USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 645 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 401 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 414 THR OG1 : rot 180:sc= -1.07 USER MOD Set 2.1: A 390 ASN : amide:sc= -0.341! C(o=-2.6!,f=-5.6!) USER MOD Set 2.2: A 393 THR OG1 : rot 155:sc= -2.23! USER MOD Single : A 361 SER OG : rot 24:sc= 0.01 USER MOD Single : A 364 TYR OH : rot 97:sc=0.000982 USER MOD Single : A 366 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 369 ASN : amide:sc= -1.5 K(o=-1.5,f=-10!) USER MOD Single : A 371 SER OG : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot -72:sc= 0.767 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 GLN : amide:sc= -1.9 K(o=-1.9,f=-0.7) USER MOD Single : A 384 CYS SG : rot -130:sc= -0.272 USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 MET CE :methyl -164:sc= -4.7! (180deg=-6.02!) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 395 GLN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A 397 MET CE :methyl -166:sc= 0 (180deg=-0.0174) USER MOD Single : A 399 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 THR OG1 : rot -150:sc= -0.903 USER MOD Single : A 408 LYS NZ :NH3+ -115:sc= -0.402 (180deg=-2.32!) USER MOD Single : A 410 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 417 TYR OH : rot 3:sc= 0.144 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ -146:sc= -0.311 (180deg=-1.37) USER MOD Single : A 433 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 438 SER OG : rot -89:sc= 1.17 USER MOD Single : A 439 LYS NZ :NH3+ -124:sc= -1.35 (180deg=-2.29!) USER MOD Single : A 441 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 SER OG : rot 180:sc= -0.168 USER MOD ----------------------------------------------------------------- ATOM 168 N SER A 361 0.679 8.578 1.204 1.00 0.00 N ATOM 169 CA SER A 361 0.929 8.292 -0.204 1.00 0.00 C ATOM 170 C SER A 361 1.618 6.941 -0.370 1.00 0.00 C ATOM 171 O SER A 361 2.390 6.737 -1.306 1.00 0.00 O ATOM 172 CB SER A 361 1.788 9.394 -0.826 1.00 0.00 C ATOM 173 OG SER A 361 1.356 10.677 -0.403 1.00 0.00 O ATOM 0 HA SER A 361 -0.032 8.257 -0.718 1.00 0.00 H new ATOM 0 HB2 SER A 361 2.831 9.248 -0.547 1.00 0.00 H new ATOM 0 HB3 SER A 361 1.737 9.330 -1.913 1.00 0.00 H new ATOM 0 HG SER A 361 0.887 10.598 0.454 1.00 0.00 H new ATOM 179 N ALA A 362 1.331 6.021 0.546 1.00 0.00 N ATOM 180 CA ALA A 362 1.920 4.689 0.500 1.00 0.00 C ATOM 181 C ALA A 362 0.867 3.614 0.753 1.00 0.00 C ATOM 182 O ALA A 362 -0.232 3.907 1.224 1.00 0.00 O ATOM 183 CB ALA A 362 3.047 4.575 1.517 1.00 0.00 C ATOM 0 H ALA A 362 0.695 6.174 1.328 1.00 0.00 H new ATOM 0 HA ALA A 362 2.328 4.534 -0.499 1.00 0.00 H new ATOM 0 HB1 ALA A 362 3.478 3.575 1.472 1.00 0.00 H new ATOM 0 HB2 ALA A 362 3.817 5.313 1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 362 2.654 4.756 2.517 1.00 0.00 H new ATOM 189 N ILE A 363 1.211 2.370 0.436 1.00 0.00 N ATOM 190 CA ILE A 363 0.295 1.253 0.629 1.00 0.00 C ATOM 191 C ILE A 363 1.007 0.062 1.261 1.00 0.00 C ATOM 192 O ILE A 363 2.185 -0.183 0.996 1.00 0.00 O ATOM 193 CB ILE A 363 -0.341 0.810 -0.702 1.00 0.00 C ATOM 194 CG1 ILE A 363 0.735 0.295 -1.660 1.00 0.00 C ATOM 195 CG2 ILE A 363 -1.111 1.962 -1.330 1.00 0.00 C ATOM 196 CD1 ILE A 363 0.175 -0.445 -2.854 1.00 0.00 C ATOM 0 H ILE A 363 2.117 2.111 0.045 1.00 0.00 H new ATOM 0 HA ILE A 363 -0.491 1.601 1.299 1.00 0.00 H new ATOM 0 HB ILE A 363 -1.040 -0.002 -0.502 1.00 0.00 H new ATOM 0 HG12 ILE A 363 1.331 1.137 -2.011 1.00 0.00 H new ATOM 0 HG13 ILE A 363 1.409 -0.367 -1.115 1.00 0.00 H new ATOM 0 HG21 ILE A 363 -1.555 1.634 -2.270 1.00 0.00 H new ATOM 0 HG22 ILE A 363 -1.899 2.286 -0.650 1.00 0.00 H new ATOM 0 HG23 ILE A 363 -0.432 2.793 -1.520 1.00 0.00 H new ATOM 0 HD11 ILE A 363 0.994 -0.782 -3.490 1.00 0.00 H new ATOM 0 HD12 ILE A 363 -0.397 -1.308 -2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 363 -0.476 0.220 -3.422 1.00 0.00 H new ATOM 208 N TYR A 364 0.285 -0.677 2.096 1.00 0.00 N ATOM 209 CA TYR A 364 0.848 -1.844 2.766 1.00 0.00 C ATOM 210 C TYR A 364 0.357 -3.134 2.117 1.00 0.00 C ATOM 211 O TYR A 364 -0.826 -3.468 2.188 1.00 0.00 O ATOM 212 CB TYR A 364 0.478 -1.833 4.249 1.00 0.00 C ATOM 213 CG TYR A 364 1.502 -2.509 5.134 1.00 0.00 C ATOM 214 CD1 TYR A 364 1.605 -3.894 5.177 1.00 0.00 C ATOM 215 CD2 TYR A 364 2.367 -1.764 5.925 1.00 0.00 C ATOM 216 CE1 TYR A 364 2.537 -4.516 5.984 1.00 0.00 C ATOM 217 CE2 TYR A 364 3.304 -2.377 6.734 1.00 0.00 C ATOM 218 CZ TYR A 364 3.385 -3.753 6.760 1.00 0.00 C ATOM 219 OH TYR A 364 4.317 -4.369 7.563 1.00 0.00 O ATOM 0 H TYR A 364 -0.691 -0.489 2.325 1.00 0.00 H new ATOM 0 HA TYR A 364 1.933 -1.800 2.668 1.00 0.00 H new ATOM 0 HB2 TYR A 364 0.353 -0.801 4.576 1.00 0.00 H new ATOM 0 HB3 TYR A 364 -0.485 -2.328 4.378 1.00 0.00 H new ATOM 0 HD1 TYR A 364 0.945 -4.494 4.569 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.306 -0.686 5.907 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.602 -5.594 6.008 1.00 0.00 H new ATOM 0 HE2 TYR A 364 3.969 -1.782 7.342 1.00 0.00 H new ATOM 0 HH TYR A 364 5.180 -4.398 7.100 1.00 0.00 H new ATOM 229 N VAL A 365 1.276 -3.858 1.485 1.00 0.00 N ATOM 230 CA VAL A 365 0.939 -5.114 0.825 1.00 0.00 C ATOM 231 C VAL A 365 1.248 -6.306 1.722 1.00 0.00 C ATOM 232 O VAL A 365 2.246 -6.311 2.443 1.00 0.00 O ATOM 233 CB VAL A 365 1.703 -5.272 -0.503 1.00 0.00 C ATOM 234 CG1 VAL A 365 1.185 -6.474 -1.277 1.00 0.00 C ATOM 235 CG2 VAL A 365 1.593 -4.004 -1.335 1.00 0.00 C ATOM 0 H VAL A 365 2.259 -3.596 1.416 1.00 0.00 H new ATOM 0 HA VAL A 365 -0.131 -5.087 0.619 1.00 0.00 H new ATOM 0 HB VAL A 365 2.756 -5.441 -0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 365 1.737 -6.570 -2.212 1.00 0.00 H new ATOM 0 HG12 VAL A 365 1.321 -7.377 -0.681 1.00 0.00 H new ATOM 0 HG13 VAL A 365 0.125 -6.338 -1.493 1.00 0.00 H new ATOM 0 HG21 VAL A 365 2.139 -4.134 -2.270 1.00 0.00 H new ATOM 0 HG22 VAL A 365 0.544 -3.801 -1.552 1.00 0.00 H new ATOM 0 HG23 VAL A 365 2.017 -3.167 -0.780 1.00 0.00 H new ATOM 245 N GLN A 366 0.386 -7.317 1.672 1.00 0.00 N ATOM 246 CA GLN A 366 0.568 -8.517 2.481 1.00 0.00 C ATOM 247 C GLN A 366 0.021 -9.746 1.762 1.00 0.00 C ATOM 248 O GLN A 366 -1.153 -9.794 1.397 1.00 0.00 O ATOM 249 CB GLN A 366 -0.126 -8.353 3.834 1.00 0.00 C ATOM 250 CG GLN A 366 0.766 -7.741 4.904 1.00 0.00 C ATOM 251 CD GLN A 366 0.113 -7.732 6.273 1.00 0.00 C ATOM 252 OE1 GLN A 366 0.397 -8.584 7.115 1.00 0.00 O ATOM 253 NE2 GLN A 366 -0.768 -6.765 6.502 1.00 0.00 N ATOM 0 H GLN A 366 -0.445 -7.329 1.080 1.00 0.00 H new ATOM 0 HA GLN A 366 1.637 -8.659 2.642 1.00 0.00 H new ATOM 0 HB2 GLN A 366 -1.009 -7.727 3.707 1.00 0.00 H new ATOM 0 HB3 GLN A 366 -0.473 -9.328 4.176 1.00 0.00 H new ATOM 0 HG2 GLN A 366 1.701 -8.299 4.955 1.00 0.00 H new ATOM 0 HG3 GLN A 366 1.020 -6.720 4.620 1.00 0.00 H new ATOM 0 HE21 GLN A 366 -0.973 -6.079 5.775 1.00 0.00 H new ATOM 0 HE22 GLN A 366 -1.239 -6.708 7.405 1.00 0.00 H new ATOM 262 N GLY A 367 0.883 -10.739 1.561 1.00 0.00 N ATOM 263 CA GLY A 367 0.468 -11.954 0.886 1.00 0.00 C ATOM 264 C GLY A 367 1.404 -12.338 -0.244 1.00 0.00 C ATOM 265 O GLY A 367 1.048 -13.141 -1.108 1.00 0.00 O ATOM 0 H GLY A 367 1.860 -10.723 1.854 1.00 0.00 H new ATOM 0 HA2 GLY A 367 0.421 -12.769 1.608 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -0.539 -11.820 0.490 1.00 0.00 H new ATOM 269 N LEU A 368 2.601 -11.764 -0.238 1.00 0.00 N ATOM 270 CA LEU A 368 3.591 -12.049 -1.271 1.00 0.00 C ATOM 271 C LEU A 368 4.239 -13.411 -1.043 1.00 0.00 C ATOM 272 O LEU A 368 4.269 -13.915 0.078 1.00 0.00 O ATOM 273 CB LEU A 368 4.663 -10.959 -1.293 1.00 0.00 C ATOM 274 CG LEU A 368 4.195 -9.565 -1.715 1.00 0.00 C ATOM 275 CD1 LEU A 368 5.280 -8.534 -1.450 1.00 0.00 C ATOM 276 CD2 LEU A 368 3.797 -9.558 -3.184 1.00 0.00 C ATOM 0 H LEU A 368 2.910 -11.098 0.470 1.00 0.00 H new ATOM 0 HA LEU A 368 3.080 -12.067 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 368 5.100 -10.887 -0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 368 5.458 -11.273 -1.969 1.00 0.00 H new ATOM 0 HG LEU A 368 3.320 -9.302 -1.121 1.00 0.00 H new ATOM 0 HD11 LEU A 368 4.928 -7.549 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 368 5.517 -8.520 -0.386 1.00 0.00 H new ATOM 0 HD13 LEU A 368 6.174 -8.793 -2.017 1.00 0.00 H new ATOM 0 HD21 LEU A 368 3.467 -8.558 -3.467 1.00 0.00 H new ATOM 0 HD22 LEU A 368 4.654 -9.843 -3.794 1.00 0.00 H new ATOM 0 HD23 LEU A 368 2.985 -10.267 -3.344 1.00 0.00 H new ATOM 288 N ASN A 369 4.759 -14.000 -2.116 1.00 0.00 N ATOM 289 CA ASN A 369 5.409 -15.303 -2.032 1.00 0.00 C ATOM 290 C ASN A 369 6.829 -15.169 -1.493 1.00 0.00 C ATOM 291 O ASN A 369 7.257 -14.081 -1.108 1.00 0.00 O ATOM 292 CB ASN A 369 5.433 -15.972 -3.408 1.00 0.00 C ATOM 293 CG ASN A 369 5.970 -15.053 -4.488 1.00 0.00 C ATOM 294 OD1 ASN A 369 7.179 -14.981 -4.714 1.00 0.00 O ATOM 295 ND2 ASN A 369 5.072 -14.344 -5.162 1.00 0.00 N ATOM 0 H ASN A 369 4.743 -13.596 -3.052 1.00 0.00 H new ATOM 0 HA ASN A 369 4.837 -15.924 -1.343 1.00 0.00 H new ATOM 0 HB2 ASN A 369 6.047 -16.871 -3.361 1.00 0.00 H new ATOM 0 HB3 ASN A 369 4.424 -16.289 -3.673 1.00 0.00 H new ATOM 0 HD21 ASN A 369 5.374 -13.708 -5.900 1.00 0.00 H new ATOM 0 HD22 ASN A 369 4.080 -14.435 -4.941 1.00 0.00 H new ATOM 302 N ASP A 370 7.555 -16.282 -1.470 1.00 0.00 N ATOM 303 CA ASP A 370 8.927 -16.289 -0.980 1.00 0.00 C ATOM 304 C ASP A 370 9.915 -16.105 -2.128 1.00 0.00 C ATOM 305 O ASP A 370 11.129 -16.114 -1.923 1.00 0.00 O ATOM 306 CB ASP A 370 9.222 -17.596 -0.242 1.00 0.00 C ATOM 307 CG ASP