USER MOD reduce.3.24.130724 H: found=0, std=0, add=619, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 620 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 323 GLN : amide:sc=-0.00644 K(o=-0.0064,f=-0.58) USER MOD Set 1.2: A 333 THR OG1 : rot 180:sc= 0 USER MOD Single : A 318 THR OG1 : rot -43:sc= 0.576 USER MOD Single : A 330 SER OG : rot 180:sc= 0 USER MOD Single : A 331 SER OG : rot 180:sc= -0.0695 USER MOD Single : A 334 ASN : amide:sc= 0.372 K(o=0.37,f=-4.5!) USER MOD Single : A 335 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 338 SER OG : rot 180:sc= -0.0318 USER MOD Single : A 347 GLN : amide:sc= -0.0104 X(o=-0.01,f=0) USER MOD Single : A 351 GLN : amide:sc=-0.00722 X(o=-0.0072,f=0) USER MOD Single : A 352 THR OG1 : rot 72:sc= 0.0743 USER MOD Single : A 355 ASN : amide:sc= 0.36 X(o=0.36,f=0) USER MOD Single : A 356 THR OG1 : rot 180:sc= -0.0632 USER MOD Single : A 357 TYR OH : rot 130:sc= -0.828 USER MOD Single : A 359 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 361 SER OG : rot 101:sc= -0.446 USER MOD Single : A 364 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 365 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 372 THR OG1 : rot 180:sc= -0.222 USER MOD Single : A 373 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 376 TYR OH : rot 120:sc= -1.08 USER MOD Single : A 377 LYS NZ :NH3+ 155:sc= 0.0245 (180deg=0) USER MOD Single : A 378 LYS NZ :NH3+ -166:sc= 0.168 (180deg=-0.0512) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 180:sc= 0 USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 163 N THR A 318 -8.528 12.555 -5.310 1.00 0.00 N ATOM 164 CA THR A 318 -7.084 12.564 -5.532 1.00 0.00 C ATOM 165 C THR A 318 -6.343 11.931 -4.347 1.00 0.00 C ATOM 166 O THR A 318 -5.297 12.417 -3.914 1.00 0.00 O ATOM 167 CB THR A 318 -6.604 14.003 -5.780 1.00 0.00 C ATOM 168 OG1 THR A 318 -5.220 14.034 -6.092 1.00 0.00 O ATOM 169 CG2 THR A 318 -6.834 14.928 -4.602 1.00 0.00 C ATOM 0 HA THR A 318 -6.861 11.965 -6.415 1.00 0.00 H new ATOM 0 HB THR A 318 -7.201 14.358 -6.620 1.00 0.00 H new ATOM 0 HG1 THR A 318 -4.735 13.433 -5.489 1.00 0.00 H new ATOM 0 HG21 THR A 318 -6.472 15.926 -4.847 1.00 0.00 H new ATOM 0 HG22 THR A 318 -7.900 14.974 -4.378 1.00 0.00 H new ATOM 0 HG23 THR A 318 -6.296 14.550 -3.732 1.00 0.00 H new ATOM 177 N VAL A 319 -6.896 10.833 -3.828 1.00 0.00 N ATOM 178 CA VAL A 319 -6.297 10.127 -2.700 1.00 0.00 C ATOM 179 C VAL A 319 -6.407 8.612 -2.874 1.00 0.00 C ATOM 180 O VAL A 319 -7.165 8.129 -3.719 1.00 0.00 O ATOM 181 CB VAL A 319 -6.957 10.529 -1.363 1.00 0.00 C ATOM 182 CG1 VAL A 319 -6.608 11.966 -0.995 1.00 0.00 C ATOM 183 CG2 VAL A 319 -8.469 10.336 -1.426 1.00 0.00 C ATOM 0 H VAL A 319 -7.760 10.415 -4.174 1.00 0.00 H new ATOM 0 HA VAL A 319 -5.245 10.412 -2.676 1.00 0.00 H new ATOM 0 HB VAL A 319 -6.565 9.877 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 319 -7.085 12.225 -0.050 1.00 0.00 H new ATOM 0 HG12 VAL A 319 -5.527 12.064 -0.895 1.00 0.00 H new ATOM 0 HG13 VAL A 319 -6.962 12.638 -1.777 1.00 0.00 H new ATOM 0 HG21 VAL A 319 -8.913 10.625 -0.473 1.00 0.00 H new ATOM 0 HG22 VAL A 319 -8.882 10.956 -2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 319 -8.694 9.289 -1.628 1.00 0.00 H new ATOM 193 N ALA A 320 -5.644 7.871 -2.070 1.00 0.00 N ATOM 194 CA ALA A 320 -5.649 6.407 -2.134 1.00 0.00 C ATOM 195 C ALA A 320 -5.921 5.777 -0.767 1.00 0.00 C ATOM 196 O ALA A 320 -5.610 6.354 0.278 1.00 0.00 O ATOM 197 CB ALA A 320 -4.332 5.898 -2.705 1.00 0.00 C ATOM 0 H ALA A 320 -5.015 8.259 -1.367 1.00 0.00 H new ATOM 0 HA ALA A 320 -6.462 6.109 -2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -4.350 4.809 -2.747 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -4.193 6.297 -3.710 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -3.509 6.223 -2.068 1.00 0.00 H new ATOM 203 N ARG A 321 -6.516 4.590 -0.782 1.00 0.00 N ATOM 204 CA ARG A 321 -6.840 3.874 0.446 1.00 0.00 C ATOM 205 C ARG A 321 -6.147 2.518 0.476 1.00 0.00 C ATOM 206 O ARG A 321 -6.294 1.722 -0.452 1.00 0.00 O ATOM 207 CB ARG A 321 -8.350 3.692 0.556 1.00 0.00 C ATOM 208 CG ARG A 321 -8.886 3.867 1.968 1.00 0.00 C ATOM 209 CD ARG A 321 -10.407 3.856 1.995 1.00 0.00 C ATOM 210 NE ARG A 321 -10.932 3.332 3.257 1.00 0.00 N ATOM 211 CZ ARG A 321 -12.193 3.486 3.669 1.00 0.00 C ATOM 212 NH1 ARG A 321 -13.074 4.147 2.921 1.00 0.00 N ATOM 213 NH2 ARG A 321 -12.576 2.975 4.834 1.00 0.00 N ATOM 0 H ARG A 321 -6.785 4.101 -1.636 1.00 0.00 H new ATOM 0 HA ARG A 321 -6.486 4.460 1.294 1.00 0.00 H new ATOM 0 HB2 ARG A 321 -8.842 4.409 -0.101 1.00 0.00 H new ATOM 0 HB3 ARG A 321 -8.614 2.697 0.197 1.00 0.00 H new ATOM 0 HG2 ARG A 321 -8.504 3.068 2.604 1.00 0.00 H new ATOM 0 HG3 ARG A 321 -8.521 4.807 2.383 1.00 0.00 H new ATOM 0 HD2 ARG A 321 -10.779 4.869 1.841 1.00 0.00 H new ATOM 0 HD3 ARG A 321 -10.779 3.250 1.169 1.00 0.00 H new ATOM 0 HE ARG A 321 -10.293 2.815 3.861 1.00 0.00 H new ATOM 0 HH11 ARG A 321 -12.788 4.541 2.025 1.00 0.00 H new ATOM 0 HH12 ARG A 321 -14.035 4.259 3.244 1.00 0.00 H new ATOM 0 HH21 ARG A 321 -11.907 2.466 5.412 1.00 0.00 H new ATOM 0 HH22 ARG A 321 -13.539 3.092 5.150 1.00 0.00 H new ATOM 227 N ILE A 322 -5.394 2.259 1.540 1.00 0.00 N ATOM 228 CA ILE A 322 -4.682 0.991 1.676 1.00 0.00 C ATOM 229 C ILE A 322 -5.012 0.307 2.996 1.00 0.00 C ATOM 230 O ILE A 322 -5.227 0.964 4.018 1.00 0.00 O ATOM 231 CB ILE A 322 -3.148 1.158 1.581 1.00 0.00 C ATOM 232 CG1 ILE A 322 -2.776 2.417 0.790 1.00 0.00 C ATOM 233 CG2 ILE A 322 -2.520 -0.074 0.942 1.00 0.00 C ATOM 234 CD1 ILE A 322 -3.092 2.324 -0.689 1.00 0.00 C ATOM 0 H ILE A 322 -5.261 2.906 2.317 1.00 0.00 H new ATOM 0 HA ILE A 322 -5.019 0.374 0.843 1.00 0.00 H new ATOM 0 HB ILE A 322 -2.758 1.268 2.593 1.00 0.00 H new ATOM 0 HG12 ILE A 322 -3.306 3.270 1.213 1.00 0.00 H new ATOM 0 HG13 ILE A 322 -1.710 2.611 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 322 -1.440 0.058 0.882 1.00 0.00 H new ATOM 0 HG22 ILE A 322 -2.745 -0.952 1.547 1.00 0.00 H new ATOM 0 HG23 ILE A 322 -2.925 -0.210 -0.061 1.00 0.00 H new ATOM 0 HD11 ILE A 322 -2.801 3.252 -1.182 1.00 0.00 H new ATOM 0 HD12 ILE A 322 -2.541 1.492 -1.127 1.00 0.00 H new ATOM 0 HD13 ILE A 322 -4.161 2.162 -0.823 1.00 0.00 H new ATOM 246 N GLN A 323 -5.044 -1.020 2.960 1.00 0.00 N ATOM 247 CA GLN A 323 -5.337 -1.822 4.142 1.00 0.00 C ATOM 248 C GLN A 323 -4.121 -2.654 4.533 1.00 0.00 C ATOM 249 O GLN A 323 -3.702 -3.544 3.788 1.00 0.00 O ATOM 250 CB GLN A 323 -6.535 -2.738 3.881 1.00 0.00 C ATOM 251 CG GLN A 323 -7.815 -2.276 4.561 1.00 0.00 C ATOM 252 CD GLN A 323 -9.066 -2.742 3.839 1.00 0.00 C ATOM 253 OE1 GLN A 323 -9.034 -3.705 3.071 1.00 0.00 O ATOM 254 NE2 GLN A 323 -10.180 -2.061 4.082 1.00 0.00 N ATOM 0 H GLN A 323 -4.869 -1.567 2.117 1.00 0.00 H new ATOM 0 HA GLN A 323 -5.582 -1.148 4.963 1.00 0.00 H new ATOM 0 HB2 GLN A 323 -6.707 -2.800 2.806 1.00 0.00 H new ATOM 0 HB3 GLN A 323 -6.294 -3.744 4.224 1.00 0.00 H new ATOM 0 HG2 GLN A 323 -7.832 -2.649 5.585 1.00 0.00 H new ATOM 0 HG3 GLN A 323 -7.818 -1.187 4.618 1.00 0.00 H new ATOM 0 HE21 GLN A 323 -10.164 -1.269 4.725 1.00 0.00 H new ATOM 0 HE22 GLN A 323 -11.052 -2.330 3.626 1.00 0.00 H new ATOM 263 N PHE A 324 -3.555 -2.357 5.702 1.00 0.00 N ATOM 264 CA PHE A 324 -2.383 -3.072 6.188 1.00 0.00 C ATOM 265 C PHE A 324 -2.784 -4.363 6.899 1.00 0.00 C ATOM 266 O PHE A 324 -3.343 -4.332 7.997 1.00 0.00 O ATOM 267 CB PHE A 324 -1.575 -2.179 7.130 1.00 0.00 C ATOM 268 CG PHE A 324 -0.095 -2.224 6.880 1.00 0.00 C ATOM 269 CD1 PHE A 324 0.496 -1.362 5.969 1.00 0.00 C ATOM 270 CD2 PHE A 324 0.707 -3.126 7.559 1.00 0.00 C ATOM 271 CE1 PHE A 324 1.857 -1.402 5.739 1.00 0.00 C ATOM 272 CE2 PHE A 324 2.068 -3.170 7.333 1.00 0.00 C ATOM 273 CZ PHE A 324 2.645 -2.305 6.424 1.00 0.00 C ATOM 0 H PHE A 324 -3.892 -1.625 6.328 1.00 0.00 H new ATOM 0 HA PHE A 324 -1.765 -3.336 5.330 1.00 0.00 H new ATOM 0 HB2 PHE A 324 -1.921 -1.150 7.028 1.00 0.00 H new ATOM 0 HB3 PHE A 324 -1.770 -2.480 8.159 1.00 0.00 H new ATOM 0 HD1 PHE A 324 -0.115 -0.651 5.433 1.00 0.00 H new ATOM 0 HD2 PHE A 324 0.262 -3.803 8.274 1.00 0.00 H new ATOM 0 HE1 PHE A 324 2.304 -0.728 5.024 1.00 0.00 H new ATOM 0 HE2 PHE A 324 2.681 -3.881 7.867 1.00 0.00 H new ATOM 0 HZ PHE A 324 3.710 -2.335 6.249 1.00 0.00 H new ATOM 283 N ARG A 325 -2.491 -5.492 6.258 1.00 0.00 N ATOM 284 CA ARG A 325 -2.812 -6.803 6.807 1.00 0.00 C ATOM 285 C ARG A 325 -1.629 -7.381 7.579 1.00 0.00 C ATOM 286 O ARG A 325 -0.567 -6.760 7.667 1.00 0.00 O ATOM 287 CB ARG A 325 -3.210 -7.768 5.687 1.00 0.00 C ATOM 288 CG ARG A 325 -4.149 -7.159 4.657 1.00 0.00 C ATOM 289 CD ARG A 325 -5.175 -8.169 4.169 1.00 0.00 C ATOM 290 NE ARG A 325 -6.262 -7.531 3.425 1.00 0.00 N ATOM 291 CZ ARG A 325 -7.376 -8.160 3.040 1.00 0.00 C ATOM 292 NH1 ARG A 325 -7.557 -9.447 3.327 1.00 0.00 N ATOM 293 NH2 ARG A 325 -8.312 -7.500 2.366 1.00 0.00 N ATOM 0 H ARG A 325 -2.028 -5.522 5.350 1.00 0.00 H new ATOM 0 HA ARG A 325 -3.650 -6.679 