USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 546 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 348 GLN : amide:sc=-0.00838 X(o=-0.0097,f=-0.16) USER MOD Set 1.2: A 351 LYS NZ :NH3+ -144:sc=-0.00136 (180deg=-0.0687) USER MOD Set 2.1: A 306 THR OG1 : rot -27:sc= 0.263 USER MOD Set 2.2: A 309 ASN : amide:sc= 1.21 K(o=1.5,f=-5!) USER MOD Single : A 294 HIS : no HD1:sc= -2.06! K(o=-2.1!,f=-0.98) USER MOD Single : A 295 THR OG1 : rot -100:sc= 1.27 USER MOD Single : A 297 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.201) USER MOD Single : A 304 ASN : amide:sc= -0.326 K(o=-0.33,f=-5.1!) USER MOD Single : A 308 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 311 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 318 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 335 TYR OH : rot 180:sc= 0 USER MOD Single : A 341 SER OG : rot 180:sc= 0 USER MOD Single : A 342 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 347 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 352 CYS SG : rot -89:sc= -1.06 USER MOD Single : A 353 ASN : amide:sc= -0.0471 K(o=-0.047,f=-2.5!) USER MOD Single : A 356 TYR OH : rot 180:sc= 0 USER MOD Single : A 357 MET CE :methyl -163:sc= -0.876 (180deg=-2.67) USER MOD Single : A 361 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 105 N HIS A 294 -6.081 10.755 -4.048 1.00 0.00 N ATOM 106 CA HIS A 294 -5.081 10.035 -3.267 1.00 0.00 C ATOM 107 C HIS A 294 -5.595 8.655 -2.866 1.00 0.00 C ATOM 108 O HIS A 294 -6.116 8.471 -1.765 1.00 0.00 O ATOM 109 CB HIS A 294 -4.704 10.834 -2.020 1.00 0.00 C ATOM 110 CG HIS A 294 -3.924 12.077 -2.319 1.00 0.00 C ATOM 111 ND1 HIS A 294 -4.309 13.330 -1.889 1.00 0.00 N ATOM 112 CD2 HIS A 294 -2.772 12.256 -3.007 1.00 0.00 C ATOM 113 CE1 HIS A 294 -3.430 14.225 -2.302 1.00 0.00 C ATOM 114 NE2 HIS A 294 -2.487 13.599 -2.983 1.00 0.00 N ATOM 0 HA HIS A 294 -4.194 9.907 -3.888 1.00 0.00 H new ATOM 0 HB2 HIS A 294 -5.613 11.106 -1.484 1.00 0.00 H new ATOM 0 HB3 HIS A 294 -4.119 10.199 -1.355 1.00 0.00 H new ATOM 0 HD2 HIS A 294 -2.186 11.486 -3.486 1.00 0.00 H new ATOM 0 HE1 HIS A 294 -3.475 15.288 -2.115 1.00 0.00 H new ATOM 0 HE2 HIS A 294 -1.678 14.041 -3.420 1.00 0.00 H new ATOM 123 N THR A 295 -5.446 7.688 -3.766 1.00 0.00 N ATOM 124 CA THR A 295 -5.896 6.327 -3.506 1.00 0.00 C ATOM 125 C THR A 295 -4.741 5.337 -3.603 1.00 0.00 C ATOM 126 O THR A 295 -3.859 5.478 -4.451 1.00 0.00 O ATOM 127 CB THR A 295 -7.003 5.904 -4.491 1.00 0.00 C ATOM 128 OG1 THR A 295 -8.041 6.890 -4.513 1.00 0.00 O ATOM 129 CG2 THR A 295 -7.587 4.554 -4.102 1.00 0.00 C ATOM 0 H THR A 295 -5.017 7.823 -4.682 1.00 0.00 H new ATOM 0 HA THR A 295 -6.297 6.315 -2.492 1.00 0.00 H new ATOM 0 HB THR A 295 -6.562 5.818 -5.484 1.00 0.00 H new ATOM 0 HG1 THR A 295 -8.788 6.592 -3.953 1.00 0.00 H new ATOM 0 HG21 THR A 295 -8.366 4.277 -4.812 1.00 0.00 H new ATOM 0 HG22 THR A 295 -6.800 3.800 -4.114 1.00 0.00 H new ATOM 0 HG23 THR A 295 -8.014 4.617 -3.101 1.00 0.00 H new ATOM 137 N VAL A 296 -4.752 4.334 -2.731 1.00 0.00 N ATOM 138 CA VAL A 296 -3.705 3.319 -2.720 1.00 0.00 C ATOM 139 C VAL A 296 -4.281 1.933 -2.984 1.00 0.00 C ATOM 140 O VAL A 296 -5.426 1.647 -2.634 1.00 0.00 O ATOM 141 CB VAL A 296 -2.953 3.304 -1.376 1.00 0.00 C ATOM 142 CG1 VAL A 296 -2.180 4.599 -1.181 1.00 0.00 C ATOM 143 CG2 VAL A 296 -3.922 3.074 -0.226 1.00 0.00 C ATOM 0 H VAL A 296 -5.474 4.202 -2.023 1.00 0.00 H new ATOM 0 HA VAL A 296 -3.006 3.576 -3.516 1.00 0.00 H new ATOM 0 HB VAL A 296 -2.238 2.481 -1.389 1.00 0.00 H new ATOM 0 HG11 VAL A 296 -1.655 4.569 -0.226 1.00 0.00 H new ATOM 0 HG12 VAL A 296 -1.457 4.716 -1.988 1.00 0.00 H new ATOM 0 HG13 VAL A 296 -2.872 5.441 -1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 296 -3.374 3.066 0.716 1.00 0.00 H new ATOM 0 HG22 VAL A 296 -4.662 3.874 -0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 296 -4.426 2.117 -0.360 1.00 0.00 H new ATOM 153 N LYS A 297 -3.479 1.073 -3.603 1.00 0.00 N ATOM 154 CA LYS A 297 -3.907 -0.286 -3.913 1.00 0.00 C ATOM 155 C LYS A 297 -3.043 -1.308 -3.183 1.00 0.00 C ATOM 156 O LYS A 297 -1.838 -1.114 -3.019 1.00 0.00 O ATOM 157 CB LYS A 297 -3.841 -0.531 -5.422 1.00 0.00 C ATOM 158 CG LYS A 297 -4.696 -1.697 -5.887 1.00 0.00 C ATOM 159 CD LYS A 297 -4.146 -2.320 -7.159 1.00 0.00 C ATOM 160 CE LYS A 297 -4.682 -1.620 -8.399 1.00 0.00 C ATOM 161 NZ LYS A 297 -4.132 -2.211 -9.651 1.00 0.00 N ATOM 0 H LYS A 297 -2.528 1.293 -3.900 1.00 0.00 H new ATOM 0 HA LYS A 297 -4.937 -0.402 -3.577 1.00 0.00 H new ATOM 0 HB2 LYS A 297 -4.159 0.372 -5.942 1.00 0.00 H new ATOM 0 HB3 LYS A 297 -2.805 -0.715 -5.707 1.00 0.00 H new ATOM 0 HG2 LYS A 297 -4.742 -2.452 -5.102 1.00 0.00 H new ATOM 0 HG3 LYS A 297 -5.716 -1.355 -6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 297 -3.057 -2.265 -7.151 1.00 0.00 H new ATOM 0 HD3 LYS A 297 -4.412 -3.377 -7.193 1.00 0.00 H new ATOM 0 HE2 LYS A 297 -5.770 -1.688 -8.413 1.00 0.00 H new ATOM 0 HE3 LYS A 297 -4.429 -0.561 -8.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 -4.790 -2.033 -10.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 -3.212 -1.777 -9.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 -4.010 -3.236 -9.527 1.00 0.00 H new ATOM 175 N LEU A 298 -3.665 -2.398 -2.747 1.00 0.00 N ATOM 176 CA LEU A 298 -2.952 -3.453 -2.035 1.00 0.00 C ATOM 177 C LEU A 298 -3.097 -4.790 -2.755 1.00 0.00 C ATOM 178 O LEU A 298 -4.208 -5.279 -2.959 1.00 0.00 O ATOM 179 CB LEU A 298 -3.476 -3.573 -0.603 1.00 0.00 C ATOM 180 CG LEU A 298 -3.114 -2.427 0.343 1.00 0.00 C ATOM 181 CD1 LEU A 298 -3.930 -1.186 0.015 1.00 0.00 C ATOM 182 CD2 LEU A 298 -3.330 -2.843 1.791 1.00 0.00 C ATOM 0 H LEU A 298 -4.662 -2.574 -2.874 1.00 0.00 H new ATOM 0 HA LEU A 298 -1.895 -3.189 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 298 -4.562 -3.657 -0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 298 -3.099 -4.503 -0.176 1.00 0.00 H new ATOM 0 HG LEU A 298 -2.059 -2.189 0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 298 -3.659 -0.381 0.698 1.00 0.00 H new ATOM 0 HD12 LEU A 298 -3.725 -0.876 -1.010 1.00 0.00 H new ATOM 0 HD13 LEU A 298 -4.991 -1.410 0.121 1.00 0.00 H new ATOM 0 HD21 LEU A 298 -3.068 -2.016 2.450 1.00 0.00 H new ATOM 0 HD22 LEU A 298 -4.376 -3.109 1.941 1.00 0.00 H new ATOM 0 HD23 LEU A 298 -2.701 -3.703 2.020 1.00 0.00 H new ATOM 194 N ARG A 299 -1.966 -5.376 -3.136 1.00 0.00 N ATOM 195 CA ARG A 299 -1.967 -6.657 -3.832 1.00 0.00 C ATOM 196 C ARG A 299 -1.147 -7.692 -3.068 1.00 0.00 C ATOM 197 O ARG A 299 -0.335 -7.346 -2.210 1.00 0.00 O ATOM 198 CB ARG A 299 -1.409 -6.493 -5.247 1.00 0.00 C ATOM 199 CG ARG A 299 -1.742 -5.152 -5.881 1.00 0.00 C ATOM 200 CD ARG A 299 -0.977 -4.944 -7.179 1.00 0.00 C ATOM 201 NE ARG A 299 -0.999 -3.549 -7.610 1.00 0.00 N ATOM 202 CZ ARG A 299 -0.718 -3.158 -8.848 1.00 0.00 C ATOM 203 NH1 ARG A 299 -0.396 -4.052 -9.772 1.00 0.00 N ATOM 204 NH2 ARG A 299 -0.760 -1.870 -9.163 1.00 0.00 N ATOM 0 H ARG A 299 -1.038 -4.984 -2.974 1.00 0.00 H new ATOM 0 HA ARG A 299 -2.997 -7.008 -3.893 1.00 0.00 H new ATOM 0 HB2 ARG A 299 -0.326 -6.613 -5.218 1.00 0.00 H new ATOM 0 HB3 ARG A 299 -1.801 -7.291 -5.878 1.00 0.00 H new ATOM 0 HG2 ARG A 299 -2.813 -5.096 -6.076 1.00 0.00 H new ATOM 0 HG3 ARG A 299 -1.503 -4.349 -5.184 1.00 0.00 H new ATOM 0 HD2 ARG A 299 0.056 -5.266 -7.047 1.00 0.00 H new ATOM 0 HD3 ARG A 299 -1.409 -5.571 -7.959 1.00 0.00 H new ATOM 0 HE ARG A 299 -1.243 -2.836 -6.923 1.00 0.00 H new ATOM 0 HH11 ARG A 299 -0.364 -5.043 -9.533 1.00 0.00 H new ATOM 0 HH12 ARG A 299 -0.181 -3.749 -10.722 1.00 0.00 H new ATOM 0 HH21 ARG A 299 -1.008 -1.180 -8.454 1.00 0.00 H new ATOM 0 HH22 ARG A 299 -0.544 -1.570 -10.114 1.00 0.00 H new ATOM 218 N GLY A 300 -1.366 -8.965 -3.384 1.00 0.00 N ATOM 219 CA GLY A 300 -0.641 -10.030 -2.718 1.00 0.00 C ATOM 220 C GLY A 300 -1.409 -10.611 -1.547 1.00 0.00 C ATOM 221 O GLY A 300 -1.174 -11.750 -1.145 1.00 0.00 O ATOM 0 H GLY A 300 -2.033 -9.277 -4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 300 -0.425 -10.822 -3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 300 0.317 -9.648 -2.366 1.00 0.00 H new ATOM 225 N ALA A 301 -2.330 -9.826 -0.998 1.00 0.00 N ATOM 226 CA ALA A 301 -3.136 -10.269 0.133 1.00 0.00 C ATOM 227 C ALA A 301 -3.874 -11.563 -0.192 1.00 0.00 C ATOM 228 O ALA A 301 -4.182 -11.857 -1.347 1.00 0.00 O ATOM 229 CB ALA A 301 -4.123 -9.183 0.535 1.00 0.00 C ATOM 0 H ALA A 301 -2.537 -8.880 -1.318 1.00 0.00 H new ATOM 0 HA ALA A 301 -2.466 -10.464 0.970 1.00 0.00 H new ATOM 0 HB1 ALA A 301 -4.718 -9.527 1.381 1.00 0.00 H new ATOM 0 HB2 ALA A 301 -3.578 -8.282 0.818 1.00 0.00 H new ATOM 0 HB3 ALA A 301 -4.781 -8.960 -0.305 1.00 0.00 H new ATOM 235 N PRO A 302 -4.163 -12.358 0.849 1.00 0.00 N ATOM 236 CA PRO A 302 -4.868 -13.634 0.699 1.00 0.00 C ATOM 237 C PRO A 302 -6.330 -13.447 0.310 1.00 0.00 C ATOM 238 O PRO A 302 -6.771 -12.331 0.032 1.00 0.00 O ATOM 239 CB PRO A 302 -4.762 -14.264 2.090 1.00 0.00 C ATOM 240 CG PRO A 302 -4.599 -13.109 3.017 1.00 0.00 C ATOM 241 CD PRO A 302 -3.825 -12.070 2.253 1.00 0.00 C ATOM 0 HA PRO A 302 -4.439 -14.245 -0.095 1.00 0.00 H new ATOM 0 HB2 PRO A 302 -5.653 -14.843 2.332 1.00 0.00 H new ATOM 0 HB3 PRO A 302 -3.913 -14.945 2.153 1.00 0.00 H new ATOM 0 HG2 PRO A 302 -5.568 -12.721 3.331 1.00 0.00 H new ATOM 0 HG3 PRO A 302 -4.067 -13.406 3.921 1.00 0.00 H new ATOM 0 HD2 PRO A 302 -4.119 -11.060 2.538 1.00 0.00 H new ATOM 0 HD3 PRO A 302 -2.753 -12.153 2.434 1.00 0.00 H new ATOM 249 N PHE A 303 -7.078 -14.545 0.291 1.00 0.00 N ATOM 250 CA PHE A 303 -8.492 -14.501 -0.065 1.00 0.00 C ATOM 251 C PHE A 303 -9.359 -14.295 1.174 1.00 0.00 C ATOM 252 O PHE A 303 -10.467 -13.769 1.087 1.00 0.00 O ATOM 253 CB PHE A 303 -8.900 -15.792 -0.778 1.00 0.00 C ATOM 254 CG PHE A 303 -8.266 -15.957 -2.129 1.00 0.00 C ATOM 255 CD1 PHE A 303 -6.887 -15.987 -2.263 1.00 0.00 C ATOM 256 CD2 PHE A 303 -9.049 -16.081 -3.266 1.00 0.00 C ATOM 257 CE1 PHE A 303 -6.301 -16.140 -3.506 1.00 0.00 C ATOM 258 CE2 PHE A 303 -8.468 -16.234 -4.511 1.00 0.00 C ATOM 259 CZ PHE A 303 -7.092 -16.262 -4.631 1.00 0.00 C ATOM 0 H PHE A 303 -6.729 -15.476 0.518 1.00 0.00 H new ATOM 0 HA PHE A 303 -8.646 -13.658 -0.738 1.00 0.00 H new ATOM 0 HB2 PHE A 303 -8.631 -16.643 -0.153 1.00 0.00 H new ATOM 0 HB3 PHE A 303 -9.984 -15.809 -0.890 1.00 0.00 H new ATOM 0 HD1 PHE A 303 -6.263 -15.890 -1.387 1.00 0.00 H new ATOM 0 HD2 PHE A 303 -10.125 -16.058 -3.178 1.00 0.00 H new ATOM 0 HE1 PHE A 303 -5.225 -16.164 -3.597 1.00 0.00 H new ATOM 0 HE2 PHE A 303 -9.089 -16.332 -5.389 1.00 0.00 H new ATOM 0 HZ PHE A 303 -6.636 -16.379 -5.603 1.00 0.00 H new ATOM 269 N ASN A 304 -8.844 -14.714 2.325 1.00 0.00 N ATOM 270 CA ASN A 304 -9.571 -14.576 3.582 1.00 0.00 C ATOM 271 C ASN A 304 -9.152 -13.306 4.316 1.00 0.00 C ATOM 272 O ASN A 304 -8.930 -13.321 5.527 1.00 0.00 O ATOM 273 CB ASN A 304 -9.328 -15.797 4.472 1.00 0.00 C ATOM 274 CG ASN A 304 -7.878 -16.242 4.459 1.00 0.00 C ATOM 275 OD1 ASN A 304 -6.981 -15.464 4.136 1.00 0.00 O ATOM 276 ND2 ASN A 304 -7.643 -17.501 4.810 1.00 0.00 N ATOM 0 H ASN A 304 -7.927 -15.152 2.414 1.00 0.00 H new ATOM 0 HA ASN A 304 -10.634 -14.508 3.353 1.00 0.00 H new ATOM 0 HB2 ASN A 304 -9.624 -15.563 5.494 1.00 0.00 H new ATOM 0 HB3 ASN A 304 -9.961 -16.619 4.137 1.00 0.00 H new ATOM 0 HD21 ASN A 304 -6.688 -17.858 4.819 1.00 0.00 H new ATOM 0 HD22 ASN A 304 -8.418 -18.111 5.071 1.00 0.00 H new ATOM 283 N VAL A 305 -9.048 -12.208 3.575 1.00 0.00 N ATOM 284 CA VAL A 305 -8.658 -10.928 4.155 1.00 0.00 C ATOM 285 C VAL A 305 -9.856 -9.995 4.283 1.00 0.00 C ATOM 286 O VAL A 305 -10.705 -9.929 3.393 1.00 0.00 O ATOM 287 CB VAL A 305 -7.571 -10.237 3.310 1.00 0.00 C ATOM 288 CG1 VAL A 305 -8.130 -9.818 1.959 1.00 0.00 C ATOM 289 CG2 VAL A 305 -7.000 -9.039 4.055 1.00 0.00 C ATOM 0 H VAL A 305 -9.228 -12.179 2.571 1.00 0.00 H new ATOM 0 HA VAL A 305 -8.258 -11.139 5.147 1.00 0.00 H new ATOM 0 HB VAL A 305 -6.763 -10.948 3.137 1.00 0.00 H new ATOM 0 HG11 VAL A 305 -7.348 -9.332 1.376 1.00 0.00 H new ATOM 0 HG12 VAL A 305 -8.487 -10.698 1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 305 -8.957 -9.123 2.107 1.00 0.00 H new ATOM 0 HG21 VAL A 305 -6.233 -8.562 3.444 1.00 0.00 H new ATOM 0 HG22 VAL A 305 -7.797 -8.324 4.260 1.00 0.00 H new ATOM 0 HG23 VAL A 305 -6.560 -9.371 4.995 1.00 0.00 H new ATOM 299 N THR A 306 -9.920 -9.272 5.398 1.00 0.00 N ATOM 300 CA THR A 306 -11.015 -8.342 5.644 1.00 0.00 C ATOM 301 C THR A 306 -10.492 -6.938 5.922 1.00 0.00 C ATOM 302 O THR A 306 -9.289 -6.735 6.080 1.00 0.00 O ATOM 303 CB THR A 306 -11.884 -8.799 6.831 1.00 0.00 C ATOM 304 OG1 THR A 306 -11.064 -9.003 7.988 1.00 0.00 O ATOM 305 CG2 THR A 306 -12.627 -10.083 6.497 1.00 0.00 C ATOM 0 H THR A 306 -9.226 -9.313 6.144 1.00 0.00 H new ATOM 0 HA THR A 306 -11.626 -8.327 4.741 1.00 0.00 H new ATOM 0 HB THR A 306 -12.617 -8.019 7.038 1.00 0.00 H new ATOM 0 HG1 THR A 306 -10.154 -9.233 7.707 1.00 0.00 H new ATOM 0 HG21 THR A 306 -13.233 -10.385 7.351 1.00 0.00 H new ATOM 0 HG22 THR A 306 -13.272 -9.916 5.635 1.00 0.00 H new ATOM 0 HG23 THR A 306 -11.909 -10.869 6.266 1.00 0.00 H new ATOM 313 N GLU A 307 -11.404 -5.972 5.981 1.00 0.00 N ATOM 314 CA GLU A 307 -11.032 -4.586 6.240 1.00 0.00 C ATOM 315 C GLU A 307 -10.096 -4.490 7.441 1.00 0.00 C ATOM 316 O GLU A 307 -9.009 -3.918 7.352 1.00 0.00 O ATOM 317 CB GLU A 307 -12.281 -3.737 6.483 1.00 0.00 C ATOM 318 CG GLU A 307 -13.024 -3.368 5.210 1.00 0.00 C ATOM 319 CD GLU A 307 -14.078 -4.390 4.833 1.00 0.00 C ATOM 320 OE1 GLU A 307 -13.805 -5.602 4.964 1.00 0.00 O ATOM 321 OE2 GLU A 307 -15.177 -3.978 4.406 1.00 0.00 O ATOM 0 H GLU A 307 -12.405 -6.124 5.853 1.00 0.00 H new ATOM 0 HA GLU A 307 -10.509 -4.206 5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 307 -12.957 -4.281 7.143 1.00 0.00 H new ATOM 0 HB3 GLU A 307 -11.993 -2.823 7.003 1.00 0.00 H new ATOM 0 HG2 GLU A 307 -13.497 -2.394 5.339 1.00 0.00 H new ATOM 0 HG3 GLU A 307 -12.310 -3.270 4.392 1.00 0.00 H new ATOM 328 N LYS A 308 -10.526 -5.052 8.566 1.00 0.00 N ATOM 329 CA LYS A 308 -9.728 -5.031 9.786 1.00 0.00 C ATOM 330 C LYS A 308 -8.257 -5.294 9.479 1.00 0.00 C ATOM 331 O LYS A 308 -7.379 -4.564 9.935 1.00 0.00 O ATOM 332 CB LYS A 308 -10.247 -6.076 10.777 1.00 0.00 C ATOM 333 CG LYS A 308 -9.822 -5.816 12.212 1.00 0.00 C ATOM 334 CD LYS A 308 -10.094 -7.019 13.100 1.00 0.00 C ATOM 335 CE LYS A 308 -11.540 -7.048 13.571 1.00 0.00 C ATOM 336 NZ LYS A 308 -11.697 -7.825 14.832 1.00 0.00 N ATOM 0 H LYS A 308 -11.423 -5.528 8.658 1.00 0.00 H new ATOM 0 HA LYS A 308 -9.817 -4.040 10.231 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -11.336 -6.102 10.728 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -9.891 -7.061 10.474 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -8.759 -5.575 12.240 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -10.356 -4.948 12.599 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -9.870 -7.935 12.553 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -9.429 -6.993 13.963 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -11.892 -6.028 13.727 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -12.166 -7.486 12.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -12.696 -7.821 15.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -11.385 -8.805 14.