USER MOD reduce.3.24.130724 H: found=0, std=0, add=645, rem=0, adj=18 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 406 THR OG1 : rot -87:sc= -1.67 USER MOD Set 1.2: A 408 LYS NZ :NH3+ -178:sc= -0.164 (180deg=-0.201) USER MOD Set 2.1: A 401 TYR OH : rot 180:sc= 0.0106 USER MOD Set 2.2: A 414 THR OG1 : rot -125:sc= -0.949 USER MOD Set 3.1: A 390 ASN : amide:sc= -0.0608 K(o=-0.81,f=-4.2!) USER MOD Set 3.2: A 393 THR OG1 : rot 160:sc= -0.744 USER MOD Set 4.1: A 369 ASN : amide:sc= -8.88! C(o=-14!,f=-23!) USER MOD Set 4.2: A 436 GLN : amide:sc= -5.32! C(o=-14!,f=-14!) USER MOD Single : A 361 SER OG : rot 22:sc= 0.162 USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 366 GLN : amide:sc= 0.0241 X(o=0.024,f=0) USER MOD Single : A 371 SER OG : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot -91:sc= 0.643 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 383 GLN : amide:sc= 0.0388 K(o=0.039,f=-2.4!) USER MOD Single : A 384 CYS SG : rot -140:sc= 0 USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 MET CE :methyl -120:sc= -2.75! (180deg=-3.57!) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 395 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.12) USER MOD Single : A 397 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 399 HIS : no HD1:sc= -0.149 X(o=-0.15,f=-0.052) USER MOD Single : A 404 LYS NZ :NH3+ 155:sc= -0.0956 (180deg=-0.532) 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 4:sc= -0.361 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 433 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 LYS NZ :NH3+ 160:sc= -0.0483 (180deg=-0.322) USER MOD Single : A 443 SER OG : rot -19:sc= 0.458 USER MOD ----------------------------------------------------------------- ATOM 168 N SER A 361 0.748 8.721 1.243 1.00 0.00 N ATOM 169 CA SER A 361 1.004 8.387 -0.154 1.00 0.00 C ATOM 170 C SER A 361 1.677 7.023 -0.272 1.00 0.00 C ATOM 171 O SER A 361 2.441 6.775 -1.205 1.00 0.00 O ATOM 172 CB SER A 361 1.882 9.459 -0.803 1.00 0.00 C ATOM 173 OG SER A 361 1.469 10.759 -0.417 1.00 0.00 O ATOM 0 HA SER A 361 0.047 8.347 -0.674 1.00 0.00 H new ATOM 0 HB2 SER A 361 2.922 9.304 -0.516 1.00 0.00 H new ATOM 0 HB3 SER A 361 1.833 9.366 -1.888 1.00 0.00 H new ATOM 0 HG SER A 361 0.967 10.707 0.423 1.00 0.00 H new ATOM 179 N ALA A 362 1.386 6.143 0.680 1.00 0.00 N ATOM 180 CA ALA A 362 1.961 4.803 0.682 1.00 0.00 C ATOM 181 C ALA A 362 0.885 3.745 0.905 1.00 0.00 C ATOM 182 O ALA A 362 -0.237 4.061 1.301 1.00 0.00 O ATOM 183 CB ALA A 362 3.039 4.694 1.750 1.00 0.00 C ATOM 0 H ALA A 362 0.756 6.333 1.459 1.00 0.00 H new ATOM 0 HA ALA A 362 2.412 4.626 -0.294 1.00 0.00 H new ATOM 0 HB1 ALA A 362 3.460 3.689 1.741 1.00 0.00 H new ATOM 0 HB2 ALA A 362 3.827 5.419 1.547 1.00 0.00 H new ATOM 0 HB3 ALA A 362 2.603 4.896 2.729 1.00 0.00 H new ATOM 189 N ILE A 363 1.234 2.489 0.646 1.00 0.00 N ATOM 190 CA ILE A 363 0.298 1.386 0.818 1.00 0.00 C ATOM 191 C ILE A 363 0.991 0.164 1.411 1.00 0.00 C ATOM 192 O ILE A 363 2.154 -0.110 1.110 1.00 0.00 O ATOM 193 CB ILE A 363 -0.359 0.991 -0.518 1.00 0.00 C ATOM 194 CG1 ILE A 363 0.700 0.502 -1.507 1.00 0.00 C ATOM 195 CG2 ILE A 363 -1.129 2.168 -1.097 1.00 0.00 C ATOM 196 CD1 ILE A 363 0.128 -0.287 -2.664 1.00 0.00 C ATOM 0 H ILE A 363 2.158 2.211 0.316 1.00 0.00 H new ATOM 0 HA ILE A 363 -0.474 1.732 1.505 1.00 0.00 H new ATOM 0 HB ILE A 363 -1.061 0.177 -0.335 1.00 0.00 H new ATOM 0 HG12 ILE A 363 1.245 1.361 -1.898 1.00 0.00 H new ATOM 0 HG13 ILE A 363 1.422 -0.119 -0.976 1.00 0.00 H new ATOM 0 HG21 ILE A 363 -1.588 1.874 -2.041 1.00 0.00 H new ATOM 0 HG22 ILE A 363 -1.906 2.475 -0.396 1.00 0.00 H new ATOM 0 HG23 ILE A 363 -0.446 3.000 -1.269 1.00 0.00 H new ATOM 0 HD11 ILE A 363 0.936 -0.602 -3.325 1.00 0.00 H new ATOM 0 HD12 ILE A 363 -0.392 -1.166 -2.283 1.00 0.00 H new ATOM 0 HD13 ILE A 363 -0.572 0.337 -3.219 1.00 0.00 H new ATOM 208 N TYR A 364 0.271 -0.568 2.254 1.00 0.00 N ATOM 209 CA TYR A 364 0.816 -1.760 2.889 1.00 0.00 C ATOM 210 C TYR A 364 0.345 -3.023 2.175 1.00 0.00 C ATOM 211 O TYR A 364 -0.855 -3.249 2.016 1.00 0.00 O ATOM 212 CB TYR A 364 0.407 -1.811 4.362 1.00 0.00 C ATOM 213 CG TYR A 364 1.415 -2.511 5.247 1.00 0.00 C ATOM 214 CD1 TYR A 364 1.469 -3.898 5.309 1.00 0.00 C ATOM 215 CD2 TYR A 364 2.312 -1.785 6.020 1.00 0.00 C ATOM 216 CE1 TYR A 364 2.387 -4.541 6.116 1.00 0.00 C ATOM 217 CE2 TYR A 364 3.235 -2.419 6.829 1.00 0.00 C ATOM 218 CZ TYR A 364 3.268 -3.798 6.874 1.00 0.00 C ATOM 219 OH TYR A 364 4.185 -4.435 7.678 1.00 0.00 O ATOM 0 H TYR A 364 -0.692 -0.356 2.513 1.00 0.00 H new ATOM 0 HA TYR A 364 1.903 -1.711 2.822 1.00 0.00 H new ATOM 0 HB2 TYR A 364 0.262 -0.794 4.725 1.00 0.00 H new ATOM 0 HB3 TYR A 364 -0.553 -2.320 4.446 1.00 0.00 H new ATOM 0 HD1 TYR A 364 0.782 -4.483 4.716 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.287 -0.706 5.988 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.415 -5.620 6.153 1.00 0.00 H new ATOM 0 HE2 TYR A 364 3.926 -1.839 7.422 1.00 0.00 H new ATOM 0 HH TYR A 364 4.731 -3.768 8.144 1.00 0.00 H new ATOM 229 N VAL A 365 1.299 -3.843 1.746 1.00 0.00 N ATOM 230 CA VAL A 365 0.983 -5.085 1.049 1.00 0.00 C ATOM 231 C VAL A 365 1.277 -6.297 1.926 1.00 0.00 C ATOM 232 O VAL A 365 2.249 -6.307 2.682 1.00 0.00 O ATOM 233 CB VAL A 365 1.777 -5.210 -0.264 1.00 0.00 C ATOM 234 CG1 VAL A 365 1.298 -6.409 -1.067 1.00 0.00 C ATOM 235 CG2 VAL A 365 1.662 -3.931 -1.080 1.00 0.00 C ATOM 0 H VAL A 365 2.297 -3.670 1.869 1.00 0.00 H new ATOM 0 HA VAL A 365 -0.082 -5.056 0.819 1.00 0.00 H new ATOM 0 HB VAL A 365 2.828 -5.364 -0.019 1.00 0.00 H new ATOM 0 HG11 VAL A 365 1.871 -6.480 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 365 1.438 -7.318 -0.482 1.00 0.00 H new ATOM 0 HG13 VAL A 365 0.241 -6.289 -1.304 1.00 0.00 H new ATOM 0 HG21 VAL A 365 2.229 -4.037 -2.005 1.00 0.00 H new ATOM 0 HG22 VAL A 365 0.615 -3.743 -1.316 1.00 0.00 H new ATOM 0 HG23 VAL A 365 2.060 -3.095 -0.504 1.00 0.00 H new ATOM 245 N GLN A 366 0.433 -7.318 1.818 1.00 0.00 N ATOM 246 CA GLN A 366 0.604 -8.536 2.602 1.00 0.00 C ATOM 247 C GLN A 366 0.067 -9.748 1.847 1.00 0.00 C ATOM 248 O GLN A 366 -1.110 -9.800 1.492 1.00 0.00 O ATOM 249 CB GLN A 366 -0.108 -8.403 3.949 1.00 0.00 C ATOM 250 CG GLN A 366 0.669 -7.589 4.971 1.00 0.00 C ATOM 251 CD GLN A 366 -0.076 -7.432 6.282 1.00 0.00 C ATOM 252 OE1 GLN A 366 -0.125 -8.354 7.096 1.00 0.00 O ATOM 253 NE2 GLN A 366 -0.662 -6.259 6.493 1.00 0.00 N ATOM 0 H GLN A 366 -0.375 -7.326 1.196 1.00 0.00 H new ATOM 0 HA GLN A 366 1.670 -8.682 2.775 1.00 0.00 H new ATOM 0 HB2 GLN A 366 -1.082 -7.939 3.791 1.00 0.00 H new ATOM 0 HB3 GLN A 366 -0.291 -9.398 4.353 1.00 0.00 H new ATOM 0 HG2 GLN A 366 1.629 -8.070 5.159 1.00 0.00 H new ATOM 0 HG3 GLN A 366 0.882 -6.603 4.558 1.00 0.00 H new ATOM 0 HE21 GLN A 366 -0.596 -5.522 5.791 1.00 0.00 H new ATOM 0 HE22 GLN A 366 -1.178 -6.095 7.357 1.00 0.00 H new ATOM 262 N GLY A 367 0.940 -10.721 1.605 1.00 0.00 N ATOM 263 CA GLY A 367 0.536 -11.920 0.894 1.00 0.00 C ATOM 264 C GLY A 367 1.464 -12.252 -0.258 1.00 0.00 C ATOM 265 O GLY A 367 1.093 -12.988 -1.172 1.00 0.00 O ATOM 0 H GLY A 367 1.920 -10.700 1.889 1.00 0.00 H new ATOM 0 HA2 GLY A 367 0.510 -12.759 1.589 1.00 0.00 H new ATOM 0 HA3 GLY A 367 -0.477 -11.789 0.514 1.00 0.00 H new ATOM 269 N LEU A 368 2.674 -11.705 -0.216 1.00 0.00 N ATOM 270 CA LEU A 368 3.659 -11.946 -1.265 1.00 0.00 C ATOM 271 C LEU A 368 4.322 -13.307 -1.087 1.00 0.00 C ATOM 272 O LEU A 368 4.394 -13.834 0.022 1.00 0.00 O ATOM 273 CB LEU A 368 4.720 -10.843 -1.259 1.00 0.00 C ATOM 274 CG LEU A 368 4.239 -9.446 -1.650 1.00 0.00 C ATOM 275 CD1 LEU A 368 5.334 -8.418 -1.414 1.00 0.00 C ATOM 276 CD2 LEU A 368 3.789 -9.425 -3.104 1.00 0.00 C ATOM 0 H LEU A 368 2.997 -11.092 0.533 1.00 0.00 H new ATOM 0 HA LEU A 368 3.141 -11.938 -2.224 1.00 0.00 H new ATOM 0 HB2 LEU A 368 5.154 -10.790 -0.260 1.00 0.00 H new ATOM 0 HB3 LEU A 368 5.521 -11.133 -1.939 1.00 0.00 H new ATOM 0 HG LEU A 368 3.386 -9.187 -1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 368 4.973 -7.430 -1.698 1.00 0.00 H new ATOM 0 HD12 LEU A 368 5.608 -8.414 -0.359 1.00 0.00 H new ATOM 0 HD13 LEU A 368 6.207 -8.672 -2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 368 3.450 -8.423 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 368 4.623 -9.705 -3.747 1.00 0.00 H new ATOM 0 HD23 LEU A 368 2.971 -10.132 -3.242 1.00 0.00 H new ATOM 288 N ASN A 369 4.810 -13.870 -2.189 1.00 0.00 N ATOM 289 CA ASN A 369 5.470 -15.171 -2.154 1.00 0.00 C ATOM 290 C ASN A 369 6.882 -15.050 -1.589 1.00 0.00 C ATOM 291 O ASN A 369 7.331 -13.956 -1.245 1.00 0.00 O ATOM 292 CB ASN A 369 5.520 -15.777 -3.557 1.00 0.00 C ATOM 293 CG ASN A 369 6.176 -14.852 -4.564 1.00 0.00 C ATOM 294 OD1 ASN A 369 7.402 -14.767 -4.639 1.00 0.00 O ATOM 295 ND2 ASN A 369 5.359 -14.152 -5.344 1.00 0.00 N ATOM 0 H ASN A 369 4.761 -13.446 -3.116 1.00 0.00 H new ATOM 0 HA ASN A 369 4.893 -15.827 -1.502 1.00 0.00 H new ATOM 0 HB2 ASN A 369 6.067 -16.719 -3.523 1.00 0.00 H new ATOM 0 HB3 ASN A 369 4.507 -16.008 -3.886 1.00 0.00 H new ATOM 0 HD21 ASN A 369 5.742 -13.512 -6.040 1.00 0.00 H new ATOM 0 HD22 ASN A 369 4.349 -14.254 -5.247 1.00 0.00 H new ATOM 302 N ASP A 370 7.575 -16.179 -1.497 1.00 0.00 N ATOM 303 CA ASP A 370 8.937 -16.199 -0.975 1.00 0.00 C ATOM 304 C ASP A 370 9.950 -15.963 -2.091 1.00 0.00 C ATOM 305 O ASP A 370 11.159 -15.978 -1.859 1.00 0.00 O ATOM 306 CB ASP A 370 9.221 -17.534 -0.286 1.00 0.00 C ATOM 307 CG ASP A 370 8.541 -18.700 -0.977 1.00 0.00 C ATOM 308 OD1 ASP A 370 