USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 628 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 451 ASN : amide:sc= 0.166 K(o=0.17,f=-6.4!) USER MOD Set 1.2: A 454 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 402 ASN : amide:sc= 1.68 K(o=2.3,f=-7!) USER MOD Set 2.2: A 448 SER OG : rot -71:sc= 0.602 USER MOD Single : A 393 SER OG : rot 180:sc= 0 USER MOD Single : A 394 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 415 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 419 GLN : amide:sc= 0.878 K(o=0.88,f=0) USER MOD Single : A 420 MET CE :methyl -169:sc= -0.0165 (180deg=-0.312) USER MOD Single : A 422 MET CE :methyl -178:sc= -0.121 (180deg=-0.125) USER MOD Single : A 426 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 429 SER OG : rot -120:sc= 0.939 USER MOD Single : A 431 LYS NZ :NH3+ 162:sc= 0.5 (180deg=0.355) USER MOD Single : A 441 SER OG : rot 180:sc= 0.174 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot -92:sc= 0.0016 USER MOD Single : A 449 TYR OH : rot 22:sc= 0.888 USER MOD Single : A 456 GLN : amide:sc=-0.00967 K(o=-0.0097,f=-0.63) USER MOD Single : A 460 GLN : amide:sc= 0.314 X(o=0.31,f=0) USER MOD Single : A 461 SER OG : rot 81:sc= 0.849 USER MOD Single : A 462 MET CE :methyl -171:sc= -0.299 (180deg=-0.717) USER MOD Single : A 463 ASN : amide:sc= 0.875 K(o=0.88,f=-5.9!) USER MOD Single : A 466 GLN : amide:sc= 1.06 K(o=1.1,f=-0.1) USER MOD Single : A 469 MET CE :methyl 172:sc= 0 (180deg=-0.0737) USER MOD Single : A 470 LYS NZ :NH3+ -149:sc= 0.767 (180deg=0.284) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0.901 K(o=0.9,f=-1.7) USER MOD Single : A 477 LYS NZ :NH3+ 154:sc= 1.24 (180deg=0.744) USER MOD ----------------------------------------------------------------- ATOM 172 N ALA A 390 -5.115 6.677 -9.982 1.00 0.00 N ATOM 173 CA ALA A 390 -4.768 6.173 -8.637 1.00 0.00 C ATOM 174 C ALA A 390 -3.261 6.123 -8.285 1.00 0.00 C ATOM 175 O ALA A 390 -2.913 6.230 -7.108 1.00 0.00 O ATOM 176 CB ALA A 390 -5.461 4.816 -8.414 1.00 0.00 C ATOM 0 HA ALA A 390 -5.144 6.919 -7.936 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -5.210 4.438 -7.423 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -6.541 4.942 -8.491 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -5.124 4.107 -9.170 1.00 0.00 H new ATOM 182 N ALA A 391 -2.372 5.974 -9.267 1.00 0.00 N ATOM 183 CA ALA A 391 -0.944 5.710 -9.088 1.00 0.00 C ATOM 184 C ALA A 391 -0.116 6.957 -8.745 1.00 0.00 C ATOM 185 O ALA A 391 -0.195 7.989 -9.416 1.00 0.00 O ATOM 186 CB ALA A 391 -0.451 5.000 -10.355 1.00 0.00 C ATOM 0 H ALA A 391 -2.638 6.037 -10.250 1.00 0.00 H new ATOM 0 HA ALA A 391 -0.805 5.072 -8.215 1.00 0.00 H new ATOM 0 HB1 ALA A 391 0.613 4.785 -10.261 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -0.999 4.067 -10.486 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -0.616 5.643 -11.220 1.00 0.00 H new ATOM 192 N GLY A 392 0.671 6.840 -7.670 1.00 0.00 N ATOM 193 CA GLY A 392 1.501 7.910 -7.103 1.00 0.00 C ATOM 194 C GLY A 392 0.721 8.857 -6.187 1.00 0.00 C ATOM 195 O GLY A 392 1.324 9.720 -5.550 1.00 0.00 O ATOM 0 H GLY A 392 0.751 5.965 -7.151 1.00 0.00 H new ATOM 0 HA2 GLY A 392 2.322 7.465 -6.541 1.00 0.00 H new ATOM 0 HA3 GLY A 392 1.946 8.485 -7.915 1.00 0.00 H new ATOM 199 N SER A 393 -0.600 8.690 -6.096 1.00 0.00 N ATOM 200 CA SER A 393 -1.488 9.508 -5.268 1.00 0.00 C ATOM 201 C SER A 393 -1.450 9.089 -3.791 1.00 0.00 C ATOM 202 O SER A 393 -1.151 7.943 -3.445 1.00 0.00 O ATOM 203 CB SER A 393 -2.920 9.437 -5.819 1.00 0.00 C ATOM 204 OG SER A 393 -3.788 10.291 -5.085 1.00 0.00 O ATOM 0 H SER A 393 -1.095 7.962 -6.611 1.00 0.00 H new ATOM 0 HA SER A 393 -1.135 10.538 -5.312 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.924 9.724 -6.870 1.00 0.00 H new ATOM 0 HB3 SER A 393 -3.284 8.411 -5.767 1.00 0.00 H new ATOM 0 HG SER A 393 -4.694 10.232 -5.454 1.00 0.00 H new ATOM 210 N GLN A 394 -1.792 10.024 -2.906 1.00 0.00 N ATOM 211 CA GLN A 394 -1.852 9.829 -1.459 1.00 0.00 C ATOM 212 C GLN A 394 -3.213 10.264 -0.889 1.00 0.00 C ATOM 213 O GLN A 394 -3.330 10.606 0.286 1.00 0.00 O ATOM 214 CB GLN A 394 -0.597 10.422 -0.791 1.00 0.00 C ATOM 215 CG GLN A 394 -0.252 11.890 -1.097 1.00 0.00 C ATOM 216 CD GLN A 394 -1.099 12.895 -0.318 1.00 0.00 C ATOM 217 OE1 GLN A 394 -2.092 13.426 -0.804 1.00 0.00 O ATOM 218 NE2 GLN A 394 -0.716 13.223 0.900 1.00 0.00 N ATOM 0 H GLN A 394 -2.044 10.972 -3.187 1.00 0.00 H new ATOM 0 HA GLN A 394 -1.814 8.768 -1.213 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -0.712 10.322 0.288 1.00 0.00 H new ATOM 0 HB3 GLN A 394 0.258 9.809 -1.078 1.00 0.00 H new ATOM 0 HG2 GLN A 394 0.800 12.062 -0.870 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -0.381 12.070 -2.164 1.00 0.00 H new ATOM 0 HE21 GLN A 394 0.109 12.785 1.310 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -1.245 13.914 1.432 1.00 0.00 H new ATOM 227 N LYS A 395 -4.268 10.216 -1.717 1.00 0.00 N ATOM 228 CA LYS A 395 -5.660 10.381 -1.287 1.00 0.00 C ATOM 229 C LYS A 395 -6.129 9.147 -0.488 1.00 0.00 C ATOM 230 O LYS A 395 -6.746 8.224 -1.030 1.00 0.00 O ATOM 231 CB LYS A 395 -6.539 10.697 -2.516 1.00 0.00 C ATOM 232 CG LYS A 395 -7.983 11.053 -2.116 1.00 0.00 C ATOM 233 CD LYS A 395 -8.913 11.287 -3.317 1.00 0.00 C ATOM 234 CE LYS A 395 -8.501 12.511 -4.147 1.00 0.00 C ATOM 235 NZ LYS A 395 -9.524 12.844 -5.172 1.00 0.00 N ATOM 0 H LYS A 395 -4.173 10.059 -2.720 1.00 0.00 H new ATOM 0 HA LYS A 395 -5.751 11.226 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -6.101 11.527 -3.071 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -6.550 9.837 -3.185 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -8.390 10.249 -1.503 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -7.969 11.950 -1.497 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -8.910 10.402 -3.953 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -9.935 11.420 -2.961 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -8.354 13.366 -3.487 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -7.546 12.316 -4.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -9.214 13.675 -5.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -9.646 12.036 -5.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -10.429 13.054 -4.704 1.00 0.00 H new ATOM 249 N GLU A 396 -5.797 9.132 0.801 1.00 0.00 N ATOM 250 CA GLU A 396 -6.108 8.045 1.733 1.00 0.00 C ATOM 251 C GLU A 396 -7.635 7.857 1.860 1.00 0.00 C ATOM 252 O GLU A 396 -8.390 8.832 1.942 1.00 0.00 O ATOM 253 CB GLU A 396 -5.456 8.293 3.109 1.00 0.00 C ATOM 254 CG GLU A 396 -3.981 8.745 3.035 1.00 0.00 C ATOM 255 CD GLU A 396 -3.292 8.871 4.403 1.00 0.00 C ATOM 256 OE1 GLU A 396 -3.779 8.319 5.417 1.00 0.00 O ATOM 257 OE2 GLU A 396 -2.247 9.557 4.465 1.00 0.00 O ATOM 0 H GLU A 396 -5.288 9.899 1.242 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.689 7.122 1.333 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.031 9.051 3.640 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.515 7.378 3.698 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -3.425 8.034 2.425 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -3.933 9.708 2.526 1.00 0.00 H new ATOM 264 N GLY A 397 -8.092 6.601 1.852 1.00 0.00 N ATOM 265 CA GLY A 397 -9.507 6.198 1.861 1.00 0.00 C ATOM 266 C GLY A 397 -10.157 6.209 3.257 1.00 0.00 C ATOM 267 O GLY A 397 -9.547 6.701 4.215 1.00 0.00 O ATOM 0 H GLY A 397 -7.460 5.800 1.838 1.00 0.00 H new ATOM 0 HA2 GLY A 397 -10.067 6.865 1.206 1.00 0.00 H new ATOM 0 HA3 GLY A 397 -9.590 5.195 1.441 1.00 0.00 H new ATOM 271 N PRO A 398 -11.390 5.678 3.387 1.00 0.00 N ATOM 272 CA PRO A 398 -12.148 5.671 4.637 1.00 0.00 C ATOM 273 C PRO A 398 -11.600 4.648 5.648 1.00 0.00 C ATOM 274 O PRO A 398 -10.704 3.858 5.343 1.00 0.00 O ATOM 275 CB PRO A 398 -13.596 5.378 4.221 1.00 0.00 C ATOM 276 CG PRO A 398 -13.442 4.518 2.969 1.00 0.00 C ATOM 277 CD PRO A 398 -12.179 5.080 2.314 1.00 0.00 C ATOM 0 HA PRO A 398 -12.071 6.623 5.162 1.00 0.00 H new ATOM 0 HB2 PRO A 398 -14.140 4.851 5.005 1.00 0.00 H new ATOM 0 HB3 PRO A 398 -14.147 6.295 4.012 1.00 0.00 H new ATOM 0 HG2 PRO A 398 -13.332 3.462 3.216 1.00 0.00 H new ATOM 0 HG3 PRO A 398 -14.308 4.603 2.313 1.00 0.00 H new ATOM 0 HD2 PRO A 398 -11.618 4.292 1.812 1.00 0.00 H new ATOM 0 HD3 PRO A 398 -12.431 5.823 1.557 1.00 0.00 H new ATOM 285 N GLU A 399 -12.144 4.670 6.869 1.00 0.00 N ATOM 286 CA GLU A 399 -11.726 3.802 7.977 1.00 0.00 C ATOM 287 C GLU A 399 -11.845 2.309 7.611 1.00 0.00 C ATOM 288 O GLU A 399 -12.891 1.845 7.149 1.00 0.00 O ATOM 289 CB GLU A 399 -12.555 4.142 9.230 1.00 0.00 C ATOM 290 CG GLU A 399 -12.117 3.393 10.498 1.00 0.00 C ATOM 291 CD GLU A 399 -10.693 3.773 10.934 1.00 0.00 C ATOM 292 OE1 GLU A 399 -10.532 4.753 11.698 1.00 0.00 O ATOM 293 OE2 GLU A 399 -9.730 3.089 10.515 1.00 0.00 O ATOM 0 H GLU A 399 -12.902 5.304 7.121 1.00 0.00 H new ATOM 0 HA GLU A 399 -10.672 3.985 8.186 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -12.490 5.214 9.415 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -13.602 3.915 9.031 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -12.814 3.613 11.307 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -12.166 2.319 10.319 1.00 0.00 H new ATOM 300 N GLY A 400 -10.753 1.561 7.803 1.00 0.00 N ATOM 301 CA GLY A 400 -10.650 0.126 7.498 1.00 0.00 C ATOM 302 C GLY A 400 -10.402 -0.205 6.021 1.00 0.00 C ATOM 303 O GLY A 400 -10.219 -1.375 5.695 1.00 