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= 1.06 K(o=1.5,f=-6!) USER MOD Set 1.2: A 454 SER OG : rot -170:sc= 0.417 USER MOD Set 2.1: A 402 ASN : amide:sc= 1.98 K(o=3.1,f=-7!) USER MOD Set 2.2: A 448 SER OG : rot 76:sc= 1.15 USER MOD Set 3.1: A 393 SER OG : rot 119:sc= 0.227 USER MOD Set 3.2: A 395 LYS NZ :NH3+ -159:sc= 0.152 (180deg=-0.436) USER MOD Single : A 394 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS : no HD1:sc= -0.0668 X(o=-0.067,f=0) USER MOD Single : A 410 GLN : amide:sc= 1.56 K(o=1.6,f=-0.016) USER MOD Single : A 415 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 419 GLN : amide:sc= -0.0698 X(o=-0.07,f=-0.54) USER MOD Single : A 420 MET CE :methyl 144:sc=-0.00817 (180deg=-0.0725) USER MOD Single : A 422 MET CE :methyl -122:sc= 0 (180deg=-0.153) USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 429 SER OG : rot -163:sc= 1.11 USER MOD Single : A 431 LYS NZ :NH3+ 156:sc= 0.495 (180deg=0.24) USER MOD Single : A 441 SER OG : rot -122:sc= 0.191 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot -91:sc= 0.101 USER MOD Single : A 449 TYR OH : rot 19:sc= 0.399 USER MOD Single : A 456 GLN : amide:sc= -0.0188 K(o=-0.019,f=-0.74) USER MOD Single : A 460 GLN : amide:sc= 0.0165 X(o=0.017,f=0) USER MOD Single : A 461 SER OG : rot 82:sc= 0.804 USER MOD Single : A 462 MET CE :methyl -162:sc= -0.098 (180deg=-1.58) USER MOD Single : A 463 ASN : amide:sc= 0.885 K(o=0.89,f=-5.3!) USER MOD Single : A 466 GLN : amide:sc= 0.925 K(o=0.93,f=-6.6!) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ -142:sc= 0.843 (180deg=0.137) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 477 LYS NZ :NH3+ -171:sc= 1.28 (180deg=1.22) USER MOD ----------------------------------------------------------------- ATOM 172 N ALA A 390 -5.359 6.193 -9.859 1.00 0.00 N ATOM 173 CA ALA A 390 -4.809 5.798 -8.547 1.00 0.00 C ATOM 174 C ALA A 390 -3.283 5.932 -8.329 1.00 0.00 C ATOM 175 O ALA A 390 -2.862 6.165 -7.192 1.00 0.00 O ATOM 176 CB ALA A 390 -5.298 4.371 -8.235 1.00 0.00 C ATOM 0 HA ALA A 390 -5.192 6.537 -7.843 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -4.905 4.055 -7.269 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -6.388 4.358 -8.205 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -4.948 3.689 -9.010 1.00 0.00 H new ATOM 182 N ALA A 391 -2.461 5.792 -9.370 1.00 0.00 N ATOM 183 CA ALA A 391 -1.003 5.661 -9.288 1.00 0.00 C ATOM 184 C ALA A 391 -0.263 6.919 -8.810 1.00 0.00 C ATOM 185 O ALA A 391 -0.417 8.012 -9.361 1.00 0.00 O ATOM 186 CB ALA A 391 -0.495 5.165 -10.649 1.00 0.00 C ATOM 0 H ALA A 391 -2.804 5.766 -10.330 1.00 0.00 H new ATOM 0 HA ALA A 391 -0.778 4.936 -8.506 1.00 0.00 H new ATOM 0 HB1 ALA A 391 0.589 5.059 -10.616 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -0.948 4.200 -10.877 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -0.766 5.884 -11.422 1.00 0.00 H new ATOM 192 N GLY A 392 0.561 6.729 -7.772 1.00 0.00 N ATOM 193 CA GLY A 392 1.430 7.744 -7.165 1.00 0.00 C ATOM 194 C GLY A 392 0.706 8.670 -6.189 1.00 0.00 C ATOM 195 O GLY A 392 1.343 9.534 -5.588 1.00 0.00 O ATOM 0 H GLY A 392 0.644 5.822 -7.312 1.00 0.00 H new ATOM 0 HA2 GLY A 392 2.245 7.245 -6.641 1.00 0.00 H new ATOM 0 HA3 GLY A 392 1.879 8.344 -7.956 1.00 0.00 H new ATOM 199 N SER A 393 -0.607 8.503 -6.020 1.00 0.00 N ATOM 200 CA SER A 393 -1.454 9.402 -5.233 1.00 0.00 C ATOM 201 C SER A 393 -1.233 9.218 -3.722 1.00 0.00 C ATOM 202 O SER A 393 -1.245 8.100 -3.206 1.00 0.00 O ATOM 203 CB SER A 393 -2.926 9.177 -5.611 1.00 0.00 C ATOM 204 OG SER A 393 -3.787 10.106 -4.961 1.00 0.00 O ATOM 0 H SER A 393 -1.121 7.725 -6.434 1.00 0.00 H new ATOM 0 HA SER A 393 -1.178 10.431 -5.466 1.00 0.00 H new ATOM 0 HB2 SER A 393 -3.042 9.268 -6.691 1.00 0.00 H new ATOM 0 HB3 SER A 393 -3.219 8.162 -5.344 1.00 0.00 H new ATOM 0 HG SER A 393 -4.256 10.643 -5.633 1.00 0.00 H new ATOM 210 N GLN A 394 -1.053 10.333 -3.008 1.00 0.00 N ATOM 211 CA GLN A 394 -0.928 10.433 -1.555 1.00 0.00 C ATOM 212 C GLN A 394 -2.305 10.348 -0.853 1.00 0.00 C ATOM 213 O GLN A 394 -2.389 10.415 0.372 1.00 0.00 O ATOM 214 CB GLN A 394 -0.166 11.759 -1.329 1.00 0.00 C ATOM 215 CG GLN A 394 -0.137 12.339 0.090 1.00 0.00 C ATOM 216 CD GLN A 394 0.807 13.542 0.224 1.00 0.00 C ATOM 217 OE1 GLN A 394 1.097 14.262 -0.726 1.00 0.00 O ATOM 218 NE2 GLN A 394 1.330 13.831 1.397 1.00 0.00 N ATOM 0 H GLN A 394 -0.987 11.245 -3.459 1.00 0.00 H new ATOM 0 HA GLN A 394 -0.382 9.602 -1.109 1.00 0.00 H new ATOM 0 HB2 GLN A 394 0.865 11.611 -1.650 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -0.600 12.510 -1.988 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -1.145 12.641 0.374 1.00 0.00 H new ATOM 0 HG3 GLN A 394 0.172 11.562 0.789 1.00 0.00 H new ATOM 0 HE21 GLN A 394 1.111 13.254 2.209 1.00 0.00 H new ATOM 0 HE22 GLN A 394 1.954 14.632 1.494 1.00 0.00 H new ATOM 227 N LYS A 395 -3.402 10.189 -1.609 1.00 0.00 N ATOM 228 CA LYS A 395 -4.774 10.181 -1.095 1.00 0.00 C ATOM 229 C LYS A 395 -5.051 8.959 -0.198 1.00 0.00 C ATOM 230 O LYS A 395 -4.589 7.852 -0.478 1.00 0.00 O ATOM 231 CB LYS A 395 -5.700 10.261 -2.320 1.00 0.00 C ATOM 232 CG LYS A 395 -7.200 10.273 -1.999 1.00 0.00 C ATOM 233 CD LYS A 395 -8.071 10.646 -3.212 1.00 0.00 C ATOM 234 CE LYS A 395 -7.912 9.728 -4.439 1.00 0.00 C ATOM 235 NZ LYS A 395 -6.801 10.132 -5.346 1.00 0.00 N ATOM 0 H LYS A 395 -3.355 10.059 -2.620 1.00 0.00 H new ATOM 0 HA LYS A 395 -4.953 11.033 -0.440 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -5.457 11.163 -2.882 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -5.490 9.413 -2.971 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -7.496 9.289 -1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -7.388 10.981 -1.192 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -9.117 10.638 -2.905 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -7.834 11.668 -3.509 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -7.739 8.707 -4.099 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -8.846 9.722 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -6.959 9.726 -6.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -6.769 11.169 -5.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -5.898 9.783 -4.966 1.00 0.00 H new ATOM 249 N GLU A 396 -5.828 9.158 0.867 1.00 0.00 N ATOM 250 CA GLU A 396 -6.179 8.130 1.851 1.00 0.00 C ATOM 251 C GLU A 396 -7.710 8.036 1.995 1.00 0.00 C ATOM 252 O GLU A 396 -8.417 9.049 1.947 1.00 0.00 O ATOM 253 CB GLU A 396 -5.511 8.449 3.200 1.00 0.00 C ATOM 254 CG GLU A 396 -3.982 8.604 3.126 1.00 0.00 C ATOM 255 CD GLU A 396 -3.430 8.970 4.509 1.00 0.00 C ATOM 256 OE1 GLU A 396 -3.452 10.170 4.872 1.00 0.00 O ATOM 257 OE2 GLU A 396 -2.999 8.060 5.250 1.00 0.00 O ATOM 0 H GLU A 396 -6.244 10.066 1.076 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.813 7.162 1.510 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.939 9.370 3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.751 7.656 3.908 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -3.530 7.676 2.778 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -3.720 9.377 2.403 1.00 0.00 H new ATOM 264 N GLY A 397 -8.216 6.812 2.154 1.00 0.00 N ATOM 265 CA GLY A 397 -9.638 6.449 2.214 1.00 0.00 C ATOM 266 C GLY A 397 -10.193 6.350 3.643 1.00 0.00 C ATOM 267 O GLY A 397 -9.523 6.784 4.590 1.00 0.00 O ATOM 0 H GLY A 397 -7.610 5.997 2.250 1.00 0.00 H new ATOM 0 HA2 GLY A 397 -10.216 7.189 1.660 1.00 0.00 H new ATOM 0 HA3 GLY A 397 -9.781 5.492 1.712 1.00 0.00 H new ATOM 271 N PRO A 398 -11.412 5.797 3.810 1.00 0.00 N ATOM 272 CA PRO A 398 -12.095 5.713 5.100 1.00 0.00 C ATOM 273 C PRO A 398 -11.461 4.665 6.032 1.00 0.00 C ATOM 274 O PRO A 398 -10.602 3.880 5.624 1.00 0.00 O ATOM 275 CB PRO A 398 -13.556 5.396 4.758 1.00 0.00 C ATOM 276 CG PRO A 398 -13.458 4.607 3.454 1.00 0.00 C ATOM 277 CD PRO A 398 -12.251 5.232 2.754 1.00 0.00 C ATOM 0 HA PRO A 398 -12.012 6.644 5.661 1.00 0.00 H new ATOM 0 HB2 PRO A 398 -14.034 4.812 5.545 1.00 0.00 H new ATOM 0 HB3 PRO A 398 -14.145 6.305 4.633 1.00 0.00 H new ATOM 0 HG2 PRO A 398 -13.310 3.543 3.638 1.00 0.00 H new ATOM 0 HG3 PRO A 398 -14.364 4.704 2.856 1.00 0.00 H new ATOM 0 HD2 PRO A 398 -11.703 4.484 2.181 1.00 0.00 H new ATOM 0 HD3 PRO A 398 -12.565 6.004 2.052 1.00 0.00 H new ATOM 285 N GLU A 399 -11.890 4.657 7.299 1.00 0.00 N ATOM 286 CA GLU A 399 -11.380 3.747 8.332 1.00 0.00 C ATOM 287 C GLU A 399 -11.563 2.271 7.928 1.00 0.00 C ATOM 288 O GLU A 399 -12.666 1.828 7.595 1.00 0.00 O ATOM 289 CB GLU A 399 -12.060 4.052 9.679 1.00 0.00 C ATOM 290 CG GLU A 399 -11.456 3.236 10.831 1.00 0.00 C ATOM 291 CD GLU A 399 -12.086 3.610 12.180 1.00 0.00 C ATOM 292 OE1 GLU A 399 -13.210 3.148 12.481 1.00 0.00 O ATOM 293 OE2 GLU A 399 -11.441 4.336 12.973 1.00 0.00 O ATOM 0 H GLU A 399 -12.612 5.292 7.641 1.00 0.00 H new ATOM 0 HA GLU A 399 -10.308 3.912 8.439 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -11.965 5.115 9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -13.126 3.837 9.603 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -11.605 2.173 10.642 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -10.380 3.405 10.872 1.00 0.00 H new ATOM 300 N GLY A 400 -10.459 1.513 7.943 1.00 0.00 N ATOM 301 CA GLY A 400 -10.415 0.092 7.569 1.00 0.00 C ATOM 302 C GLY A 400 -10.249 -0.168 6.066 1.00 0.00 C ATOM 303 O GLY A 400 -10.121 -1.326 5.675 1.00 0.00 O ATOM 0 H GLY A 400 -9.549 1.879 8.222 