8.647 -18.797 -2.217 1.00 0.00 O ATOM 309 OD2 ASP A 370 7.904 -19.514 -0.277 1.00 0.00 O ATOM 0 H ASP A 370 7.217 -17.092 -1.777 1.00 0.00 H new ATOM 0 HA ASP A 370 9.033 -15.394 -0.246 1.00 0.00 H new ATOM 0 HB2 ASP A 370 10.297 -17.706 -0.264 1.00 0.00 H new ATOM 0 HB3 ASP A 370 8.885 -17.483 0.750 1.00 0.00 H new ATOM 314 N SER A 371 9.448 -15.746 -3.303 1.00 0.00 N ATOM 315 CA SER A 371 10.309 -15.511 -4.456 1.00 0.00 C ATOM 316 C SER A 371 10.032 -14.143 -5.072 1.00 0.00 C ATOM 317 O SER A 371 10.385 -13.884 -6.222 1.00 0.00 O ATOM 318 CB SER A 371 10.103 -16.606 -5.504 1.00 0.00 C ATOM 319 OG SER A 371 10.971 -17.703 -5.274 1.00 0.00 O ATOM 0 H SER A 371 8.450 -15.728 -3.511 1.00 0.00 H new ATOM 0 HA SER A 371 11.344 -15.533 -4.116 1.00 0.00 H new ATOM 0 HB2 SER A 371 9.068 -16.946 -5.480 1.00 0.00 H new ATOM 0 HB3 SER A 371 10.282 -16.199 -6.499 1.00 0.00 H new ATOM 0 HG SER A 371 10.818 -18.390 -5.956 1.00 0.00 H new ATOM 325 N VAL A 372 9.397 -13.270 -4.296 1.00 0.00 N ATOM 326 CA VAL A 372 9.073 -11.927 -4.763 1.00 0.00 C ATOM 327 C VAL A 372 10.268 -10.992 -4.619 1.00 0.00 C ATOM 328 O VAL A 372 10.919 -10.954 -3.574 1.00 0.00 O ATOM 329 CB VAL A 372 7.877 -11.339 -3.991 1.00 0.00 C ATOM 330 CG1 VAL A 372 8.186 -11.265 -2.504 1.00 0.00 C ATOM 331 CG2 VAL A 372 7.515 -9.965 -4.538 1.00 0.00 C ATOM 0 H VAL A 372 9.097 -13.469 -3.342 1.00 0.00 H new ATOM 0 HA VAL A 372 8.809 -12.013 -5.817 1.00 0.00 H new ATOM 0 HB VAL A 372 7.019 -11.997 -4.127 1.00 0.00 H new ATOM 0 HG11 VAL A 372 7.330 -10.847 -1.975 1.00 0.00 H new ATOM 0 HG12 VAL A 372 8.394 -12.266 -2.125 1.00 0.00 H new ATOM 0 HG13 VAL A 372 9.057 -10.629 -2.345 1.00 0.00 H new ATOM 0 HG21 VAL A 372 6.668 -9.563 -3.982 1.00 0.00 H new ATOM 0 HG22 VAL A 372 8.368 -9.295 -4.433 1.00 0.00 H new ATOM 0 HG23 VAL A 372 7.249 -10.051 -5.591 1.00 0.00 H new ATOM 341 N THR A 373 10.552 -10.236 -5.676 1.00 0.00 N ATOM 342 CA THR A 373 11.670 -9.301 -5.668 1.00 0.00 C ATOM 343 C THR A 373 11.182 -7.862 -5.800 1.00 0.00 C ATOM 344 O THR A 373 10.042 -7.615 -6.194 1.00 0.00 O ATOM 345 CB THR A 373 12.661 -9.601 -6.806 1.00 0.00 C ATOM 346 OG1 THR A 373 12.027 -9.401 -8.074 1.00 0.00 O ATOM 347 CG2 THR A 373 13.178 -11.029 -6.712 1.00 0.00 C ATOM 0 H THR A 373 10.023 -10.253 -6.548 1.00 0.00 H new ATOM 0 HA THR A 373 12.179 -9.424 -4.712 1.00 0.00 H new ATOM 0 HB THR A 373 13.506 -8.919 -6.711 1.00 0.00 H new ATOM 0 HG1 THR A 373 11.622 -10.242 -8.373 1.00 0.00 H new ATOM 0 HG21 THR A 373 13.877 -11.217 -7.527 1.00 0.00 H new ATOM 0 HG22 THR A 373 13.686 -11.170 -5.758 1.00 0.00 H new ATOM 0 HG23 THR A 373 12.342 -11.724 -6.783 1.00 0.00 H new ATOM 355 N LEU A 374 12.053 -6.915 -5.468 1.00 0.00 N ATOM 356 CA LEU A 374 11.712 -5.499 -5.549 1.00 0.00 C ATOM 357 C LEU A 374 11.216 -5.138 -6.946 1.00 0.00 C ATOM 358 O LEU A 374 10.086 -4.681 -7.116 1.00 0.00 O ATOM 359 CB LEU A 374 12.925 -4.640 -5.189 1.00 0.00 C ATOM 360 CG LEU A 374 12.861 -3.174 -5.618 1.00 0.00 C ATOM 361 CD1 LEU A 374 11.938 -2.389 -4.699 1.00 0.00 C ATOM 362 CD2 LEU A 374 14.252 -2.559 -5.630 1.00 0.00 C ATOM 0 H LEU A 374 13.001 -7.102 -5.140 1.00 0.00 H new ATOM 0 HA LEU A 374 10.911 -5.302 -4.836 1.00 0.00 H new ATOM 0 HB2 LEU A 374 13.062 -4.676 -4.108 1.00 0.00 H new ATOM 0 HB3 LEU A 374 13.810 -5.091 -5.638 1.00 0.00 H new ATOM 0 HG LEU A 374 12.458 -3.130 -6.630 1.00 0.00 H new ATOM 0 HD11 LEU A 374 11.905 -1.348 -5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 374 10.935 -2.814 -4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 374 12.312 -2.442 -3.676 1.00 0.00 H new ATOM 0 HD21 LEU A 374 14.186 -1.515 -5.938 1.00 0.00 H new ATOM 0 HD22 LEU A 374 14.684 -2.616 -4.631 1.00 0.00 H new ATOM 0 HD23 LEU A 374 14.885 -3.104 -6.330 1.00 0.00 H new ATOM 374 N ASP A 375 12.068 -5.350 -7.943 1.00 0.00 N ATOM 375 CA ASP A 375 11.716 -5.051 -9.327 1.00 0.00 C ATOM 376 C ASP A 375 10.336 -5.605 -9.669 1.00 0.00 C ATOM 377 O ASP A 375 9.503 -4.908 -10.249 1.00 0.00 O ATOM 378 CB ASP A 375 12.763 -5.630 -10.279 1.00 0.00 C ATOM 379 CG ASP A 375 13.927 -4.686 -10.504 1.00 0.00 C ATOM 380 OD1 ASP A 375 14.780 -4.571 -9.600 1.00 0.00 O ATOM 381 OD2 ASP A 375 13.985 -4.061 -11.584 1.00 0.00 O ATOM 0 H ASP A 375 13.007 -5.728 -7.819 1.00 0.00 H new ATOM 0 HA ASP A 375 11.691 -3.968 -9.444 1.00 0.00 H new ATOM 0 HB2 ASP A 375 13.136 -6.571 -9.875 1.00 0.00 H new ATOM 0 HB3 ASP A 375 12.293 -5.857 -11.236 1.00 0.00 H new ATOM 386 N ASP A 376 10.103 -6.861 -9.306 1.00 0.00 N ATOM 387 CA ASP A 376 8.825 -7.510 -9.574 1.00 0.00 C ATOM 388 C ASP A 376 7.667 -6.672 -9.039 1.00 0.00 C ATOM 389 O ASP A 376 6.612 -6.579 -9.667 1.00 0.00 O ATOM 390 CB ASP A 376 8.794 -8.904 -8.946 1.00 0.00 C ATOM 391 CG ASP A 376 9.673 -9.892 -9.687 1.00 0.00 C ATOM 392 OD1 ASP A 376 9.863 -9.718 -10.909 1.00 0.00 O ATOM 393 OD2 ASP A 376 10.173 -10.838 -9.044 1.00 0.00 O ATOM 0 H ASP A 376 10.783 -7.450 -8.825 1.00 0.00 H new ATOM 0 HA ASP A 376 8.714 -7.604 -10.654 1.00 0.00 H new ATOM 0 HB2 ASP A 376 9.120 -8.839 -7.908 1.00 0.00 H new ATOM 0 HB3 ASP A 376 7.768 -9.272 -8.935 1.00 0.00 H new ATOM 398 N LEU A 377 7.872 -6.065 -7.875 1.00 0.00 N ATOM 399 CA LEU A 377 6.846 -5.235 -7.255 1.00 0.00 C ATOM 400 C LEU A 377 6.858 -3.825 -7.839 1.00 0.00 C ATOM 401 O LEU A 377 5.825 -3.161 -7.903 1.00 0.00 O ATOM 402 CB LEU A 377 7.058 -5.173 -5.741 1.00 0.00 C ATOM 403 CG LEU A 377 7.042 -6.514 -5.006 1.00 0.00 C ATOM 404 CD1 LEU A 377 7.389 -6.322 -3.538 1.00 0.00 C ATOM 405 CD2 LEU A 377 5.684 -7.186 -5.152 1.00 0.00 C ATOM 0 H LEU A 377 8.739 -6.132 -7.342 1.00 0.00 H new ATOM 0 HA LEU A 377 5.876 -5.686 -7.462 1.00 0.00 H new ATOM 0 HB2 LEU A 377 8.014 -4.687 -5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 377 6.284 -4.537 -5.312 1.00 0.00 H new ATOM 0 HG LEU A 377 7.795 -7.162 -5.454 1.00 0.00 H new ATOM 0 HD11 LEU A 377 7.373 -7.287 -3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 377 8.384 -5.884 -3.453 1.00 0.00 H new ATOM 0 HD13 LEU A 377 6.660 -5.657 -3.076 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.691 -8.139 -4.623 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.912 -6.542 -4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.475 -7.359 -6.208 1.00 0.00 H new ATOM 417 N ALA A 378 8.034 -3.378 -8.266 1.00 0.00 N ATOM 418 CA ALA A 378 8.180 -2.050 -8.848 1.00 0.00 C ATOM 419 C ALA A 378 7.553 -1.988 -10.237 1.00 0.00 C ATOM 420 O ALA A 378 7.150 -0.920 -10.700 1.00 0.00 O ATOM 421 CB ALA A 378 9.649 -1.659 -8.912 1.00 0.00 C ATOM 0 H ALA A 378 8.899 -3.916 -8.220 1.00 0.00 H new ATOM 0 HA ALA A 378 7.655 -1.341 -8.208 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.742 -0.665 -9.349 1.00 0.00 H new ATOM 0 HB2 ALA A 378 10.068 -1.654 -7.906 1.00 0.00 H new ATOM 0 HB3 ALA A 378 10.190 -2.378 -9.527 1.00 0.00 H new ATOM 427 N ASP A 379 7.476 -3.138 -10.898 1.00 0.00 N ATOM 428 CA ASP A 379 6.898 -3.214 -12.234 1.00 0.00 C ATOM 429 C ASP A 379 5.415 -3.563 -12.166 1.00 0.00 C ATOM 430 O ASP A 379 4.666 -3.327 -13.114 1.00 0.00 O ATOM 431 CB ASP A 379 7.641 -4.254 -13.075 1.00 0.00 C ATOM 432 CG ASP A 379 7.366 -4.103 -14.558 1.00 0.00 C ATOM 433 OD1 ASP A 379 7.782 -3.078 -15.138 1.00 0.00 O ATOM 434 OD2 ASP A 379 6.734 -5.009 -15.140 1.00 0.00 O ATOM 0 H ASP A 379 7.807 -4.030 -10.530 1.00 0.00 H new ATOM 0 HA ASP A 379 7.001 -2.236 -12.704 1.00 0.00 H new ATOM 0 HB2 ASP A 379 8.712 -4.163 -12.896 1.00 0.00 H new ATOM 0 HB3 ASP A 379 7.348 -5.253 -12.754 1.00 0.00 H new ATOM 439 N PHE A 380 4.996 -4.129 -11.038 1.00 0.00 N ATOM 440 CA PHE A 380 3.603 -4.512 -10.847 1.00 0.00 C ATOM 441 C PHE A 380 2.813 -3.383 -10.190 1.00 0.00 C ATOM 442 O PHE A 380 1.764 -2.973 -10.689 1.00 0.00 O ATOM 443 CB PHE A 380 3.512 -5.777 -9.991 1.00 0.00 C ATOM 444 CG PHE A 380 2.104 -6.232 -9.739 1.00 0.00 C ATOM 445 CD1 PHE A 380 1.249 -6.500 -10.797 1.00 0.00 C ATOM 446 CD2 PHE A 380 1.634 -6.391 -8.445 1.00 0.00 C ATOM 447 CE1 PHE A 380 -0.048 -6.920 -10.569 1.00 0.00 C ATOM 448 CE2 PHE A 380 0.337 -6.811 -8.212 1.00 0.00 C ATOM 449 CZ PHE A 380 -0.504 -7.075 -9.275 1.00 0.00 C ATOM 0 H PHE A 380 5.602 -4.332 -10.243 1.00 0.00 H new ATOM 0 HA PHE A 380 3.170 -4.713 -11.827 1.00 0.00 H new ATOM 0 HB2 PHE A 380 4.062 -6.579 -10.484 1.00 0.00 H new ATOM 0 HB3 PHE A 380 4.003 -5.595 -9.035 1.00 0.00 H new ATOM 0 HD1 PHE A 380 1.600 -6.379 -11.811 1.00 0.00 H new ATOM 0 HD2 PHE A 380 2.287 -6.185 -7.610 1.00 0.00 H new ATOM 0 HE1 PHE A 380 -0.704 -7.127 -11.402 1.00 0.00 H new ATOM 0 HE2 PHE A 380 -0.018 -6.932 -7.199 1.00 0.00 H new ATOM 0 HZ PHE A 380 -1.517 -7.402 -9.094 1.00 0.00 H new ATOM 459 N PHE A 381 3.323 -2.886 -9.069 1.00 0.00 N ATOM 460 CA PHE A 381 2.666 -1.806 -8.343 1.00 0.00 C ATOM 461 C PHE A 381 2.534 -0.563 -9.218 1.00 0.00 C ATOM 462 O PHE A 381 1.670 0.284 -8.988 1.00 0.00 O ATOM 463 CB PHE A 381 3.448 -1.468 -7.071 1.00 0.00 C ATOM 464 CG PHE A 381 3.226 -2.446 -5.954 1.00 0.00 C ATOM 465 CD1 PHE A 381 1.944 -2.748 -5.523 1.00 0.00 C ATOM 466 CD2 PHE A 381 4.300 -3.064 -5.332 1.00 0.00 C ATOM 467 CE1 PHE A 381 1.737 -3.648 -4.495 1.00 0.00 C ATOM 468 CE2 PHE A 381 4.098 -3.964 -4.303 1.00 0.00 C ATOM 469 CZ PHE A 381 2.815 -4.256 -3.883 1.00 0.00 C ATOM 0 H PHE A 381 4.190 -3.214 -8.643 1.00 0.00 H new ATOM 0 HA PHE A 381 1.666 -2.143 -8.068 1.00 0.00 H new ATOM 0 HB2 PHE A 381 4.512 -1.433 -7.306 1.00 0.00 H new ATOM 0 HB3 PHE A 381 3.163 -0.472 -6.733 1.00 0.00 H new ATOM 0 HD1 PHE A 381 1.097 -2.274 -5.996 1.00 0.00 H new ATOM 0 HD2 PHE A 381 5.306 -2.840 -5.655 1.00 0.00 H new ATOM 0 HE1 PHE A 381 0.732 -3.876 -4.170 1.00 0.00 H new ATOM 0 HE2 PHE A 381 4.943 -4.439 -3.827 1.00 0.00 H new ATOM 0 HZ PHE A 381 2.655 -4.958 -3.078 1.00 0.00 H new ATOM 479 N LYS A 382 3.398 -0.460 -10.223 1.00 0.00 N ATOM 480 CA LYS A 382 3.380 0.677 -11.135 1.00 0.00 C ATOM 481 C LYS A 382 2.177 0.606 -12.068 1.00 0.00 C ATOM 482 O LYS A 382 1.870 1.569 -12.772 1.00 0.00 O ATOM 483 CB LYS A 382 4.673 0.721 -11.953 1.00 0.00 C ATOM 484 CG LYS A 382 4.748 -0.348 -13.029 1.00 0.00 C ATOM 485 CD LYS A 382 5.619 0.093 -14.193 1.00 0.00 C ATOM 486 CE LYS A 382 4.871 1.035 -15.124 1.00 0.00 C ATOM 487 NZ LYS A 382 5.801 1.860 -15.943 1.00 0.00 N ATOM 0 H LYS A 382 4.120 -1.151 -10.426 1.00 0.00 H new ATOM 0 HA LYS A 382 3.303 1.587 -10.541 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.765 1.702 -12.420 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.523 0.608 -11.280 1.00 0.00 H new ATOM 0 HG2 LYS A 382 5.148 -1.268 -12.602 1.00 0.00 H new ATOM 0 HG3 LYS A 382 3.744 -0.574 -13.389 1.00 0.00 H new ATOM 0 HD2 LYS A 382 6.512 0.589 -13.813 1.00 0.00 H new ATOM 0 HD3 LYS A 382 5.953 -0.782 -14.751 1.00 0.00 H new ATOM 0 HE2 LYS A 382 4.223 0.456 -15.783 1.00 0.00 H new ATOM 0 HE3 LYS A 382 4.226 1.689 -14.