0.00 O ATOM 0 H GLY A 400 -9.890 1.947 8.186 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -9.841 -0.299 8.091 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -11.570 -0.365 7.816 1.00 0.00 H new ATOM 307 N ALA A 401 -10.384 0.792 5.126 1.00 0.00 N ATOM 308 CA ALA A 401 -10.180 0.611 3.682 1.00 0.00 C ATOM 309 C ALA A 401 -8.721 0.803 3.224 1.00 0.00 C ATOM 310 O ALA A 401 -8.431 0.686 2.033 1.00 0.00 O ATOM 311 CB ALA A 401 -11.141 1.553 2.947 1.00 0.00 C ATOM 0 H ALA A 401 -10.514 1.768 5.391 1.00 0.00 H new ATOM 0 HA ALA A 401 -10.398 -0.428 3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -11.010 1.439 1.871 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -12.168 1.307 3.216 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -10.928 2.584 3.231 1.00 0.00 H new ATOM 317 N ASN A 402 -7.801 1.097 4.148 1.00 0.00 N ATOM 318 CA ASN A 402 -6.415 1.461 3.844 1.00 0.00 C ATOM 319 C ASN A 402 -5.429 0.357 4.252 1.00 0.00 C ATOM 320 O ASN A 402 -5.233 0.081 5.440 1.00 0.00 O ATOM 321 CB ASN A 402 -6.082 2.788 4.536 1.00 0.00 C ATOM 322 CG ASN A 402 -6.911 3.948 4.005 1.00 0.00 C ATOM 323 OD1 ASN A 402 -7.133 4.076 2.809 1.00 0.00 O ATOM 324 ND2 ASN A 402 -7.392 4.816 4.877 1.00 0.00 N ATOM 0 H ASN A 402 -8.004 1.088 5.148 1.00 0.00 H new ATOM 0 HA ASN A 402 -6.314 1.580 2.765 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -6.250 2.687 5.608 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -5.024 3.010 4.399 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -7.955 5.603 4.555 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -7.200 4.699 5.872 1.00 0.00 H new ATOM 331 N LEU A 403 -4.785 -0.251 3.254 1.00 0.00 N ATOM 332 CA LEU A 403 -3.777 -1.297 3.419 1.00 0.00 C ATOM 333 C LEU A 403 -2.359 -0.743 3.362 1.00 0.00 C ATOM 334 O LEU A 403 -2.080 0.182 2.597 1.00 0.00 O ATOM 335 CB LEU A 403 -3.918 -2.362 2.314 1.00 0.00 C ATOM 336 CG LEU A 403 -5.276 -3.075 2.236 1.00 0.00 C ATOM 337 CD1 LEU A 403 -5.156 -4.269 1.286 1.00 0.00 C ATOM 338 CD2 LEU A 403 -5.733 -3.564 3.612 1.00 0.00 C ATOM 0 H LEU A 403 -4.958 -0.020 2.276 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.947 -1.737 4.402 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -3.723 -1.887 1.352 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -3.143 -3.114 2.461 1.00 0.00 H new ATOM 0 HG LEU A 403 -6.017 -2.366 1.868 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -6.116 -4.782 1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.867 -3.918 0.295 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -4.400 -4.958 1.662 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -6.697 -4.064 3.519 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.999 -4.264 4.012 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -5.829 -2.714 4.287 1.00 0.00 H new ATOM 350 N PHE A 404 -1.479 -1.401 4.115 1.00 0.00 N ATOM 351 CA PHE A 404 -0.028 -1.275 4.091 1.00 0.00 C ATOM 352 C PHE A 404 0.554 -2.631 3.670 1.00 0.00 C ATOM 353 O PHE A 404 0.223 -3.670 4.246 1.00 0.00 O ATOM 354 CB PHE A 404 0.463 -0.853 5.481 1.00 0.00 C ATOM 355 CG PHE A 404 1.953 -1.012 5.716 1.00 0.00 C ATOM 356 CD1 PHE A 404 2.869 -0.108 5.149 1.00 0.00 C ATOM 357 CD2 PHE A 404 2.425 -2.043 6.551 1.00 0.00 C ATOM 358 CE1 PHE A 404 4.234 -0.198 5.467 1.00 0.00 C ATOM 359 CE2 PHE A 404 3.794 -2.152 6.844 1.00 0.00 C ATOM 360 CZ PHE A 404 4.697 -1.209 6.325 1.00 0.00 C ATOM 0 H PHE A 404 -1.787 -2.085 4.807 1.00 0.00 H new ATOM 0 HA PHE A 404 0.297 -0.514 3.381 1.00 0.00 H new ATOM 0 HB2 PHE A 404 0.196 0.191 5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -0.071 -1.437 6.230 1.00 0.00 H new ATOM 0 HD1 PHE A 404 2.523 0.656 4.469 1.00 0.00 H new ATOM 0 HD2 PHE A 404 1.729 -2.755 6.969 1.00 0.00 H new ATOM 0 HE1 PHE A 404 4.931 0.514 5.050 1.00 0.00 H new ATOM 0 HE2 PHE A 404 4.152 -2.959 7.467 1.00 0.00 H new ATOM 0 HZ PHE A 404 5.744 -1.261 6.585 1.00 0.00 H new ATOM 370 N ILE A 405 1.405 -2.609 2.647 1.00 0.00 N ATOM 371 CA ILE A 405 2.053 -3.765 2.021 1.00 0.00 C ATOM 372 C ILE A 405 3.564 -3.644 2.249 1.00 0.00 C ATOM 373 O ILE A 405 4.142 -2.583 2.013 1.00 0.00 O ATOM 374 CB ILE A 405 1.741 -3.825 0.500 1.00 0.00 C ATOM 375 CG1 ILE A 405 0.243 -3.917 0.118 1.00 0.00 C ATOM 376 CG2 ILE A 405 2.448 -5.054 -0.110 1.00 0.00 C ATOM 377 CD1 ILE A 405 -0.599 -2.645 0.287 1.00 0.00 C ATOM 0 H ILE A 405 1.679 -1.732 2.204 1.00 0.00 H new ATOM 0 HA ILE A 405 1.673 -4.684 2.468 1.00 0.00 H new ATOM 0 HB ILE A 405 2.100 -2.874 0.108 1.00 0.00 H new ATOM 0 HG12 ILE A 405 0.178 -4.230 -0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -0.211 -4.706 0.717 1.00 0.00 H new ATOM 0 HG21 ILE A 405 2.234 -5.104 -1.178 1.00 0.00 H new ATOM 0 HG22 ILE A 405 3.524 -4.967 0.041 1.00 0.00 H new ATOM 0 HG23 ILE A 405 2.086 -5.960 0.375 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.627 -2.846 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -0.582 -2.334 1.331 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.187 -1.851 -0.335 1.00 0.00 H new ATOM 389 N TYR A 406 4.210 -4.731 2.666 1.00 0.00 N ATOM 390 CA TYR A 406 5.651 -4.811 2.919 1.00 0.00 C ATOM 391 C TYR A 406 6.283 -6.001 2.166 1.00 0.00 C ATOM 392 O TYR A 406 5.584 -6.943 1.787 1.00 0.00 O ATOM 393 CB TYR A 406 5.873 -4.882 4.442 1.00 0.00 C ATOM 394 CG TYR A 406 7.264 -4.472 4.883 1.00 0.00 C ATOM 395 CD1 TYR A 406 7.547 -3.113 5.100 1.00 0.00 C ATOM 396 CD2 TYR A 406 8.282 -5.427 5.050 1.00 0.00 C ATOM 397 CE1 TYR A 406 8.840 -2.698 5.462 1.00 0.00 C ATOM 398 CE2 TYR A 406 9.587 -5.022 5.392 1.00 0.00 C ATOM 399 CZ TYR A 406 9.872 -3.654 5.592 1.00 0.00 C ATOM 400 OH TYR A 406 11.138 -3.265 5.911 1.00 0.00 O ATOM 0 H TYR A 406 3.729 -5.613 2.844 1.00 0.00 H new ATOM 0 HA TYR A 406 6.152 -3.922 2.537 1.00 0.00 H new ATOM 0 HB2 TYR A 406 5.143 -4.240 4.935 1.00 0.00 H new ATOM 0 HB3 TYR A 406 5.682 -5.901 4.779 1.00 0.00 H new ATOM 0 HD1 TYR A 406 6.762 -2.379 4.987 1.00 0.00 H new ATOM 0 HD2 TYR A 406 8.063 -6.476 4.915 1.00 0.00 H new ATOM 0 HE1 TYR A 406 9.044 -1.652 5.640 1.00 0.00 H new ATOM 0 HE2 TYR A 406 10.370 -5.758 5.501 1.00 0.00 H new ATOM 0 HH TYR A 406 11.720 -4.052 5.960 1.00 0.00 H new ATOM 410 N HIS A 407 7.598 -5.937 1.922 1.00 0.00 N ATOM 411 CA HIS A 407 8.412 -6.897 1.146 1.00 0.00 C ATOM 412 C HIS A 407 8.166 -6.840 -0.385 1.00 0.00 C ATOM 413 O HIS A 407 8.329 -7.846 -1.080 1.00 0.00 O ATOM 414 CB HIS A 407 8.319 -8.334 1.707 1.00 0.00 C ATOM 415 CG HIS A 407 8.775 -8.512 3.128 1.00 0.00 C ATOM 416 ND1 HIS A 407 10.055 -8.225 3.608 1.00 0.00 N ATOM 417 CD2 HIS A 407 8.041 -9.078 4.130 1.00 0.00 C ATOM 418 CE1 HIS A 407 10.054 -8.615 4.894 1.00 0.00 C ATOM 419 NE2 HIS A 407 8.859 -9.128 5.238 1.00 0.00 N ATOM 0 H HIS A 407 8.163 -5.167 2.281 1.00 0.00 H new ATOM 0 HA HIS A 407 9.443 -6.570 1.279 1.00 0.00 H new ATOM 0 HB2 HIS A 407 7.284 -8.666 1.633 1.00 0.00 H new ATOM 0 HB3 HIS A 407 8.911 -8.991 1.070 1.00 0.00 H new ATOM 0 HD2 HIS A 407 7.019 -9.420 4.067 1.00 0.00 H new ATOM 0 HE1 HIS A 407 10.899 -8.528 5.561 1.00 0.00 H new ATOM 0 HE2 HIS A 407 8.603 -9.490 6.157 1.00 0.00 H new ATOM 427 N LEU A 408 7.794 -5.678 -0.936 1.00 0.00 N ATOM 428 CA LEU A 408 7.682 -5.474 -2.393 1.00 0.00 C ATOM 429 C LEU A 408 9.046 -5.647 -3.103 1.00 0.00 C ATOM 430 O LEU A 408 10.091 -5.457 -2.467 1.00 0.00 O ATOM 431 CB LEU A 408 7.143 -4.060 -2.699 1.00 0.00 C ATOM 432 CG LEU A 408 5.726 -3.740 -2.181 1.00 0.00 C ATOM 433 CD1 LEU A 408 5.435 -2.248 -2.388 1.00 0.00 C ATOM 434 CD2 LEU A 408 4.668 -4.564 -2.927 1.00 0.00 C ATOM 0 H LEU A 408 7.561 -4.850 -0.388 1.00 0.00 H new ATOM 0 HA LEU A 408 6.992 -6.230 -2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 408 7.834 -3.332 -2.275 1.00 0.00 H new ATOM 0 HB3 LEU A 408 7.152 -3.917 -3.780 1.00 0.00 H new ATOM 0 HG LEU A 408 5.682 -3.993 -1.122 1.00 0.00 H new ATOM 0 HD11 LEU A 408 4.434 -2.018 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 408 6.166 -1.655 -1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 408 5.498 -2.009 -3.450 1.00 0.00 H new ATOM 0 HD21 LEU A 408 3.678 -4.319 -2.542 1.00 0.00 H new ATOM 0 HD22 LEU A 408 4.711 -4.333 -3.991 1.00 0.00 H new ATOM 0 HD23 LEU A 408 4.862 -5.626 -2.778 1.00 0.00 H new ATOM 446 N PRO A 409 9.069 -5.985 -4.408 1.00 0.00 N ATOM 447 CA PRO A 409 10.277 -5.913 -5.229 1.00 0.00 C ATOM 448 C PRO A 409 10.805 -4.471 -5.288 1.00 0.00 C ATOM 449 O PRO A 409 10.028 -3.518 -5.240 1.00 0.00 O ATOM 450 CB PRO A 409 9.871 -6.418 -6.620 1.00 0.00 C ATOM 451 CG PRO A 409 8.630 -7.267 -6.353 1.00 0.00 C ATOM 452 CD PRO A 409 7.970 -6.555 -5.175 1.00 0.00 C ATOM 0 HA PRO A 409 11.084 -6.518 -4.815 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.652 -5.592 -7.297 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.666 -7.005 -7.080 1.00 0.00 H new ATOM 0 HG2 PRO A 409 7.972 -7.304 -7.221 1.00 0.00 H new ATOM 0 HG3 PRO A 409 8.891 -8.296 -6.107 1.00 0.00 H new ATOM 0 HD2 PRO A 409 7.285 -5.779 -5.517 1.00 0.00 H new ATOM 0 HD3 PRO A 409 7.387 -7.251 -4.571 1.00 0.00 H new ATOM 460 N GLN A 410 12.123 -4.292 -5.421 1.00 0.00 N ATOM 461 CA GLN A 410 12.742 -2.957 -5.489 1.00 0.00 C ATOM 462 C GLN A 410 12.420 -2.220 -6.810 1.00 0.00 C ATOM 463 O GLN A 410 12.502 -0.993 -6.872 1.00 0.00 O ATOM 464 CB GLN A 410 14.257 -3.113 -5.256 1.00 0.00 C ATOM 465 CG GLN A 410 14.984 -1.781 -4.997 1.00 0.00 C ATOM 466 CD GLN A 410 16.481 -1.972 -4.725 1.00 0.00 C ATOM 467 OE1 GLN A 410 16.907 -2.811 -3.940 1.00 0.00 