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 Single : A 318 THR OG1 : rot 37:sc= 0.183 USER MOD Single : A 323 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.57) USER MOD Single : A 330 SER OG : rot 180:sc= 0.00578 USER MOD Single : A 331 SER OG : rot 120:sc= -0.132 USER MOD Single : A 333 THR OG1 : rot 180:sc= 0 USER MOD Single : A 334 ASN : amide:sc= 0.0763 K(o=0.076,f=-3.5!) USER MOD Single : A 335 GLN : amide:sc= -0.0462 X(o=-0.046,f=-0.46) USER MOD Single : A 338 SER OG : rot 180:sc= -0.343 USER MOD Single : A 347 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 351 GLN : amide:sc= -0.0834 X(o=-0.083,f=-0.12) USER MOD Single : A 352 THR OG1 : rot 71:sc= 1.22 USER MOD Single : A 355 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 356 THR OG1 : rot 180:sc= 0 USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 359 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 361 SER OG : rot 127:sc= 1.12 USER MOD Single : A 364 THR OG1 : rot 180:sc= -0.098 USER MOD Single : A 365 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 372 THR OG1 : rot 180:sc= -0.541 USER MOD Single : A 373 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 376 TYR OH : rot 180:sc= 0 USER MOD Single : A 377 LYS NZ :NH3+ -167:sc=-0.00222 (180deg=-0.0544) USER MOD Single : A 378 LYS NZ :NH3+ -172:sc= -0.0749 (180deg=-0.163) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 180:sc= -0.116 USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 163 N THR A 318 -8.538 12.025 -5.473 1.00 0.00 N ATOM 164 CA THR A 318 -7.104 12.293 -5.583 1.00 0.00 C ATOM 165 C THR A 318 -6.338 11.707 -4.387 1.00 0.00 C ATOM 166 O THR A 318 -5.308 12.237 -3.970 1.00 0.00 O ATOM 167 CB THR A 318 -6.848 13.803 -5.694 1.00 0.00 C ATOM 168 OG1 THR A 318 -7.664 14.387 -6.698 1.00 0.00 O ATOM 169 CG2 THR A 318 -5.409 14.137 -6.015 1.00 0.00 C ATOM 0 HA THR A 318 -6.739 11.808 -6.488 1.00 0.00 H new ATOM 0 HB THR A 318 -7.092 14.210 -4.712 1.00 0.00 H new ATOM 0 HG1 THR A 318 -8.545 13.958 -6.694 1.00 0.00 H new ATOM 0 HG21 THR A 318 -5.292 15.219 -6.080 1.00 0.00 H new ATOM 0 HG22 THR A 318 -4.761 13.749 -5.229 1.00 0.00 H new ATOM 0 HG23 THR A 318 -5.134 13.684 -6.968 1.00 0.00 H new ATOM 177 N VAL A 319 -6.851 10.605 -3.842 1.00 0.00 N ATOM 178 CA VAL A 319 -6.225 9.940 -2.697 1.00 0.00 C ATOM 179 C VAL A 319 -6.288 8.424 -2.851 1.00 0.00 C ATOM 180 O VAL A 319 -7.115 7.904 -3.601 1.00 0.00 O ATOM 181 CB VAL A 319 -6.899 10.333 -1.363 1.00 0.00 C ATOM 182 CG1 VAL A 319 -6.515 11.749 -0.956 1.00 0.00 C ATOM 183 CG2 VAL A 319 -8.413 10.189 -1.458 1.00 0.00 C ATOM 0 H VAL A 319 -7.702 10.151 -4.175 1.00 0.00 H new ATOM 0 HA VAL A 319 -5.186 10.268 -2.675 1.00 0.00 H new ATOM 0 HB VAL A 319 -6.541 9.652 -0.591 1.00 0.00 H new ATOM 0 HG11 VAL A 319 -7.002 12.002 -0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 319 -5.434 11.812 -0.834 1.00 0.00 H new ATOM 0 HG13 VAL A 319 -6.834 12.449 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 319 -8.866 10.471 -0.507 1.00 0.00 H new ATOM 0 HG22 VAL A 319 -8.791 10.839 -2.247 1.00 0.00 H new ATOM 0 HG23 VAL A 319 -8.666 9.154 -1.688 1.00 0.00 H new ATOM 193 N ALA A 320 -5.412 7.720 -2.134 1.00 0.00 N ATOM 194 CA ALA A 320 -5.374 6.257 -2.196 1.00 0.00 C ATOM 195 C ALA A 320 -5.655 5.626 -0.831 1.00 0.00 C ATOM 196 O ALA A 320 -5.317 6.187 0.211 1.00 0.00 O ATOM 197 CB ALA A 320 -4.028 5.786 -2.736 1.00 0.00 C ATOM 0 H ALA A 320 -4.723 8.135 -1.507 1.00 0.00 H new ATOM 0 HA ALA A 320 -6.162 5.932 -2.876 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -4.013 4.697 -2.777 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -3.877 6.189 -3.737 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -3.230 6.135 -2.080 1.00 0.00 H new ATOM 203 N ARG A 321 -6.280 4.454 -0.844 1.00 0.00 N ATOM 204 CA ARG A 321 -6.603 3.750 0.388 1.00 0.00 C ATOM 205 C ARG A 321 -5.951 2.375 0.402 1.00 0.00 C ATOM 206 O ARG A 321 -6.137 1.589 -0.525 1.00 0.00 O ATOM 207 CB ARG A 321 -8.113 3.617 0.529 1.00 0.00 C ATOM 208 CG ARG A 321 -8.612 3.769 1.957 1.00 0.00 C ATOM 209 CD ARG A 321 -10.126 3.906 2.006 1.00 0.00 C ATOM 210 NE ARG A 321 -10.759 2.798 2.724 1.00 0.00 N ATOM 211 CZ ARG A 321 -12.077 2.686 2.913 1.00 0.00 C ATOM 212 NH1 ARG A 321 -12.910 3.608 2.436 1.00 0.00 N ATOM 213 NH2 ARG A 321 -12.564 1.645 3.580 1.00 0.00 N ATOM 0 H ARG A 321 -6.572 3.973 -1.695 1.00 0.00 H new ATOM 0 HA ARG A 321 -6.217 4.324 1.230 1.00 0.00 H new ATOM 0 HB2 ARG A 321 -8.594 4.369 -0.096 1.00 0.00 H new ATOM 0 HB3 ARG A 321 -8.420 2.643 0.149 1.00 0.00 H new ATOM 0 HG2 ARG A 321 -8.305 2.904 2.545 1.00 0.00 H new ATOM 0 HG3 ARG A 321 -8.151 4.645 2.413 1.00 0.00 H new ATOM 0 HD2 ARG A 321 -10.388 4.847 2.489 1.00 0.00 H new ATOM 0 HD3 ARG A 321 -10.518 3.949 0.990 1.00 0.00 H new ATOM 0 HE ARG A 321 -10.157 2.067 3.103 1.00 0.00 H new ATOM 0 HH11 ARG A 321 -12.544 4.409 1.921 1.00 0.00 H new ATOM 0 HH12 ARG A 321 -13.915 3.514 2.585 1.00 0.00 H new ATOM 0 HH21 ARG A 321 -11.932 0.933 3.947 1.00 0.00 H new ATOM 0 HH22 ARG A 321 -13.570 1.558 3.725 1.00 0.00 H new ATOM 227 N ILE A 322 -5.188 2.085 1.452 1.00 0.00 N ATOM 228 CA ILE A 322 -4.518 0.794 1.565 1.00 0.00 C ATOM 229 C ILE A 322 -4.833 0.122 2.893 1.00 0.00 C ATOM 230 O ILE A 322 -4.985 0.787 3.921 1.00 0.00 O ATOM 231 CB ILE A 322 -2.982 0.908 1.417 1.00 0.00 C ATOM 232 CG1 ILE A 322 -2.586 2.206 0.708 1.00 0.00 C ATOM 233 CG2 ILE A 322 -2.433 -0.295 0.659 1.00 0.00 C ATOM 234 CD1 ILE A 322 -3.057 2.283 -0.731 1.00 0.00 C ATOM 0 H ILE A 322 -5.019 2.721 2.231 1.00 0.00 H new ATOM 0 HA ILE A 322 -4.901 0.188 0.744 1.00 0.00 H new ATOM 0 HB ILE A 322 -2.549 0.926 2.417 1.00 0.00 H new ATOM 0 HG12 ILE A 322 -2.996 3.051 1.261 1.00 0.00 H new ATOM 0 HG13 ILE A 322 -1.501 2.306 0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 322 -1.351 -0.201 0.562 1.00 0.00 H new ATOM 0 HG22 ILE A 322 -2.671 -1.208 1.204 1.00 0.00 H new ATOM 0 HG23 ILE A 322 -2.884 -0.337 -0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 322 -2.740 3.230 -1.168 1.00 0.00 H new ATOM 0 HD12 ILE A 322 -2.626 1.459 -1.299 1.00 0.00 H new ATOM 0 HD13 ILE A 322 -4.144 2.216 -0.762 1.00 0.00 H new ATOM 246 N GLN A 323 -4.924 -1.203 2.860 1.00 0.00 N ATOM 247 CA GLN A 323 -5.215 -1.988 4.052 1.00 0.00 C ATOM 248 C GLN A 323 -4.001 -2.830 4.441 1.00 0.00 C ATOM 249 O GLN A 323 -3.608 -3.740 3.706 1.00 0.00 O ATOM 250 CB GLN A 323 -6.426 -2.891 3.809 1.00 0.00 C ATOM 251 CG GLN A 323 -7.749 -2.268 4.229 1.00 0.00 C ATOM 252 CD GLN A 323 -8.826 -2.406 3.167 1.00 0.00 C ATOM 253 OE1 GLN A 323 -8.856 -3.384 2.419 1.00 0.00 O ATOM 254 NE2 GLN A 323 -9.722 -1.427 3.097 1.00 0.00 N ATOM 0 H GLN A 323 -4.799 -1.758 2.014 1.00 0.00 H new ATOM 0 HA GLN A 323 -5.445 -1.306 4.870 1.00 0.00 H new ATOM 0 HB2 GLN A 323 -6.473 -3.143 2.749 1.00 0.00 H new ATOM 0 HB3 GLN A 323 -6.286 -3.825 4.353 1.00 0.00 H new ATOM 0 HG2 GLN A 323 -8.091 -2.739 5.151 1.00 0.00 H new ATOM 0 HG3 GLN A 323 -7.595 -1.212 4.449 1.00 0.00 H new ATOM 0 HE21 GLN A 323 -9.662 -0.634 3.735 1.00 0.00 H new ATOM 0 HE22 GLN A 323 -10.470 -1.469 2.405 1.00 0.00 H new ATOM 263 N PHE A 324 -3.411 -2.519 5.595 1.00 0.00 N ATOM 264 CA PHE A 324 -2.239 -3.247 6.078 1.00 0.00 C ATOM 265 C PHE A 324 -2.657 -4.527 6.800 1.00 0.00 C ATOM 266 O PHE A 324 -3.190 -4.480 7.908 1.00 0.00 O ATOM 267 CB PHE A 324 -1.420 -2.355 7.017 1.00 0.00 C ATOM 268 CG PHE A 324 0.063 -2.438 6.792 1.00 0.00 C ATOM 269 CD1 PHE A 324 0.662 -1.732 5.761 1.00 0.00 C ATOM 270 CD2 PHE A 324 0.858 -3.219 7.615 1.00 0.00 C ATOM 271 CE1 PHE A 324 2.027 -1.802 5.557 1.00 0.00 C ATOM 272 CE2 PHE A 324 2.223 -3.292 7.415 1.00 0.00 C ATOM 273 CZ PHE A 324 2.808 -2.582 6.385 1.00 0.00 C ATOM 0 H PHE A 324 -3.725 -1.769 6.211 1.00 0.00 H new ATOM 0 HA PHE A 324 -1.625 -3.522 5.221 1.00 0.00 H new ATOM 0 HB2 PHE A 324 -1.740 -1.321 6.891 1.00 0.00 H new ATOM 0 HB3 PHE A 324 -1.638 -2.633 8.048 1.00 0.00 H new ATOM 0 HD1 PHE A 324 0.055 -1.120 5.110 1.00 0.00 H new ATOM 0 HD2 PHE A 324 0.406 -3.777 8.422 1.00 0.00 H new ATOM 0 HE1 PHE A 324 2.482 -1.247 4.750 1.00 0.00 H new ATOM 0 HE2 PHE A 324 2.832 -3.904 8.064 1.00 0.00 H new ATOM 0 HZ PHE A 324 3.875 -2.637 6.228 1.00 0.00 H new ATOM 283 N ARG A 325 -2.404 -5.667 6.163 1.00 0.00 N ATOM 284 CA ARG A 325 -2.750 -6.964 6.733 1.00 0.00 C ATOM 285 C ARG A 325 -1.574 -7.561 7.502 1.00 0.00 C ATOM 286 O ARG A 325 -0.496 -6.968 7.566 1.00 0.00 O ATOM 287 CB ARG A 325 -3.189 -7.932 5.629 1.00 0.00 C ATOM 288 CG ARG A 325 -4.096 -7.301 4.582 1.00 0.00 C ATOM 289 CD ARG A 325 -5.329 -8.151 4.319 1.00 0.00 C ATOM 290 NE ARG A 325 -6.521 -7.333 4.093 1.00 0.00 N ATOM 291 CZ ARG A 325 -7.667 -7.799 3.590 1.00 0.00 C ATOM 292 NH1 ARG A 325 -7.787 -9.083 3.258 1.00 0.00 N ATOM 293 NH2 ARG A 325 -8.699 -6.978 3.419 1.00 0.00 N ATOM 0 H ARG A 325 -1.958 -5.718 5.247 1.00 0.00 H new ATOM 0 HA ARG A 325 -3.575 -6.811 7.428 1.00 0.00 H new ATOM 0 HB2 ARG A 325 -2.303 -8.331 5.135 1.00 