USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=21 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= -1.1 USER MOD Set 2.1: A 395 GLN : amide:sc= -0.477 K(o=-0.76,f=-2.9) USER MOD Set 2.2: A 397 MET CE :methyl -102:sc= -0.28 (180deg=0) USER MOD Set 3.1: A 390 ASN : amide:sc= -2.6! C(o=-8.1!,f=-15!) USER MOD Set 3.2: A 393 THR OG1 : rot -179:sc= -5.53! USER MOD Set 4.1: A 369 ASN : amide:sc= -6.88! C(o=-12!,f=-20!) USER MOD Set 4.2: A 436 GLN :FLIP amide:sc= -4.84! C(o=-12!,f=-12!) USER MOD Single : A 361 SER OG : rot -59:sc= -1.67 USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 366 GLN : amide:sc= -0.0282 X(o=-0.028,f=0) USER MOD Single : A 371 SER OG : rot -54:sc= 0.011 USER MOD Single : A 373 THR OG1 : rot -117:sc= -0.631 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 GLN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 384 CYS SG : rot -130:sc=-0.00146 USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 MET CE :methyl -162:sc= -3.76! (180deg=-4.79!) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 399 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 404 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0218) USER MOD Single : A 406 THR OG1 : rot -120:sc= -0.586 USER MOD Single : A 408 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0169) 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 2:sc= 0.187 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00194) USER MOD Single : A 433 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 SER OG : rot -128:sc= 0.0235 USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.137) USER MOD Single : A 443 SER OG : rot -11:sc= 0.517! USER MOD ----------------------------------------------------------------- ATOM 168 N SER A 361 0.590 8.531 1.030 1.00 0.00 N ATOM 169 CA SER A 361 0.685 8.105 -0.361 1.00 0.00 C ATOM 170 C SER A 361 1.351 6.736 -0.466 1.00 0.00 C ATOM 171 O SER A 361 1.880 6.371 -1.515 1.00 0.00 O ATOM 172 CB SER A 361 1.473 9.132 -1.178 1.00 0.00 C ATOM 173 OG SER A 361 1.495 8.782 -2.551 1.00 0.00 O ATOM 0 HA SER A 361 -0.326 8.030 -0.762 1.00 0.00 H new ATOM 0 HB2 SER A 361 1.025 10.118 -1.058 1.00 0.00 H new ATOM 0 HB3 SER A 361 2.493 9.197 -0.800 1.00 0.00 H new ATOM 0 HG SER A 361 1.900 7.896 -2.656 1.00 0.00 H new ATOM 179 N ALA A 362 1.320 5.985 0.630 1.00 0.00 N ATOM 180 CA ALA A 362 1.918 4.656 0.662 1.00 0.00 C ATOM 181 C ALA A 362 0.856 3.582 0.872 1.00 0.00 C ATOM 182 O ALA A 362 -0.263 3.876 1.292 1.00 0.00 O ATOM 183 CB ALA A 362 2.973 4.578 1.755 1.00 0.00 C ATOM 0 H ALA A 362 0.887 6.274 1.507 1.00 0.00 H new ATOM 0 HA ALA A 362 2.395 4.476 -0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 362 3.411 3.580 1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 362 3.753 5.314 1.561 1.00 0.00 H new ATOM 0 HB3 ALA A 362 2.512 4.784 2.721 1.00 0.00 H new ATOM 189 N ILE A 363 1.214 2.337 0.576 1.00 0.00 N ATOM 190 CA ILE A 363 0.292 1.219 0.733 1.00 0.00 C ATOM 191 C ILE A 363 0.987 0.016 1.360 1.00 0.00 C ATOM 192 O ILE A 363 2.148 -0.268 1.063 1.00 0.00 O ATOM 193 CB ILE A 363 -0.319 0.799 -0.617 1.00 0.00 C ATOM 194 CG1 ILE A 363 0.774 0.286 -1.557 1.00 0.00 C ATOM 195 CG2 ILE A 363 -1.063 1.966 -1.247 1.00 0.00 C ATOM 196 CD1 ILE A 363 0.235 -0.452 -2.764 1.00 0.00 C ATOM 0 H ILE A 363 2.136 2.077 0.226 1.00 0.00 H new ATOM 0 HA ILE A 363 -0.506 1.559 1.394 1.00 0.00 H new ATOM 0 HB ILE A 363 -1.031 -0.008 -0.443 1.00 0.00 H new ATOM 0 HG12 ILE A 363 1.376 1.129 -1.896 1.00 0.00 H new ATOM 0 HG13 ILE A 363 1.438 -0.377 -1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 363 -1.489 1.654 -2.200 1.00 0.00 H new ATOM 0 HG22 ILE A 363 -1.863 2.290 -0.581 1.00 0.00 H new ATOM 0 HG23 ILE A 363 -0.371 2.792 -1.412 1.00 0.00 H new ATOM 0 HD11 ILE A 363 1.065 -0.787 -3.386 1.00 0.00 H new ATOM 0 HD12 ILE A 363 -0.343 -1.315 -2.434 1.00 0.00 H new ATOM 0 HD13 ILE A 363 -0.405 0.214 -3.342 1.00 0.00 H new ATOM 208 N TYR A 364 0.271 -0.689 2.228 1.00 0.00 N ATOM 209 CA TYR A 364 0.819 -1.863 2.898 1.00 0.00 C ATOM 210 C TYR A 364 0.326 -3.147 2.238 1.00 0.00 C ATOM 211 O TYR A 364 -0.865 -3.456 2.268 1.00 0.00 O ATOM 212 CB TYR A 364 0.435 -1.856 4.379 1.00 0.00 C ATOM 213 CG TYR A 364 1.429 -2.572 5.265 1.00 0.00 C ATOM 214 CD1 TYR A 364 1.350 -3.944 5.466 1.00 0.00 C ATOM 215 CD2 TYR A 364 2.450 -1.876 5.900 1.00 0.00 C ATOM 216 CE1 TYR A 364 2.255 -4.602 6.276 1.00 0.00 C ATOM 217 CE2 TYR A 364 3.362 -2.525 6.711 1.00 0.00 C ATOM 218 CZ TYR A 364 3.259 -3.888 6.895 1.00 0.00 C ATOM 219 OH TYR A 364 4.165 -4.539 7.701 1.00 0.00 O ATOM 0 H TYR A 364 -0.691 -0.468 2.485 1.00 0.00 H new ATOM 0 HA TYR A 364 1.905 -1.826 2.811 1.00 0.00 H new ATOM 0 HB2 TYR A 364 0.338 -0.824 4.716 1.00 0.00 H new ATOM 0 HB3 TYR A 364 -0.544 -2.322 4.494 1.00 0.00 H new ATOM 0 HD1 TYR A 364 0.567 -4.507 4.980 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.533 -0.809 5.757 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.177 -5.669 6.423 1.00 0.00 H new ATOM 0 HE2 TYR A 364 4.150 -1.969 7.197 1.00 0.00 H new ATOM 0 HH TYR A 364 4.808 -3.892 8.060 1.00 0.00 H new ATOM 229 N VAL A 365 1.253 -3.892 1.643 1.00 0.00 N ATOM 230 CA VAL A 365 0.914 -5.144 0.977 1.00 0.00 C ATOM 231 C VAL A 365 1.262 -6.343 1.852 1.00 0.00 C ATOM 232 O VAL A 365 2.282 -6.346 2.539 1.00 0.00 O ATOM 233 CB VAL A 365 1.645 -5.277 -0.372 1.00 0.00 C ATOM 234 CG1 VAL A 365 1.022 -6.385 -1.210 1.00 0.00 C ATOM 235 CG2 VAL A 365 1.623 -3.954 -1.122 1.00 0.00 C ATOM 0 H VAL A 365 2.243 -3.650 1.609 1.00 0.00 H new ATOM 0 HA VAL A 365 -0.161 -5.128 0.799 1.00 0.00 H new ATOM 0 HB VAL A 365 2.685 -5.541 -0.178 1.00 0.00 H new ATOM 0 HG11 VAL A 365 1.551 -6.464 -2.160 1.00 0.00 H new ATOM 0 HG12 VAL A 365 1.094 -7.331 -0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 365 -0.027 -6.154 -1.397 1.00 0.00 H new ATOM 0 HG21 VAL A 365 2.144 -4.066 -2.073 1.00 0.00 H new ATOM 0 HG22 VAL A 365 0.590 -3.658 -1.307 1.00 0.00 H new ATOM 0 HG23 VAL A 365 2.119 -3.189 -0.525 1.00 0.00 H new ATOM 245 N GLN A 366 0.406 -7.360 1.819 1.00 0.00 N ATOM 246 CA GLN A 366 0.624 -8.566 2.610 1.00 0.00 C ATOM 247 C GLN A 366 0.081 -9.795 1.889 1.00 0.00 C ATOM 248 O GLN A 366 -1.096 -9.850 1.535 1.00 0.00 O ATOM 249 CB GLN A 366 -0.040 -8.429 3.982 1.00 0.00 C ATOM 250 CG GLN A 366 0.776 -7.618 4.975 1.00 0.00 C ATOM 251 CD GLN A 366 0.011 -7.313 6.248 1.00 0.00 C ATOM 252 OE1 GLN A 366 0.405 -7.731 7.337 1.00 0.00 O ATOM 253 NE2 GLN A 366 -1.090 -6.583 6.117 1.00 0.00 N ATOM 0 H GLN A 366 -0.443 -7.373 1.254 1.00 0.00 H new ATOM 0 HA GLN A 366 1.698 -8.692 2.746 1.00 0.00 H new ATOM 0 HB2 GLN A 366 -1.016 -7.961 3.859 1.00 0.00 H new ATOM 0 HB3 GLN A 366 -0.213 -9.423 4.393 1.00 0.00 H new ATOM 0 HG2 GLN A 366 1.685 -8.165 5.224 1.00 0.00 H new ATOM 0 HG3 GLN A 366 1.084 -6.683 4.508 1.00 0.00 H new ATOM 0 HE21 GLN A 366 -1.379 -6.258 5.195 1.00 0.00 H new ATOM 0 HE22 GLN A 366 -1.647 -6.348 6.939 1.00 0.00 H new ATOM 262 N GLY A 367 0.948 -10.780 1.674 1.00 0.00 N ATOM 263 CA GLY A 367 0.537 -11.995 0.995 1.00 0.00 C ATOM 264 C GLY A 367 1.452 -12.353 -0.159 1.00 0.00 C ATOM 265 O GLY A 367 1.111 -13.190 -0.996 1.00 0.00 O ATOM 0 H GLY A 367 1.927 -10.758 1.958 1.00 0.00 H new ATOM 0 HA2 GLY A 367 0.519 -12.818 1.709 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -0.480 -11.873 0.623 1.00 0.00 H new ATOM 269 N LEU A 368 2.617 -11.718 -0.206 1.00 0.00 N ATOM 270 CA LEU A 368 3.585 -11.973 -1.268 1.00 0.00 C ATOM 271 C LEU A 368 4.255 -13.330 -1.079 1.00 0.00 C ATOM 272 O LEU A 368 4.372 -13.825 0.040 1.00 0.00 O ATOM 273 CB LEU A 368 4.644 -10.868 -1.295 1.00 0.00 C ATOM 274 CG LEU A 368 4.156 -9.481 -1.714 1.00 0.00 C ATOM 275 CD1 LEU A 368 5.248 -8.444 -1.499 1.00 0.00 C ATOM 276 CD2 LEU A 368 3.704 -9.491 -3.167 1.00 0.00 C ATOM 0 H LEU A 368 2.915 -11.023 0.478 1.00 0.00 H new ATOM 0 HA LEU A 368 3.052 -11.981 -2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 368 5.085 -10.791 -0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 368 5.440 -11.172 -1.975 1.00 0.00 H new ATOM 0 HG LEU A 368 3.302 -9.213 -1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 368 4.883 -7.463 -1.803 1.00 0.00 H new ATOM 0 HD12 LEU A 368 5.523 -8.418 -0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 368 6.122 -8.707 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 368 3.360 -8.496 -3.448 1.00 0.00 H new ATOM 0 HD22 LEU A 368 4.539 -9.780 -3.806 1.00 0.00 H new ATOM 0 HD23 LEU A 368 2.889 -10.205 -3.290 1.00 0.00 H new ATOM 288 N ASN A 369 4.694 -13.926 -2.184 1.00 0.00 N ATOM 289 CA ASN A 369 5.354 -15.225 -2.140 1.00 0.00 C ATOM 290 C ASN A 369 6.761 -15.102 -1.562 1.00 0.00 C ATOM 291 O ASN A 369 7.179 -14.022 -1.144 1.00 0.00 O ATOM 292 CB ASN A 369 5.419 -15.835 -3.543 1.00 0.00 C ATOM 293 CG ASN A 369 5.989 -14.872 -4.566 1.00 0.00 C ATOM 294 OD1 ASN A 369 7.206 -14.733 -4.693 1.00 0.00 O ATOM 295 ND2 ASN A 369 5.110 -14.201 -5.301 1.00 0.00 N ATOM 0 H ASN A 369 4.604 -13.530 -3.120 1.00 0.00 H new ATOM 0 HA ASN A 369 4.770 -15.879 -1.492 1.00 0.00 H new ATOM 0 HB2 ASN A 369 6.031 -16.737 -3.516 1.00 0.00 H new ATOM 0 HB3 ASN A 369 4.418 -16.138 -3.851 1.00 0.00 H new ATOM 0 HD21 ASN A 369 5.434 -13.538 -6.005 1.00 0.00 H new ATOM 0 HD22 ASN A 369 4.110 -14.348 -5.161 1.00 0.00 H new ATOM 302 N ASP A 370 7.485 -16.216 -1.543 1.00 0.00 N ATOM 303 CA ASP A 370 8.846 -16.233 -1.017 1.00 0.00 C ATOM 304 C ASP A 370 9.862 -16.005 -2.133 1.00 0.00 C ATOM 305 O ASP A 370 11.069 -15.985 -1.891 1.00 0.00 O ATOM 306 CB ASP A 370 9.128 -17.562 -0.317 1.00 0.00 C ATOM 