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -11.119 -7.392 15.581 1.00 0.00 H new ATOM 350 N ASN A 309 -7.997 -6.340 8.701 1.00 0.00 N ATOM 351 CA ASN A 309 -6.632 -6.697 8.333 1.00 0.00 C ATOM 352 C ASN A 309 -5.931 -5.530 7.643 1.00 0.00 C ATOM 353 O ASN A 309 -4.757 -5.260 7.896 1.00 0.00 O ATOM 354 CB ASN A 309 -6.634 -7.920 7.414 1.00 0.00 C ATOM 355 CG ASN A 309 -7.168 -9.161 8.103 1.00 0.00 C ATOM 356 OD1 ASN A 309 -8.234 -9.667 7.755 1.00 0.00 O ATOM 357 ND2 ASN A 309 -6.426 -9.656 9.087 1.00 0.00 N ATOM 0 H ASN A 309 -8.713 -6.955 8.314 1.00 0.00 H new ATOM 0 HA ASN A 309 -6.087 -6.937 9.246 1.00 0.00 H new ATOM 0 HB2 ASN A 309 -7.240 -7.708 6.533 1.00 0.00 H new ATOM 0 HB3 ASN A 309 -5.619 -8.110 7.065 1.00 0.00 H new ATOM 0 HD21 ASN A 309 -6.734 -10.489 9.588 1.00 0.00 H new ATOM 0 HD22 ASN A 309 -5.548 -9.203 9.341 1.00 0.00 H new ATOM 364 N VAL A 310 -6.660 -4.841 6.771 1.00 0.00 N ATOM 365 CA VAL A 310 -6.110 -3.702 6.046 1.00 0.00 C ATOM 366 C VAL A 310 -5.778 -2.556 6.995 1.00 0.00 C ATOM 367 O VAL A 310 -4.669 -2.022 6.975 1.00 0.00 O ATOM 368 CB VAL A 310 -7.088 -3.196 4.970 1.00 0.00 C ATOM 369 CG1 VAL A 310 -6.525 -1.968 4.271 1.00 0.00 C ATOM 370 CG2 VAL A 310 -7.392 -4.298 3.966 1.00 0.00 C ATOM 0 H VAL A 310 -7.633 -5.052 6.550 1.00 0.00 H new ATOM 0 HA VAL A 310 -5.196 -4.046 5.562 1.00 0.00 H new ATOM 0 HB VAL A 310 -8.021 -2.912 5.457 1.00 0.00 H new ATOM 0 HG11 VAL A 310 -7.230 -1.625 3.514 1.00 0.00 H new ATOM 0 HG12 VAL A 310 -6.363 -1.176 5.002 1.00 0.00 H new ATOM 0 HG13 VAL A 310 -5.578 -2.222 3.796 1.00 0.00 H new ATOM 0 HG21 VAL A 310 -8.085 -3.923 3.213 1.00 0.00 H new ATOM 0 HG22 VAL A 310 -6.468 -4.615 3.483 1.00 0.00 H new ATOM 0 HG23 VAL A 310 -7.842 -5.146 4.482 1.00 0.00 H new ATOM 380 N MET A 311 -6.746 -2.182 7.824 1.00 0.00 N ATOM 381 CA MET A 311 -6.556 -1.099 8.783 1.00 0.00 C ATOM 382 C MET A 311 -5.291 -1.319 9.607 1.00 0.00 C ATOM 383 O MET A 311 -4.552 -0.376 9.889 1.00 0.00 O ATOM 384 CB MET A 311 -7.769 -0.989 9.708 1.00 0.00 C ATOM 385 CG MET A 311 -8.838 -0.037 9.197 1.00 0.00 C ATOM 386 SD MET A 311 -8.311 1.687 9.237 1.00 0.00 S ATOM 387 CE MET A 311 -9.894 2.524 9.295 1.00 0.00 C ATOM 0 H MET A 311 -7.670 -2.612 7.852 1.00 0.00 H new ATOM 0 HA MET A 311 -6.448 -0.168 8.226 1.00 0.00 H new ATOM 0 HB2 MET A 311 -8.207 -1.978 9.838 1.00 0.00 H new ATOM 0 HB3 MET A 311 -7.437 -0.656 10.691 1.00 0.00 H new ATOM 0 HG2 MET A 311 -9.102 -0.308 8.175 1.00 0.00 H new ATOM 0 HG3 MET A 311 -9.739 -0.151 9.800 1.00 0.00 H new ATOM 0 HE1 MET A 311 -9.735 3.602 9.324 1.00 0.00 H new ATOM 0 HE2 MET A 311 -10.475 2.266 8.409 1.00 0.00 H new ATOM 0 HE3 MET A 311 -10.437 2.214 10.188 1.00 0.00 H new ATOM 397 N GLU A 312 -5.050 -2.569 9.991 1.00 0.00 N ATOM 398 CA GLU A 312 -3.875 -2.910 10.784 1.00 0.00 C ATOM 399 C GLU A 312 -2.612 -2.878 9.927 1.00 0.00 C ATOM 400 O GLU A 312 -1.524 -2.578 10.418 1.00 0.00 O ATOM 401 CB GLU A 312 -4.042 -4.294 11.414 1.00 0.00 C ATOM 402 CG GLU A 312 -4.717 -4.266 12.775 1.00 0.00 C ATOM 403 CD GLU A 312 -3.735 -4.049 13.909 1.00 0.00 C ATOM 404 OE1 GLU A 312 -2.862 -3.166 13.776 1.00 0.00 O ATOM 405 OE2 GLU A 312 -3.839 -4.761 14.930 1.00 0.00 O ATOM 0 H GLU A 312 -5.652 -3.361 9.766 1.00 0.00 H new ATOM 0 HA GLU A 312 -3.775 -2.168 11.576 1.00 0.00 H new ATOM 0 HB2 GLU A 312 -4.626 -4.922 10.741 1.00 0.00 H new ATOM 0 HB3 GLU A 312 -3.061 -4.759 11.514 1.00 0.00 H new ATOM 0 HG2 GLU A 312 -5.464 -3.472 12.790 1.00 0.00 H new ATOM 0 HG3 GLU A 312 -5.247 -5.205 12.933 1.00 0.00 H new ATOM 412 N PHE A 313 -2.766 -3.191 8.645 1.00 0.00 N ATOM 413 CA PHE A 313 -1.639 -3.200 7.720 1.00 0.00 C ATOM 414 C PHE A 313 -1.197 -1.778 7.387 1.00 0.00 C ATOM 415 O PHE A 313 -0.002 -1.486 7.323 1.00 0.00 O ATOM 416 CB PHE A 313 -2.013 -3.943 6.435 1.00 0.00 C ATOM 417 CG PHE A 313 -1.098 -3.644 5.282 1.00 0.00 C ATOM 418 CD1 PHE A 313 0.128 -4.280 5.170 1.00 0.00 C ATOM 419 CD2 PHE A 313 -1.463 -2.726 4.311 1.00 0.00 C ATOM 420 CE1 PHE A 313 0.972 -4.007 4.110 1.00 0.00 C ATOM 421 CE2 PHE A 313 -0.624 -2.450 3.248 1.00 0.00 C ATOM 422 CZ PHE A 313 0.596 -3.090 3.148 1.00 0.00 C ATOM 0 H PHE A 313 -3.660 -3.442 8.223 1.00 0.00 H new ATOM 0 HA PHE A 313 -0.809 -3.716 8.203 1.00 0.00 H new ATOM 0 HB2 PHE A 313 -2.002 -5.016 6.629 1.00 0.00 H new ATOM 0 HB3 PHE A 313 -3.033 -3.680 6.156 1.00 0.00 H new ATOM 0 HD1 PHE A 313 0.428 -4.997 5.920 1.00 0.00 H new ATOM 0 HD2 PHE A 313 -2.414 -2.220 4.385 1.00 0.00 H new ATOM 0 HE1 PHE A 313 1.925 -4.510 4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 313 -0.922 -1.734 2.496 1.00 0.00 H new ATOM 0 HZ PHE A 313 1.254 -2.874 2.320 1.00 0.00 H new ATOM 432 N LEU A 314 -2.168 -0.896 7.177 1.00 0.00 N ATOM 433 CA LEU A 314 -1.881 0.496 6.851 1.00 0.00 C ATOM 434 C LEU A 314 -1.558 1.295 8.110 1.00 0.00 C ATOM 435 O LEU A 314 -0.848 2.299 8.054 1.00 0.00 O ATOM 436 CB LEU A 314 -3.070 1.126 6.124 1.00 0.00 C ATOM 437 CG LEU A 314 -3.428 0.517 4.768 1.00 0.00 C ATOM 438 CD1 LEU A 314 -4.748 1.078 4.263 1.00 0.00 C ATOM 439 CD2 LEU A 314 -2.317 0.770 3.760 1.00 0.00 C ATOM 0 H LEU A 314 -3.162 -1.121 7.227 1.00 0.00 H new ATOM 0 HA LEU A 314 -1.010 0.518 6.196 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -3.944 1.058 6.772 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -2.862 2.186 5.980 1.00 0.00 H new ATOM 0 HG LEU A 314 -3.539 -0.560 4.892 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -4.987 0.633 3.297 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -5.539 0.844 4.975 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -4.666 2.159 4.154 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -2.589 0.330 2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -2.173 1.844 3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -1.392 0.318 4.117 1.00 0.00 H new ATOM 451 N ALA A 315 -2.081 0.840 9.243 1.00 0.00 N ATOM 452 CA ALA A 315 -1.845 1.510 10.516 1.00 0.00 C ATOM 453 C ALA A 315 -0.373 1.870 10.682 1.00 0.00 C ATOM 454 O ALA A 315 0.503 1.328 10.008 1.00 0.00 O ATOM 455 CB ALA A 315 -2.310 0.631 11.668 1.00 0.00 C ATOM 0 H ALA A 315 -2.671 0.010 9.306 1.00 0.00 H new ATOM 0 HA ALA A 315 -2.421 2.436 10.525 1.00 0.00 H new ATOM 0 HB1 ALA A 315 -2.128 1.143 12.613 1.00 0.00 H new ATOM 0 HB2 ALA A 315 -3.376 0.429 11.564 1.00 0.00 H new ATOM 0 HB3 ALA A 315 -1.759 -0.310 11.653 1.00 0.00 H new ATOM 461 N PRO A 316 -0.092 2.805 11.601 1.00 0.00 N ATOM 462 CA PRO A 316 -1.126 3.457 12.410 1.00 0.00 C ATOM 463 C PRO A 316 -2.004 4.391 11.585 1.00 0.00 C ATOM 464 O PRO A 316 -3.066 4.823 12.037 1.00 0.00 O ATOM 465 CB PRO A 316 -0.322 4.251 13.442 1.00 0.00 C ATOM 466 CG PRO A 316 0.993 4.500 12.788 1.00 0.00 C ATOM 467 CD PRO A 316 1.258 3.300 11.921 1.00 0.00 C ATOM 0 HA PRO A 316 -1.814 2.735 12.850 1.00 0.00 H new ATOM 0 HB2 PRO A 316 -0.820 5.186 13.698 1.00 0.00 H new ATOM 0 HB3 PRO A 316 -0.203 3.689 14.369 1.00 0.00 H new ATOM 0 HG2 PRO A 316 0.966 5.413 12.193 1.00 0.00 H new ATOM 0 HG3 PRO A 316 1.781 4.626 13.531 1.00 0.00 H new ATOM 0 HD2 PRO A 316 1.811 3.569 11.021 1.00 0.00 H new ATOM 0 HD3 PRO A 316 1.848 2.548 12.445 1.00 0.00 H new ATOM 475 N LEU A 317 -1.556 4.700 10.373 1.00 0.00 N ATOM 476 CA LEU A 317 -2.302 5.584 9.484 1.00 0.00 C ATOM 477 C LEU A 317 -3.790 5.250 9.507 1.00 0.00 C ATOM 478 O LEU A 317 -4.177 4.083 9.446 1.00 0.00 O ATOM 479 CB LEU A 317 -1.765 5.473 8.055 1.00 0.00 C ATOM 480 CG LEU A 317 -0.313 5.907 7.849 1.00 0.00 C ATOM 481 CD1 LEU A 317 0.166 5.523 6.457 1.00 0.00 C ATOM 482 CD2 LEU A 317 -0.167 7.405 8.071 1.00 0.00 C ATOM 0 H LEU A 317 -0.680 4.352 9.983 1.00 0.00 H new ATOM 0 HA LEU A 317 -2.173 6.607 9.837 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -1.863 4.437 7.731 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -2.399 6.073 7.402 1.00 0.00 H new ATOM 0 HG LEU A 317 0.308 5.390 8.580 1.00 0.00 H new ATOM 0 HD11 LEU A 317 1.201 5.840 6.328 1.00 0.00 H new ATOM 0 HD12 LEU A 317 0.099 4.442 6.335 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -0.459 6.012 5.709 1.00 0.00 H new ATOM 0 HD21 LEU A 317 0.873 7.696 7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -0.800 7.941 7.364 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -0.469 7.653 9.088 1.00 0.00 H new ATOM 494 N LYS A 318 -4.621 6.283 9.593 1.00 0.00 N ATOM 495 CA LYS A 318 -6.068 6.101 9.620 1.00 0.00 C ATOM 496 C LYS A 318 -6.708 6.637 8.343 1.00 0.00 C ATOM 497 O LYS A 318 -6.914 7.840 8.181 1.00 0.00 O ATOM 498 CB LYS A 318 -6.668 6.806 10.838 1.00 0.00 C ATOM 499 CG LYS A 318 -7.933 6.148 11.360 1.00 0.00 C ATOM 500 CD LYS A 318 -9.173 6.707 10.682 1.00 0.00 C ATOM 501 CE LYS A 318 -10.446 6.166 11.314 1.00 0.00 C ATOM 502 NZ LYS A 318 -11.574 6.125 10.343 1.00 0.00 N ATOM 0 H LYS A 318 -4.317 7.255 9.645 1.00 0.00 H new ATOM 0 HA LYS A 318 -6.274 5.033 9.688 1.00 0.00 H new ATOM 0 HB2 LYS A 318 -5.925 6.830 11.636 1.00 0.00 H new ATOM 0 HB3 LYS A 318 -6.888 7.841 10.576 1.00 0.00 H new ATOM 0 HG2 LYS A 318 -7.880 5.072 11.193 1.00 0.00 H new ATOM 0 HG3 LYS A 318 -8.006 6.301 12.437 1.00 0.00 H new ATOM 0 HD2 LYS A 318 -9.166 7.795 10.749 1.00 0.00 H new ATOM 0 HD3 LYS A 318 -9.155 6.453 9.622 1.00 0.00 H new ATOM 0 HE2 LYS A 318 -10.262 5.163 11.699 1.00 0.00 H new ATOM 0 HE3 LYS A 318 -10.722 6.789 12.