A 370 8.491 -18.778 -0.846 1.00 0.00 C ATOM 308 OD1 ASP A 370 8.585 -18.969 -2.076 1.00 0.00 O ATOM 309 OD2 ASP A 370 7.824 -19.513 -0.087 1.00 0.00 O ATOM 0 H ASP A 370 7.215 -17.191 -1.785 1.00 0.00 H new ATOM 0 HA ASP A 370 9.043 -15.456 -0.287 1.00 0.00 H new ATOM 0 HB2 ASP A 370 10.295 -17.787 -0.262 1.00 0.00 H new ATOM 0 HB3 ASP A 370 8.936 -17.492 0.805 1.00 0.00 H new ATOM 314 N SER A 371 9.387 -15.941 -3.336 1.00 0.00 N ATOM 315 CA SER A 371 10.221 -15.760 -4.517 1.00 0.00 C ATOM 316 C SER A 371 9.952 -14.408 -5.172 1.00 0.00 C ATOM 317 O SER A 371 10.248 -14.205 -6.349 1.00 0.00 O ATOM 318 CB SER A 371 9.970 -16.885 -5.523 1.00 0.00 C ATOM 319 OG SER A 371 10.801 -18.001 -5.258 1.00 0.00 O ATOM 0 H SER A 371 8.384 -15.930 -3.522 1.00 0.00 H new ATOM 0 HA SER A 371 11.264 -15.790 -4.201 1.00 0.00 H new ATOM 0 HB2 SER A 371 8.924 -17.188 -5.480 1.00 0.00 H new ATOM 0 HB3 SER A 371 10.156 -16.521 -6.534 1.00 0.00 H new ATOM 0 HG SER A 371 10.620 -18.707 -5.914 1.00 0.00 H new ATOM 325 N VAL A 372 9.387 -13.486 -4.399 1.00 0.00 N ATOM 326 CA VAL A 372 9.076 -12.153 -4.902 1.00 0.00 C ATOM 327 C VAL A 372 10.271 -11.218 -4.753 1.00 0.00 C ATOM 328 O VAL A 372 10.948 -11.215 -3.723 1.00 0.00 O ATOM 329 CB VAL A 372 7.867 -11.544 -4.168 1.00 0.00 C ATOM 330 CG1 VAL A 372 8.261 -11.093 -2.770 1.00 0.00 C ATOM 331 CG2 VAL A 372 7.288 -10.386 -4.966 1.00 0.00 C ATOM 0 H VAL A 372 9.135 -13.638 -3.422 1.00 0.00 H new ATOM 0 HA VAL A 372 8.832 -12.262 -5.959 1.00 0.00 H new ATOM 0 HB VAL A 372 7.099 -12.311 -4.073 1.00 0.00 H new ATOM 0 HG11 VAL A 372 7.393 -10.666 -2.268 1.00 0.00 H new ATOM 0 HG12 VAL A 372 8.625 -11.948 -2.201 1.00 0.00 H new ATOM 0 HG13 VAL A 372 9.047 -10.341 -2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 372 6.434 -9.967 -4.433 1.00 0.00 H new ATOM 0 HG22 VAL A 372 8.049 -9.616 -5.094 1.00 0.00 H new ATOM 0 HG23 VAL A 372 6.965 -10.743 -5.944 1.00 0.00 H new ATOM 341 N THR A 373 10.527 -10.423 -5.787 1.00 0.00 N ATOM 342 CA THR A 373 11.639 -9.483 -5.772 1.00 0.00 C ATOM 343 C THR A 373 11.151 -8.049 -5.945 1.00 0.00 C ATOM 344 O THR A 373 10.020 -7.815 -6.373 1.00 0.00 O ATOM 345 CB THR A 373 12.660 -9.803 -6.880 1.00 0.00 C ATOM 346 OG1 THR A 373 12.011 -9.811 -8.156 1.00 0.00 O ATOM 347 CG2 THR A 373 13.322 -11.151 -6.633 1.00 0.00 C ATOM 0 H THR A 373 9.978 -10.412 -6.646 1.00 0.00 H new ATOM 0 HA THR A 373 12.124 -9.584 -4.801 1.00 0.00 H new ATOM 0 HB THR A 373 13.429 -9.031 -6.869 1.00 0.00 H new ATOM 0 HG1 THR A 373 11.449 -10.610 -8.232 1.00 0.00 H new ATOM 0 HG21 THR A 373 14.039 -11.355 -7.428 1.00 0.00 H new ATOM 0 HG22 THR A 373 13.840 -11.132 -5.674 1.00 0.00 H new ATOM 0 HG23 THR A 373 12.562 -11.932 -6.620 1.00 0.00 H new ATOM 355 N LEU A 374 12.011 -7.092 -5.612 1.00 0.00 N ATOM 356 CA LEU A 374 11.667 -5.679 -5.732 1.00 0.00 C ATOM 357 C LEU A 374 11.268 -5.335 -7.164 1.00 0.00 C ATOM 358 O LEU A 374 10.129 -4.949 -7.425 1.00 0.00 O ATOM 359 CB LEU A 374 12.846 -4.809 -5.297 1.00 0.00 C ATOM 360 CG LEU A 374 12.796 -3.344 -5.733 1.00 0.00 C ATOM 361 CD1 LEU A 374 11.867 -2.549 -4.829 1.00 0.00 C ATOM 362 CD2 LEU A 374 14.192 -2.738 -5.729 1.00 0.00 C ATOM 0 H LEU A 374 12.951 -7.269 -5.257 1.00 0.00 H new ATOM 0 HA LEU A 374 10.816 -5.481 -5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 374 12.914 -4.842 -4.210 1.00 0.00 H new ATOM 0 HB3 LEU A 374 13.762 -5.252 -5.687 1.00 0.00 H new ATOM 0 HG LEU A 374 12.405 -3.301 -6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 374 11.844 -1.509 -5.155 1.00 0.00 H new ATOM 0 HD12 LEU A 374 10.862 -2.968 -4.882 1.00 0.00 H new ATOM 0 HD13 LEU A 374 12.228 -2.600 -3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 374 14.137 -1.695 -6.042 1.00 0.00 H new ATOM 0 HD22 LEU A 374 14.610 -2.794 -4.724 1.00 0.00 H new ATOM 0 HD23 LEU A 374 14.830 -3.290 -6.418 1.00 0.00 H new ATOM 374 N ASP A 375 12.211 -5.483 -8.087 1.00 0.00 N ATOM 375 CA ASP A 375 11.958 -5.191 -9.493 1.00 0.00 C ATOM 376 C ASP A 375 10.621 -5.777 -9.937 1.00 0.00 C ATOM 377 O ASP A 375 9.955 -5.232 -10.817 1.00 0.00 O ATOM 378 CB ASP A 375 13.087 -5.745 -10.363 1.00 0.00 C ATOM 379 CG ASP A 375 14.426 -5.111 -10.047 1.00 0.00 C ATOM 380 OD1 ASP A 375 14.603 -3.913 -10.354 1.00 0.00 O ATOM 381 OD2 ASP A 375 15.298 -5.812 -9.493 1.00 0.00 O ATOM 0 H ASP A 375 13.158 -5.804 -7.887 1.00 0.00 H new ATOM 0 HA ASP A 375 11.917 -4.108 -9.612 1.00 0.00 H new ATOM 0 HB2 ASP A 375 13.156 -6.823 -10.220 1.00 0.00 H new ATOM 0 HB3 ASP A 375 12.848 -5.578 -11.413 1.00 0.00 H new ATOM 386 N ASP A 376 10.236 -6.890 -9.322 1.00 0.00 N ATOM 387 CA ASP A 376 8.980 -7.551 -9.655 1.00 0.00 C ATOM 388 C ASP A 376 7.792 -6.774 -9.093 1.00 0.00 C ATOM 389 O ASP A 376 6.721 -6.732 -9.701 1.00 0.00 O ATOM 390 CB ASP A 376 8.971 -8.981 -9.111 1.00 0.00 C ATOM 391 CG ASP A 376 9.650 -9.960 -10.049 1.00 0.00 C ATOM 392 OD1 ASP A 376 9.518 -9.792 -11.280 1.00 0.00 O ATOM 393 OD2 ASP A 376 10.314 -10.893 -9.552 1.00 0.00 O ATOM 0 H ASP A 376 10.776 -7.353 -8.591 1.00 0.00 H new ATOM 0 HA ASP A 376 8.892 -7.583 -10.741 1.00 0.00 H new ATOM 0 HB2 ASP A 376 9.472 -9.002 -8.143 1.00 0.00 H new ATOM 0 HB3 ASP A 376 7.941 -9.297 -8.944 1.00 0.00 H new ATOM 398 N LEU A 377 7.989 -6.161 -7.931 1.00 0.00 N ATOM 399 CA LEU A 377 6.934 -5.387 -7.286 1.00 0.00 C ATOM 400 C LEU A 377 6.919 -3.952 -7.806 1.00 0.00 C ATOM 401 O LEU A 377 5.897 -3.270 -7.741 1.00 0.00 O ATOM 402 CB LEU A 377 7.127 -5.390 -5.769 1.00 0.00 C ATOM 403 CG LEU A 377 6.917 -6.732 -5.069 1.00 0.00 C ATOM 404 CD1 LEU A 377 7.069 -6.580 -3.564 1.00 0.00 C ATOM 405 CD2 LEU A 377 5.549 -7.305 -5.412 1.00 0.00 C ATOM 0 H LEU A 377 8.869 -6.185 -7.416 1.00 0.00 H new ATOM 0 HA LEU A 377 5.977 -5.852 -7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 377 8.137 -5.043 -5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 377 6.440 -4.664 -5.334 1.00 0.00 H new ATOM 0 HG LEU A 377 7.680 -7.426 -5.423 1.00 0.00 H new ATOM 0 HD11 LEU A 377 6.916 -7.546 -3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 377 8.070 -6.215 -3.334 1.00 0.00 H new ATOM 0 HD13 LEU A 377 6.330 -5.869 -3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.417 -8.261 -4.905 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.773 -6.612 -5.088 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.476 -7.453 -6.489 1.00 0.00 H new ATOM 417 N ALA A 378 8.058 -3.502 -8.321 1.00 0.00 N ATOM 418 CA ALA A 378 8.173 -2.151 -8.855 1.00 0.00 C ATOM 419 C ALA A 378 7.502 -2.041 -10.221 1.00 0.00 C ATOM 420 O ALA A 378 6.964 -0.992 -10.576 1.00 0.00 O ATOM 421 CB ALA A 378 9.637 -1.744 -8.950 1.00 0.00 C ATOM 0 H ALA A 378 8.914 -4.053 -8.380 1.00 0.00 H new ATOM 0 HA ALA A 378 7.662 -1.472 -8.172 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.708 -0.733 -9.350 1.00 0.00 H new ATOM 0 HB2 ALA A 378 10.088 -1.774 -7.958 1.00 0.00 H new ATOM 0 HB3 ALA A 378 10.164 -2.433 -9.610 1.00 0.00 H new ATOM 427 N ASP A 379 7.541 -3.129 -10.982 1.00 0.00 N ATOM 428 CA ASP A 379 6.936 -3.154 -12.310 1.00 0.00 C ATOM 429 C ASP A 379 5.464 -3.545 -12.228 1.00 0.00 C ATOM 430 O ASP A 379 4.697 -3.313 -13.163 1.00 0.00 O ATOM 431 CB ASP A 379 7.686 -4.131 -13.216 1.00 0.00 C ATOM 432 CG ASP A 379 7.395 -3.897 -14.685 1.00 0.00 C ATOM 433 OD1 ASP A 379 6.230 -3.599 -15.019 1.00 0.00 O ATOM 434 OD2 ASP A 379 8.334 -4.012 -15.502 1.00 0.00 O ATOM 0 H ASP A 379 7.984 -4.004 -10.703 1.00 0.00 H new ATOM 0 HA ASP A 379 7.005 -2.152 -12.733 1.00 0.00 H new ATOM 0 HB2 ASP A 379 8.758 -4.035 -13.041 1.00 0.00 H new ATOM 0 HB3 ASP A 379 7.410 -5.152 -12.952 1.00 0.00 H new ATOM 439 N PHE A 380 5.076 -4.140 -11.106 1.00 0.00 N ATOM 440 CA PHE A 380 3.696 -4.565 -10.903 1.00 0.00 C ATOM 441 C PHE A 380 2.885 -3.471 -10.213 1.00 0.00 C ATOM 442 O PHE A 380 1.805 -3.100 -10.673 1.00 0.00 O ATOM 443 CB PHE A 380 3.652 -5.849 -10.070 1.00 0.00 C ATOM 444 CG PHE A 380 2.258 -6.323 -9.773 1.00 0.00 C ATOM 445 CD1 PHE A 380 1.360 -6.566 -10.800 1.00 0.00 C ATOM 446 CD2 PHE A 380 1.846 -6.525 -8.466 1.00 0.00 C ATOM 447 CE1 PHE A 380 0.077 -7.002 -10.531 1.00 0.00 C ATOM 448 CE2 PHE A 380 0.564 -6.963 -8.190 1.00 0.00 C ATOM 449 CZ PHE A 380 -0.321 -7.200 -9.222 1.00 0.00 C ATOM 0 H PHE A 380 5.698 -4.339 -10.322 1.00 0.00 H new ATOM 0 HA PHE A 380 3.255 -4.758 -11.881 1.00 0.00 H new ATOM 0 HB2 PHE A 380 4.189 -6.635 -10.600 1.00 0.00 H new ATOM 0 HB3 PHE A 380 4.178 -5.681 -9.130 1.00 0.00 H new ATOM 0 HD1 PHE A 380 1.667 -6.413 -11.824 1.00 0.00 H new ATOM 0 HD2 PHE A 380 2.533 -6.338 -7.654 1.00 0.00 H new ATOM 0 HE1 PHE A 380 -0.613 -7.188 -11.341 1.00 0.00 H new ATOM 0 HE2 PHE A 380 0.255 -7.120 -7.167 1.00 0.00 H new ATOM 0 HZ PHE A 380 -1.323 -7.540 -9.007 1.00 0.00 H new ATOM 459 N PHE A 381 3.414 -2.959 -9.108 1.00 0.00 N ATOM 460 CA PHE A 381 2.741 -1.909 -8.352 1.00 0.00 C ATOM 461 C PHE A 381 2.578 -0.650 -9.199 1.00 0.00 C ATOM 462 O PHE A 381 1.717 0.188 -8.929 1.00 0.00 O ATOM 463 CB PHE A 381 3.524 -1.584 -7.079 1.00 0.00 C ATOM 464 CG PHE A 381 3.315 -2.582 -5.977 1.00 0.00 C ATOM 465 CD1 PHE A 381 2.036 -2.944 -5.584 1.00 0.00 C ATOM 466 CD2 PHE A 381 4.399 -3.158 -5.332 1.00 0.00 C ATOM 467 CE1 PHE A 381 1.842 -3.862 -4.569 1.00 0.00 C ATOM 468 CE2 PHE A 381 4.209 -4.078 -4.317 1.00 0.00 C ATOM 469 CZ PHE A 381 2.929 -4.429 -3.935 1.00 0.00 C ATOM 0 H PHE A 381 4.308 -3.254 -8.715 1.00 0.00 H new ATOM 0 HA PHE A 381 1.751 -2.272 -8.077 1.00 0.00 H new ATOM 0 HB2 PHE A 381 4.586 -1.535 -7.318 1.00 0.00 H new ATOM 0 HB3 PHE A 381 3.231 -0.596 -6.724 1.00 0.00 H new ATOM 0 HD1 PHE A 381 1.181 -2.504 -6.076 1.00 0.00 H new ATOM 0 HD2 PHE A 381 5.402 -2.885 -5.625 1.00 0.00 H new ATOM 0 HE1 PHE A 381 0.840 -4.135 -4.272 1.00 0.00 H new ATOM 0 HE2 PHE A 381 5.061 -4.522 -3.823 1.00 0.00 H new ATOM 0 HZ PHE A 381 2.779 -5.146 -3.141 1.00 0.00 H new ATOM 479 N LYS A 382 3.414 -0.522 -10.224 1.00 0.00 N ATOM 480 CA LYS A 382 3.365 0.634 -11.112 1.00 0.00 C ATOM 481 C LYS A 382 2.181 0.536 -12.068 1.00 0.00 C ATOM 482 O LYS A 382 1.851 1.498 -12.761 1.00 0.00 O ATOM 483 CB LYS A 382 4.668 0.748 -11.907 1.00 0.00 C ATOM 484 CG LYS A 382 4.830 -0.329 -12.967 1.00 0.00 C ATOM 485 CD LYS A 382 5.795 0.104 -14.058 1.00 0.00 C ATOM 486 CE LYS A 382 5.113 0.995 -15.084 1.00 0.00 C ATOM 487 NZ LYS A 382 5.897 1.084 -16.348 1.00 0.00 N ATOM 0 H LYS A 382 4.134 -1.205 -10.460 1.00 0.00 H new ATOM 0 HA LYS A 382 3.241 1.527 -10.499 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.707 1.726 -12.386 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.510 0.697 -11.217 1.00 0.00 H new ATOM 0 HG2 LYS A 382 5.192 -1.246 -12.503 1.00 0.00 H new ATOM 0 HG3 LYS A 382 3.859 -0.556 -13.408 1.00 0.00 H new ATOM 0 HD2 LYS A 382 6.634 0.638 -13.612 1.00 0.00 H new ATOM 0 HD3 LYS A 382 6.204 -0.776 -14.554 1.00 0.00 H new ATOM 0 HE2 LYS A 382 4.118 0.605 -15.300 1.00 0.00 H new ATOM 0 HE3 LYS A 382 4.980 1.993 -14.