0.00 H new ATOM 0 HB3 ARG A 325 -3.708 -8.776 6.084 1.00 0.00 H new ATOM 0 HG2 ARG A 325 -4.402 -6.310 4.916 1.00 0.00 H new ATOM 0 HG3 ARG A 325 -3.541 -7.167 3.653 1.00 0.00 H new ATOM 0 HD2 ARG A 325 -5.154 -8.784 3.449 1.00 0.00 H new ATOM 0 HD3 ARG A 325 -5.500 -8.814 5.167 1.00 0.00 H new ATOM 0 HE ARG A 325 -6.474 -6.343 4.335 1.00 0.00 H new ATOM 0 HH11 ARG A 325 -7.000 -9.719 3.387 1.00 0.00 H new ATOM 0 HH12 ARG A 325 -8.666 -9.431 2.874 1.00 0.00 H new ATOM 0 HH21 ARG A 325 -8.615 -5.993 3.672 1.00 0.00 H new ATOM 0 HH22 ARG A 325 -9.575 -7.333 3.035 1.00 0.00 H new ATOM 307 N LEU A 326 -1.788 -8.742 8.081 1.00 0.00 N ATOM 308 CA LEU A 326 -0.746 -9.425 8.844 1.00 0.00 C ATOM 309 C LEU A 326 -1.117 -10.890 9.092 1.00 0.00 C ATOM 310 O LEU A 326 -2.279 -11.275 8.944 1.00 0.00 O ATOM 311 CB LEU A 326 -0.501 -8.705 10.180 1.00 0.00 C ATOM 312 CG LEU A 326 -1.716 -7.980 10.772 1.00 0.00 C ATOM 313 CD1 LEU A 326 -1.865 -8.294 12.254 1.00 0.00 C ATOM 314 CD2 LEU A 326 -1.602 -6.478 10.552 1.00 0.00 C ATOM 0 H LEU A 326 -2.674 -9.245 8.036 1.00 0.00 H new ATOM 0 HA LEU A 326 0.172 -9.401 8.257 1.00 0.00 H new ATOM 0 HB2 LEU A 326 -0.146 -9.436 10.907 1.00 0.00 H new ATOM 0 HB3 LEU A 326 0.300 -7.980 10.040 1.00 0.00 H new ATOM 0 HG LEU A 326 -2.608 -8.337 10.258 1.00 0.00 H new ATOM 0 HD11 LEU A 326 -2.733 -7.769 12.652 1.00 0.00 H new ATOM 0 HD12 LEU A 326 -1.998 -9.368 12.387 1.00 0.00 H new ATOM 0 HD13 LEU A 326 -0.970 -7.971 12.786 1.00 0.00 H new ATOM 0 HD21 LEU A 326 -2.473 -5.981 10.979 1.00 0.00 H new ATOM 0 HD22 LEU A 326 -0.699 -6.107 11.036 1.00 0.00 H new ATOM 0 HD23 LEU A 326 -1.553 -6.270 9.483 1.00 0.00 H new ATOM 326 N PRO A 327 -0.130 -11.729 9.484 1.00 0.00 N ATOM 327 CA PRO A 327 -0.358 -13.156 9.763 1.00 0.00 C ATOM 328 C PRO A 327 -1.415 -13.382 10.844 1.00 0.00 C ATOM 329 O PRO A 327 -2.050 -14.436 10.884 1.00 0.00 O ATOM 330 CB PRO A 327 1.008 -13.666 10.242 1.00 0.00 C ATOM 331 CG PRO A 327 1.783 -12.444 10.598 1.00 0.00 C ATOM 332 CD PRO A 327 1.277 -11.354 9.697 1.00 0.00 C ATOM 0 HA PRO A 327 -0.734 -13.676 8.882 1.00 0.00 H new ATOM 0 HB2 PRO A 327 0.901 -14.328 11.101 1.00 0.00 H new ATOM 0 HB3 PRO A 327 1.511 -14.236 9.461 1.00 0.00 H new ATOM 0 HG2 PRO A 327 1.638 -12.182 11.646 1.00 0.00 H new ATOM 0 HG3 PRO A 327 2.852 -12.604 10.454 1.00 0.00 H new ATOM 0 HD2 PRO A 327 1.367 -10.372 10.161 1.00 0.00 H new ATOM 0 HD3 PRO A 327 1.831 -11.316 8.759 1.00 0.00 H new ATOM 340 N ASP A 328 -1.601 -12.386 11.716 1.00 0.00 N ATOM 341 CA ASP A 328 -2.586 -12.472 12.793 1.00 0.00 C ATOM 342 C ASP A 328 -3.977 -12.798 12.244 1.00 0.00 C ATOM 343 O ASP A 328 -4.753 -13.509 12.884 1.00 0.00 O ATOM 344 CB ASP A 328 -2.633 -11.156 13.579 1.00 0.00 C ATOM 345 CG ASP A 328 -3.230 -11.326 14.963 1.00 0.00 C ATOM 346 OD1 ASP A 328 -4.474 -11.362 15.073 1.00 0.00 O ATOM 347 OD2 ASP A 328 -2.454 -11.423 15.936 1.00 0.00 O ATOM 0 H ASP A 328 -1.080 -11.510 11.695 1.00 0.00 H new ATOM 0 HA ASP A 328 -2.282 -13.278 13.460 1.00 0.00 H new ATOM 0 HB2 ASP A 328 -1.624 -10.754 13.669 1.00 0.00 H new ATOM 0 HB3 ASP A 328 -3.218 -10.425 13.022 1.00 0.00 H new ATOM 352 N GLY A 329 -4.287 -12.268 11.057 1.00 0.00 N ATOM 353 CA GLY A 329 -5.584 -12.508 10.447 1.00 0.00 C ATOM 354 C GLY A 329 -6.301 -11.214 10.110 1.00 0.00 C ATOM 355 O GLY A 329 -6.911 -11.096 9.046 1.00 0.00 O ATOM 0 H GLY A 329 -3.661 -11.677 10.510 1.00 0.00 H new ATOM 0 HA2 GLY A 329 -5.454 -13.098 9.540 1.00 0.00 H new ATOM 0 HA3 GLY A 329 -6.200 -13.098 11.125 1.00 0.00 H new ATOM 359 N SER A 330 -6.222 -10.240 11.018 1.00 0.00 N ATOM 360 CA SER A 330 -6.861 -8.942 10.814 1.00 0.00 C ATOM 361 C SER A 330 -5.942 -7.987 10.050 1.00 0.00 C ATOM 362 O SER A 330 -4.795 -8.322 9.741 1.00 0.00 O ATOM 363 CB SER A 330 -7.255 -8.326 12.158 1.00 0.00 C ATOM 364 OG SER A 330 -8.294 -7.374 11.997 1.00 0.00 O ATOM 0 H SER A 330 -5.721 -10.327 11.902 1.00 0.00 H new ATOM 0 HA SER A 330 -7.759 -9.101 10.217 1.00 0.00 H new ATOM 0 HB2 SER A 330 -7.579 -9.111 12.841 1.00 0.00 H new ATOM 0 HB3 SER A 330 -6.387 -7.848 12.611 1.00 0.00 H new ATOM 0 HG SER A 330 -8.529 -6.996 12.870 1.00 0.00 H new ATOM 370 N SER A 331 -6.456 -6.794 9.751 1.00 0.00 N ATOM 371 CA SER A 331 -5.690 -5.782 9.024 1.00 0.00 C ATOM 372 C SER A 331 -6.100 -4.371 9.447 1.00 0.00 C ATOM 373 O SER A 331 -7.122 -4.182 10.111 1.00 0.00 O ATOM 374 CB SER A 331 -5.878 -5.947 7.508 1.00 0.00 C ATOM 375 OG SER A 331 -6.070 -7.307 7.150 1.00 0.00 O ATOM 0 H SER A 331 -7.401 -6.504 10.002 1.00 0.00 H new ATOM 0 HA SER A 331 -4.638 -5.924 9.269 1.00 0.00 H new ATOM 0 HB2 SER A 331 -6.736 -5.360 7.181 1.00 0.00 H new ATOM 0 HB3 SER A 331 -5.005 -5.553 6.988 1.00 0.00 H new ATOM 0 HG SER A 331 -6.941 -7.410 6.713 1.00 0.00 H new ATOM 381 N PHE A 332 -5.298 -3.384 9.050 1.00 0.00 N ATOM 382 CA PHE A 332 -5.567 -1.986 9.375 1.00 0.00 C ATOM 383 C PHE A 332 -5.946 -1.213 8.114 1.00 0.00 C ATOM 384 O PHE A 332 -5.666 -1.656 7.000 1.00 0.00 O ATOM 385 CB PHE A 332 -4.343 -1.334 10.034 1.00 0.00 C ATOM 386 CG PHE A 332 -3.594 -2.229 10.991 1.00 0.00 C ATOM 387 CD1 PHE A 332 -4.271 -3.022 11.907 1.00 0.00 C ATOM 388 CD2 PHE A 332 -2.208 -2.273 10.974 1.00 0.00 C ATOM 389 CE1 PHE A 332 -3.582 -3.837 12.783 1.00 0.00 C ATOM 390 CE2 PHE A 332 -1.514 -3.086 11.849 1.00 0.00 C ATOM 391 CZ PHE A 332 -2.201 -3.870 12.754 1.00 0.00 C ATOM 0 H PHE A 332 -4.452 -3.529 8.499 1.00 0.00 H new ATOM 0 HA PHE A 332 -6.399 -1.956 10.078 1.00 0.00 H new ATOM 0 HB2 PHE A 332 -3.658 -1.005 9.253 1.00 0.00 H new ATOM 0 HB3 PHE A 332 -4.667 -0.442 10.570 1.00 0.00 H new ATOM 0 HD1 PHE A 332 -5.350 -3.001 11.935 1.00 0.00 H new ATOM 0 HD2 PHE A 332 -1.664 -1.664 10.267 1.00 0.00 H new ATOM 0 HE1 PHE A 332 -4.122 -4.448 13.491 1.00 0.00 H new ATOM 0 HE2 PHE A 332 -0.434 -3.108 11.825 1.00 0.00 H new ATOM 0 HZ PHE A 332 -1.660 -4.508 13.438 1.00 0.00 H new ATOM 401 N THR A 333 -6.586 -0.060 8.292 1.00 0.00 N ATOM 402 CA THR A 333 -7.001 0.765 7.160 1.00 0.00 C ATOM 403 C THR A 333 -6.620 2.227 7.377 1.00 0.00 C ATOM 404 O THR A 333 -7.070 2.860 8.335 1.00 0.00 O ATOM 405 CB THR A 333 -8.513 0.644 6.938 1.00 0.00 C ATOM 406 OG1 THR A 333 -8.939 -0.707 7.039 1.00 0.00 O ATOM 407 CG2 THR A 333 -8.963 1.165 5.591 1.00 0.00 C ATOM 0 H THR A 333 -6.828 0.323 9.206 1.00 0.00 H new ATOM 0 HA THR A 333 -6.481 0.404 6.273 1.00 0.00 H new ATOM 0 HB THR A 333 -8.964 1.256 7.720 1.00 0.00 H new ATOM 0 HG1 THR A 333 -9.907 -0.756 6.895 1.00 0.00 H new ATOM 0 HG21 THR A 333 -10.043 1.050 5.499 1.00 0.00 H new ATOM 0 HG22 THR A 333 -8.702 2.220 5.503 1.00 0.00 H new ATOM 0 HG23 THR A 333 -8.469 0.602 4.799 1.00 0.00 H new ATOM 415 N ASN A 334 -5.792 2.755 6.478 1.00 0.00 N ATOM 416 CA ASN A 334 -5.347 4.144 6.559 1.00 0.00 C ATOM 417 C ASN A 334 -5.538 4.855 5.219 1.00 0.00 C ATOM 418 O ASN A 334 -5.738 4.211 4.186 1.00 0.00 O ATOM 419 CB ASN A 334 -3.875 4.212 6.982 1.00 0.00 C ATOM 420 CG ASN A 334 -3.618 5.283 8.029 1.00 0.00 C ATOM 421 OD1 ASN A 334 -4.247 6.341 8.018 1.00 0.00 O ATOM 422 ND2 ASN A 334 -2.686 5.017 8.940 1.00 0.00 N ATOM 0 H ASN A 334 -5.415 2.240 5.683 1.00 0.00 H new ATOM 0 HA ASN A 334 -5.954 4.649 7.310 1.00 0.00 H new ATOM 0 HB2 ASN A 334 -3.569 3.243 7.376 1.00 0.00 H new ATOM 0 HB3 ASN A 334 -3.258 4.410 6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 334 -2.470 5.702 9.664 1.00 0.00 H new ATOM 0 HD22 ASN A 334 -2.187 4.128 8.914 1.00 0.00 H new ATOM 429 N GLN A 335 -5.475 6.187 5.244 1.00 0.00 N ATOM 430 CA GLN A 335 -5.641 6.985 4.034 1.00 0.00 C ATOM 431 C GLN A 335 -4.303 7.551 3.568 1.00 0.00 C ATOM 432 O GLN A 335 -3.655 8.312 4.288 1.00 0.00 O ATOM 433 CB GLN A 335 -6.634 8.127 4.281 1.00 0.00 C ATOM 434 CG GLN A 335 -7.759 8.189 3.258 1.00 0.00 C ATOM 435 CD GLN A 335 -8.282 9.598 3.044 1.00 0.00 C ATOM 436 OE1 GLN A 335 -7.509 10.548 2.907 1.00 0.00 O ATOM 437 NE2 GLN A 335 -9.602 9.743 3.011 1.00 0.00 N ATOM 0 H GLN A 335 -5.310 6.733 6.089 1.00 0.00 H new ATOM 0 HA GLN A 335 -6.033 6.335 3.251 1.00 0.00 H new ATOM 0 HB2 GLN A 335 -7.065 8.014 5.276 1.00 0.00 H new ATOM 0 HB3 GLN A 335 -6.095 9.074 4.273 1.00 0.00 H new ATOM 0 HG2 GLN A 335 -7.403 7.790 2.308 1.00 0.00 H new ATOM 0 HG3 GLN A 335 -8.578 7.548 3.586 1.00 0.00 H new ATOM 0 HE21 GLN A 335 -10.207 8.931 3.129 1.00 0.00 H new ATOM 0 HE22 GLN A 335 -10.010 10.667 2.868 1.00 0.00 H new ATOM 446 N PHE A 336 -3.905 7.184 2.353 1.00 0.00 N ATOM 447 CA PHE A 336 -2.653 7.657 1.773 1.00 0.00 C ATOM 448 C PHE A 336 -2.918 8.278 0.402 1.00 0.00 C ATOM 449 O PHE A 336 -3.365 7.597 -0.514 1.00 0.00 O ATOM 450 CB PHE A 336 -1.653 6.505 1.644 1.00 0.00 C ATOM 451 CG PHE A 336 -1.225 5.928 2.964 1.00 0.00 C ATOM 452 CD1 PHE A 336 -0.370 6.631 3.797 1.00 0.00 C ATOM 453 CD2 PHE A 336 -1.676 4.683 3.371 1.00 0.00 C ATOM 454 CE1 PHE A 336 0.027 6.105 5.009 1.00 0.00 C ATOM 455 CE2 PHE A 336 -1.282 4.151 4.584 1.00 0.00 C ATOM 456 CZ PHE A 336 -0.429 4.862 5.403 1.00 0.00 C ATOM 0 H PHE A 336 -4.436 