O ATOM 468 NE2 GLN A 410 17.346 -1.208 -5.366 1.00 0.00 N ATOM 0 H GLN A 410 12.790 -5.061 -5.485 1.00 0.00 H new ATOM 0 HA GLN A 410 12.320 -2.325 -4.708 1.00 0.00 H new ATOM 0 HB2 GLN A 410 14.418 -3.776 -4.406 1.00 0.00 H new ATOM 0 HB3 GLN A 410 14.702 -3.596 -6.126 1.00 0.00 H new ATOM 0 HG2 GLN A 410 14.855 -1.127 -5.859 1.00 0.00 H new ATOM 0 HG3 GLN A 410 14.524 -1.280 -4.145 1.00 0.00 H new ATOM 0 HE21 GLN A 410 17.014 -0.503 -6.024 1.00 0.00 H new ATOM 0 HE22 GLN A 410 18.346 -1.323 -5.203 1.00 0.00 H new ATOM 477 N GLU A 411 12.007 -2.954 -7.850 1.00 0.00 N ATOM 478 CA GLU A 411 11.618 -2.431 -9.168 1.00 0.00 C ATOM 479 C GLU A 411 10.097 -2.204 -9.330 1.00 0.00 C ATOM 480 O GLU A 411 9.648 -1.779 -10.397 1.00 0.00 O ATOM 481 CB GLU A 411 12.172 -3.358 -10.267 1.00 0.00 C ATOM 482 CG GLU A 411 11.563 -4.769 -10.267 1.00 0.00 C ATOM 483 CD GLU A 411 12.180 -5.629 -11.380 1.00 0.00 C ATOM 484 OE1 GLU A 411 13.207 -6.304 -11.129 1.00 0.00 O ATOM 485 OE2 GLU A 411 11.641 -5.644 -12.513 1.00 0.00 O ATOM 0 H GLU A 411 11.931 -3.970 -7.796 1.00 0.00 H new ATOM 0 HA GLU A 411 12.058 -1.438 -9.264 1.00 0.00 H new ATOM 0 HB2 GLU A 411 11.994 -2.898 -11.239 1.00 0.00 H new ATOM 0 HB3 GLU A 411 13.252 -3.441 -10.147 1.00 0.00 H new ATOM 0 HG2 GLU A 411 11.731 -5.243 -9.300 1.00 0.00 H new ATOM 0 HG3 GLU A 411 10.484 -4.704 -10.407 1.00 0.00 H new ATOM 492 N PHE A 412 9.293 -2.494 -8.298 1.00 0.00 N ATOM 493 CA PHE A 412 7.830 -2.426 -8.340 1.00 0.00 C ATOM 494 C PHE A 412 7.334 -0.969 -8.381 1.00 0.00 C ATOM 495 O PHE A 412 7.704 -0.157 -7.527 1.00 0.00 O ATOM 496 CB PHE A 412 7.269 -3.180 -7.122 1.00 0.00 C ATOM 497 CG PHE A 412 5.995 -3.959 -7.365 1.00 0.00 C ATOM 498 CD1 PHE A 412 6.026 -5.090 -8.204 1.00 0.00 C ATOM 499 CD2 PHE A 412 4.809 -3.622 -6.687 1.00 0.00 C ATOM 500 CE1 PHE A 412 4.873 -5.880 -8.368 1.00 0.00 C ATOM 501 CE2 PHE A 412 3.665 -4.425 -6.838 1.00 0.00 C ATOM 502 CZ PHE A 412 3.692 -5.546 -7.684 1.00 0.00 C ATOM 0 H PHE A 412 9.653 -2.789 -7.390 1.00 0.00 H new ATOM 0 HA PHE A 412 7.471 -2.898 -9.254 1.00 0.00 H new ATOM 0 HB2 PHE A 412 8.032 -3.870 -6.761 1.00 0.00 H new ATOM 0 HB3 PHE A 412 7.087 -2.460 -6.324 1.00 0.00 H new ATOM 0 HD1 PHE A 412 6.937 -5.351 -8.723 1.00 0.00 H new ATOM 0 HD2 PHE A 412 4.778 -2.749 -6.052 1.00 0.00 H new ATOM 0 HE1 PHE A 412 4.896 -6.742 -9.019 1.00 0.00 H new ATOM 0 HE2 PHE A 412 2.761 -4.179 -6.301 1.00 0.00 H new ATOM 0 HZ PHE A 412 2.806 -6.151 -7.809 1.00 0.00 H new ATOM 512 N GLY A 413 6.496 -0.635 -9.367 1.00 0.00 N ATOM 513 CA GLY A 413 5.903 0.694 -9.543 1.00 0.00 C ATOM 514 C GLY A 413 4.514 0.825 -8.919 1.00 0.00 C ATOM 515 O GLY A 413 3.876 -0.155 -8.533 1.00 0.00 O ATOM 0 H GLY A 413 6.204 -1.299 -10.084 1.00 0.00 H new ATOM 0 HA2 GLY A 413 6.564 1.440 -9.101 1.00 0.00 H new ATOM 0 HA3 GLY A 413 5.837 0.917 -10.608 1.00 0.00 H new ATOM 519 N ASP A 414 4.012 2.058 -8.875 1.00 0.00 N ATOM 520 CA ASP A 414 2.680 2.386 -8.345 1.00 0.00 C ATOM 521 C ASP A 414 1.542 1.741 -9.157 1.00 0.00 C ATOM 522 O ASP A 414 0.525 1.332 -8.596 1.00 0.00 O ATOM 523 CB ASP A 414 2.520 3.909 -8.334 1.00 0.00 C ATOM 524 CG ASP A 414 3.547 4.599 -7.431 1.00 0.00 C ATOM 525 OD1 ASP A 414 3.387 4.513 -6.193 1.00 0.00 O ATOM 526 OD2 ASP A 414 4.503 5.206 -7.965 1.00 0.00 O ATOM 0 H ASP A 414 4.524 2.874 -9.211 1.00 0.00 H new ATOM 0 HA ASP A 414 2.609 1.982 -7.335 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.621 4.289 -9.351 1.00 0.00 H new ATOM 0 HB3 ASP A 414 1.515 4.163 -7.997 1.00 0.00 H new ATOM 531 N GLN A 415 1.735 1.600 -10.472 1.00 0.00 N ATOM 532 CA GLN A 415 0.828 0.928 -11.386 1.00 0.00 C ATOM 533 C GLN A 415 0.922 -0.605 -11.295 1.00 0.00 C ATOM 534 O GLN A 415 -0.056 -1.288 -11.600 1.00 0.00 O ATOM 535 CB GLN A 415 1.180 1.409 -12.800 1.00 0.00 C ATOM 536 CG GLN A 415 0.764 2.868 -13.061 1.00 0.00 C ATOM 537 CD GLN A 415 1.021 3.310 -14.506 1.00 0.00 C ATOM 538 OE1 GLN A 415 2.039 3.006 -15.117 1.00 0.00 O ATOM 539 NE2 GLN A 415 0.114 4.049 -15.116 1.00 0.00 N ATOM 0 H GLN A 415 2.563 1.968 -10.940 1.00 0.00 H new ATOM 0 HA GLN A 415 -0.201 1.176 -11.124 1.00 0.00 H new ATOM 0 HB2 GLN A 415 2.255 1.310 -12.954 1.00 0.00 H new ATOM 0 HB3 GLN A 415 0.693 0.762 -13.530 1.00 0.00 H new ATOM 0 HG2 GLN A 415 -0.295 2.985 -12.833 1.00 0.00 H new ATOM 0 HG3 GLN A 415 1.310 3.524 -12.383 1.00 0.00 H new ATOM 0 HE21 GLN A 415 -0.741 4.314 -14.627 1.00 0.00 H new ATOM 0 HE22 GLN A 415 0.268 4.355 -16.077 1.00 0.00 H new ATOM 548 N ASP A 416 2.050 -1.164 -10.844 1.00 0.00 N ATOM 549 CA ASP A 416 2.168 -2.601 -10.562 1.00 0.00 C ATOM 550 C ASP A 416 1.411 -2.956 -9.277 1.00 0.00 C ATOM 551 O ASP A 416 0.682 -3.947 -9.248 1.00 0.00 O ATOM 552 CB ASP A 416 3.638 -3.039 -10.453 1.00 0.00 C ATOM 553 CG ASP A 416 4.433 -2.813 -11.745 1.00 0.00 C ATOM 554 OD1 ASP A 416 4.101 -3.439 -12.780 1.00 0.00 O ATOM 555 OD2 ASP A 416 5.414 -2.033 -11.708 1.00 0.00 O ATOM 0 H ASP A 416 2.904 -0.637 -10.664 1.00 0.00 H new ATOM 0 HA ASP A 416 1.723 -3.140 -11.398 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.114 -2.491 -9.640 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.677 -4.096 -10.190 1.00 0.00 H new ATOM 560 N LEU A 417 1.505 -2.102 -8.247 1.00 0.00 N ATOM 561 CA LEU A 417 0.723 -2.233 -7.017 1.00 0.00 C ATOM 562 C LEU A 417 -0.779 -2.082 -7.288 1.00 0.00 C ATOM 563 O LEU A 417 -1.580 -2.824 -6.724 1.00 0.00 O ATOM 564 CB LEU A 417 1.242 -1.218 -5.979 1.00 0.00 C ATOM 565 CG LEU A 417 0.741 -1.478 -4.543 1.00 0.00 C ATOM 566 CD1 LEU A 417 1.321 -2.774 -3.956 1.00 0.00 C ATOM 567 CD2 LEU A 417 1.132 -0.313 -3.624 1.00 0.00 C ATOM 0 H LEU A 417 2.131 -1.297 -8.248 1.00 0.00 H new ATOM 0 HA LEU A 417 0.851 -3.236 -6.609 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.332 -1.236 -5.982 1.00 0.00 H new ATOM 0 HB3 LEU A 417 0.939 -0.216 -6.283 1.00 0.00 H new ATOM 0 HG LEU A 417 -0.343 -1.573 -4.600 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.941 -2.917 -2.944 1.00 0.00 H new ATOM 0 HD12 LEU A 417 1.025 -3.619 -4.577 1.00 0.00 H new ATOM 0 HD13 LEU A 417 2.409 -2.707 -3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 417 0.772 -0.510 -2.614 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.217 -0.210 -3.609 1.00 0.00 H new ATOM 0 HD23 LEU A 417 0.685 0.609 -3.995 1.00 0.00 H new ATOM 579 N LEU A 418 -1.168 -1.194 -8.207 1.00 0.00 N ATOM 580 CA LEU A 418 -2.558 -1.056 -8.643 1.00 0.00 C ATOM 581 C LEU A 418 -3.064 -2.327 -9.324 1.00 0.00 C ATOM 582 O LEU A 418 -4.082 -2.873 -8.910 1.00 0.00 O ATOM 583 CB LEU A 418 -2.665 0.166 -9.565 1.00 0.00 C ATOM 584 CG LEU A 418 -4.091 0.576 -9.971 1.00 0.00 C ATOM 585 CD1 LEU A 418 -4.965 0.934 -8.762 1.00 0.00 C ATOM 586 CD2 LEU A 418 -4.007 1.773 -10.926 1.00 0.00 C ATOM 0 H LEU A 418 -0.526 -0.550 -8.670 1.00 0.00 H new ATOM 0 HA LEU A 418 -3.197 -0.905 -7.773 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.191 1.013 -9.070 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -2.093 -0.035 -10.471 1.00 0.00 H new ATOM 0 HG LEU A 418 -4.561 -0.277 -10.461 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -5.961 1.216 -9.104 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -5.040 0.072 -8.099 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.516 1.769 -8.223 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -5.012 2.074 -11.222 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.512 2.605 -10.424 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -3.437 1.493 -11.812 1.00 0.00 H new ATOM 598 N GLN A 419 -2.354 -2.831 -10.335 1.00 0.00 N ATOM 599 CA GLN A 419 -2.777 -4.023 -11.084 1.00 0.00 C ATOM 600 C GLN A 419 -2.731 -5.308 -10.241 1.00 0.00 C ATOM 601 O GLN A 419 -3.451 -6.262 -10.544 1.00 0.00 O ATOM 602 CB GLN A 419 -1.921 -4.152 -12.354 1.00 0.00 C ATOM 603 CG GLN A 419 -2.263 -3.064 -13.386 1.00 0.00 C ATOM 604 CD GLN A 419 -1.226 -3.004 -14.507 1.00 0.00 C ATOM 605 OE1 GLN A 419 -1.407 -3.532 -15.598 1.00 0.00 O ATOM 606 NE2 GLN A 419 -0.100 -2.362 -14.275 1.00 0.00 N ATOM 0 H GLN A 419 -1.474 -2.430 -10.659 1.00 0.00 H new ATOM 0 HA GLN A 419 -3.823 -3.893 -11.361 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -0.866 -4.083 -12.090 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -2.075 -5.135 -12.798 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -3.247 -3.261 -13.811 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -2.319 -2.095 -12.889 1.00 0.00 H new ATOM 0 HE21 GLN A 419 0.058 -1.920 -13.369 1.00 0.00 H new ATOM 0 HE22 GLN A 419 0.614 -2.307 -15.001 1.00 0.00 H new ATOM 615 N MET A 420 -1.952 -5.323 -9.155 1.00 0.00 N ATOM 616 CA MET A 420 -1.924 -6.408 -8.171 1.00 0.00 C ATOM 617 C MET A 420 -3.182 -6.425 -7.283 1.00 0.00 C ATOM 618 O MET A 420 -3.699 -7.502 -6.979 1.00 0.00 O ATOM 619 CB MET A 420 -0.646 -6.256 -7.329 1.00 0.00 C ATOM 620 CG MET A 420 -0.416 -7.426 -6.372 1.00 0.00 C ATOM 621 SD MET A 420 0.104 -8.947 -7.206 1.00 0.00 S ATOM 622 CE MET A 420 1.779 -9.061 -6.537 1.00 0.00 C ATOM 0 H MET A 420 -1.309 -4.564 -8.931 1.00 0.00 H new ATOM 0 HA MET A 420 -1.918 -7.365 -8.693 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.212 -6.165 -7.995 1.00 0.00 H new ATOM 0 HB3 MET A 420 -0.704 -5.331 -6.755 1.00 0.00 H new ATOM 0 HG2 MET A 420 0.342 -7.144 -5.641 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.335 -7.620 -5.819 1.00 0.00 H new ATOM 0 HE1 MET A 420 2.336 -9.825 -7.079 1.00 0.00 H new ATOM 0 HE2 MET A 420 2.281 -8.100 -6.647 1.00 