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 5.400 1.700 -17.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 6.837 1.480 -16.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 6.002 0.134 -16.759 1.00 0.00 H new ATOM 501 N GLN A 383 1.545 -0.631 -12.099 1.00 0.00 N ATOM 502 CA GLN A 383 0.398 -0.853 -12.970 1.00 0.00 C ATOM 503 C GLN A 383 -0.640 0.251 -12.794 1.00 0.00 C ATOM 504 O GLN A 383 -1.053 0.888 -13.763 1.00 0.00 O ATOM 505 CB GLN A 383 -0.235 -2.216 -12.678 1.00 0.00 C ATOM 506 CG GLN A 383 0.433 -3.366 -13.415 1.00 0.00 C ATOM 507 CD GLN A 383 -0.480 -4.565 -13.572 1.00 0.00 C ATOM 508 OE1 GLN A 383 -0.751 -5.011 -14.688 1.00 0.00 O ATOM 509 NE2 GLN A 383 -0.961 -5.096 -12.454 1.00 0.00 N ATOM 0 H GLN A 383 1.805 -1.437 -11.531 1.00 0.00 H new ATOM 0 HA GLN A 383 0.748 -0.837 -14.002 1.00 0.00 H new ATOM 0 HB2 GLN A 383 -0.189 -2.407 -11.606 1.00 0.00 H new ATOM 0 HB3 GLN A 383 -1.290 -2.184 -12.951 1.00 0.00 H new ATOM 0 HG2 GLN A 383 0.752 -3.025 -14.400 1.00 0.00 H new ATOM 0 HG3 GLN A 383 1.331 -3.666 -12.875 1.00 0.00 H new ATOM 0 HE21 GLN A 383 -0.711 -4.695 -11.550 1.00 0.00 H new ATOM 0 HE22 GLN A 383 -1.581 -5.905 -12.499 1.00 0.00 H new ATOM 518 N CYS A 384 -1.058 0.470 -11.553 1.00 0.00 N ATOM 519 CA CYS A 384 -2.050 1.496 -11.250 1.00 0.00 C ATOM 520 C CYS A 384 -1.562 2.872 -11.694 1.00 0.00 C ATOM 521 O CYS A 384 -2.131 3.480 -12.599 1.00 0.00 O ATOM 522 CB CYS A 384 -2.358 1.510 -9.752 1.00 0.00 C ATOM 523 SG CYS A 384 -3.436 2.866 -9.233 1.00 0.00 S ATOM 0 H CYS A 384 -0.726 -0.049 -10.740 1.00 0.00 H new ATOM 0 HA CYS A 384 -2.961 1.259 -11.799 1.00 0.00 H new ATOM 0 HB2 CYS A 384 -2.825 0.564 -9.479 1.00 0.00 H new ATOM 0 HB3 CYS A 384 -1.420 1.574 -9.200 1.00 0.00 H new ATOM 0 HG CYS A 384 -2.907 3.475 -8.213 1.00 0.00 H new ATOM 529 N GLY A 385 -0.504 3.356 -11.048 1.00 0.00 N ATOM 530 CA GLY A 385 0.041 4.657 -11.390 1.00 0.00 C ATOM 531 C GLY A 385 1.549 4.633 -11.534 1.00 0.00 C ATOM 532 O GLY A 385 2.095 3.847 -12.309 1.00 0.00 O ATOM 0 H GLY A 385 -0.016 2.871 -10.295 1.00 0.00 H new ATOM 0 HA2 GLY A 385 -0.405 5.000 -12.324 1.00 0.00 H new ATOM 0 HA3 GLY A 385 -0.236 5.377 -10.620 1.00 0.00 H new ATOM 536 N VAL A 386 2.227 5.498 -10.785 1.00 0.00 N ATOM 537 CA VAL A 386 3.682 5.574 -10.833 1.00 0.00 C ATOM 538 C VAL A 386 4.285 5.440 -9.439 1.00 0.00 C ATOM 539 O VAL A 386 3.865 6.118 -8.501 1.00 0.00 O ATOM 540 CB VAL A 386 4.155 6.900 -11.459 1.00 0.00 C ATOM 541 CG1 VAL A 386 5.659 7.059 -11.300 1.00 0.00 C ATOM 542 CG2 VAL A 386 3.756 6.968 -12.926 1.00 0.00 C ATOM 0 H VAL A 386 1.791 6.155 -10.138 1.00 0.00 H new ATOM 0 HA VAL A 386 4.022 4.746 -11.455 1.00 0.00 H new ATOM 0 HB VAL A 386 3.669 7.723 -10.935 1.00 0.00 H new ATOM 0 HG11 VAL A 386 5.975 8.001 -11.748 1.00 0.00 H new ATOM 0 HG12 VAL A 386 5.915 7.057 -10.241 1.00 0.00 H new ATOM 0 HG13 VAL A 386 6.167 6.233 -11.797 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.098 7.911 -13.353 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.213 6.139 -13.466 1.00 0.00 H new ATOM 0 HG23 VAL A 386 2.671 6.903 -13.011 1.00 0.00 H new ATOM 552 N VAL A 387 5.274 4.561 -9.311 1.00 0.00 N ATOM 553 CA VAL A 387 5.938 4.339 -8.032 1.00 0.00 C ATOM 554 C VAL A 387 7.015 5.388 -7.781 1.00 0.00 C ATOM 555 O VAL A 387 7.870 5.632 -8.633 1.00 0.00 O ATOM 556 CB VAL A 387 6.576 2.938 -7.966 1.00 0.00 C ATOM 557 CG1 VAL A 387 7.261 2.726 -6.625 1.00 0.00 C ATOM 558 CG2 VAL A 387 5.528 1.864 -8.214 1.00 0.00 C ATOM 0 H VAL A 387 5.633 3.991 -10.077 1.00 0.00 H new ATOM 0 HA VAL A 387 5.172 4.418 -7.261 1.00 0.00 H new ATOM 0 HB VAL A 387 7.331 2.864 -8.748 1.00 0.00 H new ATOM 0 HG11 VAL A 387 7.706 1.731 -6.597 1.00 0.00 H new ATOM 0 HG12 VAL A 387 8.041 3.476 -6.492 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.528 2.819 -5.823 1.00 0.00 H new ATOM 0 HG21 VAL A 387 5.996 0.881 -8.164 1.00 0.00 H new ATOM 0 HG22 VAL A 387 4.749 1.934 -7.455 1.00 0.00 H new ATOM 0 HG23 VAL A 387 5.088 2.006 -9.201 1.00 0.00 H new ATOM 568 N LYS A 388 6.969 6.007 -6.605 1.00 0.00 N ATOM 569 CA LYS A 388 7.941 7.029 -6.241 1.00 0.00 C ATOM 570 C LYS A 388 9.365 6.501 -6.383 1.00 0.00 C ATOM 571 O LYS A 388 9.815 5.676 -5.587 1.00 0.00 O ATOM 572 CB LYS A 388 7.702 7.499 -4.803 1.00 0.00 C ATOM 573 CG LYS A 388 8.512 8.728 -4.424 1.00 0.00 C ATOM 574 CD LYS A 388 7.789 9.571 -3.386 1.00 0.00 C ATOM 575 CE LYS A 388 8.050 9.062 -1.975 1.00 0.00 C ATOM 576 NZ LYS A 388 7.734 10.092 -0.947 1.00 0.00 N ATOM 0 H LYS A 388 6.268 5.818 -5.889 1.00 0.00 H new ATOM 0 HA LYS A 388 7.815 7.873 -6.920 1.00 0.00 H new ATOM 0 HB2 LYS A 388 6.642 7.718 -4.672 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.947 6.687 -4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 388 9.482 8.420 -4.033 1.00 0.00 H new ATOM 0 HG3 LYS A 388 8.703 9.328 -5.314 1.00 0.00 H new ATOM 0 HD2 LYS A 388 8.115 10.608 -3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.718 9.558 -3.587 1.00 0.00 H new ATOM 0 HE2 LYS A 388 7.449 8.171 -1.793 1.00 0.00 H new ATOM 0 HE3 LYS A 388 9.095 8.766 -1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 7.925 9.707 0.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 8.325 10.933 -1.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 6.731 10.356 -1.018 1.00 0.00 H new ATOM 590 N MET A 389 10.072 6.984 -7.400 1.00 0.00 N ATOM 591 CA MET A 389 11.447 6.562 -7.644 1.00 0.00 C ATOM 592 C MET A 389 12.432 7.636 -7.198 1.00 0.00 C ATOM 593 O MET A 389 12.380 8.772 -7.666 1.00 0.00 O ATOM 594 CB MET A 389 11.651 6.251 -9.127 1.00 0.00 C ATOM 595 CG MET A 389 11.001 4.950 -9.571 1.00 0.00 C ATOM 596 SD MET A 389 11.883 3.494 -8.978 1.00 0.00 S ATOM 597 CE MET A 389 13.517 3.792 -9.651 1.00 0.00 C ATOM 0 H MET A 389 9.716 7.668 -8.068 1.00 0.00 H new ATOM 0 HA MET A 389 11.633 5.659 -7.062 1.00 0.00 H new ATOM 0 HB2 MET A 389 11.246 7.071 -9.721 1.00 0.00 H new ATOM 0 HB3 MET A 389 12.720 6.203 -9.336 1.00 0.00 H new ATOM 0 HG2 MET A 389 9.973 4.920 -9.209 1.00 0.00 H new ATOM 0 HG3 MET A 389 10.956 4.924 -10.660 1.00 0.00 H new ATOM 0 HE1 MET A 389 14.096 2.869 -9.622 1.00 0.00 H new ATOM 0 HE2 MET A 389 13.429 4.133 -10.683 1.00 0.00 H new ATOM 0 HE3 MET A 389 14.021 4.556 -9.059 1.00 0.00 H new ATOM 607 N ASN A 390 13.330 7.269 -6.289 1.00 0.00 N ATOM 608 CA ASN A 390 14.327 8.203 -5.778 1.00 0.00 C ATOM 609 C ASN A 390 15.017 8.940 -6.922 1.00 0.00 C ATOM 610 O ASN A 390 15.173 8.402 -8.018 1.00 0.00 O ATOM 611 CB ASN A 390 15.367 7.461 -4.935 1.00 0.00 C ATOM 612 CG ASN A 390 16.032 8.363 -3.913 1.00 0.00 C ATOM 613 OD1 ASN A 390 15.909 9.585 -3.974 1.00 0.00 O ATOM 614 ND2 ASN A 390 16.740 7.760 -2.965 1.00 0.00 N ATOM 0 H ASN A 390 13.388 6.332 -5.891 1.00 0.00 H new ATOM 0 HA ASN A 390 13.816 8.935 -5.152 1.00 0.00 H new ATOM 0 HB2 ASN A 390 14.887 6.627 -4.422 1.00 0.00 H new ATOM 0 HB3 ASN A 390 16.127 7.037 -5.591 1.00 0.00 H new ATOM 0 HD21 ASN A 390 17.209 8.314 -2.248 1.00 0.00 H new ATOM 0 HD22 ASN A 390 16.815 6.743 -2.953 1.00 0.00 H new ATOM 621 N LYS A 391 15.428 10.177 -6.658 1.00 0.00 N ATOM 622 CA LYS A 391 16.102 10.989 -7.663 1.00 0.00 C ATOM 623 C LYS A 391 17.617 10.874 -7.528 1.00 0.00 C ATOM 624 O LYS A 391 18.358 11.186 -8.460 1.00 0.00 O ATOM 625 CB LYS A 391 15.678 12.454 -7.534 1.00 0.00 C ATOM 626 CG LYS A 391 14.186 12.673 -7.715 1.00 0.00 C ATOM 627 CD LYS A 391 13.858 14.143 -7.912 1.00 0.00 C ATOM 628 CE LYS A 391 12.384 14.350 -8.221 1.00 0.00 C ATOM 629 NZ LYS A 391 11.536 14.191 -7.008 1.00 0.00 N ATOM 0 H LYS A 391 15.306 10.638 -5.756 1.00 0.00 H new ATOM 0 HA LYS A 391 15.813 10.619 -8.647 1.00 0.00 H new ATOM 0 HB2 LYS A 391 15.975 12.824 -6.553 1.00 0.00 H new ATOM 0 HB3 LYS A 391 16.216 13.046 -8.274 1.00 0.00 H new ATOM 0 HG2 LYS A 391 13.835 12.103 -8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 391 13.653 12.294 -6.843 1.00 0.00 H new ATOM 0 HD2 LYS A 391 14.124 14.699 -7.013 1.00 0.00 H new ATOM 0 HD3 LYS A 391 14.461 14.545 -8.726 1.00 0.00 H new ATOM 0 HE2 LYS A 391 12.237 15.346 -8.639 1.00 0.00 H new ATOM 0 HE3 LYS A 391 12.068 13.635 -8.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 10.538 14.340 -7.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 11.657 13.232 -6.