6.557 1.748 1.00 0.00 H new ATOM 0 HA PHE A 336 -2.226 8.413 2.432 1.00 0.00 H new ATOM 0 HB2 PHE A 336 -2.098 5.715 1.039 1.00 0.00 H new ATOM 0 HB3 PHE A 336 -0.772 6.858 1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 336 -0.010 7.603 3.494 1.00 0.00 H new ATOM 0 HD2 PHE A 336 -2.343 4.122 2.733 1.00 0.00 H new ATOM 0 HE1 PHE A 336 0.693 6.664 5.649 1.00 0.00 H new ATOM 0 HE2 PHE A 336 -1.641 3.180 4.891 1.00 0.00 H new ATOM 0 HZ PHE A 336 -0.118 4.447 6.351 1.00 0.00 H new ATOM 466 N PRO A 337 -2.645 9.584 0.243 1.00 0.00 N ATOM 467 CA PRO A 337 -2.875 10.290 -1.021 1.00 0.00 C ATOM 468 C PRO A 337 -2.209 9.620 -2.216 1.00 0.00 C ATOM 469 O PRO A 337 -1.318 8.781 -2.064 1.00 0.00 O ATOM 470 CB PRO A 337 -2.264 11.671 -0.787 1.00 0.00 C ATOM 471 CG PRO A 337 -2.242 11.841 0.689 1.00 0.00 C ATOM 472 CD PRO A 337 -2.099 10.469 1.280 1.00 0.00 C ATOM 0 HA PRO A 337 -3.937 10.309 -1.268 1.00 0.00 H new ATOM 0 HB2 PRO A 337 -1.260 11.734 -1.206 1.00 0.00 H new ATOM 0 HB3 PRO A 337 -2.858 12.451 -1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 337 -1.414 12.481 0.992 1.00 0.00 H new ATOM 0 HG3 PRO A 337 -3.158 12.319 1.037 1.00 0.00 H new ATOM 0 HD2 PRO A 337 -1.057 10.234 1.499 1.00 0.00 H new ATOM 0 HD3 PRO A 337 -2.650 10.377 2.216 1.00 0.00 H new ATOM 480 N SER A 338 -2.645 10.012 -3.410 1.00 0.00 N ATOM 481 CA SER A 338 -2.097 9.469 -4.649 1.00 0.00 C ATOM 482 C SER A 338 -0.683 10.002 -4.920 1.00 0.00 C ATOM 483 O SER A 338 -0.035 9.582 -5.876 1.00 0.00 O ATOM 484 CB SER A 338 -3.020 9.803 -5.825 1.00 0.00 C ATOM 485 OG SER A 338 -4.168 8.970 -5.828 1.00 0.00 O ATOM 0 H SER A 338 -3.379 10.707 -3.546 1.00 0.00 H new ATOM 0 HA SER A 338 -2.031 8.387 -4.539 1.00 0.00 H new ATOM 0 HB2 SER A 338 -3.325 10.848 -5.766 1.00 0.00 H new ATOM 0 HB3 SER A 338 -2.477 9.682 -6.763 1.00 0.00 H new ATOM 0 HG SER A 338 -4.741 9.205 -6.588 1.00 0.00 H new ATOM 491 N ASP A 339 -0.208 10.928 -4.078 1.00 0.00 N ATOM 492 CA ASP A 339 1.128 11.508 -4.239 1.00 0.00 C ATOM 493 C ASP A 339 2.022 11.192 -3.038 1.00 0.00 C ATOM 494 O ASP A 339 3.234 11.028 -3.190 1.00 0.00 O ATOM 495 CB ASP A 339 1.026 13.023 -4.433 1.00 0.00 C ATOM 496 CG ASP A 339 -0.008 13.404 -5.475 1.00 0.00 C ATOM 497 OD1 ASP A 339 0.254 13.190 -6.679 1.00 0.00 O ATOM 498 OD2 ASP A 339 -1.081 13.911 -5.089 1.00 0.00 O ATOM 0 H ASP A 339 -0.729 11.290 -3.280 1.00 0.00 H new ATOM 0 HA ASP A 339 1.582 11.062 -5.124 1.00 0.00 H new ATOM 0 HB2 ASP A 339 0.770 13.492 -3.483 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.999 13.415 -4.730 1.00 0.00 H new ATOM 503 N ALA A 340 1.418 11.107 -1.848 1.00 0.00 N ATOM 504 CA ALA A 340 2.156 10.807 -0.623 1.00 0.00 C ATOM 505 C ALA A 340 2.967 9.520 -0.777 1.00 0.00 C ATOM 506 O ALA A 340 2.532 8.581 -1.444 1.00 0.00 O ATOM 507 CB ALA A 340 1.198 10.698 0.559 1.00 0.00 C ATOM 0 H ALA A 340 0.417 11.243 -1.710 1.00 0.00 H new ATOM 0 HA ALA A 340 2.852 11.624 -0.433 1.00 0.00 H new ATOM 0 HB1 ALA A 340 1.762 10.474 1.465 1.00 0.00 H new ATOM 0 HB2 ALA A 340 0.667 11.642 0.686 1.00 0.00 H new ATOM 0 HB3 ALA A 340 0.479 9.900 0.372 1.00 0.00 H new ATOM 513 N PRO A 341 4.173 9.469 -0.171 1.00 0.00 N ATOM 514 CA PRO A 341 5.055 8.295 -0.254 1.00 0.00 C ATOM 515 C PRO A 341 4.374 7.001 0.193 1.00 0.00 C ATOM 516 O PRO A 341 3.566 7.000 1.122 1.00 0.00 O ATOM 517 CB PRO A 341 6.208 8.643 0.695 1.00 0.00 C ATOM 518 CG PRO A 341 6.211 10.131 0.768 1.00 0.00 C ATOM 519 CD PRO A 341 4.775 10.554 0.629 1.00 0.00 C ATOM 0 HA PRO A 341 5.366 8.105 -1.281 1.00 0.00 H new ATOM 0 HB2 PRO A 341 6.057 8.200 1.679 1.00 0.00 H new ATOM 0 HB3 PRO A 341 7.158 8.264 0.318 1.00 0.00 H new ATOM 0 HG2 PRO A 341 6.629 10.475 1.714 1.00 0.00 H new ATOM 0 HG3 PRO A 341 6.823 10.560 -0.026 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.290 10.654 1.600 1.00 0.00 H new ATOM 0 HD3 PRO A 341 4.687 11.518 0.128 1.00 0.00 H new ATOM 527 N LEU A 342 4.719 5.901 -0.476 1.00 0.00 N ATOM 528 CA LEU A 342 4.158 4.586 -0.153 1.00 0.00 C ATOM 529 C LEU A 342 4.718 4.072 1.174 1.00 0.00 C ATOM 530 O LEU A 342 4.016 3.405 1.938 1.00 0.00 O ATOM 531 CB LEU A 342 4.465 3.591 -1.282 1.00 0.00 C ATOM 532 CG LEU A 342 4.008 2.141 -1.048 1.00 0.00 C ATOM 533 CD1 LEU A 342 5.042 1.376 -0.233 1.00 0.00 C ATOM 534 CD2 LEU A 342 2.644 2.098 -0.365 1.00 0.00 C ATOM 0 H LEU A 342 5.386 5.893 -1.247 1.00 0.00 H new ATOM 0 HA LEU A 342 3.077 4.685 -0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 342 3.997 3.955 -2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 342 5.541 3.588 -1.454 1.00 0.00 H new ATOM 0 HG LEU A 342 3.912 1.659 -2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 342 4.699 0.353 -0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 342 5.991 1.364 -0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 342 5.177 1.863 0.733 1.00 0.00 H new ATOM 0 HD21 LEU A 342 2.346 1.061 -0.212 1.00 0.00 H new ATOM 0 HD22 LEU A 342 2.703 2.604 0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 342 1.907 2.598 -0.993 1.00 0.00 H new ATOM 546 N GLU A 343 5.988 4.391 1.442 1.00 0.00 N ATOM 547 CA GLU A 343 6.652 3.967 2.676 1.00 0.00 C ATOM 548 C GLU A 343 5.864 4.380 3.922 1.00 0.00 C ATOM 549 O GLU A 343 6.009 3.762 4.975 1.00 0.00 O ATOM 550 CB GLU A 343 8.070 4.535 2.750 1.00 0.00 C ATOM 551 CG GLU A 343 8.156 6.029 2.468 1.00 0.00 C ATOM 552 CD GLU A 343 9.478 6.635 2.899 1.00 0.00 C ATOM 553 OE1 GLU A 343 9.843 6.488 4.086 1.00 0.00 O ATOM 554 OE2 GLU A 343 10.150 7.257 2.049 1.00 0.00 O ATOM 0 H GLU A 343 6.577 4.943 0.818 1.00 0.00 H new ATOM 0 HA GLU A 343 6.700 2.878 2.653 1.00 0.00 H new ATOM 0 HB2 GLU A 343 8.477 4.339 3.742 1.00 0.00 H new ATOM 0 HB3 GLU A 343 8.700 4.004 2.036 1.00 0.00 H new ATOM 0 HG2 GLU A 343 8.014 6.201 1.401 1.00 0.00 H new ATOM 0 HG3 GLU A 343 7.343 6.539 2.985 1.00 0.00 H new ATOM 561 N GLU A 344 5.033 5.424 3.798 1.00 0.00 N ATOM 562 CA GLU A 344 4.224 5.908 4.918 1.00 0.00 C ATOM 563 C GLU A 344 3.489 4.755 5.603 1.00 0.00 C ATOM 564 O GLU A 344 3.473 4.664 6.831 1.00 0.00 O ATOM 565 CB GLU A 344 3.214 6.955 4.439 1.00 0.00 C ATOM 566 CG GLU A 344 3.856 8.200 3.846 1.00 0.00 C ATOM 567 CD GLU A 344 4.678 8.971 4.860 1.00 0.00 C ATOM 568 OE1 GLU A 344 5.872 8.648 5.023 1.00 0.00 O ATOM 569 OE2 GLU A 344 4.124 9.895 5.493 1.00 0.00 O ATOM 0 H GLU A 344 4.906 5.948 2.932 1.00 0.00 H new ATOM 0 HA GLU A 344 4.898 6.368 5.641 1.00 0.00 H new ATOM 0 HB2 GLU A 344 2.562 6.502 3.692 1.00 0.00 H new ATOM 0 HB3 GLU A 344 2.582 7.247 5.278 1.00 0.00 H new ATOM 0 HG2 GLU A 344 4.494 7.912 3.010 1.00 0.00 H new ATOM 0 HG3 GLU A 344 3.078 8.850 3.445 1.00 0.00 H new ATOM 576 N ALA A 345 2.890 3.871 4.802 1.00 0.00 N ATOM 577 CA ALA A 345 2.164 2.718 5.333 1.00 0.00 C ATOM 578 C ALA A 345 3.121 1.712 5.978 1.00 0.00 C ATOM 579 O ALA A 345 2.787 1.082 6.983 1.00 0.00 O ATOM 580 CB ALA A 345 1.350 2.050 4.231 1.00 0.00 C ATOM 0 H ALA A 345 2.894 3.933 3.784 1.00 0.00 H new ATOM 0 HA ALA A 345 1.482 3.074 6.105 1.00 0.00 H new ATOM 0 HB1 ALA A 345 0.815 1.194 4.642 1.00 0.00 H new ATOM 0 HB2 ALA A 345 0.634 2.764 3.824 1.00 0.00 H new ATOM 0 HB3 ALA A 345 2.018 1.714 3.438 1.00 0.00 H new ATOM 586 N ARG A 346 4.314 1.573 5.396 1.00 0.00 N ATOM 587 CA ARG A 346 5.324 0.652 5.913 1.00 0.00 C ATOM 588 C ARG A 346 5.836 1.112 7.279 1.00 0.00 C ATOM 589 O ARG A 346 5.750 0.371 8.260 1.00 0.00 O ATOM 590 CB ARG A 346 6.489 0.539 4.925 1.00 0.00 C ATOM 591 CG ARG A 346 7.601 -0.387 5.390 1.00 0.00 C ATOM 592 CD ARG A 346 8.932 -0.017 4.753 1.00 0.00 C ATOM 593 NE ARG A 346 9.748 -1.197 4.468 1.00 0.00 N ATOM 594 CZ ARG A 346 10.318 -1.967 5.402 1.00 0.00 C ATOM 595 NH1 ARG A 346 10.186 -1.679 6.696 1.00 0.00 N ATOM 596 NH2 ARG A 346 11.025 -3.030 5.035 1.00 0.00 N ATOM 0 H ARG A 346 4.603 2.088 4.565 1.00 0.00 H new ATOM 0 HA ARG A 346 4.862 -0.328 6.034 1.00 0.00 H new ATOM 0 HB2 ARG A 346 6.108 0.182 3.968 1.00 0.00 H new ATOM 0 HB3 ARG A 346 6.904 1.532 4.752 1.00 0.00 H new ATOM 0 HG2 ARG A 346 7.689 -0.337 6.475 1.00 0.00 H new ATOM 0 HG3 ARG A 346 7.349 -1.417 5.138 1.00 0.00 H new ATOM 0 HD2 ARG A 346 8.752 0.531 3.828 1.00 0.00 H new ATOM 0 HD3 ARG A 346 9.479 0.651 5.418 1.00 0.00 H new ATOM 0 HE ARG A 346 9.892 -1.450 3.491 1.00 0.00 H new ATOM 0 HH11 ARG A 346 9.645 -0.864 6.984 1.00 0.00 H new ATOM 0 HH12 ARG A 346 10.625 -2.274 7.398 1.00 0.00 H new ATOM 0 HH21 ARG A 346 11.131 -3.255 4.046 1.00 0.00 H new ATOM 0 HH22 ARG A 346 11.462 -3.621 5.742 1.00 0.00 H new ATOM 610 N GLN A 347 6.364 2.337 7.332 1.00 0.00 N ATOM 611 CA GLN A 347 6.887 2.899 8.579 1.00 0.00 C ATOM 612 C GLN A 347 5.808 2.937 9.664 1.00 0.00 C ATOM 613 O GLN A 347 6.107 2.776 10.848 1.00 0.00 O ATOM 614 CB GLN A 347 7.455 4.304 8.349 1.00 0.00 C ATOM 615 CG GLN A 347 6.479 5.272 7.695 1.00 0.00 C ATOM 616 CD GLN A 347 6.656 6.697 8.185 1.00 0.00 C ATOM 617 OE1 GLN A 347 6.160 7.062 9.251 1.00 0.00 O ATOM 618 NE2 GLN A 347 7.368 7.509 7.411 1.00 0.00 N ATOM 0 H GLN A 347 6.441 