7.493 1.00 0.00 H new ATOM 0 HB2 ARG A 325 -2.309 -8.116 5.182 1.00 0.00 H new ATOM 0 HB3 ARG A 325 -3.687 -8.644 6.127 1.00 0.00 H new ATOM 0 HG2 ARG A 325 -4.661 -6.301 5.093 1.00 0.00 H new ATOM 0 HG3 ARG A 325 -3.571 -6.789 3.810 1.00 0.00 H new ATOM 0 HD2 ARG A 325 -4.684 -8.906 3.533 1.00 0.00 H new ATOM 0 HD3 ARG A 325 -5.587 -8.708 5.022 1.00 0.00 H new ATOM 0 HE ARG A 325 -6.163 -6.544 3.185 1.00 0.00 H new ATOM 0 HH11 ARG A 325 -6.843 -9.960 3.844 1.00 0.00 H new ATOM 0 HH12 ARG A 325 -8.410 -9.921 3.030 1.00 0.00 H new ATOM 0 HH21 ARG A 325 -8.180 -6.514 2.143 1.00 0.00 H new ATOM 0 HH22 ARG A 325 -9.163 -7.980 2.072 1.00 0.00 H new ATOM 307 N LEU A 326 -1.817 -8.577 8.129 1.00 0.00 N ATOM 308 CA LEU A 326 -0.767 -9.247 8.890 1.00 0.00 C ATOM 309 C LEU A 326 -1.087 -10.733 9.072 1.00 0.00 C ATOM 310 O LEU A 326 -2.235 -11.148 8.901 1.00 0.00 O ATOM 311 CB LEU A 326 -0.588 -8.568 10.259 1.00 0.00 C ATOM 312 CG LEU A 326 -1.883 -8.090 10.930 1.00 0.00 C ATOM 313 CD1 LEU A 326 -1.811 -8.277 12.438 1.00 0.00 C ATOM 314 CD2 LEU A 326 -2.157 -6.631 10.588 1.00 0.00 C ATOM 0 H LEU A 326 -2.688 -9.103 8.062 1.00 0.00 H new ATOM 0 HA LEU A 326 0.165 -9.166 8.331 1.00 0.00 H new ATOM 0 HB2 LEU A 326 -0.088 -9.267 10.930 1.00 0.00 H new ATOM 0 HB3 LEU A 326 0.076 -7.712 10.137 1.00 0.00 H new ATOM 0 HG LEU A 326 -2.705 -8.695 10.549 1.00 0.00 H new ATOM 0 HD11 LEU A 326 -2.740 -7.931 12.892 1.00 0.00 H new ATOM 0 HD12 LEU A 326 -1.666 -9.333 12.667 1.00 0.00 H new ATOM 0 HD13 LEU A 326 -0.976 -7.701 12.837 1.00 0.00 H new ATOM 0 HD21 LEU A 326 -3.079 -6.311 11.073 1.00 0.00 H new ATOM 0 HD22 LEU A 326 -1.330 -6.014 10.938 1.00 0.00 H new ATOM 0 HD23 LEU A 326 -2.259 -6.523 9.508 1.00 0.00 H new ATOM 326 N PRO A 327 -0.077 -11.556 9.438 1.00 0.00 N ATOM 327 CA PRO A 327 -0.265 -12.997 9.657 1.00 0.00 C ATOM 328 C PRO A 327 -1.388 -13.286 10.651 1.00 0.00 C ATOM 329 O PRO A 327 -2.038 -14.328 10.573 1.00 0.00 O ATOM 330 CB PRO A 327 1.081 -13.474 10.225 1.00 0.00 C ATOM 331 CG PRO A 327 1.821 -12.232 10.596 1.00 0.00 C ATOM 332 CD PRO A 327 1.315 -11.153 9.682 1.00 0.00 C ATOM 0 HA PRO A 327 -0.549 -13.506 8.736 1.00 0.00 H new ATOM 0 HB2 PRO A 327 0.935 -14.117 11.093 1.00 0.00 H new ATOM 0 HB3 PRO A 327 1.634 -14.055 9.487 1.00 0.00 H new ATOM 0 HG2 PRO A 327 1.646 -11.972 11.640 1.00 0.00 H new ATOM 0 HG3 PRO A 327 2.896 -12.370 10.478 1.00 0.00 H new ATOM 0 HD2 PRO A 327 1.375 -10.169 10.147 1.00 0.00 H new ATOM 0 HD3 PRO A 327 1.890 -11.105 8.757 1.00 0.00 H new ATOM 340 N ASP A 328 -1.615 -12.349 11.579 1.00 0.00 N ATOM 341 CA ASP A 328 -2.667 -12.495 12.581 1.00 0.00 C ATOM 342 C ASP A 328 -4.015 -12.769 11.916 1.00 0.00 C ATOM 343 O ASP A 328 -4.814 -13.562 12.415 1.00 0.00 O ATOM 344 CB ASP A 328 -2.767 -11.229 13.448 1.00 0.00 C ATOM 345 CG ASP A 328 -3.408 -11.491 14.801 1.00 0.00 C ATOM 346 OD1 ASP A 328 -4.572 -11.944 14.831 1.00 0.00 O ATOM 347 OD2 ASP A 328 -2.744 -11.240 15.830 1.00 0.00 O ATOM 0 H ASP A 328 -1.082 -11.483 11.653 1.00 0.00 H new ATOM 0 HA ASP A 328 -2.409 -13.342 13.216 1.00 0.00 H new ATOM 0 HB2 ASP A 328 -1.769 -10.817 13.598 1.00 0.00 H new ATOM 0 HB3 ASP A 328 -3.347 -10.475 12.916 1.00 0.00 H new ATOM 352 N GLY A 329 -4.266 -12.100 10.790 1.00 0.00 N ATOM 353 CA GLY A 329 -5.520 -12.275 10.083 1.00 0.00 C ATOM 354 C GLY A 329 -6.277 -10.967 9.941 1.00 0.00 C ATOM 355 O GLY A 329 -7.035 -10.782 8.988 1.00 0.00 O ATOM 0 H GLY A 329 -3.620 -11.440 10.357 1.00 0.00 H new ATOM 0 HA2 GLY A 329 -5.324 -12.690 9.094 1.00 0.00 H new ATOM 0 HA3 GLY A 329 -6.139 -12.997 10.615 1.00 0.00 H new ATOM 359 N SER A 330 -6.069 -10.054 10.897 1.00 0.00 N ATOM 360 CA SER A 330 -6.734 -8.752 10.885 1.00 0.00 C ATOM 361 C SER A 330 -5.926 -7.725 10.085 1.00 0.00 C ATOM 362 O SER A 330 -4.769 -7.968 9.732 1.00 0.00 O ATOM 363 CB SER A 330 -6.946 -8.251 12.318 1.00 0.00 C ATOM 364 OG SER A 330 -7.600 -9.228 13.115 1.00 0.00 O ATOM 0 H SER A 330 -5.443 -10.197 11.690 1.00 0.00 H new ATOM 0 HA SER A 330 -7.703 -8.874 10.402 1.00 0.00 H new ATOM 0 HB2 SER A 330 -5.984 -8.000 12.764 1.00 0.00 H new ATOM 0 HB3 SER A 330 -7.538 -7.336 12.302 1.00 0.00 H new ATOM 0 HG SER A 330 -7.720 -8.882 14.024 1.00 0.00 H new ATOM 370 N SER A 331 -6.545 -6.577 9.804 1.00 0.00 N ATOM 371 CA SER A 331 -5.884 -5.508 9.050 1.00 0.00 C ATOM 372 C SER A 331 -6.422 -4.136 9.458 1.00 0.00 C ATOM 373 O SER A 331 -7.578 -4.009 9.872 1.00 0.00 O ATOM 374 CB SER A 331 -6.067 -5.710 7.536 1.00 0.00 C ATOM 375 OG SER A 331 -6.437 -7.046 7.225 1.00 0.00 O ATOM 0 H SER A 331 -7.502 -6.363 10.086 1.00 0.00 H new ATOM 0 HA SER A 331 -4.820 -5.550 9.284 1.00 0.00 H new ATOM 0 HB2 SER A 331 -6.831 -5.026 7.167 1.00 0.00 H new ATOM 0 HB3 SER A 331 -5.140 -5.460 7.021 1.00 0.00 H new ATOM 0 HG SER A 331 -6.546 -7.138 6.255 1.00 0.00 H new ATOM 381 N PHE A 332 -5.580 -3.108 9.327 1.00 0.00 N ATOM 382 CA PHE A 332 -5.976 -1.745 9.671 1.00 0.00 C ATOM 383 C PHE A 332 -6.045 -0.873 8.421 1.00 0.00 C ATOM 384 O PHE A 332 -5.144 -0.900 7.580 1.00 0.00 O ATOM 385 CB PHE A 332 -5.030 -1.120 10.716 1.00 0.00 C ATOM 386 CG PHE A 332 -3.597 -1.590 10.659 1.00 0.00 C ATOM 387 CD1 PHE A 332 -3.244 -2.857 11.105 1.00 0.00 C ATOM 388 CD2 PHE A 332 -2.601 -0.755 10.177 1.00 0.00 C ATOM 389 CE1 PHE A 332 -1.929 -3.280 11.064 1.00 0.00 C ATOM 390 CE2 PHE A 332 -1.284 -1.175 10.134 1.00 0.00 C ATOM 391 CZ PHE A 332 -0.948 -2.438 10.579 1.00 0.00 C ATOM 0 H PHE A 332 -4.623 -3.196 8.986 1.00 0.00 H new ATOM 0 HA PHE A 332 -6.969 -1.797 10.117 1.00 0.00 H new ATOM 0 HB2 PHE A 332 -5.044 -0.037 10.592 1.00 0.00 H new ATOM 0 HB3 PHE A 332 -5.424 -1.332 11.710 1.00 0.00 H new ATOM 0 HD1 PHE A 332 -4.006 -3.519 11.488 1.00 0.00 H new ATOM 0 HD2 PHE A 332 -2.857 0.236 9.831 1.00 0.00 H new ATOM 0 HE1 PHE A 332 -1.669 -4.269 11.411 1.00 0.00 H new ATOM 0 HE2 PHE A 332 -0.519 -0.515 9.752 1.00 0.00 H new ATOM 0 HZ PHE A 332 0.080 -2.767 10.548 1.00 0.00 H new ATOM 401 N THR A 333 -7.132 -0.113 8.299 1.00 0.00 N ATOM 402 CA THR A 333 -7.338 0.758 7.145 1.00 0.00 C ATOM 403 C THR A 333 -6.874 2.183 7.436 1.00 0.00 C ATOM 404 O THR A 333 -7.078 2.703 8.536 1.00 0.00 O ATOM 405 CB THR A 333 -8.819 0.768 6.738 1.00 0.00 C ATOM 406 OG1 THR A 333 -9.408 -0.513 6.900 1.00 0.00 O ATOM 407 CG2 THR A 333 -9.037 1.192 5.304 1.00 0.00 C ATOM 0 H THR A 333 -7.884 -0.083 8.987 1.00 0.00 H new ATOM 0 HA THR A 333 -6.741 0.363 6.323 1.00 0.00 H new ATOM 0 HB THR A 333 -9.289 1.497 7.399 1.00 0.00 H new ATOM 0 HG1 THR A 333 -10.351 -0.476 6.635 1.00 0.00 H new ATOM 0 HG21 THR A 333 -10.103 1.178 5.079 1.00 0.00 H new ATOM 0 HG22 THR A 333 -8.648 2.200 5.160 1.00 0.00 H new ATOM 0 HG23 THR A 333 -8.517 0.504 4.638 1.00 0.00 H new ATOM 415 N ASN A 334 -6.251 2.806 6.437 1.00 0.00 N ATOM 416 CA ASN A 334 -5.756 4.173 6.565 1.00 0.00 C ATOM 417 C ASN A 334 -5.951 4.947 5.260 1.00 0.00 C ATOM 418 O ASN A 334 -6.343 4.371 4.241 1.00 0.00 O ATOM 419 CB ASN A 334 -4.272 4.162 6.952 1.00 0.00 C ATOM 420 CG ASN A 334 -3.914 5.258 7.942 1.00 0.00 C ATOM 421 OD1 ASN A 334 -4.534 6.322 7.961 1.00 0.00 O ATOM 422 ND2 ASN A 334 -2.906 5.005 8.772 1.00 0.00 N ATOM 0 H ASN A 334 -6.077 2.382 5.526 1.00 0.00 H new ATOM 0 HA ASN A 334 -6.326 4.671 7.349 1.00 0.00 H new ATOM 0 HB2 ASN A 334 -4.021 3.193 7.383 1.00 0.00 H new ATOM 0 HB3 ASN A 334 -3.666 4.278 6.053 1.00 0.00 H new ATOM 0 HD21 ASN A 334 -2.621 5.705 9.457 1.00 0.00 H new ATOM 0 HD22 ASN A 334 -2.418 4.111 8.724 1.00 0.00 H new ATOM 429 N GLN A 335 -5.676 6.252 5.295 1.00 0.00 N ATOM 430 CA GLN A 335 -5.823 7.098 4.118 1.00 0.00 C ATOM 431 C GLN A 335 -4.465 7.614 3.649 1.00 0.00 C ATOM 432 O GLN A 335 -3.768 8.314 4.383 1.00 0.00 O ATOM 433 CB GLN A 335 -6.755 8.276 4.422 1.00 0.00 C ATOM 434 CG GLN A 335 -8.090 8.202 3.697 1.00 0.00 C ATOM 435 CD GLN A 335 -9.263 8.585 4.582 1.00 0.00 C ATOM 436 OE1 GLN A 335 -9.214 9.585 5.299 1.00 0.00 O ATOM 437 NE2 GLN A 335 -10.325 7.789 4.537 1.00 0.00 N ATOM 0 H GLN A 335 -5.350 6.743 6.128 1.00 0.00 H new ATOM 0 HA GLN A 335 -6.260 6.497 3.320 1.00 0.00 H new ATOM 0 HB2 GLN A 335 -6.937 8.316 5.496 1.00 0.00 H new ATOM 0 HB3 GLN A 335 -6.254 9.204 4.148 1.00 0.00 H new ATOM 0 HG2 GLN A 335 -8.064 8.862 2.830 1.00 0.00 H new ATOM 0 HG3 GLN A 335 -8.239 7.189 3.322 1.00 0.00 H new ATOM 0 HE21 GLN A 335 -10.323 6.970 3.929 1.00 0.00 H new ATOM 0 HE22 GLN A 335 -11.142 7.996 5.111 1.00 0.00 H new ATOM 446 N PHE A 336 -4.107 7.266 2.419 1.00 0.00 N ATOM 447 CA PHE A 336 -2.843 7.688 1.829 1.00 0.00 C ATOM 448 C PHE A 336 -3.100 8.311 0.457 1.00 0.00 C ATOM 449 O PHE A 336 -3.585 7.642 -0.449 1.00 0.00 O ATOM 450 CB PHE A 336 -1.890 6.497 1.700 1.00 0.00 C ATOM 451 CG PHE A 336 -1.490 5.888 3.017 1.00 0.00 C ATOM 452 CD1 PHE A 336 -0.520 6.488 3.805 1.00 0.00 C ATOM 453 CD2 PHE A 336 -2.079 4.714 3.464 1.00 0.00 C ATOM 454 CE1 PHE A 336 -0.145 5.930 5.012 1.00 0.00 C ATOM 455 CE2 PHE A 336 -1.706 4.151 4.670 1.00 0.00 C ATOM 456 CZ PHE A 336 -0.738 4.761 5.445 