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= 0.0548 K(o=0.11,f=-0.8) USER MOD Set 1.2: A 333 THR OG1 : rot 180:sc= 0.0514 USER MOD Single : A 318 THR OG1 : rot -51:sc= 0.402 USER MOD Single : A 330 SER OG : rot 180:sc= 0 USER MOD Single : A 331 SER OG : rot 170:sc= 0 USER MOD Single : A 334 ASN : amide:sc= 0 X(o=0,f=0.063) USER MOD Single : A 335 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 338 SER OG : rot 96:sc= 0.618 USER MOD Single : A 347 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 351 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 352 THR OG1 : rot 180:sc= 0.0385 USER MOD Single : A 355 ASN : amide:sc= -0.125 X(o=-0.13,f=-0.0035) USER MOD Single : A 356 THR OG1 : rot -174:sc= -0.659 USER MOD Single : A 357 TYR OH : rot 165:sc= -2.25! USER MOD Single : A 359 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 361 SER OG : rot 78:sc= 1.88 USER MOD Single : A 364 THR OG1 : rot 180:sc= 0 USER MOD Single : A 365 MET CE :methyl 178:sc= -1.19 (180deg=-1.27) USER MOD Single : A 372 THR OG1 : rot 180:sc= -0.0536 USER MOD Single : A 373 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 376 TYR OH : rot -166:sc= -0.604 USER MOD Single : A 377 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 378 LYS NZ :NH3+ -160:sc= -1.07 (180deg=-1.12) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 180:sc= -0.142 USER MOD Single : A 390 SER OG : rot 180:sc= -0.0525 USER MOD ----------------------------------------------------------------- ATOM 163 N THR A 318 -8.959 12.889 -4.247 1.00 0.00 N ATOM 164 CA THR A 318 -7.844 12.454 -5.097 1.00 0.00 C ATOM 165 C THR A 318 -6.765 11.730 -4.275 1.00 0.00 C ATOM 166 O THR A 318 -5.566 11.887 -4.521 1.00 0.00 O ATOM 167 CB THR A 318 -7.249 13.649 -5.866 1.00 0.00 C ATOM 168 OG1 THR A 318 -6.317 13.213 -6.844 1.00 0.00 O ATOM 169 CG2 THR A 318 -6.545 14.665 -4.988 1.00 0.00 C ATOM 0 HA THR A 318 -8.233 11.742 -5.825 1.00 0.00 H new ATOM 0 HB THR A 318 -8.112 14.134 -6.323 1.00 0.00 H new ATOM 0 HG1 THR A 318 -5.666 12.609 -6.429 1.00 0.00 H new ATOM 0 HG21 THR A 318 -6.155 15.473 -5.607 1.00 0.00 H new ATOM 0 HG22 THR A 318 -7.251 15.071 -4.263 1.00 0.00 H new ATOM 0 HG23 THR A 318 -5.722 14.182 -4.461 1.00 0.00 H new ATOM 177 N VAL A 319 -7.208 10.930 -3.301 1.00 0.00 N ATOM 178 CA VAL A 319 -6.294 10.176 -2.441 1.00 0.00 C ATOM 179 C VAL A 319 -6.441 8.671 -2.655 1.00 0.00 C ATOM 180 O VAL A 319 -7.386 8.212 -3.299 1.00 0.00 O ATOM 181 CB VAL A 319 -6.531 10.487 -0.945 1.00 0.00 C ATOM 182 CG1 VAL A 319 -6.074 11.898 -0.603 1.00 0.00 C ATOM 183 CG2 VAL A 319 -7.996 10.288 -0.580 1.00 0.00 C ATOM 0 H VAL A 319 -8.196 10.788 -3.089 1.00 0.00 H new ATOM 0 HA VAL A 319 -5.286 10.487 -2.718 1.00 0.00 H new ATOM 0 HB VAL A 319 -5.935 9.790 -0.356 1.00 0.00 H new ATOM 0 HG11 VAL A 319 -6.252 12.092 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 319 -5.010 11.998 -0.816 1.00 0.00 H new ATOM 0 HG13 VAL A 319 -6.633 12.617 -1.202 1.00 0.00 H new ATOM 0 HG21 VAL A 319 -8.141 10.512 0.477 1.00 0.00 H new ATOM 0 HG22 VAL A 319 -8.614 10.955 -1.181 1.00 0.00 H new ATOM 0 HG23 VAL A 319 -8.282 9.254 -0.774 1.00 0.00 H new ATOM 193 N ALA A 320 -5.498 7.910 -2.100 1.00 0.00 N ATOM 194 CA ALA A 320 -5.507 6.449 -2.217 1.00 0.00 C ATOM 195 C ALA A 320 -5.766 5.784 -0.864 1.00 0.00 C ATOM 196 O ALA A 320 -5.438 6.336 0.187 1.00 0.00 O ATOM 197 CB ALA A 320 -4.193 5.958 -2.812 1.00 0.00 C ATOM 0 H ALA A 320 -4.715 8.281 -1.563 1.00 0.00 H new ATOM 0 HA ALA A 320 -6.321 6.170 -2.885 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -4.214 4.871 -2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -4.057 6.393 -3.802 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -3.367 6.258 -2.167 1.00 0.00 H new ATOM 203 N ARG A 321 -6.367 4.597 -0.895 1.00 0.00 N ATOM 204 CA ARG A 321 -6.676 3.864 0.328 1.00 0.00 C ATOM 205 C ARG A 321 -5.975 2.512 0.342 1.00 0.00 C ATOM 206 O ARG A 321 -6.116 1.726 -0.593 1.00 0.00 O ATOM 207 CB ARG A 321 -8.183 3.669 0.440 1.00 0.00 C ATOM 208 CG ARG A 321 -8.716 3.750 1.863 1.00 0.00 C ATOM 209 CD ARG A 321 -10.112 3.153 1.969 1.00 0.00 C ATOM 210 NE ARG A 321 -11.148 4.184 2.046 1.00 0.00 N ATOM 211 CZ ARG A 321 -11.790 4.531 3.167 1.00 0.00 C ATOM 212 NH1 ARG A 321 -11.503 3.944 4.328 1.00 0.00 N ATOM 213 NH2 ARG A 321 -12.725 5.474 3.127 1.00 0.00 N ATOM 0 H ARG A 321 -6.649 4.123 -1.753 1.00 0.00 H new ATOM 0 HA ARG A 321 -6.319 4.443 1.180 1.00 0.00 H new ATOM 0 HB2 ARG A 321 -8.682 4.424 -0.167 1.00 0.00 H new ATOM 0 HB3 ARG A 321 -8.445 2.698 0.020 1.00 0.00 H new ATOM 0 HG2 ARG A 321 -8.041 3.222 2.536 1.00 0.00 H new ATOM 0 HG3 ARG A 321 -8.738 4.791 2.186 1.00 0.00 H new ATOM 0 HD2 ARG A 321 -10.299 2.515 1.105 1.00 0.00 H new ATOM 0 HD3 ARG A 321 -10.168 2.517 2.853 1.00 0.00 H new ATOM 0 HE ARG A 321 -11.398 4.672 1.186 1.00 0.00 H new ATOM 0 HH11 ARG A 321 -10.786 3.220 4.370 1.00 0.00 H new ATOM 0 HH12 ARG A 321 -12.001 4.219 5.175 1.00 0.00 H new ATOM 0 HH21 ARG A 321 -12.951 5.931 2.243 1.00 0.00 H new ATOM 0 HH22 ARG A 321 -13.217 5.741 3.980 1.00 0.00 H new ATOM 227 N ILE A 322 -5.223 2.245 1.406 1.00 0.00 N ATOM 228 CA ILE A 322 -4.504 0.981 1.532 1.00 0.00 C ATOM 229 C ILE A 322 -4.819 0.299 2.860 1.00 0.00 C ATOM 230 O ILE A 322 -5.023 0.962 3.879 1.00 0.00 O ATOM 231 CB ILE A 322 -2.972 1.153 1.413 1.00 0.00 C ATOM 232 CG1 ILE A 322 -2.616 2.439 0.656 1.00 0.00 C ATOM 233 CG2 ILE A 322 -2.355 -0.059 0.725 1.00 0.00 C ATOM 234 CD1 ILE A 322 -2.923 2.382 -0.825 1.00 0.00 C ATOM 0 H ILE A 322 -5.096 2.884 2.191 1.00 0.00 H new ATOM 0 HA ILE A 322 -4.846 0.360 0.704 1.00 0.00 H new ATOM 0 HB ILE A 322 -2.561 1.232 2.420 1.00 0.00 H new ATOM 0 HG12 ILE A 322 -3.161 3.273 1.099 1.00 0.00 H new ATOM 0 HG13 ILE A 322 -1.554 2.646 0.790 1.00 0.00 H new ATOM 0 HG21 ILE A 322 -1.276 0.076 0.648 1.00 0.00 H new ATOM 0 HG22 ILE A 322 -2.568 -0.955 1.307 1.00 0.00 H new ATOM 0 HG23 ILE A 322 -2.779 -0.166 -0.273 1.00 0.00 H new ATOM 0 HD11 ILE A 322 -2.644 3.327 -1.291 1.00 0.00 H new ATOM 0 HD12 ILE A 322 -2.357 1.571 -1.283 1.00 0.00 H new ATOM 0 HD13 ILE A 322 -3.989 2.207 -0.969 1.00 0.00 H new ATOM 246 N GLN A 323 -4.855 -1.029 2.833 1.00 0.00 N ATOM 247 CA GLN A 323 -5.140 -1.821 4.024 1.00 0.00 C ATOM 248 C GLN A 323 -3.922 -2.650 4.421 1.00 0.00 C ATOM 249 O GLN A 323 -3.458 -3.493 3.650 1.00 0.00 O ATOM 250 CB GLN A 323 -6.340 -2.739 3.772 1.00 0.00 C ATOM 251 CG GLN A 323 -7.618 -2.270 4.448 1.00 0.00 C ATOM 252 CD GLN A 323 -8.839 -3.056 4.003 1.00 0.00 C ATOM 253 OE1 GLN A 323 -8.736 -3.999 3.216 1.00 0.00 O ATOM 254 NE2 GLN A 323 -10.007 -2.671 4.506 1.00 0.00 N ATOM 0 H GLN A 323 -4.689 -1.583 1.993 1.00 0.00 H new ATOM 0 HA GLN A 323 -5.378 -1.141 4.842 1.00 0.00 H new ATOM 0 HB2 GLN A 323 -6.512 -2.811 2.698 1.00 0.00 H new ATOM 0 HB3 GLN A 323 -6.100 -3.742 4.124 1.00 0.00 H new ATOM 0 HG2 GLN A 323 -7.507 -2.360 5.529 1.00 0.00 H new ATOM 0 HG3 GLN A 323 -7.772 -1.213 4.231 1.00 0.00 H new ATOM 0 HE21 GLN A 323 -10.049 -1.885 5.155 1.00 0.00 H new ATOM 0 HE22 GLN A 323 -10.862 -3.161 4.243 1.00 0.00 H new ATOM 263 N PHE A 324 -3.402 -2.401 5.623 1.00 0.00 N ATOM 264 CA PHE A 324 -2.236 -3.118 6.115 1.00 0.00 C ATOM 265 C PHE A 324 -2.636 -4.389 6.862 1.00 0.00 C ATOM 266 O PHE A 324 -3.197 -4.330 7.957 1.00 0.00 O ATOM 267 CB PHE A 324 -1.409 -2.210 7.025 1.00 0.00 C ATOM 268 CG PHE A 324 0.058 -2.226 6.703 1.00 0.00 C ATOM 269 CD1 PHE A 324 0.892 -3.176 7.265 1.00 0.00 C ATOM 270 CD2 PHE A 324 0.599 -1.294 5.830 1.00 0.00 C ATOM 271 CE1 PHE A 324 2.240 -3.199 6.965 1.00 0.00 C ATOM 272 CE2 PHE A 324 1.947 -1.311 5.527 1.00 0.00 C ATOM 273 CZ PHE A 324 2.768 -2.265 6.095 1.00 0.00 C ATOM 0 H PHE A 324 -3.774 -1.707 6.271 1.00 0.00 H new ATOM 0 HA PHE A 324 -1.634 -3.412 5.255 1.00 0.00 H new ATOM 0 HB2 PHE A 324 -1.781 -1.189 6.943 1.00 0.00 H new ATOM 0 HB3 PHE A 324 -1.550 -2.519 8.061 1.00 0.00 H new ATOM 0 HD1 PHE A 324 0.484 -3.908 7.946 1.00 0.00 H new ATOM 0 HD2 PHE A 324 -0.040 -0.547 5.382 1.00 0.00 H new ATOM 0 HE1 PHE A 324 2.880 -3.946 7.410 1.00 0.00 H new ATOM 0 HE2 PHE A 324 2.358 -0.579 4.847 1.00 0.00 H new ATOM 0 HZ PHE A 324 3.822 -2.281 5.859 1.00 0.00 H new ATOM 283 N ARG A 325 -2.343 -5.536 6.252 1.00 0.00 N ATOM 284 CA ARG A 325 -2.663 -6.833 6.835 1.00 0.00 C ATOM 285 C ARG A 325 -1.463 -7.407 7.590 1.00 0.00 C ATOM 286 O ARG A 325 -0.437 -6.742 7.744 1.00 0.00 O ATOM 287 CB ARG A 325 -3.109 -7.813 5.743 1.00 0.00 C ATOM 288 CG ARG A 325 -3.945 -7.175 4.643 1.00 0.00 C ATOM 289 CD ARG A 325 -4.804 -8.202 3.919 1.00 0.00 C ATOM 290 NE ARG A 325 -3.997 -9.159 3.158 1.00 0.00 N ATOM 291 CZ ARG A 325 -4.474 -9.916 2.167 1.00 0.00 C ATOM 292 NH1 ARG A 325 -5.751 -9.830 1.805 1.00 0.00 N ATOM 293 NH2 ARG A 325 -3.669 -10.765 1.538 1.00 0.00 N ATOM 0 H ARG A 325 -1.880 -5.590 5.345 1.00 0.00 H new ATOM 0 HA ARG A 325 -3.479 -6.691 7.543 1.00 0.00 H new ATOM 0 HB2 ARG A 325 -2.226 -8.269 5.296 1.00 0.00 H new ATOM 0 HB3 