2.958 6.527 1.00 0.00 H new ATOM 0 HA GLN A 347 7.693 2.249 8.920 1.00 0.00 H new ATOM 0 HB2 GLN A 347 7.772 4.717 9.307 1.00 0.00 H new ATOM 0 HB3 GLN A 347 8.345 4.226 7.725 1.00 0.00 H new ATOM 0 HG2 GLN A 347 6.614 5.244 6.614 1.00 0.00 H new ATOM 0 HG3 GLN A 347 5.459 4.946 7.897 1.00 0.00 H new ATOM 0 HE21 GLN A 347 7.761 7.164 6.535 1.00 0.00 H new ATOM 0 HE22 GLN A 347 7.522 8.477 7.693 1.00 0.00 H new ATOM 627 N PHE A 348 4.553 3.142 9.250 1.00 0.00 N ATOM 628 CA PHE A 348 3.427 3.188 10.182 1.00 0.00 C ATOM 629 C PHE A 348 3.319 1.881 10.965 1.00 0.00 C ATOM 630 O PHE A 348 3.261 1.890 12.196 1.00 0.00 O ATOM 631 CB PHE A 348 2.117 3.450 9.430 1.00 0.00 C ATOM 632 CG PHE A 348 0.977 3.853 10.326 1.00 0.00 C ATOM 633 CD1 PHE A 348 0.192 2.895 10.951 1.00 0.00 C ATOM 634 CD2 PHE A 348 0.694 5.191 10.548 1.00 0.00 C ATOM 635 CE1 PHE A 348 -0.854 3.265 11.777 1.00 0.00 C ATOM 636 CE2 PHE A 348 -0.350 5.567 11.371 1.00 0.00 C ATOM 637 CZ PHE A 348 -1.124 4.602 11.987 1.00 0.00 C ATOM 0 H PHE A 348 4.294 3.279 8.273 1.00 0.00 H new ATOM 0 HA PHE A 348 3.604 4.004 10.883 1.00 0.00 H new ATOM 0 HB2 PHE A 348 2.283 4.235 8.692 1.00 0.00 H new ATOM 0 HB3 PHE A 348 1.837 2.551 8.882 1.00 0.00 H new ATOM 0 HD1 PHE A 348 0.400 1.847 10.791 1.00 0.00 H new ATOM 0 HD2 PHE A 348 1.297 5.950 10.072 1.00 0.00 H new ATOM 0 HE1 PHE A 348 -1.458 2.509 12.257 1.00 0.00 H new ATOM 0 HE2 PHE A 348 -0.561 6.614 11.533 1.00 0.00 H new ATOM 0 HZ PHE A 348 -1.939 4.894 12.632 1.00 0.00 H new ATOM 647 N ALA A 349 3.300 0.758 10.243 1.00 0.00 N ATOM 648 CA ALA A 349 3.210 -0.560 10.868 1.00 0.00 C ATOM 649 C ALA A 349 4.423 -0.829 11.755 1.00 0.00 C ATOM 650 O ALA A 349 4.291 -1.357 12.861 1.00 0.00 O ATOM 651 CB ALA A 349 3.081 -1.645 9.810 1.00 0.00 C ATOM 0 H ALA A 349 3.346 0.737 9.224 1.00 0.00 H new ATOM 0 HA ALA A 349 2.318 -0.574 11.495 1.00 0.00 H new ATOM 0 HB1 ALA A 349 3.015 -2.619 10.294 1.00 0.00 H new ATOM 0 HB2 ALA A 349 2.182 -1.472 9.219 1.00 0.00 H new ATOM 0 HB3 ALA A 349 3.954 -1.622 9.157 1.00 0.00 H new ATOM 657 N ALA A 350 5.607 -0.455 11.259 1.00 0.00 N ATOM 658 CA ALA A 350 6.854 -0.646 12.000 1.00 0.00 C ATOM 659 C ALA A 350 6.874 0.190 13.280 1.00 0.00 C ATOM 660 O ALA A 350 7.439 -0.231 14.288 1.00 0.00 O ATOM 661 CB ALA A 350 8.051 -0.299 11.126 1.00 0.00 C ATOM 0 H ALA A 350 5.726 -0.017 10.345 1.00 0.00 H new ATOM 0 HA ALA A 350 6.915 -1.697 12.283 1.00 0.00 H new ATOM 0 HB1 ALA A 350 8.970 -0.447 11.693 1.00 0.00 H new ATOM 0 HB2 ALA A 350 8.059 -0.944 10.247 1.00 0.00 H new ATOM 0 HB3 ALA A 350 7.982 0.742 10.811 1.00 0.00 H new ATOM 667 N GLN A 351 6.255 1.372 13.234 1.00 0.00 N ATOM 668 CA GLN A 351 6.201 2.259 14.395 1.00 0.00 C ATOM 669 C GLN A 351 5.100 1.834 15.367 1.00 0.00 C ATOM 670 O GLN A 351 5.228 2.027 16.576 1.00 0.00 O ATOM 671 CB GLN A 351 5.974 3.707 13.951 1.00 0.00 C ATOM 672 CG GLN A 351 7.260 4.496 13.776 1.00 0.00 C ATOM 673 CD GLN A 351 7.946 4.787 15.097 1.00 0.00 C ATOM 674 OE1 GLN A 351 8.887 4.094 15.485 1.00 0.00 O ATOM 675 NE2 GLN A 351 7.476 5.811 15.801 1.00 0.00 N ATOM 0 H GLN A 351 5.785 1.736 12.405 1.00 0.00 H new ATOM 0 HA GLN A 351 7.158 2.189 14.911 1.00 0.00 H new ATOM 0 HB2 GLN A 351 5.425 3.708 13.009 1.00 0.00 H new ATOM 0 HB3 GLN A 351 5.346 4.210 14.686 1.00 0.00 H new ATOM 0 HG2 GLN A 351 7.940 3.938 13.132 1.00 0.00 H new ATOM 0 HG3 GLN A 351 7.040 5.436 13.269 1.00 0.00 H new ATOM 0 HE21 GLN A 351 6.694 6.360 15.443 1.00 0.00 H new ATOM 0 HE22 GLN A 351 7.897 6.048 16.699 1.00 0.00 H new ATOM 684 N THR A 352 4.017 1.263 14.834 1.00 0.00 N ATOM 685 CA THR A 352 2.892 0.821 15.659 1.00 0.00 C ATOM 686 C THR A 352 3.332 -0.231 16.681 1.00 0.00 C ATOM 687 O THR A 352 3.138 -0.054 17.884 1.00 0.00 O ATOM 688 CB THR A 352 1.763 0.265 14.780 1.00 0.00 C ATOM 689 OG1 THR A 352 1.259 1.264 13.910 1.00 0.00 O ATOM 690 CG2 THR A 352 0.592 -0.277 15.576 1.00 0.00 C ATOM 0 H THR A 352 3.896 1.096 13.835 1.00 0.00 H new ATOM 0 HA THR A 352 2.520 1.689 16.204 1.00 0.00 H new ATOM 0 HB THR A 352 2.216 -0.554 14.221 1.00 0.00 H new ATOM 0 HG1 THR A 352 1.927 1.465 13.221 1.00 0.00 H new ATOM 0 HG21 THR A 352 -0.169 -0.654 14.893 1.00 0.00 H new ATOM 0 HG22 THR A 352 0.934 -1.087 16.221 1.00 0.00 H new ATOM 0 HG23 THR A 352 0.168 0.519 16.188 1.00 0.00 H new ATOM 698 N VAL A 353 3.927 -1.323 16.195 1.00 0.00 N ATOM 699 CA VAL A 353 4.395 -2.400 17.074 1.00 0.00 C ATOM 700 C VAL A 353 5.846 -2.183 17.505 1.00 0.00 C ATOM 701 O VAL A 353 6.237 -2.577 18.606 1.00 0.00 O ATOM 702 CB VAL A 353 4.266 -3.792 16.407 1.00 0.00 C ATOM 703 CG1 VAL A 353 2.808 -4.227 16.354 1.00 0.00 C ATOM 704 CG2 VAL A 353 4.887 -3.795 15.012 1.00 0.00 C ATOM 0 H VAL A 353 4.096 -1.486 15.202 1.00 0.00 H new ATOM 0 HA VAL A 353 3.752 -2.373 17.954 1.00 0.00 H new ATOM 0 HB VAL A 353 4.816 -4.510 17.016 1.00 0.00 H new ATOM 0 HG11 VAL A 353 2.738 -5.207 15.882 1.00 0.00 H new ATOM 0 HG12 VAL A 353 2.408 -4.282 17.366 1.00 0.00 H new ATOM 0 HG13 VAL A 353 2.233 -3.504 15.776 1.00 0.00 H new ATOM 0 HG21 VAL A 353 4.781 -4.785 14.569 1.00 0.00 H new ATOM 0 HG22 VAL A 353 4.379 -3.061 14.386 1.00 0.00 H new ATOM 0 HG23 VAL A 353 5.944 -3.541 15.084 1.00 0.00 H new ATOM 714 N GLY A 354 6.639 -1.560 16.631 1.00 0.00 N ATOM 715 CA GLY A 354 8.037 -1.307 16.934 1.00 0.00 C ATOM 716 C GLY A 354 8.945 -2.395 16.396 1.00 0.00 C ATOM 717 O GLY A 354 9.920 -2.109 15.698 1.00 0.00 O ATOM 0 H GLY A 354 6.334 -1.226 15.717 1.00 0.00 H new ATOM 0 HA2 GLY A 354 8.331 -0.347 16.509 1.00 0.00 H new ATOM 0 HA3 GLY A 354 8.165 -1.230 18.014 1.00 0.00 H new ATOM 721 N ASN A 355 8.619 -3.647 16.720 1.00 0.00 N ATOM 722 CA ASN A 355 9.401 -4.793 16.266 1.00 0.00 C ATOM 723 C ASN A 355 8.703 -6.100 16.625 1.00 0.00 C ATOM 724 O ASN A 355 8.551 -6.430 17.804 1.00 0.00 O ATOM 725 CB ASN A 355 10.799 -4.768 16.886 1.00 0.00 C ATOM 726 CG ASN A 355 11.703 -5.843 16.312 1.00 0.00 C ATOM 727 OD1 ASN A 355 11.699 -6.096 15.107 1.00 0.00 O ATOM 728 ND2 ASN A 355 12.483 -6.484 17.175 1.00 0.00 N ATOM 0 H ASN A 355 7.815 -3.892 17.298 1.00 0.00 H new ATOM 0 HA ASN A 355 9.492 -4.729 15.182 1.00 0.00 H new ATOM 0 HB2 ASN A 355 11.250 -3.790 16.720 1.00 0.00 H new ATOM 0 HB3 ASN A 355 10.718 -4.902 17.965 1.00 0.00 H new ATOM 0 HD21 ASN A 355 13.111 -7.218 16.847 1.00 0.00 H new ATOM 0 HD22 ASN A 355 12.454 -6.242 18.165 1.00 0.00 H new ATOM 735 N THR A 356 8.280 -6.842 15.605 1.00 0.00 N ATOM 736 CA THR A 356 7.597 -8.117 15.819 1.00 0.00 C ATOM 737 C THR A 356 7.723 -9.037 14.601 1.00 0.00 C ATOM 738 O THR A 356 8.003 -10.228 14.747 1.00 0.00 O ATOM 739 CB THR A 356 6.120 -7.882 16.164 1.00 0.00 C ATOM 740 OG1 THR A 356 5.480 -9.099 16.515 1.00 0.00 O ATOM 741 CG2 THR A 356 5.325 -7.249 15.040 1.00 0.00 C ATOM 0 H THR A 356 8.397 -6.585 14.625 1.00 0.00 H new ATOM 0 HA THR A 356 8.081 -8.615 16.659 1.00 0.00 H new ATOM 0 HB THR A 356 6.136 -7.189 17.005 1.00 0.00 H new ATOM 0 HG1 THR A 356 4.541 -8.924 16.732 1.00 0.00 H new ATOM 0 HG21 THR A 356 4.291 -7.114 15.357 1.00 0.00 H new ATOM 0 HG22 THR A 356 5.757 -6.280 14.789 1.00 0.00 H new ATOM 0 HG23 THR A 356 5.354 -7.897 14.164 1.00 0.00 H new ATOM 749 N TYR A 357 7.518 -8.484 13.404 1.00 0.00 N ATOM 750 CA TYR A 357 7.610 -9.267 12.172 1.00 0.00 C ATOM 751 C TYR A 357 9.066 -9.439 11.739 1.00 0.00 C ATOM 752 O TYR A 357 9.452 -10.505 11.255 1.00 0.00 O ATOM 753 CB TYR A 357 6.806 -8.602 11.049 1.00 0.00 C ATOM 754 CG TYR A 357 5.402 -8.209 11.458 1.00 0.00 C ATOM 755 CD1 TYR A 357 4.446 -9.175 11.747 1.00 0.00 C ATOM 756 CD2 TYR A 357 5.035 -6.873 11.562 1.00 0.00 C ATOM 757 CE1 TYR A 357 3.166 -8.822 12.126 1.00 0.00 C ATOM 758 CE2 TYR A 357 3.756 -6.511 11.942 1.00 0.00 C ATOM 759 CZ TYR A 357 2.825 -7.488 12.223 1.00 0.00 C ATOM 760 OH TYR A 357 1.552 -7.128 12.606 1.00 0.00 O ATOM 0 H TYR A 357 7.288 -7.500 13.262 1.00 0.00 H new ATOM 0 HA TYR A 357 7.190 -10.253 12.372 1.00 0.00 H new ATOM 0 HB2 TYR A 357 7.338 -7.714 10.710 1.00 0.00 H new ATOM 0 HB3 TYR A 357 6.751 -9.284 10.201 1.00 0.00 H new ATOM 0 HD1 TYR A 357 4.709 -10.220 11.674 1.00 0.00 H new ATOM 0 HD2 TYR A 357 5.761 -6.104 11.342 1.00 0.00 H new ATOM 0 HE1 TYR A 357 2.435 -9.586 12.346 1.00 0.00 H new ATOM 0 HE2 TYR A 357 3.488 -5.468 12.018 1.00 0.00 H new ATOM 0 HH TYR A 357 1.480 -6.151 12.625 1.00 0.00 H new ATOM 770 N GLY A 358 9.867 -8.384 11.912 1.00 0.00 N ATOM 771 CA GLY A 358 11.267 -8.442 11.532 1.00 0.00 C ATOM 772 C GLY A 358 11.494 -7.984 10.105 1.00 0.00 C ATOM 773 O GLY A 358 11.273 -6.815 9.782 1.00 0.00 O ATOM 0 H GLY A 358 9.568 -7.493 12.308 1.00 0.00 H new ATOM 0 HA2 GLY A 358 11.851 -7.819 12.209 1.00 0.00 H new ATOM 0 HA3 GLY A 358 11.630 -9.463 11.646 1.00 0.00 H new ATOM 777 N ASN A 359 11.929 -8.908 9.248 1.00 0.00 N ATOM 778 CA ASN A 359 12.181 -8.595 7.845 1.00 0.00 C ATOM 779 C ASN A 359 10.961 -8.931 6.986 1.00 0.00 C ATOM 780 O ASN A 359 11.014 -9.805 6.120 1.00 0.00 O ATOM 781 CB ASN A 359 13.413 -9.358 7.344 1.00 0.00 C ATOM 