USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=17 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 473 LYS NZ :NH3+ -112:sc= 0.26 (180deg=0) USER MOD Set 1.2: A 475 GLN : amide:sc= 0.987 K(o=1.2,f=-1.3) USER MOD Set 2.1: A 451 ASN : amide:sc= 2.13 K(o=2.7,f=-4.6!) USER MOD Set 2.2: A 454 SER OG : rot -170:sc= 0.616 USER MOD Single : A 393 SER OG : rot 180:sc= 0.022 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 402 ASN : amide:sc= 0.529 K(o=0.53,f=-0.35) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS : no HD1:sc= -0.072 X(o=-0.072,f=0) USER MOD Single : A 410 GLN : amide:sc= 0.884 K(o=0.88,f=0) USER MOD Single : A 415 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= 0.825 K(o=0.82,f=0) USER MOD Single : A 420 MET CE :methyl 145:sc= 0 (180deg=-0.0404) USER MOD Single : A 422 MET CE :methyl -172:sc= 0 (180deg=-0.112) USER MOD Single : A 426 ASN : amide:sc= 0.00166 X(o=0.0017,f=0) USER MOD Single : A 429 SER OG : rot -106:sc= 0.804 USER MOD Single : A 431 LYS NZ :NH3+ 146:sc= 0.88 (180deg=-0.101) USER MOD Single : A 441 SER OG : rot 180:sc= 0.336 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot 120:sc= 0.696 USER MOD Single : A 449 TYR OH : rot -155:sc= 0.425 USER MOD Single : A 456 GLN : amide:sc= -0.067 X(o=-0.067,f=-0.41) USER MOD Single : A 460 GLN : amide:sc= -0.139 X(o=-0.14,f=0) USER MOD Single : A 461 SER OG : rot 81:sc= 0.839 USER MOD Single : A 462 MET CE :methyl -162:sc= -0.0374 (180deg=-1.21) USER MOD Single : A 463 ASN : amide:sc= 0.924 K(o=0.92,f=-5.3!) USER MOD Single : A 466 GLN : amide:sc= 0.933 K(o=0.93,f=-0.14) USER MOD Single : A 469 MET CE :methyl 174:sc= 0 (180deg=-0.0535) USER MOD Single : A 470 LYS NZ :NH3+ -143:sc= 0.711 (180deg=0.124) USER MOD Single : A 477 LYS NZ :NH3+ -170:sc= -0.0531 (180deg=-0.265) USER MOD ----------------------------------------------------------------- ATOM 172 N ALA A 390 -5.147 7.240 -10.074 1.00 0.00 N ATOM 173 CA ALA A 390 -5.083 6.407 -8.876 1.00 0.00 C ATOM 174 C ALA A 390 -3.654 5.997 -8.466 1.00 0.00 C ATOM 175 O ALA A 390 -3.446 5.552 -7.338 1.00 0.00 O ATOM 176 CB ALA A 390 -5.952 5.191 -9.184 1.00 0.00 C ATOM 0 HA ALA A 390 -5.441 6.969 -8.013 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -5.952 4.518 -8.327 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -6.972 5.516 -9.391 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -5.553 4.670 -10.055 1.00 0.00 H new ATOM 182 N ALA A 391 -2.675 6.171 -9.361 1.00 0.00 N ATOM 183 CA ALA A 391 -1.253 5.903 -9.152 1.00 0.00 C ATOM 184 C ALA A 391 -0.439 7.192 -9.311 1.00 0.00 C ATOM 185 O ALA A 391 -0.714 8.013 -10.192 1.00 0.00 O ATOM 186 CB ALA A 391 -0.816 4.804 -10.128 1.00 0.00 C ATOM 0 H ALA A 391 -2.867 6.521 -10.300 1.00 0.00 H new ATOM 0 HA ALA A 391 -1.073 5.549 -8.137 1.00 0.00 H new ATOM 0 HB1 ALA A 391 0.244 4.591 -9.986 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -1.396 3.900 -9.941 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -0.985 5.138 -11.152 1.00 0.00 H new ATOM 192 N GLY A 392 0.540 7.379 -8.419 1.00 0.00 N ATOM 193 CA GLY A 392 1.270 8.647 -8.274 1.00 0.00 C ATOM 194 C GLY A 392 0.480 9.664 -7.446 1.00 0.00 C ATOM 195 O GLY A 392 0.564 10.866 -7.690 1.00 0.00 O ATOM 0 H GLY A 392 0.851 6.653 -7.774 1.00 0.00 H new ATOM 0 HA2 GLY A 392 2.233 8.460 -7.799 1.00 0.00 H new ATOM 0 HA3 GLY A 392 1.477 9.063 -9.260 1.00 0.00 H new ATOM 199 N SER A 393 -0.310 9.181 -6.485 1.00 0.00 N ATOM 200 CA SER A 393 -1.237 9.968 -5.661 1.00 0.00 C ATOM 201 C SER A 393 -1.118 9.598 -4.169 1.00 0.00 C ATOM 202 O SER A 393 -0.418 8.653 -3.799 1.00 0.00 O ATOM 203 CB SER A 393 -2.666 9.767 -6.191 1.00 0.00 C ATOM 204 OG SER A 393 -3.586 10.639 -5.547 1.00 0.00 O ATOM 0 H SER A 393 -0.324 8.189 -6.248 1.00 0.00 H new ATOM 0 HA SER A 393 -0.979 11.025 -5.733 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.685 9.945 -7.266 1.00 0.00 H new ATOM 0 HB3 SER A 393 -2.972 8.733 -6.034 1.00 0.00 H new ATOM 0 HG SER A 393 -4.485 10.489 -5.906 1.00 0.00 H new ATOM 210 N GLN A 394 -1.800 10.353 -3.306 1.00 0.00 N ATOM 211 CA GLN A 394 -1.706 10.300 -1.839 1.00 0.00 C ATOM 212 C GLN A 394 -3.103 10.144 -1.198 1.00 0.00 C ATOM 213 O GLN A 394 -3.289 10.443 -0.018 1.00 0.00 O ATOM 214 CB GLN A 394 -0.998 11.580 -1.341 1.00 0.00 C ATOM 215 CG GLN A 394 0.446 11.751 -1.844 1.00 0.00 C ATOM 216 CD GLN A 394 0.978 13.160 -1.570 1.00 0.00 C ATOM 217 OE1 GLN A 394 1.001 14.020 -2.445 1.00 0.00 O ATOM 218 NE2 GLN A 394 1.412 13.476 -0.368 1.00 0.00 N ATOM 0 H GLN A 394 -2.468 11.055 -3.624 1.00 0.00 H new ATOM 0 HA GLN A 394 -1.123 9.428 -1.542 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -1.582 12.446 -1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -0.991 11.575 -0.251 1.00 0.00 H new ATOM 0 HG2 GLN A 394 1.090 11.018 -1.358 1.00 0.00 H new ATOM 0 HG3 GLN A 394 0.485 11.549 -2.914 1.00 0.00 H new ATOM 0 HE21 GLN A 394 1.403 12.779 0.377 1.00 0.00 H new ATOM 0 HE22 GLN A 394 1.757 14.418 -0.182 1.00 0.00 H new ATOM 227 N LYS A 395 -4.120 9.723 -1.964 1.00 0.00 N ATOM 228 CA LYS A 395 -5.524 9.693 -1.527 1.00 0.00 C ATOM 229 C LYS A 395 -5.839 8.485 -0.616 1.00 0.00 C ATOM 230 O LYS A 395 -6.417 7.481 -1.042 1.00 0.00 O ATOM 231 CB LYS A 395 -6.432 9.812 -2.764 1.00 0.00 C ATOM 232 CG LYS A 395 -7.890 10.090 -2.367 1.00 0.00 C ATOM 233 CD LYS A 395 -8.763 10.294 -3.616 1.00 0.00 C ATOM 234 CE LYS A 395 -10.251 10.468 -3.274 1.00 0.00 C ATOM 235 NZ LYS A 395 -10.536 11.757 -2.585 1.00 0.00 N ATOM 0 H LYS A 395 -3.989 9.389 -2.919 1.00 0.00 H new ATOM 0 HA LYS A 395 -5.726 10.551 -0.886 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -6.070 10.614 -3.407 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -6.381 8.891 -3.344 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -8.277 9.258 -1.778 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -7.937 10.977 -1.735 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -8.414 11.172 -4.160 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -8.644 9.439 -4.281 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -10.839 10.413 -4.190 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -10.572 9.643 -2.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -11.553 11.822 -2.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -9.998 11.802 -1.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -10.256 12.548 -3.199 1.00 0.00 H new ATOM 249 N GLU A 396 -5.439 8.590 0.650 1.00 0.00 N ATOM 250 CA GLU A 396 -5.628 7.559 1.677 1.00 0.00 C ATOM 251 C GLU A 396 -7.123 7.380 2.014 1.00 0.00 C ATOM 252 O GLU A 396 -7.863 8.360 2.152 1.00 0.00 O ATOM 253 CB GLU A 396 -4.819 7.882 2.950 1.00 0.00 C ATOM 254 CG GLU A 396 -3.383 8.371 2.685 1.00 0.00 C ATOM 255 CD GLU A 396 -2.487 8.387 3.934 1.00 0.00 C ATOM 256 OE1 GLU A 396 -2.980 8.252 5.078 1.00 0.00 O ATOM 257 OE2 GLU A 396 -1.252 8.503 3.781 1.00 0.00 O ATOM 0 H GLU A 396 -4.960 9.418 1.003 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.255 6.619 1.271 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.350 8.645 3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -4.776 6.990 3.575 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -2.926 7.731 1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -3.424 9.377 2.267 1.00 0.00 H new ATOM 264 N GLY A 397 -7.573 6.127 2.131 1.00 0.00 N ATOM 265 CA GLY A 397 -8.976 5.741 2.332 1.00 0.00 C ATOM 266 C GLY A 397 -9.434 5.776 3.799 1.00 0.00 C ATOM 267 O GLY A 397 -8.608 5.984 4.697 1.00 0.00 O ATOM 0 H GLY A 397 -6.948 5.322 2.087 1.00 0.00 H new ATOM 0 HA2 GLY A 397 -9.612 6.407 1.748 1.00 0.00 H new ATOM 0 HA3 GLY A 397 -9.124 4.735 1.940 1.00 0.00 H new ATOM 271 N PRO A 398 -10.742 5.560 4.053 1.00 0.00 N ATOM 272 CA PRO A 398 -11.347 5.643 5.382 1.00 0.00 C ATOM 273 C PRO A 398 -10.915 4.489 6.303 1.00 0.00 C ATOM 274 O PRO A 398 -10.202 3.573 5.890 1.00 0.00 O ATOM 275 CB PRO A 398 -12.861 5.665 5.128 1.00 0.00 C ATOM 276 CG PRO A 398 -13.020 4.873 3.833 1.00 0.00 C ATOM 277 CD PRO A 398 -11.759 5.244 3.054 1.00 0.00 C ATOM 0 HA PRO A 398 -11.019 6.534 5.917 1.00 0.00 H new ATOM 0 HB2 PRO A 398 -13.412 5.206 5.949 1.00 0.00 H new ATOM 0 HB3 PRO A 398 -13.235 6.683 5.023 1.00 0.00 H new ATOM 0 HG2 PRO A 398 -13.080 3.801 4.019 1.00 0.00 H new ATOM 0 HG3 PRO A 398 -13.925 5.154 3.295 1.00 0.00 H new ATOM 0 HD2 PRO A 398 -11.437 4.419 2.418 1.00 0.00 H new ATOM 0 HD3 PRO A 398 -11.942 6.097 2.401 1.00 0.00 H new ATOM 285 N GLU A 399 -11.349 4.542 7.567 1.00 0.00 N ATOM 286 CA GLU A 399 -11.012 3.563 8.608 1.00 0.00 C ATOM 287 C GLU A 399 -11.359 2.124 8.179 1.00 0.00 C ATOM 288 O GLU A 399 -12.500 1.815 7.827 1.00 0.00 O ATOM 289 CB GLU A 399 -11.724 3.949 9.917 1.00 0.00 C ATOM 290 CG GLU A 399 -11.293 3.077 11.103 1.00 0.00 C ATOM 291 CD GLU A 399 -11.975 3.540 12.399 1.00 0.00 C ATOM 292 OE1 GLU A 399 -13.083 3.046 12.716 1.00 0.00 O ATOM 293 OE2 GLU A 399 -11.404 4.397 13.116 1.00 0.00 O ATOM 0 H GLU A 399 -11.960 5.286 7.904 1.00 0.00 H new ATOM 0 HA GLU A 399 -9.934 3.582 8.769 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -11.516 4.994 10.145 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -12.802 3.862 9.779 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -11.547 2.036 10.905 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -10.210 3.124 11.220 1.00 0.00 H new ATOM 300 N GLY A 400 -10.350 1.243 8.192 1.00 0.00 N ATOM 301 CA GLY A 400 -10.462 -0.166 7.788 1.00 0.00 C ATOM 302 C GLY A 400 -10.361 -0.409 6.277 1.00 0.00 C ATOM 303 O GLY A 400 -10.313 -1.564 5.862 1.00 0.00 O ATOM 0 H GLY A 400 -9.408 1.497 8.491 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -9.679 -0.736 8.287 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -11.416 -0.557 8.142 1.00 0.00 H new ATOM 307 N ALA A 401 -10.315 0.646 5.454 1.00 0.00 N ATOM 308 CA ALA A 401 -10.243 0.573 3.989 1.00 0.00 C ATOM 309 C ALA A 401 -8.837 0.851 3.414 1.00 0.00 C ATOM 310 O ALA A 401 -8.647 0.776 2.200 1.00 0.00 O ATOM 311 CB ALA A 401 -11.286 1.540 3.418 1.00 0.00 C ATOM 0 H ALA A 401 -10.327 1.605 5.801 1.00 0.00 H new ATOM 0 HA ALA A 401 -10.459 -0.452 3.688 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -11.255 1.507 2.329 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -12.279 1.249 3.762 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -11.067 2.553 3.756 1.00 0.00 H new ATOM 317 N ASN A 402 -7.856 1.162 4.267 1.00 0.00 N ATOM 318 CA ASN A 402 -6.473 1.481 3.892 1.00 0.00 C ATOM 319 C ASN A 402 -5.490 0.363 4.308 1.00 0.00 C ATOM 320 O ASN A 402 -5.612 -0.227 5.384 1.00 0.00 O ATOM 321 CB ASN A 402 -6.105 2.877 4.433 1.00 0.00 C ATOM 322 CG ASN A 402 -6.270 3.059 5.942 1.00 0.00 C ATOM 323 OD1 ASN A 402 -5.684 2.353 6.751 1.00 0.00 O ATOM 324 ND2 ASN A 402 -7.060 4.025 6.374 1.00 0.00 N ATOM 0 H ASN A 402 -8.008 1.200 5.275 1.00 0.00 H new ATOM 0 HA ASN A 402 -6.389 1.525 2.806 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -5.069 3.089 4.170 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -6.721 3.619 3.925 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -7.178 4.178 7.376 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -7.552 4.618 5.706 1.00 0.00 H new ATOM 331 N LEU A 403 -4.527 0.047 3.432 1.00 0.00 N ATOM 332 CA LEU A 403 -3.631 -1.115 3.523 1.00 0.00 C ATOM 333 C LEU A 403 -2.158 -0.735 3.401 1.00 0.00 C ATOM 334 O LEU A 403 -1.803 0.129 2.597 1.00 0.00 O ATOM 335 CB LEU A 403 -3.931 -2.124 2.393 1.00 0.00 C ATOM 336 CG LEU A 403 -5.343 -2.723 2.357 1.00 0.00 C ATOM 337 CD1 LEU A 403 -5.437 -3.710 1.189 1.00 0.00 C ATOM 338 CD2 LEU A 403 -5.654 -3.459 3.660 1.00 0.00 C ATOM 0 H LEU A 403 -4.343 0.617 2.606 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.813 -1.549 4.506 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -3.747 -1.630 1.439 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -3.216 -2.943 2.471 1.00 0.00 H new ATOM 0 HG LEU A 403 -6.064 -1.915 2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -6.438 -4.141 1.156 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -5.236 -3.187 0.254 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -4.704 -4.505 1.325 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -6.660 -3.875 3.611 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.934 -4.265 3.803 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -5.590 -2.762 4.496 1.00 0.00 H new ATOM 350 N PHE A 404 -1.325 -1.465 4.145 1.00 0.00 N ATOM 351 CA PHE A 404 0.134 -1.483 4.073 1.00 0.00 C ATOM 352 C PHE A 404 0.582 -2.832 3.501 1.00 0.00 C ATOM 353 O PHE A 404 0.162 -3.889 3.973 1.00 0.00 O ATOM 354 CB PHE A 404 0.707 -1.266 5.480 1.00 0.00 C ATOM 355 CG PHE A 404 2.208 -1.453 5.611 1.00 0.00 C ATOM 356 CD1 PHE A 404 3.083 -0.432 5.197 1.00 0.00 C ATOM 357 CD2 PHE A 404 2.735 -2.621 6.195 1.00 0.00 C ATOM 358 CE1 PHE A 404 4.467 -0.556 5.400 1.00 0.00 C ATOM 359 CE2 PHE A 404 4.123 -2.750 6.385 1.00 0.00 C ATOM 360 CZ PHE A 404 4.990 -1.715 5.995 1.00 0.00 C ATOM 0 H PHE A 404 -1.677 -2.101 4.861 1.00 0.00 H new ATOM 0 HA PHE A 404 0.499 -0.687 3.424 1.00 0.00 H new ATOM 0 HB2 PHE A 404 0.455 -0.256 5.804 1.00 0.00 H new ATOM 0 HB3 PHE A 404 0.212 -1.954 6.165 1.00 0.00 H new ATOM 0 HD1 PHE A 404 2.688 0.453 4.720 1.00 0.00 H new ATOM 0 HD2 PHE A 404 2.073 -3.419 6.497 1.00 0.00 H new ATOM 0 HE1 PHE A 404 5.130 0.241 5.098 1.00 0.00 H new ATOM 0 HE2 PHE A 404 4.524 -3.648 6.832 1.00 0.00 H new ATOM 0 HZ PHE A 404 6.054 -1.811 6.152 1.00 0.00 H new ATOM 370 N ILE A 405 1.429 -2.777 2.476 1.00 0.00 N ATOM 371 CA ILE A 405 2.030 -3.906 1.761 1.00 0.00 C ATOM 372 C ILE A 405 3.551 -3.807 1.949 1.00 0.00 C ATOM 373 O ILE A 405 4.112 -2.721 1.836 1.00 0.00 O ATOM 374 CB ILE A 405 1.655 -3.859 0.254 1.00 0.00 C ATOM 375 CG1 ILE A 405 0.143 -3.971 -0.066 1.00 0.00 C ATOM 376 CG2 ILE A 405 2.355 -5.013 -0.493 1.00 0.00 C ATOM 377 CD1 ILE A 405 -0.732 -2.754 0.256 1.00 0.00 C ATOM 0 H ILE A 405 1.736 -1.882 2.095 1.00 0.00 H new ATOM 0 HA ILE A 405 1.659 -4.853 2.154 1.00 0.00 H new ATOM 0 HB ILE A 405 1.981 -2.871 -0.070 1.00 0.00 H new ATOM 0 HG12 ILE A 405 0.038 -4.192 -1.128 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -0.255 -4.827 0.478 1.00 0.00 H new ATOM 0 HG21 ILE A 405 2.089 -4.977 -1.550 1.00 0.00 H new ATOM 0 HG22 ILE A 405 3.435 -4.913 -0.387 1.00 0.00 H new ATOM 0 HG23 ILE A 405 2.036 -5.966 -0.071 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.766 -2.967 -0.017 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -0.675 -2.537 1.323 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.378 -1.892 -0.309 1.00 0.00 H new ATOM 389 N TYR A 406 4.232 -4.920 2.208 1.00 0.00 N ATOM 390 CA TYR A 406 5.671 -4.954 2.502 1.00 0.00 C ATOM 391 C TYR A 406 6.341 -6.224 1.957 1.00 0.00 C ATOM 392 O TYR A 406 5.675 -7.233 1.728 1.00 0.00 O ATOM 393 CB TYR A 406 5.849 -4.777 4.018 1.00 0.00 C ATOM 394 CG TYR A 406 7.262 -4.714 4.579 1.00 0.00 C ATOM 395 CD1 TYR A 406 8.277 -3.993 3.920 1.00 0.00 C ATOM 396 CD2 TYR A 406 7.543 -5.321 5.819 1.00 0.00 C ATOM 397 CE1 TYR A 406 9.559 -3.879 4.485 1.00 0.00 C ATOM 398 CE2 TYR A 406 8.823 -5.211 6.391 1.00 0.00 C ATOM 399 CZ TYR A 406 9.839 -4.489 5.727 1.00 0.00 C ATOM 400 OH TYR A 406 11.080 -4.370 6.276 1.00 0.00 O ATOM 0 H TYR A 406 3.796 -5.842 2.221 1.00 0.00 H new ATOM 0 HA TYR A 406 6.178 -4.137 1.990 1.00 0.00 H new ATOM 0 HB2 TYR A 406 5.336 -3.860 4.308 1.00 0.00 H new ATOM 0 HB3 TYR A 406 5.333 -5.601 4.511 1.00 0.00 H new ATOM 0 HD1 TYR A 406 8.068 -3.523 2.970 1.00 0.00 H new ATOM 0 HD2 TYR A 406 6.771 -5.874 6.333 1.00 0.00 H new ATOM 0 HE1 TYR A 406 10.329 -3.325 3.969 1.00 0.00 H new ATOM 0 HE2 TYR A 406 9.030 -5.680 7.341 1.00 0.00 H new ATOM 0 HH TYR A 406 11.106 -4.847 7.132 1.00 0.00 H new ATOM 410 N HIS A 407 7.650 -6.137 1.703 1.00 0.00 N ATOM 411 CA HIS A 407 8.515 -7.125 1.036 1.00 0.00 C ATOM 412 C HIS A 407 8.365 -7.115 -0.506 1.00 0.00 C ATOM 413 O HIS A 407 8.621 -8.121 -1.170 1.00 0.00 O ATOM 414 CB HIS A 407 8.389 -8.523 1.677 1.00 0.00 C ATOM 415 CG HIS A 407 8.578 -8.533 3.169 1.00 0.00 C ATOM 416 ND1 HIS A 407 9.709 -8.066 3.844 1.00 0.00 N ATOM 417 CD2 HIS A 407 7.690 -9.026 4.077 1.00 0.00 C ATOM 418 CE1 HIS A 407 9.464 -8.284 5.147 1.00 0.00 C ATOM 419 NE2 HIS A 407 8.259 -8.857 5.319 1.00 0.00 N ATOM 0 H HIS A 407 8.178 -5.309 1.979 1.00 0.00 H new ATOM 0 HA HIS A 407 9.546 -6.817 1.207 1.00 0.00 H new ATOM 0 HB2 HIS A 407 7.406 -8.931 1.443 1.00 0.00 H new ATOM 0 HB3 HIS A 407 9.125 -9.187 1.224 1.00 0.00 H new ATOM 0 HD2 HIS A 407 6.726 -9.464 3.864 1.00 0.00 H new ATOM 0 HE1 HIS A 407 10.143 -8.033 5.948 1.00 0.00 H new ATOM 0 HE2 HIS A 407 7.841 -9.120 6.212 1.00 0.00 H new ATOM 427 N LEU A 408 7.960 -5.976 -1.084 1.00 0.00 N ATOM 428 CA LEU A 408 7.871 -5.740 -2.535 1.00 0.00 C ATOM 429 C LEU A 408 9.259 -5.768 -3.220 1.00 0.00 C ATOM 430 O LEU A 408 10.284 -5.705 -2.530 1.00 0.00 O ATOM 431 CB LEU A 408 7.194 -4.371 -2.778 1.00 0.00 C ATOM 432 CG LEU A 408 5.704 -4.298 -2.383 1.00 0.00 C ATOM 433 CD1 LEU A 408 5.251 -2.832 -2.334 1.00 0.00 C ATOM 434 CD2 LEU A 408 4.830 -5.062 -3.390 1.00 0.00 C ATOM 0 H LEU A 408 7.675 -5.164 -0.537 1.00 0.00 H new ATOM 0 HA LEU A 408 7.280 -6.544 -2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 408 7.739 -3.609 -2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 408 7.286 -4.120 -3.835 1.00 0.00 H new ATOM 0 HG LEU A 408 5.590 -4.757 -1.401 1.00 0.00 H new ATOM 0 HD11 LEU A 408 4.198 -2.786 -2.055 1.00 0.00 H new ATOM 0 HD12 LEU A 408 5.846 -2.292 -1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 408 5.387 -2.376 -3.315 1.00 0.00 H new ATOM 0 HD21 LEU A 408 3.785 -4.995 -3.089 1.00 0.00 H new ATOM 0 HD22 LEU A 408 4.951 -4.625 -4.381 1.00 0.00 H new ATOM 0 HD23 LEU A 408 5.134 -6.108 -3.415 1.00 0.00 H new ATOM 446 N PRO A 409 9.318 -5.852 -4.565 1.00 0.00 N ATOM 447 CA PRO A 409 10.542 -5.643 -5.335 1.00 0.00 C ATOM 448 C PRO A 409 11.104 -4.226 -5.139 1.00 0.00 C ATOM 449 O PRO A 409 10.353 -3.268 -4.954 1.00 0.00 O ATOM 450 CB PRO A 409 10.162 -5.897 -6.800 1.00 0.00 C ATOM 451 CG PRO A 409 8.946 -6.816 -6.699 1.00 0.00 C ATOM 452 CD PRO A 409 8.244 -6.294 -5.447 1.00 0.00 C ATOM 0 HA PRO A 409 11.333 -6.317 -5.005 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.922 -4.969 -7.319 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.977 -6.368 -7.350 1.00 0.00 H new ATOM 0 HG2 PRO A 409 8.309 -6.746 -7.581 1.00 0.00 H new ATOM 0 HG3 PRO A 409 9.235 -7.862 -6.597 1.00 0.00 H new ATOM 0 HD2 PRO A 409 7.568 -5.473 -5.687 1.00 0.00 H new ATOM 0 HD3 PRO A 409 7.644 -7.074 -4.978 1.00 0.00 H new ATOM 460 N GLN A 410 12.430 -4.081 -5.238 1.00 0.00 N ATOM 461 CA GLN A 410 13.150 -2.805 -5.063 1.00 0.00 C ATOM 462 C GLN A 410 12.989 -1.843 -6.269 1.00 0.00 C ATOM 463 O GLN A 410 13.550 -0.745 -6.284 1.00 0.00 O ATOM 464 CB GLN A 410 14.622 -3.141 -4.746 1.00 0.00 C ATOM 465 CG GLN A 410 15.451 -1.970 -4.180 1.00 0.00 C ATOM 466 CD GLN A 410 16.630 -1.597 -5.083 1.00 0.00 C ATOM 467 OE1 GLN A 410 17.786 -1.895 -4.806 1.00 0.00 O ATOM 468 NE2 GLN A 410 16.383 -0.950 -6.202 1.00 0.00 N ATOM 0 H GLN A 410 13.051 -4.863 -5.447 1.00 0.00 H new ATOM 0 HA GLN A 410 12.714 -2.249 -4.233 1.00 0.00 H new ATOM 0 HB2 GLN A 410 14.645 -3.962 -4.030 1.00 0.00 H new ATOM 0 HB3 GLN A 410 15.102 -3.499 -5.657 1.00 0.00 H new ATOM 0 HG2 GLN A 410 14.806 -1.101 -4.052 1.00 0.00 H new ATOM 0 HG3 GLN A 410 15.825 -2.238 -3.192 1.00 0.00 H new ATOM 0 HE21 GLN A 410 15.425 -0.696 -6.444 1.00 0.00 H new ATOM 0 HE22 GLN A 410 17.150 -0.702 -6.828 1.00 0.00 H new ATOM 477 N GLU A 411 12.189 -2.229 -7.268 1.00 0.00 N ATOM 478 CA GLU A 411 11.923 -1.491 -8.511 1.00 0.00 C ATOM 479 C GLU A 411 10.417 -1.385 -8.848 1.00 0.00 C ATOM 480 O GLU A 411 10.055 -0.954 -9.945 1.00 0.00 O ATOM 481 CB GLU A 411 12.729 -2.134 -9.658 1.00 0.00 C ATOM 482 CG GLU A 411 12.311 -3.578 -9.980 1.00 0.00 C ATOM 483 CD GLU A 411 13.151 -4.145 -11.135 1.00 0.00 C ATOM 484 OE1 GLU A 411 14.219 -4.746 -10.873 1.00 0.00 O ATOM 485 OE2 GLU A 411 12.745 -4.002 -12.313 1.00 0.00 O ATOM 0 H GLU A 411 11.681 -3.113 -7.231 1.00 0.00 H new ATOM 0 HA GLU A 411 12.250 -0.461 -8.371 1.00 0.00 H new ATOM 0 HB2 GLU A 411 12.615 -1.525 -10.555 1.00 0.00 H new ATOM 0 HB3 GLU A 411 13.787 -2.122 -9.396 1.00 0.00 H new ATOM 0 HG2 GLU A 411 12.433 -4.203 -9.095 1.00 0.00 H new ATOM 0 HG3 GLU A 411 11.254 -3.605 -10.246 1.00 0.00 H new ATOM 492 N PHE A 412 9.530 -1.784 -7.925 1.00 0.00 N ATOM 493 CA PHE A 412 8.077 -1.810 -8.131 1.00 0.00 C ATOM 494 C PHE A 412 7.491 -0.387 -8.202 1.00 0.00 C ATOM 495 O PHE A 412 7.816 0.464 -7.369 1.00 0.00 O ATOM 496 CB PHE A 412 7.429 -2.638 -7.004 1.00 0.00 C ATOM 497 CG PHE A 412 6.274 -3.523 -7.431 1.00 0.00 C ATOM 498 CD1 PHE A 412 6.497 -4.558 -8.359 1.00 0.00 C ATOM 499 CD2 PHE A 412 5.002 -3.373 -6.847 1.00 0.00 C ATOM 500 CE1 PHE A 412 5.456 -5.438 -8.702 1.00 0.00 C ATOM 501 CE2 PHE A 412 3.963 -4.259 -7.183 1.00 0.00 C ATOM 502 CZ PHE A 412 4.188 -5.288 -8.112 1.00 0.00 C ATOM 0 H PHE A 412 9.809 -2.103 -6.997 1.00 0.00 H new ATOM 0 HA PHE A 412 7.857 -2.280 -9.090 1.00 0.00 H new ATOM 0 HB2 PHE A 412 8.196 -3.265 -6.549 1.00 0.00 H new ATOM 0 HB3 PHE A 412 7.075 -1.955 -6.231 1.00 0.00 H new ATOM 0 HD1 PHE A 412 7.472 -4.676 -8.809 1.00 0.00 H new ATOM 0 HD2 PHE A 412 4.824 -2.576 -6.140 1.00 0.00 H new ATOM 0 HE1 PHE A 412 5.629 -6.228 -9.418 1.00 0.00 H new ATOM 0 HE2 PHE A 412 2.991 -4.148 -6.726 1.00 0.00 H new ATOM 0 HZ PHE A 412 3.387 -5.964 -8.373 1.00 0.00 H new ATOM 512 N GLY A 413 6.630 -0.126 -9.192 1.00 0.00 N ATOM 513 CA GLY A 413 5.983 1.171 -9.417 1.00 0.00 C ATOM 514 C GLY A 413 4.565 1.252 -8.852 1.00 0.00 C ATOM 515 O GLY A 413 3.932 0.245 -8.540 1.00 0.00 O ATOM 0 H GLY A 413 6.357 -0.830 -9.877 1.00 0.00 H new ATOM 0 HA2 GLY A 413 6.591 1.955 -8.965 1.00 0.00 H new ATOM 0 HA3 GLY A 413 5.951 1.371 -10.488 1.00 0.00 H new ATOM 519 N ASP A 414 4.037 2.475 -8.777 1.00 0.00 N ATOM 520 CA ASP A 414 2.698 2.763 -8.237 1.00 0.00 C ATOM 521 C ASP A 414 1.578 2.105 -9.063 1.00 0.00 C ATOM 522 O ASP A 414 0.574 1.656 -8.510 1.00 0.00 O ATOM 523 CB ASP A 414 2.496 4.291 -8.160 1.00 0.00 C ATOM 524 CG ASP A 414 3.412 5.002 -7.152 1.00 0.00 C ATOM 525 OD1 ASP A 414 4.035 4.312 -6.316 1.00 0.00 O ATOM 526 OD2 ASP A 414 3.464 6.252 -7.153 1.00 0.00 O ATOM 0 H ASP A 414 4.532 3.309 -9.093 1.00 0.00 H new ATOM 0 HA ASP A 414 2.638 2.333 -7.237 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.664 4.718 -9.149 1.00 0.00 H new ATOM 0 HB3 ASP A 414 1.458 4.495 -7.897 1.00 0.00 H new ATOM 531 N GLN A 415 1.777 1.993 -10.380 1.00 0.00 N ATOM 532 CA GLN A 415 0.886 1.323 -11.311 1.00 0.00 C ATOM 533 C GLN A 415 0.979 -0.210 -11.227 1.00 0.00 C ATOM 534 O GLN A 415 0.002 -0.892 -11.532 1.00 0.00 O ATOM 535 CB GLN A 415 1.265 1.803 -12.717 1.00 0.00 C ATOM 536 CG GLN A 415 0.835 3.253 -12.998 1.00 0.00 C ATOM 537 CD GLN A 415 1.171 3.698 -14.427 1.00 0.00 C ATOM 538 OE1 GLN A 415 2.282 3.538 -14.919 1.00 0.00 O ATOM 539 NE2 GLN A 415 0.233 4.275 -15.153 1.00 0.00 N ATOM 0 H GLN A 415 2.600 2.386 -10.838 1.00 0.00 H new ATOM 0 HA GLN A 415 -0.146 1.572 -11.063 1.00 0.00 H new ATOM 0 HB2 GLN A 415 2.344 1.720 -12.844 1.00 0.00 H new ATOM 0 HB3 GLN A 415 0.806 1.145 -13.455 1.00 0.00 H new ATOM 0 HG2 GLN A 415 -0.238 3.349 -12.834 1.00 0.00 H new ATOM 0 HG3 GLN A 415 1.327 3.919 -12.288 1.00 0.00 H new ATOM 0 HE21 GLN A 415 -0.698 4.418 -14.763 1.00 0.00 H new ATOM 0 HE22 GLN A 415 0.439 4.578 -16.105 1.00 0.00 H new ATOM 548 N ASP A 416 2.112 -0.774 -10.792 1.00 0.00 N ATOM 549 CA ASP A 416 2.260 -2.223 -10.605 1.00 0.00 C ATOM 550 C ASP A 416 1.488 -2.686 -9.363 1.00 0.00 C ATOM 551 O ASP A 416 0.769 -3.686 -9.413 1.00 0.00 O ATOM 552 CB ASP A 416 3.741 -2.624 -10.490 1.00 0.00 C ATOM 553 CG ASP A 416 4.570 -2.265 -11.732 1.00 0.00 C ATOM 554 OD1 ASP A 416 4.249 -2.761 -12.839 1.00 0.00 O ATOM 555 OD2 ASP A 416 5.564 -1.516 -11.585 1.00 0.00 O ATOM 0 H ASP A 416 2.950 -0.241 -10.560 1.00 0.00 H new ATOM 0 HA ASP A 416 1.844 -2.715 -11.484 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.175 -2.134 -9.619 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.806 -3.698 -10.317 1.00 0.00 H new ATOM 560 N LEU A 417 1.570 -1.912 -8.272 1.00 0.00 N ATOM 561 CA LEU A 417 0.805 -2.155 -7.050 1.00 0.00 C ATOM 562 C LEU A 417 -0.698 -1.935 -7.259 1.00 0.00 C ATOM 563 O LEU A 417 -1.507 -2.679 -6.709 1.00 0.00 O ATOM 564 CB LEU A 417 1.372 -1.267 -5.930 1.00 0.00 C ATOM 565 CG LEU A 417 0.882 -1.660 -4.522 1.00 0.00 C ATOM 566 CD1 LEU A 417 1.380 -3.052 -4.103 1.00 0.00 C ATOM 567 CD2 LEU A 417 1.368 -0.630 -3.500 1.00 0.00 C ATOM 0 H LEU A 417 2.176 -1.093 -8.217 1.00 0.00 H new ATOM 0 HA LEU A 417 0.909 -3.201 -6.763 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.461 -1.318 -5.954 1.00 0.00 H new ATOM 0 HB3 LEU A 417 1.097 -0.231 -6.125 1.00 0.00 H new ATOM 0 HG LEU A 417 -0.207 -1.685 -4.553 1.00 0.00 H new ATOM 0 HD11 LEU A 417 1.010 -3.286 -3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 417 1.014 -3.797 -4.809 1.00 0.00 H new ATOM 0 HD13 LEU A 417 2.470 -3.062 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.020 -0.911 -2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.457 -0.597 -3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 417 0.973 0.353 -3.758 1.00 0.00 H new ATOM 579 N LEU A 418 -1.078 -0.971 -8.105 1.00 0.00 N ATOM 580 CA LEU A 418 -2.468 -0.780 -8.530 1.00 0.00 C ATOM 581 C LEU A 418 -3.000 -2.016 -9.262 1.00 0.00 C ATOM 582 O LEU A 418 -4.000 -2.587 -8.836 1.00 0.00 O ATOM 583 CB LEU A 418 -2.570 0.490 -9.393 1.00 0.00 C ATOM 584 CG LEU A 418 -3.992 0.855 -9.864 1.00 0.00 C ATOM 585 CD1 LEU A 418 -4.971 1.049 -8.699 1.00 0.00 C ATOM 586 CD2 LEU A 418 -3.935 2.136 -10.707 1.00 0.00 C ATOM 0 H LEU A 418 -0.428 -0.300 -8.515 1.00 0.00 H new ATOM 0 HA LEU A 418 -3.097 -0.648 -7.649 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.167 1.328 -8.825 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -1.935 0.365 -10.270 1.00 0.00 H new ATOM 0 HG LEU A 418 -4.362 0.020 -10.458 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -5.956 1.304 -9.090 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -5.038 0.127 -8.122 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.616 1.854 -8.056 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -4.939 2.396 -11.041 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.530 2.950 -10.105 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -3.295 1.973 -11.574 1.00 0.00 H new ATOM 598 N GLN A 419 -2.323 -2.454 -10.330 1.00 0.00 N ATOM 599 CA GLN A 419 -2.739 -3.608 -11.143 1.00 0.00 C ATOM 600 C GLN A 419 -2.771 -4.920 -10.342 1.00 0.00 C ATOM 601 O GLN A 419 -3.612 -5.780 -10.605 1.00 0.00 O ATOM 602 CB GLN A 419 -1.804 -3.741 -12.356 1.00 0.00 C ATOM 603 CG GLN A 419 -2.056 -2.651 -13.409 1.00 0.00 C ATOM 604 CD GLN A 419 -0.952 -2.629 -14.467 1.00 0.00 C ATOM 605 OE1 GLN A 419 -1.083 -3.160 -15.565 1.00 0.00 O ATOM 606 NE2 GLN A 419 0.180 -2.025 -14.171 1.00 0.00 N ATOM 0 H GLN A 419 -1.463 -2.015 -10.659 1.00 0.00 H new ATOM 0 HA GLN A 419 -3.760 -3.425 -11.477 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -0.768 -3.687 -12.021 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -1.941 -4.722 -12.812 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -3.019 -2.824 -13.890 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -2.113 -1.678 -12.921 1.00 0.00 H new ATOM 0 HE21 GLN A 419 0.298 -1.581 -13.260 1.00 0.00 H new ATOM 0 HE22 GLN A 419 0.939 -2.001 -14.852 1.00 0.00 H new ATOM 615 N MET A 420 -1.910 -5.053 -9.327 1.00 0.00 N ATOM 616 CA MET A 420 -1.889 -6.186 -8.397 1.00 0.00 C ATOM 617 C MET A 420 -3.142 -6.249 -7.501 1.00 0.00 C ATOM 618 O MET A 420 -3.584 -7.348 -7.158 1.00 0.00 O ATOM 619 CB MET A 420 -0.586 -6.085 -7.583 1.00 0.00 C ATOM 620 CG MET A 420 -0.439 -7.135 -6.482 1.00 0.00 C ATOM 621 SD MET A 420 1.068 -6.930 -5.498 1.00 0.00 S ATOM 622 CE MET A 420 2.194 -7.956 -6.461 1.00 0.00 C ATOM 0 H MET A 420 -1.191 -4.358 -9.125 1.00 0.00 H new ATOM 0 HA MET A 420 -1.912 -7.122 -8.955 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.260 -6.172 -8.265 1.00 0.00 H new ATOM 0 HB3 MET A 420 -0.531 -5.094 -7.132 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.305 -7.085 -5.823 1.00 0.00 H new ATOM 0 HG3 MET A 420 -0.439 -8.127 -6.933 1.00 0.00 H new ATOM 0 HE1 MET A 420 3.192 -7.518 -6.442 