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 5.252 2.488 -16.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 6.402 2.432 -15.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 6.399 1.237 -16.522 1.00 0.00 H new ATOM 501 N GLN A 383 1.499 -0.536 -12.068 1.00 0.00 N ATOM 502 CA GLN A 383 0.328 -0.730 -12.915 1.00 0.00 C ATOM 503 C GLN A 383 -0.652 0.428 -12.763 1.00 0.00 C ATOM 504 O GLN A 383 -0.990 1.100 -13.737 1.00 0.00 O ATOM 505 CB GLN A 383 -0.365 -2.050 -12.570 1.00 0.00 C ATOM 506 CG GLN A 383 0.271 -3.262 -13.230 1.00 0.00 C ATOM 507 CD GLN A 383 -0.571 -4.514 -13.085 1.00 0.00 C ATOM 508 OE1 GLN A 383 -1.526 -4.548 -12.308 1.00 0.00 O ATOM 509 NE2 GLN A 383 -0.221 -5.553 -13.835 1.00 0.00 N ATOM 0 H GLN A 383 1.740 -1.342 -11.491 1.00 0.00 H new ATOM 0 HA GLN A 383 0.663 -0.764 -13.952 1.00 0.00 H new ATOM 0 HB2 GLN A 383 -0.351 -2.186 -11.489 1.00 0.00 H new ATOM 0 HB3 GLN A 383 -1.411 -1.991 -12.870 1.00 0.00 H new ATOM 0 HG2 GLN A 383 0.427 -3.054 -14.289 1.00 0.00 H new ATOM 0 HG3 GLN A 383 1.253 -3.436 -12.791 1.00 0.00 H new ATOM 0 HE21 GLN A 383 0.578 -5.481 -14.465 1.00 0.00 H new ATOM 0 HE22 GLN A 383 -0.751 -6.423 -13.780 1.00 0.00 H new ATOM 518 N CYS A 384 -1.105 0.656 -11.535 1.00 0.00 N ATOM 519 CA CYS A 384 -2.048 1.733 -11.255 1.00 0.00 C ATOM 520 C CYS A 384 -1.492 3.076 -11.716 1.00 0.00 C ATOM 521 O CYS A 384 -1.981 3.664 -12.679 1.00 0.00 O ATOM 522 CB CYS A 384 -2.366 1.785 -9.760 1.00 0.00 C ATOM 523 SG CYS A 384 -3.410 3.179 -9.274 1.00 0.00 S ATOM 0 H CYS A 384 -0.834 0.109 -10.717 1.00 0.00 H new ATOM 0 HA CYS A 384 -2.966 1.531 -11.807 1.00 0.00 H new ATOM 0 HB2 CYS A 384 -2.861 0.857 -9.472 1.00 0.00 H new ATOM 0 HB3 CYS A 384 -1.431 1.834 -9.202 1.00 0.00 H new ATOM 0 HG CYS A 384 -2.990 3.662 -8.142 1.00 0.00 H new ATOM 529 N GLY A 385 -0.466 3.556 -11.020 1.00 0.00 N ATOM 530 CA GLY A 385 0.138 4.828 -11.371 1.00 0.00 C ATOM 531 C GLY A 385 1.649 4.743 -11.477 1.00 0.00 C ATOM 532 O GLY A 385 2.180 3.928 -12.232 1.00 0.00 O ATOM 0 H GLY A 385 -0.042 3.087 -10.220 1.00 0.00 H new ATOM 0 HA2 GLY A 385 -0.271 5.171 -12.321 1.00 0.00 H new ATOM 0 HA3 GLY A 385 -0.129 5.573 -10.621 1.00 0.00 H new ATOM 536 N VAL A 386 2.341 5.587 -10.719 1.00 0.00 N ATOM 537 CA VAL A 386 3.799 5.603 -10.731 1.00 0.00 C ATOM 538 C VAL A 386 4.361 5.472 -9.320 1.00 0.00 C ATOM 539 O VAL A 386 3.937 6.174 -8.402 1.00 0.00 O ATOM 540 CB VAL A 386 4.340 6.897 -11.367 1.00 0.00 C ATOM 541 CG1 VAL A 386 5.853 6.972 -11.223 1.00 0.00 C ATOM 542 CG2 VAL A 386 3.932 6.982 -12.831 1.00 0.00 C ATOM 0 H VAL A 386 1.916 6.268 -10.089 1.00 0.00 H new ATOM 0 HA VAL A 386 4.120 4.750 -11.329 1.00 0.00 H new ATOM 0 HB VAL A 386 3.906 7.748 -10.841 1.00 0.00 H new ATOM 0 HG11 VAL A 386 6.217 7.893 -11.678 1.00 0.00 H new ATOM 0 HG12 VAL A 386 6.119 6.960 -10.166 1.00 0.00 H new ATOM 0 HG13 VAL A 386 6.309 6.116 -11.721 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.323 7.903 -13.265 1.00 0.00 H new ATOM 0 HG22 VAL A 386 4.336 6.126 -13.372 1.00 0.00 H new ATOM 0 HG23 VAL A 386 2.845 6.978 -12.906 1.00 0.00 H new ATOM 552 N VAL A 387 5.320 4.566 -9.153 1.00 0.00 N ATOM 553 CA VAL A 387 5.943 4.342 -7.854 1.00 0.00 C ATOM 554 C VAL A 387 7.064 5.343 -7.602 1.00 0.00 C ATOM 555 O VAL A 387 8.006 5.449 -8.388 1.00 0.00 O ATOM 556 CB VAL A 387 6.510 2.914 -7.742 1.00 0.00 C ATOM 557 CG1 VAL A 387 7.178 2.708 -6.391 1.00 0.00 C ATOM 558 CG2 VAL A 387 5.412 1.886 -7.965 1.00 0.00 C ATOM 0 H VAL A 387 5.682 3.975 -9.902 1.00 0.00 H new ATOM 0 HA VAL A 387 5.165 4.476 -7.103 1.00 0.00 H new ATOM 0 HB VAL A 387 7.265 2.780 -8.517 1.00 0.00 H new ATOM 0 HG11 VAL A 387 7.572 1.694 -6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 387 7.994 3.422 -6.276 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.447 2.861 -5.597 1.00 0.00 H new ATOM 0 HG21 VAL A 387 5.830 0.883 -7.882 1.00 0.00 H new ATOM 0 HG22 VAL A 387 4.633 2.017 -7.214 1.00 0.00 H new ATOM 0 HG23 VAL A 387 4.985 2.020 -8.959 1.00 0.00 H new ATOM 568 N LYS A 388 6.958 6.077 -6.500 1.00 0.00 N ATOM 569 CA LYS A 388 7.963 7.070 -6.141 1.00 0.00 C ATOM 570 C LYS A 388 9.370 6.496 -6.280 1.00 0.00 C ATOM 571 O LYS A 388 9.811 5.702 -5.449 1.00 0.00 O ATOM 572 CB LYS A 388 7.740 7.558 -4.708 1.00 0.00 C ATOM 573 CG LYS A 388 8.579 8.770 -4.340 1.00 0.00 C ATOM 574 CD LYS A 388 7.908 9.605 -3.262 1.00 0.00 C ATOM 575 CE LYS A 388 8.749 10.817 -2.892 1.00 0.00 C ATOM 576 NZ LYS A 388 9.715 10.510 -1.802 1.00 0.00 N ATOM 0 H LYS A 388 6.185 6.003 -5.839 1.00 0.00 H new ATOM 0 HA LYS A 388 7.864 7.913 -6.825 1.00 0.00 H new ATOM 0 HB2 LYS A 388 6.686 7.803 -4.576 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.967 6.746 -4.017 1.00 0.00 H new ATOM 0 HG2 LYS A 388 9.559 8.443 -3.992 1.00 0.00 H new ATOM 0 HG3 LYS A 388 8.744 9.383 -5.226 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.929 9.933 -3.611 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.742 8.992 -2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 388 9.292 11.164 -3.771 1.00 0.00 H new ATOM 0 HE3 LYS A 388 8.095 11.631 -2.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 10.269 11.361 -1.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 9.196 10.203 -0.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 10.356 9.751 -2.110 1.00 0.00 H new ATOM 590 N MET A 389 10.068 6.903 -7.335 1.00 0.00 N ATOM 591 CA MET A 389 11.425 6.430 -7.580 1.00 0.00 C ATOM 592 C MET A 389 12.450 7.492 -7.191 1.00 0.00 C ATOM 593 O MET A 389 12.359 8.641 -7.618 1.00 0.00 O ATOM 594 CB MET A 389 11.599 6.053 -9.053 1.00 0.00 C ATOM 595 CG MET A 389 10.977 4.715 -9.416 1.00 0.00 C ATOM 596 SD MET A 389 11.777 3.938 -10.832 1.00 0.00 S ATOM 597 CE MET A 389 13.396 3.583 -10.155 1.00 0.00 C ATOM 0 H MET A 389 9.717 7.559 -8.033 1.00 0.00 H new ATOM 0 HA MET A 389 11.591 5.546 -6.964 1.00 0.00 H new ATOM 0 HB2 MET A 389 11.154 6.831 -9.673 1.00 0.00 H new ATOM 0 HB3 MET A 389 12.663 6.026 -9.289 1.00 0.00 H new ATOM 0 HG2 MET A 389 11.037 4.046 -8.558 1.00 0.00 H new ATOM 0 HG3 MET A 389 9.919 4.858 -9.635 1.00 0.00 H new ATOM 0 HE1 MET A 389 14.156 4.101 -10.740 1.00 0.00 H new ATOM 0 HE2 MET A 389 13.440 3.922 -9.120 1.00 0.00 H new ATOM 0 HE3 MET A 389 13.579 2.509 -10.193 1.00 0.00 H new ATOM 607 N ASN A 390 13.424 7.097 -6.377 1.00 0.00 N ATOM 608 CA ASN A 390 14.464 8.015 -5.929 1.00 0.00 C ATOM 609 C ASN A 390 15.144 8.688 -7.117 1.00 0.00 C ATOM 610 O ASN A 390 15.284 8.094 -8.187 1.00 0.00 O ATOM 611 CB ASN A 390 15.504 7.271 -5.089 1.00 0.00 C ATOM 612 CG ASN A 390 16.206 8.180 -4.098 1.00 0.00 C ATOM 613 OD1 ASN A 390 16.114 9.404 -4.191 1.00 0.00 O ATOM 614 ND2 ASN A 390 16.912 7.583 -3.145 1.00 0.00 N ATOM 0 H ASN A 390 13.514 6.148 -6.015 1.00 0.00 H new ATOM 0 HA ASN A 390 13.994 8.784 -5.317 1.00 0.00 H new ATOM 0 HB2 ASN A 390 15.017 6.458 -4.550 1.00 0.00 H new ATOM 0 HB3 ASN A 390 16.244 6.818 -5.749 1.00 0.00 H new ATOM 0 HD21 ASN A 390 17.407 8.143 -2.450 1.00 0.00 H new ATOM 0 HD22 ASN A 390 16.959 6.565 -3.107 1.00 0.00 H new ATOM 621 N LYS A 391 15.566 9.934 -6.924 1.00 0.00 N ATOM 622 CA LYS A 391 16.233 10.689 -7.978 1.00 0.00 C ATOM 623 C LYS A 391 17.748 10.566 -7.859 1.00 0.00 C ATOM 624 O LYS A 391 18.481 10.873 -8.800 1.00 0.00 O ATOM 625 CB LYS A 391 15.823 12.162 -7.915 1.00 0.00 C ATOM 626 CG LYS A 391 14.382 12.411 -8.326 1.00 0.00 C ATOM 627 CD LYS A 391 14.240 12.504 -9.835 1.00 0.00 C ATOM 628 CE LYS A 391 12.996 13.283 -10.231 1.00 0.00 C ATOM 629 NZ LYS A 391 11.755 12.485 -10.029 1.00 0.00 N ATOM 0 H LYS A 391 15.457 10.442 -6.046 1.00 0.00 H new ATOM 0 HA LYS A 391 15.927 10.274 -8.938 1.00 0.00 H new ATOM 0 HB2 LYS A 391 15.971 12.528 -6.899 1.00 0.00 H new ATOM 0 HB3 LYS A 391 16.482 12.742 -8.562 1.00 0.00 H new ATOM 0 HG2 LYS A 391 13.751 11.606 -7.949 1.00 0.00 H new ATOM 0 HG3 LYS A 391 14.027 13.335 -7.869 1.00 0.00 H new ATOM 0 HD2 LYS A 391 15.122 12.987 -10.255 1.00 0.00 H new ATOM 0 HD3 LYS A 391 14.193 11.501 -10.260 1.00 0.00 H new ATOM 0 HE2 LYS A 391 12.939 14.199 -9.643 1.00 0.00 H new ATOM 0 HE3 LYS A 391 13.071 13.580 -11.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 10.929 13.051 -10.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 11.798 11.623 -10.