307 CG ASP A 370 8.418 -18.728 -0.978 1.00 0.00 C ATOM 308 OD1 ASP A 370 8.435 -18.802 -2.224 1.00 0.00 O ATOM 309 OD2 ASP A 370 7.847 -19.564 -0.248 1.00 0.00 O ATOM 0 H ASP A 370 7.153 -17.118 -1.885 1.00 0.00 H new ATOM 0 HA ASP A 370 8.940 -15.424 -0.293 1.00 0.00 H new ATOM 0 HB2 ASP A 370 10.202 -17.748 -0.316 1.00 0.00 H new ATOM 0 HB3 ASP A 370 8.815 -17.494 0.725 1.00 0.00 H new ATOM 314 N SER A 371 9.365 -15.838 -3.353 1.00 0.00 N ATOM 315 CA SER A 371 10.229 -15.617 -4.507 1.00 0.00 C ATOM 316 C SER A 371 9.972 -14.246 -5.126 1.00 0.00 C ATOM 317 O SER A 371 10.343 -13.989 -6.270 1.00 0.00 O ATOM 318 CB SER A 371 10.007 -16.711 -5.554 1.00 0.00 C ATOM 319 OG SER A 371 11.157 -16.880 -6.366 1.00 0.00 O ATOM 0 H SER A 371 8.368 -15.851 -3.569 1.00 0.00 H new ATOM 0 HA SER A 371 11.264 -15.654 -4.166 1.00 0.00 H new ATOM 0 HB2 SER A 371 9.767 -17.651 -5.057 1.00 0.00 H new ATOM 0 HB3 SER A 371 9.152 -16.453 -6.178 1.00 0.00 H new ATOM 0 HG SER A 371 11.418 -16.016 -6.748 1.00 0.00 H new ATOM 325 N VAL A 372 9.333 -13.369 -4.358 1.00 0.00 N ATOM 326 CA VAL A 372 9.025 -12.023 -4.828 1.00 0.00 C ATOM 327 C VAL A 372 10.249 -11.119 -4.743 1.00 0.00 C ATOM 328 O VAL A 372 11.011 -11.175 -3.777 1.00 0.00 O ATOM 329 CB VAL A 372 7.877 -11.393 -4.017 1.00 0.00 C ATOM 330 CG1 VAL A 372 8.341 -11.057 -2.608 1.00 0.00 C ATOM 331 CG2 VAL A 372 7.344 -10.156 -4.721 1.00 0.00 C ATOM 0 H VAL A 372 9.019 -13.566 -3.408 1.00 0.00 H new ATOM 0 HA VAL A 372 8.715 -12.114 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 372 7.066 -12.118 -3.944 1.00 0.00 H new ATOM 0 HG11 VAL A 372 7.517 -10.613 -2.050 1.00 0.00 H new ATOM 0 HG12 VAL A 372 8.670 -11.967 -2.107 1.00 0.00 H new ATOM 0 HG13 VAL A 372 9.169 -10.350 -2.657 1.00 0.00 H new ATOM 0 HG21 VAL A 372 6.534 -9.724 -4.134 1.00 0.00 H new ATOM 0 HG22 VAL A 372 8.145 -9.424 -4.827 1.00 0.00 H new ATOM 0 HG23 VAL A 372 6.971 -10.431 -5.707 1.00 0.00 H new ATOM 341 N THR A 373 10.434 -10.283 -5.760 1.00 0.00 N ATOM 342 CA THR A 373 11.565 -9.366 -5.801 1.00 0.00 C ATOM 343 C THR A 373 11.097 -7.921 -5.933 1.00 0.00 C ATOM 344 O THR A 373 9.967 -7.658 -6.348 1.00 0.00 O ATOM 345 CB THR A 373 12.513 -9.695 -6.971 1.00 0.00 C ATOM 346 OG1 THR A 373 11.833 -9.513 -8.218 1.00 0.00 O ATOM 347 CG2 THR A 373 13.021 -11.125 -6.868 1.00 0.00 C ATOM 0 H THR A 373 9.813 -10.223 -6.567 1.00 0.00 H new ATOM 0 HA THR A 373 12.104 -9.486 -4.861 1.00 0.00 H new ATOM 0 HB THR A 373 13.366 -9.018 -6.921 1.00 0.00 H new ATOM 0 HG1 THR A 373 11.773 -10.372 -8.686 1.00 0.00 H new ATOM 0 HG21 THR A 373 13.688 -11.335 -7.704 1.00 0.00 H new ATOM 0 HG22 THR A 373 13.563 -11.252 -5.931 1.00 0.00 H new ATOM 0 HG23 THR A 373 12.177 -11.814 -6.896 1.00 0.00 H new ATOM 355 N LEU A 374 11.972 -6.986 -5.578 1.00 0.00 N ATOM 356 CA LEU A 374 11.648 -5.566 -5.656 1.00 0.00 C ATOM 357 C LEU A 374 11.228 -5.181 -7.071 1.00 0.00 C ATOM 358 O LEU A 374 10.110 -4.716 -7.292 1.00 0.00 O ATOM 359 CB LEU A 374 12.849 -4.725 -5.221 1.00 0.00 C ATOM 360 CG LEU A 374 12.843 -3.264 -5.672 1.00 0.00 C ATOM 361 CD1 LEU A 374 11.906 -2.440 -4.801 1.00 0.00 C ATOM 362 CD2 LEU A 374 14.251 -2.687 -5.634 1.00 0.00 C ATOM 0 H LEU A 374 12.911 -7.186 -5.233 1.00 0.00 H new ATOM 0 HA LEU A 374 10.813 -5.371 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 374 12.909 -4.748 -4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 374 13.755 -5.198 -5.600 1.00 0.00 H new ATOM 0 HG LEU A 374 12.482 -3.224 -6.700 1.00 0.00 H new ATOM 0 HD11 LEU A 374 11.915 -1.403 -5.137 1.00 0.00 H new ATOM 0 HD12 LEU A 374 10.894 -2.838 -4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 374 12.237 -2.488 -3.764 1.00 0.00 H new ATOM 0 HD21 LEU A 374 14.227 -1.647 -5.958 1.00 0.00 H new ATOM 0 HD22 LEU A 374 14.639 -2.741 -4.617 1.00 0.00 H new ATOM 0 HD23 LEU A 374 14.897 -3.260 -6.300 1.00 0.00 H new ATOM 374 N ASP A 375 12.131 -5.379 -8.025 1.00 0.00 N ATOM 375 CA ASP A 375 11.853 -5.057 -9.419 1.00 0.00 C ATOM 376 C ASP A 375 10.501 -5.619 -9.849 1.00 0.00 C ATOM 377 O ASP A 375 9.773 -4.991 -10.618 1.00 0.00 O ATOM 378 CB ASP A 375 12.958 -5.607 -10.323 1.00 0.00 C ATOM 379 CG ASP A 375 13.127 -4.793 -11.591 1.00 0.00 C ATOM 380 OD1 ASP A 375 12.196 -4.790 -12.423 1.00 0.00 O ATOM 381 OD2 ASP A 375 14.192 -4.161 -11.753 1.00 0.00 O ATOM 0 H ASP A 375 13.062 -5.761 -7.858 1.00 0.00 H new ATOM 0 HA ASP A 375 11.822 -3.972 -9.515 1.00 0.00 H new ATOM 0 HB2 ASP A 375 13.900 -5.619 -9.774 1.00 0.00 H new ATOM 0 HB3 ASP A 375 12.728 -6.640 -10.585 1.00 0.00 H new ATOM 386 N ASP A 376 10.173 -6.804 -9.348 1.00 0.00 N ATOM 387 CA ASP A 376 8.909 -7.451 -9.679 1.00 0.00 C ATOM 388 C ASP A 376 7.735 -6.698 -9.061 1.00 0.00 C ATOM 389 O ASP A 376 6.630 -6.695 -9.606 1.00 0.00 O ATOM 390 CB ASP A 376 8.912 -8.902 -9.195 1.00 0.00 C ATOM 391 CG ASP A 376 9.453 -9.859 -10.239 1.00 0.00 C ATOM 392 OD1 ASP A 376 10.691 -10.002 -10.330 1.00 0.00 O ATOM 393 OD2 ASP A 376 8.639 -10.468 -10.964 1.00 0.00 O ATOM 0 H ASP A 376 10.765 -7.337 -8.711 1.00 0.00 H new ATOM 0 HA ASP A 376 8.796 -7.438 -10.763 1.00 0.00 H new ATOM 0 HB2 ASP A 376 9.514 -8.979 -8.289 1.00 0.00 H new ATOM 0 HB3 ASP A 376 7.897 -9.195 -8.929 1.00 0.00 H new ATOM 398 N LEU A 377 7.981 -6.062 -7.922 1.00 0.00 N ATOM 399 CA LEU A 377 6.944 -5.306 -7.228 1.00 0.00 C ATOM 400 C LEU A 377 6.844 -3.887 -7.780 1.00 0.00 C ATOM 401 O LEU A 377 5.768 -3.290 -7.793 1.00 0.00 O ATOM 402 CB LEU A 377 7.233 -5.263 -5.727 1.00 0.00 C ATOM 403 CG LEU A 377 7.039 -6.576 -4.968 1.00 0.00 C ATOM 404 CD1 LEU A 377 7.377 -6.397 -3.496 1.00 0.00 C ATOM 405 CD2 LEU A 377 5.614 -7.082 -5.132 1.00 0.00 C ATOM 0 H LEU A 377 8.890 -6.054 -7.459 1.00 0.00 H new ATOM 0 HA LEU A 377 5.991 -5.809 -7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 377 8.262 -4.933 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 377 6.591 -4.507 -5.275 1.00 0.00 H new ATOM 0 HG LEU A 377 7.717 -7.319 -5.388 1.00 0.00 H new ATOM 0 HD11 LEU A 377 7.233 -7.342 -2.972 1.00 0.00 H new ATOM 0 HD12 LEU A 377 8.416 -6.082 -3.397 1.00 0.00 H new ATOM 0 HD13 LEU A 377 6.725 -5.639 -3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.495 -8.017 -4.585 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.917 -6.341 -4.740 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.407 -7.251 -6.189 1.00 0.00 H new ATOM 417 N ALA A 378 7.973 -3.354 -8.235 1.00 0.00 N ATOM 418 CA ALA A 378 8.012 -2.008 -8.791 1.00 0.00 C ATOM 419 C ALA A 378 7.357 -1.963 -10.167 1.00 0.00 C ATOM 420 O ALA A 378 6.718 -0.974 -10.530 1.00 0.00 O ATOM 421 CB ALA A 378 9.448 -1.512 -8.872 1.00 0.00 C ATOM 0 H ALA A 378 8.873 -3.834 -8.229 1.00 0.00 H new ATOM 0 HA ALA A 378 7.449 -1.351 -8.128 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.462 -0.505 -9.289 1.00 0.00 H new ATOM 0 HB2 ALA A 378 9.885 -1.497 -7.873 1.00 0.00 H new ATOM 0 HB3 ALA A 378 10.027 -2.178 -9.511 1.00 0.00 H new ATOM 427 N ASP A 379 7.520 -3.038 -10.930 1.00 0.00 N ATOM 428 CA ASP A 379 6.945 -3.121 -12.267 1.00 0.00 C ATOM 429 C ASP A 379 5.468 -3.500 -12.200 1.00 0.00 C ATOM 430 O ASP A 379 4.713 -3.267 -13.144 1.00 0.00 O ATOM 431 CB ASP A 379 7.708 -4.142 -13.112 1.00 0.00 C ATOM 432 CG ASP A 379 7.464 -3.963 -14.598 1.00 0.00 C ATOM 433 OD1 ASP A 379 7.265 -2.809 -15.031 1.00 0.00 O ATOM 434 OD2 ASP A 379 7.473 -4.976 -15.326 1.00 0.00 O ATOM 0 H ASP A 379 8.046 -3.864 -10.645 1.00 0.00 H new ATOM 0 HA ASP A 379 7.030 -2.140 -12.734 1.00 0.00 H new ATOM 0 HB2 ASP A 379 8.775 -4.052 -12.909 1.00 0.00 H new ATOM 0 HB3 ASP A 379 7.411 -5.148 -12.817 1.00 0.00 H new ATOM 439 N PHE A 380 5.064 -4.088 -11.080 1.00 0.00 N ATOM 440 CA PHE A 380 3.679 -4.503 -10.890 1.00 0.00 C ATOM 441 C PHE A 380 2.872 -3.406 -10.200 1.00 0.00 C ATOM 442 O PHE A 380 1.807 -3.012 -10.674 1.00 0.00 O ATOM 443 CB PHE A 380 3.617 -5.791 -10.066 1.00 0.00 C ATOM 444 CG PHE A 380 2.217 -6.242 -9.765 1.00 0.00 C ATOM 445 CD1 PHE A 380 1.343 -6.567 -10.790 1.00 0.00 C ATOM 446 CD2 PHE A 380 1.774 -6.344 -8.456 1.00 0.00 C ATOM 447 CE1 PHE A 380 0.054 -6.983 -10.515 1.00 0.00 C ATOM 448 CE2 PHE A 380 0.487 -6.760 -8.175 1.00 0.00 C ATOM 449 CZ PHE A 380 -0.375 -7.080 -9.206 1.00 0.00 C ATOM 0 H PHE A 380 5.676 -4.288 -10.289 1.00 0.00 H new ATOM 0 HA PHE A 380 3.244 -4.687 -11.872 1.00 0.00 H new ATOM 0 HB2 PHE A 380 4.138 -6.583 -10.604 1.00 0.00 H new ATOM 0 HB3 PHE A 380 4.151 -5.639 -9.128 1.00 0.00 H new ATOM 0 HD1 PHE A 380 1.673 -6.494 -11.816 1.00 0.00 H new ATOM 0 HD2 PHE A 380 2.443 -6.095 -7.646 1.00 0.00 H new ATOM 0 HE1 PHE A 380 -0.617 -7.232 -11.323 1.00 0.00 H new ATOM 0 HE2 PHE A 380 0.155 -6.835 -7.150 1.00 0.00 H new ATOM 0 HZ PHE A 380 -1.382 -7.405 -8.989 1.00 0.00 H new ATOM 459 N PHE A 381 3.390 -2.918 -9.077 1.00 0.00 N ATOM 460 CA PHE A 381 2.718 -1.867 -8.320 1.00 0.00 C ATOM 461 C PHE A 381 2.570 -0.601 -9.160 1.00 0.00 C ATOM 462 O PHE A 381 1.720 0.244 -8.884 1.00 0.00 O ATOM 463 CB PHE A 381 3.496 -1.555 -7.040 1.00 0.00 C ATOM 464 CG PHE A 381 3.282 -2.564 -5.948 1.00 0.00 C ATOM 465 CD1 PHE A 381 2.001 -2.935 -5.571 1.00 0.00 C ATOM 466 CD2 PHE A 381 4.361 -3.140 -5.297 1.00 0.00 C ATOM 467 CE1 PHE A 381 1.800 -3.863 -4.567 1.00 0.00 C ATOM 468 CE2 PHE A 381 4.166 -4.069 -4.293 1.00 0.00 C ATOM 469 CZ PHE A 381 2.885 -4.430 -3.926 1.00 0.00 C ATOM 0 H PHE A 381 4.271 -3.233 -8.672 1.00 0.00 H new ATOM 0 HA PHE A 381 1.723 -2.224 -8.055 1.00 0.00 H new ATOM 0 HB2 PHE A 381 4.559 -1.504 -7.274 1.00 0.00 H new ATOM 0 HB3 PHE A 381 3.202 -0.570 -6.677 1.00 0.00 H new ATOM 0 HD1 PHE A 381 1.150 -2.494 -6.068 1.00 0.00 H new ATOM 0 HD2 PHE A 381 5.366 -2.860 -5.577 1.00 0.00 H new ATOM 0 HE1 PHE A 381 0.797 -4.145 -4.284 1.00 0.00 H new ATOM 0 HE2 PHE A 381 5.016 -4.513 -3.795 1.00 0.00 H new ATOM 0 HZ PHE A 381 2.731 -5.154 -3.140 1.00 0.00 H new ATOM 479 N LYS A 382 3.406 -0.478 -10.186 1.00 0.00 N ATOM 480 CA LYS A 382 3.370 0.682 -11.067 1.00 0.00 C ATOM 481 C LYS A 382 2.186 0.601 -12.026 1.00 0.00 C ATOM 482 O LYS A 382 1.835 1.584 -12.679 1.00 0.00 O ATOM 483 CB LYS A 382 4.675 0.788 -11.860 1.00 0.00 C ATOM 484 CG LYS A 382 4.853 -0.315 -12.888 1.00 0.00 C ATOM 485 CD LYS A 382 5.721 0.139 -14.049 1.00 0.00 C ATOM 486 CE LYS A 382 7.160 0.371 -13.612 1.00 0.00 C ATOM 487 NZ LYS A 382 7.822 1.429 -14.424 1.00 0.00 N ATOM 0 H LYS A 382 4.117 -1.168 -10.427 1.00 0.00 H new ATOM 0 HA LYS A 382 3.254 1.572 -10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.706 1.753 -12.366 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.515 0.765 -11.166 1.00 0.00 H new ATOM 0 HG2 LYS A 382 5.305 -1.186 -12.414 1.00 0.00 H new ATOM 0 HG3 LYS A 382 3.877 -0.626 -13.262 1.00 0.00 H new ATOM 0 HD2 LYS A 382 5.696 -0.612 -14.839 1.00 0.00 H new ATOM 0 HD3 LYS A 382 5.315 1.059 -14.471 1.00 0.00 H new ATOM 0 HE2 LYS A 382 7.179 0.656 -12.560 1.00 0.00 H new ATOM 0 HE3 LYS A 382 7.721 -0.559 -13.