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -9.591 -0.385 8.100 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -11.333 -0.388 7.908 1.00 0.00 H new ATOM 307 N ALA A 401 -10.237 0.872 5.223 1.00 0.00 N ATOM 308 CA ALA A 401 -10.084 0.757 3.766 1.00 0.00 C ATOM 309 C ALA A 401 -8.645 0.994 3.259 1.00 0.00 C ATOM 310 O ALA A 401 -8.383 0.848 2.065 1.00 0.00 O ATOM 311 CB ALA A 401 -11.081 1.713 3.107 1.00 0.00 C ATOM 0 H ALA A 401 -10.335 1.836 5.540 1.00 0.00 H new ATOM 0 HA ALA A 401 -10.297 -0.275 3.486 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -10.987 1.646 2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -12.095 1.441 3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -10.872 2.734 3.427 1.00 0.00 H new ATOM 317 N ASN A 402 -7.713 1.345 4.151 1.00 0.00 N ATOM 318 CA ASN A 402 -6.315 1.651 3.825 1.00 0.00 C ATOM 319 C ASN A 402 -5.398 0.478 4.198 1.00 0.00 C ATOM 320 O ASN A 402 -5.402 0.021 5.344 1.00 0.00 O ATOM 321 CB ASN A 402 -5.890 2.935 4.557 1.00 0.00 C ATOM 322 CG ASN A 402 -6.730 4.142 4.153 1.00 0.00 C ATOM 323 OD1 ASN A 402 -7.108 4.304 2.999 1.00 0.00 O ATOM 324 ND2 ASN A 402 -7.068 5.009 5.091 1.00 0.00 N ATOM 0 H ASN A 402 -7.915 1.427 5.147 1.00 0.00 H new ATOM 0 HA ASN A 402 -6.225 1.808 2.750 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -5.974 2.781 5.633 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -4.840 3.140 4.346 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -7.645 5.816 4.855 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -6.752 4.871 6.051 1.00 0.00 H new ATOM 331 N LEU A 403 -4.599 0.009 3.237 1.00 0.00 N ATOM 332 CA LEU A 403 -3.672 -1.116 3.379 1.00 0.00 C ATOM 333 C LEU A 403 -2.220 -0.674 3.243 1.00 0.00 C ATOM 334 O LEU A 403 -1.892 0.124 2.362 1.00 0.00 O ATOM 335 CB LEU A 403 -3.938 -2.179 2.297 1.00 0.00 C ATOM 336 CG LEU A 403 -5.338 -2.808 2.299 1.00 0.00 C ATOM 337 CD1 LEU A 403 -5.365 -3.940 1.270 1.00 0.00 C ATOM 338 CD2 LEU A 403 -5.695 -3.362 3.680 1.00 0.00 C ATOM 0 H LEU A 403 -4.579 0.418 2.303 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.837 -1.528 4.375 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -3.767 -1.725 1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -3.203 -2.976 2.411 1.00 0.00 H new ATOM 0 HG LEU A 403 -6.070 -2.041 2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -6.354 -4.398 1.259 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -5.140 -3.539 0.282 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -4.620 -4.691 1.535 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -6.692 -3.801 3.649 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.971 -4.126 3.964 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -5.676 -2.554 4.412 1.00 0.00 H new ATOM 350 N PHE A 404 -1.375 -1.287 4.068 1.00 0.00 N ATOM 351 CA PHE A 404 0.082 -1.253 4.017 1.00 0.00 C ATOM 352 C PHE A 404 0.576 -2.606 3.484 1.00 0.00 C ATOM 353 O PHE A 404 0.175 -3.662 3.977 1.00 0.00 O ATOM 354 CB PHE A 404 0.603 -0.973 5.432 1.00 0.00 C ATOM 355 CG PHE A 404 2.091 -1.202 5.635 1.00 0.00 C ATOM 356 CD1 PHE A 404 3.018 -0.200 5.294 1.00 0.00 C ATOM 357 CD2 PHE A 404 2.545 -2.403 6.214 1.00 0.00 C ATOM 358 CE1 PHE A 404 4.386 -0.383 5.565 1.00 0.00 C ATOM 359 CE2 PHE A 404 3.914 -2.586 6.481 1.00 0.00 C ATOM 360 CZ PHE A 404 4.834 -1.571 6.165 1.00 0.00 C ATOM 0 H PHE A 404 -1.714 -1.859 4.842 1.00 0.00 H new ATOM 0 HA PHE A 404 0.449 -0.469 3.354 1.00 0.00 H new ATOM 0 HB2 PHE A 404 0.374 0.062 5.687 1.00 0.00 H new ATOM 0 HB3 PHE A 404 0.056 -1.603 6.134 1.00 0.00 H new ATOM 0 HD1 PHE A 404 2.679 0.711 4.823 1.00 0.00 H new ATOM 0 HD2 PHE A 404 1.840 -3.185 6.454 1.00 0.00 H new ATOM 0 HE1 PHE A 404 5.094 0.392 5.311 1.00 0.00 H new ATOM 0 HE2 PHE A 404 4.258 -3.506 6.929 1.00 0.00 H new ATOM 0 HZ PHE A 404 5.883 -1.705 6.383 1.00 0.00 H new ATOM 370 N ILE A 405 1.428 -2.562 2.460 1.00 0.00 N ATOM 371 CA ILE A 405 2.030 -3.704 1.761 1.00 0.00 C ATOM 372 C ILE A 405 3.551 -3.589 1.916 1.00 0.00 C ATOM 373 O ILE A 405 4.101 -2.502 1.765 1.00 0.00 O ATOM 374 CB ILE A 405 1.637 -3.700 0.258 1.00 0.00 C ATOM 375 CG1 ILE A 405 0.123 -3.822 -0.041 1.00 0.00 C ATOM 376 CG2 ILE A 405 2.335 -4.870 -0.465 1.00 0.00 C ATOM 377 CD1 ILE A 405 -0.738 -2.583 0.224 1.00 0.00 C ATOM 0 H ILE A 405 1.738 -1.672 2.069 1.00 0.00 H new ATOM 0 HA ILE A 405 1.670 -4.640 2.188 1.00 0.00 H new ATOM 0 HB ILE A 405 1.955 -2.720 -0.098 1.00 0.00 H new ATOM 0 HG12 ILE A 405 0.005 -4.099 -1.089 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -0.275 -4.645 0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 405 2.057 -4.864 -1.519 1.00 0.00 H new ATOM 0 HG22 ILE A 405 3.416 -4.761 -0.374 1.00 0.00 H new ATOM 0 HG23 ILE A 405 2.026 -5.813 -0.014 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.776 -2.801 -0.026 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -0.668 -2.310 1.277 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.383 -1.755 -0.390 1.00 0.00 H new ATOM 389 N TYR A 406 4.243 -4.691 2.195 1.00 0.00 N ATOM 390 CA TYR A 406 5.664 -4.697 2.562 1.00 0.00 C ATOM 391 C TYR A 406 6.361 -5.996 2.124 1.00 0.00 C ATOM 392 O TYR A 406 5.716 -7.033 1.986 1.00 0.00 O ATOM 393 CB TYR A 406 5.734 -4.437 4.073 1.00 0.00 C ATOM 394 CG TYR A 406 7.080 -4.530 4.771 1.00 0.00 C ATOM 395 CD1 TYR A 406 8.251 -3.969 4.219 1.00 0.00 C ATOM 396 CD2 TYR A 406 7.136 -5.140 6.037 1.00 0.00 C ATOM 397 CE1 TYR A 406 9.473 -4.045 4.915 1.00 0.00 C ATOM 398 CE2 TYR A 406 8.351 -5.223 6.735 1.00 0.00 C ATOM 399 CZ TYR A 406 9.528 -4.679 6.177 1.00 0.00 C ATOM 400 OH TYR A 406 10.705 -4.772 6.859 1.00 0.00 O ATOM 0 H TYR A 406 3.828 -5.623 2.173 1.00 0.00 H new ATOM 0 HA TYR A 406 6.212 -3.914 2.037 1.00 0.00 H new ATOM 0 HB2 TYR A 406 5.337 -3.438 4.255 1.00 0.00 H new ATOM 0 HB3 TYR A 406 5.060 -5.142 4.560 1.00 0.00 H new ATOM 0 HD1 TYR A 406 8.210 -3.479 3.258 1.00 0.00 H new ATOM 0 HD2 TYR A 406 6.237 -5.548 6.476 1.00 0.00 H new ATOM 0 HE1 TYR A 406 10.367 -3.619 4.485 1.00 0.00 H new ATOM 0 HE2 TYR A 406 8.385 -5.704 7.701 1.00 0.00 H new ATOM 0 HH TYR A 406 10.555 -5.238 7.708 1.00 0.00 H new ATOM 410 N HIS A 407 7.667 -5.900 1.846 1.00 0.00 N ATOM 411 CA HIS A 407 8.548 -6.902 1.218 1.00 0.00 C ATOM 412 C HIS A 407 8.425 -6.925 -0.325 1.00 0.00 C ATOM 413 O HIS A 407 8.687 -7.945 -0.964 1.00 0.00 O ATOM 414 CB HIS A 407 8.430 -8.292 1.880 1.00 0.00 C ATOM 415 CG HIS A 407 8.637 -8.286 3.370 1.00 0.00 C ATOM 416 ND1 HIS A 407 9.781 -7.819 4.021 1.00 0.00 N ATOM 417 CD2 HIS A 407 7.772 -8.790 4.295 1.00 0.00 C ATOM 418 CE1 HIS A 407 9.568 -8.045 5.328 1.00 0.00 C ATOM 419 NE2 HIS A 407 8.372 -8.629 5.524 1.00 0.00 N ATOM 0 H HIS A 407 8.181 -5.049 2.072 1.00 0.00 H new ATOM 0 HA HIS A 407 9.572 -6.582 1.411 1.00 0.00 H new ATOM 0 HB2 HIS A 407 7.444 -8.702 1.663 1.00 0.00 H new ATOM 0 HB3 HIS A 407 9.161 -8.961 1.426 1.00 0.00 H new ATOM 0 HD2 HIS A 407 6.805 -9.230 4.102 1.00 0.00 H new ATOM 0 HE1 HIS A 407 10.263 -7.792 6.115 1.00 0.00 H new ATOM 0 HE2 HIS A 407 7.979 -8.904 6.424 1.00 0.00 H new ATOM 427 N LEU A 408 8.026 -5.799 -0.933 1.00 0.00 N ATOM 428 CA LEU A 408 7.908 -5.616 -2.388 1.00 0.00 C ATOM 429 C LEU A 408 9.270 -5.744 -3.109 1.00 0.00 C ATOM 430 O LEU A 408 10.316 -5.557 -2.473 1.00 0.00 O ATOM 431 CB LEU A 408 7.295 -4.227 -2.678 1.00 0.00 C ATOM 432 CG LEU A 408 5.823 -4.056 -2.253 1.00 0.00 C ATOM 433 CD1 LEU A 408 5.427 -2.574 -2.340 1.00 0.00 C ATOM 434 CD2 LEU A 408 4.895 -4.883 -3.158 1.00 0.00 C ATOM 0 H LEU A 408 7.768 -4.963 -0.409 1.00 0.00 H new ATOM 0 HA LEU A 408 7.263 -6.407 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 408 7.893 -3.471 -2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 408 7.373 -4.030 -3.747 1.00 0.00 H new ATOM 0 HG LEU A 408 5.719 -4.408 -1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 408 4.386 -2.457 -2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 408 6.064 -1.988 -1.678 1.00 0.00 H new ATOM 0 HD13 LEU A 408 5.550 -2.224 -3.365 1.00 0.00 H new ATOM 0 HD21 LEU A 408 3.861 -4.747 -2.840 1.00 0.00 H new ATOM 0 HD22 LEU A 408 5.004 -4.551 -4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 408 5.161 -5.937 -3.086 1.00 0.00 H new ATOM 446 N PRO A 409 9.281 -6.032 -4.427 1.00 0.00 N ATOM 447 CA PRO A 409 10.480 -5.944 -5.260 1.00 0.00 C ATOM 448 C PRO A 409 11.102 -4.537 -5.217 1.00 0.00 C ATOM 449 O PRO A 409 10.410 -3.544 -4.990 1.00 0.00 O ATOM 450 CB PRO A 409 10.033 -6.329 -6.676 1.00 0.00 C ATOM 451 CG PRO A 409 8.796 -7.189 -6.439 1.00 0.00 C ATOM 452 CD PRO A 409 8.162 -6.536 -5.214 1.00 0.00 C ATOM 0 HA PRO A 409 11.263 -6.612 -4.900 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.801 -5.449 -7.276 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.810 -6.881 -7.206 1.00 0.00 H new ATOM 0 HG2 PRO A 409 8.124 -7.177 -7.297 1.00 0.00 H new ATOM 0 HG3 PRO A 409 9.057 -8.231 -6.253 1.00 0.00 H new ATOM 0 HD2 PRO A 409 7.488 -5.729 -5.502 1.00 0.00 H new ATOM 0 HD3 PRO A 409 7.573 -7.255 -4.645 1.00 0.00 H new ATOM 460 N GLN A 410 12.417 -4.446 -5.434 1.00 0.00 N ATOM 461 CA GLN A 410 13.176 -3.192 -5.327 1.00 0.00 C ATOM 462 C GLN A 410 12.885 -2.215 -6.488 1.00 0.00 C ATOM 463 O GLN A 410 13.092 -1.009 -6.344 1.00 0.00 O ATOM 464 CB GLN A 410 14.671 -3.555 -5.214 1.00 0.00 C ATOM 465 CG GLN A 410 15.645 -2.375 -5.031 1.00 0.00 C ATOM 466 CD GLN A 410 15.356 -1.535 -3.783 1.00 0.00 C ATOM 467 OE1 GLN A 410 15.887 -1.763 -2.704 1.00 0.00 O ATOM 468 NE2 