USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1033 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 497 CYS SG : rot -113:sc= -0.101 USER MOD Set 1.2: A 499 HIS : no HE2:sc= 1.14 K(o=1,f=-6.8!) USER MOD Set 2.1: A 398 LYS NZ :NH3+ 180:sc= 0.885 (180deg=0) USER MOD Set 2.2: A 472 GLN : amide:sc= -0.353 K(o=0.53,f=-4.6!) USER MOD Set 3.1: A 430 GLN : amide:sc=-0.00714 K(o=-0.072,f=-1.6) USER MOD Set 3.2: A 432 TYR OH : rot 180:sc= 0 USER MOD Set 3.3: A 474 HIS : no HD1:sc= -0.0645 X(o=-0.072,f=-0.46) USER MOD Set 4.1: A 409 GLN :FLIP amide:sc= 0.829 F(o=-2.3!,f=1.8) USER MOD Set 4.2: A 424 THR OG1 : rot -57:sc= 0.997 USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 429 CYS SG : rot 36:sc= -4.2! USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 438 ASN : amide:sc= -0.0351 K(o=-0.035,f=-0.61) USER MOD Single : A 440 LYS NZ :NH3+ -164:sc= -0.0368 (180deg=-0.303) USER MOD Single : A 441 THR OG1 : rot 115:sc= -0.12 USER MOD Single : A 443 GLN : amide:sc= -0.0774 X(o=-0.077,f=0) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 447 LYS NZ :NH3+ 171:sc= 0.354 (180deg=0.193) USER MOD Single : A 450 MET CE :methyl 169:sc= -0.316 (180deg=-0.565) USER MOD Single : A 451 GLN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 455 GLN : amide:sc= -0.757 X(o=-0.76,f=-0.45) USER MOD Single : A 456 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 459 THR OG1 : rot -82:sc= 0.952 USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.65) USER MOD Single : A 468 SER OG : rot -69:sc= -1 USER MOD Single : A 470 MET CE :methyl -173:sc= 0 (180deg=-0.0942) USER MOD Single : A 476 THR OG1 : rot -22:sc= 0.784 USER MOD Single : A 477 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 478 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 SER OG : rot 180:sc= -0.0845 USER MOD Single : A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 MET CE :methyl 162:sc= 0 (180deg=-0.217) USER MOD Single : A 492 ASN : amide:sc= -0.179 K(o=-0.18,f=-2.6!) USER MOD Single : A 512 MET CE :methyl -117:sc= -1.12 (180deg=-3.4!) USER MOD Single : A 515 TYR OH : rot 180:sc= 0 USER MOD Single : A 516 SER OG : rot 180:sc= 0.297 USER MOD Single : A 517 SER OG : rot -34:sc= 0.0785 USER MOD Single : A 518 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 520 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0639) USER MOD Single : A 523 MET CE :methyl 163:sc= -0.0217 (180deg=-0.913) USER MOD Single : A 528 TYR OH : rot 180:sc= -0.229 USER MOD Single : A 530 GLN : amide:sc= -0.0851 K(o=-0.085,f=-11!) USER MOD Single : A 531 SER OG : rot 180:sc=-0.00184 USER MOD Single : A 535 ASN : amide:sc= 0.458 X(o=0.46,f=0) USER MOD Single : A 539 GLN : amide:sc=-0.00822 X(o=-0.0082,f=-0.0082) USER MOD ----------------------------------------------------------------- ATOM 250 N LYS A 398 -16.782 8.210 5.926 1.00 55.32 N ATOM 251 CA LYS A 398 -15.649 8.694 5.100 1.00 12.14 C ATOM 252 C LYS A 398 -16.113 9.515 3.859 1.00 40.43 C ATOM 253 O LYS A 398 -17.280 9.915 3.756 1.00 60.01 O ATOM 254 CB LYS A 398 -14.709 7.509 4.714 1.00 23.43 C ATOM 255 CG LYS A 398 -13.883 6.934 5.889 1.00 75.52 C ATOM 256 CD LYS A 398 -12.853 7.951 6.442 1.00 4.40 C ATOM 257 CE LYS A 398 -12.121 7.447 7.698 1.00 65.01 C ATOM 258 NZ LYS A 398 -11.381 6.178 7.466 1.00 12.02 N ATOM 0 HA LYS A 398 -15.075 9.393 5.708 1.00 12.14 H new ATOM 0 HB2 LYS A 398 -15.312 6.709 4.285 1.00 23.43 H new ATOM 0 HB3 LYS A 398 -14.024 7.844 3.935 1.00 23.43 H new ATOM 0 HG2 LYS A 398 -14.558 6.633 6.690 1.00 75.52 H new ATOM 0 HG3 LYS A 398 -13.361 6.036 5.557 1.00 75.52 H new ATOM 0 HD2 LYS A 398 -12.120 8.175 5.667 1.00 4.40 H new ATOM 0 HD3 LYS A 398 -13.364 8.885 6.677 1.00 4.40 H new ATOM 0 HE2 LYS A 398 -11.423 8.212 8.037 1.00 65.01 H new ATOM 0 HE3 LYS A 398 -12.845 7.298 8.499 1.00 65.01 H new ATOM 0 HZ1 LYS A 398 -10.908 5.886 8.345 1.00 12.02 H new ATOM 0 HZ2 LYS A 398 -12.047 5.437 7.169 1.00 12.02 H new ATOM 0 HZ3 LYS A 398 -10.669 6.322 6.721 1.00 12.02 H new ATOM 272 N LEU A 399 -15.178 9.796 2.943 1.00 11.41 N ATOM 273 CA LEU A 399 -15.444 10.623 1.751 1.00 31.22 C ATOM 274 C LEU A 399 -14.661 10.063 0.549 1.00 41.34 C ATOM 275 O LEU A 399 -13.432 9.968 0.607 1.00 55.53 O ATOM 276 CB LEU A 399 -15.037 12.091 2.038 1.00 64.12 C ATOM 277 CG LEU A 399 -15.410 13.133 0.941 1.00 55.12 C ATOM 278 CD1 LEU A 399 -16.938 13.181 0.709 1.00 33.13 C ATOM 279 CD2 LEU A 399 -14.847 14.521 1.299 1.00 71.13 C ATOM 0 H LEU A 399 -14.217 9.459 3.003 1.00 11.41 H new ATOM 0 HA LEU A 399 -16.507 10.598 1.513 1.00 31.22 H new ATOM 0 HB2 LEU A 399 -15.501 12.399 2.975 1.00 64.12 H new ATOM 0 HB3 LEU A 399 -13.958 12.124 2.190 1.00 64.12 H new ATOM 0 HG LEU A 399 -14.953 12.818 0.003 1.00 55.12 H new ATOM 0 HD11 LEU A 399 -17.166 13.917 -0.062 1.00 33.13 H new ATOM 0 HD12 LEU A 399 -17.288 12.200 0.389 1.00 33.13 H new ATOM 0 HD13 LEU A 399 -17.438 13.460 1.636 1.00 33.13 H new ATOM 0 HD21 LEU A 399 -15.118 15.235 0.521 1.00 71.13 H new ATOM 0 HD22 LEU A 399 -15.263 14.848 2.252 1.00 71.13 H new ATOM 0 HD23 LEU A 399 -13.761 14.464 1.377 1.00 71.13 H new ATOM 291 N LEU A 400 -15.375 9.692 -0.533 1.00 40.13 N ATOM 292 CA LEU A 400 -14.749 9.105 -1.734 1.00 53.34 C ATOM 293 C LEU A 400 -13.907 10.170 -2.470 1.00 32.35 C ATOM 294 O LEU A 400 -14.430 11.017 -3.194 1.00 44.22 O ATOM 295 CB LEU A 400 -15.821 8.489 -2.677 1.00 53.50 C ATOM 296 CG LEU A 400 -15.275 7.817 -3.979 1.00 23.50 C ATOM 297 CD1 LEU A 400 -14.244 6.720 -3.656 1.00 62.21 C ATOM 298 CD2 LEU A 400 -16.422 7.262 -4.859 1.00 12.21 C ATOM 0 H LEU A 400 -16.388 9.789 -0.599 1.00 40.13 H new ATOM 0 HA LEU A 400 -14.086 8.299 -1.420 1.00 53.34 H new ATOM 0 HB2 LEU A 400 -16.387 7.745 -2.116 1.00 53.50 H new ATOM 0 HB3 LEU A 400 -16.522 9.274 -2.962 1.00 53.50 H new ATOM 0 HG LEU A 400 -14.767 8.592 -4.552 1.00 23.50 H new ATOM 0 HD11 LEU A 400 -13.885 6.274 -4.583 1.00 62.21 H new ATOM 0 HD12 LEU A 400 -13.405 7.157 -3.115 1.00 62.21 H new ATOM 0 HD13 LEU A 400 -14.711 5.951 -3.041 1.00 62.21 H new ATOM 0 HD21 LEU A 400 -16.004 6.803 -5.755 1.00 12.21 H new ATOM 0 HD22 LEU A 400 -16.983 6.516 -4.297 1.00 12.21 H new ATOM 0 HD23 LEU A 400 -17.087 8.076 -5.146 1.00 12.21 H new ATOM 310 N ALA A 401 -12.595 10.123 -2.225 1.00 71.32 N ATOM 311 CA ALA A 401 -11.629 11.083 -2.777 1.00 23.21 C ATOM 312 C ALA A 401 -11.108 10.640 -4.159 1.00 40.32 C ATOM 313 O ALA A 401 -10.970 11.455 -5.078 1.00 70.02 O ATOM 314 CB ALA A 401 -10.475 11.235 -1.784 1.00 21.40 C ATOM 0 H ALA A 401 -12.167 9.412 -1.632 1.00 71.32 H new ATOM 0 HA ALA A 401 -12.125 12.043 -2.923 1.00 23.21 H new ATOM 0 HB1 ALA A 401 -9.747 11.945 -2.178 1.00 21.40 H new ATOM 0 HB2 ALA A 401 -10.860 11.600 -0.832 1.00 21.40 H new ATOM 0 HB3 ALA A 401 -9.994 10.268 -1.634 1.00 21.40 H new ATOM 320 N TRP A 402 -10.844 9.330 -4.304 1.00 63.43 N ATOM 321 CA TRP A 402 -10.177 8.777 -5.504 1.00 0.10 C ATOM 322 C TRP A 402 -10.769 7.408 -5.893 1.00 71.42 C ATOM 323 O TRP A 402 -11.203 6.641 -5.033 1.00 65.13 O ATOM 324 CB TRP A 402 -8.645 8.653 -5.262 1.00 43.50 C ATOM 325 CG TRP A 402 -7.847 8.241 -6.486 1.00 64.12 C ATOM 326 CD1 TRP A 402 -7.474 9.043 -7.528 1.00 41.03 C ATOM 327 CD2 TRP A 402 -7.340 6.929 -6.799 1.00 21.02 C ATOM 328 NE1 TRP A 402 -6.762 8.323 -8.449 1.00 54.20 N ATOM 329 CE2 TRP A 402 -6.665 7.025 -8.026 1.00 30.21 C ATOM 330 CE3 TRP A 402 -7.382 5.689 -6.153 1.00 31.43 C ATOM 331 CZ2 TRP A 402 -6.051 5.931 -8.634 1.00 11.02 C ATOM 332 CZ3 TRP A 402 -6.772 4.605 -6.752 1.00 43.54 C ATOM 333 CH2 TRP A 402 -6.109 4.732 -7.980 1.00 64.40 C ATOM 0 H TRP A 402 -11.082 8.628 -3.603 1.00 63.43 H new ATOM 0 HA TRP A 402 -10.351 9.465 -6.331 1.00 0.10 H new ATOM 0 HB2 TRP A 402 -8.268 9.611 -4.903 1.00 43.50 H new ATOM 0 HB3 TRP A 402 -8.473 7.925 -4.469 1.00 43.50 H new ATOM 0 HD1 TRP A 402 -7.708 10.094 -7.613 1.00 41.03 H new ATOM 0 HE1 TRP A 402 -6.367 8.695 -9.313 1.00 54.20 H new ATOM 0 HE3 TRP A 402 -7.883 5.581 -5.202 1.00 31.43 H new ATOM 0 HZ2 TRP A 402 -5.549 6.027 -9.585 1.00 11.02 H new ATOM 0 HZ3 TRP A 402 -6.806 3.642 -6.265 1.00 43.54 H new ATOM 0 HH2 TRP A 402 -5.635 3.866 -8.418 1.00 64.40 H new ATOM 344 N SER A 403 -10.756 7.118 -7.203 1.00 23.15 N ATOM 345 CA SER A 403 -11.163 5.812 -7.768 1.00 12.53 C ATOM 346 C SER A 403 -10.255 5.472 -8.971 1.00 3.10 C ATOM 347 O SER A 403 -9.941 6.348 -9.790 1.00 62.30 O ATOM 348 CB SER A 403 -12.655 5.841 -8.193 1.00 23.11 C ATOM 349 OG SER A 403 -12.912 6.854 -9.159 1.00 44.03 O ATOM 0 H SER A 403 -10.460 7.788 -7.912 1.00 23.15 H new ATOM 0 HA SER A 403 -11.051 5.040 -7.007 1.00 12.53 H new ATOM 0 HB2 SER A 403 -12.935 4.870 -8.602 1.00 23.11 H new ATOM 0 HB3 SER A 403 -13.279 6.009 -7.315 1.00 23.11 H new ATOM 0 HG SER A 403 -13.861 6.840 -9.403 1.00 44.03 H new ATOM 355 N GLY A 404 -9.820 4.204 -9.062 1.00 44.23 N ATOM 356 CA GLY A 404 -8.918 3.762 -10.136 1.00 12.12 C ATOM 357 C GLY A 404 -8.541 2.281 -10.030 1.00 72.21 C ATOM 358 O GLY A 404 -9.302 1.478 -9.491 1.00 1.50 O ATOM 0 H GLY A 404 -10.079 3.468 -8.405 1.00 44.23 H new ATOM 0 HA2 GLY A 404 -9.394 3.942 -11.100 1.00 12.12 H new ATOM 0 HA3 GLY A 404 -8.010 4.365 -10.112 1.00 12.12 H new ATOM 362 N VAL A 405 -7.353 1.913 -10.549 1.00 52.51 N ATOM 363 CA VAL A 405 -6.867 0.509 -10.584 1.00 42.02 C ATOM 364 C VAL A 405 -5.560 0.356 -9.769 1.00 34.03 C ATOM 365 O VAL A 405 -4.556 0.971 -10.102 1.00 64.20 O ATOM 366 CB VAL A 405 -6.603 0.046 -12.070 1.00 73.54 C ATOM 367 CG1 VAL A 405 -6.073 -1.413 -12.135 1.00 33.43 C ATOM 368 CG2 VAL A 405 -7.866 0.222 -12.949 1.00 73.50 C ATOM 0 H VAL A 405 -6.698 2.579 -10.958 1.00 52.51 H new ATOM 0 HA VAL A 405 -7.642 -0.117 -10.141 1.00 42.02 H new ATOM 0 HB VAL A 405 -5.824 0.693 -12.473 1.00 73.54 H new ATOM 0 HG11 VAL A 405 -5.904 -1.693 -13.175 1.00 33.43 H new ATOM 0 HG12 VAL A 405 -5.136 -1.485 -11.583 1.00 33.43 H new ATOM 0 HG13 VAL A 405 -6.807 -2.087 -11.693 1.00 33.43 H new ATOM 0 HG21 VAL A 405 -7.650 -0.106 -13.966 1.00 73.50 H new ATOM 0 HG22 VAL A 405 -8.680 -0.376 -12.540 1.00 73.50 H new ATOM 0 HG23 VAL A 405 -8.158 1.272 -12.961 1.00 73.50 H new ATOM 378 N LEU A 406 -5.568 -0.477 -8.711 1.00 15.25 N ATOM 379 CA LEU A 406 -4.343 -0.825 -7.948 1.00 24.43 C ATOM 380 C LEU A 406 -3.808 -2.174 -8.453 1.00 64.24 C ATOM 381 O LEU A 406 -4.489 -3.198 -8.332 1.00 0.25 O ATOM 382 CB LEU A 406 -4.637 -0.912 -6.426 1.00 41.45 C ATOM 383 CG LEU A 406 -3.402 -1.190 -5.510 1.00 10.22 C ATOM 384 CD1 LEU A 406 -2.404 -0.015 -5.534 1.00 13.22 C ATOM 385 CD2 LEU A 406 -3.833 -1.513 -4.068 1.00 24.42 C ATOM 0 H LEU A 406 -6.413 -0.927 -8.359 1.00 15.25 H new ATOM 0 HA LEU A 406 -3.599 -0.044 -8.102 1.00 24.43 H new ATOM 0 HB2 LEU A 406 -5.097 0.024 -6.110 1.00 41.45 H new ATOM 0 HB3 LEU A 406 -5.372 -1.700 -6.262 1.00 41.45 H new ATOM 0 HG LEU A 406 -2.894 -2.067 -5.912 1.00 10.22 H new ATOM 0 HD11 LEU A 406 -1.558 -0.243 -4.886 1.00 13.22 H new ATOM 0 HD12 LEU A 406 -2.049 0.140 -6.553 1.00 13.22 H new ATOM 0 HD13 LEU A 406 -2.899 0.890 -5.180 1.00 13.22 H new ATOM 0 HD21 LEU A 406 -2.950 -1.701 -3.458 1.00 24.42 H new ATOM 0 HD22 LEU A 406 -4.386 -0.669 -3.656 1.00 24.42 H new ATOM 0 HD23 LEU A 406 -4.469 -2.398 -4.068 1.00 24.42 H new ATOM 397 N GLU A 407 -2.596 -2.171 -9.022 1.00 65.15 N ATOM 398 CA GLU A 407 -1.980 -3.370 -9.619 1.00 65.14 C ATOM 399 C GLU A 407 -0.580 -3.617 -9.034 1.00 51.24 C ATOM 400 O GLU A 407 0.241 -2.703 -8.967 1.00 72.21 O ATOM 401 CB GLU A 407 -1.908 -3.214 -11.154 1.00 12.34 C ATOM 402 CG GLU A 407 -1.357 -4.441 -11.903 1.00 41.30 C ATOM 403 CD GLU A 407 -1.347 -4.255 -13.427 1.00 73.34 C ATOM 404 OE1 GLU A 407 -2.406 -4.432 -14.068 1.00 50.34 O ATOM 405 OE2 GLU A 407 -0.288 -3.904 -13.992 1.00 3.11 O ATOM 0 H GLU A 407 -2.011 -1.337 -9.083 1.00 65.15 H new ATOM 0 HA GLU A 407 -2.599 -4.235 -9.380 1.00 65.14 H new ATOM 0 HB2 GLU A 407 -2.907 -2.995 -11.530 1.00 12.34 H new ATOM 0 HB3 GLU A 407 -1.283 -2.352 -11.389 1.00 12.34 H new ATOM 0 HG2 GLU A 407 -0.343 -4.644 -11.560 1.00 41.30 H new ATOM 0 HG3 GLU A 407 -1.959 -5.314 -11.652 1.00 41.30 H new ATOM 412 N TRP A 408 -0.316 -4.872 -8.656 1.00 23.41 N ATOM 413 CA TRP A 408 0.936 -5.294 -8.012 1.00 74.11 C ATOM 414 C TRP A 408 1.538 -6.529 -8.706 1.00 14.30 C ATOM 415 O TRP A 408 0.879 -7.202 -9.508 1.00 54.31 O ATOM 416 CB TRP A 408 0.672 -5.596 -6.513 1.00 62.21 C ATOM 417 CG TRP A 408 -0.318 -6.720 -6.254 1.00 1.05 C ATOM 418 CD1 TRP A 408 -0.032 -8.048 -6.095 1.00 5.10 C ATOM 419 CD2 TRP A 408 -1.750 -6.612 -6.143 1.00 45.33 C ATOM 420 NE1 TRP A 408 -1.173 -8.754 -5.844 1.00 61.41 N ATOM 421 CE2 TRP A 408 -2.240 -7.901 -5.872 1.00 72.10 C ATOM 422 CE3 TRP A 408 -2.662 -5.548 -6.220 1.00 33.22 C ATOM 423 CZ2 TRP A 408 -3.592 -8.163 -5.692 1.00 42.01 C ATOM 424 CZ3 TRP A 408 -4.006 -5.814 -6.054 1.00 52.52 C ATOM 425 CH2 TRP A 408 -4.457 -7.116 -5.784 1.00 60.14 C ATOM 0 H TRP A 408 -0.977 -5.638 -8.791 1.00 23.41 H new ATOM 0 HA TRP A 408 1.658 -4.482 -8.100 1.00 74.11 H new ATOM 0 HB2 TRP A 408 1.619 -5.848 -6.035 1.00 62.21 H new ATOM 0 HB3 TRP A 408 0.304 -4.689 -6.033 1.00 62.21 H new ATOM 0 HD1 TRP A 408 0.957 -8.477 -6.159 1.00 5.10 H new ATOM 0 HE1 TRP A 408 -1.221 -9.757 -5.664 1.00 61.41 H new ATOM 0 HE3 TRP A 408 -2.319 -4.541 -6.406 1.00 33.22 H new ATOM 0 HZ2 TRP A 