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 8.800 1.557 -14.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 7.827 1.146 -15.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 7.302 2.323 -14.319 1.00 0.00 H new ATOM 501 N GLN A 383 1.574 -0.576 -12.105 1.00 0.00 N ATOM 502 CA GLN A 383 0.430 -0.784 -12.984 1.00 0.00 C ATOM 503 C GLN A 383 -0.586 0.343 -12.831 1.00 0.00 C ATOM 504 O GLN A 383 -0.969 0.984 -13.810 1.00 0.00 O ATOM 505 CB GLN A 383 -0.234 -2.129 -12.682 1.00 0.00 C ATOM 506 CG GLN A 383 0.413 -3.302 -13.402 1.00 0.00 C ATOM 507 CD GLN A 383 -0.441 -4.554 -13.362 1.00 0.00 C ATOM 508 OE1 GLN A 383 -1.491 -4.583 -12.720 1.00 0.00 O ATOM 509 NE2 GLN A 383 0.006 -5.598 -14.050 1.00 0.00 N ATOM 0 H GLN A 383 1.851 -1.400 -11.571 1.00 0.00 H new ATOM 0 HA GLN A 383 0.790 -0.787 -14.013 1.00 0.00 H new ATOM 0 HB2 GLN A 383 -0.199 -2.309 -11.608 1.00 0.00 H new ATOM 0 HB3 GLN A 383 -1.286 -2.077 -12.962 1.00 0.00 H new ATOM 0 HG2 GLN A 383 0.600 -3.028 -14.440 1.00 0.00 H new ATOM 0 HG3 GLN A 383 1.381 -3.513 -12.948 1.00 0.00 H new ATOM 0 HE21 GLN A 383 0.882 -5.530 -14.568 1.00 0.00 H new ATOM 0 HE22 GLN A 383 -0.526 -6.468 -14.060 1.00 0.00 H new ATOM 518 N CYS A 384 -1.020 0.578 -11.597 1.00 0.00 N ATOM 519 CA CYS A 384 -1.993 1.628 -11.315 1.00 0.00 C ATOM 520 C CYS A 384 -1.483 2.984 -11.792 1.00 0.00 C ATOM 521 O CYS A 384 -1.997 3.547 -12.757 1.00 0.00 O ATOM 522 CB CYS A 384 -2.297 1.682 -9.818 1.00 0.00 C ATOM 523 SG CYS A 384 -3.306 3.097 -9.320 1.00 0.00 S ATOM 0 H CYS A 384 -0.714 0.056 -10.776 1.00 0.00 H new ATOM 0 HA CYS A 384 -2.910 1.394 -11.856 1.00 0.00 H new ATOM 0 HB2 CYS A 384 -2.809 0.764 -9.529 1.00 0.00 H new ATOM 0 HB3 CYS A 384 -1.356 1.709 -9.268 1.00 0.00 H new ATOM 0 HG CYS A 384 -2.746 3.696 -8.311 1.00 0.00 H new ATOM 529 N GLY A 385 -0.469 3.504 -11.107 1.00 0.00 N ATOM 530 CA GLY A 385 0.093 4.791 -11.474 1.00 0.00 C ATOM 531 C GLY A 385 1.606 4.761 -11.557 1.00 0.00 C ATOM 532 O GLY A 385 2.180 3.954 -12.288 1.00 0.00 O ATOM 0 H GLY A 385 -0.027 3.057 -10.304 1.00 0.00 H new ATOM 0 HA2 GLY A 385 -0.314 5.101 -12.436 1.00 0.00 H new ATOM 0 HA3 GLY A 385 -0.213 5.539 -10.743 1.00 0.00 H new ATOM 536 N VAL A 386 2.256 5.645 -10.805 1.00 0.00 N ATOM 537 CA VAL A 386 3.712 5.717 -10.797 1.00 0.00 C ATOM 538 C VAL A 386 4.260 5.576 -9.382 1.00 0.00 C ATOM 539 O VAL A 386 3.736 6.168 -8.439 1.00 0.00 O ATOM 540 CB VAL A 386 4.212 7.043 -11.399 1.00 0.00 C ATOM 541 CG1 VAL A 386 5.727 7.134 -11.308 1.00 0.00 C ATOM 542 CG2 VAL A 386 3.747 7.181 -12.842 1.00 0.00 C ATOM 0 H VAL A 386 1.797 6.321 -10.194 1.00 0.00 H new ATOM 0 HA VAL A 386 4.073 4.890 -11.409 1.00 0.00 H new ATOM 0 HB VAL A 386 3.788 7.866 -10.824 1.00 0.00 H new ATOM 0 HG11 VAL A 386 6.061 8.078 -11.739 1.00 0.00 H new ATOM 0 HG12 VAL A 386 6.032 7.083 -10.263 1.00 0.00 H new ATOM 0 HG13 VAL A 386 6.175 6.306 -11.857 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.109 8.124 -13.252 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.141 6.353 -13.432 1.00 0.00 H new ATOM 0 HG23 VAL A 386 2.658 7.165 -12.876 1.00 0.00 H new ATOM 552 N VAL A 387 5.321 4.786 -9.240 1.00 0.00 N ATOM 553 CA VAL A 387 5.944 4.568 -7.939 1.00 0.00 C ATOM 554 C VAL A 387 7.071 5.563 -7.696 1.00 0.00 C ATOM 555 O VAL A 387 7.957 5.732 -8.534 1.00 0.00 O ATOM 556 CB VAL A 387 6.501 3.137 -7.817 1.00 0.00 C ATOM 557 CG1 VAL A 387 7.183 2.943 -6.472 1.00 0.00 C ATOM 558 CG2 VAL A 387 5.391 2.115 -8.014 1.00 0.00 C ATOM 0 H VAL A 387 5.767 4.287 -10.010 1.00 0.00 H new ATOM 0 HA VAL A 387 5.168 4.713 -7.188 1.00 0.00 H new ATOM 0 HB VAL A 387 7.245 2.987 -8.599 1.00 0.00 H new ATOM 0 HG11 VAL A 387 7.570 1.926 -6.404 1.00 0.00 H new ATOM 0 HG12 VAL A 387 8.005 3.652 -6.375 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.463 3.111 -5.671 1.00 0.00 H new ATOM 0 HG21 VAL A 387 5.802 1.109 -7.925 1.00 0.00 H new ATOM 0 HG22 VAL A 387 4.623 2.262 -7.255 1.00 0.00 H new ATOM 0 HG23 VAL A 387 4.952 2.241 -9.004 1.00 0.00 H new ATOM 568 N LYS A 388 7.035 6.221 -6.542 1.00 0.00 N ATOM 569 CA LYS A 388 8.055 7.200 -6.185 1.00 0.00 C ATOM 570 C LYS A 388 9.453 6.615 -6.356 1.00 0.00 C ATOM 571 O LYS A 388 9.887 5.778 -5.566 1.00 0.00 O ATOM 572 CB LYS A 388 7.859 7.668 -4.742 1.00 0.00 C ATOM 573 CG LYS A 388 8.721 8.861 -4.367 1.00 0.00 C ATOM 574 CD LYS A 388 8.055 9.718 -3.303 1.00 0.00 C ATOM 575 CE LYS A 388 8.289 9.155 -1.908 1.00 0.00 C ATOM 576 NZ LYS A 388 8.280 10.224 -0.871 1.00 0.00 N ATOM 0 H LYS A 388 6.309 6.094 -5.837 1.00 0.00 H new ATOM 0 HA LYS A 388 7.953 8.055 -6.854 1.00 0.00 H new ATOM 0 HB2 LYS A 388 6.811 7.926 -4.592 1.00 0.00 H new ATOM 0 HB3 LYS A 388 8.083 6.842 -4.067 1.00 0.00 H new ATOM 0 HG2 LYS A 388 9.687 8.513 -4.002 1.00 0.00 H new ATOM 0 HG3 LYS A 388 8.914 9.465 -5.254 1.00 0.00 H new ATOM 0 HD2 LYS A 388 8.444 10.735 -3.357 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.984 9.776 -3.498 1.00 0.00 H new ATOM 0 HE2 LYS A 388 7.518 8.420 -1.679 1.00 0.00 H new ATOM 0 HE3 LYS A 388 9.245 8.632 -1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 8.443 9.801 0.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 9.032 10.912 -1.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 7.359 10.706 -0.878 1.00 0.00 H new ATOM 590 N MET A 389 10.154 7.064 -7.393 1.00 0.00 N ATOM 591 CA MET A 389 11.505 6.585 -7.665 1.00 0.00 C ATOM 592 C MET A 389 12.542 7.625 -7.251 1.00 0.00 C ATOM 593 O MET A 389 12.497 8.771 -7.693 1.00 0.00 O ATOM 594 CB MET A 389 11.662 6.254 -9.150 1.00 0.00 C ATOM 595 CG MET A 389 10.997 4.949 -9.556 1.00 0.00 C ATOM 596 SD MET A 389 11.909 3.500 -8.991 1.00 0.00 S ATOM 597 CE MET A 389 13.512 3.799 -9.729 1.00 0.00 C ATOM 0 H MET A 389 9.810 7.757 -8.057 1.00 0.00 H new ATOM 0 HA MET A 389 11.669 5.680 -7.080 1.00 0.00 H new ATOM 0 HB2 MET A 389 11.240 7.067 -9.741 1.00 0.00 H new ATOM 0 HB3 MET A 389 12.724 6.202 -9.392 1.00 0.00 H new ATOM 0 HG2 MET A 389 9.986 4.919 -9.149 1.00 0.00 H new ATOM 0 HG3 MET A 389 10.905 4.915 -10.642 1.00 0.00 H new ATOM 0 HE1 MET A 389 14.082 2.870 -9.750 1.00 0.00 H new ATOM 0 HE2 MET A 389 13.381 4.167 -10.747 1.00 0.00 H new ATOM 0 HE3 MET A 389 14.050 4.542 -9.141 1.00 0.00 H new ATOM 607 N ASN A 390 13.477 7.214 -6.400 1.00 0.00 N ATOM 608 CA ASN A 390 14.525 8.110 -5.925 1.00 0.00 C ATOM 609 C ASN A 390 15.155 8.874 -7.086 1.00 0.00 C ATOM 610 O ASN A 390 15.287 8.348 -8.192 1.00 0.00 O ATOM 611 CB ASN A 390 15.601 7.320 -5.177 1.00 0.00 C ATOM 612 CG ASN A 390 16.376 8.181 -4.199 1.00 0.00 C ATOM 613 OD1 ASN A 390 16.698 9.333 -4.490 1.00 0.00 O ATOM 614 ND2 ASN A 390 16.681 7.624 -3.033 1.00 0.00 N ATOM 0 H ASN A 390 13.530 6.267 -6.026 1.00 0.00 H new ATOM 0 HA ASN A 390 14.071 8.829 -5.243 1.00 0.00 H new ATOM 0 HB2 ASN A 390 15.134 6.495 -4.639 1.00 0.00 H new ATOM 0 HB3 ASN A 390 16.292 6.881 -5.897 1.00 0.00 H new ATOM 0 HD21 ASN A 390 17.203 8.154 -2.335 1.00 0.00 H new ATOM 0 HD22 ASN A 390 16.393 6.666 -2.835 1.00 0.00 H new ATOM 621 N LYS A 391 15.542 10.118 -6.829 1.00 0.00 N ATOM 622 CA LYS A 391 16.160 10.955 -7.850 1.00 0.00 C ATOM 623 C LYS A 391 17.680 10.877 -7.771 1.00 0.00 C ATOM 624 O LYS A 391 18.380 11.225 -8.723 1.00 0.00 O ATOM 625 CB LYS A 391 15.704 12.408 -7.692 1.00 0.00 C ATOM 626 CG LYS A 391 16.195 13.323 -8.801 1.00 0.00 C ATOM 627 CD LYS A 391 16.149 14.783 -8.380 1.00 0.00 C ATOM 628 CE LYS A 391 16.593 15.701 -9.507 1.00 0.00 C ATOM 629 NZ LYS A 391 17.092 17.008 -8.994 1.00 0.00 N ATOM 0 H LYS A 391 15.438 10.570 -5.920 1.00 0.00 H new ATOM 0 HA LYS A 391 15.846 10.586 -8.826 1.00 0.00 H new ATOM 0 HB2 LYS A 391 14.615 12.437 -7.664 1.00 0.00 H new ATOM 0 HB3 LYS A 391 16.058 12.789 -6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 391 17.216 13.053 -9.071 1.00 0.00 H new ATOM 0 HG3 LYS A 391 15.581 13.180 -9.690 1.00 0.00 H new ATOM 0 HD2 LYS A 391 15.135 15.043 -8.075 1.00 0.00 H new ATOM 0 HD3 LYS A 391 16.791 14.933 -7.512 1.00 0.00 H new ATOM 0 HE2 LYS A 391 17.379 15.214 -10.084 1.00 0.00 H new ATOM 0 HE3 LYS A 391 15.758 15.872 -10.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 17.385 17.606 -9.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 16.335 17.485 -8.