0.00 H new ATOM 0 HE3 MET A 420 1.732 -9.327 -5.481 1.00 0.00 H new ATOM 632 N PHE A 421 -3.679 -5.250 -6.874 1.00 0.00 N ATOM 633 CA PHE A 421 -4.738 -5.103 -5.865 1.00 0.00 C ATOM 634 C PHE A 421 -6.134 -4.737 -6.423 1.00 0.00 C ATOM 635 O PHE A 421 -7.138 -5.008 -5.762 1.00 0.00 O ATOM 636 CB PHE A 421 -4.234 -4.144 -4.772 1.00 0.00 C ATOM 637 CG PHE A 421 -3.298 -4.808 -3.770 1.00 0.00 C ATOM 638 CD1 PHE A 421 -1.908 -4.847 -3.993 1.00 0.00 C ATOM 639 CD2 PHE A 421 -3.820 -5.414 -2.612 1.00 0.00 C ATOM 640 CE1 PHE A 421 -1.055 -5.500 -3.086 1.00 0.00 C ATOM 641 CE2 PHE A 421 -2.969 -6.060 -1.695 1.00 0.00 C ATOM 642 CZ PHE A 421 -1.586 -6.114 -1.939 1.00 0.00 C ATOM 0 H PHE A 421 -3.350 -4.357 -7.242 1.00 0.00 H new ATOM 0 HA PHE A 421 -4.926 -6.085 -5.430 1.00 0.00 H new ATOM 0 HB2 PHE A 421 -3.717 -3.308 -5.243 1.00 0.00 H new ATOM 0 HB3 PHE A 421 -5.090 -3.730 -4.239 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -1.493 -4.371 -4.869 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -4.883 -5.383 -2.425 1.00 0.00 H new ATOM 0 HE1 PHE A 421 0.009 -5.530 -3.271 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.379 -6.514 -0.805 1.00 0.00 H new ATOM 0 HZ PHE A 421 -0.933 -6.626 -1.247 1.00 0.00 H new ATOM 652 N MET A 422 -6.240 -4.220 -7.655 1.00 0.00 N ATOM 653 CA MET A 422 -7.518 -3.999 -8.368 1.00 0.00 C ATOM 654 C MET A 422 -8.478 -5.214 -8.414 1.00 0.00 C ATOM 655 O MET A 422 -9.684 -4.989 -8.280 1.00 0.00 O ATOM 656 CB MET A 422 -7.254 -3.521 -9.808 1.00 0.00 C ATOM 657 CG MET A 422 -7.082 -2.002 -9.900 1.00 0.00 C ATOM 658 SD MET A 422 -7.210 -1.301 -11.571 1.00 0.00 S ATOM 659 CE MET A 422 -5.848 -2.148 -12.418 1.00 0.00 C ATOM 0 H MET A 422 -5.426 -3.936 -8.200 1.00 0.00 H new ATOM 0 HA MET A 422 -8.026 -3.237 -7.777 1.00 0.00 H new ATOM 0 HB2 MET A 422 -6.357 -4.009 -10.191 1.00 0.00 H new ATOM 0 HB3 MET A 422 -8.082 -3.829 -10.447 1.00 0.00 H new ATOM 0 HG2 MET A 422 -7.834 -1.530 -9.268 1.00 0.00 H new ATOM 0 HG3 MET A 422 -6.108 -1.738 -9.488 1.00 0.00 H new ATOM 0 HE1 MET A 422 -5.781 -1.791 -13.446 1.00 0.00 H new ATOM 0 HE2 MET A 422 -4.912 -1.940 -11.900 1.00 0.00 H new ATOM 0 HE3 MET A 422 -6.032 -3.222 -12.418 1.00 0.00 H new ATOM 669 N PRO A 423 -8.007 -6.472 -8.575 1.00 0.00 N ATOM 670 CA PRO A 423 -8.845 -7.674 -8.547 1.00 0.00 C ATOM 671 C PRO A 423 -9.728 -7.867 -7.302 1.00 0.00 C ATOM 672 O PRO A 423 -10.649 -8.684 -7.349 1.00 0.00 O ATOM 673 CB PRO A 423 -7.873 -8.849 -8.695 1.00 0.00 C ATOM 674 CG PRO A 423 -6.760 -8.264 -9.557 1.00 0.00 C ATOM 675 CD PRO A 423 -6.677 -6.824 -9.057 1.00 0.00 C ATOM 0 HA PRO A 423 -9.577 -7.590 -9.350 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -7.500 -9.189 -7.729 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -8.346 -9.707 -9.173 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -5.819 -8.796 -9.420 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -7.002 -8.312 -10.619 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -5.939 -6.733 -8.260 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -6.365 -6.153 -9.858 1.00 0.00 H new ATOM 683 N PHE A 424 -9.483 -7.130 -6.209 1.00 0.00 N ATOM 684 CA PHE A 424 -10.217 -7.255 -4.942 1.00 0.00 C ATOM 685 C PHE A 424 -11.204 -6.099 -4.676 1.00 0.00 C ATOM 686 O PHE A 424 -11.908 -6.129 -3.665 1.00 0.00 O ATOM 687 CB PHE A 424 -9.199 -7.422 -3.802 1.00 0.00 C ATOM 688 CG PHE A 424 -8.135 -8.473 -4.071 1.00 0.00 C ATOM 689 CD1 PHE A 424 -8.509 -9.818 -4.260 1.00 0.00 C ATOM 690 CD2 PHE A 424 -6.782 -8.103 -4.208 1.00 0.00 C ATOM 691 CE1 PHE A 424 -7.544 -10.778 -4.608 1.00 0.00 C ATOM 692 CE2 PHE A 424 -5.820 -9.063 -4.564 1.00 0.00 C ATOM 693 CZ PHE A 424 -6.199 -10.400 -4.765 1.00 0.00 C ATOM 0 H PHE A 424 -8.755 -6.416 -6.181 1.00 0.00 H new ATOM 0 HA PHE A 424 -10.852 -8.138 -5.005 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -8.711 -6.464 -3.621 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -9.732 -7.685 -2.889 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -9.541 -10.112 -4.137 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -6.484 -7.079 -4.039 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.836 -11.807 -4.755 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.787 -8.772 -4.683 1.00 0.00 H new ATOM 0 HZ PHE A 424 -5.459 -11.137 -5.040 1.00 0.00 H new ATOM 703 N GLY A 425 -11.290 -5.105 -5.575 1.00 0.00 N ATOM 704 CA GLY A 425 -12.235 -3.977 -5.505 1.00 0.00 C ATOM 705 C GLY A 425 -11.693 -2.655 -6.057 1.00 0.00 C ATOM 706 O GLY A 425 -10.536 -2.559 -6.469 1.00 0.00 O ATOM 0 H GLY A 425 -10.686 -5.062 -6.396 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -13.138 -4.242 -6.055 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -12.527 -3.829 -4.465 1.00 0.00 H new ATOM 710 N ASN A 426 -12.539 -1.619 -6.062 1.00 0.00 N ATOM 711 CA ASN A 426 -12.191 -0.287 -6.575 1.00 0.00 C ATOM 712 C ASN A 426 -11.157 0.425 -5.675 1.00 0.00 C ATOM 713 O ASN A 426 -11.370 0.559 -4.467 1.00 0.00 O ATOM 714 CB ASN A 426 -13.471 0.554 -6.735 1.00 0.00 C ATOM 715 CG ASN A 426 -13.210 1.924 -7.365 1.00 0.00 C ATOM 716 OD1 ASN A 426 -12.234 2.138 -8.074 1.00 0.00 O ATOM 717 ND2 ASN A 426 -14.070 2.896 -7.117 1.00 0.00 N ATOM 0 H ASN A 426 -13.493 -1.681 -5.707 1.00 0.00 H new ATOM 0 HA ASN A 426 -11.721 -0.405 -7.551 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -14.184 0.007 -7.351 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -13.934 0.692 -5.758 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -13.921 3.823 -7.516 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -14.883 2.719 -6.527 1.00 0.00 H new ATOM 724 N VAL A 427 -10.062 0.901 -6.273 1.00 0.00 N ATOM 725 CA VAL A 427 -8.919 1.535 -5.592 1.00 0.00 C ATOM 726 C VAL A 427 -8.957 3.050 -5.824 1.00 0.00 C ATOM 727 O VAL A 427 -8.952 3.516 -6.961 1.00 0.00 O ATOM 728 CB VAL A 427 -7.578 0.926 -6.073 1.00 0.00 C ATOM 729 CG1 VAL A 427 -6.363 1.661 -5.486 1.00 0.00 C ATOM 730 CG2 VAL A 427 -7.475 -0.564 -5.696 1.00 0.00 C ATOM 0 H VAL A 427 -9.938 0.856 -7.284 1.00 0.00 H new ATOM 0 HA VAL A 427 -8.995 1.344 -4.522 1.00 0.00 H new ATOM 0 HB VAL A 427 -7.569 1.037 -7.157 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -5.446 1.198 -5.852 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.388 2.707 -5.791 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -6.391 1.600 -4.398 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -6.523 -0.963 -6.047 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -7.536 -0.670 -4.613 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -8.293 -1.114 -6.161 1.00 0.00 H new ATOM 740 N VAL A 428 -8.988 3.811 -4.732 1.00 0.00 N ATOM 741 CA VAL A 428 -8.991 5.284 -4.697 1.00 0.00 C ATOM 742 C VAL A 428 -7.576 5.839 -4.911 1.00 0.00 C ATOM 743 O VAL A 428 -7.407 6.849 -5.592 1.00 0.00 O ATOM 744 CB VAL A 428 -9.573 5.804 -3.357 1.00 0.00 C ATOM 745 CG1 VAL A 428 -9.602 7.342 -3.279 1.00 0.00 C ATOM 746 CG2 VAL A 428 -11.004 5.278 -3.130 1.00 0.00 C ATOM 0 H VAL A 428 -9.013 3.403 -3.797 1.00 0.00 H new ATOM 0 HA VAL A 428 -9.627 5.635 -5.510 1.00 0.00 H new ATOM 0 HB VAL A 428 -8.906 5.429 -2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -10.019 7.650 -2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -8.588 7.730 -3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -10.220 7.736 -4.086 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -11.386 5.659 -2.183 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -11.648 5.614 -3.942 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -10.991 4.188 -3.104 1.00 0.00 H new ATOM 756 N SER A 429 -6.550 5.156 -4.398 1.00 0.00 N ATOM 757 CA SER A 429 -5.137 5.513 -4.580 1.00 0.00 C ATOM 758 C SER A 429 -4.204 4.323 -4.286 1.00 0.00 C ATOM 759 O SER A 429 -4.507 3.477 -3.437 1.00 0.00 O ATOM 760 CB SER A 429 -4.757 6.738 -3.731 1.00 0.00 C ATOM 761 OG SER A 429 -4.917 6.499 -2.344 1.00 0.00 O ATOM 0 H SER A 429 -6.680 4.319 -3.830 1.00 0.00 H new ATOM 0 HA SER A 429 -5.005 5.778 -5.629 1.00 0.00 H new ATOM 0 HB2 SER A 429 -3.721 7.011 -3.934 1.00 0.00 H new ATOM 0 HB3 SER A 429 -5.374 7.587 -4.025 1.00 0.00 H new ATOM 0 HG SER A 429 -5.562 7.138 -1.974 1.00 0.00 H new ATOM 767 N ALA A 430 -3.068 4.259 -4.988 1.00 0.00 N ATOM 768 CA ALA A 430 -2.028 3.239 -4.847 1.00 0.00 C ATOM 769 C ALA A 430 -0.653 3.924 -4.832 1.00 0.00 C ATOM 770 O ALA A 430 -0.354 4.761 -5.691 1.00 0.00 O ATOM 771 CB ALA A 430 -2.159 2.223 -5.991 1.00 0.00 C ATOM 0 H ALA A 430 -2.840 4.950 -5.703 1.00 0.00 H new ATOM 0 HA ALA A 430 -2.140 2.696 -3.909 1.00 0.00 H new ATOM 0 HB1 ALA A 430 -1.386 1.461 -5.891 1.00 0.00 H new ATOM 0 HB2 ALA A 430 -3.141 1.752 -5.949 1.00 0.00 H new ATOM 0 HB3 ALA A 430 -2.043 2.734 -6.947 1.00 0.00 H new ATOM 777 N LYS A 431 0.182 3.572 -3.852 1.00 0.00 N ATOM 778 CA LYS A 431 1.410 4.309 -3.539 1.00 0.00 C ATOM 779 C LYS A 431 2.540 3.402 -3.031 1.00 0.00 C ATOM 780 O LYS A 431 2.505 2.957 -1.888 1.00 0.00 O ATOM 781 CB LYS A 431 1.026 5.371 -2.491 1.00 0.00 C ATOM 782 CG LYS A 431 2.119 6.379 -2.106 1.00 0.00 C ATOM 783 CD LYS A 431 2.542 7.282 -3.270 1.00 0.00 C ATOM 784 CE LYS A 431 3.361 8.457 -2.725 1.00 0.00 C ATOM 785 NZ LYS A 431 3.787 9.397 -3.789 1.00 0.00 N ATOM 0 H LYS A 431 0.025 2.764 -3.250 1.00 0.00 H new ATOM 0 HA LYS A 431 1.808 4.768 -4.444 1.00 0.00 H new ATOM 0 HB2 LYS A 431 0.167 5.926 -2.867 1.00 0.00 H new ATOM 0 HB3 LYS A 431 0.702 4.856 -1.586 1.00 0.00 H new ATOM 0 HG2 LYS A 431 1.760 6.999 -1.285 1.00 0.00 H new ATOM 0 HG3 LYS A 431 2.991 5.838 -1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 431 3.132 6.715 -3.990 1.00 0.00 H new ATOM 0 HD3 LYS A 431 1.663 7.650 -3.798 1.00 0.00 H new ATOM 0 HE2 LYS A 431 2.769 8.996 -1.985 1.00 0.00 H new ATOM 0 HE3 LYS A 431 4.242 8.073 -2.