ARG A 325 -3.684 -8.616 6.203 1.00 0.00 H new ATOM 0 HG2 ARG A 325 -4.585 -6.404 5.073 1.00 0.00 H new ATOM 0 HG3 ARG A 325 -3.288 -6.681 3.927 1.00 0.00 H new ATOM 0 HD2 ARG A 325 -5.414 -8.740 4.645 1.00 0.00 H new ATOM 0 HD3 ARG A 325 -5.489 -7.689 3.244 1.00 0.00 H new ATOM 0 HE ARG A 325 -3.011 -9.253 3.400 1.00 0.00 H new ATOM 0 HH11 ARG A 325 -6.375 -9.182 2.286 1.00 0.00 H new ATOM 0 HH12 ARG A 325 -6.106 -10.412 1.047 1.00 0.00 H new ATOM 0 HH21 ARG A 325 -2.689 -10.837 1.812 1.00 0.00 H new ATOM 0 HH22 ARG A 325 -4.031 -11.345 0.781 1.00 0.00 H new ATOM 307 N LEU A 326 -1.600 -8.650 8.058 1.00 0.00 N ATOM 308 CA LEU A 326 -0.532 -9.323 8.799 1.00 0.00 C ATOM 309 C LEU A 326 -0.886 -10.793 9.043 1.00 0.00 C ATOM 310 O LEU A 326 -2.043 -11.188 8.889 1.00 0.00 O ATOM 311 CB LEU A 326 -0.278 -8.606 10.135 1.00 0.00 C ATOM 312 CG LEU A 326 -1.517 -7.974 10.785 1.00 0.00 C ATOM 313 CD1 LEU A 326 -2.163 -8.944 11.760 1.00 0.00 C ATOM 314 CD2 LEU A 326 -1.152 -6.673 11.484 1.00 0.00 C ATOM 0 H LEU A 326 -2.443 -9.212 7.936 1.00 0.00 H new ATOM 0 HA LEU A 326 0.379 -9.284 8.201 1.00 0.00 H new ATOM 0 HB2 LEU A 326 0.155 -9.320 10.835 1.00 0.00 H new ATOM 0 HB3 LEU A 326 0.466 -7.826 9.974 1.00 0.00 H new ATOM 0 HG LEU A 326 -2.238 -7.748 9.999 1.00 0.00 H new ATOM 0 HD11 LEU A 326 -3.039 -8.478 12.210 1.00 0.00 H new ATOM 0 HD12 LEU A 326 -2.465 -9.847 11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 326 -1.449 -9.204 12.541 1.00 0.00 H new ATOM 0 HD21 LEU A 326 -2.044 -6.241 11.938 1.00 0.00 H new ATOM 0 HD22 LEU A 326 -0.411 -6.871 12.258 1.00 0.00 H new ATOM 0 HD23 LEU A 326 -0.740 -5.973 10.757 1.00 0.00 H new ATOM 326 N PRO A 327 0.107 -11.626 9.432 1.00 0.00 N ATOM 327 CA PRO A 327 -0.111 -13.056 9.701 1.00 0.00 C ATOM 328 C PRO A 327 -1.293 -13.313 10.634 1.00 0.00 C ATOM 329 O PRO A 327 -2.002 -14.308 10.485 1.00 0.00 O ATOM 330 CB PRO A 327 1.193 -13.491 10.370 1.00 0.00 C ATOM 331 CG PRO A 327 2.218 -12.555 9.836 1.00 0.00 C ATOM 332 CD PRO A 327 1.517 -11.238 9.642 1.00 0.00 C ATOM 0 HA PRO A 327 -0.351 -13.603 8.789 1.00 0.00 H new ATOM 0 HB2 PRO A 327 1.123 -13.425 11.456 1.00 0.00 H new ATOM 0 HB3 PRO A 327 1.437 -14.526 10.129 1.00 0.00 H new ATOM 0 HG2 PRO A 327 3.053 -12.454 10.529 1.00 0.00 H new ATOM 0 HG3 PRO A 327 2.628 -12.921 8.895 1.00 0.00 H new ATOM 0 HD2 PRO A 327 1.630 -10.591 10.512 1.00 0.00 H new ATOM 0 HD3 PRO A 327 1.915 -10.693 8.786 1.00 0.00 H new ATOM 340 N ASP A 328 -1.497 -12.410 11.596 1.00 0.00 N ATOM 341 CA ASP A 328 -2.594 -12.539 12.555 1.00 0.00 C ATOM 342 C ASP A 328 -3.953 -12.611 11.850 1.00 0.00 C ATOM 343 O ASP A 328 -4.889 -13.228 12.360 1.00 0.00 O ATOM 344 CB ASP A 328 -2.582 -11.368 13.545 1.00 0.00 C ATOM 345 CG ASP A 328 -2.841 -11.810 14.974 1.00 0.00 C ATOM 346 OD1 ASP A 328 -2.158 -12.747 15.442 1.00 0.00 O ATOM 347 OD2 ASP A 328 -3.724 -11.216 15.627 1.00 0.00 O ATOM 0 H ASP A 328 -0.916 -11.582 11.731 1.00 0.00 H new ATOM 0 HA ASP A 328 -2.445 -13.471 13.099 1.00 0.00 H new ATOM 0 HB2 ASP A 328 -1.617 -10.863 13.494 1.00 0.00 H new ATOM 0 HB3 ASP A 328 -3.338 -10.640 13.251 1.00 0.00 H new ATOM 352 N GLY A 329 -4.059 -11.973 10.681 1.00 0.00 N ATOM 353 CA GLY A 329 -5.309 -11.977 9.939 1.00 0.00 C ATOM 354 C GLY A 329 -5.972 -10.613 9.904 1.00 0.00 C ATOM 355 O GLY A 329 -6.513 -10.205 8.875 1.00 0.00 O ATOM 0 H GLY A 329 -3.301 -11.455 10.238 1.00 0.00 H new ATOM 0 HA2 GLY A 329 -5.120 -12.311 8.919 1.00 0.00 H new ATOM 0 HA3 GLY A 329 -5.992 -12.697 10.389 1.00 0.00 H new ATOM 359 N SER A 330 -5.928 -9.904 11.033 1.00 0.00 N ATOM 360 CA SER A 330 -6.530 -8.576 11.132 1.00 0.00 C ATOM 361 C SER A 330 -5.712 -7.539 10.358 1.00 0.00 C ATOM 362 O SER A 330 -4.483 -7.592 10.337 1.00 0.00 O ATOM 363 CB SER A 330 -6.649 -8.154 12.600 1.00 0.00 C ATOM 364 OG SER A 330 -7.075 -9.235 13.413 1.00 0.00 O ATOM 0 H SER A 330 -5.482 -10.228 11.891 1.00 0.00 H new ATOM 0 HA SER A 330 -7.525 -8.627 10.691 1.00 0.00 H new ATOM 0 HB2 SER A 330 -5.686 -7.787 12.954 1.00 0.00 H new ATOM 0 HB3 SER A 330 -7.356 -7.329 12.688 1.00 0.00 H new ATOM 0 HG SER A 330 -7.141 -8.938 14.345 1.00 0.00 H new ATOM 370 N SER A 331 -6.407 -6.594 9.726 1.00 0.00 N ATOM 371 CA SER A 331 -5.746 -5.540 8.956 1.00 0.00 C ATOM 372 C SER A 331 -6.333 -4.172 9.300 1.00 0.00 C ATOM 373 O SER A 331 -7.507 -4.066 9.660 1.00 0.00 O ATOM 374 CB SER A 331 -5.875 -5.806 7.450 1.00 0.00 C ATOM 375 OG SER A 331 -5.990 -7.194 7.175 1.00 0.00 O ATOM 0 H SER A 331 -7.425 -6.536 9.732 1.00 0.00 H new ATOM 0 HA SER A 331 -4.689 -5.542 9.220 1.00 0.00 H new ATOM 0 HB2 SER A 331 -6.749 -5.283 7.061 1.00 0.00 H new ATOM 0 HB3 SER A 331 -5.005 -5.402 6.932 1.00 0.00 H new ATOM 0 HG SER A 331 -6.231 -7.322 6.234 1.00 0.00 H new ATOM 381 N PHE A 332 -5.512 -3.128 9.188 1.00 0.00 N ATOM 382 CA PHE A 332 -5.961 -1.770 9.487 1.00 0.00 C ATOM 383 C PHE A 332 -5.999 -0.921 8.219 1.00 0.00 C ATOM 384 O PHE A 332 -5.082 -0.970 7.397 1.00 0.00 O ATOM 385 CB PHE A 332 -5.074 -1.105 10.556 1.00 0.00 C ATOM 386 CG PHE A 332 -3.622 -1.516 10.529 1.00 0.00 C ATOM 387 CD1 PHE A 332 -3.225 -2.752 11.019 1.00 0.00 C ATOM 388 CD2 PHE A 332 -2.655 -0.660 10.025 1.00 0.00 C ATOM 389 CE1 PHE A 332 -1.895 -3.125 11.003 1.00 0.00 C ATOM 390 CE2 PHE A 332 -1.323 -1.027 10.008 1.00 0.00 C ATOM 391 CZ PHE A 332 -0.942 -2.261 10.498 1.00 0.00 C ATOM 0 H PHE A 332 -4.538 -3.196 8.894 1.00 0.00 H new ATOM 0 HA PHE A 332 -6.972 -1.839 9.889 1.00 0.00 H new ATOM 0 HB2 PHE A 332 -5.132 -0.024 10.432 1.00 0.00 H new ATOM 0 HB3 PHE A 332 -5.483 -1.336 11.540 1.00 0.00 H new ATOM 0 HD1 PHE A 332 -3.965 -3.431 11.418 1.00 0.00 H new ATOM 0 HD2 PHE A 332 -2.947 0.306 9.641 1.00 0.00 H new ATOM 0 HE1 PHE A 332 -1.600 -4.091 11.385 1.00 0.00 H new ATOM 0 HE2 PHE A 332 -0.581 -0.350 9.612 1.00 0.00 H new ATOM 0 HZ PHE A 332 0.099 -2.550 10.486 1.00 0.00 H new ATOM 401 N THR A 333 -7.076 -0.153 8.064 1.00 0.00 N ATOM 402 CA THR A 333 -7.251 0.701 6.891 1.00 0.00 C ATOM 403 C THR A 333 -6.774 2.124 7.172 1.00 0.00 C ATOM 404 O THR A 333 -7.127 2.718 8.193 1.00 0.00 O ATOM 405 CB THR A 333 -8.723 0.719 6.454 1.00 0.00 C ATOM 406 OG1 THR A 333 -9.386 -0.482 6.817 1.00 0.00 O ATOM 407 CG2 THR A 333 -8.901 0.904 4.961 1.00 0.00 C ATOM 0 H THR A 333 -7.841 -0.105 8.737 1.00 0.00 H new ATOM 0 HA THR A 333 -6.646 0.288 6.084 1.00 0.00 H new ATOM 0 HB THR A 333 -9.158 1.574 6.971 1.00 0.00 H new ATOM 0 HG1 THR A 333 -10.321 -0.440 6.527 1.00 0.00 H new ATOM 0 HG21 THR A 333 -9.964 0.908 4.719 1.00 0.00 H new ATOM 0 HG22 THR A 333 -8.456 1.851 4.656 1.00 0.00 H new ATOM 0 HG23 THR A 333 -8.411 0.086 4.432 1.00 0.00 H new ATOM 415 N ASN A 334 -5.973 2.663 6.254 1.00 0.00 N ATOM 416 CA ASN A 334 -5.443 4.018 6.389 1.00 0.00 C ATOM 417 C ASN A 334 -5.684 4.827 5.114 1.00 0.00 C ATOM 418 O ASN A 334 -6.121 4.283 4.097 1.00 0.00 O ATOM 419 CB ASN A 334 -3.946 3.968 6.710 1.00 0.00 C ATOM 420 CG ASN A 334 -3.652 4.309 8.160 1.00 0.00 C ATOM 421 OD1 ASN A 334 -3.425 3.422 8.983 1.00 0.00 O ATOM 422 ND2 ASN A 334 -3.654 5.598 8.480 1.00 0.00 N ATOM 0 H ASN A 334 -5.676 2.180 5.406 1.00 0.00 H new ATOM 0 HA ASN A 334 -5.966 4.511 7.209 1.00 0.00 H new ATOM 0 HB2 ASN A 334 -3.563 2.972 6.489 1.00 0.00 H new ATOM 0 HB3 ASN A 334 -3.415 4.664 6.061 1.00 0.00 H new ATOM 0 HD21 ASN A 334 -3.462 5.886 9.440 1.00 0.00 H new ATOM 0 HD22 ASN A 334 -3.847 6.300 7.766 1.00 0.00 H new ATOM 429 N GLN A 335 -5.398 6.128 5.174 1.00 0.00 N ATOM 430 CA GLN A 335 -5.587 7.008 4.027 1.00 0.00 C ATOM 431 C GLN A 335 -4.253 7.571 3.548 1.00 0.00 C ATOM 432 O GLN A 335 -3.556 8.264 4.292 1.00 0.00 O ATOM 433 CB GLN A 335 -6.540 8.151 4.388 1.00 0.00 C ATOM 434 CG GLN A 335 -7.681 8.329 3.399 1.00 0.00 C ATOM 435 CD GLN A 335 -8.837 9.126 3.976 1.00 0.00 C ATOM 436 OE1 GLN A 335 -9.873 8.568 4.334 1.00 0.00 O ATOM 437 NE2 GLN A 335 -8.662 10.441 4.068 1.00 0.00 N ATOM 0 H GLN A 335 -5.035 6.593 6.006 1.00 0.00 H new ATOM 0 HA GLN A 335 -6.024 6.423 3.218 1.00 0.00 H new ATOM 0 HB2 GLN A 335 -6.955 7.967 5.379 1.00 0.00 H new ATOM 0 HB3 GLN A 335 -5.973 9.080 4.447 1.00 0.00 H new ATOM 0 HG2 GLN A 335 -7.308 8.832 2.507 1.00 0.00 H new ATOM 0 HG3 GLN A 335 -8.041 7.349 3.086 1.00 0.00 H new ATOM 0 HE21 GLN A 335 -7.786 10.862 3.759 1.00 0.00 H new ATOM 0 HE22 GLN A 335 -9.404 11.029 4.448 1.00 0.00 H new ATOM 446 N PHE A 336 -3.910 7.276 2.298 1.00 0.00 N ATOM 447 CA PHE A 336 -2.666 7.756 1.706 1.00 0.00 C ATOM 448 C PHE A 336 -2.945 8.395 0.348 1.00 0.00 C ATOM 449 O PHE A 336 -3.419 7.729 -0.569 1.00 0.00 O ATOM 450 CB PHE A 336 -1.665 6.608 1.562 1.00 0.00 C ATOM 451 CG PHE A 336 -1.266 5.995 2.876 1.00 0.00 C ATOM 452 CD1 PHE A 336 -0.501 6.709 3.784 1.00 0.00 C ATOM 453 CD2 PHE A 336 -1.659 4.707 3.203 1.00 0.00 C ATOM 454 CE1 PHE A 336 -0.135 6.150 4.994 1.00 0.00 C ATOM 455 CE2 PHE A 336 -1.296 4.143 4.411 1.00 0.00 C ATOM 456 CZ PHE A 336 -0.533 4.866 5.308 1.00 0.00 C ATOM 0 H PHE A 336 -4.479 6.704 1.673 1.00 0.00 H