1.00 0.00 C ATOM 0 H PHE A 336 -4.681 6.687 1.806 1.00 0.00 H new ATOM 0 HA PHE A 336 -2.379 8.430 2.478 1.00 0.00 H new ATOM 0 HB2 PHE A 336 -2.363 5.731 1.086 1.00 0.00 H new ATOM 0 HB3 PHE A 336 -0.992 6.819 1.172 1.00 0.00 H new ATOM 0 HD1 PHE A 336 -0.052 7.402 3.471 1.00 0.00 H new ATOM 0 HD2 PHE A 336 -2.837 4.235 2.863 1.00 0.00 H new ATOM 0 HE1 PHE A 336 0.612 6.408 5.616 1.00 0.00 H new ATOM 0 HE2 PHE A 336 -2.170 3.236 5.006 1.00 0.00 H new ATOM 0 HZ PHE A 336 -0.446 4.324 6.388 1.00 0.00 H new ATOM 466 N PRO A 337 -2.775 9.603 0.279 1.00 0.00 N ATOM 467 CA PRO A 337 -2.992 10.299 -0.991 1.00 0.00 C ATOM 468 C PRO A 337 -2.346 9.590 -2.167 1.00 0.00 C ATOM 469 O PRO A 337 -1.464 8.747 -1.998 1.00 0.00 O ATOM 470 CB PRO A 337 -2.347 11.665 -0.780 1.00 0.00 C ATOM 471 CG PRO A 337 -2.320 11.851 0.693 1.00 0.00 C ATOM 472 CD PRO A 337 -2.170 10.481 1.288 1.00 0.00 C ATOM 0 HA PRO A 337 -4.053 10.349 -1.236 1.00 0.00 H new ATOM 0 HB2 PRO A 337 -1.342 11.697 -1.201 1.00 0.00 H new ATOM 0 HB3 PRO A 337 -2.922 12.453 -1.267 1.00 0.00 H new ATOM 0 HG2 PRO A 337 -1.492 12.496 0.988 1.00 0.00 H new ATOM 0 HG3 PRO A 337 -3.236 12.328 1.042 1.00 0.00 H new ATOM 0 HD2 PRO A 337 -1.123 10.231 1.462 1.00 0.00 H new ATOM 0 HD3 PRO A 337 -2.681 10.402 2.248 1.00 0.00 H new ATOM 480 N SER A 338 -2.792 9.946 -3.362 1.00 0.00 N ATOM 481 CA SER A 338 -2.265 9.354 -4.584 1.00 0.00 C ATOM 482 C SER A 338 -0.850 9.861 -4.891 1.00 0.00 C ATOM 483 O SER A 338 -0.203 9.367 -5.814 1.00 0.00 O ATOM 484 CB SER A 338 -3.189 9.662 -5.764 1.00 0.00 C ATOM 485 OG SER A 338 -4.548 9.693 -5.364 1.00 0.00 O ATOM 0 H SER A 338 -3.520 10.644 -3.513 1.00 0.00 H new ATOM 0 HA SER A 338 -2.215 8.276 -4.432 1.00 0.00 H new ATOM 0 HB2 SER A 338 -2.915 10.622 -6.201 1.00 0.00 H new ATOM 0 HB3 SER A 338 -3.054 8.908 -6.540 1.00 0.00 H new ATOM 0 HG SER A 338 -5.113 9.894 -6.139 1.00 0.00 H new ATOM 491 N ASP A 339 -0.373 10.851 -4.119 1.00 0.00 N ATOM 492 CA ASP A 339 0.963 11.421 -4.327 1.00 0.00 C ATOM 493 C ASP A 339 1.881 11.161 -3.129 1.00 0.00 C ATOM 494 O ASP A 339 3.096 11.029 -3.292 1.00 0.00 O ATOM 495 CB ASP A 339 0.860 12.931 -4.585 1.00 0.00 C ATOM 496 CG ASP A 339 0.206 13.274 -5.916 1.00 0.00 C ATOM 497 OD1 ASP A 339 -0.631 12.482 -6.400 1.00 0.00 O ATOM 498 OD2 ASP A 339 0.530 14.346 -6.472 1.00 0.00 O ATOM 0 H ASP A 339 -0.893 11.270 -3.348 1.00 0.00 H new ATOM 0 HA ASP A 339 1.399 10.931 -5.198 1.00 0.00 H new ATOM 0 HB2 ASP A 339 0.289 13.392 -3.779 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.859 13.366 -4.557 1.00 0.00 H new ATOM 503 N ALA A 340 1.290 11.091 -1.929 1.00 0.00 N ATOM 504 CA ALA A 340 2.043 10.848 -0.700 1.00 0.00 C ATOM 505 C ALA A 340 2.959 9.632 -0.841 1.00 0.00 C ATOM 506 O ALA A 340 2.644 8.686 -1.564 1.00 0.00 O ATOM 507 CB ALA A 340 1.090 10.663 0.478 1.00 0.00 C ATOM 0 H ALA A 340 0.286 11.201 -1.787 1.00 0.00 H new ATOM 0 HA ALA A 340 2.671 11.719 -0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 340 1.665 10.483 1.386 1.00 0.00 H new ATOM 0 HB2 ALA A 340 0.487 11.562 0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 340 0.437 9.812 0.287 1.00 0.00 H new ATOM 513 N PRO A 341 4.119 9.652 -0.153 1.00 0.00 N ATOM 514 CA PRO A 341 5.101 8.557 -0.204 1.00 0.00 C ATOM 515 C PRO A 341 4.498 7.199 0.151 1.00 0.00 C ATOM 516 O PRO A 341 3.717 7.083 1.095 1.00 0.00 O ATOM 517 CB PRO A 341 6.146 8.960 0.841 1.00 0.00 C ATOM 518 CG PRO A 341 6.018 10.438 0.967 1.00 0.00 C ATOM 519 CD PRO A 341 4.569 10.753 0.720 1.00 0.00 C ATOM 0 HA PRO A 341 5.503 8.432 -1.209 1.00 0.00 H new ATOM 0 HB2 PRO A 341 5.961 8.466 1.795 1.00 0.00 H new ATOM 0 HB3 PRO A 341 7.150 8.677 0.524 1.00 0.00 H new ATOM 0 HG2 PRO A 341 6.326 10.773 1.957 1.00 0.00 H new ATOM 0 HG3 PRO A 341 6.656 10.948 0.245 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.001 10.785 1.650 1.00 0.00 H new ATOM 0 HD3 PRO A 341 4.446 11.723 0.238 1.00 0.00 H new ATOM 527 N LEU A 342 4.882 6.174 -0.609 1.00 0.00 N ATOM 528 CA LEU A 342 4.400 4.813 -0.377 1.00 0.00 C ATOM 529 C LEU A 342 4.885 4.294 0.978 1.00 0.00 C ATOM 530 O LEU A 342 4.167 3.569 1.669 1.00 0.00 O ATOM 531 CB LEU A 342 4.877 3.887 -1.503 1.00 0.00 C ATOM 532 CG LEU A 342 4.385 2.433 -1.433 1.00 0.00 C ATOM 533 CD1 LEU A 342 5.286 1.605 -0.529 1.00 0.00 C ATOM 534 CD2 LEU A 342 2.938 2.366 -0.962 1.00 0.00 C ATOM 0 H LEU A 342 5.528 6.261 -1.394 1.00 0.00 H new ATOM 0 HA LEU A 342 3.310 4.827 -0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 342 4.559 4.312 -2.455 1.00 0.00 H new ATOM 0 HB3 LEU A 342 5.967 3.881 -1.505 1.00 0.00 H new ATOM 0 HG LEU A 342 4.429 2.014 -2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 342 4.921 0.579 -0.493 1.00 0.00 H new ATOM 0 HD12 LEU A 342 6.303 1.615 -0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 342 5.281 2.028 0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 342 2.616 1.325 -0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 342 2.858 2.809 0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 342 2.303 2.915 -1.657 1.00 0.00 H new ATOM 546 N GLU A 343 6.112 4.675 1.350 1.00 0.00 N ATOM 547 CA GLU A 343 6.700 4.254 2.622 1.00 0.00 C ATOM 548 C GLU A 343 5.847 4.681 3.819 1.00 0.00 C ATOM 549 O GLU A 343 5.960 4.093 4.892 1.00 0.00 O ATOM 550 CB GLU A 343 8.120 4.808 2.778 1.00 0.00 C ATOM 551 CG GLU A 343 8.240 6.298 2.491 1.00 0.00 C ATOM 552 CD GLU A 343 9.448 6.925 3.161 1.00 0.00 C ATOM 553 OE1 GLU A 343 10.583 6.633 2.730 1.00 0.00 O ATOM 554 OE2 GLU A 343 9.259 7.705 4.119 1.00 0.00 O ATOM 0 H GLU A 343 6.715 5.274 0.787 1.00 0.00 H new ATOM 0 HA GLU A 343 6.738 3.165 2.605 1.00 0.00 H new ATOM 0 HB2 GLU A 343 8.464 4.616 3.794 1.00 0.00 H new ATOM 0 HB3 GLU A 343 8.786 4.265 2.108 1.00 0.00 H new ATOM 0 HG2 GLU A 343 8.305 6.453 1.414 1.00 0.00 H new ATOM 0 HG3 GLU A 343 7.337 6.804 2.832 1.00 0.00 H new ATOM 561 N GLU A 344 4.997 5.700 3.633 1.00 0.00 N ATOM 562 CA GLU A 344 4.129 6.189 4.708 1.00 0.00 C ATOM 563 C GLU A 344 3.413 5.031 5.405 1.00 0.00 C ATOM 564 O GLU A 344 3.399 4.953 6.632 1.00 0.00 O ATOM 565 CB GLU A 344 3.097 7.179 4.161 1.00 0.00 C ATOM 566 CG GLU A 344 3.656 8.572 3.913 1.00 0.00 C ATOM 567 CD GLU A 344 4.299 9.172 5.149 1.00 0.00 C ATOM 568 OE1 GLU A 344 3.608 9.286 6.184 1.00 0.00 O ATOM 569 OE2 GLU A 344 5.495 9.526 5.083 1.00 0.00 O ATOM 0 H GLU A 344 4.893 6.199 2.750 1.00 0.00 H new ATOM 0 HA GLU A 344 4.760 6.698 5.436 1.00 0.00 H new ATOM 0 HB2 GLU A 344 2.692 6.789 3.228 1.00 0.00 H new ATOM 0 HB3 GLU A 344 2.267 7.250 4.864 1.00 0.00 H new ATOM 0 HG2 GLU A 344 4.393 8.526 3.111 1.00 0.00 H new ATOM 0 HG3 GLU A 344 2.853 9.226 3.572 1.00 0.00 H new ATOM 576 N ALA A 345 2.828 4.132 4.612 1.00 0.00 N ATOM 577 CA ALA A 345 2.121 2.973 5.156 1.00 0.00 C ATOM 578 C ALA A 345 3.094 1.990 5.808 1.00 0.00 C ATOM 579 O ALA A 345 2.777 1.378 6.829 1.00 0.00 O ATOM 580 CB ALA A 345 1.323 2.277 4.063 1.00 0.00 C ATOM 0 H ALA A 345 2.830 4.184 3.593 1.00 0.00 H new ATOM 0 HA ALA A 345 1.433 3.329 5.923 1.00 0.00 H new ATOM 0 HB1 ALA A 345 0.803 1.417 4.484 1.00 0.00 H new ATOM 0 HB2 ALA A 345 0.595 2.972 3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 345 1.999 1.943 3.276 1.00 0.00 H new ATOM 586 N ARG A 346 4.279 1.843 5.210 1.00 0.00 N ATOM 587 CA ARG A 346 5.298 0.934 5.728 1.00 0.00 C ATOM 588 C ARG A 346 5.848 1.423 7.070 1.00 0.00 C ATOM 589 O ARG A 346 5.808 0.692 8.062 1.00 0.00 O ATOM 590 CB ARG A 346 6.439 0.786 4.717 1.00 0.00 C ATOM 591 CG ARG A 346 7.546 -0.147 5.178 1.00 0.00 C ATOM 592 CD ARG A 346 8.911 0.381 4.776 1.00 0.00 C ATOM 593 NE ARG A 346 9.912 -0.681 4.688 1.00 0.00 N ATOM 594 CZ ARG A 346 11.055 -0.577 4.005 1.00 0.00 C ATOM 595 NH1 ARG A 346 11.354 0.550 3.359 1.00 0.00 N ATOM 596 NH2 ARG A 346 11.904 -1.598 3.973 1.00 0.00 N ATOM 0 H ARG A 346 4.554 2.344 4.365 1.00 0.00 H new ATOM 0 HA ARG A 346 4.831 -0.038 5.887 1.00 0.00 H new ATOM 0 HB2 ARG A 346 6.033 0.416 3.776 1.00 0.00 H new ATOM 0 HB3 ARG A 346 6.865 1.769 4.516 1.00 0.00 H new ATOM 0 HG2 ARG A 346 7.502 -0.261 6.261 1.00 0.00 H new ATOM 0 HG3 ARG A 346 7.394 -1.137 4.747 1.00 0.00 H new ATOM 0 HD2 ARG A 346 8.834 0.885 3.813 1.00 0.00 H new ATOM 0 HD3 ARG A 346 9.238 1.126 5.501 1.00 0.00 H new ATOM 0 HE ARG A 346 9.726 -1.556 5.179 1.00 0.00 H new ATOM 0 HH11 ARG A 346 10.708 1.339 3.385 1.00 0.00 H new ATOM 0 HH12 ARG A 346 12.229 0.623 2.839 1.00 0.00 H new ATOM 0 HH21 ARG A 346 11.683 -2.461 4.470 1.00 0.00 H new ATOM 0 HH22 ARG A 346 12.777 -1.519 3.452 1.00 0.00 H new ATOM 610 N GLN A 347 6.366 2.655 7.093 1.00 0.00 N ATOM 611 CA GLN A 347 6.929 3.235 8.315 1.00 0.00 C ATOM 612 C GLN A 347 5.895 3.284 9.442 1.00 0.00 C ATOM 613 O GLN A 347 6.240 3.107 10.611 1.00 0.00 O ATOM 614 CB GLN A 347 7.487 4.639 8.048 1.00 0.00 C ATOM 615 CG GLN A 347 6.476 5.618 7.467 1.00 0.00 C ATOM 616 CD GLN A 347 6.515 6.969 8.155 1.00 0.00 C ATOM 617 OE1 GLN A 347 5.485 7.492 8.580 1.00 0.00 O ATOM 618 NE2 GLN A 347 7.710 7.542 8.271 1.00 0.00 