.758 7.421 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.837 1.588 6.838 1.00 0.00 H new ATOM 0 HG SER A 73 -3.405 2.957 8.737 1.00 0.00 H new ATOM 210 N ARG A 74 -4.115 2.751 3.998 1.00 0.00 N ATOM 211 CA ARG A 74 -4.252 2.251 2.635 1.00 0.00 C ATOM 212 C ARG A 74 -3.197 2.869 1.722 1.00 0.00 C ATOM 213 O ARG A 74 -3.309 4.028 1.320 1.00 0.00 O ATOM 214 CB ARG A 74 -5.650 2.556 2.095 1.00 0.00 C ATOM 215 CG ARG A 74 -5.952 1.878 0.769 1.00 0.00 C ATOM 216 CD ARG A 74 -7.447 1.679 0.572 1.00 0.00 C ATOM 217 NE ARG A 74 -7.737 0.750 -0.516 1.00 0.00 N ATOM 218 CZ ARG A 74 -7.690 1.084 -1.801 1.00 0.00 C ATOM 219 NH1 ARG A 74 -7.366 2.320 -2.156 1.00 0.00 N ATOM 220 NH2 ARG A 74 -7.967 0.182 -2.733 1.00 0.00 N ATOM 0 H ARG A 74 -4.286 3.751 4.100 1.00 0.00 H new ATOM 0 HA ARG A 74 -4.105 1.171 2.654 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.391 2.243 2.831 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.757 3.634 1.975 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.553 2.480 -0.048 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.447 0.913 0.729 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.888 1.304 1.496 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.916 2.640 0.362 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.990 -0.209 -0.276 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -7.152 3.016 -1.442 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.330 2.574 -3.143 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.217 -0.770 -2.464 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -7.931 0.440 -3.719 1.00 0.00 H new ATOM 234 N LEU A 75 -2.172 2.088 1.398 1.00 0.00 N ATOM 235 CA LEU A 75 -1.096 2.558 0.532 1.00 0.00 C ATOM 236 C LEU A 75 -1.388 2.227 -0.928 1.00 0.00 C ATOM 237 O LEU A 75 -1.857 1.134 -1.247 1.00 0.00 O ATOM 238 CB LEU A 75 0.234 1.930 0.952 1.00 0.00 C ATOM 239 CG LEU A 75 0.846 2.460 2.249 1.00 0.00 C ATOM 240 CD1 LEU A 75 1.977 1.555 2.715 1.00 0.00 C ATOM 241 CD2 LEU A 75 1.345 3.885 2.060 1.00 0.00 C ATOM 0 H LEU A 75 -2.063 1.127 1.722 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.028 3.641 0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.089 0.855 1.055 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.954 2.079 0.147 1.00 0.00 H new ATOM 0 HG LEU A 75 0.073 2.466 3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.400 1.948 3.639 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.591 0.551 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.751 1.517 1.949 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.777 4.246 2.993 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.103 3.904 1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.512 4.527 1.774 1.00 0.00 H new ATOM 253 N PHE A 76 -1.107 3.179 -1.813 1.00 0.00 N ATOM 254 CA PHE A 76 -1.339 2.988 -3.240 1.00 0.00 C ATOM 255 C PHE A 76 -0.028 2.722 -3.973 1.00 0.00 C ATOM 256 O PHE A 76 0.944 3.463 -3.820 1.00 0.00 O ATOM 257 CB PHE A 76 -2.028 4.218 -3.834 1.00 0.00 C ATOM 258 CG PHE A 76 -2.148 4.173 -5.331 1.00 0.00 C ATOM 259 CD1 PHE A 76 -1.048 4.429 -6.135 1.00 0.00 C ATOM 260 CD2 PHE A 76 -3.359 3.875 -5.934 1.00 0.00 C ATOM 261 CE1 PHE A 76 -1.156 4.390 -7.512 1.00 0.00 C ATOM 262 CE2 PHE A 76 -3.472 3.833 -7.311 1.00 0.00 C ATOM 263 CZ PHE A 76 -2.369 4.090 -8.101 1.00 0.00 C ATOM 0 H PHE A 76 -0.719 4.089 -1.567 1.00 0.00 H new ATOM 0 HA PHE A 76 -1.987 2.121 -3.365 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.024 4.312 -3.400 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.471 5.110 -3.549 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.096 4.661 -5.680 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.225 3.673 -5.321 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.292 4.594 -8.128 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.422 3.599 -7.769 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.454 4.057 -9.177 1.00 0.00 H new ATOM 273 N VAL A 77 -0.007 1.659 -4.770 1.00 0.00 N ATOM 274 CA VAL A 77 1.183 1.293 -5.528 1.00 0.00 C ATOM 275 C VAL A 77 0.881 1.209 -7.020 1.00 0.00 C ATOM 276 O VAL A 77 0.154 0.323 -7.467 1.00 0.00 O ATOM 277 CB VAL A 77 1.758 -0.055 -5.055 1.00 0.00 C ATOM 278 CG1 VAL A 77 3.187 -0.228 -5.547 1.00 0.00 C ATOM 279 CG2 VAL A 77 1.692 -0.159 -3.538 1.00 0.00 C ATOM 0 H VAL A 77 -0.802 1.035 -4.908 1.00 0.00 H new ATOM 0 HA VAL A 77 1.921 2.076 -5.354 1.00 0.00 H new ATOM 0 HB VAL A 77 1.153 -0.857 -5.479 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.577 -1.186 -5.203 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.203 -0.200 -6.637 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.807 0.578 -5.154 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.102 -1.118 -3.221 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.272 0.649 -3.092 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.654 -0.083 -3.213 1.00 0.00 H new ATOM 289 N GLY A 78 1.445 2.137 -7.786 1.00 0.00 N ATOM 290 CA GLY A 78 1.225 2.150 -9.220 1.00 0.00 C ATOM 291 C GLY A 78 2.456 1.734 -10.000 1.00 0.00 C ATOM 292 O GLY A 78 3.530 1.553 -9.428 1.00 0.00 O ATOM 0 H GLY A 78 2.051 2.881 -7.439 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.401 1.480 -9.464 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.924 3.151 -9.529 1.00 0.00 H new ATOM 296 N ASN A 79 2.300 1.579 -11.311 1.00 0.00 N ATOM 297 CA ASN A 79 3.409 1.179 -12.171 1.00 0.00 C ATOM 298 C ASN A 79 3.935 -0.197 -11.775 1.00 0.00 C ATOM 299 O ASN A 79 5.144 -0.401 -11.655 1.00 0.00 O ATOM 300 CB ASN A 79 4.537 2.210 -12.096 1.00 0.00 C ATOM 301 CG ASN A 79 4.392 3.303 -13.137 1.00 0.00 C ATOM 302 OD1 ASN A 79 3.529 4.174 -13.023 1.00 0.00 O ATOM 303 ND2 ASN A 79 5.237 3.262 -14.160 1.00 0.00 N ATOM 0 H ASN A 79 1.417 1.724 -11.801 1.00 0.00 H new ATOM 0 HA ASN A 79 3.041 1.127 -13.196 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.550 2.658 -11.102 1.00 0.00 H new ATOM 0 HB3 ASN A 79 5.495 1.707 -12.232 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.187 3.971 -14.892 1.00 0.00 H new ATOM 0 HD22 ASN A 79 5.937 2.522 -14.214 1.00 0.00 H new ATOM 310 N LEU A 80 3.019 -1.138 -11.573 1.00 0.00 N ATOM 311 CA LEU A 80 3.390 -2.497 -11.191 1.00 0.00 C ATOM 312 C LEU A 80 3.857 -3.295 -12.404 1.00 0.00 C ATOM 313 O LEU A 80 3.313 -3.178 -13.502 1.00 0.00 O ATOM 314 CB LEU A 80 2.206 -3.202 -10.527 1.00 0.00 C ATOM 315 CG LEU A 80 1.879 -2.764 -9.099 1.00 0.00 C ATOM 316 CD1 LEU A 80 0.498 -3.255 -8.694 1.00 0.00 C ATOM 317 CD2 LEU A 80 2.935 -3.275 -8.130 1.00 0.00 C ATOM 0 H LEU A 80 2.015 -0.985 -11.667 1.00 0.00 H new ATOM 0 HA LEU A 80 4.214 -2.436 -10.480 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.322 -3.045 -11.145 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.404 -4.274 -10.521 1.00 0.00 H new ATOM 0 HG LEU A 80 1.879 -1.675 -9.064 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.282 -2.934 -7.675 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.249 -2.840 -9.371 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.469 -4.343 -8.745 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.686 -2.954 -7.118 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.967 -4.364 -8.168 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.909 -2.874 -8.409 1.00 0.00 H new ATOM 329 N PRO A 81 4.889 -4.129 -12.203 1.00 0.00 N ATOM 330 CA PRO A 81 5.450 -4.965 -13.268 1.00 0.00 C ATOM 331 C PRO A 81 4.502 -6.083 -13.688 1.00 0.00 C ATOM 332 O PRO A 81 3.642 -6.521 -12.922 1.00 0.00 O ATOM 333 CB PRO A 81 6.715 -5.547 -12.632 1.00 0.00 C ATOM 334 CG PRO A 81 6.446 -5.528 -11.167 1.00 0.00 C ATOM 335 CD PRO A 81 5.586 -4.319 -10.920 1.00 0.00 C ATOM 0 HA PRO A 81 5.637 -4.395 -14.178 1.00 0.00 H new ATOM 0 HB2 PRO A 81 6.906 -6.560 -12.986 1.00 0.00 H new ATOM 0 HB3 PRO A 81 7.593 -4.951 -12.881 1.00 0.00 H new ATOM 0 HG2 PRO A 81 5.938 -6.439 -10.852 1.00 0.00 H new ATOM 0 HG3 PRO A 81 7.375 -5.468 -10.600 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.885 -4.485 -10.102 1.00 0.00 H new ATOM 0 HD3 PRO A 81 6.184 -3.447 -10.655 1.00 0.00 H new ATOM 343 N PRO A 82 4.659 -6.557 -14.932 1.00 0.00 N ATOM 344 CA PRO A 82 3.826 -7.631 -15.481 1.00 0.00 C ATOM 345 C PRO A 82 4.111 -8.979 -14.826 1.00 0.00 C ATOM 346 O PRO A 82 3.517 -9.994 -15.189 1.00 0.00 O ATOM 347 CB PRO A 82 4.218 -7.663 -16.961 1.00 0.00 C ATOM 348 CG PRO A 82 5.599 -7.106 -16.999 1.00 0.00 C ATOM 349 CD PRO A 82 5.663 -6.082 -15.899 1.00 0.00 C ATOM 0 HA PRO A 82 2.765 -7.451 -15.310 1.00 0.00 H new ATOM 0 HB2 PRO A 82 4.190 -8.678 -17.356 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.534 -7.067 -17.565 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.340 -7.890 -16.846 1.00 0.00 H new ATOM 0 HG3 PRO A 82 5.810 -6.652 -17.967 1.00 0.00 H new ATOM 0 HD2 PRO A 82 