408 -3.945 -9.163 -5.486 1.00 42.01 H new ATOM 0 HZ3 TRP A 408 -4.721 -5.009 -6.133 1.00 52.52 H new ATOM 0 HH2 TRP A 408 -5.514 -7.291 -5.646 1.00 60.14 H new ATOM 436 N GLN A 409 2.798 -6.819 -8.363 1.00 31.03 N ATOM 437 CA GLN A 409 3.466 -8.076 -8.749 1.00 2.13 C ATOM 438 C GLN A 409 3.346 -9.100 -7.607 1.00 53.14 C ATOM 439 O GLN A 409 3.584 -8.769 -6.436 1.00 33.30 O ATOM 440 CB GLN A 409 4.957 -7.825 -9.125 1.00 43.22 C ATOM 441 CG GLN A 409 5.163 -7.054 -10.463 1.00 10.21 C ATOM 442 CD GLN A 409 5.014 -7.895 -11.759 1.00 72.22 C ATOM 443 OE1 GLN A 409 4.201 -8.945 -11.764 1.00 12.04 O flip ATOM 444 NE2 GLN A 409 5.645 -7.600 -12.767 1.00 30.23 N flip ATOM 0 H GLN A 409 3.386 -6.194 -7.812 1.00 31.03 H new ATOM 0 HA GLN A 409 2.972 -8.479 -9.633 1.00 2.13 H new ATOM 0 HB2 GLN A 409 5.432 -7.265 -8.320 1.00 43.22 H new ATOM 0 HB3 GLN A 409 5.469 -8.785 -9.191 1.00 43.22 H new ATOM 0 HG2 GLN A 409 4.447 -6.233 -10.501 1.00 10.21 H new ATOM 0 HG3 GLN A 409 6.158 -6.609 -10.454 1.00 10.21 H new ATOM 0 HE21 GLN A 409 6.269 -6.793 -12.760 1.00 30.23 H new ATOM 0 HE22 GLN A 409 5.547 -8.161 -13.613 1.00 30.23 H new ATOM 453 N GLU A 410 2.961 -10.329 -7.960 1.00 74.25 N ATOM 454 CA GLU A 410 2.730 -11.419 -6.993 1.00 41.34 C ATOM 455 C GLU A 410 4.079 -12.032 -6.516 1.00 21.45 C ATOM 456 O GLU A 410 5.134 -11.777 -7.114 1.00 12.31 O ATOM 457 CB GLU A 410 1.811 -12.505 -7.638 1.00 14.42 C ATOM 458 CG GLU A 410 0.963 -13.303 -6.630 1.00 14.31 C ATOM 459 CD GLU A 410 0.076 -14.373 -7.292 1.00 33.12 C ATOM 460 OE1 GLU A 410 0.597 -15.446 -7.659 1.00 63.21 O ATOM 461 OE2 GLU A 410 -1.144 -14.146 -7.447 1.00 70.22 O ATOM 0 H GLU A 410 2.798 -10.603 -8.929 1.00 74.25 H new ATOM 0 HA GLU A 410 2.228 -11.015 -6.114 1.00 41.34 H new ATOM 0 HB2 GLU A 410 1.144 -12.022 -8.352 1.00 14.42 H new ATOM 0 HB3 GLU A 410 2.432 -13.201 -8.202 1.00 14.42 H new ATOM 0 HG2 GLU A 410 1.625 -13.784 -5.910 1.00 14.31 H new ATOM 0 HG3 GLU A 410 0.331 -12.613 -6.071 1.00 14.31 H new ATOM 649 N LEU A 423 3.167 -13.269 -13.113 1.00 12.14 N ATOM 650 CA LEU A 423 2.101 -13.173 -12.090 1.00 60.21 C ATOM 651 C LEU A 423 1.881 -11.710 -11.654 1.00 43.31 C ATOM 652 O LEU A 423 2.581 -11.187 -10.783 1.00 12.45 O ATOM 653 CB LEU A 423 2.443 -14.094 -10.885 1.00 23.34 C ATOM 654 CG LEU A 423 2.702 -15.601 -11.230 1.00 70.01 C ATOM 655 CD1 LEU A 423 2.895 -16.437 -9.952 1.00 53.30 C ATOM 656 CD2 LEU A 423 1.578 -16.186 -12.111 1.00 64.42 C ATOM 0 HA LEU A 423 1.161 -13.516 -12.522 1.00 60.21 H new ATOM 0 HB2 LEU A 423 3.328 -13.697 -10.389 1.00 23.34 H new ATOM 0 HB3 LEU A 423 1.624 -14.041 -10.167 1.00 23.34 H new ATOM 0 HG LEU A 423 3.626 -15.648 -11.807 1.00 70.01 H new ATOM 0 HD11 LEU A 423 3.073 -17.478 -10.222 1.00 53.30 H new ATOM 0 HD12 LEU A 423 3.750 -16.056 -9.393 1.00 53.30 H new ATOM 0 HD13 LEU A 423 1.999 -16.370 -9.335 1.00 53.30 H new ATOM 0 HD21 LEU A 423 1.794 -17.232 -12.329 1.00 64.42 H new ATOM 0 HD22 LEU A 423 0.627 -16.114 -11.583 1.00 64.42 H new ATOM 0 HD23 LEU A 423 1.518 -15.626 -13.044 1.00 64.42 H new ATOM 668 N THR A 424 0.928 -11.044 -12.336 1.00 71.33 N ATOM 669 CA THR A 424 0.549 -9.638 -12.072 1.00 51.13 C ATOM 670 C THR A 424 -0.976 -9.562 -11.810 1.00 3.34 C ATOM 671 O THR A 424 -1.776 -10.084 -12.595 1.00 51.11 O ATOM 672 CB THR A 424 0.936 -8.706 -13.283 1.00 34.22 C ATOM 673 OG1 THR A 424 2.237 -9.053 -13.791 1.00 70.22 O ATOM 674 CG2 THR A 424 0.950 -7.218 -12.885 1.00 72.44 C ATOM 0 H THR A 424 0.393 -11.470 -13.093 1.00 71.33 H new ATOM 0 HA THR A 424 1.094 -9.289 -11.195 1.00 51.13 H new ATOM 0 HB THR A 424 0.176 -8.858 -14.050 1.00 34.22 H new ATOM 0 HG1 THR A 424 2.897 -8.990 -13.070 1.00 70.22 H new ATOM 0 HG21 THR A 424 1.222 -6.613 -13.750 1.00 72.44 H new ATOM 0 HG22 THR A 424 -0.040 -6.926 -12.534 1.00 72.44 H new ATOM 0 HG23 THR A 424 1.678 -7.061 -12.089 1.00 72.44 H new ATOM 682 N ARG A 425 -1.368 -8.927 -10.692 1.00 21.25 N ATOM 683 CA ARG A 425 -2.766 -8.922 -10.191 1.00 23.25 C ATOM 684 C ARG A 425 -3.268 -7.474 -9.989 1.00 1.22 C ATOM 685 O ARG A 425 -2.499 -6.617 -9.565 1.00 21.20 O ATOM 686 CB ARG A 425 -2.822 -9.703 -8.844 1.00 23.24 C ATOM 687 CG ARG A 425 -2.261 -11.145 -8.889 1.00 32.21 C ATOM 688 CD ARG A 425 -3.068 -12.071 -9.812 1.00 10.20 C ATOM 689 NE ARG A 425 -2.392 -13.364 -10.012 1.00 75.21 N ATOM 690 CZ ARG A 425 -1.930 -13.821 -11.158 1.00 61.22 C ATOM 691 NH1 ARG A 425 -1.988 -13.105 -12.241 1.00 44.21 N ATOM 692 NH2 ARG A 425 -1.390 -14.989 -11.205 1.00 11.14 N ATOM 0 H ARG A 425 -0.725 -8.398 -10.103 1.00 21.25 H new ATOM 0 HA ARG A 425 -3.413 -9.404 -10.924 1.00 23.25 H new ATOM 0 HB2 ARG A 425 -2.268 -9.139 -8.093 1.00 23.24 H new ATOM 0 HB3 ARG A 425 -3.859 -9.745 -8.511 1.00 23.24 H new ATOM 0 HG2 ARG A 425 -1.225 -11.116 -9.227 1.00 32.21 H new ATOM 0 HG3 ARG A 425 -2.256 -11.559 -7.881 1.00 32.21 H new ATOM 0 HD2 ARG A 425 -4.057 -12.239 -9.385 1.00 10.20 H new ATOM 0 HD3 ARG A 425 -3.216 -11.585 -10.776 1.00 10.20 H new ATOM 0 HE ARG A 425 -2.271 -13.958 -9.191 1.00 75.21 H new ATOM 0 HH11 ARG A 425 -2.397 -12.171 -12.214 1.00 44.21 H new ATOM 0 HH12 ARG A 425 -1.625 -13.477 -13.118 1.00 44.21 H new ATOM 0 HH21 ARG A 425 -1.322 -15.554 -10.358 1.00 11.14 H new ATOM 0 HH22 ARG A 425 -1.030 -15.349 -12.089 1.00 11.14 H new ATOM 706 N SER A 426 -4.569 -7.213 -10.256 1.00 23.45 N ATOM 707 CA SER A 426 -5.137 -5.830 -10.211 1.00 73.23 C ATOM 708 C SER A 426 -6.595 -5.807 -9.707 1.00 61.22 C ATOM 709 O SER A 426 -7.344 -6.775 -9.893 1.00 5.40 O ATOM 710 CB SER A 426 -5.072 -5.161 -11.604 1.00 55.54 C ATOM 711 OG SER A 426 -5.912 -5.807 -12.545 1.00 73.40 O ATOM 0 H SER A 426 -5.248 -7.932 -10.504 1.00 23.45 H new ATOM 0 HA SER A 426 -4.524 -5.271 -9.504 1.00 73.23 H new ATOM 0 HB2 SER A 426 -5.363 -4.114 -11.517 1.00 55.54 H new ATOM 0 HB3 SER A 426 -4.044 -5.177 -11.966 1.00 55.54 H new ATOM 0 HG SER A 426 -5.843 -5.353 -13.411 1.00 73.40 H new ATOM 717 N LEU A 427 -6.993 -4.671 -9.083 1.00 74.01 N ATOM 718 CA LEU A 427 -8.351 -4.470 -8.504 1.00 42.30 C ATOM 719 C LEU A 427 -8.884 -3.035 -8.778 1.00 13.15 C ATOM 720 O LEU A 427 -8.085 -2.099 -8.903 1.00 70.33 O ATOM 721 CB LEU A 427 -8.309 -4.699 -6.966 1.00 75.11 C ATOM 722 CG LEU A 427 -7.957 -6.136 -6.497 1.00 15.20 C ATOM 723 CD1 LEU A 427 -7.799 -6.198 -4.968 1.00 2.51 C ATOM 724 CD2 LEU A 427 -9.004 -7.152 -7.000 1.00 22.52 C ATOM 0 H LEU A 427 -6.381 -3.863 -8.965 1.00 74.01 H new ATOM 0 HA LEU A 427 -9.019 -5.188 -8.979 1.00 42.30 H new ATOM 0 HB2 LEU A 427 -7.581 -4.010 -6.537 1.00 75.11 H new ATOM 0 HB3 LEU A 427 -9.282 -4.432 -6.553 1.00 75.11 H new ATOM 0 HG LEU A 427 -6.997 -6.408 -6.935 1.00 15.20 H new ATOM 0 HD11 LEU A 427 -7.553 -7.217 -4.669 1.00 2.51 H new ATOM 0 HD12 LEU A 427 -7.000 -5.525 -4.657 1.00 2.51 H new ATOM 0 HD13 LEU A 427 -8.733 -5.896 -4.493 1.00 2.51 H new ATOM 0 HD21 LEU A 427 -8.735 -8.151 -6.658 1.00 22.52 H new ATOM 0 HD22 LEU A 427 -9.986 -6.887 -6.608 1.00 22.52 H new ATOM 0 HD23 LEU A 427 -9.032 -7.137 -8.090 1.00 22.52 H new ATOM 736 N PRO A 428 -10.243 -2.840 -8.877 1.00 75.12 N ATOM 737 CA PRO A 428 -10.859 -1.486 -8.863 1.00 24.22 C ATOM 738 C PRO A 428 -10.865 -0.876 -7.423 1.00 2.34 C ATOM 739 O PRO A 428 -11.750 -1.156 -6.613 1.00 71.24 O ATOM 740 CB PRO A 428 -12.290 -1.741 -9.409 1.00 32.25 C ATOM 741 CG PRO A 428 -12.597 -3.162 -9.012 1.00 44.23 C ATOM 742 CD PRO A 428 -11.273 -3.910 -9.049 1.00 51.33 C ATOM 0 HA PRO A 428 -10.313 -0.756 -9.460 1.00 24.22 H new ATOM 0 HB2 PRO A 428 -13.009 -1.044 -8.978 1.00 32.25 H new ATOM 0 HB3 PRO A 428 -12.331 -1.613 -10.491 1.00 32.25 H new ATOM 0 HG2 PRO A 428 -13.038 -3.201 -8.016 1.00 44.23 H new ATOM 0 HG3 PRO A 428 -13.316 -3.611 -9.697 1.00 44.23 H new ATOM 0 HD2 PRO A 428 -11.213 -4.653 -8.253 1.00 51.33 H new ATOM 0 HD3 PRO A 428 -11.142 -4.441 -9.992 1.00 51.33 H new ATOM 750 N CYS A 429 -9.859 -0.034 -7.122 1.00 4.02 N ATOM 751 CA CYS A 429 -9.590 0.466 -5.748 1.00 44.44 C ATOM 752 C CYS A 429 -10.056 1.925 -5.553 1.00 13.02 C ATOM 753 O CYS A 429 -9.916 2.765 -6.448 1.00 62.00 O ATOM 754 CB CYS A 429 -8.078 0.385 -5.467 1.00 10.52 C ATOM 755 SG CYS A 429 -7.073 1.354 -6.613 1.00 61.43 S ATOM 0 H CYS A 429 -9.206 0.323 -7.820 1.00 4.02 H new ATOM 0 HA CYS A 429 -10.152 -0.160 -5.055 1.00 44.44 H new ATOM 0 HB2 CYS A 429 -7.888 0.729 -4.450 1.00 10.52 H new ATOM 0 HB3 CYS A 429 -7.764 -0.658 -5.515 1.00 10.52 H new ATOM 0 HG CYS A 429 -7.706 2.444 -6.930 1.00 61.43 H new ATOM 761 N GLN A 430 -10.591 2.209 -4.354 1.00 50.53 N ATOM 762 CA GLN A 430 -11.125 3.535 -3.975 1.00 12.15 C ATOM 763 C GLN A 430 -10.435 4.069 -2.696 1.00 52.25 C ATOM 764 O GLN A 430 -10.433 3.394 -1.667 1.00 10.45 O ATOM 765 CB GLN A 430 -12.647 3.425 -3.712 1.00 35.14 C ATOM 766 CG GLN A 430 -13.500 2.987 -4.920 1.00 55.52 C ATOM 767 CD GLN A 430 -14.988 2.843 -4.576 1.00 35.43 C ATOM 768 OE1 GLN A 430 -15.353 2.512 -3.450 1.00 74.10 O ATOM 769 NE2 GLN A 430 -15.857 3.094 -5.531 1.00 24.42 N ATOM 0 H GLN A 430 -10.667 1.517 -3.608 1.00 50.53 H new ATOM 0 HA GLN A 430 -10.930 4.226 -4.795 1.00 12.15 H new ATOM 0 HB2 GLN A 430 -12.807 2.716 -2.900 1.00 35.14 H new ATOM 0 HB3 GLN A 430 -13.009 4.393 -3.366 1.00 35.14 H new ATOM 0 HG2 GLN A 430 -13.386 3.716 -5.723 1.00 55.52 H new ATOM 0 HG3 GLN A 430 -13.125 2.036 -5.298 1.00 55.52 H new ATOM 0 HE21 GLN A 430 -15.531 3.367 -6.458 1.00 24.42 H new ATOM 0 HE22 GLN A 430 -16.857 3.015 -5.344 1.00 24.42 H new ATOM 778 N VAL A 431 -9.868 5.283 -2.766 1.00 22.22 N ATOM 779 CA VAL A 431 -9.295 5.974 -1.585 1.00 41.34 C ATOM 780 C VAL A 431 -10.364 6.867 -0.907 1.00 61.42 C ATOM 781 O VAL A 431 -10.811 7.867 -1.478 1.00 3.02 O ATOM 782 CB VAL A 431 -8.030 6.826 -1.976 1.00 11.01 C ATOM 783 CG1 VAL A 431 -7.479 7.642 -0.772 1.00 63.32 C ATOM 784 CG2 VAL A 431 -6.935 5.912 -2.572 1.00 11.23 C ATOM 0 H VAL A 431 -9.791 5.816 -3.632 1.00 22.22 H new ATOM 0 HA VAL A 431 -8.976 5.211 -0.875 1.00 41.34 H new ATOM 0 HB VAL A 431 -8.338 7.548 -2.732 1.00 11.01 H new ATOM 0 HG11 VAL A 431 -6.607 8.214 -1.089 1.00 63.32 H new ATOM 0 HG12 VAL A 431 -8.249 8.324 -0.412 1.00 63.32 H new ATOM 0 HG13 VAL A 431 -7.194 6.960 0.030 1.00 63.32 H new ATOM 0 HG21 VAL A 431 -6.065 6.512 -2.839 1.00 11.23 H new ATOM 0 HG22 VAL A 431 -6.646 5.162 -1.835 1.00 11.23 H new ATOM 0 HG23 VAL A 431 -7.320 5.416 -3.463 1.00 11.23 H new ATOM 794 N TYR A 432 -10.795 6.453 0.291 1.00 71.41 N ATOM 795 CA TYR A 432 -11.701 7.232 1.159 1.00 25.24 C ATOM 796 C TYR A 432 -10.904 8.056 2.204 1.00 22.41 C ATOM 797 O TYR A 432 -10.194 7.496 3.048 1.00 71.33 O ATOM 798 CB TYR A 432 -12.709 6.287 1.875 1.00 71.32 C ATOM 799 CG TYR A 432 -13.877 5.802 0.999 1.00 54.31 C ATOM 800 CD1 TYR A 432 -13.711 4.787 0.052 1.00 5.24 C ATOM 801 CD2 TYR A 432 -15.156 6.368 1.126 1.00 34.22 C ATOM 802 CE1 TYR A 432 -14.768 4.358 -0.729 1.00 4.43 C ATOM 803 CE2 TYR A 432 -16.210 5.942 0.343 1.00 70.04 C ATOM 804 CZ TYR A 432 -16.014 4.939 -0.581 1.00 45.31 C ATOM 805 OH TYR A 432 -17.068 4.525 -1.367 1.00 11.35 O ATOM 0 H TYR A 432 -10.523 5.556 0.694 1.00 71.41 H new ATOM 0 HA TYR A 432 -12.254 7.928 0.529 1.00 25.24 H new ATOM 0 HB2 TYR A 432 -12.168 5.417 2.247 1.00 71.32 H new ATOM 0 HB3 TYR A 432 -13.116 6.805 2.744 1.00 71.32 H new ATOM 0 HD1 TYR A 432 -12.740 4.330 -0.072 1.00 5.24 H new ATOM 0 HD2 TYR A 432 -15.318 7.152 1.851 1.00 34.22 H new ATOM 0 HE1 TYR A 432 -14.621 3.571 -1.453 1.00 4.43 H new ATOM 0 HE2 TYR A 432 -17.185 6.393 0.454 1.00 70.04 H new ATOM 0 HH TYR A 432 -17.871 5.036 -1.133 1.00 11.35 H new ATOM 815 N VAL A 433 -11.026 9.387 2.122 1.00 1.21 N ATOM 816 CA VAL A 433 -10.459 10.331 3.113 1.00 11.14 C ATOM 817 C VAL A 433 -11.550 10.811 4.108 1.00 1.15 C ATOM 818 O VAL A 433 -12.661 10.283 4.135 1.00 54.04 O ATOM 819 CB VAL A 433 -9.819 11.580 2.394 1.00 22.42 C ATOM 820 CG1 VAL A 433 -8.624 11.179 1.501 1.00 74.10 C ATOM 821 CG2 VAL A 433 -10.892 12.371 1.594 1.00 71.41 C ATOM 0 H VAL A 433 -11.524 9.850 1.362 1.00 1.21 H new ATOM 0 HA VAL A 433 -9.683 9.801 3.666 1.00 11.14 H new ATOM 0 HB VAL A 433 -9.427 12.240 3.168 1.00 22.42 H new ATOM 0 HG11 VAL A 433 -8.212 12.068 1.024 1.00 74.10 H new ATOM 0 HG12 VAL A 433 -7.856 10.706 2.112 1.00 74.10 H new ATOM 0 HG13 VAL A 433 -8.960 10.480 0.736 1.00 74.10 H new ATOM 0 HG21 VAL A 433 -10.425 13.227 1.108 1.00 71.41 H new ATOM 0 HG22 VAL A 433 -11.335 11.722 0.839 1.00 71.41 H new ATOM 0 HG23 VAL A 433 -11.669 12.719 2.274 1.00 71.41 H new ATOM 831 N ASN A 434 -11.199 11.811 4.935 1.00 23.02 N ATOM 832 CA ASN A 434 -12.153 12.486 5.846 1.00 43.22 C ATOM 833 C ASN A 434 -12.926 13.616 5.110 1.00 71.40 C ATOM 834 O ASN A 434 -12.626 13.946 3.961 1.00 40.32 O ATOM 835 CB ASN A 434 -11.382 13.058 7.063 1.00 41.44 C ATOM 836 CG ASN A 434 -10.653 11.979 7.877 1.00 41.24 C ATOM 837 OD1 ASN A 434 -11.106 10.841 7.987 1.00 11.51 O ATOM 838 ND2 ASN A 434 -9.510 12.321 8.439 1.00 2.42 N ATOM 0 H ASN A 434 -10.249 12.177 4.994 1.00 23.02 H new ATOM 0 HA ASN A 434 -12.886 11.757 6.191 1.00 43.22 H new ATOM 0 HB2 ASN A 434 -10.657 13.792 6.713 1.00 41.44 H new ATOM 0 HB3 ASN A 434 -12.081 13.585 7.713 1.00 41.44 H new ATOM 0 HD21 ASN A 434 -8.982 11.635 8.979 1.00 2.42 H new ATOM 0 HD22 ASN A 434 -9.154 13.271 8.334 1.00 2.42 H new ATOM 884 N ASN A 438 -7.319 18.119 