N ATOM 0 H GLN A 347 6.407 3.269 6.280 1.00 0.00 H new ATOM 0 HA GLN A 347 7.746 2.588 8.634 1.00 0.00 H new ATOM 0 HB2 GLN A 347 7.874 5.047 8.982 1.00 0.00 H new ATOM 0 HB3 GLN A 347 8.330 4.557 7.362 1.00 0.00 H new ATOM 0 HG2 GLN A 347 6.673 5.750 6.403 1.00 0.00 H new ATOM 0 HG3 GLN A 347 5.475 5.197 7.556 1.00 0.00 H new ATOM 0 HE21 GLN A 347 8.538 7.073 7.904 1.00 0.00 H new ATOM 0 HE22 GLN A 347 7.798 8.450 8.727 1.00 0.00 H new ATOM 627 N PHE A 348 4.628 3.515 9.084 1.00 0.00 N ATOM 628 CA PHE A 348 3.548 3.572 10.069 1.00 0.00 C ATOM 629 C PHE A 348 3.392 2.224 10.772 1.00 0.00 C ATOM 630 O PHE A 348 3.269 2.165 11.997 1.00 0.00 O ATOM 631 CB PHE A 348 2.228 3.969 9.399 1.00 0.00 C ATOM 632 CG PHE A 348 1.186 4.463 10.366 1.00 0.00 C ATOM 633 CD1 PHE A 348 1.241 5.757 10.862 1.00 0.00 C ATOM 634 CD2 PHE A 348 0.154 3.635 10.780 1.00 0.00 C ATOM 635 CE1 PHE A 348 0.287 6.215 11.751 1.00 0.00 C ATOM 636 CE2 PHE A 348 -0.802 4.087 11.669 1.00 0.00 C ATOM 637 CZ PHE A 348 -0.736 5.379 12.156 1.00 0.00 C ATOM 0 H PHE A 348 4.327 3.665 8.121 1.00 0.00 H new ATOM 0 HA PHE A 348 3.805 4.328 10.811 1.00 0.00 H new ATOM 0 HB2 PHE A 348 2.424 4.747 8.661 1.00 0.00 H new ATOM 0 HB3 PHE A 348 1.832 3.109 8.859 1.00 0.00 H new ATOM 0 HD1 PHE A 348 2.039 6.415 10.550 1.00 0.00 H new ATOM 0 HD2 PHE A 348 0.097 2.625 10.403 1.00 0.00 H new ATOM 0 HE1 PHE A 348 0.341 7.225 12.129 1.00 0.00 H new ATOM 0 HE2 PHE A 348 -1.601 3.431 11.983 1.00 0.00 H new ATOM 0 HZ PHE A 348 -1.482 5.734 12.851 1.00 0.00 H new ATOM 647 N ALA A 349 3.405 1.143 9.989 1.00 0.00 N ATOM 648 CA ALA A 349 3.278 -0.207 10.534 1.00 0.00 C ATOM 649 C ALA A 349 4.485 -0.560 11.399 1.00 0.00 C ATOM 650 O ALA A 349 4.337 -1.141 12.475 1.00 0.00 O ATOM 651 CB ALA A 349 3.124 -1.222 9.413 1.00 0.00 C ATOM 0 H ALA A 349 3.502 1.178 8.974 1.00 0.00 H new ATOM 0 HA ALA A 349 2.385 -0.235 11.159 1.00 0.00 H new ATOM 0 HB1 ALA A 349 3.031 -2.222 9.838 1.00 0.00 H new ATOM 0 HB2 ALA A 349 2.231 -0.990 8.832 1.00 0.00 H new ATOM 0 HB3 ALA A 349 3.999 -1.183 8.764 1.00 0.00 H new ATOM 657 N ALA A 350 5.679 -0.202 10.919 1.00 0.00 N ATOM 658 CA ALA A 350 6.919 -0.474 11.645 1.00 0.00 C ATOM 659 C ALA A 350 6.947 0.250 12.990 1.00 0.00 C ATOM 660 O ALA A 350 7.467 -0.278 13.972 1.00 0.00 O ATOM 661 CB ALA A 350 8.125 -0.082 10.803 1.00 0.00 C ATOM 0 H ALA A 350 5.812 0.278 10.029 1.00 0.00 H new ATOM 0 HA ALA A 350 6.963 -1.545 11.843 1.00 0.00 H new ATOM 0 HB1 ALA A 350 9.040 -0.291 11.358 1.00 0.00 H new ATOM 0 HB2 ALA A 350 8.124 -0.656 9.876 1.00 0.00 H new ATOM 0 HB3 ALA A 350 8.076 0.982 10.571 1.00 0.00 H new ATOM 667 N GLN A 351 6.383 1.458 13.033 1.00 0.00 N ATOM 668 CA GLN A 351 6.343 2.237 14.268 1.00 0.00 C ATOM 669 C GLN A 351 5.475 1.550 15.323 1.00 0.00 C ATOM 670 O GLN A 351 5.779 1.606 16.514 1.00 0.00 O ATOM 671 CB GLN A 351 5.814 3.647 14.001 1.00 0.00 C ATOM 672 CG GLN A 351 6.893 4.716 14.064 1.00 0.00 C ATOM 673 CD GLN A 351 6.916 5.455 15.391 1.00 0.00 C ATOM 674 OE1 GLN A 351 6.909 6.685 15.427 1.00 0.00 O ATOM 675 NE2 GLN A 351 6.945 4.711 16.494 1.00 0.00 N ATOM 0 H GLN A 351 5.950 1.915 12.230 1.00 0.00 H new ATOM 0 HA GLN A 351 7.362 2.307 14.648 1.00 0.00 H new ATOM 0 HB2 GLN A 351 5.345 3.671 13.017 1.00 0.00 H new ATOM 0 HB3 GLN A 351 5.038 3.880 14.730 1.00 0.00 H new ATOM 0 HG2 GLN A 351 7.866 4.254 13.894 1.00 0.00 H new ATOM 0 HG3 GLN A 351 6.735 5.432 13.258 1.00 0.00 H new ATOM 0 HE21 GLN A 351 6.950 3.693 16.423 1.00 0.00 H new ATOM 0 HE22 GLN A 351 6.962 5.158 17.411 1.00 0.00 H new ATOM 684 N THR A 352 4.393 0.907 14.879 1.00 0.00 N ATOM 685 CA THR A 352 3.486 0.217 15.791 1.00 0.00 C ATOM 686 C THR A 352 3.994 -1.190 16.117 1.00 0.00 C ATOM 687 O THR A 352 4.226 -1.514 17.282 1.00 0.00 O ATOM 688 CB THR A 352 2.073 0.151 15.198 1.00 0.00 C ATOM 689 OG1 THR A 352 1.671 1.421 14.707 1.00 0.00 O ATOM 690 CG2 THR A 352 1.029 -0.305 16.195 1.00 0.00 C ATOM 0 H THR A 352 4.126 0.851 13.896 1.00 0.00 H new ATOM 0 HA THR A 352 3.449 0.786 16.720 1.00 0.00 H new ATOM 0 HB THR A 352 2.132 -0.582 14.393 1.00 0.00 H new ATOM 0 HG1 THR A 352 2.168 1.627 13.888 1.00 0.00 H new ATOM 0 HG21 THR A 352 0.052 -0.330 15.713 1.00 0.00 H new ATOM 0 HG22 THR A 352 1.281 -1.302 16.556 1.00 0.00 H new ATOM 0 HG23 THR A 352 1.001 0.389 17.035 1.00 0.00 H new ATOM 698 N VAL A 353 4.167 -2.020 15.085 1.00 0.00 N ATOM 699 CA VAL A 353 4.651 -3.391 15.271 1.00 0.00 C ATOM 700 C VAL A 353 6.092 -3.544 14.780 1.00 0.00 C ATOM 701 O VAL A 353 6.379 -4.343 13.885 1.00 0.00 O ATOM 702 CB VAL A 353 3.744 -4.416 14.553 1.00 0.00 C ATOM 703 CG1 VAL A 353 2.395 -4.508 15.250 1.00 0.00 C ATOM 704 CG2 VAL A 353 3.569 -4.060 13.080 1.00 0.00 C ATOM 0 H VAL A 353 3.980 -1.768 14.115 1.00 0.00 H new ATOM 0 HA VAL A 353 4.622 -3.593 16.342 1.00 0.00 H new ATOM 0 HB VAL A 353 4.228 -5.391 14.603 1.00 0.00 H new ATOM 0 HG11 VAL A 353 1.767 -5.234 14.733 1.00 0.00 H new ATOM 0 HG12 VAL A 353 2.540 -4.824 16.283 1.00 0.00 H new ATOM 0 HG13 VAL A 353 1.910 -3.532 15.234 1.00 0.00 H new ATOM 0 HG21 VAL A 353 2.926 -4.799 12.601 1.00 0.00 H new ATOM 0 HG22 VAL A 353 3.113 -3.073 12.996 1.00 0.00 H new ATOM 0 HG23 VAL A 353 4.542 -4.053 12.589 1.00 0.00 H new ATOM 714 N GLY A 354 7.000 -2.770 15.377 1.00 0.00 N ATOM 715 CA GLY A 354 8.401 -2.828 14.993 1.00 0.00 C ATOM 716 C GLY A 354 9.230 -3.739 15.883 1.00 0.00 C ATOM 717 O GLY A 354 10.419 -3.495 16.089 1.00 0.00 O ATOM 0 H GLY A 354 6.788 -2.104 16.120 1.00 0.00 H new ATOM 0 HA2 GLY A 354 8.474 -3.174 13.962 1.00 0.00 H new ATOM 0 HA3 GLY A 354 8.821 -1.822 15.022 1.00 0.00 H new ATOM 721 N ASN A 355 8.604 -4.793 16.408 1.00 0.00 N ATOM 722 CA ASN A 355 9.293 -5.747 17.275 1.00 0.00 C ATOM 723 C ASN A 355 8.586 -7.105 17.256 1.00 0.00 C ATOM 724 O ASN A 355 8.448 -7.761 18.290 1.00 0.00 O ATOM 725 CB ASN A 355 9.368 -5.203 18.708 1.00 0.00 C ATOM 726 CG ASN A 355 10.668 -5.574 19.396 1.00 0.00 C ATOM 727 OD1 ASN A 355 11.538 -4.728 19.601 1.00 0.00 O ATOM 728 ND2 ASN A 355 10.809 -6.846 19.752 1.00 0.00 N ATOM 0 H ASN A 355 7.620 -5.007 16.247 1.00 0.00 H new ATOM 0 HA ASN A 355 10.307 -5.885 16.899 1.00 0.00 H new ATOM 0 HB2 ASN A 355 9.266 -4.118 18.688 1.00 0.00 H new ATOM 0 HB3 ASN A 355 8.530 -5.591 19.286 1.00 0.00 H new ATOM 0 HD21 ASN A 355 11.664 -7.154 20.215 1.00 0.00 H new ATOM 0 HD22 ASN A 355 10.062 -7.514 19.563 1.00 0.00 H new ATOM 735 N THR A 356 8.138 -7.517 16.069 1.00 0.00 N ATOM 736 CA THR A 356 7.441 -8.791 15.912 1.00 0.00 C ATOM 737 C THR A 356 7.753 -9.426 14.555 1.00 0.00 C ATOM 738 O THR A 356 8.191 -10.574 14.487 1.00 0.00 O ATOM 739 CB THR A 356 5.926 -8.595 16.056 1.00 0.00 C ATOM 740 OG1 THR A 356 5.627 -7.625 17.048 1.00 0.00 O ATOM 741 CG2 THR A 356 5.195 -9.867 16.427 1.00 0.00 C ATOM 0 H THR A 356 8.246 -6.987 15.204 1.00 0.00 H new ATOM 0 HA THR A 356 7.792 -9.461 16.697 1.00 0.00 H new ATOM 0 HB THR A 356 5.587 -8.266 15.074 1.00 0.00 H new ATOM 0 HG1 THR A 356 4.655 -7.518 17.119 1.00 0.00 H new ATOM 0 HG21 THR A 356 4.128 -9.661 16.514 1.00 0.00 H new ATOM 0 HG22 THR A 356 5.358 -10.619 15.655 1.00 0.00 H new ATOM 0 HG23 THR A 356 5.571 -10.238 17.380 1.00 0.00 H new ATOM 749 N TYR A 357 7.518 -8.670 13.482 1.00 0.00 N ATOM 750 CA TYR A 357 7.766 -9.159 12.126 1.00 0.00 C ATOM 751 C TYR A 357 9.202 -8.877 11.690 1.00 0.00 C ATOM 752 O TYR A 357 9.873 -9.755 11.143 1.00 0.00 O ATOM 753 CB TYR A 357 6.783 -8.517 11.141 1.00 0.00 C ATOM 754 CG TYR A 357 5.331 -8.657 11.550 1.00 0.00 C ATOM 755 CD1 TYR A 357 4.819 -9.882 11.968 1.00 0.00 C ATOM 756 CD2 TYR A 357 4.471 -7.566 11.516 1.00 0.00 C ATOM 757 CE1 TYR A 357 3.496 -10.012 12.341 1.00 0.00 C ATOM 758 CE2 TYR A 357 3.147 -7.690 11.889 1.00 0.00 C ATOM 759 CZ TYR A 357 2.664 -8.914 12.300 1.00 0.00 C ATOM 760 OH TYR A 357 1.344 -9.045 12.669 1.00 0.00 O ATOM 0 H TYR A 357 7.156 -7.717 13.526 1.00 0.00 H new ATOM 0 HA TYR A 357 7.617 -10.239 12.127 1.00 0.00 H new ATOM 0 HB2 TYR A 357 7.022 -7.458 11.041 1.00 0.00 H new ATOM 0 HB3 TYR A 357 6.920 -8.969 10.159 1.00 0.00 H new ATOM 0 HD1 TYR A 357 5.467 -10.745 12.001 1.00 0.00 H new ATOM 0 HD2 TYR A 357 4.844 -6.605 11.193 1.00 0.00 H new ATOM 0 HE1 TYR A 357 3.115 -10.970 12.663 1.00 0.00 H new ATOM 0 HE2 TYR A 357 2.493 -6.831 11.859 1.00 0.00 H new ATOM 0 HH TYR A 357 1.114 -8.345 13.315 1.00 0.00 H new ATOM 770 N GLY A 358 9.668 -7.650 11.933 1.00 0.00 N ATOM 771 CA GLY A 358 11.022 -7.280 11.556 1.00 0.00 C ATOM 772 C GLY A 358 11.150 -6.974 10.077 1.00 0.00 C ATOM 773 O GLY A 358 10.651 -5.951 9.605 1.00 0.00 O ATOM 0 H GLY A 358 9.131 -6.909 12.383 1.00 0.00 H new ATOM 0 HA2 GLY A 358 11.331 -6.408 12.132 1.00 0.00 H new ATOM 0 HA3 GLY A 358 11.702 -8.091 11.816 1.00 0.00 H new ATOM 777 N ASN A 359 11.818 -7.866 9.344 1.00 0.00 N ATOM 778 CA ASN A 359 12.012 -7.690 7.908 1.00 0.00 C ATOM 779 C ASN A 359 10.882 -8.352 7.121 1.00 0.00 C ATOM 780 O ASN A 359 11.062 -9.414 6.522 1.00 0.00 O ATOM 781 CB ASN A 359 13.366 -8.262 7.474 1.00 