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 318 -12.423 5.750 10.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 318 -11.767 7.086 9.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 318 -11.321 5.510 9.543 1.00 0.00 H new ATOM 516 N PRO A 319 -7.031 5.724 7.414 1.00 0.00 N ATOM 517 CA PRO A 319 -7.654 6.082 6.137 1.00 0.00 C ATOM 518 C PRO A 319 -9.091 6.561 6.307 1.00 0.00 C ATOM 519 O PRO A 319 -9.583 6.697 7.427 1.00 0.00 O ATOM 520 CB PRO A 319 -7.617 4.772 5.345 1.00 0.00 C ATOM 521 CG PRO A 319 -7.585 3.704 6.383 1.00 0.00 C ATOM 522 CD PRO A 319 -6.813 4.274 7.541 1.00 0.00 C ATOM 0 HA PRO A 319 -7.136 6.907 5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -8.491 4.673 4.702 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -6.740 4.724 4.700 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -8.594 3.425 6.686 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -7.106 2.803 6.001 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -7.180 3.894 8.495 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -5.755 4.020 7.483 1.00 0.00 H new ATOM 530 N VAL A 320 -9.762 6.816 5.188 1.00 0.00 N ATOM 531 CA VAL A 320 -11.144 7.279 5.213 1.00 0.00 C ATOM 532 C VAL A 320 -12.112 6.133 4.939 1.00 0.00 C ATOM 533 O VAL A 320 -13.137 6.000 5.607 1.00 0.00 O ATOM 534 CB VAL A 320 -11.381 8.395 4.179 1.00 0.00 C ATOM 535 CG1 VAL A 320 -12.790 8.953 4.308 1.00 0.00 C ATOM 536 CG2 VAL A 320 -10.346 9.498 4.339 1.00 0.00 C ATOM 0 H VAL A 320 -9.370 6.710 4.252 1.00 0.00 H new ATOM 0 HA VAL A 320 -11.327 7.675 6.212 1.00 0.00 H new ATOM 0 HB VAL A 320 -11.274 7.970 3.181 1.00 0.00 H new ATOM 0 HG11 VAL A 320 -12.939 9.740 3.569 1.00 0.00 H new ATOM 0 HG12 VAL A 320 -13.514 8.156 4.139 1.00 0.00 H new ATOM 0 HG13 VAL A 320 -12.929 9.363 5.308 1.00 0.00 H new ATOM 0 HG21 VAL A 320 -10.529 10.278 3.600 1.00 0.00 H new ATOM 0 HG22 VAL A 320 -10.418 9.922 5.340 1.00 0.00 H new ATOM 0 HG23 VAL A 320 -9.348 9.085 4.191 1.00 0.00 H new ATOM 546 N ALA A 321 -11.780 5.308 3.952 1.00 0.00 N ATOM 547 CA ALA A 321 -12.618 4.172 3.591 1.00 0.00 C ATOM 548 C ALA A 321 -11.810 3.101 2.866 1.00 0.00 C ATOM 549 O ALA A 321 -10.901 3.412 2.095 1.00 0.00 O ATOM 550 CB ALA A 321 -13.785 4.630 2.728 1.00 0.00 C ATOM 0 H ALA A 321 -10.936 5.405 3.388 1.00 0.00 H new ATOM 0 HA ALA A 321 -13.009 3.735 4.510 1.00 0.00 H new ATOM 0 HB1 ALA A 321 -14.403 3.771 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 321 -14.385 5.353 3.281 1.00 0.00 H new ATOM 0 HB3 ALA A 321 -13.404 5.095 1.818 1.00 0.00 H new ATOM 556 N ILE A 322 -12.145 1.841 3.118 1.00 0.00 N ATOM 557 CA ILE A 322 -11.450 0.725 2.489 1.00 0.00 C ATOM 558 C ILE A 322 -12.390 -0.071 1.590 1.00 0.00 C ATOM 559 O ILE A 322 -13.210 -0.854 2.070 1.00 0.00 O ATOM 560 CB ILE A 322 -10.838 -0.221 3.538 1.00 0.00 C ATOM 561 CG1 ILE A 322 -9.852 0.539 4.428 1.00 0.00 C ATOM 562 CG2 ILE A 322 -10.149 -1.394 2.857 1.00 0.00 C ATOM 563 CD1 ILE A 322 -9.525 -0.180 5.718 1.00 0.00 C ATOM 0 H ILE A 322 -12.894 1.567 3.754 1.00 0.00 H new ATOM 0 HA ILE A 322 -10.649 1.152 1.886 1.00 0.00 H new ATOM 0 HB ILE A 322 -11.640 -0.611 4.165 1.00 0.00 H new ATOM 0 HG12 ILE A 322 -8.930 0.709 3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 322 -10.268 1.519 4.663 1.00 0.00 H new ATOM 0 HG21 ILE A 322 -9.722 -2.053 3.612 1.00 0.00 H new ATOM 0 HG22 ILE A 322 -10.876 -1.947 2.262 1.00 0.00 H new ATOM 0 HG23 ILE A 322 -9.356 -1.023 2.208 1.00 0.00 H new ATOM 0 HD11 ILE A 322 -8.821 0.416 6.298 1.00 0.00 H new ATOM 0 HD12 ILE A 322 -10.438 -0.326 6.295 1.00 0.00 H new ATOM 0 HD13 ILE A 322 -9.080 -1.149 5.492 1.00 0.00 H new ATOM 575 N ARG A 323 -12.263 0.132 0.283 1.00 0.00 N ATOM 576 CA ARG A 323 -13.101 -0.567 -0.684 1.00 0.00 C ATOM 577 C ARG A 323 -12.367 -1.770 -1.270 1.00 0.00 C ATOM 578 O ARG A 323 -11.345 -1.620 -1.940 1.00 0.00 O ATOM 579 CB ARG A 323 -13.522 0.382 -1.807 1.00 0.00 C ATOM 580 CG ARG A 323 -14.797 1.154 -1.506 1.00 0.00 C ATOM 581 CD ARG A 323 -15.319 1.871 -2.741 1.00 0.00 C ATOM 582 NE ARG A 323 -16.508 2.667 -2.449 1.00 0.00 N ATOM 583 CZ ARG A 323 -17.694 2.141 -2.166 1.00 0.00 C ATOM 584 NH1 ARG A 323 -17.848 0.824 -2.135 1.00 0.00 N ATOM 585 NH2 ARG A 323 -18.729 2.932 -1.911 1.00 0.00 N ATOM 0 H ARG A 323 -11.588 0.775 -0.131 1.00 0.00 H new ATOM 0 HA ARG A 323 -13.991 -0.923 -0.165 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -12.715 1.090 -1.995 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -13.662 -0.192 -2.723 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -15.558 0.469 -1.132 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -14.606 1.880 -0.716 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -14.539 2.518 -3.142 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -15.554 1.139 -3.514 1.00 0.00 H new ATOM 0 HE ARG A 323 -16.423 3.683 -2.463 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -17.055 0.213 -2.329 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -18.760 0.422 -1.917 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -18.614 3.945 -1.932 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -19.639 2.527 -1.694 1.00 0.00 H new ATOM 599 N ILE A 324 -12.894 -2.962 -1.011 1.00 0.00 N ATOM 600 CA ILE A 324 -12.289 -4.190 -1.513 1.00 0.00 C ATOM 601 C ILE A 324 -12.775 -4.505 -2.923 1.00 0.00 C ATOM 602 O ILE A 324 -13.978 -4.600 -3.171 1.00 0.00 O ATOM 603 CB ILE A 324 -12.601 -5.387 -0.595 1.00 0.00 C ATOM 604 CG1 ILE A 324 -12.100 -5.112 0.825 1.00 0.00 C ATOM 605 CG2 ILE A 324 -11.972 -6.656 -1.148 1.00 0.00 C ATOM 606 CD1 ILE A 324 -12.702 -6.029 1.866 1.00 0.00 C ATOM 0 H ILE A 324 -13.738 -3.104 -0.457 1.00 0.00 H new ATOM 0 HA ILE A 324 -11.211 -4.027 -1.531 1.00 0.00 H new ATOM 0 HB ILE A 324 -13.681 -5.527 -0.558 1.00 0.00 H new ATOM 0 HG12 ILE A 324 -11.015 -5.215 0.845 1.00 0.00 H new ATOM 0 HG13 ILE A 324 -12.327 -4.079 1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 324 -12.201 -7.493 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 324 -12.372 -6.857 -2.142 1.00 0.00 H new ATOM 0 HG23 ILE A 324 -10.891 -6.529 -1.211 1.00 0.00 H new ATOM 0 HD11 ILE A 324 -12.302 -5.777 2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 324 -13.785 -5.909 1.874 1.00 0.00 H new ATOM 0 HD13 ILE A 324 -12.453 -7.063 1.627 1.00 0.00 H new ATOM 618 N VAL A 325 -11.832 -4.670 -3.845 1.00 0.00 N ATOM 619 CA VAL A 325 -12.163 -4.978 -5.231 1.00 0.00 C ATOM 620 C VAL A 325 -12.468 -6.462 -5.406 1.00 0.00 C ATOM 621 O VAL A 325 -11.613 -7.314 -5.166 1.00 0.00 O ATOM 622 CB VAL A 325 -11.018 -4.585 -6.183 1.00 0.00 C ATOM 623 CG1 VAL A 325 -11.472 -4.676 -7.632 1.00 0.00 C ATOM 624 CG2 VAL A 325 -10.515 -3.186 -5.860 1.00 0.00 C ATOM 0 H VAL A 325 -10.832 -4.595 -3.657 1.00 0.00 H new ATOM 0 HA VAL A 325 -13.049 -4.395 -5.482 1.00 0.00 H new ATOM 0 HB VAL A 325 -10.194 -5.285 -6.042 1.00 0.00 H new ATOM 0 HG11 VAL A 325 -10.649 -4.395 -8.289 1.00 0.00 H new ATOM 0 HG12 VAL