3.083 1.00 13.34 N ATOM 885 CA ASN A 438 -6.816 18.993 1.996 1.00 41.32 C ATOM 886 C ASN A 438 -6.100 18.144 0.900 1.00 70.20 C ATOM 887 O ASN A 438 -5.546 18.688 -0.070 1.00 0.30 O ATOM 888 CB ASN A 438 -5.855 20.054 2.607 1.00 13.44 C ATOM 889 CG ASN A 438 -5.478 21.187 1.649 1.00 25.20 C ATOM 890 OD1 ASN A 438 -6.252 21.568 0.770 1.00 75.05 O ATOM 891 ND2 ASN A 438 -4.291 21.733 1.808 1.00 63.13 N ATOM 0 HA ASN A 438 -7.651 19.505 1.517 1.00 41.32 H new ATOM 0 HB2 ASN A 438 -6.323 20.483 3.493 1.00 13.44 H new ATOM 0 HB3 ASN A 438 -4.944 19.555 2.937 1.00 13.44 H new ATOM 0 HD21 ASN A 438 -3.992 22.491 1.195 1.00 63.13 H new ATOM 0 HD22 ASN A 438 -3.670 21.398 2.544 1.00 63.13 H new ATOM 898 N LEU A 439 -6.167 16.801 1.049 1.00 1.30 N ATOM 899 CA LEU A 439 -5.436 15.837 0.200 1.00 31.44 C ATOM 900 C LEU A 439 -5.949 15.876 -1.257 1.00 41.14 C ATOM 901 O LEU A 439 -7.117 15.568 -1.524 1.00 44.03 O ATOM 902 CB LEU A 439 -5.567 14.401 0.787 1.00 62.13 C ATOM 903 CG LEU A 439 -4.812 13.283 0.004 1.00 60.14 C ATOM 904 CD1 LEU A 439 -3.305 13.580 -0.079 1.00 64.01 C ATOM 905 CD2 LEU A 439 -5.077 11.888 0.611 1.00 2.53 C ATOM 0 H LEU A 439 -6.735 16.354 1.768 1.00 1.30 H new ATOM 0 HA LEU A 439 -4.383 16.120 0.190 1.00 31.44 H new ATOM 0 HB2 LEU A 439 -5.200 14.412 1.813 1.00 62.13 H new ATOM 0 HB3 LEU A 439 -6.624 14.140 0.829 1.00 62.13 H new ATOM 0 HG LEU A 439 -5.204 13.275 -1.013 1.00 60.14 H new ATOM 0 HD11 LEU A 439 -2.807 12.783 -0.631 1.00 64.01 H new ATOM 0 HD12 LEU A 439 -3.149 14.529 -0.592 1.00 64.01 H new ATOM 0 HD13 LEU A 439 -2.890 13.639 0.927 1.00 64.01 H new ATOM 0 HD21 LEU A 439 -4.535 11.134 0.040 1.00 2.53 H new ATOM 0 HD22 LEU A 439 -4.738 11.872 1.647 1.00 2.53 H new ATOM 0 HD23 LEU A 439 -6.145 11.672 0.575 1.00 2.53 H new ATOM 917 N LYS A 440 -5.065 16.262 -2.200 1.00 40.40 N ATOM 918 CA LYS A 440 -5.435 16.442 -3.612 1.00 70.12 C ATOM 919 C LYS A 440 -5.289 15.147 -4.425 1.00 43.10 C ATOM 920 O LYS A 440 -4.340 14.928 -5.183 1.00 70.13 O ATOM 921 CB LYS A 440 -4.678 17.643 -4.215 1.00 22.01 C ATOM 922 CG LYS A 440 -5.266 18.990 -3.768 1.00 12.10 C ATOM 923 CD LYS A 440 -6.705 19.178 -4.303 1.00 1.43 C ATOM 924 CE LYS A 440 -7.459 20.320 -3.619 1.00 33.44 C ATOM 925 NZ LYS A 440 -7.625 20.085 -2.150 1.00 44.51 N ATOM 0 H LYS A 440 -4.083 16.455 -2.003 1.00 40.40 H new ATOM 0 HA LYS A 440 -6.498 16.679 -3.663 1.00 70.12 H new ATOM 0 HB2 LYS A 440 -3.629 17.592 -3.922 1.00 22.01 H new ATOM 0 HB3 LYS A 440 -4.709 17.579 -5.303 1.00 22.01 H new ATOM 0 HG2 LYS A 440 -5.270 19.045 -2.679 1.00 12.10 H new ATOM 0 HG3 LYS A 440 -4.633 19.802 -4.126 1.00 12.10 H new ATOM 0 HD2 LYS A 440 -6.665 19.369 -5.375 1.00 1.43 H new ATOM 0 HD3 LYS A 440 -7.261 18.251 -4.165 1.00 1.43 H new ATOM 0 HE2 LYS A 440 -6.922 21.255 -3.778 1.00 33.44 H new ATOM 0 HE3 LYS A 440 -8.440 20.434 -4.081 1.00 33.44 H new ATOM 0 HZ1 LYS A 440 -8.357 20.723 -1.777 1.00 44.51 H new ATOM 0 HZ2 LYS A 440 -7.910 19.098 -1.986 1.00 44.51 H new ATOM 0 HZ3 LYS A 440 -6.724 20.270 -1.665 1.00 44.51 H new ATOM 939 N THR A 441 -6.303 14.311 -4.221 1.00 3.12 N ATOM 940 CA THR A 441 -6.511 13.022 -4.907 1.00 73.23 C ATOM 941 C THR A 441 -7.006 13.208 -6.353 1.00 41.33 C ATOM 942 O THR A 441 -6.916 12.286 -7.170 1.00 22.44 O ATOM 943 CB THR A 441 -7.563 12.185 -4.133 1.00 64.52 C ATOM 944 OG1 THR A 441 -8.754 12.973 -3.959 1.00 14.13 O ATOM 945 CG2 THR A 441 -7.045 11.729 -2.757 1.00 1.55 C ATOM 0 H THR A 441 -7.039 14.515 -3.545 1.00 3.12 H new ATOM 0 HA THR A 441 -5.548 12.512 -4.935 1.00 73.23 H new ATOM 0 HB THR A 441 -7.775 11.289 -4.717 1.00 64.52 H new ATOM 0 HG1 THR A 441 -9.494 12.560 -4.451 1.00 14.13 H new ATOM 0 HG21 THR A 441 -7.816 11.147 -2.253 1.00 1.55 H new ATOM 0 HG22 THR A 441 -6.154 11.115 -2.889 1.00 1.55 H new ATOM 0 HG23 THR A 441 -6.797 12.602 -2.154 1.00 1.55 H new ATOM 953 N GLU A 442 -7.548 14.403 -6.652 1.00 53.21 N ATOM 954 CA GLU A 442 -7.990 14.785 -8.009 1.00 20.11 C ATOM 955 C GLU A 442 -6.807 14.759 -9.023 1.00 32.23 C ATOM 956 O GLU A 442 -7.000 14.491 -10.215 1.00 43.33 O ATOM 957 CB GLU A 442 -8.666 16.189 -7.963 1.00 73.31 C ATOM 958 CG GLU A 442 -9.188 16.690 -9.333 1.00 2.30 C ATOM 959 CD GLU A 442 -10.136 17.900 -9.239 1.00 20.44 C ATOM 960 OE1 GLU A 442 -9.657 19.025 -8.979 1.00 14.30 O ATOM 961 OE2 GLU A 442 -11.368 17.726 -9.418 1.00 23.20 O ATOM 0 H GLU A 442 -7.693 15.135 -5.957 1.00 53.21 H new ATOM 0 HA GLU A 442 -8.720 14.054 -8.356 1.00 20.11 H new ATOM 0 HB2 GLU A 442 -9.498 16.156 -7.260 1.00 73.31 H new ATOM 0 HB3 GLU A 442 -7.949 16.912 -7.574 1.00 73.31 H new ATOM 0 HG2 GLU A 442 -8.336 16.957 -9.959 1.00 2.30 H new ATOM 0 HG3 GLU A 442 -9.708 15.873 -9.833 1.00 2.30 H new ATOM 968 N GLN A 443 -5.585 15.003 -8.519 1.00 5.04 N ATOM 969 CA GLN A 443 -4.349 15.019 -9.340 1.00 61.12 C ATOM 970 C GLN A 443 -3.813 13.586 -9.616 1.00 2.34 C ATOM 971 O GLN A 443 -3.051 13.382 -10.571 1.00 32.21 O ATOM 972 CB GLN A 443 -3.246 15.847 -8.628 1.00 71.23 C ATOM 973 CG GLN A 443 -3.732 17.175 -8.025 1.00 4.45 C ATOM 974 CD GLN A 443 -2.600 17.998 -7.417 1.00 32.10 C ATOM 975 OE1 GLN A 443 -2.053 18.886 -8.042 1.00 75.33 O ATOM 976 NE2 GLN A 443 -2.181 17.648 -6.230 1.00 54.51 N ATOM 0 H GLN A 443 -5.420 15.195 -7.531 1.00 5.04 H new ATOM 0 HA GLN A 443 -4.604 15.476 -10.296 1.00 61.12 H new ATOM 0 HB2 GLN A 443 -2.810 15.240 -7.834 1.00 71.23 H new ATOM 0 HB3 GLN A 443 -2.450 16.057 -9.342 1.00 71.23 H new ATOM 0 HG2 GLN A 443 -4.226 17.761 -8.800 1.00 4.45 H new ATOM 0 HG3 GLN A 443 -4.478 16.969 -7.257 1.00 4.45 H new ATOM 0 HE21 GLN A 443 -2.654 16.900 -5.722 1.00 54.51 H new ATOM 0 HE22 GLN A 443 -1.381 18.122 -5.811 1.00 54.51 H new ATOM 985 N TRP A 444 -4.210 12.620 -8.762 1.00 32.53 N ATOM 986 CA TRP A 444 -3.731 11.217 -8.833 1.00 3.34 C ATOM 987 C TRP A 444 -4.245 10.510 -10.129 1.00 24.43 C ATOM 988 O TRP A 444 -5.402 10.715 -10.521 1.00 22.20 O ATOM 989 CB TRP A 444 -4.192 10.422 -7.578 1.00 42.40 C ATOM 990 CG TRP A 444 -3.698 10.924 -6.232 1.00 70.01 C ATOM 991 CD1 TRP A 444 -2.964 12.053 -5.956 1.00 31.52 C ATOM 992 CD2 TRP A 444 -3.922 10.284 -4.965 1.00 62.41 C ATOM 993 NE1 TRP A 444 -2.734 12.147 -4.607 1.00 62.24 N ATOM 994 CE2 TRP A 444 -3.305 11.069 -3.979 1.00 71.50 C ATOM 995 CE3 TRP A 444 -4.582 9.111 -4.580 1.00 63.54 C ATOM 996 CZ2 TRP A 444 -3.330 10.721 -2.630 1.00 32.34 C ATOM 997 CZ3 TRP A 444 -4.610 8.771 -3.242 1.00 51.25 C ATOM 998 CH2 TRP A 444 -3.983 9.572 -2.280 1.00 65.12 C ATOM 0 H TRP A 444 -4.871 12.787 -8.003 1.00 32.53 H new ATOM 0 HA TRP A 444 -2.642 11.238 -8.862 1.00 3.34 H new ATOM 0 HB2 TRP A 444 -5.282 10.417 -7.560 1.00 42.40 H new ATOM 0 HB3 TRP A 444 -3.870 9.387 -7.694 1.00 42.40 H new ATOM 0 HD1 TRP A 444 -2.619 12.762 -6.694 1.00 31.52 H new ATOM 0 HE1 TRP A 444 -2.221 12.898 -4.145 1.00 62.24 H new ATOM 0 HE3 TRP A 444 -5.061 8.483 -5.317 1.00 63.54 H new ATOM 0 HZ2 TRP A 444 -2.849 11.338 -1.886 1.00 32.34 H new ATOM 0 HZ3 TRP A 444 -5.124 7.873 -2.933 1.00 51.25 H new ATOM 0 HH2 TRP A 444 -4.016 9.277 -1.242 1.00 65.12 H new ATOM 1009 N PRO A 445 -3.396 9.652 -10.795 1.00 72.14 N ATOM 1010 CA PRO A 445 -3.735 8.994 -12.105 1.00 43.44 C ATOM 1011 C PRO A 445 -4.920 7.988 -12.042 1.00 44.50 C ATOM 1012 O PRO A 445 -5.548 7.808 -11.004 1.00 43.23 O ATOM 1013 CB PRO A 445 -2.416 8.259 -12.479 1.00 73.24 C ATOM 1014 CG PRO A 445 -1.729 8.040 -11.168 1.00 23.33 C ATOM 1015 CD PRO A 445 -2.035 9.264 -10.339 1.00 25.21 C ATOM 0 HA PRO A 445 -4.073 9.733 -12.832 1.00 43.44 H new ATOM 0 HB2 PRO A 445 -2.617 7.315 -12.985 1.00 73.24 H new ATOM 0 HB3 PRO A 445 -1.804 8.858 -13.153 1.00 73.24 H new ATOM 0 HG2 PRO A 445 -2.094 7.136 -10.681 1.00 23.33 H new ATOM 0 HG3 PRO A 445 -0.655 7.918 -11.304 1.00 23.33 H new ATOM 0 HD2 PRO A 445 -2.016 9.043 -9.272 1.00 25.21 H new ATOM 0 HD3 PRO A 445 -1.310 10.059 -10.513 1.00 25.21 H new ATOM 1023 N GLN A 446 -5.204 7.334 -13.186 1.00 21.53 N ATOM 1024 CA GLN A 446 -6.264 6.295 -13.298 1.00 70.32 C ATOM 1025 C GLN A 446 -5.812 4.918 -12.734 1.00 13.41 C ATOM 1026 O GLN A 446 -6.641 4.039 -12.491 1.00 40.55 O ATOM 1027 CB GLN A 446 -6.672 6.140 -14.790 1.00 55.14 C ATOM 1028 CG GLN A 446 -5.535 5.645 -15.719 1.00 52.10 C ATOM 1029 CD GLN A 446 -5.957 5.516 -17.182 1.00 11.23 C ATOM 1030 OE1 GLN A 446 -5.842 6.452 -17.962 1.00 64.13 O ATOM 1031 NE2 GLN A 446 -6.456 4.359 -17.559 1.00 55.21 N ATOM 0 H GLN A 446 -4.709 7.506 -14.061 1.00 21.53 H new ATOM 0 HA GLN A 446 -7.113 6.624 -12.699 1.00 70.32 H new ATOM 0 HB2 GLN A 446 -7.507 5.442 -14.855 1.00 55.14 H new ATOM 0 HB3 GLN A 446 -7.031 7.101 -15.157 1.00 55.14 H new ATOM 0 HG2 GLN A 446 -4.694 6.335 -15.651 1.00 52.10 H new ATOM 0 HG3 GLN A 446 -5.182 4.677 -15.364 1.00 52.10 H new ATOM 0 HE21 GLN A 446 -6.540 3.596 -16.887 1.00 55.21 H new ATOM 0 HE22 GLN A 446 -6.759 4.224 -18.524 1.00 55.21 H new ATOM 1040 N LYS A 447 -4.491 4.747 -12.551 1.00 62.23 N ATOM 1041 CA LYS A 447 -3.877 3.462 -12.159 1.00 3.02 C ATOM 1042 C LYS A 447 -2.612 3.709 -11.289 1.00 12.33 C ATOM 1043 O LYS A 447 -1.768 4.546 -11.624 1.00 64.23 O ATOM 1044 CB LYS A 447 -3.561 2.648 -13.466 1.00 22.33 C ATOM 1045 CG LYS A 447 -3.020 1.195 -13.293 1.00 3.04 C ATOM 1046 CD LYS A 447 -1.489 1.127 -13.052 1.00 50.11 C ATOM 1047 CE LYS A 447 -0.943 -0.307 -13.037 1.00 61.10 C ATOM 1048 NZ LYS A 447 -1.123 -0.993 -14.343 1.00 14.43 N ATOM 0 H LYS A 447 -3.813 5.500 -12.671 1.00 62.23 H new ATOM 0 HA LYS A 447 -4.562 2.878 -11.544 1.00 3.02 H new ATOM 0 HB2 LYS A 447 -4.473 2.599 -14.061 1.00 22.33 H new ATOM 0 HB3 LYS A 447 -2.831 3.212 -14.046 1.00 22.33 H new ATOM 0 HG2 LYS A 447 -3.533 0.723 -12.455 1.00 3.04 H new ATOM 0 HG3 LYS A 447 -3.265 0.616 -14.184 1.00 3.04 H new ATOM 0 HD2 LYS A 447 -0.980 1.695 -13.831 1.00 50.11 H new ATOM 0 HD3 LYS A 447 -1.255 1.608 -12.102 1.00 50.11 H new ATOM 0 HE2 LYS A 447 0.117 -0.287 -12.783 1.00 61.10 H new ATOM 0 HE3 LYS A 447 -1.447 -0.877 -12.257 1.00 61.10 H new ATOM 0 HZ1 LYS A 447 -0.608 -1.896 -14.335 1.00 14.43 H new ATOM 0 HZ2 LYS A 447 -2.135 -1.173 -14.504 1.00 14.43 H new ATOM 0 HZ3 LYS A 447 -0.753 -0.390 -15.106 1.00 14.43 H new ATOM 1062 N LEU A 448 -2.517 2.968 -10.166 1.00 53.54 N ATOM 1063 CA LEU A 448 -1.357 2.965 -9.247 1.00 44.41 C ATOM 1064 C LEU A 448 -0.636 1.593 -9.262 1.00 3.12 C ATOM 1065 O LEU A 448 -1.267 0.547 -9.447 1.00 1.10 O ATOM 1066 CB LEU A 448 -1.826 3.303 -7.804 1.00 44.15 C ATOM 1067 CG LEU A 448 -2.512 4.692 -7.614 1.00 70.12 C ATOM 1068 CD1 LEU A 448 -2.909 4.933 -6.140 1.00 63.13 C ATOM 1069 CD2 LEU A 448 -1.624 5.829 -8.157 1.00 21.54 C ATOM 0 H LEU A 448 -3.262 2.340 -9.865 1.00 53.54 H new ATOM 0 HA LEU A 448 -0.651 3.723 -9.586 1.00 44.41 H new ATOM 0 HB2 LEU A 448 -2.522 2.529 -7.479 1.00 44.15 H new ATOM 0 HB3 LEU A 448 -0.962 3.253 -7.142 1.00 44.15 H new ATOM 0 HG LEU A 448 -3.433 4.688 -8.197 1.00 70.12 H new ATOM 0 HD11 LEU A 448 -3.384 5.910 -6.046 1.00 63.13 H new ATOM 0 HD12 LEU A 448 -3.606 4.159 -5.820 1.00 63.13 H new ATOM 0 HD13 LEU A 448 -2.018 4.901 -5.513 1.00 63.13 H new ATOM 0 HD21 LEU A 448 -2.127 6.785 -8.011 1.00 21.54 H new ATOM 0 HD22 LEU A 448 -0.673 5.834 -7.624 1.00 21.54 H new ATOM 0 HD23 LEU A 448 -1.443 5.673 -9.220 1.00 21.54 H new ATOM 1081 N ILE A 449 0.695 1.620 -9.065 1.00 34.32 N ATOM 1082 CA ILE A 449 1.553 0.408 -9.047 1.00 55.11 C ATOM 1083 C ILE A 449 1.976 0.115 -7.586 1.00 14.01 C ATOM 1084 O ILE A 449 2.335 1.037 -6.856 1.00 22.55 O ATOM 1085 CB ILE A 449 2.847 0.567 -9.964 1.00 62.32 C ATOM 1086 CG1 ILE A 449 2.486 0.800 -11.481 1.00 51.33 C ATOM 1087 CG2 ILE A 449 3.792 -0.664 -9.827 1.00 15.42 C ATOM 1088 CD1 ILE A 449 1.894 2.159 -11.829 1.00 33.11 C ATOM 0 H ILE A 449 1.214 2.485 -8.912 1.00 34.32 H new ATOM 0 HA ILE A 449 0.974 -0.421 -9.453 1.00 55.11 H new ATOM 0 HB ILE A 449 3.367 1.456 -9.606 1.00 62.32 H new ATOM 0 HG12 ILE A 449 3.389 0.658 -12.074 1.00 51.33 H new ATOM 0 HG13 ILE A 449 1.779 0.029 -11.787 1.00 51.33 H new ATOM 0 HG21 ILE A 449 4.665 -0.525 -10.465 1.00 15.42 H new ATOM 0 HG22 ILE A 449 4.112 -0.763 -8.790 1.00 15.42 H new ATOM 0 HG23 ILE A 449 3.261 -1.566 -10.131 1.00 15.42 H new ATOM 0 HD11 ILE A 449 1.687 2.203 -12.898 1.00 33.11 H new ATOM 0 HD12 ILE A 449 0.968 2.305 -11.273 1.00 33.11 H new ATOM 0 HD13 ILE A 449 2.603 2.943 -11.565 1.00 33.11 H new ATOM 1100 N MET A 450 1.945 -1.164 -7.169 1.00 31.24 N ATOM 1101 CA MET A 450 2.265 -1.567 -5.778 1.00 60.50 C ATOM 1102 C MET A 450 3.333 -2.692 -5.739 1.00 52.34 C ATOM 1103 O MET A 450 3.394 -3.537 -6.636 1.00 73.33 O ATOM 1104 CB MET A 450 0.960 -2.008 -5.057 1.00 64.43 C ATOM 1105 CG MET A 450 1.135 -2.302 -3.564 1.00 31.41 C ATOM 1106 SD MET A 450 -0.417 -2.622 -2.695 1.00 62.44 S ATOM 1107 CE MET A 450 -0.914 -4.199 -3.380 1.00 64.20 C ATOM 0 H MET A 450 1.700 -1.945 -7.778 1.00 31.24 H new ATOM 0 HA MET A 450 2.691 -0.710 -5.256 1.00 60.50 H new ATOM 0 HB2 MET A 450 0.210 -1.226 -5.176 1.00 64.43 H new ATOM 0 HB3 MET A 450 0.571 -2.900 -5.548 1.00 64.43 H new ATOM 0 HG2 MET A 450 1.790 -3.166 -3.448 1.00 31.41 H new ATOM 0 HG3 MET A 450 1.636 -1.456 -3.093 1.00 31.41 H new ATOM 0 HE1 MET A 450 -1.742 -4.604 -2.798 1.00 64.20 H new ATOM 0 HE2 MET A 450 -1.229 -4.063 -4.414 1.00 64.20 H new ATOM 0 HE3 MET A 450 -0.073 -4.892 -3.345 1.00 