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 11.820 14.890 -6.292 1.00 0.00 H new ATOM 643 N ARG A 392 18.070 10.424 -6.363 1.00 0.00 N ATOM 644 CA ARG A 392 19.498 10.267 -6.106 1.00 0.00 C ATOM 645 C ARG A 392 19.933 8.820 -6.322 1.00 0.00 C ATOM 646 O ARG A 392 20.938 8.554 -6.981 1.00 0.00 O ATOM 647 CB ARG A 392 19.832 10.705 -4.679 1.00 0.00 C ATOM 648 CG ARG A 392 21.276 10.442 -4.284 1.00 0.00 C ATOM 649 CD ARG A 392 21.486 10.620 -2.788 1.00 0.00 C ATOM 650 NE ARG A 392 21.218 11.989 -2.357 1.00 0.00 N ATOM 651 CZ ARG A 392 21.628 12.487 -1.198 1.00 0.00 C ATOM 652 NH1 ARG A 392 22.323 11.733 -0.357 1.00 0.00 N ATOM 653 NH2 ARG A 392 21.346 13.743 -0.876 1.00 0.00 N ATOM 0 H ARG A 392 17.470 10.161 -5.581 1.00 0.00 H new ATOM 0 HA ARG A 392 20.040 10.900 -6.809 1.00 0.00 H new ATOM 0 HB2 ARG A 392 19.624 11.770 -4.577 1.00 0.00 H new ATOM 0 HB3 ARG A 392 19.173 10.184 -3.984 1.00 0.00 H new ATOM 0 HG2 ARG A 392 21.555 9.429 -4.574 1.00 0.00 H new ATOM 0 HG3 ARG A 392 21.933 11.121 -4.828 1.00 0.00 H new ATOM 0 HD2 ARG A 392 20.834 9.935 -2.246 1.00 0.00 H new ATOM 0 HD3 ARG A 392 22.511 10.353 -2.532 1.00 0.00 H new ATOM 0 HE ARG A 392 20.686 12.596 -2.981 1.00 0.00 H new ATOM 0 HH11 ARG A 392 22.544 10.767 -0.601 1.00 0.00 H new ATOM 0 HH12 ARG A 392 22.637 12.119 0.534 1.00 0.00 H new ATOM 0 HH21 ARG A 392 20.813 14.327 -1.520 1.00 0.00 H new ATOM 0 HH22 ARG A 392 21.662 14.124 0.016 1.00 0.00 H new ATOM 667 N THR A 393 19.170 7.888 -5.759 1.00 0.00 N ATOM 668 CA THR A 393 19.477 6.469 -5.888 1.00 0.00 C ATOM 669 C THR A 393 18.788 5.865 -7.106 1.00 0.00 C ATOM 670 O THR A 393 19.176 4.802 -7.588 1.00 0.00 O ATOM 671 CB THR A 393 19.053 5.686 -4.631 1.00 0.00 C ATOM 672 OG1 THR A 393 17.663 5.905 -4.364 1.00 0.00 O ATOM 673 CG2 THR A 393 19.879 6.110 -3.425 1.00 0.00 C ATOM 0 H THR A 393 18.335 8.091 -5.209 1.00 0.00 H new ATOM 0 HA THR A 393 20.557 6.390 -6.009 1.00 0.00 H new ATOM 0 HB THR A 393 19.225 4.625 -4.815 1.00 0.00 H new ATOM 0 HG1 THR A 393 17.304 5.148 -3.856 1.00 0.00 H new ATOM 0 HG21 THR A 393 19.562 5.544 -2.549 1.00 0.00 H new ATOM 0 HG22 THR A 393 20.934 5.916 -3.620 1.00 0.00 H new ATOM 0 HG23 THR A 393 19.734 7.174 -3.241 1.00 0.00 H new ATOM 681 N GLY A 394 17.761 6.551 -7.600 1.00 0.00 N ATOM 682 CA GLY A 394 17.034 6.067 -8.759 1.00 0.00 C ATOM 683 C GLY A 394 16.365 4.730 -8.506 1.00 0.00 C ATOM 684 O GLY A 394 16.154 3.949 -9.434 1.00 0.00 O ATOM 0 H GLY A 394 17.420 7.433 -7.218 1.00 0.00 H new ATOM 0 HA2 GLY A 394 16.279 6.800 -9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 394 17.720 5.973 -9.601 1.00 0.00 H new ATOM 688 N GLN A 395 16.032 4.466 -7.246 1.00 0.00 N ATOM 689 CA GLN A 395 15.385 3.213 -6.875 1.00 0.00 C ATOM 690 C GLN A 395 13.971 3.463 -6.359 1.00 0.00 C ATOM 691 O GLN A 395 13.653 4.534 -5.840 1.00 0.00 O ATOM 692 CB GLN A 395 16.207 2.487 -5.809 1.00 0.00 C ATOM 693 CG GLN A 395 17.605 2.109 -6.273 1.00 0.00 C ATOM 694 CD GLN A 395 18.134 0.867 -5.583 1.00 0.00 C ATOM 695 OE1 GLN A 395 18.848 0.064 -6.184 1.00 0.00 O ATOM 696 NE2 GLN A 395 17.785 0.702 -4.312 1.00 0.00 N ATOM 0 H GLN A 395 16.199 5.102 -6.466 1.00 0.00 H new ATOM 0 HA GLN A 395 15.323 2.587 -7.765 1.00 0.00 H new ATOM 0 HB2 GLN A 395 16.285 3.122 -4.927 1.00 0.00 H new ATOM 0 HB3 GLN A 395 15.677 1.584 -5.506 1.00 0.00 H new ATOM 0 HG2 GLN A 395 17.594 1.944 -7.350 1.00 0.00 H new ATOM 0 HG3 GLN A 395 18.283 2.941 -6.085 1.00 0.00 H new ATOM 0 HE21 GLN A 395 17.191 1.392 -3.852 1.00 0.00 H new ATOM 0 HE22 GLN A 395 18.111 -0.115 -3.796 1.00 0.00 H new ATOM 705 N PRO A 396 13.101 2.453 -6.504 1.00 0.00 N ATOM 706 CA PRO A 396 11.706 2.539 -6.059 1.00 0.00 C ATOM 707 C PRO A 396 11.584 2.557 -4.539 1.00 0.00 C ATOM 708 O PRO A 396 12.369 1.923 -3.836 1.00 0.00 O ATOM 709 CB PRO A 396 11.073 1.270 -6.632 1.00 0.00 C ATOM 710 CG PRO A 396 12.205 0.314 -6.781 1.00 0.00 C ATOM 711 CD PRO A 396 13.411 1.149 -7.113 1.00 0.00 C ATOM 0 HA PRO A 396 11.226 3.459 -6.393 1.00 0.00 H new ATOM 0 HB2 PRO A 396 10.307 0.875 -5.965 1.00 0.00 H new ATOM 0 HB3 PRO A 396 10.592 1.466 -7.590 1.00 0.00 H new ATOM 0 HG2 PRO A 396 12.362 -0.251 -5.862 1.00 0.00 H new ATOM 0 HG3 PRO A 396 12.003 -0.411 -7.570 1.00 0.00 H new ATOM 0 HD2 PRO A 396 14.323 0.719 -6.700 1.00 0.00 H new ATOM 0 HD3 PRO A 396 13.558 1.233 -8.190 1.00 0.00 H new ATOM 719 N MET A 397 10.591 3.287 -4.039 1.00 0.00 N ATOM 720 CA MET A 397 10.366 3.385 -2.601 1.00 0.00 C ATOM 721 C MET A 397 9.601 2.169 -2.088 1.00 0.00 C ATOM 722 O MET A 397 8.697 2.296 -1.262 1.00 0.00 O ATOM 723 CB MET A 397 9.593 4.663 -2.272 1.00 0.00 C ATOM 724 CG MET A 397 10.330 5.935 -2.659 1.00 0.00 C ATOM 725 SD MET A 397 11.427 6.527 -1.355 1.00 0.00 S ATOM 726 CE MET A 397 13.025 6.302 -2.131 1.00 0.00 C ATOM 0 H MET A 397 9.931 3.818 -4.607 1.00 0.00 H new ATOM 0 HA MET A 397 11.337 3.418 -2.106 1.00 0.00 H new ATOM 0 HB2 MET A 397 8.632 4.639 -2.786 1.00 0.00 H new ATOM 0 HB3 MET A 397 9.383 4.686 -1.203 1.00 0.00 H new ATOM 0 HG2 MET A 397 10.912 5.753 -3.563 1.00 0.00 H new ATOM 0 HG3 MET A 397 9.604 6.712 -2.898 1.00 0.00 H new ATOM 0 HE1 MET A 397 13.810 6.383 -1.379 1.00 0.00 H new ATOM 0 HE2 MET A 397 13.068 5.317 -2.596 1.00 0.00 H new ATOM 0 HE3 MET A 397 13.171 7.069 -2.892 1.00 0.00 H new ATOM 736 N ILE A 398 9.971 0.991 -2.581 1.00 0.00 N ATOM 737 CA ILE A 398 9.320 -0.247 -2.171 1.00 0.00 C ATOM 738 C ILE A 398 10.145 -0.978 -1.117 1.00 0.00 C ATOM 739 O ILE A 398 11.365 -1.095 -1.240 1.00 0.00 O ATOM 740 CB ILE A 398 9.090 -1.186 -3.369 1.00 0.00 C ATOM 741 CG1 ILE A 398 8.063 -0.581 -4.328 1.00 0.00 C ATOM 742 CG2 ILE A 398 8.632 -2.555 -2.889 1.00 0.00 C ATOM 743 CD1 ILE A 398 7.934 -1.339 -5.632 1.00 0.00 C ATOM 0 H ILE A 398 10.718 0.868 -3.265 1.00 0.00 H new ATOM 0 HA ILE A 398 8.355 0.029 -1.747 1.00 0.00 H new ATOM 0 HB ILE A 398 10.032 -1.307 -3.904 1.00 0.00 H new ATOM 0 HG12 ILE A 398 7.091 -0.553 -3.836 1.00 0.00 H new ATOM 0 HG13 ILE A 398 8.342 0.451 -4.543 1.00 0.00 H new ATOM 0 HG21 ILE A 398 8.474 -3.207 -3.748 1.00 0.00 H new ATOM 0 HG22 ILE A 398 9.394 -2.987 -2.241 1.00 0.00 H new ATOM 0 HG23 ILE A 398 7.699 -2.453 -2.334 1.00 0.00 H new ATOM 0 HD11 ILE A 398 7.189 -0.854 -6.263 1.00 0.00 H new ATOM 0 HD12 ILE A 398 8.895 -1.345 -6.146 1.00 0.00 H new ATOM 0 HD13 ILE A 398 7.625 -2.364 -5.428 1.00 0.00 H new ATOM 755 N HIS A 399 9.471 -1.470 -0.082 1.00 0.00 N ATOM 756 CA HIS A 399 10.142 -2.193 0.992 1.00 0.00 C ATOM 757 C HIS A 399 9.666 -3.642 1.053 1.00 0.00 C ATOM 758 O HIS A 399 8.485 -3.925 0.852 1.00 0.00 O ATOM 759 CB HIS A 399 9.889 -1.505 2.334 1.00 0.00 C ATOM 760 CG HIS A 399 11.020 -1.652 3.306 1.00 0.00 C ATOM 761 ND1 HIS A 399 12.162 -0.882 3.253 1.00 0.00 N ATOM 762 CD2 HIS A 399 11.179 -2.488 4.359 1.00 0.00 C ATOM 763 CE1 HIS A 399 12.976 -1.237 4.232 1.00 0.00 C ATOM 764 NE2 HIS A 399 12.403 -2.209 4.918 1.00 0.00 N ATOM 0 H HIS A 399 8.462 -1.381 0.035 1.00 0.00 H new ATOM 0 HA HIS A 399 11.212 -2.189 0.785 1.00 0.00 H new ATOM 0 HB2 HIS A 399 9.706 -0.445 2.160 1.00 0.00 H new ATOM 0 HB3 HIS A 399 8.983 -1.917 2.779 1.00 0.00 H new ATOM 0 HD2 HIS A 399 10.475 -3.235 4.697 1.00 0.00 H new ATOM 0 HE1 HIS A 399 13.945 -0.806 4.436 1.00 0.00 H new ATOM 0 HE2 HIS A 399 12.804 -2.677 5.731 1.00 0.00 H new ATOM 772 N ILE A 400 10.593 -4.553 1.329 1.00 0.00 N ATOM 773 CA ILE A 400 10.267 -5.971 1.416 1.00 0.00 C ATOM 774 C ILE A 400 10.888 -6.603 2.657 1.00 0.00 C ATOM 775 O ILE A 400 12.040 -7.038 2.635 1.00 0.00 O ATOM 776 CB ILE A 400 10.747 -6.736 0.168 1.00 0.00 C ATOM 777 CG1 ILE A 400 10.100 -6.159 -1.092 1.00 0.00 C ATOM 778 CG2 ILE A 400 10.431 -8.218 0.301 1.00 0.00 C ATOM 779 CD1 ILE A 400 10.578 -6.811 -2.370 1.00 0.00 C ATOM 0 H ILE A 400 11.575 -4.335 1.496 1.00 0.00 H new ATOM 0 HA ILE A 400 9.181 -6.042 1.480 1.00 0.00 H new ATOM 0 HB ILE A 400 11.828 -6.621 0.083 1.00 0.00 H new ATOM 0 HG12 ILE A 400 9.018 -6.271 -1.019 1.00 0.00 H new ATOM 0 HG13 ILE A 400 10.307 -5.090 -1.140 1.00 0.00 H new ATOM 0 HG21 ILE A 400 10.776 -8.745 -0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 400 10.935 -8.620 1.180 1.00 0.00 H new ATOM 0 HG23 ILE A 400 9.355 -8.352 0.407 1.00 0.00 H new ATOM 0 HD11 ILE A 400 10.077 -6.352 -3.222 1.00 0.00 H new ATOM 0 HD12 ILE A 400 11.655 -6.676 -2.466 1.00 0.00 H new ATOM 0 HD13 ILE A 400 10.347 -7.876 -2.344 1.00 0.00 H new ATOM 791 N TYR A 401 10.117 -6.652 3.738 1.00 0.00 N ATOM 792 CA TYR A 401 10.592 -7.230 4.989 1.00 0.00 C ATOM 793 C TYR A 401 10.960 -8.699 4.805 1.00 0.00 C ATOM 794 O TYR A 401 10.143 -9.505 4.357 1.00 0.00 O ATOM 795 CB TYR A 401 9.525 -7.092 6.076 1.00 0.00 C ATOM 796 CG TYR A 401 8.860 -5.735 6.103 1.00 0.00 C ATOM 797 CD1 TYR A 401 7.810 -5.436 5.242 1.00 0.00 C ATOM 798 CD2 TYR A 401 9.281 -4.750 6.989 1.00 0.00 C ATOM 799 CE1 TYR A 401 7.201 -4.196 5.262 1.00 0.00 C ATOM 800 CE2 TYR A 401 8.675 -3.509 7.017 1.00 0.00 C ATOM 801 CZ TYR A 401 7.636 -3.237 6.152 1.00 0.00 C ATOM 802 OH TYR A 401 7.032 -2.001 6.176 1.00 0.00 O ATOM 0 H TYR A 401 9.161 -6.298 3.773 1.00 0.00 H new ATOM 0 HA TYR A 401 11.486 -6.686 5.295 1.00 0.00 H new ATOM 0 HB2 TYR A 401 8.764 -7.857 5.925 1.00 0.00 H new ATOM 0 HB3 TYR A 401 9.981 -7.283 7.047 1.00 0.00 H new ATOM 0 HD1 TYR A 401 7.465 -6.186 4.546 1.00 0.00 H new ATOM 0 HD2 TYR A 401 10.096 -4.959 7.667 1.00 0.00 H new ATOM 0 HE1 TYR A 401 6.389 -3.979 4.584 1.00 0.00 H new ATOM 0 HE2 TYR A 401 9.013 -2.755 7.713 1.00 0.00 H new ATOM 0 HH TYR A 401 7.456 -1.443 6.861 1.00 0.00 H new ATOM 812 N LEU A 402 12.195 -9.041 5.155 1.00 0.00 