GLN A 410 14.503 -0.539 -3.893 1.00 0.00 N ATOM 0 H GLN A 410 12.993 -5.248 -5.692 1.00 0.00 H new ATOM 0 HA GLN A 410 12.862 -2.650 -4.435 1.00 0.00 H new ATOM 0 HB2 GLN A 410 14.796 -4.236 -4.372 1.00 0.00 H new ATOM 0 HB3 GLN A 410 14.960 -4.102 -6.112 1.00 0.00 H new ATOM 0 HG2 GLN A 410 16.663 -2.760 -4.973 1.00 0.00 H new ATOM 0 HG3 GLN A 410 15.596 -1.734 -5.911 1.00 0.00 H new ATOM 0 HE21 GLN A 410 14.058 -0.345 -4.790 1.00 0.00 H new ATOM 0 HE22 GLN A 410 14.287 0.039 -3.081 1.00 0.00 H new ATOM 477 N GLU A 411 12.369 -2.718 -7.612 1.00 0.00 N ATOM 478 CA GLU A 411 12.026 -1.965 -8.825 1.00 0.00 C ATOM 479 C GLU A 411 10.504 -1.801 -9.052 1.00 0.00 C ATOM 480 O GLU A 411 10.085 -1.335 -10.114 1.00 0.00 O ATOM 481 CB GLU A 411 12.721 -2.607 -10.043 1.00 0.00 C ATOM 482 CG GLU A 411 12.280 -4.046 -10.358 1.00 0.00 C ATOM 483 CD GLU A 411 13.105 -5.092 -9.592 1.00 0.00 C ATOM 484 OE1 GLU A 411 12.771 -5.380 -8.420 1.00 0.00 O ATOM 485 OE2 GLU A 411 14.087 -5.626 -10.160 1.00 0.00 O ATOM 0 H GLU A 411 12.168 -3.713 -7.707 1.00 0.00 H new ATOM 0 HA GLU A 411 12.396 -0.949 -8.689 1.00 0.00 H new ATOM 0 HB2 GLU A 411 12.534 -1.986 -10.919 1.00 0.00 H new ATOM 0 HB3 GLU A 411 13.798 -2.602 -9.873 1.00 0.00 H new ATOM 0 HG2 GLU A 411 11.226 -4.163 -10.107 1.00 0.00 H new ATOM 0 HG3 GLU A 411 12.374 -4.226 -11.429 1.00 0.00 H new ATOM 492 N PHE A 412 9.665 -2.194 -8.084 1.00 0.00 N ATOM 493 CA PHE A 412 8.202 -2.199 -8.217 1.00 0.00 C ATOM 494 C PHE A 412 7.624 -0.777 -8.329 1.00 0.00 C ATOM 495 O PHE A 412 7.955 0.100 -7.525 1.00 0.00 O ATOM 496 CB PHE A 412 7.586 -2.959 -7.029 1.00 0.00 C ATOM 497 CG PHE A 412 6.395 -3.831 -7.370 1.00 0.00 C ATOM 498 CD1 PHE A 412 6.562 -4.931 -8.234 1.00 0.00 C ATOM 499 CD2 PHE A 412 5.145 -3.600 -6.764 1.00 0.00 C ATOM 500 CE1 PHE A 412 5.486 -5.800 -8.485 1.00 0.00 C ATOM 501 CE2 PHE A 412 4.075 -4.478 -7.007 1.00 0.00 C ATOM 502 CZ PHE A 412 4.243 -5.575 -7.869 1.00 0.00 C ATOM 0 H PHE A 412 9.988 -2.522 -7.174 1.00 0.00 H new ATOM 0 HA PHE A 412 7.943 -2.709 -9.145 1.00 0.00 H new ATOM 0 HB2 PHE A 412 8.357 -3.584 -6.579 1.00 0.00 H new ATOM 0 HB3 PHE A 412 7.282 -2.235 -6.273 1.00 0.00 H new ATOM 0 HD1 PHE A 412 7.518 -5.107 -8.704 1.00 0.00 H new ATOM 0 HD2 PHE A 412 5.009 -2.749 -6.113 1.00 0.00 H new ATOM 0 HE1 PHE A 412 5.614 -6.640 -9.151 1.00 0.00 H new ATOM 0 HE2 PHE A 412 3.121 -4.309 -6.530 1.00 0.00 H new ATOM 0 HZ PHE A 412 3.417 -6.245 -8.058 1.00 0.00 H new ATOM 512 N GLY A 413 6.750 -0.551 -9.317 1.00 0.00 N ATOM 513 CA GLY A 413 6.081 0.730 -9.568 1.00 0.00 C ATOM 514 C GLY A 413 4.679 0.814 -8.964 1.00 0.00 C ATOM 515 O GLY A 413 4.092 -0.179 -8.532 1.00 0.00 O ATOM 0 H GLY A 413 6.481 -1.276 -9.983 1.00 0.00 H new ATOM 0 HA2 GLY A 413 6.692 1.536 -9.161 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.015 0.892 -10.644 1.00 0.00 H new ATOM 519 N ASP A 414 4.116 2.021 -8.985 1.00 0.00 N ATOM 520 CA ASP A 414 2.778 2.315 -8.449 1.00 0.00 C ATOM 521 C ASP A 414 1.660 1.595 -9.223 1.00 0.00 C ATOM 522 O ASP A 414 0.675 1.146 -8.638 1.00 0.00 O ATOM 523 CB ASP A 414 2.548 3.833 -8.497 1.00 0.00 C ATOM 524 CG ASP A 414 3.598 4.618 -7.701 1.00 0.00 C ATOM 525 OD1 ASP A 414 3.739 4.351 -6.487 1.00 0.00 O ATOM 526 OD2 ASP A 414 4.275 5.488 -8.297 1.00 0.00 O ATOM 0 H ASP A 414 4.580 2.839 -9.380 1.00 0.00 H new ATOM 0 HA ASP A 414 2.740 1.949 -7.423 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.562 4.165 -9.535 1.00 0.00 H new ATOM 0 HB3 ASP A 414 1.557 4.058 -8.103 1.00 0.00 H new ATOM 531 N GLN A 415 1.839 1.445 -10.539 1.00 0.00 N ATOM 532 CA GLN A 415 0.946 0.732 -11.432 1.00 0.00 C ATOM 533 C GLN A 415 1.071 -0.795 -11.293 1.00 0.00 C ATOM 534 O GLN A 415 0.087 -1.502 -11.505 1.00 0.00 O ATOM 535 CB GLN A 415 1.282 1.183 -12.858 1.00 0.00 C ATOM 536 CG GLN A 415 0.821 2.622 -13.154 1.00 0.00 C ATOM 537 CD GLN A 415 1.076 3.044 -14.605 1.00 0.00 C ATOM 538 OE1 GLN A 415 2.101 2.747 -15.209 1.00 0.00 O ATOM 539 NE2 GLN A 415 0.158 3.755 -15.231 1.00 0.00 N ATOM 0 H GLN A 415 2.647 1.837 -11.023 1.00 0.00 H new ATOM 0 HA GLN A 415 -0.088 0.965 -11.179 1.00 0.00 H new ATOM 0 HB2 GLN A 415 2.359 1.113 -13.012 1.00 0.00 H new ATOM 0 HB3 GLN A 415 0.813 0.503 -13.569 1.00 0.00 H new ATOM 0 HG2 GLN A 415 -0.244 2.709 -12.938 1.00 0.00 H new ATOM 0 HG3 GLN A 415 1.339 3.309 -12.485 1.00 0.00 H new ATOM 0 HE21 GLN A 415 -0.703 4.014 -14.749 1.00 0.00 H new ATOM 0 HE22 GLN A 415 0.309 4.046 -16.197 1.00 0.00 H new ATOM 548 N ASP A 416 2.234 -1.318 -10.886 1.00 0.00 N ATOM 549 CA ASP A 416 2.406 -2.750 -10.605 1.00 0.00 C ATOM 550 C ASP A 416 1.633 -3.148 -9.340 1.00 0.00 C ATOM 551 O ASP A 416 0.942 -4.169 -9.329 1.00 0.00 O ATOM 552 CB ASP A 416 3.893 -3.118 -10.460 1.00 0.00 C ATOM 553 CG ASP A 416 4.717 -2.834 -11.723 1.00 0.00 C ATOM 554 OD1 ASP A 416 4.443 -3.458 -12.777 1.00 0.00 O ATOM 555 OD2 ASP A 416 5.660 -2.013 -11.644 1.00 0.00 O ATOM 0 H ASP A 416 3.079 -0.765 -10.743 1.00 0.00 H new ATOM 0 HA ASP A 416 2.003 -3.305 -11.452 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.318 -2.561 -9.625 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.975 -4.176 -10.212 1.00 0.00 H new ATOM 560 N LEU A 417 1.680 -2.298 -8.306 1.00 0.00 N ATOM 561 CA LEU A 417 0.900 -2.466 -7.080 1.00 0.00 C ATOM 562 C LEU A 417 -0.606 -2.315 -7.334 1.00 0.00 C ATOM 563 O LEU A 417 -1.403 -3.048 -6.754 1.00 0.00 O ATOM 564 CB LEU A 417 1.418 -1.465 -6.030 1.00 0.00 C ATOM 565 CG LEU A 417 0.906 -1.740 -4.602 1.00 0.00 C ATOM 566 CD1 LEU A 417 1.411 -3.084 -4.057 1.00 0.00 C ATOM 567 CD2 LEU A 417 1.367 -0.623 -3.658 1.00 0.00 C ATOM 0 H LEU A 417 2.269 -1.465 -8.301 1.00 0.00 H new ATOM 0 HA LEU A 417 1.031 -3.480 -6.702 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.508 -1.488 -6.026 1.00 0.00 H new ATOM 0 HB3 LEU A 417 1.122 -0.458 -6.324 1.00 0.00 H new ATOM 0 HG LEU A 417 -0.182 -1.776 -4.652 1.00 0.00 H new ATOM 0 HD11 LEU A 417 1.026 -3.236 -3.049 1.00 0.00 H new ATOM 0 HD12 LEU A 417 1.066 -3.891 -4.703 1.00 0.00 H new ATOM 0 HD13 LEU A 417 2.501 -3.080 -4.032 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.002 -0.824 -2.651 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.456 -0.582 -3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 417 0.971 0.332 -4.004 1.00 0.00 H new ATOM 579 N LEU A 418 -1.005 -1.423 -8.245 1.00 0.00 N ATOM 580 CA LEU A 418 -2.400 -1.286 -8.670 1.00 0.00 C ATOM 581 C LEU A 418 -2.908 -2.539 -9.379 1.00 0.00 C ATOM 582 O LEU A 418 -3.916 -3.095 -8.956 1.00 0.00 O ATOM 583 CB LEU A 418 -2.538 -0.041 -9.553 1.00 0.00 C ATOM 584 CG LEU A 418 -3.954 0.247 -10.084 1.00 0.00 C ATOM 585 CD1 LEU A 418 -4.966 0.480 -8.953 1.00 0.00 C ATOM 586 CD2 LEU A 418 -3.894 1.482 -10.993 1.00 0.00 C ATOM 0 H LEU A 418 -0.369 -0.775 -8.709 1.00 0.00 H new ATOM 0 HA LEU A 418 -3.025 -1.166 -7.785 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.200 0.825 -8.984 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -1.865 -0.145 -10.404 1.00 0.00 H new ATOM 0 HG LEU A 418 -4.294 -0.627 -10.640 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -5.949 0.679 -9.380 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -5.017 -0.407 -8.322 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.651 1.334 -8.353 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -4.890 1.699 -11.378 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.531 2.337 -10.422 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -3.218 1.288 -11.826 1.00 0.00 H new ATOM 598 N GLN A 419 -2.230 -3.005 -10.432 1.00 0.00 N ATOM 599 CA GLN A 419 -2.686 -4.170 -11.203 1.00 0.00 C ATOM 600 C GLN A 419 -2.671 -5.468 -10.372 1.00 0.00 C ATOM 601 O GLN A 419 -3.462 -6.375 -10.634 1.00 0.00 O ATOM 602 CB GLN A 419 -1.844 -4.319 -12.482 1.00 0.00 C ATOM 603 CG GLN A 419 -2.074 -3.196 -13.513 1.00 0.00 C ATOM 604 CD GLN A 419 -3.487 -3.146 -14.109 1.00 0.00 C ATOM 605 OE1 GLN A 419 -4.295 -4.057 -13.988 1.00 0.00 O ATOM 606 NE2 GLN A 419 -3.849 -2.065 -14.770 1.00 0.00 N ATOM 0 H GLN A 419 -1.361 -2.593 -10.772 1.00 0.00 H new ATOM 0 HA GLN A 419 -3.725 -3.995 -11.482 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -0.789 -4.340 -12.211 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -2.072 -5.278 -12.946 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -1.861 -2.238 -13.039 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -1.357 -3.316 -14.325 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -3.192 -1.293 -14.884 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -4.786 -2.000 -15.168 1.00 0.00 H new ATOM 615 N MET A 420 -1.836 -5.536 -9.329 1.00 0.00 N ATOM 616 CA MET A 420 -1.832 -6.603 -8.324 1.00 0.00 C ATOM 617 C MET A 420 -3.090 -6.594 -7.431 1.00 0.00 C ATOM 618 O MET A 420 -3.612 -7.664 -7.113 1.00 0.00 O ATOM 619 CB MET A 420 -0.537 -6.450 -7.509 1.00 0.00 C ATOM 620 CG MET A 420 -0.420 -7.399 -6.318 1.00 0.00 C ATOM 621 SD MET A 420 1.073 -7.115 -5.332 1.00 0.00 S ATOM 622 CE MET A 420 2.215 -8.198 -6.209 1.00 0.00 C ATOM 0 H MET A 420 -1.123 -4.828 -9.156 1.00 0.00 H new ATOM 0 HA MET A 420 -1.860 -7.575 -8.817 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.314 -6.611 -8.170 1.00 0.00 H new ATOM 0 HB3 MET A 420 -0.470 -5.424 -7.147 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.297 -7.284 -5.681 1.00 0.00 H new ATOM 0 HG3 MET A 420 -0.421 -8.428 -6.678 1.00 0.00 H new ATOM 0 HE1 MET A 420 3.206 -7.745 -6.225 1.00 0.00 H new ATOM 0 HE2 MET A 