6.657 -6.032 -15.454 1.00 0.00 H new ATOM 0 HD3 PRO A 82 5.427 -5.083 -16.266 1.00 0.00 H new ATOM 357 N ASP A 83 5.023 -8.980 -13.860 1.00 0.00 N ATOM 358 CA ASP A 83 5.385 -10.203 -13.153 1.00 0.00 C ATOM 359 C ASP A 83 5.159 -10.051 -11.652 1.00 0.00 C ATOM 360 O ASP A 83 5.913 -10.591 -10.843 1.00 0.00 O ATOM 361 CB ASP A 83 6.847 -10.561 -13.427 1.00 0.00 C ATOM 362 CG ASP A 83 7.135 -10.727 -14.906 1.00 0.00 C ATOM 363 OD1 ASP A 83 7.257 -9.699 -15.606 1.00 0.00 O ATOM 364 OD2 ASP A 83 7.240 -11.884 -15.364 1.00 0.00 O ATOM 0 H ASP A 83 5.525 -8.148 -13.549 1.00 0.00 H new ATOM 0 HA ASP A 83 4.746 -11.007 -13.518 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.491 -9.782 -13.020 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.096 -11.485 -12.905 1.00 0.00 H new ATOM 369 N ILE A 84 4.116 -9.311 -11.289 1.00 0.00 N ATOM 370 CA ILE A 84 3.791 -9.088 -9.886 1.00 0.00 C ATOM 371 C ILE A 84 2.624 -9.965 -9.446 1.00 0.00 C ATOM 372 O ILE A 84 1.627 -10.095 -10.157 1.00 0.00 O ATOM 373 CB ILE A 84 3.439 -7.613 -9.617 1.00 0.00 C ATOM 374 CG1 ILE A 84 3.100 -7.407 -8.139 1.00 0.00 C ATOM 375 CG2 ILE A 84 2.278 -7.176 -10.498 1.00 0.00 C ATOM 376 CD1 ILE A 84 4.318 -7.223 -7.260 1.00 0.00 C ATOM 0 H ILE A 84 3.483 -8.856 -11.947 1.00 0.00 H new ATOM 0 HA ILE A 84 4.679 -9.352 -9.311 1.00 0.00 H new ATOM 0 HB ILE A 84 4.306 -6.999 -9.860 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.456 -6.533 -8.041 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.530 -8.265 -7.782 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.041 -6.131 -10.296 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.554 -7.289 -11.546 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.406 -7.794 -10.284 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.003 -7.082 -6.226 1.00 0.00 H new ATOM 0 HD12 ILE A 84 4.953 -8.106 -7.329 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.877 -6.348 -7.591 1.00 0.00 H new ATOM 388 N THR A 85 2.753 -10.565 -8.266 1.00 0.00 N ATOM 389 CA THR A 85 1.710 -11.430 -7.730 1.00 0.00 C ATOM 390 C THR A 85 1.456 -11.136 -6.256 1.00 0.00 C ATOM 391 O THR A 85 2.226 -10.421 -5.615 1.00 0.00 O ATOM 392 CB THR A 85 2.076 -12.917 -7.890 1.00 0.00 C ATOM 393 OG1 THR A 85 3.283 -13.205 -7.175 1.00 0.00 O ATOM 394 CG2 THR A 85 2.253 -13.276 -9.358 1.00 0.00 C ATOM 0 H THR A 85 3.570 -10.467 -7.664 1.00 0.00 H new ATOM 0 HA THR A 85 0.804 -11.224 -8.300 1.00 0.00 H new ATOM 0 HB THR A 85 1.261 -13.514 -7.481 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.508 -14.153 -7.281 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.511 -14.331 -9.446 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.324 -13.084 -9.894 1.00 0.00 H new ATOM 0 HG23 THR A 85 3.051 -12.670 -9.787 1.00 0.00 H new ATOM 402 N GLU A 86 0.373 -11.693 -5.724 1.00 0.00 N ATOM 403 CA GLU A 86 0.019 -11.490 -4.324 1.00 0.00 C ATOM 404 C GLU A 86 1.192 -11.836 -3.411 1.00 0.00 C ATOM 405 O GLU A 86 1.424 -11.168 -2.403 1.00 0.00 O ATOM 406 CB GLU A 86 -1.198 -12.341 -3.954 1.00 0.00 C ATOM 407 CG GLU A 86 -2.519 -11.744 -4.409 1.00 0.00 C ATOM 408 CD GLU A 86 -3.606 -12.789 -4.571 1.00 0.00 C ATOM 409 OE1 GLU A 86 -4.193 -13.200 -3.548 1.00 0.00 O ATOM 410 OE2 GLU A 86 -3.869 -13.197 -5.722 1.00 0.00 O ATOM 0 H GLU A 86 -0.274 -12.288 -6.241 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.228 -10.437 -4.187 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.086 -13.332 -4.395 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -1.222 -12.474 -2.872 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.844 -10.996 -3.686 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.373 -11.227 -5.358 1.00 0.00 H new ATOM 417 N GLU A 87 1.927 -12.883 -3.772 1.00 0.00 N ATOM 418 CA GLU A 87 3.075 -13.317 -2.984 1.00 0.00 C ATOM 419 C GLU A 87 4.151 -12.236 -2.949 1.00 0.00 C ATOM 420 O GLU A 87 4.603 -11.831 -1.878 1.00 0.00 O ATOM 421 CB GLU A 87 3.654 -14.612 -3.558 1.00 0.00 C ATOM 422 CG GLU A 87 3.007 -15.868 -3.001 1.00 0.00 C ATOM 423 CD GLU A 87 3.815 -17.118 -3.290 1.00 0.00 C ATOM 424 OE1 GLU A 87 4.945 -17.228 -2.768 1.00 0.00 O ATOM 425 OE2 GLU A 87 3.319 -17.987 -4.038 1.00 0.00 O ATOM 0 H GLU A 87 1.749 -13.446 -4.604 1.00 0.00 H new ATOM 0 HA GLU A 87 2.736 -13.500 -1.964 1.00 0.00 H new ATOM 0 HB2 GLU A 87 3.537 -14.603 -4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.724 -14.644 -3.353 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.883 -15.761 -1.923 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.010 -15.978 -3.427 1.00 0.00 H new ATOM 432 N GLU A 88 4.557 -11.775 -4.128 1.00 0.00 N ATOM 433 CA GLU A 88 5.581 -10.742 -4.231 1.00 0.00 C ATOM 434 C GLU A 88 5.245 -9.550 -3.340 1.00 0.00 C ATOM 435 O GLU A 88 6.106 -9.029 -2.632 1.00 0.00 O ATOM 436 CB GLU A 88 5.727 -10.282 -5.683 1.00 0.00 C ATOM 437 CG GLU A 88 6.266 -11.357 -6.612 1.00 0.00 C ATOM 438 CD GLU A 88 7.616 -11.886 -6.170 1.00 0.00 C ATOM 439 OE1 GLU A 88 8.631 -11.202 -6.418 1.00 0.00 O ATOM 440 OE2 GLU A 88 7.659 -12.984 -5.576 1.00 0.00 O ATOM 0 H GLU A 88 4.193 -12.100 -5.024 1.00 0.00 H new ATOM 0 HA GLU A 88 6.526 -11.169 -3.895 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.755 -9.951 -6.050 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.391 -9.419 -5.716 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.555 -12.181 -6.659 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.351 -10.951 -7.620 1.00 0.00 H new ATOM 447 N MET A 89 3.986 -9.125 -3.381 1.00 0.00 N ATOM 448 CA MET A 89 3.536 -7.995 -2.576 1.00 0.00 C ATOM 449 C MET A 89 3.740 -8.271 -1.090 1.00 0.00 C ATOM 450 O MET A 89 4.267 -7.431 -0.360 1.00 0.00 O ATOM 451 CB MET A 89 2.060 -7.700 -2.854 1.00 0.00 C ATOM 452 CG MET A 89 1.597 -6.358 -2.312 1.00 0.00 C ATOM 453 SD MET A 89 0.261 -5.639 -3.288 1.00 0.00 S ATOM 454 CE MET A 89 0.973 -4.054 -3.721 1.00 0.00 C ATOM 0 H MET A 89 3.261 -9.545 -3.962 1.00 0.00 H new ATOM 0 HA MET A 89 4.132 -7.124 -2.851 1.00 0.00 H new ATOM 0 HB2 MET A 89 1.889 -7.727 -3.930 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.451 -8.490 -2.415 1.00 0.00 H new ATOM 0 HG2 MET A 89 1.263 -6.482 -1.282 1.00 0.00 H new ATOM 0 HG3 MET A 89 2.440 -5.668 -2.293 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.222 -3.442 -4.219 1.00 0.00 H new ATOM 0 HE2 MET A 89 1.312 -3.548 -2.817 1.00 0.00 H new ATOM 0 HE3 MET A 89 1.820 -4.206 -4.391 1.00 0.00 H new ATOM 464 N ARG A 90 3.319 -9.451 -0.648 1.00 0.00 N ATOM 465 CA ARG A 90 3.455 -9.836 0.752 1.00 0.00 C ATOM 466 C ARG A 90 4.909 -9.738 1.204 1.00 0.00 C ATOM 467 O ARG A 90 5.202 -9.219 2.282 1.00 0.00 O ATOM 468 CB ARG A 90 2.938 -11.260 0.964 1.00 0.00 C ATOM 469 CG ARG A 90 1.462 -11.326 1.321 1.00 0.00 C ATOM 470 CD ARG A 90 0.914 -12.736 1.168 1.00 0.00 C ATOM 471 NE ARG A 90 1.194 -13.562 2.339 1.00 0.00 N ATOM 472 CZ ARG A 90 1.085 -14.886 2.348 1.00 0.00 C ATOM 473 NH1 ARG A 90 0.704 -15.530 1.254 1.00 0.00 N ATOM 474 NH2 ARG A 90 1.357 -15.568 3.453 1.00 0.00 N ATOM 0 H ARG A 90 2.881 -10.157 -1.239 1.00 0.00 H new ATOM 0 HA ARG A 90 2.859 -9.148 1.352 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.110 -11.839 0.056 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.516 -11.733 1.758 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.320 -10.989 2.348 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.901 -10.645 0.681 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.163 -12.691 1.005 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.351 -13.201 0.284 1.00 0.00 H new ATOM 0 HE ARG A 90 1.490 -13.097 3.197 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.494 -15.009 0.403 1.00 0.00 H new ATOM 0 HH12 ARG A 90 0.621 -16.547 1.263 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.650 -15.076 4.297 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.273 -16.585 3.459 1.00 0.00 H new ATOM 488 N LYS A 91 5.816 -10.241 0.374 1.00 0.00 N ATOM 489 CA LYS A 91 7.240 -10.210 0.686 1.00 0.00 C ATOM 490 C LYS A 91 7.777 -8.783 0.638 1.00 0.00 C ATOM 491 O LYS A 91 8.615 -8.396 1.454 1.00 0.00 O ATOM 492 CB LYS A 91 8.017 -11.092 -0.293 1.00 0.00 C ATOM 493 CG LYS A 91 9.301 -11.660 0.287 1.00 0.00 C ATOM 494 CD LYS A 91 10.000 -12.580 -0.701 1.00 0.00 C ATOM 495 CE LYS A 91 10.604 -11.800 -1.858 1.00 0.00 C ATOM 496 NZ LYS A 91 11.391 -12.677 -2.768 1.00 0.00 N ATOM 0 H LYS A 91 5.590 -10.675 -0.521 1.00 0.00 H new ATOM 0 HA LYS A 91 7.373 -10.595 1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.378 -11.915 -0.614 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.257 -10.509 -1.182 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.970 -10.844 0.561 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.077 -12.209 1.201 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.784 -13.138 -0.188 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.288 -13.311 -1.086 1.00 0.00 H new ATOM 0 HE2 LYS A 91 9.809 -11.313 -2.422 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.247 -11.011 -1.