N ATOM 813 CA LEU A 402 12.674 -10.413 5.030 1.00 0.00 C ATOM 814 C LEU A 402 12.838 -11.060 6.401 1.00 0.00 C ATOM 815 O LEU A 402 13.352 -10.441 7.333 1.00 0.00 O ATOM 816 CB LEU A 402 14.005 -10.444 4.277 1.00 0.00 C ATOM 817 CG LEU A 402 14.050 -9.662 2.963 1.00 0.00 C ATOM 818 CD1 LEU A 402 15.458 -9.666 2.388 1.00 0.00 C ATOM 819 CD2 LEU A 402 13.064 -10.246 1.961 1.00 0.00 C ATOM 0 H LEU A 402 12.883 -8.387 5.528 1.00 0.00 H new ATOM 0 HA LEU A 402 11.932 -10.980 4.467 1.00 0.00 H new ATOM 0 HB2 LEU A 402 14.781 -10.055 4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 402 14.257 -11.483 4.067 1.00 0.00 H new ATOM 0 HG LEU A 402 13.764 -8.630 3.167 1.00 0.00 H new ATOM 0 HD11 LEU A 402 15.471 -9.105 1.453 1.00 0.00 H new ATOM 0 HD12 LEU A 402 16.143 -9.203 3.099 1.00 0.00 H new ATOM 0 HD13 LEU A 402 15.771 -10.693 2.199 1.00 0.00 H new ATOM 0 HD21 LEU A 402 13.109 -9.677 1.032 1.00 0.00 H new ATOM 0 HD22 LEU A 402 13.320 -11.287 1.762 1.00 0.00 H new ATOM 0 HD23 LEU A 402 12.055 -10.193 2.370 1.00 0.00 H new ATOM 831 N ASP A 403 12.399 -12.308 6.518 1.00 0.00 N ATOM 832 CA ASP A 403 12.499 -13.040 7.775 1.00 0.00 C ATOM 833 C ASP A 403 13.942 -13.071 8.272 1.00 0.00 C ATOM 834 O ASP A 403 14.854 -13.457 7.540 1.00 0.00 O ATOM 835 CB ASP A 403 11.976 -14.467 7.603 1.00 0.00 C ATOM 836 CG ASP A 403 11.360 -15.016 8.874 1.00 0.00 C ATOM 837 OD1 ASP A 403 10.371 -14.426 9.357 1.00 0.00 O ATOM 838 OD2 ASP A 403 11.867 -16.035 9.387 1.00 0.00 O ATOM 0 H ASP A 403 11.970 -12.834 5.757 1.00 0.00 H new ATOM 0 HA ASP A 403 11.888 -12.525 8.516 1.00 0.00 H new ATOM 0 HB2 ASP A 403 11.233 -14.485 6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 403 12.794 -15.115 7.290 1.00 0.00 H new ATOM 843 N LYS A 404 14.142 -12.660 9.519 1.00 0.00 N ATOM 844 CA LYS A 404 15.473 -12.640 10.115 1.00 0.00 C ATOM 845 C LYS A 404 15.936 -14.052 10.461 1.00 0.00 C ATOM 846 O LYS A 404 17.045 -14.247 10.956 1.00 0.00 O ATOM 847 CB LYS A 404 15.478 -11.768 11.373 1.00 0.00 C ATOM 848 CG LYS A 404 14.771 -12.405 12.557 1.00 0.00 C ATOM 849 CD LYS A 404 14.799 -11.498 13.776 1.00 0.00 C ATOM 850 CE LYS A 404 13.687 -11.844 14.754 1.00 0.00 C ATOM 851 NZ LYS A 404 12.436 -11.094 14.459 1.00 0.00 N ATOM 0 H LYS A 404 13.399 -12.336 10.138 1.00 0.00 H new ATOM 0 HA LYS A 404 16.164 -12.219 9.385 1.00 0.00 H new ATOM 0 HB2 LYS A 404 16.510 -11.551 11.650 1.00 0.00 H new ATOM 0 HB3 LYS A 404 15.001 -10.814 11.146 1.00 0.00 H new ATOM 0 HG2 LYS A 404 13.737 -12.625 12.290 1.00 0.00 H new ATOM 0 HG3 LYS A 404 15.247 -13.355 12.798 1.00 0.00 H new ATOM 0 HD2 LYS A 404 15.764 -11.587 14.275 1.00 0.00 H new ATOM 0 HD3 LYS A 404 14.697 -10.460 13.461 1.00 0.00 H new ATOM 0 HE2 LYS A 404 13.487 -12.915 14.712 1.00 0.00 H new ATOM 0 HE3 LYS A 404 14.014 -11.620 15.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 11.703 -11.358 15.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 12.620 -10.072 14.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 12.110 -11.327 13.499 1.00 0.00 H new ATOM 865 N GLU A 405 15.078 -15.032 10.195 1.00 0.00 N ATOM 866 CA GLU A 405 15.400 -16.425 10.479 1.00 0.00 C ATOM 867 C GLU A 405 15.917 -17.130 9.227 1.00 0.00 C ATOM 868 O GLU A 405 16.790 -17.995 9.302 1.00 0.00 O ATOM 869 CB GLU A 405 14.170 -17.158 11.017 1.00 0.00 C ATOM 870 CG GLU A 405 13.359 -16.339 12.008 1.00 0.00 C ATOM 871 CD GLU A 405 13.853 -16.491 13.433 1.00 0.00 C ATOM 872 OE1 GLU A 405 15.053 -16.240 13.674 1.00 0.00 O ATOM 873 OE2 GLU A 405 13.042 -16.859 14.307 1.00 0.00 O ATOM 0 H GLU A 405 14.156 -14.887 9.784 1.00 0.00 H new ATOM 0 HA GLU A 405 16.184 -16.442 11.236 1.00 0.00 H new ATOM 0 HB2 GLU A 405 13.530 -17.439 10.181 1.00 0.00 H new ATOM 0 HB3 GLU A 405 14.490 -18.082 11.498 1.00 0.00 H new ATOM 0 HG2 GLU A 405 13.400 -15.288 11.724 1.00 0.00 H new ATOM 0 HG3 GLU A 405 12.314 -16.643 11.955 1.00 0.00 H new ATOM 880 N THR A 406 15.372 -16.752 8.075 1.00 0.00 N ATOM 881 CA THR A 406 15.776 -17.347 6.807 1.00 0.00 C ATOM 882 C THR A 406 16.309 -16.289 5.848 1.00 0.00 C ATOM 883 O THR A 406 17.229 -16.547 5.074 1.00 0.00 O ATOM 884 CB THR A 406 14.604 -18.088 6.135 1.00 0.00 C ATOM 885 OG1 THR A 406 13.471 -17.217 6.029 1.00 0.00 O ATOM 886 CG2 THR A 406 14.223 -19.329 6.928 1.00 0.00 C ATOM 0 H THR A 406 14.650 -16.036 7.994 1.00 0.00 H new ATOM 0 HA THR A 406 16.568 -18.062 7.032 1.00 0.00 H new ATOM 0 HB THR A 406 14.920 -18.396 5.138 1.00 0.00 H new ATOM 0 HG1 THR A 406 12.647 -17.746 6.067 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.394 -19.836 6.435 1.00 0.00 H new ATOM 0 HG22 THR A 406 15.078 -20.002 6.983 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.924 -19.039 7.935 1.00 0.00 H new ATOM 894 N GLY A 407 15.725 -15.096 5.907 1.00 0.00 N ATOM 895 CA GLY A 407 16.156 -14.016 5.037 1.00 0.00 C ATOM 896 C GLY A 407 15.253 -13.845 3.833 1.00 0.00 C ATOM 897 O GLY A 407 15.469 -12.960 3.005 1.00 0.00 O ATOM 0 H GLY A 407 14.962 -14.858 6.541 1.00 0.00 H new ATOM 0 HA2 GLY A 407 16.181 -13.085 5.604 1.00 0.00 H new ATOM 0 HA3 GLY A 407 17.174 -14.210 4.699 1.00 0.00 H new ATOM 901 N LYS A 408 14.236 -14.696 3.732 1.00 0.00 N ATOM 902 CA LYS A 408 13.297 -14.636 2.619 1.00 0.00 C ATOM 903 C LYS A 408 12.162 -13.660 2.916 1.00 0.00 C ATOM 904 O LYS A 408 11.843 -13.376 4.071 1.00 0.00 O ATOM 905 CB LYS A 408 12.725 -16.027 2.332 1.00 0.00 C ATOM 906 CG LYS A 408 13.659 -17.160 2.722 1.00 0.00 C ATOM 907 CD LYS A 408 13.140 -18.502 2.236 1.00 0.00 C ATOM 908 CE LYS A 408 12.005 -19.013 3.111 1.00 0.00 C ATOM 909 NZ LYS A 408 10.695 -18.423 2.720 1.00 0.00 N ATOM 0 H LYS A 408 14.042 -15.435 4.408 1.00 0.00 H new ATOM 0 HA LYS A 408 13.836 -14.282 1.740 1.00 0.00 H new ATOM 0 HB2 LYS A 408 11.784 -16.142 2.869 1.00 0.00 H new ATOM 0 HB3 LYS A 408 12.497 -16.105 1.269 1.00 0.00 H new ATOM 0 HG2 LYS A 408 14.648 -16.978 2.303 1.00 0.00 H new ATOM 0 HG3 LYS A 408 13.772 -17.183 3.806 1.00 0.00 H new ATOM 0 HD2 LYS A 408 12.793 -18.408 1.207 1.00 0.00 H new ATOM 0 HD3 LYS A 408 13.953 -19.228 2.233 1.00 0.00 H new ATOM 0 HE2 LYS A 408 11.951 -20.099 3.038 1.00 0.00 H new ATOM 0 HE3 LYS A 408 12.214 -18.774 4.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 10.337 -17.829 3.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 10.817 -17.842 1.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 10.015 -19.186 2.525 1.00 0.00 H new ATOM 923 N PRO A 409 11.536 -13.137 1.852 1.00 0.00 N ATOM 924 CA PRO A 409 10.427 -12.187 1.974 1.00 0.00 C ATOM 925 C PRO A 409 9.162 -12.841 2.519 1.00 0.00 C ATOM 926 O PRO A 409 8.344 -13.362 1.760 1.00 0.00 O ATOM 927 CB PRO A 409 10.207 -11.711 0.536 1.00 0.00 C ATOM 928 CG PRO A 409 10.718 -12.823 -0.313 1.00 0.00 C ATOM 929 CD PRO A 409 11.864 -13.432 0.447 1.00 0.00 C ATOM 0 HA PRO A 409 10.654 -11.382 2.673 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.153 -11.516 0.340 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.745 -10.783 0.339 1.00 0.00 H new ATOM 0 HG2 PRO A 409 9.938 -13.561 -0.500 1.00 0.00 H new ATOM 0 HG3 PRO A 409 11.047 -12.453 -1.284 1.00 0.00 H new ATOM 0 HD2 PRO A 409 11.940 -14.505 0.269 1.00 0.00 H new ATOM 0 HD3 PRO A 409 12.818 -12.992 0.156 1.00 0.00 H new ATOM 937 N LYS A 410 9.005 -12.809 3.838 1.00 0.00 N ATOM 938 CA LYS A 410 7.839 -13.397 4.485 1.00 0.00 C ATOM 939 C LYS A 410 6.611 -13.299 3.586 1.00 0.00 C ATOM 940 O LYS A 410 5.945 -14.297 3.317 1.00 0.00 O ATOM 941 CB LYS A 410 7.564 -12.699 5.820 1.00 0.00 C ATOM 942 CG LYS A 410 7.800 -11.199 5.781 1.00 0.00 C ATOM 943 CD LYS A 410 8.013 -10.632 7.175 1.00 0.00 C ATOM 944 CE LYS A 410 6.702 -10.523 7.938 1.00 0.00 C ATOM 945 NZ LYS A 410 6.880 -9.843 9.251 1.00 0.00 N ATOM 0 H LYS A 410 9.672 -12.381 4.480 1.00 0.00 H new ATOM 0 HA LYS A 410 8.050 -14.450 4.669 1.00 0.00 H new ATOM 0 HB2 LYS A 410 6.532 -12.889 6.114 1.00 0.00 H new ATOM 0 HB3 LYS A 410 8.200 -13.139 6.588 1.00 0.00 H new ATOM 0 HG2 LYS A 410 8.671 -10.983 5.162 1.00 0.00 H new ATOM 0 HG3 LYS A 410 6.947 -10.707 5.314 1.00 0.00 H new ATOM 0 HD2 LYS A 410 8.704 -11.269 7.726 1.00 0.00 H new ATOM 0 HD3 LYS A 410 8.476 -9.648 7.102 1.00 0.00 H new ATOM 0 HE2 LYS A 410 5.978 -9.972 7.339 1.00 0.00 H new ATOM 0 HE3 LYS A 410 6.291 -11.520 8.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 5.964 -9.788 9.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 7.552 -10.383 9.