0.00 C ATOM 782 CG ASN A 359 13.970 -7.496 6.311 1.00 0.00 C ATOM 783 OD1 ASN A 359 14.920 -6.734 6.484 1.00 0.00 O ATOM 784 ND2 ASN A 359 13.417 -7.692 5.119 1.00 0.00 N ATOM 0 H ASN A 359 12.233 -8.717 9.723 1.00 0.00 H new ATOM 0 HA ASN A 359 11.999 -6.621 7.694 1.00 0.00 H new ATOM 0 HB2 ASN A 359 14.055 -8.239 8.318 1.00 0.00 H new ATOM 0 HB3 ASN A 359 13.242 -9.308 7.192 1.00 0.00 H new ATOM 0 HD21 ASN A 359 13.779 -7.201 4.302 1.00 0.00 H new ATOM 0 HD22 ASN A 359 12.630 -8.334 5.021 1.00 0.00 H new ATOM 791 N PHE A 360 9.715 -7.712 7.126 1.00 0.00 N ATOM 792 CA PHE A 360 8.552 -8.229 6.415 1.00 0.00 C ATOM 793 C PHE A 360 8.479 -7.669 5.001 1.00 0.00 C ATOM 794 O PHE A 360 9.052 -6.619 4.704 1.00 0.00 O ATOM 795 CB PHE A 360 7.261 -7.891 7.171 1.00 0.00 C ATOM 796 CG PHE A 360 7.134 -6.437 7.550 1.00 0.00 C ATOM 797 CD1 PHE A 360 6.641 -5.511 6.645 1.00 0.00 C ATOM 798 CD2 PHE A 360 7.515 -5.997 8.810 1.00 0.00 C ATOM 799 CE1 PHE A 360 6.529 -4.176 6.987 1.00 0.00 C ATOM 800 CE2 PHE A 360 7.407 -4.663 9.156 1.00 0.00 C ATOM 801 CZ PHE A 360 6.913 -3.753 8.244 1.00 0.00 C ATOM 0 H PHE A 360 9.551 -6.833 7.616 1.00 0.00 H new ATOM 0 HA PHE A 360 8.658 -9.312 6.355 1.00 0.00 H new ATOM 0 HB2 PHE A 360 6.407 -8.171 6.554 1.00 0.00 H new ATOM 0 HB3 PHE A 360 7.213 -8.497 8.076 1.00 0.00 H new ATOM 0 HD1 PHE A 360 6.340 -5.836 5.660 1.00 0.00 H new ATOM 0 HD2 PHE A 360 7.900 -6.705 9.529 1.00 0.00 H new ATOM 0 HE1 PHE A 360 6.142 -3.465 6.272 1.00 0.00 H new ATOM 0 HE2 PHE A 360 7.709 -4.333 10.139 1.00 0.00 H new ATOM 0 HZ PHE A 360 6.827 -2.711 8.513 1.00 0.00 H new ATOM 811 N SER A 361 7.761 -8.376 4.137 1.00 0.00 N ATOM 812 CA SER A 361 7.592 -7.959 2.756 1.00 0.00 C ATOM 813 C SER A 361 6.195 -7.379 2.549 1.00 0.00 C ATOM 814 O SER A 361 5.228 -7.850 3.148 1.00 0.00 O ATOM 815 CB SER A 361 7.838 -9.150 1.815 1.00 0.00 C ATOM 816 OG SER A 361 6.771 -9.335 0.895 1.00 0.00 O ATOM 0 H SER A 361 7.285 -9.246 4.373 1.00 0.00 H new ATOM 0 HA SER A 361 8.320 -7.182 2.524 1.00 0.00 H new ATOM 0 HB2 SER A 361 8.766 -8.992 1.266 1.00 0.00 H new ATOM 0 HB3 SER A 361 7.968 -10.057 2.406 1.00 0.00 H new ATOM 0 HG SER A 361 7.020 -8.959 0.025 1.00 0.00 H new ATOM 822 N LEU A 362 6.098 -6.356 1.700 1.00 0.00 N ATOM 823 CA LEU A 362 4.817 -5.712 1.415 1.00 0.00 C ATOM 824 C LEU A 362 4.481 -5.817 -0.070 1.00 0.00 C ATOM 825 O LEU A 362 5.284 -5.439 -0.923 1.00 0.00 O ATOM 826 CB LEU A 362 4.847 -4.240 1.839 1.00 0.00 C ATOM 827 CG LEU A 362 5.348 -3.978 3.262 1.00 0.00 C ATOM 828 CD1 LEU A 362 6.203 -2.719 3.306 1.00 0.00 C ATOM 829 CD2 LEU A 362 4.177 -3.865 4.225 1.00 0.00 C ATOM 0 H LEU A 362 6.891 -5.956 1.198 1.00 0.00 H new ATOM 0 HA LEU A 362 4.046 -6.227 1.987 1.00 0.00 H new ATOM 0 HB2 LEU A 362 5.480 -3.691 1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 362 3.841 -3.831 1.745 1.00 0.00 H new ATOM 0 HG LEU A 362 5.967 -4.821 3.570 1.00 0.00 H new ATOM 0 HD11 LEU A 362 6.549 -2.550 4.326 1.00 0.00 H new ATOM 0 HD12 LEU A 362 7.062 -2.839 2.646 1.00 0.00 H new ATOM 0 HD13 LEU A 362 5.610 -1.865 2.978 1.00 0.00 H new ATOM 0 HD21 LEU A 362 4.551 -3.679 5.232 1.00 0.00 H new ATOM 0 HD22 LEU A 362 3.532 -3.041 3.919 1.00 0.00 H new ATOM 0 HD23 LEU A 362 3.607 -4.794 4.216 1.00 0.00 H new ATOM 841 N ALA A 363 3.291 -6.332 -0.370 1.00 0.00 N ATOM 842 CA ALA A 363 2.843 -6.490 -1.752 1.00 0.00 C ATOM 843 C ALA A 363 1.318 -6.520 -1.832 1.00 0.00 C ATOM 844 O ALA A 363 0.641 -6.676 -0.818 1.00 0.00 O ATOM 845 CB ALA A 363 3.431 -7.758 -2.359 1.00 0.00 C ATOM 0 H ALA A 363 2.617 -6.648 0.328 1.00 0.00 H new ATOM 0 HA ALA A 363 3.196 -5.632 -2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 363 3.088 -7.862 -3.388 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.519 -7.698 -2.343 1.00 0.00 H new ATOM 0 HB3 ALA A 363 3.107 -8.623 -1.780 1.00 0.00 H new ATOM 851 N THR A 364 0.781 -6.371 -3.041 1.00 0.00 N ATOM 852 CA THR A 364 -0.668 -6.388 -3.239 1.00 0.00 C ATOM 853 C THR A 364 -1.179 -7.819 -3.420 1.00 0.00 C ATOM 854 O THR A 364 -0.388 -8.755 -3.564 1.00 0.00 O ATOM 855 CB THR A 364 -1.055 -5.524 -4.446 1.00 0.00 C ATOM 856 OG1 THR A 364 -2.464 -5.411 -4.557 1.00 0.00 O ATOM 857 CG2 THR A 364 -0.533 -6.055 -5.767 1.00 0.00 C ATOM 0 H THR A 364 1.323 -6.238 -3.895 1.00 0.00 H new ATOM 0 HA THR A 364 -1.136 -5.971 -2.348 1.00 0.00 H new ATOM 0 HB THR A 364 -0.593 -4.555 -4.257 1.00 0.00 H new ATOM 0 HG1 THR A 364 -2.687 -4.855 -5.332 1.00 0.00 H new ATOM 0 HG21 THR A 364 -0.846 -5.393 -6.574 1.00 0.00 H new ATOM 0 HG22 THR A 364 0.556 -6.101 -5.736 1.00 0.00 H new ATOM 0 HG23 THR A 364 -0.933 -7.054 -5.941 1.00 0.00 H new ATOM 865 N MET A 365 -2.502 -7.983 -3.407 1.00 0.00 N ATOM 866 CA MET A 365 -3.116 -9.300 -3.568 1.00 0.00 C ATOM 867 C MET A 365 -2.869 -9.851 -4.973 1.00 0.00 C ATOM 868 O MET A 365 -2.104 -10.802 -5.146 1.00 0.00 O ATOM 869 CB MET A 365 -4.620 -9.231 -3.277 1.00 0.00 C ATOM 870 CG MET A 365 -5.106 -10.335 -2.353 1.00 0.00 C ATOM 871 SD MET A 365 -6.838 -10.756 -2.625 1.00 0.00 S ATOM 872 CE MET A 365 -7.653 -9.327 -1.916 1.00 0.00 C ATOM 0 H MET A 365 -3.168 -7.220 -3.287 1.00 0.00 H new ATOM 0 HA MET A 365 -2.653 -9.978 -2.851 1.00 0.00 H new ATOM 0 HB2 MET A 365 -4.852 -8.264 -2.830 1.00 0.00 H new ATOM 0 HB3 MET A 365 -5.168 -9.287 -4.218 1.00 0.00 H new ATOM 0 HG2 MET A 365 -4.493 -11.224 -2.501 1.00 0.00 H new ATOM 0 HG3 MET A 365 -4.970 -10.023 -1.318 1.00 0.00 H new ATOM 0 HE1 MET A 365 -8.733 -9.441 -2.009 1.00 0.00 H new ATOM 0 HE2 MET A 365 -7.387 -9.242 -0.863 1.00 0.00 H new ATOM 0 HE3 MET A 365 -7.336 -8.428 -2.444 1.00 0.00 H new ATOM 882 N PHE A 366 -3.520 -9.251 -5.973 1.00 0.00 N ATOM 883 CA PHE A 366 -3.375 -9.681 -7.360 1.00 0.00 C ATOM 884 C PHE A 366 -3.426 -8.481 -8.305 1.00 0.00 C ATOM 885 O PHE A 366 -4.314 -7.632 -8.190 1.00 0.00 O ATOM 886 CB PHE A 366 -4.481 -10.674 -7.722 1.00 0.00 C ATOM 887 CG PHE A 366 -4.370 -11.993 -7.010 1.00 0.00 C ATOM 888 CD1 PHE A 366 -3.326 -12.861 -7.288 1.00 0.00 C ATOM 889 CD2 PHE A 366 -5.309 -12.363 -6.060 1.00 0.00 C ATOM 890 CE1 PHE A 366 -3.220 -14.072 -6.633 1.00 0.00 C ATOM 891 CE2 PHE A 366 -5.210 -13.574 -5.402 1.00 0.00 C ATOM 892 CZ PHE A 366 -4.164 -14.430 -5.688 1.00 0.00 C ATOM 0 H PHE A 366 -4.155 -8.463 -5.844 1.00 0.00 H new ATOM 0 HA PHE A 366 -2.406 -10.169 -7.468 1.00 0.00 H new ATOM 0 HB2 PHE A 366 -5.448 -10.227 -7.490 1.00 0.00 H new ATOM 0 HB3 PHE A 366 -4.461 -10.850 -8.798 1.00 0.00 H new ATOM 0 HD1 PHE A 366 -2.586 -12.587 -8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 366 -6.128 -11.697 -5.831 1.00 0.00 H new ATOM 0 HE1 PHE A 366 -2.401 -14.739 -6.858 1.00 0.00 H new ATOM 0 HE2 PHE A 366 -5.949 -13.851 -4.665 1.00 0.00 H new ATOM 0 HZ PHE A 366 -4.084 -15.377 -5.175 1.00 0.00 H new ATOM 902 N PRO A 367 -2.474 -8.390 -9.257 1.00 0.00 N ATOM 903 CA PRO A 367 -1.401 -9.380 -9.424 1.00 0.00 C ATOM 904 C PRO A 367 -0.312 -9.244 -8.359 1.00 0.00 C ATOM 905 O PRO A 367 -0.421 -8.420 -7.452 1.00 0.00 O ATOM 906 CB PRO A 367 -0.846 -9.055 -10.812 1.00 0.00 C ATOM 907 CG PRO A 367 -1.086 -7.595 -10.975 1.00 0.00 C ATOM 908 CD PRO A 367 -2.373 -7.300 -10.251 1.00 0.00 C ATOM 0 HA PRO A 367 -1.763 -10.403 -9.322 1.00 0.00 H new ATOM 0 HB2 PRO A 367 0.215 -9.293 -10.881 1.00 0.00 H new ATOM 0 HB3 PRO A 367 -1.353 -9.630 -11.587 1.00 0.00 H new ATOM 0 HG2 PRO A 367 -0.262 -7.016 -10.558 1.00 0.00 H new ATOM 0 HG3 PRO A 367 -1.162 -7.328 -12.029 1.00 0.00 H new ATOM 0 HD2 PRO A 367 -2.347 -6.322 -9.771 1.00 0.00 H new ATOM 0 HD3 PRO A 367 -3.224 -7.299 -10.932 1.00 0.00 H new ATOM 916 N ARG A 368 0.740 -10.052 -8.475 1.00 0.00 N ATOM 917 CA ARG A 368 1.840 -10.008 -7.519 1.00 0.00 C ATOM 918 C ARG A 368 2.951 -9.080 -8.013 1.00 0.00 C ATOM 919 O ARG A 368 4.021 -9.533 -8.423 1.00 0.00 O ATOM 920 CB ARG A 368 2.392 -11.415 -7.262 1.00 0.00 C ATOM 921 CG ARG A 368 1.882 -12.040 -5.972 1.00 0.00 C ATOM 922 CD ARG A 368 2.194 -11.169 -4.762 1.00 0.00 C ATOM 923 NE ARG A 368 2.331 -11.959 -3.541 1.00 0.00 N ATOM 924 CZ ARG A 368 3.442 -12.619 -3.196 1.00 0.00 C ATOM 925 NH1 ARG A 368 4.514 -12.598 -3.987 1.00 0.00 N ATOM 926 NH2 ARG A 368 3.478 -13.306 -2.059 1.00 0.00 N ATOM 0 H ARG A 368 0.852 -10.741 -9.218 1.00 0.00 H new ATOM 0 HA ARG A 368 1.455 -9.613 -6.579 1.00 0.00 H new ATOM 0 HB2 ARG A 368 2.125 -12.060 -8.099 1.00 0.00 H new ATOM 0 HB3 ARG A 368 3.481 -11.369 -7.229 1.00 0.00 H new ATOM 0 HG2 ARG A 368 0.805 -12.193 -6.043 1.00 0.00 H new ATOM 0 HG3 ARG A 368 2.335 -13.022 -5.840 1.00 0.00 H new ATOM 0 HD2 ARG A 368 3.116 -10.616 -4.941 1.00 0.00 H new ATOM 0 HD3 ARG A 368 1.401 -10.433 -4.631 1.00 0.00 H new ATOM 0 HE ARG A 368 1.529 -12.011 -2.912 1.00 0.00 H new ATOM 0 HH11 ARG A 368 4.491 -12.076 -4.863 1.00 0.00 H new ATOM 0 HH12 ARG A 368 5.357 -13.104 -3.717 1.00 0.00 H new ATOM 0 HH21 ARG A 368 2.659 -13.329 -1.451 1.00 0.00 H new ATOM 0 HH22 ARG A 368 4.324 -13.810 -1.794 1.00 0.00 H new ATOM 940 N ARG A 369 2.687 -7.774 -7.965 1.00 0.00 N ATOM 