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 4.060 10.305 -3.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 4.599 8.997 -4.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 3.001 9.550 -4.452 1.00 0.00 H new ATOM 799 N VAL A 432 3.557 3.151 -3.849 1.00 0.00 N ATOM 800 CA VAL A 432 4.819 2.530 -3.414 1.00 0.00 C ATOM 801 C VAL A 432 5.673 3.665 -2.845 1.00 0.00 C ATOM 802 O VAL A 432 5.772 4.723 -3.467 1.00 0.00 O ATOM 803 CB VAL A 432 5.552 1.809 -4.569 1.00 0.00 C ATOM 804 CG1 VAL A 432 6.880 1.200 -4.085 1.00 0.00 C ATOM 805 CG2 VAL A 432 4.683 0.683 -5.154 1.00 0.00 C ATOM 0 H VAL A 432 3.535 3.373 -4.844 1.00 0.00 H new ATOM 0 HA VAL A 432 4.625 1.757 -2.671 1.00 0.00 H new ATOM 0 HB VAL A 432 5.751 2.556 -5.338 1.00 0.00 H new ATOM 0 HG11 VAL A 432 7.375 0.699 -4.917 1.00 0.00 H new ATOM 0 HG12 VAL A 432 7.525 1.991 -3.702 1.00 0.00 H new ATOM 0 HG13 VAL A 432 6.682 0.478 -3.293 1.00 0.00 H new ATOM 0 HG21 VAL A 432 5.221 0.192 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 432 4.458 -0.045 -4.375 1.00 0.00 H new ATOM 0 HG23 VAL A 432 3.753 1.103 -5.538 1.00 0.00 H new ATOM 815 N PHE A 433 6.246 3.482 -1.653 1.00 0.00 N ATOM 816 CA PHE A 433 7.000 4.537 -0.981 1.00 0.00 C ATOM 817 C PHE A 433 8.390 4.700 -1.618 1.00 0.00 C ATOM 818 O PHE A 433 9.240 3.807 -1.537 1.00 0.00 O ATOM 819 CB PHE A 433 7.055 4.270 0.527 1.00 0.00 C ATOM 820 CG PHE A 433 7.571 5.452 1.327 1.00 0.00 C ATOM 821 CD1 PHE A 433 8.954 5.624 1.512 1.00 0.00 C ATOM 822 CD2 PHE A 433 6.673 6.390 1.878 1.00 0.00 C ATOM 823 CE1 PHE A 433 9.443 6.717 2.248 1.00 0.00 C ATOM 824 CE2 PHE A 433 7.162 7.486 2.614 1.00 0.00 C ATOM 825 CZ PHE A 433 8.546 7.646 2.805 1.00 0.00 C ATOM 0 H PHE A 433 6.200 2.606 -1.132 1.00 0.00 H new ATOM 0 HA PHE A 433 6.489 5.491 -1.113 1.00 0.00 H new ATOM 0 HB2 PHE A 433 6.057 4.009 0.880 1.00 0.00 H new ATOM 0 HB3 PHE A 433 7.694 3.407 0.713 1.00 0.00 H new ATOM 0 HD1 PHE A 433 9.645 4.912 1.086 1.00 0.00 H new ATOM 0 HD2 PHE A 433 5.610 6.267 1.735 1.00 0.00 H new ATOM 0 HE1 PHE A 433 10.507 6.843 2.386 1.00 0.00 H new ATOM 0 HE2 PHE A 433 6.473 8.205 3.033 1.00 0.00 H new ATOM 0 HZ PHE A 433 8.920 8.481 3.379 1.00 0.00 H new ATOM 835 N ILE A 434 8.615 5.851 -2.256 1.00 0.00 N ATOM 836 CA ILE A 434 9.865 6.209 -2.945 1.00 0.00 C ATOM 837 C ILE A 434 10.547 7.343 -2.175 1.00 0.00 C ATOM 838 O ILE A 434 9.955 8.404 -1.983 1.00 0.00 O ATOM 839 CB ILE A 434 9.594 6.629 -4.411 1.00 0.00 C ATOM 840 CG1 ILE A 434 8.727 5.643 -5.229 1.00 0.00 C ATOM 841 CG2 ILE A 434 10.924 6.877 -5.144 1.00 0.00 C ATOM 842 CD1 ILE A 434 9.223 4.192 -5.284 1.00 0.00 C ATOM 0 H ILE A 434 7.911 6.587 -2.311 1.00 0.00 H new ATOM 0 HA ILE A 434 10.521 5.339 -2.973 1.00 0.00 H new ATOM 0 HB ILE A 434 9.007 7.545 -4.339 1.00 0.00 H new ATOM 0 HG12 ILE A 434 7.720 5.645 -4.813 1.00 0.00 H new ATOM 0 HG13 ILE A 434 8.651 6.018 -6.250 1.00 0.00 H new ATOM 0 HG21 ILE A 434 10.722 7.172 -6.174 1.00 0.00 H new ATOM 0 HG22 ILE A 434 11.474 7.672 -4.640 1.00 0.00 H new ATOM 0 HG23 ILE A 434 11.519 5.964 -5.138 1.00 0.00 H new ATOM 0 HD11 ILE A 434 8.536 3.595 -5.884 1.00 0.00 H new ATOM 0 HD12 ILE A 434 10.216 4.164 -5.733 1.00 0.00 H new ATOM 0 HD13 ILE A 434 9.270 3.785 -4.274 1.00 0.00 H new ATOM 952 N SER A 441 12.940 2.941 -4.254 1.00 0.00 N ATOM 953 CA SER A 441 11.885 2.265 -3.486 1.00 0.00 C ATOM 954 C SER A 441 12.417 1.712 -2.156 1.00 0.00 C ATOM 955 O SER A 441 13.503 1.126 -2.091 1.00 0.00 O ATOM 956 CB SER A 441 11.269 1.127 -4.311 1.00 0.00 C ATOM 957 OG SER A 441 10.294 0.419 -3.555 1.00 0.00 O ATOM 0 HA SER A 441 11.119 3.007 -3.262 1.00 0.00 H new ATOM 0 HB2 SER A 441 10.810 1.534 -5.212 1.00 0.00 H new ATOM 0 HB3 SER A 441 12.053 0.441 -4.633 1.00 0.00 H new ATOM 0 HG SER A 441 9.914 -0.300 -4.102 1.00 0.00 H new ATOM 963 N LYS A 442 11.623 1.856 -1.090 1.00 0.00 N ATOM 964 CA LYS A 442 11.902 1.278 0.232 1.00 0.00 C ATOM 965 C LYS A 442 11.229 -0.099 0.447 1.00 0.00 C ATOM 966 O LYS A 442 11.170 -0.587 1.577 1.00 0.00 O ATOM 967 CB LYS A 442 11.520 2.307 1.314 1.00 0.00 C ATOM 968 CG LYS A 442 12.203 3.685 1.195 1.00 0.00 C ATOM 969 CD LYS A 442 13.735 3.673 1.055 1.00 0.00 C ATOM 970 CE LYS A 442 14.432 2.835 2.133 1.00 0.00 C ATOM 971 NZ LYS A 442 15.911 2.940 2.024 1.00 0.00 N ATOM 0 H LYS A 442 10.752 2.387 -1.121 1.00 0.00 H new ATOM 0 HA LYS A 442 12.969 1.069 0.304 1.00 0.00 H new ATOM 0 HB2 LYS A 442 10.440 2.453 1.286 1.00 0.00 H new ATOM 0 HB3 LYS A 442 11.759 1.886 2.291 1.00 0.00 H new ATOM 0 HG2 LYS A 442 11.784 4.202 0.332 1.00 0.00 H new ATOM 0 HG3 LYS A 442 11.944 4.273 2.075 1.00 0.00 H new ATOM 0 HD2 LYS A 442 14.001 3.283 0.072 1.00 0.00 H new ATOM 0 HD3 LYS A 442 14.106 4.697 1.103 1.00 0.00 H new ATOM 0 HE2 LYS A 442 14.113 3.170 3.120 1.00 0.00 H new ATOM 0 HE3 LYS A 442 14.131 1.792 2.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 16.356 2.363 2.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 16.215 2.598 1.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 16.198 3.933 2.139 1.00 0.00 H new ATOM 985 N CYS A 443 10.693 -0.715 -0.618 1.00 0.00 N ATOM 986 CA CYS A 443 10.077 -2.058 -0.624 1.00 0.00 C ATOM 987 C CYS A 443 8.790 -2.166 0.230 1.00 0.00 C ATOM 988 O CYS A 443 8.376 -3.269 0.599 1.00 0.00 O ATOM 989 CB CYS A 443 11.136 -3.126 -0.280 1.00 0.00 C ATOM 990 SG CYS A 443 12.388 -3.194 -1.596 1.00 0.00 S ATOM 0 H CYS A 443 10.674 -0.276 -1.538 1.00 0.00 H new ATOM 0 HA CYS A 443 9.723 -2.249 -1.637 1.00 0.00 H new ATOM 0 HB2 CYS A 443 11.609 -2.889 0.673 1.00 0.00 H new ATOM 0 HB3 CYS A 443 10.660 -4.100 -0.167 1.00 0.00 H new ATOM 0 HG CYS A 443 12.042 -4.084 -2.479 1.00 0.00 H new ATOM 996 N PHE A 444 8.134 -1.035 0.504 1.00 0.00 N ATOM 997 CA PHE A 444 6.830 -0.953 1.166 1.00 0.00 C ATOM 998 C PHE A 444 5.921 0.057 0.457 1.00 0.00 C ATOM 999 O PHE A 444 6.399 0.963 -0.228 1.00 0.00 O ATOM 1000 CB PHE A 444 6.999 -0.665 2.666 1.00 0.00 C ATOM 1001 CG PHE A 444 7.405 0.743 3.070 1.00 0.00 C ATOM 1002 CD1 PHE A 444 6.436 1.762 3.168 1.00 0.00 C ATOM 1003 CD2 PHE A 444 8.738 1.020 3.430 1.00 0.00 C ATOM 1004 CE1 PHE A 444 6.798 3.042 3.622 1.00 0.00 C ATOM 1005 CE2 PHE A 444 9.103 2.305 3.871 1.00 0.00 C ATOM 1006 CZ PHE A 444 8.132 3.316 3.970 1.00 0.00 C ATOM 0 H PHE A 444 8.510 -0.118 0.262 1.00 0.00 H new ATOM 0 HA PHE A 444 6.332 -1.920 1.091 1.00 0.00 H new ATOM 0 HB2 PHE A 444 6.056 -0.898 3.161 1.00 0.00 H new ATOM 0 HB3 PHE A 444 7.745 -1.356 3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 444 5.412 1.558 2.893 1.00 0.00 H new ATOM 0 HD2 PHE A 444 9.484 0.242 3.367 1.00 0.00 H new ATOM 0 HE1 PHE A 444 6.050 3.816 3.704 1.00 0.00 H new ATOM 0 HE2 PHE A 444 10.129 2.515 4.133 1.00 0.00 H new ATOM 0 HZ PHE A 444 8.410 4.302 4.313 1.00 0.00 H new ATOM 1016 N GLY A 445 4.606 -0.118 0.598 1.00 0.00 N ATOM 1017 CA GLY A 445 3.594 0.710 -0.057 1.00 0.00 C ATOM 1018 C GLY A 445 2.210 0.610 0.574 1.00 0.00 C ATOM 1019 O GLY A 445 2.024 -0.032 1.608 1.00 0.00 O ATOM 0 H GLY A 445 4.208 -0.853 1.182 1.00 0.00 H new ATOM 0 HA2 GLY A 445 3.919 1.750 -0.033 1.00 0.00 H new ATOM 0 HA3 GLY A 445 3.526 0.421 -1.106 1.00 0.00 H new ATOM 1023 N PHE A 446 1.235 1.248 -0.070 1.00 0.00 N ATOM 1024 CA PHE A 446 -0.120 1.449 0.431 1.00 0.00 C ATOM 1025 C PHE A 446 -1.161 1.330 -0.685 1.00 0.00 C ATOM 1026 O PHE A 446 -0.887 1.678 -1.836 1.00 0.00 O ATOM 1027 CB PHE A 446 -0.240 2.834 1.087 1.00 0.00 C ATOM 1028 CG PHE A 446 0.749 3.109 2.199 1.00 0.00 C ATOM 1029 CD1 PHE A 446 0.427 2.783 3.529 1.00 0.00 C ATOM 1030 CD2 PHE A 446 1.996 3.691 1.898 1.00 0.00 C ATOM 1031 CE1 PHE A 446 1.350 3.043 4.558 1.00 0.00 C ATOM 1032 CE2 PHE A 446 2.927 3.925 2.923 1.00 0.00 C ATOM 1033 CZ PHE A 446 2.603 3.601 4.251 1.00 0.00 C ATOM 0 H PHE A 446 1.375 1.656 -0.994 1.00 0.00 H new ATOM 0 HA PHE A 446 -0.315 0.668 1.166 1.00 0.00 H new ATOM 0 HB2 PHE A 446 -0.117 3.595 0.316 1.00 0.00 H new ATOM 0 HB3 PHE A 446 -1.249 2.944 1.485 1.00 0.00 H new ATOM 0 HD1 PHE A 446 -0.528 2.334 3.760 1.00 0.00 H new ATOM 0 HD2 PHE A 446 2.236 3.957 0.879 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.096 2.814 5.583 1.00 0.00 H new ATOM 0 HE2 PHE A 446 3.891 4.353 2.691 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.319 3.781 5.039 1.00 0.00 H new ATOM 1043 N VAL A 447 -2.368 0.893 -0.324 1.00 0.00 N ATOM 1044 CA VAL A 447 -3.529 0.809 -1.232 1.00 0.00 C ATOM 1045 C VAL A 447 -4.785 1.243 -0.479 1.00 0.00 C ATOM 1046 O VAL A 447 -5.119 0.667 0.554 1.00 0.00 O ATOM 1047 CB VAL A 447 -3.716 -0.612 -1.824 1.00 0.00 C ATOM 1048 CG1 VAL A 447 -4.972 -0.700 -2.711 1.00 0.00 C ATOM 1049 CG2 VAL A 447 -2.511 -1.042 -2.678 1.00 0.00 C ATOM 0 H VAL A 447 -2.577 0.580 0.624 1.00 0.00 H new ATOM 0 HA VAL A 447 -3.347 1.476 -2.074 1.00 0.00 H new ATOM 0 HB VAL A 447 -3.817 -1.276 -0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -5.068 -1.711 -3.107 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -5.854 -0.457 -2.118 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -4.884 0.006 -3.537 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -2.684 -2.043 -3.073 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -2.383 -0.343 -3.504 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -1.611 -1.045 -2.062 1.00 0.00 H new ATOM 1059 N SER A 448 -5.480 2.248 -1.003 1.00 0.00 N ATOM 1060 CA SER A 448 -6.742 2.759 -0.454 1.00 0.00 C ATOM 1061 C SER A 448 -7.927 2.298 -1.301 1.00 0.00 C ATOM 1062 O SER A 448 -8.068 2.707 -2.453 1.00 0.00 O ATOM 1063 CB SER A 448 -6.731 4.290 -0.429 1.00 0.00 C ATOM 1064 OG SER A 448 -5.708 4.785 0.412 1.00 0.00 O ATOM 0 H SER A 448 -5.178 2.745 -1.841 1.00 0.00 H new ATOM 0 HA SER A 448 -6.843 2.370 0.559 1.00 0.00 H new ATOM 0 HB2 SER A 448 -6.589 4.671 -1.440 1.00 0.00 H new ATOM 0 HB3 SER A 448 -7.698 4.657 -0.083 1.00 0.00 H new ATOM 0 HG SER A 448 -5.942 4.613 1.348 1.00 0.00 H new ATOM 1070 N TYR A 449 -8.814 1.483 -0.734 1.00 0.00 N ATOM 1071 CA TYR A 449 -10.063 1.069 -1.381 1.00 0.00 C ATOM 1072 C TYR A 449 -11.209 2.067 -1.146 1.00 0.00 C ATOM 1073 O TYR A 449 -11.167 2.901 -0.241 1.00 0.00 O ATOM 1074 CB TYR A 449 -10.447 -0.330 -0.884 1.00 0.00 C ATOM 1075 CG TYR A 449 -9.564 -1.421 -1.445 1.00 0.00 C ATOM 1076 CD1 TYR A 449 -9.876 -1.996 -2.693 1.00 0.00 C ATOM 1077 CD2 TYR A 449 -8.426 -1.848 -0.736 1.00 0.00 C ATOM 1078 CE1 TYR A 449 -9.068 -3.015 -3.225 1.00 0.00 C ATOM 1079 CE2 TYR A 449 -7.618 -2.872 -1.259 1.00 0.00 C ATOM 1080 CZ TYR A 449 -7.942 -3.460 -2.499 1.00 0.00 C ATOM 1081 OH TYR A 449 -7.158 -4.446 -2.999 1.00 0.00 O ATOM 0 H TYR A 449 -8.687 1.086 0.197 1.00 0.00 H new ATOM 0 HA TYR A 449 -9.894 1.047 -2.458 1.00 0.00 H new ATOM 0 HB2 TYR A 449 -10.392 -0.350 0.204 1.00 0.00 H new ATOM 0 HB3 TYR A 449 -11.483 -0.534 -1.155 1.00 0.00 H new ATOM 0 HD1 TYR A 449 -10.740 -1.652 -3.243 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -8.174 -1.389 0.209 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -9.307 -3.455 -4.182 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -6.750 -3.208 -0.712 1.00 0.00 H new ATOM 0 HH TYR A 449 -7.279 -4.500 -3.970 1.00 0.00 H new ATOM 1091 N ASP A 450 -12.265 1.953 -1.953 1.00 0.00 N ATOM 1092 CA ASP A 450 -13.509 2.718 -1.798 1.00 0.00 C ATOM 1093 C ASP A 450 -14.371 2.246 -0.601 1.00 0.00 C ATOM 1094 O ASP A 450 -15.274 2.963 -0.170 1.00 0.00 O ATOM 1095 CB ASP A 450 -14.270 2.640 -3.130 1.00 0.00 C ATOM 1096 CG ASP A 450 -15.550 3.492 -3.151 1.00 0.00 C ATOM 1097 OD1 ASP A 450 -15.441 4.741 -3.112 1.00 0.00 O ATOM 1098 OD2 ASP A 450 -16.656 2.909 -3.252 1.00 0.00 O ATOM 0 H ASP A 450 -12.283 1.315 -2.749 1.00 0.00 H new ATOM 0 HA ASP A 450 -13.267 3.754 -1.562 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -13.612 2.966 -3.936 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -14.530 1.601 -3.331 1.00 0.00 H new ATOM 1103 N ASN A 451 -14.070 1.071 -0.026 1.00 0.00 N ATOM 1104 CA ASN A 451 -14.763 0.482 1.129 1.00 0.00 C ATOM 1105 C ASN A 451 -13.873 -0.550 1.877 1.00 0.00 C ATOM 1106 O ASN A 451 -12.894 -1.040 1.298 1.00 0.00 O ATOM 1107 CB ASN A 451 -16.112 -0.113 0.664 1.00 0.00 C ATOM 1108 CG ASN A 451 -15.976 -1.500 0.046 1.00 0.00 C ATOM 1109 OD1 ASN A 451 -15.700 -2.470 0.743 1.00 0.00 O ATOM 1110 ND2 ASN A 451 -16.151 -1.638 -1.252 1.00 0.00 N ATOM 0 H ASN A 451 -13.309 0.484 -0.366 1.00 0.00 H new ATOM 0 HA ASN A 451 -14.970 1.264 1.859 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -16.791 -0.167 1.515 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -16.566 0.559 -0.064 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -16.057 -2.557 -1.684 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -16.380 -0.826 -1.825 1.00 0.00 H new ATOM 1117 N PRO A 452 -14.194 -0.912 3.138 1.00 0.00 N ATOM 1118 CA PRO A 452 -13.340 -1.765 3.964 1.00 0.00 C ATOM 1119 C PRO A 452 -13.470 -3.271 3.683 1.00 0.00 C ATOM 1120 O PRO A 452 -12.566 -4.017 4.052 1.00 0.00 O ATOM 1121 CB PRO A 452 -13.712 -1.426 5.407 1.00 0.00 C ATOM 1122 CG PRO A 452 -15.186 -1.054 5.311 1.00 0.00 C ATOM 1123 CD PRO A 452 -15.303 -0.399 3.935 1.00 0.00 C ATOM 0 HA PRO A 452 -12.293 -1.565 3.738 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -13.554 -2.274 6.073 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -13.113 -0.601 5.794 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -15.827 -1.932 5.393 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -15.479 -0.370 6.107 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -16.259 -0.640 3.470 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -15.253 0.687 4.016 1.00 0.00 H new ATOM 1131 N VAL A 453 -14.534 -3.738 3.015 1.00 0.00 N ATOM 1132 CA VAL A 453 -14.714 -5.166 2.684 1.00 0.00 C ATOM 1133 C VAL A 453 -13.743 -5.570 1.566 1.00 0.00 C ATOM 1134 O VAL A 453 -13.143 -6.641 1.636 1.00 0.00 O ATOM 1135 CB VAL A 453 -16.174 -5.498 2.283 1.00 0.00 C ATOM 1136 CG1 VAL A 453 -16.367 -7.004 2.031 1.00 0.00 C ATOM 1137 CG2 VAL A 453 -17.167 -5.056 3.375 1.00 0.00 C ATOM 0 H VAL A 453 -15.294 -3.142 2.688 1.00 0.00 H new ATOM 0 HA VAL A 453 -14.493 -5.742 3.582 1.00 0.00 H new ATOM 0 HB VAL A 453 -16.371 -4.951 1.361 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -17.403 -7.196 1.752 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -15.709 -7.325 1.224 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -16.126 -7.558 2.938 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -18.182 -5.302 3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -16.937 -5.573 4.307 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -17.085 -3.980 3.527 1.00 0.00 H new ATOM 1147 N SER A 454 -13.512 -4.691 0.584 1.00 0.00 N ATOM 1148 CA SER A 454 -12.494 -4.879 -0.462 1.00 0.00 C ATOM 1149 C SER A 454 -11.076 -4.994 0.126 1.00 0.00 C ATOM 1150 O SER A 454 -10.319 -5.894 -0.239 1.00 0.00 O ATOM 1151 CB SER A 454 -12.544 -3.701 -1.444 1.00 0.00 C ATOM 1152 OG SER A 454 -13.840 -3.536 -2.003 1.00 0.00 O ATOM 0 H SER A 454 -14.032 -3.818 0.490 1.00 0.00 H new ATOM 0 HA SER A 454 -12.718 -5.813 -0.977 1.00 0.00 H new ATOM 0 HB2 SER A 454 -12.251 -2.786 -0.930 1.00 0.00 H new ATOM 0 HB3 SER A 454 -11.821 -3.863 -2.243 1.00 0.00 H new ATOM 0 HG SER A 454 -13.835 -2.776 -2.622 1.00 0.00 H new ATOM 1158 N ALA A 455 -10.739 -4.133 1.096 1.00 0.00 N ATOM 1159 CA ALA A 455 -9.464 -4.161 1.814 1.00 0.00 C ATOM 1160 C ALA A 455 -9.284 -5.451 2.636 1.00 0.00 C ATOM 1161 O ALA A 455 -8.269 -6.131 2.502 1.00 0.00 O ATOM 1162 CB ALA A 455 -9.398 -2.895 2.679 1.00 0.00 C ATOM 0 H ALA A 455 -11.359 -3.385 1.407 1.00 0.00 H new ATOM 0 HA ALA A 455 -8.635 -4.169 1.107 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -8.458 -2.880 3.231 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -9.457 -2.014 2.040 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -10.232 -2.890 3.381 1.00 0.00 H new ATOM 1168 N GLN A 456 -10.282 -5.831 3.437 1.00 0.00 N ATOM 1169 CA GLN A 456 -10.288 -7.084 4.203 1.00 0.00 C ATOM 1170 C GLN A 456 -10.126 -8.328 3.313 1.00 0.00 C ATOM 1171 O GLN A 456 -9.334 -9.218 3.628 1.00 0.00 O ATOM 1172 CB GLN A 456 -11.602 -7.170 4.999 1.00 0.00 C ATOM 1173 CG GLN A 456 -11.606 -6.309 6.277 1.00 0.00 C ATOM 1174 CD GLN A 456 -10.675 -6.804 7.390 1.00 0.00 C ATOM 1175 OE1 GLN A 456 -9.989 -7.814 7.290 1.00 0.00 O ATOM 1176 NE2 GLN A 456 -10.611 -6.107 8.506 1.00 0.00 N ATOM 0 H GLN A 456 -11.122 -5.270 3.575 1.00 0.00 H new ATOM 0 HA GLN A 456 -9.430 -7.071 4.875 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -12.427 -6.858 4.358 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -11.785 -8.210 5.271 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -11.323 -5.290 6.012 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -12.623 -6.266 6.666 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -11.173 -5.262 8.613 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.000 -6.412 9.263 1.00 0.00 H new ATOM 1185 N ALA A 457 -10.843 -8.391 2.189 1.00 0.00 N ATOM 1186 CA ALA A 457 -10.715 -9.466 1.201 1.00 0.00 C ATOM 1187 C ALA A 457 -9.314 -9.518 0.562 1.00 0.00 C ATOM 1188 O ALA A 457 -8.788 -10.605 0.317 1.00 0.00 O ATOM 1189 CB ALA A 457 -11.812 -9.291 0.144 1.00 0.00 C ATOM 0 H ALA A 457 -11.538 -7.688 1.936 1.00 0.00 H new ATOM 0 HA ALA A 457 -10.840 -10.423 1.707 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -11.731 -10.084 -0.600 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -12.790 -9.341 0.623 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -11.696 -8.323 -0.344 1.00 0.00 H new ATOM 1195 N ALA A 458 -8.676 -8.363 0.347 1.00 0.00 N ATOM 1196 CA ALA A 458 -7.319 -8.276 -0.184 1.00 0.00 C ATOM 1197 C ALA A 458 -6.250 -8.708 0.834 1.00 0.00 C ATOM 1198 O ALA A 458 -5.302 -9.383 0.441 1.00 0.00 O ATOM 1199 CB ALA A 458 -7.095 -6.857 -0.695 1.00 0.00 C ATOM 0 H ALA A 458 -9.096 -7.454 0.540 1.00 0.00 H new ATOM 0 HA ALA A 458 -7.214 -8.981 -1.009 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -6.085 -6.770 -1.097 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -7.818 -6.634 -1.480 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -7.221 -6.151 0.126 1.00 0.00 H new ATOM 1205 N ILE A 459 -6.415 -8.433 2.137 1.00 0.00 N ATOM 1206 CA ILE A 459 -5.531 -8.977 3.195 1.00 0.00 C ATOM 1207 C ILE A 459 -5.574 -10.508 3.164 1.00 0.00 C ATOM 1208 O ILE A 459 -4.533 -11.163 3.141 1.00 0.00 O ATOM 1209 CB ILE A 459 -5.926 -8.443 4.599 1.00 0.00 C ATOM 1210 CG1 ILE A 459 -5.718 -6.918 4.676 1.00 0.00 C ATOM 1211 CG2 ILE A 459 -5.112 -9.144 5.707 1.00 0.00 C ATOM 1212 CD1 ILE A 459 -6.294 -6.270 5.944 1.00 0.00 C ATOM 0 H ILE A 459 -7.159 -7.832 2.492 1.00 