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 17.905 16.847 -8.366 1.00 0.00 H new ATOM 643 N ARG A 392 18.187 10.418 -6.631 1.00 0.00 N ATOM 644 CA ARG A 392 19.626 10.294 -6.429 1.00 0.00 C ATOM 645 C ARG A 392 20.082 8.854 -6.640 1.00 0.00 C ATOM 646 O ARG A 392 21.088 8.599 -7.303 1.00 0.00 O ATOM 647 CB ARG A 392 20.006 10.761 -5.023 1.00 0.00 C ATOM 648 CG ARG A 392 21.375 10.279 -4.571 1.00 0.00 C ATOM 649 CD ARG A 392 22.486 10.884 -5.416 1.00 0.00 C ATOM 650 NE ARG A 392 22.482 12.344 -5.360 1.00 0.00 N ATOM 651 CZ ARG A 392 23.077 13.044 -4.401 1.00 0.00 C ATOM 652 NH1 ARG A 392 23.721 12.421 -3.424 1.00 0.00 N ATOM 653 NH2 ARG A 392 23.030 14.370 -4.420 1.00 0.00 N ATOM 0 H ARG A 392 17.623 10.126 -5.833 1.00 0.00 H new ATOM 0 HA ARG A 392 20.127 10.926 -7.162 1.00 0.00 H new ATOM 0 HB2 ARG A 392 19.985 11.850 -4.993 1.00 0.00 H new ATOM 0 HB3 ARG A 392 19.254 10.409 -4.317 1.00 0.00 H new ATOM 0 HG2 ARG A 392 21.528 10.543 -3.525 1.00 0.00 H new ATOM 0 HG3 ARG A 392 21.419 9.192 -4.635 1.00 0.00 H new ATOM 0 HD2 ARG A 392 23.450 10.510 -5.070 1.00 0.00 H new ATOM 0 HD3 ARG A 392 22.372 10.560 -6.451 1.00 0.00 H new ATOM 0 HE ARG A 392 21.996 12.853 -6.098 1.00 0.00 H new ATOM 0 HH11 ARG A 392 23.760 11.402 -3.408 1.00 0.00 H new ATOM 0 HH12 ARG A 392 24.177 12.961 -2.689 1.00 0.00 H new ATOM 0 HH21 ARG A 392 22.537 14.852 -5.171 1.00 0.00 H new ATOM 0 HH22 ARG A 392 23.487 14.907 -3.683 1.00 0.00 H new ATOM 667 N THR A 393 19.337 7.912 -6.068 1.00 0.00 N ATOM 668 CA THR A 393 19.665 6.498 -6.192 1.00 0.00 C ATOM 669 C THR A 393 18.956 5.870 -7.386 1.00 0.00 C ATOM 670 O THR A 393 19.407 4.863 -7.931 1.00 0.00 O ATOM 671 CB THR A 393 19.286 5.719 -4.917 1.00 0.00 C ATOM 672 OG1 THR A 393 17.939 6.024 -4.540 1.00 0.00 O ATOM 673 CG2 THR A 393 20.229 6.063 -3.774 1.00 0.00 C ATOM 0 H THR A 393 18.502 8.104 -5.514 1.00 0.00 H new ATOM 0 HA THR A 393 20.743 6.437 -6.340 1.00 0.00 H new ATOM 0 HB THR A 393 19.371 4.653 -5.129 1.00 0.00 H new ATOM 0 HG1 THR A 393 17.710 5.537 -3.721 1.00 0.00 H new ATOM 0 HG21 THR A 393 19.943 5.502 -2.885 1.00 0.00 H new ATOM 0 HG22 THR A 393 21.250 5.803 -4.054 1.00 0.00 H new ATOM 0 HG23 THR A 393 20.171 7.131 -3.563 1.00 0.00 H new ATOM 681 N GLY A 394 17.842 6.473 -7.791 1.00 0.00 N ATOM 682 CA GLY A 394 17.088 5.959 -8.919 1.00 0.00 C ATOM 683 C GLY A 394 16.429 4.628 -8.619 1.00 0.00 C ATOM 684 O GLY A 394 16.221 3.814 -9.518 1.00 0.00 O ATOM 0 H GLY A 394 17.449 7.308 -7.358 1.00 0.00 H new ATOM 0 HA2 GLY A 394 16.324 6.683 -9.201 1.00 0.00 H new ATOM 0 HA3 GLY A 394 17.753 5.847 -9.775 1.00 0.00 H new ATOM 688 N GLN A 395 16.100 4.406 -7.350 1.00 0.00 N ATOM 689 CA GLN A 395 15.462 3.163 -6.933 1.00 0.00 C ATOM 690 C GLN A 395 14.057 3.423 -6.400 1.00 0.00 C ATOM 691 O GLN A 395 13.748 4.505 -5.899 1.00 0.00 O ATOM 692 CB GLN A 395 16.305 2.466 -5.863 1.00 0.00 C ATOM 693 CG GLN A 395 16.508 3.302 -4.609 1.00 0.00 C ATOM 694 CD GLN A 395 15.444 3.048 -3.560 1.00 0.00 C ATOM 695 OE1 GLN A 395 14.647 3.931 -3.240 1.00 0.00 O ATOM 696 NE2 GLN A 395 15.425 1.836 -3.017 1.00 0.00 N ATOM 0 H GLN A 395 16.265 5.070 -6.594 1.00 0.00 H new ATOM 0 HA GLN A 395 15.385 2.514 -7.805 1.00 0.00 H new ATOM 0 HB2 GLN A 395 15.825 1.526 -5.590 1.00 0.00 H new ATOM 0 HB3 GLN A 395 17.279 2.216 -6.285 1.00 0.00 H new ATOM 0 HG2 GLN A 395 17.489 3.084 -4.186 1.00 0.00 H new ATOM 0 HG3 GLN A 395 16.504 4.359 -4.877 1.00 0.00 H new ATOM 0 HE21 GLN A 395 16.104 1.134 -3.312 1.00 0.00 H new ATOM 0 HE22 GLN A 395 14.731 1.607 -2.305 1.00 0.00 H new ATOM 705 N PRO A 396 13.185 2.410 -6.510 1.00 0.00 N ATOM 706 CA PRO A 396 11.798 2.507 -6.045 1.00 0.00 C ATOM 707 C PRO A 396 11.699 2.556 -4.524 1.00 0.00 C ATOM 708 O PRO A 396 12.483 1.920 -3.821 1.00 0.00 O ATOM 709 CB PRO A 396 11.154 1.225 -6.581 1.00 0.00 C ATOM 710 CG PRO A 396 12.285 0.267 -6.727 1.00 0.00 C ATOM 711 CD PRO A 396 13.485 1.094 -7.096 1.00 0.00 C ATOM 0 HA PRO A 396 11.315 3.421 -6.391 1.00 0.00 H new ATOM 0 HB2 PRO A 396 10.398 0.844 -5.894 1.00 0.00 H new ATOM 0 HB3 PRO A 396 10.658 1.400 -7.535 1.00 0.00 H new ATOM 0 HG2 PRO A 396 12.457 -0.277 -5.799 1.00 0.00 H new ATOM 0 HG3 PRO A 396 12.071 -0.475 -7.497 1.00 0.00 H new ATOM 0 HD2 PRO A 396 14.404 0.673 -6.689 1.00 0.00 H new ATOM 0 HD3 PRO A 396 13.614 1.155 -8.177 1.00 0.00 H new ATOM 719 N MET A 397 10.730 3.315 -4.023 1.00 0.00 N ATOM 720 CA MET A 397 10.528 3.446 -2.585 1.00 0.00 C ATOM 721 C MET A 397 9.742 2.260 -2.037 1.00 0.00 C ATOM 722 O MET A 397 8.861 2.424 -1.192 1.00 0.00 O ATOM 723 CB MET A 397 9.793 4.751 -2.268 1.00 0.00 C ATOM 724 CG MET A 397 10.606 5.996 -2.579 1.00 0.00 C ATOM 725 SD MET A 397 11.599 6.546 -1.177 1.00 0.00 S ATOM 726 CE MET A 397 13.253 6.289 -1.813 1.00 0.00 C ATOM 0 H MET A 397 10.072 3.849 -4.592 1.00 0.00 H new ATOM 0 HA MET A 397 11.507 3.463 -2.106 1.00 0.00 H new ATOM 0 HB2 MET A 397 8.864 4.782 -2.837 1.00 0.00 H new ATOM 0 HB3 MET A 397 9.521 4.758 -1.212 1.00 0.00 H new ATOM 0 HG2 MET A 397 11.261 5.795 -3.427 1.00 0.00 H new ATOM 0 HG3 MET A 397 9.933 6.799 -2.880 1.00 0.00 H new ATOM 0 HE1 MET A 397 13.668 5.374 -1.390 1.00 0.00 H new ATOM 0 HE2 MET A 397 13.216 6.202 -2.899 1.00 0.00 H new ATOM 0 HE3 MET A 397 13.884 7.134 -1.538 1.00 0.00 H new ATOM 736 N ILE A 398 10.065 1.066 -2.521 1.00 0.00 N ATOM 737 CA ILE A 398 9.389 -0.147 -2.078 1.00 0.00 C ATOM 738 C ILE A 398 10.198 -0.867 -1.005 1.00 0.00 C ATOM 739 O ILE A 398 11.428 -0.902 -1.058 1.00 0.00 O ATOM 740 CB ILE A 398 9.141 -1.113 -3.252 1.00 0.00 C ATOM 741 CG1 ILE A 398 8.152 -0.500 -4.246 1.00 0.00 C ATOM 742 CG2 ILE A 398 8.624 -2.449 -2.738 1.00 0.00 C ATOM 743 CD1 ILE A 398 7.994 -1.305 -5.516 1.00 0.00 C ATOM 0 H ILE A 398 10.791 0.912 -3.221 1.00 0.00 H new ATOM 0 HA ILE A 398 8.430 0.160 -1.661 1.00 0.00 H new ATOM 0 HB ILE A 398 10.086 -1.285 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 398 7.179 -0.402 -3.764 1.00 0.00 H new ATOM 0 HG13 ILE A 398 8.484 0.506 -4.502 1.00 0.00 H new ATOM 0 HG21 ILE A 398 8.453 -3.121 -3.579 1.00 0.00 H new ATOM 0 HG22 ILE A 398 9.360 -2.889 -2.065 1.00 0.00 H new ATOM 0 HG23 ILE A 398 7.688 -2.295 -2.201 1.00 0.00 H new ATOM 0 HD11 ILE A 398 7.278 -0.811 -6.173 1.00 0.00 H new ATOM 0 HD12 ILE A 398 8.957 -1.381 -6.020 1.00 0.00 H new ATOM 0 HD13 ILE A 398 7.632 -2.304 -5.271 1.00 0.00 H new ATOM 755 N HIS A 399 9.500 -1.441 -0.030 1.00 0.00 N ATOM 756 CA HIS A 399 10.153 -2.163 1.055 1.00 0.00 C ATOM 757 C HIS A 399 9.659 -3.605 1.124 1.00 0.00 C ATOM 758 O HIS A 399 8.469 -3.872 0.951 1.00 0.00 O ATOM 759 CB HIS A 399 9.898 -1.460 2.389 1.00 0.00 C ATOM 760 CG HIS A 399 11.019 -1.611 3.370 1.00 0.00 C ATOM 761 ND1 HIS A 399 12.080 -0.733 3.441 1.00 0.00 N ATOM 762 CD2 HIS A 399 11.242 -2.546 4.324 1.00 0.00 C ATOM 763 CE1 HIS A 399 12.907 -1.121 4.396 1.00 0.00 C ATOM 764 NE2 HIS A 399 12.420 -2.218 4.947 1.00 0.00 N ATOM 0 H HIS A 399 8.482 -1.420 0.030 1.00 0.00 H new ATOM 0 HA HIS A 399 11.225 -2.174 0.857 1.00 0.00 H new ATOM 0 HB2 HIS A 399 9.728 -0.399 2.205 1.00 0.00 H new ATOM 0 HB3 HIS A 399 8.984 -1.857 2.831 1.00 0.00 H new ATOM 0 HD2 HIS A 399 10.611 -3.392 4.552 1.00 0.00 H new ATOM 0 HE1 HIS A 399 13.824 -0.626 4.678 1.00 0.00 H new ATOM 0 HE2 HIS A 399 12.850 -2.738 5.712 1.00 0.00 H new ATOM 772 N ILE A 400 10.580 -4.530 1.376 1.00 0.00 N ATOM 773 CA ILE A 400 10.238 -5.943 1.468 1.00 0.00 C ATOM 774 C ILE A 400 10.873 -6.585 2.697 1.00 0.00 C ATOM 775 O ILE A 400 12.024 -7.019 2.657 1.00 0.00 O ATOM 776 CB ILE A 400 10.685 -6.713 0.212 1.00 0.00 C ATOM 777 CG1 ILE A 400 10.036 -6.114 -1.038 1.00 0.00 C ATOM 778 CG2 ILE A 400 10.334 -8.188 0.341 1.00 0.00 C ATOM 779 CD1 ILE A 400 10.452 -6.798 -2.322 1.00 0.00 C ATOM 0 H ILE A 400 11.569 -4.325 1.520 1.00 0.00 H new ATOM 0 HA ILE A 400 9.153 -5.999 1.552 1.00 0.00 H new ATOM 0 HB ILE A 400 11.767 -6.624 0.116 1.00 0.00 H new ATOM 0 HG12 ILE A 400 8.952 -6.174 -0.939 1.00 0.00 H new ATOM 0 HG13 ILE A 400 10.293 -5.056 -1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 400 10.657 -8.718 -0.555 1.00 0.00 H new ATOM 0 HG22 ILE A 400 10.838 -8.607 1.212 1.00 0.00 H new ATOM 0 HG23 ILE A 400 9.256 -8.297 0.458 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.954 -6.321 -3.166 1.00 0.00 H new ATOM 0 HD12 ILE A 400 11.532 -6.716 -2.445 1.00 0.00 H new ATOM 0 HD13 ILE A 400 10.170 -7.850 -2.281 1.00 0.00 H new ATOM 791 N TYR A 401 10.116 -6.641 3.786 1.00 0.00 N ATOM 792 CA TYR A 401 10.605 -7.229 5.028 1.00 0.00 C ATOM 793 C TYR A 401 10.956 -8.701 4.832 1.00 0.00 C ATOM 794 O TYR A 401 10.115 -9.504 4.428 1.00 0.00 O ATOM 795 CB TYR A 401 9.557 -7.086 6.132 1.00 0.00 C ATOM 796 CG TYR A 401 8.923 -5.714 6.192 1.00 0.00 C ATOM 797 CD1 TYR A 401 7.862 -5.380 5.360 1.00 0.00 C ATOM 798 CD2 TYR A 401 9.387 -4.751 7.080 1.00 0.00 C ATOM 799 CE1 TYR A 401 7.281 -4.128 5.411 1.00 0.00 C ATOM 800 CE2 TYR A 401 8.811 -3.498 7.140 1.00 0.00 C ATOM 801 CZ TYR A 401 7.758 -3.191 6.303 1.00 0.00 C ATOM 802 OH TYR A 401 7.183 -1.942 6.357 1.00 0.00 O ATOM 0 H TYR A 401 9.161 -6.286 3.835 1.00 0.00 H new ATOM 0 HA TYR A 401 11.508 -6.694 5.323 1.00 0.00 H new ATOM 0 HB2 TYR A 401 8.776 -7.831 5.979 1.00 0.00 H new ATOM 0 HB3 TYR A 401 10.022 -7.304 7.093 1.00 0.00 H new ATOM 0 HD1 TYR A 401 7.485 -6.112 4.661 1.00 0.00 H new ATOM 0 HD2 TYR A 401 10.213 -4.987 7.735 1.00 0.00 H new ATOM 0 HE1 TYR A 401 6.458 -3.884 4.756 1.00 0.00 H new ATOM 0 HE2 TYR A 401 9.182 -2.762 7.838 1.00 0.00 H new ATOM 0 HH TYR A 401 7.636 -1.403 7.039 1.00 0.00 H new ATOM 812 N LEU A 402 12.207 -9.047 