782 CG ASN A 359 14.265 -8.525 6.404 1.00 0.00 C ATOM 783 OD1 ASN A 359 13.844 -8.193 5.296 1.00 0.00 O ATOM 784 ND2 ASN A 359 15.473 -8.182 6.841 1.00 0.00 N ATOM 0 H ASN A 359 12.114 -9.878 9.503 1.00 0.00 H new ATOM 0 HA ASN A 359 12.373 -7.525 7.761 1.00 0.00 H new ATOM 0 HB2 ASN A 359 14.016 -9.670 8.197 1.00 0.00 H new ATOM 0 HB3 ASN A 359 13.092 -10.265 6.832 1.00 0.00 H new ATOM 0 HD21 ASN A 359 16.089 -7.623 6.251 1.00 0.00 H new ATOM 0 HD22 ASN A 359 15.784 -8.478 7.766 1.00 0.00 H new ATOM 791 N PHE A 360 9.861 -8.223 7.234 1.00 0.00 N ATOM 792 CA PHE A 360 8.628 -8.438 6.489 1.00 0.00 C ATOM 793 C PHE A 360 8.660 -7.697 5.156 1.00 0.00 C ATOM 794 O PHE A 360 9.419 -6.742 4.980 1.00 0.00 O ATOM 795 CB PHE A 360 7.417 -7.981 7.312 1.00 0.00 C ATOM 796 CG PHE A 360 7.396 -6.504 7.603 1.00 0.00 C ATOM 797 CD1 PHE A 360 6.808 -5.617 6.714 1.00 0.00 C ATOM 798 CD2 PHE A 360 7.968 -6.002 8.762 1.00 0.00 C ATOM 799 CE1 PHE A 360 6.791 -4.260 6.976 1.00 0.00 C ATOM 800 CE2 PHE A 360 7.954 -4.646 9.028 1.00 0.00 C ATOM 801 CZ PHE A 360 7.364 -3.775 8.135 1.00 0.00 C ATOM 0 H PHE A 360 9.801 -7.495 7.946 1.00 0.00 H new ATOM 0 HA PHE A 360 8.539 -9.506 6.289 1.00 0.00 H new ATOM 0 HB2 PHE A 360 6.506 -8.248 6.777 1.00 0.00 H new ATOM 0 HB3 PHE A 360 7.405 -8.527 8.255 1.00 0.00 H new ATOM 0 HD1 PHE A 360 6.358 -5.991 5.806 1.00 0.00 H new ATOM 0 HD2 PHE A 360 8.430 -6.679 9.465 1.00 0.00 H new ATOM 0 HE1 PHE A 360 6.330 -3.580 6.275 1.00 0.00 H new ATOM 0 HE2 PHE A 360 8.404 -4.268 9.934 1.00 0.00 H new ATOM 0 HZ PHE A 360 7.350 -2.715 8.342 1.00 0.00 H new ATOM 811 N SER A 361 7.830 -8.147 4.221 1.00 0.00 N ATOM 812 CA SER A 361 7.754 -7.536 2.902 1.00 0.00 C ATOM 813 C SER A 361 6.322 -7.115 2.580 1.00 0.00 C ATOM 814 O SER A 361 5.367 -7.764 3.010 1.00 0.00 O ATOM 815 CB SER A 361 8.265 -8.512 1.841 1.00 0.00 C ATOM 816 OG SER A 361 8.134 -7.968 0.539 1.00 0.00 O ATOM 0 H SER A 361 7.198 -8.937 4.355 1.00 0.00 H new ATOM 0 HA SER A 361 8.382 -6.645 2.900 1.00 0.00 H new ATOM 0 HB2 SER A 361 9.311 -8.750 2.035 1.00 0.00 H new ATOM 0 HB3 SER A 361 7.709 -9.447 1.905 1.00 0.00 H new ATOM 0 HG SER A 361 8.998 -8.008 0.079 1.00 0.00 H new ATOM 822 N LEU A 362 6.184 -6.031 1.816 1.00 0.00 N ATOM 823 CA LEU A 362 4.872 -5.523 1.425 1.00 0.00 C ATOM 824 C LEU A 362 4.619 -5.769 -0.058 1.00 0.00 C ATOM 825 O LEU A 362 5.483 -5.502 -0.894 1.00 0.00 O ATOM 826 CB LEU A 362 4.758 -4.023 1.719 1.00 0.00 C ATOM 827 CG LEU A 362 5.239 -3.585 3.103 1.00 0.00 C ATOM 828 CD1 LEU A 362 5.239 -2.067 3.210 1.00 0.00 C ATOM 829 CD2 LEU A 362 4.368 -4.199 4.189 1.00 0.00 C ATOM 0 H LEU A 362 6.968 -5.488 1.456 1.00 0.00 H new ATOM 0 HA LEU A 362 4.123 -6.057 2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 362 5.328 -3.479 0.966 1.00 0.00 H new ATOM 0 HB3 LEU A 362 3.715 -3.726 1.605 1.00 0.00 H new ATOM 0 HG LEU A 362 6.260 -3.939 3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 362 5.584 -1.772 4.201 1.00 0.00 H new ATOM 0 HD12 LEU A 362 5.905 -1.649 2.455 1.00 0.00 H new ATOM 0 HD13 LEU A 362 4.228 -1.691 3.051 1.00 0.00 H new ATOM 0 HD21 LEU A 362 4.725 -3.877 5.167 1.00 0.00 H new ATOM 0 HD22 LEU A 362 3.336 -3.875 4.054 1.00 0.00 H new ATOM 0 HD23 LEU A 362 4.418 -5.286 4.125 1.00 0.00 H new ATOM 841 N ALA A 363 3.433 -6.277 -0.376 1.00 0.00 N ATOM 842 CA ALA A 363 3.061 -6.559 -1.760 1.00 0.00 C ATOM 843 C ALA A 363 1.544 -6.548 -1.934 1.00 0.00 C ATOM 844 O ALA A 363 0.803 -6.804 -0.987 1.00 0.00 O ATOM 845 CB ALA A 363 3.638 -7.899 -2.200 1.00 0.00 C ATOM 0 H ALA A 363 2.710 -6.503 0.307 1.00 0.00 H new ATOM 0 HA ALA A 363 3.478 -5.773 -2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 363 3.353 -8.096 -3.233 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.725 -7.870 -2.123 1.00 0.00 H new ATOM 0 HB3 ALA A 363 3.250 -8.690 -1.559 1.00 0.00 H new ATOM 851 N THR A 364 1.087 -6.252 -3.147 1.00 0.00 N ATOM 852 CA THR A 364 -0.345 -6.217 -3.431 1.00 0.00 C ATOM 853 C THR A 364 -0.915 -7.636 -3.510 1.00 0.00 C ATOM 854 O THR A 364 -0.166 -8.615 -3.556 1.00 0.00 O ATOM 855 CB THR A 364 -0.614 -5.450 -4.735 1.00 0.00 C ATOM 856 OG1 THR A 364 -2.008 -5.297 -4.960 1.00 0.00 O ATOM 857 CG2 THR A 364 -0.014 -6.114 -5.957 1.00 0.00 C ATOM 0 H THR A 364 1.683 -6.034 -3.945 1.00 0.00 H new ATOM 0 HA THR A 364 -0.846 -5.695 -2.615 1.00 0.00 H new ATOM 0 HB THR A 364 -0.135 -4.481 -4.599 1.00 0.00 H new ATOM 0 HG1 THR A 364 -2.152 -4.804 -5.795 1.00 0.00 H new ATOM 0 HG21 THR A 364 -0.242 -5.520 -6.842 1.00 0.00 H new ATOM 0 HG22 THR A 364 1.067 -6.187 -5.837 1.00 0.00 H new ATOM 0 HG23 THR A 364 -0.435 -7.113 -6.072 1.00 0.00 H new ATOM 865 N MET A 365 -2.241 -7.741 -3.520 1.00 0.00 N ATOM 866 CA MET A 365 -2.906 -9.038 -3.589 1.00 0.00 C ATOM 867 C MET A 365 -2.931 -9.563 -5.024 1.00 0.00 C ATOM 868 O MET A 365 -2.378 -10.625 -5.313 1.00 0.00 O ATOM 869 CB MET A 365 -4.331 -8.940 -3.033 1.00 0.00 C ATOM 870 CG MET A 365 -4.791 -10.201 -2.320 1.00 0.00 C ATOM 871 SD MET A 365 -5.560 -9.857 -0.726 1.00 0.00 S ATOM 872 CE MET A 365 -7.196 -9.341 -1.239 1.00 0.00 C ATOM 0 H MET A 365 -2.876 -6.944 -3.481 1.00 0.00 H new ATOM 0 HA MET A 365 -2.340 -9.741 -2.978 1.00 0.00 H new ATOM 0 HB2 MET A 365 -4.385 -8.100 -2.340 1.00 0.00 H new ATOM 0 HB3 MET A 365 -5.018 -8.724 -3.851 1.00 0.00 H new ATOM 0 HG2 MET A 365 -5.500 -10.734 -2.954 1.00 0.00 H new ATOM 0 HG3 MET A 365 -3.937 -10.862 -2.172 1.00 0.00 H new ATOM 0 HE1 MET A 365 -7.792 -9.094 -0.360 1.00 0.00 H new ATOM 0 HE2 MET A 365 -7.116 -8.464 -1.881 1.00 0.00 H new ATOM 0 HE3 MET A 365 -7.677 -10.150 -1.788 1.00 0.00 H new ATOM 882 N PHE A 366 -3.576 -8.810 -5.917 1.00 0.00 N ATOM 883 CA PHE A 366 -3.676 -9.190 -7.323 1.00 0.00 C ATOM 884 C PHE A 366 -3.666 -7.950 -8.218 1.00 0.00 C ATOM 885 O PHE A 366 -4.448 -7.021 -8.004 1.00 0.00 O ATOM 886 CB PHE A 366 -4.956 -9.996 -7.566 1.00 0.00 C ATOM 887 CG PHE A 366 -4.889 -11.411 -7.063 1.00 0.00 C ATOM 888 CD1 PHE A 366 -3.958 -12.301 -7.575 1.00 0.00 C ATOM 889 CD2 PHE A 366 -5.757 -11.849 -6.076 1.00 0.00 C ATOM 890 CE1 PHE A 366 -3.895 -13.601 -7.111 1.00 0.00 C ATOM 891 CE2 PHE A 366 -5.699 -13.147 -5.609 1.00 0.00 C ATOM 892 CZ PHE A 366 -4.767 -14.024 -6.126 1.00 0.00 C ATOM 0 H PHE A 366 -4.038 -7.930 -5.688 1.00 0.00 H new ATOM 0 HA PHE A 366 -2.813 -9.808 -7.572 1.00 0.00 H new ATOM 0 HB2 PHE A 366 -5.791 -9.488 -7.083 1.00 0.00 H new ATOM 0 HB3 PHE A 366 -5.167 -10.010 -8.635 1.00 0.00 H new ATOM 0 HD1 PHE A 366 -3.274 -11.975 -8.345 1.00 0.00 H new ATOM 0 HD2 PHE A 366 -6.488 -11.167 -5.667 1.00 0.00 H new ATOM 0 HE1 PHE A 366 -3.165 -14.286 -7.518 1.00 0.00 H new ATOM 0 HE2 PHE A 366 -6.382 -13.476 -4.840 1.00 0.00 H new ATOM 0 HZ PHE A 366 -4.719 -15.039 -5.761 1.00 0.00 H new ATOM 902 N PRO A 367 -2.777 -7.914 -9.235 1.00 0.00 N ATOM 903 CA PRO A 367 -1.826 -8.997 -9.524 1.00 0.00 C ATOM 904 C PRO A 367 -0.685 -9.055 -8.506 1.00 0.00 C ATOM 905 O PRO A 367 -0.762 -8.437 -7.444 1.00 0.00 O ATOM 906 CB PRO A 367 -1.286 -8.650 -10.925 1.00 0.00 C ATOM 907 CG PRO A 367 -2.115 -7.506 -11.413 1.00 0.00 C ATOM 908 CD PRO A 367 -2.630 -6.810 -10.188 1.00 0.00 C ATOM 0 HA PRO A 367 -2.302 -9.976 -9.474 1.00 0.00 H new ATOM 0 HB2 PRO A 367 -0.232 -8.377 -10.880 1.00 0.00 H new ATOM 0 HB3 PRO A 367 -1.366 -9.505 -11.597 1.00 0.00 H new ATOM 0 HG2 PRO A 367 -1.521 -6.828 -12.025 1.00 0.00 H new ATOM 0 HG3 PRO A 367 -2.938 -7.859 -12.035 1.00 0.00 H new ATOM 0 HD2 PRO A 367 -1.933 -6.053 -9.828 1.00 0.00 H new ATOM 0 HD3 PRO A 367 -3.578 -6.307 -10.376 1.00 0.00 H new ATOM 916 N ARG A 368 0.372 -9.797 -8.836 1.00 0.00 N ATOM 917 CA ARG A 368 1.523 -9.927 -7.947 1.00 0.00 C ATOM 918 C ARG A 368 2.756 -9.255 -8.549 1.00 0.00 C ATOM 919 O ARG A 368 3.577 -9.905 -9.201 1.00 0.00 O ATOM 920 CB ARG A 368 1.811 -11.404 -7.657 1.00 0.00 C ATOM 921 CG ARG A 368 2.409 -11.647 -6.281 1.00 0.00 C ATOM 922 CD ARG A 368 1.353 -12.101 -5.287 1.00 0.00 C ATOM 923 NE ARG A 368 1.262 -13.559 -5.215 1.00 0.00 N ATOM 924 CZ ARG A 368 2.123 -14.331 -4.542 1.00 0.00 C ATOM 925 NH1 ARG A 368 3.150 -13.789 -3.886 1.00 0.00 N ATOM 926 NH2 ARG A 368 1.962 -15.651 -4.533 1.00 0.00 N ATOM 0 H ARG A 368 0.454 -10.316 -9.711 1.00 0.00 H new ATOM 0 HA ARG A 368 1.285 -9.426 -7.009 1.00 0.00 H new ATOM 0 HB2 ARG A 368 0.884 -11.971 -7.747 1.00 0.00 H new ATOM 0 HB3 ARG A 368 2.494 -11.788 -8.414 1.00 0.00 H new ATOM 0 HG2 ARG A 368 3.192 -12.402 -6.352 1.00 0.00 H new ATOM 0 HG3 ARG A 368 2.880 -10.732 -5.921 1.00 0.00 H new ATOM 0 HD2 ARG A 368 1.589 -11.703 -4.300 1.00 0.00 H new ATOM 0 HD3 ARG A 368 0.385 -11.691 -5.573 1.00 0.00 H new ATOM 0 HE ARG A 368 0.495 -14.015 -5.708 1.00 0.00 H new ATOM 0 HH11 ARG A 368 3.284 -12.778 -3.895 1.00 0.00 H new ATOM 0 HH12 ARG A 368 3.801 -14.386 -3.376 1.00 0.00 H new ATOM 0 HH21 ARG A 368 1.183 -16.073 -5.039 1.00 0.00 H new ATOM 0 HH22 ARG A 368 2.617 -16.241 -4.021 1.00 0.00 H new ATOM 940 N ARG A 369 2.879 -7.947 -8.326 1.00 0.00 N ATOM 941 CA