0.00 H new ATOM 0 HA ILE A 459 -4.512 -8.643 2.998 1.00 0.00 H new ATOM 0 HB ILE A 459 -6.982 -8.664 4.756 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -4.650 -6.705 4.625 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.178 -6.455 3.803 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -5.408 -8.751 6.680 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -5.303 -10.217 5.675 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -4.049 -8.960 5.550 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.106 -5.197 5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.368 -6.450 5.989 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -5.817 -6.703 6.823 1.00 0.00 H new ATOM 1224 N GLN A 460 -6.783 -11.062 3.107 1.00 0.00 N ATOM 1225 CA GLN A 460 -7.035 -12.504 3.076 1.00 0.00 C ATOM 1226 C GLN A 460 -6.537 -13.181 1.785 1.00 0.00 C ATOM 1227 O GLN A 460 -6.309 -14.391 1.781 1.00 0.00 O ATOM 1228 CB GLN A 460 -8.544 -12.719 3.269 1.00 0.00 C ATOM 1229 CG GLN A 460 -8.981 -12.457 4.720 1.00 0.00 C ATOM 1230 CD GLN A 460 -10.503 -12.438 4.853 1.00 0.00 C ATOM 1231 OE1 GLN A 460 -11.148 -13.425 5.187 1.00 0.00 O ATOM 1232 NE2 GLN A 460 -11.133 -11.313 4.583 1.00 0.00 N ATOM 0 H GLN A 460 -7.638 -10.507 3.080 1.00 0.00 H new ATOM 0 HA GLN A 460 -6.469 -12.975 3.880 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.093 -12.057 2.600 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -8.803 -13.740 2.991 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.568 -13.228 5.370 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -8.574 -11.504 5.057 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.604 -10.487 4.304 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.150 -11.268 4.653 1.00 0.00 H new ATOM 1241 N SER A 461 -6.326 -12.427 0.703 1.00 0.00 N ATOM 1242 CA SER A 461 -5.845 -12.940 -0.584 1.00 0.00 C ATOM 1243 C SER A 461 -4.339 -12.719 -0.830 1.00 0.00 C ATOM 1244 O SER A 461 -3.733 -13.492 -1.577 1.00 0.00 O ATOM 1245 CB SER A 461 -6.638 -12.263 -1.709 1.00 0.00 C ATOM 1246 OG SER A 461 -8.029 -12.543 -1.623 1.00 0.00 O ATOM 0 H SER A 461 -6.488 -11.420 0.697 1.00 0.00 H new ATOM 0 HA SER A 461 -5.997 -14.019 -0.566 1.00 0.00 H new ATOM 0 HB2 SER A 461 -6.482 -11.185 -1.665 1.00 0.00 H new ATOM 0 HB3 SER A 461 -6.259 -12.601 -2.674 1.00 0.00 H new ATOM 0 HG SER A 461 -8.442 -11.950 -0.961 1.00 0.00 H new ATOM 1252 N MET A 462 -3.724 -11.703 -0.205 1.00 0.00 N ATOM 1253 CA MET A 462 -2.360 -11.241 -0.524 1.00 0.00 C ATOM 1254 C MET A 462 -1.348 -11.337 0.623 1.00 0.00 C ATOM 1255 O MET A 462 -0.144 -11.285 0.362 1.00 0.00 O ATOM 1256 CB MET A 462 -2.408 -9.797 -1.052 1.00 0.00 C ATOM 1257 CG MET A 462 -3.230 -9.662 -2.341 1.00 0.00 C ATOM 1258 SD MET A 462 -2.692 -10.697 -3.733 1.00 0.00 S ATOM 1259 CE MET A 462 -1.032 -10.030 -3.968 1.00 0.00 C ATOM 0 H MET A 462 -4.164 -11.171 0.546 1.00 0.00 H new ATOM 0 HA MET A 462 -1.998 -11.931 -1.286 1.00 0.00 H new ATOM 0 HB2 MET A 462 -2.833 -9.149 -0.286 1.00 0.00 H new ATOM 0 HB3 MET A 462 -1.392 -9.448 -1.236 1.00 0.00 H new ATOM 0 HG2 MET A 462 -4.269 -9.902 -2.114 1.00 0.00 H new ATOM 0 HG3 MET A 462 -3.206 -8.619 -2.657 1.00 0.00 H new ATOM 0 HE1 MET A 462 -0.604 -10.434 -4.885 1.00 0.00 H new ATOM 0 HE2 MET A 462 -1.083 -8.944 -4.040 1.00 0.00 H new ATOM 0 HE3 MET A 462 -0.405 -10.309 -3.121 1.00 0.00 H new ATOM 1269 N ASN A 463 -1.775 -11.512 1.876 1.00 0.00 N ATOM 1270 CA ASN A 463 -0.837 -11.718 2.982 1.00 0.00 C ATOM 1271 C ASN A 463 -0.155 -13.099 2.862 1.00 0.00 C ATOM 1272 O ASN A 463 -0.815 -14.138 2.952 1.00 0.00 O ATOM 1273 CB ASN A 463 -1.561 -11.525 4.323 1.00 0.00 C ATOM 1274 CG ASN A 463 -0.572 -11.455 5.479 1.00 0.00 C ATOM 1275 OD1 ASN A 463 0.397 -10.706 5.428 1.00 0.00 O ATOM 1276 ND2 ASN A 463 -0.769 -12.224 6.533 1.00 0.00 N ATOM 0 H ASN A 463 -2.758 -11.515 2.149 1.00 0.00 H new ATOM 0 HA ASN A 463 -0.042 -10.974 2.934 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -2.152 -10.610 4.291 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -2.256 -12.349 4.485 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -0.112 -12.198 7.313 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -1.578 -12.844 6.568 1.00 0.00 H new ATOM 1283 N GLY A 464 1.162 -13.107 2.623 1.00 0.00 N ATOM 1284 CA GLY A 464 1.972 -14.302 2.339 1.00 0.00 C ATOM 1285 C GLY A 464 2.150 -14.615 0.847 1.00 0.00 C ATOM 1286 O GLY A 464 2.743 -15.646 0.530 1.00 0.00 O ATOM 0 H GLY A 464 1.715 -12.250 2.622 1.00 0.00 H new ATOM 0 HA2 GLY A 464 2.956 -14.173 2.789 1.00 0.00 H new ATOM 0 HA3 GLY A 464 1.510 -15.162 2.824 1.00 0.00 H new ATOM 1290 N PHE A 465 1.671 -13.762 -0.070 1.00 0.00 N ATOM 1291 CA PHE A 465 1.782 -13.961 -1.523 1.00 0.00 C ATOM 1292 C PHE A 465 3.253 -14.046 -1.963 1.00 0.00 C ATOM 1293 O PHE A 465 4.031 -13.130 -1.699 1.00 0.00 O ATOM 1294 CB PHE A 465 1.054 -12.813 -2.240 1.00 0.00 C ATOM 1295 CG PHE A 465 1.054 -12.907 -3.754 1.00 0.00 C ATOM 1296 CD1 PHE A 465 2.129 -12.388 -4.505 1.00 0.00 C ATOM 1297 CD2 PHE A 465 -0.029 -13.513 -4.420 1.00 0.00 C ATOM 1298 CE1 PHE A 465 2.126 -12.492 -5.907 1.00 0.00 C ATOM 1299 CE2 PHE A 465 -0.037 -13.603 -5.823 1.00 0.00 C ATOM 1300 CZ PHE A 465 1.042 -13.095 -6.567 1.00 0.00 C ATOM 0 H PHE A 465 1.187 -12.900 0.181 1.00 0.00 H new ATOM 0 HA PHE A 465 1.315 -14.908 -1.793 1.00 0.00 H new ATOM 0 HB2 PHE A 465 0.022 -12.783 -1.892 1.00 0.00 H new ATOM 0 HB3 PHE A 465 1.516 -11.870 -1.949 1.00 0.00 H new ATOM 0 HD1 PHE A 465 2.956 -11.910 -4.002 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -0.856 -13.910 -3.851 1.00 0.00 H new ATOM 0 HE1 PHE A 465 2.958 -12.108 -6.478 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -0.873 -14.063 -6.329 1.00 0.00 H new ATOM 0 HZ PHE A 465 1.038 -13.168 -7.645 1.00 0.00 H new ATOM 1310 N GLN A 466 3.641 -15.140 -2.624 1.00 0.00 N ATOM 1311 CA GLN A 466 5.031 -15.396 -3.018 1.00 0.00 C ATOM 1312 C GLN A 466 5.397 -14.580 -4.267 1.00 0.00 C ATOM 1313 O GLN A 466 4.701 -14.630 -5.281 1.00 0.00 O ATOM 1314 CB GLN A 466 5.230 -16.913 -3.204 1.00 0.00 C ATOM 1315 CG GLN A 466 6.690 -17.386 -3.072 1.00 0.00 C ATOM 1316 CD GLN A 466 7.579 -17.067 -4.277 1.00 0.00 C ATOM 1317 OE1 GLN A 466 7.401 -17.584 -5.374 1.00 0.00 O ATOM 1318 NE2 GLN A 466 8.586 -16.234 -4.120 1.00 0.00 N ATOM 0 H GLN A 466 2.996 -15.879 -2.903 1.00 0.00 H new ATOM 0 HA GLN A 466 5.714 -15.068 -2.235 1.00 0.00 H new ATOM 0 HB2 GLN A 466 4.623 -17.439 -2.468 1.00 0.00 H new ATOM 0 HB3 GLN A 466 4.856 -17.198 -4.188 1.00 0.00 H new ATOM 0 HG2 GLN A 466 7.127 -16.928 -2.185 1.00 0.00 H new ATOM 0 HG3 GLN A 466 6.695 -18.464 -2.910 1.00 0.00 H new ATOM 0 HE21 GLN A 466 8.748 -15.795 -3.214 1.00 0.00 H new ATOM 0 HE22 GLN A 466 9.204 -16.027 -4.905 1.00 0.00 H new ATOM 1327 N ILE A 467 6.499 -13.828 -4.197 1.00 0.00 N ATOM 1328 CA ILE A 467 6.969 -12.923 -5.254 1.00 0.00 C ATOM 1329 C ILE A 467 8.504 -12.864 -5.253 1.00 0.00 C ATOM 1330 O ILE A 467 9.127 -12.764 -4.192 1.00 0.00 O ATOM 1331 CB ILE A 467 6.287 -11.540 -5.092 1.00 0.00 C ATOM 1332 CG1 ILE A 467 6.412 -10.725 -6.396 1.00 0.00 C ATOM 1333 CG2 ILE A 467 6.799 -10.759 -3.865 1.00 0.00 C ATOM 1334 CD1 ILE A 467 5.582 -9.435 -6.399 1.00 0.00 C ATOM 0 H ILE A 467 7.108 -13.831 -3.379 1.00 0.00 H new ATOM 0 HA ILE A 467 6.684 -13.297 -6.237 1.00 0.00 H new ATOM 0 HB ILE A 467 5.229 -11.717 -4.901 1.00 0.00 H new ATOM 0 HG12 ILE A 467 7.460 -10.473 -6.557 1.00 0.00 H new ATOM 0 HG13 ILE A 467 6.102 -11.348 -7.235 1.00 0.00 H new ATOM 0 HG21 ILE A 467 6.285 -9.800 -3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 467 6.603 -11.334 -2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 467 7.872 -10.591 -3.962 1.00 0.00 H new ATOM 0 HD11 ILE A 467 5.720 -8.916 -7.347 1.00 0.00 H new ATOM 0 HD12 ILE A 467 4.528 -9.680 -6.270 1.00 0.00 H new ATOM 0 HD13 ILE A 467 5.907 -8.791 -5.582 1.00 0.00 H new ATOM 1346 N GLY A 468 9.132 -12.999 -6.427 1.00 0.00 N ATOM 1347 CA GLY A 468 10.593 -13.105 -6.543 1.00 0.00 C ATOM 1348 C GLY A 468 11.118 -14.323 -5.777 1.00 0.00 C ATOM 1349 O GLY A 468 10.690 -15.451 -6.029 1.00 0.00 O ATOM 0 H GLY A 468 8.644 -13.038 -7.322 1.00 0.00 H new ATOM 0 HA2 GLY A 468 10.873 -13.183 -7.593 1.00 0.00 H new ATOM 0 HA3 GLY A 468 11.059 -12.199 -6.156 1.00 0.00 H new ATOM 1353 N MET A 469 12.012 -14.085 -4.813 1.00 0.00 N ATOM 1354 CA MET A 469 12.569 -15.092 -3.890 1.00 0.00 C ATOM 1355 C MET A 469 12.000 -14.970 -2.457 1.00 0.00 C ATOM 1356 O MET A 469 12.574 -15.512 -1.510 1.00 0.00 O ATOM 1357 CB MET A 469 14.108 -15.000 -3.905 1.00 0.00 C ATOM 1358 CG MET A 469 14.697 -15.284 -5.295 1.00 0.00 C ATOM 1359 SD MET A 469 16.506 -15.198 -5.398 1.00 0.00 S ATOM 1360 CE MET A 469 16.958 -16.676 -4.453 1.00 0.00 C ATOM 0 H MET A 469 12.385 -13.151 -4.643 1.00 0.00 H new ATOM 0 HA MET A 469 12.265 -16.079 -4.240 1.00 0.00 H new ATOM 0 HB2 MET A 469 14.413 -14.005 -3.580 1.00 0.00 H new ATOM 0 HB3 MET A 469 14.519 -15.710 -3.187 1.00 0.00 H new ATOM 0 HG2 MET A 469 14.378 -16.277 -5.612 1.00 0.00 H new ATOM 0 HG3 MET A 469 14.274 -14.572 -6.004 1.00 0.00 H new ATOM 0 HE1 MET A 469 18.031 -16.849 -4.539 1.00 0.00 H new ATOM 0 HE2 MET A 469 16.697 -16.531 -3.405 1.00 0.00 H new ATOM 0 HE3 MET A 469 16.419 -17.538 -4.846 1.00 0.00 H new ATOM 1370 N LYS A 470 10.886 -14.249 -2.279 1.00 0.00 N ATOM 1371 CA LYS A 470 10.321 -13.848 -0.976 1.00 0.00 C ATOM 1372 C LYS A 470 8.774 -13.881 -0.952 1.00 0.00 C ATOM 1373 O LYS A 470 8.146 -14.439 -1.859 1.00 0.00 O ATOM 1374 CB LYS A 470 10.947 -12.496 -0.577 1.00 0.00 C ATOM 1375 CG LYS A 470 10.663 -11.339 -1.550 1.00 0.00 C ATOM 1376 CD LYS A 470 11.403 -10.093 -1.058 1.00 0.00 C ATOM 1377 CE LYS A 470 11.161 -8.907 -2.001 1.00 0.00 C ATOM 1378 NZ LYS A 470 11.806 -7.661 -1.501 1.00 0.00 N ATOM 0 H LYS A 470 10.329 -13.914 -3.066 1.00 0.00 H new ATOM 0 HA LYS A 470 10.586 -14.580 -0.213 1.00 0.00 H new ATOM 0 HB2 LYS A 470 10.579 -12.219 0.411 1.00 0.00 H new ATOM 0 HB3 LYS A 470 12.026 -12.623 -0.491 1.00 0.00 H new ATOM 0 HG2 LYS A 470 10.992 -11.601 -2.556 1.00 0.00 H new ATOM 0 HG3 LYS A 470 9.592 -11.145 -1.605 1.00 0.00 H new ATOM 0 HD2 LYS A 470 11.067 -9.838 -0.053 1.00 0.00 H new ATOM 0 HD3 LYS A 470 12.471 -10.301 -0.994 1.00 0.00 H new ATOM 0 HE2 LYS A 470 11.550 -9.145 -2.991 1.00 0.00 H new ATOM 0 HE3 LYS A 470 10.089 -8.743 -2.