5.121 1.00 0.00 N ATOM 813 CA LEU A 402 12.672 -10.422 4.978 1.00 0.00 C ATOM 814 C LEU A 402 12.858 -11.078 6.343 1.00 0.00 C ATOM 815 O LEU A 402 13.425 -10.480 7.258 1.00 0.00 O ATOM 816 CB LEU A 402 13.987 -10.458 4.198 1.00 0.00 C ATOM 817 CG LEU A 402 14.008 -9.681 2.882 1.00 0.00 C ATOM 818 CD1 LEU A 402 15.412 -9.656 2.298 1.00 0.00 C ATOM 819 CD2 LEU A 402 13.026 -10.286 1.889 1.00 0.00 C ATOM 0 H LEU A 402 12.916 -8.394 5.455 1.00 0.00 H new ATOM 0 HA LEU A 402 11.915 -10.981 4.427 1.00 0.00 H new ATOM 0 HB2 LEU A 402 14.777 -10.068 4.839 1.00 0.00 H new ATOM 0 HB3 LEU A 402 14.232 -11.499 3.986 1.00 0.00 H new ATOM 0 HG LEU A 402 13.703 -8.654 3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 402 15.407 -9.098 1.361 1.00 0.00 H new ATOM 0 HD12 LEU A 402 16.091 -9.175 3.003 1.00 0.00 H new ATOM 0 HD13 LEU A 402 15.746 -10.676 2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 402 13.055 -9.720 0.958 1.00 0.00 H new ATOM 0 HD22 LEU A 402 13.300 -11.322 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 402 12.019 -10.250 2.305 1.00 0.00 H new ATOM 831 N ASP A 403 12.380 -12.311 6.471 1.00 0.00 N ATOM 832 CA ASP A 403 12.497 -13.050 7.722 1.00 0.00 C ATOM 833 C ASP A 403 13.953 -13.135 8.170 1.00 0.00 C ATOM 834 O ASP A 403 14.806 -13.648 7.446 1.00 0.00 O ATOM 835 CB ASP A 403 11.916 -14.455 7.565 1.00 0.00 C ATOM 836 CG ASP A 403 11.373 -15.007 8.869 1.00 0.00 C ATOM 837 OD1 ASP A 403 10.970 -14.201 9.733 1.00 0.00 O ATOM 838 OD2 ASP A 403 11.351 -16.246 9.025 1.00 0.00 O ATOM 0 H ASP A 403 11.908 -12.820 5.723 1.00 0.00 H new ATOM 0 HA ASP A 403 11.932 -12.515 8.485 1.00 0.00 H new ATOM 0 HB2 ASP A 403 11.118 -14.434 6.823 1.00 0.00 H new ATOM 0 HB3 ASP A 403 12.688 -15.124 7.184 1.00 0.00 H new ATOM 843 N LYS A 404 14.229 -12.628 9.366 1.00 0.00 N ATOM 844 CA LYS A 404 15.581 -12.645 9.911 1.00 0.00 C ATOM 845 C LYS A 404 16.008 -14.067 10.263 1.00 0.00 C ATOM 846 O LYS A 404 17.128 -14.293 10.717 1.00 0.00 O ATOM 847 CB LYS A 404 15.665 -11.755 11.152 1.00 0.00 C ATOM 848 CG LYS A 404 14.845 -12.267 12.324 1.00 0.00 C ATOM 849 CD LYS A 404 15.651 -13.216 13.196 1.00 0.00 C ATOM 850 CE LYS A 404 14.893 -13.592 14.460 1.00 0.00 C ATOM 851 NZ LYS A 404 14.876 -12.479 15.449 1.00 0.00 N ATOM 0 H LYS A 404 13.534 -12.200 9.977 1.00 0.00 H new ATOM 0 HA LYS A 404 16.257 -12.259 9.148 1.00 0.00 H new ATOM 0 HB2 LYS A 404 16.708 -11.670 11.458 1.00 0.00 H new ATOM 0 HB3 LYS A 404 15.326 -10.752 10.893 1.00 0.00 H new ATOM 0 HG2 LYS A 404 14.500 -11.425 12.924 1.00 0.00 H new ATOM 0 HG3 LYS A 404 13.957 -12.778 11.952 1.00 0.00 H new ATOM 0 HD2 LYS A 404 15.888 -14.118 12.631 1.00 0.00 H new ATOM 0 HD3 LYS A 404 16.599 -12.749 13.464 1.00 0.00 H new ATOM 0 HE2 LYS A 404 13.870 -13.864 14.202 1.00 0.00 H new ATOM 0 HE3 LYS A 404 15.353 -14.471 14.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 14.440 -12.808 16.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 15.850 -12.168 15.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 14.326 -11.683 15.067 1.00 0.00 H new ATOM 865 N GLU A 405 15.106 -15.020 10.048 1.00 0.00 N ATOM 866 CA GLU A 405 15.390 -16.420 10.342 1.00 0.00 C ATOM 867 C GLU A 405 16.018 -17.113 9.137 1.00 0.00 C ATOM 868 O GLU A 405 16.907 -17.952 9.281 1.00 0.00 O ATOM 869 CB GLU A 405 14.110 -17.148 10.754 1.00 0.00 C ATOM 870 CG GLU A 405 13.328 -16.437 11.846 1.00 0.00 C ATOM 871 CD GLU A 405 13.755 -16.858 13.239 1.00 0.00 C ATOM 872 OE1 GLU A 405 14.967 -17.072 13.447 1.00 0.00 O ATOM 873 OE2 GLU A 405 12.877 -16.975 14.119 1.00 0.00 O ATOM 0 H GLU A 405 14.174 -14.848 9.672 1.00 0.00 H new ATOM 0 HA GLU A 405 16.100 -16.454 11.169 1.00 0.00 H new ATOM 0 HB2 GLU A 405 13.471 -17.265 9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 405 14.367 -18.150 11.097 1.00 0.00 H new ATOM 0 HG2 GLU A 405 13.460 -15.360 11.740 1.00 0.00 H new ATOM 0 HG3 GLU A 405 12.265 -16.642 11.719 1.00 0.00 H new ATOM 880 N THR A 406 15.547 -16.756 7.946 1.00 0.00 N ATOM 881 CA THR A 406 16.059 -17.344 6.715 1.00 0.00 C ATOM 882 C THR A 406 16.537 -16.265 5.748 1.00 0.00 C ATOM 883 O THR A 406 17.518 -16.453 5.030 1.00 0.00 O ATOM 884 CB THR A 406 14.991 -18.206 6.016 1.00 0.00 C ATOM 885 OG1 THR A 406 13.929 -17.374 5.535 1.00 0.00 O ATOM 886 CG2 THR A 406 14.431 -19.251 6.969 1.00 0.00 C ATOM 0 H THR A 406 14.812 -16.062 7.808 1.00 0.00 H new ATOM 0 HA THR A 406 16.901 -17.978 6.994 1.00 0.00 H new ATOM 0 HB THR A 406 15.461 -18.718 5.176 1.00 0.00 H new ATOM 0 HG1 THR A 406 13.085 -17.646 5.953 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.679 -19.848 6.453 1.00 0.00 H new ATOM 0 HG22 THR A 406 15.237 -19.900 7.311 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.976 -18.755 7.826 1.00 0.00 H new ATOM 894 N GLY A 407 15.838 -15.135 5.736 1.00 0.00 N ATOM 895 CA GLY A 407 16.207 -14.043 4.854 1.00 0.00 C ATOM 896 C GLY A 407 15.255 -13.897 3.683 1.00 0.00 C ATOM 897 O GLY A 407 15.447 -13.038 2.822 1.00 0.00 O ATOM 0 H GLY A 407 15.022 -14.956 6.321 1.00 0.00 H new ATOM 0 HA2 GLY A 407 16.226 -13.112 5.421 1.00 0.00 H new ATOM 0 HA3 GLY A 407 17.217 -14.208 4.479 1.00 0.00 H new ATOM 901 N LYS A 408 14.229 -14.739 3.649 1.00 0.00 N ATOM 902 CA LYS A 408 13.243 -14.701 2.575 1.00 0.00 C ATOM 903 C LYS A 408 12.128 -13.710 2.894 1.00 0.00 C ATOM 904 O LYS A 408 11.820 -13.438 4.055 1.00 0.00 O ATOM 905 CB LYS A 408 12.652 -16.093 2.348 1.00 0.00 C ATOM 906 CG LYS A 408 11.770 -16.574 3.487 1.00 0.00 C ATOM 907 CD LYS A 408 11.571 -18.079 3.442 1.00 0.00 C ATOM 908 CE LYS A 408 10.667 -18.556 4.570 1.00 0.00 C ATOM 909 NZ LYS A 408 9.246 -18.179 4.337 1.00 0.00 N ATOM 0 H LYS A 408 14.058 -15.457 4.353 1.00 0.00 H new ATOM 0 HA LYS A 408 13.747 -14.374 1.665 1.00 0.00 H new ATOM 0 HB2 LYS A 408 12.069 -16.085 1.427 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.465 -16.804 2.204 1.00 0.00 H new ATOM 0 HG2 LYS A 408 12.220 -16.294 4.440 1.00 0.00 H new ATOM 0 HG3 LYS A 408 10.802 -16.076 3.433 1.00 0.00 H new ATOM 0 HD2 LYS A 408 11.137 -18.361 2.483 1.00 0.00 H new ATOM 0 HD3 LYS A 408 12.538 -18.577 3.514 1.00 0.00 H new ATOM 0 HE2 LYS A 408 10.745 -19.639 4.665 1.00 0.00 H new ATOM 0 HE3 LYS A 408 11.006 -18.128 5.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 8.650 -18.593 5.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 9.154 -17.143 4.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 8.940 -18.537 3.410 1.00 0.00 H new ATOM 923 N PRO A 409 11.507 -13.157 1.841 1.00 0.00 N ATOM 924 CA PRO A 409 10.415 -12.189 1.984 1.00 0.00 C ATOM 925 C PRO A 409 9.141 -12.829 2.525 1.00 0.00 C ATOM 926 O PRO A 409 8.325 -13.351 1.765 1.00 0.00 O ATOM 927 CB PRO A 409 10.197 -11.687 0.555 1.00 0.00 C ATOM 928 CG PRO A 409 10.684 -12.794 -0.314 1.00 0.00 C ATOM 929 CD PRO A 409 11.823 -13.434 0.430 1.00 0.00 C ATOM 0 HA PRO A 409 10.660 -11.400 2.695 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.145 -11.470 0.368 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.750 -10.766 0.370 1.00 0.00 H new ATOM 0 HG2 PRO A 409 9.890 -13.516 -0.508 1.00 0.00 H new ATOM 0 HG3 PRO A 409 11.014 -12.415 -1.281 1.00 0.00 H new ATOM 0 HD2 PRO A 409 11.880 -14.505 0.234 1.00 0.00 H new ATOM 0 HD3 PRO A 409 12.783 -13.005 0.141 1.00 0.00 H new ATOM 937 N LYS A 410 8.975 -12.784 3.842 1.00 0.00 N ATOM 938 CA LYS A 410 7.799 -13.358 4.485 1.00 0.00 C ATOM 939 C LYS A 410 6.573 -13.236 3.585 1.00 0.00 C ATOM 940 O LYS A 410 5.890 -14.223 3.313 1.00 0.00 O ATOM 941 CB LYS A 410 7.534 -12.662 5.823 1.00 0.00 C ATOM 942 CG LYS A 410 7.786 -11.165 5.790 1.00 0.00 C ATOM 943 CD LYS A 410 8.130 -10.627 7.169 1.00 0.00 C ATOM 944 CE LYS A 410 6.890 -10.488 8.039 1.00 0.00 C ATOM 945 NZ LYS A 410 7.107 -9.540 9.167 1.00 0.00 N ATOM 0 H LYS A 410 9.640 -12.356 4.486 1.00 0.00 H new ATOM 0 HA LYS A 410 7.993 -14.416 4.664 1.00 0.00 H new ATOM 0 HB2 LYS A 410 6.500 -12.842 6.118 1.00 0.00 H new ATOM 0 HB3 LYS A 410 8.166 -13.112 6.588 1.00 0.00 H new ATOM 0 HG2 LYS A 410 8.601 -10.947 5.100 1.00 0.00 H new ATOM 0 HG3 LYS A 410 6.901 -10.654 5.410 1.00 0.00 H new ATOM 0 HD2 LYS A 410 8.843 -11.294 7.654 1.00 0.00 H new ATOM 0 HD3 LYS A 410 8.617 -9.657 7.071 1.00 0.00 H new ATOM 0 HE2 LYS A 410 6.056 -10.142 7.429 1.00 0.00 H new ATOM 0 HE3 LYS A 410 6.612 -11.465 8.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 6.239 -9.473 9.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 7.887 -9.883 9.