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 7.248 -8.883 9.097 1.00 0.00 H new ATOM 959 N GLY A 411 6.317 -12.087 3.123 1.00 0.00 N ATOM 960 CA GLY A 411 5.170 -11.882 2.258 1.00 0.00 C ATOM 961 C GLY A 411 4.640 -10.464 2.324 1.00 0.00 C ATOM 962 O GLY A 411 3.857 -10.046 1.470 1.00 0.00 O ATOM 0 H GLY A 411 6.853 -11.244 3.332 1.00 0.00 H new ATOM 0 HA2 GLY A 411 5.448 -12.115 1.230 1.00 0.00 H new ATOM 0 HA3 GLY A 411 4.378 -12.576 2.539 1.00 0.00 H new ATOM 966 N ASP A 412 5.066 -9.721 3.340 1.00 0.00 N ATOM 967 CA ASP A 412 4.628 -8.341 3.515 1.00 0.00 C ATOM 968 C ASP A 412 5.543 -7.382 2.759 1.00 0.00 C ATOM 969 O ASP A 412 6.696 -7.702 2.475 1.00 0.00 O ATOM 970 CB ASP A 412 4.602 -7.977 5.001 1.00 0.00 C ATOM 971 CG ASP A 412 5.976 -8.048 5.639 1.00 0.00 C ATOM 972 OD1 ASP A 412 6.910 -8.554 4.981 1.00 0.00 O ATOM 973 OD2 ASP A 412 6.118 -7.599 6.795 1.00 0.00 O ATOM 0 H ASP A 412 5.714 -10.051 4.055 1.00 0.00 H new ATOM 0 HA ASP A 412 3.621 -8.250 3.109 1.00 0.00 H new ATOM 0 HB2 ASP A 412 4.202 -6.970 5.118 1.00 0.00 H new ATOM 0 HB3 ASP A 412 3.926 -8.652 5.526 1.00 0.00 H new ATOM 978 N ALA A 413 5.018 -6.204 2.436 1.00 0.00 N ATOM 979 CA ALA A 413 5.786 -5.199 1.714 1.00 0.00 C ATOM 980 C ALA A 413 5.062 -3.856 1.705 1.00 0.00 C ATOM 981 O ALA A 413 3.884 -3.771 2.057 1.00 0.00 O ATOM 982 CB ALA A 413 6.057 -5.663 0.290 1.00 0.00 C ATOM 0 H ALA A 413 4.064 -5.923 2.663 1.00 0.00 H new ATOM 0 HA ALA A 413 6.738 -5.067 2.229 1.00 0.00 H new ATOM 0 HB1 ALA A 413 6.632 -4.902 -0.238 1.00 0.00 H new ATOM 0 HB2 ALA A 413 6.623 -6.594 0.312 1.00 0.00 H new ATOM 0 HB3 ALA A 413 5.111 -5.826 -0.226 1.00 0.00 H new ATOM 988 N THR A 414 5.772 -2.809 1.300 1.00 0.00 N ATOM 989 CA THR A 414 5.198 -1.470 1.248 1.00 0.00 C ATOM 990 C THR A 414 5.595 -0.751 -0.037 1.00 0.00 C ATOM 991 O THR A 414 6.734 -0.856 -0.491 1.00 0.00 O ATOM 992 CB THR A 414 5.639 -0.621 2.456 1.00 0.00 C ATOM 993 OG1 THR A 414 7.002 -0.908 2.784 1.00 0.00 O ATOM 994 CG2 THR A 414 4.752 -0.896 3.661 1.00 0.00 C ATOM 0 H THR A 414 6.746 -2.862 1.003 1.00 0.00 H new ATOM 0 HA THR A 414 4.115 -1.590 1.274 1.00 0.00 H new ATOM 0 HB THR A 414 5.545 0.431 2.188 1.00 0.00 H new ATOM 0 HG1 THR A 414 7.275 -0.363 3.551 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.081 -0.286 4.502 1.00 0.00 H new ATOM 0 HG22 THR A 414 3.719 -0.649 3.416 1.00 0.00 H new ATOM 0 HG23 THR A 414 4.819 -1.950 3.929 1.00 0.00 H new ATOM 1002 N VAL A 415 4.650 -0.019 -0.616 1.00 0.00 N ATOM 1003 CA VAL A 415 4.903 0.720 -1.848 1.00 0.00 C ATOM 1004 C VAL A 415 4.516 2.187 -1.698 1.00 0.00 C ATOM 1005 O VAL A 415 3.338 2.519 -1.568 1.00 0.00 O ATOM 1006 CB VAL A 415 4.128 0.116 -3.033 1.00 0.00 C ATOM 1007 CG1 VAL A 415 4.509 0.811 -4.332 1.00 0.00 C ATOM 1008 CG2 VAL A 415 4.382 -1.382 -3.128 1.00 0.00 C ATOM 0 H VAL A 415 3.702 0.079 -0.253 1.00 0.00 H new ATOM 0 HA VAL A 415 5.972 0.647 -2.047 1.00 0.00 H new ATOM 0 HB VAL A 415 3.063 0.272 -2.864 1.00 0.00 H new ATOM 0 HG11 VAL A 415 3.951 0.370 -5.158 1.00 0.00 H new ATOM 0 HG12 VAL A 415 4.272 1.873 -4.260 1.00 0.00 H new ATOM 0 HG13 VAL A 415 5.577 0.689 -4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 415 3.826 -1.793 -3.971 1.00 0.00 H new ATOM 0 HG22 VAL A 415 5.447 -1.562 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 415 4.055 -1.866 -2.208 1.00 0.00 H new ATOM 1018 N SER A 416 5.516 3.062 -1.717 1.00 0.00 N ATOM 1019 CA SER A 416 5.283 4.495 -1.580 1.00 0.00 C ATOM 1020 C SER A 416 5.054 5.141 -2.943 1.00 0.00 C ATOM 1021 O SER A 416 5.958 5.191 -3.778 1.00 0.00 O ATOM 1022 CB SER A 416 6.467 5.162 -0.879 1.00 0.00 C ATOM 1023 OG SER A 416 6.401 4.973 0.524 1.00 0.00 O ATOM 0 H SER A 416 6.497 2.803 -1.826 1.00 0.00 H new ATOM 0 HA SER A 416 4.387 4.636 -0.975 1.00 0.00 H new ATOM 0 HB2 SER A 416 7.400 4.748 -1.261 1.00 0.00 H new ATOM 0 HB3 SER A 416 6.474 6.228 -1.106 1.00 0.00 H new ATOM 0 HG SER A 416 7.170 5.407 0.949 1.00 0.00 H new ATOM 1029 N TYR A 417 3.840 5.633 -3.161 1.00 0.00 N ATOM 1030 CA TYR A 417 3.491 6.274 -4.424 1.00 0.00 C ATOM 1031 C TYR A 417 3.804 7.766 -4.382 1.00 0.00 C ATOM 1032 O TYR A 417 4.025 8.336 -3.313 1.00 0.00 O ATOM 1033 CB TYR A 417 2.008 6.062 -4.733 1.00 0.00 C ATOM 1034 CG TYR A 417 1.670 4.644 -5.134 1.00 0.00 C ATOM 1035 CD1 TYR A 417 1.973 4.168 -6.403 1.00 0.00 C ATOM 1036 CD2 TYR A 417 1.047 3.780 -4.242 1.00 0.00 C ATOM 1037 CE1 TYR A 417 1.666 2.873 -6.773 1.00 0.00 C ATOM 1038 CE2 TYR A 417 0.736 2.483 -4.603 1.00 0.00 C ATOM 1039 CZ TYR A 417 1.048 2.034 -5.870 1.00 0.00 C ATOM 1040 OH TYR A 417 0.740 0.743 -6.233 1.00 0.00 O ATOM 0 H TYR A 417 3.081 5.601 -2.480 1.00 0.00 H new ATOM 0 HA TYR A 417 4.090 5.818 -5.212 1.00 0.00 H new ATOM 0 HB2 TYR A 417 1.420 6.332 -3.856 1.00 0.00 H new ATOM 0 HB3 TYR A 417 1.712 6.738 -5.535 1.00 0.00 H new ATOM 0 HD1 TYR A 417 2.457 4.822 -7.113 1.00 0.00 H new ATOM 0 HD2 TYR A 417 0.802 4.128 -3.250 1.00 0.00 H new ATOM 0 HE1 TYR A 417 1.909 2.520 -7.764 1.00 0.00 H new ATOM 0 HE2 TYR A 417 0.251 1.824 -3.897 1.00 0.00 H new ATOM 0 HH TYR A 417 1.072 0.570 -7.139 1.00 0.00 H new ATOM 1050 N GLU A 418 3.823 8.393 -5.554 1.00 0.00 N ATOM 1051 CA GLU A 418 4.110 9.820 -5.652 1.00 0.00 C ATOM 1052 C GLU A 418 3.128 10.631 -4.812 1.00 0.00 C ATOM 1053 O GLU A 418 3.502 11.221 -3.798 1.00 0.00 O ATOM 1054 CB GLU A 418 4.048 10.276 -7.111 1.00 0.00 C ATOM 1055 CG GLU A 418 5.049 9.572 -8.012 1.00 0.00 C ATOM 1056 CD GLU A 418 6.377 10.299 -8.090 1.00 0.00 C ATOM 1057 OE1 GLU A 418 6.735 10.987 -7.110 1.00 0.00 O ATOM 1058 OE2 GLU A 418 7.058 10.183 -9.130 1.00 0.00 O ATOM 0 H GLU A 418 3.643 7.936 -6.448 1.00 0.00 H new ATOM 0 HA GLU A 418 5.116 9.990 -5.268 1.00 0.00 H new ATOM 0 HB2 GLU A 418 3.042 10.103 -7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 418 4.225 11.351 -7.155 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.215 8.560 -7.643 1.00 0.00 H new ATOM 0 HG3 GLU A 418 4.629 9.482 -9.014 1.00 0.00 H new ATOM 1065 N ASP A 419 1.871 10.657 -5.242 1.00 0.00 N ATOM 1066 CA ASP A 419 0.834 11.395 -4.530 1.00 0.00 C ATOM 1067 C ASP A 419 -0.190 10.443 -3.921 1.00 0.00 C ATOM 1068 O ASP A 419 -0.358 9.307 -4.364 1.00 0.00 O ATOM 1069 CB ASP A 419 0.139 12.377 -5.474 1.00 0.00 C ATOM 1070 CG ASP A 419 1.114 13.088 -6.391 1.00 0.00 C ATOM 1071 OD1 ASP A 419 2.267 13.314 -5.969 1.00 0.00 O ATOM 1072 OD2 ASP A 419 0.724 13.421 -7.530 1.00 0.00 O ATOM 0 H ASP A 419 1.546 10.175 -6.080 1.00 0.00 H new ATOM 0 HA ASP A 419 1.308 11.953 -3.723 1.00 0.00 H new ATOM 0 HB2 ASP A 419 -0.595 11.841 -6.075 1.00 0.00 H new ATOM 0 HB3 ASP A 419 -0.408 13.115 -4.887 1.00 0.00 H new ATOM 1077 N PRO A 420 -0.891 10.915 -2.880 1.00 0.00 N ATOM 1078 CA PRO A 420 -1.911 10.122 -2.187 1.00 0.00 C ATOM 1079 C PRO A 420 -3.008 9.639 -3.129 1.00 0.00 C ATOM 1080 O PRO A 420 -3.447 8.490 -3.071 1.00 0.00 O ATOM 1081 CB PRO A 420 -2.482 11.100 -1.157 1.00 0.00 C ATOM 1082 CG PRO A 420 -1.427 12.140 -0.996 1.00 0.00 C ATOM 1083 CD PRO A 420 -0.744 12.261 -2.299 1.00 0.00 C ATOM 0 HA PRO A 420 -1.494 9.216 -1.748 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -3.419 11.537 -1.503 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -2.693 10.601 -0.211 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -1.866 13.093 -0.700 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -0.722 11.857 -0.215 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -1.205 13.023 -2.927 1.00 0.00 H new ATOM 0 HD3 PRO A 420 0.304 12.537 -2.181 1.00 0.00 H new ATOM 1091 N PRO A 421 -3.463 10.535 -4.018 1.00 0.00 N ATOM 1092 CA PRO A 421 -4.515 10.221 -4.990 1.00 0.00 C ATOM 1093 C PRO A 421 -4.229 8.935 -5.758 1.00 0.00 C ATOM 1094 O PRO A 421 -5.147 8.263 -6.228 1.00 0.00 O ATOM 1095 CB PRO A 421 -4.494 11.425 -5.935 1.00 0.00 C ATOM 1096 CG PRO A 421 -3.931 12.537 -5.120 1.00 0.00 C ATOM 1097 CD PRO A 421 -2.985 11.922 -4.142 1.00 0.00 C ATOM 0 HA PRO A 421 -5.479 10.056 -4.509 1.00 0.00 H new ATOM 0 HB2 PRO A 421 -3.880 11.228 -6.814 1.00 0.00 H new ATOM 0 HB3 PRO A 421 -5.495 11.664 -6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 421 -3.416 13.258 -5.754 1.00 0.00 H new ATOM 0 HG3 PRO A 421 -4.724 13.077 -4.603 1.00 0.00 H new ATOM 0 HD2 PRO A 421 -1.957 11.960 -4.501 1.00 0.00 H new ATOM 0 HD3 PRO A 421 -3.007 12.440 -3.183 1.00 0.00 H new ATOM 1105 N THR A 422 -2.949 8.597 -5.884 1.00 0.00 N ATOM 1106 CA THR A 422 -2.543 7.392 -6.595 1.00 0.00 C ATOM 1107 C THR A 422 -2.466 6.197 -5.653 1.00 0.00 C ATOM 1108 O THR A 422 -2.856 5.086 -6.011 1.00 0.00 O ATOM 1109 CB THR A 422 -1.177 7.580 -7.283 1.00 0.00 C ATOM 1110 OG1 THR A 422 -1.203 8.744 -8.117 1.00 0.00 O ATOM 1111 CG2 THR A 422 -0.819 6.360 -8.117 1.00 0.00 C ATOM 0 H THR A 422 -2.176 9.142 -5.502 1.00 0.00 H new ATOM 0 HA THR A 422 -3.301 7.202 -7.355 1.00 0.00 H new ATOM 0 HB THR A 422 -0.420 7.706 -6.509 1.00 0.00 H new ATOM 0 HG1 THR A 422 -0.330 8.857 -8.549 1.00 0.00 H new ATOM 0 HG21 THR A 422 0.149 6.516 -8.593 1.00 0.00 H new ATOM 0 HG22 THR A 422 -0.770 5.481 -7.474 1.00 0.00 H new ATOM 0 HG23 THR A 422 -1.579 6.207 -8.883 1.00 0.00 H new ATOM 1119 N ALA A 423 -1.959 6.432 -4.447 1.00 0.00 N ATOM 1120 CA ALA A 423 -1.832 5.374 -3.453 1.00 0.00 C ATOM 1121 C ALA A 423 -3.193 4.779 -3.109 1.00 0.00 C ATOM 1122 O ALA A 423 -3.378 3.562 -3.143 1.00 0.00 O ATOM 1123 CB ALA A 423 -1.155 5.906 -2.198 1.00 0.00 C ATOM 0 H ALA A 423 -1.630 7.346 -4.135 1.00 0.00 H new ATOM 0 HA ALA A 423 -1.214 4.583 -3.878 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -1.067 5.105 -1.464 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.162 6.278 -2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.751 6.717 -1.779 1.00 0.00 H new ATOM 1129 N LYS A 424 -4.146 5.644 -2.776 1.00 0.00 N ATOM 1130 CA LYS A 424 -5.491 5.205 -2.426 1.00 0.00 C ATOM 1131 C LYS A 424 -6.112 4.397 -3.560 1.00 0.00 C ATOM 1132 O LYS A 424 -6.796 3.401 -3.324 1.00 0.00 O ATOM 1133 CB LYS A 424 -6.375 6.411 -2.102 1.00 0.00 C ATOM 1134 CG LYS A 424 -5.845 7.266 -0.963 1.00 0.00 C ATOM 1135 CD LYS A 424 -6.252 8.721 -1.122 1.00 0.00 C ATOM 1136 CE LYS A 424 -7.744 8.910 -0.900 1.00 0.00 C ATOM 1137 NZ LYS A 424 -8.531 8.605 -2.127 1.00 0.00 N ATOM 0 H LYS A 424 -4.011 6.654 -2.741 1.00 0.00 H new ATOM 0 HA LYS A 424 -5.420 4.567 -1.545 1.00 0.00 H new ATOM 0 HB2 LYS A 424 -6.473 7.029 -2.994 1.00 0.00 H new ATOM 0 HB3 LYS A 424 -7.375 6.060 -1.847 1.00 0.00 H new ATOM 0 HG2 LYS A 424 -6.221 6.884 -0.014 1.00 0.00 H new ATOM 0 HG3 LYS A 424 -4.758 7.193 -0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 424 -5.697 9.335 -0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 424 -5.985 9.068 -2.120 1.00 0.00 H new ATOM 0 HE2 LYS A 424 -8.075 8.264 -0.087 1.00 0.00 H new ATOM 0 HE3 LYS A 424 -7.938 9.937 -0.