A 325 -11.780 -5.698 -7.853 1.00 0.00 H new ATOM 0 HG13 VAL A 325 -12.312 -4.001 -7.793 1.00 0.00 H new ATOM 0 HG21 VAL A 325 -9.706 -2.924 -6.542 1.00 0.00 H new ATOM 0 HG22 VAL A 325 -11.330 -2.471 -5.972 1.00 0.00 H new ATOM 0 HG23 VAL A 325 -10.148 -3.159 -4.834 1.00 0.00 H new ATOM 764 N TYR A 335 -6.955 -7.907 -4.353 1.00 0.00 N ATOM 765 CA TYR A 335 -6.901 -6.482 -4.657 1.00 0.00 C ATOM 766 C TYR A 335 -7.781 -5.687 -3.697 1.00 0.00 C ATOM 767 O TYR A 335 -8.892 -6.103 -3.368 1.00 0.00 O ATOM 768 CB TYR A 335 -7.342 -6.229 -6.099 1.00 0.00 C ATOM 769 CG TYR A 335 -6.381 -6.777 -7.131 1.00 0.00 C ATOM 770 CD1 TYR A 335 -5.030 -6.454 -7.091 1.00 0.00 C ATOM 771 CD2 TYR A 335 -6.824 -7.616 -8.145 1.00 0.00 C ATOM 772 CE1 TYR A 335 -4.149 -6.951 -8.032 1.00 0.00 C ATOM 773 CE2 TYR A 335 -5.950 -8.119 -9.089 1.00 0.00 C ATOM 774 CZ TYR A 335 -4.614 -7.784 -9.028 1.00 0.00 C ATOM 775 OH TYR A 335 -3.740 -8.282 -9.968 1.00 0.00 O ATOM 0 HA TYR A 335 -5.870 -6.150 -4.537 1.00 0.00 H new ATOM 0 HB2 TYR A 335 -8.323 -6.678 -6.254 1.00 0.00 H new ATOM 0 HB3 TYR A 335 -7.454 -5.156 -6.253 1.00 0.00 H new ATOM 0 HD1 TYR A 335 -4.663 -5.803 -6.311 1.00 0.00 H new ATOM 0 HD2 TYR A 335 -7.870 -7.880 -8.196 1.00 0.00 H new ATOM 0 HE1 TYR A 335 -3.102 -6.689 -7.988 1.00 0.00 H new ATOM 0 HE2 TYR A 335 -6.311 -8.771 -9.871 1.00 0.00 H new ATOM 0 HH TYR A 335 -4.228 -8.853 -10.598 1.00 0.00 H new ATOM 785 N ILE A 336 -7.276 -4.541 -3.254 1.00 0.00 N ATOM 786 CA ILE A 336 -8.016 -3.686 -2.334 1.00 0.00 C ATOM 787 C ILE A 336 -7.710 -2.213 -2.585 1.00 0.00 C ATOM 788 O ILE A 336 -6.608 -1.860 -3.006 1.00 0.00 O ATOM 789 CB ILE A 336 -7.691 -4.023 -0.867 1.00 0.00 C ATOM 790 CG1 ILE A 336 -8.175 -5.434 -0.526 1.00 0.00 C ATOM 791 CG2 ILE A 336 -8.325 -3.001 0.065 1.00 0.00 C ATOM 792 CD1 ILE A 336 -7.566 -5.992 0.741 1.00 0.00 C ATOM 0 H ILE A 336 -6.358 -4.183 -3.517 1.00 0.00 H new ATOM 0 HA ILE A 336 -9.075 -3.871 -2.515 1.00 0.00 H new ATOM 0 HB ILE A 336 -6.610 -3.987 -0.733 1.00 0.00 H new ATOM 0 HG12 ILE A 336 -9.260 -5.422 -0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 336 -7.941 -6.100 -1.356 1.00 0.00 H new ATOM 0 HG21 ILE A 336 -8.086 -3.253 1.098 1.00 0.00 H new ATOM 0 HG22 ILE A 336 -7.937 -2.009 -0.165 1.00 0.00 H new ATOM 0 HG23 ILE A 336 -9.407 -3.008 -0.069 1.00 0.00 H new ATOM 0 HD11 ILE A 336 -7.954 -6.995 0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 336 -6.482 -6.036 0.635 1.00 0.00 H new ATOM 0 HD13 ILE A 336 -7.822 -5.348 1.582 1.00 0.00 H new ATOM 804 N PHE A 337 -8.692 -1.357 -2.323 1.00 0.00 N ATOM 805 CA PHE A 337 -8.527 0.078 -2.519 1.00 0.00 C ATOM 806 C PHE A 337 -8.760 0.836 -1.215 1.00 0.00 C ATOM 807 O PHE A 337 -9.827 0.739 -0.609 1.00 0.00 O ATOM 808 CB PHE A 337 -9.493 0.581 -3.594 1.00 0.00 C ATOM 809 CG PHE A 337 -9.061 0.247 -4.993 1.00 0.00 C ATOM 810 CD1 PHE A 337 -7.774 0.530 -5.420 1.00 0.00 C ATOM 811 CD2 PHE A 337 -9.942 -0.349 -5.880 1.00 0.00 C ATOM 812 CE1 PHE A 337 -7.372 0.223 -6.707 1.00 0.00 C ATOM 813 CE2 PHE A 337 -9.546 -0.658 -7.168 1.00 0.00 C ATOM 814 CZ PHE A 337 -8.260 -0.371 -7.582 1.00 0.00 C ATOM 0 H PHE A 337 -9.610 -1.632 -1.974 1.00 0.00 H new ATOM 0 HA PHE A 337 -7.503 0.260 -2.846 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -10.479 0.152 -3.415 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -9.595 1.662 -3.502 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -7.076 0.996 -4.740 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -10.949 -0.575 -5.562 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -6.365 0.447 -7.027 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -10.242 -1.124 -7.850 1.00 0.00 H new ATOM 0 HZ PHE A 337 -7.949 -0.611 -8.588 1.00 0.00 H new ATOM 824 N VAL A 338 -7.752 1.591 -0.789 1.00 0.00 N ATOM 825 CA VAL A 338 -7.845 2.366 0.443 1.00 0.00 C ATOM 826 C VAL A 338 -7.637 3.852 0.174 1.00 0.00 C ATOM 827 O VAL A 338 -6.636 4.252 -0.420 1.00 0.00 O ATOM 828 CB VAL A 338 -6.811 1.894 1.483 1.00 0.00 C ATOM 829 CG1 VAL A 338 -7.013 2.620 2.804 1.00 0.00 C ATOM 830 CG2 VAL A 338 -6.898 0.388 1.674 1.00 0.00 C ATOM 0 H VAL A 338 -6.862 1.682 -1.279 1.00 0.00 H new ATOM 0 HA VAL A 338 -8.847 2.208 0.841 1.00 0.00 H new ATOM 0 HB VAL A 338 -5.814 2.133 1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 338 -6.274 2.274 3.526 1.00 0.00 H new ATOM 0 HG12 VAL A 338 -6.896 3.693 2.651 1.00 0.00 H new ATOM 0 HG13 VAL A 338 -8.014 2.415 3.183 1.00 0.00 H new ATOM 0 HG21 VAL A 338 -6.161 0.072 2.412 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -7.896 0.122 2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -6.699 -0.111 0.726 1.00 0.00 H new ATOM 840 N ASP A 339 -8.590 4.666 0.614 1.00 0.00 N ATOM 841 CA ASP A 339 -8.511 6.110 0.423 1.00 0.00 C ATOM 842 C ASP A 339 -8.124 6.810 1.722 1.00 0.00 C ATOM 843 O ASP A 339 -8.320 6.272 2.812 1.00 0.00 O ATOM 844 CB ASP A 339 -9.848 6.652 -0.085 1.00 0.00 C ATOM 845 CG ASP A 339 -10.150 6.212 -1.504 1.00 0.00 C ATOM 846 OD1 ASP A 339 -9.530 6.761 -2.439 1.00 0.00 O ATOM 847 OD2 ASP A 339 -11.006 5.321 -1.680 1.00 0.00 O ATOM 0 H ASP A 339 -9.426 4.351 1.105 1.00 0.00 H new ATOM 0 HA ASP A 339 -7.740 6.312 -0.320 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -10.648 6.315 0.575 1.00 0.00 H new ATOM 0 HB3 ASP A 339 -9.836 7.741 -0.040 1.00 0.00 H new ATOM 852 N PHE A 340 -7.573 8.013 1.598 1.00 0.00 N ATOM 853 CA PHE A 340 -7.157 8.786 2.762 1.00 0.00 C ATOM 854 C PHE A 340 -7.612 10.237 2.642 1.00 0.00 C ATOM 855 O PHE A 340 -8.047 10.677 1.578 1.00 0.00 O ATOM 856 CB PHE A 340 -5.636 8.729 2.921 1.00 0.00 C ATOM 857 CG PHE A 340 -5.136 7.408 3.433 1.00 0.00 C ATOM 858 CD1 PHE A 340 -4.886 6.362 2.560 1.00 0.00 C ATOM 859 CD2 PHE A 340 -4.916 7.213 4.787 1.00 0.00 C ATOM 860 CE1 PHE A 340 -4.427 5.145 3.028 1.00 0.00 C ATOM 861 CE2 PHE A 340 -4.457 5.998 5.261 1.00 0.00 C ATOM 862 CZ PHE A 340 -4.211 4.964 4.380 1.00 0.00 C ATOM 0 H PHE A 340 -7.404 8.473 0.704 1.00 0.00 H new ATOM 0 HA PHE A 340 -7.625 8.348 3.644 1.00 0.00 H new ATOM 0 HB2 PHE A 340 -5.170 8.936 1.958 1.00 0.00 H new ATOM 0 HB3 PHE A 340 -5.320 9.518 3.604 1.00 0.00 H new ATOM 0 HD1 PHE A 340 -5.052 6.499 1.502 1.00 0.00 H new ATOM 0 HD2 PHE A 340 -5.105 8.019 5.480 1.00 0.00 H new ATOM 0 HE1 PHE A 340 -4.238 4.337 2.337 1.00 0.00 H new ATOM 0 HE2 PHE A 340 -4.291 5.858 6.319 1.00 0.00 H new ATOM 0 HZ PHE A 340 -3.850 4.015 4.748 1.00 0.00 H new ATOM 872 N SER A 341 -7.511 10.976 3.743 1.00 0.00 N ATOM 873 CA SER A 341 -7.916 12.377 3.763 1.00 0.00 C ATOM 874 C SER A 341 -6.765 13.282 3.334 1.00 0.00 C ATOM 875 O SER A 341 -6.888 14.051 2.382 1.00 0.00 O ATOM 876 CB SER A 341 -8.396 12.770 5.162 1.00 0.00 C ATOM 877 OG SER A 341 -8.895 14.096 5.175 1.00 0.00 O ATOM 0 H SER A 341 -7.152 10.628 4.632 1.00 0.00 H new ATOM 0 HA SER A 341 -8.736 12.503 3.056 1.00 0.00 H new ATOM 0 HB2 SER A 341 -9.175 12.082 5.490 1.00 0.00 H new ATOM 0 HB3 SER A 341 -7.573 12.681 5.871 1.00 0.00 H new ATOM 0 HG SER A 341 -9.197 14.323 6.079 1.00 0.00 H new ATOM 883 N ASN A 342 -5.647 13.183 4.046 1.00 0.00 N ATOM 884 CA ASN A 342 -4.473 13.993 3.740 1.00 0.00 C ATOM 885 C ASN A 342 -3.565 13.280 2.743 1.00 0.00 C ATOM 886 O ASN A 342 -3.643 12.063 2.578 1.00 0.00 O ATOM 887 CB ASN A 342 -3.697 14.307 5.020 1.00 0.00 C ATOM 888 CG ASN A 342 -4.545 15.030 6.049 1.00 0.00 C ATOM 889 OD1 ASN A 342 -5.307 15.937 5.714 1.00 0.00 O ATOM 890 ND2 ASN A 342 -4.417 14.629 7.308 1.00 0.00 N ATOM 0 H ASN A 342 -5.529 12.551 4.838 1.00 0.00 H new ATOM 0 HA ASN A 342 -4.813 14.926 3.291 1.00 0.00 H new ATOM 0 HB2 ASN A 342 -3.321 13.379 5.451 1.00 0.00 H new ATOM 0 HB3 ASN A 342 -2.829 14.919 4.774 1.00 0.00 H new ATOM 0 HD21 ASN A 342 -4.963 15.077 8.044 1.00 0.00 H new ATOM 0 HD22 ASN A 342 -3.773 13.873 7.539 1.00 0.00 H new ATOM 897 N GLU A 343 -2.704 14.047 2.082 1.00 0.00 N ATOM 898 CA GLU A 343 -1.781 