64.20 H new ATOM 1117 N GLN A 451 4.186 -2.672 -4.694 1.00 71.33 N ATOM 1118 CA GLN A 451 5.217 -3.708 -4.458 1.00 3.01 C ATOM 1119 C GLN A 451 4.932 -4.454 -3.129 1.00 74.14 C ATOM 1120 O GLN A 451 4.946 -3.840 -2.054 1.00 11.32 O ATOM 1121 CB GLN A 451 6.623 -3.046 -4.418 1.00 54.01 C ATOM 1122 CG GLN A 451 7.797 -4.032 -4.226 1.00 24.01 C ATOM 1123 CD GLN A 451 9.174 -3.351 -4.205 1.00 23.14 C ATOM 1124 OE1 GLN A 451 9.821 -3.195 -5.233 1.00 62.54 O ATOM 1125 NE2 GLN A 451 9.624 -2.924 -3.039 1.00 21.33 N ATOM 0 H GLN A 451 4.180 -1.936 -3.988 1.00 71.33 H new ATOM 0 HA GLN A 451 5.190 -4.433 -5.272 1.00 3.01 H new ATOM 0 HB2 GLN A 451 6.777 -2.496 -5.346 1.00 54.01 H new ATOM 0 HB3 GLN A 451 6.643 -2.317 -3.608 1.00 54.01 H new ATOM 0 HG2 GLN A 451 7.655 -4.575 -3.292 1.00 24.01 H new ATOM 0 HG3 GLN A 451 7.777 -4.769 -5.029 1.00 24.01 H new ATOM 0 HE21 GLN A 451 9.068 -3.065 -2.195 1.00 21.33 H new ATOM 0 HE22 GLN A 451 10.527 -2.454 -2.982 1.00 21.33 H new ATOM 1134 N LEU A 452 4.664 -5.776 -3.212 1.00 51.32 N ATOM 1135 CA LEU A 452 4.440 -6.626 -2.020 1.00 2.31 C ATOM 1136 C LEU A 452 5.775 -6.984 -1.328 1.00 51.33 C ATOM 1137 O LEU A 452 6.602 -7.716 -1.882 1.00 42.23 O ATOM 1138 CB LEU A 452 3.686 -7.922 -2.401 1.00 62.40 C ATOM 1139 CG LEU A 452 2.225 -7.741 -2.911 1.00 30.24 C ATOM 1140 CD1 LEU A 452 1.631 -9.103 -3.314 1.00 64.34 C ATOM 1141 CD2 LEU A 452 1.337 -7.026 -1.856 1.00 24.24 C ATOM 0 H LEU A 452 4.597 -6.280 -4.096 1.00 51.32 H new ATOM 0 HA LEU A 452 3.830 -6.053 -1.322 1.00 2.31 H new ATOM 0 HB2 LEU A 452 4.258 -8.437 -3.173 1.00 62.40 H new ATOM 0 HB3 LEU A 452 3.666 -8.576 -1.529 1.00 62.40 H new ATOM 0 HG LEU A 452 2.248 -7.101 -3.793 1.00 30.24 H new ATOM 0 HD11 LEU A 452 0.610 -8.964 -3.669 1.00 64.34 H new ATOM 0 HD12 LEU A 452 2.234 -9.542 -4.108 1.00 64.34 H new ATOM 0 HD13 LEU A 452 1.628 -9.768 -2.451 1.00 64.34 H new ATOM 0 HD21 LEU A 452 0.325 -6.917 -2.246 1.00 24.24 H new ATOM 0 HD22 LEU A 452 1.311 -7.618 -0.941 1.00 24.24 H new ATOM 0 HD23 LEU A 452 1.751 -6.041 -1.640 1.00 24.24 H new ATOM 1153 N ILE A 453 5.975 -6.442 -0.120 1.00 23.13 N ATOM 1154 CA ILE A 453 7.163 -6.702 0.722 1.00 14.14 C ATOM 1155 C ILE A 453 6.708 -7.141 2.138 1.00 33.53 C ATOM 1156 O ILE A 453 5.630 -6.739 2.582 1.00 55.23 O ATOM 1157 CB ILE A 453 8.097 -5.429 0.812 1.00 31.24 C ATOM 1158 CG1 ILE A 453 7.346 -4.198 1.434 1.00 30.12 C ATOM 1159 CG2 ILE A 453 8.677 -5.085 -0.580 1.00 72.33 C ATOM 1160 CD1 ILE A 453 8.201 -2.943 1.610 1.00 53.41 C ATOM 0 H ILE A 453 5.310 -5.800 0.312 1.00 23.13 H new ATOM 0 HA ILE A 453 7.743 -7.502 0.262 1.00 14.14 H new ATOM 0 HB ILE A 453 8.924 -5.669 1.480 1.00 31.24 H new ATOM 0 HG12 ILE A 453 6.494 -3.953 0.800 1.00 30.12 H new ATOM 0 HG13 ILE A 453 6.948 -4.488 2.406 1.00 30.12 H new ATOM 0 HG21 ILE A 453 9.317 -4.207 -0.500 1.00 72.33 H new ATOM 0 HG22 ILE A 453 9.261 -5.928 -0.949 1.00 72.33 H new ATOM 0 HG23 ILE A 453 7.861 -4.878 -1.273 1.00 72.33 H new ATOM 0 HD11 ILE A 453 7.595 -2.148 2.046 1.00 53.41 H new ATOM 0 HD12 ILE A 453 9.040 -3.164 2.270 1.00 53.41 H new ATOM 0 HD13 ILE A 453 8.579 -2.621 0.640 1.00 53.41 H new ATOM 1172 N PRO A 454 7.500 -7.992 2.866 1.00 31.03 N ATOM 1173 CA PRO A 454 7.135 -8.427 4.239 1.00 14.34 C ATOM 1174 C PRO A 454 7.119 -7.243 5.243 1.00 75.21 C ATOM 1175 O PRO A 454 8.017 -6.388 5.229 1.00 24.24 O ATOM 1176 CB PRO A 454 8.226 -9.475 4.590 1.00 4.42 C ATOM 1177 CG PRO A 454 9.390 -9.113 3.718 1.00 15.12 C ATOM 1178 CD PRO A 454 8.788 -8.597 2.424 1.00 74.30 C ATOM 0 HA PRO A 454 6.126 -8.836 4.294 1.00 14.34 H new ATOM 0 HB2 PRO A 454 8.493 -9.432 5.646 1.00 4.42 H new ATOM 0 HB3 PRO A 454 7.881 -10.489 4.390 1.00 4.42 H new ATOM 0 HG2 PRO A 454 10.012 -8.353 4.191 1.00 15.12 H new ATOM 0 HG3 PRO A 454 10.027 -9.979 3.536 1.00 15.12 H new ATOM 0 HD2 PRO A 454 9.434 -7.862 1.944 1.00 74.30 H new ATOM 0 HD3 PRO A 454 8.630 -9.401 1.705 1.00 74.30 H new ATOM 1186 N GLN A 455 6.092 -7.215 6.115 1.00 64.14 N ATOM 1187 CA GLN A 455 5.900 -6.148 7.126 1.00 73.51 C ATOM 1188 C GLN A 455 7.038 -6.174 8.199 1.00 35.01 C ATOM 1189 O GLN A 455 7.223 -5.216 8.962 1.00 0.41 O ATOM 1190 CB GLN A 455 4.485 -6.299 7.759 1.00 74.45 C ATOM 1191 CG GLN A 455 3.959 -5.042 8.481 1.00 63.52 C ATOM 1192 CD GLN A 455 2.565 -5.207 9.110 1.00 32.14 C ATOM 1193 OE1 GLN A 455 2.168 -6.297 9.512 1.00 3.14 O ATOM 1194 NE2 GLN A 455 1.822 -4.116 9.223 1.00 50.14 N ATOM 0 H GLN A 455 5.368 -7.933 6.141 1.00 64.14 H new ATOM 0 HA GLN A 455 5.960 -5.172 6.645 1.00 73.51 H new ATOM 0 HB2 GLN A 455 3.779 -6.572 6.974 1.00 74.45 H new ATOM 0 HB3 GLN A 455 4.507 -7.126 8.469 1.00 74.45 H new ATOM 0 HG2 GLN A 455 4.666 -4.764 9.262 1.00 63.52 H new ATOM 0 HG3 GLN A 455 3.928 -4.216 7.771 1.00 63.52 H new ATOM 0 HE21 GLN A 455 2.174 -3.222 8.881 1.00 50.14 H new ATOM 0 HE22 GLN A 455 0.898 -4.170 9.652 1.00 50.14 H new ATOM 1203 N GLN A 456 7.787 -7.297 8.223 1.00 43.41 N ATOM 1204 CA GLN A 456 9.076 -7.451 8.944 1.00 2.21 C ATOM 1205 C GLN A 456 10.055 -6.272 8.665 1.00 54.22 C ATOM 1206 O GLN A 456 10.625 -5.687 9.587 1.00 15.32 O ATOM 1207 CB GLN A 456 9.731 -8.788 8.486 1.00 33.04 C ATOM 1208 CG GLN A 456 11.120 -9.100 9.083 1.00 51.32 C ATOM 1209 CD GLN A 456 11.742 -10.382 8.514 1.00 73.44 C ATOM 1210 OE1 GLN A 456 12.464 -10.348 7.521 1.00 4.41 O ATOM 1211 NE2 GLN A 456 11.455 -11.519 9.118 1.00 2.11 N ATOM 0 H GLN A 456 7.508 -8.145 7.730 1.00 43.41 H new ATOM 0 HA GLN A 456 8.874 -7.454 10.015 1.00 2.21 H new ATOM 0 HB2 GLN A 456 9.056 -9.606 8.740 1.00 33.04 H new ATOM 0 HB3 GLN A 456 9.819 -8.773 7.400 1.00 33.04 H new ATOM 0 HG2 GLN A 456 11.789 -8.261 8.890 1.00 51.32 H new ATOM 0 HG3 GLN A 456 11.031 -9.195 10.165 1.00 51.32 H new ATOM 0 HE21 GLN A 456 10.853 -11.521 9.941 1.00 2.11 H new ATOM 0 HE22 GLN A 456 11.835 -12.396 8.762 1.00 2.11 H new ATOM 1220 N LEU A 457 10.221 -5.936 7.370 1.00 41.44 N ATOM 1221 CA LEU A 457 11.176 -4.894 6.906 1.00 43.23 C ATOM 1222 C LEU A 457 10.701 -3.457 7.251 1.00 40.33 C ATOM 1223 O LEU A 457 11.497 -2.516 7.247 1.00 12.20 O ATOM 1224 CB LEU A 457 11.420 -5.048 5.375 1.00 64.01 C ATOM 1225 CG LEU A 457 11.953 -6.444 4.912 1.00 74.43 C ATOM 1226 CD1 LEU A 457 12.172 -6.490 3.389 1.00 23.13 C ATOM 1227 CD2 LEU A 457 13.238 -6.831 5.673 1.00 63.31 C ATOM 0 H LEU A 457 9.700 -6.376 6.612 1.00 41.44 H new ATOM 0 HA LEU A 457 12.115 -5.044 7.438 1.00 43.23 H new ATOM 0 HB2 LEU A 457 10.484 -4.845 4.854 1.00 64.01 H new ATOM 0 HB3 LEU A 457 12.132 -4.285 5.060 1.00 64.01 H new ATOM 0 HG LEU A 457 11.188 -7.182 5.153 1.00 74.43 H new ATOM 0 HD11 LEU A 457 12.542 -7.475 3.104 1.00 23.13 H new ATOM 0 HD12 LEU A 457 11.228 -6.296 2.880 1.00 23.13 H new ATOM 0 HD13 LEU A 457 12.901 -5.732 3.103 1.00 23.13 H new ATOM 0 HD21 LEU A 457 13.585 -7.806 5.330 1.00 63.31 H new ATOM 0 HD22 LEU A 457 14.010 -6.085 5.486 1.00 63.31 H new ATOM 0 HD23 LEU A 457 13.028 -6.876 6.742 1.00 63.31 H new ATOM 1239 N LEU A 458 9.398 -3.301 7.546 1.00 61.30 N ATOM 1240 CA LEU A 458 8.794 -1.988 7.905 1.00 15.05 C ATOM 1241 C LEU A 458 9.124 -1.535 9.350 1.00 21.14 C ATOM 1242 O LEU A 458 8.979 -0.351 9.674 1.00 64.45 O ATOM 1243 CB LEU A 458 7.260 -2.033 7.715 1.00 4.33 C ATOM 1244 CG LEU A 458 6.748 -2.334 6.273 1.00 25.52 C ATOM 1245 CD1 LEU A 458 5.226 -2.125 6.190 1.00 0.34 C ATOM 1246 CD2 LEU A 458 7.495 -1.491 5.214 1.00 51.02 C ATOM 0 H LEU A 458 8.730 -4.072 7.545 1.00 61.30 H new ATOM 0 HA LEU A 458 9.237 -1.255 7.231 1.00 15.05 H new ATOM 0 HB2 LEU A 458 6.855 -2.790 8.386 1.00 4.33 H new ATOM 0 HB3 LEU A 458 6.848 -1.074 8.030 1.00 4.33 H new ATOM 0 HG LEU A 458 6.961 -3.380 6.051 1.00 25.52 H new ATOM 0 HD11 LEU A 458 4.884 -2.339 5.177 1.00 0.34 H new ATOM 0 HD12 LEU A 458 4.728 -2.795 6.890 1.00 0.34 H new ATOM 0 HD13 LEU A 458 4.986 -1.092 6.443 1.00 0.34 H new ATOM 0 HD21 LEU A 458 7.110 -1.729 4.222 1.00 51.02 H new ATOM 0 HD22 LEU A 458 7.342 -0.431 5.418 1.00 51.02 H new ATOM 0 HD23 LEU A 458 8.560 -1.718 5.254 1.00 51.02 H new ATOM 1258 N THR A 459 9.546 -2.483 10.210 1.00 41.12 N ATOM 1259 CA THR A 459 9.825 -2.216 11.651 1.00 14.20 C ATOM 1260 C THR A 459 11.001 -1.227 11.871 1.00 2.33 C ATOM 1261 O THR A 459 11.070 -0.567 12.915 1.00 43.25 O ATOM 1262 CB THR A 459 10.119 -3.541 12.428 1.00 42.11 C ATOM 1263 OG1 THR A 459 11.295 -4.172 11.890 1.00 45.44 O ATOM 1264 CG2 THR A 459 8.929 -4.525 12.364 1.00 62.51 C ATOM 0 H THR A 459 9.705 -3.453 9.936 1.00 41.12 H new ATOM 0 HA THR A 459 8.920 -1.752 12.042 1.00 14.20 H new ATOM 0 HB THR A 459 10.280 -3.280 13.474 1.00 42.11 H new ATOM 0 HG1 THR A 459 11.055 -4.680 11.087 1.00 45.44 H new ATOM 0 HG21 THR A 459 9.176 -5.431 12.917 1.00 62.51 H new ATOM 0 HG22 THR A 459 8.048 -4.060 12.806 1.00 62.51 H new ATOM 0 HG23 THR A 459 8.722 -4.779 11.324 1.00 62.51 H new ATOM 1272 N THR A 460 11.926 -1.133 10.892 1.00 44.45 N ATOM 1273 CA THR A 460 13.038 -0.142 10.929 1.00 20.15 C ATOM 1274 C THR A 460 12.562 1.276 10.521 1.00 40.34 C ATOM 1275 O THR A 460 13.159 2.279 10.925 1.00 34.42 O ATOM 1276 CB THR A 460 14.242 -0.576 10.018 1.00 62.24 C ATOM 1277 OG1 THR A 460 15.326 0.363 10.131 1.00 22.23 O ATOM 1278 CG2 THR A 460 13.853 -0.717 8.536 1.00 52.31 C ATOM 0 H THR A 460 11.930 -1.728 10.064 1.00 44.45 H new ATOM 0 HA THR A 460 13.380 -0.110 11.963 1.00 20.15 H new ATOM 0 HB THR A 460 14.553 -1.558 10.375 1.00 62.24 H new ATOM 0 HG1 THR A 460 16.068 0.077 9.558 1.00 22.23 H new ATOM 0 HG21 THR A 460 14.726 -1.019 7.958 1.00 52.31 H new ATOM 0 HG22 THR A 460 13.073 -1.471 8.435 1.00 52.31 H new ATOM 0 HG23 THR A 460 13.484 0.239 8.164 1.00 52.31 H new ATOM 1286 N LEU A 461 11.456 1.353 9.753 1.00 32.13 N ATOM 1287 CA LEU A 461 10.914 2.635 9.223 1.00 23.14 C ATOM 1288 C LEU A 461 9.945 3.312 10.243 1.00 1.34 C ATOM 1289 O LEU A 461 8.953 3.929 9.845 1.00 72.10 O ATOM 1290 CB LEU A 461 10.176 2.377 7.874 1.00 44.32 C ATOM 1291 CG LEU A 461 10.927 1.525 6.794 1.00 63.43 C ATOM 1292 CD1 LEU A 461 10.063 1.348 5.524 1.00 70.33 C ATOM 1293 CD2 LEU A 461 12.318 2.110 6.449 1.00 13.44 C ATOM 0 H LEU A 461 10.911 0.536 9.480 1.00 32.13 H new ATOM 0 HA LEU A 461 11.751 3.314 9.058 1.00 23.14 H new ATOM 0 HB2 LEU A 461 9.231 1.882 8.096 1.00 44.32 H new ATOM 0 HB3 LEU A 461 9.934 3.343 7.432 1.00 44.32 H new ATOM 0 HG LEU A 461 11.097 0.540 7.228 1.00 63.43 H new ATOM 0 HD11 LEU A 461 10.609 0.753 4.792 1.00 70.33 H new ATOM 0 HD12 LEU A 461 9.134 0.840 5.784 1.00 70.33 H new ATOM 0 HD13 LEU A 461 9.836 2.326 5.099 1.00 70.33 H new ATOM 0 HD21 LEU A 461 12.799 1.485 5.697 1.00 13.44 H new ATOM 0 HD22 LEU A 461 12.201 3.121 6.060 1.00 13.44 H new ATOM 0 HD23 LEU A 461 12.935 2.136 7.347 1.00 13.44 H new ATOM 1305 N GLY A 462 10.278 3.225 11.550 1.00 23.44 N ATOM 1306 CA GLY A 462 9.453 3.788 12.640 1.00 55.14 C ATOM 1307 C GLY A 462 9.069 5.272 12.459 1.00 74.21 C ATOM 1308 O GLY A 462 7.878 5.577 12.359 1.00 50.02 O ATOM 0 H GLY A 462 11.126 2.763 11.878 1.00 23.44 H new ATOM 0 HA2 GLY A 462 8.540 3.199 12.727 1.00 55.14 H new ATOM 0 HA3 GLY A 462 9.994 3.679 13.580 1.00 55.14 H new ATOM 1312 N PRO A 463 10.061 6.229 12.406 1.00 11.33 N ATOM 1313 CA PRO A 463 9.794 7.671 12.116 1.00 4.44 C ATOM 1314 C PRO A 463 9.010 7.934 10.797 1.00 35.21 C ATOM 1315 O PRO A 463 8.280 8.925 10.700 1.00 51.02 O ATOM 1316 CB PRO A 463 11.213 8.294 12.062 1.00 34.14 C ATOM 1317 CG PRO A 463 12.043 7.387 12.921 1.00 2.22 C ATOM 1318 CD PRO A 463 11.508 5.991 12.669 1.00 34.21 C ATOM 0 HA PRO A 463 9.143 8.105 12.875 1.00 4.44 H new ATOM 0 HB2 PRO A 463 11.592 8.334 11.041 1.00 34.14 H new ATOM 0 HB3 PRO A 463 11.215 9.315 12.443 1.00 34.14 H new ATOM 0 HG2 PRO A 463 13.099 7.456 12.659 1.00 2.22 H new ATOM 0 HG3 PRO A 463 11.957 7.656 13.974 1.00 2.22 H new ATOM 0 HD2 PRO A 463 12.000 5.518 11.819 1.00 34.21 H new ATOM 0 HD3 PRO A 463 11.660 5.339 13.529 1.00 34.21 H new ATOM 1326 N LEU A 464 9.161 7.044 9.790 1.00 75.51 N ATOM 1327 CA LEU A 464 8.428 7.150 8.499 1.00 51.55 C ATOM 1328 C LEU A 464 6.912 6.857 8.669 1.00 12.34 C ATOM 1329 O LEU A 464 6.074 7.482 8.014 1.00 1.22 O ATOM 1330 CB LEU A 464 9.062 6.210 7.437 1.00 34.42 C ATOM 1331 CG LEU A 464 10.521 6.574 6.997 1.00 40.55 C ATOM 1332 CD1 LEU A 464 11.092 5.549 5.999 1.00 53.31 C ATOM 1333 CD2 LEU A 464 10.585 8.000 6.410 1.00 22.41 C ATOM 0 H LEU A 464 9.786 6.240 9.843 1.00 75.51 H new ATOM 0 HA LEU A 464 8.518 8.179 8.150 1.00 51.55 H new ATOM 0 HB2 LEU A 464 9.063 5.194 7.832 1.00 34.42 H new ATOM 0 HB3 LEU A 464 8.425 6.208 6.553 1.00 34.42 H new ATOM 0 HG LEU A 464 11.142 6.543 7.892 1.00 40.55 H new ATOM 0 HD11 LEU A 464 12.105 5.839 5.720 1.00 53.31 H new ATOM 0 HD12 LEU A 464 11.111 4.562 6.462 1.00 53.31 H new ATOM 0 HD13 LEU A 464 10.464 5.520 5.108 1.00 53.31 H new ATOM 0 HD21 LEU A 464 11.609 8.226 6.113 1.00 22.41 H new ATOM 0 HD22 LEU A 464 9.932 8.065 5.539 1.00 22.41 H new ATOM 0 HD23 LEU A 464 10.259 8.718 7.162 1.00 22.41 H new ATOM 1345 N PHE A 465 6.570 5.907 9.561 1.00 0.42 N ATOM 1346 CA PHE A 465 5.156 5.576 9.891 1.00 5.34 C ATOM 1347 C PHE A 465 4.597 6.434 11.055 1.00 45.41 C ATOM 1348 O PHE A 465 3.395 6.388 11.330 1.00 23.14 O ATOM 1349 CB PHE A 465 5.022 4.062 10.200 1.00 65.30 C ATOM 1350 CG PHE A 465 5.297 3.171 8.987 1.00 54.02 C ATOM 1351 CD1 PHE A 465 4.458 