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 11.670 12.223 -9.026 1.00 0.00 H new ATOM 643 N ARG A 392 18.212 10.116 -6.698 1.00 0.00 N ATOM 644 CA ARG A 392 19.641 9.953 -6.458 1.00 0.00 C ATOM 645 C ARG A 392 20.073 8.511 -6.708 1.00 0.00 C ATOM 646 O ARG A 392 21.046 8.258 -7.419 1.00 0.00 O ATOM 647 CB ARG A 392 19.987 10.359 -5.024 1.00 0.00 C ATOM 648 CG ARG A 392 21.475 10.298 -4.717 1.00 0.00 C ATOM 649 CD ARG A 392 21.741 10.423 -3.225 1.00 0.00 C ATOM 650 NE ARG A 392 21.652 11.806 -2.766 1.00 0.00 N ATOM 651 CZ ARG A 392 20.513 12.392 -2.414 1.00 0.00 C ATOM 652 NH1 ARG A 392 19.373 11.717 -2.466 1.00 0.00 N ATOM 653 NH2 ARG A 392 20.514 13.655 -2.007 1.00 0.00 N ATOM 0 H ARG A 392 17.619 9.858 -5.909 1.00 0.00 H new ATOM 0 HA ARG A 392 20.178 10.600 -7.152 1.00 0.00 H new ATOM 0 HB2 ARG A 392 19.629 11.373 -4.846 1.00 0.00 H new ATOM 0 HB3 ARG A 392 19.455 9.707 -4.332 1.00 0.00 H new ATOM 0 HG2 ARG A 392 21.885 9.357 -5.083 1.00 0.00 H new ATOM 0 HG3 ARG A 392 21.990 11.098 -5.248 1.00 0.00 H new ATOM 0 HD2 ARG A 392 21.023 9.813 -2.677 1.00 0.00 H new ATOM 0 HD3 ARG A 392 22.732 10.030 -3.000 1.00 0.00 H new ATOM 0 HE ARG A 392 22.512 12.352 -2.713 1.00 0.00 H new ATOM 0 HH11 ARG A 392 19.369 10.746 -2.777 1.00 0.00 H new ATOM 0 HH12 ARG A 392 18.500 12.169 -2.195 1.00 0.00 H new ATOM 0 HH21 ARG A 392 21.390 14.176 -1.964 1.00 0.00 H new ATOM 0 HH22 ARG A 392 19.639 14.104 -1.737 1.00 0.00 H new ATOM 667 N THR A 393 19.343 7.569 -6.118 1.00 0.00 N ATOM 668 CA THR A 393 19.653 6.153 -6.276 1.00 0.00 C ATOM 669 C THR A 393 18.914 5.559 -7.470 1.00 0.00 C ATOM 670 O THR A 393 19.322 4.535 -8.017 1.00 0.00 O ATOM 671 CB THR A 393 19.286 5.355 -5.010 1.00 0.00 C ATOM 672 OG1 THR A 393 17.909 5.566 -4.678 1.00 0.00 O ATOM 673 CG2 THR A 393 20.164 5.764 -3.838 1.00 0.00 C ATOM 0 H THR A 393 18.534 7.761 -5.527 1.00 0.00 H new ATOM 0 HA THR A 393 20.727 6.080 -6.445 1.00 0.00 H new ATOM 0 HB THR A 393 19.451 4.297 -5.215 1.00 0.00 H new ATOM 0 HG1 THR A 393 17.598 4.841 -4.097 1.00 0.00 H new ATOM 0 HG21 THR A 393 19.886 5.187 -2.956 1.00 0.00 H new ATOM 0 HG22 THR A 393 21.209 5.573 -4.082 1.00 0.00 H new ATOM 0 HG23 THR A 393 20.028 6.826 -3.634 1.00 0.00 H new ATOM 681 N GLY A 394 17.825 6.208 -7.870 1.00 0.00 N ATOM 682 CA GLY A 394 17.048 5.729 -8.998 1.00 0.00 C ATOM 683 C GLY A 394 16.319 4.437 -8.691 1.00 0.00 C ATOM 684 O GLY A 394 15.985 3.676 -9.599 1.00 0.00 O ATOM 0 H GLY A 394 17.467 7.057 -7.433 1.00 0.00 H new ATOM 0 HA2 GLY A 394 16.324 6.491 -9.287 1.00 0.00 H new ATOM 0 HA3 GLY A 394 17.708 5.576 -9.852 1.00 0.00 H new ATOM 688 N GLN A 395 16.072 4.187 -7.410 1.00 0.00 N ATOM 689 CA GLN A 395 15.379 2.976 -6.986 1.00 0.00 C ATOM 690 C GLN A 395 13.992 3.303 -6.444 1.00 0.00 C ATOM 691 O GLN A 395 13.738 4.398 -5.941 1.00 0.00 O ATOM 692 CB GLN A 395 16.196 2.241 -5.922 1.00 0.00 C ATOM 693 CG GLN A 395 17.590 1.852 -6.387 1.00 0.00 C ATOM 694 CD GLN A 395 17.575 1.047 -7.670 1.00 0.00 C ATOM 695 OE1 GLN A 395 18.070 1.496 -8.705 1.00 0.00 O ATOM 696 NE2 GLN A 395 17.004 -0.151 -7.612 1.00 0.00 N ATOM 0 H GLN A 395 16.342 4.807 -6.647 1.00 0.00 H new ATOM 0 HA GLN A 395 15.265 2.330 -7.856 1.00 0.00 H new ATOM 0 HB2 GLN A 395 16.280 2.874 -5.039 1.00 0.00 H new ATOM 0 HB3 GLN A 395 15.659 1.342 -5.620 1.00 0.00 H new ATOM 0 HG2 GLN A 395 18.184 2.754 -6.536 1.00 0.00 H new ATOM 0 HG3 GLN A 395 18.081 1.273 -5.605 1.00 0.00 H new ATOM 0 HE21 GLN A 395 16.606 -0.484 -6.734 1.00 0.00 H new ATOM 0 HE22 GLN A 395 16.963 -0.738 -8.446 1.00 0.00 H new ATOM 705 N PRO A 396 13.072 2.332 -6.547 1.00 0.00 N ATOM 706 CA PRO A 396 11.694 2.494 -6.072 1.00 0.00 C ATOM 707 C PRO A 396 11.609 2.548 -4.550 1.00 0.00 C ATOM 708 O PRO A 396 12.405 1.920 -3.853 1.00 0.00 O ATOM 709 CB PRO A 396 10.987 1.245 -6.604 1.00 0.00 C ATOM 710 CG PRO A 396 12.070 0.233 -6.758 1.00 0.00 C ATOM 711 CD PRO A 396 13.305 1.004 -7.136 1.00 0.00 C ATOM 0 HA PRO A 396 11.251 3.429 -6.415 1.00 0.00 H new ATOM 0 HB2 PRO A 396 10.219 0.900 -5.912 1.00 0.00 H new ATOM 0 HB3 PRO A 396 10.493 1.444 -7.555 1.00 0.00 H new ATOM 0 HG2 PRO A 396 12.223 -0.319 -5.831 1.00 0.00 H new ATOM 0 HG3 PRO A 396 11.815 -0.498 -7.526 1.00 0.00 H new ATOM 0 HD2 PRO A 396 14.207 0.540 -6.736 1.00 0.00 H new ATOM 0 HD3 PRO A 396 13.428 1.060 -8.218 1.00 0.00 H new ATOM 719 N MET A 397 10.638 3.301 -4.044 1.00 0.00 N ATOM 720 CA MET A 397 10.449 3.435 -2.604 1.00 0.00 C ATOM 721 C MET A 397 9.670 2.248 -2.046 1.00 0.00 C ATOM 722 O MET A 397 8.801 2.412 -1.189 1.00 0.00 O ATOM 723 CB MET A 397 9.714 4.739 -2.283 1.00 0.00 C ATOM 724 CG MET A 397 10.510 5.986 -2.633 1.00 0.00 C ATOM 725 SD MET A 397 11.546 6.552 -1.270 1.00 0.00 S ATOM 726 CE MET A 397 13.114 6.776 -2.108 1.00 0.00 C ATOM 0 H MET A 397 9.971 3.827 -4.608 1.00 0.00 H new ATOM 0 HA MET A 397 11.432 3.456 -2.134 1.00 0.00 H new ATOM 0 HB2 MET A 397 8.769 4.757 -2.825 1.00 0.00 H new ATOM 0 HB3 MET A 397 9.472 4.758 -1.220 1.00 0.00 H new ATOM 0 HG2 MET A 397 11.137 5.781 -3.500 1.00 0.00 H new ATOM 0 HG3 MET A 397 9.823 6.783 -2.918 1.00 0.00 H new ATOM 0 HE1 MET A 397 13.861 7.125 -1.395 1.00 0.00 H new ATOM 0 HE2 MET A 397 13.437 5.827 -2.536 1.00 0.00 H new ATOM 0 HE3 MET A 397 12.999 7.512 -2.903 1.00 0.00 H new ATOM 736 N ILE A 398 9.986 1.055 -2.537 1.00 0.00 N ATOM 737 CA ILE A 398 9.316 -0.158 -2.085 1.00 0.00 C ATOM 738 C ILE A 398 10.148 -0.890 -1.038 1.00 0.00 C ATOM 739 O ILE A 398 11.370 -0.993 -1.161 1.00 0.00 O ATOM 740 CB ILE A 398 9.033 -1.114 -3.259 1.00 0.00 C ATOM 741 CG1 ILE A 398 8.004 -0.499 -4.211 1.00 0.00 C ATOM 742 CG2 ILE A 398 8.544 -2.458 -2.741 1.00 0.00 C ATOM 743 CD1 ILE A 398 7.841 -1.268 -5.502 1.00 0.00 C ATOM 0 H ILE A 398 10.702 0.902 -3.248 1.00 0.00 H new ATOM 0 HA ILE A 398 8.370 0.151 -1.641 1.00 0.00 H new ATOM 0 HB ILE A 398 9.960 -1.273 -3.810 1.00 0.00 H new ATOM 0 HG12 ILE A 398 7.040 -0.445 -3.705 1.00 0.00 H new ATOM 0 HG13 ILE A 398 8.301 0.524 -4.442 1.00 0.00 H new ATOM 0 HG21 ILE A 398 8.348 -3.123 -3.582 1.00 0.00 H new ATOM 0 HG22 ILE A 398 9.306 -2.900 -2.099 1.00 0.00 H new ATOM 0 HG23 ILE A 398 7.627 -2.316 -2.170 1.00 0.00 H new ATOM 0 HD11 ILE A 398 7.097 -0.775 -6.128 1.00 0.00 H new ATOM 0 HD12 ILE A 398 8.794 -1.300 -6.029 1.00 0.00 H new ATOM 0 HD13 ILE A 398 7.514 -2.284 -5.281 1.00 0.00 H new ATOM 755 N HIS A 399 9.481 -1.398 -0.008 1.00 0.00 N ATOM 756 CA HIS A 399 10.158 -2.123 1.061 1.00 0.00 C ATOM 757 C HIS A 399 9.687 -3.573 1.119 1.00 0.00 C ATOM 758 O HIS A 399 8.507 -3.859 0.917 1.00 0.00 O ATOM 759 CB HIS A 399 9.910 -1.440 2.406 1.00 0.00 C ATOM 760 CG HIS A 399 11.032 -1.617 3.383 1.00 0.00 C ATOM 761 ND1 HIS A 399 12.301 -1.122 3.170 1.00 0.00 N ATOM 762 CD2 HIS A 399 11.069 -2.236 4.586 1.00 0.00 C ATOM 763 CE1 HIS A 399 13.071 -1.430 4.197 1.00 0.00 C ATOM 764 NE2 HIS A 399 12.347 -2.106 5.071 1.00 0.00 N ATOM 0 H HIS A 399 8.471 -1.321 0.110 1.00 0.00 H new ATOM 0 HA HIS A 399 11.227 -2.116 0.850 1.00 0.00 H new ATOM 0 HB2 HIS A 399 9.749 -0.375 2.239 1.00 0.00 H new ATOM 0 HB3 HIS A 399 8.993 -1.837 2.842 1.00 0.00 H new ATOM 0 HD2 HIS A 399 10.247 -2.738 5.074 1.00 0.00 H new ATOM 0 HE1 HIS A 399 14.115 -1.173 4.304 1.00 0.00 H new ATOM 0 HE2 HIS A 399 12.683 -2.472 5.962 1.00 0.00 H new ATOM 772 N ILE A 400 10.616 -4.482 1.393 1.00 0.00 N ATOM 773 CA ILE A 400 10.295 -5.901 1.478 1.00 0.00 C ATOM 774 C ILE A 400 10.939 -6.540 2.703 1.00 0.00 C ATOM 775 O ILE A 400 12.102 -6.945 2.666 1.00 0.00 O ATOM 776 CB ILE A 400 10.753 -6.658 0.217 1.00 0.00 C ATOM 777 CG1 ILE A 400 10.017 -6.132 -1.017 1.00 0.00 C ATOM 778 CG2 ILE A 400 10.520 -8.152 0.382 1.00 0.00 C ATOM 779 CD1 ILE A 400 10.446 -6.797 -2.306 1.00 0.00 C ATOM 0 H ILE A 400 11.598 -4.261 1.560 1.00 0.00 H new ATOM 0 HA ILE A 400 9.211 -5.974 1.563 1.00 0.00 H new ATOM 0 HB ILE A 400 11.821 -6.489 0.079 1.00 0.00 H new ATOM 0 HG12 ILE A 400 8.946 -6.279 -0.881 1.00 0.00 H new ATOM 0 HG13 ILE A 400 10.184 -5.058 -1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 400 10.849 -8.673 -0.517 1.00 0.00 H new ATOM 0 HG22 ILE A 400 11.086 -8.516 1.240 1.00 0.00 H new ATOM 0 HG23 ILE A 400 9.458 -8.339 0.542 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.883 -6.375 -3.138 1.00 0.00 H new ATOM 0 HD12 ILE A 400 11.511 -6.628 -2.466 1.00 0.00 H new ATOM 0 HD13 ILE A 400 10.254 -7.868 -2.244 1.00 0.00 H new ATOM 791 N TYR A 401 10.177 -6.628 3.787 1.00 0.00 N ATOM 792 CA TYR A 401 10.673 -7.216 5.025 1.00 0.00 C ATOM 793 C TYR A 401 11.030 -8.686 4.824 1.00 0.00 C ATOM 794 O TYR A 401 10.203 -9.483 4.378 1.00 0.00 O ATOM 795 CB TYR A 401 9.629 -7.081 6.135 1.00 0.00 C ATOM 796 CG TYR A 401 8.967 -5.722 6.180 1.00 0.00 C ATOM 797 CD1 TYR A 401 7.913 -5.412 5.330 1.00 0.00 C ATOM 798 CD2 TYR A 401 9.399 -4.747 7.071 1.00 0.00 C ATOM 799 CE1 TYR A 401 7.306 -4.172 5.368 1.00 0.00 C ATOM 800 CE2 TYR A 401 8.797 -3.504 7.116 1.00 0.00 C ATOM 801 CZ TYR A 401 7.750 -3.222 6.263 1.00 0.00 C ATOM 802 OH TYR A 401 7.149 -1.984 6.304 1.00 0.00 O ATOM 0 H TYR A 401 9.213 -6.299 3.833 1.00 0.00 H new ATOM 0 HA TYR A 401 11.574 -6.677 5.317 1.00 0.00 H new ATOM 0 HB2 TYR A 401 8.863 -7.845 5.997 1.00 0.00 H new ATOM 0 HB3 TYR A 401 10.105 -7.276 7.096 1.00 0.00 H new ATOM 0 HD1 TYR A 401 7.562 -6.153 4.627 1.00 0.00 H new ATOM 0 HD2 TYR A 401 10.219 -4.964 7.739 1.00 0.00 H new ATOM 0 HE1 TYR A 401 6.488 -3.948 4.700 1.00 0.00 H new ATOM 0 HE2 TYR A 401 9.144 -2.757 7.815 1.00 0.00 H new ATOM 0 HH TYR A 401 7.581 -1.433 6.990 1.00 0.00 H new ATOM 812 N LEU A 402 12.267 -9.039 5.158 1.00 0.00 N ATOM 813 CA