new ATOM 0 HA PHE A 336 -2.232 8.509 2.364 1.00 0.00 H new ATOM 0 HB2 PHE A 336 -2.098 5.836 0.926 1.00 0.00 H new ATOM 0 HB3 PHE A 336 -0.773 6.975 1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 336 -0.187 7.714 3.544 1.00 0.00 H new ATOM 0 HD2 PHE A 336 -2.256 4.138 2.506 1.00 0.00 H new ATOM 0 HE1 PHE A 336 0.462 6.717 5.693 1.00 0.00 H new ATOM 0 HE2 PHE A 336 -1.608 3.138 4.654 1.00 0.00 H new ATOM 0 HZ PHE A 336 -0.249 4.427 6.253 1.00 0.00 H new ATOM 466 N PRO A 337 -2.661 9.700 0.201 1.00 0.00 N ATOM 467 CA PRO A 337 -2.901 10.427 -1.049 1.00 0.00 C ATOM 468 C PRO A 337 -2.259 9.766 -2.258 1.00 0.00 C ATOM 469 O PRO A 337 -1.366 8.926 -2.128 1.00 0.00 O ATOM 470 CB PRO A 337 -2.275 11.798 -0.807 1.00 0.00 C ATOM 471 CG PRO A 337 -2.234 11.950 0.670 1.00 0.00 C ATOM 472 CD PRO A 337 -2.089 10.568 1.240 1.00 0.00 C ATOM 0 HA PRO A 337 -3.966 10.462 -1.280 1.00 0.00 H new ATOM 0 HB2 PRO A 337 -1.275 11.856 -1.237 1.00 0.00 H new ATOM 0 HB3 PRO A 337 -2.867 12.589 -1.268 1.00 0.00 H new ATOM 0 HG2 PRO A 337 -1.399 12.583 0.971 1.00 0.00 H new ATOM 0 HG3 PRO A 337 -3.144 12.426 1.036 1.00 0.00 H new ATOM 0 HD2 PRO A 337 -1.045 10.323 1.436 1.00 0.00 H new ATOM 0 HD3 PRO A 337 -2.623 10.467 2.185 1.00 0.00 H new ATOM 480 N SER A 338 -2.720 10.168 -3.437 1.00 0.00 N ATOM 481 CA SER A 338 -2.201 9.634 -4.691 1.00 0.00 C ATOM 482 C SER A 338 -0.783 10.145 -4.977 1.00 0.00 C ATOM 483 O SER A 338 -0.150 9.707 -5.936 1.00 0.00 O ATOM 484 CB SER A 338 -3.133 10.011 -5.847 1.00 0.00 C ATOM 485 OG SER A 338 -4.434 9.485 -5.646 1.00 0.00 O ATOM 0 H SER A 338 -3.456 10.865 -3.551 1.00 0.00 H new ATOM 0 HA SER A 338 -2.155 8.549 -4.598 1.00 0.00 H new ATOM 0 HB2 SER A 338 -3.186 11.096 -5.937 1.00 0.00 H new ATOM 0 HB3 SER A 338 -2.726 9.633 -6.785 1.00 0.00 H new ATOM 0 HG SER A 338 -5.003 10.169 -5.235 1.00 0.00 H new ATOM 491 N ASP A 339 -0.290 11.072 -4.150 1.00 0.00 N ATOM 492 CA ASP A 339 1.050 11.632 -4.336 1.00 0.00 C ATOM 493 C ASP A 339 1.964 11.303 -3.154 1.00 0.00 C ATOM 494 O ASP A 339 3.170 11.118 -3.331 1.00 0.00 O ATOM 495 CB ASP A 339 0.970 13.148 -4.530 1.00 0.00 C ATOM 496 CG ASP A 339 -0.103 13.550 -5.525 1.00 0.00 C ATOM 497 OD1 ASP A 339 0.187 13.556 -6.740 1.00 0.00 O ATOM 498 OD2 ASP A 339 -1.232 13.855 -5.088 1.00 0.00 O ATOM 0 H ASP A 339 -0.797 11.448 -3.349 1.00 0.00 H new ATOM 0 HA ASP A 339 1.478 11.178 -5.230 1.00 0.00 H new ATOM 0 HB2 ASP A 339 0.768 13.624 -3.570 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.936 13.519 -4.872 1.00 0.00 H new ATOM 503 N ALA A 340 1.384 11.233 -1.954 1.00 0.00 N ATOM 504 CA ALA A 340 2.140 10.926 -0.742 1.00 0.00 C ATOM 505 C ALA A 340 2.964 9.646 -0.913 1.00 0.00 C ATOM 506 O ALA A 340 2.571 8.742 -1.651 1.00 0.00 O ATOM 507 CB ALA A 340 1.199 10.804 0.451 1.00 0.00 C ATOM 0 H ALA A 340 0.388 11.386 -1.797 1.00 0.00 H new ATOM 0 HA ALA A 340 2.834 11.746 -0.558 1.00 0.00 H new ATOM 0 HB1 ALA A 340 1.776 10.575 1.347 1.00 0.00 H new ATOM 0 HB2 ALA A 340 0.667 11.745 0.592 1.00 0.00 H new ATOM 0 HB3 ALA A 340 0.481 10.005 0.268 1.00 0.00 H new ATOM 513 N PRO A 341 4.131 9.563 -0.243 1.00 0.00 N ATOM 514 CA PRO A 341 5.023 8.395 -0.335 1.00 0.00 C ATOM 515 C PRO A 341 4.341 7.088 0.073 1.00 0.00 C ATOM 516 O PRO A 341 3.543 7.058 1.011 1.00 0.00 O ATOM 517 CB PRO A 341 6.158 8.724 0.641 1.00 0.00 C ATOM 518 CG PRO A 341 6.127 10.206 0.788 1.00 0.00 C ATOM 519 CD PRO A 341 4.685 10.605 0.644 1.00 0.00 C ATOM 0 HA PRO A 341 5.353 8.232 -1.361 1.00 0.00 H new ATOM 0 HB2 PRO A 341 6.008 8.230 1.601 1.00 0.00 H new ATOM 0 HB3 PRO A 341 7.120 8.386 0.255 1.00 0.00 H new ATOM 0 HG2 PRO A 341 6.521 10.511 1.757 1.00 0.00 H new ATOM 0 HG3 PRO A 341 6.743 10.687 0.028 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.175 10.626 1.607 1.00 0.00 H new ATOM 0 HD3 PRO A 341 4.584 11.599 0.209 1.00 0.00 H new ATOM 527 N LEU A 342 4.675 6.010 -0.637 1.00 0.00 N ATOM 528 CA LEU A 342 4.113 4.688 -0.356 1.00 0.00 C ATOM 529 C LEU A 342 4.616 4.160 0.986 1.00 0.00 C ATOM 530 O LEU A 342 3.876 3.504 1.722 1.00 0.00 O ATOM 531 CB LEU A 342 4.483 3.710 -1.481 1.00 0.00 C ATOM 532 CG LEU A 342 3.981 2.265 -1.319 1.00 0.00 C ATOM 533 CD1 LEU A 342 4.899 1.474 -0.397 1.00 0.00 C ATOM 534 CD2 LEU A 342 2.545 2.236 -0.806 1.00 0.00 C ATOM 0 H LEU A 342 5.335 6.027 -1.414 1.00 0.00 H new ATOM 0 HA LEU A 342 3.028 4.778 -0.304 1.00 0.00 H new ATOM 0 HB2 LEU A 342 4.093 4.105 -2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 342 5.569 3.687 -1.571 1.00 0.00 H new ATOM 0 HG LEU A 342 3.995 1.794 -2.302 1.00 0.00 H new ATOM 0 HD11 LEU A 342 4.524 0.455 -0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 342 5.905 1.451 -0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 342 4.926 1.948 0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 342 2.217 1.202 -0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 342 2.495 2.733 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 342 1.896 2.753 -1.513 1.00 0.00 H new ATOM 546 N GLU A 343 5.881 4.451 1.297 1.00 0.00 N ATOM 547 CA GLU A 343 6.486 4.005 2.552 1.00 0.00 C ATOM 548 C GLU A 343 5.690 4.475 3.772 1.00 0.00 C ATOM 549 O GLU A 343 5.807 3.888 4.847 1.00 0.00 O ATOM 550 CB GLU A 343 7.933 4.486 2.660 1.00 0.00 C ATOM 551 CG GLU A 343 8.102 5.992 2.509 1.00 0.00 C ATOM 552 CD GLU A 343 9.542 6.437 2.686 1.00 0.00 C ATOM 553 OE1 GLU A 343 10.385 6.071 1.840 1.00 0.00 O ATOM 554 OE2 GLU A 343 9.825 7.149 3.672 1.00 0.00 O ATOM 0 H GLU A 343 6.504 4.992 0.698 1.00 0.00 H new ATOM 0 HA GLU A 343 6.471 2.915 2.540 1.00 0.00 H new ATOM 0 HB2 GLU A 343 8.334 4.182 3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 343 8.528 3.986 1.896 1.00 0.00 H new ATOM 0 HG2 GLU A 343 7.750 6.297 1.524 1.00 0.00 H new ATOM 0 HG3 GLU A 343 7.476 6.500 3.242 1.00 0.00 H new ATOM 561 N GLU A 344 4.881 5.530 3.603 1.00 0.00 N ATOM 562 CA GLU A 344 4.068 6.063 4.697 1.00 0.00 C ATOM 563 C GLU A 344 3.347 4.939 5.443 1.00 0.00 C ATOM 564 O GLU A 344 3.315 4.921 6.673 1.00 0.00 O ATOM 565 CB GLU A 344 3.046 7.071 4.163 1.00 0.00 C ATOM 566 CG GLU A 344 3.611 8.471 3.974 1.00 0.00 C ATOM 567 CD GLU A 344 4.052 9.109 5.280 1.00 0.00 C ATOM 568 OE1 GLU A 344 3.371 8.900 6.308 1.00 0.00 O ATOM 569 OE2 GLU A 344 5.081 9.816 5.275 1.00 0.00 O ATOM 0 H GLU A 344 4.774 6.028 2.719 1.00 0.00 H new ATOM 0 HA GLU A 344 4.736 6.568 5.394 1.00 0.00 H new ATOM 0 HB2 GLU A 344 2.659 6.713 3.209 1.00 0.00 H new ATOM 0 HB3 GLU A 344 2.202 7.119 4.851 1.00 0.00 H new ATOM 0 HG2 GLU A 344 4.460 8.426 3.292 1.00 0.00 H new ATOM 0 HG3 GLU A 344 2.857 9.102 3.503 1.00 0.00 H new ATOM 576 N ALA A 345 2.783 3.994 4.689 1.00 0.00 N ATOM 577 CA ALA A 345 2.080 2.858 5.280 1.00 0.00 C ATOM 578 C ALA A 345 3.068 1.865 5.888 1.00 0.00 C ATOM 579 O ALA A 345 2.849 1.348 6.984 1.00 0.00 O ATOM 580 CB ALA A 345 1.218 2.163 4.235 1.00 0.00 C ATOM 0 H ALA A 345 2.800 3.994 3.669 1.00 0.00 H new ATOM 0 HA ALA A 345 1.436 3.235 6.074 1.00 0.00 H new ATOM 0 HB1 ALA A 345 0.701 1.319 4.692 1.00 0.00 H new ATOM 0 HB2 ALA A 345 0.485 2.867 3.841 1.00 0.00 H new ATOM 0 HB3 ALA A 345 1.850 1.805 3.422 1.00 0.00 H new ATOM 586 N ARG A 346 4.156 1.605 5.161 1.00 0.00 N ATOM 587 CA ARG A 346 5.188 0.676 5.612 1.00 0.00 C ATOM 588 C ARG A 346 5.741 1.085 6.980 1.00 0.00 C ATOM 589 O ARG A 346 5.787 0.272 7.904 1.00 0.00 O ATOM 590 CB ARG A 346 6.315 0.613 4.579 1.00 0.00 C ATOM 591 CG ARG A 346 7.487 -0.259 4.993 1.00 0.00 C ATOM 592 CD ARG A 346 8.805 0.353 4.554 1.00 0.00 C ATOM 593 NE ARG A 346 9.943 -0.516 4.849 1.00 0.00 N ATOM 594 CZ ARG A 346 11.140 -0.401 4.270 1.00 0.00 C ATOM 595 NH1 ARG A 346 11.364 0.543 3.360 1.00 0.00 N ATOM 596 NH2 ARG A 346 12.118 -1.238 4.603 1.00 0.00 N ATOM 0 H ARG A 346 4.344 2.029 4.252 1.00 0.00 H new ATOM 0 HA ARG A 346 4.740 -0.312 5.716 1.00 0.00 H new ATOM 0 HB2 ARG A 346 5.911 0.238 3.639 1.00 0.00 H new ATOM 0 HB3 ARG A 346 6.677 1.624 4.390 1.00 0.00 H new ATOM 0 HG2 ARG A 346 7.485 -0.387 6.075 1.00 0.00 H new ATOM 0 HG3 ARG A 346 7.379 -1.251 4.554 1.00 0.00 H new ATOM 0 HD2 ARG A 346 8.772 0.554 3.483 1.00 0.00 H new ATOM 0 HD3 ARG A 346 8.943 1.312 5.054 1.00 0.00 H new ATOM 0 HE ARG A 346 9.814 -1.256 5.540 1.00 0.00 H new ATOM 0 HH11 ARG A 346 10.617 1.187 3.099 1.00 0.00 H new ATOM 0 HH12 ARG A 346 12.282 0.623 2.923 1.00 0.00 H new ATOM 0 HH21 ARG A 346 11.952 -1.965 5.299 1.00 0.00 H new ATOM 0 HH22 ARG A 346 13.034 -1.153 4.163 1.00 0.00 H new ATOM 610 N GLN A 347 6.155 2.348 7.102 1.00 0.00 N ATOM 611 CA GLN A 347 6.702 2.859 8.359 1.00 0.00 C ATOM 612 C GLN A 347 5.642 2.869 9.462 1.00 0.00 C ATOM 613 O GLN A 347 5.951 2.624 10.629 1.00 0.00 O ATOM 614 CB GLN A 347 7.282 4.266 8.168 1.00 0.00 C ATOM 615 CG GLN A 347 6.270 5.304 7.696 1.00 0.00 C ATOM 616 CD GLN A 347 6.741 6.729 7.934 1.00 0.00 C ATOM 617 OE1 GLN A 347 7.930 6.977 8.139 1.00 0.00 O ATOM 618 NE2 GLN A 347 5.810 7.676 7.909 1.00 0.00 N ATOM 0 H GLN A 347 6.122 3.034 6.347 1.00 0.00 H new