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.786 -12.107 -3.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.166 -13.123 -2.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.772 -13.414 -3.161 1.00 0.00 H new ATOM 510 N LEU A 92 7.290 -8.005 -0.322 1.00 0.00 N ATOM 511 CA LEU A 92 7.720 -6.619 -0.476 1.00 0.00 C ATOM 512 C LEU A 92 7.511 -5.837 0.817 1.00 0.00 C ATOM 513 O LEU A 92 8.380 -5.075 1.241 1.00 0.00 O ATOM 514 CB LEU A 92 6.955 -5.951 -1.620 1.00 0.00 C ATOM 515 CG LEU A 92 7.457 -6.255 -3.032 1.00 0.00 C ATOM 516 CD1 LEU A 92 6.392 -5.913 -4.062 1.00 0.00 C ATOM 517 CD2 LEU A 92 8.742 -5.491 -3.316 1.00 0.00 C ATOM 0 H LEU A 92 6.597 -8.310 -1.006 1.00 0.00 H new ATOM 0 HA LEU A 92 8.784 -6.618 -0.711 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.909 -6.252 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.986 -4.872 -1.470 1.00 0.00 H new ATOM 0 HG LEU A 92 7.669 -7.322 -3.100 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.767 -6.136 -5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.497 -6.505 -3.870 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.148 -4.853 -3.994 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.085 -5.719 -4.325 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.556 -4.421 -3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.507 -5.785 -2.597 1.00 0.00 H new ATOM 529 N PHE A 93 6.353 -6.033 1.439 1.00 0.00 N ATOM 530 CA PHE A 93 6.030 -5.347 2.685 1.00 0.00 C ATOM 531 C PHE A 93 6.231 -6.271 3.882 1.00 0.00 C ATOM 532 O PHE A 93 5.525 -6.166 4.885 1.00 0.00 O ATOM 533 CB PHE A 93 4.586 -4.841 2.653 1.00 0.00 C ATOM 534 CG PHE A 93 4.370 -3.703 1.697 1.00 0.00 C ATOM 535 CD1 PHE A 93 4.636 -3.855 0.346 1.00 0.00 C ATOM 536 CD2 PHE A 93 3.901 -2.480 2.150 1.00 0.00 C ATOM 537 CE1 PHE A 93 4.439 -2.809 -0.535 1.00 0.00 C ATOM 538 CE2 PHE A 93 3.702 -1.430 1.273 1.00 0.00 C ATOM 539 CZ PHE A 93 3.970 -1.596 -0.071 1.00 0.00 C ATOM 0 H PHE A 93 5.623 -6.661 1.101 1.00 0.00 H new ATOM 0 HA PHE A 93 6.704 -4.496 2.788 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.927 -5.665 2.379 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.299 -4.523 3.655 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.002 -4.802 -0.023 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.689 -2.346 3.200 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.652 -2.940 -1.586 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.337 -0.481 1.639 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.813 -0.778 -0.759 1.00 0.00 H new ATOM 549 N GLU A 94 7.199 -7.175 3.769 1.00 0.00 N ATOM 550 CA GLU A 94 7.492 -8.118 4.842 1.00 0.00 C ATOM 551 C GLU A 94 8.145 -7.410 6.025 1.00 0.00 C ATOM 552 O GLU A 94 7.788 -7.647 7.179 1.00 0.00 O ATOM 553 CB GLU A 94 8.406 -9.235 4.333 1.00 0.00 C ATOM 554 CG GLU A 94 9.837 -8.786 4.091 1.00 0.00 C ATOM 555 CD GLU A 94 10.723 -9.909 3.586 1.00 0.00 C ATOM 556 OE1 GLU A 94 10.196 -10.830 2.928 1.00 0.00 O ATOM 557 OE2 GLU A 94 11.943 -9.865 3.848 1.00 0.00 O ATOM 0 H GLU A 94 7.793 -7.274 2.946 1.00 0.00 H new ATOM 0 HA GLU A 94 6.550 -8.553 5.177 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.407 -10.050 5.056 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.997 -9.633 3.405 1.00 0.00 H new ATOM 0 HG2 GLU A 94 9.841 -7.971 3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.251 -8.390 5.018 1.00 0.00 H new ATOM 564 N LYS A 95 9.104 -6.540 5.730 1.00 0.00 N ATOM 565 CA LYS A 95 9.808 -5.795 6.768 1.00 0.00 C ATOM 566 C LYS A 95 8.824 -5.145 7.734 1.00 0.00 C ATOM 567 O LYS A 95 9.105 -5.011 8.925 1.00 0.00 O ATOM 568 CB LYS A 95 10.704 -4.726 6.138 1.00 0.00 C ATOM 569 CG LYS A 95 11.854 -4.293 7.031 1.00 0.00 C ATOM 570 CD LYS A 95 12.250 -2.849 6.770 1.00 0.00 C ATOM 571 CE LYS A 95 13.033 -2.712 5.473 1.00 0.00 C ATOM 572 NZ LYS A 95 13.901 -1.502 5.475 1.00 0.00 N ATOM 0 H LYS A 95 9.412 -6.333 4.780 1.00 0.00 H new ATOM 0 HA LYS A 95 10.428 -6.496 7.327 1.00 0.00 H new ATOM 0 HB2 LYS A 95 11.107 -5.108 5.200 1.00 0.00 H new ATOM 0 HB3 LYS A 95 10.098 -3.854 5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 95 11.568 -4.409 8.076 1.00 0.00 H new ATOM 0 HG3 LYS A 95 12.712 -4.943 6.861 1.00 0.00 H new ATOM 0 HD2 LYS A 95 11.355 -2.228 6.724 1.00 0.00 H new ATOM 0 HD3 LYS A 95 12.852 -2.480 7.600 1.00 0.00 H new ATOM 0 HE2 LYS A 95 13.648 -3.600 5.324 1.00 0.00 H new ATOM 0 HE3 LYS A 95 12.339 -2.660 4.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 14.418 -1.444 4.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 13.312 -0.653 5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 14.580 -1.563 6.260 1.00 0.00 H new ATOM 586 N TYR A 96 7.669 -4.745 7.214 1.00 0.00 N ATOM 587 CA TYR A 96 6.643 -4.108 8.031 1.00 0.00 C ATOM 588 C TYR A 96 5.515 -5.085 8.349 1.00 0.00 C ATOM 589 O TYR A 96 4.340 -4.721 8.332 1.00 0.00 O ATOM 590 CB TYR A 96 6.081 -2.879 7.314 1.00 0.00 C ATOM 591 CG TYR A 96 7.084 -2.187 6.420 1.00 0.00 C ATOM 592 CD1 TYR A 96 8.001 -1.282 6.940 1.00 0.00 C ATOM 593 CD2 TYR A 96 7.117 -2.440 5.054 1.00 0.00 C ATOM 594 CE1 TYR A 96 8.920 -0.648 6.126 1.00 0.00 C ATOM 595 CE2 TYR A 96 8.033 -1.812 4.233 1.00 0.00 C ATOM 596 CZ TYR A 96 8.932 -0.916 4.773 1.00 0.00 C ATOM 597 OH TYR A 96 9.846 -0.287 3.960 1.00 0.00 O ATOM 0 H TYR A 96 7.420 -4.851 6.231 1.00 0.00 H new ATOM 0 HA TYR A 96 7.103 -3.795 8.968 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.221 -3.180 6.716 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.719 -2.169 8.058 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.995 -1.070 7.999 1.00 0.00 H new ATOM 0 HD2 TYR A 96 6.414 -3.140 4.627 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.625 0.054 6.547 1.00 0.00 H new ATOM 0 HE2 TYR A 96 8.045 -2.021 3.174 1.00 0.00 H new ATOM 0 HH TYR A 96 9.722 -0.587 3.035 1.00 0.00 H new ATOM 607 N GLY A 97 5.883 -6.329 8.640 1.00 0.00 N ATOM 608 CA GLY A 97 4.893 -7.340 8.959 1.00 0.00 C ATOM 609 C GLY A 97 4.016 -7.687 7.772 1.00 0.00 C ATOM 610 O GLY A 97 4.181 -7.133 6.685 1.00 0.00 O ATOM 0 H GLY A 97 6.850 -6.654 8.660 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.397 -8.240 9.310 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.267 -6.986 9.778 1.00 0.00 H new ATOM 614 N LYS A 98 3.081 -8.609 7.979 1.00 0.00 N ATOM 615 CA LYS A 98 2.174 -9.030 6.918 1.00 0.00 C ATOM 616 C LYS A 98 1.059 -8.009 6.717 1.00 0.00 C ATOM 617 O LYS A 98 0.526 -7.461 7.681 1.00 0.00 O ATOM 618 CB LYS A 98 1.573 -10.399 7.246 1.00 0.00 C ATOM 619 CG LYS A 98 0.568 -10.365 8.384 1.00 0.00 C ATOM 620 CD LYS A 98 -0.216 -11.664 8.475 1.00 0.00 C ATOM 621 CE LYS A 98 -1.456 -11.507 9.341 1.00 0.00 C ATOM 622 NZ LYS A 98 -2.095 -12.819 9.637 1.00 0.00 N ATOM 0 H LYS A 98 2.932 -9.079 8.872 1.00 0.00 H new ATOM 0 HA LYS A 98 2.746 -9.103 5.993 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.087 -10.796 6.355 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.378 -11.088 7.504 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.088 -10.186 9.325 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.121 -9.533 8.238 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.508 -11.985 7.475 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.421 -12.446 8.888 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.186 -11.015 10.276 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.173 -10.860 8.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.937 -12.669 10.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.375 -13.277 8.