13.488 1.101 1.00 0.00 C ATOM 899 C GLU A 343 -0.599 12.812 1.790 1.00 0.00 C ATOM 900 O GLU A 343 0.149 12.060 1.165 1.00 0.00 O ATOM 901 CB GLU A 343 -1.278 14.584 0.159 1.00 0.00 C ATOM 902 CG GLU A 343 -0.637 15.759 0.878 1.00 0.00 C ATOM 903 CD GLU A 343 0.059 16.715 -0.070 1.00 0.00 C ATOM 904 OE1 GLU A 343 0.613 16.245 -1.087 1.00 0.00 O ATOM 905 OE2 GLU A 343 0.050 17.933 0.204 1.00 0.00 O ATOM 0 H GLU A 343 -2.626 15.056 2.208 1.00 0.00 H new ATOM 0 HA GLU A 343 -2.318 12.738 0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -0.554 14.153 -0.532 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -2.113 14.947 -0.440 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -1.402 16.299 1.436 1.00 0.00 H new ATOM 0 HG3 GLU A 343 0.084 15.385 1.605 1.00 0.00 H new ATOM 912 N GLU A 344 -0.437 13.086 3.080 1.00 0.00 N ATOM 913 CA GLU A 344 0.654 12.506 3.853 1.00 0.00 C ATOM 914 C GLU A 344 0.369 11.044 4.185 1.00 0.00 C ATOM 915 O GLU A 344 1.243 10.187 4.059 1.00 0.00 O ATOM 916 CB GLU A 344 0.874 13.299 5.143 1.00 0.00 C ATOM 917 CG GLU A 344 2.185 12.977 5.840 1.00 0.00 C ATOM 918 CD GLU A 344 2.217 13.465 7.276 1.00 0.00 C ATOM 919 OE1 GLU A 344 1.367 13.018 8.073 1.00 0.00 O ATOM 920 OE2 GLU A 344 3.093 14.294 7.601 1.00 0.00 O ATOM 0 H GLU A 344 -1.048 13.706 3.612 1.00 0.00 H new ATOM 0 HA GLU A 344 1.559 12.554 3.247 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.846 14.364 4.914 1.00 0.00 H new ATOM 0 HB3 GLU A 344 0.050 13.099 5.828 1.00 0.00 H new ATOM 0 HG2 GLU A 344 2.346 11.899 5.823 1.00 0.00 H new ATOM 0 HG3 GLU A 344 3.007 13.431 5.287 1.00 0.00 H new ATOM 927 N GLU A 345 -0.861 10.768 4.609 1.00 0.00 N ATOM 928 CA GLU A 345 -1.261 9.411 4.960 1.00 0.00 C ATOM 929 C GLU A 345 -1.008 8.452 3.800 1.00 0.00 C ATOM 930 O GLU A 345 -0.566 7.321 4.000 1.00 0.00 O ATOM 931 CB GLU A 345 -2.740 9.376 5.351 1.00 0.00 C ATOM 932 CG GLU A 345 -3.089 10.317 6.492 1.00 0.00 C ATOM 933 CD GLU A 345 -4.562 10.277 6.850 1.00 0.00 C ATOM 934 OE1 GLU A 345 -5.381 10.774 6.050 1.00 0.00 O ATOM 935 OE2 GLU A 345 -4.895 9.748 7.932 1.00 0.00 O ATOM 0 H GLU A 345 -1.597 11.466 4.717 1.00 0.00 H new ATOM 0 HA GLU A 345 -0.660 9.092 5.811 1.00 0.00 H new ATOM 0 HB2 GLU A 345 -3.344 9.634 4.481 1.00 0.00 H new ATOM 0 HB3 GLU A 345 -3.008 8.358 5.635 1.00 0.00 H new ATOM 0 HG2 GLU A 345 -2.498 10.053 7.369 1.00 0.00 H new ATOM 0 HG3 GLU A 345 -2.813 11.335 6.216 1.00 0.00 H new ATOM 942 N VAL A 346 -1.293 8.913 2.586 1.00 0.00 N ATOM 943 CA VAL A 346 -1.096 8.098 1.393 1.00 0.00 C ATOM 944 C VAL A 346 0.384 7.979 1.046 1.00 0.00 C ATOM 945 O VAL A 346 0.861 6.907 0.674 1.00 0.00 O ATOM 946 CB VAL A 346 -1.850 8.682 0.183 1.00 0.00 C ATOM 947 CG1 VAL A 346 -1.469 7.944 -1.091 1.00 0.00 C ATOM 948 CG2 VAL A 346 -3.353 8.624 0.414 1.00 0.00 C ATOM 0 H VAL A 346 -1.661 9.847 2.403 1.00 0.00 H new ATOM 0 HA VAL A 346 -1.494 7.108 1.617 1.00 0.00 H new ATOM 0 HB VAL A 346 -1.563 9.727 0.068 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -2.012 8.371 -1.935 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -0.397 8.042 -1.262 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -1.725 6.889 -0.991 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -3.870 9.040 -0.450 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -3.660 7.588 0.556 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -3.607 9.202 1.302 1.00 0.00 H new ATOM 958 N LYS A 347 1.106 9.087 1.171 1.00 0.00 N ATOM 959 CA LYS A 347 2.533 9.109 0.873 1.00 0.00 C ATOM 960 C LYS A 347 3.290 8.128 1.764 1.00 0.00 C ATOM 961 O LYS A 347 4.322 7.588 1.369 1.00 0.00 O ATOM 962 CB LYS A 347 3.093 10.521 1.061 1.00 0.00 C ATOM 963 CG LYS A 347 2.860 11.431 -0.133 1.00 0.00 C ATOM 964 CD LYS A 347 2.951 12.896 0.257 1.00 0.00 C ATOM 965 CE LYS A 347 4.396 13.369 0.314 1.00 0.00 C ATOM 966 NZ LYS A 347 4.499 14.851 0.200 1.00 0.00 N ATOM 0 H LYS A 347 0.726 9.983 1.477 1.00 0.00 H new ATOM 0 HA LYS A 347 2.666 8.807 -0.166 1.00 0.00 H new ATOM 0 HB2 LYS A 347 2.637 10.969 1.944 1.00 0.00 H new ATOM 0 HB3 LYS A 347 4.164 10.456 1.254 1.00 0.00 H new ATOM 0 HG2 LYS A 347 3.596 11.213 -0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 347 1.878 11.228 -0.561 1.00 0.00 H new ATOM 0 HD2 LYS A 347 2.397 13.500 -0.462 1.00 0.00 H new ATOM 0 HD3 LYS A 347 2.480 13.045 1.228 1.00 0.00 H new ATOM 0 HE2 LYS A 347 4.848 13.044 1.251 1.00 0.00 H new ATOM 0 HE3 LYS A 347 4.963 12.902 -0.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 347 5.499 15.134 0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 347 4.091 15.159 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 347 3.979 15.296 0.983 1.00 0.00 H new ATOM 980 N GLN A 348 2.768 7.903 2.965 1.00 0.00 N ATOM 981 CA GLN A 348 3.395 6.986 3.910 1.00 0.00 C ATOM 982 C GLN A 348 2.896 5.561 3.698 1.00 0.00 C ATOM 983 O GLN A 348 3.607 4.596 3.978 1.00 0.00 O ATOM 984 CB GLN A 348 3.112 7.429 5.347 1.00 0.00 C ATOM 985 CG GLN A 348 4.027 8.543 5.831 1.00 0.00 C ATOM 986 CD GLN A 348 5.310 8.018 6.446 1.00 0.00 C ATOM 987 OE1 GLN A 348 5.283 7.176 7.344 1.00 0.00 O ATOM 988 NE2 GLN A 348 6.444 8.513 5.963 1.00 0.00 N ATOM 0 H GLN A 348 1.913 8.342 3.307 1.00 0.00 H new ATOM 0 HA GLN A 348 4.471 7.005 3.736 1.00 0.00 H new ATOM 0 HB2 GLN A 348 2.077 7.763 5.418 1.00 0.00 H new ATOM 0 HB3 GLN A 348 3.216 6.570 6.010 1.00 0.00 H new ATOM 0 HG2 GLN A 348 4.271 9.197 4.994 1.00 0.00 H new ATOM 0 HG3 GLN A 348 3.498 9.149 6.566 1.00 0.00 H new ATOM 0 HE21 GLN A 348 6.420 9.210 5.218 1.00 0.00 H new ATOM 0 HE22 GLN A 348 7.339 8.197 6.337 1.00 0.00 H new ATOM 997 N ALA A 349 1.670 5.436 3.201 1.00 0.00 N ATOM 998 CA ALA A 349 1.077 4.128 2.950 1.00 0.00 C ATOM 999 C ALA A 349 1.964 3.290 2.036 1.00 0.00 C ATOM 1000 O ALA A 349 2.057 2.071 2.190 1.00 0.00 O ATOM 1001 CB ALA A 349 -0.310 4.284 2.345 1.00 0.00 C ATOM 0 H ALA A 349 1.068 6.225 2.964 1.00 0.00 H new ATOM 0 HA ALA A 349 0.988 3.608 3.904 1.00 0.00 H new ATOM 0 HB1 ALA A 349 -0.740 3.299 2.163 1.00 0.00 H new ATOM 0 HB2 ALA A 349 -0.948 4.837 3.035 1.00 0.00 H new ATOM 0 HB3 ALA A 349 -0.237 4.828 1.403 1.00 0.00 H new ATOM 1007 N LEU A 350 2.614 3.949 1.083 1.00 0.00 N ATOM 1008 CA LEU A 350 3.494 3.264 0.142 1.00 0.00 C ATOM 1009 C LEU A 350 4.726 2.712 0.852 1.00 0.00 C ATOM 1010 O LEU A 350 5.193 1.615 0.545 1.00 0.00 O ATOM 1011 CB LEU A 350 3.920 4.218 -0.975 1.00 0.00 C ATOM 1012 CG LEU A 350 2.796 4.769 -1.853 1.00 0.00 C ATOM 1013 CD1 LEU A 350 3.277 5.977 -2.641 1.00 0.00 C ATOM 1014 CD2 LEU A 350 2.275 3.690 -2.791 1.00 0.00 C ATOM 0 H LEU A 350 2.548 4.957 0.941 1.00 0.00 H new ATOM 0 HA LEU A 350 2.943 2.430 -0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 350 4.448 5.059 -0.525 1.00 0.00 H new ATOM 0 HB3 LEU A 350 4.633 3.700 -1.616 1.00 0.00 H new ATOM 0 HG LEU A 350 1.978 5.086 -1.206 1.00 0.00 H new ATOM 0 HD11 LEU A 350 2.463 6.355 -3.260 1.00 0.00 H new ATOM 0 HD12 LEU A 350 3.600 6.756 -1.951 1.00 0.00 H new ATOM 0 HD13 LEU A 350 4.113 5.687 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 350 1.476 4.100 -3.408 1.00 0.00 H new ATOM 0 HD22 LEU A 350 3.086 3.342 -3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 350 1.890 2.854 -2.206 1.00 0.00 H new ATOM 1026 N LYS A 351 5.246 3.477 1.805 1.00 0.00 N ATOM 1027 CA LYS A 351 6.421 3.064 2.563 1.00 0.00 C ATOM 1028 C LYS A 351 6.186 1.718 3.241 1.00 0.00 C ATOM 1029 O LYS A 351 7.132 0.981 3.522 1.00 0.00 O ATOM 1030 CB LYS A 351 6.775 4.121 3.612 1.00 0.00 C ATOM 1031 CG LYS A 351 7.052 5.493 3.023 1.00 0.00 C ATOM 1032 CD LYS A 351 8.502 5.633 2.592 1.00 0.00 C ATOM 1033 CE LYS A 351 8.977 7.075 2.693 1.00 0.00 C ATOM 1034 NZ LYS A 351 9.208 7.485 4.106 1.00 0.00 N ATOM 0 H LYS A 351 4.872 4.388 2.071 1.00 0.00 H new ATOM 0 HA LYS A 351 7.253 2.960 1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 351 5.956 4.200 4.327 1.00 0.00 H new ATOM 0 HB3 LYS A 351 7.652 3.790 4.168 1.00 0.00 H new ATOM 0 HG2 LYS A 351 6.399 5.661 2.166 1.00 0.00 H new ATOM 0 HG3 LYS A 351 6.815 6.261 3.760 1.00 0.00 H new ATOM 0 HD2 LYS A 351 9.131 4.997 3.215 1.00 0.00 H new ATOM 0 HD3 LYS A 351 8.613 5.283 1.566 1.00 0.00 H new ATOM 0 HE2 LYS A 351 9.900 7.194 2.125 1.00 0.00 H new ATOM 0 HE3 LYS A 351 8.236 7.734 2.