1.00 0.00 H new ATOM 0 HE2 MET A 420 2.229 -8.958 -6.033 1.00 0.00 H new ATOM 0 HE3 MET A 420 1.843 -8.014 -7.491 1.00 0.00 H new ATOM 632 N PHE A 421 -3.732 -5.100 -7.140 1.00 0.00 N ATOM 633 CA PHE A 421 -4.852 -4.988 -6.193 1.00 0.00 C ATOM 634 C PHE A 421 -6.223 -4.666 -6.830 1.00 0.00 C ATOM 635 O PHE A 421 -7.245 -4.756 -6.146 1.00 0.00 O ATOM 636 CB PHE A 421 -4.457 -4.016 -5.069 1.00 0.00 C ATOM 637 CG PHE A 421 -3.580 -4.641 -3.990 1.00 0.00 C ATOM 638 CD1 PHE A 421 -2.220 -4.915 -4.230 1.00 0.00 C ATOM 639 CD2 PHE A 421 -4.126 -4.950 -2.727 1.00 0.00 C ATOM 640 CE1 PHE A 421 -1.426 -5.518 -3.239 1.00 0.00 C ATOM 641 CE2 PHE A 421 -3.334 -5.553 -1.733 1.00 0.00 C ATOM 642 CZ PHE A 421 -1.986 -5.851 -1.995 1.00 0.00 C ATOM 0 H PHE A 421 -3.435 -4.197 -7.509 1.00 0.00 H new ATOM 0 HA PHE A 421 -5.022 -5.979 -5.772 1.00 0.00 H new ATOM 0 HB2 PHE A 421 -3.930 -3.167 -5.505 1.00 0.00 H new ATOM 0 HB3 PHE A 421 -5.363 -3.625 -4.606 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -1.783 -4.660 -5.184 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -5.161 -4.722 -2.521 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -0.384 -5.725 -3.435 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.762 -5.787 -0.769 1.00 0.00 H new ATOM 0 HZ PHE A 421 -1.382 -6.335 -1.242 1.00 0.00 H new ATOM 652 N MET A 422 -6.282 -4.391 -8.142 1.00 0.00 N ATOM 653 CA MET A 422 -7.527 -4.247 -8.930 1.00 0.00 C ATOM 654 C MET A 422 -8.639 -5.294 -8.678 1.00 0.00 C ATOM 655 O MET A 422 -9.795 -4.877 -8.561 1.00 0.00 O ATOM 656 CB MET A 422 -7.206 -4.264 -10.438 1.00 0.00 C ATOM 657 CG MET A 422 -6.638 -2.943 -10.945 1.00 0.00 C ATOM 658 SD MET A 422 -6.333 -2.926 -12.731 1.00 0.00 S ATOM 659 CE MET A 422 -5.616 -1.272 -12.894 1.00 0.00 C ATOM 0 H MET A 422 -5.442 -4.258 -8.706 1.00 0.00 H new ATOM 0 HA MET A 422 -7.929 -3.294 -8.586 1.00 0.00 H new ATOM 0 HB2 MET A 422 -6.492 -5.062 -10.642 1.00 0.00 H new ATOM 0 HB3 MET A 422 -8.114 -4.499 -10.994 1.00 0.00 H new ATOM 0 HG2 MET A 422 -7.330 -2.139 -10.695 1.00 0.00 H new ATOM 0 HG3 MET A 422 -5.704 -2.734 -10.423 1.00 0.00 H new ATOM 0 HE1 MET A 422 -5.496 -1.030 -13.950 1.00 0.00 H new ATOM 0 HE2 MET A 422 -6.277 -0.541 -12.427 1.00 0.00 H new ATOM 0 HE3 MET A 422 -4.643 -1.247 -12.403 1.00 0.00 H new ATOM 669 N PRO A 423 -8.364 -6.618 -8.618 1.00 0.00 N ATOM 670 CA PRO A 423 -9.418 -7.640 -8.618 1.00 0.00 C ATOM 671 C PRO A 423 -10.172 -7.806 -7.291 1.00 0.00 C ATOM 672 O PRO A 423 -11.161 -8.539 -7.245 1.00 0.00 O ATOM 673 CB PRO A 423 -8.722 -8.935 -9.038 1.00 0.00 C ATOM 674 CG PRO A 423 -7.285 -8.748 -8.571 1.00 0.00 C ATOM 675 CD PRO A 423 -7.061 -7.254 -8.785 1.00 0.00 C ATOM 0 HA PRO A 423 -10.210 -7.339 -9.303 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -9.183 -9.806 -8.572 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -8.775 -9.085 -10.116 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -7.157 -9.032 -7.526 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -6.587 -9.351 -9.153 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -6.342 -6.862 -8.066 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -6.658 -7.059 -9.779 1.00 0.00 H new ATOM 683 N PHE A 424 -9.743 -7.119 -6.229 1.00 0.00 N ATOM 684 CA PHE A 424 -10.318 -7.244 -4.880 1.00 0.00 C ATOM 685 C PHE A 424 -11.360 -6.158 -4.541 1.00 0.00 C ATOM 686 O PHE A 424 -11.966 -6.209 -3.469 1.00 0.00 O ATOM 687 CB PHE A 424 -9.178 -7.293 -3.850 1.00 0.00 C ATOM 688 CG PHE A 424 -8.055 -8.255 -4.201 1.00 0.00 C ATOM 689 CD1 PHE A 424 -8.345 -9.608 -4.469 1.00 0.00 C ATOM 690 CD2 PHE A 424 -6.730 -7.790 -4.322 1.00 0.00 C ATOM 691 CE1 PHE A 424 -7.327 -10.479 -4.890 1.00 0.00 C ATOM 692 CE2 PHE A 424 -5.713 -8.666 -4.738 1.00 0.00 C ATOM 693 CZ PHE A 424 -6.011 -10.008 -5.027 1.00 0.00 C ATOM 0 H PHE A 424 -8.975 -6.449 -6.279 1.00 0.00 H new ATOM 0 HA PHE A 424 -10.881 -8.177 -4.847 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -8.761 -6.292 -3.740 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -9.592 -7.574 -2.882 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -9.353 -9.976 -4.350 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -6.496 -6.760 -4.095 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.556 -11.512 -5.109 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.699 -8.306 -4.836 1.00 0.00 H new ATOM 0 HZ PHE A 424 -5.229 -10.677 -5.354 1.00 0.00 H new ATOM 703 N GLY A 425 -11.607 -5.208 -5.458 1.00 0.00 N ATOM 704 CA GLY A 425 -12.649 -4.176 -5.351 1.00 0.00 C ATOM 705 C GLY A 425 -12.230 -2.804 -5.877 1.00 0.00 C ATOM 706 O GLY A 425 -11.212 -2.656 -6.554 1.00 0.00 O ATOM 0 H GLY A 425 -11.069 -5.136 -6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -13.531 -4.508 -5.898 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -12.941 -4.078 -4.305 1.00 0.00 H new ATOM 710 N ASN A 426 -13.029 -1.779 -5.568 1.00 0.00 N ATOM 711 CA ASN A 426 -12.804 -0.408 -6.035 1.00 0.00 C ATOM 712 C ASN A 426 -11.628 0.260 -5.293 1.00 0.00 C ATOM 713 O ASN A 426 -11.813 0.901 -4.254 1.00 0.00 O ATOM 714 CB ASN A 426 -14.114 0.393 -5.925 1.00 0.00 C ATOM 715 CG ASN A 426 -13.974 1.791 -6.525 1.00 0.00 C ATOM 716 OD1 ASN A 426 -14.227 2.008 -7.704 1.00 0.00 O ATOM 717 ND2 ASN A 426 -13.547 2.766 -5.744 1.00 0.00 N ATOM 0 H ASN A 426 -13.858 -1.878 -4.981 1.00 0.00 H new ATOM 0 HA ASN A 426 -12.512 -0.430 -7.085 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -14.913 -0.144 -6.436 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -14.404 0.474 -4.877 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -13.426 3.706 -6.121 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -13.338 2.579 -4.763 1.00 0.00 H new ATOM 724 N VAL A 427 -10.416 0.123 -5.840 1.00 0.00 N ATOM 725 CA VAL A 427 -9.221 0.857 -5.389 1.00 0.00 C ATOM 726 C VAL A 427 -9.418 2.351 -5.677 1.00 0.00 C ATOM 727 O VAL A 427 -9.671 2.742 -6.815 1.00 0.00 O ATOM 728 CB VAL A 427 -7.920 0.341 -6.057 1.00 0.00 C ATOM 729 CG1 VAL A 427 -6.699 1.154 -5.596 1.00 0.00 C ATOM 730 CG2 VAL A 427 -7.655 -1.139 -5.736 1.00 0.00 C ATOM 0 H VAL A 427 -10.231 -0.509 -6.619 1.00 0.00 H new ATOM 0 HA VAL A 427 -9.104 0.692 -4.318 1.00 0.00 H new ATOM 0 HB VAL A 427 -8.066 0.457 -7.131 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -5.802 0.769 -6.081 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.836 2.201 -5.865 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -6.592 1.068 -4.515 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -6.734 -1.458 -6.224 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -7.557 -1.266 -4.658 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -8.486 -1.744 -6.098 1.00 0.00 H new ATOM 740 N VAL A 428 -9.294 3.176 -4.639 1.00 0.00 N ATOM 741 CA VAL A 428 -9.338 4.648 -4.691 1.00 0.00 C ATOM 742 C VAL A 428 -7.953 5.209 -5.037 1.00 0.00 C ATOM 743 O VAL A 428 -7.854 6.127 -5.850 1.00 0.00 O ATOM 744 CB VAL A 428 -9.859 5.231 -3.354 1.00 0.00 C ATOM 745 CG1 VAL A 428 -9.742 6.763 -3.269 1.00 0.00 C ATOM 746 CG2 VAL A 428 -11.335 4.846 -3.153 1.00 0.00 C ATOM 0 H VAL A 428 -9.153 2.826 -3.691 1.00 0.00 H new ATOM 0 HA VAL A 428 -10.033 4.947 -5.475 1.00 0.00 H new ATOM 0 HB VAL A 428 -9.229 4.806 -2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -10.125 7.104 -2.307 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -8.696 7.054 -3.367 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -10.322 7.217 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -11.694 5.260 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -11.930 5.245 -3.974 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -11.428 3.760 -3.131 1.00 0.00 H new ATOM 756 N SER A 429 -6.881 4.620 -4.496 1.00 0.00 N ATOM 757 CA SER A 429 -5.499 4.906 -4.907 1.00 0.00 C ATOM 758 C SER A 429 -4.503 3.825 -4.450 1.00 0.00 C ATOM 759 O SER A 429 -4.813 3.019 -3.566 1.00 0.00 O ATOM 760 CB SER A 429 -5.033 6.290 -4.420 1.00 0.00 C ATOM 761 OG SER A 429 -4.796 6.300 -3.020 1.00 0.00 O ATOM 0 H SER A 429 -6.947 3.924 -3.753 1.00 0.00 H new ATOM 0 HA SER A 429 -5.511 4.903 -5.997 1.00 0.00 H new ATOM 0 HB2 SER A 429 -4.121 6.573 -4.946 1.00 0.00 H new ATOM 0 HB3 SER A 429 -5.788 7.036 -4.667 1.00 0.00 H new ATOM 0 HG SER A 429 -5.520 6.782 -2.569 1.00 0.00 H new ATOM 767 N ALA A 430 -3.295 3.831 -5.027 1.00 0.00 N ATOM 768 CA ALA A 430 -2.204 2.916 -4.700 1.00 0.00 C ATOM 769 C ALA A 430 -0.844 3.583 -4.953 1.00 0.00 C ATOM 770 O ALA A 430 -0.683 4.357 -5.901 1.00 0.00 O ATOM 771 CB ALA A 430 -2.365 1.631 -5.524 1.00 0.00 C ATOM 0 H ALA A 430 -3.046 4.497 -5.758 1.00 0.00 H new ATOM 0 HA ALA A 430 -2.243 2.660 -3.641 1.00 0.00 H new ATOM 0 HB1 ALA A 430 -1.554 0.942 -5.286 1.00 0.00 H new ATOM 0 HB2 ALA A 430 -3.320 1.163 -5.286 1.00 0.00 H new ATOM 0 HB3 ALA A 430 -2.335 1.874 -6.586 1.00 0.00 H new ATOM 777 N LYS A 431 0.142 3.279 -4.105 1.00 0.00 N ATOM 778 CA LYS A 431 1.476 3.893 -4.153 1.00 0.00 C ATOM 779 C LYS A 431 2.541 3.032 -3.451 1.00 0.00 C ATOM 780 O LYS A 431 2.365 2.650 -2.297 1.00 0.00 O ATOM 781 CB LYS A 431 1.399 5.313 -3.548 1.00 0.00 C ATOM 782 CG LYS A 431 2.782 5.980 -3.475 1.00 0.00 C ATOM 783 CD LYS A 431 2.767 7.480 -3.796 1.00 0.00 C ATOM 784 CE LYS A 431 4.194 8.039 -3.909 1.00 0.00 C ATOM 785 NZ LYS A 431 4.990 7.378 -4.978 1.00 0.00 N ATOM 0 H LYS A 431 0.038 2.593 -3.357 1.00 0.00 H new ATOM 0 HA LYS A 431 1.790 3.962 -5.194 1.00 0.00 H new ATOM 0 HB2 LYS A 431 0.730 5.928 -4.150 1.00 0.00 H new ATOM 0 HB3 LYS A 431 0.969 5.259 -2.548 1.00 0.00 H new ATOM 0 HG2 LYS A 431 3.191 5.837 -2.475 1.00 0.00 H new ATOM 0 HG3 LYS A 431 3.454 5.477 -4.170 1.00 0.00 H new ATOM 0 HD2 LYS A 431 2.232 7.649 -4.731 1.00 0.00 H new ATOM 0 HD3 LYS A 431 2.224 8.016 -3.017 1.00 0.00 H new ATOM 0 HE2 LYS A 431 4.145 9.110 -4.108 1.00 0.00 H new ATOM 0 HE3 LYS A 431 4.704 7.916 -2.