ARG A 369 4.015 -7.182 -8.842 1.00 0.00 C ATOM 942 C ARG A 369 5.150 -7.091 -7.817 1.00 0.00 C ATOM 943 O ARG A 369 6.245 -6.631 -8.146 1.00 0.00 O ATOM 944 CB ARG A 369 3.572 -5.773 -9.250 1.00 0.00 C ATOM 945 CG ARG A 369 3.067 -4.922 -8.091 1.00 0.00 C ATOM 946 CD ARG A 369 2.184 -3.781 -8.578 1.00 0.00 C ATOM 947 NE ARG A 369 1.109 -4.246 -9.458 1.00 0.00 N ATOM 948 CZ ARG A 369 0.406 -3.447 -10.268 1.00 0.00 C ATOM 949 NH1 ARG A 369 0.642 -2.137 -10.295 1.00 0.00 N ATOM 950 NH2 ARG A 369 -0.535 -3.958 -11.054 1.00 0.00 N ATOM 0 H ARG A 369 2.207 -7.395 -7.792 1.00 0.00 H new ATOM 0 HA ARG A 369 4.391 -7.711 -9.718 1.00 0.00 H new ATOM 0 HB2 ARG A 369 4.411 -5.263 -9.724 1.00 0.00 H new ATOM 0 HB3 ARG A 369 2.784 -5.854 -9.999 1.00 0.00 H new ATOM 0 HG2 ARG A 369 2.505 -5.547 -7.397 1.00 0.00 H new ATOM 0 HG3 ARG A 369 3.915 -4.517 -7.539 1.00 0.00 H new ATOM 0 HD2 ARG A 369 1.751 -3.268 -7.719 1.00 0.00 H new ATOM 0 HD3 ARG A 369 2.796 -3.052 -9.110 1.00 0.00 H new ATOM 0 HE ARG A 369 0.883 -5.241 -9.453 1.00 0.00 H new ATOM 0 HH11 ARG A 369 1.363 -1.736 -9.695 1.00 0.00 H new ATOM 0 HH12 ARG A 369 0.102 -1.534 -10.915 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -0.722 -4.961 -11.040 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -1.071 -3.348 -11.671 1.00 0.00 H new ATOM 964 N GLU A 370 4.885 -7.529 -6.579 1.00 0.00 N ATOM 965 CA GLU A 370 5.883 -7.492 -5.514 1.00 0.00 C ATOM 966 C GLU A 370 6.248 -6.049 -5.155 1.00 0.00 C ATOM 967 O GLU A 370 5.549 -5.106 -5.531 1.00 0.00 O ATOM 968 CB GLU A 370 7.134 -8.278 -5.929 1.00 0.00 C ATOM 969 CG GLU A 370 7.748 -9.097 -4.803 1.00 0.00 C ATOM 970 CD GLU A 370 7.849 -10.571 -5.141 1.00 0.00 C ATOM 971 OE1 GLU A 370 8.865 -10.973 -5.746 1.00 0.00 O ATOM 972 OE2 GLU A 370 6.912 -11.324 -4.800 1.00 0.00 O ATOM 0 H GLU A 370 3.984 -7.913 -6.295 1.00 0.00 H new ATOM 0 HA GLU A 370 5.455 -7.961 -4.628 1.00 0.00 H new ATOM 0 HB2 GLU A 370 6.876 -8.945 -6.752 1.00 0.00 H new ATOM 0 HB3 GLU A 370 7.881 -7.580 -6.307 1.00 0.00 H new ATOM 0 HG2 GLU A 370 8.742 -8.711 -4.579 1.00 0.00 H new ATOM 0 HG3 GLU A 370 7.148 -8.975 -3.901 1.00 0.00 H new ATOM 979 N PHE A 371 7.346 -5.891 -4.419 1.00 0.00 N ATOM 980 CA PHE A 371 7.815 -4.578 -3.995 1.00 0.00 C ATOM 981 C PHE A 371 9.083 -4.183 -4.746 1.00 0.00 C ATOM 982 O PHE A 371 9.615 -4.958 -5.544 1.00 0.00 O ATOM 983 CB PHE A 371 8.093 -4.579 -2.488 1.00 0.00 C ATOM 984 CG PHE A 371 9.250 -5.460 -2.096 1.00 0.00 C ATOM 985 CD1 PHE A 371 9.077 -6.828 -1.957 1.00 0.00 C ATOM 986 CD2 PHE A 371 10.508 -4.923 -1.874 1.00 0.00 C ATOM 987 CE1 PHE A 371 10.134 -7.643 -1.605 1.00 0.00 C ATOM 988 CE2 PHE A 371 11.570 -5.734 -1.521 1.00 0.00 C ATOM 989 CZ PHE A 371 11.383 -7.096 -1.386 1.00 0.00 C ATOM 0 H PHE A 371 7.931 -6.665 -4.103 1.00 0.00 H new ATOM 0 HA PHE A 371 7.034 -3.852 -4.221 1.00 0.00 H new ATOM 0 HB2 PHE A 371 8.296 -3.559 -2.162 1.00 0.00 H new ATOM 0 HB3 PHE A 371 7.198 -4.910 -1.961 1.00 0.00 H new ATOM 0 HD1 PHE A 371 8.103 -7.262 -2.126 1.00 0.00 H new ATOM 0 HD2 PHE A 371 10.660 -3.859 -1.978 1.00 0.00 H new ATOM 0 HE1 PHE A 371 9.984 -8.708 -1.501 1.00 0.00 H new ATOM 0 HE2 PHE A 371 12.546 -5.303 -1.351 1.00 0.00 H new ATOM 0 HZ PHE A 371 12.211 -7.731 -1.110 1.00 0.00 H new ATOM 999 N THR A 372 9.567 -2.975 -4.469 1.00 0.00 N ATOM 1000 CA THR A 372 10.781 -2.462 -5.097 1.00 0.00 C ATOM 1001 C THR A 372 11.237 -1.183 -4.400 1.00 0.00 C ATOM 1002 O THR A 372 10.428 -0.480 -3.791 1.00 0.00 O ATOM 1003 CB THR A 372 10.554 -2.199 -6.596 1.00 0.00 C ATOM 1004 OG1 THR A 372 9.171 -2.181 -6.910 1.00 0.00 O ATOM 1005 CG2 THR A 372 11.206 -3.233 -7.491 1.00 0.00 C ATOM 0 H THR A 372 9.133 -2.329 -3.809 1.00 0.00 H new ATOM 0 HA THR A 372 11.561 -3.216 -4.997 1.00 0.00 H new ATOM 0 HB THR A 372 11.013 -1.228 -6.783 1.00 0.00 H new ATOM 0 HG1 THR A 372 9.055 -2.011 -7.868 1.00 0.00 H new ATOM 0 HG21 THR A 372 11.007 -2.988 -8.534 1.00 0.00 H new ATOM 0 HG22 THR A 372 12.282 -3.237 -7.318 1.00 0.00 H new ATOM 0 HG23 THR A 372 10.798 -4.218 -7.265 1.00 0.00 H new ATOM 1013 N LYS A 373 12.534 -0.885 -4.493 1.00 0.00 N ATOM 1014 CA LYS A 373 13.093 0.317 -3.870 1.00 0.00 C ATOM 1015 C LYS A 373 12.334 1.569 -4.314 1.00 0.00 C ATOM 1016 O LYS A 373 12.229 2.538 -3.562 1.00 0.00 O ATOM 1017 CB LYS A 373 14.579 0.459 -4.212 1.00 0.00 C ATOM 1018 CG LYS A 373 15.455 0.756 -3.005 1.00 0.00 C ATOM 1019 CD LYS A 373 16.120 2.120 -3.113 1.00 0.00 C ATOM 1020 CE LYS A 373 17.557 2.079 -2.614 1.00 0.00 C ATOM 1021 NZ LYS A 373 17.858 3.200 -1.680 1.00 0.00 N ATOM 0 H LYS A 373 13.215 -1.457 -4.992 1.00 0.00 H new ATOM 0 HA LYS A 373 12.987 0.213 -2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 373 14.924 -0.461 -4.684 1.00 0.00 H new ATOM 0 HB3 LYS A 373 14.700 1.258 -4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 373 14.851 0.717 -2.099 1.00 0.00 H new ATOM 0 HG3 LYS A 373 16.220 -0.015 -2.912 1.00 0.00 H new ATOM 0 HD2 LYS A 373 16.103 2.453 -4.151 1.00 0.00 H new ATOM 0 HD3 LYS A 373 15.553 2.849 -2.535 1.00 0.00 H new ATOM 0 HE2 LYS A 373 17.738 1.129 -2.110 1.00 0.00 H new ATOM 0 HE3 LYS A 373 18.237 2.124 -3.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 373 18.847 3.133 -1.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 373 17.710 4.107 -2.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 373 17.227 3.143 -0.855 1.00 0.00 H new ATOM 1035 N GLU A 374 11.807 1.537 -5.540 1.00 0.00 N ATOM 1036 CA GLU A 374 11.055 2.661 -6.086 1.00 0.00 C ATOM 1037 C GLU A 374 9.626 2.691 -5.545 1.00 0.00 C ATOM 1038 O GLU A 374 9.074 3.762 -5.304 1.00 0.00 O ATOM 1039 CB GLU A 374 11.019 2.579 -7.613 1.00 0.00 C ATOM 1040 CG GLU A 374 10.891 3.934 -8.292 1.00 0.00 C ATOM 1041 CD GLU A 374 9.941 3.917 -9.475 1.00 0.00 C ATOM 1042 OE1 GLU A 374 10.133 3.082 -10.384 1.00 0.00 O ATOM 1043 OE2 GLU A 374 9.008 4.749 -9.495 1.00 0.00 O ATOM 0 H GLU A 374 11.889 0.741 -6.172 1.00 0.00 H new ATOM 0 HA GLU A 374 11.559 3.577 -5.779 1.00 0.00 H new ATOM 0 HB2 GLU A 374 11.928 2.090 -7.964 1.00 0.00 H new ATOM 0 HB3 GLU A 374 10.182 1.950 -7.915 1.00 0.00 H new ATOM 0 HG2 GLU A 374 10.543 4.667 -7.564 1.00 0.00 H new ATOM 0 HG3 GLU A 374 11.875 4.260 -8.628 1.00 0.00 H new ATOM 1050 N ASP A 375 9.030 1.510 -5.373 1.00 0.00 N ATOM 1051 CA ASP A 375 7.658 1.389 -4.879 1.00 0.00 C ATOM 1052 C ASP A 375 7.430 2.162 -3.579 1.00 0.00 C ATOM 1053 O ASP A 375 6.339 2.681 -3.352 1.00 0.00 O ATOM 1054 CB ASP A 375 7.306 -0.087 -4.669 1.00 0.00 C ATOM 1055 CG ASP A 375 6.828 -0.774 -5.938 1.00 0.00 C ATOM 1056 OD1 ASP A 375 7.142 -0.282 -7.047 1.00 0.00 O ATOM 1057 OD2 ASP A 375 6.134 -1.806 -5.822 1.00 0.00 O ATOM 0 H ASP A 375 9.481 0.617 -5.571 1.00 0.00 H new ATOM 0 HA ASP A 375 7.007 1.827 -5.636 1.00 0.00 H new ATOM 0 HB2 ASP A 375 8.181 -0.612 -4.287 1.00 0.00 H new ATOM 0 HB3 ASP A 375 6.530 -0.164 -3.907 1.00 0.00 H new ATOM 1062 N TYR A 376 8.453 2.227 -2.725 1.00 0.00 N ATOM 1063 CA TYR A 376 8.340 2.930 -1.446 1.00 0.00 C ATOM 1064 C TYR A 376 8.521 4.434 -1.624 1.00 0.00 C ATOM 1065 O TYR A 376 7.674 5.221 -1.198 1.00 0.00 O ATOM 1066 CB TYR A 376 9.365 2.390 -0.444 1.00 0.00 C ATOM 1067 CG TYR A 376 9.085 0.968 0.000 1.00 0.00 C ATOM 1068 CD1 TYR A 376 9.417 -0.109 -0.812 1.00 0.00 C ATOM 1069 CD2 TYR A 376 8.483 0.703 1.226 1.00 0.00 C ATOM 1070 CE1 TYR A 376 9.158 -1.408 -0.420 1.00 0.00 C ATOM 1071 CE2 TYR A 376 8.223 -0.594 1.625 1.00 0.00 C ATOM 1072 CZ TYR A 376 8.561 -1.645 0.800 1.00 0.00 C ATOM 1073 OH TYR A 376 8.301 -2.939 1.196 1.00 0.00 O ATOM 0 H TYR A 376 9.365 1.803 -2.895 1.00 0.00 H new ATOM 0 HA TYR A 376 7.338 2.752 -1.056 1.00 0.00 H new ATOM 0 HB2 TYR A 376 10.358 2.433 -0.892 1.00 0.00 H new ATOM 0 HB3 TYR A 376 9.382 3.039 0.432 1.00 0.00 H new ATOM 0 HD1 TYR A 376 9.886 0.073 -1.768 1.00 0.00 H new ATOM 0 HD2 TYR A 376 8.215 1.523 1.875 1.00 0.00 H new ATOM 0 HE1 TYR A 376 9.422 -2.233 -1.065 1.00 0.00 H new ATOM 0 HE2 TYR A 376 7.756 -0.784 2.580 1.00 0.00 H new ATOM 0 HH TYR A 376 7.879 -2.932 2.080 1.00 0.00 H new ATOM 1083 N LYS A 377 9.632 4.825 -2.251 1.00 0.00 N ATOM 1084 CA LYS A 377 9.934 6.241 -2.485 1.00 0.00 C ATOM 1085 C LYS A 377 8.880 6.912 -3.376 1.00 0.00 C ATOM 1086 O LYS A 377 8.590 8.097 -3.206 1.00 0.00 O ATOM 1087 CB LYS A 377 11.327 6.411 -3.111 1.00 0.00 C ATOM 1088 CG LYS A 377 11.535 5.631 -4.404 1.00 0.00 C ATOM 1089 CD LYS A 377 10.925 6.350 -5.598 1.00 0.00 C ATOM 1090 CE LYS A 377 11.943 6.562 -6.707 1.00 0.00 C ATOM 1091 NZ LYS A 377 11.343 7.224 -7.902 1.00 0.00 N ATOM 0 H LYS A 377 10.339 4.181 -2.607 1.00 0.00 H new ATOM 0 HA LYS A 377 9.918 6.732 -1.512 1.00 0.00 H new ATOM 0 HB2 LYS A 377 11.497 7.470 -3.308 1.00 0.00 H new ATOM 0 HB3 LYS A 377 12.078 6.097 -2.387 1.00 0.00 H new ATOM 0 HG2 LYS A 377 12.602 5.485 -4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 377 11.089 4.641 -4.308 1.00 0.00 H new ATOM 0 HD2 LYS A 377 10.085 5.771 -5.981 1.00 0.00 H new ATOM 0 HD3 LYS A 377 10.529 7.314 -5.279 1.00 0.00 H new ATOM 0 HE2 LYS A 377 12.766 7.170 -6.331 1.00 0.00 H new ATOM 0 HE3 LYS A 377 12.365 5.601 -7.