420 2.264 -9.162 -5.702 1.00 0.00 H new ATOM 0 HE3 MET A 420 1.866 -8.343 -7.231 1.00 0.00 H new ATOM 632 N PHE A 421 -3.588 -5.413 -7.038 1.00 0.00 N ATOM 633 CA PHE A 421 -4.707 -5.239 -6.096 1.00 0.00 C ATOM 634 C PHE A 421 -6.076 -4.924 -6.746 1.00 0.00 C ATOM 635 O PHE A 421 -7.109 -5.032 -6.080 1.00 0.00 O ATOM 636 CB PHE A 421 -4.295 -4.217 -5.022 1.00 0.00 C ATOM 637 CG PHE A 421 -3.432 -4.798 -3.908 1.00 0.00 C ATOM 638 CD1 PHE A 421 -2.059 -5.039 -4.102 1.00 0.00 C ATOM 639 CD2 PHE A 421 -4.008 -5.101 -2.657 1.00 0.00 C ATOM 640 CE1 PHE A 421 -1.278 -5.588 -3.070 1.00 0.00 C ATOM 641 CE2 PHE A 421 -3.231 -5.660 -1.627 1.00 0.00 C ATOM 642 CZ PHE A 421 -1.867 -5.915 -1.838 1.00 0.00 C ATOM 0 H PHE A 421 -3.214 -4.526 -7.375 1.00 0.00 H new ATOM 0 HA PHE A 421 -4.892 -6.207 -5.629 1.00 0.00 H new ATOM 0 HB2 PHE A 421 -3.751 -3.402 -5.501 1.00 0.00 H new ATOM 0 HB3 PHE A 421 -5.194 -3.785 -4.583 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -1.602 -4.800 -5.051 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -5.056 -4.902 -2.488 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -0.223 -5.759 -3.225 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.683 -5.893 -0.674 1.00 0.00 H new ATOM 0 HZ PHE A 421 -1.272 -6.361 -1.055 1.00 0.00 H new ATOM 652 N MET A 422 -6.113 -4.628 -8.051 1.00 0.00 N ATOM 653 CA MET A 422 -7.321 -4.463 -8.888 1.00 0.00 C ATOM 654 C MET A 422 -8.474 -5.464 -8.646 1.00 0.00 C ATOM 655 O MET A 422 -9.614 -5.002 -8.519 1.00 0.00 O ATOM 656 CB MET A 422 -6.917 -4.531 -10.375 1.00 0.00 C ATOM 657 CG MET A 422 -6.538 -3.173 -10.963 1.00 0.00 C ATOM 658 SD MET A 422 -7.940 -2.094 -11.349 1.00 0.00 S ATOM 659 CE MET A 422 -7.028 -0.808 -12.238 1.00 0.00 C ATOM 0 H MET A 422 -5.256 -4.488 -8.587 1.00 0.00 H new ATOM 0 HA MET A 422 -7.723 -3.493 -8.596 1.00 0.00 H new ATOM 0 HB2 MET A 422 -6.074 -5.214 -10.484 1.00 0.00 H new ATOM 0 HB3 MET A 422 -7.743 -4.950 -10.950 1.00 0.00 H new ATOM 0 HG2 MET A 422 -5.884 -2.658 -10.259 1.00 0.00 H new ATOM 0 HG3 MET A 422 -5.961 -3.335 -11.874 1.00 0.00 H new ATOM 0 HE1 MET A 422 -7.184 0.153 -11.748 1.00 0.00 H new ATOM 0 HE2 MET A 422 -5.965 -1.048 -12.235 1.00 0.00 H new ATOM 0 HE3 MET A 422 -7.385 -0.754 -13.266 1.00 0.00 H new ATOM 669 N PRO A 423 -8.254 -6.799 -8.602 1.00 0.00 N ATOM 670 CA PRO A 423 -9.351 -7.775 -8.609 1.00 0.00 C ATOM 671 C PRO A 423 -10.142 -7.876 -7.297 1.00 0.00 C ATOM 672 O PRO A 423 -11.150 -8.582 -7.249 1.00 0.00 O ATOM 673 CB PRO A 423 -8.705 -9.106 -8.989 1.00 0.00 C ATOM 674 CG PRO A 423 -7.269 -8.969 -8.498 1.00 0.00 C ATOM 675 CD PRO A 423 -6.978 -7.493 -8.746 1.00 0.00 C ATOM 0 HA PRO A 423 -10.114 -7.458 -9.320 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -9.211 -9.946 -8.514 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -8.745 -9.277 -10.065 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -7.173 -9.231 -7.444 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -6.587 -9.616 -9.050 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -6.246 -7.115 -8.032 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -6.561 -7.340 -9.741 1.00 0.00 H new ATOM 683 N PHE A 424 -9.719 -7.160 -6.252 1.00 0.00 N ATOM 684 CA PHE A 424 -10.326 -7.208 -4.916 1.00 0.00 C ATOM 685 C PHE A 424 -11.303 -6.045 -4.633 1.00 0.00 C ATOM 686 O PHE A 424 -11.959 -6.049 -3.589 1.00 0.00 O ATOM 687 CB PHE A 424 -9.207 -7.284 -3.863 1.00 0.00 C ATOM 688 CG PHE A 424 -8.122 -8.310 -4.158 1.00 0.00 C ATOM 689 CD1 PHE A 424 -8.468 -9.656 -4.389 1.00 0.00 C ATOM 690 CD2 PHE A 424 -6.773 -7.913 -4.254 1.00 0.00 C ATOM 691 CE1 PHE A 424 -7.480 -10.589 -4.745 1.00 0.00 C ATOM 692 CE2 PHE A 424 -5.787 -8.848 -4.612 1.00 0.00 C ATOM 693 CZ PHE A 424 -6.139 -10.186 -4.860 1.00 0.00 C ATOM 0 H PHE A 424 -8.929 -6.517 -6.310 1.00 0.00 H new ATOM 0 HA PHE A 424 -10.945 -8.104 -4.864 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -8.744 -6.301 -3.774 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -9.653 -7.515 -2.896 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -9.496 -9.972 -4.292 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -6.497 -6.889 -4.052 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.752 -11.618 -4.931 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.756 -8.538 -4.697 1.00 0.00 H new ATOM 0 HZ PHE A 424 -5.380 -10.903 -5.138 1.00 0.00 H new ATOM 703 N GLY A 425 -11.443 -5.082 -5.557 1.00 0.00 N ATOM 704 CA GLY A 425 -12.399 -3.964 -5.478 1.00 0.00 C ATOM 705 C GLY A 425 -11.899 -2.651 -6.086 1.00 0.00 C ATOM 706 O GLY A 425 -10.812 -2.582 -6.656 1.00 0.00 O ATOM 0 H GLY A 425 -10.878 -5.058 -6.406 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -13.320 -4.255 -5.983 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -12.650 -3.792 -4.431 1.00 0.00 H new ATOM 710 N ASN A 426 -12.706 -1.593 -5.957 1.00 0.00 N ATOM 711 CA ASN A 426 -12.394 -0.259 -6.484 1.00 0.00 C ATOM 712 C ASN A 426 -11.276 0.426 -5.671 1.00 0.00 C ATOM 713 O ASN A 426 -11.479 0.779 -4.506 1.00 0.00 O ATOM 714 CB ASN A 426 -13.679 0.588 -6.502 1.00 0.00 C ATOM 715 CG ASN A 426 -13.451 1.996 -7.051 1.00 0.00 C ATOM 716 OD1 ASN A 426 -12.563 2.240 -7.858 1.00 0.00 O ATOM 717 ND2 ASN A 426 -14.243 2.963 -6.625 1.00 0.00 N ATOM 0 H ASN A 426 -13.605 -1.639 -5.478 1.00 0.00 H new ATOM 0 HA ASN A 426 -12.018 -0.359 -7.502 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -14.433 0.084 -7.107 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -14.077 0.657 -5.490 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -14.116 3.915 -6.968 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -14.982 2.758 -5.953 1.00 0.00 H new ATOM 724 N VAL A 427 -10.114 0.627 -6.294 1.00 0.00 N ATOM 725 CA VAL A 427 -8.922 1.240 -5.692 1.00 0.00 C ATOM 726 C VAL A 427 -8.970 2.761 -5.886 1.00 0.00 C ATOM 727 O VAL A 427 -8.996 3.255 -7.010 1.00 0.00 O ATOM 728 CB VAL A 427 -7.617 0.646 -6.280 1.00 0.00 C ATOM 729 CG1 VAL A 427 -6.373 1.343 -5.706 1.00 0.00 C ATOM 730 CG2 VAL A 427 -7.504 -0.864 -5.998 1.00 0.00 C ATOM 0 H VAL A 427 -9.968 0.359 -7.267 1.00 0.00 H new ATOM 0 HA VAL A 427 -8.921 1.017 -4.625 1.00 0.00 H new ATOM 0 HB VAL A 427 -7.664 0.811 -7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -5.476 0.902 -6.140 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.408 2.405 -5.947 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -6.352 1.217 -4.624 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -6.577 -1.246 -6.425 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -7.505 -1.034 -4.921 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -8.351 -1.382 -6.448 1.00 0.00 H new ATOM 740 N VAL A 428 -8.959 3.488 -4.771 1.00 0.00 N ATOM 741 CA VAL A 428 -9.011 4.957 -4.677 1.00 0.00 C ATOM 742 C VAL A 428 -7.621 5.587 -4.873 1.00 0.00 C ATOM 743 O VAL A 428 -7.505 6.689 -5.408 1.00 0.00 O ATOM 744 CB VAL A 428 -9.625 5.366 -3.312 1.00 0.00 C ATOM 745 CG1 VAL A 428 -9.512 6.865 -2.990 1.00 0.00 C ATOM 746 CG2 VAL A 428 -11.114 4.973 -3.276 1.00 0.00 C ATOM 0 H VAL A 428 -8.911 3.048 -3.852 1.00 0.00 H new ATOM 0 HA VAL A 428 -9.644 5.335 -5.480 1.00 0.00 H new ATOM 0 HB VAL A 428 -9.045 4.834 -2.558 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -9.966 7.064 -2.019 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -8.461 7.154 -2.965 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -10.029 7.442 -3.757 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -11.543 5.261 -2.316 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -11.645 5.484 -4.079 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -11.209 3.895 -3.407 1.00 0.00 H new ATOM 756 N SER A 429 -6.558 4.876 -4.496 1.00 0.00 N ATOM 757 CA SER A 429 -5.162 5.314 -4.612 1.00 0.00 C ATOM 758 C SER A 429 -4.211 4.119 -4.422 1.00 0.00 C ATOM 759 O SER A 429 -4.516 3.190 -3.667 1.00 0.00 O ATOM 760 CB SER A 429 -4.847 6.424 -3.594 1.00 0.00 C ATOM 761 OG SER A 429 -4.942 5.921 -2.274 1.00 0.00 O ATOM 0 H SER A 429 -6.646 3.946 -4.087 1.00 0.00 H new ATOM 0 HA SER A 429 -5.013 5.723 -5.611 1.00 0.00 H new ATOM 0 HB2 SER A 429 -3.845 6.815 -3.770 1.00 0.00 H new ATOM 0 HB3 SER A 429 -5.541 7.255 -3.725 1.00 0.00 H new ATOM 0 HG SER A 429 -5.015 6.668 -1.644 1.00 0.00 H new ATOM 767 N ALA A 430 -3.049 4.148 -5.077 1.00 0.00 N ATOM 768 CA ALA A 430 -2.012 3.121 -4.983 1.00 0.00 C ATOM 769 C ALA A 430 -0.630 3.776 -5.115 1.00 0.00 C ATOM 770 O ALA A 430 -0.379 4.525 -6.063 1.00 0.00 O ATOM 771 CB ALA A 430 -2.253 2.059 -6.065 1.00 0.00 C ATOM 0 H ALA A 430 -2.797 4.910 -5.706 1.00 0.00 H new ATOM 0 HA ALA A 430 -2.051 2.625 -4.013 1.00 0.00 H new ATOM 0 HB1 ALA A 430 -1.482 1.291 -5.999 1.00 0.00 H new ATOM 0 HB2 ALA A 430 -3.232 1.604 -5.917 1.00 0.00 H new ATOM 0 HB3 ALA A 430 -2.216 2.527 -7.049 1.00 0.00 H new ATOM 777 N LYS A 431 0.259 3.519 -4.155 1.00 0.00 N ATOM 778 CA LYS A 431 1.534 4.237 -4.037 1.00 0.00 C ATOM 779 C LYS A 431 2.618 3.384 -3.361 1.00 0.00 C ATOM 780 O LYS A 431 2.473 3.005 -2.201 1.00 0.00 O ATOM 781 CB LYS A 431 1.284 5.559 -3.282 1.00 0.00 C ATOM 782 CG LYS A 431 2.541 6.441 -3.213 1.00 0.00 C ATOM 783 CD LYS A 431 2.222 7.818 -2.614 1.00 0.00 C ATOM 784 CE LYS A 431 3.447 8.745 -2.587 1.00 0.00 C ATOM 785 NZ LYS A 431 3.887 9.160 -3.945 1.00 0.00 N ATOM 0 H LYS A 431 0.118 2.809 -3.437 1.00 0.00 H new ATOM 0 HA LYS A 431 1.916 4.457 -5.034 1.00 0.00 H new ATOM 0 HB2 LYS A 431 0.483 6.110 -3.775 1.00 0.00 H new ATOM 0 HB3 LYS A 431 0.943 5.338 -2.271 1.00 0.00 H new ATOM 0 HG2 LYS A 431 3.302 5.947 -2.610 1.00 0.00 H new ATOM 0 HG3 LYS A 431 2.957 6.564 -4.213 1.00 0.00 H new ATOM 0 HD2 LYS A 431 1.427 8.288 -3.194 1.00 0.00 H new ATOM 0 HD3 LYS A 431 1.844 7.691 -1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 431 3.212 9.633 -1.999 1.00 0.00 H new ATOM 0 HE3 LYS A 431 4.270 8.238 -2.