941 CA ARG A 369 3.663 -6.777 -8.402 1.00 0.00 C ATOM 942 C ARG A 369 4.890 -6.759 -7.484 1.00 0.00 C ATOM 943 O ARG A 369 5.975 -6.353 -7.905 1.00 0.00 O ATOM 944 CB ARG A 369 3.027 -5.384 -8.457 1.00 0.00 C ATOM 945 CG ARG A 369 2.638 -4.825 -7.097 1.00 0.00 C ATOM 946 CD ARG A 369 2.333 -3.340 -7.177 1.00 0.00 C ATOM 947 NE ARG A 369 0.909 -3.059 -6.995 1.00 0.00 N ATOM 948 CZ ARG A 369 0.336 -2.822 -5.810 1.00 0.00 C ATOM 949 NH1 ARG A 369 1.057 -2.849 -4.689 1.00 0.00 N ATOM 950 NH2 ARG A 369 -0.966 -2.558 -5.747 1.00 0.00 N ATOM 0 H ARG A 369 1.807 -7.383 -7.628 1.00 0.00 H new ATOM 0 HA ARG A 369 3.991 -7.055 -9.404 1.00 0.00 H new ATOM 0 HB2 ARG A 369 3.725 -4.696 -8.934 1.00 0.00 H new ATOM 0 HB3 ARG A 369 2.139 -5.426 -9.088 1.00 0.00 H new ATOM 0 HG2 ARG A 369 1.765 -5.358 -6.719 1.00 0.00 H new ATOM 0 HG3 ARG A 369 3.447 -4.994 -6.387 1.00 0.00 H new ATOM 0 HD2 ARG A 369 2.906 -2.811 -6.416 1.00 0.00 H new ATOM 0 HD3 ARG A 369 2.657 -2.956 -8.144 1.00 0.00 H new ATOM 0 HE ARG A 369 0.315 -3.043 -7.824 1.00 0.00 H new ATOM 0 HH11 ARG A 369 2.056 -3.052 -4.730 1.00 0.00 H new ATOM 0 HH12 ARG A 369 0.610 -2.667 -3.791 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -1.524 -2.537 -6.601 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -1.407 -2.377 -4.845 1.00 0.00 H new ATOM 964 N GLU A 370 4.709 -7.202 -6.232 1.00 0.00 N ATOM 965 CA GLU A 370 5.796 -7.243 -5.255 1.00 0.00 C ATOM 966 C GLU A 370 6.262 -5.835 -4.880 1.00 0.00 C ATOM 967 O GLU A 370 5.615 -4.842 -5.223 1.00 0.00 O ATOM 968 CB GLU A 370 6.970 -8.065 -5.802 1.00 0.00 C ATOM 969 CG GLU A 370 7.391 -9.211 -4.894 1.00 0.00 C ATOM 970 CD GLU A 370 7.530 -10.523 -5.643 1.00 0.00 C ATOM 971 OE1 GLU A 370 8.518 -10.677 -6.391 1.00 0.00 O ATOM 972 OE2 GLU A 370 6.650 -11.393 -5.482 1.00 0.00 O ATOM 0 H GLU A 370 3.814 -7.537 -5.875 1.00 0.00 H new ATOM 0 HA GLU A 370 5.418 -7.721 -4.351 1.00 0.00 H new ATOM 0 HB2 GLU A 370 6.697 -8.468 -6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 370 7.823 -7.404 -5.958 1.00 0.00 H new ATOM 0 HG2 GLU A 370 8.341 -8.965 -4.420 1.00 0.00 H new ATOM 0 HG3 GLU A 370 6.657 -9.327 -4.097 1.00 0.00 H new ATOM 979 N PHE A 371 7.383 -5.762 -4.163 1.00 0.00 N ATOM 980 CA PHE A 371 7.942 -4.485 -3.728 1.00 0.00 C ATOM 981 C PHE A 371 9.312 -4.241 -4.354 1.00 0.00 C ATOM 982 O PHE A 371 9.899 -5.138 -4.965 1.00 0.00 O ATOM 983 CB PHE A 371 8.053 -4.448 -2.200 1.00 0.00 C ATOM 984 CG PHE A 371 8.950 -5.515 -1.633 1.00 0.00 C ATOM 985 CD1 PHE A 371 8.460 -6.787 -1.376 1.00 0.00 C ATOM 986 CD2 PHE A 371 10.281 -5.247 -1.359 1.00 0.00 C ATOM 987 CE1 PHE A 371 9.283 -7.768 -0.858 1.00 0.00 C ATOM 988 CE2 PHE A 371 11.108 -6.225 -0.841 1.00 0.00 C ATOM 989 CZ PHE A 371 10.608 -7.488 -0.589 1.00 0.00 C ATOM 0 H PHE A 371 7.923 -6.577 -3.871 1.00 0.00 H new ATOM 0 HA PHE A 371 7.269 -3.694 -4.059 1.00 0.00 H new ATOM 0 HB2 PHE A 371 8.428 -3.471 -1.895 1.00 0.00 H new ATOM 0 HB3 PHE A 371 7.057 -4.556 -1.769 1.00 0.00 H new ATOM 0 HD1 PHE A 371 7.424 -7.013 -1.583 1.00 0.00 H new ATOM 0 HD2 PHE A 371 10.677 -4.261 -1.553 1.00 0.00 H new ATOM 0 HE1 PHE A 371 8.890 -8.755 -0.663 1.00 0.00 H new ATOM 0 HE2 PHE A 371 12.144 -6.002 -0.633 1.00 0.00 H new ATOM 0 HZ PHE A 371 11.252 -8.254 -0.183 1.00 0.00 H new ATOM 999 N THR A 372 9.815 -3.021 -4.192 1.00 0.00 N ATOM 1000 CA THR A 372 11.119 -2.645 -4.735 1.00 0.00 C ATOM 1001 C THR A 372 11.728 -1.494 -3.932 1.00 0.00 C ATOM 1002 O THR A 372 11.162 -1.062 -2.928 1.00 0.00 O ATOM 1003 CB THR A 372 10.995 -2.254 -6.219 1.00 0.00 C ATOM 1004 OG1 THR A 372 9.801 -2.765 -6.797 1.00 0.00 O ATOM 1005 CG2 THR A 372 12.151 -2.747 -7.061 1.00 0.00 C ATOM 0 H THR A 372 9.339 -2.273 -3.688 1.00 0.00 H new ATOM 0 HA THR A 372 11.781 -3.508 -4.657 1.00 0.00 H new ATOM 0 HB THR A 372 10.989 -1.164 -6.220 1.00 0.00 H new ATOM 0 HG1 THR A 372 9.753 -2.497 -7.739 1.00 0.00 H new ATOM 0 HG21 THR A 372 12.004 -2.439 -8.096 1.00 0.00 H new ATOM 0 HG22 THR A 372 13.082 -2.323 -6.685 1.00 0.00 H new ATOM 0 HG23 THR A 372 12.201 -3.835 -7.009 1.00 0.00 H new ATOM 1013 N LYS A 373 12.881 -0.996 -4.379 1.00 0.00 N ATOM 1014 CA LYS A 373 13.561 0.106 -3.704 1.00 0.00 C ATOM 1015 C LYS A 373 12.893 1.441 -4.033 1.00 0.00 C ATOM 1016 O LYS A 373 12.806 2.327 -3.181 1.00 0.00 O ATOM 1017 CB LYS A 373 15.037 0.146 -4.109 1.00 0.00 C ATOM 1018 CG LYS A 373 15.892 1.052 -3.233 1.00 0.00 C ATOM 1019 CD LYS A 373 17.210 1.409 -3.908 1.00 0.00 C ATOM 1020 CE LYS A 373 18.171 0.229 -3.926 1.00 0.00 C ATOM 1021 NZ LYS A 373 19.041 0.197 -2.716 1.00 0.00 N ATOM 0 H LYS A 373 13.364 -1.341 -5.209 1.00 0.00 H new ATOM 0 HA LYS A 373 13.491 -0.059 -2.629 1.00 0.00 H new ATOM 0 HB2 LYS A 373 15.441 -0.866 -4.072 1.00 0.00 H new ATOM 0 HB3 LYS A 373 15.111 0.482 -5.143 1.00 0.00 H new ATOM 0 HG2 LYS A 373 15.341 1.964 -3.006 1.00 0.00 H new ATOM 0 HG3 LYS A 373 16.092 0.556 -2.283 1.00 0.00 H new ATOM 0 HD2 LYS A 373 17.018 1.738 -4.929 1.00 0.00 H new ATOM 0 HD3 LYS A 373 17.672 2.246 -3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 373 17.603 -0.699 -3.989 1.00 0.00 H new ATOM 0 HE3 LYS A 373 18.794 0.283 -4.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 373 19.680 -0.622 -2.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 373 19.602 1.071 -2.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 373 18.449 0.119 -1.865 1.00 0.00 H new ATOM 1035 N GLU A 374 12.422 1.573 -5.274 1.00 0.00 N ATOM 1036 CA GLU A 374 11.758 2.795 -5.721 1.00 0.00 C ATOM 1037 C GLU A 374 10.270 2.784 -5.370 1.00 0.00 C ATOM 1038 O GLU A 374 9.637 3.838 -5.315 1.00 0.00 O ATOM 1039 CB GLU A 374 11.928 2.971 -7.230 1.00 0.00 C ATOM 1040 CG GLU A 374 12.987 3.994 -7.608 1.00 0.00 C ATOM 1041 CD GLU A 374 12.586 4.846 -8.799 1.00 0.00 C ATOM 1042 OE1 GLU A 374 12.226 4.270 -9.848 1.00 0.00 O ATOM 1043 OE2 GLU A 374 12.636 6.088 -8.684 1.00 0.00 O ATOM 0 H GLU A 374 12.489 0.847 -5.987 1.00 0.00 H new ATOM 0 HA GLU A 374 12.226 3.632 -5.202 1.00 0.00 H new ATOM 0 HB2 GLU A 374 12.189 2.010 -7.672 1.00 0.00 H new ATOM 0 HB3 GLU A 374 10.974 3.272 -7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 374 13.181 4.642 -6.753 1.00 0.00 H new ATOM 0 HG3 GLU A 374 13.920 3.477 -7.835 1.00 0.00 H new ATOM 1050 N ASP A 375 9.714 1.590 -5.141 1.00 0.00 N ATOM 1051 CA ASP A 375 8.298 1.444 -4.805 1.00 0.00 C ATOM 1052 C ASP A 375 7.928 2.218 -3.538 1.00 0.00 C ATOM 1053 O ASP A 375 6.791 2.660 -3.393 1.00 0.00 O ATOM 1054 CB ASP A 375 7.945 -0.035 -4.623 1.00 0.00 C ATOM 1055 CG ASP A 375 7.544 -0.717 -5.920 1.00 0.00 C ATOM 1056 OD1 ASP A 375 7.976 -0.261 -7.001 1.00 0.00 O ATOM 1057 OD2 ASP A 375 6.795 -1.715 -5.853 1.00 0.00 O ATOM 0 H ASP A 375 10.227 0.709 -5.183 1.00 0.00 H new ATOM 0 HA ASP A 375 7.725 1.860 -5.634 1.00 0.00 H new ATOM 0 HB2 ASP A 375 8.801 -0.557 -4.195 1.00 0.00 H new ATOM 0 HB3 ASP A 375 7.128 -0.122 -3.906 1.00 0.00 H new ATOM 1062 N TYR A 376 8.885 2.377 -2.623 1.00 0.00 N ATOM 1063 CA TYR A 376 8.636 3.098 -1.376 1.00 0.00 C ATOM 1064 C TYR A 376 8.734 4.607 -1.591 1.00 0.00 C ATOM 1065 O TYR A 376 7.821 5.353 -1.234 1.00 0.00 O ATOM 1066 CB TYR A 376 9.624 2.657 -0.297 1.00 0.00 C ATOM 1067 CG TYR A 376 9.422 1.227 0.151 1.00 0.00 C ATOM 1068 CD1 TYR A 376 9.984 0.175 -0.560 1.00 0.00 C ATOM 1069 CD2 TYR A 376 8.662 0.925 1.276 1.00 0.00 C ATOM 1070 CE1 TYR A 376 9.802 -1.136 -0.164 1.00 0.00 C ATOM 1071 CE2 TYR A 376 8.477 -0.384 1.678 1.00 0.00 C ATOM 1072 CZ TYR A 376 9.046 -1.409 0.954 1.00 0.00 C ATOM 1073 OH TYR A 376 8.862 -2.714 1.353 1.00 0.00 O ATOM 0 H TYR A 376 9.835 2.018 -2.722 1.00 0.00 H new ATOM 0 HA TYR A 376 7.625 2.861 -1.046 1.00 0.00 H new ATOM 0 HB2 TYR A 376 10.640 2.772 -0.676 1.00 0.00 H new ATOM 0 HB3 TYR A 376 9.529 3.317 0.565 1.00 0.00 H new ATOM 0 HD1 TYR A 376 10.575 0.386 -1.439 1.00 0.00 H new ATOM 0 HD2 TYR A 376 8.210 1.725 1.843 1.00 0.00 H new ATOM 0 HE1 TYR A 376 10.250 -1.941 -0.728 1.00 0.00 H new ATOM 0 HE2 TYR A 376 7.888 -0.603 2.557 1.00 0.00 H new ATOM 0 HH TYR A 376 9.219 -2.833 2.258 1.00 0.00 H new ATOM 1083 N LYS A 377 9.849 5.042 -2.176 1.00 0.00 N ATOM 1084 CA LYS A 377 10.085 6.465 -2.446 1.00 0.00 C ATOM 1085 C LYS A 377 9.006 7.071 -3.358 1.00 0.00 C ATOM 1086 O LYS A 377 8.779 8.281 -3.326 1.00 0.00 O ATOM 1087 CB LYS A 377 11.474 6.680 -3.067 1.00 0.00 C ATOM 1088 CG LYS A 377 11.787 5.762 -4.245 1.00 0.00 C ATOM 1089 CD LYS A 377 11.361 6.384 -5.567 1.00 0.00 C ATOM 1090 CE LYS A 377 12.320 7.482 -6.003 1.00 0.00 C ATOM 1091 NZ LYS A 377 11.682 8.446 -6.944 1.00 0.00 N ATOM 0 H LYS A 377 10.608 4.429 -2.474 1.00 0.00 H new ATOM 0 HA LYS A 377 10.036 6.979 -1.486 1.00 0.00 H new ATOM 0 HB2 LYS A 377 11.554 7.715 -3.398 1.00 0.00 H new ATOM 0 HB3 LYS A 377 12.230 6.532 -2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 377 12.856 5.551 -4.269 1.00 0.00 H new ATOM 0 HG3 LYS A 377 11.277 4.808 -4.110 1.00 0.00 H new ATOM 0 HD2 LYS A 377 11.317 5.612 -6.336 1.00 0.00 H new ATOM 0 HD3 LYS A 377 10.356 6.795 -5.470 1.00 0.00 H new ATOM 0 HE2 LYS A 377 12.679 8.018 -5.125 1.00 0.00 H new ATOM 0 HE3 LYS A 377 13.191 7.033 -6.