3.218 7.875 1.00 23.21 C ATOM 1352 CD2 PHE A 465 6.386 2.304 8.943 1.00 61.34 C ATOM 1353 CE1 PHE A 465 4.697 2.431 6.768 1.00 64.21 C ATOM 1354 CE2 PHE A 465 6.623 1.522 7.829 1.00 40.01 C ATOM 1355 CZ PHE A 465 5.778 1.586 6.747 1.00 44.54 C ATOM 0 H PHE A 465 7.253 5.348 10.073 1.00 0.42 H new ATOM 0 HA PHE A 465 4.552 5.817 9.016 1.00 5.34 H new ATOM 0 HB2 PHE A 465 5.714 3.799 11.000 1.00 65.30 H new ATOM 0 HB3 PHE A 465 4.016 3.861 10.569 1.00 65.30 H new ATOM 0 HD1 PHE A 465 3.606 3.882 7.880 1.00 23.21 H new ATOM 0 HD2 PHE A 465 7.053 2.242 9.790 1.00 61.34 H new ATOM 0 HE1 PHE A 465 4.033 2.480 5.917 1.00 64.21 H new ATOM 0 HE2 PHE A 465 7.475 0.858 7.808 1.00 40.01 H new ATOM 0 HZ PHE A 465 5.965 0.971 5.879 1.00 44.54 H new ATOM 1365 N ARG A 466 5.471 7.193 11.741 1.00 54.03 N ATOM 1366 CA ARG A 466 5.048 8.216 12.729 1.00 13.35 C ATOM 1367 C ARG A 466 4.625 9.519 12.008 1.00 15.44 C ATOM 1368 O ARG A 466 3.548 10.074 12.263 1.00 3.13 O ATOM 1369 CB ARG A 466 6.193 8.517 13.731 1.00 43.43 C ATOM 1370 CG ARG A 466 6.520 7.373 14.718 1.00 4.35 C ATOM 1371 CD ARG A 466 7.681 7.734 15.668 1.00 0.34 C ATOM 1372 NE ARG A 466 7.422 8.987 16.408 1.00 73.11 N ATOM 1373 CZ ARG A 466 8.199 9.514 17.330 1.00 41.11 C ATOM 1374 NH1 ARG A 466 9.279 8.921 17.744 1.00 71.23 N ATOM 1375 NH2 ARG A 466 7.860 10.648 17.850 1.00 61.14 N ATOM 0 H ARG A 466 6.482 7.120 11.631 1.00 54.03 H new ATOM 0 HA ARG A 466 4.195 7.822 13.281 1.00 13.35 H new ATOM 0 HB2 ARG A 466 7.094 8.758 13.167 1.00 43.43 H new ATOM 0 HB3 ARG A 466 5.929 9.406 14.304 1.00 43.43 H new ATOM 0 HG2 ARG A 466 5.632 7.138 15.305 1.00 4.35 H new ATOM 0 HG3 ARG A 466 6.778 6.475 14.157 1.00 4.35 H new ATOM 0 HD2 ARG A 466 7.836 6.920 16.376 1.00 0.34 H new ATOM 0 HD3 ARG A 466 8.601 7.836 15.093 1.00 0.34 H new ATOM 0 HE ARG A 466 6.563 9.489 16.184 1.00 73.11 H new ATOM 0 HH11 ARG A 466 9.547 8.018 17.352 1.00 71.23 H new ATOM 0 HH12 ARG A 466 9.858 9.358 18.461 1.00 71.23 H new ATOM 0 HH21 ARG A 466 7.006 11.115 17.544 1.00 61.14 H new ATOM 0 HH22 ARG A 466 8.446 11.076 18.566 1.00 61.14 H new ATOM 1389 N ASN A 467 5.506 9.997 11.111 1.00 65.22 N ATOM 1390 CA ASN A 467 5.279 11.207 10.300 1.00 73.13 C ATOM 1391 C ASN A 467 4.457 10.838 9.036 1.00 13.44 C ATOM 1392 O ASN A 467 5.008 10.703 7.946 1.00 3.13 O ATOM 1393 CB ASN A 467 6.661 11.833 9.932 1.00 42.41 C ATOM 1394 CG ASN A 467 6.579 13.176 9.205 1.00 55.01 C ATOM 1395 OD1 ASN A 467 5.697 13.987 9.465 1.00 24.42 O ATOM 1396 ND2 ASN A 467 7.491 13.417 8.280 1.00 11.33 N ATOM 0 H ASN A 467 6.404 9.550 10.927 1.00 65.22 H new ATOM 0 HA ASN A 467 4.707 11.945 10.861 1.00 73.13 H new ATOM 0 HB2 ASN A 467 7.240 11.964 10.846 1.00 42.41 H new ATOM 0 HB3 ASN A 467 7.209 11.129 9.306 1.00 42.41 H new ATOM 0 HD21 ASN A 467 7.472 14.296 7.762 1.00 11.33 H new ATOM 0 HD22 ASN A 467 8.214 12.725 8.084 1.00 11.33 H new ATOM 1403 N SER A 468 3.133 10.642 9.214 1.00 73.22 N ATOM 1404 CA SER A 468 2.240 10.111 8.149 1.00 63.22 C ATOM 1405 C SER A 468 0.749 10.449 8.403 1.00 15.34 C ATOM 1406 O SER A 468 0.401 11.110 9.390 1.00 43.14 O ATOM 1407 CB SER A 468 2.420 8.573 8.041 1.00 62.41 C ATOM 1408 OG SER A 468 2.051 7.924 9.247 1.00 64.14 O ATOM 0 H SER A 468 2.651 10.844 10.090 1.00 73.22 H new ATOM 0 HA SER A 468 2.524 10.592 7.213 1.00 63.22 H new ATOM 0 HB2 SER A 468 1.814 8.191 7.220 1.00 62.41 H new ATOM 0 HB3 SER A 468 3.459 8.342 7.805 1.00 62.41 H new ATOM 0 HG SER A 468 2.701 8.141 9.947 1.00 64.14 H new ATOM 1414 N ARG A 469 -0.119 10.016 7.462 1.00 31.42 N ATOM 1415 CA ARG A 469 -1.601 10.129 7.575 1.00 73.53 C ATOM 1416 C ARG A 469 -2.294 8.821 7.119 1.00 24.40 C ATOM 1417 O ARG A 469 -1.868 8.201 6.145 1.00 35.21 O ATOM 1418 CB ARG A 469 -2.125 11.318 6.718 1.00 4.11 C ATOM 1419 CG ARG A 469 -1.726 11.261 5.217 1.00 54.33 C ATOM 1420 CD ARG A 469 -2.476 12.283 4.341 1.00 64.51 C ATOM 1421 NE ARG A 469 -3.923 11.968 4.240 1.00 22.32 N ATOM 1422 CZ ARG A 469 -4.908 12.841 4.343 1.00 74.42 C ATOM 1423 NH1 ARG A 469 -4.676 14.076 4.651 1.00 21.05 N ATOM 1424 NH2 ARG A 469 -6.130 12.454 4.160 1.00 62.02 N ATOM 0 H ARG A 469 0.185 9.574 6.594 1.00 31.42 H new ATOM 0 HA ARG A 469 -1.840 10.307 8.623 1.00 73.53 H new ATOM 0 HB2 ARG A 469 -3.212 11.349 6.790 1.00 4.11 H new ATOM 0 HB3 ARG A 469 -1.751 12.249 7.145 1.00 4.11 H new ATOM 0 HG2 ARG A 469 -0.654 11.436 5.128 1.00 54.33 H new ATOM 0 HG3 ARG A 469 -1.918 10.258 4.836 1.00 54.33 H new ATOM 0 HD2 ARG A 469 -2.350 13.282 4.759 1.00 64.51 H new ATOM 0 HD3 ARG A 469 -2.037 12.298 3.343 1.00 64.51 H new ATOM 0 HE ARG A 469 -4.178 10.994 4.077 1.00 22.32 H new ATOM 0 HH11 ARG A 469 -3.720 14.389 4.819 1.00 21.05 H new ATOM 0 HH12 ARG A 469 -5.449 14.737 4.726 1.00 21.05 H new ATOM 0 HH21 ARG A 469 -6.328 11.479 3.937 1.00 62.02 H new ATOM 0 HH22 ARG A 469 -6.895 13.125 4.238 1.00 62.02 H new ATOM 1438 N MET A 470 -3.368 8.417 7.824 1.00 51.43 N ATOM 1439 CA MET A 470 -4.180 7.229 7.455 1.00 12.24 C ATOM 1440 C MET A 470 -5.364 7.599 6.534 1.00 0.54 C ATOM 1441 O MET A 470 -6.176 8.475 6.850 1.00 23.13 O ATOM 1442 CB MET A 470 -4.703 6.489 8.729 1.00 32.05 C ATOM 1443 CG MET A 470 -3.716 5.467 9.285 1.00 14.15 C ATOM 1444 SD MET A 470 -4.190 4.793 10.892 1.00 10.13 S ATOM 1445 CE MET A 470 -2.802 3.704 11.242 1.00 33.21 C ATOM 0 H MET A 470 -3.700 8.897 8.660 1.00 51.43 H new ATOM 0 HA MET A 470 -3.523 6.558 6.901 1.00 12.24 H new ATOM 0 HB2 MET A 470 -4.926 7.225 9.501 1.00 32.05 H new ATOM 0 HB3 MET A 470 -5.639 5.985 8.489 1.00 32.05 H new ATOM 0 HG2 MET A 470 -3.617 4.648 8.573 1.00 14.15 H new ATOM 0 HG3 MET A 470 -2.735 5.934 9.373 1.00 14.15 H new ATOM 0 HE1 MET A 470 -3.012 3.125 12.141 1.00 33.21 H new ATOM 0 HE2 MET A 470 -2.650 3.027 10.402 1.00 33.21 H new ATOM 0 HE3 MET A 470 -1.902 4.299 11.395 1.00 33.21 H new ATOM 1455 N VAL A 471 -5.429 6.909 5.391 1.00 32.34 N ATOM 1456 CA VAL A 471 -6.629 6.861 4.511 1.00 13.42 C ATOM 1457 C VAL A 471 -7.151 5.404 4.463 1.00 13.42 C ATOM 1458 O VAL A 471 -6.486 4.492 4.966 1.00 44.15 O ATOM 1459 CB VAL A 471 -6.346 7.412 3.054 1.00 11.30 C ATOM 1460 CG1 VAL A 471 -5.872 8.887 3.094 1.00 72.20 C ATOM 1461 CG2 VAL A 471 -5.337 6.526 2.280 1.00 54.43 C ATOM 0 H VAL A 471 -4.648 6.358 5.036 1.00 32.34 H new ATOM 0 HA VAL A 471 -7.389 7.519 4.934 1.00 13.42 H new ATOM 0 HB VAL A 471 -7.291 7.373 2.512 1.00 11.30 H new ATOM 0 HG11 VAL A 471 -5.686 9.237 2.079 1.00 72.20 H new ATOM 0 HG12 VAL A 471 -6.643 9.505 3.555 1.00 72.20 H new ATOM 0 HG13 VAL A 471 -4.953 8.958 3.677 1.00 72.20 H new ATOM 0 HG21 VAL A 471 -5.174 6.943 1.286 1.00 54.43 H new ATOM 0 HG22 VAL A 471 -4.391 6.495 2.820 1.00 54.43 H new ATOM 0 HG23 VAL A 471 -5.736 5.516 2.188 1.00 54.43 H new ATOM 1471 N GLN A 472 -8.331 5.177 3.869 1.00 13.02 N ATOM 1472 CA GLN A 472 -8.997 3.852 3.925 1.00 13.02 C ATOM 1473 C GLN A 472 -9.454 3.385 2.524 1.00 34.25 C ATOM 1474 O GLN A 472 -10.220 4.070 1.856 1.00 11.34 O ATOM 1475 CB GLN A 472 -10.184 3.931 4.916 1.00 33.40 C ATOM 1476 CG GLN A 472 -10.912 2.591 5.155 1.00 34.50 C ATOM 1477 CD GLN A 472 -11.905 2.645 6.317 1.00 62.43 C ATOM 1478 OE1 GLN A 472 -12.475 3.686 6.635 1.00 23.34 O ATOM 1479 NE2 GLN A 472 -12.133 1.529 6.951 1.00 65.23 N ATOM 0 H GLN A 472 -8.848 5.884 3.345 1.00 13.02 H new ATOM 0 HA GLN A 472 -8.284 3.107 4.278 1.00 13.02 H new ATOM 0 HB2 GLN A 472 -9.818 4.306 5.872 1.00 33.40 H new ATOM 0 HB3 GLN A 472 -10.904 4.659 4.543 1.00 33.40 H new ATOM 0 HG2 GLN A 472 -11.441 2.305 4.246 1.00 34.50 H new ATOM 0 HG3 GLN A 472 -10.174 1.814 5.352 1.00 34.50 H new ATOM 0 HE21 GLN A 472 -11.649 0.676 6.671 1.00 65.23 H new ATOM 0 HE22 GLN A 472 -12.795 1.509 7.727 1.00 65.23 H new ATOM 1488 N PHE A 473 -8.986 2.196 2.103 1.00 3.41 N ATOM 1489 CA PHE A 473 -9.256 1.637 0.756 1.00 21.52 C ATOM 1490 C PHE A 473 -10.485 0.693 0.753 1.00 13.34 C ATOM 1491 O PHE A 473 -10.674 -0.116 1.667 1.00 14.20 O ATOM 1492 CB PHE A 473 -8.009 0.875 0.222 1.00 73.43 C ATOM 1493 CG PHE A 473 -6.828 1.762 -0.182 1.00 75.30 C ATOM 1494 CD1 PHE A 473 -6.150 2.535 0.761 1.00 25.54 C ATOM 1495 CD2 PHE A 473 -6.395 1.817 -1.511 1.00 14.23 C ATOM 1496 CE1 PHE A 473 -5.081 3.327 0.392 1.00 42.33 C ATOM 1497 CE2 PHE A 473 -5.322 2.610 -1.876 1.00 33.53 C ATOM 1498 CZ PHE A 473 -4.668 3.368 -0.927 1.00 43.23 C ATOM 0 H PHE A 473 -8.408 1.590 2.685 1.00 3.41 H new ATOM 0 HA PHE A 473 -9.478 2.479 0.100 1.00 21.52 H new ATOM 0 HB2 PHE A 473 -7.673 0.177 0.989 1.00 73.43 H new ATOM 0 HB3 PHE A 473 -8.308 0.280 -0.641 1.00 73.43 H new ATOM 0 HD1 PHE A 473 -6.466 2.514 1.794 1.00 25.54 H new ATOM 0 HD2 PHE A 473 -6.905 1.232 -2.262 1.00 14.23 H new ATOM 0 HE1 PHE A 473 -4.566 3.916 1.136 1.00 42.33 H new ATOM 0 HE2 PHE A 473 -4.996 2.636 -2.905 1.00 33.53 H new ATOM 0 HZ PHE A 473 -3.835 3.992 -1.214 1.00 43.23 H new ATOM 1508 N HIS A 474 -11.304 0.815 -0.309 1.00 20.41 N ATOM 1509 CA HIS A 474 -12.421 -0.105 -0.613 1.00 52.23 C ATOM 1510 C HIS A 474 -12.275 -0.590 -2.080 1.00 55.23 C ATOM 1511 O HIS A 474 -12.245 0.222 -3.001 1.00 40.24 O ATOM 1512 CB HIS A 474 -13.781 0.610 -0.387 1.00 61.41 C ATOM 1513 CG HIS A 474 -14.987 -0.269 -0.630 1.00 22.31 C ATOM 1514 ND1 HIS A 474 -15.355 -1.247 0.265 1.00 21.45 N ATOM 1515 CD2 HIS A 474 -15.845 -0.298 -1.682 1.00 21.30 C ATOM 1516 CE1 HIS A 474 -16.413 -1.842 -0.255 1.00 73.22 C ATOM 1517 NE2 HIS A 474 -16.746 -1.303 -1.433 1.00 25.23 N ATOM 0 H HIS A 474 -11.208 1.567 -0.992 1.00 20.41 H new ATOM 0 HA HIS A 474 -12.392 -0.968 0.053 1.00 52.23 H new ATOM 0 HB2 HIS A 474 -13.817 0.984 0.636 1.00 61.41 H new ATOM 0 HB3 HIS A 474 -13.838 1.477 -1.045 1.00 61.41 H new ATOM 0 HD2 HIS A 474 -15.823 0.346 -2.549 1.00 21.30 H new ATOM 0 HE1 HIS A 474 -16.942 -2.660 0.212 1.00 73.22 H new ATOM 0 HE2 HIS A 474 -17.522 -1.585 -2.032 1.00 25.23 H new ATOM 1525 N PHE A 475 -12.184 -1.913 -2.283 1.00 63.23 N ATOM 1526 CA PHE A 475 -11.862 -2.520 -3.607 1.00 11.41 C ATOM 1527 C PHE A 475 -13.112 -3.013 -4.377 1.00 12.24 C ATOM 1528 O PHE A 475 -12.962 -3.667 -5.414 1.00 71.44 O ATOM 1529 CB PHE A 475 -10.852 -3.682 -3.400 1.00 12.44 C ATOM 1530 CG PHE A 475 -9.482 -3.223 -2.897 1.00 62.41 C ATOM 1531 CD1 PHE A 475 -9.214 -3.084 -1.536 1.00 52.55 C ATOM 1532 CD2 PHE A 475 -8.463 -2.923 -3.794 1.00 52.34 C ATOM 1533 CE1 PHE A 475 -7.971 -2.664 -1.100 1.00 4.20 C ATOM 1534 CE2 PHE A 475 -7.226 -2.508 -3.355 1.00 25.30 C ATOM 1535 CZ PHE A 475 -6.978 -2.375 -2.006 1.00 11.15 C ATOM 0 H PHE A 475 -12.329 -2.600 -1.544 1.00 63.23 H new ATOM 0 HA PHE A 475 -11.421 -1.739 -4.227 1.00 11.41 H new ATOM 0 HB2 PHE A 475 -11.271 -4.393 -2.688 1.00 12.44 H new ATOM 0 HB3 PHE A 475 -10.724 -4.213 -4.343 1.00 12.44 H new ATOM 0 HD1 PHE A 475 -9.986 -3.307 -0.814 1.00 52.55 H new ATOM 0 HD2 PHE A 475 -8.645 -3.017 -4.854 1.00 52.34 H new ATOM 0 HE1 PHE A 475 -7.779 -2.562 -0.042 1.00 4.20 H new ATOM 0 HE2 PHE A 475 -6.448 -2.286 -4.070 1.00 25.30 H new ATOM 0 HZ PHE A 475 -6.009 -2.045 -1.662 1.00 11.15 H new ATOM 1545 N THR A 476 -14.318 -2.650 -3.874 1.00 20.15 N ATOM 1546 CA THR A 476 -15.660 -3.062 -4.412 1.00 14.42 C ATOM 1547 C THR A 476 -15.860 -4.605 -4.442 1.00 0.45 C ATOM 1548 O THR A 476 -15.001 -5.338 -4.930 1.00 43.22 O ATOM 1549 CB THR A 476 -16.016 -2.445 -5.829 1.00 4.02 C ATOM 1550 OG1 THR A 476 -15.278 -3.072 -6.893 1.00 31.51 O ATOM 1551 CG2 THR A 476 -15.764 -0.922 -5.871 1.00 23.03 C ATOM 0 H THR A 476 -14.397 -2.044 -3.058 1.00 20.15 H new ATOM 0 HA THR A 476 -16.360 -2.636 -3.693 1.00 14.42 H new ATOM 0 HB THR A 476 -17.079 -2.635 -5.979 1.00 4.02 H new ATOM 0 HG1 THR A 476 -14.467 -3.486 -6.529 1.00 31.51 H new ATOM 0 HG21 THR A 476 -16.020 -0.538 -6.858 1.00 23.03 H new ATOM 0 HG22 THR A 476 -16.381 -0.430 -5.119 1.00 23.03 H new ATOM 0 HG23 THR A 476 -14.713 -0.721 -5.665 1.00 23.03 H new ATOM 1559 N ASN A 477 -17.017 -5.082 -3.910 1.00 5.34 N ATOM 1560 CA ASN A 477 -17.361 -6.534 -3.813 1.00 1.00 C ATOM 1561 C ASN A 477 -16.362 -7.325 -2.908 1.00 12.24 C ATOM 1562 O ASN A 477 -15.581 -6.735 -2.152 1.00 63.32 O ATOM 1563 CB ASN A 477 -17.460 -7.186 -5.234 1.00 33.12 C ATOM 1564 CG ASN A 477 -18.513 -6.538 -6.137 1.00 31.15 C ATOM 1565 OD1 ASN A 477 -19.527 -6.029 -5.671 1.00 23.33 O ATOM 1566 ND2 ASN A 477 -18.286 -6.561 -7.441 1.00 54.11 N ATOM 0 H ASN A 477 -17.742 -4.471 -3.534 1.00 5.34 H new ATOM 0 HA ASN A 477 -18.339 -6.593 -3.336 1.00 1.00 H new ATOM 0 HB2 ASN A 477 -16.487 -7.122 -5.722 1.00 33.12 H new ATOM 0 HB3 ASN A 477 -17.692 -8.245 -5.123 1.00 33.12 H new ATOM 0 HD21 ASN A 477 -18.962 -6.149 -8.084 1.00 54.11 H new ATOM 0 HD22 ASN A 477 -17.435 -6.991 -7.803 1.00 54.11 H new ATOM 1573 N LYS A 478 -16.442 -8.669 -2.952 1.00 24.54 N ATOM 1574 CA LYS A 478 -15.434 -9.580 -2.333 1.00 54.53 C ATOM 1575 C LYS A 478 -15.142 -10.778 -3.272 1.00 71.50 C ATOM 1576 O LYS A 478 -14.366 -11.680 -2.942 1.00 72.51 O ATOM 1577 CB LYS A 478 -15.908 -10.082 -0.928 1.00 31.01 C ATOM 1578 CG LYS A 478 -17.101 -11.085 -0.921 1.00 1.35 C ATOM 1579 CD LYS A 478 -18.472 -10.466 -1.287 1.00 63.22 C ATOM 1580 CE LYS A 478 -18.967 -9.414 -0.273 1.00 22.34 C ATOM 1581 NZ LYS A 478 -20.344 -8.958 -0.583 1.00 22.41 N ATOM 0 H LYS A 478 -17.204 -9.163 -3.416 1.00 24.54 H new ATOM 0 HA LYS A 478 -14.513 -9.016 -2.190 1.00 54.53 H new ATOM 0 HB2 LYS A 478 -15.061 -10.554 -0.429 1.00 31.01 H new ATOM 0 HB3 LYS A 478 -16.187 -9.214 -0.330 1.00 31.01 H new ATOM 0 HG2 LYS A 478 -16.884 -11.891 -1.622 1.00 1.35 H new ATOM 0 HG3 LYS A 478 -17.174 -11.534 0.069 1.00 1.35 H new ATOM 0 HD2 LYS A 478 -18.401 -10.004 -2.272 1.00 63.22 H new ATOM 0 HD3 LYS A 478 -19.212 -11.263 -1.362 1.00 63.22 H new ATOM 0 HE2 LYS A 478 -18.941 -9.836 0.731 1.00 22.34 H new ATOM 0 HE3 LYS A 478 -18.291 -8.559 -0.277 1.00 22.34 H new ATOM 0 HZ1 LYS A 478 -20.642 -8.252 0.120 1.00 22.41 H new ATOM 0 HZ2 LYS A 478 -20.363 -8.532 -1.532 1.00 22.41 H new ATOM 0 HZ3 LYS A 478 -20.993 -9.770 -0.555 1.00 22.41 H new ATOM 1595 N ASP A 479 -15.747 -10.725 -4.470 1.00 64.32 N ATOM 1596 CA ASP A 479 -15.812 -11.846 -5.432 1.00 43.32 C ATOM 1597 C ASP A 479 -14.581 -11.906 -6.370 1.00 20.41 C ATOM 1598 O ASP A 479 -14.423 -12.870 -7.130 1.00 54.42 O ATOM 1599 CB ASP A 479 -17.117 -11.700 -6.251 1.00 34.24 C ATOM 1600 CG ASP A 479 -18.360 -11.594 -5.347 1.00 1.33 C ATOM 1601 OD1 ASP A 479 -18.658 -10.472 -4.851 1.00 72.25 O ATOM 1602 OD2 ASP A 479 -19.027 -12.624 -5.108 1.00 13.53 O ATOM 0 H ASP A 479 -16.216 -9.884 -4.807 1.00 64.32 H new ATOM 0 HA ASP A 479 -15.807 -12.783 -4.875 1.00 43.32 H new ATOM 0 HB2 ASP A 479 -17.051 -10.813 -6.882 1.00 34.24 H new ATOM 0 HB3 ASP A 479 -17.225 -12.557 -6.916 1.00 34.24 H new ATOM 1607 N LEU A 480 -13.722 -10.876 -6.301 1.00 43.21 N ATOM 1608 CA LEU A 480 -12.535 -10.757 -7.169 1.00 61.01 C ATOM 1609 C LEU A 480 -11.419 -11.729 -6.709 1.00 31.41 C ATOM 1610 O LEU A 480 -11.108 -11.807 -5.515 1.00 3.20 O ATOM 1611 CB LEU A 480 -12.007 -9.288 -7.205 1.00 10.42 C ATOM 1612 CG LEU A 480 -12.975 -8.178 -7.760 1.00 32.53 C ATOM 1613 CD1 LEU A 480 -13.583 -8.575 -9.118 1.00 62.34 C ATOM 1614 CD2 LEU A 480 -14.058 -7.788 -6.734 1.00 60.15 C ATOM 0 H LEU A 480 -13.829 -10.103 -5.644 1.00 43.21 H new ATOM 0 HA LEU A 480 -12.833 -11.031 -8.181 1.00 61.01 H new ATOM 0 HB2 LEU A 480 -11.722 -9.009 -6.191 1.00 10.42 H new ATOM 0 HB3 LEU A 480 -11.098 -9.272 -7.807 1.00 10.42 H new ATOM 0 HG LEU A 480 -12.370 -7.287 -7.931 1.00 32.53 H new ATOM 0 HD11 LEU A 480 -14.245 -7.782 -9.466 1.00 62.34 H new ATOM 0 HD12 LEU A 480 -12.784 -8.726 -9.844 1.00 62.34 H new ATOM 0 HD13 LEU A 480 -14.151 -9.499 -9.006 1.00 62.34 H new ATOM 0 HD21 LEU A 480 -14.703 -7.019 -7.160 1.00 60.15 H new ATOM 0 HD22 LEU A 480 -14.655 -8.665 -6.484 1.00 60.15 H new ATOM 0 HD23 LEU A 480 -13.583 -7.404 -5.832 1.00 60.15 H new ATOM 1626 N GLU A 481 -10.815 -12.445 -7.677 1.00 42.21 N ATOM 1627 CA GLU A 481 -9.806 -13.503 -7.416 1.00 24.44 C ATOM 1628 C GLU A 481 -8.529 -12.921 -6.756 1.00 52.42 C ATOM 1629 O GLU A 481 -8.023 -13.452 -5.758 1.00 31.44 O ATOM 1630 CB GLU A 481 -9.451 -14.221 -8.753 1.00 13.25 C ATOM 1631 CG GLU A 481 -10.673 -14.755 -9.536 1.00 52.32 C ATOM 1632 CD GLU A 481 -10.309 -15.524 -10.819 1.00 5.25 C ATOM 1633 OE1 GLU A 481 -10.114 -16.759 -10.756 1.00 53.33 O ATOM 1634 OE2 GLU A 481 -10.222 -14.900 -11.902 1.00 20.44 O ATOM 0 H GLU A 481 -11.011 -12.309 -8.669 1.00 42.21 H new ATOM 0 HA GLU A 481 -10.233 -14.223 -6.718 1.00 24.44 H new ATOM 0 HB2 GLU A 481 -8.902 -13.527 -9.389 1.00 13.25 H new ATOM 0 HB3 GLU A 481 -8.781 -15.053 -8.537 1.00 13.25 H new ATOM 0 HG2 GLU A 481 -11.251 -15.410 -8.884 1.00 52.32 H new ATOM 0 HG3 GLU A 481 -11.318 -13.916 -9.798 1.00 52.32 H new ATOM 1641 N SER A 482 -8.045 -11.805 -7.321 1.00 53.04 N ATOM 1642 CA SER A 482 -6.853 -11.070 -6.823 1.00 61.03 C ATOM 1643 C SER A 482 -7.103 -10.411 -5.442 1.00 4.24 C ATOM 1644 O SER A 482 -6.162 -10.180 -4.686 1.00 72.30 O ATOM 1645 CB SER A 482 -6.429 -9.998 -7.858 1.00 52.24 C ATOM 1646 OG SER A 482 -6.098 -10.594 -9.103 1.00 53.11 O ATOM 0 H SER A 482 -8.468 -11.376 -8.144 1.00 53.04 H new ATOM 0 HA SER A 482 -6.050 -11.795 -6.692 1.00 61.03 H new ATOM 0 HB2 SER A 482 -7.239 -9.282 -7.998 1.00 52.24 H new ATOM 0 HB3 SER A 482 -5.573 -9.440 -7.479 1.00 52.24 H new ATOM 0 HG SER A 482 -5.835 -9.897 -9.740 1.00 53.11 H new ATOM 1652 N LEU A 483 -8.382 -10.105 -5.139 1.00 24.45 N ATOM 1653 CA LEU A 483 -8.799 -9.519 -3.838 1.00 63.23 C ATOM 1654 C LEU A 483 -8.709 -10.561 -2.706 1.00 1.31 C ATOM 1655 O LEU A 483 -8.158 -10.282 -1.643 1.00 24.31 O ATOM 1656 CB LEU A 483 -10.235 -8.949 -3.967 1.00 51.15 C ATOM 1657 CG LEU A 483 -10.864 -8.267 -2.712 1.00 33.24 C ATOM 1658 CD1 LEU A 483 -9.955 -7.160 -2.120 1.00 31.12 C ATOM 1659 CD2 LEU A 483 -12.266 -7.717 -3.057 1.00 43.43 C ATOM 0 H LEU A 483 -9.157 -10.255 -5.785 1.00 24.45 H new ATOM 0 HA LEU A 483 -8.120 -8.707 -3.579 1.00 63.23 H new ATOM 0 HB2 LEU A 483 -10.235 -8.221 -4.778 1.00 51.15 H new ATOM 0 HB3 LEU A 483 -10.893 -9.764 -4.270 1.00 51.15 H new ATOM 0 HG LEU A 483 -10.963 -9.027 -1.937 1.00 33.24 H new ATOM 0 HD11 LEU A 483 -10.440 -6.718 -1.249 1.00 31.12 H new ATOM 0 HD12 LEU A 483 -9.000 -7.594 -1.823 1.00 31.12 H new ATOM 0 HD13 LEU A 483 -9.785 -6.389 -2.871 1.00 31.12 H new ATOM 0 HD21 LEU A 483 -12.698 -7.243 -2.176 1.00 43.43 H new ATOM 0 HD22 LEU A 483 -12.182 -6.984 -3.859 1.00 43.43 H new ATOM 0 HD23 LEU A 483 -12.909 -8.536 -3.380 1.00 43.43 H new ATOM 1671 N LYS A 484 -9.238 -11.769 -2.967 1.00 5.14 N ATOM 1672 CA LYS A 484 -9.135 -12.928 -2.037 1.00 50.13 C ATOM 1673 C LYS A 484 -7.659 -13.308 -1.790 1.00 20.42 C ATOM 1674 O LYS A 484 -7.268 -13.681 -0.674 1.00 22.30 O ATOM 1675 CB LYS A 484 -9.902 -14.138 -2.623 1.00 43.33 C ATOM 1676 CG LYS A 484 -11.389 -13.860 -2.923 1.00 71.41 C ATOM 1677 CD LYS A 484 -12.101 -15.070 -3.562 1.00 70.34 C ATOM 1678 CE LYS A 484 -13.569 -14.781 -3.919 1.00 32.31 C ATOM 1679 NZ LYS A 484 -14.238 -15.981 -4.480 1.00 71.44 N ATOM 0 H LYS A 484 -9.750 -11.978 -3.824 1.00 5.14 H new ATOM 0 HA LYS A 484 -9.578 -12.645 -1.082 1.00 50.13 H new ATOM 0 HB2 LYS A 484 -9.410 -14.454 -3.543 1.00 43.33 H new ATOM 0 HB3 LYS A 484 -9.834 -14.971 -1.923 1.00 43.33 H new ATOM 0 HG2 LYS A 484 -11.898 -13.590 -1.998 1.00 71.41 H new ATOM 0 HG3 LYS A 484 -11.467 -13.003 -3.591 1.00 71.41 H new ATOM 0 HD2 LYS A 484 -11.565 -15.366 -4.464 1.00 70.34 H new ATOM 0 HD3 LYS A 484 -12.059 -15.915 -2.874 1.00 70.34 H new ATOM 0 HE2 LYS A 484 -14.103 -14.448 -3.029 1.00 32.31 H new ATOM 0 HE3 LYS A 484 -13.615 -13.966 -4.641 1.00 32.31 H new ATOM 0 HZ1 LYS A 484 -15.226 -15.752 -4.710 1.00 71.44 H new ATOM 0 HZ2 LYS A 484 -13.743 -16.283 -5.343 1.00 71.44 H new ATOM 0 HZ3 LYS A 484 -14.215 -16.750 -3.781 1.00 71.44 H new ATOM 1693 N GLY A 485 -6.853 -13.187 -2.862 1.00 24.53 N ATOM 1694 CA GLY A 485 -5.402 -13.333 -2.781 1.00 74.13 C ATOM 1695 C GLY A 485 -4.739 -12.259 -1.913 1.00 60.23 C ATOM 1696 O GLY A 485 -3.887 -12.572 -1.095 1.00 0.00 O ATOM 0 H GLY A 485 -7.196 -12.986 -3.801 1.00 24.53 H new ATOM 0 HA2 GLY A 485 -5.164 -14.317 -2.377 1.00 74.13 H new ATOM 0 HA3 GLY A 485 -4.982 -13.291 -3.786 1.00 74.13 H new ATOM 1700 N LEU A 486 -5.175 -10.993 -2.078 1.00 53.14 N ATOM 1701 CA LEU A 486 -4.636 -9.832 -1.323 1.00 62.11 C ATOM 1702 C LEU A 486 -4.929 -9.966 0.198 1.00 64.13 C ATOM 1703 O LEU A 486 -4.083 -9.633 1.030 1.00 14.30 O ATOM 1704 CB LEU A 486 -5.232 -8.508 -1.886 1.00 44.12 C ATOM 1705 CG LEU A 486 -4.621 -7.173 -1.343 1.00 40.11 C ATOM 1706 CD1 LEU A 486 -3.102 -7.082 -1.626 1.00 52.44 C ATOM 1707 CD2 LEU A 486 -5.371 -5.944 -1.915 1.00 14.14 C ATOM 0 H LEU A 486 -5.911 -10.742 -2.738 1.00 53.14 H new ATOM 0 HA LEU A 486 -3.553 -9.812 -1.449 1.00 62.11 H new ATOM 0 HB2 LEU A 486 -5.118 -8.518 -2.970 1.00 44.12 H new ATOM 0 HB3 LEU A 486 -6.302 -8.501 -1.678 1.00 44.12 H new ATOM 0 HG LEU A 486 -4.750 -7.172 -0.261 1.00 40.11 H new ATOM 0 HD11 LEU A 486 -2.715 -6.142 -1.234 1.00 52.44 H new ATOM 0 HD12 LEU A 486 -2.591 -7.915 -1.142 1.00 52.44 H new ATOM 0 HD13 LEU A 486 -2.929 -7.126 -2.701 1.00 52.44 H new ATOM 0 HD21 LEU A 486 -4.926 -5.030 -1.521 1.00 14.14 H new ATOM 0 HD22 LEU A 486 -5.295 -5.945 -3.002 1.00 14.14 H new ATOM 0 HD23 LEU A 486 -6.421 -5.991 -1.624 1.00 14.14 H new ATOM 1719 N TYR A 487 -6.127 -10.487 0.536 1.00 2.12 N ATOM 1720 CA TYR A 487 -6.511 -10.826 1.931 1.00 13.13 C ATOM 1721 C TYR A 487 -5.536 -11.856 2.571 1.00 70.44 C ATOM 1722 O TYR A 487 -5.108 -11.692 3.719 1.00 73.42 O ATOM 1723 CB TYR A 487 -7.967 -11.381 1.975 1.00 41.42 C ATOM 1724 CG TYR A 487 -9.078 -10.312 1.915 1.00 1.34 C ATOM 1725 CD1 TYR A 487 -9.249 -9.410 2.966 1.00 60.14 C ATOM 1726 CD2 TYR A 487 -9.961 -10.216 0.835 1.00 31.11 C ATOM 1727 CE1 TYR A 487 -10.246 -8.458 2.943 1.00 32.44 C ATOM 1728 CE2 TYR A 487 -10.961 -9.262 0.810 1.00 12.20 C ATOM 1729 CZ TYR A 487 -11.099 -8.385 1.863 1.00 61.21 C ATOM 1730 OH TYR A 487 -12.092 -7.428 1.840 1.00 31.32 O ATOM 0 H TYR A 487 -6.858 -10.686 -0.147 1.00 2.12 H new ATOM 0 HA TYR A 487 -6.454 -9.906 2.513 1.00 13.13 H new ATOM 0 HB2 TYR A 487 -8.102 -12.070 1.141 1.00 41.42 H new ATOM 0 HB3 TYR A 487 -8.091 -11.960 2.890 1.00 41.42 H new ATOM 0 HD1 TYR A 487 -8.585 -9.459 3.817 1.00 60.14 H new ATOM 0 HD2 TYR A 487 -9.860 -10.900 0.005 1.00 31.11 H new ATOM 0 HE1 TYR A 487 -10.358 -7.771 3.769 1.00 32.44 H new ATOM 0 HE2 TYR A 487 -11.633 -9.204 -0.034 1.00 12.20 H new ATOM 0 HH TYR A 487 -12.606 -7.509 1.009 1.00 31.32 H new ATOM 1740 N ARG A 488 -5.193 -12.906 1.800 1.00 52.02 N ATOM 1741 CA ARG A 488 -4.303 -14.004 2.256 1.00 61.51 C ATOM 1742 C ARG A 488 -2.834 -13.515 2.395 1.00 75.42 C ATOM 1743 O ARG A 488 -2.166 -13.821 3.380 1.00 22.13 O ATOM 1744 CB ARG A 488 -4.423 -15.218 1.270 1.00 23.52 C ATOM 1745 CG ARG A 488 -3.872 -16.581 1.794 1.00 3.44 C ATOM 1746 CD ARG A 488 -2.349 -16.782 1.619 1.00 31.24 C ATOM 1747 NE ARG A 488 -1.865 -17.986 2.326 1.00 72.42 N ATOM 1748 CZ ARG A 488 -1.848 -19.215 1.846 1.00 12.41 C ATOM 1749 NH1 ARG A 488 -2.263 -19.492 0.649 1.00 52.45 N ATOM 1750 NH2 ARG A 488 -1.409 -20.176 2.588 1.00 12.33 N ATOM 0 H ARG A 488 -5.523 -13.022 0.842 1.00 52.02 H new ATOM 0 HA ARG A 488 -4.618 -14.332 3.247 1.00 61.51 H new ATOM 0 HB2 ARG A 488 -5.474 -15.349 1.012 1.00 23.52 H new ATOM 0 HB3 ARG A 488 -3.897 -14.966 0.349 1.00 23.52 H new ATOM 0 HG2 ARG A 488 -4.116 -16.671 2.853 1.00 3.44 H new ATOM 0 HG3 ARG A 488 -4.391 -17.388 1.277 1.00 3.44 H new ATOM 0 HD2 ARG A 488 -2.114 -16.866 0.558 1.00 31.24 H new ATOM 0 HD3 ARG A 488 -1.822 -15.905 1.994 1.00 31.24 H new ATOM 0 HE ARG A 488 -1.511 -17.855 3.274 1.00 72.42 H new ATOM 0 HH11 ARG A 488 -2.617 -18.748 0.047 1.00 52.45 H new ATOM 0 HH12 ARG A 488 -2.236 -20.453 0.310 1.00 52.45 H new ATOM 0 HH21 ARG A 488 -1.080 -19.981 3.534 1.00 12.33 H new ATOM 0 HH22 ARG A 488 -1.391 -21.130 2.229 1.00 12.33 H new ATOM 1764 N ILE A 489 -2.363 -12.745 1.396 1.00 61.24 N ATOM 1765 CA ILE A 489 -0.989 -12.174 1.347 1.00 60.54 C ATOM 1766 C ILE A 489 -0.703 -11.257 2.565 1.00 40.52 C ATOM 1767 O ILE A 489 0.288 -11.441 3.282 1.00 0.42 O ATOM 1768 CB ILE A 489 -0.789 -11.382 -0.013 1.00 73.22 C ATOM 1769 CG1 ILE A 489 -0.734 -12.374 -1.229 1.00 24.12 C ATOM 1770 CG2 ILE A 489 0.452 -10.445 0.019 1.00 14.22 C ATOM 1771 CD1 ILE A 489 -0.837 -11.722 -2.609 1.00 2.22 C ATOM 0 H ILE A 489 -2.929 -12.494 0.585 1.00 61.24 H new ATOM 0 HA ILE A 489 -0.276 -12.997 1.393 1.00 60.54 H new ATOM 0 HB ILE A 489 -1.656 -10.734 -0.140 1.00 73.22 H new ATOM 0 HG12 ILE A 489 0.200 -12.934 -1.178 1.00 24.12 H new ATOM 0 HG13 ILE A 489 -1.544 -13.096 -1.125 1.00 24.12 H new ATOM 0 HG21 ILE A 489 0.542 -9.928 -0.936 1.00 14.22 H new ATOM 0 HG22 ILE A 489 0.335 -9.713 0.818 1.00 14.22 H new ATOM 0 HG23 ILE A 489 1.350 -11.037 0.197 1.00 14.22 H new ATOM 0 HD11 ILE A 489 -0.789 -12.492 -3.379 1.00 2.22 H new ATOM 0 HD12 ILE A 489 -1.783 -11.187 -2.689 1.00 2.22 H new ATOM 0 HD13 ILE A 489 -0.012 -11.022 -2.743 1.00 2.22 H new ATOM 1783 N MET A 490 -1.601 -10.288 2.790 1.00 12.22 N ATOM 1784 CA MET A 490 -1.528 -9.374 3.951 1.00 10.34 C ATOM 1785 C MET A 490 -1.731 -10.152 5.282 1.00 64.23 C ATOM 1786 O MET A 490 -1.123 -9.822 6.304 1.00 31.14 O ATOM 1787 CB MET A 490 -2.588 -8.261 3.798 1.00 1.02 C ATOM 1788 CG MET A 490 -2.373 -7.338 2.581 1.00 53.12 C ATOM 1789 SD MET A 490 -0.900 -6.308 2.735 1.00 32.54 S ATOM 1790 CE MET A 490 -1.056 -5.222 1.316 1.00 14.13 C ATOM 0 H MET A 490 -2.398 -10.112 2.178 1.00 12.22 H new ATOM 0 HA MET A 490 -0.538 -8.920 3.983 1.00 10.34 H new ATOM 0 HB2 MET A 490 -3.572 -8.722 3.719 1.00 1.02 H new ATOM 0 HB3 MET A 490 -2.592 -7.653 4.703 1.00 1.02 H new ATOM 0 HG2 MET A 490 -2.293 -7.946 1.680 1.00 53.12 H new ATOM 0 HG3 MET A 490 -3.247 -6.698 2.457 1.00 53.12 H new ATOM 0 HE1 MET A 490 -0.417 -4.349 1.454 1.00 14.13 H new ATOM 0 HE2 MET A 490 -0.753 -5.755 0.415 1.00 14.13 H new ATOM 0 HE3 MET A 490 -2.093 -4.901 1.216 1.00 14.13 H new ATOM 1800 N GLY A 491 -2.572 -11.210 5.225 1.00 24.03 N ATOM 1801 CA GLY A 491 -2.804 -12.115 6.362 1.00 63.32 C ATOM 1802 C GLY A 491 -1.575 -12.953 6.766 1.00 10.33 C ATOM 1803 O GLY A 491 -1.464 -13.387 7.923 1.00 42.23 O ATOM 0 H GLY A 491 -3.105 -11.455 4.390 1.00 24.03 H new ATOM 0 HA2 GLY A 491 -3.126 -11.526 7.221 1.00 63.32 H new ATOM 0 HA3 GLY A 491 -3.623 -12.789 6.113 1.00 63.32 H new ATOM 1807 N ASN A 492 -0.663 -13.211 5.802 1.00 22.44 N ATOM 1808 CA ASN A 492 0.634 -13.901 6.065 1.00 52.21 C ATOM 1809 C ASN A 492 1.593 -13.002 6.889 1.00 11.21 C ATOM 1810 O ASN A 492 2.488 -13.505 7.584 1.00 