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 377 12.000 7.152 -8.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 377 10.447 6.756 -8.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 377 11.164 8.226 -7.690 1.00 0.00 H new ATOM 1105 N LYS A 378 8.324 6.162 -4.331 1.00 0.00 N ATOM 1106 CA LYS A 378 7.319 6.707 -5.244 1.00 0.00 C ATOM 1107 C LYS A 378 5.959 6.843 -4.559 1.00 0.00 C ATOM 1108 O LYS A 378 5.772 6.393 -3.426 1.00 0.00 O ATOM 1109 CB LYS A 378 7.198 5.832 -6.502 1.00 0.00 C ATOM 1110 CG LYS A 378 6.416 4.541 -6.296 1.00 0.00 C ATOM 1111 CD LYS A 378 6.726 3.524 -7.383 1.00 0.00 C ATOM 1112 CE LYS A 378 5.499 2.720 -7.771 1.00 0.00 C ATOM 1113 NZ LYS A 378 5.630 2.127 -9.133 1.00 0.00 N ATOM 0 H LYS A 378 8.552 5.181 -4.491 1.00 0.00 H new ATOM 0 HA LYS A 378 7.648 7.703 -5.540 1.00 0.00 H new ATOM 0 HB2 LYS A 378 6.717 6.413 -7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 378 8.199 5.584 -6.855 1.00 0.00 H new ATOM 0 HG2 LYS A 378 6.659 4.119 -5.321 1.00 0.00 H new ATOM 0 HG3 LYS A 378 5.348 4.758 -6.293 1.00 0.00 H new ATOM 0 HD2 LYS A 378 7.116 4.039 -8.261 1.00 0.00 H new ATOM 0 HD3 LYS A 378 7.508 2.849 -7.036 1.00 0.00 H new ATOM 0 HE2 LYS A 378 5.341 1.925 -7.043 1.00 0.00 H new ATOM 0 HE3 LYS A 378 4.619 3.362 -7.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 378 4.724 1.702 -9.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 378 5.890 2.871 -9.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 378 6.368 1.394 -9.123 1.00 0.00 H new ATOM 1127 N LYS A 379 5.015 7.470 -5.261 1.00 0.00 N ATOM 1128 CA LYS A 379 3.663 7.678 -4.738 1.00 0.00 C ATOM 1129 C LYS A 379 2.904 6.348 -4.603 1.00 0.00 C ATOM 1130 O LYS A 379 3.476 5.273 -4.801 1.00 0.00 O ATOM 1131 CB LYS A 379 2.892 8.642 -5.645 1.00 0.00 C ATOM 1132 CG LYS A 379 2.783 8.173 -7.087 1.00 0.00 C ATOM 1133 CD LYS A 379 2.622 9.341 -8.045 1.00 0.00 C ATOM 1134 CE LYS A 379 3.951 9.743 -8.664 1.00 0.00 C ATOM 1135 NZ LYS A 379 3.888 11.094 -9.289 1.00 0.00 N ATOM 0 H LYS A 379 5.162 7.845 -6.198 1.00 0.00 H new ATOM 0 HA LYS A 379 3.748 8.115 -3.743 1.00 0.00 H new ATOM 0 HB2 LYS A 379 1.889 8.782 -5.242 1.00 0.00 H new ATOM 0 HB3 LYS A 379 3.382 9.615 -5.625 1.00 0.00 H new ATOM 0 HG2 LYS A 379 3.674 7.604 -7.353 1.00 0.00 H new ATOM 0 HG3 LYS A 379 1.932 7.499 -7.188 1.00 0.00 H new ATOM 0 HD2 LYS A 379 1.919 9.072 -8.833 1.00 0.00 H new ATOM 0 HD3 LYS A 379 2.195 10.192 -7.514 1.00 0.00 H new ATOM 0 HE2 LYS A 379 4.726 9.734 -7.897 1.00 0.00 H new ATOM 0 HE3 LYS A 379 4.238 9.008 -9.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 4.814 11.330 -9.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 3.167 11.097 -10.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 3.639 11.800 -8.566 1.00 0.00 H new ATOM 1149 N LEU A 380 1.619 6.428 -4.250 1.00 0.00 N ATOM 1150 CA LEU A 380 0.793 5.233 -4.067 1.00 0.00 C ATOM 1151 C LEU A 380 -0.006 4.878 -5.324 1.00 0.00 C ATOM 1152 O LEU A 380 0.043 3.739 -5.787 1.00 0.00 O ATOM 1153 CB LEU A 380 -0.158 5.429 -2.887 1.00 0.00 C ATOM 1154 CG LEU A 380 0.397 4.989 -1.531 1.00 0.00 C ATOM 1155 CD1 LEU A 380 1.195 6.112 -0.889 1.00 0.00 C ATOM 1156 CD2 LEU A 380 -0.733 4.546 -0.618 1.00 0.00 C ATOM 0 H LEU A 380 1.129 7.307 -4.085 1.00 0.00 H new ATOM 0 HA LEU A 380 1.469 4.402 -3.864 1.00 0.00 H new ATOM 0 HB2 LEU A 380 -0.427 6.484 -2.828 1.00 0.00 H new ATOM 0 HB3 LEU A 380 -1.076 4.876 -3.084 1.00 0.00 H new ATOM 0 HG LEU A 380 1.066 4.143 -1.689 1.00 0.00 H new ATOM 0 HD11 LEU A 380 1.581 5.779 0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 380 2.027 6.385 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU A 380 0.550 6.978 -0.742 1.00 0.00 H new ATOM 0 HD21 LEU A 380 -0.324 4.236 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 380 -1.425 5.375 -0.467 1.00 0.00 H new ATOM 0 HD23 LEU A 380 -1.262 3.709 -1.074 1.00 0.00 H new ATOM 1168 N LEU A 381 -0.755 5.847 -5.861 1.00 0.00 N ATOM 1169 CA LEU A 381 -1.576 5.608 -7.059 1.00 0.00 C ATOM 1170 C LEU A 381 -0.738 5.098 -8.242 1.00 0.00 C ATOM 1171 O LEU A 381 -1.283 4.495 -9.170 1.00 0.00 O ATOM 1172 CB LEU A 381 -2.378 6.869 -7.444 1.00 0.00 C ATOM 1173 CG LEU A 381 -1.761 7.804 -8.504 1.00 0.00 C ATOM 1174 CD1 LEU A 381 -0.300 8.098 -8.205 1.00 0.00 C ATOM 1175 CD2 LEU A 381 -1.913 7.227 -9.906 1.00 0.00 C ATOM 0 H LEU A 381 -0.812 6.796 -5.492 1.00 0.00 H new ATOM 0 HA LEU A 381 -2.286 4.820 -6.809 1.00 0.00 H new ATOM 0 HB2 LEU A 381 -3.356 6.550 -7.804 1.00 0.00 H new ATOM 0 HB3 LEU A 381 -2.547 7.451 -6.538 1.00 0.00 H new ATOM 0 HG LEU A 381 -2.309 8.745 -8.461 1.00 0.00 H new ATOM 0 HD11 LEU A 381 0.102 8.760 -8.972 1.00 0.00 H new ATOM 0 HD12 LEU A 381 -0.218 8.580 -7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 381 0.265 7.166 -8.197 1.00 0.00 H new ATOM 0 HD21 LEU A 381 -1.468 7.909 -10.630 1.00 0.00 H new ATOM 0 HD22 LEU A 381 -1.409 6.262 -9.959 1.00 0.00 H new ATOM 0 HD23 LEU A 381 -2.971 7.096 -10.133 1.00 0.00 H new ATOM 1187 N ASP A 382 0.583 5.327 -8.201 1.00 0.00 N ATOM 1188 CA ASP A 382 1.485 4.871 -9.265 1.00 0.00 C ATOM 1189 C ASP A 382 1.343 3.363 -9.485 1.00 0.00 C ATOM 1190 O ASP A 382 1.536 2.867 -10.595 1.00 0.00 O ATOM 1191 CB ASP A 382 2.942 5.212 -8.915 1.00 0.00 C ATOM 1192 CG ASP A 382 3.902 5.053 -10.086 1.00 0.00 C ATOM 1193 OD1 ASP A 382 3.441 5.021 -11.248 1.00 0.00 O ATOM 1194 OD2 ASP A 382 5.123 4.959 -9.836 1.00 0.00 O ATOM 0 H ASP A 382 1.049 5.825 -7.442 1.00 0.00 H new ATOM 0 HA ASP A 382 1.211 5.386 -10.186 1.00 0.00 H new ATOM 0 HB2 ASP A 382 2.989 6.239 -8.554 1.00 0.00 H new ATOM 0 HB3 ASP A 382 3.270 4.571 -8.097 1.00 0.00 H new ATOM 1199 N LEU A 383 0.996 2.641 -8.419 1.00 0.00 N ATOM 1200 CA LEU A 383 0.818 1.196 -8.497 1.00 0.00 C ATOM 1201 C LEU A 383 -0.670 0.827 -8.483 1.00 0.00 C ATOM 1202 O LEU A 383 -1.029 -0.298 -8.130 1.00 0.00 O ATOM 1203 CB LEU A 383 1.534 0.516 -7.327 1.00 0.00 C ATOM 1204 CG LEU A 383 2.987 0.947 -7.109 1.00 0.00 C ATOM 1205 CD1 LEU A 383 3.250 1.207 -5.634 1.00 0.00 C ATOM 1206 CD2 LEU A 383 3.941 -0.110 -7.645 1.00 0.00 C ATOM 0 H LEU A 383 0.833 3.036 -7.493 1.00 0.00 H new ATOM 0 HA LEU A 383 1.250 0.848 -9.435 1.00 0.00 H new ATOM 0 HB2 LEU A 383 0.973 0.715 -6.414 1.00 0.00 H new ATOM 0 HB3 LEU A 383 1.512 -0.562 -7.486 1.00 0.00 H new ATOM 0 HG LEU A 383 3.158 1.874 -7.656 1.00 0.00 H new ATOM 0 HD11 LEU A 383 4.287 1.512 -5.498 1.00 0.00 H new ATOM 0 HD12 LEU A 383 2.589 1.999 -5.281 1.00 0.00 H new ATOM 0 HD13 LEU A 383 3.062 0.297 -5.065 1.00 0.00 H new ATOM 0 HD21 LEU A 383 4.970 0.212 -7.482 1.00 0.00 H new ATOM 0 HD22 LEU A 383 3.769 -1.052 -7.125 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.769 -0.248 -8.712 1.00 0.00 H new ATOM 1218 N GLU A 384 -1.530 1.782 -8.867 1.00 0.00 N ATOM 1219 CA GLU A 384 -2.976 1.566 -8.898 1.00 0.00 C ATOM 1220 C GLU A 384 -3.501 1.160 -7.518 1.00 0.00 C ATOM 1221 O GLU A 384 -3.954 0.030 -7.318 1.00 0.00 O ATOM 1222 CB GLU A 384 -3.335 0.500 -9.938 1.00 0.00 C ATOM 1223 CG GLU A 384 -3.234 0.985 -11.377 1.00 0.00 C ATOM 1224 CD GLU A 384 -2.212 0.203 -12.182 1.00 0.00 C ATOM 1225 OE1 GLU A 384 -2.481 -0.977 -12.496 1.00 0.00 O ATOM 1226 OE2 GLU A 384 -1.143 0.766 -12.491 1.00 0.00 O ATOM 0 H GLU A 384 -1.242 2.715 -9.161 1.00 0.00 H new ATOM 0 HA GLU A 384 -3.452 2.506 -9.179 1.00 0.00 H new ATOM 0 HB2 GLU A 384 -2.676 -0.358 -9.807 1.00 0.00 H new ATOM 0 HB3 GLU A 384 -4.351 0.153 -9.752 1.00 0.00 H new ATOM 0 HG2 GLU A 384 -4.210 0.901 -11.855 1.00 0.00 H new ATOM 0 HG3 GLU A 384 -2.966 2.041 -11.383 1.00 0.00 H new ATOM 1233 N LEU A 385 -3.440 2.093 -6.566 1.00 0.00 N ATOM 1234 CA LEU A 385 -3.913 1.833 -5.204 1.00 0.00 C ATOM 1235 C LEU A 385 -5.255 2.513 -4.947 1.00 0.00 C ATOM 1236 O LEU A 385 -6.079 1.998 -4.194 1.00 0.00 O ATOM 1237 CB LEU A 385 -2.885 2.301 -4.171 1.00 0.00 C ATOM 1238 CG LEU A 385 -1.527 1.591 -4.239 1.00 0.00 C ATOM 1239 CD1 LEU A 385 -0.570 2.158 -3.202 1.00 0.00 C ATOM 1240 CD2 LEU A 385 -1.694 0.091 -4.047 1.00 0.00 C ATOM 0 H LEU A 385 -3.069 3.032 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 385 -4.047 0.756 -5.104 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.725 3.372 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -3.303 2.158 -3.174 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.103 1.765 -5.228 1.00 0.00 H new ATOM 0 HD11 LEU A 385 0.387 1.640 -3.268 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.420 3.222 -3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -0.990 2.020 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -0.719 -0.393 -4.099 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.144 -0.103 -3.074 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.339 -0.307 -4.831 1.00 0.00 H new ATOM 1252 N ALA A 386 -5.470 3.671 -5.577 1.00 0.00 N ATOM 1253 CA ALA A 386 -6.715 4.410 -5.413 1.00 0.00 C