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 7.347 -8.601 8.790 1.00 0.00 H new ATOM 959 N GLY A 411 6.300 -12.020 3.125 1.00 0.00 N ATOM 960 CA GLY A 411 5.158 -11.792 2.259 1.00 0.00 C ATOM 961 C GLY A 411 4.639 -10.371 2.346 1.00 0.00 C ATOM 962 O GLY A 411 3.880 -9.927 1.484 1.00 0.00 O ATOM 0 H GLY A 411 6.850 -11.187 3.337 1.00 0.00 H new ATOM 0 HA2 GLY A 411 5.438 -12.011 1.229 1.00 0.00 H new ATOM 0 HA3 GLY A 411 4.359 -12.484 2.526 1.00 0.00 H new ATOM 966 N ASP A 412 5.046 -9.657 3.390 1.00 0.00 N ATOM 967 CA ASP A 412 4.615 -8.277 3.586 1.00 0.00 C ATOM 968 C ASP A 412 5.545 -7.310 2.861 1.00 0.00 C ATOM 969 O ASP A 412 6.708 -7.623 2.608 1.00 0.00 O ATOM 970 CB ASP A 412 4.572 -7.942 5.078 1.00 0.00 C ATOM 971 CG ASP A 412 5.943 -7.985 5.721 1.00 0.00 C ATOM 972 OD1 ASP A 412 6.883 -8.497 5.079 1.00 0.00 O ATOM 973 OD2 ASP A 412 6.076 -7.506 6.867 1.00 0.00 O ATOM 0 H ASP A 412 5.673 -10.010 4.113 1.00 0.00 H new ATOM 0 HA ASP A 412 3.614 -8.171 3.169 1.00 0.00 H new ATOM 0 HB2 ASP A 412 4.142 -6.949 5.212 1.00 0.00 H new ATOM 0 HB3 ASP A 412 3.913 -8.646 5.587 1.00 0.00 H new ATOM 978 N ALA A 413 5.025 -6.133 2.530 1.00 0.00 N ATOM 979 CA ALA A 413 5.809 -5.119 1.835 1.00 0.00 C ATOM 980 C ALA A 413 5.085 -3.777 1.825 1.00 0.00 C ATOM 981 O ALA A 413 3.905 -3.692 2.169 1.00 0.00 O ATOM 982 CB ALA A 413 6.111 -5.568 0.413 1.00 0.00 C ATOM 0 H ALA A 413 4.064 -5.858 2.732 1.00 0.00 H new ATOM 0 HA ALA A 413 6.749 -4.991 2.372 1.00 0.00 H new ATOM 0 HB1 ALA A 413 6.697 -4.801 -0.094 1.00 0.00 H new ATOM 0 HB2 ALA A 413 6.677 -6.499 0.438 1.00 0.00 H new ATOM 0 HB3 ALA A 413 5.176 -5.725 -0.125 1.00 0.00 H new ATOM 988 N THR A 414 5.799 -2.727 1.430 1.00 0.00 N ATOM 989 CA THR A 414 5.225 -1.388 1.376 1.00 0.00 C ATOM 990 C THR A 414 5.633 -0.666 0.098 1.00 0.00 C ATOM 991 O THR A 414 6.778 -0.764 -0.345 1.00 0.00 O ATOM 992 CB THR A 414 5.657 -0.545 2.590 1.00 0.00 C ATOM 993 OG1 THR A 414 7.020 -0.833 2.928 1.00 0.00 O ATOM 994 CG2 THR A 414 4.763 -0.821 3.789 1.00 0.00 C ATOM 0 H THR A 414 6.776 -2.778 1.143 1.00 0.00 H new ATOM 0 HA THR A 414 4.142 -1.506 1.391 1.00 0.00 H new ATOM 0 HB THR A 414 5.564 0.508 2.323 1.00 0.00 H new ATOM 0 HG1 THR A 414 7.287 -0.291 3.700 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.089 -0.213 4.633 1.00 0.00 H new ATOM 0 HG22 THR A 414 3.732 -0.572 3.539 1.00 0.00 H new ATOM 0 HG23 THR A 414 4.827 -1.876 4.055 1.00 0.00 H new ATOM 1002 N VAL A 415 4.690 0.062 -0.491 1.00 0.00 N ATOM 1003 CA VAL A 415 4.951 0.803 -1.719 1.00 0.00 C ATOM 1004 C VAL A 415 4.607 2.279 -1.554 1.00 0.00 C ATOM 1005 O VAL A 415 3.450 2.635 -1.330 1.00 0.00 O ATOM 1006 CB VAL A 415 4.149 0.229 -2.903 1.00 0.00 C ATOM 1007 CG1 VAL A 415 4.546 0.918 -4.200 1.00 0.00 C ATOM 1008 CG2 VAL A 415 4.353 -1.275 -3.005 1.00 0.00 C ATOM 0 H VAL A 415 3.738 0.154 -0.137 1.00 0.00 H new ATOM 0 HA VAL A 415 6.016 0.702 -1.929 1.00 0.00 H new ATOM 0 HB VAL A 415 3.090 0.418 -2.728 1.00 0.00 H new ATOM 0 HG11 VAL A 415 3.970 0.500 -5.025 1.00 0.00 H new ATOM 0 HG12 VAL A 415 4.344 1.986 -4.121 1.00 0.00 H new ATOM 0 HG13 VAL A 415 5.609 0.762 -4.384 1.00 0.00 H new ATOM 0 HG21 VAL A 415 3.779 -1.664 -3.846 1.00 0.00 H new ATOM 0 HG22 VAL A 415 5.411 -1.489 -3.157 1.00 0.00 H new ATOM 0 HG23 VAL A 415 4.015 -1.751 -2.085 1.00 0.00 H new ATOM 1018 N SER A 416 5.618 3.133 -1.666 1.00 0.00 N ATOM 1019 CA SER A 416 5.423 4.572 -1.526 1.00 0.00 C ATOM 1020 C SER A 416 5.158 5.219 -2.882 1.00 0.00 C ATOM 1021 O SER A 416 6.045 5.296 -3.731 1.00 0.00 O ATOM 1022 CB SER A 416 6.650 5.213 -0.874 1.00 0.00 C ATOM 1023 OG SER A 416 6.694 4.935 0.515 1.00 0.00 O ATOM 0 H SER A 416 6.581 2.854 -1.853 1.00 0.00 H new ATOM 0 HA SER A 416 4.554 4.736 -0.889 1.00 0.00 H new ATOM 0 HB2 SER A 416 7.556 4.840 -1.351 1.00 0.00 H new ATOM 0 HB3 SER A 416 6.628 6.291 -1.032 1.00 0.00 H new ATOM 0 HG SER A 416 7.488 5.354 0.908 1.00 0.00 H new ATOM 1029 N TYR A 417 3.928 5.683 -3.077 1.00 0.00 N ATOM 1030 CA TYR A 417 3.543 6.322 -4.330 1.00 0.00 C ATOM 1031 C TYR A 417 3.866 7.812 -4.304 1.00 0.00 C ATOM 1032 O TYR A 417 4.067 8.395 -3.239 1.00 0.00 O ATOM 1033 CB TYR A 417 2.050 6.117 -4.593 1.00 0.00 C ATOM 1034 CG TYR A 417 1.705 4.725 -5.073 1.00 0.00 C ATOM 1035 CD1 TYR A 417 2.006 4.320 -6.367 1.00 0.00 C ATOM 1036 CD2 TYR A 417 1.078 3.814 -4.231 1.00 0.00 C ATOM 1037 CE1 TYR A 417 1.691 3.050 -6.809 1.00 0.00 C ATOM 1038 CE2 TYR A 417 0.761 2.542 -4.664 1.00 0.00 C ATOM 1039 CZ TYR A 417 1.069 2.164 -5.954 1.00 0.00 C ATOM 1040 OH TYR A 417 0.756 0.898 -6.391 1.00 0.00 O ATOM 0 H TYR A 417 3.181 5.629 -2.384 1.00 0.00 H new ATOM 0 HA TYR A 417 4.114 5.859 -5.135 1.00 0.00 H new ATOM 0 HB2 TYR A 417 1.497 6.324 -3.677 1.00 0.00 H new ATOM 0 HB3 TYR A 417 1.718 6.841 -5.337 1.00 0.00 H new ATOM 0 HD1 TYR A 417 2.495 5.010 -7.039 1.00 0.00 H new ATOM 0 HD2 TYR A 417 0.835 4.106 -3.220 1.00 0.00 H new ATOM 0 HE1 TYR A 417 1.930 2.752 -7.819 1.00 0.00 H new ATOM 0 HE2 TYR A 417 0.274 1.847 -3.996 1.00 0.00 H new ATOM 0 HH TYR A 417 1.071 0.783 -7.312 1.00 0.00 H new ATOM 1050 N GLU A 418 3.914 8.422 -5.485 1.00 0.00 N ATOM 1051 CA GLU A 418 4.213 9.844 -5.598 1.00 0.00 C ATOM 1052 C GLU A 418 3.210 10.676 -4.804 1.00 0.00 C ATOM 1053 O GLU A 418 3.573 11.358 -3.846 1.00 0.00 O ATOM 1054 CB GLU A 418 4.201 10.275 -7.066 1.00 0.00 C ATOM 1055 CG GLU A 418 4.890 9.290 -7.995 1.00 0.00 C ATOM 1056 CD GLU A 418 5.489 9.961 -9.217 1.00 0.00 C ATOM 1057 OE1 GLU A 418 4.763 10.716 -9.894 1.00 0.00 O ATOM 1058 OE2 GLU A 418 6.684 9.729 -9.494 1.00 0.00 O ATOM 0 H GLU A 418 3.750 7.953 -6.376 1.00 0.00 H new ATOM 0 HA GLU A 418 5.207 10.014 -5.185 1.00 0.00 H new ATOM 0 HB2 GLU A 418 3.168 10.405 -7.389 1.00 0.00 H new ATOM 0 HB3 GLU A 418 4.687 11.246 -7.155 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.677 8.770 -7.448 1.00 0.00 H new ATOM 0 HG3 GLU A 418 4.172 8.535 -8.315 1.00 0.00 H new ATOM 1065 N ASP A 419 1.947 10.614 -5.211 1.00 0.00 N ATOM 1066 CA ASP A 419 0.890 11.361 -4.539 1.00 0.00 C ATOM 1067 C ASP A 419 -0.160 10.416 -3.962 1.00 0.00 C ATOM 1068 O ASP A 419 -0.317 9.278 -4.406 1.00 0.00 O ATOM 1069 CB ASP A 419 0.233 12.342 -5.509 1.00 0.00 C ATOM 1070 CG ASP A 419 1.244 13.054 -6.387 1.00 0.00 C ATOM 1071 OD1 ASP A 419 1.828 12.394 -7.273 1.00 0.00 O ATOM 1072 OD2 ASP A 419 1.450 14.268 -6.189 1.00 0.00 O ATOM 0 H ASP A 419 1.630 10.054 -6.003 1.00 0.00 H new ATOM 0 HA ASP A 419 1.340 11.921 -3.719 1.00 0.00 H new ATOM 0 HB2 ASP A 419 -0.476 11.805 -6.139 1.00 0.00 H new ATOM 0 HB3 ASP A 419 -0.337 13.080 -4.944 1.00 0.00 H new ATOM 1077 N PRO A 420 -0.898 10.897 -2.949 1.00 0.00 N ATOM 1078 CA PRO A 420 -1.945 10.111 -2.291 1.00 0.00 C ATOM 1079 C PRO A 420 -3.011 9.630 -3.269 1.00 0.00 C ATOM 1080 O PRO A 420 -3.458 8.484 -3.224 1.00 0.00 O ATOM 1081 CB PRO A 420 -2.548 11.097 -1.286 1.00 0.00 C ATOM 1082 CG PRO A 420 -1.494 12.131 -1.092 1.00 0.00 C ATOM 1083 CD PRO A 420 -0.765 12.244 -2.371 1.00 0.00 C ATOM 0 HA PRO A 420 -1.548 9.204 -1.835 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -3.469 11.537 -1.667 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -2.796 10.603 -0.347 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -1.937 13.087 -0.814 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -0.818 11.847 -0.286 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -1.201 13.005 -3.018 1.00 0.00 H new ATOM 0 HD3 PRO A 420 0.279 12.516 -2.217 1.00 0.00 H new ATOM 1091 N PRO A 421 -3.430 10.526 -4.177 1.00 0.00 N ATOM 1092 CA PRO A 421 -4.448 10.214 -5.184 1.00 0.00 C ATOM 1093 C PRO A 421 -4.153 8.915 -5.925 1.00 0.00 C ATOM 1094 O PRO A 421 -5.063 8.250 -6.423 1.00 0.00 O ATOM 1095 CB PRO A 421 -4.374 11.405 -6.144 1.00 0.00 C ATOM 1096 CG PRO A 421 -3.840 12.524 -5.317 1.00 0.00 C ATOM 1097 CD PRO A 421 -2.942 11.910 -4.288 1.00 0.00 C ATOM 0 HA PRO A 421 -5.431 10.069 -4.737 1.00 0.00 H new ATOM 0 HB2 PRO A 421 -3.721 11.192 -6.990 1.00 0.00 H new ATOM 0 HB3 PRO A 421 -5.356 11.647 -6.551 1.00 0.00 H new ATOM 0 HG2 PRO A 421 -3.291 13.234 -5.935 1.00 0.00 H new ATOM 0 HG3 PRO A 421 -4.652 13.076 -4.842 1.00 0.00 H new ATOM 0 HD2 PRO A 421 -1.898 11.942 -4.598 1.00 0.00 H new ATOM 0 HD3 PRO A 421 -3.008 12.435 -3.335 1.00 0.00 H new ATOM 1105 N THR A 422 -2.874 8.556 -5.994 1.00 0.00 N ATOM 1106 CA THR A 422 -2.460 7.335 -6.673 1.00 0.00 C ATOM 1107 C THR A 422 -2.409 6.157 -5.707 1.00 0.00 C ATOM 1108 O THR A 422 -2.821 5.047 -6.045 1.00 0.00 O ATOM 1109 CB THR A 422 -1.077 7.503 -7.333 1.00 0.00 C ATOM 1110 OG1 THR A 422 -1.126 8.542 -8.316 1.00 0.00 O ATOM 1111 CG2 THR A 422 -0.628 6.204 -7.984 1.00 0.00 C ATOM 0 H THR A 422 -2.108 9.094 -5.588 1.00 0.00 H new ATOM 0 HA THR A 422 -3.203 7.135 -7.445 1.00 0.00 H new ATOM 0 HB THR A 422 -0.359 7.771 -6.558 1.00 0.00 H new ATOM 0 HG1 THR A 422 -0.243 8.643 -8.729 1.00 0.00 H new ATOM 0 HG21 THR A 422 0.350 6.346 -8.443 1.00 0.00 H new ATOM 0 HG22 THR A 422 -0.564 5.421 -7.228 1.00 0.00 H new ATOM 0 HG23 THR A 422 -1.348 5.912 -8.748 1.00 0.00 H new ATOM 1119 N ALA A 423 -1.902 6.406 -4.505 1.00 0.00 N ATOM 1120 CA ALA A 423 -1.801 5.364 -3.489 1.00 0.00 C ATOM 1121 C ALA A 423 -3.170 4.781 -3.162 1.00 0.00 C ATOM 1122 O ALA A 423 -3.358 3.564 -3.174 1.00 0.00 O ATOM 1123 CB ALA A 423 -1.148 5.918 -2.230 1.00 0.00 C ATOM 0 H ALA A 423 -1.555 7.319 -4.210 1.00 0.00 H new ATOM 0 HA ALA A 423 -1.179 4.562 -3.887 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -1.079 5.131 -1.480 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.148 6.281 -2.468 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.749 6.739 -1.840 1.00 0.00 H new ATOM 1129 N LYS A 424 -4.127 5.656 -2.870 1.00 0.00 N ATOM 1130 CA LYS A 424 -5.482 5.228 -2.540 1.00 0.00 C ATOM 1131 C LYS A 424 -6.089 4.419 -3.682 1.00 0.00 C ATOM 1132 O LYS A 424 -6.790 3.434 -3.452 1.00 0.00 O ATOM 1133 CB LYS A 424 -6.362 6.442 -2.236 1.00 0.00 C ATOM 1134 CG LYS A 424 -5.904 7.238 -1.026 1.00 0.00 C ATOM 1135 CD LYS A 424 -6.601 8.586 -0.948 1.00 0.00 C ATOM 1136 CE LYS A 424 -8.072 8.432 -0.591 1.00 0.00 C ATOM 1137 NZ LYS A 424 -8.263 8.151 0.860 1.00 0.00 N ATOM 0 H LYS A 424 -3.989 6.667 -2.855 1.00 0.00 H new ATOM 0 HA LYS A 424 -5.432 4.593 -1.655 1.00 0.00 H new ATOM 0 HB2 LYS A 424 -6.376 7.097 -3.107 1.00 0.00 H new ATOM 0 HB3 LYS A 424 -7.386 6.106 -2.073 1.00 0.00 H new ATOM 0 HG2 LYS A 424 -6.106 6.670 -0.118 1.00 0.00 H new ATOM 0 HG3 LYS A 424 -4.825 7.388 -1.075 1.00 0.00 H new ATOM 0 HD2 LYS A 424 -6.108 9.209 -0.202 1.00 0.00 H new ATOM 0 HD3 LYS A 424 -6.509 9.100 -1.905 1.00 0.00 H new ATOM 0 HE2 LYS A 424 -8.608 9.343 -0.859 1.00 0.00 H new ATOM 0 HE3 LYS A 424 -8.506 7.623 -1.