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.420 -13.428 10.142 1.00 0.00 H new ATOM 636 N ALA A 99 0.711 -7.759 5.459 1.00 0.00 N ATOM 637 CA ALA A 99 -0.343 -6.806 5.133 1.00 0.00 C ATOM 638 C ALA A 99 -1.722 -7.431 5.312 1.00 0.00 C ATOM 639 O ALA A 99 -1.888 -8.643 5.177 1.00 0.00 O ATOM 640 CB ALA A 99 -0.172 -6.297 3.709 1.00 0.00 C ATOM 0 H ALA A 99 1.144 -8.203 4.649 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.263 -5.964 5.820 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.966 -5.586 3.479 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.795 -5.804 3.612 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -0.223 -7.135 3.014 1.00 0.00 H new ATOM 646 N GLY A 100 -2.711 -6.596 5.617 1.00 0.00 N ATOM 647 CA GLY A 100 -4.063 -7.086 5.810 1.00 0.00 C ATOM 648 C GLY A 100 -4.814 -7.244 4.503 1.00 0.00 C ATOM 649 O GLY A 100 -5.483 -8.253 4.283 1.00 0.00 O ATOM 0 H GLY A 100 -2.600 -5.589 5.734 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.028 -8.047 6.324 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.607 -6.398 6.457 1.00 0.00 H new ATOM 653 N GLU A 101 -4.706 -6.243 3.635 1.00 0.00 N ATOM 654 CA GLU A 101 -5.383 -6.275 2.344 1.00 0.00 C ATOM 655 C GLU A 101 -4.377 -6.197 1.199 1.00 0.00 C ATOM 656 O GLU A 101 -3.533 -5.302 1.160 1.00 0.00 O ATOM 657 CB GLU A 101 -6.383 -5.122 2.239 1.00 0.00 C ATOM 658 CG GLU A 101 -7.389 -5.290 1.112 1.00 0.00 C ATOM 659 CD GLU A 101 -8.572 -6.152 1.510 1.00 0.00 C ATOM 660 OE1 GLU A 101 -8.425 -7.392 1.522 1.00 0.00 O ATOM 661 OE2 GLU A 101 -9.644 -5.586 1.809 1.00 0.00 O ATOM 0 H GLU A 101 -4.156 -5.400 3.802 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.920 -7.220 2.268 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -6.920 -5.030 3.183 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -5.837 -4.190 2.091 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -7.747 -4.309 0.801 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -6.893 -5.736 0.250 1.00 0.00 H new ATOM 668 N VAL A 102 -4.473 -7.141 0.269 1.00 0.00 N ATOM 669 CA VAL A 102 -3.573 -7.180 -0.877 1.00 0.00 C ATOM 670 C VAL A 102 -4.331 -7.497 -2.161 1.00 0.00 C ATOM 671 O VAL A 102 -4.724 -8.640 -2.396 1.00 0.00 O ATOM 672 CB VAL A 102 -2.458 -8.224 -0.680 1.00 0.00 C ATOM 673 CG1 VAL A 102 -1.570 -8.296 -1.913 1.00 0.00 C ATOM 674 CG2 VAL A 102 -1.638 -7.900 0.559 1.00 0.00 C ATOM 0 H VAL A 102 -5.166 -7.890 0.287 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.123 -6.191 -0.960 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.920 -9.201 -0.537 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.788 -9.039 -1.755 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -2.170 -8.579 -2.778 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.114 -7.322 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.855 -8.648 0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.185 -6.915 0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.286 -7.905 1.436 1.00 0.00 H new ATOM 684 N PHE A 103 -4.533 -6.478 -2.990 1.00 0.00 N ATOM 685 CA PHE A 103 -5.245 -6.649 -4.251 1.00 0.00 C ATOM 686 C PHE A 103 -4.429 -6.093 -5.415 1.00 0.00 C ATOM 687 O PHE A 103 -4.197 -4.887 -5.505 1.00 0.00 O ATOM 688 CB PHE A 103 -6.607 -5.953 -4.191 1.00 0.00 C ATOM 689 CG PHE A 103 -7.650 -6.742 -3.453 1.00 0.00 C ATOM 690 CD1 PHE A 103 -8.024 -8.002 -3.892 1.00 0.00 C ATOM 691 CD2 PHE A 103 -8.257 -6.224 -2.320 1.00 0.00 C ATOM 692 CE1 PHE A 103 -8.984 -8.731 -3.215 1.00 0.00 C ATOM 693 CE2 PHE A 103 -9.217 -6.948 -1.639 1.00 0.00 C ATOM 694 CZ PHE A 103 -9.582 -8.203 -2.088 1.00 0.00 C ATOM 0 H PHE A 103 -4.214 -5.526 -2.811 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.397 -7.716 -4.412 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.489 -4.982 -3.710 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.956 -5.765 -5.207 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.560 -8.419 -4.773 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.977 -5.243 -1.965 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.266 -9.712 -3.567 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.682 -6.533 -0.757 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.334 -8.770 -1.558 1.00 0.00 H new ATOM 704 N ILE A 104 -3.997 -6.982 -6.304 1.00 0.00 N ATOM 705 CA ILE A 104 -3.208 -6.581 -7.462 1.00 0.00 C ATOM 706 C ILE A 104 -4.018 -6.703 -8.748 1.00 0.00 C ATOM 707 O ILE A 104 -4.531 -7.774 -9.073 1.00 0.00 O ATOM 708 CB ILE A 104 -1.929 -7.429 -7.592 1.00 0.00 C ATOM 709 CG1 ILE A 104 -1.038 -7.241 -6.363 1.00 0.00 C ATOM 710 CG2 ILE A 104 -1.175 -7.059 -8.861 1.00 0.00 C ATOM 711 CD1 ILE A 104 -0.027 -8.350 -6.173 1.00 0.00 C ATOM 0 H ILE A 104 -4.180 -7.984 -6.244 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.929 -5.538 -7.309 1.00 0.00 H new ATOM 0 HB ILE A 104 -2.213 -8.480 -7.654 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.511 -6.291 -6.449 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.667 -7.178 -5.475 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.273 -7.667 -8.939 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -1.811 -7.240 -9.728 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.900 -6.005 -8.827 1.00 0.00 H new ATOM 0 HD11 ILE A 104 0.569 -8.150 -5.283 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.547 -9.300 -6.055 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.627 -8.400 -7.044 1.00 0.00 H new ATOM 723 N HIS A 105 -4.129 -5.597 -9.478 1.00 0.00 N ATOM 724 CA HIS A 105 -4.876 -5.580 -10.731 1.00 0.00 C ATOM 725 C HIS A 105 -3.937 -5.402 -11.920 1.00 0.00 C ATOM 726 O HIS A 105 -3.191 -4.425 -11.995 1.00 0.00 O ATOM 727 CB HIS A 105 -5.915 -4.459 -10.714 1.00 0.00 C ATOM 728 CG HIS A 105 -7.131 -4.758 -11.536 1.00 0.00 C ATOM 729 ND1 HIS A 105 -7.966 -3.777 -12.029 1.00 0.00 N ATOM 730 CD2 HIS A 105 -7.651 -5.936 -11.952 1.00 0.00 C ATOM 731 CE1 HIS A 105 -8.948 -4.340 -12.711 1.00 0.00 C ATOM 732 NE2 HIS A 105 -8.779 -5.649 -12.680 1.00 0.00 N ATOM 0 H HIS A 105 -3.712 -4.702 -9.224 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.387 -6.537 -10.834 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -6.219 -4.272 -9.684 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -5.454 -3.542 -11.081 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -7.253 -6.919 -11.749 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -9.752 -3.818 -13.209 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -9.388 -6.336 -13.125 1.00 0.00 H new ATOM 740 N LYS A 106 -3.978 -6.352 -12.848 1.00 0.00 N ATOM 741 CA LYS A 106 -3.132 -6.302 -14.034 1.00 0.00 C ATOM 742 C LYS A 106 -3.859 -5.626 -15.192 1.00 0.00 C ATOM 743 O LYS A 106 -3.254 -4.892 -15.974 1.00 0.00 O ATOM 744 CB LYS A 106 -2.703 -7.713 -14.441 1.00 0.00 C ATOM 745 CG LYS A 106 -3.865 -8.618 -14.812 1.00 0.00 C ATOM 746 CD LYS A 106 -3.383 -9.983 -15.274 1.00 0.00 C ATOM 747 CE LYS A 106 -4.546 -10.883 -15.664 1.00 0.00 C ATOM 748 NZ LYS A 106 -4.080 -12.174 -16.240 1.00 0.00 N ATOM 0 H LYS A 106 -4.589 -7.167 -12.801 1.00 0.00 H new ATOM 0 HA LYS A 106 -2.245 -5.716 -13.792 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -2.020 -7.646 -15.288 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -2.148 -8.166 -13.620 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.525 -8.736 -13.952 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.453 -8.152 -15.603 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.712 -9.864 -16.125 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.807 -10.455 -14.478 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.164 -11.079 -14.787 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -5.176 -10.368 -16.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -4.902 -12.758 -16.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -3.512 -11.989 -17.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.500 -12.678 -15.539 1.00 0.00 H new ATOM 762 N ASP A 107 -5.159 -5.877 -15.295 1.00 0.00 N ATOM 763 CA ASP A 107 -5.969 -5.290 -16.356 1.00 0.00 C ATOM 764 C ASP A 107 -5.844 -3.770 -16.358 1.00 0.00 C ATOM 765 O ASP A 107 -5.898 -3.133 -17.411 1.00 0.00 O ATOM 766 CB ASP A 107 -7.435 -5.694 -16.190 1.00 0.00 C ATOM 767 CG ASP A 107 -7.734 -7.051 -16.795 1.00 0.00 C ATOM 768 OD1 ASP A 107 -7.266 -8.065 -16.237 1.00 0.00 O ATOM 769 OD2 ASP A 107 -8.435 -7.100 -17.828 1.00 0.00 O ATOM 0 H ASP A 107 -5.675 -6.483 -14.657 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.602 -5.667 -17.311 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.687 -5.709 -15.130 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -8.071 -4.943 -16.658 1.00 0.00 H new ATOM 774 N LYS A 108 -5.678 -3.194 -15.173 1.00 0.00 N ATOM 775 CA LYS A 108 -5.545 -1.748 -15.036 1.00 0.00 C ATOM 776 C LYS A 108 -4.091 -1.356 -14.796 1.00 0.00 C ATOM 777 O LYS A 108 -3.671 -0.252 -15.140 1.00 0.00 O ATOM 778 CB LYS A 108 -6.419 -1.242 -13.886 1.00 0.00 C ATOM 779 CG LYS A 108 -7.903 -1.237 -14.205 1.00 0.00 C ATOM 780 CD LYS A 108 -8.641 -0.169 -13.416 1.00 0.00 C ATOM 781 CE LYS A 108 -10.148 -0.360 -13.491 1.00 0.00 C ATOM 782 NZ LYS A 108 -10.679 -0.049 -14.847 1.00 0.00 N ATOM 0 H LYS A 108 -5.632 -3.707 -14.292 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.877 -1.287 -15.966 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -6.247 -1.866 -13.009 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -6.109 -0.230 -13.624 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -8.046 -1.066 -15.272 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -8.328 -2.215 -13.980 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -8.321 -0.199 -12.374 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -8.379 0.816 -13.802 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -10.397 -1.389 -13.230 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -10.633 0.282 -12.