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 11.247 -6.837 -1.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 11.855 -7.688 -0.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 12.767 -7.587 -1.891 1.00 0.00 H new ATOM 1392 N ARG A 471 8.149 -13.316 0.091 1.00 0.00 N ATOM 1393 CA ARG A 471 6.688 -13.231 0.266 1.00 0.00 C ATOM 1394 C ARG A 471 6.263 -11.842 0.756 1.00 0.00 C ATOM 1395 O ARG A 471 6.914 -11.271 1.630 1.00 0.00 O ATOM 1396 CB ARG A 471 6.188 -14.285 1.274 1.00 0.00 C ATOM 1397 CG ARG A 471 6.326 -15.728 0.773 1.00 0.00 C ATOM 1398 CD ARG A 471 5.739 -16.721 1.782 1.00 0.00 C ATOM 1399 NE ARG A 471 5.875 -18.109 1.302 1.00 0.00 N ATOM 1400 CZ ARG A 471 4.999 -18.797 0.579 1.00 0.00 C ATOM 1401 NH1 ARG A 471 3.852 -18.288 0.180 1.00 0.00 N ATOM 1402 NH2 ARG A 471 5.276 -20.037 0.235 1.00 0.00 N ATOM 0 H ARG A 471 8.662 -12.891 0.863 1.00 0.00 H new ATOM 0 HA ARG A 471 6.243 -13.419 -0.711 1.00 0.00 H new ATOM 0 HB2 ARG A 471 6.745 -14.178 2.205 1.00 0.00 H new ATOM 0 HB3 ARG A 471 5.141 -14.088 1.504 1.00 0.00 H new ATOM 0 HG2 ARG A 471 5.816 -15.834 -0.185 1.00 0.00 H new ATOM 0 HG3 ARG A 471 7.378 -15.958 0.602 1.00 0.00 H new ATOM 0 HD2 ARG A 471 6.247 -16.613 2.741 1.00 0.00 H new ATOM 0 HD3 ARG A 471 4.687 -16.493 1.951 1.00 0.00 H new ATOM 0 HE ARG A 471 6.737 -18.594 1.553 1.00 0.00 H new ATOM 0 HH11 ARG A 471 3.607 -17.329 0.425 1.00 0.00 H new ATOM 0 HH12 ARG A 471 3.209 -18.853 -0.374 1.00 0.00 H new ATOM 0 HH21 ARG A 471 6.157 -20.462 0.524 1.00 0.00 H new ATOM 0 HH22 ARG A 471 4.609 -20.573 -0.320 1.00 0.00 H new ATOM 1416 N LEU A 472 5.154 -11.324 0.220 1.00 0.00 N ATOM 1417 CA LEU A 472 4.502 -10.094 0.682 1.00 0.00 C ATOM 1418 C LEU A 472 3.893 -10.271 2.076 1.00 0.00 C ATOM 1419 O LEU A 472 3.426 -11.354 2.430 1.00 0.00 O ATOM 1420 CB LEU A 472 3.393 -9.670 -0.305 1.00 0.00 C ATOM 1421 CG LEU A 472 3.858 -9.333 -1.735 1.00 0.00 C ATOM 1422 CD1 LEU A 472 2.663 -8.835 -2.558 1.00 0.00 C ATOM 1423 CD2 LEU A 472 4.959 -8.266 -1.735 1.00 0.00 C ATOM 0 H LEU A 472 4.672 -11.759 -0.567 1.00 0.00 H new ATOM 0 HA LEU A 472 5.267 -9.319 0.732 1.00 0.00 H new ATOM 0 HB2 LEU A 472 2.658 -10.473 -0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 472 2.882 -8.799 0.105 1.00 0.00 H new ATOM 0 HG LEU A 472 4.268 -10.240 -2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 472 2.992 -8.597 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 472 1.900 -9.612 -2.598 1.00 0.00 H new ATOM 0 HD13 LEU A 472 2.247 -7.942 -2.092 1.00 0.00 H new ATOM 0 HD21 LEU A 472 5.261 -8.055 -2.761 1.00 0.00 H new ATOM 0 HD22 LEU A 472 4.582 -7.354 -1.273 1.00 0.00 H new ATOM 0 HD23 LEU A 472 5.818 -8.630 -1.171 1.00 0.00 H new ATOM 1435 N LYS A 473 3.824 -9.179 2.833 1.00 0.00 N ATOM 1436 CA LYS A 473 3.087 -9.084 4.098 1.00 0.00 C ATOM 1437 C LYS A 473 2.085 -7.920 4.001 1.00 0.00 C ATOM 1438 O LYS A 473 2.466 -6.829 3.579 1.00 0.00 O ATOM 1439 CB LYS A 473 4.104 -8.925 5.241 1.00 0.00 C ATOM 1440 CG LYS A 473 3.442 -9.065 6.620 1.00 0.00 C ATOM 1441 CD LYS A 473 4.451 -8.961 7.774 1.00 0.00 C ATOM 1442 CE LYS A 473 5.071 -7.560 7.872 1.00 0.00 C ATOM 1443 NZ LYS A 473 6.040 -7.467 8.993 1.00 0.00 N ATOM 0 H LYS A 473 4.292 -8.309 2.579 1.00 0.00 H new ATOM 0 HA LYS A 473 2.507 -9.984 4.304 1.00 0.00 H new ATOM 0 HB2 LYS A 473 4.888 -9.675 5.137 1.00 0.00 H new ATOM 0 HB3 LYS A 473 4.585 -7.950 5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 473 2.683 -8.291 6.735 1.00 0.00 H new ATOM 0 HG3 LYS A 473 2.929 -10.025 6.677 1.00 0.00 H new ATOM 0 HD2 LYS A 473 3.954 -9.204 8.713 1.00 0.00 H new ATOM 0 HD3 LYS A 473 5.241 -9.698 7.632 1.00 0.00 H new ATOM 0 HE2 LYS A 473 5.573 -7.318 6.935 1.00 0.00 H new ATOM 0 HE3 LYS A 473 4.282 -6.821 8.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 6.439 -6.507 9.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 5.555 -7.674 9.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 6.806 -8.155 8.847 1.00 0.00 H new ATOM 1457 N VAL A 474 0.817 -8.136 4.356 1.00 0.00 N ATOM 1458 CA VAL A 474 -0.290 -7.191 4.098 1.00 0.00 C ATOM 1459 C VAL A 474 -1.214 -7.105 5.314 1.00 0.00 C ATOM 1460 O VAL A 474 -1.518 -8.118 5.939 1.00 0.00 O ATOM 1461 CB VAL A 474 -1.100 -7.560 2.828 1.00 0.00 C ATOM 1462 CG1 VAL A 474 -2.057 -6.416 2.453 1.00 0.00 C ATOM 1463 CG2 VAL A 474 -0.201 -7.850 1.614 1.00 0.00 C ATOM 0 H VAL A 474 0.518 -8.983 4.839 1.00 0.00 H new ATOM 0 HA VAL A 474 0.159 -6.214 3.919 1.00 0.00 H new ATOM 0 HB VAL A 474 -1.654 -8.466 3.073 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -2.619 -6.690 1.560 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -2.749 -6.236 3.276 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -1.483 -5.511 2.257 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -0.821 -8.103 0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 474 0.396 -6.967 1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 474 0.460 -8.686 1.842 1.00 0.00 H new ATOM 1473 N GLN A 475 -1.643 -5.885 5.649 1.00 0.00 N ATOM 1474 CA GLN A 475 -2.396 -5.549 6.860 1.00 0.00 C ATOM 1475 C GLN A 475 -3.027 -4.151 6.739 1.00 0.00 C ATOM 1476 O GLN A 475 -2.675 -3.386 5.840 1.00 0.00 O ATOM 1477 CB GLN A 475 -1.474 -5.642 8.099 1.00 0.00 C ATOM 1478 CG GLN A 475 -0.199 -4.772 8.038 1.00 0.00 C ATOM 1479 CD GLN A 475 1.028 -5.521 7.502 1.00 0.00 C ATOM 1480 OE1 GLN A 475 1.638 -6.332 8.185 1.00 0.00 O ATOM 1481 NE2 GLN A 475 1.457 -5.278 6.279 1.00 0.00 N ATOM 0 H GLN A 475 -1.468 -5.071 5.059 1.00 0.00 H new ATOM 0 HA GLN A 475 -3.207 -6.267 6.981 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -2.047 -5.356 8.981 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -1.178 -6.682 8.234 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -0.390 -3.905 7.406 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.023 -4.396 9.037 1.00 0.00 H new ATOM 0 HE21 GLN A 475 0.965 -4.606 5.690 1.00 0.00 H new ATOM 0 HE22 GLN A 475 2.281 -5.762 5.922 1.00 0.00 H new ATOM 1490 N LEU A 476 -3.931 -3.794 7.661 1.00 0.00 N ATOM 1491 CA LEU A 476 -4.439 -2.423 7.803 1.00 0.00 C ATOM 1492 C LEU A 476 -3.307 -1.495 8.286 1.00 0.00 C ATOM 1493 O LEU A 476 -2.499 -1.875 9.138 1.00 0.00 O ATOM 1494 CB LEU A 476 -5.631 -2.394 8.784 1.00 0.00 C ATOM 1495 CG LEU A 476 -6.866 -3.232 8.383 1.00 0.00 C ATOM 1496 CD1 LEU A 476 -7.912 -3.169 9.505 1.00 0.00 C ATOM 1497 CD2 LEU A 476 -7.507 -2.751 7.074 1.00 0.00 C ATOM 0 H LEU A 476 -4.332 -4.450 8.331 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.790 -2.068 6.834 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -5.283 -2.741 9.757 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.946 -1.358 8.910 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.524 -4.255 8.226 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -8.784 -3.760 9.223 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -7.484 -3.569 10.424 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -8.212 -2.133 9.665 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -8.370 -3.375 6.840 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -7.828 -1.715 7.185 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.779 -2.821 6.265 1.00 0.00 H new ATOM 1509 N LYS A 477 -3.227 -0.279 7.738 1.00 0.00 N ATOM 1510 CA LYS A 477 -2.101 0.636 7.988 1.00 0.00 C ATOM 1511 C LYS A 477 -2.129 1.357 9.359 1.00 0.00 C ATOM 1512 O LYS A 477 -3.155 1.399 10.046 1.00 0.00 O ATOM 1513 CB LYS A 477 -1.961 1.607 6.803 1.00 0.00 C ATOM 1514 CG LYS A 477 -2.943 2.784 6.829 1.00 0.00 C ATOM 1515 CD LYS A 477 -2.615 3.732 5.675 1.00 0.00 C ATOM 1516 CE LYS A 477 -3.399 5.043 5.799 1.00 0.00 C ATOM 1517 NZ LYS A 477 -2.633 6.069 6.546 1.00 0.00 N ATOM 0 H LYS A 477 -3.936 0.101 7.111 1.00 0.00 H new ATOM 0 HA LYS A 477 -1.204 0.020 8.059 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -0.944 1.999 6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.102 1.052 5.876 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -3.967 2.422 6.739 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.874 3.311 7.781 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -1.546 3.943 5.666 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -2.852 3.251 4.726 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -3.639 5.420 4.805 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -4.346 4.855 6.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -2.946 7.017 6.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -2.796 5.950 7.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -1.619 5.961 6.343 1.00 0.00 H new