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 4.412 10.055 -3.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 4.502 8.426 -4.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 3.055 9.290 -4.555 1.00 0.00 H new ATOM 799 N VAL A 432 3.714 3.110 -4.063 1.00 0.00 N ATOM 800 CA VAL A 432 4.932 2.516 -3.492 1.00 0.00 C ATOM 801 C VAL A 432 5.725 3.658 -2.853 1.00 0.00 C ATOM 802 O VAL A 432 5.928 4.696 -3.486 1.00 0.00 O ATOM 803 CB VAL A 432 5.769 1.773 -4.560 1.00 0.00 C ATOM 804 CG1 VAL A 432 7.057 1.189 -3.954 1.00 0.00 C ATOM 805 CG2 VAL A 432 4.959 0.619 -5.182 1.00 0.00 C ATOM 0 H VAL A 432 3.788 3.296 -5.063 1.00 0.00 H new ATOM 0 HA VAL A 432 4.672 1.762 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 432 6.028 2.503 -5.327 1.00 0.00 H new ATOM 0 HG11 VAL A 432 7.623 0.673 -4.730 1.00 0.00 H new ATOM 0 HG12 VAL A 432 7.662 1.995 -3.539 1.00 0.00 H new ATOM 0 HG13 VAL A 432 6.800 0.484 -3.163 1.00 0.00 H new ATOM 0 HG21 VAL A 432 5.567 0.110 -5.930 1.00 0.00 H new ATOM 0 HG22 VAL A 432 4.676 -0.088 -4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.061 1.018 -5.654 1.00 0.00 H new ATOM 815 N PHE A 433 6.132 3.497 -1.590 1.00 0.00 N ATOM 816 CA PHE A 433 6.838 4.538 -0.848 1.00 0.00 C ATOM 817 C PHE A 433 8.296 4.621 -1.324 1.00 0.00 C ATOM 818 O PHE A 433 9.043 3.639 -1.286 1.00 0.00 O ATOM 819 CB PHE A 433 6.706 4.291 0.659 1.00 0.00 C ATOM 820 CG PHE A 433 7.133 5.464 1.524 1.00 0.00 C ATOM 821 CD1 PHE A 433 8.501 5.698 1.753 1.00 0.00 C ATOM 822 CD2 PHE A 433 6.178 6.312 2.120 1.00 0.00 C ATOM 823 CE1 PHE A 433 8.916 6.747 2.592 1.00 0.00 C ATOM 824 CE2 PHE A 433 6.592 7.359 2.964 1.00 0.00 C ATOM 825 CZ PHE A 433 7.960 7.570 3.209 1.00 0.00 C ATOM 0 H PHE A 433 5.980 2.641 -1.057 1.00 0.00 H new ATOM 0 HA PHE A 433 6.387 5.511 -1.044 1.00 0.00 H new ATOM 0 HB2 PHE A 433 5.668 4.046 0.886 1.00 0.00 H new ATOM 0 HB3 PHE A 433 7.305 3.420 0.927 1.00 0.00 H new ATOM 0 HD1 PHE A 433 9.239 5.067 1.280 1.00 0.00 H new ATOM 0 HD2 PHE A 433 5.126 6.158 1.929 1.00 0.00 H new ATOM 0 HE1 PHE A 433 9.969 6.920 2.762 1.00 0.00 H new ATOM 0 HE2 PHE A 433 5.857 8.002 3.425 1.00 0.00 H new ATOM 0 HZ PHE A 433 8.275 8.363 3.870 1.00 0.00 H new ATOM 835 N ILE A 434 8.693 5.801 -1.803 1.00 0.00 N ATOM 836 CA ILE A 434 9.962 6.043 -2.507 1.00 0.00 C ATOM 837 C ILE A 434 10.669 7.258 -1.894 1.00 0.00 C ATOM 838 O ILE A 434 10.048 8.291 -1.647 1.00 0.00 O ATOM 839 CB ILE A 434 9.680 6.180 -4.028 1.00 0.00 C ATOM 840 CG1 ILE A 434 9.276 4.806 -4.618 1.00 0.00 C ATOM 841 CG2 ILE A 434 10.905 6.713 -4.789 1.00 0.00 C ATOM 842 CD1 ILE A 434 8.719 4.840 -6.041 1.00 0.00 C ATOM 0 H ILE A 434 8.125 6.644 -1.711 1.00 0.00 H new ATOM 0 HA ILE A 434 10.646 5.203 -2.388 1.00 0.00 H new ATOM 0 HB ILE A 434 8.865 6.894 -4.146 1.00 0.00 H new ATOM 0 HG12 ILE A 434 10.149 4.153 -4.603 1.00 0.00 H new ATOM 0 HG13 ILE A 434 8.529 4.355 -3.965 1.00 0.00 H new ATOM 0 HG21 ILE A 434 10.667 6.795 -5.850 1.00 0.00 H new ATOM 0 HG22 ILE A 434 11.175 7.695 -4.401 1.00 0.00 H new ATOM 0 HG23 ILE A 434 11.742 6.028 -4.656 1.00 0.00 H new ATOM 0 HD11 ILE A 434 8.468 3.828 -6.358 1.00 0.00 H new ATOM 0 HD12 ILE A 434 7.823 5.461 -6.066 1.00 0.00 H new ATOM 0 HD13 ILE A 434 9.468 5.256 -6.715 1.00 0.00 H new ATOM 952 N SER A 441 12.889 2.854 -4.045 1.00 0.00 N ATOM 953 CA SER A 441 11.798 2.213 -3.296 1.00 0.00 C ATOM 954 C SER A 441 12.289 1.682 -1.940 1.00 0.00 C ATOM 955 O SER A 441 13.364 1.085 -1.831 1.00 0.00 O ATOM 956 CB SER A 441 11.174 1.085 -4.126 1.00 0.00 C ATOM 957 OG SER A 441 10.249 0.331 -3.353 1.00 0.00 O ATOM 0 HA SER A 441 11.035 2.966 -3.100 1.00 0.00 H new ATOM 0 HB2 SER A 441 10.668 1.506 -4.995 1.00 0.00 H new ATOM 0 HB3 SER A 441 11.959 0.429 -4.501 1.00 0.00 H new ATOM 0 HG SER A 441 10.522 -0.610 -3.343 1.00 0.00 H new ATOM 963 N LYS A 442 11.474 1.864 -0.899 1.00 0.00 N ATOM 964 CA LYS A 442 11.731 1.328 0.441 1.00 0.00 C ATOM 965 C LYS A 442 11.208 -0.119 0.627 1.00 0.00 C ATOM 966 O LYS A 442 11.160 -0.625 1.750 1.00 0.00 O ATOM 967 CB LYS A 442 11.137 2.296 1.480 1.00 0.00 C ATOM 968 CG LYS A 442 11.693 3.732 1.450 1.00 0.00 C ATOM 969 CD LYS A 442 13.173 3.879 1.838 1.00 0.00 C ATOM 970 CE LYS A 442 13.524 3.368 3.248 1.00 0.00 C ATOM 971 NZ LYS A 442 12.712 3.997 4.326 1.00 0.00 N ATOM 0 H LYS A 442 10.605 2.395 -0.963 1.00 0.00 H new ATOM 0 HA LYS A 442 12.809 1.255 0.584 1.00 0.00 H new ATOM 0 HB2 LYS A 442 10.058 2.341 1.332 1.00 0.00 H new ATOM 0 HB3 LYS A 442 11.306 1.881 2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 442 11.557 4.134 0.446 1.00 0.00 H new ATOM 0 HG3 LYS A 442 11.096 4.348 2.123 1.00 0.00 H new ATOM 0 HD2 LYS A 442 13.780 3.341 1.110 1.00 0.00 H new ATOM 0 HD3 LYS A 442 13.450 4.931 1.769 1.00 0.00 H new ATOM 0 HE2 LYS A 442 13.382 2.288 3.280 1.00 0.00 H new ATOM 0 HE3 LYS A 442 14.580 3.557 3.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 12.998 3.609 5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 12.865 5.026 4.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 11.705 3.796 4.164 1.00 0.00 H new ATOM 985 N CYS A 443 10.741 -0.766 -0.453 1.00 0.00 N ATOM 986 CA CYS A 443 10.121 -2.106 -0.464 1.00 0.00 C ATOM 987 C CYS A 443 8.807 -2.194 0.350 1.00 0.00 C ATOM 988 O CYS A 443 8.324 -3.297 0.625 1.00 0.00 O ATOM 989 CB CYS A 443 11.159 -3.181 -0.080 1.00 0.00 C ATOM 990 SG CYS A 443 12.421 -3.298 -1.383 1.00 0.00 S ATOM 0 H CYS A 443 10.786 -0.353 -1.385 1.00 0.00 H new ATOM 0 HA CYS A 443 9.802 -2.307 -1.487 1.00 0.00 H new ATOM 0 HB2 CYS A 443 11.626 -2.927 0.872 1.00 0.00 H new ATOM 0 HB3 CYS A 443 10.668 -4.145 0.053 1.00 0.00 H new ATOM 0 HG CYS A 443 12.066 -4.197 -2.252 1.00 0.00 H new ATOM 996 N PHE A 444 8.210 -1.048 0.694 1.00 0.00 N ATOM 997 CA PHE A 444 6.868 -0.928 1.260 1.00 0.00 C ATOM 998 C PHE A 444 6.045 0.100 0.475 1.00 0.00 C ATOM 999 O PHE A 444 6.586 1.020 -0.139 1.00 0.00 O ATOM 1000 CB PHE A 444 6.900 -0.651 2.775 1.00 0.00 C ATOM 1001 CG PHE A 444 7.431 0.694 3.243 1.00 0.00 C ATOM 1002 CD1 PHE A 444 6.571 1.807 3.321 1.00 0.00 C ATOM 1003 CD2 PHE A 444 8.760 0.812 3.698 1.00 0.00 C ATOM 1004 CE1 PHE A 444 7.041 3.026 3.840 1.00 0.00 C ATOM 1005 CE2 PHE A 444 9.233 2.035 4.210 1.00 0.00 C ATOM 1006 CZ PHE A 444 8.372 3.145 4.278 1.00 0.00 C ATOM 0 H PHE A 444 8.669 -0.144 0.580 1.00 0.00 H new ATOM 0 HA PHE A 444 6.365 -1.889 1.155 1.00 0.00 H new ATOM 0 HB2 PHE A 444 5.885 -0.760 3.156 1.00 0.00 H new ATOM 0 HB3 PHE A 444 7.502 -1.429 3.244 1.00 0.00 H new ATOM 0 HD1 PHE A 444 5.549 1.724 2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 444 9.420 -0.042 3.653 1.00 0.00 H new ATOM 0 HE1 PHE A 444 6.377 3.875 3.903 1.00 0.00 H new ATOM 0 HE2 PHE A 444 10.255 2.121 4.550 1.00 0.00 H new ATOM 0 HZ PHE A 444 8.732 4.086 4.666 1.00 0.00 H new ATOM 1016 N GLY A 445 4.729 -0.096 0.462 1.00 0.00 N ATOM 1017 CA GLY A 445 3.750 0.689 -0.284 1.00 0.00 C ATOM 1018 C GLY A 445 2.347 0.573 0.301 1.00 0.00 C ATOM 1019 O GLY A 445 2.144 -0.010 1.369 1.00 0.00 O ATOM 0 H GLY A 445 4.294 -0.846 1.000 1.00 0.00 H new ATOM 0 HA2 GLY A 445 4.054 1.736 -0.288 1.00 0.00 H new ATOM 0 HA3 GLY A 445 3.737 0.357 -1.322 1.00 0.00 H new ATOM 1023 N PHE A 446 1.374 1.130 -0.414 1.00 0.00 N ATOM 1024 CA PHE A 446 0.014 1.323 0.070 1.00 0.00 C ATOM 1025 C PHE A 446 -1.034 1.169 -1.029 1.00 0.00 C ATOM 1026 O PHE A 446 -0.781 1.487 -2.191 1.00 0.00 O ATOM 1027 CB PHE A 446 -0.121 2.723 0.677 1.00 0.00 C ATOM 1028 CG PHE A 446 0.817 3.021 1.823 1.00 0.00 C ATOM 1029 CD1 PHE A 446 0.439 2.698 3.139 1.00 0.00 C ATOM 1030 CD2 PHE A 446 2.066 3.618 1.572 1.00 0.00 C ATOM 1031 CE1 PHE A 446 1.310 2.974 4.202 1.00 0.00 C ATOM 1032 CE2 PHE A 446 2.944 3.874 2.636 1.00 0.00 C ATOM 1033 CZ PHE A 446 2.563 3.555 3.947 1.00 0.00 C ATOM 0 H PHE A 446 1.514 1.467 -1.367 1.00 0.00 H new ATOM 0 HA PHE A 446 -0.167 0.549 0.816 1.00 0.00 H new ATOM 0 HB2 PHE A 446 0.046 3.460 -0.109 1.00 0.00 H new ATOM 0 HB3 PHE A 446 -1.146 2.854 1.024 1.00 0.00 H new ATOM 0 HD1 PHE A 446 -0.520 2.239 3.330 1.00 0.00 H new ATOM 0 HD2 PHE A 446 2.348 3.879 0.563 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.018 2.740 5.215 1.00 0.00 H new ATOM 0 HE2 PHE A 446 3.911 4.316 2.446 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.237 3.757 4.766 1.00 0.00 H new ATOM 1043 N VAL A 447 -2.233 0.750 -0.623 1.00 0.00 N ATOM 1044 CA VAL A 447 -3.426 0.656 -1.480 1.00 0.00 C ATOM 1045 C VAL A 447 -4.641 1.095 -0.663 1.00 0.00 C ATOM 1046 O VAL A 447 -4.842 0.616 0.449 1.00 0.00 O ATOM 1047 CB VAL A 447 -3.631 -0.774 -2.039 1.00 0.00 C ATOM 1048 CG1 VAL A 447 -4.915 -0.886 -2.881 1.00 0.00 C ATOM 1049 CG2 VAL A 447 -2.452 -1.213 -2.925 1.00 0.00 C ATOM 0 H VAL A 447 -2.411 0.457 0.338 1.00 0.00 H new ATOM 0 HA VAL A 447 -3.293 1.309 -2.343 1.00 0.00 H new ATOM 0 HB VAL A 447 -3.705 -1.422 -1.166 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -5.019 -1.905 -3.253 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -5.778 -0.635 -2.264 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -4.859 -0.197 -3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -2.633 -2.221 -3.298 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -2.354 -0.527 -3.766 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -1.533 -1.202 -2.339 1.00 0.00 H new ATOM 1059 N SER A 448 -5.448 2.002 -1.207 1.00 0.00 N ATOM 1060 CA SER A 448 -6.690 2.472 -0.583 1.00 0.00 C ATOM 1061 C SER A 448 -7.918 2.053 -1.395 1.00 0.00 C ATOM 1062 O SER A 448 -7.940 2.208 -2.616 1.00 0.00 O ATOM 1063 CB SER A 448 -6.677 3.996 -0.473 1.00 0.00 C ATOM 1064 OG SER A 448 -7.754 4.440 0.327 1.00 0.00 O ATOM 0 H SER A 448 -5.258 2.440 -2.108 1.00 0.00 H new ATOM 0 HA SER A 448 -6.749 2.020 0.407 1.00 0.00 H new ATOM 0 HB2 SER A 448 -5.733 4.328 -0.041 1.00 0.00 H new ATOM 0 HB3 SER A 448 -6.746 4.440 -1.466 1.00 0.00 H new ATOM 0 HG SER A 448 -7.548 4.278 1.271 1.00 0.00 H new ATOM 1070 N TYR A 449 -8.963 1.569 -0.724 1.00 0.00 N ATOM 1071 CA TYR A 449 -10.254 1.215 -1.320 1.00 0.00 C ATOM 1072 C TYR A 449 -11.365 2.216 -0.957 1.00 0.00 C ATOM 1073 O TYR A 449 -11.244 3.013 -0.024 1.00 0.00 O ATOM 1074 CB TYR A 449 -10.629 -0.208 -0.883 1.00 0.00 C ATOM 1075 CG TYR A 449 -9.761 -1.278 -1.512 1.00 0.00 C ATOM 1076 CD1 TYR A 449 -10.120 -1.823 -2.762 1.00 0.00 C ATOM 1077 CD2 TYR A 449 -8.587 -1.710 -0.867 1.00 0.00 C ATOM 1078 CE1 TYR A 449 -9.310 -2.800 -3.367 1.00 0.00 C ATOM 1079 CE2 TYR A 449 -7.779 -2.694 -1.464 1.00 0.00 C ATOM 1080 CZ TYR A 449 -8.137 -3.237 -2.716 1.00 0.00 C ATOM 1081 OH TYR A 449 -7.336 -4.166 -3.298 1.00 0.00 O ATOM 0 H TYR A 449 -8.935 1.407 0.283 1.00 0.00 H new ATOM 0 HA TYR A 449 -10.154 1.256 -2.405 1.00 0.00 H new ATOM 0 HB2 TYR A 449 -10.552 -0.279 0.202 1.00 0.00 H new ATOM 0 HB3 TYR A 449 -11.671 -0.397 -1.142 1.00 0.00 H new ATOM 0 HD1 TYR A 449 -11.020 -1.489 -3.256 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -8.307 -1.286 0.086 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -9.584 -3.214 -4.326 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -6.884 -3.034 -0.964 1.00 0.00 H new ATOM 0 HH TYR A 449 -7.523 -4.203 -4.259 1.00 0.00 H new ATOM 1091 N ASP A 450 -12.484 2.150 -1.681 1.00 0.00 N ATOM 1092 CA ASP A 450 -13.693 2.940 -1.396 1.00 0.00 C ATOM 1093 C ASP A 450 -14.484 2.419 -0.172 1.00 0.00 C ATOM 1094 O ASP A 450 -15.385 3.098 0.320 1.00 0.00 O ATOM 1095 CB ASP A 450 -14.552 2.958 -2.671 1.00 0.00 C ATOM 1096 CG ASP A 450 -15.768 3.895 -2.571 1.00 0.00 C ATOM 1097 OD1 ASP A 450 -15.571 5.128 -2.445 1.00 0.00 O ATOM 1098 OD2 ASP A 450 -16.916 3.397 -2.666 1.00 0.00 O ATOM 0 H ASP A 450 -12.582 1.540 -2.493 1.00 0.00 H new ATOM 0 HA ASP A 450 -13.401 3.954 -1.123 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -13.933 3.266 -3.514 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -14.898 1.946 -2.882 1.00 0.00 H new ATOM 1103 N ASN A 451 -14.133 1.233 0.347 1.00 0.00 N ATOM 1104 CA ASN A 451 -14.802 0.563 1.467 1.00 0.00 C ATOM 1105 C ASN A 451 -13.859 -0.450 2.168 1.00 0.00 C ATOM 1106 O ASN A 451 -12.874 -0.888 1.559 1.00 0.00 O ATOM 1107 CB ASN A 451 -16.086 -0.110 0.940 1.00 0.00 C ATOM 1108 CG ASN A 451 -15.777 -1.400 0.192 1.00 0.00 C ATOM 1109 OD1 ASN A 451 -15.578 -2.438 0.810 1.00 0.00 O ATOM 1110 ND2 ASN A 451 -15.664 -1.369 -1.120 1.00 0.00 N ATOM 0 H ASN A 451 -13.346 0.696 -0.017 1.00 0.00 H new ATOM 0 HA ASN A 451 -15.071 1.298 2.226 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -16.754 -0.324 1.774 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -16.612 0.578 0.278 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -15.409 -2.215 -1.630 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -15.832 -0.499 -1.626 1.00 0.00 H new ATOM 1117 N PRO A 452 -14.154 -0.866 3.417 1.00 0.00 N ATOM 1118 CA PRO A 452 -13.275 -1.740 4.189 1.00 0.00 C ATOM 1119 C PRO A 452 -13.408 -3.234 3.845 1.00 0.00 C ATOM 1120 O PRO A 452 -12.497 -3.994 4.163 1.00 0.00 O ATOM 1121 CB PRO A 452 -13.623 -1.459 5.652 1.00 0.00 C ATOM 1122 CG PRO A 452 -15.103 -1.100 5.600 1.00 0.00 C ATOM 1123 CD PRO A 452 -15.265 -0.409 4.246 1.00 0.00 C ATOM 0 HA PRO A 452 -12.232 -1.525 3.957 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -13.443 -2.330 6.282 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -13.025 -0.643 6.058 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -15.732 -1.987 5.674 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -15.384 -0.441 6.421 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -16.221 -0.666 3.790 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -15.246 0.675 4.358 1.00 0.00 H new ATOM 1131 N VAL A 453 -14.483 -3.674 3.174 1.00 0.00 N ATOM 1132 CA VAL A 453 -14.685 -5.090 2.808 1.00 0.00 C ATOM 1133 C VAL A 453 -13.758 -5.478 1.647 1.00 0.00 C ATOM 1134 O VAL A 453 -13.165 -6.552 1.676 1.00 0.00 O ATOM 1135 CB VAL A 453 -16.162 -5.402 2.457 1.00 0.00 C ATOM 1136 CG1 VAL A 453 -16.376 -6.897 2.161 1.00 0.00 C ATOM 1137 CG2 VAL A 453 -17.105 -4.993 3.604 1.00 0.00 C ATOM 0 H VAL A 453 -15.239 -3.061 2.868 1.00 0.00 H new ATOM 0 HA VAL A 453 -14.432 -5.691 3.682 1.00 0.00 H new ATOM 0 HB VAL A 453 -16.393 -4.823 1.563 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -17.424 -7.074 1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -15.754 -7.193 1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -16.102 -7.484 3.037 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -18.134 -5.224 3.329 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -16.839 -5.542 4.507 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -17.010 -3.923 3.789 1.00 0.00 H new ATOM 1147 N SER A 454 -13.557 -4.589 0.667 1.00 0.00 N ATOM 1148 CA SER A 454 -12.585 -4.791 -0.421 1.00 0.00 C ATOM 1149 C SER A 454 -11.139 -4.846 0.101 1.00 0.00 C ATOM 1150 O SER A 454 -10.361 -5.708 -0.309 1.00 0.00 O ATOM 1151 CB SER A 454 -12.725 -3.667 -1.456 1.00 0.00 C ATOM 1152 OG SER A 454 -14.024 -3.643 -2.038 1.00 0.00 O ATOM 0 H SER A 454 -14.064 -3.706 0.604 1.00 0.00 H new ATOM 0 HA SER A 454 -12.803 -5.752 -0.886 1.00 0.00 H new ATOM 0 HB2 SER A 454 -12.522 -2.708 -0.980 1.00 0.00 H new ATOM 0 HB3 SER A 454 -11.978 -3.799 -2.239 1.00 0.00 H new ATOM 0 HG SER A 454 -14.031 -3.024 -2.798 1.00 0.00 H new ATOM 1158 N ALA A 455 -10.797 -3.990 1.073 1.00 0.00 N ATOM 1159 CA ALA A 455 -9.501 -4.008 1.751 1.00 0.00 C ATOM 1160 C ALA A 455 -9.278 -5.308 2.549 1.00 0.00 C ATOM 1161 O ALA A 455 -8.244 -5.956 2.397 1.00 0.00 O ATOM 1162 CB ALA A 455 -9.422 -2.754 2.630 1.00 0.00 C ATOM 0 H ALA A 455 -11.422 -3.259 1.412 1.00 0.00 H new ATOM 0 HA ALA A 455 -8.695 -3.993 1.018 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -8.465 -2.735 3.152 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -9.512 -1.865 2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -10.233 -2.769 3.359 1.00 0.00 H new ATOM 1168 N GLN A 456 -10.259 -5.740 3.346 1.00 0.00 N ATOM 1169 CA GLN A 456 -10.213 -7.010 4.082 1.00 0.00 C ATOM 1170 C GLN A 456 -10.074 -8.229 3.158 1.00 0.00 C ATOM 1171 O GLN A 456 -9.273 -9.126 3.428 1.00 0.00 O ATOM 1172 CB GLN A 456 -11.485 -7.139 4.937 1.00 0.00 C ATOM 1173 CG GLN A 456 -11.427 -6.333 6.249 1.00 0.00 C ATOM 1174 CD GLN A 456 -10.457 -6.888 7.302 1.00 0.00 C ATOM 1175 OE1 GLN A 456 -9.741 -7.862 7.105 1.00 0.00 O ATOM 1176 NE2 GLN A 456 -10.397 -6.286 8.471 1.00 0.00 N ATOM 0 H GLN A 456 -11.118 -5.213 3.501 1.00 0.00 H new ATOM 0 HA GLN A 456 -9.325 -6.995 4.714 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -12.342 -6.805 4.352 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -11.650 -8.190 5.173 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -11.141 -5.307 6.017 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -12.427 -6.295 6.681 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.984 -5.473 8.657 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.763 -6.632 9.191 1.00 0.00 H new ATOM 1185 N ALA A 457 -10.821 -8.266 2.053 1.00 0.00 N ATOM 1186 CA ALA A 457 -10.705 -9.306 1.026 1.00 0.00 C ATOM 1187 C ALA A 457 -9.312 -9.332 0.370 1.00 0.00 C ATOM 1188 O ALA A 457 -8.789 -10.411 0.084 1.00 0.00 O ATOM 1189 CB ALA A 457 -11.813 -9.093 -0.014 1.00 0.00 C ATOM 0 H ALA A 457 -11.533 -7.566 1.842 1.00 0.00 H new ATOM 0 HA ALA A 457 -10.826 -10.281 1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -11.740 -9.860 -0.786 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -12.786 -9.159 0.472 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -11.701 -8.109 -0.469 1.00 0.00 H new ATOM 1195 N ALA A 458 -8.676 -8.170 0.191 1.00 0.00 N ATOM 1196 CA ALA A 458 -7.319 -8.072 -0.333 1.00 0.00 C ATOM 1197 C ALA A 458 -6.262 -8.541 0.681 1.00 0.00 C ATOM 1198 O ALA A 458 -5.334 -9.238 0.283 1.00 0.00 O ATOM 1199 CB ALA A 458 -7.076 -6.638 -0.805 1.00 0.00 C ATOM 0 H ALA A 458 -9.096 -7.266 0.409 1.00 0.00 H new ATOM 0 HA ALA A 458 -7.218 -8.748 -1.182 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -6.064 -6.551 -1.200 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -7.793 -6.386 -1.586 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -7.198 -5.953 0.034 1.00 0.00 H new ATOM 1205 N ILE A 459 -6.417 -8.273 1.987 1.00 0.00 N ATOM 1206 CA ILE A 459 -5.535 -8.833 3.039 1.00 0.00 C ATOM 1207 C ILE A 459 -5.574 -10.362 2.993 1.00 0.00 C ATOM 1208 O ILE A 459 -4.532 -11.015 2.962 1.00 0.00 O ATOM 1209 CB ILE A 459 -5.930 -8.318 4.449 1.00 0.00 C ATOM 1210 CG1 ILE A 459 -5.705 -6.797 4.553 1.00 0.00 C ATOM 1211 CG2 ILE A 459 -5.132 -9.049 5.552 1.00 0.00 C ATOM 1212 CD1 ILE A 459 -6.269 -6.170 5.837 1.00 0.00 C ATOM 0 H ILE A 459 -7.152 -7.665 2.349 1.00 0.00 H new ATOM 0 HA ILE A 459 -4.517 -8.496 2.843 1.00 0.00 H new ATOM 0 HB ILE A 459 -6.989 -8.528 4.596 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -4.635 -6.594 4.501 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.164 -6.312 3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -5.429 -8.668 6.529 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -5.337 -10.118 5.502 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -4.066 -8.877 5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.071 -5.098 5.836 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.345 -6.340 5.883 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -5.792 -6.626 6.705 1.00 0.00 H new ATOM 1224 N GLN A 460 -6.784 -10.917 2.933 1.00 0.00 N ATOM 1225 CA GLN A 460 -7.035 -12.358 2.889 1.00 0.00 C ATOM 1226 C GLN A 460 -6.522 -13.024 1.598 1.00 0.00 C ATOM 1227 O GLN A 460 -6.295 -14.234 1.586 1.00 0.00 O ATOM 1228 CB GLN A 460 -8.545 -12.573 3.061 1.00 0.00 C ATOM 1229 CG GLN A 460 -8.995 -12.344 4.514 1.00 0.00 C ATOM 1230 CD GLN A 460 -10.519 -12.318 4.633 1.00 0.00 C ATOM 1231 OE1 GLN A 460 -11.170 -13.302 4.964 1.00 0.00 O ATOM 1232 NE2 GLN A 460 -11.141 -11.192 4.354 1.00 0.00 N ATOM 0 H GLN A 460 -7.640 -10.362 2.913 1.00 0.00 H new ATOM 0 HA GLN A 460 -6.479 -12.836 3.696 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.086 -11.894 2.402 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -8.804 -13.587 2.756 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.593 -13.134 5.149 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -8.585 -11.402 4.879 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.606 -10.369 4.078 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.158 -11.143 4.414 1.00 0.00 H new ATOM 1241 N SER A 461 -6.301 -12.260 0.526 1.00 0.00 N ATOM 1242 CA SER A 461 -5.789 -12.755 -0.755 1.00 0.00 C ATOM 1243 C SER A 461 -4.283 -12.510 -0.972 1.00 0.00 C ATOM 1244 O SER A 461 -3.657 -13.246 -1.739 1.00 0.00 O ATOM 1245 CB SER A 461 -6.574 -12.082 -1.887 1.00 0.00 C ATOM 1246 OG SER A 461 -7.963 -12.378 -1.821 1.00 0.00 O ATOM 0 H SER A 461 -6.477 -11.255 0.524 1.00 0.00 H new ATOM 0 HA SER A 461 -5.923 -13.837 -0.749 1.00 0.00 H new ATOM 0 HB2 SER A 461 -6.430 -11.003 -1.836 1.00 0.00 H new ATOM 0 HB3 SER A 461 -6.178 -12.411 -2.848 1.00 0.00 H new ATOM 0 HG SER A 461 -8.395 -11.780 -1.176 1.00 0.00 H new ATOM 1252 N MET A 462 -3.688 -11.512 -0.298 1.00 0.00 N ATOM 1253 CA MET A 462 -2.328 -11.017 -0.580 1.00 0.00 C ATOM 1254 C MET A 462 -1.330 -11.139 0.575 1.00 0.00 C ATOM 1255 O MET A 462 -0.125 -11.095 0.327 1.00 0.00 O ATOM 1256 CB MET A 462 -2.393 -9.552 -1.049 1.00 0.00 C ATOM 1257 CG MET A 462 -3.200 -9.382 -2.344 1.00 0.00 C ATOM 1258 SD MET A 462 -2.626 -10.350 -3.767 1.00 0.00 S ATOM 1259 CE MET A 462 -0.964 -9.666 -3.915 1.00 0.00 C ATOM 0 H MET A 462 -4.144 -11.018 0.469 1.00 0.00 H new ATOM 0 HA MET A 462 -1.946 -11.672 -1.363 1.00 0.00 H new ATOM 0 HB2 MET A 462 -2.840 -8.943 -0.264 1.00 0.00 H new ATOM 0 HB3 MET A 462 -1.381 -9.179 -1.204 1.00 0.00 H new ATOM 0 HG2 MET A 462 -4.237 -9.650 -2.141 1.00 0.00 H new ATOM 0 HG3 MET A 462 -3.191 -8.327 -2.619 1.00 0.00 H new ATOM 0 HE1 MET A 462 -0.565 -9.889 -4.905 1.00 0.00 H new ATOM 0 HE2 MET A 462 -1.001 -8.586 -3.774 1.00 0.00 H new ATOM 0 HE3 MET A 462 -0.319 -10.109 -3.156 1.00 0.00 H new ATOM 1269 N ASN A 463 -1.774 -11.332 1.820 1.00 0.00 N ATOM 1270 CA ASN A 463 -0.854 -11.580 2.930 1.00 0.00 C ATOM 1271 C ASN A 463 -0.228 -12.985 2.798 1.00 0.00 C ATOM 1272 O ASN A 463 -0.921 -14.000 2.900 1.00 0.00 O ATOM 1273 CB ASN A 463 -1.572 -11.366 4.272 1.00 0.00 C ATOM 1274 CG ASN A 463 -0.580 -11.317 5.427 1.00 0.00 C ATOM 1275 OD1 ASN A 463 0.388 -10.565 5.398 1.00 0.00 O ATOM 1276 ND2 ASN A 463 -0.776 -12.112 6.463 1.00 0.00 N ATOM 0 H ASN A 463 -2.760 -11.321 2.082 1.00 0.00 H new ATOM 0 HA ASN A 463 -0.032 -10.865 2.896 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -2.141 -10.437 4.239 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -2.287 -12.172 4.437 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -0.120 -12.102 7.244 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -1.583 -12.736 6.482 1.00 0.00 H new ATOM 1283 N GLY A 464 1.080 -13.035 2.528 1.00 0.00 N ATOM 1284 CA GLY A 464 1.850 -14.242 2.193 1.00 0.00 C ATOM 1285 C GLY A 464 2.021 -14.492 0.688 1.00 0.00 C ATOM 1286 O GLY A 464 2.537 -15.549 0.324 1.00 0.00 O ATOM 0 H GLY A 464 1.660 -12.196 2.537 1.00 0.00 H new ATOM 0 HA2 GLY A 464 2.837 -14.166 2.650 1.00 0.00 H new ATOM 0 HA3 GLY A 464 1.358 -15.107 2.638 1.00 0.00 H new ATOM 1290 N PHE A 465 1.628 -13.556 -0.191 1.00 0.00 N ATOM 1291 CA PHE A 465 1.822 -13.669 -1.645 1.00 0.00 C ATOM 1292 C PHE A 465 3.317 -13.753 -1.981 1.00 0.00 C ATOM 1293 O PHE A 465 4.076 -12.850 -1.624 1.00 0.00 O ATOM 1294 CB PHE A 465 1.174 -12.463 -2.342 1.00 0.00 C ATOM 1295 CG PHE A 465 1.209 -12.502 -3.861 1.00 0.00 C ATOM 1296 CD1 PHE A 465 2.322 -12.010 -4.580 1.00 0.00 C ATOM 1297 CD2 PHE A 465 0.105 -13.020 -4.565 1.00 0.00 C ATOM 1298 CE1 PHE A 465 2.323 -12.042 -5.986 1.00 0.00 C ATOM 1299 CE2 PHE A 465 0.106 -13.046 -5.971 1.00 0.00 C ATOM 1300 CZ PHE A 465 1.216 -12.557 -6.682 1.00 0.00 C ATOM 0 H PHE A 465 1.163 -12.693 0.090 1.00 0.00 H new ATOM 0 HA PHE A 465 1.346 -14.582 -2.002 1.00 0.00 H new ATOM 0 HB2 PHE A 465 0.135 -12.391 -2.020 1.00 0.00 H new ATOM 0 HB3 PHE A 465 1.676 -11.556 -2.005 1.00 0.00 H new ATOM 0 HD1 PHE A 465 3.173 -11.609 -4.049 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -0.748 -13.400 -4.022 1.00 0.00 H new ATOM 0 HE1 PHE A 465 3.177 -11.670 -6.532 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -0.746 -13.441 -6.505 1.00 0.00 H new ATOM 0 HZ PHE A 465 1.218 -12.577 -7.762 1.00 0.00 H new ATOM 1310 N GLN A 466 3.752 -14.823 -2.651 1.00 0.00 N ATOM 1311 CA GLN A 466 5.161 -15.020 -2.990 1.00 0.00 C ATOM 1312 C GLN A 466 5.508 -14.324 -4.313 1.00 0.00 C ATOM 1313 O GLN A 466 4.823 -14.500 -5.322 1.00 0.00 O ATOM 1314 CB GLN A 466 5.502 -16.521 -2.999 1.00 0.00 C ATOM 1315 CG GLN A 466 7.026 -16.744 -3.068 1.00 0.00 C ATOM 1316 CD GLN A 466 7.439 -18.194 -2.813 1.00 0.00 C ATOM 1317 OE1 GLN A 466 7.020 -18.829 -1.849 1.00 0.00 O ATOM 1318 NE2 GLN A 466 8.296 -18.767 -3.635 1.00 0.00 N ATOM 0 H GLN A 466 3.140 -15.573 -2.972 1.00 0.00 H new ATOM 0 HA GLN A 466 5.782 -14.554 -2.224 1.00 0.00 H new ATOM 0 HB2 GLN A 466 5.103 -16.993 -2.101 1.00 0.00 H new ATOM 0 HB3 GLN A 466 5.022 -17.001 -3.852 1.00 0.00 H new ATOM 0 HG2 GLN A 466 7.386 -16.439 -4.050 1.00 0.00 H new ATOM 0 HG3 GLN A 466 7.514 -16.101 -2.335 1.00 0.00 H new ATOM 0 HE21 GLN A 466 8.653 -18.252 -4.440 1.00 0.00 H new ATOM 0 HE22 GLN A 466 8.602 -19.725 -3.466 1.00 0.00 H new ATOM 1327 N ILE A 467 6.592 -13.545 -4.308 1.00 0.00 N ATOM 1328 CA ILE A 467 7.067 -12.754 -5.448 1.00 0.00 C ATOM 1329 C ILE A 467 8.604 -12.731 -5.462 1.00 0.00 C ATOM 1330 O ILE A 467 9.244 -12.473 -4.439 1.00 0.00 O ATOM 1331 CB ILE A 467 6.396 -11.355 -5.417 1.00 0.00 C ATOM 1332 CG1 ILE A 467 6.499 -10.699 -6.806 1.00 0.00 C ATOM 1333 CG2 ILE A 467 6.919 -10.447 -4.288 1.00 0.00 C ATOM 1334 CD1 ILE A 467 5.727 -9.383 -6.943 1.00 0.00 C ATOM 0 H ILE A 467 7.184 -13.443 -3.483 1.00 0.00 H new ATOM 0 HA ILE A 467 6.774 -13.207 -6.395 1.00 0.00 H new ATOM 0 HB ILE A 467 5.342 -11.498 -5.179 1.00 0.00 H new ATOM 0 HG12 ILE A 467 7.550 -10.515 -7.030 1.00 0.00 H new ATOM 0 HG13 ILE A 467 6.132 -11.401 -7.554 1.00 0.00 H new ATOM 0 HG21 ILE A 467 6.406 -9.486 -4.327 1.00 0.00 H new ATOM 0 HG22 ILE A 467 6.731 -10.920 -3.324 1.00 0.00 H new ATOM 0 HG23 ILE A 467 7.991 -10.292 -4.413 1.00 0.00 H new ATOM 0 HD11 ILE A 467 5.854 -8.990 -7.952 1.00 0.00 H new ATOM 0 HD12 ILE A 467 4.668 -9.561 -6.753 1.00 0.00 H new ATOM 0 HD13 ILE A 467 6.109 -8.661 -6.221 1.00 0.00 H new ATOM 1346 N GLY A 468 9.211 -13.093 -6.598 1.00 0.00 N ATOM 1347 CA GLY A 468 10.657 -13.328 -6.698 1.00 0.00 C ATOM 1348 C GLY A 468 11.064 -14.552 -5.871 1.00 0.00 C ATOM 1349 O GLY A 468 10.826 -15.689 -6.280 1.00 0.00 O ATOM 0 H GLY A 468 8.712 -13.232 -7.477 1.00 0.00 H new ATOM 0 HA2 GLY A 468 10.935 -13.479 -7.741 1.00 0.00 H new ATOM 0 HA3 GLY A 468 11.199 -12.449 -6.348 1.00 0.00 H new ATOM 1353 N MET A 469 11.654 -14.303 -4.697 1.00 0.00 N ATOM 1354 CA MET A 469 12.130 -15.311 -3.733 1.00 0.00 C ATOM 1355 C MET A 469 11.686 -14.994 -2.286 1.00 0.00 C ATOM 1356 O MET A 469 12.261 -15.510 -1.325 1.00 0.00 O ATOM 1357 CB MET A 469 13.665 -15.462 -3.834 1.00 0.00 C ATOM 1358 CG MET A 469 14.182 -15.843 -5.231 1.00 0.00 C ATOM 1359 SD MET A 469 14.444 -14.462 -6.380 1.00 0.00 S ATOM 1360 CE MET A 469 14.949 -15.408 -7.838 1.00 0.00 C ATOM 0 H MET A 469 11.822 -13.350 -4.374 1.00 0.00 H new ATOM 0 HA MET A 469 11.669 -16.264 -3.993 1.00 0.00 H new ATOM 0 HB2 MET A 469 14.129 -14.523 -3.533 1.00 0.00 H new ATOM 0 HB3 MET A 469 13.990 -16.221 -3.122 1.00 0.00 H new ATOM 0 HG2 MET A 469 15.124 -16.379 -5.115 1.00 0.00 H new ATOM 0 HG3 MET A 469 13.474 -16.538 -5.683 1.00 0.00 H new ATOM 0 HE1 MET A 469 15.156 -14.724 -8.661 1.00 0.00 H new ATOM 0 HE2 MET A 469 15.847 -15.981 -7.607 1.00 0.00 H new ATOM 0 HE3 MET A 469 14.148 -16.089 -8.125 1.00 0.00 H new ATOM 1370 N LYS A 470 10.671 -14.137 -2.117 1.00 0.00 N ATOM 1371 CA LYS A 470 10.186 -13.617 -0.825 1.00 0.00 C ATOM 1372 C LYS A 470 8.651 -13.469 -0.788 1.00 0.00 C ATOM 1373 O LYS A 470 7.993 -13.573 -1.825 1.00 0.00 O ATOM 1374 CB LYS A 470 10.940 -12.318 -0.486 1.00 0.00 C ATOM 1375 CG LYS A 470 10.776 -11.192 -1.521 1.00 0.00 C ATOM 1376 CD LYS A 470 11.598 -9.987 -1.061 1.00 0.00 C ATOM 1377 CE LYS A 470 11.483 -8.831 -2.064 1.00 0.00 C ATOM 1378 NZ LYS A 470 12.180 -7.610 -1.579 1.00 0.00 N ATOM 0 H LYS A 470 10.141 -13.770 -2.907 1.00 0.00 H new ATOM 0 HA LYS A 470 10.405 -14.344 -0.043 1.00 0.00 H new ATOM 0 HB2 LYS A 470 10.595 -11.956 0.483 1.00 0.00 H new ATOM 0 HB3 LYS A 470 12.001 -12.546 -0.382 1.00 0.00 H new ATOM 0 HG2 LYS A 470 11.112 -11.527 -2.502 1.00 0.00 H new ATOM 0 HG3 LYS A 470 9.726 -10.918 -1.620 1.00 0.00 H new ATOM 0 HD2 LYS A 470 11.253 -9.659 -0.081 1.00 0.00 H new ATOM 0 HD3 LYS A 470 12.643 -10.275 -0.951 1.00 0.00 H new ATOM 0 HE2 LYS A 470 11.907 -9.136 -3.021 1.00 0.00 H new ATOM 0 HE3 LYS A 470 10.431 -8.604 -2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 11.628 -6.768 -1.