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 377 12.172 9.361 -6.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 377 11.745 8.077 -7.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 377 10.682 8.573 -6.686 1.00 0.00 H new ATOM 1105 N LYS A 378 8.348 6.236 -4.172 1.00 0.00 N ATOM 1106 CA LYS A 378 7.303 6.712 -5.082 1.00 0.00 C ATOM 1107 C LYS A 378 5.988 6.952 -4.333 1.00 0.00 C ATOM 1108 O LYS A 378 5.934 6.849 -3.105 1.00 0.00 O ATOM 1109 CB LYS A 378 7.082 5.699 -6.210 1.00 0.00 C ATOM 1110 CG LYS A 378 6.643 4.327 -5.720 1.00 0.00 C ATOM 1111 CD LYS A 378 5.751 3.632 -6.729 1.00 0.00 C ATOM 1112 CE LYS A 378 6.494 3.345 -8.026 1.00 0.00 C ATOM 1113 NZ LYS A 378 6.669 1.886 -8.262 1.00 0.00 N ATOM 0 H LYS A 378 8.521 5.232 -4.218 1.00 0.00 H new ATOM 0 HA LYS A 378 7.633 7.659 -5.509 1.00 0.00 H new ATOM 0 HB2 LYS A 378 6.329 6.089 -6.895 1.00 0.00 H new ATOM 0 HB3 LYS A 378 8.006 5.594 -6.779 1.00 0.00 H new ATOM 0 HG2 LYS A 378 7.521 3.712 -5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 378 6.111 4.431 -4.774 1.00 0.00 H new ATOM 0 HD2 LYS A 378 5.381 2.698 -6.306 1.00 0.00 H new ATOM 0 HD3 LYS A 378 4.881 4.255 -6.937 1.00 0.00 H new ATOM 0 HE2 LYS A 378 5.947 3.783 -8.861 1.00 0.00 H new ATOM 0 HE3 LYS A 378 7.471 3.827 -7.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 378 7.372 1.738 -9.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 378 6.997 1.430 -7.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 378 5.761 1.470 -8.550 1.00 0.00 H new ATOM 1127 N LYS A 379 4.928 7.264 -5.082 1.00 0.00 N ATOM 1128 CA LYS A 379 3.613 7.510 -4.494 1.00 0.00 C ATOM 1129 C LYS A 379 2.835 6.198 -4.321 1.00 0.00 C ATOM 1130 O LYS A 379 3.420 5.114 -4.357 1.00 0.00 O ATOM 1131 CB LYS A 379 2.821 8.505 -5.354 1.00 0.00 C ATOM 1132 CG LYS A 379 2.388 7.954 -6.704 1.00 0.00 C ATOM 1133 CD LYS A 379 2.098 9.073 -7.690 1.00 0.00 C ATOM 1134 CE LYS A 379 3.380 9.648 -8.274 1.00 0.00 C ATOM 1135 NZ LYS A 379 3.224 10.025 -9.706 1.00 0.00 N ATOM 0 H LYS A 379 4.957 7.352 -6.098 1.00 0.00 H new ATOM 0 HA LYS A 379 3.756 7.946 -3.505 1.00 0.00 H new ATOM 0 HB2 LYS A 379 1.936 8.821 -4.802 1.00 0.00 H new ATOM 0 HB3 LYS A 379 3.430 9.394 -5.515 1.00 0.00 H new ATOM 0 HG2 LYS A 379 3.170 7.308 -7.103 1.00 0.00 H new ATOM 0 HG3 LYS A 379 1.498 7.337 -6.579 1.00 0.00 H new ATOM 0 HD2 LYS A 379 1.468 8.696 -8.495 1.00 0.00 H new ATOM 0 HD3 LYS A 379 1.538 9.863 -7.190 1.00 0.00 H new ATOM 0 HE2 LYS A 379 3.678 10.525 -7.699 1.00 0.00 H new ATOM 0 HE3 LYS A 379 4.182 8.916 -8.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 4.121 10.412 -10.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 2.965 9.184 -10.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 2.477 10.743 -9.797 1.00 0.00 H new ATOM 1149 N LEU A 380 1.520 6.306 -4.120 1.00 0.00 N ATOM 1150 CA LEU A 380 0.673 5.130 -3.924 1.00 0.00 C ATOM 1151 C LEU A 380 -0.013 4.696 -5.217 1.00 0.00 C ATOM 1152 O LEU A 380 0.151 3.556 -5.655 1.00 0.00 O ATOM 1153 CB LEU A 380 -0.370 5.418 -2.844 1.00 0.00 C ATOM 1154 CG LEU A 380 0.157 5.325 -1.410 1.00 0.00 C ATOM 1155 CD1 LEU A 380 0.409 6.713 -0.845 1.00 0.00 C ATOM 1156 CD2 LEU A 380 -0.814 4.553 -0.532 1.00 0.00 C ATOM 0 H LEU A 380 1.020 7.195 -4.089 1.00 0.00 H new ATOM 0 HA LEU A 380 1.314 4.308 -3.605 1.00 0.00 H new ATOM 0 HB2 LEU A 380 -0.774 6.417 -3.005 1.00 0.00 H new ATOM 0 HB3 LEU A 380 -1.197 4.717 -2.960 1.00 0.00 H new ATOM 0 HG LEU A 380 1.104 4.785 -1.425 1.00 0.00 H new ATOM 0 HD11 LEU A 380 0.783 6.628 0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 380 1.147 7.228 -1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 380 -0.522 7.280 -0.844 1.00 0.00 H new ATOM 0 HD21 LEU A 380 -0.421 4.498 0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 380 -1.778 5.062 -0.521 1.00 0.00 H new ATOM 0 HD23 LEU A 380 -0.940 3.545 -0.928 1.00 0.00 H new ATOM 1168 N LEU A 381 -0.785 5.603 -5.821 1.00 0.00 N ATOM 1169 CA LEU A 381 -1.502 5.298 -7.067 1.00 0.00 C ATOM 1170 C LEU A 381 -0.579 4.696 -8.134 1.00 0.00 C ATOM 1171 O LEU A 381 -1.048 3.988 -9.024 1.00 0.00 O ATOM 1172 CB LEU A 381 -2.211 6.544 -7.614 1.00 0.00 C ATOM 1173 CG LEU A 381 -1.398 7.412 -8.591 1.00 0.00 C ATOM 1174 CD1 LEU A 381 -1.455 6.845 -10.005 1.00 0.00 C ATOM 1175 CD2 LEU A 381 -1.911 8.846 -8.576 1.00 0.00 C ATOM 0 H LEU A 381 -0.931 6.550 -5.472 1.00 0.00 H new ATOM 0 HA LEU A 381 -2.253 4.547 -6.822 1.00 0.00 H new ATOM 0 HB2 LEU A 381 -3.125 6.226 -8.116 1.00 0.00 H new ATOM 0 HB3 LEU A 381 -2.511 7.166 -6.771 1.00 0.00 H new ATOM 0 HG LEU A 381 -0.358 7.405 -8.265 1.00 0.00 H new ATOM 0 HD11 LEU A 381 -0.872 7.478 -10.674 1.00 0.00 H new ATOM 0 HD12 LEU A 381 -1.043 5.836 -10.009 1.00 0.00 H new ATOM 0 HD13 LEU A 381 -2.491 6.815 -10.344 1.00 0.00 H new ATOM 0 HD21 LEU A 381 -1.327 9.449 -9.272 1.00 0.00 H new ATOM 0 HD22 LEU A 381 -2.959 8.861 -8.875 1.00 0.00 H new ATOM 0 HD23 LEU A 381 -1.815 9.256 -7.571 1.00 0.00 H new ATOM 1187 N ASP A 382 0.729 4.974 -8.039 1.00 0.00 N ATOM 1188 CA ASP A 382 1.703 4.439 -8.996 1.00 0.00 C ATOM 1189 C ASP A 382 1.554 2.922 -9.140 1.00 0.00 C ATOM 1190 O ASP A 382 1.776 2.370 -10.217 1.00 0.00 O ATOM 1191 CB ASP A 382 3.129 4.775 -8.551 1.00 0.00 C ATOM 1192 CG ASP A 382 3.879 5.609 -9.572 1.00 0.00 C ATOM 1193 OD1 ASP A 382 4.069 5.128 -10.708 1.00 0.00 O ATOM 1194 OD2 ASP A 382 4.283 6.741 -9.231 1.00 0.00 O ATOM 0 H ASP A 382 1.134 5.564 -7.312 1.00 0.00 H new ATOM 0 HA ASP A 382 1.509 4.902 -9.964 1.00 0.00 H new ATOM 0 HB2 ASP A 382 3.092 5.314 -7.604 1.00 0.00 H new ATOM 0 HB3 ASP A 382 3.677 3.850 -8.371 1.00 0.00 H new ATOM 1199 N LEU A 383 1.172 2.256 -8.046 1.00 0.00 N ATOM 1200 CA LEU A 383 0.985 0.807 -8.048 1.00 0.00 C ATOM 1201 C LEU A 383 -0.504 0.441 -8.130 1.00 0.00 C ATOM 1202 O LEU A 383 -0.894 -0.668 -7.763 1.00 0.00 O ATOM 1203 CB LEU A 383 1.600 0.201 -6.784 1.00 0.00 C ATOM 1204 CG LEU A 383 3.045 0.616 -6.492 1.00 0.00 C ATOM 1205 CD1 LEU A 383 3.344 0.510 -5.002 1.00 0.00 C ATOM 1206 CD2 LEU A 383 4.016 -0.238 -7.297 1.00 0.00 C ATOM 0 H LEU A 383 0.987 2.701 -7.147 1.00 0.00 H new ATOM 0 HA LEU A 383 1.485 0.401 -8.927 1.00 0.00 H new ATOM 0 HB2 LEU A 383 0.981 0.478 -5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 383 1.562 -0.885 -6.867 1.00 0.00 H new ATOM 0 HG LEU A 383 3.172 1.657 -6.791 1.00 0.00 H new ATOM 0 HD11 LEU A 383 4.375 0.809 -4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 383 2.671 1.164 -4.448 1.00 0.00 H new ATOM 0 HD13 LEU A 383 3.200 -0.520 -4.674 1.00 0.00 H new ATOM 0 HD21 LEU A 383 5.039 0.069 -7.078 1.00 0.00 H new ATOM 0 HD22 LEU A 383 3.887 -1.287 -7.029 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.818 -0.109 -8.361 1.00 0.00 H new ATOM 1218 N GLU A 384 -1.327 1.381 -8.613 1.00 0.00 N ATOM 1219 CA GLU A 384 -2.769 1.169 -8.744 1.00 0.00 C ATOM 1220 C GLU A 384 -3.405 0.842 -7.390 1.00 0.00 C ATOM 1221 O GLU A 384 -3.842 -0.287 -7.154 1.00 0.00 O ATOM 1222 CB GLU A 384 -3.051 0.051 -9.752 1.00 0.00 C ATOM 1223 CG GLU A 384 -3.235 0.544 -11.183 1.00 0.00 C ATOM 1224 CD GLU A 384 -2.707 -0.428 -12.226 1.00 0.00 C ATOM 1225 OE1 GLU A 384 -2.681 -1.649 -11.954 1.00 0.00 O ATOM 1226 OE2 GLU A 384 -2.322 0.033 -13.322 1.00 0.00 O ATOM 0 H GLU A 384 -1.013 2.301 -8.921 1.00 0.00 H new ATOM 0 HA GLU A 384 -3.216 2.094 -9.109 1.00 0.00 H new ATOM 0 HB2 GLU A 384 -2.229 -0.664 -9.727 1.00 0.00 H new ATOM 0 HB3 GLU A 384 -3.949 -0.485 -9.444 1.00 0.00 H new ATOM 0 HG2 GLU A 384 -4.295 0.722 -11.365 1.00 0.00 H new ATOM 0 HG3 GLU A 384 -2.727 1.501 -11.298 1.00 0.00 H new ATOM 1233 N LEU A 385 -3.449 1.837 -6.501 1.00 0.00 N ATOM 1234 CA LEU A 385 -4.031 1.650 -5.169 1.00 0.00 C ATOM 1235 C LEU A 385 -5.379 2.356 -5.046 1.00 0.00 C ATOM 1236 O LEU A 385 -6.286 1.854 -4.384 1.00 0.00 O ATOM 1237 CB LEU A 385 -3.079 2.163 -4.087 1.00 0.00 C ATOM 1238 CG LEU A 385 -1.770 1.377 -3.950 1.00 0.00 C ATOM 1239 CD1 LEU A 385 -0.792 2.123 -3.059 1.00 0.00 C ATOM 1240 CD2 LEU A 385 -2.032 -0.018 -3.402 1.00 0.00 C ATOM 0 H LEU A 385 -3.091 2.776 -6.677 1.00 0.00 H new ATOM 0 HA LEU A 385 -4.189 0.581 -5.029 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.839 3.205 -4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -3.598 2.145 -3.129 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.328 1.276 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 385 0.131 1.550 -2.973 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.575 3.099 -3.494 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.230 2.256 -2.070 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -1.089 -0.557 -3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.500 0.059 -2.420 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.695 -0.556 -4.079 1.00 0.00 H new ATOM 1252 N ALA A 386 -5.507 3.521 -5.686 1.00 0.00 N ATOM 1253 CA ALA A 386 -6.750 