ATOM 0 HA GLN A 347 7.505 2.189 8.665 1.00 0.00 H new ATOM 0 HB2 GLN A 347 7.713 4.599 9.112 1.00 0.00 H new ATOM 0 HB3 GLN A 347 8.097 4.215 7.445 1.00 0.00 H new ATOM 0 HG2 GLN A 347 6.078 5.162 6.633 1.00 0.00 H new ATOM 0 HG3 GLN A 347 5.324 5.146 8.215 1.00 0.00 H new ATOM 0 HE21 GLN A 347 4.836 7.429 7.736 1.00 0.00 H new ATOM 0 HE22 GLN A 347 6.069 8.650 8.063 1.00 0.00 H new ATOM 627 N PHE A 348 4.392 3.147 9.082 1.00 0.00 N ATOM 628 CA PHE A 348 3.284 3.180 10.036 1.00 0.00 C ATOM 629 C PHE A 348 3.138 1.836 10.749 1.00 0.00 C ATOM 630 O PHE A 348 2.985 1.787 11.970 1.00 0.00 O ATOM 631 CB PHE A 348 1.978 3.537 9.319 1.00 0.00 C ATOM 632 CG PHE A 348 0.862 3.935 10.248 1.00 0.00 C ATOM 633 CD1 PHE A 348 0.774 5.231 10.735 1.00 0.00 C ATOM 634 CD2 PHE A 348 -0.099 3.013 10.634 1.00 0.00 C ATOM 635 CE1 PHE A 348 -0.252 5.599 11.585 1.00 0.00 C ATOM 636 CE2 PHE A 348 -1.127 3.376 11.484 1.00 0.00 C ATOM 637 CZ PHE A 348 -1.203 4.670 11.961 1.00 0.00 C ATOM 0 H PHE A 348 4.123 3.352 8.120 1.00 0.00 H new ATOM 0 HA PHE A 348 3.501 3.944 10.783 1.00 0.00 H new ATOM 0 HB2 PHE A 348 2.168 4.355 8.624 1.00 0.00 H new ATOM 0 HB3 PHE A 348 1.656 2.682 8.725 1.00 0.00 H new ATOM 0 HD1 PHE A 348 1.516 5.961 10.447 1.00 0.00 H new ATOM 0 HD2 PHE A 348 -0.044 1.999 10.266 1.00 0.00 H new ATOM 0 HE1 PHE A 348 -0.310 6.612 11.955 1.00 0.00 H new ATOM 0 HE2 PHE A 348 -1.870 2.648 11.775 1.00 0.00 H new ATOM 0 HZ PHE A 348 -2.004 4.955 12.627 1.00 0.00 H new ATOM 647 N ALA A 349 3.195 0.747 9.978 1.00 0.00 N ATOM 648 CA ALA A 349 3.079 -0.599 10.537 1.00 0.00 C ATOM 649 C ALA A 349 4.208 -0.887 11.524 1.00 0.00 C ATOM 650 O ALA A 349 3.982 -1.471 12.584 1.00 0.00 O ATOM 651 CB ALA A 349 3.072 -1.638 9.426 1.00 0.00 C ATOM 0 H ALA A 349 3.321 0.773 8.966 1.00 0.00 H new ATOM 0 HA ALA A 349 2.134 -0.656 11.078 1.00 0.00 H new ATOM 0 HB1 ALA A 349 2.985 -2.634 9.860 1.00 0.00 H new ATOM 0 HB2 ALA A 349 2.226 -1.456 8.763 1.00 0.00 H new ATOM 0 HB3 ALA A 349 4.000 -1.569 8.858 1.00 0.00 H new ATOM 657 N ALA A 350 5.425 -0.465 11.169 1.00 0.00 N ATOM 658 CA ALA A 350 6.590 -0.669 12.027 1.00 0.00 C ATOM 659 C ALA A 350 6.414 0.035 13.372 1.00 0.00 C ATOM 660 O ALA A 350 6.899 -0.444 14.395 1.00 0.00 O ATOM 661 CB ALA A 350 7.856 -0.182 11.337 1.00 0.00 C ATOM 0 H ALA A 350 5.626 0.019 10.294 1.00 0.00 H new ATOM 0 HA ALA A 350 6.684 -1.739 12.214 1.00 0.00 H new ATOM 0 HB1 ALA A 350 8.712 -0.343 11.992 1.00 0.00 H new ATOM 0 HB2 ALA A 350 8.000 -0.735 10.409 1.00 0.00 H new ATOM 0 HB3 ALA A 350 7.763 0.881 11.115 1.00 0.00 H new ATOM 667 N GLN A 351 5.711 1.169 13.362 1.00 0.00 N ATOM 668 CA GLN A 351 5.463 1.927 14.587 1.00 0.00 C ATOM 669 C GLN A 351 4.477 1.192 15.498 1.00 0.00 C ATOM 670 O GLN A 351 4.536 1.329 16.719 1.00 0.00 O ATOM 671 CB GLN A 351 4.923 3.321 14.250 1.00 0.00 C ATOM 672 CG GLN A 351 5.962 4.424 14.383 1.00 0.00 C ATOM 673 CD GLN A 351 5.399 5.803 14.094 1.00 0.00 C ATOM 674 OE1 GLN A 351 4.717 6.011 13.089 1.00 0.00 O ATOM 675 NE2 GLN A 351 5.686 6.756 14.974 1.00 0.00 N ATOM 0 H GLN A 351 5.305 1.581 12.522 1.00 0.00 H new ATOM 0 HA GLN A 351 6.410 2.029 15.117 1.00 0.00 H new ATOM 0 HB2 GLN A 351 4.539 3.316 13.230 1.00 0.00 H new ATOM 0 HB3 GLN A 351 4.082 3.544 14.906 1.00 0.00 H new ATOM 0 HG2 GLN A 351 6.373 4.409 15.392 1.00 0.00 H new ATOM 0 HG3 GLN A 351 6.787 4.223 13.700 1.00 0.00 H new ATOM 0 HE21 GLN A 351 6.254 6.540 15.793 1.00 0.00 H new ATOM 0 HE22 GLN A 351 5.338 7.704 14.831 1.00 0.00 H new ATOM 684 N THR A 352 3.566 0.421 14.898 1.00 0.00 N ATOM 685 CA THR A 352 2.566 -0.322 15.663 1.00 0.00 C ATOM 686 C THR A 352 3.209 -1.384 16.560 1.00 0.00 C ATOM 687 O THR A 352 3.002 -1.381 17.774 1.00 0.00 O ATOM 688 CB THR A 352 1.547 -0.986 14.729 1.00 0.00 C ATOM 689 OG1 THR A 352 1.430 -0.273 13.510 1.00 0.00 O ATOM 690 CG2 THR A 352 0.162 -1.087 15.332 1.00 0.00 C ATOM 0 H THR A 352 3.502 0.296 13.888 1.00 0.00 H new ATOM 0 HA THR A 352 2.054 0.399 16.300 1.00 0.00 H new ATOM 0 HB THR A 352 1.932 -1.991 14.559 1.00 0.00 H new ATOM 0 HG1 THR A 352 0.776 -0.718 12.932 1.00 0.00 H new ATOM 0 HG21 THR A 352 -0.511 -1.566 14.620 1.00 0.00 H new ATOM 0 HG22 THR A 352 0.205 -1.680 16.246 1.00 0.00 H new ATOM 0 HG23 THR A 352 -0.207 -0.088 15.565 1.00 0.00 H new ATOM 698 N VAL A 353 3.976 -2.296 15.959 1.00 0.00 N ATOM 699 CA VAL A 353 4.629 -3.365 16.721 1.00 0.00 C ATOM 700 C VAL A 353 6.012 -2.950 17.222 1.00 0.00 C ATOM 701 O VAL A 353 6.373 -3.229 18.367 1.00 0.00 O ATOM 702 CB VAL A 353 4.754 -4.669 15.894 1.00 0.00 C ATOM 703 CG1 VAL A 353 3.376 -5.206 15.534 1.00 0.00 C ATOM 704 CG2 VAL A 353 5.595 -4.454 14.641 1.00 0.00 C ATOM 0 H VAL A 353 4.160 -2.317 14.956 1.00 0.00 H new ATOM 0 HA VAL A 353 3.988 -3.554 17.582 1.00 0.00 H new ATOM 0 HB VAL A 353 5.264 -5.409 16.510 1.00 0.00 H new ATOM 0 HG11 VAL A 353 3.483 -6.122 14.953 1.00 0.00 H new ATOM 0 HG12 VAL A 353 2.818 -5.418 16.446 1.00 0.00 H new ATOM 0 HG13 VAL A 353 2.839 -4.463 14.944 1.00 0.00 H new ATOM 0 HG21 VAL A 353 5.663 -5.388 14.084 1.00 0.00 H new ATOM 0 HG22 VAL A 353 5.129 -3.692 14.016 1.00 0.00 H new ATOM 0 HG23 VAL A 353 6.595 -4.128 14.926 1.00 0.00 H new ATOM 714 N GLY A 354 6.786 -2.293 16.361 1.00 0.00 N ATOM 715 CA GLY A 354 8.120 -1.859 16.732 1.00 0.00 C ATOM 716 C GLY A 354 9.180 -2.880 16.363 1.00 0.00 C ATOM 717 O GLY A 354 10.174 -2.548 15.715 1.00 0.00 O ATOM 0 H GLY A 354 6.510 -2.053 15.409 1.00 0.00 H new ATOM 0 HA2 GLY A 354 8.342 -0.913 16.239 1.00 0.00 H new ATOM 0 HA3 GLY A 354 8.154 -1.674 17.806 1.00 0.00 H new ATOM 721 N ASN A 355 8.962 -4.128 16.779 1.00 0.00 N ATOM 722 CA ASN A 355 9.900 -5.209 16.492 1.00 0.00 C ATOM 723 C ASN A 355 9.251 -6.573 16.722 1.00 0.00 C ATOM 724 O ASN A 355 9.330 -7.132 17.819 1.00 0.00 O ATOM 725 CB ASN A 355 11.155 -5.068 17.359 1.00 0.00 C ATOM 726 CG ASN A 355 12.426 -5.391 16.595 1.00 0.00 C ATOM 727 OD1 ASN A 355 13.164 -6.305 16.958 1.00 0.00 O ATOM 728 ND2 ASN A 355 12.686 -4.641 15.529 1.00 0.00 N ATOM 0 H ASN A 355 8.143 -4.413 17.316 1.00 0.00 H new ATOM 0 HA ASN A 355 10.185 -5.140 15.442 1.00 0.00 H new ATOM 0 HB2 ASN A 355 11.215 -4.050 17.744 1.00 0.00 H new ATOM 0 HB3 ASN A 355 11.074 -5.731 18.221 1.00 0.00 H new ATOM 0 HD21 ASN A 355 13.526 -4.814 14.976 1.00 0.00 H new ATOM 0 HD22 ASN A 355 12.046 -3.893 15.264 1.00 0.00 H new ATOM 735 N THR A 356 8.607 -7.102 15.683 1.00 0.00 N ATOM 736 CA THR A 356 7.942 -8.400 15.773 1.00 0.00 C ATOM 737 C THR A 356 8.054 -9.172 14.458 1.00 0.00 C ATOM 738 O THR A 356 8.560 -10.293 14.429 1.00 0.00 O ATOM 739 CB THR A 356 6.468 -8.225 16.150 1.00 0.00 C ATOM 740 OG1 THR A 356 6.330 -7.319 17.234 1.00 0.00 O ATOM 741 CG2 THR A 356 5.794 -9.521 16.547 1.00 0.00 C ATOM 0 H THR A 356 8.532 -6.652 14.771 1.00 0.00 H new ATOM 0 HA THR A 356 8.443 -8.974 16.552 1.00 0.00 H new ATOM 0 HB THR A 356 5.984 -7.842 15.251 1.00 0.00 H new ATOM 0 HG1 THR A 356 5.393 -7.293 17.521 1.00 0.00 H new ATOM 0 HG21 THR A 356 4.752 -9.326 16.802 1.00 0.00 H new ATOM 0 HG22 THR A 356 5.839 -10.224 15.715 1.00 0.00 H new ATOM 0 HG23 THR A 356 6.305 -9.947 17.410 1.00 0.00 H new ATOM 749 N TYR A 357 7.574 -8.563 13.372 1.00 0.00 N ATOM 750 CA TYR A 357 7.617 -9.194 12.052 1.00 0.00 C ATOM 751 C TYR A 357 9.051 -9.302 11.534 1.00 0.00 C ATOM 752 O TYR A 357 9.393 -10.256 10.832 1.00 0.00 O ATOM 753 CB TYR A 357 6.760 -8.407 11.054 1.00 0.00 C ATOM 754 CG TYR A 357 5.343 -8.156 11.529 1.00 0.00 C ATOM 755 CD1 TYR A 357 4.429 -9.198 11.635 1.00 0.00 C ATOM 756 CD2 TYR A 357 4.924 -6.878 11.878 1.00 0.00 C ATOM 757 CE1 TYR A 357 3.137 -8.972 12.069 1.00 0.00 C ATOM 758 CE2 TYR A 357 3.633 -6.645 12.313 1.00 0.00 C ATOM 759 CZ TYR A 357 2.745 -7.695 12.409 1.00 0.00 C ATOM 760 OH TYR A 357 1.460 -7.466 12.843 1.00 0.00 O ATOM 0 H TYR A 357 7.152 -7.635 13.381 1.00 0.00 H new ATOM 0 HA TYR A 357 7.214 -10.202 12.154 1.00 0.00 H new ATOM 0 HB2 TYR A 357 7.241 -7.450 10.853 1.00 0.00 H new ATOM 0 HB3 TYR A 357 6.726 -8.951 10.110 1.00 0.00 H new ATOM 0 HD1 TYR A 357 4.734 -10.201 11.374 1.00 0.00 H new ATOM 0 HD2 TYR A 357 5.618 -6.054 11.808 1.00 0.00 H new ATOM 0 HE1 TYR A 357 2.438 -9.792 12.142 1.00 0.00 H new ATOM 0 HE2 TYR A 357 3.321 -5.645 12.576 1.00 0.00 H new ATOM 0 HH TYR A 357 1.409 -6.582 13.262 1.00 0.00 H new ATOM 770 N GLY A 358 9.887 -8.320 11.881 1.00 0.00 N ATOM 771 CA GLY A 358 11.271 -8.330 11.442 1.00 0.00 C ATOM 772 C GLY A 358 11.426 -7.893 9.997 1.00 0.00 C ATOM 773 O GLY A 358 11.096 -6.758 9.646 1.00 0.00 O ATOM 0 H GLY A 358 9.627 -7.520 12.458 1.00 0.00 H new ATOM 0 HA2 GLY A 358 11.857 -7.670 12.082 1.00 0.00 H new ATOM 0 HA3 GLY A 358 11.679 -9.334 11.560 1.00 0.00 H new ATOM 777 N ASN A 359 11.929 -8.797 9.157 1.00 0.00 N ATOM 778 CA ASN A 359 12.131 -8.503 7.740 1.00 0.00 C ATOM 779 C ASN A 359 10.932 -8.965 6.912 1.00 0.00 C ATOM 780 O ASN A 359 11.005 -9.960 6.190 1.00 0.00 O ATOM 781 CB ASN A 359 13.417 -9.169 7.237 1.00 0.00 C ATOM 782 CG ASN A 359 