LEU A 402 12.736 -10.413 5.016 1.00 0.00 C ATOM 814 C LEU A 402 12.950 -11.059 6.381 1.00 0.00 C ATOM 815 O LEU A 402 13.525 -10.450 7.284 1.00 0.00 O ATOM 816 CB LEU A 402 14.036 -10.448 4.212 1.00 0.00 C ATOM 817 CG LEU A 402 14.027 -9.685 2.887 1.00 0.00 C ATOM 818 CD1 LEU A 402 15.396 -9.746 2.227 1.00 0.00 C ATOM 819 CD2 LEU A 402 12.960 -10.243 1.958 1.00 0.00 C ATOM 0 H LEU A 402 12.963 -8.392 5.529 1.00 0.00 H new ATOM 0 HA LEU A 402 11.972 -10.979 4.483 1.00 0.00 H new ATOM 0 HB2 LEU A 402 14.835 -10.046 4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 402 14.285 -11.489 4.007 1.00 0.00 H new ATOM 0 HG LEU A 402 13.791 -8.641 3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 402 15.371 -9.198 1.285 1.00 0.00 H new ATOM 0 HD12 LEU A 402 16.139 -9.299 2.888 1.00 0.00 H new ATOM 0 HD13 LEU A 402 15.661 -10.786 2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 402 12.968 -9.688 1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 402 13.165 -11.295 1.759 1.00 0.00 H new ATOM 0 HD23 LEU A 402 11.981 -10.147 2.428 1.00 0.00 H new ATOM 831 N ASP A 403 12.486 -12.296 6.524 1.00 0.00 N ATOM 832 CA ASP A 403 12.630 -13.026 7.778 1.00 0.00 C ATOM 833 C ASP A 403 14.094 -13.093 8.203 1.00 0.00 C ATOM 834 O ASP A 403 14.955 -13.521 7.435 1.00 0.00 O ATOM 835 CB ASP A 403 12.062 -14.439 7.639 1.00 0.00 C ATOM 836 CG ASP A 403 11.609 -15.014 8.966 1.00 0.00 C ATOM 837 OD1 ASP A 403 10.874 -14.317 9.697 1.00 0.00 O ATOM 838 OD2 ASP A 403 11.990 -16.163 9.275 1.00 0.00 O ATOM 0 H ASP A 403 12.007 -12.814 5.787 1.00 0.00 H new ATOM 0 HA ASP A 403 12.071 -12.492 8.546 1.00 0.00 H new ATOM 0 HB2 ASP A 403 11.220 -14.422 6.947 1.00 0.00 H new ATOM 0 HB3 ASP A 403 12.819 -15.091 7.204 1.00 0.00 H new ATOM 843 N LYS A 404 14.368 -12.666 9.431 1.00 0.00 N ATOM 844 CA LYS A 404 15.727 -12.678 9.959 1.00 0.00 C ATOM 845 C LYS A 404 16.156 -14.094 10.329 1.00 0.00 C ATOM 846 O LYS A 404 17.281 -14.316 10.774 1.00 0.00 O ATOM 847 CB LYS A 404 15.827 -11.767 11.185 1.00 0.00 C ATOM 848 CG LYS A 404 14.907 -12.175 12.322 1.00 0.00 C ATOM 849 CD LYS A 404 14.848 -11.107 13.401 1.00 0.00 C ATOM 850 CE LYS A 404 13.873 -9.998 13.036 1.00 0.00 C ATOM 851 NZ LYS A 404 12.470 -10.492 12.971 1.00 0.00 N ATOM 0 H LYS A 404 13.667 -12.307 10.079 1.00 0.00 H new ATOM 0 HA LYS A 404 16.395 -12.307 9.182 1.00 0.00 H new ATOM 0 HB2 LYS A 404 16.856 -11.766 11.544 1.00 0.00 H new ATOM 0 HB3 LYS A 404 15.592 -10.745 10.888 1.00 0.00 H new ATOM 0 HG2 LYS A 404 13.905 -12.357 11.933 1.00 0.00 H new ATOM 0 HG3 LYS A 404 15.256 -13.112 12.755 1.00 0.00 H new ATOM 0 HD2 LYS A 404 14.548 -11.560 14.346 1.00 0.00 H new ATOM 0 HD3 LYS A 404 15.842 -10.684 13.551 1.00 0.00 H new ATOM 0 HE2 LYS A 404 13.942 -9.197 13.772 1.00 0.00 H new ATOM 0 HE3 LYS A 404 14.153 -9.571 12.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 11.816 -9.702 13.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 12.287 -10.894 12.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 12.326 -11.225 13.695 1.00 0.00 H new ATOM 865 N GLU A 405 15.250 -15.050 10.140 1.00 0.00 N ATOM 866 CA GLU A 405 15.536 -16.445 10.454 1.00 0.00 C ATOM 867 C GLU A 405 16.049 -17.186 9.221 1.00 0.00 C ATOM 868 O GLU A 405 16.836 -18.126 9.331 1.00 0.00 O ATOM 869 CB GLU A 405 14.282 -17.137 10.993 1.00 0.00 C ATOM 870 CG GLU A 405 13.495 -16.289 11.978 1.00 0.00 C ATOM 871 CD GLU A 405 12.692 -17.124 12.956 1.00 0.00 C ATOM 872 OE1 GLU A 405 13.311 -17.787 13.815 1.00 0.00 O ATOM 873 OE2 GLU A 405 11.448 -17.116 12.863 1.00 0.00 O ATOM 0 H GLU A 405 14.314 -14.884 9.772 1.00 0.00 H new ATOM 0 HA GLU A 405 16.312 -16.467 11.219 1.00 0.00 H new ATOM 0 HB2 GLU A 405 13.635 -17.402 10.156 1.00 0.00 H new ATOM 0 HB3 GLU A 405 14.572 -18.069 11.479 1.00 0.00 H new ATOM 0 HG2 GLU A 405 14.183 -15.650 12.531 1.00 0.00 H new ATOM 0 HG3 GLU A 405 12.821 -15.632 11.428 1.00 0.00 H new ATOM 880 N THR A 406 15.597 -16.755 8.048 1.00 0.00 N ATOM 881 CA THR A 406 16.006 -17.376 6.795 1.00 0.00 C ATOM 882 C THR A 406 16.522 -16.335 5.808 1.00 0.00 C ATOM 883 O THR A 406 17.455 -16.593 5.051 1.00 0.00 O ATOM 884 CB THR A 406 14.845 -18.152 6.146 1.00 0.00 C ATOM 885 OG1 THR A 406 13.827 -17.241 5.717 1.00 0.00 O ATOM 886 CG2 THR A 406 14.253 -19.157 7.123 1.00 0.00 C ATOM 0 H THR A 406 14.946 -15.977 7.940 1.00 0.00 H new ATOM 0 HA THR A 406 16.808 -18.073 7.036 1.00 0.00 H new ATOM 0 HB THR A 406 15.235 -18.693 5.284 1.00 0.00 H new ATOM 0 HG1 THR A 406 13.208 -17.070 6.457 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.435 -19.693 6.642 1.00 0.00 H new ATOM 0 HG22 THR A 406 15.023 -19.866 7.426 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.877 -18.632 8.001 1.00 0.00 H new ATOM 894 N GLY A 407 15.906 -15.157 5.823 1.00 0.00 N ATOM 895 CA GLY A 407 16.317 -14.094 4.923 1.00 0.00 C ATOM 896 C GLY A 407 15.357 -13.912 3.765 1.00 0.00 C ATOM 897 O GLY A 407 15.503 -12.983 2.968 1.00 0.00 O ATOM 0 H GLY A 407 15.130 -14.919 6.441 1.00 0.00 H new ATOM 0 HA2 GLY A 407 16.392 -13.160 5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 407 17.312 -14.315 4.535 1.00 0.00 H new ATOM 901 N LYS A 408 14.374 -14.800 3.667 1.00 0.00 N ATOM 902 CA LYS A 408 13.386 -14.734 2.596 1.00 0.00 C ATOM 903 C LYS A 408 12.275 -13.746 2.942 1.00 0.00 C ATOM 904 O LYS A 408 11.973 -13.499 4.109 1.00 0.00 O ATOM 905 CB LYS A 408 12.790 -16.120 2.339 1.00 0.00 C ATOM 906 CG LYS A 408 11.940 -16.639 3.486 1.00 0.00 C ATOM 907 CD LYS A 408 11.985 -18.154 3.572 1.00 0.00 C ATOM 908 CE LYS A 408 10.813 -18.703 4.371 1.00 0.00 C ATOM 909 NZ LYS A 408 10.595 -17.940 5.631 1.00 0.00 N ATOM 0 H LYS A 408 14.240 -15.575 4.317 1.00 0.00 H new ATOM 0 HA LYS A 408 13.887 -14.388 1.692 1.00 0.00 H new ATOM 0 HB2 LYS A 408 12.182 -16.083 1.435 1.00 0.00 H new ATOM 0 HB3 LYS A 408 13.600 -16.825 2.150 1.00 0.00 H new ATOM 0 HG2 LYS A 408 12.292 -16.210 4.424 1.00 0.00 H new ATOM 0 HG3 LYS A 408 10.909 -16.312 3.353 1.00 0.00 H new ATOM 0 HD2 LYS A 408 11.972 -18.577 2.567 1.00 0.00 H new ATOM 0 HD3 LYS A 408 12.921 -18.465 4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 408 9.909 -18.665 3.763 1.00 0.00 H new ATOM 0 HE3 LYS A 408 10.994 -19.751 4.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 9.810 -18.366 6.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 11.460 -17.968 6.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 10.363 -16.952 5.403 1.00 0.00 H new ATOM 923 N PRO A 409 11.651 -13.170 1.904 1.00 0.00 N ATOM 924 CA PRO A 409 10.562 -12.203 2.073 1.00 0.00 C ATOM 925 C PRO A 409 9.289 -12.851 2.606 1.00 0.00 C ATOM 926 O PRO A 409 8.488 -13.390 1.841 1.00 0.00 O ATOM 927 CB PRO A 409 10.339 -11.669 0.656 1.00 0.00 C ATOM 928 CG PRO A 409 10.819 -12.759 -0.240 1.00 0.00 C ATOM 929 CD PRO A 409 11.960 -13.419 0.486 1.00 0.00 C ATOM 0 HA PRO A 409 10.812 -11.430 2.800 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.287 -11.445 0.478 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.894 -10.746 0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 409 10.022 -13.474 -0.447 1.00 0.00 H new ATOM 0 HG3 PRO A 409 11.146 -12.360 -1.200 1.00 0.00 H new ATOM 0 HD2 PRO A 409 12.012 -14.486 0.267 1.00 0.00 H new ATOM 0 HD3 PRO A 409 12.920 -12.988 0.202 1.00 0.00 H new ATOM 937 N LYS A 410 9.106 -12.794 3.920 1.00 0.00 N ATOM 938 CA LYS A 410 7.929 -13.373 4.556 1.00 0.00 C ATOM 939 C LYS A 410 6.712 -13.271 3.642 1.00 0.00 C ATOM 940 O LYS A 410 6.028 -14.262 3.390 1.00 0.00 O ATOM 941 CB LYS A 410 7.643 -12.669 5.884 1.00 0.00 C ATOM 942 CG LYS A 410 7.875 -11.170 5.840 1.00 0.00 C ATOM 943 CD LYS A 410 8.166 -10.610 7.223 1.00 0.00 C ATOM 944 CE LYS A 410 6.926 -10.626 8.103 1.00 0.00 C ATOM 945 NZ LYS A 410 7.178 -9.992 9.427 1.00 0.00 N ATOM 0 H LYS A 410 9.759 -12.352 4.567 1.00 0.00 H new ATOM 0 HA LYS A 410 8.131 -14.427 4.747 1.00 0.00 H new ATOM 0 HB2 LYS A 410 6.609 -12.860 6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 410 8.274 -13.103 6.659 1.00 0.00 H new ATOM 0 HG2 LYS A 410 8.709 -10.949 5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 410 6.996 -10.677 5.424 1.00 0.00 H new ATOM 0 HD2 LYS A 410 8.956 -11.195 7.695 1.00 0.00 H new ATOM 0 HD3 LYS A 410 8.536 -9.589 7.133 1.00 0.00 H new ATOM 0 HE2 LYS A 410 6.115 -10.102 7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 410 6.598 -11.655 8.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 410 6.309 -10.023 9.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 410 7.935 -10.508 9.