4.286 -5.641 1.00 0.00 C ATOM 1254 C ALA A 386 -7.878 3.544 -6.361 1.00 0.00 C ATOM 1255 O ALA A 386 -7.672 2.987 -7.440 1.00 0.00 O ATOM 1256 CB ALA A 386 -6.546 5.663 -6.255 1.00 0.00 C ATOM 0 H ALA A 386 -4.766 3.952 -6.239 1.00 0.00 H new ATOM 0 HA ALA A 386 -7.036 4.406 -4.596 1.00 0.00 H new ATOM 0 HB1 ALA A 386 -7.481 6.222 -6.214 1.00 0.00 H new ATOM 0 HB2 ALA A 386 -5.778 6.200 -5.698 1.00 0.00 H new ATOM 0 HB3 ALA A 386 -6.232 5.556 -7.293 1.00 0.00 H new ATOM 1262 N PRO A 387 -9.090 3.521 -5.767 1.00 0.00 N ATOM 1263 CA PRO A 387 -9.373 4.172 -4.484 1.00 0.00 C ATOM 1264 C PRO A 387 -8.993 3.323 -3.266 1.00 0.00 C ATOM 1265 O PRO A 387 -8.603 3.869 -2.239 1.00 0.00 O ATOM 1266 CB PRO A 387 -10.881 4.376 -4.540 1.00 0.00 C ATOM 1267 CG PRO A 387 -11.390 3.229 -5.348 1.00 0.00 C ATOM 1268 CD PRO A 387 -10.290 2.858 -6.316 1.00 0.00 C ATOM 0 HA PRO A 387 -8.792 5.086 -4.360 1.00 0.00 H new ATOM 0 HB2 PRO A 387 -11.317 4.381 -3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 387 -11.134 5.330 -5.003 1.00 0.00 H new ATOM 0 HG2 PRO A 387 -11.642 2.385 -4.706 1.00 0.00 H new ATOM 0 HG3 PRO A 387 -12.299 3.505 -5.882 1.00 0.00 H new ATOM 0 HD2 PRO A 387 -10.157 1.778 -6.374 1.00 0.00 H new ATOM 0 HD3 PRO A 387 -10.512 3.207 -7.325 1.00 0.00 H new ATOM 1276 N SER A 388 -9.124 1.996 -3.374 1.00 0.00 N ATOM 1277 CA SER A 388 -8.804 1.095 -2.262 1.00 0.00 C ATOM 1278 C SER A 388 -7.892 -0.048 -2.712 1.00 0.00 C ATOM 1279 O SER A 388 -7.970 -0.503 -3.854 1.00 0.00 O ATOM 1280 CB SER A 388 -10.091 0.527 -1.651 1.00 0.00 C ATOM 1281 OG SER A 388 -11.096 1.523 -1.540 1.00 0.00 O ATOM 0 H SER A 388 -9.448 1.524 -4.218 1.00 0.00 H new ATOM 0 HA SER A 388 -8.272 1.675 -1.508 1.00 0.00 H new ATOM 0 HB2 SER A 388 -10.457 -0.294 -2.268 1.00 0.00 H new ATOM 0 HB3 SER A 388 -9.876 0.114 -0.666 1.00 0.00 H new ATOM 0 HG SER A 388 -11.904 1.130 -1.149 1.00 0.00 H new ATOM 1287 N ALA A 389 -7.026 -0.503 -1.801 1.00 0.00 N ATOM 1288 CA ALA A 389 -6.090 -1.589 -2.093 1.00 0.00 C ATOM 1289 C ALA A 389 -5.714 -2.369 -0.829 1.00 0.00 C ATOM 1290 O ALA A 389 -5.782 -1.841 0.284 1.00 0.00 O ATOM 1291 CB ALA A 389 -4.837 -1.033 -2.752 1.00 0.00 C ATOM 0 H ALA A 389 -6.955 -0.134 -0.853 1.00 0.00 H new ATOM 0 HA ALA A 389 -6.586 -2.280 -2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 389 -4.146 -1.848 -2.966 1.00 0.00 H new ATOM 0 HB2 ALA A 389 -5.107 -0.533 -3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 389 -4.359 -0.319 -2.081 1.00 0.00 H new ATOM 1297 N SER A 390 -5.304 -3.627 -1.015 1.00 0.00 N ATOM 1298 CA SER A 390 -4.903 -4.488 0.101 1.00 0.00 C ATOM 1299 C SER A 390 -3.431 -4.877 -0.015 1.00 0.00 C ATOM 1300 O SER A 390 -2.900 -5.010 -1.120 1.00 0.00 O ATOM 1301 CB SER A 390 -5.766 -5.755 0.148 1.00 0.00 C ATOM 1302 OG SER A 390 -7.057 -5.526 -0.392 1.00 0.00 O ATOM 0 H SER A 390 -5.241 -4.073 -1.930 1.00 0.00 H new ATOM 0 HA SER A 390 -5.049 -3.925 1.023 1.00 0.00 H new ATOM 0 HB2 SER A 390 -5.274 -6.552 -0.409 1.00 0.00 H new ATOM 0 HB3 SER A 390 -5.857 -6.096 1.179 1.00 0.00 H new ATOM 0 HG SER A 390 -7.581 -6.353 -0.349 1.00 0.00 H new ATOM 1308 N VAL A 391 -2.777 -5.064 1.132 1.00 0.00 N ATOM 1309 CA VAL A 391 -1.364 -5.445 1.159 1.00 0.00 C ATOM 1310 C VAL A 391 -1.180 -6.836 1.774 1.00 0.00 C ATOM 1311 O VAL A 391 -2.102 -7.386 2.374 1.00 0.00 O ATOM 1312 CB VAL A 391 -0.509 -4.415 1.945 1.00 0.00 C ATOM 1313 CG1 VAL A 391 -1.025 -3.004 1.721 1.00 0.00 C ATOM 1314 CG2 VAL A 391 -0.489 -4.736 3.431 1.00 0.00 C ATOM 0 H VAL A 391 -3.202 -4.958 2.053 1.00 0.00 H new ATOM 0 HA VAL A 391 -1.021 -5.463 0.124 1.00 0.00 H new ATOM 0 HB VAL A 391 0.512 -4.478 1.568 1.00 0.00 H new ATOM 0 HG11 VAL A 391 -0.411 -2.299 2.281 1.00 0.00 H new ATOM 0 HG12 VAL A 391 -0.977 -2.763 0.659 1.00 0.00 H new ATOM 0 HG13 VAL A 391 -2.058 -2.936 2.062 1.00 0.00 H new ATOM 0 HG21 VAL A 391 0.118 -3.997 3.955 1.00 0.00 H new ATOM 0 HG22 VAL A 391 -1.506 -4.713 3.822 1.00 0.00 H new ATOM 0 HG23 VAL A 391 -0.064 -5.728 3.583 1.00 0.00 H new ATOM 1324 N VAL A 392 0.021 -7.392 1.627 1.00 0.00 N ATOM 1325 CA VAL A 392 0.331 -8.708 2.173 1.00 0.00 C ATOM 1326 C VAL A 392 1.648 -8.670 2.945 1.00 0.00 C ATOM 1327 O VAL A 392 2.698 -8.370 2.376 1.00 0.00 O ATOM 1328 CB VAL A 392 0.413 -9.789 1.069 1.00 0.00 C ATOM 1329 CG1 VAL A 392 -0.919 -9.918 0.348 1.00 0.00 C ATOM 1330 CG2 VAL A 392 1.532 -9.486 0.080 1.00 0.00 C ATOM 0 H VAL A 392 0.796 -6.949 1.133 1.00 0.00 H new ATOM 0 HA VAL A 392 -0.483 -8.973 2.848 1.00 0.00 H new ATOM 0 HB VAL A 392 0.641 -10.741 1.549 1.00 0.00 H new ATOM 0 HG11 VAL A 392 -0.842 -10.683 -0.425 1.00 0.00 H new ATOM 0 HG12 VAL A 392 -1.693 -10.200 1.062 1.00 0.00 H new ATOM 0 HG13 VAL A 392 -1.178 -8.964 -0.111 1.00 0.00 H new ATOM 0 HG21 VAL A 392 1.564 -10.264 -0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 392 1.348 -8.521 -0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 392 2.485 -9.456 0.607 1.00 0.00 H new ATOM 1340 N LEU A 393 1.582 -8.959 4.243 1.00 0.00 N ATOM 1341 CA LEU A 393 2.772 -8.944 5.089 1.00 0.00 C ATOM 1342 C LEU A 393 3.523 -10.269 5.008 1.00 0.00 C ATOM 1343 O LEU A 393 2.941 -11.337 5.207 1.00 0.00 O ATOM 1344 CB LEU A 393 2.394 -8.640 6.539 1.00 0.00 C ATOM 1345 CG LEU A 393 3.229 -7.545 7.200 1.00 0.00 C ATOM 1346 CD1 LEU A 393 2.776 -6.171 6.730 1.00 0.00 C ATOM 1347 CD2 LEU A 393 3.142 -7.651 8.713 1.00 0.00 C ATOM 0 H LEU A 393 0.720 -9.205 4.730 1.00 0.00 H new ATOM 0 HA LEU A 393 3.431 -8.157 4.723 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.344 -8.348 6.573 1.00 0.00 H new ATOM 0 HB3 LEU A 393 2.490 -9.554 7.125 1.00 0.00 H new ATOM 0 HG LEU A 393 4.270 -7.680 6.907 1.00 0.00 H new ATOM 0 HD11 LEU A 393 3.382 -5.404 7.211 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.892 -6.100 5.649 1.00 0.00 H new ATOM 0 HD13 LEU A 393 1.728 -6.024 6.993 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.743 -6.863 9.168 1.00 0.00 H new ATOM 0 HD22 LEU A 393 2.104 -7.542 9.026 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.517 -8.623 9.032 1.00 0.00 H new ATOM 1359 N LEU A 394 4.823 -10.189 4.721 1.00 0.00 N ATOM 1360 CA LEU A 394 5.665 -11.374 4.617 1.00 0.00 C ATOM 1361 C LEU A 394 6.806 -11.318 5.634 1.00 0.00 C ATOM 1362 O LEU A 394 7.976 -11.205 5.266 1.00 0.00 O ATOM 1363 CB LEU A 394 6.204 -11.522 3.192 1.00 0.00 C ATOM 1364 CG LEU A 394 5.615 -12.688 2.395 1.00 0.00 C ATOM 1365 CD1 LEU A 394 5.475 -12.317 0.925 1.00 0.00 C ATOM 1366 CD2 LEU A 394 6.478 -13.931 2.556 1.00 0.00 C ATOM 0 H LEU A 394 5.314 -9.310 4.556 1.00 0.00 H new ATOM 0 HA LEU A 394 5.059 -12.251 4.844 1.00 0.00 H new ATOM 0 HB2 LEU A 394 6.012 -10.597 2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 394 7.286 -11.644 3.240 1.00 0.00 H new ATOM 0 HG LEU A 394 4.621 -12.906 2.786 1.00 0.00 H new ATOM 0 HD11 LEU A 394 5.055 -13.159 0.376 1.00 0.00 H new ATOM 0 HD12 LEU A 394 4.815 -11.455 0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 394 6.455 -12.071 0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 394 6.045 -14.751 1.983 1.00 0.00 H new ATOM 0 HD22 LEU A 394 7.484 -13.725 2.191 1.00 0.00 H new ATOM 0 HD23 LEU A 394 6.523 -14.209 3.609 1.00 0.00 H new ATOM 1378 N PRO A 395 6.468 -11.388 6.937 1.00 0.00 N ATOM 1379 CA PRO A 395 7.448 -11.339 8.029 1.00 0.00 C ATOM 1380 C PRO A 395 8.587 -12.344 7.855 1.00 0.00 C ATOM 1381 O PRO A 395 8.461 -13.324 7.121 1.00 0.00 O ATOM 1382 CB PRO A 395 6.626 -11.681 9.282 1.00 0.00 C ATOM 1383 CG PRO A 395 5.305 -12.163 8.781 1.00 0.00 C ATOM 1384 CD PRO A 395 5.099 -11.506 7.449 1.00 0.00 C ATOM 0 HA PRO A 395 7.936 -10.365 8.074 1.00 0.00 H new ATOM 0 HB2 PRO A 395 7.122 -12.447 9.878 1.00 0.00 H new ATOM 0 HB3 PRO A 395 6.506 -10.807 9.922 1.00 0.00 H new ATOM 0 HG2 PRO A 395 5.297 -13.249 8.685 1.00 0.00 H new ATOM 0 HG3 PRO A 395 4.506 -11.899 9.473 1.00 0.00 H new ATOM 0 HD2 PRO A 395 4.471 -12.108 6.793 1.00 0.00 H new ATOM 0 HD3 PRO A 395 4.617 -10.533 7.547 1.00 0.00 H new ATOM 1392 N ALA A 396 9.698 -12.086 8.544 1.00 0.00 N ATOM 1393 CA ALA A 396 10.871 -12.958 8.478 1.00 0.00 C ATOM 1394 C ALA A 396 11.247 -13.495 9.861 1.00 0.00 C ATOM 1395 O ALA A 396 12.430 -13.686 10.161 1.00 0.00 O ATOM 1396 CB ALA A 396 12.046 -12.208 7.864 1.00 0.00 C ATOM 0 H ALA A 396 9.811 -11.278 9.156 1.00 0.00 H new ATOM 0 HA ALA A 396 10.622 -13.811 7.847 1.00 0.00 H new ATOM 0 HB1 ALA A 396 12.914 -12.866 7.819 1.00 0.00 H new ATOM 0 HB2 ALA A 396 11.784 -11.884 6.857 1.00 0.00 H new ATOM 0 HB3 ALA A 396 12.282 -11.337 8.476 1.00 0.00 H new ATOM 1402 N GLY A 397 10.238 -13.743 10.698 1.00 0.00 N ATOM 1403 CA GLY A 397 10.486 -14.257 12.033 1.00 0.00 C ATOM 1404 C GLY A 397 10.350 -15.764 12.105 1.00 0.00 C ATOM 1405 O GLY A 397 9.272 -16.243 12.509 1.00 0.00 O ATOM 1406 OXT GLY A 397 11.322 -16.465 11.753 1.00 0.00 O ATOM 0 H GLY A 397 9.254 -13.596 10.473 1.00 0.00 H new ATOM 0 HA2 GLY A 397 11.489 -13.970 12.350 1.00 0.00 H new ATOM 0 HA3 GLY A 397 9.787 -13.798 12.732 1.00 0.00 H new