14.621 -8.252 7.340 1.00 0.00 C ATOM 783 OD1 ASN A 359 14.765 -7.309 6.564 1.00 0.00 O ATOM 784 ND2 ASN A 359 15.496 -8.525 8.304 1.00 0.00 N ATOM 0 H ASN A 359 12.204 -9.739 9.434 1.00 0.00 H new ATOM 0 HA ASN A 359 12.227 -7.423 7.625 1.00 0.00 H new ATOM 0 HB2 ASN A 359 13.603 -10.075 7.814 1.00 0.00 H new ATOM 0 HB3 ASN A 359 13.283 -9.474 6.199 1.00 0.00 H new ATOM 0 HD21 ASN A 359 16.325 -7.942 8.421 1.00 0.00 H new ATOM 0 HD22 ASN A 359 15.338 -9.317 8.927 1.00 0.00 H new ATOM 791 N PHE A 360 9.828 -8.229 7.022 1.00 0.00 N ATOM 792 CA PHE A 360 8.610 -8.555 6.286 1.00 0.00 C ATOM 793 C PHE A 360 8.625 -7.933 4.893 1.00 0.00 C ATOM 794 O PHE A 360 9.298 -6.931 4.656 1.00 0.00 O ATOM 795 CB PHE A 360 7.372 -8.079 7.055 1.00 0.00 C ATOM 796 CG PHE A 360 7.358 -6.601 7.351 1.00 0.00 C ATOM 797 CD1 PHE A 360 6.845 -5.702 6.431 1.00 0.00 C ATOM 798 CD2 PHE A 360 7.858 -6.115 8.550 1.00 0.00 C ATOM 799 CE1 PHE A 360 6.830 -4.345 6.699 1.00 0.00 C ATOM 800 CE2 PHE A 360 7.846 -4.760 8.823 1.00 0.00 C ATOM 801 CZ PHE A 360 7.331 -3.875 7.897 1.00 0.00 C ATOM 0 H PHE A 360 9.753 -7.402 7.615 1.00 0.00 H new ATOM 0 HA PHE A 360 8.568 -9.639 6.179 1.00 0.00 H new ATOM 0 HB2 PHE A 360 6.481 -8.331 6.479 1.00 0.00 H new ATOM 0 HB3 PHE A 360 7.309 -8.627 7.995 1.00 0.00 H new ATOM 0 HD1 PHE A 360 6.452 -6.065 5.493 1.00 0.00 H new ATOM 0 HD2 PHE A 360 8.261 -6.803 9.278 1.00 0.00 H new ATOM 0 HE1 PHE A 360 6.427 -3.654 5.973 1.00 0.00 H new ATOM 0 HE2 PHE A 360 8.239 -4.394 9.760 1.00 0.00 H new ATOM 0 HZ PHE A 360 7.320 -2.816 8.109 1.00 0.00 H new ATOM 811 N SER A 361 7.866 -8.534 3.980 1.00 0.00 N ATOM 812 CA SER A 361 7.777 -8.040 2.612 1.00 0.00 C ATOM 813 C SER A 361 6.361 -7.562 2.307 1.00 0.00 C ATOM 814 O SER A 361 5.389 -8.243 2.634 1.00 0.00 O ATOM 815 CB SER A 361 8.184 -9.136 1.620 1.00 0.00 C ATOM 816 OG SER A 361 7.902 -8.753 0.283 1.00 0.00 O ATOM 0 H SER A 361 7.304 -9.365 4.165 1.00 0.00 H new ATOM 0 HA SER A 361 8.461 -7.198 2.508 1.00 0.00 H new ATOM 0 HB2 SER A 361 9.249 -9.346 1.723 1.00 0.00 H new ATOM 0 HB3 SER A 361 7.653 -10.058 1.856 1.00 0.00 H new ATOM 0 HG SER A 361 8.593 -8.134 -0.033 1.00 0.00 H new ATOM 822 N LEU A 362 6.252 -6.392 1.679 1.00 0.00 N ATOM 823 CA LEU A 362 4.951 -5.826 1.322 1.00 0.00 C ATOM 824 C LEU A 362 4.660 -6.028 -0.163 1.00 0.00 C ATOM 825 O LEU A 362 5.542 -5.853 -1.005 1.00 0.00 O ATOM 826 CB LEU A 362 4.899 -4.330 1.653 1.00 0.00 C ATOM 827 CG LEU A 362 5.480 -3.929 3.012 1.00 0.00 C ATOM 828 CD1 LEU A 362 5.705 -2.426 3.070 1.00 0.00 C ATOM 829 CD2 LEU A 362 4.562 -4.374 4.140 1.00 0.00 C ATOM 0 H LEU A 362 7.049 -5.817 1.407 1.00 0.00 H new ATOM 0 HA LEU A 362 4.193 -6.347 1.907 1.00 0.00 H new ATOM 0 HB2 LEU A 362 5.434 -3.786 0.875 1.00 0.00 H new ATOM 0 HB3 LEU A 362 3.860 -4.004 1.612 1.00 0.00 H new ATOM 0 HG LEU A 362 6.441 -4.428 3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 362 6.118 -2.157 4.042 1.00 0.00 H new ATOM 0 HD12 LEU A 362 6.402 -2.132 2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 362 4.756 -1.910 2.924 1.00 0.00 H new ATOM 0 HD21 LEU A 362 4.993 -4.080 5.097 1.00 0.00 H new ATOM 0 HD22 LEU A 362 3.586 -3.904 4.021 1.00 0.00 H new ATOM 0 HD23 LEU A 362 4.449 -5.458 4.111 1.00 0.00 H new ATOM 841 N ALA A 363 3.419 -6.393 -0.479 1.00 0.00 N ATOM 842 CA ALA A 363 3.011 -6.613 -1.866 1.00 0.00 C ATOM 843 C ALA A 363 1.508 -6.403 -2.038 1.00 0.00 C ATOM 844 O ALA A 363 0.740 -6.570 -1.092 1.00 0.00 O ATOM 845 CB ALA A 363 3.404 -8.014 -2.317 1.00 0.00 C ATOM 0 H ALA A 363 2.678 -6.543 0.206 1.00 0.00 H new ATOM 0 HA ALA A 363 3.527 -5.883 -2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 363 3.094 -8.164 -3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.485 -8.131 -2.242 1.00 0.00 H new ATOM 0 HB3 ALA A 363 2.914 -8.752 -1.681 1.00 0.00 H new ATOM 851 N THR A 364 1.096 -6.040 -3.253 1.00 0.00 N ATOM 852 CA THR A 364 -0.319 -5.812 -3.547 1.00 0.00 C ATOM 853 C THR A 364 -1.113 -7.117 -3.438 1.00 0.00 C ATOM 854 O THR A 364 -0.538 -8.207 -3.461 1.00 0.00 O ATOM 855 CB THR A 364 -0.484 -5.193 -4.942 1.00 0.00 C ATOM 856 OG1 THR A 364 -1.802 -4.694 -5.121 1.00 0.00 O ATOM 857 CG2 THR A 364 -0.196 -6.157 -6.076 1.00 0.00 C ATOM 0 H THR A 364 1.720 -5.898 -4.047 1.00 0.00 H new ATOM 0 HA THR A 364 -0.714 -5.112 -2.810 1.00 0.00 H new ATOM 0 HB THR A 364 0.252 -4.390 -4.983 1.00 0.00 H new ATOM 0 HG1 THR A 364 -1.885 -4.302 -6.016 1.00 0.00 H new ATOM 0 HG21 THR A 364 -0.334 -5.648 -7.030 1.00 0.00 H new ATOM 0 HG22 THR A 364 0.832 -6.513 -5.999 1.00 0.00 H new ATOM 0 HG23 THR A 364 -0.879 -7.005 -6.015 1.00 0.00 H new ATOM 865 N MET A 365 -2.434 -6.994 -3.311 1.00 0.00 N ATOM 866 CA MET A 365 -3.307 -8.162 -3.189 1.00 0.00 C ATOM 867 C MET A 365 -3.089 -9.135 -4.350 1.00 0.00 C ATOM 868 O MET A 365 -2.567 -10.236 -4.155 1.00 0.00 O ATOM 869 CB MET A 365 -4.776 -7.729 -3.123 1.00 0.00 C ATOM 870 CG MET A 365 -5.629 -8.615 -2.232 1.00 0.00 C ATOM 871 SD MET A 365 -7.381 -8.538 -2.650 1.00 0.00 S ATOM 872 CE MET A 365 -7.882 -7.066 -1.761 1.00 0.00 C ATOM 0 H MET A 365 -2.923 -6.099 -3.290 1.00 0.00 H new ATOM 0 HA MET A 365 -3.053 -8.678 -2.263 1.00 0.00 H new ATOM 0 HB2 MET A 365 -4.828 -6.703 -2.759 1.00 0.00 H new ATOM 0 HB3 MET A 365 -5.193 -7.731 -4.130 1.00 0.00 H new ATOM 0 HG2 MET A 365 -5.285 -9.646 -2.315 1.00 0.00 H new ATOM 0 HG3 MET A 365 -5.494 -8.316 -1.193 1.00 0.00 H new ATOM 0 HE1 MET A 365 -8.937 -6.867 -1.951 1.00 0.00 H new ATOM 0 HE2 MET A 365 -7.728 -7.216 -0.692 1.00 0.00 H new ATOM 0 HE3 MET A 365 -7.286 -6.217 -2.097 1.00 0.00 H new ATOM 882 N PHE A 366 -3.485 -8.720 -5.555 1.00 0.00 N ATOM 883 CA PHE A 366 -3.333 -9.547 -6.748 1.00 0.00 C ATOM 884 C PHE A 366 -3.255 -8.675 -8.003 1.00 0.00 C ATOM 885 O PHE A 366 -4.017 -7.715 -8.143 1.00 0.00 O ATOM 886 CB PHE A 366 -4.504 -10.526 -6.869 1.00 0.00 C ATOM 887 CG PHE A 366 -4.360 -11.753 -6.013 1.00 0.00 C ATOM 888 CD1 PHE A 366 -3.566 -12.812 -6.422 1.00 0.00 C ATOM 889 CD2 PHE A 366 -5.018 -11.844 -4.797 1.00 0.00 C ATOM 890 CE1 PHE A 366 -3.432 -13.940 -5.635 1.00 0.00 C ATOM 891 CE2 PHE A 366 -4.888 -12.968 -4.006 1.00 0.00 C ATOM 892 CZ PHE A 366 -4.093 -14.018 -4.424 1.00 0.00 C ATOM 0 H PHE A 366 -3.915 -7.811 -5.728 1.00 0.00 H new ATOM 0 HA PHE A 366 -2.405 -10.111 -6.655 1.00 0.00 H new ATOM 0 HB2 PHE A 366 -5.425 -10.011 -6.597 1.00 0.00 H new ATOM 0 HB3 PHE A 366 -4.604 -10.831 -7.911 1.00 0.00 H new ATOM 0 HD1 PHE A 366 -3.046 -12.755 -7.367 1.00 0.00 H new ATOM 0 HD2 PHE A 366 -5.640 -11.026 -4.464 1.00 0.00 H new ATOM 0 HE1 PHE A 366 -2.811 -14.760 -5.966 1.00 0.00 H new ATOM 0 HE2 PHE A 366 -5.407 -13.027 -3.061 1.00 0.00 H new ATOM 0 HZ PHE A 366 -3.988 -14.897 -3.806 1.00 0.00 H new ATOM 902 N PRO A 367 -2.333 -8.991 -8.936 1.00 0.00 N ATOM 903 CA PRO A 367 -1.408 -10.123 -8.805 1.00 0.00 C ATOM 904 C PRO A 367 -0.254 -9.827 -7.845 1.00 0.00 C ATOM 905 O PRO A 367 -0.214 -8.768 -7.218 1.00 0.00 O ATOM 906 CB PRO A 367 -0.893 -10.310 -10.232 1.00 0.00 C ATOM 907 CG PRO A 367 -0.937 -8.944 -10.825 1.00 0.00 C ATOM 908 CD PRO A 367 -2.124 -8.257 -10.202 1.00 0.00 C ATOM 0 HA PRO A 367 -1.892 -11.007 -8.390 1.00 0.00 H new ATOM 0 HB2 PRO A 367 0.119 -10.714 -10.239 1.00 0.00 H new ATOM 0 HB3 PRO A 367 -1.518 -11.006 -10.792 1.00 0.00 H new ATOM 0 HG2 PRO A 367 -0.017 -8.398 -10.616 1.00 0.00 H new ATOM 0 HG3 PRO A 367 -1.039 -8.993 -11.909 1.00 0.00 H new ATOM 0 HD2 PRO A 367 -1.926 -7.200 -10.023 1.00 0.00 H new ATOM 0 HD3 PRO A 367 -3.002 -8.313 -10.846 1.00 0.00 H new ATOM 916 N ARG A 368 0.681 -10.769 -7.733 1.00 0.00 N ATOM 917 CA ARG A 368 1.829 -10.604 -6.847 1.00 0.00 C ATOM 918 C ARG A 368 2.967 -9.864 -7.550 1.00 0.00 C ATOM 919 O ARG A 368 3.673 -10.437 -8.381 1.00 0.00 O ATOM 920 CB ARG A 368 2.318 -11.967 -6.342 1.00 0.00 C ATOM 921 CG ARG A 368 2.826 -11.936 -4.910 1.00 0.00 C ATOM 922 CD ARG A 368 1.685 -11.762 -3.917 1.00 0.00 C ATOM 923 NE ARG A 368 1.682 -12.806 -2.893 1.00 0.00 N ATOM 924 CZ ARG A 368 0.624 -13.104 -2.134 1.00 0.00 C ATOM 925 NH1 ARG A 368 -0.517 -12.433 -2.270 1.00 0.00 N ATOM 926 NH2 ARG A 368 0.710 -14.076 -1.233 1.00 0.00 N ATOM 0 H ARG A 368 0.665 -11.652 -8.244 1.00 0.00 H new ATOM 0 HA ARG A 368 1.509 -10.005 -5.994 1.00 0.00 H new ATOM 0 HB2 ARG A 368 1.502 -12.686 -6.414 1.00 0.00 H new ATOM 0 HB3 ARG A 368 3.115 -12.323 -6.994 1.00 0.00 H new ATOM 0 HG2 ARG A 368 3.361 -12.860 -4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 368 3.539 -11.120 -4.793 1.00 0.00 H new ATOM 0 HD2 ARG A 368 1.767 -10.786 -3.439 1.00 0.00 H new ATOM 0 HD3 ARG A 368 0.735 -11.776 -4.451 1.00 0.00 H new ATOM 0 HE ARG A 368 2.540 -13.339 -2.750 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -0.589 -11.684 -2.958 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -1.319 -12.668 -1.686 1.00 0.00 H new ATOM 0 HH21 ARG A 368 1.582 -14.593 -1.122 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -0.096 -14.306 -0.652 1.00 0.00 H new ATOM 940 N