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 410 7.467 -9.002 9.289 1.00 0.00 H new ATOM 959 N GLY A 411 6.449 -12.065 3.148 1.00 0.00 N ATOM 960 CA GLY A 411 5.314 -11.856 2.266 1.00 0.00 C ATOM 961 C GLY A 411 4.757 -10.449 2.361 1.00 0.00 C ATOM 962 O GLY A 411 3.946 -10.038 1.531 1.00 0.00 O ATOM 0 H GLY A 411 7.001 -11.229 3.342 1.00 0.00 H new ATOM 0 HA2 GLY A 411 5.615 -12.055 1.238 1.00 0.00 H new ATOM 0 HA3 GLY A 411 4.530 -12.571 2.513 1.00 0.00 H new ATOM 966 N ASP A 412 5.189 -9.711 3.377 1.00 0.00 N ATOM 967 CA ASP A 412 4.728 -8.343 3.580 1.00 0.00 C ATOM 968 C ASP A 412 5.642 -7.350 2.869 1.00 0.00 C ATOM 969 O ASP A 412 6.800 -7.655 2.579 1.00 0.00 O ATOM 970 CB ASP A 412 4.665 -8.018 5.072 1.00 0.00 C ATOM 971 CG ASP A 412 6.025 -8.098 5.740 1.00 0.00 C ATOM 972 OD1 ASP A 412 6.990 -8.521 5.070 1.00 0.00 O ATOM 973 OD2 ASP A 412 6.122 -7.737 6.932 1.00 0.00 O ATOM 0 H ASP A 412 5.859 -10.038 4.074 1.00 0.00 H new ATOM 0 HA ASP A 412 3.728 -8.257 3.156 1.00 0.00 H new ATOM 0 HB2 ASP A 412 4.256 -7.017 5.206 1.00 0.00 H new ATOM 0 HB3 ASP A 412 3.981 -8.710 5.563 1.00 0.00 H new ATOM 978 N ALA A 413 5.116 -6.163 2.588 1.00 0.00 N ATOM 979 CA ALA A 413 5.885 -5.126 1.912 1.00 0.00 C ATOM 980 C ALA A 413 5.148 -3.791 1.939 1.00 0.00 C ATOM 981 O ALA A 413 3.993 -3.714 2.361 1.00 0.00 O ATOM 982 CB ALA A 413 6.180 -5.539 0.477 1.00 0.00 C ATOM 0 H ALA A 413 4.159 -5.895 2.818 1.00 0.00 H new ATOM 0 HA ALA A 413 6.828 -5.002 2.444 1.00 0.00 H new ATOM 0 HB1 ALA A 413 6.755 -4.755 -0.016 1.00 0.00 H new ATOM 0 HB2 ALA A 413 6.754 -6.466 0.476 1.00 0.00 H new ATOM 0 HB3 ALA A 413 5.243 -5.692 -0.058 1.00 0.00 H new ATOM 988 N THR A 414 5.822 -2.739 1.485 1.00 0.00 N ATOM 989 CA THR A 414 5.233 -1.406 1.459 1.00 0.00 C ATOM 990 C THR A 414 5.648 -0.645 0.205 1.00 0.00 C ATOM 991 O THR A 414 6.813 -0.673 -0.193 1.00 0.00 O ATOM 992 CB THR A 414 5.638 -0.588 2.700 1.00 0.00 C ATOM 993 OG1 THR A 414 6.940 -0.987 3.145 1.00 0.00 O ATOM 994 CG2 THR A 414 4.631 -0.778 3.824 1.00 0.00 C ATOM 0 H THR A 414 6.777 -2.785 1.130 1.00 0.00 H new ATOM 0 HA THR A 414 4.151 -1.539 1.458 1.00 0.00 H new ATOM 0 HB THR A 414 5.656 0.466 2.425 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.898 -1.245 4.089 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.937 -0.191 4.690 1.00 0.00 H new ATOM 0 HG22 THR A 414 3.647 -0.447 3.491 1.00 0.00 H new ATOM 0 HG23 THR A 414 4.586 -1.832 4.098 1.00 0.00 H new ATOM 1002 N VAL A 415 4.688 0.034 -0.415 1.00 0.00 N ATOM 1003 CA VAL A 415 4.955 0.804 -1.623 1.00 0.00 C ATOM 1004 C VAL A 415 4.608 2.275 -1.425 1.00 0.00 C ATOM 1005 O VAL A 415 3.501 2.612 -1.004 1.00 0.00 O ATOM 1006 CB VAL A 415 4.160 0.257 -2.824 1.00 0.00 C ATOM 1007 CG1 VAL A 415 4.540 0.998 -4.098 1.00 0.00 C ATOM 1008 CG2 VAL A 415 4.389 -1.239 -2.978 1.00 0.00 C ATOM 0 H VAL A 415 3.718 0.066 -0.100 1.00 0.00 H new ATOM 0 HA VAL A 415 6.021 0.710 -1.829 1.00 0.00 H new ATOM 0 HB VAL A 415 3.098 0.421 -2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 415 3.969 0.598 -4.936 1.00 0.00 H new ATOM 0 HG12 VAL A 415 4.319 2.059 -3.981 1.00 0.00 H new ATOM 0 HG13 VAL A 415 5.605 0.868 -4.290 1.00 0.00 H new ATOM 0 HG21 VAL A 415 3.820 -1.608 -3.831 1.00 0.00 H new ATOM 0 HG22 VAL A 415 5.450 -1.430 -3.140 1.00 0.00 H new ATOM 0 HG23 VAL A 415 4.062 -1.752 -2.074 1.00 0.00 H new ATOM 1018 N SER A 416 5.561 3.149 -1.733 1.00 0.00 N ATOM 1019 CA SER A 416 5.358 4.585 -1.586 1.00 0.00 C ATOM 1020 C SER A 416 5.086 5.237 -2.938 1.00 0.00 C ATOM 1021 O SER A 416 5.971 5.316 -3.791 1.00 0.00 O ATOM 1022 CB SER A 416 6.582 5.231 -0.933 1.00 0.00 C ATOM 1023 OG SER A 416 6.508 5.150 0.480 1.00 0.00 O ATOM 0 H SER A 416 6.481 2.887 -2.086 1.00 0.00 H new ATOM 0 HA SER A 416 4.489 4.740 -0.946 1.00 0.00 H new ATOM 0 HB2 SER A 416 7.488 4.736 -1.282 1.00 0.00 H new ATOM 0 HB3 SER A 416 6.652 6.275 -1.237 1.00 0.00 H new ATOM 0 HG SER A 416 7.302 5.568 0.874 1.00 0.00 H new ATOM 1029 N TYR A 417 3.856 5.703 -3.127 1.00 0.00 N ATOM 1030 CA TYR A 417 3.466 6.346 -4.376 1.00 0.00 C ATOM 1031 C TYR A 417 3.777 7.839 -4.341 1.00 0.00 C ATOM 1032 O TYR A 417 3.897 8.433 -3.270 1.00 0.00 O ATOM 1033 CB TYR A 417 1.975 6.131 -4.641 1.00 0.00 C ATOM 1034 CG TYR A 417 1.633 4.719 -5.064 1.00 0.00 C ATOM 1035 CD1 TYR A 417 1.926 4.266 -6.344 1.00 0.00 C ATOM 1036 CD2 TYR A 417 1.019 3.839 -4.181 1.00 0.00 C ATOM 1037 CE1 TYR A 417 1.614 2.978 -6.734 1.00 0.00 C ATOM 1038 CE2 TYR A 417 0.705 2.548 -4.562 1.00 0.00 C ATOM 1039 CZ TYR A 417 1.005 2.123 -5.839 1.00 0.00 C ATOM 1040 OH TYR A 417 0.693 0.839 -6.224 1.00 0.00 O ATOM 0 H TYR A 417 3.112 5.647 -2.431 1.00 0.00 H new ATOM 0 HA TYR A 417 4.041 5.892 -5.183 1.00 0.00 H new ATOM 0 HB2 TYR A 417 1.415 6.377 -3.739 1.00 0.00 H new ATOM 0 HB3 TYR A 417 1.649 6.823 -5.417 1.00 0.00 H new ATOM 0 HD1 TYR A 417 2.406 4.932 -7.046 1.00 0.00 H new ATOM 0 HD2 TYR A 417 0.783 4.169 -3.180 1.00 0.00 H new ATOM 0 HE1 TYR A 417 1.846 2.642 -7.734 1.00 0.00 H new ATOM 0 HE2 TYR A 417 0.228 1.876 -3.864 1.00 0.00 H new ATOM 0 HH TYR A 417 1.023 0.681 -7.133 1.00 0.00 H new ATOM 1050 N GLU A 418 3.906 8.439 -5.520 1.00 0.00 N ATOM 1051 CA GLU A 418 4.202 9.862 -5.625 1.00 0.00 C ATOM 1052 C GLU A 418 3.201 10.688 -4.822 1.00 0.00 C ATOM 1053 O GLU A 418 3.559 11.329 -3.834 1.00 0.00 O ATOM 1054 CB GLU A 418 4.185 10.304 -7.089 1.00 0.00 C ATOM 1055 CG GLU A 418 4.831 9.304 -8.034 1.00 0.00 C ATOM 1056 CD GLU A 418 5.427 9.963 -9.262 1.00 0.00 C ATOM 1057 OE1 GLU A 418 6.263 10.877 -9.099 1.00 0.00 O ATOM 1058 OE2 GLU A 418 5.057 9.567 -10.387 1.00 0.00 O ATOM 0 H GLU A 418 3.810 7.961 -6.416 1.00 0.00 H new ATOM 0 HA GLU A 418 5.198 10.029 -5.214 1.00 0.00 H new ATOM 0 HB2 GLU A 418 3.153 10.469 -7.398 1.00 0.00 H new ATOM 0 HB3 GLU A 418 4.701 11.260 -7.177 1.00 0.00 H new ATOM 0 HG2 GLU A 418 5.612 8.760 -7.503 1.00 0.00 H new ATOM 0 HG3 GLU A 418 4.087 8.571 -8.345 1.00 0.00 H new ATOM 1065 N ASP A 419 1.945 10.665 -5.254 1.00 0.00 N ATOM 1066 CA ASP A 419 0.890 11.411 -4.576 1.00 0.00 C ATOM 1067 C ASP A 419 -0.121 10.463 -3.938 1.00 0.00 C ATOM 1068 O ASP A 419 -0.279 9.314 -4.351 1.00 0.00 O ATOM 1069 CB ASP A 419 0.181 12.343 -5.560 1.00 0.00 C ATOM 1070 CG ASP A 419 1.141 12.980 -6.547 1.00 0.00 C ATOM 1071 OD1 ASP A 419 2.205 13.465 -6.111 1.00 0.00 O ATOM 1072 OD2 ASP A 419 0.826 12.994 -7.756 1.00 0.00 O ATOM 0 H ASP A 419 1.632 10.139 -6.070 1.00 0.00 H new ATOM 0 HA ASP A 419 1.350 12.008 -3.789 1.00 0.00 H new ATOM 0 HB2 ASP A 419 -0.578 11.782 -6.106 1.00 0.00 H new ATOM 0 HB3 ASP A 419 -0.338 13.125 -5.006 1.00 0.00 H new ATOM 1077 N PRO A 420 -0.820 10.953 -2.904 1.00 0.00 N ATOM 1078 CA PRO A 420 -1.828 10.166 -2.185 1.00 0.00 C ATOM 1079 C PRO A 420 -2.923 9.645 -3.109 1.00 0.00 C ATOM 1080 O PRO A 420 -3.349 8.492 -3.017 1.00 0.00 O ATOM 1081 CB PRO A 420 -2.406 11.164 -1.179 1.00 0.00 C ATOM 1082 CG PRO A 420 -1.362 12.218 -1.048 1.00 0.00 C ATOM 1083 CD PRO A 420 -0.684 12.313 -2.357 1.00 0.00 C ATOM 0 HA PRO A 420 -1.399 9.277 -1.724 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -3.348 11.582 -1.533 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -2.609 10.687 -0.220 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -1.810 13.173 -0.774 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -0.651 11.962 -0.262 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -1.155 13.055 -3.002 1.00 0.00 H new ATOM 0 HD3 PRO A 420 0.362 12.601 -2.249 1.00 0.00 H new ATOM 1091 N PRO A 421 -3.391 10.510 -4.020 1.00 0.00 N ATOM 1092 CA PRO A 421 -4.442 10.158 -4.979 1.00 0.00 C ATOM 1093 C PRO A 421 -4.144 8.856 -5.715 1.00 0.00 C ATOM 1094 O PRO A 421 -5.057 8.153 -6.151 1.00 0.00 O ATOM 1095 CB PRO A 421 -4.442 11.337 -5.955 1.00 0.00 C ATOM 1096 CG PRO A 421 -3.890 12.477 -5.172 1.00 0.00 C ATOM 1097 CD PRO A 421 -2.930 11.898 -4.185 1.00 0.00 C ATOM 0 HA PRO A 421 -5.402 9.993 -4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 421 -3.829 11.125 -6.831 1.00 0.00 H new ATOM 0 HB3 PRO A 421 -5.448 11.554 -6.314 1.00 0.00 H new ATOM 0 HG2 PRO A 421 -3.388 13.189 -5.827 1.00 0.00 H new ATOM 0 HG3 PRO A 421 -4.687 13.019 -4.664 1.00 0.00 H new ATOM 0 HD2 PRO A 421 -1.905 11.938 -4.553 1.00 0.00 H new ATOM 0 HD3 PRO A 421 -2.951 12.441 -3.240 1.00 0.00 H new ATOM 1105 N THR A 422 -2.860 8.539 -5.850 1.00 0.00 N ATOM 1106 CA THR A 422 -2.441 7.323 -6.535 1.00 0.00 C ATOM 1107 C THR A 422 -2.355 6.148 -5.566 1.00 0.00 C ATOM 1108 O THR A 422 -2.642 5.009 -5.930 1.00 0.00 O ATOM 1109 CB THR A 422 -1.075 7.506 -7.222 1.00 0.00 C ATOM 1110 OG1 THR A 422 -1.116 8.639 -8.098 1.00 0.00 O ATOM 1111 CG2 THR A 422 -0.694 6.262 -8.010 1.00 0.00 C ATOM 0 H THR A 422 -2.092 9.108 -5.494 1.00 0.00 H new ATOM 0 HA THR A 422 -3.195 7.112 -7.293 1.00 0.00 H new ATOM 0 HB THR A 422 -0.323 7.671 -6.450 1.00 0.00 H new ATOM 0 HG1 THR A 422 -0.243 8.750 -8.530 1.00 0.00 H new ATOM 0 HG21 THR A 422 0.274 6.415 -8.486 1.00 0.00 H new ATOM 0 HG22 THR A 422 -0.635 5.408 -7.335 1.00 0.00 H new ATOM 0 HG23 THR A 422 -1.448 6.070 -8.774 1.00 0.00 H new ATOM 1119 N ALA A 423 -1.961 6.436 -4.329 1.00 0.00 N ATOM 1120 CA ALA A 423 -1.841 5.404 -3.307 1.00 0.00 C ATOM 1121 C ALA A 423 -3.200 4.795 -2.979 1.00 0.00 C ATOM 1122 O ALA A 423 -3.361 3.575 -2.973 1.00 0.00 O ATOM 1123 CB ALA A 423 -1.200 5.976 -2.052 1.00 0.00 C ATOM 0 H ALA A 423 -1.720 7.375 -4.011 1.00 0.00 H new ATOM 0 HA ALA A 423 -1.203 4.612 -3.699 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -1.117 5.194 -1.297 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.207 6.356 -2.292 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.816 6.788 -1.666 1.00 0.00 H new ATOM 1129 N LYS A 424 -4.176 5.653 -2.703 1.00 0.00 N ATOM 1130 CA LYS A 424 -5.523 5.201 -2.374 1.00 0.00 C ATOM 1131 C LYS A 424 -6.131 4.415 -3.532 1.00 0.00 C ATOM 1132 O LYS A 424 -6.802 3.404 -3.322 1.00 0.00 O ATOM 1133 CB LYS A 424 -6.415 6.396 -2.032 1.00 0.00 C ATOM 1134 CG LYS A 424 -5.902 7.224 -0.866 1.00 0.00 C ATOM 1135 CD LYS A 424 -6.504 8.619 -0.865 1.00 0.00 C ATOM 1136 CE LYS A 424 -6.467 9.242 0.522 1.00 0.00 C ATOM 1137 NZ LYS A 424 -5.184 9.954 0.777 1.00 0.00 N ATOM 0 H LYS A 424 -4.059 6.666 -2.701 1.00 0.00 H new ATOM 0 HA LYS A 424 -5.457 4.544 -1.506 1.00 0.00 H new ATOM 0 HB2 LYS A 424 -6.503 7.036 -2.910 1.00 0.00 H new ATOM 0 HB3 LYS A 424 -7.417 6.036 -1.798 1.00 0.00 H new ATOM 0 HG2 LYS A 424 -6.143 6.722 0.071 1.00 0.00 H new ATOM 0 HG3 LYS A 424 -4.816 7.296 -0.920 1.00 0.00 H new ATOM 0 HD2 LYS A 424 -5.958 9.252 -1.564 1.00 0.00 H new ATOM 0 HD3 LYS A 424 -7.535 8.572 -1.216 1.00 0.00 H new ATOM 0 HE2 LYS A 424 -7.297 9.940 0.629 1.00 0.00 H new ATOM 0 HE3 LYS A 424 -6.606 8.464 1.