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -11.709 -0.191 -14.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -10.464 0.940 -15.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -10.236 -0.678 -15.546 1.00 0.00 H new ATOM 796 N GLY A 109 -3.327 -2.268 -14.203 1.00 0.00 N ATOM 797 CA GLY A 109 -1.927 -1.998 -13.929 1.00 0.00 C ATOM 798 C GLY A 109 -1.728 -1.228 -12.638 1.00 0.00 C ATOM 799 O GLY A 109 -0.967 -0.261 -12.596 1.00 0.00 O ATOM 0 H GLY A 109 -3.652 -3.189 -13.907 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.382 -2.940 -13.874 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -1.501 -1.431 -14.756 1.00 0.00 H new ATOM 803 N PHE A 110 -2.415 -1.655 -11.584 1.00 0.00 N ATOM 804 CA PHE A 110 -2.311 -0.997 -10.287 1.00 0.00 C ATOM 805 C PHE A 110 -2.662 -1.962 -9.158 1.00 0.00 C ATOM 806 O PHE A 110 -3.389 -2.933 -9.360 1.00 0.00 O ATOM 807 CB PHE A 110 -3.234 0.223 -10.235 1.00 0.00 C ATOM 808 CG PHE A 110 -2.814 1.332 -11.157 1.00 0.00 C ATOM 809 CD1 PHE A 110 -1.867 2.261 -10.758 1.00 0.00 C ATOM 810 CD2 PHE A 110 -3.365 1.444 -12.423 1.00 0.00 C ATOM 811 CE1 PHE A 110 -1.479 3.282 -11.605 1.00 0.00 C ATOM 812 CE2 PHE A 110 -2.981 2.463 -13.274 1.00 0.00 C ATOM 813 CZ PHE A 110 -2.036 3.383 -12.865 1.00 0.00 C ATOM 0 H PHE A 110 -3.049 -2.453 -11.602 1.00 0.00 H new ATOM 0 HA PHE A 110 -1.280 -0.670 -10.155 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.247 -0.087 -10.490 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -3.264 0.602 -9.214 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.427 2.187 -9.774 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.103 0.726 -12.749 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.740 4.001 -11.282 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.420 2.540 -14.258 1.00 0.00 H new ATOM 0 HZ PHE A 110 -1.733 4.179 -13.529 1.00 0.00 H new ATOM 823 N GLY A 111 -2.138 -1.686 -7.967 1.00 0.00 N ATOM 824 CA GLY A 111 -2.406 -2.538 -6.823 1.00 0.00 C ATOM 825 C GLY A 111 -2.570 -1.750 -5.539 1.00 0.00 C ATOM 826 O GLY A 111 -1.979 -0.682 -5.377 1.00 0.00 O ATOM 0 H GLY A 111 -1.533 -0.888 -7.774 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.311 -3.116 -7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.590 -3.251 -6.706 1.00 0.00 H new ATOM 830 N PHE A 112 -3.377 -2.276 -4.623 1.00 0.00 N ATOM 831 CA PHE A 112 -3.620 -1.613 -3.347 1.00 0.00 C ATOM 832 C PHE A 112 -3.216 -2.511 -2.182 1.00 0.00 C ATOM 833 O PHE A 112 -3.589 -3.684 -2.131 1.00 0.00 O ATOM 834 CB PHE A 112 -5.096 -1.227 -3.222 1.00 0.00 C ATOM 835 CG PHE A 112 -5.566 -0.297 -4.303 1.00 0.00 C ATOM 836 CD1 PHE A 112 -5.971 -0.791 -5.533 1.00 0.00 C ATOM 837 CD2 PHE A 112 -5.604 1.072 -4.089 1.00 0.00 C ATOM 838 CE1 PHE A 112 -6.405 0.063 -6.530 1.00 0.00 C ATOM 839 CE2 PHE A 112 -6.038 1.930 -5.082 1.00 0.00 C ATOM 840 CZ PHE A 112 -6.437 1.425 -6.304 1.00 0.00 C ATOM 0 H PHE A 112 -3.874 -3.159 -4.741 1.00 0.00 H new ATOM 0 HA PHE A 112 -3.011 -0.709 -3.313 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.703 -2.132 -3.243 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -5.259 -0.756 -2.253 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -5.947 -1.855 -5.715 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -5.291 1.473 -3.136 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -6.718 -0.334 -7.484 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -6.065 2.995 -4.902 1.00 0.00 H new ATOM 0 HZ PHE A 112 -6.774 2.094 -7.082 1.00 0.00 H new ATOM 850 N ILE A 113 -2.453 -1.952 -1.249 1.00 0.00 N ATOM 851 CA ILE A 113 -1.999 -2.702 -0.084 1.00 0.00 C ATOM 852 C ILE A 113 -2.422 -2.016 1.210 1.00 0.00 C ATOM 853 O ILE A 113 -2.255 -0.806 1.366 1.00 0.00 O ATOM 854 CB ILE A 113 -0.468 -2.872 -0.086 1.00 0.00 C ATOM 855 CG1 ILE A 113 -0.034 -3.789 1.060 1.00 0.00 C ATOM 856 CG2 ILE A 113 0.215 -1.518 0.024 1.00 0.00 C ATOM 857 CD1 ILE A 113 1.222 -4.576 0.761 1.00 0.00 C ATOM 0 H ILE A 113 -2.136 -0.983 -1.277 1.00 0.00 H new ATOM 0 HA ILE A 113 -2.465 -3.686 -0.140 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.169 -3.332 -1.028 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.128 -3.187 1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.843 -4.484 1.285 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.296 -1.655 0.021 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -0.074 -0.895 -0.822 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -0.087 -1.032 0.952 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.470 -5.204 1.617 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.058 -5.204 -0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.044 -3.888 0.565 1.00 0.00 H new ATOM 869 N ARG A 114 -2.968 -2.797 2.136 1.00 0.00 N ATOM 870 CA ARG A 114 -3.414 -2.264 3.418 1.00 0.00 C ATOM 871 C ARG A 114 -2.628 -2.887 4.569 1.00 0.00 C ATOM 872 O ARG A 114 -2.727 -4.087 4.825 1.00 0.00 O ATOM 873 CB ARG A 114 -4.909 -2.523 3.610 1.00 0.00 C ATOM 874 CG ARG A 114 -5.521 -1.738 4.758 1.00 0.00 C ATOM 875 CD ARG A 114 -6.681 -2.490 5.392 1.00 0.00 C ATOM 876 NE ARG A 114 -6.236 -3.384 6.457 1.00 0.00 N ATOM 877 CZ ARG A 114 -6.912 -4.460 6.844 1.00 0.00 C ATOM 878 NH1 ARG A 114 -8.058 -4.775 6.255 1.00 0.00 N ATOM 879 NH2 ARG A 114 -6.443 -5.225 7.821 1.00 0.00 N ATOM 0 H ARG A 114 -3.112 -3.800 2.023 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.235 -1.189 3.418 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.434 -2.271 2.688 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.065 -3.587 3.785 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.759 -1.540 5.512 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -5.868 -0.771 4.394 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -7.399 -1.776 5.795 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -7.200 -3.067 4.627 1.00 0.00 H new ATOM 0 HE ARG A 114 -5.358 -3.171 6.930 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -8.422 -4.190 5.503 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -8.575 -5.602 6.554 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -5.562 -4.987 8.277 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -6.964 -6.051 8.117 1.00 0.00 H new ATOM 893 N LEU A 115 -1.846 -2.063 5.258 1.00 0.00 N ATOM 894 CA LEU A 115 -1.042 -2.532 6.381 1.00 0.00 C ATOM 895 C LEU A 115 -1.870 -2.581 7.661 1.00 0.00 C ATOM 896 O LEU A 115 -3.068 -2.302 7.646 1.00 0.00 O ATOM 897 CB LEU A 115 0.171 -1.621 6.580 1.00 0.00 C ATOM 898 CG LEU A 115 0.938 -1.238 5.314 1.00 0.00 C ATOM 899 CD1 LEU A 115 2.057 -0.262 5.642 1.00 0.00 C ATOM 900 CD2 LEU A 115 1.494 -2.479 4.631 1.00 0.00 C ATOM 0 H LEU A 115 -1.752 -1.067 5.059 1.00 0.00 H new ATOM 0 HA LEU A 115 -0.698 -3.541 6.154 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.163 -0.706 7.069 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.862 -2.114 7.264 1.00 0.00 H new ATOM 0 HG LEU A 115 0.247 -0.749 4.628 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.592 -0.001 4.729 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.635 0.640 6.086 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.748 -0.724 6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 115 2.037 -2.187 3.732 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.170 -2.996 5.311 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.674 -3.144 4.360 1.00 0.00 H new ATOM 912 N GLU A 116 -1.222 -2.936 8.766 1.00 0.00 N ATOM 913 CA GLU A 116 -1.900 -3.021 10.054 1.00 0.00 C ATOM 914 C GLU A 116 -1.880 -1.672 10.769 1.00 0.00 C ATOM 915 O GLU A 116 -2.928 -1.084 11.039 1.00 0.00 O ATOM 916 CB GLU A 116 -1.241 -4.086 10.933 1.00 0.00 C ATOM 917 CG GLU A 116 -1.821 -4.161 12.336 1.00 0.00 C ATOM 918 CD GLU A 116 -1.321 -5.366 13.110 1.00 0.00 C ATOM 919 OE1 GLU A 116 -0.210 -5.291 13.673 1.00 0.00 O ATOM 920 OE2 GLU A 116 -2.044 -6.384 13.151 1.00 0.00 O ATOM 0 H GLU A 116 -0.229 -3.169 8.795 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.937 -3.302 9.872 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -1.347 -5.059 10.452 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -0.173 -3.879 11.001 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.564 -3.252 12.880 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.909 -4.199 12.274 1.00 0.00 H new ATOM 927 N THR A 117 -0.680 -1.188 11.073 1.00 0.00 N ATOM 928 CA THR A 117 -0.522 0.089 11.757 1.00 0.00 C ATOM 929 C THR A 117 -0.276 1.219 10.763 1.00 0.00 C ATOM 930 O THR A 117 -0.050 0.977 9.577 1.00 0.00 O ATOM 931 CB THR A 117 0.641 0.046 12.766 1.00 0.00 C ATOM 932 OG1 THR A 117 1.855 -0.315 12.099 1.00 0.00 O ATOM 933 CG2 THR A 117 0.353 -0.949 13.881 1.00 0.00 C ATOM 0 H THR A 117 0.197 -1.662 10.856 1.00 0.00 H new ATOM 0 HA THR A 117 -1.452 0.277 12.294 1.00 