ARG A 369 3.138 -8.587 -7.207 1.00 0.00 N ATOM 941 CA ARG A 369 4.192 -7.765 -7.800 1.00 0.00 C ATOM 942 C ARG A 369 5.358 -7.558 -6.830 1.00 0.00 C ATOM 943 O ARG A 369 6.474 -7.255 -7.255 1.00 0.00 O ATOM 944 CB ARG A 369 3.629 -6.408 -8.233 1.00 0.00 C ATOM 945 CG ARG A 369 3.181 -5.529 -7.072 1.00 0.00 C ATOM 946 CD ARG A 369 2.928 -4.098 -7.519 1.00 0.00 C ATOM 947 NE ARG A 369 4.170 -3.332 -7.635 1.00 0.00 N ATOM 948 CZ ARG A 369 4.864 -3.190 -8.771 1.00 0.00 C ATOM 949 NH1 ARG A 369 4.442 -3.754 -9.901 1.00 0.00 N ATOM 950 NH2 ARG A 369 5.986 -2.479 -8.776 1.00 0.00 N ATOM 0 H ARG A 369 2.560 -8.100 -6.522 1.00 0.00 H new ATOM 0 HA ARG A 369 4.569 -8.295 -8.674 1.00 0.00 H new ATOM 0 HB2 ARG A 369 4.388 -5.877 -8.807 1.00 0.00 H new ATOM 0 HB3 ARG A 369 2.782 -6.572 -8.900 1.00 0.00 H new ATOM 0 HG2 ARG A 369 2.272 -5.940 -6.633 1.00 0.00 H new ATOM 0 HG3 ARG A 369 3.943 -5.538 -6.293 1.00 0.00 H new ATOM 0 HD2 ARG A 369 2.415 -4.104 -8.481 1.00 0.00 H new ATOM 0 HD3 ARG A 369 2.265 -3.608 -6.807 1.00 0.00 H new ATOM 0 HE ARG A 369 4.530 -2.877 -6.796 1.00 0.00 H new ATOM 0 HH11 ARG A 369 3.581 -4.301 -9.907 1.00 0.00 H new ATOM 0 HH12 ARG A 369 4.979 -3.639 -10.760 1.00 0.00 H new ATOM 0 HH21 ARG A 369 6.317 -2.043 -7.916 1.00 0.00 H new ATOM 0 HH22 ARG A 369 6.516 -2.369 -9.640 1.00 0.00 H new ATOM 964 N GLU A 370 5.092 -7.718 -5.527 1.00 0.00 N ATOM 965 CA GLU A 370 6.115 -7.545 -4.495 1.00 0.00 C ATOM 966 C GLU A 370 6.563 -6.089 -4.399 1.00 0.00 C ATOM 967 O GLU A 370 6.316 -5.289 -5.305 1.00 0.00 O ATOM 968 CB GLU A 370 7.321 -8.446 -4.773 1.00 0.00 C ATOM 969 CG GLU A 370 7.268 -9.781 -4.049 1.00 0.00 C ATOM 970 CD GLU A 370 8.276 -10.780 -4.585 1.00 0.00 C ATOM 971 OE1 GLU A 370 9.454 -10.403 -4.767 1.00 0.00 O ATOM 972 OE2 GLU A 370 7.886 -11.943 -4.822 1.00 0.00 O ATOM 0 H GLU A 370 4.172 -7.968 -5.164 1.00 0.00 H new ATOM 0 HA GLU A 370 5.672 -7.831 -3.541 1.00 0.00 H new ATOM 0 HB2 GLU A 370 7.388 -8.627 -5.846 1.00 0.00 H new ATOM 0 HB3 GLU A 370 8.230 -7.921 -4.481 1.00 0.00 H new ATOM 0 HG2 GLU A 370 7.452 -9.621 -2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 370 6.265 -10.199 -4.140 1.00 0.00 H new ATOM 979 N PHE A 371 7.223 -5.751 -3.293 1.00 0.00 N ATOM 980 CA PHE A 371 7.705 -4.390 -3.075 1.00 0.00 C ATOM 981 C PHE A 371 8.911 -4.089 -3.961 1.00 0.00 C ATOM 982 O PHE A 371 9.561 -4.999 -4.479 1.00 0.00 O ATOM 983 CB PHE A 371 8.071 -4.169 -1.602 1.00 0.00 C ATOM 984 CG PHE A 371 9.276 -4.945 -1.142 1.00 0.00 C ATOM 985 CD1 PHE A 371 10.558 -4.511 -1.447 1.00 0.00 C ATOM 986 CD2 PHE A 371 9.125 -6.105 -0.402 1.00 0.00 C ATOM 987 CE1 PHE A 371 11.664 -5.223 -1.023 1.00 0.00 C ATOM 988 CE2 PHE A 371 10.227 -6.820 0.024 1.00 0.00 C ATOM 989 CZ PHE A 371 11.498 -6.379 -0.287 1.00 0.00 C ATOM 0 H PHE A 371 7.436 -6.400 -2.535 1.00 0.00 H new ATOM 0 HA PHE A 371 6.898 -3.708 -3.341 1.00 0.00 H new ATOM 0 HB2 PHE A 371 8.254 -3.107 -1.440 1.00 0.00 H new ATOM 0 HB3 PHE A 371 7.218 -4.444 -0.982 1.00 0.00 H new ATOM 0 HD1 PHE A 371 10.693 -3.607 -2.022 1.00 0.00 H new ATOM 0 HD2 PHE A 371 8.134 -6.455 -0.155 1.00 0.00 H new ATOM 0 HE1 PHE A 371 12.657 -4.875 -1.267 1.00 0.00 H new ATOM 0 HE2 PHE A 371 10.095 -7.724 0.600 1.00 0.00 H new ATOM 0 HZ PHE A 371 12.361 -6.937 0.045 1.00 0.00 H new ATOM 999 N THR A 372 9.205 -2.802 -4.123 1.00 0.00 N ATOM 1000 CA THR A 372 10.332 -2.366 -4.937 1.00 0.00 C ATOM 1001 C THR A 372 10.958 -1.109 -4.344 1.00 0.00 C ATOM 1002 O THR A 372 10.272 -0.307 -3.706 1.00 0.00 O ATOM 1003 CB THR A 372 9.886 -2.102 -6.381 1.00 0.00 C ATOM 1004 OG1 THR A 372 8.804 -2.947 -6.744 1.00 0.00 O ATOM 1005 CG2 THR A 372 10.990 -2.315 -7.394 1.00 0.00 C ATOM 0 H THR A 372 8.675 -2.041 -3.699 1.00 0.00 H new ATOM 0 HA THR A 372 11.077 -3.161 -4.944 1.00 0.00 H new ATOM 0 HB THR A 372 9.588 -1.054 -6.400 1.00 0.00 H new ATOM 0 HG1 THR A 372 8.537 -2.758 -7.668 1.00 0.00 H new ATOM 0 HG21 THR A 372 10.609 -2.112 -8.395 1.00 0.00 H new ATOM 0 HG22 THR A 372 11.818 -1.640 -7.177 1.00 0.00 H new ATOM 0 HG23 THR A 372 11.339 -3.346 -7.341 1.00 0.00 H new ATOM 1013 N LYS A 373 12.262 -0.941 -4.557 1.00 0.00 N ATOM 1014 CA LYS A 373 12.981 0.223 -4.039 1.00 0.00 C ATOM 1015 C LYS A 373 12.322 1.527 -4.489 1.00 0.00 C ATOM 1016 O LYS A 373 12.277 2.499 -3.733 1.00 0.00 O ATOM 1017 CB LYS A 373 14.445 0.192 -4.490 1.00 0.00 C ATOM 1018 CG LYS A 373 15.386 0.954 -3.568 1.00 0.00 C ATOM 1019 CD LYS A 373 15.449 0.321 -2.187 1.00 0.00 C ATOM 1020 CE LYS A 373 15.306 1.361 -1.086 1.00 0.00 C ATOM 1021 NZ LYS A 373 16.627 1.779 -0.537 1.00 0.00 N ATOM 0 H LYS A 373 12.842 -1.594 -5.084 1.00 0.00 H new ATOM 0 HA LYS A 373 12.943 0.180 -2.951 1.00 0.00 H new ATOM 0 HB2 LYS A 373 14.774 -0.845 -4.554 1.00 0.00 H new ATOM 0 HB3 LYS A 373 14.516 0.611 -5.494 1.00 0.00 H new ATOM 0 HG2 LYS A 373 16.385 0.977 -4.004 1.00 0.00 H new ATOM 0 HG3 LYS A 373 15.052 1.988 -3.480 1.00 0.00 H new ATOM 0 HD2 LYS A 373 14.658 -0.422 -2.091 1.00 0.00 H new ATOM 0 HD3 LYS A 373 16.397 -0.205 -2.070 1.00 0.00 H new ATOM 0 HE2 LYS A 373 14.784 2.234 -1.478 1.00 0.00 H new ATOM 0 HE3 LYS A 373 14.691 0.956 -0.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 373 16.484 2.488 0.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 373 17.115 0.951 -0.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 373 17.205 2.190 -1.298 1.00 0.00 H new ATOM 1035 N GLU A 374 11.809 1.538 -5.720 1.00 0.00 N ATOM 1036 CA GLU A 374 11.148 2.720 -6.269 1.00 0.00 C ATOM 1037 C GLU A 374 9.704 2.833 -5.782 1.00 0.00 C ATOM 1038 O GLU A 374 9.166 3.934 -5.681 1.00 0.00 O ATOM 1039 CB GLU A 374 11.173 2.684 -7.800 1.00 0.00 C ATOM 1040 CG GLU A 374 12.378 3.391 -8.406 1.00 0.00 C ATOM 1041 CD GLU A 374 12.449 3.268 -9.919 1.00 0.00 C ATOM 1042 OE1 GLU A 374 11.389 3.097 -10.560 1.00 0.00 O ATOM 1043 OE2 GLU A 374 13.569 3.349 -10.464 1.00 0.00 O ATOM 0 H GLU A 374 11.839 0.741 -6.355 1.00 0.00 H new ATOM 0 HA GLU A 374 11.697 3.594 -5.917 1.00 0.00 H new ATOM 0 HB2 GLU A 374 11.167 1.645 -8.131 1.00 0.00 H new ATOM 0 HB3 GLU A 374 10.262 3.145 -8.181 1.00 0.00 H new ATOM 0 HG2 GLU A 374 12.345 4.446 -8.135 1.00 0.00 H new ATOM 0 HG3 GLU A 374 13.289 2.979 -7.972 1.00 0.00 H new ATOM 1050 N ASP A 375 9.083 1.691 -5.487 1.00 0.00 N ATOM 1051 CA ASP A 375 7.697 1.657 -5.020 1.00 0.00 C ATOM 1052 C ASP A 375 7.499 2.471 -3.740 1.00 0.00 C ATOM 1053 O ASP A 375 6.438 3.060 -3.540 1.00 0.00 O ATOM 1054 CB ASP A 375 7.257 0.210 -4.779 1.00 0.00 C ATOM 1055 CG ASP A 375 6.777 -0.490 -6.040 1.00 0.00 C ATOM 1056 OD1 ASP A 375 7.072 -0.001 -7.152 1.00 0.00 O ATOM 1057 OD2 ASP A 375 6.105 -1.536 -5.914 1.00 0.00 O ATOM 0 H ASP A 375 9.521 0.773 -5.564 1.00 0.00 H new ATOM 0 HA ASP A 375 7.083 2.107 -5.800 1.00 0.00 H new ATOM 0 HB2 ASP A 375 8.091 -0.350 -4.356 1.00 0.00 H new ATOM 0 HB3 ASP A 375 6.457 0.199 -4.039 1.00 0.00 H new ATOM 1062 N TYR A 376 8.511 2.494 -2.874 1.00 0.00 N ATOM 1063 CA TYR A 376 8.420 3.233 -1.613 1.00 0.00 C ATOM 1064 C TYR A 376 8.656 4.722 -1.832 1.00 0.00 C ATOM 1065 O TYR A 376 7.834 5.554 -1.447 1.00 0.00 O ATOM 1066 CB TYR A 376 9.428 2.691 -0.596 1.00 0.00 C ATOM 1067 CG TYR A 376 9.126 1.280 -0.135 1.00 0.00 C ATOM 1068 CD1 TYR A 376 8.262 1.040 0.928 1.00 0.00 C ATOM 1069 CD2 TYR A 376 9.707 0.189 -0.765 1.00 0.00 C ATOM 1070 CE1 TYR A 376 7.987 -0.247 1.344 1.00 0.00 C ATOM 1071 CE2 TYR A 376 9.435 -1.101 -0.355 1.00 0.00 C ATOM 1072 CZ TYR A 376 8.575 -1.315 0.701 1.00 0.00 C ATOM 1073 OH TYR A 376 8.303 -2.598 1.114 1.00 0.00 O ATOM 0 H TYR A 376 9.399 2.013 -3.020 1.00 0.00 H new ATOM 0 HA TYR A 376 7.412 3.096 -1.221 1.00 0.00 H new ATOM 0 HB2 TYR A 376 10.425 2.715 -1.037 1.00 0.00 H new ATOM 0 HB3 TYR A 376 9.447 3.351 0.271 1.00 0.00 H new ATOM 0 HD1 TYR A 376 7.799 1.873 1.436 1.00 0.00 H new ATOM 0 HD2 TYR A 376 10.384 0.352 -1.591 1.00 0.00 H new ATOM 0 HE1 TYR A 376 7.313 -0.417 2.171 1.00 0.00 H new ATOM 0 HE2 TYR A 376 9.894 -1.939 -0.859 1.00 0.00 H new ATOM 0 HH TYR A 376 8.953 -3.214 0.716 1.00 0.00 H new ATOM 1083 N LYS A 377 9.789 5.048 -2.453 1.00 0.00 N ATOM 1084 CA LYS A 377 10.149 6.439 -2.728 1.00 0.00 C ATOM 1085 C LYS A 377 9.119 7.132 -3.630 1.00 0.00 C ATOM 1086 O LYS A 377 8.990 8.357 -3.598 1.00 0.00 O ATOM 1087 CB LYS A 377 11.544 6.524 -3.366 1.00 0.00 C ATOM 1088 CG LYS A 377 11.748 5.591 -4.554 1.00 0.00 C ATOM 1089 CD LYS A 377 11.349 6.254 -5.863 1.00 0.00 C ATOM 1090 CE LYS A 377 12.406 7.242 -6.333 1.00 0.00 C ATOM 1091 NZ LYS A 377 11.950 8.036 -7.510 1.00 0.00 N ATOM 0 H LYS A 377 10.475 4.366 -2.776 1.00 0.00 H new ATOM 0 HA LYS A 377 10.160 6.960 -1.771 1.00 0.00 H new ATOM 0 HB2 LYS A 377 11.721 7.550 -3.690 1.00 0.00 H new ATOM 0 HB3 LYS A 377 12.292 6.296 -2.607 1.00 0.00 H new ATOM 0 HG2 LYS A 377 12.794 5.288 -4.603 1.00 0.00 H new ATOM 0 HG3 LYS A 377 11.160 4.685 -4.411 1.00 0.00 H new ATOM 0 HD2 LYS A 377 11.197 5.491 -6.627 1.00 0.00 H new ATOM 0 HD3 LYS A 377 10.398 6.771 -5.735 1.00 0.00 H new ATOM 0 HE2 LYS A 377 12.658 7.918 -5.516 1.00 0.00 H new ATOM 0 HE3 LYS A 377 13.317 6.702 -6.