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 -9.279 8.086 1.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 -7.801 7.251 1.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 -7.842 8.919 1.421 1.00 0.00 H new ATOM 1151 N ALA A 425 -5.816 4.842 -4.912 1.00 0.00 N ATOM 1152 CA ALA A 425 -6.333 4.154 -6.089 1.00 0.00 C ATOM 1153 C ALA A 425 -5.617 2.825 -6.307 1.00 0.00 C ATOM 1154 O ALA A 425 -6.208 1.865 -6.800 1.00 0.00 O ATOM 1155 CB ALA A 425 -6.194 5.038 -7.320 1.00 0.00 C ATOM 0 H ALA A 425 -5.240 5.658 -5.119 1.00 0.00 H new ATOM 0 HA ALA A 425 -7.390 3.945 -5.922 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -6.584 4.512 -8.192 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -6.756 5.960 -7.171 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -5.142 5.276 -7.480 1.00 0.00 H new ATOM 1161 N ALA A 426 -4.343 2.776 -5.935 1.00 0.00 N ATOM 1162 CA ALA A 426 -3.547 1.564 -6.088 1.00 0.00 C ATOM 1163 C ALA A 426 -3.993 0.487 -5.104 1.00 0.00 C ATOM 1164 O ALA A 426 -3.965 -0.703 -5.417 1.00 0.00 O ATOM 1165 CB ALA A 426 -2.070 1.875 -5.902 1.00 0.00 C ATOM 0 H ALA A 426 -3.839 3.562 -5.525 1.00 0.00 H new ATOM 0 HA ALA A 426 -3.701 1.182 -7.097 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -1.488 0.961 -6.019 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -1.755 2.604 -6.649 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -1.907 2.284 -4.905 1.00 0.00 H new ATOM 1171 N VAL A 427 -4.401 0.914 -3.914 1.00 0.00 N ATOM 1172 CA VAL A 427 -4.853 -0.014 -2.884 1.00 0.00 C ATOM 1173 C VAL A 427 -5.964 -0.918 -3.406 1.00 0.00 C ATOM 1174 O VAL A 427 -5.811 -2.138 -3.459 1.00 0.00 O ATOM 1175 CB VAL A 427 -5.359 0.736 -1.637 1.00 0.00 C ATOM 1176 CG1 VAL A 427 -5.868 -0.248 -0.592 1.00 0.00 C ATOM 1177 CG2 VAL A 427 -4.261 1.616 -1.061 1.00 0.00 C ATOM 0 H VAL A 427 -4.428 1.896 -3.639 1.00 0.00 H new ATOM 0 HA VAL A 427 -3.993 -0.624 -2.609 1.00 0.00 H new ATOM 0 HB VAL A 427 -6.189 1.378 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -6.221 0.300 0.282 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.688 -0.832 -1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -5.059 -0.917 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.637 2.138 -0.181 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -3.409 0.997 -0.780 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -3.949 2.345 -1.809 1.00 0.00 H new ATOM 1187 N GLU A 428 -7.081 -0.310 -3.792 1.00 0.00 N ATOM 1188 CA GLU A 428 -8.218 -1.062 -4.310 1.00 0.00 C ATOM 1189 C GLU A 428 -7.873 -1.722 -5.642 1.00 0.00 C ATOM 1190 O GLU A 428 -8.602 -2.588 -6.125 1.00 0.00 O ATOM 1191 CB GLU A 428 -9.429 -0.142 -4.484 1.00 0.00 C ATOM 1192 CG GLU A 428 -9.943 0.439 -3.178 1.00 0.00 C ATOM 1193 CD GLU A 428 -10.997 -0.435 -2.525 1.00 0.00 C ATOM 1194 OE1 GLU A 428 -12.071 -0.624 -3.132 1.00 0.00 O ATOM 1195 OE2 GLU A 428 -10.746 -0.929 -1.406 1.00 0.00 O ATOM 0 H GLU A 428 -7.223 0.699 -3.756 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.463 -1.843 -3.590 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -9.161 0.674 -5.155 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -10.232 -0.700 -4.965 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -9.108 0.570 -2.490 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -10.361 1.428 -3.364 1.00 0.00 H new ATOM 1202 N TRP A 429 -6.755 -1.306 -6.229 1.00 0.00 N ATOM 1203 CA TRP A 429 -6.313 -1.857 -7.505 1.00 0.00 C ATOM 1204 C TRP A 429 -5.611 -3.196 -7.306 1.00 0.00 C ATOM 1205 O TRP A 429 -5.939 -4.184 -7.963 1.00 0.00 O ATOM 1206 CB TRP A 429 -5.375 -0.876 -8.209 1.00 0.00 C ATOM 1207 CG TRP A 429 -4.691 -1.462 -9.406 1.00 0.00 C ATOM 1208 CD1 TRP A 429 -3.878 -2.559 -9.430 1.00 0.00 C ATOM 1209 CD2 TRP A 429 -4.759 -0.982 -10.754 1.00 0.00 C ATOM 1210 NE1 TRP A 429 -3.437 -2.790 -10.710 1.00 0.00 N ATOM 1211 CE2 TRP A 429 -3.964 -1.837 -11.542 1.00 0.00 C ATOM 1212 CE3 TRP A 429 -5.416 0.086 -11.372 1.00 0.00 C ATOM 1213 CZ2 TRP A 429 -3.808 -1.655 -12.913 1.00 0.00 C ATOM 1214 CZ3 TRP A 429 -5.261 0.265 -12.732 1.00 0.00 C ATOM 1215 CH2 TRP A 429 -4.463 -0.601 -13.491 1.00 0.00 C ATOM 0 H TRP A 429 -6.140 -0.590 -5.842 1.00 0.00 H new ATOM 0 HA TRP A 429 -7.193 -2.018 -8.127 1.00 0.00 H new ATOM 0 HB2 TRP A 429 -5.944 0.001 -8.518 1.00 0.00 H new ATOM 0 HB3 TRP A 429 -4.621 -0.534 -7.500 1.00 0.00 H new ATOM 0 HD1 TRP A 429 -3.620 -3.157 -8.569 1.00 0.00 H new ATOM 0 HE1 TRP A 429 -2.817 -3.548 -10.995 1.00 0.00 H new ATOM 0 HE3 TRP A 429 -6.034 0.759 -10.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 429 -3.193 -2.321 -13.500 1.00 0.00 H new ATOM 0 HZ3 TRP A 429 -5.764 1.087 -13.220 1.00 0.00 H new ATOM 0 HH2 TRP A 429 -4.363 -0.434 -14.553 1.00 0.00 H new ATOM 1226 N PHE A 430 -4.643 -3.222 -6.395 1.00 0.00 N ATOM 1227 CA PHE A 430 -3.895 -4.441 -6.111 1.00 0.00 C ATOM 1228 C PHE A 430 -4.528 -5.211 -4.956 1.00 0.00 C ATOM 1229 O PHE A 430 -4.198 -6.373 -4.715 1.00 0.00 O ATOM 1230 CB PHE A 430 -2.440 -4.105 -5.777 1.00 0.00 C ATOM 1231 CG PHE A 430 -1.742 -3.326 -6.856 1.00 0.00 C ATOM 1232 CD1 PHE A 430 -1.257 -3.962 -7.985 1.00 0.00 C ATOM 1233 CD2 PHE A 430 -1.571 -1.955 -6.738 1.00 0.00 C ATOM 1234 CE1 PHE A 430 -0.615 -3.248 -8.980 1.00 0.00 C ATOM 1235 CE2 PHE A 430 -0.931 -1.236 -7.729 1.00 0.00 C ATOM 1236 CZ PHE A 430 -0.451 -1.884 -8.851 1.00 0.00 C ATOM 0 H PHE A 430 -4.359 -2.414 -5.842 1.00 0.00 H new ATOM 0 HA PHE A 430 -3.921 -5.069 -7.001 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.411 -3.532 -4.850 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -1.894 -5.031 -5.597 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.381 -5.030 -8.090 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -1.942 -1.444 -5.862 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.243 -3.757 -9.857 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -0.806 -0.168 -7.627 1.00 0.00 H new ATOM 0 HZ PHE A 430 0.052 -1.324 -9.626 1.00 0.00 H new ATOM 1246 N ASP A 431 -5.438 -4.556 -4.244 1.00 0.00 N ATOM 1247 CA ASP A 431 -6.119 -5.178 -3.114 1.00 0.00 C ATOM 1248 C ASP A 431 -6.880 -6.424 -3.557 1.00 0.00 C ATOM 1249 O ASP A 431 -8.035 -6.343 -3.972 1.00 0.00 O ATOM 1250 CB ASP A 431 -7.080 -4.184 -2.459 1.00 0.00 C ATOM 1251 CG ASP A 431 -8.225 -4.871 -1.743 1.00 0.00 C ATOM 1252 OD1 ASP A 431 -7.970 -5.875 -1.044 1.00 0.00 O ATOM 1253 OD2 ASP A 431 -9.375 -4.406 -1.880 1.00 0.00 O ATOM 0 H ASP A 431 -5.722 -3.594 -4.429 1.00 0.00 H new ATOM 0 HA ASP A 431 -5.364 -5.475 -2.386 1.00 0.00 H new ATOM 0 HB2 ASP A 431 -6.530 -3.566 -1.749 1.00 0.00 H new ATOM 0 HB3 ASP A 431 -7.481 -3.515 -3.221 1.00 0.00 H new ATOM 1258 N GLY A 432 -6.223 -7.576 -3.467 1.00 0.00 N ATOM 1259 CA GLY A 432 -6.853 -8.822 -3.863 1.00 0.00 C ATOM 1260 C GLY A 432 -6.177 -9.458 -5.061 1.00 0.00 C ATOM 1261 O GLY A 432 -6.419 -10.624 -5.374 1.00 0.00 O ATOM 0 H GLY A 432 -5.266 -7.669 -3.127 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -6.831 -9.519 -3.025 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -7.901 -8.637 -4.097 1.00 0.00 H new ATOM 1265 N LYS A 433 -5.328 -8.690 -5.736 1.00 0.00 N ATOM 1266 CA LYS A 433 -4.616 -9.184 -6.908 1.00 0.00 C ATOM 1267 C LYS A 433 -4.035 -10.570 -6.648 1.00 0.00 C ATOM 1268 O LYS A 433 -3.973 -11.022 -5.505 1.00 0.00 O ATOM 1269 CB LYS A 433 -3.496 -8.215 -7.296 1.00 0.00 C ATOM 1270 CG LYS A 433 -3.932 -7.143 -8.279 1.00 0.00 C ATOM 1271 CD LYS A 433 -4.123 -7.712 -9.675 1.00 0.00 C ATOM 1272 CE LYS A 433 -5.132 -6.903 -10.475 1.00 0.00 C ATOM 1273 NZ LYS A 433 -6.529 -7.359 -10.229 1.00 0.00 N ATOM 0 H LYS A 433 -5.117 -7.723 -5.491 1.00 0.00 H new ATOM 0 HA LYS A 433 -5.328 -9.256 -7.730 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -3.113 -7.736 -6.395 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -2.672 -8.781 -7.730 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -4.864 -6.693 -7.938 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -3.186 -6.349 -8.308 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -3.167 -7.722 -10.198 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -4.459 -8.746 -9.604 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -5.042 -5.849 -10.212 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -4.904 -6.987 -11.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -7.187 -6.783 -10.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -6.622 -8.358 -10.