0.00 H new ATOM 0 HB THR A 117 0.750 1.038 13.205 1.00 0.00 H new ATOM 0 HG1 THR A 117 2.503 -0.647 12.755 1.00 0.00 H new ATOM 0 HG21 THR A 117 1.188 -0.962 14.581 1.00 0.00 H new ATOM 0 HG22 THR A 117 -0.556 -0.655 14.406 1.00 0.00 H new ATOM 0 HG23 THR A 117 0.220 -1.944 13.456 1.00 0.00 H new ATOM 941 N ARG A 118 -0.320 2.453 11.254 1.00 0.00 N ATOM 942 CA ARG A 118 -0.102 3.620 10.408 1.00 0.00 C ATOM 943 C ARG A 118 1.388 3.909 10.254 1.00 0.00 C ATOM 944 O ARG A 118 1.881 4.115 9.144 1.00 0.00 O ATOM 945 CB ARG A 118 -0.811 4.842 10.995 1.00 0.00 C ATOM 946 CG ARG A 118 -1.266 5.844 9.947 1.00 0.00 C ATOM 947 CD ARG A 118 -2.327 6.784 10.499 1.00 0.00 C ATOM 948 NE ARG A 118 -1.740 7.976 11.106 1.00 0.00 N ATOM 949 CZ ARG A 118 -1.104 8.915 10.415 1.00 0.00 C ATOM 950 NH1 ARG A 118 -0.973 8.802 9.100 1.00 0.00 N ATOM 951 NH2 ARG A 118 -0.597 9.971 11.039 1.00 0.00 N ATOM 0 H ARG A 118 -0.505 2.670 12.233 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.517 3.406 9.423 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -1.677 4.509 11.567 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -0.139 5.340 11.694 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -0.410 6.423 9.600 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -1.663 5.313 9.082 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -3.001 7.081 9.696 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -2.927 6.257 11.241 1.00 0.00 H new ATOM 0 HE ARG A 118 -1.823 8.094 12.116 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -1.361 7.992 8.617 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -0.484 9.525 8.572 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -0.696 10.062 12.050 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -0.109 10.692 10.507 1.00 0.00 H new ATOM 965 N THR A 119 2.103 3.923 11.375 1.00 0.00 N ATOM 966 CA THR A 119 3.536 4.188 11.365 1.00 0.00 C ATOM 967 C THR A 119 4.236 3.382 10.277 1.00 0.00 C ATOM 968 O THR A 119 5.077 3.907 9.546 1.00 0.00 O ATOM 969 CB THR A 119 4.177 3.857 12.726 1.00 0.00 C ATOM 970 OG1 THR A 119 3.429 4.469 13.782 1.00 0.00 O ATOM 971 CG2 THR A 119 5.620 4.339 12.775 1.00 0.00 C ATOM 0 H THR A 119 1.712 3.754 12.302 1.00 0.00 H new ATOM 0 HA THR A 119 3.660 5.252 11.162 1.00 0.00 H new ATOM 0 HB THR A 119 4.166 2.775 12.854 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.842 4.252 14.644 1.00 0.00 H new ATOM 0 HG21 THR A 119 6.053 4.095 13.745 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.194 3.850 11.988 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.648 5.419 12.627 1.00 0.00 H new ATOM 979 N LEU A 120 3.885 2.105 10.174 1.00 0.00 N ATOM 980 CA LEU A 120 4.480 1.226 9.173 1.00 0.00 C ATOM 981 C LEU A 120 4.179 1.723 7.763 1.00 0.00 C ATOM 982 O LEU A 120 4.989 1.564 6.852 1.00 0.00 O ATOM 983 CB LEU A 120 3.959 -0.202 9.345 1.00 0.00 C ATOM 984 CG LEU A 120 4.462 -0.956 10.577 1.00 0.00 C ATOM 985 CD1 LEU A 120 3.786 -2.314 10.683 1.00 0.00 C ATOM 986 CD2 LEU A 120 5.975 -1.114 10.524 1.00 0.00 C ATOM 0 H LEU A 120 3.191 1.655 10.771 1.00 0.00 H new ATOM 0 HA LEU A 120 5.560 1.232 9.317 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.870 -0.168 9.384 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.228 -0.775 8.458 1.00 0.00 H new ATOM 0 HG LEU A 120 4.208 -0.376 11.464 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.156 -2.837 11.565 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.708 -2.178 10.767 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.009 -2.902 9.793 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.316 -1.653 11.408 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.251 -1.673 9.630 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.443 -0.130 10.496 1.00 0.00 H new ATOM 998 N ALA A 121 3.007 2.328 7.593 1.00 0.00 N ATOM 999 CA ALA A 121 2.600 2.853 6.295 1.00 0.00 C ATOM 1000 C ALA A 121 3.415 4.087 5.922 1.00 0.00 C ATOM 1001 O ALA A 121 3.790 4.267 4.764 1.00 0.00 O ATOM 1002 CB ALA A 121 1.114 3.180 6.301 1.00 0.00 C ATOM 0 H ALA A 121 2.324 2.466 8.337 1.00 0.00 H new ATOM 0 HA ALA A 121 2.789 2.086 5.544 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.824 3.571 5.326 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.543 2.276 6.514 1.00 0.00 H new ATOM 0 HB3 ALA A 121 0.909 3.928 7.067 1.00 0.00 H new ATOM 1008 N GLU A 122 3.684 4.934 6.911 1.00 0.00 N ATOM 1009 CA GLU A 122 4.452 6.152 6.684 1.00 0.00 C ATOM 1010 C GLU A 122 5.902 5.824 6.340 1.00 0.00 C ATOM 1011 O GLU A 122 6.440 6.310 5.345 1.00 0.00 O ATOM 1012 CB GLU A 122 4.401 7.052 7.921 1.00 0.00 C ATOM 1013 CG GLU A 122 3.039 7.681 8.159 1.00 0.00 C ATOM 1014 CD GLU A 122 2.906 8.277 9.547 1.00 0.00 C ATOM 1015 OE1 GLU A 122 3.239 7.579 10.528 1.00 0.00 O ATOM 1016 OE2 GLU A 122 2.470 9.443 9.653 1.00 0.00 O ATOM 0 H GLU A 122 3.382 4.799 7.876 1.00 0.00 H new ATOM 0 HA GLU A 122 4.007 6.680 5.841 1.00 0.00 H new ATOM 0 HB2 GLU A 122 4.680 6.467 8.797 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.144 7.843 7.816 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.868 8.459 7.416 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.265 6.927 8.016 1.00 0.00 H new ATOM 1023 N ILE A 123 6.529 4.997 7.171 1.00 0.00 N ATOM 1024 CA ILE A 123 7.916 4.604 6.955 1.00 0.00 C ATOM 1025 C ILE A 123 8.060 3.774 5.684 1.00 0.00 C ATOM 1026 O ILE A 123 8.893 4.070 4.828 1.00 0.00 O ATOM 1027 CB ILE A 123 8.464 3.798 8.146 1.00 0.00 C ATOM 1028 CG1 ILE A 123 8.513 4.671 9.402 1.00 0.00 C ATOM 1029 CG2 ILE A 123 9.845 3.248 7.823 1.00 0.00 C ATOM 1030 CD1 ILE A 123 8.640 3.879 10.684 1.00 0.00 C ATOM 0 H ILE A 123 6.098 4.587 8.000 1.00 0.00 H new ATOM 0 HA ILE A 123 8.493 5.523 6.853 1.00 0.00 H new ATOM 0 HB ILE A 123 7.795 2.959 8.336 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.355 5.358 9.324 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.609 5.278 9.448 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.219 2.680 8.675 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.782 2.596 6.952 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.525 4.073 7.610 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.669 4.562 11.533 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.785 3.211 10.785 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.558 3.292 10.660 1.00 0.00 H new ATOM 1042 N ALA A 124 7.241 2.733 5.567 1.00 0.00 N ATOM 1043 CA ALA A 124 7.275 1.862 4.399 1.00 0.00 C ATOM 1044 C ALA A 124 6.953 2.638 3.126 1.00 0.00 C ATOM 1045 O ALA A 124 7.457 2.320 2.049 1.00 0.00 O ATOM 1046 CB ALA A 124 6.302 0.706 4.575 1.00 0.00 C ATOM 0 H ALA A 124 6.546 2.473 6.267 1.00 0.00 H new ATOM 0 HA ALA A 124 8.284 1.462 4.304 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.338 0.063 3.695 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.578 0.129 5.457 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.292 1.096 4.699 1.00 0.00 H new ATOM 1052 N LYS A 125 6.109 3.656 3.257 1.00 0.00 N ATOM 1053 CA LYS A 125 5.720 4.478 2.117 1.00 0.00 C ATOM 1054 C LYS A 125 6.844 5.432 1.725 1.00 0.00 C ATOM 1055 O LYS A 125 7.204 5.533 0.552 1.00 0.00 O ATOM 1056 CB LYS A 125 4.454 5.273 2.445 1.00 0.00 C ATOM 1057 CG LYS A 125 4.055 6.257 1.359 1.00 0.00 C ATOM 1058 CD LYS A 125 4.695 7.617 1.576 1.00 0.00 C ATOM 1059 CE LYS A 125 4.171 8.645 0.585 1.00 0.00 C ATOM 1060 NZ LYS A 125 4.640 10.020 0.911 1.00 0.00 N ATOM 0 H LYS A 125 5.681 3.931 4.141 1.00 0.00 H new ATOM 0 HA LYS A 125 5.519 3.816 1.275 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.632 4.577 2.613 1.00 0.00 H new ATOM 0 HB3 LYS A 125 4.608 5.816 3.377 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.351 5.866 0.386 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.970 6.363 1.343 1.00 0.00 H new ATOM 0 HD2 LYS A 125 4.496 7.956 2.593 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.777 7.531 1.475 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.497 8.379 -0.420 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.081 8.624 0.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.261 10.691 0.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.307 10.284 1.