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 5.637 8.070 -5.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 5.541 6.597 -4.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 4.349 7.004 -5.707 1.00 0.00 H new ATOM 799 N VAL A 432 3.658 2.766 -4.121 1.00 0.00 N ATOM 800 CA VAL A 432 4.870 2.175 -3.537 1.00 0.00 C ATOM 801 C VAL A 432 5.705 3.335 -2.988 1.00 0.00 C ATOM 802 O VAL A 432 5.801 4.383 -3.632 1.00 0.00 O ATOM 803 CB VAL A 432 5.677 1.374 -4.586 1.00 0.00 C ATOM 804 CG1 VAL A 432 6.890 0.687 -3.938 1.00 0.00 C ATOM 805 CG2 VAL A 432 4.814 0.290 -5.254 1.00 0.00 C ATOM 0 H VAL A 432 3.753 2.960 -5.118 1.00 0.00 H new ATOM 0 HA VAL A 432 4.604 1.470 -2.750 1.00 0.00 H new ATOM 0 HB VAL A 432 6.009 2.090 -5.338 1.00 0.00 H new ATOM 0 HG11 VAL A 432 7.441 0.130 -4.696 1.00 0.00 H new ATOM 0 HG12 VAL A 432 7.542 1.441 -3.496 1.00 0.00 H new ATOM 0 HG13 VAL A 432 6.549 0.002 -3.162 1.00 0.00 H new ATOM 0 HG21 VAL A 432 5.413 -0.253 -5.985 1.00 0.00 H new ATOM 0 HG22 VAL A 432 4.450 -0.404 -4.496 1.00 0.00 H new ATOM 0 HG23 VAL A 432 3.966 0.757 -5.755 1.00 0.00 H new ATOM 815 N PHE A 433 6.283 3.183 -1.795 1.00 0.00 N ATOM 816 CA PHE A 433 7.102 4.228 -1.192 1.00 0.00 C ATOM 817 C PHE A 433 8.498 4.238 -1.830 1.00 0.00 C ATOM 818 O PHE A 433 9.276 3.289 -1.697 1.00 0.00 O ATOM 819 CB PHE A 433 7.136 4.065 0.328 1.00 0.00 C ATOM 820 CG PHE A 433 7.642 5.299 1.054 1.00 0.00 C ATOM 821 CD1 PHE A 433 9.024 5.490 1.232 1.00 0.00 C ATOM 822 CD2 PHE A 433 6.738 6.259 1.548 1.00 0.00 C ATOM 823 CE1 PHE A 433 9.502 6.620 1.917 1.00 0.00 C ATOM 824 CE2 PHE A 433 7.217 7.391 2.237 1.00 0.00 C ATOM 825 CZ PHE A 433 8.597 7.563 2.433 1.00 0.00 C ATOM 0 H PHE A 433 6.196 2.340 -1.227 1.00 0.00 H new ATOM 0 HA PHE A 433 6.660 5.204 -1.389 1.00 0.00 H new ATOM 0 HB2 PHE A 433 6.133 3.829 0.683 1.00 0.00 H new ATOM 0 HB3 PHE A 433 7.772 3.217 0.581 1.00 0.00 H new ATOM 0 HD1 PHE A 433 9.721 4.764 0.840 1.00 0.00 H new ATOM 0 HD2 PHE A 433 5.676 6.128 1.399 1.00 0.00 H new ATOM 0 HE1 PHE A 433 10.565 6.764 2.047 1.00 0.00 H new ATOM 0 HE2 PHE A 433 6.522 8.127 2.615 1.00 0.00 H new ATOM 0 HZ PHE A 433 8.962 8.420 2.980 1.00 0.00 H new ATOM 835 N ILE A 434 8.808 5.318 -2.545 1.00 0.00 N ATOM 836 CA ILE A 434 10.059 5.523 -3.286 1.00 0.00 C ATOM 837 C ILE A 434 10.893 6.582 -2.559 1.00 0.00 C ATOM 838 O ILE A 434 10.395 7.674 -2.283 1.00 0.00 O ATOM 839 CB ILE A 434 9.748 5.954 -4.740 1.00 0.00 C ATOM 840 CG1 ILE A 434 8.717 5.078 -5.490 1.00 0.00 C ATOM 841 CG2 ILE A 434 11.043 6.032 -5.559 1.00 0.00 C ATOM 842 CD1 ILE A 434 9.012 3.573 -5.530 1.00 0.00 C ATOM 0 H ILE A 434 8.170 6.109 -2.630 1.00 0.00 H new ATOM 0 HA ILE A 434 10.628 4.594 -3.331 1.00 0.00 H new ATOM 0 HB ILE A 434 9.281 6.934 -4.642 1.00 0.00 H new ATOM 0 HG12 ILE A 434 7.741 5.224 -5.027 1.00 0.00 H new ATOM 0 HG13 ILE A 434 8.641 5.440 -6.515 1.00 0.00 H new ATOM 0 HG21 ILE A 434 10.810 6.336 -6.580 1.00 0.00 H new ATOM 0 HG22 ILE A 434 11.716 6.761 -5.107 1.00 0.00 H new ATOM 0 HG23 ILE A 434 11.524 5.054 -5.573 1.00 0.00 H new ATOM 0 HD11 ILE A 434 8.223 3.062 -6.081 1.00 0.00 H new ATOM 0 HD12 ILE A 434 9.968 3.403 -6.024 1.00 0.00 H new ATOM 0 HD13 ILE A 434 9.055 3.183 -4.513 1.00 0.00 H new ATOM 952 N SER A 441 12.644 1.977 -4.740 1.00 0.00 N ATOM 953 CA SER A 441 11.617 1.499 -3.801 1.00 0.00 C ATOM 954 C SER A 441 12.237 1.059 -2.468 1.00 0.00 C ATOM 955 O SER A 441 13.247 0.352 -2.429 1.00 0.00 O ATOM 956 CB SER A 441 10.804 0.358 -4.423 1.00 0.00 C ATOM 957 OG SER A 441 9.974 -0.279 -3.462 1.00 0.00 O ATOM 0 HA SER A 441 10.944 2.331 -3.595 1.00 0.00 H new ATOM 0 HB2 SER A 441 10.189 0.749 -5.233 1.00 0.00 H new ATOM 0 HB3 SER A 441 11.481 -0.375 -4.862 1.00 0.00 H new ATOM 0 HG SER A 441 9.469 -1.000 -3.893 1.00 0.00 H new ATOM 963 N LYS A 442 11.594 1.437 -1.359 1.00 0.00 N ATOM 964 CA LYS A 442 11.962 1.001 -0.006 1.00 0.00 C ATOM 965 C LYS A 442 11.342 -0.363 0.374 1.00 0.00 C ATOM 966 O LYS A 442 11.391 -0.768 1.539 1.00 0.00 O ATOM 967 CB LYS A 442 11.622 2.122 0.996 1.00 0.00 C ATOM 968 CG LYS A 442 12.271 3.462 0.595 1.00 0.00 C ATOM 969 CD LYS A 442 12.532 4.403 1.780 1.00 0.00 C ATOM 970 CE LYS A 442 13.659 3.829 2.639 1.00 0.00 C ATOM 971 NZ LYS A 442 14.512 4.892 3.231 1.00 0.00 N ATOM 0 H LYS A 442 10.790 2.065 -1.375 1.00 0.00 H new ATOM 0 HA LYS A 442 13.037 0.826 0.026 1.00 0.00 H new ATOM 0 HB2 LYS A 442 10.540 2.244 1.052 1.00 0.00 H new ATOM 0 HB3 LYS A 442 11.963 1.836 1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 442 13.215 3.261 0.088 1.00 0.00 H new ATOM 0 HG3 LYS A 442 11.625 3.967 -0.123 1.00 0.00 H new ATOM 0 HD2 LYS A 442 12.803 5.395 1.419 1.00 0.00 H new ATOM 0 HD3 LYS A 442 11.626 4.517 2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 442 13.232 3.222 3.437 1.00 0.00 H new ATOM 0 HE3 LYS A 442 14.276 3.167 2.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 15.262 4.456 3.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 14.942 5.456 2.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 13.930 5.509 3.833 1.00 0.00 H new ATOM 985 N CYS A 443 10.727 -1.051 -0.599 1.00 0.00 N ATOM 986 CA CYS A 443 10.122 -2.391 -0.514 1.00 0.00 C ATOM 987 C CYS A 443 8.795 -2.436 0.276 1.00 0.00 C ATOM 988 O CYS A 443 8.250 -3.523 0.482 1.00 0.00 O ATOM 989 CB CYS A 443 11.156 -3.430 -0.036 1.00 0.00 C ATOM 990 SG CYS A 443 12.603 -3.427 -1.142 1.00 0.00 S ATOM 0 H CYS A 443 10.632 -0.658 -1.535 1.00 0.00 H new ATOM 0 HA CYS A 443 9.827 -2.665 -1.527 1.00 0.00 H new ATOM 0 HB2 CYS A 443 11.467 -3.202 0.984 1.00 0.00 H new ATOM 0 HB3 CYS A 443 10.705 -4.422 -0.018 1.00 0.00 H new ATOM 0 HG CYS A 443 13.468 -4.305 -0.728 1.00 0.00 H new ATOM 996 N PHE A 444 8.251 -1.279 0.671 1.00 0.00 N ATOM 997 CA PHE A 444 6.906 -1.126 1.233 1.00 0.00 C ATOM 998 C PHE A 444 6.057 -0.170 0.387 1.00 0.00 C ATOM 999 O PHE A 444 6.576 0.720 -0.288 1.00 0.00 O ATOM 1000 CB PHE A 444 6.951 -0.713 2.714 1.00 0.00 C ATOM 1001 CG PHE A 444 7.529 0.652 3.038 1.00 0.00 C ATOM 1002 CD1 PHE A 444 6.695 1.785 3.061 1.00 0.00 C ATOM 1003 CD2 PHE A 444 8.886 0.777 3.393 1.00 0.00 C ATOM 1004 CE1 PHE A 444 7.220 3.038 3.423 1.00 0.00 C ATOM 1005 CE2 PHE A 444 9.409 2.030 3.758 1.00 0.00 C ATOM 1006 CZ PHE A 444 8.579 3.163 3.766 1.00 0.00 C ATOM 0 H PHE A 444 8.753 -0.394 0.605 1.00 0.00 H new ATOM 0 HA PHE A 444 6.419 -2.101 1.199 1.00 0.00 H new ATOM 0 HB2 PHE A 444 5.935 -0.751 3.106 1.00 0.00 H new ATOM 0 HB3 PHE A 444 7.529 -1.462 3.256 1.00 0.00 H new ATOM 0 HD1 PHE A 444 5.651 1.692 2.800 1.00 0.00 H new ATOM 0 HD2 PHE A 444 9.527 -0.092 3.385 1.00 0.00 H new ATOM 0 HE1 PHE A 444 6.579 3.907 3.438 1.00 0.00 H new ATOM 0 HE2 PHE A 444 10.450 2.121 4.032 1.00 0.00 H new ATOM 0 HZ PHE A 444 8.983 4.128 4.035 1.00 0.00 H new ATOM 1016 N GLY A 445 4.742 -0.382 0.412 1.00 0.00 N ATOM 1017 CA GLY A 445 3.735 0.357 -0.344 1.00 0.00 C ATOM 1018 C GLY A 445 2.358 0.317 0.314 1.00 0.00 C ATOM 1019 O GLY A 445 2.180 -0.233 1.403 1.00 0.00 O ATOM 0 H GLY A 445 4.330 -1.113 0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 445 4.053 1.394 -0.448 1.00 0.00 H new ATOM 0 HA3 GLY A 445 3.665 -0.057 -1.350 1.00 0.00 H new ATOM 1023 N PHE A 446 1.376 0.900 -0.369 1.00 0.00 N ATOM 1024 CA PHE A 446 0.047 1.179 0.160 1.00 0.00 C ATOM 1025 C PHE A 446 -1.038 1.071 -0.907 1.00 0.00 C ATOM 1026 O PHE A 446 -0.803 1.365 -2.079 1.00 0.00 O ATOM 1027 CB PHE A 446 0.020 2.597 0.740 1.00 0.00 C ATOM 1028 CG PHE A 446 1.068 2.861 1.793 1.00 0.00 C ATOM 1029 CD1 PHE A 446 0.803 2.541 3.136 1.00 0.00 C ATOM 1030 CD2 PHE A 446 2.312 3.411 1.427 1.00 0.00 C ATOM 1031 CE1 PHE A 446 1.777 2.779 4.117 1.00 0.00 C ATOM 1032 CE2 PHE A 446 3.299 3.612 2.402 1.00 0.00 C ATOM 1033 CZ PHE A 446 3.032 3.289 3.742 1.00 0.00 C ATOM 0 H PHE A 446 1.489 1.200 -1.337 1.00 0.00 H new ATOM 0 HA PHE A 446 -0.159 0.434 0.928 1.00 0.00 H new ATOM 0 HB2 PHE A 446 0.151 3.311 -0.073 1.00 0.00 H new ATOM 0 HB3 PHE A 446 -0.964 2.782 1.170 1.00 0.00 H new ATOM 0 HD1 PHE A 446 -0.149 2.113 3.412 1.00 0.00 H new ATOM 0 HD2 PHE A 446 2.505 3.677 0.398 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.564 2.571 5.155 1.00 0.00 H new ATOM 0 HE2 PHE A 446 4.262 4.014 2.123 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.797 3.434 4.491 1.00 0.00 H new ATOM 1043 N VAL A 447 -2.244 0.712 -0.474 1.00 0.00 N ATOM 1044 CA VAL A 447 -3.451 0.622 -1.312 1.00 0.00 C ATOM 1045 C VAL A 447 -4.650 1.042 -0.466 1.00 0.00 C ATOM 1046 O VAL A 447 -4.752 0.643 0.689 1.00 0.00 O ATOM 1047 CB VAL A 447 -3.663 -0.808 -1.874 1.00 0.00 C ATOM 1048 CG1 VAL A 447 -4.953 -0.916 -2.707 1.00 0.00 C ATOM 1049 CG2 VAL A 447 -2.491 -1.260 -2.763 1.00 0.00 C ATOM 0 H VAL A 447 -2.420 0.467 0.500 1.00 0.00 H new ATOM 0 HA VAL A 447 -3.336 1.283 -2.171 1.00 0.00 H new ATOM 0 HB VAL A 447 -3.733 -1.454 -0.999 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -5.061 -1.934 -3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -5.811 -0.666 -2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -4.902 -0.225 -3.548 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -2.683 -2.267 -3.134 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -2.389 -0.576 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -1.570 -1.258 -2.180 1.00 0.00 H new ATOM 1059 N SER A 448 -5.563 1.827 -1.029 1.00 0.00 N ATOM 1060 CA SER A 448 -6.797 2.239 -0.351 1.00 0.00 C ATOM 1061 C SER A 448 -8.036 2.015 -1.213 1.00 0.00 C ATOM 1062 O SER A 448 -8.050 2.331 -2.400 1.00 0.00 O ATOM 1063 CB SER A 448 -6.718 3.708 0.065 1.00 0.00 C ATOM 1064 OG SER A 448 -6.060 3.817 1.313 1.00 0.00 O ATOM 0 H SER A 448 -5.471 2.200 -1.974 1.00 0.00 H new ATOM 0 HA SER A 448 -6.892 1.613 0.536 1.00 0.00 H new ATOM 0 HB2 SER A 448 -6.181 4.281 -0.691 1.00 0.00 H new ATOM 0 HB3 SER A 448 -7.720 4.131 0.134 1.00 0.00 H new ATOM 0 HG SER A 448 -5.256 4.368 1.212 1.00 0.00 H new ATOM 1070 N TYR A 449 -9.096 1.501 -0.589 1.00 0.00 N ATOM 1071 CA TYR A 449 -10.413 1.243 -1.176 1.00 0.00 C ATOM 1072 C TYR A 449 -11.458 2.264 -0.690 1.00 0.00 C ATOM 1073 O TYR A 449 -11.206 3.051 0.224 1.00 0.00 O ATOM 1074 CB TYR A 449 -10.833 -0.192 -0.813 1.00 0.00 C ATOM 1075 CG TYR A 449 -9.973 -1.262 -1.453 1.00 0.00 C ATOM 1076 CD1 TYR A 449 -8.780 -1.680 -0.833 1.00 0.00 C ATOM 1077 CD2 TYR A 449 -10.355 -1.821 -2.688 1.00 0.00 C ATOM 1078 CE1 TYR A 449 -7.965 -2.644 -1.454 1.00 0.00 C ATOM 1079 CE2 TYR A 449 -9.541 -2.781 -3.316 1.00 0.00 C ATOM 1080 CZ TYR A 449 -8.337 -3.187 -2.701 1.00 0.00 C ATOM 1081 OH TYR A 449 -7.513 -4.073 -3.316 1.00 0.00 O ATOM 0 H TYR A 449 -9.057 1.238 0.396 1.00 0.00 H new ATOM 0 HA TYR A 449 -10.353 1.349 -2.259 1.00 0.00 H new ATOM 0 HB2 TYR A 449 -10.795 -0.309 0.270 1.00 0.00 H new ATOM 0 HB3 TYR A 449 -11.870 -0.344 -1.114 1.00 0.00 H new ATOM 0 HD1 TYR A 449 -8.491 -1.261 0.119 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -11.278 -1.511 -3.155 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -7.053 -2.969 -0.975 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -9.836 -3.205 -4.264 1.00 0.00 H new ATOM 0 HH TYR A 449 -7.680 -4.059 -4.282 1.00 0.00 H new ATOM 1091 N ASP A 450 -12.656 2.236 -1.281 1.00 0.00 N ATOM 1092 CA ASP A 450 -13.796 3.057 -0.846 1.00 0.00 C ATOM 1093 C ASP A 450 -14.560 2.453 0.353 1.00 0.00 C ATOM 1094 O ASP A 450 -15.456 3.097 0.898 1.00 0.00 O ATOM 1095 CB ASP A 450 -14.736 3.317 -2.038 1.00 0.00 C ATOM 1096 CG ASP A 450 -15.684 2.145 -2.346 1.00 0.00 C ATOM 1097 OD1 ASP A 450 -15.212 0.986 -2.402 1.00 0.00 O ATOM 1098 OD2 ASP A 450 -16.899 2.391 -2.537 1.00 0.00 O ATOM 0 H ASP A 450 -12.866 1.639 -2.081 1.00 0.00 H new ATOM 0 HA ASP A 450 -13.395 4.006 -0.489 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -15.329 4.208 -1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -14.136 3.529 -2.923 1.00 0.00 H new ATOM 1103 N ASN A 451 -14.211 1.227 0.768 1.00 0.00 N ATOM 1104 CA ASN A 451 -14.902 0.460 1.805 1.00 0.00 C ATOM 1105 C ASN A 451 -13.960 -0.581 2.461 1.00 0.00 C ATOM 1106 O ASN A 451 -12.963 -0.978 1.846 1.00 0.00 O ATOM 1107 CB ASN A 451 -16.147 -0.201 1.182 1.00 0.00 C ATOM 1108 CG ASN A 451 -15.790 -1.472 0.418 1.00 0.00 C ATOM 1109 OD1 ASN A 451 -15.693 -2.538 1.012 1.00 0.00 O ATOM 1110 ND2 ASN A 451 -15.520 -1.398 -0.868 1.00 0.00 N ATOM 0 H ASN A 451 -13.412 0.728 0.375 1.00 0.00 H new ATOM 0 HA ASN A 451 -15.218 1.129 2.605 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -16.864 -0.438 1.968 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -16.634 0.504 0.508 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -15.228 -2.232 -1.377 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -15.603 -0.506 -1.356 1.00 0.00 H new ATOM 1117 N PRO A 452 -14.274 -1.063 3.681 1.00 0.00 N ATOM 1118 CA PRO A 452 -13.390 -1.951 4.427 1.00 0.00 C ATOM 1119 C PRO A 452 -13.476 -3.423 3.997 1.00 0.00 C ATOM 1120 O PRO A 452 -12.536 -4.169 4.258 1.00 0.00 O ATOM 1121 CB PRO A 452 -13.778 -1.754 5.893 1.00 0.00 C ATOM 1122 CG PRO A 452 -15.267 -1.430 5.825 1.00 0.00 C ATOM 1123 CD PRO A 452 -15.421 -0.684 4.498 1.00 0.00 C ATOM 0 HA PRO A 452 -12.347 -1.700 4.237 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -13.589 -2.651 6.483 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -13.211 -0.945 6.353 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -15.874 -2.335 5.847 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -15.581 -0.815 6.668 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -16.355 -0.954 4.006 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -15.445 0.394 4.658 1.00 0.00 H new ATOM 1131 N VAL A 453 -14.545 -3.855 3.312 1.00 0.00 N ATOM 1132 CA VAL A 453 -14.720 -5.257 2.885 1.00 0.00 C ATOM 1133 C VAL A 453 -13.784 -5.581 1.714 1.00 0.00 C ATOM 1134 O VAL A 453 -13.185 -6.653 1.699 1.00 0.00 O ATOM 1135 CB VAL A 453 -16.190 -5.581 2.517 1.00 0.00 C ATOM 1136 CG1 VAL A 453 -16.378 -7.068 2.168 1.00 0.00 C ATOM 1137 CG2 VAL A 453 -17.145 -5.228 3.673 1.00 0.00 C ATOM 0 H VAL A 453 -15.314 -3.245 3.037 1.00 0.00 H new ATOM 0 HA VAL A 453 -14.458 -5.889 3.734 1.00 0.00 H new ATOM 0 HB VAL A 453 -16.427 -4.975 1.643 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -17.422 -7.253 1.916 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -15.748 -7.324 1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -16.097 -7.681 3.024 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -18.169 -5.466 3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -16.874 -5.804 4.558 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -17.069 -4.164 3.895 1.00 0.00 H new ATOM 1147 N SER A 454 -13.580 -4.649 0.773 1.00 0.00 N ATOM 1148 CA SER A 454 -12.622 -4.836 -0.331 1.00 0.00 C ATOM 1149 C SER A 454 -11.165 -4.850 0.163 1.00 0.00 C ATOM 1150 O SER A 454 -10.360 -5.661 -0.296 1.00 0.00 O ATOM 1151 CB SER A 454 -12.811 -3.736 -1.384 1.00 0.00 C ATOM 1152 OG SER A 454 -14.130 -3.743 -1.919 1.00 0.00 O ATOM 0 H SER A 454 -14.067 -3.753 0.753 1.00 0.00 H new ATOM 0 HA SER A 454 -12.825 -5.809 -0.779 1.00 0.00 H new ATOM 0 HB2 SER A 454 -12.605 -2.764 -0.936 1.00 0.00 H new ATOM 0 HB3 SER A 454 -12.090 -3.875 -2.190 1.00 0.00 H new ATOM 0 HG SER A 454 -14.173 -3.142 -2.692 1.00 0.00 H new ATOM 1158 N ALA A 455 -10.836 -4.022 1.163 1.00 0.00 N ATOM 1159 CA ALA A 455 -9.529 -4.025 1.818 1.00 0.00 C ATOM 1160 C ALA A 455 -9.269 -5.338 2.582 1.00 0.00 C ATOM 1161 O ALA A 455 -8.229 -5.967 2.396 1.00 0.00 O ATOM 1162 CB ALA A 455 -9.460 -2.791 2.722 1.00 0.00 C ATOM 0 H ALA A 455 -11.479 -3.326 1.541 1.00 0.00 H new ATOM 0 HA ALA A 455 -8.735 -3.974 1.073 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -8.494 -2.763 3.227 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -9.580 -1.891 2.119 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -10.256 -2.839 3.465 1.00 0.00 H new ATOM 1168 N GLN A 456 -10.232 -5.803 3.385 1.00 0.00 N ATOM 1169 CA GLN A 456 -10.169 -7.097 4.073 1.00 0.00 C ATOM 1170 C GLN A 456 -10.033 -8.281 3.103 1.00 0.00 C ATOM 1171 O GLN A 456 -9.232 -9.187 3.340 1.00 0.00 O ATOM 1172 CB GLN A 456 -11.429 -7.267 4.936 1.00 0.00 C ATOM 1173 CG GLN A 456 -11.358 -6.509 6.276 1.00 0.00 C ATOM 1174 CD GLN A 456 -10.303 -7.037 7.256 1.00 0.00 C ATOM 1175 OE1 GLN A 456 -9.716 -8.101 7.096 1.00 0.00 O ATOM 1176 NE2 GLN A 456 -10.007 -6.304 8.309 1.00 0.00 N ATOM 0 H GLN A 456 -11.089 -5.284 3.578 1.00 0.00 H new ATOM 0 HA GLN A 456 -9.274 -7.098 4.695 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -12.295 -6.917 4.374 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -11.585 -8.327 5.134 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -11.152 -5.458 6.073 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -12.335 -6.555 6.756 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.483 -5.415 8.462 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.301 -6.625 8.972 1.00 0.00 H new ATOM 1185 N ALA A 457 -10.782 -8.280 1.998 1.00 0.00 N ATOM 1186 CA ALA A 457 -10.657 -9.279 0.932 1.00 0.00 C ATOM 1187 C ALA A 457 -9.258 -9.278 0.288 1.00 0.00 C ATOM 1188 O ALA A 457 -8.722 -10.347 -0.011 1.00 0.00 O ATOM 1189 CB ALA A 457 -11.755 -9.034 -0.111 1.00 0.00 C ATOM 0 H ALA A 457 -11.500 -7.579 1.815 1.00 0.00 H new ATOM 0 HA ALA A 457 -10.783 -10.270 1.369 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -11.671 -9.772 -0.908 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -12.733 -9.122 0.363 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -11.643 -8.034 -0.529 1.00 0.00 H new ATOM 1195 N ALA A 458 -8.631 -8.107 0.137 1.00 0.00 N ATOM 1196 CA ALA A 458 -7.270 -7.994 -0.379 1.00 0.00 C ATOM 1197 C ALA A 458 -6.219 -8.494 0.627 1.00 0.00 C ATOM 1198 O ALA A 458 -5.278 -9.165 0.213 1.00 0.00 O ATOM 1199 CB ALA A 458 -7.027 -6.547 -0.804 1.00 0.00 C ATOM 0 H ALA A 458 -9.057 -7.210 0.371 1.00 0.00 H new ATOM 0 HA ALA A 458 -7.163 -8.643 -1.248 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -6.013 -6.447 -1.192 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -7.741 -6.271 -1.580 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -7.153 -5.889 0.056 1.00 0.00 H new ATOM 1205 N ILE A 459 -6.394 -8.277 1.940 1.00 0.00 N ATOM 1206 CA ILE A 459 -5.528 -8.875 2.983 1.00 0.00 C ATOM 1207 C ILE A 459 -5.586 -10.401 2.891 1.00 0.00 C ATOM 1208 O ILE A 459 -4.550 -11.063 2.844 1.00 0.00 O ATOM 1209 CB ILE A 459 -5.930 -8.391 4.402 1.00 0.00 C ATOM 1210 CG1 ILE A 459 -5.693 -6.874 4.541 1.00 0.00 C ATOM 1211 CG2 ILE A 459 -5.145 -9.153 5.492 1.00 0.00 C ATOM 1212 CD1 ILE A 459 -6.256 -6.267 5.834 1.00 0.00 C ATOM 0 H