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 377 12.701 8.696 -7.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 377 11.734 7.394 -8.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 377 11.096 8.573 -7.257 1.00 0.00 H new ATOM 1105 N LYS A 378 8.394 6.353 -4.439 1.00 0.00 N ATOM 1106 CA LYS A 378 7.391 6.916 -5.343 1.00 0.00 C ATOM 1107 C LYS A 378 6.034 7.066 -4.650 1.00 0.00 C ATOM 1108 O LYS A 378 5.875 6.696 -3.484 1.00 0.00 O ATOM 1109 CB LYS A 378 7.251 6.050 -6.604 1.00 0.00 C ATOM 1110 CG LYS A 378 6.448 4.773 -6.396 1.00 0.00 C ATOM 1111 CD LYS A 378 6.612 3.815 -7.566 1.00 0.00 C ATOM 1112 CE LYS A 378 5.334 3.040 -7.841 1.00 0.00 C ATOM 1113 NZ LYS A 378 5.114 2.828 -9.300 1.00 0.00 N ATOM 0 H LYS A 378 8.483 5.338 -4.485 1.00 0.00 H new ATOM 0 HA LYS A 378 7.732 7.909 -5.635 1.00 0.00 H new ATOM 0 HB2 LYS A 378 6.776 6.641 -7.387 1.00 0.00 H new ATOM 0 HB3 LYS A 378 8.246 5.786 -6.963 1.00 0.00 H new ATOM 0 HG2 LYS A 378 6.771 4.285 -5.476 1.00 0.00 H new ATOM 0 HG3 LYS A 378 5.394 5.021 -6.272 1.00 0.00 H new ATOM 0 HD2 LYS A 378 6.897 4.374 -8.457 1.00 0.00 H new ATOM 0 HD3 LYS A 378 7.422 3.117 -7.354 1.00 0.00 H new ATOM 0 HE2 LYS A 378 5.380 2.075 -7.337 1.00 0.00 H new ATOM 0 HE3 LYS A 378 4.485 3.579 -7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 378 4.111 2.613 -9.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 378 5.378 3.689 -9.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 378 5.700 2.033 -9.628 1.00 0.00 H new ATOM 1127 N LYS A 379 5.062 7.613 -5.381 1.00 0.00 N ATOM 1128 CA LYS A 379 3.711 7.821 -4.854 1.00 0.00 C ATOM 1129 C LYS A 379 2.963 6.492 -4.696 1.00 0.00 C ATOM 1130 O LYS A 379 3.533 5.419 -4.906 1.00 0.00 O ATOM 1131 CB LYS A 379 2.924 8.765 -5.772 1.00 0.00 C ATOM 1132 CG LYS A 379 2.906 8.329 -7.230 1.00 0.00 C ATOM 1133 CD LYS A 379 3.084 9.511 -8.170 1.00 0.00 C ATOM 1134 CE LYS A 379 4.524 9.637 -8.645 1.00 0.00 C ATOM 1135 NZ LYS A 379 5.320 10.551 -7.778 1.00 0.00 N ATOM 0 H LYS A 379 5.186 7.922 -6.345 1.00 0.00 H new ATOM 0 HA LYS A 379 3.802 8.275 -3.867 1.00 0.00 H new ATOM 0 HB2 LYS A 379 1.898 8.836 -5.411 1.00 0.00 H new ATOM 0 HB3 LYS A 379 3.355 9.764 -5.706 1.00 0.00 H new ATOM 0 HG2 LYS A 379 3.700 7.603 -7.403 1.00 0.00 H new ATOM 0 HG3 LYS A 379 1.963 7.828 -7.449 1.00 0.00 H new ATOM 0 HD2 LYS A 379 2.425 9.395 -9.031 1.00 0.00 H new ATOM 0 HD3 LYS A 379 2.786 10.428 -7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 379 4.989 8.651 -8.656 1.00 0.00 H new ATOM 0 HE3 LYS A 379 4.537 10.007 -9.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 6.295 10.608 -8.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 4.891 11.499 -7.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 5.330 10.185 -6.805 1.00 0.00 H new ATOM 1149 N LEU A 380 1.686 6.569 -4.312 1.00 0.00 N ATOM 1150 CA LEU A 380 0.867 5.373 -4.110 1.00 0.00 C ATOM 1151 C LEU A 380 0.053 5.015 -5.356 1.00 0.00 C ATOM 1152 O LEU A 380 0.118 3.882 -5.837 1.00 0.00 O ATOM 1153 CB LEU A 380 -0.068 5.570 -2.914 1.00 0.00 C ATOM 1154 CG LEU A 380 0.529 5.181 -1.559 1.00 0.00 C ATOM 1155 CD1 LEU A 380 1.154 6.390 -0.884 1.00 0.00 C ATOM 1156 CD2 LEU A 380 -0.532 4.560 -0.665 1.00 0.00 C ATOM 0 H LEU A 380 1.198 7.447 -4.135 1.00 0.00 H new ATOM 0 HA LEU A 380 1.546 4.544 -3.911 1.00 0.00 H new ATOM 0 HB2 LEU A 380 -0.369 6.617 -2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 380 -0.972 4.984 -3.078 1.00 0.00 H new ATOM 0 HG LEU A 380 1.310 4.440 -1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 380 1.573 6.094 0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 380 1.946 6.791 -1.517 1.00 0.00 H new ATOM 0 HD13 LEU A 380 0.392 7.154 -0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 380 -0.088 4.290 0.293 1.00 0.00 H new ATOM 0 HD22 LEU A 380 -1.337 5.277 -0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 380 -0.933 3.666 -1.143 1.00 0.00 H new ATOM 1168 N LEU A 381 -0.721 5.975 -5.871 1.00 0.00 N ATOM 1169 CA LEU A 381 -1.554 5.735 -7.058 1.00 0.00 C ATOM 1170 C LEU A 381 -0.732 5.225 -8.250 1.00 0.00 C ATOM 1171 O LEU A 381 -1.286 4.623 -9.173 1.00 0.00 O ATOM 1172 CB LEU A 381 -2.358 6.998 -7.436 1.00 0.00 C ATOM 1173 CG LEU A 381 -1.764 7.921 -8.520 1.00 0.00 C ATOM 1174 CD1 LEU A 381 -0.293 8.208 -8.267 1.00 0.00 C ATOM 1175 CD2 LEU A 381 -1.963 7.330 -9.911 1.00 0.00 C ATOM 0 H LEU A 381 -0.790 6.919 -5.490 1.00 0.00 H new ATOM 0 HA LEU A 381 -2.260 4.947 -6.798 1.00 0.00 H new ATOM 0 HB2 LEU A 381 -3.346 6.681 -7.769 1.00 0.00 H new ATOM 0 HB3 LEU A 381 -2.501 7.589 -6.532 1.00 0.00 H new ATOM 0 HG LEU A 381 -2.301 8.868 -8.468 1.00 0.00 H new ATOM 0 HD11 LEU A 381 0.090 8.861 -9.051 1.00 0.00 H new ATOM 0 HD12 LEU A 381 -0.179 8.697 -7.299 1.00 0.00 H new ATOM 0 HD13 LEU A 381 0.266 7.272 -8.269 1.00 0.00 H new ATOM 0 HD21 LEU A 381 -1.535 8.001 -10.656 1.00 0.00 H new ATOM 0 HD22 LEU A 381 -1.468 6.361 -9.969 1.00 0.00 H new ATOM 0 HD23 LEU A 381 -3.028 7.205 -10.104 1.00 0.00 H new ATOM 1187 N ASP A 382 0.588 5.453 -8.223 1.00 0.00 N ATOM 1188 CA ASP A 382 1.472 4.999 -9.298 1.00 0.00 C ATOM 1189 C ASP A 382 1.307 3.497 -9.550 1.00 0.00 C ATOM 1190 O ASP A 382 1.469 3.028 -10.677 1.00 0.00 O ATOM 1191 CB ASP A 382 2.935 5.308 -8.948 1.00 0.00 C ATOM 1192 CG ASP A 382 3.679 6.045 -10.052 1.00 0.00 C ATOM 1193 OD1 ASP A 382 3.182 6.078 -11.198 1.00 0.00 O ATOM 1194 OD2 ASP A 382 4.766 6.588 -9.766 1.00 0.00 O ATOM 0 H ASP A 382 1.064 5.948 -7.469 1.00 0.00 H new ATOM 0 HA ASP A 382 1.197 5.534 -10.207 1.00 0.00 H new ATOM 0 HB2 ASP A 382 2.964 5.907 -8.038 1.00 0.00 H new ATOM 0 HB3 ASP A 382 3.454 4.374 -8.731 1.00 0.00 H new ATOM 1199 N LEU A 383 0.978 2.751 -8.492 1.00 0.00 N ATOM 1200 CA LEU A 383 0.781 1.306 -8.598 1.00 0.00 C ATOM 1201 C LEU A 383 -0.711 0.952 -8.562 1.00 0.00 C ATOM 1202 O LEU A 383 -1.083 -0.159 -8.182 1.00 0.00 O ATOM 1203 CB LEU A 383 1.520 0.589 -7.461 1.00 0.00 C ATOM 1204 CG LEU A 383 2.985 0.995 -7.277 1.00 0.00 C ATOM 1205 CD1 LEU A 383 3.335 1.101 -5.799 1.00 0.00 C ATOM 1206 CD2 LEU A 383 3.909 0.006 -7.974 1.00 0.00 C ATOM 0 H LEU A 383 0.843 3.125 -7.553 1.00 0.00 H new ATOM 0 HA LEU A 383 1.188 0.975 -9.554 1.00 0.00 H new ATOM 0 HB2 LEU A 383 0.988 0.776 -6.528 1.00 0.00 H new ATOM 0 HB3 LEU A 383 1.477 -0.485 -7.642 1.00 0.00 H new ATOM 0 HG LEU A 383 3.124 1.975 -7.733 1.00 0.00 H new ATOM 0 HD11 LEU A 383 4.380 1.391 -5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 383 2.701 1.852 -5.328 1.00 0.00 H new ATOM 0 HD13 LEU A 383 3.175 0.137 -5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 383 4.945 0.313 -7.831 1.00 0.00 H new ATOM 0 HD22 LEU A 383 3.763 -0.988 -7.551 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.681 -0.016 -9.040 1.00 0.00 H new ATOM 1218 N GLU A 384 -1.560 1.908 -8.963 1.00 0.00 N ATOM 1219 CA GLU A 384 -3.009 1.713 -8.982 1.00 0.00 C ATOM 1220 C GLU A 384 -3.535 1.314 -7.599 1.00 0.00 C ATOM 1221 O GLU A 384 -4.040 0.205 -7.410 1.00 0.00 O ATOM 1222 CB GLU A 384 -3.397 0.659 -10.026 1.00 0.00 C ATOM 1223 CG GLU A 384 -3.638 1.234 -11.417 1.00 0.00 C ATOM 1224 CD GLU A 384 -5.057 1.739 -11.613 1.00 0.00 C ATOM 1225 OE1 GLU A 384 -5.594 2.385 -10.688 1.00 0.00 O ATOM 1226 OE2 GLU A 384 -5.628 1.495 -12.697 1.00 0.00 O ATOM 0 H GLU A 384 -1.261 2.830 -9.280 1.00 0.00 H new ATOM 0 HA GLU A 384 -3.469 2.662 -9.256 1.00 0.00 H new ATOM 0 HB2 GLU A 384 -2.607 -0.090 -10.084 1.00 0.00 H new ATOM 0 HB3 GLU A 384 -4.299 0.146 -9.693 1.00 0.00 H new ATOM 0 HG2 GLU A 384 -2.940 2.052 -11.592 1.00 0.00 H new ATOM 0 HG3 GLU A 384 -3.425 0.468 -12.163 1.00 0.00 H new ATOM 1233 N LEU A 385 -3.415 2.226 -6.637 1.00 0.00 N ATOM 1234 CA LEU A 385 -3.883 1.965 -5.275 1.00 0.00 C ATOM 1235 C LEU A 385 -5.254 2.593 -5.037 1.00 0.00 C ATOM 1236 O LEU A 385 -6.089 2.022 -4.338 1.00 0.00 O ATOM 1237 CB LEU A 385 -2.882 2.498 -4.247 1.00 0.00 C ATOM 1238 CG LEU A 385 -1.562 1.723 -4.167 1.00 0.00 C ATOM 1239 CD1 LEU A 385 -0.597 2.404 -3.212 1.00 0.00 C ATOM 1240 CD2 LEU A 385 -1.806 0.283 -3.737 1.00 0.00 C ATOM 0 H LEU A 385 -3.000 3.148 -6.772 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.970 0.885 -5.156 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.661 3.539 -4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -3.353 2.487 -3.264 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.115 1.714 -5.161 1.00 0.00 H new ATOM 0 HD11 LEU A 385 0.333 1.838 -3.170 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.391 3.415 -3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.040 2.448 -2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -0.855 -0.248 -3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.280 0.272 -2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.458 -0.207 -4.460 1.00 0.00 H new ATOM 1252 N ALA A 386 -5.480 3.768 -5.625 1.00 0.00 N ATOM 1253 CA ALA A 386 -6.753 