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 -9.359 9.233 -2.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 -7.936 8.753 -2.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 -8.849 7.615 -2.098 1.00 0.00 H new ATOM 1151 N ALA A 425 -5.868 4.830 -4.793 1.00 0.00 N ATOM 1152 CA ALA A 425 -6.400 4.145 -5.964 1.00 0.00 C ATOM 1153 C ALA A 425 -5.699 2.808 -6.182 1.00 0.00 C ATOM 1154 O ALA A 425 -6.310 1.843 -6.641 1.00 0.00 O ATOM 1155 CB ALA A 425 -6.264 5.023 -7.197 1.00 0.00 C ATOM 0 H ALA A 425 -5.305 5.653 -5.006 1.00 0.00 H new ATOM 0 HA ALA A 425 -7.458 3.947 -5.790 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -6.666 4.498 -8.064 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -6.817 5.950 -7.046 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -5.212 5.251 -7.367 1.00 0.00 H new ATOM 1161 N ALA A 426 -4.412 2.759 -5.854 1.00 0.00 N ATOM 1162 CA ALA A 426 -3.628 1.541 -6.014 1.00 0.00 C ATOM 1163 C ALA A 426 -4.086 0.462 -5.039 1.00 0.00 C ATOM 1164 O ALA A 426 -4.016 -0.730 -5.338 1.00 0.00 O ATOM 1165 CB ALA A 426 -2.148 1.836 -5.822 1.00 0.00 C ATOM 0 H ALA A 426 -3.890 3.550 -5.476 1.00 0.00 H new ATOM 0 HA ALA A 426 -3.784 1.169 -7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -1.575 0.917 -5.944 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -1.824 2.567 -6.562 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -1.983 2.236 -4.821 1.00 0.00 H new ATOM 1171 N VAL A 427 -4.554 0.888 -3.870 1.00 0.00 N ATOM 1172 CA VAL A 427 -5.024 -0.043 -2.850 1.00 0.00 C ATOM 1173 C VAL A 427 -6.132 -0.939 -3.392 1.00 0.00 C ATOM 1174 O VAL A 427 -5.970 -2.155 -3.487 1.00 0.00 O ATOM 1175 CB VAL A 427 -5.543 0.703 -1.606 1.00 0.00 C ATOM 1176 CG1 VAL A 427 -6.082 -0.282 -0.580 1.00 0.00 C ATOM 1177 CG2 VAL A 427 -4.443 1.564 -1.004 1.00 0.00 C ATOM 0 H VAL A 427 -4.618 1.871 -3.606 1.00 0.00 H new ATOM 0 HA VAL A 427 -4.171 -0.658 -2.565 1.00 0.00 H new ATOM 0 HB VAL A 427 -6.360 1.358 -1.910 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -6.444 0.263 0.292 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.901 -0.852 -1.018 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -5.287 -0.964 -0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.827 2.084 -0.126 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -3.604 0.932 -0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -4.108 2.294 -1.741 1.00 0.00 H new ATOM 1187 N GLU A 428 -7.259 -0.329 -3.746 1.00 0.00 N ATOM 1188 CA GLU A 428 -8.394 -1.072 -4.278 1.00 0.00 C ATOM 1189 C GLU A 428 -8.036 -1.737 -5.604 1.00 0.00 C ATOM 1190 O GLU A 428 -8.781 -2.576 -6.111 1.00 0.00 O ATOM 1191 CB GLU A 428 -9.596 -0.144 -4.470 1.00 0.00 C ATOM 1192 CG GLU A 428 -10.119 0.450 -3.172 1.00 0.00 C ATOM 1193 CD GLU A 428 -11.176 -0.419 -2.519 1.00 0.00 C ATOM 1194 OE1 GLU A 428 -10.804 -1.422 -1.873 1.00 0.00 O ATOM 1195 OE2 GLU A 428 -12.375 -0.096 -2.652 1.00 0.00 O ATOM 0 H GLU A 428 -7.410 0.677 -3.674 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.655 -1.849 -3.559 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -9.315 0.666 -5.143 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -10.399 -0.699 -4.956 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -9.289 0.589 -2.479 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -10.537 1.437 -3.370 1.00 0.00 H new ATOM 1202 N TRP A 429 -6.892 -1.356 -6.160 1.00 0.00 N ATOM 1203 CA TRP A 429 -6.434 -1.915 -7.428 1.00 0.00 C ATOM 1204 C TRP A 429 -5.745 -3.258 -7.213 1.00 0.00 C ATOM 1205 O TRP A 429 -6.124 -4.265 -7.812 1.00 0.00 O ATOM 1206 CB TRP A 429 -5.479 -0.943 -8.122 1.00 0.00 C ATOM 1207 CG TRP A 429 -4.778 -1.542 -9.303 1.00 0.00 C ATOM 1208 CD1 TRP A 429 -3.969 -2.643 -9.305 1.00 0.00 C ATOM 1209 CD2 TRP A 429 -4.820 -1.071 -10.654 1.00 0.00 C ATOM 1210 NE1 TRP A 429 -3.507 -2.885 -10.576 1.00 0.00 N ATOM 1211 CE2 TRP A 429 -4.015 -1.934 -11.423 1.00 0.00 C ATOM 1212 CE3 TRP A 429 -5.461 -0.005 -11.291 1.00 0.00 C ATOM 1213 CZ2 TRP A 429 -3.836 -1.763 -12.792 1.00 0.00 C ATOM 1214 CZ3 TRP A 429 -5.281 0.165 -12.650 1.00 0.00 C ATOM 1215 CH2 TRP A 429 -4.474 -0.710 -13.390 1.00 0.00 C ATOM 0 H TRP A 429 -6.264 -0.663 -5.754 1.00 0.00 H new ATOM 0 HA TRP A 429 -7.306 -2.072 -8.063 1.00 0.00 H new ATOM 0 HB2 TRP A 429 -6.038 -0.065 -8.447 1.00 0.00 H new ATOM 0 HB3 TRP A 429 -4.735 -0.599 -7.403 1.00 0.00 H new ATOM 0 HD1 TRP A 429 -3.728 -3.236 -8.435 1.00 0.00 H new ATOM 0 HE1 TRP A 429 -2.887 -3.648 -10.846 1.00 0.00 H new ATOM 0 HE3 TRP A 429 -6.086 0.674 -10.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 429 -3.215 -2.438 -13.363 1.00 0.00 H new ATOM 0 HZ3 TRP A 429 -5.771 0.987 -13.151 1.00 0.00 H new ATOM 0 HH2 TRP A 429 -4.353 -0.550 -14.451 1.00 0.00 H new ATOM 1226 N PHE A 430 -4.731 -3.267 -6.354 1.00 0.00 N ATOM 1227 CA PHE A 430 -3.987 -4.487 -6.062 1.00 0.00 C ATOM 1228 C PHE A 430 -4.638 -5.259 -4.917 1.00 0.00 C ATOM 1229 O PHE A 430 -4.324 -6.426 -4.683 1.00 0.00 O ATOM 1230 CB PHE A 430 -2.537 -4.154 -5.707 1.00 0.00 C ATOM 1231 CG PHE A 430 -1.810 -3.414 -6.793 1.00 0.00 C ATOM 1232 CD1 PHE A 430 -1.312 -4.089 -7.896 1.00 0.00 C ATOM 1233 CD2 PHE A 430 -1.623 -2.044 -6.711 1.00 0.00 C ATOM 1234 CE1 PHE A 430 -0.643 -3.411 -8.897 1.00 0.00 C ATOM 1235 CE2 PHE A 430 -0.955 -1.360 -7.709 1.00 0.00 C ATOM 1236 CZ PHE A 430 -0.463 -2.046 -8.804 1.00 0.00 C ATOM 0 H PHE A 430 -4.406 -2.443 -5.848 1.00 0.00 H new ATOM 0 HA PHE A 430 -4.000 -5.113 -6.954 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.522 -3.554 -4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -2.003 -5.079 -5.488 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.448 -5.158 -7.974 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -2.004 -1.504 -5.857 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.261 -3.949 -9.752 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -0.818 -0.291 -7.634 1.00 0.00 H new ATOM 0 HZ PHE A 430 0.061 -1.515 -9.585 1.00 0.00 H new ATOM 1246 N ASP A 431 -5.546 -4.598 -4.208 1.00 0.00 N ATOM 1247 CA ASP A 431 -6.242 -5.221 -3.087 1.00 0.00 C ATOM 1248 C ASP A 431 -6.995 -6.467 -3.540 1.00 0.00 C ATOM 1249 O ASP A 431 -8.118 -6.381 -4.035 1.00 0.00 O ATOM 1250 CB ASP A 431 -7.213 -4.227 -2.447 1.00 0.00 C ATOM 1251 CG ASP A 431 -8.348 -4.917 -1.717 1.00 0.00 C ATOM 1252 OD1 ASP A 431 -8.106 -5.985 -1.116 1.00 0.00 O ATOM 1253 OD2 ASP A 431 -9.479 -4.388 -1.744 1.00 0.00 O ATOM 0 H ASP A 431 -5.818 -3.632 -4.389 1.00 0.00 H new ATOM 0 HA ASP A 431 -5.498 -5.517 -2.348 1.00 0.00 H new ATOM 0 HB2 ASP A 431 -6.669 -3.590 -1.749 1.00 0.00 H new ATOM 0 HB3 ASP A 431 -7.624 -3.576 -3.219 1.00 0.00 H new ATOM 1258 N GLY A 432 -6.367 -7.627 -3.368 1.00 0.00 N ATOM 1259 CA GLY A 432 -6.992 -8.875 -3.766 1.00 0.00 C ATOM 1260 C GLY A 432 -6.287 -9.530 -4.937 1.00 0.00 C ATOM 1261 O GLY A 432 -6.491 -10.712 -5.212 1.00 0.00 O ATOM 0 H GLY A 432 -5.437 -7.724 -2.960 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -6.997 -9.561 -2.919 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -8.033 -8.688 -4.031 1.00 0.00 H new ATOM 1265 N LYS A 433 -5.453 -8.760 -5.629 1.00 0.00 N ATOM 1266 CA LYS A 433 -4.715 -9.271 -6.777 1.00 0.00 C ATOM 1267 C LYS A 433 -4.015 -10.583 -6.435 1.00 0.00 C ATOM 1268 O LYS A 433 -3.894 -10.945 -5.265 1.00 0.00 O ATOM 1269 CB LYS A 433 -3.687 -8.240 -7.248 1.00 0.00 C ATOM 1270 CG LYS A 433 -4.240 -7.241 -8.249 1.00 0.00 C ATOM 1271 CD LYS A 433 -4.542 -7.899 -9.584 1.00 0.00 C ATOM 1272 CE LYS A 433 -4.504 -6.891 -10.723 1.00 0.00 C ATOM 1273 NZ LYS A 433 -4.728 -7.539 -12.045 1.00 0.00 N ATOM 0 H LYS A 433 -5.272 -7.780 -5.414 1.00 0.00 H new ATOM 0 HA LYS A 433 -5.427 -9.459 -7.580 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -3.304 -7.700 -6.382 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -2.842 -8.762 -7.697 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -5.149 -6.790 -7.850 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -3.522 -6.434 -8.394 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -3.817 -8.691 -9.773 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -5.525 -8.369 -9.545 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -5.265 -6.129 -10.559 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -3.540 -6.383 -10.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -4.695 -6.819 -12.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -3.987 -8.249 -12.