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.679 10.047 0.888 1.00 0.00 H new ATOM 1074 N VAL A 126 7.396 6.128 2.714 1.00 0.00 N ATOM 1075 CA VAL A 126 8.481 7.071 2.472 1.00 0.00 C ATOM 1076 C VAL A 126 9.729 6.355 1.970 1.00 0.00 C ATOM 1077 O VAL A 126 10.609 6.970 1.367 1.00 0.00 O ATOM 1078 CB VAL A 126 8.833 7.861 3.747 1.00 0.00 C ATOM 1079 CG1 VAL A 126 9.837 8.959 3.434 1.00 0.00 C ATOM 1080 CG2 VAL A 126 7.576 8.440 4.378 1.00 0.00 C ATOM 0 H VAL A 126 7.109 6.056 3.690 1.00 0.00 H new ATOM 0 HA VAL A 126 8.132 7.766 1.708 1.00 0.00 H new ATOM 0 HB VAL A 126 9.290 7.178 4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 126 10.074 9.506 4.346 1.00 0.00 H new ATOM 0 HG12 VAL A 126 10.747 8.515 3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 126 9.411 9.643 2.701 1.00 0.00 H new ATOM 0 HG21 VAL A 126 7.843 8.995 5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 126 7.089 9.110 3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 126 6.894 7.631 4.640 1.00 0.00 H new ATOM 1090 N GLU A 127 9.799 5.052 2.221 1.00 0.00 N ATOM 1091 CA GLU A 127 10.942 4.252 1.794 1.00 0.00 C ATOM 1092 C GLU A 127 10.667 3.587 0.449 1.00 0.00 C ATOM 1093 O GLU A 127 11.448 3.722 -0.494 1.00 0.00 O ATOM 1094 CB GLU A 127 11.269 3.188 2.844 1.00 0.00 C ATOM 1095 CG GLU A 127 12.073 3.719 4.019 1.00 0.00 C ATOM 1096 CD GLU A 127 12.947 2.656 4.656 1.00 0.00 C ATOM 1097 OE1 GLU A 127 13.588 1.889 3.907 1.00 0.00 O ATOM 1098 OE2 GLU A 127 12.991 2.591 5.902 1.00 0.00 O ATOM 0 H GLU A 127 9.079 4.528 2.717 1.00 0.00 H new ATOM 0 HA GLU A 127 11.798 4.917 1.683 1.00 0.00 H new ATOM 0 HB2 GLU A 127 10.339 2.759 3.216 1.00 0.00 H new ATOM 0 HB3 GLU A 127 11.826 2.380 2.369 1.00 0.00 H new ATOM 0 HG2 GLU A 127 12.699 4.545 3.682 1.00 0.00 H new ATOM 0 HG3 GLU A 127 11.391 4.121 4.769 1.00 0.00 H new ATOM 1105 N LEU A 128 9.554 2.867 0.367 1.00 0.00 N ATOM 1106 CA LEU A 128 9.175 2.179 -0.862 1.00 0.00 C ATOM 1107 C LEU A 128 9.112 3.154 -2.034 1.00 0.00 C ATOM 1108 O LEU A 128 9.410 2.792 -3.172 1.00 0.00 O ATOM 1109 CB LEU A 128 7.823 1.486 -0.687 1.00 0.00 C ATOM 1110 CG LEU A 128 7.834 0.186 0.117 1.00 0.00 C ATOM 1111 CD1 LEU A 128 6.438 -0.413 0.183 1.00 0.00 C ATOM 1112 CD2 LEU A 128 8.814 -0.808 -0.491 1.00 0.00 C ATOM 0 H LEU A 128 8.897 2.744 1.138 1.00 0.00 H new ATOM 0 HA LEU A 128 9.935 1.428 -1.078 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.140 2.184 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 128 7.415 1.275 -1.675 1.00 0.00 H new ATOM 0 HG LEU A 128 8.158 0.412 1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 128 6.466 -1.338 0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 128 5.761 0.294 0.663 1.00 0.00 H new ATOM 0 HD13 LEU A 128 6.085 -0.625 -0.826 1.00 0.00 H new ATOM 0 HD21 LEU A 128 8.809 -1.728 0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 128 8.519 -1.029 -1.517 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.816 -0.380 -0.486 1.00 0.00 H new ATOM 1124 N ASP A 129 8.723 4.392 -1.747 1.00 0.00 N ATOM 1125 CA ASP A 129 8.624 5.420 -2.776 1.00 0.00 C ATOM 1126 C ASP A 129 9.894 5.468 -3.620 1.00 0.00 C ATOM 1127 O ASP A 129 10.990 5.672 -3.099 1.00 0.00 O ATOM 1128 CB ASP A 129 8.369 6.787 -2.138 1.00 0.00 C ATOM 1129 CG ASP A 129 9.652 7.493 -1.748 1.00 0.00 C ATOM 1130 OD1 ASP A 129 10.470 6.883 -1.027 1.00 0.00 O ATOM 1131 OD2 ASP A 129 9.839 8.655 -2.165 1.00 0.00 O ATOM 0 H ASP A 129 8.471 4.707 -0.810 1.00 0.00 H new ATOM 0 HA ASP A 129 7.786 5.169 -3.426 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.812 7.412 -2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 129 7.744 6.661 -1.254 1.00 0.00 H new ATOM 1136 N ASN A 130 9.738 5.278 -4.926 1.00 0.00 N ATOM 1137 CA ASN A 130 10.872 5.298 -5.843 1.00 0.00 C ATOM 1138 C ASN A 130 11.760 4.074 -5.636 1.00 0.00 C ATOM 1139 O ASN A 130 12.976 4.195 -5.489 1.00 0.00 O ATOM 1140 CB ASN A 130 11.691 6.575 -5.645 1.00 0.00 C ATOM 1141 CG ASN A 130 12.392 7.015 -6.916 1.00 0.00 C ATOM 1142 OD1 ASN A 130 12.829 6.187 -7.715 1.00 0.00 O ATOM 1143 ND2 ASN A 130 12.502 8.324 -7.109 1.00 0.00 N ATOM 0 H ASN A 130 8.837 5.108 -5.373 1.00 0.00 H new ATOM 0 HA ASN A 130 10.485 5.276 -6.862 1.00 0.00 H new ATOM 0 HB2 ASN A 130 11.035 7.374 -5.300 1.00 0.00 H new ATOM 0 HB3 ASN A 130 12.432 6.411 -4.863 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.964 8.679 -7.946 1.00 0.00 H new ATOM 0 HD22 ASN A 130 12.125 8.975 -6.420 1.00 0.00 H new ATOM 1150 N MET A 131 11.143 2.897 -5.628 1.00 0.00 N ATOM 1151 CA MET A 131 11.877 1.651 -5.442 1.00 0.00 C ATOM 1152 C MET A 131 11.895 0.833 -6.729 1.00 0.00 C ATOM 1153 O MET A 131 10.865 0.607 -7.364 1.00 0.00 O ATOM 1154 CB MET A 131 11.254 0.831 -4.311 1.00 0.00 C ATOM 1155 CG MET A 131 12.057 -0.407 -3.944 1.00 0.00 C ATOM 1156 SD MET A 131 11.286 -1.369 -2.628 1.00 0.00 S ATOM 1157 CE MET A 131 10.085 -2.316 -3.561 1.00 0.00 C ATOM 0 H MET A 131 10.137 2.780 -5.748 1.00 0.00 H new ATOM 0 HA MET A 131 12.904 1.900 -5.177 1.00 0.00 H new ATOM 0 HB2 MET A 131 11.152 1.463 -3.429 1.00 0.00 H new ATOM 0 HB3 MET A 131 10.249 0.528 -4.604 1.00 0.00 H new ATOM 0 HG2 MET A 131 12.174 -1.035 -4.827 1.00 0.00 H new ATOM 0 HG3 MET A 131 13.057 -0.107 -3.632 1.00 0.00 H new ATOM 0 HE1 MET A 131 10.059 -3.340 -3.187 1.00 0.00 H new ATOM 0 HE2 MET A 131 9.099 -1.864 -3.450 1.00 0.00 H new ATOM 0 HE3 MET A 131 10.365 -2.322 -4.614 1.00 0.00 H new ATOM 1167 N PRO A 132 13.094 0.379 -7.126 1.00 0.00 N ATOM 1168 CA PRO A 132 13.274 -0.421 -8.341 1.00 0.00 C ATOM 1169 C PRO A 132 12.678 -1.818 -8.209 1.00 0.00 C ATOM 1170 O PRO A 132 12.888 -2.501 -7.205 1.00 0.00 O ATOM 1171 CB PRO A 132 14.795 -0.500 -8.491 1.00 0.00 C ATOM 1172 CG PRO A 132 15.322 -0.320 -7.109 1.00 0.00 C ATOM 1173 CD PRO A 132 14.364 0.611 -6.419 1.00 0.00 C ATOM 0 HA PRO A 132 12.770 0.022 -9.200 1.00 0.00 H new ATOM 0 HB2 PRO A 132 15.102 -1.458 -8.910 1.00 0.00 H new ATOM 0 HB3 PRO A 132 15.168 0.275 -9.161 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.383 -1.275 -6.587 1.00 0.00 H new ATOM 0 HG3 PRO A 132 16.328 0.098 -7.126 1.00 0.00 H new ATOM 0 HD2 PRO A 132 14.279 0.385 -5.356 1.00 0.00 H new ATOM 0 HD3 PRO A 132 14.685 1.650 -6.499 1.00 0.00 H new ATOM 1181 N LEU A 133 11.936 -2.239 -9.227 1.00 0.00 N ATOM 1182 CA LEU A 133 11.310 -3.556 -9.225 1.00 0.00 C ATOM 1183 C LEU A 133 11.501 -4.252 -10.569 1.00 0.00 C ATOM 1184 O LEU A 133 10.817 -3.940 -11.544 1.00 0.00 O ATOM 1185 CB LEU A 133 9.818 -3.433 -8.909 1.00 0.00 C ATOM 1186 CG LEU A 133 9.122 -4.715 -8.449 1.00 0.00 C ATOM 1187 CD1 LEU A 133 9.668 -5.165 -7.103 1.00 0.00 C ATOM 1188 CD2 LEU A 133 7.616 -4.506 -8.374 1.00 0.00 C ATOM 0 H LEU A 133 11.753 -1.687 -10.065 1.00 0.00 H new ATOM 0 HA LEU A 133 11.790 -4.158 -8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.692 -2.677 -8.134 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.307 -3.065 -9.799 1.00 0.00 H new ATOM 0 HG LEU A 133 9.324 -5.498 -9.180 1.00 0.00 H new ATOM 0 HD11 LEU A 133 9.161 -6.078 -6.792 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.738 -5.355 -7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.497 -4.384 -6.362 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.137 -5.428 -8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.394 -3.709 -7.665 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.237 -4.231 -9.359 1.00 0.00 H new ATOM 1200 N ARG A 134 12.434 -5.198 -10.612 1.00 0.00 N ATOM 1201 CA ARG A 134 12.714 -5.939 -11.836 1.00 0.00 C ATOM 1202 C ARG A 134 13.046 -4.988 -12.983 1.00 0.00 C ATOM 1203 O ARG A 134 12.848 -5.317 -14.152 1.00 0.00 O ATOM 1204 CB ARG A 134 11.517 -6.813 -12.214 1.00 0.00 C ATOM 1205 CG ARG A 134 11.494 -8.155 -11.502 1.00 0.00 C ATOM 1206 CD ARG A 134 10.787 -9.214 -12.332 1.00 0.00 C ATOM 1207 NE ARG A 134 11.670 -9.805 -13.334 1.00 0.00 N ATOM 1208 CZ ARG A 134 11.399 -10.934 -13.979 1.00 0.00 C ATOM 1209 NH1 ARG A 134 10.275 -11.592 -13.727 1.00 0.00 N ATOM 1210 NH2 ARG A 134 12.252 -11.408 -14.877 1.00 0.00 N ATOM 0 H ARG A 134 13.008 -5.469 -9.814 1.00 0.00 H new ATOM 0 HA ARG A 134 13.578 -6.578 -11.655 1.00 0.00 H new ATOM 0 HB2 ARG A 134 10.598 -6.274 -11.985 1.00 0.00 H new ATOM 0 HB3 ARG A 134 11.527 -6.983 -13.291 1.00 0.00 H new ATOM 0 HG2 ARG A 134 12.515 -8.476 -11.295 1.00 0.00 H new ATOM 0 HG3 ARG A 134 10.991 -8.049 -10.541 1.00 0.00 H new ATOM 0 HD2 ARG A 134 10.410 -9.997 -11.675 1.00 0.00 H new ATOM 0 HD3 ARG A 134 9.923 -8.770 -12.827 1.00 0.00 H new ATOM 0 HE ARG A 134 12.543 -9.324 -13.550 1.00 0.00 H new ATOM 0 HH11 ARG A 134 9.617 -11.231 -13.037 1.00 0.00 H new ATOM 0 HH12 ARG A 134 10.069 -12.459 -14.224 1.00 0.00 H new ATOM 0 HH21 ARG A 134 13.118 -10.905 -15.073 1.00 0.00 H new ATOM 0 HH22 ARG A 134 12.042 -12.275 -15.371 1.00 0.00 H new ATOM 1224 N GLY A 135 13.552 -3.808 -12.640 1.00 0.00 N ATOM 1225 CA GLY A 135 13.903 -2.828 -13.651 1.00 0.00 C ATOM 1226 C GLY A 135 12.847 -1.752 -13.806 1.00 0.00 C ATOM 1227 O GLY A 135 13.111 -0.687 -14.366 1.00 0.00 O ATOM 0 H GLY A 135 13.725 -3.513 -11.679 1.00 0.00 H new ATOM 0 HA2 GLY A 135 14.854 -2.364 -13.389 1.00 0.00 H new ATOM 0 HA3 GLY A 135 14.047 -3.332 -14.607 1.00 0.00 H new ATOM 1231 N LYS A 136 11.645 -2.028 -13.311 1.00 0.00 N ATOM 1232 CA LYS A 136 10.544 -1.076 -13.397 1.00 0.00 C ATOM 1233 C LYS A 136 10.541 -0.138 -12.193 1.00 0.00 C ATOM 1234 O LYS A 136 11.304 -0.327 -11.247 1.00 0.00 O ATOM 1235 CB LYS A 136 9.208 -1.817 -13.483 1.00 0.00 C ATOM 1236 CG LYS A 136 9.088 -2.714 -14.702 1.00 0.00 C ATOM 1237 CD LYS A 136 8.655 -1.931 -15.931 1.00 0.00 C ATOM 1238 CE LYS A 136 7.158 -1.664 -15.923 1.00 0.00 C ATOM 1239 NZ LYS A 136 6.702 -1.021 -17.186 1.00 0.00 N ATOM 0 H LYS A 136 11.409 -2.904 -12.846 1.00 0.00 H new ATOM 0 HA LYS A 136 10.681 -0.480 -14.299 1.00 0.00 H new ATOM 0 HB2 LYS A 136 9.078 -2.420 -12.584 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.398 -1.088 -13.498 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.046 -3.196 -14.896 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.367 -3.507 -14.502 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.194 -0.984 -15.969 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.922 -2.486 -16.830 1.00 0.00 H new ATOM 0 HE2 LYS A 136 6.623 -2.603 -15.780 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.908 -1.022 -15.