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 8.932 8.480 4.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 8.638 6.888 4.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 10.215 7.374 4.340 1.00 0.00 H new ATOM 1048 N CYS A 352 4.922 1.404 3.500 1.00 0.00 N ATOM 1049 CA CYS A 352 4.563 0.146 4.145 1.00 0.00 C ATOM 1050 C CYS A 352 4.601 -1.006 3.147 1.00 0.00 C ATOM 1051 O CYS A 352 3.603 -1.695 2.940 1.00 0.00 O ATOM 1052 CB CYS A 352 3.171 0.249 4.770 1.00 0.00 C ATOM 1053 SG CYS A 352 2.592 -1.282 5.539 1.00 0.00 S ATOM 0 H CYS A 352 4.128 2.003 3.273 1.00 0.00 H new ATOM 0 HA CYS A 352 5.292 -0.053 4.930 1.00 0.00 H new ATOM 0 HB2 CYS A 352 3.179 1.039 5.520 1.00 0.00 H new ATOM 0 HB3 CYS A 352 2.460 0.548 4.000 1.00 0.00 H new ATOM 0 HG CYS A 352 1.961 -1.999 4.657 1.00 0.00 H new ATOM 1059 N ASN A 353 5.761 -1.209 2.529 1.00 0.00 N ATOM 1060 CA ASN A 353 5.929 -2.278 1.551 1.00 0.00 C ATOM 1061 C ASN A 353 6.842 -3.373 2.093 1.00 0.00 C ATOM 1062 O ASN A 353 7.466 -3.212 3.142 1.00 0.00 O ATOM 1063 CB ASN A 353 6.503 -1.718 0.248 1.00 0.00 C ATOM 1064 CG ASN A 353 7.643 -0.747 0.488 1.00 0.00 C ATOM 1065 OD1 ASN A 353 8.392 -0.879 1.457 1.00 0.00 O ATOM 1066 ND2 ASN A 353 7.780 0.235 -0.394 1.00 0.00 N ATOM 0 H ASN A 353 6.598 -0.648 2.688 1.00 0.00 H new ATOM 0 HA ASN A 353 4.949 -2.713 1.352 1.00 0.00 H new ATOM 0 HB2 ASN A 353 6.855 -2.541 -0.374 1.00 0.00 H new ATOM 0 HB3 ASN A 353 5.712 -1.215 -0.308 1.00 0.00 H new ATOM 0 HD21 ASN A 353 8.529 0.919 -0.284 1.00 0.00 H new ATOM 0 HD22 ASN A 353 7.136 0.306 -1.182 1.00 0.00 H new ATOM 1073 N ARG A 354 6.915 -4.486 1.371 1.00 0.00 N ATOM 1074 CA ARG A 354 7.751 -5.609 1.779 1.00 0.00 C ATOM 1075 C ARG A 354 7.292 -6.167 3.123 1.00 0.00 C ATOM 1076 O ARG A 354 8.093 -6.704 3.888 1.00 0.00 O ATOM 1077 CB ARG A 354 9.216 -5.176 1.868 1.00 0.00 C ATOM 1078 CG ARG A 354 9.834 -4.840 0.521 1.00 0.00 C ATOM 1079 CD ARG A 354 9.423 -5.841 -0.547 1.00 0.00 C ATOM 1080 NE ARG A 354 10.232 -5.716 -1.756 1.00 0.00 N ATOM 1081 CZ ARG A 354 10.384 -6.694 -2.643 1.00 0.00 C ATOM 1082 NH1 ARG A 354 9.785 -7.861 -2.457 1.00 0.00 N ATOM 1083 NH2 ARG A 354 11.137 -6.503 -3.719 1.00 0.00 N ATOM 0 H ARG A 354 6.405 -4.635 0.500 1.00 0.00 H new ATOM 0 HA ARG A 354 7.656 -6.393 1.027 1.00 0.00 H new ATOM 0 HB2 ARG A 354 9.290 -4.305 2.520 1.00 0.00 H new ATOM 0 HB3 ARG A 354 9.794 -5.973 2.335 1.00 0.00 H new ATOM 0 HG2 ARG A 354 9.528 -3.838 0.219 1.00 0.00 H new ATOM 0 HG3 ARG A 354 10.920 -4.828 0.611 1.00 0.00 H new ATOM 0 HD2 ARG A 354 9.517 -6.852 -0.151 1.00 0.00 H new ATOM 0 HD3 ARG A 354 8.372 -5.693 -0.797 1.00 0.00 H new ATOM 0 HE ARG A 354 10.706 -4.830 -1.929 1.00 0.00 H new ATOM 0 HH11 ARG A 354 9.205 -8.011 -1.631 1.00 0.00 H new ATOM 0 HH12 ARG A 354 9.904 -8.610 -3.140 1.00 0.00 H new ATOM 0 HH21 ARG A 354 11.599 -5.606 -3.865 1.00 0.00 H new ATOM 0 HH22 ARG A 354 11.254 -7.254 -4.400 1.00 0.00 H new ATOM 1097 N GLU A 355 5.999 -6.036 3.402 1.00 0.00 N ATOM 1098 CA GLU A 355 5.435 -6.527 4.654 1.00 0.00 C ATOM 1099 C GLU A 355 4.795 -7.898 4.462 1.00 0.00 C ATOM 1100 O GLU A 355 4.676 -8.388 3.338 1.00 0.00 O ATOM 1101 CB GLU A 355 4.399 -5.539 5.194 1.00 0.00 C ATOM 1102 CG GLU A 355 4.864 -4.093 5.165 1.00 0.00 C ATOM 1103 CD GLU A 355 5.898 -3.791 6.232 1.00 0.00 C ATOM 1104 OE1 GLU A 355 6.488 -4.749 6.774 1.00 0.00 O ATOM 1105 OE2 GLU A 355 6.117 -2.597 6.526 1.00 0.00 O ATOM 0 H GLU A 355 5.323 -5.595 2.779 1.00 0.00 H new ATOM 0 HA GLU A 355 6.246 -6.622 5.376 1.00 0.00 H new ATOM 0 HB2 GLU A 355 3.484 -5.629 4.609 1.00 0.00 H new ATOM 0 HB3 GLU A 355 4.150 -5.811 6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 355 5.284 -3.870 4.184 1.00 0.00 H new ATOM 0 HG3 GLU A 355 4.005 -3.436 5.301 1.00 0.00 H new ATOM 1112 N TYR A 356 4.385 -8.513 5.565 1.00 0.00 N ATOM 1113 CA TYR A 356 3.759 -9.830 5.520 1.00 0.00 C ATOM 1114 C TYR A 356 2.572 -9.902 6.475 1.00 0.00 C ATOM 1115 O TYR A 356 2.711 -9.667 7.675 1.00 0.00 O ATOM 1116 CB TYR A 356 4.778 -10.914 5.872 1.00 0.00 C ATOM 1117 CG TYR A 356 6.027 -10.872 5.020 1.00 0.00 C ATOM 1118 CD1 TYR A 356 6.857 -9.758 5.024 1.00 0.00 C ATOM 1119 CD2 TYR A 356 6.377 -11.947 4.212 1.00 0.00 C ATOM 1120 CE1 TYR A 356 7.998 -9.715 4.247 1.00 0.00 C ATOM 1121 CE2 TYR A 356 7.517 -11.913 3.433 1.00 0.00 C ATOM 1122 CZ TYR A 356 8.324 -10.795 3.453 1.00 0.00 C ATOM 1123 OH TYR A 356 9.461 -10.756 2.679 1.00 0.00 O ATOM 0 H TYR A 356 4.475 -8.121 6.502 1.00 0.00 H new ATOM 0 HA TYR A 356 3.396 -9.997 4.506 1.00 0.00 H new ATOM 0 HB2 TYR A 356 5.060 -10.809 6.920 1.00 0.00 H new ATOM 0 HB3 TYR A 356 4.308 -11.891 5.764 1.00 0.00 H new ATOM 0 HD1 TYR A 356 6.606 -8.911 5.645 1.00 0.00 H new ATOM 0 HD2 TYR A 356 5.747 -12.824 4.193 1.00 0.00 H new ATOM 0 HE1 TYR A 356 8.632 -8.841 4.261 1.00 0.00 H new ATOM 0 HE2 TYR A 356 7.775 -12.758 2.811 1.00 0.00 H new ATOM 0 HH TYR A 356 9.546 -11.596 2.181 1.00 0.00 H new ATOM 1133 N MET A 357 1.404 -10.230 5.932 1.00 0.00 N ATOM 1134 CA MET A 357 0.191 -10.336 6.736 1.00 0.00 C ATOM 1135 C MET A 357 -0.746 -11.398 6.169 1.00 0.00 C ATOM 1136 O MET A 357 -0.692 -11.717 4.983 1.00 0.00 O ATOM 1137 CB MET A 357 -0.526 -8.986 6.795 1.00 0.00 C ATOM 1138 CG MET A 357 -1.245 -8.622 5.506 1.00 0.00 C ATOM 1139 SD MET A 357 -2.609 -7.473 5.772 1.00 0.00 S ATOM 1140 CE MET A 357 -2.501 -6.472 4.290 1.00 0.00 C ATOM 0 H MET A 357 1.272 -10.427 4.940 1.00 0.00 H new ATOM 0 HA MET A 357 0.478 -10.632 7.745 1.00 0.00 H new ATOM 0 HB2 MET A 357 -1.248 -9.003 7.612 1.00 0.00 H new ATOM 0 HB3 MET A 357 0.201 -8.208 7.028 1.00 0.00 H new ATOM 0 HG2 MET A 357 -0.533 -8.179 4.810 1.00 0.00 H new ATOM 0 HG3 MET A 357 -1.626 -9.530 5.038 1.00 0.00 H new ATOM 0 HE1 MET A 357 -3.061 -5.548 4.434 1.00 0.00 H new ATOM 0 HE2 MET A 357 -1.457 -6.236 4.086 1.00 0.00 H new ATOM 0 HE3 MET A 357 -2.920 -7.023 3.448 1.00 0.00 H new ATOM 1150 N GLY A 358 -1.604 -11.942 7.027 1.00 0.00 N ATOM 1151 CA GLY A 358 -2.540 -12.962 6.593 1.00 0.00 C ATOM 1152 C GLY A 358 -1.843 -14.194 6.050 1.00 0.00 C ATOM 1153 O GLY A 358 -2.487 -15.091 5.506 1.00 0.00 O ATOM 0 H GLY A 358 -1.667 -11.694 8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 358 -3.176 -13.248 7.431 1.00 0.00 H new ATOM 0 HA3 GLY A 358 -3.193 -12.549 5.824 1.00 0.00 H new ATOM 1157 N GLY A 359 -0.522 -14.239 6.196 1.00 0.00 N ATOM 1158 CA GLY A 359 0.240 -15.373 5.709 1.00 0.00 C ATOM 1159 C GLY A 359 0.574 -15.258 4.235 1.00 0.00 C ATOM 1160 O GLY A 359 0.749 -16.266 3.550 1.00 0.00 O ATOM 0 H GLY A 359 0.034 -13.510 6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 359 1.163 -15.459 6.282 1.00 0.00 H new ATOM 0 HA3 GLY A 359 -0.327 -16.288 5.879 1.00 0.00 H new ATOM 1164 N ARG A 360 0.661 -14.026 3.744 1.00 0.00 N ATOM 1165 CA ARG A 360 0.973 -13.783 2.341 1.00 0.00 C ATOM 1166 C ARG A 360 1.767 -12.490 2.176 1.00 0.00 C ATOM 1167 O ARG A 360 2.023 -11.779 3.148 1.00 0.00 O ATOM 1168 CB ARG A 360 -0.312 -13.713 1.515 1.00 0.00 C ATOM 1169 CG ARG A 360 -0.961 -15.067 1.282 1.00 0.00 C ATOM 1170 CD ARG A 360 -0.306 -15.808 0.127 1.00 0.00 C ATOM 1171 NE ARG A 360 -0.677 -15.241 -1.167 1.00 0.00 N ATOM 1172 CZ ARG A 360 -0.316 -15.769 -2.331 1.00 0.00 C ATOM 1173 NH1 ARG A 360 0.421 -16.870 -2.364 1.00 0.00 N ATOM 1174 NH2 ARG A 360 -0.693 -15.195 -3.467 1.00 0.00 N ATOM 0 H ARG A 360 0.520 -13.181 4.297 1.00 0.00 H new ATOM 0 HA ARG A 360 1.583 -14.612 1.982 1.00 0.00 H new ATOM 0 HB2 ARG A 360 -1.024 -13.061 2.021 1.00 0.00 H new ATOM 0 HB3 ARG A 360 -0.090 -13.255 0.551 1.00 