ILE A 459 -7.136 -7.685 2.314 1.00 0.00 H new ATOM 0 HA ILE A 459 -4.503 -8.547 2.808 1.00 0.00 H new ATOM 0 HB ILE A 459 -6.992 -8.597 4.538 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -4.621 -6.679 4.497 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.144 -6.367 3.688 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -5.447 -8.794 6.476 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -5.357 -10.219 5.415 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -4.077 -8.984 5.356 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.048 -5.197 5.855 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.333 -6.428 5.872 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -5.787 -6.745 6.694 1.00 0.00 H new ATOM 1224 N GLN A 460 -6.799 -10.947 2.816 1.00 0.00 N ATOM 1225 CA GLN A 460 -7.057 -12.385 2.737 1.00 0.00 C ATOM 1226 C GLN A 460 -6.545 -13.021 1.431 1.00 0.00 C ATOM 1227 O GLN A 460 -6.282 -14.222 1.402 1.00 0.00 O ATOM 1228 CB GLN A 460 -8.569 -12.599 2.899 1.00 0.00 C ATOM 1229 CG GLN A 460 -9.021 -12.413 4.358 1.00 0.00 C ATOM 1230 CD GLN A 460 -10.544 -12.378 4.472 1.00 0.00 C ATOM 1231 OE1 GLN A 460 -11.203 -13.362 4.788 1.00 0.00 O ATOM 1232 NE2 GLN A 460 -11.157 -11.243 4.206 1.00 0.00 N ATOM 0 H GLN A 460 -7.652 -10.387 2.808 1.00 0.00 H new ATOM 0 HA GLN A 460 -6.506 -12.884 3.534 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.106 -11.897 2.260 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -8.832 -13.602 2.562 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.628 -13.226 4.968 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -8.604 -11.487 4.754 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.615 -10.420 3.942 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.174 -11.187 4.264 1.00 0.00 H new ATOM 1241 N SER A 461 -6.359 -12.237 0.366 1.00 0.00 N ATOM 1242 CA SER A 461 -5.862 -12.711 -0.929 1.00 0.00 C ATOM 1243 C SER A 461 -4.353 -12.485 -1.147 1.00 0.00 C ATOM 1244 O SER A 461 -3.741 -13.226 -1.922 1.00 0.00 O ATOM 1245 CB SER A 461 -6.640 -12.006 -2.044 1.00 0.00 C ATOM 1246 OG SER A 461 -8.033 -12.279 -1.978 1.00 0.00 O ATOM 0 H SER A 461 -6.553 -11.236 0.380 1.00 0.00 H new ATOM 0 HA SER A 461 -6.015 -13.790 -0.945 1.00 0.00 H new ATOM 0 HB2 SER A 461 -6.478 -10.930 -1.974 1.00 0.00 H new ATOM 0 HB3 SER A 461 -6.254 -12.325 -3.012 1.00 0.00 H new ATOM 0 HG SER A 461 -8.450 -11.695 -1.310 1.00 0.00 H new ATOM 1252 N MET A 462 -3.742 -11.499 -0.471 1.00 0.00 N ATOM 1253 CA MET A 462 -2.370 -11.034 -0.750 1.00 0.00 C ATOM 1254 C MET A 462 -1.379 -11.190 0.407 1.00 0.00 C ATOM 1255 O MET A 462 -0.171 -11.165 0.165 1.00 0.00 O ATOM 1256 CB MET A 462 -2.393 -9.570 -1.220 1.00 0.00 C ATOM 1257 CG MET A 462 -3.185 -9.374 -2.520 1.00 0.00 C ATOM 1258 SD MET A 462 -2.578 -10.303 -3.956 1.00 0.00 S ATOM 1259 CE MET A 462 -0.944 -9.551 -4.117 1.00 0.00 C ATOM 0 H MET A 462 -4.190 -10.995 0.294 1.00 0.00 H new ATOM 0 HA MET A 462 -2.003 -11.693 -1.537 1.00 0.00 H new ATOM 0 HB2 MET A 462 -2.829 -8.949 -0.437 1.00 0.00 H new ATOM 0 HB3 MET A 462 -1.370 -9.225 -1.368 1.00 0.00 H new ATOM 0 HG2 MET A 462 -4.222 -9.657 -2.339 1.00 0.00 H new ATOM 0 HG3 MET A 462 -3.183 -8.313 -2.769 1.00 0.00 H new ATOM 0 HE1 MET A 462 -0.548 -9.751 -5.112 1.00 0.00 H new ATOM 0 HE2 MET A 462 -1.023 -8.474 -3.968 1.00 0.00 H new ATOM 0 HE3 MET A 462 -0.274 -9.973 -3.368 1.00 0.00 H new ATOM 1269 N ASN A 463 -1.828 -11.396 1.649 1.00 0.00 N ATOM 1270 CA ASN A 463 -0.913 -11.696 2.752 1.00 0.00 C ATOM 1271 C ASN A 463 -0.327 -13.114 2.581 1.00 0.00 C ATOM 1272 O ASN A 463 -1.054 -14.110 2.633 1.00 0.00 O ATOM 1273 CB ASN A 463 -1.623 -11.503 4.100 1.00 0.00 C ATOM 1274 CG ASN A 463 -0.629 -11.515 5.255 1.00 0.00 C ATOM 1275 OD1 ASN A 463 0.357 -10.785 5.245 1.00 0.00 O ATOM 1276 ND2 ASN A 463 -0.840 -12.337 6.265 1.00 0.00 N ATOM 0 H ASN A 463 -2.812 -11.361 1.914 1.00 0.00 H new ATOM 0 HA ASN A 463 -0.075 -11.000 2.736 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -2.167 -10.558 4.095 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -2.359 -12.294 4.242 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -0.182 -12.368 7.043 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -1.662 -12.941 6.268 1.00 0.00 H new ATOM 1283 N GLY A 464 0.984 -13.198 2.334 1.00 0.00 N ATOM 1284 CA GLY A 464 1.710 -14.421 1.964 1.00 0.00 C ATOM 1285 C GLY A 464 1.874 -14.630 0.453 1.00 0.00 C ATOM 1286 O GLY A 464 2.371 -15.687 0.059 1.00 0.00 O ATOM 0 H GLY A 464 1.595 -12.383 2.388 1.00 0.00 H new ATOM 0 HA2 GLY A 464 2.698 -14.395 2.424 1.00 0.00 H new ATOM 0 HA3 GLY A 464 1.186 -15.280 2.382 1.00 0.00 H new ATOM 1290 N PHE A 465 1.492 -13.663 -0.397 1.00 0.00 N ATOM 1291 CA PHE A 465 1.644 -13.747 -1.858 1.00 0.00 C ATOM 1292 C PHE A 465 3.120 -13.913 -2.242 1.00 0.00 C ATOM 1293 O PHE A 465 3.947 -13.069 -1.895 1.00 0.00 O ATOM 1294 CB PHE A 465 1.047 -12.488 -2.506 1.00 0.00 C ATOM 1295 CG PHE A 465 1.102 -12.459 -4.023 1.00 0.00 C ATOM 1296 CD1 PHE A 465 2.217 -11.913 -4.696 1.00 0.00 C ATOM 1297 CD2 PHE A 465 0.019 -12.962 -4.769 1.00 0.00 C ATOM 1298 CE1 PHE A 465 2.244 -11.877 -6.101 1.00 0.00 C ATOM 1299 CE2 PHE A 465 0.047 -12.920 -6.175 1.00 0.00 C ATOM 1300 CZ PHE A 465 1.159 -12.377 -6.841 1.00 0.00 C ATOM 0 H PHE A 465 1.064 -12.791 -0.085 1.00 0.00 H new ATOM 0 HA PHE A 465 1.108 -14.623 -2.224 1.00 0.00 H new ATOM 0 HB2 PHE A 465 0.007 -12.395 -2.193 1.00 0.00 H new ATOM 0 HB3 PHE A 465 1.574 -11.615 -2.122 1.00 0.00 H new ATOM 0 HD1 PHE A 465 3.050 -11.523 -4.130 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -0.836 -13.382 -4.260 1.00 0.00 H new ATOM 0 HE1 PHE A 465 3.101 -11.464 -6.613 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -0.787 -13.305 -6.743 1.00 0.00 H new ATOM 0 HZ PHE A 465 1.180 -12.344 -7.920 1.00 0.00 H new ATOM 1310 N GLN A 466 3.456 -15.000 -2.939 1.00 0.00 N ATOM 1311 CA GLN A 466 4.835 -15.336 -3.292 1.00 0.00 C ATOM 1312 C GLN A 466 5.268 -14.539 -4.530 1.00 0.00 C ATOM 1313 O GLN A 466 4.607 -14.571 -5.569 1.00 0.00 O ATOM 1314 CB GLN A 466 4.952 -16.864 -3.474 1.00 0.00 C ATOM 1315 CG GLN A 466 6.382 -17.413 -3.322 1.00 0.00 C ATOM 1316 CD GLN A 466 7.310 -17.123 -4.506 1.00 0.00 C ATOM 1317 OE1 GLN A 466 7.139 -17.633 -5.608 1.00 0.00 O ATOM 1318 NE2 GLN A 466 8.341 -16.325 -4.323 1.00 0.00 N ATOM 0 H GLN A 466 2.772 -15.677 -3.277 1.00 0.00 H new ATOM 0 HA GLN A 466 5.520 -15.054 -2.492 1.00 0.00 H new ATOM 0 HB2 GLN A 466 4.308 -17.355 -2.745 1.00 0.00 H new ATOM 0 HB3 GLN A 466 4.576 -17.130 -4.462 1.00 0.00 H new ATOM 0 HG2 GLN A 466 6.824 -16.991 -2.420 1.00 0.00 H new ATOM 0 HG3 GLN A 466 6.328 -18.492 -3.176 1.00 0.00 H new ATOM 0 HE21 GLN A 466 8.496 -15.893 -3.412 1.00 0.00 H new ATOM 0 HE22 GLN A 466 8.984 -16.138 -5.092 1.00 0.00 H new ATOM 1327 N ILE A 467 6.389 -13.820 -4.419 1.00 0.00 N ATOM 1328 CA ILE A 467 6.936 -12.947 -5.465 1.00 0.00 C ATOM 1329 C ILE A 467 8.470 -12.970 -5.415 1.00 0.00 C ATOM 1330 O ILE A 467 9.061 -12.930 -4.334 1.00 0.00 O ATOM 1331 CB ILE A 467 6.321 -11.531 -5.326 1.00 0.00 C ATOM 1332 CG1 ILE A 467 6.517 -10.733 -6.630 1.00 0.00 C ATOM 1333 CG2 ILE A 467 6.837 -10.774 -4.087 1.00 0.00 C ATOM 1334 CD1 ILE A 467 5.803 -9.376 -6.649 1.00 0.00 C ATOM 0 H ILE A 467 6.959 -13.829 -3.573 1.00 0.00 H new ATOM 0 HA ILE A 467 6.663 -13.308 -6.457 1.00 0.00 H new ATOM 0 HB ILE A 467 5.250 -11.650 -5.162 1.00 0.00 H new ATOM 0 HG12 ILE A 467 7.583 -10.572 -6.788 1.00 0.00 H new ATOM 0 HG13 ILE A 467 6.158 -11.332 -7.467 1.00 0.00 H new ATOM 0 HG21 ILE A 467 6.372 -9.789 -4.042 1.00 0.00 H new ATOM 0 HG22 ILE A 467 6.586 -11.335 -3.187 1.00 0.00 H new ATOM 0 HG23 ILE A 467 7.919 -10.661 -4.154 1.00 0.00 H new ATOM 0 HD11 ILE A 467 5.992 -8.879 -7.601 1.00 0.00 H new ATOM 0 HD12 ILE A 467 4.731 -9.527 -6.525 1.00 0.00 H new ATOM 0 HD13 ILE A 467 6.179 -8.756 -5.835 1.00 0.00 H new ATOM 1346 N GLY A 468 9.129 -13.114 -6.570 1.00 0.00 N ATOM 1347 CA GLY A 468 10.583 -13.314 -6.639 1.00 0.00 C ATOM 1348 C GLY A 468 10.992 -14.592 -5.899 1.00 0.00 C ATOM 1349 O GLY A 468 10.512 -15.679 -6.223 1.00 0.00 O ATOM 0 H GLY A 468 8.672 -13.095 -7.482 1.00 0.00 H new ATOM 0 HA2 GLY A 468 10.897 -13.375 -7.681 1.00 0.00 H new ATOM 0 HA3 GLY A 468 11.094 -12.456 -6.202 1.00 0.00 H new ATOM 1353 N MET A 469 11.838 -14.447 -4.875 1.00 0.00 N ATOM 1354 CA MET A 469 12.286 -15.524 -3.970 1.00 0.00 C ATOM 1355 C MET A 469 11.724 -15.358 -2.536 1.00 0.00 C ATOM 1356 O MET A 469 12.264 -15.906 -1.575 1.00 0.00 O ATOM 1357 CB MET A 469 13.826 -15.582 -4.028 1.00 0.00 C ATOM 1358 CG MET A 469 14.392 -16.952 -3.627 1.00 0.00 C ATOM 1359 SD MET A 469 16.188 -17.124 -3.817 1.00 0.00 S ATOM 1360 CE MET A 469 16.756 -16.022 -2.495 1.00 0.00 C ATOM 0 H MET A 469 12.249 -13.544 -4.640 1.00 0.00 H new ATOM 0 HA MET A 469 11.887 -16.483 -4.300 1.00 0.00 H new ATOM 0 HB2 MET A 469 14.155 -15.341 -5.039 1.00 0.00 H new ATOM 0 HB3 MET A 469 14.238 -14.818 -3.368 1.00 0.00 H new ATOM 0 HG2 MET A 469 14.132 -17.146 -2.586 1.00 0.00 H new ATOM 0 HG3 MET A 469 13.903 -17.720 -4.226 1.00 0.00 H new ATOM 0 HE1 MET A 469 17.840 -16.093 -2.403 1.00 0.00 H new ATOM 0 HE2 MET A 469 16.478 -14.995 -2.733 1.00 0.00 H new ATOM 0 HE3 MET A 469 16.292 -16.314 -1.553 1.00 0.00 H new ATOM 1370 N LYS A 470 10.645 -14.580 -2.374 1.00 0.00 N ATOM 1371 CA LYS A 470 10.095 -14.132 -1.081 1.00 0.00 C ATOM 1372 C LYS A 470 8.548 -14.082 -1.064 1.00 0.00 C ATOM 1373 O LYS A 470 7.899 -14.526 -2.017 1.00 0.00 O ATOM 1374 CB LYS A 470 10.786 -12.809 -0.693 1.00 0.00 C ATOM 1375 CG LYS A 470 10.616 -11.670 -1.712 1.00 0.00 C ATOM 1376 CD LYS A 470 11.390 -10.447 -1.217 1.00 0.00 C ATOM 1377 CE LYS A 470 11.272 -9.288 -2.216 1.00 0.00 C ATOM 1378 NZ LYS A 470 11.920 -8.051 -1.705 1.00 0.00 N ATOM 0 H LYS A 470 10.109 -14.231 -3.168 1.00 0.00 H new ATOM 0 HA LYS A 470 10.319 -14.869 -0.309 1.00 0.00 H new ATOM 0 HB2 LYS A 470 10.393 -12.479 0.269 1.00 0.00 H new ATOM 0 HB3 LYS A 470 11.851 -12.998 -0.555 1.00 0.00 H new ATOM 0 HG2 LYS A 470 10.985 -11.980 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 470 9.561 -11.426 -1.832 1.00 0.00 H new ATOM 0 HD2 LYS A 470 11.006 -10.136 -0.245 1.00 0.00 H new ATOM 0 HD3 LYS A 470 12.439 -10.707 -1.077 1.00 0.00 H new ATOM 0 HE2 LYS A 470 11.732 -9.575 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 470 10.220 -9.090 -2.