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.676 -0.856 -17.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.194 -0.113 -17.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.917 -1.644 -17.990 1.00 0.00 H new ATOM 1253 N GLN A 137 9.676 0.870 -12.237 1.00 0.00 N ATOM 1254 CA GLN A 137 9.574 1.836 -11.150 1.00 0.00 C ATOM 1255 C GLN A 137 8.278 1.642 -10.369 1.00 0.00 C ATOM 1256 O GLN A 137 7.241 1.305 -10.942 1.00 0.00 O ATOM 1257 CB GLN A 137 9.644 3.263 -11.698 1.00 0.00 C ATOM 1258 CG GLN A 137 11.051 3.705 -12.065 1.00 0.00 C ATOM 1259 CD GLN A 137 11.063 4.829 -13.083 1.00 0.00 C ATOM 1260 OE1 GLN A 137 10.178 4.920 -13.934 1.00 0.00 O ATOM 1261 NE2 GLN A 137 12.069 5.692 -13.000 1.00 0.00 N ATOM 0 H GLN A 137 9.036 1.039 -13.013 1.00 0.00 H new ATOM 0 HA GLN A 137 10.413 1.673 -10.473 1.00 0.00 H new ATOM 0 HB2 GLN A 137 9.007 3.336 -12.580 1.00 0.00 H new ATOM 0 HB3 GLN A 137 9.239 3.949 -10.954 1.00 0.00 H new ATOM 0 HG2 GLN A 137 11.572 4.030 -11.164 1.00 0.00 H new ATOM 0 HG3 GLN A 137 11.603 2.854 -12.463 1.00 0.00 H new ATOM 0 HE21 GLN A 137 12.781 5.578 -12.278 1.00 0.00 H new ATOM 0 HE22 GLN A 137 12.130 6.469 -13.658 1.00 0.00 H new ATOM 1270 N LEU A 138 8.345 1.856 -9.060 1.00 0.00 N ATOM 1271 CA LEU A 138 7.176 1.704 -8.200 1.00 0.00 C ATOM 1272 C LEU A 138 6.741 3.050 -7.630 1.00 0.00 C ATOM 1273 O LEU A 138 7.536 3.762 -7.015 1.00 0.00 O ATOM 1274 CB LEU A 138 7.481 0.730 -7.060 1.00 0.00 C ATOM 1275 CG LEU A 138 7.517 -0.752 -7.436 1.00 0.00 C ATOM 1276 CD1 LEU A 138 7.992 -1.590 -6.260 1.00 0.00 C ATOM 1277 CD2 LEU A 138 6.145 -1.217 -7.904 1.00 0.00 C ATOM 0 H LEU A 138 9.195 2.135 -8.571 1.00 0.00 H new ATOM 0 HA LEU A 138 6.361 1.305 -8.803 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.445 0.998 -6.628 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.732 0.869 -6.280 1.00 0.00 H new ATOM 0 HG LEU A 138 8.223 -0.881 -8.257 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.011 -2.641 -6.547 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.994 -1.275 -5.970 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.312 -1.455 -5.419 1.00 0.00 H new ATOM 0 HD21 LEU A 138 6.189 -2.274 -8.167 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.419 -1.073 -7.104 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.843 -0.638 -8.777 1.00 0.00 H new ATOM 1289 N ARG A 139 5.473 3.392 -7.836 1.00 0.00 N ATOM 1290 CA ARG A 139 4.932 4.653 -7.342 1.00 0.00 C ATOM 1291 C ARG A 139 4.089 4.429 -6.090 1.00 0.00 C ATOM 1292 O ARG A 139 2.976 3.908 -6.163 1.00 0.00 O ATOM 1293 CB ARG A 139 4.088 5.329 -8.424 1.00 0.00 C ATOM 1294 CG ARG A 139 3.355 6.569 -7.939 1.00 0.00 C ATOM 1295 CD ARG A 139 4.318 7.714 -7.668 1.00 0.00 C ATOM 1296 NE ARG A 139 3.679 8.805 -6.938 1.00 0.00 N ATOM 1297 CZ ARG A 139 4.308 9.920 -6.583 1.00 0.00 C ATOM 1298 NH1 ARG A 139 5.587 10.090 -6.890 1.00 0.00 N ATOM 1299 NH2 ARG A 139 3.659 10.868 -5.919 1.00 0.00 N ATOM 0 H ARG A 139 4.802 2.814 -8.341 1.00 0.00 H new ATOM 0 HA ARG A 139 5.768 5.303 -7.085 1.00 0.00 H new ATOM 0 HB2 ARG A 139 4.734 5.602 -9.259 1.00 0.00 H new ATOM 0 HB3 ARG A 139 3.360 4.613 -8.805 1.00 0.00 H new ATOM 0 HG2 ARG A 139 2.623 6.876 -8.686 1.00 0.00 H new ATOM 0 HG3 ARG A 139 2.802 6.334 -7.030 1.00 0.00 H new ATOM 0 HD2 ARG A 139 5.169 7.344 -7.096 1.00 0.00 H new ATOM 0 HD3 ARG A 139 4.709 8.090 -8.613 1.00 0.00 H new ATOM 0 HE ARG A 139 2.695 8.706 -6.687 1.00 0.00 H new ATOM 0 HH11 ARG A 139 6.090 9.364 -7.400 1.00 0.00 H new ATOM 0 HH12 ARG A 139 6.068 10.947 -6.616 1.00 0.00 H new ATOM 0 HH21 ARG A 139 2.675 10.741 -5.680 1.00 0.00 H new ATOM 0 HH22 ARG A 139 4.144 11.723 -5.647 1.00 0.00 H new ATOM 1313 N VAL A 140 4.628 4.825 -4.941 1.00 0.00 N ATOM 1314 CA VAL A 140 3.925 4.668 -3.673 1.00 0.00 C ATOM 1315 C VAL A 140 3.373 6.002 -3.183 1.00 0.00 C ATOM 1316 O VAL A 140 4.129 6.912 -2.844 1.00 0.00 O ATOM 1317 CB VAL A 140 4.848 4.078 -2.590 1.00 0.00 C ATOM 1318 CG1 VAL A 140 4.033 3.601 -1.397 1.00 0.00 C ATOM 1319 CG2 VAL A 140 5.683 2.943 -3.163 1.00 0.00 C ATOM 0 H VAL A 140 5.549 5.257 -4.862 1.00 0.00 H new ATOM 0 HA VAL A 140 3.099 3.979 -3.851 1.00 0.00 H new ATOM 0 HB VAL A 140 5.525 4.860 -2.248 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.701 3.187 -0.642 1.00 0.00 H new ATOM 0 HG12 VAL A 140 3.482 4.441 -0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.331 2.833 -1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.329 2.538 -2.384 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.024 2.157 -3.533 1.00 0.00 H new ATOM 0 HG23 VAL A 140 6.295 3.319 -3.983 1.00 0.00 H new ATOM 1329 N ARG A 141 2.048 6.110 -3.147 1.00 0.00 N ATOM 1330 CA ARG A 141 1.394 7.333 -2.698 1.00 0.00 C ATOM 1331 C ARG A 141 0.200 7.013 -1.803 1.00 0.00 C ATOM 1332 O ARG A 141 -0.353 5.914 -1.856 1.00 0.00 O ATOM 1333 CB ARG A 141 0.937 8.162 -3.900 1.00 0.00 C ATOM 1334 CG ARG A 141 -0.289 7.598 -4.599 1.00 0.00 C ATOM 1335 CD ARG A 141 -1.018 8.668 -5.397 1.00 0.00 C ATOM 1336 NE ARG A 141 -0.525 8.757 -6.769 1.00 0.00 N ATOM 1337 CZ ARG A 141 -0.911 9.694 -7.628 1.00 0.00 C ATOM 1338 NH1 ARG A 141 -1.789 10.616 -7.259 1.00 0.00 N ATOM 1339 NH2 ARG A 141 -0.418 9.710 -8.860 1.00 0.00 N ATOM 0 H ARG A 141 1.408 5.366 -3.423 1.00 0.00 H new ATOM 0 HA ARG A 141 2.115 7.911 -2.120 1.00 0.00 H new ATOM 0 HB2 ARG A 141 0.721 9.178 -3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 141 1.755 8.228 -4.617 1.00 0.00 H new ATOM 0 HG2 ARG A 141 0.011 6.788 -5.264 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -0.966 7.170 -3.860 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -2.085 8.448 -5.409 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.897 9.633 -4.905 1.00 0.00 H new ATOM 0 HE ARG A 141 0.152 8.062 -7.085 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -2.170 10.607 -6.313 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -2.083 11.334 -7.921 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.258 9.002 -9.148 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -0.715 10.430 -9.519 1.00 0.00 H new ATOM 1353 N PHE A 142 -0.193 7.981 -0.982 1.00 0.00 N ATOM 1354 CA PHE A 142 -1.320 7.803 -0.074 1.00 0.00 C ATOM 1355 C PHE A 142 -2.645 7.953 -0.816 1.00 0.00 C ATOM 1356 O PHE A 142 -2.877 8.951 -1.498 1.00 0.00 O ATOM 1357 CB PHE A 142 -1.246 8.816 1.070 1.00 0.00 C ATOM 1358 CG PHE A 142 -0.262 8.440 2.141 1.00 0.00 C ATOM 1359 CD1 PHE A 142 -0.535 7.402 3.018 1.00 0.00 C ATOM 1360 CD2 PHE A 142 0.936 9.123 2.270 1.00 0.00 C ATOM 1361 CE1 PHE A 142 0.368 7.055 4.004 1.00 0.00 C ATOM 1362 CE2 PHE A 142 1.844 8.779 3.254 1.00 0.00 C ATOM 1363 CZ PHE A 142 1.560 7.743 4.122 1.00 0.00 C ATOM 0 H PHE A 142 0.252 8.897 -0.927 1.00 0.00 H new ATOM 0 HA PHE A 142 -1.266 6.795 0.338 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -0.975 9.791 0.665 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.235 8.921 1.517 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.464 6.858 2.929 1.00 0.00 H new ATOM 0 HD2 PHE A 142 1.163 9.934 1.594 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.142 6.246 4.683 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.774 9.320 3.344 1.00 0.00 H new ATOM 0 HZ PHE A 142 2.268 7.471 4.891 1.00 0.00 H new ATOM 1373 N ALA A 143 -3.510 6.954 -0.678 1.00 0.00 N ATOM 1374 CA ALA A 143 -4.812 6.975 -1.333 1.00 0.00 C ATOM 1375 C ALA A 143 -5.916 7.348 -0.350 1.00 0.00 C ATOM 1376 O ALA A 143 -7.046 6.871 -0.460 1.00 0.00 O ATOM 1377 CB ALA A 143 -5.104 5.624 -1.970 1.00 0.00 C ATOM 0 H ALA A 143 -3.333 6.120 -0.118 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.786 7.735 -2.114 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.079 5.654 -2.456 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -4.337 5.397 -2.710 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -5.105 4.852 -1.201 1.00 0.00 H new