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 -5.199 10.364 1.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 -4.393 9.283 0.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 -5.063 10.713 0.076 1.00 0.00 H new ATOM 1151 N ALA A 425 -5.890 4.884 -4.752 1.00 0.00 N ATOM 1152 CA ALA A 425 -6.411 4.222 -5.941 1.00 0.00 C ATOM 1153 C ALA A 425 -5.719 2.883 -6.171 1.00 0.00 C ATOM 1154 O ALA A 425 -6.339 1.925 -6.632 1.00 0.00 O ATOM 1155 CB ALA A 425 -6.246 5.120 -7.158 1.00 0.00 C ATOM 0 H ALA A 425 -5.337 5.720 -4.942 1.00 0.00 H new ATOM 0 HA ALA A 425 -7.473 4.030 -5.785 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -6.639 4.614 -8.040 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -6.792 6.050 -7.000 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -5.189 5.340 -7.307 1.00 0.00 H new ATOM 1161 N ALA A 426 -4.431 2.824 -5.849 1.00 0.00 N ATOM 1162 CA ALA A 426 -3.655 1.602 -6.021 1.00 0.00 C ATOM 1163 C ALA A 426 -4.112 0.521 -5.046 1.00 0.00 C ATOM 1164 O ALA A 426 -4.103 -0.666 -5.371 1.00 0.00 O ATOM 1165 CB ALA A 426 -2.173 1.887 -5.837 1.00 0.00 C ATOM 0 H ALA A 426 -3.903 3.609 -5.467 1.00 0.00 H new ATOM 0 HA ALA A 426 -3.820 1.236 -7.034 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -1.606 0.965 -5.968 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -1.849 2.620 -6.575 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -2.000 2.280 -4.835 1.00 0.00 H new ATOM 1171 N VAL A 427 -4.510 0.941 -3.849 1.00 0.00 N ATOM 1172 CA VAL A 427 -4.971 0.007 -2.827 1.00 0.00 C ATOM 1173 C VAL A 427 -6.101 -0.869 -3.352 1.00 0.00 C ATOM 1174 O VAL A 427 -5.972 -2.091 -3.420 1.00 0.00 O ATOM 1175 CB VAL A 427 -5.455 0.751 -1.567 1.00 0.00 C ATOM 1176 CG1 VAL A 427 -6.086 -0.223 -0.583 1.00 0.00 C ATOM 1177 CG2 VAL A 427 -4.304 1.505 -0.919 1.00 0.00 C ATOM 0 H VAL A 427 -4.523 1.920 -3.563 1.00 0.00 H new ATOM 0 HA VAL A 427 -4.120 -0.622 -2.565 1.00 0.00 H new ATOM 0 HB VAL A 427 -6.214 1.476 -1.862 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -6.422 0.319 0.301 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.938 -0.714 -1.053 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -5.351 -0.973 -0.291 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.664 2.025 -0.031 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -3.522 0.801 -0.636 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -3.901 2.231 -1.625 1.00 0.00 H new ATOM 1187 N GLU A 428 -7.210 -0.237 -3.724 1.00 0.00 N ATOM 1188 CA GLU A 428 -8.364 -0.961 -4.244 1.00 0.00 C ATOM 1189 C GLU A 428 -8.043 -1.600 -5.591 1.00 0.00 C ATOM 1190 O GLU A 428 -8.793 -2.442 -6.084 1.00 0.00 O ATOM 1191 CB GLU A 428 -9.563 -0.021 -4.385 1.00 0.00 C ATOM 1192 CG GLU A 428 -10.062 0.532 -3.061 1.00 0.00 C ATOM 1193 CD GLU A 428 -11.121 -0.347 -2.423 1.00 0.00 C ATOM 1194 OE1 GLU A 428 -10.747 -1.337 -1.759 1.00 0.00 O ATOM 1195 OE2 GLU A 428 -12.321 -0.046 -2.588 1.00 0.00 O ATOM 0 H GLU A 428 -7.333 0.774 -3.675 1.00 0.00 H new ATOM 0 HA GLU A 428 -8.613 -1.752 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 428 -9.288 0.809 -5.035 1.00 0.00 H new ATOM 0 HB3 GLU A 428 -10.377 -0.555 -4.876 1.00 0.00 H new ATOM 0 HG2 GLU A 428 -9.221 0.637 -2.375 1.00 0.00 H new ATOM 0 HG3 GLU A 428 -10.471 1.530 -3.219 1.00 0.00 H new ATOM 1202 N TRP A 429 -6.925 -1.194 -6.181 1.00 0.00 N ATOM 1203 CA TRP A 429 -6.505 -1.726 -7.472 1.00 0.00 C ATOM 1204 C TRP A 429 -5.840 -3.088 -7.309 1.00 0.00 C ATOM 1205 O TRP A 429 -6.238 -4.064 -7.944 1.00 0.00 O ATOM 1206 CB TRP A 429 -5.544 -0.755 -8.159 1.00 0.00 C ATOM 1207 CG TRP A 429 -4.849 -1.347 -9.348 1.00 0.00 C ATOM 1208 CD1 TRP A 429 -4.044 -2.450 -9.361 1.00 0.00 C ATOM 1209 CD2 TRP A 429 -4.897 -0.866 -10.695 1.00 0.00 C ATOM 1210 NE1 TRP A 429 -3.589 -2.683 -10.637 1.00 0.00 N ATOM 1211 CE2 TRP A 429 -4.098 -1.726 -11.474 1.00 0.00 C ATOM 1212 CE3 TRP A 429 -5.537 0.207 -11.321 1.00 0.00 C ATOM 1213 CZ2 TRP A 429 -3.924 -1.545 -12.843 1.00 0.00 C ATOM 1214 CZ3 TRP A 429 -5.363 0.386 -12.680 1.00 0.00 C ATOM 1215 CH2 TRP A 429 -4.563 -0.487 -13.429 1.00 0.00 C ATOM 0 H TRP A 429 -6.293 -0.498 -5.786 1.00 0.00 H new ATOM 0 HA TRP A 429 -7.393 -1.848 -8.093 1.00 0.00 H new ATOM 0 HB2 TRP A 429 -6.097 0.130 -8.474 1.00 0.00 H new ATOM 0 HB3 TRP A 429 -4.797 -0.424 -7.438 1.00 0.00 H new ATOM 0 HD1 TRP A 429 -3.801 -3.050 -8.497 1.00 0.00 H new ATOM 0 HE1 TRP A 429 -2.972 -3.446 -10.916 1.00 0.00 H new ATOM 0 HE3 TRP A 429 -6.157 0.885 -10.752 1.00 0.00 H new ATOM 0 HZ2 TRP A 429 -3.307 -2.216 -13.422 1.00 0.00 H new ATOM 0 HZ3 TRP A 429 -5.852 1.213 -13.173 1.00 0.00 H new ATOM 0 HH2 TRP A 429 -4.449 -0.321 -14.490 1.00 0.00 H new ATOM 1226 N PHE A 430 -4.823 -3.147 -6.455 1.00 0.00 N ATOM 1227 CA PHE A 430 -4.103 -4.391 -6.209 1.00 0.00 C ATOM 1228 C PHE A 430 -4.773 -5.198 -5.101 1.00 0.00 C ATOM 1229 O PHE A 430 -4.564 -6.405 -4.985 1.00 0.00 O ATOM 1230 CB PHE A 430 -2.648 -4.096 -5.833 1.00 0.00 C ATOM 1231 CG PHE A 430 -1.912 -3.295 -6.868 1.00 0.00 C ATOM 1232 CD1 PHE A 430 -1.421 -3.901 -8.013 1.00 0.00 C ATOM 1233 CD2 PHE A 430 -1.711 -1.935 -6.697 1.00 0.00 C ATOM 1234 CE1 PHE A 430 -0.743 -3.167 -8.967 1.00 0.00 C ATOM 1235 CE2 PHE A 430 -1.035 -1.195 -7.647 1.00 0.00 C ATOM 1236 CZ PHE A 430 -0.549 -1.812 -8.784 1.00 0.00 C ATOM 0 H PHE A 430 -4.479 -2.348 -5.922 1.00 0.00 H new ATOM 0 HA PHE A 430 -4.123 -4.981 -7.125 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.628 -3.557 -4.886 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -2.124 -5.038 -5.674 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.570 -4.960 -8.162 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -2.088 -1.448 -5.810 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.365 -3.652 -9.855 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -0.886 -0.135 -7.502 1.00 0.00 H new ATOM 0 HZ PHE A 430 -0.019 -1.236 -9.528 1.00 0.00 H new ATOM 1246 N ASP A 431 -5.577 -4.522 -4.288 1.00 0.00 N ATOM 1247 CA ASP A 431 -6.279 -5.175 -3.190 1.00 0.00 C ATOM 1248 C ASP A 431 -7.099 -6.358 -3.696 1.00 0.00 C ATOM 1249 O ASP A 431 -8.197 -6.185 -4.222 1.00 0.00 O ATOM 1250 CB ASP A 431 -7.189 -4.178 -2.472 1.00 0.00 C ATOM 1251 CG ASP A 431 -8.270 -4.861 -1.659 1.00 0.00 C ATOM 1252 OD1 ASP A 431 -7.992 -5.243 -0.503 1.00 0.00 O ATOM 1253 OD2 ASP A 431 -9.395 -5.013 -2.178 1.00 0.00 O ATOM 0 H ASP A 431 -5.759 -3.522 -4.369 1.00 0.00 H new ATOM 0 HA ASP A 431 -5.534 -5.546 -2.486 1.00 0.00 H new ATOM 0 HB2 ASP A 431 -6.587 -3.549 -1.815 1.00 0.00 H new ATOM 0 HB3 ASP A 431 -7.653 -3.520 -3.207 1.00 0.00 H new ATOM 1258 N GLY A 432 -6.557 -7.561 -3.532 1.00 0.00 N ATOM 1259 CA GLY A 432 -7.251 -8.754 -3.979 1.00 0.00 C ATOM 1260 C GLY A 432 -6.665 -9.323 -5.255 1.00 0.00 C ATOM 1261 O GLY A 432 -7.260 -10.199 -5.885 1.00 0.00 O ATOM 0 H GLY A 432 -5.650 -7.730 -3.098 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -7.209 -9.510 -3.195 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -8.303 -8.520 -4.139 1.00 0.00 H new ATOM 1265 N LYS A 433 -5.495 -8.825 -5.640 1.00 0.00 N ATOM 1266 CA LYS A 433 -4.827 -9.288 -6.851 1.00 0.00 C ATOM 1267 C LYS A 433 -4.215 -10.669 -6.641 1.00 0.00 C ATOM 1268 O LYS A 433 -4.257 -11.215 -5.539 1.00 0.00 O ATOM 1269 CB LYS A 433 -3.741 -8.295 -7.270 1.00 0.00 C ATOM 1270 CG LYS A 433 -4.236 -7.211 -8.212 1.00 0.00 C ATOM 1271 CD LYS A 433 -4.571 -7.775 -9.583 1.00 0.00 C ATOM 1272 CE LYS A 433 -4.654 -6.676 -10.631 1.00 0.00 C ATOM 1273 NZ LYS A 433 -4.677 -7.229 -12.014 1.00 0.00 N ATOM 0 H LYS A 433 -4.989 -8.100 -5.131 1.00 0.00 H new ATOM 0 HA LYS A 433 -5.572 -9.358 -7.643 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -3.325 -7.827 -6.378 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -2.929 -8.840 -7.752 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -5.120 -6.734 -7.788 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -3.474 -6.438 -8.312 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -3.812 -8.501 -9.875 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -5.521 -8.308 -9.537 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -5.552 -6.081 -10.463 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -3.802 -6.005 -10.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -4.734 -6.449 -12.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -3.809 -7.776 -12.