4.464 -5.476 1.00 0.00 C ATOM 1254 C ALA A 386 -7.855 3.761 -6.271 1.00 0.00 C ATOM 1255 O ALA A 386 -7.611 3.256 -7.368 1.00 0.00 O ATOM 1256 CB ALA A 386 -6.621 5.915 -5.918 1.00 0.00 C ATOM 0 H ALA A 386 -4.798 4.255 -6.207 1.00 0.00 H new ATOM 0 HA ALA A 386 -7.029 4.445 -4.422 1.00 0.00 H new ATOM 0 HB1 ALA A 386 -7.580 6.420 -5.800 1.00 0.00 H new ATOM 0 HB2 ALA A 386 -5.870 6.415 -5.306 1.00 0.00 H new ATOM 0 HB3 ALA A 386 -6.318 5.950 -6.965 1.00 0.00 H new ATOM 1262 N PRO A 387 -9.086 3.710 -5.723 1.00 0.00 N ATOM 1263 CA PRO A 387 -9.414 4.297 -4.426 1.00 0.00 C ATOM 1264 C PRO A 387 -9.198 3.343 -3.243 1.00 0.00 C ATOM 1265 O PRO A 387 -9.346 3.752 -2.093 1.00 0.00 O ATOM 1266 CB PRO A 387 -10.896 4.620 -4.585 1.00 0.00 C ATOM 1267 CG PRO A 387 -11.425 3.557 -5.493 1.00 0.00 C ATOM 1268 CD PRO A 387 -10.267 3.078 -6.342 1.00 0.00 C ATOM 0 HA PRO A 387 -8.776 5.150 -4.193 1.00 0.00 H new ATOM 0 HB2 PRO A 387 -11.408 4.609 -3.623 1.00 0.00 H new ATOM 0 HB3 PRO A 387 -11.041 5.612 -5.012 1.00 0.00 H new ATOM 0 HG2 PRO A 387 -11.846 2.733 -4.917 1.00 0.00 H new ATOM 0 HG3 PRO A 387 -12.225 3.950 -6.120 1.00 0.00 H new ATOM 0 HD2 PRO A 387 -10.189 1.991 -6.333 1.00 0.00 H new ATOM 0 HD3 PRO A 387 -10.383 3.381 -7.383 1.00 0.00 H new ATOM 1276 N SER A 388 -8.854 2.080 -3.521 1.00 0.00 N ATOM 1277 CA SER A 388 -8.630 1.099 -2.455 1.00 0.00 C ATOM 1278 C SER A 388 -7.643 0.012 -2.890 1.00 0.00 C ATOM 1279 O SER A 388 -7.646 -0.414 -4.046 1.00 0.00 O ATOM 1280 CB SER A 388 -9.954 0.453 -2.030 1.00 0.00 C ATOM 1281 OG SER A 388 -10.950 1.431 -1.785 1.00 0.00 O ATOM 0 H SER A 388 -8.726 1.717 -4.465 1.00 0.00 H new ATOM 0 HA SER A 388 -8.201 1.633 -1.607 1.00 0.00 H new ATOM 0 HB2 SER A 388 -10.295 -0.229 -2.809 1.00 0.00 H new ATOM 0 HB3 SER A 388 -9.798 -0.143 -1.131 1.00 0.00 H new ATOM 0 HG SER A 388 -11.783 0.990 -1.517 1.00 0.00 H new ATOM 1287 N ALA A 389 -6.798 -0.427 -1.950 1.00 0.00 N ATOM 1288 CA ALA A 389 -5.799 -1.458 -2.223 1.00 0.00 C ATOM 1289 C ALA A 389 -5.481 -2.276 -0.968 1.00 0.00 C ATOM 1290 O ALA A 389 -5.670 -1.805 0.156 1.00 0.00 O ATOM 1291 CB ALA A 389 -4.529 -0.821 -2.765 1.00 0.00 C ATOM 0 H ALA A 389 -6.789 -0.080 -0.991 1.00 0.00 H new ATOM 0 HA ALA A 389 -6.212 -2.136 -2.970 1.00 0.00 H new ATOM 0 HB1 ALA A 389 -3.790 -1.597 -2.966 1.00 0.00 H new ATOM 0 HB2 ALA A 389 -4.755 -0.288 -3.688 1.00 0.00 H new ATOM 0 HB3 ALA A 389 -4.131 -0.122 -2.030 1.00 0.00 H new ATOM 1297 N SER A 390 -4.991 -3.501 -1.169 1.00 0.00 N ATOM 1298 CA SER A 390 -4.640 -4.386 -0.058 1.00 0.00 C ATOM 1299 C SER A 390 -3.171 -4.797 -0.128 1.00 0.00 C ATOM 1300 O SER A 390 -2.603 -4.925 -1.214 1.00 0.00 O ATOM 1301 CB SER A 390 -5.530 -5.631 -0.073 1.00 0.00 C ATOM 1302 OG SER A 390 -5.537 -6.272 1.191 1.00 0.00 O ATOM 0 H SER A 390 -4.828 -3.903 -2.092 1.00 0.00 H new ATOM 0 HA SER A 390 -4.800 -3.841 0.872 1.00 0.00 H new ATOM 0 HB2 SER A 390 -6.547 -5.351 -0.347 1.00 0.00 H new ATOM 0 HB3 SER A 390 -5.175 -6.326 -0.834 1.00 0.00 H new ATOM 0 HG SER A 390 -6.115 -7.063 1.154 1.00 0.00 H new ATOM 1308 N VAL A 391 -2.562 -5.006 1.039 1.00 0.00 N ATOM 1309 CA VAL A 391 -1.158 -5.407 1.113 1.00 0.00 C ATOM 1310 C VAL A 391 -1.019 -6.820 1.688 1.00 0.00 C ATOM 1311 O VAL A 391 -1.972 -7.373 2.235 1.00 0.00 O ATOM 1312 CB VAL A 391 -0.326 -4.421 1.974 1.00 0.00 C ATOM 1313 CG1 VAL A 391 -0.817 -2.993 1.796 1.00 0.00 C ATOM 1314 CG2 VAL A 391 -0.373 -4.808 3.442 1.00 0.00 C ATOM 0 H VAL A 391 -3.019 -4.904 1.945 1.00 0.00 H new ATOM 0 HA VAL A 391 -0.772 -5.393 0.094 1.00 0.00 H new ATOM 0 HB VAL A 391 0.708 -4.477 1.632 1.00 0.00 H new ATOM 0 HG11 VAL A 391 -0.216 -2.322 2.411 1.00 0.00 H new ATOM 0 HG12 VAL A 391 -0.726 -2.705 0.749 1.00 0.00 H new ATOM 0 HG13 VAL A 391 -1.861 -2.927 2.101 1.00 0.00 H new ATOM 0 HG21 VAL A 391 0.218 -4.101 4.024 1.00 0.00 H new ATOM 0 HG22 VAL A 391 -1.406 -4.790 3.790 1.00 0.00 H new ATOM 0 HG23 VAL A 391 0.035 -5.811 3.567 1.00 0.00 H new ATOM 1324 N VAL A 392 0.180 -7.387 1.572 1.00 0.00 N ATOM 1325 CA VAL A 392 0.452 -8.723 2.093 1.00 0.00 C ATOM 1326 C VAL A 392 1.745 -8.728 2.908 1.00 0.00 C ATOM 1327 O VAL A 392 2.812 -8.408 2.387 1.00 0.00 O ATOM 1328 CB VAL A 392 0.553 -9.776 0.965 1.00 0.00 C ATOM 1329 CG1 VAL A 392 -0.759 -9.872 0.201 1.00 0.00 C ATOM 1330 CG2 VAL A 392 1.701 -9.454 0.017 1.00 0.00 C ATOM 0 H VAL A 392 0.979 -6.941 1.121 1.00 0.00 H new ATOM 0 HA VAL A 392 -0.388 -8.991 2.734 1.00 0.00 H new ATOM 0 HB VAL A 392 0.756 -10.743 1.426 1.00 0.00 H new ATOM 0 HG11 VAL A 392 -0.667 -10.618 -0.588 1.00 0.00 H new ATOM 0 HG12 VAL A 392 -1.557 -10.163 0.884 1.00 0.00 H new ATOM 0 HG13 VAL A 392 -0.994 -8.904 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 392 1.749 -10.210 -0.766 1.00 0.00 H new ATOM 0 HG22 VAL A 392 1.537 -8.475 -0.433 1.00 0.00 H new ATOM 0 HG23 VAL A 392 2.639 -9.446 0.571 1.00 0.00 H new ATOM 1340 N LEU A 393 1.641 -9.081 4.188 1.00 0.00 N ATOM 1341 CA LEU A 393 2.806 -9.116 5.071 1.00 0.00 C ATOM 1342 C LEU A 393 3.546 -10.449 4.955 1.00 0.00 C ATOM 1343 O LEU A 393 2.946 -11.516 5.097 1.00 0.00 O ATOM 1344 CB LEU A 393 2.381 -8.874 6.522 1.00 0.00 C ATOM 1345 CG LEU A 393 3.233 -7.858 7.284 1.00 0.00 C ATOM 1346 CD1 LEU A 393 2.842 -6.438 6.905 1.00 0.00 C ATOM 1347 CD2 LEU A 393 3.094 -8.068 8.783 1.00 0.00 C ATOM 0 H LEU A 393 0.764 -9.346 4.636 1.00 0.00 H new ATOM 0 HA LEU A 393 3.486 -8.322 4.763 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.345 -8.535 6.530 1.00 0.00 H new ATOM 0 HB3 LEU A 393 2.410 -9.824 7.056 1.00 0.00 H new ATOM 0 HG LEU A 393 4.277 -8.009 7.009 1.00 0.00 H new ATOM 0 HD11 LEU A 393 3.460 -5.731 7.458 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.993 -6.292 5.835 1.00 0.00 H new ATOM 0 HD13 LEU A 393 1.793 -6.272 7.150 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.706 -7.337 9.311 1.00 0.00 H new ATOM 0 HD22 LEU A 393 2.051 -7.944 9.073 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.425 -9.074 9.042 1.00 0.00 H new ATOM 1359 N LEU A 394 4.853 -10.377 4.696 1.00 0.00 N ATOM 1360 CA LEU A 394 5.681 -11.574 4.559 1.00 0.00 C ATOM 1361 C LEU A 394 6.813 -11.607 5.598 1.00 0.00 C ATOM 1362 O LEU A 394 7.982 -11.776 5.243 1.00 0.00 O ATOM 1363 CB LEU A 394 6.255 -11.652 3.142 1.00 0.00 C ATOM 1364 CG LEU A 394 6.186 -13.035 2.491 1.00 0.00 C ATOM 1365 CD1 LEU A 394 5.899 -12.907 1.003 1.00 0.00 C ATOM 1366 CD2 LEU A 394 7.479 -13.801 2.727 1.00 0.00 C ATOM 0 H LEU A 394 5.360 -9.500 4.577 1.00 0.00 H new ATOM 0 HA LEU A 394 5.047 -12.442 4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 394 5.720 -10.943 2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 394 7.297 -11.332 3.170 1.00 0.00 H new ATOM 0 HG LEU A 394 5.371 -13.594 2.950 1.00 0.00 H new ATOM 0 HD11 LEU A 394 5.853 -13.899 0.555 1.00 0.00 H new ATOM 0 HD12 LEU A 394 4.945 -12.399 0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 394 6.693 -12.331 0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 394 7.412 -14.782 2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 394 8.313 -13.248 2.295 1.00 0.00 H new ATOM 0 HD23 LEU A 394 7.640 -13.922 3.798 1.00 0.00 H new ATOM 1378 N PRO A 395 6.481 -11.438 6.896 1.00 0.00 N ATOM 1379 CA PRO A 395 7.467 -11.447 7.986 1.00 0.00 C ATOM 1380 C PRO A 395 8.539 -12.530 7.824 1.00 0.00 C ATOM 1381 O PRO A 395 8.242 -13.650 7.402 1.00 0.00 O ATOM 1382 CB PRO A 395 6.612 -11.742 9.216 1.00 0.00 C ATOM 1383 CG PRO A 395 5.273 -11.171 8.903 1.00 0.00 C ATOM 1384 CD PRO A 395 5.114 -11.216 7.404 1.00 0.00 C ATOM 0 HA PRO A 395 8.023 -10.511 8.030 1.00 0.00 H new ATOM 0 HB2 PRO A 395 6.549 -12.814 9.405 1.00 0.00 H new ATOM 0 HB3 PRO A 395 7.036 -11.285 10.110 1.00 0.00 H new ATOM 0 HG2 PRO A 395 4.485 -11.744 9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 395 5.195 -10.147 9.268 1.00 0.00 H new ATOM 0 HD2 PRO A 395 4.442 -12.018 7.100 1.00 0.00 H new ATOM 0 HD3 PRO A 395 4.694 -10.286 7.021 1.00 0.00 H new ATOM 1392 N ALA A 396 9.781 -12.191 8.172 1.00 0.00 N ATOM 1393 CA ALA A 396 10.897 -13.134 8.076 1.00 0.00 C ATOM 1394 C ALA A 396 11.572 -13.335 9.435 1.00 0.00 C ATOM 1395 O ALA A 396 12.797 -13.449 9.520 1.00 0.00 O ATOM 1396 CB ALA A 396 11.911 -12.654 7.047 1.00 0.00 C ATOM 0 H ALA A 396 10.040 -11.269 8.523 1.00 0.00 H new ATOM 0 HA ALA A 396 10.497 -14.095 7.754 1.00 0.00 H new ATOM 0 HB1 ALA A 396 12.734 -13.366 6.988 1.00 0.00 H new ATOM 0 HB2 ALA A 396 11.430 -12.574 6.072 1.00 0.00 H new ATOM 0 HB3 ALA A 396 12.296 -11.678 7.343 1.00 0.00 H new ATOM 1402 N GLY A 397 10.765 -13.380 10.495 1.00 0.00 N ATOM 1403 CA GLY A 397 11.297 -13.570 11.832 1.00 0.00 C ATOM 1404 C GLY A 397 11.100 -14.985 12.340 1.00 0.00 C ATOM 1405 O GLY A 397 12.091 -15.598 12.791 1.00 0.00 O ATOM 1406 OXT GLY A 397 9.955 -15.482 12.285 1.00 0.00 O ATOM 0 H GLY A 397 9.750 -13.288 10.449 1.00 0.00 H new ATOM 0 HA2 GLY A 397 12.361 -13.332 11.833 1.00 0.00 H new ATOM 0 HA3 GLY A 397 10.813 -12.872 12.515 1.00 0.00 H new