ATOM 1254 C ALA A 386 -7.851 3.749 -6.198 1.00 0.00 C ATOM 1255 O ALA A 386 -7.641 3.254 -7.308 1.00 0.00 O ATOM 1256 CB ALA A 386 -6.533 5.853 -5.855 1.00 0.00 C ATOM 0 H ALA A 386 -4.797 4.113 -6.203 1.00 0.00 H new ATOM 0 HA ALA A 386 -6.983 4.398 -4.356 1.00 0.00 H new ATOM 0 HB1 ALA A 386 -7.471 6.394 -5.727 1.00 0.00 H new ATOM 0 HB2 ALA A 386 -5.758 6.324 -5.251 1.00 0.00 H new ATOM 0 HB3 ALA A 386 -6.240 5.878 -6.905 1.00 0.00 H new ATOM 1262 N PRO A 387 -9.074 3.724 -5.629 1.00 0.00 N ATOM 1263 CA PRO A 387 -9.361 4.299 -4.316 1.00 0.00 C ATOM 1264 C PRO A 387 -9.170 3.316 -3.155 1.00 0.00 C ATOM 1265 O PRO A 387 -9.327 3.700 -1.998 1.00 0.00 O ATOM 1266 CB PRO A 387 -10.830 4.680 -4.447 1.00 0.00 C ATOM 1267 CG PRO A 387 -11.414 3.655 -5.366 1.00 0.00 C ATOM 1268 CD PRO A 387 -10.286 3.136 -6.230 1.00 0.00 C ATOM 0 HA PRO A 387 -8.686 5.121 -4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 387 -11.328 4.671 -3.478 1.00 0.00 H new ATOM 0 HB3 PRO A 387 -10.943 5.685 -4.854 1.00 0.00 H new ATOM 0 HG2 PRO A 387 -11.869 2.843 -4.798 1.00 0.00 H new ATOM 0 HG3 PRO A 387 -12.200 4.093 -5.981 1.00 0.00 H new ATOM 0 HD2 PRO A 387 -10.247 2.047 -6.222 1.00 0.00 H new ATOM 0 HD3 PRO A 387 -10.405 3.444 -7.269 1.00 0.00 H new ATOM 1276 N SER A 388 -8.840 2.053 -3.459 1.00 0.00 N ATOM 1277 CA SER A 388 -8.641 1.042 -2.417 1.00 0.00 C ATOM 1278 C SER A 388 -7.666 -0.048 -2.873 1.00 0.00 C ATOM 1279 O SER A 388 -7.651 -0.429 -4.046 1.00 0.00 O ATOM 1280 CB SER A 388 -9.979 0.404 -2.027 1.00 0.00 C ATOM 1281 OG SER A 388 -10.958 1.388 -1.736 1.00 0.00 O ATOM 0 H SER A 388 -8.707 1.711 -4.411 1.00 0.00 H new ATOM 0 HA SER A 388 -8.213 1.545 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 388 -10.331 -0.232 -2.839 1.00 0.00 H new ATOM 0 HB3 SER A 388 -9.838 -0.238 -1.158 1.00 0.00 H new ATOM 0 HG SER A 388 -11.800 0.950 -1.492 1.00 0.00 H new ATOM 1287 N ALA A 389 -6.852 -0.542 -1.934 1.00 0.00 N ATOM 1288 CA ALA A 389 -5.867 -1.582 -2.228 1.00 0.00 C ATOM 1289 C ALA A 389 -5.514 -2.391 -0.977 1.00 0.00 C ATOM 1290 O ALA A 389 -5.609 -1.891 0.146 1.00 0.00 O ATOM 1291 CB ALA A 389 -4.612 -0.955 -2.816 1.00 0.00 C ATOM 0 H ALA A 389 -6.858 -0.235 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 389 -6.306 -2.266 -2.954 1.00 0.00 H new ATOM 0 HB1 ALA A 389 -3.883 -1.735 -3.033 1.00 0.00 H new ATOM 0 HB2 ALA A 389 -4.865 -0.429 -3.737 1.00 0.00 H new ATOM 0 HB3 ALA A 389 -4.188 -0.250 -2.101 1.00 0.00 H new ATOM 1297 N SER A 390 -5.101 -3.643 -1.183 1.00 0.00 N ATOM 1298 CA SER A 390 -4.726 -4.528 -0.079 1.00 0.00 C ATOM 1299 C SER A 390 -3.251 -4.916 -0.162 1.00 0.00 C ATOM 1300 O SER A 390 -2.690 -5.034 -1.255 1.00 0.00 O ATOM 1301 CB SER A 390 -5.595 -5.787 -0.092 1.00 0.00 C ATOM 1302 OG SER A 390 -6.893 -5.514 0.406 1.00 0.00 O ATOM 0 H SER A 390 -5.018 -4.068 -2.107 1.00 0.00 H new ATOM 0 HA SER A 390 -4.888 -3.988 0.854 1.00 0.00 H new ATOM 0 HB2 SER A 390 -5.666 -6.174 -1.109 1.00 0.00 H new ATOM 0 HB3 SER A 390 -5.126 -6.563 0.512 1.00 0.00 H new ATOM 0 HG SER A 390 -7.430 -6.333 0.386 1.00 0.00 H new ATOM 1308 N VAL A 391 -2.626 -5.115 0.999 1.00 0.00 N ATOM 1309 CA VAL A 391 -1.213 -5.491 1.061 1.00 0.00 C ATOM 1310 C VAL A 391 -1.040 -6.897 1.642 1.00 0.00 C ATOM 1311 O VAL A 391 -1.973 -7.465 2.211 1.00 0.00 O ATOM 1312 CB VAL A 391 -0.390 -4.481 1.903 1.00 0.00 C ATOM 1313 CG1 VAL A 391 -0.914 -3.067 1.712 1.00 0.00 C ATOM 1314 CG2 VAL A 391 -0.412 -4.852 3.376 1.00 0.00 C ATOM 0 H VAL A 391 -3.076 -5.022 1.910 1.00 0.00 H new ATOM 0 HA VAL A 391 -0.838 -5.479 0.037 1.00 0.00 H new ATOM 0 HB VAL A 391 0.642 -4.522 1.554 1.00 0.00 H new ATOM 0 HG11 VAL A 391 -0.322 -2.376 2.312 1.00 0.00 H new ATOM 0 HG12 VAL A 391 -0.840 -2.790 0.660 1.00 0.00 H new ATOM 0 HG13 VAL A 391 -1.956 -3.020 2.027 1.00 0.00 H new ATOM 0 HG21 VAL A 391 0.173 -4.127 3.943 1.00 0.00 H new ATOM 0 HG22 VAL A 391 -1.441 -4.850 3.736 1.00 0.00 H new ATOM 0 HG23 VAL A 391 0.016 -5.846 3.507 1.00 0.00 H new ATOM 1324 N VAL A 392 0.166 -7.445 1.503 1.00 0.00 N ATOM 1325 CA VAL A 392 0.476 -8.775 2.018 1.00 0.00 C ATOM 1326 C VAL A 392 1.755 -8.744 2.854 1.00 0.00 C ATOM 1327 O VAL A 392 2.830 -8.421 2.346 1.00 0.00 O ATOM 1328 CB VAL A 392 0.628 -9.813 0.880 1.00 0.00 C ATOM 1329 CG1 VAL A 392 -0.665 -9.934 0.088 1.00 0.00 C ATOM 1330 CG2 VAL A 392 1.788 -9.454 -0.041 1.00 0.00 C ATOM 0 H VAL A 392 0.947 -6.985 1.035 1.00 0.00 H new ATOM 0 HA VAL A 392 -0.362 -9.078 2.646 1.00 0.00 H new ATOM 0 HB VAL A 392 0.847 -10.779 1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 392 -0.537 -10.669 -0.707 1.00 0.00 H new ATOM 0 HG12 VAL A 392 -1.469 -10.253 0.751 1.00 0.00 H new ATOM 0 HG13 VAL A 392 -0.916 -8.967 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 392 1.870 -10.201 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 392 1.610 -8.475 -0.485 1.00 0.00 H new ATOM 0 HG23 VAL A 392 2.714 -9.429 0.533 1.00 0.00 H new ATOM 1340 N LEU A 393 1.633 -9.076 4.138 1.00 0.00 N ATOM 1341 CA LEU A 393 2.782 -9.081 5.038 1.00 0.00 C ATOM 1342 C LEU A 393 3.593 -10.365 4.877 1.00 0.00 C ATOM 1343 O LEU A 393 3.034 -11.463 4.870 1.00 0.00 O ATOM 1344 CB LEU A 393 2.324 -8.925 6.491 1.00 0.00 C ATOM 1345 CG LEU A 393 3.006 -7.796 7.264 1.00 0.00 C ATOM 1346 CD1 LEU A 393 2.433 -6.446 6.855 1.00 0.00 C ATOM 1347 CD2 LEU A 393 2.861 -8.011 8.763 1.00 0.00 C ATOM 0 H LEU A 393 0.752 -9.344 4.577 1.00 0.00 H new ATOM 0 HA LEU A 393 3.420 -8.236 4.778 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.248 -8.754 6.501 1.00 0.00 H new ATOM 0 HB3 LEU A 393 2.502 -9.864 7.015 1.00 0.00 H new ATOM 0 HG LEU A 393 4.068 -7.804 7.020 1.00 0.00 H new ATOM 0 HD11 LEU A 393 2.931 -5.655 7.416 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.593 -6.291 5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 393 1.364 -6.425 7.068 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.353 -7.198 9.296 1.00 0.00 H new ATOM 0 HD22 LEU A 393 1.804 -8.031 9.027 1.00 0.00 H new ATOM 0 HD23 LEU A 393 3.323 -8.958 9.041 1.00 0.00 H new ATOM 1359 N LEU A 394 4.913 -10.220 4.750 1.00 0.00 N ATOM 1360 CA LEU A 394 5.802 -11.368 4.591 1.00 0.00 C ATOM 1361 C LEU A 394 6.829 -11.448 5.730 1.00 0.00 C ATOM 1362 O LEU A 394 8.030 -11.578 5.480 1.00 0.00 O ATOM 1363 CB LEU A 394 6.512 -11.294 3.236 1.00 0.00 C ATOM 1364 CG LEU A 394 6.710 -12.638 2.532 1.00 0.00 C ATOM 1365 CD1 LEU A 394 5.367 -13.235 2.131 1.00 0.00 C ATOM 1366 CD2 LEU A 394 7.612 -12.472 1.316 1.00 0.00 C ATOM 0 H LEU A 394 5.389 -9.318 4.754 1.00 0.00 H new ATOM 0 HA LEU A 394 5.196 -12.273 4.631 1.00 0.00 H new ATOM 0 HB2 LEU A 394 5.940 -10.638 2.579 1.00 0.00 H new ATOM 0 HB3 LEU A 394 7.488 -10.830 3.380 1.00 0.00 H new ATOM 0 HG LEU A 394 7.193 -13.325 3.226 1.00 0.00 H new ATOM 0 HD11 LEU A 394 5.528 -14.190 1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 394 4.757 -13.389 3.021 1.00 0.00 H new ATOM 0 HD13 LEU A 394 4.854 -12.553 1.453 1.00 0.00 H new ATOM 0 HD21 LEU A 394 7.743 -13.437 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 394 7.156 -11.770 0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 394 8.583 -12.091 1.632 1.00 0.00 H new ATOM 1378 N PRO A 395 6.371 -11.363 7.000 1.00 0.00 N ATOM 1379 CA PRO A 395 7.252 -11.420 8.175 1.00 0.00 C ATOM 1380 C PRO A 395 8.345 -12.482 8.065 1.00 0.00 C ATOM 1381 O PRO A 395 8.063 -13.654 7.807 1.00 0.00 O ATOM 1382 CB PRO A 395 6.291 -11.780 9.305 1.00 0.00 C ATOM 1383 CG PRO A 395 4.983 -11.193 8.900 1.00 0.00 C ATOM 1384 CD PRO A 395 4.957 -11.194 7.394 1.00 0.00 C ATOM 0 HA PRO A 395 7.792 -10.483 8.313 1.00 0.00 H new ATOM 0 HB2 PRO A 395 6.217 -12.860 9.431 1.00 0.00 H new ATOM 0 HB3 PRO A 395 6.630 -11.371 10.257 1.00 0.00 H new ATOM 0 HG2 PRO A 395 4.155 -11.777 9.302 1.00 0.00 H new ATOM 0 HG3 PRO A 395 4.876 -10.180 9.288 1.00 0.00 H new ATOM 0 HD2 PRO A 395 4.338 -12.004 7.008 1.00 0.00 H new ATOM 0 HD3 PRO A 395 4.545 -10.264 7.003 1.00 0.00 H new ATOM 1392 N ALA A 396 9.592 -12.064 8.277 1.00 0.00 N ATOM 1393 CA ALA A 396 10.726 -12.978 8.219 1.00 0.00 C ATOM 1394 C ALA A 396 11.464 -13.002 9.553 1.00 0.00 C ATOM 1395 O ALA A 396 12.633 -12.619 9.637 1.00 0.00 O ATOM 1396 CB ALA A 396 11.667 -12.596 7.086 1.00 0.00 C ATOM 0 H ALA A 396 9.840 -11.098 8.490 1.00 0.00 H new ATOM 0 HA ALA A 396 10.348 -13.981 8.021 1.00 0.00 H new ATOM 0 HB1 ALA A 396 12.506 -13.291 7.060 1.00 0.00 H new ATOM 0 HB2 ALA A 396 11.131 -12.639 6.138 1.00 0.00 H new ATOM 0 HB3 ALA A 396 12.038 -11.584 7.247 1.00 0.00 H new ATOM 1402 N GLY A 397 10.772 -13.460 10.598 1.00 0.00 N ATOM 1403 CA GLY A 397 11.378 -13.533 11.914 1.00 0.00 C ATOM 1404 C GLY A 397 12.118 -14.839 12.132 1.00 0.00 C ATOM 1405 O GLY A 397 12.918 -15.222 11.251 1.00 0.00 O ATOM 1406 OXT GLY A 397 11.895 -15.479 13.180 1.00 0.00 O ATOM 0 H GLY A 397 9.805 -13.780 10.553 1.00 0.00 H new ATOM 0 HA2 GLY A 397 12.070 -12.700 12.040 1.00 0.00 H new ATOM 0 HA3 GLY A 397 10.605 -13.424 12.675 1.00 0.00 H new