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 12.277 -7.653 -0.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 13.124 -7.553 -2.013 1.00 0.00 H new ATOM 1392 N ARG A 471 8.062 -13.255 0.398 1.00 0.00 N ATOM 1393 CA ARG A 471 6.601 -13.195 0.598 1.00 0.00 C ATOM 1394 C ARG A 471 6.152 -11.850 1.174 1.00 0.00 C ATOM 1395 O ARG A 471 6.740 -11.349 2.133 1.00 0.00 O ATOM 1396 CB ARG A 471 6.116 -14.363 1.477 1.00 0.00 C ATOM 1397 CG ARG A 471 6.306 -15.711 0.767 1.00 0.00 C ATOM 1398 CD ARG A 471 5.603 -16.867 1.484 1.00 0.00 C ATOM 1399 NE ARG A 471 5.810 -18.122 0.743 1.00 0.00 N ATOM 1400 CZ ARG A 471 5.319 -19.319 1.028 1.00 0.00 C ATOM 1401 NH1 ARG A 471 4.579 -19.547 2.095 1.00 0.00 N ATOM 1402 NH2 ARG A 471 5.583 -20.311 0.208 1.00 0.00 N ATOM 0 H ARG A 471 8.592 -13.117 1.259 1.00 0.00 H new ATOM 0 HA ARG A 471 6.139 -13.292 -0.384 1.00 0.00 H new ATOM 0 HB2 ARG A 471 6.665 -14.365 2.419 1.00 0.00 H new ATOM 0 HB3 ARG A 471 5.063 -14.224 1.722 1.00 0.00 H new ATOM 0 HG2 ARG A 471 5.925 -15.636 -0.251 1.00 0.00 H new ATOM 0 HG3 ARG A 471 7.371 -15.930 0.693 1.00 0.00 H new ATOM 0 HD2 ARG A 471 5.991 -16.966 2.498 1.00 0.00 H new ATOM 0 HD3 ARG A 471 4.537 -16.658 1.570 1.00 0.00 H new ATOM 0 HE ARG A 471 6.400 -18.063 -0.087 1.00 0.00 H new ATOM 0 HH11 ARG A 471 4.364 -18.786 2.739 1.00 0.00 H new ATOM 0 HH12 ARG A 471 4.221 -20.485 2.276 1.00 0.00 H new ATOM 0 HH21 ARG A 471 6.153 -20.148 -0.622 1.00 0.00 H new ATOM 0 HH22 ARG A 471 5.218 -21.244 0.402 1.00 0.00 H new ATOM 1416 N LEU A 472 5.101 -11.277 0.580 1.00 0.00 N ATOM 1417 CA LEU A 472 4.529 -9.984 0.964 1.00 0.00 C ATOM 1418 C LEU A 472 3.799 -10.060 2.306 1.00 0.00 C ATOM 1419 O LEU A 472 2.973 -10.945 2.519 1.00 0.00 O ATOM 1420 CB LEU A 472 3.559 -9.485 -0.127 1.00 0.00 C ATOM 1421 CG LEU A 472 4.172 -9.263 -1.524 1.00 0.00 C ATOM 1422 CD1 LEU A 472 3.112 -8.673 -2.464 1.00 0.00 C ATOM 1423 CD2 LEU A 472 5.389 -8.332 -1.470 1.00 0.00 C ATOM 0 H LEU A 472 4.612 -11.712 -0.202 1.00 0.00 H new ATOM 0 HA LEU A 472 5.355 -9.281 1.070 1.00 0.00 H new ATOM 0 HB2 LEU A 472 2.745 -10.204 -0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 472 3.118 -8.546 0.208 1.00 0.00 H new ATOM 0 HG LEU A 472 4.508 -10.230 -1.899 1.00 0.00 H new ATOM 0 HD11 LEU A 472 3.547 -8.517 -3.451 1.00 0.00 H new ATOM 0 HD12 LEU A 472 2.272 -9.363 -2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 472 2.763 -7.720 -2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 472 5.792 -8.201 -2.474 1.00 0.00 H new ATOM 0 HD22 LEU A 472 5.089 -7.363 -1.070 1.00 0.00 H new ATOM 0 HD23 LEU A 472 6.153 -8.769 -0.827 1.00 0.00 H new ATOM 1435 N LYS A 473 4.061 -9.099 3.191 1.00 0.00 N ATOM 1436 CA LYS A 473 3.279 -8.883 4.412 1.00 0.00 C ATOM 1437 C LYS A 473 2.266 -7.754 4.147 1.00 0.00 C ATOM 1438 O LYS A 473 2.643 -6.700 3.630 1.00 0.00 O ATOM 1439 CB LYS A 473 4.232 -8.605 5.591 1.00 0.00 C ATOM 1440 CG LYS A 473 3.455 -8.564 6.922 1.00 0.00 C ATOM 1441 CD LYS A 473 4.342 -8.628 8.175 1.00 0.00 C ATOM 1442 CE LYS A 473 5.233 -7.389 8.341 1.00 0.00 C ATOM 1443 NZ LYS A 473 5.973 -7.411 9.631 1.00 0.00 N ATOM 0 H LYS A 473 4.831 -8.439 3.081 1.00 0.00 H new ATOM 0 HA LYS A 473 2.708 -9.769 4.690 1.00 0.00 H new ATOM 0 HB2 LYS A 473 4.999 -9.378 5.635 1.00 0.00 H new ATOM 0 HB3 LYS A 473 4.745 -7.656 5.434 1.00 0.00 H new ATOM 0 HG2 LYS A 473 2.864 -7.649 6.956 1.00 0.00 H new ATOM 0 HG3 LYS A 473 2.753 -9.398 6.945 1.00 0.00 H new ATOM 0 HD2 LYS A 473 3.710 -8.735 9.056 1.00 0.00 H new ATOM 0 HD3 LYS A 473 4.971 -9.517 8.124 1.00 0.00 H new ATOM 0 HE2 LYS A 473 5.943 -7.338 7.515 1.00 0.00 H new ATOM 0 HE3 LYS A 473 4.619 -6.490 8.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 6.564 -6.558 9.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 5.295 -7.434 10.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 6.578 -8.256 9.670 1.00 0.00 H new ATOM 1457 N VAL A 474 0.985 -7.977 4.451 1.00 0.00 N ATOM 1458 CA VAL A 474 -0.124 -7.070 4.098 1.00 0.00 C ATOM 1459 C VAL A 474 -1.128 -7.001 5.248 1.00 0.00 C ATOM 1460 O VAL A 474 -1.559 -8.038 5.749 1.00 0.00 O ATOM 1461 CB VAL A 474 -0.848 -7.486 2.791 1.00 0.00 C ATOM 1462 CG1 VAL A 474 -1.878 -6.417 2.381 1.00 0.00 C ATOM 1463 CG2 VAL A 474 0.127 -7.702 1.621 1.00 0.00 C ATOM 0 H VAL A 474 0.678 -8.807 4.959 1.00 0.00 H new ATOM 0 HA VAL A 474 0.313 -6.087 3.923 1.00 0.00 H new ATOM 0 HB VAL A 474 -1.345 -8.432 3.003 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -2.376 -6.725 1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -2.617 -6.301 3.173 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -1.370 -5.467 2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -0.431 -7.992 0.731 1.00 0.00 H new ATOM 0 HG22 VAL A 474 0.670 -6.777 1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 474 0.835 -8.490 1.878 1.00 0.00 H new ATOM 1473 N GLN A 475 -1.503 -5.784 5.650 1.00 0.00 N ATOM 1474 CA GLN A 475 -2.448 -5.522 6.741 1.00 0.00 C ATOM 1475 C GLN A 475 -3.003 -4.088 6.681 1.00 0.00 C ATOM 1476 O GLN A 475 -2.566 -3.275 5.862 1.00 0.00 O ATOM 1477 CB GLN A 475 -1.810 -5.859 8.108 1.00 0.00 C ATOM 1478 CG GLN A 475 -0.554 -5.044 8.482 1.00 0.00 C ATOM 1479 CD GLN A 475 0.037 -5.460 9.838 1.00 0.00 C ATOM 1480 OE1 GLN A 475 -0.385 -6.414 10.483 1.00 0.00 O ATOM 1481 NE2 GLN A 475 1.042 -4.776 10.345 1.00 0.00 N ATOM 0 H GLN A 475 -1.150 -4.932 5.216 1.00 0.00 H new ATOM 0 HA GLN A 475 -3.306 -6.182 6.616 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -2.561 -5.711 8.884 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -1.549 -6.917 8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 475 0.201 -5.171 7.706 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -0.808 -3.984 8.510 1.00 0.00 H new ATOM 0 HE21 GLN A 475 1.421 -3.976 9.839 1.00 0.00 H new ATOM 0 HE22 GLN A 475 1.441 -5.047 11.244 1.00 0.00 H new ATOM 1490 N LEU A 476 -3.968 -3.775 7.554 1.00 0.00 N ATOM 1491 CA LEU A 476 -4.526 -2.427 7.709 1.00 0.00 C ATOM 1492 C LEU A 476 -3.440 -1.421 8.130 1.00 0.00 C ATOM 1493 O LEU A 476 -2.537 -1.740 8.909 1.00 0.00 O ATOM 1494 CB LEU A 476 -5.665 -2.446 8.750 1.00 0.00 C ATOM 1495 CG LEU A 476 -6.893 -3.317 8.406 1.00 0.00 C ATOM 1496 CD1 LEU A 476 -7.882 -3.286 9.579 1.00 0.00 C ATOM 1497 CD2 LEU A 476 -7.608 -2.839 7.134 1.00 0.00 C ATOM 0 H LEU A 476 -4.389 -4.461 8.181 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.924 -2.110 6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -5.255 -2.792 9.699 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -6.005 -1.422 8.904 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.536 -4.331 8.226 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -8.750 -3.900 9.339 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -7.397 -3.676 10.474 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -8.202 -2.260 9.758 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -8.464 -3.483 6.934 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -7.950 -1.813 7.272 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.918 -2.881 6.291 1.00 0.00 H new ATOM 1509 N LYS A 477 -3.543 -0.186 7.635 1.00 0.00 N ATOM 1510 CA LYS A 477 -2.616 0.899 7.979 1.00 0.00 C ATOM 1511 C LYS A 477 -2.668 1.268 9.481 1.00 0.00 C ATOM 1512 O LYS A 477 -3.735 1.186 10.103 1.00 0.00 O ATOM 1513 CB LYS A 477 -2.924 2.124 7.094 1.00 0.00 C ATOM 1514 CG LYS A 477 -1.646 2.941 6.864 1.00 0.00 C ATOM 1515 CD LYS A 477 -1.878 4.348 6.322 1.00 0.00 C ATOM 1516 CE LYS A 477 -2.370 5.286 7.432 1.00 0.00 C ATOM 1517 NZ LYS A 477 -1.799 6.644 7.281 1.00 0.00 N ATOM 0 H LYS A 477 -4.274 0.093 6.981 1.00 0.00 H new ATOM 0 HA LYS A 477 -1.600 0.554 7.788 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -3.334 1.798 6.138 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -3.682 2.746 7.571 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -1.103 3.014 7.806 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -1.005 2.399 6.168 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.953 4.736 5.896 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -2.611 4.316 5.516 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -3.458 5.342 7.408 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -2.093 4.879 8.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -2.024 7.211 8.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -0.767 6.577 7.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -2.204 7.099 6.438 1.00 0.00 H new