0.00 H new ATOM 0 HG2 ARG A 360 -0.888 -15.667 2.189 1.00 0.00 H new ATOM 0 HG3 ARG A 360 -2.022 -14.932 1.074 1.00 0.00 H new ATOM 0 HD2 ARG A 360 0.777 -15.772 0.241 1.00 0.00 H new ATOM 0 HD3 ARG A 360 -0.596 -16.858 0.159 1.00 0.00 H new ATOM 0 HE ARG A 360 -1.244 -14.393 -1.177 1.00 0.00 H new ATOM 0 HH11 ARG A 360 0.713 -17.315 -1.494 1.00 0.00 H new ATOM 0 HH12 ARG A 360 0.696 -17.273 -3.260 1.00 0.00 H new ATOM 0 HH21 ARG A 360 -1.260 -14.348 -3.446 1.00 0.00 H new ATOM 0 HH22 ARG A 360 -0.415 -15.601 -4.360 1.00 0.00 H new ATOM 1188 N TYR A 361 2.154 -12.193 0.941 1.00 0.00 N ATOM 1189 CA TYR A 361 2.922 -10.988 0.650 1.00 0.00 C ATOM 1190 C TYR A 361 1.999 -9.831 0.278 1.00 0.00 C ATOM 1191 O TYR A 361 0.924 -10.037 -0.286 1.00 0.00 O ATOM 1192 CB TYR A 361 3.912 -11.250 -0.486 1.00 0.00 C ATOM 1193 CG TYR A 361 3.250 -11.461 -1.829 1.00 0.00 C ATOM 1194 CD1 TYR A 361 2.841 -10.381 -2.601 1.00 0.00 C ATOM 1195 CD2 TYR A 361 3.033 -12.740 -2.326 1.00 0.00 C ATOM 1196 CE1 TYR A 361 2.235 -10.568 -3.829 1.00 0.00 C ATOM 1197 CE2 TYR A 361 2.429 -12.937 -3.553 1.00 0.00 C ATOM 1198 CZ TYR A 361 2.032 -11.848 -4.300 1.00 0.00 C ATOM 1199 OH TYR A 361 1.429 -12.040 -5.522 1.00 0.00 O ATOM 0 H TYR A 361 1.949 -12.770 0.125 1.00 0.00 H new ATOM 0 HA TYR A 361 3.475 -10.715 1.549 1.00 0.00 H new ATOM 0 HB2 TYR A 361 4.601 -10.408 -0.558 1.00 0.00 H new ATOM 0 HB3 TYR A 361 4.508 -12.129 -0.242 1.00 0.00 H new ATOM 0 HD1 TYR A 361 2.999 -9.377 -2.235 1.00 0.00 H new ATOM 0 HD2 TYR A 361 3.342 -13.595 -1.743 1.00 0.00 H new ATOM 0 HE1 TYR A 361 1.922 -9.717 -4.416 1.00 0.00 H new ATOM 0 HE2 TYR A 361 2.269 -13.938 -3.925 1.00 0.00 H new ATOM 0 HH TYR A 361 1.362 -13.000 -5.706 1.00 0.00 H new ATOM 1209 N ILE A 362 2.428 -8.615 0.598 1.00 0.00 N ATOM 1210 CA ILE A 362 1.642 -7.425 0.297 1.00 0.00 C ATOM 1211 C ILE A 362 2.395 -6.493 -0.647 1.00 0.00 C ATOM 1212 O ILE A 362 3.624 -6.445 -0.637 1.00 0.00 O ATOM 1213 CB ILE A 362 1.276 -6.652 1.578 1.00 0.00 C ATOM 1214 CG1 ILE A 362 0.832 -7.622 2.675 1.00 0.00 C ATOM 1215 CG2 ILE A 362 0.184 -5.634 1.289 1.00 0.00 C ATOM 1216 CD1 ILE A 362 -0.354 -8.475 2.283 1.00 0.00 C ATOM 0 H ILE A 362 3.315 -8.428 1.065 1.00 0.00 H new ATOM 0 HA ILE A 362 0.726 -7.766 -0.186 1.00 0.00 H new ATOM 0 HB ILE A 362 2.159 -6.117 1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 362 1.668 -8.272 2.934 1.00 0.00 H new ATOM 0 HG13 ILE A 362 0.581 -7.054 3.571 1.00 0.00 H new ATOM 0 HG21 ILE A 362 -0.063 -5.096 2.204 1.00 0.00 H new ATOM 0 HG22 ILE A 362 0.535 -4.928 0.537 1.00 0.00 H new ATOM 0 HG23 ILE A 362 -0.703 -6.147 0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 362 -0.614 -9.138 3.108 1.00 0.00 H new ATOM 0 HD12 ILE A 362 -1.204 -7.833 2.053 1.00 0.00 H new ATOM 0 HD13 ILE A 362 -0.100 -9.070 1.405 1.00 0.00 H new ATOM 1228 N GLU A 363 1.647 -5.754 -1.461 1.00 0.00 N ATOM 1229 CA GLU A 363 2.245 -4.823 -2.411 1.00 0.00 C ATOM 1230 C GLU A 363 1.428 -3.538 -2.501 1.00 0.00 C ATOM 1231 O GLU A 363 0.293 -3.542 -2.979 1.00 0.00 O ATOM 1232 CB GLU A 363 2.353 -5.469 -3.794 1.00 0.00 C ATOM 1233 CG GLU A 363 2.541 -6.976 -3.748 1.00 0.00 C ATOM 1234 CD GLU A 363 3.234 -7.516 -4.984 1.00 0.00 C ATOM 1235 OE1 GLU A 363 4.482 -7.527 -5.008 1.00 0.00 O ATOM 1236 OE2 GLU A 363 2.527 -7.927 -5.928 1.00 0.00 O ATOM 0 H GLU A 363 0.628 -5.782 -1.482 1.00 0.00 H new ATOM 0 HA GLU A 363 3.245 -4.574 -2.055 1.00 0.00 H new ATOM 0 HB2 GLU A 363 1.452 -5.241 -4.364 1.00 0.00 H new ATOM 0 HB3 GLU A 363 3.191 -5.023 -4.330 1.00 0.00 H new ATOM 0 HG2 GLU A 363 3.124 -7.239 -2.865 1.00 0.00 H new ATOM 0 HG3 GLU A 363 1.568 -7.457 -3.642 1.00 0.00 H new ATOM 1243 N VAL A 364 2.012 -2.438 -2.036 1.00 0.00 N ATOM 1244 CA VAL A 364 1.340 -1.144 -2.064 1.00 0.00 C ATOM 1245 C VAL A 364 1.596 -0.420 -3.380 1.00 0.00 C ATOM 1246 O VAL A 364 2.703 -0.459 -3.918 1.00 0.00 O ATOM 1247 CB VAL A 364 1.799 -0.248 -0.899 1.00 0.00 C ATOM 1248 CG1 VAL A 364 0.888 0.963 -0.765 1.00 0.00 C ATOM 1249 CG2 VAL A 364 1.840 -1.040 0.399 1.00 0.00 C ATOM 0 H VAL A 364 2.950 -2.417 -1.635 1.00 0.00 H new ATOM 0 HA VAL A 364 0.272 -1.340 -1.963 1.00 0.00 H new ATOM 0 HB VAL A 364 2.807 0.107 -1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 364 1.228 1.584 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 364 0.915 1.542 -1.688 1.00 0.00 H new ATOM 0 HG13 VAL A 364 -0.133 0.631 -0.574 1.00 0.00 H new ATOM 0 HG21 VAL A 364 2.167 -0.391 1.211 1.00 0.00 H new ATOM 0 HG22 VAL A 364 0.845 -1.427 0.621 1.00 0.00 H new ATOM 0 HG23 VAL A 364 2.538 -1.871 0.296 1.00 0.00 H new ATOM 1259 N PHE A 365 0.565 0.242 -3.895 1.00 0.00 N ATOM 1260 CA PHE A 365 0.678 0.977 -5.150 1.00 0.00 C ATOM 1261 C PHE A 365 -0.074 2.302 -5.074 1.00 0.00 C ATOM 1262 O PHE A 365 -1.133 2.392 -4.454 1.00 0.00 O ATOM 1263 CB PHE A 365 0.137 0.136 -6.308 1.00 0.00 C ATOM 1264 CG PHE A 365 1.045 -0.993 -6.705 1.00 0.00 C ATOM 1265 CD1 PHE A 365 2.077 -0.786 -7.605 1.00 0.00 C ATOM 1266 CD2 PHE A 365 0.866 -2.262 -6.178 1.00 0.00 C ATOM 1267 CE1 PHE A 365 2.915 -1.822 -7.972 1.00 0.00 C ATOM 1268 CE2 PHE A 365 1.700 -3.302 -6.541 1.00 0.00 C ATOM 1269 CZ PHE A 365 2.725 -3.082 -7.440 1.00 0.00 C ATOM 0 H PHE A 365 -0.358 0.285 -3.463 1.00 0.00 H new ATOM 0 HA PHE A 365 1.733 1.188 -5.325 1.00 0.00 H new ATOM 0 HB2 PHE A 365 -0.835 -0.271 -6.028 1.00 0.00 H new ATOM 0 HB3 PHE A 365 -0.025 0.782 -7.171 1.00 0.00 H new ATOM 0 HD1 PHE A 365 2.229 0.197 -8.025 1.00 0.00 H new ATOM 0 HD2 PHE A 365 0.065 -2.440 -5.475 1.00 0.00 H new ATOM 0 HE1 PHE A 365 3.717 -1.646 -8.674 1.00 0.00 H new ATOM 0 HE2 PHE A 365 1.550 -4.286 -6.122 1.00 0.00 H new ATOM 0 HZ PHE A 365 3.377 -3.894 -7.726 1.00 0.00 H new ATOM 1279 N ARG A 366 0.482 3.328 -5.710 1.00 0.00 N ATOM 1280 CA ARG A 366 -0.134 4.650 -5.713 1.00 0.00 C ATOM 1281 C ARG A 366 -1.053 4.818 -6.920 1.00 0.00 C ATOM 1282 O ARG A 366 -0.621 4.682 -8.064 1.00 0.00 O ATOM 1283 CB ARG A 366 0.942 5.737 -5.722 1.00 0.00 C ATOM 1284 CG ARG A 366 0.509 7.027 -5.044 1.00 0.00 C ATOM 1285 CD ARG A 366 1.549 8.123 -5.218 1.00 0.00 C ATOM 1286 NE ARG A 366 1.387 8.834 -6.483 1.00 0.00 N ATOM 1287 CZ ARG A 366 0.341 9.602 -6.767 1.00 0.00 C ATOM 1288 NH1 ARG A 366 -0.631 9.758 -5.879 1.00 0.00 N ATOM 1289 NH2 ARG A 366 0.266 10.217 -7.941 1.00 0.00 N ATOM 0 H ARG A 366 1.358 3.269 -6.230 1.00 0.00 H new ATOM 0 HA ARG A 366 -0.731 4.748 -4.807 1.00 0.00 H new ATOM 0 HB2 ARG A 366 1.835 5.357 -5.225 1.00 0.00 H new ATOM 0 HB3 ARG A 366 1.219 5.954 -6.754 1.00 0.00 H new ATOM 0 HG2 ARG A 366 -0.442 7.357 -5.461 1.00 0.00 H new ATOM 0 HG3 ARG A 366 0.345 6.844 -3.982 1.00 0.00 H new ATOM 0 HD2 ARG A 366 1.472 8.830 -4.392 1.00 0.00 H new ATOM 0 HD3 ARG A 366 2.547 7.687 -5.172 1.00 0.00 H new ATOM 0 HE ARG A 366 2.118 8.735 -7.188 1.00 0.00 H new ATOM 0 HH11 ARG A 366 -0.577 9.288 -4.975 1.00 0.00 H new ATOM 0 HH12 ARG A 366 -1.433 10.348 -6.099 1.00 0.00 H new ATOM 0 HH21 ARG A 366 1.012 10.100 -8.627 1.00 0.00 H new ATOM 0 HH22 ARG A 366 -0.538 10.806 -8.158 1.00 0.00 H new ATOM 1303 N GLU A 367 -2.322 5.113 -6.654 1.00 0.00 N ATOM 1304 CA GLU A 367 -3.301 5.297 -7.719 1.00 0.00 C ATOM 1305 C GLU A 367 -3.656 6.773 -7.881 1.00 0.00 C ATOM 1306 O GLU A 367 -4.019 7.446 -6.916 1.00 0.00 O ATOM 1307 CB GLU A 367 -4.565 4.486 -7.426 1.00 0.00 C ATOM 1308 CG GLU A 367 -4.405 2.997 -7.680 1.00 0.00 C ATOM 1309 CD GLU A 367 -3.219 2.403 -6.945 1.00 0.00 C ATOM 1310 OE1 GLU A 367 -3.195 2.477 -5.699 1.00 0.00 O ATOM 1311 OE2 GLU A 367 -2.315 1.865 -7.617 1.00 0.00 O ATOM 0 H GLU A 367 -2.695 5.229 -5.712 1.00 0.00 H new ATOM 0 HA GLU A 367 -2.859 4.942 -8.650 1.00 0.00 H new ATOM 0 HB2 GLU A 367 -4.852 4.640 -6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 367 -5.381 4.865 -8.041 1.00 0.00 H new ATOM 0 HG2 GLU A 367 -5.314 2.480 -7.372 1.00 0.00 H new ATOM 0 HG3 GLU A 367 -4.287 2.825 -8.750 1.00 0.00 H new