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -5.659 -8.002 -12.051 1.00 0.00 H new ATOM 1287 N ASP A 434 -3.556 -11.289 -7.462 1.00 0.00 N ATOM 1288 CA ASP A 434 -2.866 -12.558 -7.269 1.00 0.00 C ATOM 1289 C ASP A 434 -1.470 -12.517 -7.881 1.00 0.00 C ATOM 1290 O ASP A 434 -1.316 -12.482 -9.102 1.00 0.00 O ATOM 1291 CB ASP A 434 -3.673 -13.701 -7.888 1.00 0.00 C ATOM 1292 CG ASP A 434 -4.650 -14.318 -6.906 1.00 0.00 C ATOM 1293 OD1 ASP A 434 -4.193 -14.989 -5.957 1.00 0.00 O ATOM 1294 OD2 ASP A 434 -5.871 -14.128 -7.086 1.00 0.00 O ATOM 0 H ASP A 434 -3.649 -11.004 -8.437 1.00 0.00 H new ATOM 0 HA ASP A 434 -2.768 -12.730 -6.197 1.00 0.00 H new ATOM 0 HB2 ASP A 434 -4.220 -13.328 -8.754 1.00 0.00 H new ATOM 0 HB3 ASP A 434 -2.990 -14.470 -8.249 1.00 0.00 H new ATOM 1299 N PHE A 435 -0.453 -12.520 -7.024 1.00 0.00 N ATOM 1300 CA PHE A 435 0.932 -12.480 -7.480 1.00 0.00 C ATOM 1301 C PHE A 435 1.536 -13.880 -7.505 1.00 0.00 C ATOM 1302 O PHE A 435 1.854 -14.449 -6.462 1.00 0.00 O ATOM 1303 CB PHE A 435 1.763 -11.570 -6.573 1.00 0.00 C ATOM 1304 CG PHE A 435 2.935 -10.941 -7.270 1.00 0.00 C ATOM 1305 CD1 PHE A 435 2.750 -9.896 -8.162 1.00 0.00 C ATOM 1306 CD2 PHE A 435 4.224 -11.392 -7.032 1.00 0.00 C ATOM 1307 CE1 PHE A 435 3.827 -9.315 -8.804 1.00 0.00 C ATOM 1308 CE2 PHE A 435 5.305 -10.815 -7.672 1.00 0.00 C ATOM 1309 CZ PHE A 435 5.106 -9.775 -8.557 1.00 0.00 C ATOM 0 H PHE A 435 -0.562 -12.550 -6.010 1.00 0.00 H new ATOM 0 HA PHE A 435 0.944 -12.080 -8.494 1.00 0.00 H new ATOM 0 HB2 PHE A 435 1.122 -10.784 -6.175 1.00 0.00 H new ATOM 0 HB3 PHE A 435 2.124 -12.149 -5.723 1.00 0.00 H new ATOM 0 HD1 PHE A 435 1.752 -9.532 -8.357 1.00 0.00 H new ATOM 0 HD2 PHE A 435 4.386 -12.204 -6.338 1.00 0.00 H new ATOM 0 HE1 PHE A 435 3.669 -8.503 -9.498 1.00 0.00 H new ATOM 0 HE2 PHE A 435 6.304 -11.178 -7.480 1.00 0.00 H new ATOM 0 HZ PHE A 435 5.949 -9.321 -9.056 1.00 0.00 H new ATOM 1319 N GLN A 436 1.689 -14.431 -8.706 1.00 0.00 N ATOM 1320 CA GLN A 436 2.254 -15.765 -8.868 1.00 0.00 C ATOM 1321 C GLN A 436 1.369 -16.815 -8.204 1.00 0.00 C ATOM 1322 O GLN A 436 1.860 -17.807 -7.669 1.00 0.00 O ATOM 1323 CB GLN A 436 3.663 -15.821 -8.277 1.00 0.00 C ATOM 1324 CG GLN A 436 4.746 -15.361 -9.240 1.00 0.00 C ATOM 1325 CD GLN A 436 6.140 -15.722 -8.766 1.00 0.00 C ATOM 1326 OE1 GLN A 436 6.592 -16.855 -8.938 1.00 0.00 O ATOM 1327 NE2 GLN A 436 6.830 -14.761 -8.166 1.00 0.00 N ATOM 0 H GLN A 436 1.429 -13.974 -9.580 1.00 0.00 H new ATOM 0 HA GLN A 436 2.307 -15.982 -9.935 1.00 0.00 H new ATOM 0 HB2 GLN A 436 3.697 -15.200 -7.382 1.00 0.00 H new ATOM 0 HB3 GLN A 436 3.877 -16.843 -7.965 1.00 0.00 H new ATOM 0 HG2 GLN A 436 4.571 -15.809 -10.218 1.00 0.00 H new ATOM 0 HG3 GLN A 436 4.678 -14.281 -9.368 1.00 0.00 H new ATOM 0 HE21 GLN A 436 6.417 -13.836 -8.044 1.00 0.00 H new ATOM 0 HE22 GLN A 436 7.774 -14.947 -7.826 1.00 0.00 H new ATOM 1336 N GLY A 437 0.060 -16.588 -8.243 1.00 0.00 N ATOM 1337 CA GLY A 437 -0.873 -17.523 -7.640 1.00 0.00 C ATOM 1338 C GLY A 437 -1.042 -17.295 -6.151 1.00 0.00 C ATOM 1339 O GLY A 437 -1.492 -18.184 -5.428 1.00 0.00 O ATOM 0 H GLY A 437 -0.371 -15.774 -8.681 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -1.842 -17.432 -8.131 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -0.524 -18.541 -7.811 1.00 0.00 H new ATOM 1343 N SER A 438 -0.681 -16.101 -5.692 1.00 0.00 N ATOM 1344 CA SER A 438 -0.789 -15.761 -4.278 1.00 0.00 C ATOM 1345 C SER A 438 -1.611 -14.491 -4.087 1.00 0.00 C ATOM 1346 O SER A 438 -1.348 -13.466 -4.716 1.00 0.00 O ATOM 1347 CB SER A 438 0.601 -15.580 -3.667 1.00 0.00 C ATOM 1348 OG SER A 438 1.131 -14.302 -3.974 1.00 0.00 O ATOM 0 H SER A 438 -0.311 -15.353 -6.279 1.00 0.00 H new ATOM 0 HA SER A 438 -1.296 -16.581 -3.770 1.00 0.00 H new ATOM 0 HB2 SER A 438 0.545 -15.704 -2.585 1.00 0.00 H new ATOM 0 HB3 SER A 438 1.270 -16.354 -4.042 1.00 0.00 H new ATOM 0 HG SER A 438 1.625 -14.347 -4.819 1.00 0.00 H new ATOM 1354 N LYS A 439 -2.609 -14.565 -3.212 1.00 0.00 N ATOM 1355 CA LYS A 439 -3.471 -13.422 -2.935 1.00 0.00 C ATOM 1356 C LYS A 439 -2.723 -12.357 -2.138 1.00 0.00 C ATOM 1357 O LYS A 439 -2.050 -12.663 -1.152 1.00 0.00 O ATOM 1358 CB LYS A 439 -4.715 -13.870 -2.165 1.00 0.00 C ATOM 1359 CG LYS A 439 -5.834 -12.842 -2.167 1.00 0.00 C ATOM 1360 CD LYS A 439 -5.739 -11.913 -0.968 1.00 0.00 C ATOM 1361 CE LYS A 439 -6.507 -12.463 0.225 1.00 0.00 C ATOM 1362 NZ LYS A 439 -5.893 -12.049 1.517 1.00 0.00 N ATOM 0 H LYS A 439 -2.841 -15.405 -2.682 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.777 -12.990 -3.888 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.085 -14.799 -2.598 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -4.435 -14.088 -1.134 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.791 -12.257 -3.086 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.798 -13.351 -2.158 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -4.693 -11.774 -0.696 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -6.132 -10.932 -1.234 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -7.539 -12.114 0.185 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -6.536 -13.551 0.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -5.673 -12.893 2.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -5.018 -11.519 1.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -6.559 -11.445 2.040 1.00 0.00 H new ATOM 1376 N LEU A 440 -2.845 -11.107 -2.570 1.00 0.00 N ATOM 1377 CA LEU A 440 -2.182 -9.996 -1.896 1.00 0.00 C ATOM 1378 C LEU A 440 -3.189 -9.145 -1.130 1.00 0.00 C ATOM 1379 O LEU A 440 -4.389 -9.190 -1.400 1.00 0.00 O ATOM 1380 CB LEU A 440 -1.433 -9.132 -2.911 1.00 0.00 C ATOM 1381 CG LEU A 440 -0.591 -9.883 -3.943 1.00 0.00 C ATOM 1382 CD1 LEU A 440 0.385 -8.939 -4.627 1.00 0.00 C ATOM 1383 CD2 LEU A 440 0.153 -11.036 -3.285 1.00 0.00 C ATOM 0 H LEU A 440 -3.397 -10.837 -3.384 1.00 0.00 H new ATOM 0 HA LEU A 440 -1.468 -10.409 -1.184 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.161 -8.519 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -0.780 -8.451 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 440 -1.260 -10.291 -4.701 1.00 0.00 H new ATOM 0 HD11 LEU A 440 0.975 -9.492 -5.358 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -0.168 -8.147 -5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 440 1.049 -8.500 -3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 440 0.747 -11.560 -4.034 1.00 0.00 H new ATOM 0 HD22 LEU A 440 0.810 -10.648 -2.507 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -0.565 -11.727 -2.843 1.00 0.00 H new ATOM 1395 N LYS A 441 -2.692 -8.367 -0.174 1.00 0.00 N ATOM 1396 CA LYS A 441 -3.547 -7.502 0.630 1.00 0.00 C ATOM 1397 C LYS A 441 -2.955 -6.100 0.737 1.00 0.00 C ATOM 1398 O LYS A 441 -2.036 -5.861 1.521 1.00 0.00 O ATOM 1399 CB LYS A 441 -3.737 -8.094 2.028 1.00 0.00 C ATOM 1400 CG LYS A 441 -4.953 -8.996 2.146 1.00 0.00 C ATOM 1401 CD LYS A 441 -6.187 -8.216 2.568 1.00 0.00 C ATOM 1402 CE LYS A 441 -7.466 -8.951 2.194 1.00 0.00 C ATOM 1403 NZ LYS A 441 -8.673 -8.285 2.757 1.00 0.00 N ATOM 0 H LYS A 441 -1.701 -8.318 0.063 1.00 0.00 H new ATOM 0 HA LYS A 441 -4.517 -7.432 0.137 1.00 0.00 H new ATOM 0 HB2 LYS A 441 -2.846 -8.662 2.297 1.00 0.00 H new ATOM 0 HB3 LYS A 441 -3.827 -7.281 2.749 1.00 0.00 H new ATOM 0 HG2 LYS A 441 -5.139 -9.484 1.189 1.00 0.00 H new ATOM 0 HG3 LYS A 441 -4.754 -9.784 2.872 1.00 0.00 H new ATOM 0 HD2 LYS A 441 -6.163 -8.050 3.645 1.00 0.00 H new ATOM 0 HD3 LYS A 441 -6.178 -7.235 2.094 1.00 0.00 H new ATOM 0 HE2 LYS A 441 -7.552 -9.001 1.109 1.00 0.00 H new ATOM 0 HE3 LYS A 441 -7.415 -9.977 2.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 441 -9.523 -8.816 2.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 441 -8.603 -8.260 3.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 441 -8.736 -7.314 2.390 1.00 0.00 H new ATOM 1417 N VAL A 442 -3.487 -5.175 -0.057 1.00 0.00 N ATOM 1418 CA VAL A 442 -3.013 -3.797 -0.049 1.00 0.00 C ATOM 1419 C VAL A 442 -3.910 -2.911 0.809 1.00 0.00 C ATOM 1420 O VAL A 442 -5.135 -2.946 0.685 1.00 0.00 O ATOM 1421 CB VAL A 442 -2.950 -3.216 -1.474 1.00 0.00 C ATOM 1422 CG1 VAL A 442 -2.207 -1.889 -1.478 1.00 0.00 C ATOM 1423 CG2 VAL A 442 -2.292 -4.207 -2.423 1.00 0.00 C ATOM 0 H VAL A 442 -4.246 -5.356 -0.714 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.009 -3.811 0.375 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.968 -3.036 -1.820 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.173 -1.494 -2.493 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.724 -1.181 -0.830 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.191 -2.040 -1.113 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.255 -3.781 -3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.279 -4.420 -2.082 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.870 -5.131 -2.442 1.00 0.00 H new ATOM 1433 N SER A 443 -3.292 -2.118 1.678 1.00 0.00 N ATOM 1434 CA SER A 443 -4.036 -1.225 2.559 1.00 0.00 C ATOM 1435 C SER A 443 -3.189 -0.016 2.947 1.00 0.00 C ATOM 1436 O SER A 443 -2.051 -0.159 3.397 1.00 0.00 O ATOM 1437 CB SER A 443 -4.484 -1.972 3.817 1.00 0.00 C ATOM 1438 OG SER A 443 -5.155 -3.175 3.483 1.00 0.00 O ATOM 0 H SER A 443 -2.279 -2.075 1.791 1.00 0.00 H new ATOM 0 HA SER A 443 -4.916 -0.874 2.021 1.00 0.00 H new ATOM 0 HB2 SER A 443 -3.617 -2.196 4.439 1.00 0.00 H new ATOM 0 HB3 SER A 443 -5.144 -1.335 4.406 1.00 0.00 H new ATOM 0 HG SER A 443 -5.430 -3.635 4.304 1.00 0.00 H new ATOM 1444 N LEU A 444 -3.753 1.174 2.770 1.00 0.00 N ATOM 1445 CA LEU A 444 -3.051 2.410 3.101 1.00 0.00 C ATOM 1446 C LEU A 444 -2.222 2.242 4.370 1.00 0.00 C ATOM 1447 O LEU A 444 -2.686 1.668 5.355 1.00 0.00 O ATOM 1448 CB LEU A 444 -4.050 3.555 3.278 1.00 0.00 C ATOM 1449 CG LEU A 444 -4.639 4.136 1.992 1.00 0.00 C ATOM 1450 CD1 LEU A 444 -5.628 5.246 2.312 1.00 0.00 C ATOM 1451 CD2 LEU A 444 -3.532 4.652 1.085 1.00 0.00 C ATOM 0 H LEU A 444 -4.694 1.309 2.399 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.377 2.648 2.278 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -4.870 3.202 3.903 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -3.557 4.359 3.824 1.00 0.00 H new ATOM 0 HG LEU A 444 -5.172 3.342 1.468 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -6.037 5.647 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.438 4.847 2.923 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -5.119 6.040 2.858 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -3.969 5.062 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -2.972 5.432 1.602 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -2.861 3.833 0.828 1.00 0.00 H new