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 11.361 -7.222 -1.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 11.973 -8.090 -0.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 12.880 -7.974 -2.098 1.00 0.00 H new ATOM 1392 N ARG A 471 7.949 -13.577 0.025 1.00 0.00 N ATOM 1393 CA ARG A 471 6.492 -13.435 0.215 1.00 0.00 C ATOM 1394 C ARG A 471 6.122 -12.056 0.779 1.00 0.00 C ATOM 1395 O ARG A 471 6.826 -11.530 1.642 1.00 0.00 O ATOM 1396 CB ARG A 471 5.951 -14.521 1.161 1.00 0.00 C ATOM 1397 CG ARG A 471 5.985 -15.930 0.549 1.00 0.00 C ATOM 1398 CD ARG A 471 5.284 -16.958 1.447 1.00 0.00 C ATOM 1399 NE ARG A 471 6.046 -17.233 2.679 1.00 0.00 N ATOM 1400 CZ ARG A 471 5.630 -17.955 3.715 1.00 0.00 C ATOM 1401 NH1 ARG A 471 4.441 -18.521 3.740 1.00 0.00 N ATOM 1402 NH2 ARG A 471 6.418 -18.117 4.756 1.00 0.00 N ATOM 0 H ARG A 471 8.482 -13.243 0.828 1.00 0.00 H new ATOM 0 HA ARG A 471 6.037 -13.546 -0.769 1.00 0.00 H new ATOM 0 HB2 ARG A 471 6.537 -14.517 2.080 1.00 0.00 H new ATOM 0 HB3 ARG A 471 4.925 -14.276 1.436 1.00 0.00 H new ATOM 0 HG2 ARG A 471 5.504 -15.913 -0.429 1.00 0.00 H new ATOM 0 HG3 ARG A 471 7.020 -16.232 0.390 1.00 0.00 H new ATOM 0 HD2 ARG A 471 4.292 -16.591 1.710 1.00 0.00 H new ATOM 0 HD3 ARG A 471 5.145 -17.886 0.893 1.00 0.00 H new ATOM 0 HE ARG A 471 6.981 -16.831 2.742 1.00 0.00 H new ATOM 0 HH11 ARG A 471 3.807 -18.412 2.948 1.00 0.00 H new ATOM 0 HH12 ARG A 471 4.154 -19.068 4.551 1.00 0.00 H new ATOM 0 HH21 ARG A 471 7.344 -17.689 4.766 1.00 0.00 H new ATOM 0 HH22 ARG A 471 6.103 -18.670 5.553 1.00 0.00 H new ATOM 1416 N LEU A 472 5.003 -11.493 0.314 1.00 0.00 N ATOM 1417 CA LEU A 472 4.474 -10.198 0.760 1.00 0.00 C ATOM 1418 C LEU A 472 3.769 -10.281 2.118 1.00 0.00 C ATOM 1419 O LEU A 472 2.999 -11.205 2.372 1.00 0.00 O ATOM 1420 CB LEU A 472 3.486 -9.635 -0.285 1.00 0.00 C ATOM 1421 CG LEU A 472 4.071 -9.352 -1.682 1.00 0.00 C ATOM 1422 CD1 LEU A 472 2.989 -8.739 -2.582 1.00 0.00 C ATOM 1423 CD2 LEU A 472 5.272 -8.401 -1.608 1.00 0.00 C ATOM 0 H LEU A 472 4.425 -11.935 -0.401 1.00 0.00 H new ATOM 0 HA LEU A 472 5.332 -9.535 0.869 1.00 0.00 H new ATOM 0 HB2 LEU A 472 2.662 -10.340 -0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 472 3.064 -8.709 0.105 1.00 0.00 H new ATOM 0 HG LEU A 472 4.413 -10.299 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 472 3.406 -8.540 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 472 2.155 -9.435 -2.674 1.00 0.00 H new ATOM 0 HD13 LEU A 472 2.636 -7.806 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 472 5.659 -8.224 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 472 4.960 -7.454 -1.167 1.00 0.00 H new ATOM 0 HD23 LEU A 472 6.053 -8.848 -0.992 1.00 0.00 H new ATOM 1435 N LYS A 473 3.983 -9.274 2.966 1.00 0.00 N ATOM 1436 CA LYS A 473 3.197 -9.041 4.185 1.00 0.00 C ATOM 1437 C LYS A 473 2.126 -7.984 3.856 1.00 0.00 C ATOM 1438 O LYS A 473 2.463 -6.951 3.275 1.00 0.00 O ATOM 1439 CB LYS A 473 4.125 -8.576 5.327 1.00 0.00 C ATOM 1440 CG LYS A 473 3.407 -8.645 6.689 1.00 0.00 C ATOM 1441 CD LYS A 473 4.124 -7.898 7.828 1.00 0.00 C ATOM 1442 CE LYS A 473 3.850 -6.386 7.773 1.00 0.00 C ATOM 1443 NZ LYS A 473 4.251 -5.696 9.029 1.00 0.00 N ATOM 0 H LYS A 473 4.720 -8.583 2.825 1.00 0.00 H new ATOM 0 HA LYS A 473 2.710 -9.957 4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 473 5.018 -9.201 5.351 1.00 0.00 H new ATOM 0 HB3 LYS A 473 4.455 -7.555 5.138 1.00 0.00 H new ATOM 0 HG2 LYS A 473 2.404 -8.234 6.578 1.00 0.00 H new ATOM 0 HG3 LYS A 473 3.293 -9.691 6.973 1.00 0.00 H new ATOM 0 HD2 LYS A 473 3.793 -8.294 8.788 1.00 0.00 H new ATOM 0 HD3 LYS A 473 5.197 -8.077 7.762 1.00 0.00 H new ATOM 0 HE2 LYS A 473 4.391 -5.951 6.933 1.00 0.00 H new ATOM 0 HE3 LYS A 473 2.789 -6.217 7.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 3.402 -5.353 9.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 4.763 -6.362 9.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 4.868 -4.891 8.801 1.00 0.00 H new ATOM 1457 N VAL A 474 0.857 -8.215 4.203 1.00 0.00 N ATOM 1458 CA VAL A 474 -0.259 -7.294 3.901 1.00 0.00 C ATOM 1459 C VAL A 474 -1.222 -7.219 5.086 1.00 0.00 C ATOM 1460 O VAL A 474 -1.550 -8.240 5.689 1.00 0.00 O ATOM 1461 CB VAL A 474 -1.016 -7.653 2.597 1.00 0.00 C ATOM 1462 CG1 VAL A 474 -2.011 -6.536 2.225 1.00 0.00 C ATOM 1463 CG2 VAL A 474 -0.063 -7.862 1.408 1.00 0.00 C ATOM 0 H VAL A 474 0.565 -9.053 4.707 1.00 0.00 H new ATOM 0 HA VAL A 474 0.184 -6.312 3.733 1.00 0.00 H new ATOM 0 HB VAL A 474 -1.543 -8.587 2.794 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -2.533 -6.805 1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -2.734 -6.410 3.031 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -1.470 -5.602 2.074 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -0.641 -8.111 0.518 1.00 0.00 H new ATOM 0 HG22 VAL A 474 0.502 -6.947 1.229 1.00 0.00 H new ATOM 0 HG23 VAL A 474 0.626 -8.676 1.633 1.00 0.00 H new ATOM 1473 N GLN A 475 -1.654 -6.003 5.425 1.00 0.00 N ATOM 1474 CA GLN A 475 -2.440 -5.681 6.619 1.00 0.00 C ATOM 1475 C GLN A 475 -3.085 -4.292 6.493 1.00 0.00 C ATOM 1476 O GLN A 475 -2.758 -3.537 5.576 1.00 0.00 O ATOM 1477 CB GLN A 475 -1.523 -5.729 7.862 1.00 0.00 C ATOM 1478 CG GLN A 475 -0.326 -4.761 7.763 1.00 0.00 C ATOM 1479 CD GLN A 475 0.340 -4.523 9.115 1.00 0.00 C ATOM 1480 OE1 GLN A 475 1.285 -5.200 9.499 1.00 0.00 O ATOM 1481 NE2 GLN A 475 -0.122 -3.552 9.877 1.00 0.00 N ATOM 0 H GLN A 475 -1.458 -5.182 4.852 1.00 0.00 H new ATOM 0 HA GLN A 475 -3.239 -6.416 6.723 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -2.108 -5.485 8.749 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -1.152 -6.745 7.994 1.00 0.00 H new ATOM 0 HG2 GLN A 475 0.408 -5.164 7.065 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -0.665 -3.809 7.355 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -0.909 -2.986 9.560 1.00 0.00 H new ATOM 0 HE22 GLN A 475 0.308 -3.367 10.783 1.00 0.00 H new ATOM 1490 N LEU A 476 -3.950 -3.921 7.444 1.00 0.00 N ATOM 1491 CA LEU A 476 -4.427 -2.540 7.588 1.00 0.00 C ATOM 1492 C LEU A 476 -3.237 -1.640 7.967 1.00 0.00 C ATOM 1493 O LEU A 476 -2.395 -2.037 8.782 1.00 0.00 O ATOM 1494 CB LEU A 476 -5.532 -2.464 8.663 1.00 0.00 C ATOM 1495 CG LEU A 476 -6.809 -3.289 8.395 1.00 0.00 C ATOM 1496 CD1 LEU A 476 -7.752 -3.166 9.602 1.00 0.00 C ATOM 1497 CD2 LEU A 476 -7.553 -2.837 7.132 1.00 0.00 C ATOM 0 H LEU A 476 -4.338 -4.566 8.133 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.853 -2.198 6.645 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -5.108 -2.790 9.613 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.819 -1.420 8.784 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.500 -4.323 8.241 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -8.656 -3.747 9.418 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -7.253 -3.544 10.494 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -8.017 -2.119 9.751 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -8.442 -3.452 6.994 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -7.847 -1.793 7.237 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.899 -2.945 6.266 1.00 0.00 H new ATOM 1509 N LYS A 477 -3.135 -0.436 7.390 1.00 0.00 N ATOM 1510 CA LYS A 477 -2.007 0.464 7.684 1.00 0.00 C ATOM 1511 C LYS A 477 -2.137 1.200 9.037 1.00 0.00 C ATOM 1512 O LYS A 477 -3.217 1.255 9.635 1.00 0.00 O ATOM 1513 CB LYS A 477 -1.694 1.393 6.492 1.00 0.00 C ATOM 1514 CG LYS A 477 -2.413 2.752 6.430 1.00 0.00 C ATOM 1515 CD LYS A 477 -1.425 3.830 5.959 1.00 0.00 C ATOM 1516 CE LYS A 477 -2.016 5.231 6.078 1.00 0.00 C ATOM 1517 NZ LYS A 477 -1.032 6.237 5.626 1.00 0.00 N ATOM 0 H LYS A 477 -3.811 -0.063 6.723 1.00 0.00 H new ATOM 0 HA LYS A 477 -1.129 -0.169 7.815 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -0.621 1.582 6.488 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -1.925 0.850 5.575 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -3.261 2.697 5.747 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.810 3.011 7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.512 3.769 6.551 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -1.146 3.640 4.922 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -2.923 5.304 5.479 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -2.300 5.428 7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -1.374 7.189 5.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -0.120 6.067 6.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.909 6.164 4.596 1.00 0.00 H new