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -6.755 -7.255 -9.219 1.00 0.00 H new ATOM 1287 N ASP A 434 -3.609 -11.238 -7.714 1.00 0.00 N ATOM 1288 CA ASP A 434 -3.031 -12.572 -7.600 1.00 0.00 C ATOM 1289 C ASP A 434 -1.563 -12.565 -8.014 1.00 0.00 C ATOM 1290 O ASP A 434 -1.238 -12.361 -9.184 1.00 0.00 O ATOM 1291 CB ASP A 434 -3.812 -13.565 -8.463 1.00 0.00 C ATOM 1292 CG ASP A 434 -3.476 -13.443 -9.935 1.00 0.00 C ATOM 1293 OD1 ASP A 434 -3.657 -12.342 -10.497 1.00 0.00 O ATOM 1294 OD2 ASP A 434 -3.029 -14.448 -10.527 1.00 0.00 O ATOM 0 H ASP A 434 -3.653 -10.878 -8.667 1.00 0.00 H new ATOM 0 HA ASP A 434 -3.095 -12.881 -6.557 1.00 0.00 H new ATOM 0 HB2 ASP A 434 -3.598 -14.580 -8.128 1.00 0.00 H new ATOM 0 HB3 ASP A 434 -4.881 -13.402 -8.323 1.00 0.00 H new ATOM 1299 N PHE A 435 -0.680 -12.789 -7.047 1.00 0.00 N ATOM 1300 CA PHE A 435 0.755 -12.806 -7.309 1.00 0.00 C ATOM 1301 C PHE A 435 1.321 -14.213 -7.142 1.00 0.00 C ATOM 1302 O PHE A 435 1.426 -14.721 -6.026 1.00 0.00 O ATOM 1303 CB PHE A 435 1.478 -11.836 -6.372 1.00 0.00 C ATOM 1304 CG PHE A 435 2.724 -11.246 -6.967 1.00 0.00 C ATOM 1305 CD1 PHE A 435 3.860 -12.020 -7.141 1.00 0.00 C ATOM 1306 CD2 PHE A 435 2.760 -9.915 -7.352 1.00 0.00 C ATOM 1307 CE1 PHE A 435 5.008 -11.480 -7.688 1.00 0.00 C ATOM 1308 CE2 PHE A 435 3.905 -9.369 -7.901 1.00 0.00 C ATOM 1309 CZ PHE A 435 5.031 -10.152 -8.067 1.00 0.00 C ATOM 0 H PHE A 435 -0.933 -12.961 -6.074 1.00 0.00 H new ATOM 0 HA PHE A 435 0.915 -12.490 -8.340 1.00 0.00 H new ATOM 0 HB2 PHE A 435 0.797 -11.029 -6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 435 1.737 -12.358 -5.451 1.00 0.00 H new ATOM 0 HD1 PHE A 435 3.848 -13.059 -6.845 1.00 0.00 H new ATOM 0 HD2 PHE A 435 1.884 -9.298 -7.222 1.00 0.00 H new ATOM 0 HE1 PHE A 435 5.886 -12.095 -7.819 1.00 0.00 H new ATOM 0 HE2 PHE A 435 3.919 -8.331 -8.200 1.00 0.00 H new ATOM 0 HZ PHE A 435 5.928 -9.726 -8.492 1.00 0.00 H new ATOM 1319 N GLN A 436 1.683 -14.835 -8.258 1.00 0.00 N ATOM 1320 CA GLN A 436 2.238 -16.184 -8.235 1.00 0.00 C ATOM 1321 C GLN A 436 1.232 -17.176 -7.661 1.00 0.00 C ATOM 1322 O GLN A 436 1.610 -18.167 -7.039 1.00 0.00 O ATOM 1323 CB GLN A 436 3.528 -16.213 -7.413 1.00 0.00 C ATOM 1324 CG GLN A 436 4.738 -15.678 -8.162 1.00 0.00 C ATOM 1325 CD GLN A 436 6.027 -15.846 -7.381 1.00 0.00 C ATOM 1326 OE1 GLN A 436 6.884 -14.832 -7.427 1.00 0.00 O flip ATOM 1327 NE2 GLN A 436 6.251 -16.876 -6.745 1.00 0.00 N flip ATOM 0 H GLN A 436 1.602 -14.428 -9.190 1.00 0.00 H new ATOM 0 HA GLN A 436 2.463 -16.476 -9.261 1.00 0.00 H new ATOM 0 HB2 GLN A 436 3.384 -15.627 -6.506 1.00 0.00 H new ATOM 0 HB3 GLN A 436 3.728 -17.238 -7.102 1.00 0.00 H new ATOM 0 HG2 GLN A 436 4.827 -16.194 -9.118 1.00 0.00 H new ATOM 0 HG3 GLN A 436 4.586 -14.621 -8.383 1.00 0.00 H new ATOM 0 HE21 GLN A 436 5.564 -17.630 -6.737 1.00 0.00 H new ATOM 0 HE22 GLN A 436 7.123 -16.975 -6.226 1.00 0.00 H new ATOM 1336 N GLY A 437 -0.051 -16.902 -7.875 1.00 0.00 N ATOM 1337 CA GLY A 437 -1.091 -17.779 -7.371 1.00 0.00 C ATOM 1338 C GLY A 437 -1.575 -17.375 -5.993 1.00 0.00 C ATOM 1339 O GLY A 437 -2.631 -17.817 -5.543 1.00 0.00 O ATOM 0 H GLY A 437 -0.389 -16.088 -8.389 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -1.933 -17.774 -8.064 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -0.714 -18.801 -7.335 1.00 0.00 H new ATOM 1343 N SER A 438 -0.798 -16.533 -5.319 1.00 0.00 N ATOM 1344 CA SER A 438 -1.150 -16.072 -3.981 1.00 0.00 C ATOM 1345 C SER A 438 -1.963 -14.782 -4.046 1.00 0.00 C ATOM 1346 O SER A 438 -1.926 -14.061 -5.043 1.00 0.00 O ATOM 1347 CB SER A 438 0.112 -15.851 -3.146 1.00 0.00 C ATOM 1348 OG SER A 438 -0.143 -16.068 -1.769 1.00 0.00 O ATOM 0 H SER A 438 0.079 -16.156 -5.678 1.00 0.00 H new ATOM 0 HA SER A 438 -1.760 -16.842 -3.508 1.00 0.00 H new ATOM 0 HB2 SER A 438 0.898 -16.526 -3.484 1.00 0.00 H new ATOM 0 HB3 SER A 438 0.478 -14.835 -3.296 1.00 0.00 H new ATOM 0 HG SER A 438 0.162 -15.292 -1.254 1.00 0.00 H new ATOM 1354 N LYS A 439 -2.696 -14.498 -2.975 1.00 0.00 N ATOM 1355 CA LYS A 439 -3.517 -13.295 -2.908 1.00 0.00 C ATOM 1356 C LYS A 439 -2.780 -12.173 -2.184 1.00 0.00 C ATOM 1357 O LYS A 439 -2.180 -12.388 -1.130 1.00 0.00 O ATOM 1358 CB LYS A 439 -4.838 -13.595 -2.194 1.00 0.00 C ATOM 1359 CG LYS A 439 -5.971 -12.668 -2.598 1.00 0.00 C ATOM 1360 CD LYS A 439 -7.138 -12.757 -1.629 1.00 0.00 C ATOM 1361 CE LYS A 439 -6.835 -12.035 -0.325 1.00 0.00 C ATOM 1362 NZ LYS A 439 -7.686 -12.529 0.793 1.00 0.00 N ATOM 0 H LYS A 439 -2.738 -15.084 -2.142 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.726 -12.970 -3.927 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -5.129 -14.624 -2.404 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -4.685 -13.520 -1.117 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.606 -11.642 -2.636 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.310 -12.923 -3.602 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -8.027 -12.324 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -7.363 -13.804 -1.423 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -5.784 -12.172 -0.070 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -6.994 -10.965 -0.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -7.449 -12.012 1.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -8.688 -12.375 0.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -7.516 -13.545 0.936 1.00 0.00 H new ATOM 1376 N LEU A 440 -2.829 -10.974 -2.756 1.00 0.00 N ATOM 1377 CA LEU A 440 -2.166 -9.817 -2.165 1.00 0.00 C ATOM 1378 C LEU A 440 -3.164 -8.947 -1.408 1.00 0.00 C ATOM 1379 O LEU A 440 -4.291 -8.738 -1.859 1.00 0.00 O ATOM 1380 CB LEU A 440 -1.474 -8.992 -3.251 1.00 0.00 C ATOM 1381 CG LEU A 440 -0.506 -9.753 -4.159 1.00 0.00 C ATOM 1382 CD1 LEU A 440 0.471 -8.795 -4.821 1.00 0.00 C ATOM 1383 CD2 LEU A 440 0.241 -10.817 -3.367 1.00 0.00 C ATOM 0 H LEU A 440 -3.321 -10.778 -3.628 1.00 0.00 H new ATOM 0 HA LEU A 440 -1.418 -10.178 -1.459 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.241 -8.533 -3.875 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -0.928 -8.181 -2.770 1.00 0.00 H new ATOM 0 HG LEU A 440 -1.083 -10.247 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 440 1.151 -9.355 -5.463 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -0.080 -8.070 -5.421 1.00 0.00 H new ATOM 0 HD13 LEU A 440 1.043 -8.272 -4.055 1.00 0.00 H new ATOM 0 HD21 LEU A 440 0.925 -11.349 -4.028 1.00 0.00 H new ATOM 0 HD22 LEU A 440 0.806 -10.343 -2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -0.473 -11.522 -2.941 1.00 0.00 H new ATOM 1395 N LYS A 441 -2.742 -8.437 -0.255 1.00 0.00 N ATOM 1396 CA LYS A 441 -3.595 -7.586 0.564 1.00 0.00 C ATOM 1397 C LYS A 441 -2.999 -6.188 0.700 1.00 0.00 C ATOM 1398 O LYS A 441 -2.094 -5.964 1.504 1.00 0.00 O ATOM 1399 CB LYS A 441 -3.790 -8.206 1.949 1.00 0.00 C ATOM 1400 CG LYS A 441 -4.494 -9.551 1.920 1.00 0.00 C ATOM 1401 CD LYS A 441 -5.276 -9.799 3.199 1.00 0.00 C ATOM 1402 CE LYS A 441 -4.424 -10.502 4.244 1.00 0.00 C ATOM 1403 NZ LYS A 441 -3.560 -9.546 4.990 1.00 0.00 N ATOM 0 H LYS A 441 -1.813 -8.599 0.133 1.00 0.00 H new ATOM 0 HA LYS A 441 -4.563 -7.503 0.071 1.00 0.00 H new ATOM 0 HB2 LYS A 441 -2.817 -8.325 2.425 1.00 0.00 H new ATOM 0 HB3 LYS A 441 -4.365 -7.518 2.568 1.00 0.00 H new ATOM 0 HG2 LYS A 441 -5.170 -9.590 1.066 1.00 0.00 H new ATOM 0 HG3 LYS A 441 -3.759 -10.344 1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 441 -5.634 -8.850 3.598 1.00 0.00 H new ATOM 0 HD3 LYS A 441 -6.155 -10.404 2.978 1.00 0.00 H new ATOM 0 HE2 LYS A 441 -5.071 -11.030 4.945 1.00 0.00 H new ATOM 0 HE3 LYS A 441 -3.800 -11.253 3.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 441 -3.178 -10.012 5.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 441 -2.775 -9.239 4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 441 -4.122 -8.719 5.274 1.00 0.00 H new ATOM 1417 N VAL A 442 -3.514 -5.251 -0.089 1.00 0.00 N ATOM 1418 CA VAL A 442 -3.035 -3.874 -0.054 1.00 0.00 C ATOM 1419 C VAL A 442 -3.935 -3.000 0.813 1.00 0.00 C ATOM 1420 O VAL A 442 -5.159 -3.043 0.695 1.00 0.00 O ATOM 1421 CB VAL A 442 -2.961 -3.270 -1.469 1.00 0.00 C ATOM 1422 CG1 VAL A 442 -2.204 -1.951 -1.448 1.00 0.00 C ATOM 1423 CG2 VAL A 442 -2.312 -4.251 -2.434 1.00 0.00 C ATOM 0 H VAL A 442 -4.263 -5.420 -0.760 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.034 -3.898 0.376 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.976 -3.073 -1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.162 -1.539 -2.456 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.716 -1.248 -0.790 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.191 -2.119 -1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.268 -3.808 -3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.302 -4.481 -2.094 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.900 -5.168 -2.471 1.00 0.00 H new ATOM 1433 N SER A 443 -3.318 -2.208 1.684 1.00 0.00 N ATOM 1434 CA SER A 443 -4.064 -1.326 2.575 1.00 0.00 C ATOM 1435 C SER A 443 -3.197 -0.156 3.031 1.00 0.00 C ATOM 1436 O SER A 443 -2.081 -0.347 3.517 1.00 0.00 O ATOM 1437 CB SER A 443 -4.571 -2.104 3.791 1.00 0.00 C ATOM 1438 OG SER A 443 -3.592 -2.146 4.815 1.00 0.00 O ATOM 0 H SER A 443 -2.305 -2.159 1.792 1.00 0.00 H new ATOM 0 HA SER A 443 -4.918 -0.931 2.024 1.00 0.00 H new ATOM 0 HB2 SER A 443 -5.480 -1.638 4.172 1.00 0.00 H new ATOM 0 HB3 SER A 443 -4.834 -3.119 3.493 1.00 0.00 H new ATOM 0 HG SER A 443 -2.736 -1.824 4.463 1.00 0.00 H new ATOM 1444 N LEU A 444 -3.717 1.055 2.871 1.00 0.00 N ATOM 1445 CA LEU A 444 -2.992 2.258 3.265 1.00 0.00 C ATOM 1446 C LEU A 444 -2.252 2.040 4.581 1.00 0.00 C ATOM 1447 O LEU A 444 -2.830 1.571 5.561 1.00 0.00 O ATOM 1448 CB LEU A 444 -3.957 3.438 3.399 1.00 0.00 C ATOM 1449 CG LEU A 444 -4.334 4.147 2.099 1.00 0.00 C ATOM 1450 CD1 LEU A 444 -5.288 5.299 2.377 1.00 0.00 C ATOM 1451 CD2 LEU A 444 -3.088 4.645 1.382 1.00 0.00 C ATOM 0 H LEU A 444 -4.639 1.231 2.471 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.259 2.482 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -4.871 3.082 3.873 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -3.513 4.170 4.073 1.00 0.00 H new ATOM 0 HG LEU A 444 -4.840 3.431 1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -5.546 5.792 1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.194 4.916 2.846 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -4.809 6.015 3.044 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -3.376 5.147 0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -2.554 5.345 2.024 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -2.440 3.800 1.149 1.00 0.00 H new