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -5.504 -7.849 -12.126 1.00 0.00 H new ATOM 1287 N ASP A 434 -3.647 -11.227 -7.703 1.00 0.00 N ATOM 1288 CA ASP A 434 -3.023 -12.543 -7.634 1.00 0.00 C ATOM 1289 C ASP A 434 -1.559 -12.474 -8.053 1.00 0.00 C ATOM 1290 O ASP A 434 -1.245 -12.214 -9.215 1.00 0.00 O ATOM 1291 CB ASP A 434 -3.774 -13.535 -8.526 1.00 0.00 C ATOM 1292 CG ASP A 434 -5.029 -14.072 -7.864 1.00 0.00 C ATOM 1293 OD1 ASP A 434 -6.039 -13.340 -7.827 1.00 0.00 O ATOM 1294 OD2 ASP A 434 -4.998 -15.225 -7.384 1.00 0.00 O ATOM 0 H ASP A 434 -3.605 -10.789 -8.623 1.00 0.00 H new ATOM 0 HA ASP A 434 -3.071 -12.886 -6.600 1.00 0.00 H new ATOM 0 HB2 ASP A 434 -4.041 -13.047 -9.463 1.00 0.00 H new ATOM 0 HB3 ASP A 434 -3.114 -14.366 -8.776 1.00 0.00 H new ATOM 1299 N PHE A 435 -0.664 -12.706 -7.097 1.00 0.00 N ATOM 1300 CA PHE A 435 0.769 -12.667 -7.366 1.00 0.00 C ATOM 1301 C PHE A 435 1.388 -14.054 -7.215 1.00 0.00 C ATOM 1302 O PHE A 435 1.452 -14.599 -6.113 1.00 0.00 O ATOM 1303 CB PHE A 435 1.460 -11.682 -6.420 1.00 0.00 C ATOM 1304 CG PHE A 435 2.682 -11.041 -7.013 1.00 0.00 C ATOM 1305 CD1 PHE A 435 2.564 -10.072 -7.996 1.00 0.00 C ATOM 1306 CD2 PHE A 435 3.948 -11.406 -6.585 1.00 0.00 C ATOM 1307 CE1 PHE A 435 3.687 -9.481 -8.544 1.00 0.00 C ATOM 1308 CE2 PHE A 435 5.075 -10.818 -7.128 1.00 0.00 C ATOM 1309 CZ PHE A 435 4.944 -9.853 -8.109 1.00 0.00 C ATOM 0 H PHE A 435 -0.906 -12.923 -6.130 1.00 0.00 H new ATOM 0 HA PHE A 435 0.912 -12.334 -8.394 1.00 0.00 H new ATOM 0 HB2 PHE A 435 0.751 -10.903 -6.138 1.00 0.00 H new ATOM 0 HB3 PHE A 435 1.741 -12.204 -5.505 1.00 0.00 H new ATOM 0 HD1 PHE A 435 1.584 -9.775 -8.338 1.00 0.00 H new ATOM 0 HD2 PHE A 435 4.056 -12.159 -5.818 1.00 0.00 H new ATOM 0 HE1 PHE A 435 3.582 -8.729 -9.312 1.00 0.00 H new ATOM 0 HE2 PHE A 435 6.056 -11.112 -6.786 1.00 0.00 H new ATOM 0 HZ PHE A 435 5.823 -9.391 -8.534 1.00 0.00 H new ATOM 1319 N GLN A 436 1.842 -14.617 -8.330 1.00 0.00 N ATOM 1320 CA GLN A 436 2.455 -15.940 -8.322 1.00 0.00 C ATOM 1321 C GLN A 436 1.489 -16.984 -7.770 1.00 0.00 C ATOM 1322 O GLN A 436 1.895 -17.910 -7.070 1.00 0.00 O ATOM 1323 CB GLN A 436 3.739 -15.926 -7.490 1.00 0.00 C ATOM 1324 CG GLN A 436 4.940 -15.366 -8.235 1.00 0.00 C ATOM 1325 CD GLN A 436 6.240 -15.575 -7.484 1.00 0.00 C ATOM 1326 OE1 GLN A 436 6.475 -16.638 -6.909 1.00 0.00 O ATOM 1327 NE2 GLN A 436 7.095 -14.558 -7.488 1.00 0.00 N ATOM 0 H GLN A 436 1.797 -14.178 -9.250 1.00 0.00 H new ATOM 0 HA GLN A 436 2.700 -16.205 -9.350 1.00 0.00 H new ATOM 0 HB2 GLN A 436 3.572 -15.335 -6.590 1.00 0.00 H new ATOM 0 HB3 GLN A 436 3.964 -16.942 -7.167 1.00 0.00 H new ATOM 0 HG2 GLN A 436 5.010 -15.841 -9.214 1.00 0.00 H new ATOM 0 HG3 GLN A 436 4.791 -14.300 -8.407 1.00 0.00 H new ATOM 0 HE21 GLN A 436 6.859 -13.695 -7.978 1.00 0.00 H new ATOM 0 HE22 GLN A 436 7.988 -14.640 -7.001 1.00 0.00 H new ATOM 1336 N GLY A 437 0.209 -16.828 -8.092 1.00 0.00 N ATOM 1337 CA GLY A 437 -0.795 -17.763 -7.620 1.00 0.00 C ATOM 1338 C GLY A 437 -1.317 -17.407 -6.243 1.00 0.00 C ATOM 1339 O GLY A 437 -2.356 -17.910 -5.816 1.00 0.00 O ATOM 0 H GLY A 437 -0.151 -16.070 -8.672 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -1.626 -17.786 -8.325 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -0.370 -18.766 -7.596 1.00 0.00 H new ATOM 1343 N SER A 438 -0.594 -16.538 -5.543 1.00 0.00 N ATOM 1344 CA SER A 438 -0.988 -16.119 -4.203 1.00 0.00 C ATOM 1345 C SER A 438 -1.833 -14.849 -4.256 1.00 0.00 C ATOM 1346 O SER A 438 -1.887 -14.169 -5.281 1.00 0.00 O ATOM 1347 CB SER A 438 0.250 -15.886 -3.335 1.00 0.00 C ATOM 1348 OG SER A 438 -0.029 -16.149 -1.970 1.00 0.00 O ATOM 0 H SER A 438 0.268 -16.111 -5.882 1.00 0.00 H new ATOM 0 HA SER A 438 -1.588 -16.915 -3.762 1.00 0.00 H new ATOM 0 HB2 SER A 438 1.062 -16.529 -3.674 1.00 0.00 H new ATOM 0 HB3 SER A 438 0.590 -14.856 -3.449 1.00 0.00 H new ATOM 0 HG SER A 438 0.778 -15.995 -1.436 1.00 0.00 H new ATOM 1354 N LYS A 439 -2.489 -14.536 -3.146 1.00 0.00 N ATOM 1355 CA LYS A 439 -3.330 -13.348 -3.062 1.00 0.00 C ATOM 1356 C LYS A 439 -2.626 -12.236 -2.293 1.00 0.00 C ATOM 1357 O LYS A 439 -2.053 -12.469 -1.228 1.00 0.00 O ATOM 1358 CB LYS A 439 -4.661 -13.687 -2.386 1.00 0.00 C ATOM 1359 CG LYS A 439 -5.785 -12.728 -2.742 1.00 0.00 C ATOM 1360 CD LYS A 439 -6.943 -12.840 -1.766 1.00 0.00 C ATOM 1361 CE LYS A 439 -7.900 -13.955 -2.161 1.00 0.00 C ATOM 1362 NZ LYS A 439 -9.201 -13.849 -1.444 1.00 0.00 N ATOM 0 H LYS A 439 -2.455 -15.089 -2.290 1.00 0.00 H new ATOM 0 HA LYS A 439 -3.523 -12.998 -4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -4.955 -14.698 -2.667 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -4.521 -13.685 -1.305 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -5.406 -11.706 -2.743 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -6.137 -12.938 -3.752 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -6.558 -13.028 -0.764 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -7.482 -11.893 -1.729 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -8.074 -13.920 -3.236 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -7.443 -14.920 -1.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -9.825 -14.626 -1.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -9.038 -13.908 -0.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -9.650 -12.939 -1.672 1.00 0.00 H new ATOM 1376 N LEU A 440 -2.675 -11.024 -2.836 1.00 0.00 N ATOM 1377 CA LEU A 440 -2.042 -9.874 -2.199 1.00 0.00 C ATOM 1378 C LEU A 440 -3.077 -9.007 -1.489 1.00 0.00 C ATOM 1379 O LEU A 440 -4.203 -8.852 -1.962 1.00 0.00 O ATOM 1380 CB LEU A 440 -1.290 -9.041 -3.238 1.00 0.00 C ATOM 1381 CG LEU A 440 -0.312 -9.805 -4.131 1.00 0.00 C ATOM 1382 CD1 LEU A 440 0.651 -8.846 -4.813 1.00 0.00 C ATOM 1383 CD2 LEU A 440 0.451 -10.843 -3.321 1.00 0.00 C ATOM 0 H LEU A 440 -3.146 -10.812 -3.715 1.00 0.00 H new ATOM 0 HA LEU A 440 -1.334 -10.244 -1.457 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.022 -8.545 -3.876 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -0.739 -8.258 -2.717 1.00 0.00 H new ATOM 0 HG LEU A 440 -0.883 -10.322 -4.902 1.00 0.00 H new ATOM 0 HD11 LEU A 440 1.339 -9.409 -5.444 1.00 0.00 H new ATOM 0 HD12 LEU A 440 0.089 -8.142 -5.427 1.00 0.00 H new ATOM 0 HD13 LEU A 440 1.216 -8.299 -4.058 1.00 0.00 H new ATOM 0 HD21 LEU A 440 1.142 -11.377 -3.973 1.00 0.00 H new ATOM 0 HD22 LEU A 440 1.010 -10.347 -2.528 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -0.252 -11.550 -2.881 1.00 0.00 H new ATOM 1395 N LYS A 441 -2.688 -8.444 -0.351 1.00 0.00 N ATOM 1396 CA LYS A 441 -3.580 -7.590 0.424 1.00 0.00 C ATOM 1397 C LYS A 441 -3.001 -6.186 0.567 1.00 0.00 C ATOM 1398 O LYS A 441 -2.072 -5.962 1.346 1.00 0.00 O ATOM 1399 CB LYS A 441 -3.824 -8.195 1.809 1.00 0.00 C ATOM 1400 CG LYS A 441 -4.915 -9.252 1.826 1.00 0.00 C ATOM 1401 CD LYS A 441 -4.750 -10.205 2.998 1.00 0.00 C ATOM 1402 CE LYS A 441 -5.314 -9.614 4.281 1.00 0.00 C ATOM 1403 NZ LYS A 441 -6.800 -9.522 4.242 1.00 0.00 N ATOM 0 H LYS A 441 -1.760 -8.564 0.056 1.00 0.00 H new ATOM 0 HA LYS A 441 -4.529 -7.521 -0.108 1.00 0.00 H new ATOM 0 HB2 LYS A 441 -2.896 -8.636 2.172 1.00 0.00 H new ATOM 0 HB3 LYS A 441 -4.091 -7.398 2.503 1.00 0.00 H new ATOM 0 HG2 LYS A 441 -5.890 -8.769 1.883 1.00 0.00 H new ATOM 0 HG3 LYS A 441 -4.893 -9.814 0.893 1.00 0.00 H new ATOM 0 HD2 LYS A 441 -5.254 -11.146 2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 441 -3.693 -10.435 3.136 1.00 0.00 H new ATOM 0 HE2 LYS A 441 -5.010 -10.229 5.128 1.00 0.00 H new ATOM 0 HE3 LYS A 441 -4.893 -8.621 4.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 441 -7.169 -9.445 5.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 441 -7.082 -8.682 3.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 441 -7.189 -10.374 3.790 1.00 0.00 H new ATOM 1417 N VAL A 442 -3.554 -5.242 -0.188 1.00 0.00 N ATOM 1418 CA VAL A 442 -3.094 -3.859 -0.142 1.00 0.00 C ATOM 1419 C VAL A 442 -4.011 -3.003 0.724 1.00 0.00 C ATOM 1420 O VAL A 442 -5.231 -3.162 0.701 1.00 0.00 O ATOM 1421 CB VAL A 442 -3.020 -3.246 -1.554 1.00 0.00 C ATOM 1422 CG1 VAL A 442 -2.229 -1.947 -1.532 1.00 0.00 C ATOM 1423 CG2 VAL A 442 -2.408 -4.236 -2.533 1.00 0.00 C ATOM 0 H VAL A 442 -4.321 -5.410 -0.839 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.095 -3.872 0.294 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.033 -3.020 -1.887 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.188 -1.529 -2.538 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.715 -1.236 -0.864 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.217 -2.143 -1.179 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.364 -3.786 -3.525 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.401 -4.495 -2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -3.020 -5.137 -2.570 1.00 0.00 H new ATOM 1433 N SER A 443 -3.413 -2.093 1.488 1.00 0.00 N ATOM 1434 CA SER A 443 -4.176 -1.213 2.366 1.00 0.00 C ATOM 1435 C SER A 443 -3.338 -0.010 2.789 1.00 0.00 C ATOM 1436 O SER A 443 -2.234 -0.161 3.315 1.00 0.00 O ATOM 1437 CB SER A 443 -4.651 -1.978 3.602 1.00 0.00 C ATOM 1438 OG SER A 443 -5.369 -3.144 3.236 1.00 0.00 O ATOM 0 H SER A 443 -2.404 -1.946 1.516 1.00 0.00 H new ATOM 0 HA SER A 443 -5.045 -0.853 1.815 1.00 0.00 H new ATOM 0 HB2 SER A 443 -3.793 -2.253 4.215 1.00 0.00 H new ATOM 0 HB3 SER A 443 -5.285 -1.333 4.211 1.00 0.00 H new ATOM 0 HG SER A 443 -5.674 -3.062 2.308 1.00 0.00 H new ATOM 1444 N LEU A 444 -3.870 1.185 2.556 1.00 0.00 N ATOM 1445 CA LEU A 444 -3.173 2.415 2.912 1.00 0.00 C ATOM 1446 C LEU A 444 -2.412 2.250 4.224 1.00 0.00 C ATOM 1447 O LEU A 444 -3.007 1.991 5.270 1.00 0.00 O ATOM 1448 CB LEU A 444 -4.167 3.572 3.029 1.00 0.00 C ATOM 1449 CG LEU A 444 -4.546 4.267 1.720 1.00 0.00 C ATOM 1450 CD1 LEU A 444 -5.565 5.366 1.975 1.00 0.00 C ATOM 1451 CD2 LEU A 444 -3.307 4.832 1.040 1.00 0.00 C ATOM 0 H LEU A 444 -4.782 1.328 2.122 1.00 0.00 H new ATOM 0 HA LEU A 444 -2.455 2.638 2.122 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -5.078 3.196 3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 444 -3.748 4.318 3.705 1.00 0.00 H new ATOM 0 HG LEU A 444 -4.997 3.530 1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 444 -5.823 5.849 1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 444 -6.462 4.934 2.419 1.00 0.00 H new ATOM 0 HD13 LEU A 444 -5.142 6.103 2.657 1.00 0.00 H new ATOM 0 HD21 LEU A 444 -3.594 5.323 0.110 1.00 0.00 H new ATOM 0 HD22 LEU A 444 -2.828 5.556 1.700 1.00 0.00 H new ATOM 0 HD23 LEU A 444 -2.610 4.022 0.823 1.00 0.00 H new