74.42 O ATOM 1811 CB ASN A 492 1.338 -14.288 4.735 1.00 63.44 C ATOM 1812 CG ASN A 492 0.551 -15.248 3.845 1.00 2.24 C ATOM 1813 OD1 ASN A 492 -0.200 -16.093 4.318 1.00 33.21 O ATOM 1814 ND2 ASN A 492 0.729 -15.131 2.540 1.00 35.23 N ATOM 0 H ASN A 492 -0.797 -12.952 4.825 1.00 22.44 H new ATOM 0 HA ASN A 492 0.404 -14.802 6.634 1.00 52.21 H new ATOM 0 HB2 ASN A 492 1.542 -13.378 4.171 1.00 63.44 H new ATOM 0 HB3 ASN A 492 2.301 -14.741 4.969 1.00 63.44 H new ATOM 0 HD21 ASN A 492 0.235 -15.753 1.900 1.00 35.23 H new ATOM 0 HD22 ASN A 492 1.360 -14.419 2.173 1.00 35.23 H new ATOM 1821 N GLY A 493 1.395 -11.677 6.794 1.00 43.21 N ATOM 1822 CA GLY A 493 2.277 -10.687 7.424 1.00 15.22 C ATOM 1823 C GLY A 493 3.080 -9.887 6.394 1.00 41.54 C ATOM 1824 O GLY A 493 4.268 -9.622 6.588 1.00 75.23 O ATOM 0 H GLY A 493 0.618 -11.264 6.278 1.00 43.21 H new ATOM 0 HA2 GLY A 493 1.680 -10.003 8.027 1.00 15.22 H new ATOM 0 HA3 GLY A 493 2.963 -11.194 8.102 1.00 15.22 H new ATOM 1828 N PHE A 494 2.425 -9.514 5.279 1.00 11.11 N ATOM 1829 CA PHE A 494 3.033 -8.681 4.211 1.00 74.23 C ATOM 1830 C PHE A 494 2.404 -7.271 4.164 1.00 42.44 C ATOM 1831 O PHE A 494 1.517 -6.933 4.956 1.00 54.20 O ATOM 1832 CB PHE A 494 2.906 -9.384 2.822 1.00 54.13 C ATOM 1833 CG PHE A 494 3.843 -10.578 2.622 1.00 74.41 C ATOM 1834 CD1 PHE A 494 3.533 -11.833 3.140 1.00 44.42 C ATOM 1835 CD2 PHE A 494 5.038 -10.441 1.911 1.00 10.01 C ATOM 1836 CE1 PHE A 494 4.383 -12.910 2.958 1.00 32.30 C ATOM 1837 CE2 PHE A 494 5.888 -11.518 1.728 1.00 20.21 C ATOM 1838 CZ PHE A 494 5.559 -12.753 2.252 1.00 44.23 C ATOM 0 H PHE A 494 1.459 -9.779 5.088 1.00 11.11 H new ATOM 0 HA PHE A 494 4.091 -8.565 4.447 1.00 74.23 H new ATOM 0 HB2 PHE A 494 1.877 -9.721 2.693 1.00 54.13 H new ATOM 0 HB3 PHE A 494 3.102 -8.651 2.040 1.00 54.13 H new ATOM 0 HD1 PHE A 494 2.615 -11.968 3.692 1.00 44.42 H new ATOM 0 HD2 PHE A 494 5.303 -9.479 1.497 1.00 10.01 H new ATOM 0 HE1 PHE A 494 4.126 -13.875 3.369 1.00 32.30 H new ATOM 0 HE2 PHE A 494 6.808 -11.393 1.176 1.00 20.21 H new ATOM 0 HZ PHE A 494 6.221 -13.595 2.110 1.00 44.23 H new ATOM 1848 N ALA A 495 2.890 -6.470 3.210 1.00 72.33 N ATOM 1849 CA ALA A 495 2.533 -5.053 3.055 1.00 64.33 C ATOM 1850 C ALA A 495 2.688 -4.631 1.578 1.00 53.44 C ATOM 1851 O ALA A 495 3.327 -5.337 0.790 1.00 33.44 O ATOM 1852 CB ALA A 495 3.433 -4.219 3.964 1.00 12.51 C ATOM 0 H ALA A 495 3.556 -6.794 2.509 1.00 72.33 H new ATOM 0 HA ALA A 495 1.493 -4.892 3.340 1.00 64.33 H new ATOM 0 HB1 ALA A 495 3.179 -3.164 3.859 1.00 12.51 H new ATOM 0 HB2 ALA A 495 3.288 -4.526 5.000 1.00 12.51 H new ATOM 0 HB3 ALA A 495 4.475 -4.371 3.683 1.00 12.51 H new ATOM 1858 N GLY A 496 2.127 -3.466 1.210 1.00 21.53 N ATOM 1859 CA GLY A 496 2.119 -3.017 -0.192 1.00 54.11 C ATOM 1860 C GLY A 496 2.559 -1.560 -0.382 1.00 35.14 C ATOM 1861 O GLY A 496 1.770 -0.645 -0.173 1.00 75.34 O ATOM 0 H GLY A 496 1.676 -2.822 1.860 1.00 21.53 H new ATOM 0 HA2 GLY A 496 2.776 -3.663 -0.774 1.00 54.11 H new ATOM 0 HA3 GLY A 496 1.114 -3.138 -0.596 1.00 54.11 H new ATOM 1865 N CYS A 497 3.821 -1.344 -0.798 1.00 11.12 N ATOM 1866 CA CYS A 497 4.352 0.011 -1.102 1.00 41.23 C ATOM 1867 C CYS A 497 3.814 0.523 -2.463 1.00 22.15 C ATOM 1868 O CYS A 497 4.309 0.128 -3.527 1.00 33.24 O ATOM 1869 CB CYS A 497 5.900 -0.004 -1.098 1.00 45.12 C ATOM 1870 SG CYS A 497 6.655 1.617 -1.342 1.00 62.45 S ATOM 0 H CYS A 497 4.501 -2.092 -0.934 1.00 11.12 H new ATOM 0 HA CYS A 497 4.010 0.695 -0.325 1.00 41.23 H new ATOM 0 HB2 CYS A 497 6.246 -0.415 -0.149 1.00 45.12 H new ATOM 0 HB3 CYS A 497 6.248 -0.676 -1.882 1.00 45.12 H new ATOM 0 HG CYS A 497 7.282 1.637 -2.481 1.00 62.45 H new ATOM 1876 N VAL A 498 2.772 1.373 -2.413 1.00 42.45 N ATOM 1877 CA VAL A 498 2.106 1.925 -3.611 1.00 1.13 C ATOM 1878 C VAL A 498 2.862 3.165 -4.164 1.00 14.21 C ATOM 1879 O VAL A 498 2.780 4.258 -3.600 1.00 64.32 O ATOM 1880 CB VAL A 498 0.614 2.310 -3.280 1.00 3.24 C ATOM 1881 CG1 VAL A 498 -0.128 2.863 -4.523 1.00 72.33 C ATOM 1882 CG2 VAL A 498 -0.156 1.115 -2.660 1.00 42.10 C ATOM 0 H VAL A 498 2.365 1.699 -1.536 1.00 42.45 H new ATOM 0 HA VAL A 498 2.117 1.152 -4.380 1.00 1.13 H new ATOM 0 HB VAL A 498 0.649 3.107 -2.538 1.00 3.24 H new ATOM 0 HG11 VAL A 498 -1.153 3.116 -4.252 1.00 72.33 H new ATOM 0 HG12 VAL A 498 0.383 3.755 -4.885 1.00 72.33 H new ATOM 0 HG13 VAL A 498 -0.137 2.107 -5.308 1.00 72.33 H new ATOM 0 HG21 VAL A 498 -1.181 1.415 -2.444 1.00 42.10 H new ATOM 0 HG22 VAL A 498 -0.162 0.282 -3.363 1.00 42.10 H new ATOM 0 HG23 VAL A 498 0.334 0.806 -1.736 1.00 42.10 H new ATOM 1892 N HIS A 499 3.613 2.968 -5.263 1.00 71.44 N ATOM 1893 CA HIS A 499 4.316 4.062 -5.981 1.00 23.35 C ATOM 1894 C HIS A 499 3.420 4.670 -7.095 1.00 61.32 C ATOM 1895 O HIS A 499 2.709 3.952 -7.812 1.00 4.14 O ATOM 1896 CB HIS A 499 5.653 3.552 -6.578 1.00 64.31 C ATOM 1897 CG HIS A 499 6.668 3.132 -5.537 1.00 42.41 C ATOM 1898 ND1 HIS A 499 7.590 4.021 -5.035 1.00 74.44 N ATOM 1899 CD2 HIS A 499 6.859 1.925 -4.942 1.00 44.13 C ATOM 1900 CE1 HIS A 499 8.311 3.347 -4.158 1.00 71.52 C ATOM 1901 NE2 HIS A 499 7.907 2.073 -4.067 1.00 54.35 N ATOM 0 H HIS A 499 3.753 2.049 -5.683 1.00 71.44 H new ATOM 0 HA HIS A 499 4.535 4.849 -5.259 1.00 23.35 H new ATOM 0 HB2 HIS A 499 5.448 2.706 -7.233 1.00 64.31 H new ATOM 0 HB3 HIS A 499 6.086 4.337 -7.198 1.00 64.31 H new ATOM 0 HD1 HIS A 499 7.695 5.003 -5.289 1.00 74.44 H new ATOM 0 HD2 HIS A 499 6.295 1.022 -5.123 1.00 44.13 H new ATOM 0 HE1 HIS A 499 9.124 3.769 -3.586 1.00 71.52 H new ATOM 1909 N PHE A 500 3.479 6.003 -7.225 1.00 34.44 N ATOM 1910 CA PHE A 500 2.656 6.779 -8.181 1.00 24.04 C ATOM 1911 C PHE A 500 3.450 7.101 -9.473 1.00 72.53 C ATOM 1912 O PHE A 500 4.615 7.521 -9.389 1.00 4.22 O ATOM 1913 CB PHE A 500 2.179 8.103 -7.510 1.00 50.03 C ATOM 1914 CG PHE A 500 1.120 7.918 -6.417 1.00 33.11 C ATOM 1915 CD1 PHE A 500 1.340 7.080 -5.320 1.00 63.20 C ATOM 1916 CD2 PHE A 500 -0.104 8.576 -6.493 1.00 32.43 C ATOM 1917 CE1 PHE A 500 0.376 6.905 -4.351 1.00 1.33 C ATOM 1918 CE2 PHE A 500 -1.060 8.398 -5.523 1.00 64.44 C ATOM 1919 CZ PHE A 500 -0.826 7.565 -4.455 1.00 43.55 C ATOM 0 H PHE A 500 4.104 6.584 -6.666 1.00 34.44 H new ATOM 0 HA PHE A 500 1.792 6.174 -8.456 1.00 24.04 H new ATOM 0 HB2 PHE A 500 3.043 8.608 -7.079 1.00 50.03 H new ATOM 0 HB3 PHE A 500 1.776 8.761 -8.280 1.00 50.03 H new ATOM 0 HD1 PHE A 500 2.283 6.560 -5.230 1.00 63.20 H new ATOM 0 HD2 PHE A 500 -0.305 9.235 -7.325 1.00 32.43 H new ATOM 0 HE1 PHE A 500 0.564 6.251 -3.512 1.00 1.33 H new ATOM 0 HE2 PHE A 500 -2.004 8.917 -5.600 1.00 64.44 H new ATOM 0 HZ PHE A 500 -1.585 7.429 -3.699 1.00 43.55 H new ATOM 1929 N PRO A 501 2.860 6.859 -10.695 1.00 55.01 N ATOM 1930 CA PRO A 501 3.407 7.425 -11.956 1.00 3.23 C ATOM 1931 C PRO A 501 3.294 8.977 -11.940 1.00 32.33 C ATOM 1932 O PRO A 501 2.191 9.513 -11.763 1.00 20.01 O ATOM 1933 CB PRO A 501 2.536 6.769 -13.068 1.00 75.42 C ATOM 1934 CG PRO A 501 1.282 6.320 -12.377 1.00 61.42 C ATOM 1935 CD PRO A 501 1.669 5.999 -10.943 1.00 32.23 C ATOM 0 HA PRO A 501 4.466 7.218 -12.109 1.00 3.23 H new ATOM 0 HB2 PRO A 501 2.313 7.480 -13.864 1.00 75.42 H new ATOM 0 HB3 PRO A 501 3.054 5.928 -13.528 1.00 75.42 H new ATOM 0 HG2 PRO A 501 0.522 7.100 -12.408 1.00 61.42 H new ATOM 0 HG3 PRO A 501 0.860 5.444 -12.870 1.00 61.42 H new ATOM 0 HD2 PRO A 501 0.860 6.227 -10.250 1.00 32.23 H new ATOM 0 HD3 PRO A 501 1.906 4.942 -10.820 1.00 32.23 H new ATOM 2024 N VAL A 508 1.868 13.556 -2.766 1.00 63.12 N ATOM 2025 CA VAL A 508 1.850 12.077 -2.689 1.00 30.44 C ATOM 2026 C VAL A 508 2.499 11.397 -3.925 1.00 33.31 C ATOM 2027 O VAL A 508 1.869 11.175 -4.960 1.00 12.13 O ATOM 2028 CB VAL A 508 0.404 11.523 -2.451 1.00 40.20 C ATOM 2029 CG1 VAL A 508 0.420 9.999 -2.140 1.00 74.31 C ATOM 2030 CG2 VAL A 508 -0.288 12.312 -1.323 1.00 45.03 C ATOM 0 HA VAL A 508 2.462 11.820 -1.825 1.00 30.44 H new ATOM 0 HB VAL A 508 -0.166 11.657 -3.370 1.00 40.20 H new ATOM 0 HG11 VAL A 508 -0.600 9.649 -1.981 1.00 74.31 H new ATOM 0 HG12 VAL A 508 0.861 9.461 -2.979 1.00 74.31 H new ATOM 0 HG13 VAL A 508 1.010 9.817 -1.242 1.00 74.31 H new ATOM 0 HG21 VAL A 508 -1.292 11.918 -1.167 1.00 45.03 H new ATOM 0 HG22 VAL A 508 0.288 12.213 -0.403 1.00 45.03 H new ATOM 0 HG23 VAL A 508 -0.350 13.364 -1.600 1.00 45.03 H new ATOM 2040 N ARG A 509 3.805 11.146 -3.782 1.00 2.31 N ATOM 2041 CA ARG A 509 4.623 10.331 -4.698 1.00 41.52 C ATOM 2042 C ARG A 509 4.449 8.812 -4.384 1.00 5.51 C ATOM 2043 O ARG A 509 4.598 7.960 -5.270 1.00 14.11 O ATOM 2044 CB ARG A 509 6.115 10.795 -4.528 1.00 24.43 C ATOM 2045 CG ARG A 509 7.142 10.276 -5.578 1.00 24.32 C ATOM 2046 CD ARG A 509 7.675 8.858 -5.302 1.00 23.31 C ATOM 2047 NE ARG A 509 8.512 8.373 -6.399 1.00 32.12 N ATOM 2048 CZ ARG A 509 8.110 7.606 -7.389 1.00 32.41 C ATOM 2049 NH1 ARG A 509 6.880 7.190 -7.474 1.00 71.23 N ATOM 2050 NH2 ARG A 509 8.958 7.271 -8.295 1.00 21.42 N ATOM 0 H ARG A 509 4.344 11.516 -2.999 1.00 2.31 H new ATOM 0 HA ARG A 509 4.309 10.470 -5.732 1.00 41.52 H new ATOM 0 HB2 ARG A 509 6.135 11.885 -4.545 1.00 24.43 H new ATOM 0 HB3 ARG A 509 6.455 10.485 -3.540 1.00 24.43 H new ATOM 0 HG2 ARG A 509 6.674 10.290 -6.563 1.00 24.32 H new ATOM 0 HG3 ARG A 509 7.985 10.966 -5.616 1.00 24.32 H new ATOM 0 HD2 ARG A 509 8.252 8.859 -4.377 1.00 23.31 H new ATOM 0 HD3 ARG A 509 6.837 8.176 -5.154 1.00 23.31 H new ATOM 0 HE ARG A 509 9.493 8.654 -6.396 1.00 32.12 H new ATOM 0 HH11 ARG A 509 6.201 7.458 -6.762 1.00 71.23 H new ATOM 0 HH12 ARG A 509 6.595 6.596 -8.253 1.00 71.23 H new ATOM 0 HH21 ARG A 509 9.922 7.599 -8.238 1.00 21.42 H new ATOM 0 HH22 ARG A 509 8.667 6.677 -9.071 1.00 21.42 H new ATOM 2064 N VAL A 510 4.154 8.497 -3.107 1.00 22.34 N ATOM 2065 CA VAL A 510 4.107 7.111 -2.581 1.00 64.53 C ATOM 2066 C VAL A 510 3.203 7.013 -1.309 1.00 44.22 C ATOM 2067 O VAL A 510 2.961 8.017 -0.628 1.00 61.12 O ATOM 2068 CB VAL A 510 5.573 6.619 -2.254 1.00 42.43 C ATOM 2069 CG1 VAL A 510 6.214 7.469 -1.121 1.00 72.20 C ATOM 2070 CG2 VAL A 510 5.630 5.097 -1.942 1.00 72.15 C ATOM 0 H VAL A 510 3.939 9.202 -2.402 1.00 22.34 H new ATOM 0 HA VAL A 510 3.670 6.468 -3.345 1.00 64.53 H new ATOM 0 HB VAL A 510 6.169 6.770 -3.154 1.00 42.43 H new ATOM 0 HG11 VAL A 510 7.222 7.106 -0.919 1.00 72.20 H new ATOM 0 HG12 VAL A 510 6.260 8.513 -1.431 1.00 72.20 H new ATOM 0 HG13 VAL A 510 5.610 7.385 -0.217 1.00 72.20 H new ATOM 0 HG21 VAL A 510 6.658 4.809 -1.724 1.00 72.15 H new ATOM 0 HG22 VAL A 510 5.001 4.879 -1.079 1.00 72.15 H new ATOM 0 HG23 VAL A 510 5.271 4.535 -2.804 1.00 72.15 H new ATOM 2080 N LEU A 511 2.686 5.800 -1.015 1.00 51.51 N ATOM 2081 CA LEU A 511 2.004 5.482 0.265 1.00 12.20 C ATOM 2082 C LEU A 511 2.148 3.984 0.603 1.00 51.15 C ATOM 2083 O LEU A 511 2.623 3.196 -0.222 1.00 54.52 O ATOM 2084 CB LEU A 511 0.516 5.948 0.247 1.00 61.12 C ATOM 2085 CG LEU A 511 -0.477 5.259 -0.764 1.00 21.51 C ATOM 2086 CD1 LEU A 511 -1.078 3.945 -0.210 1.00 3.40 C ATOM 2087 CD2 LEU A 511 -1.602 6.229 -1.189 1.00 2.10 C ATOM 0 H LEU A 511 2.729 5.010 -1.658 1.00 51.51 H new ATOM 0 HA LEU A 511 2.493 6.041 1.063 1.00 12.20 H new ATOM 0 HB2 LEU A 511 0.114 5.812 1.251 1.00 61.12 H new ATOM 0 HB3 LEU A 511 0.507 7.019 0.043 1.00 61.12 H new ATOM 0 HG LEU A 511 0.113 4.997 -1.643 1.00 21.51 H new ATOM 0 HD11 LEU A 511 -1.754 3.514 -0.949 1.00 3.40 H new ATOM 0 HD12 LEU A 511 -0.275 3.239 0.002 1.00 3.40 H new ATOM 0 HD13 LEU A 511 -1.628 4.155 0.707 1.00 3.40 H new ATOM 0 HD21 LEU A 511 -2.272 5.726 -1.887 1.00 2.10 H new ATOM 0 HD22 LEU A 511 -2.164 6.543 -0.309 1.00 2.10 H new ATOM 0 HD23 LEU A 511 -1.165 7.103 -1.672 1.00 2.10 H new ATOM 2099 N MET A 512 1.764 3.594 1.830 1.00 23.41 N ATOM 2100 CA MET A 512 1.855 2.186 2.286 1.00 23.23 C ATOM 2101 C MET A 512 0.451 1.593 2.574 1.00 15.03 C ATOM 2102 O MET A 512 -0.227 2.016 3.511 1.00 33.14 O ATOM 2103 CB MET A 512 2.779 2.078 3.545 1.00 54.23 C ATOM 2104 CG MET A 512 3.949 1.111 3.360 1.00 75.21 C ATOM 2105 SD MET A 512 3.404 -0.527 2.849 1.00 62.32 S ATOM 2106 CE MET A 512 4.978 -1.294 2.494 1.00 75.32 C ATOM 0 H MET A 512 1.386 4.232 2.530 1.00 23.41 H new ATOM 0 HA MET A 512 2.298 1.599 1.482 1.00 23.23 H new ATOM 0 HB2 MET A 512 3.169 3.067 3.786 1.00 54.23 H new ATOM 0 HB3 MET A 512 2.182 1.755 4.398 1.00 54.23 H new ATOM 0 HG2 MET A 512 4.635 1.512 2.615 1.00 75.21 H new ATOM 0 HG3 MET A 512 4.504 1.032 4.295 1.00 75.21 H new ATOM 0 HE1 MET A 512 5.025 -1.556 1.437 1.00 75.32 H new ATOM 0 HE2 MET A 512 5.783 -0.599 2.731 1.00 75.32 H new ATOM 0 HE3 MET A 512 5.088 -2.196 3.097 1.00 75.32 H new ATOM 2116 N LEU A 513 0.045 0.595 1.771 1.00 70.51 N ATOM 2117 CA LEU A 513 -1.205 -0.157 1.983 1.00 13.41 C ATOM 2118 C LEU A 513 -0.980 -1.232 3.076 1.00 2.34 C ATOM 2119 O LEU A 513 -0.171 -2.149 2.900 1.00 64.34 O ATOM 2120 CB LEU A 513 -1.664 -0.839 0.658 1.00 73.24 C ATOM 2121 CG LEU A 513 -3.043 -1.590 0.715 1.00 74.15 C ATOM 2122 CD1 LEU A 513 -4.215 -0.598 0.848 1.00 15.45 C ATOM 2123 CD2 LEU A 513 -3.245 -2.518 -0.504 1.00 1.34 C ATOM 0 H LEU A 513 0.574 0.286 0.956 1.00 70.51 H new ATOM 0 HA LEU A 513 -1.984 0.535 2.304 1.00 13.41 H new ATOM 0 HB2 LEU A 513 -1.719 -0.077 -0.120 1.00 73.24 H new ATOM 0 HB3 LEU A 513 -0.897 -1.551 0.354 1.00 73.24 H new ATOM 0 HG LEU A 513 -3.027 -2.218 1.606 1.00 74.15 H new ATOM 0 HD11 LEU A 513 -5.155 -1.148 0.885 1.00 15.45 H new ATOM 0 HD12 LEU A 513 -4.098 -0.017 1.763 1.00 15.45 H new ATOM 0 HD13 LEU A 513 -4.222 0.074 -0.010 1.00 15.45 H new ATOM 0 HD21 LEU A 513 -4.210 -3.018 -0.425 1.00 1.34 H new ATOM 0 HD22 LEU A 513 -3.216 -1.927 -1.420 1.00 1.34 H new ATOM 0 HD23 LEU A 513 -2.451 -3.264 -0.529 1.00 1.34 H new ATOM 2135 N LEU A 514 -1.697 -1.099 4.207 1.00 61.45 N ATOM 2136 CA LEU A 514 -1.582 -2.017 5.363 1.00 22.34 C ATOM 2137 C LEU A 514 -2.978 -2.514 5.791 1.00 2.33 C ATOM 2138 O LEU A 514 -3.758 -1.766 6.379 1.00 23.20 O ATOM 2139 CB LEU A 514 -0.871 -1.294 6.549 1.00 54.50 C ATOM 2140 CG LEU A 514 0.654 -1.011 6.356 1.00 54.40 C ATOM 2141 CD1 LEU A 514 1.224 -0.137 7.494 1.00 2.10 C ATOM 2142 CD2 LEU A 514 1.447 -2.327 6.234 1.00 44.14 C ATOM 0 H LEU A 514 -2.375 -0.351 4.349 1.00 61.45 H new ATOM 0 HA LEU A 514 -0.984 -2.880 5.072 1.00 22.34 H new ATOM 0 HB2 LEU A 514 -1.378 -0.346 6.728 1.00 54.50 H new ATOM 0 HB3 LEU A 514 -0.999 -1.898 7.447 1.00 54.50 H new ATOM 0 HG LEU A 514 0.763 -0.453 5.426 1.00 54.40 H new ATOM 0 HD11 LEU A 514 2.286 0.036 7.322 1.00 2.10 H new ATOM 0 HD12 LEU A 514 0.699 0.818 7.517 1.00 2.10 H new ATOM 0 HD13 LEU A 514 1.089 -0.648 8.447 1.00 2.10 H new ATOM 0 HD21 LEU A 514 2.505 -2.103 6.100 1.00 44.14 H new ATOM 0 HD22 LEU A 514 1.313 -2.918 7.140 1.00 44.14 H new ATOM 0 HD23 LEU A 514 1.085 -2.892 5.375 1.00 44.14 H new ATOM 2154 N TYR A 515 -3.284 -3.780 5.483 1.00 65.20 N ATOM 2155 CA TYR A 515 -4.558 -4.410 5.885 1.00 4.21 C ATOM 2156 C TYR A 515 -4.510 -4.866 7.362 1.00 62.53 C ATOM 2157 O TYR A 515 -3.760 -5.780 7.720 1.00 41.15 O ATOM 2158 CB TYR A 515 -4.892 -5.607 4.954 1.00 0.43 C ATOM 2159 CG TYR A 515 -6.124 -6.435 5.379 1.00 63.55 C ATOM 2160 CD1 TYR A 515 -7.401 -5.866 5.405 1.00 32.24 C ATOM 2161 CD2 TYR A 515 -6.005 -7.778 5.765 1.00 62.23 C ATOM 2162 CE1 TYR A 515 -8.504 -6.603 5.800 1.00 64.31 C ATOM 2163 CE2 TYR A 515 -7.105 -8.514 6.156 1.00 44.35 C ATOM 2164 CZ TYR A 515 -8.349 -7.925 6.176 1.00 74.01 C ATOM 2165 OH TYR A 515 -9.447 -8.663 6.564 1.00 24.35 O ATOM 0 H TYR A 515 -2.666 -4.395 4.954 1.00 65.20 H new ATOM 0 HA TYR A 515 -5.348 -3.666 5.788 1.00 4.21 H new ATOM 0 HB2 TYR A 515 -5.057 -5.229 3.945 1.00 0.43 H new ATOM 0 HB3 TYR A 515 -4.026 -6.267 4.910 1.00 0.43 H new ATOM 0 HD1 TYR A 515 -7.529 -4.834 5.112 1.00 32.24 H new ATOM 0 HD2 TYR A 515 -5.032 -8.246 5.756 1.00 62.23 H new ATOM 0 HE1 TYR A 515 -9.483 -6.147 5.815 1.00 64.31 H new ATOM 0 HE2 TYR A 515 -6.990 -9.548 6.445 1.00 44.35 H new ATOM 0 HH TYR A 515 -9.165 -9.573 6.795 1.00 24.35 H new ATOM 2175 N SER A 516 -5.311 -4.203 8.210 1.00 50.52 N ATOM 2176 CA SER A 516 -5.553 -4.650 9.591 1.00 44.32 C ATOM 2177 C SER A 516 -6.572 -5.802 9.599 1.00 75.52 C ATOM 2178 O SER A 516 -7.729 -5.598 9.241 1.00 64.21 O ATOM 2179 CB SER A 516 -6.079 -3.486 10.465 1.00 4.44 C ATOM 2180 OG SER A 516 -6.338 -3.917 11.798 1.00 32.22 O ATOM 0 H SER A 516 -5.807 -3.347 7.960 1.00 50.52 H new ATOM 0 HA SER A 516 -4.607 -4.996 10.007 1.00 44.32 H new ATOM 0 HB2 SER A 516 -5.348 -2.678 10.477 1.00 4.44 H new ATOM 0 HB3 SER A 516 -6.992 -3.083 10.027 1.00 4.44 H new ATOM 0 HG SER A 516 -6.668 -3.161 12.328 1.00 32.22 H new ATOM 2186 N SER A 517 -6.125 -7.010 9.967 1.00 22.12 N ATOM 2187 CA SER A 517 -7.022 -8.178 10.172 1.00 45.23 C ATOM 2188 C SER A 517 -7.901 -8.010 11.437 1.00 44.12 C ATOM 2189 O SER A 517 -8.979 -8.605 11.538 1.00 61.35 O ATOM 2190 CB SER A 517 -6.187 -9.474 10.271 1.00 2.12 C ATOM 2191 OG SER A 517 -5.414 -9.681 9.094 1.00 60.41 O ATOM 0 H SER A 517 -5.140 -7.215 10.133 1.00 22.12 H new ATOM 0 HA SER A 517 -7.689 -8.242 9.312 1.00 45.23 H new ATOM 0 HB2 SER A 517 -5.527 -9.419 11.137 1.00 2.12 H new ATOM 0 HB3 SER A 517 -6.850 -10.325 10.428 1.00 2.12 H new ATOM 0 HG SER A 517 -5.909 -9.351 8.315 1.00 60.41 H new ATOM 2197 N LYS A 518 -7.418 -7.191 12.395 1.00 41.44 N ATOM 2198 CA LYS A 518 -8.120 -6.913 13.670 1.00 30.40 C ATOM 2199 C LYS A 518 -9.350 -5.993 13.443 1.00 72.32 C ATOM 2200 O LYS A 518 -10.452 -6.288 13.914 1.00 31.13 O ATOM 2201 CB LYS A 518 -7.118 -6.280 14.674 1.00 41.34 C ATOM 2202 CG LYS A 518 -5.917 -7.200 15.027 1.00 30.15 C ATOM 2203 CD LYS A 518 -4.887 -6.544 15.982 1.00 13.34 C ATOM 2204 CE LYS A 518 -4.151 -5.341 15.358 1.00 30.54 C ATOM 2205 NZ LYS A 518 -3.122 -4.783 16.271 1.00 42.52 N ATOM 0 H LYS A 518 -6.527 -6.701 12.307 1.00 41.44 H new ATOM 0 HA LYS A 518 -8.496 -7.848 14.085 1.00 30.40 H new ATOM 0 HB2 LYS A 518 -6.739 -5.348 14.255 1.00 41.34 H new ATOM 0 HB3 LYS A 518 -7.649 -6.024 15.591 1.00 41.34 H new ATOM 0 HG2 LYS A 518 -6.294 -8.114 15.486 1.00 30.15 H new ATOM 0 HG3 LYS A 518 -5.411 -7.491 14.106 1.00 30.15 H new ATOM 0 HD2 LYS A 518 -5.399 -6.217 16.887 1.00 13.34 H new ATOM 0 HD3 LYS A 518 -4.154 -7.292 16.283 1.00 13.34 H new ATOM 0 HE2 LYS A 518 -3.679 -5.649 14.425 1.00 30.54 H new ATOM 0 HE3 LYS A 518 -4.873 -4.564 15.108 1.00 30.54 H new ATOM 0 HZ1 LYS A 518 -2.652 -3.977 15.813 1.00 42.52 H new ATOM 0 HZ2 LYS A 518 -3.575 -4.465 17.151 1.00 42.52 H new ATOM 0 HZ3 LYS A 518 -2.417 -5.516 16.490 1.00 42.52 H new ATOM 2219 N LYS A 519 -9.148 -4.884 12.708 1.00 62.13 N ATOM 2220 CA LYS A 519 -10.249 -3.960 12.328 1.00 10.44 C ATOM 2221 C LYS A 519 -10.954 -4.413 11.019 1.00 1.33 C ATOM 2222 O LYS A 519 -12.030 -3.901 10.691 1.00 64.42 O ATOM 2223 CB LYS A 519 -9.720 -2.505 12.182 1.00 52.14 C ATOM 2224 CG LYS A 519 -9.125 -1.902 13.478 1.00 52.31 C ATOM 2225 CD LYS A 519 -8.772 -0.404 13.330 1.00 73.32 C ATOM 2226 CE LYS A 519 -8.202 0.206 14.625 1.00 43.14 C ATOM 2227 NZ LYS A 519 -7.972 1.667 14.499 1.00 54.21 N ATOM 0 H LYS A 519 -8.232 -4.600 12.361 1.00 62.13 H new ATOM 0 HA LYS A 519 -10.987 -3.987 13.129 1.00 10.44 H new ATOM 0 HB2 LYS A 519 -8.956 -2.486 11.404 1.00 52.14 H new ATOM 0 HB3 LYS A 519 -10.537 -1.868 11.842 1.00 52.14 H new ATOM 0 HG2 LYS A 519 -9.839 -2.024 14.292 1.00 52.31 H new ATOM 0 HG3 LYS A 519 -8.228 -2.457 13.754 1.00 52.31 H new ATOM 0 HD2 LYS A 519 -8.045 -0.284 12.527 1.00 73.32 H new ATOM 0 HD3 LYS A 519 -9.665 0.148 13.036 1.00 73.32 H new ATOM 0 HE2 LYS A 519 -8.891 0.017 15.448 1.00 43.14 H new ATOM 0 HE3 LYS A 519 -7.263 -0.288 14.876 1.00 43.14 H new ATOM 0 HZ1 LYS A 519 -7.588 2.036 15.392 1.00 54.21 H new ATOM 0 HZ2 LYS A 519 -7.295 1.847 13.731 1.00 54.21 H new ATOM 0 HZ3 LYS A 519 -8.872 2.143 14.286 1.00 54.21 H new ATOM 2241 N LYS A 520 -10.323 -5.370 10.286 1.00 52.33 N ATOM 2242 CA LYS A 520 -10.834 -5.929 9.000 1.00 52.23 C ATOM 2243 C LYS A 520 -10.966 -4.807 7.918 1.00 21.21 C ATOM 2244 O LYS A 520 -11.892 -4.796 7.102 1.00 30.12 O ATOM 2245 CB LYS A 520 -12.165 -6.735 9.256 1.00 4.04 C ATOM 2246 CG LYS A 520 -12.380 -7.991 8.360 1.00 51.52 C ATOM 2247 CD LYS A 520 -12.931 -7.674 6.947 1.00 54.41 C ATOM 2248 CE LYS A 520 -13.052 -8.925 6.061 1.00 44.30 C ATOM 2249 NZ LYS A 520 -13.895 -9.989 6.681 1.00 4.15 N ATOM 0 H LYS A 520 -9.435 -5.781 10.573 1.00 52.33 H new ATOM 0 HA LYS A 520 -10.116 -6.641 8.593 1.00 52.23 H new ATOM 0 HB2 LYS A 520 -12.182 -7.049 10.300 1.00 4.04 H new ATOM 0 HB3 LYS A 520 -13.009 -6.061 9.112 1.00 4.04 H new ATOM 0 HG2 LYS A 520 -11.431 -8.518 8.258 1.00 51.52 H new ATOM 0 HG3 LYS A 520 -13.069 -8.669 8.863 1.00 51.52 H new ATOM 0 HD2 LYS A 520 -13.910 -7.204 7.041 1.00 54.41 H new ATOM 0 HD3 LYS A 520 -12.276 -6.951 6.460 1.00 54.41 H new ATOM 0 HE2 LYS A 520 -13.479 -8.644 5.098 1.00 44.30 H new ATOM 0 HE3 LYS A 520 -12.057 -9.324 5.864 1.00 44.30 H new ATOM 0 HZ1 LYS A 520 -14.013 -10.774 6.009 1.00 4.15 H new ATOM 0 HZ2 LYS A 520 -13.433 -10.339 7.544 1.00 4.15 H new ATOM 0 HZ3 LYS A 520 -14.827 -9.596 6.923 1.00 4.15 H new ATOM 2263 N ILE A 521 -9.995 -3.863 7.914 1.00 22.03 N ATOM 2264 CA ILE A 521 -9.979 -2.715 6.965 1.00 32.33 C ATOM 2265 C ILE A 521 -8.584 -2.547 6.304 1.00 54.24 C ATOM 2266 O ILE A 521 -7.554 -2.856 6.913 1.00 21.13 O ATOM 2267 CB ILE A 521 -10.387 -1.348 7.658 1.00 65.01 C ATOM 2268 CG1 ILE A 521 -9.336 -0.889 8.725 1.00 32.33 C ATOM 2269 CG2 ILE A 521 -11.798 -1.440 8.290 1.00 13.31 C ATOM 2270 CD1 ILE A 521 -9.594 0.488 9.331 1.00 41.30 C ATOM 0 H ILE A 521 -9.206 -3.871 8.560 1.00 22.03 H new ATOM 0 HA ILE A 521 -10.721 -2.950 6.202 1.00 32.33 H new ATOM 0 HB ILE A 521 -10.408 -0.592 6.873 1.00 65.01 H new ATOM 0 HG12 ILE A 521 -9.311 -1.625 9.529 1.00 32.33 H new ATOM 0 HG13 ILE A 521 -8.348 -0.887 8.264 1.00 32.33 H new ATOM 0 HG21 ILE A 521 -12.050 -0.488 8.757 1.00 13.31 H new ATOM 0 HG22 ILE A 521 -12.530 -1.669 7.515 1.00 13.31 H new ATOM 0 HG23 ILE A 521 -11.809 -2.228 9.043 1.00 13.31 H new ATOM 0 HD11 ILE A 521 -8.815 0.718 10.058 1.00 41.30 H new ATOM 0 HD12 ILE A 521 -9.587 1.240 8.542 1.00 41.30 H new ATOM 0 HD13 ILE A 521 -10.565 0.491 9.827 1.00 41.30 H new ATOM 2282 N PHE A 522 -8.571 -2.060 5.051 1.00 10.42 N ATOM 2283 CA PHE A 522 -7.328 -1.684 4.339 1.00 24.41 C ATOM 2284 C PHE A 522 -6.968 -0.210 4.644 1.00 45.23 C ATOM 2285 O PHE A 522 -7.764 0.693 4.386 1.00 72.23 O ATOM 2286 CB PHE A 522 -7.494 -1.878 2.811 1.00 14.05 C ATOM 2287 CG PHE A 522 -7.670 -3.331 2.371 1.00 30.02 C ATOM 2288 CD1 PHE A 522 -8.931 -3.927 2.326 1.00 1.40 C ATOM 2289 CD2 PHE A 522 -6.568 -4.099 1.983 1.00 54.14 C ATOM 2290 CE1 PHE A 522 -9.084 -5.235 1.912 1.00 35.31 C ATOM 2291 CE2 PHE A 522 -6.723 -5.409 1.567 1.00 23.43 C ATOM 2292 CZ PHE A 522 -7.979 -5.977 1.530 1.00 43.40 C ATOM 0 H PHE A 522 -9.417 -1.915 4.501 1.00 10.42 H new ATOM 0 HA PHE A 522 -6.523 -2.331 4.687 1.00 24.41 H new ATOM 0 HB2 PHE A 522 -8.358 -1.303 2.477 1.00 14.05 H new ATOM 0 HB3 PHE A 522 -6.621 -1.463 2.308 1.00 14.05 H new ATOM 0 HD1 PHE A 522 -9.800 -3.357 2.619 1.00 1.40 H new ATOM 0 HD2 PHE A 522 -5.580 -3.663 2.008 1.00 54.14 H new ATOM 0 HE1 PHE A 522 -10.067 -5.680 1.886 1.00 35.31 H new ATOM 0 HE2 PHE A 522 -5.860 -5.987 1.271 1.00 23.43 H new ATOM 0 HZ PHE A 522 -8.101 -6.999 1.204 1.00 43.40 H new ATOM 2302 N MET A 523 -5.779 0.010 5.222 1.00 61.02 N ATOM 2303 CA MET A 523 -5.258 1.367 5.542 1.00 13.31 C ATOM 2304 C MET A 523 -4.257 1.849 4.460 1.00 72.34 C ATOM 2305 O MET A 523 -3.747 1.052 3.677 1.00 55.23 O ATOM 2306 CB MET A 523 -4.574 1.367 6.941 1.00 61.21 C ATOM 2307 CG MET A 523 -5.459 0.843 8.081 1.00 20.01 C ATOM 2308 SD MET A 523 -4.640 0.943 9.692 1.00 22.34 S ATOM 2309 CE MET A 523 -5.904 0.291 10.785 1.00 1.43 C ATOM 0 H MET A 523 -5.143 -0.742 5.485 1.00 61.02 H new ATOM 0 HA MET A 523 -6.102 2.057 5.558 1.00 13.31 H new ATOM 0 HB2 MET A 523 -3.671 0.759 6.890 1.00 61.21 H new ATOM 0 HB3 MET A 523 -4.261 2.384 7.179 1.00 61.21 H new ATOM 0 HG2 MET A 523 -6.385 1.417 8.111 1.00 20.01 H new ATOM 0 HG3 MET A 523 -5.732 -0.193 7.879 1.00 20.01 H new ATOM 0 HE1 MET A 523 -5.453 0.011 11.737 1.00 1.43 H new ATOM 0 HE2 MET A 523 -6.666 1.051 10.954 1.00 1.43 H new ATOM 0 HE3 MET A 523 -6.362 -0.587 10.329 1.00 1.43 H new ATOM 2319 N GLY A 524 -3.980 3.165 4.452 1.00 54.41 N ATOM 2320 CA GLY A 524 -3.024 3.779 3.518 1.00 31.24 C ATOM 2321 C GLY A 524 -2.245 4.925 4.177 1.00 71.43 C ATOM 2322 O GLY A 524 -2.752 6.042 4.289 1.00 63.43 O ATOM 0 H GLY A 524 -4.413 3.831 5.092 1.00 54.41 H new ATOM 0 HA2 GLY A 524 -2.326 3.022 3.162 1.00 31.24 H new ATOM 0 HA3 GLY A 524 -3.558 4.156 2.646 1.00 31.24 H new ATOM 2326 N LEU A 525 -1.020 4.632 4.645 1.00 34.30 N ATOM 2327 CA LEU A 525 -0.135 5.626 5.296 1.00 54.52 C ATOM 2328 C LEU A 525 0.693 6.416 4.260 1.00 73.11 C ATOM 2329 O LEU A 525 1.611 5.863 3.653 1.00 33.22 O ATOM 2330 CB LEU A 525 0.792 4.895 6.315 1.00 21.14 C ATOM 2331 CG LEU A 525 0.093 4.467 7.649 1.00 34.12 C ATOM 2332 CD1 LEU A 525 0.951 3.479 8.459 1.00 70.55 C ATOM 2333 CD2 LEU A 525 -0.250 5.713 8.499 1.00 5.11 C ATOM 0 H LEU A 525 -0.611 3.700 4.585 1.00 34.30 H new ATOM 0 HA LEU A 525 -0.752 6.352 5.825 1.00 54.52 H new ATOM 0 HB2 LEU A 525 1.205 4.007 5.837 1.00 21.14 H new ATOM 0 HB3 LEU A 525 1.631 5.548 6.554 1.00 21.14 H new ATOM 0 HG LEU A 525 -0.830 3.951 7.385 1.00 34.12 H new ATOM 0 HD11 LEU A 525 0.427 3.209 9.376 1.00 70.55 H new ATOM 0 HD12 LEU A 525 1.130 2.582 7.866 1.00 70.55 H new ATOM 0 HD13 LEU A 525 1.904 3.945 8.709 1.00 70.55 H new ATOM 0 HD21 LEU A 525 -0.736 5.400 9.423 1.00 5.11 H new ATOM 0 HD22 LEU A 525 0.665 6.255 8.735 1.00 5.11 H new ATOM 0 HD23 LEU A 525 -0.922 6.362 7.938 1.00 5.11 H new ATOM 2345 N ILE A 526 0.353 7.711 4.058 1.00 32.22 N ATOM 2346 CA ILE A 526 1.170 8.642 3.239 1.00 23.24 C ATOM 2347 C ILE A 526 2.177 9.366 4.178 1.00 63.04 C ATOM 2348 O ILE A 526 1.764 10.251 4.943 1.00 74.12 O ATOM 2349 CB ILE A 526 0.320 9.744 2.457 1.00 34.13 C ATOM 2350 CG1 ILE A 526 -0.782 9.131 1.513 1.00 52.21 C ATOM 2351 CG2 ILE A 526 1.264 10.681 1.650 1.00 54.34 C ATOM 2352 CD1 ILE A 526 -2.015 8.567 2.208 1.00 24.34 C ATOM 0 H ILE A 526 -0.485 8.138 4.453 1.00 32.22 H new ATOM 0 HA ILE A 526 1.667 8.038 2.480 1.00 23.24 H new ATOM 0 HB ILE A 526 -0.211 10.320 3.215 1.00 34.13 H new ATOM 0 HG12 ILE A 526 -1.104 9.903 0.814 1.00 52.21 H new ATOM 0 HG13 ILE A 526 -0.326 8.336 0.923 1.00 52.21 H new ATOM 0 HG21 ILE A 526 0.671 11.428 1.122 1.00 54.34 H new ATOM 0 HG22 ILE A 526 1.952 11.180 2.333 1.00 54.34 H new ATOM 0 HG23 ILE A 526 1.832 10.092 0.929 1.00 54.34 H new ATOM 0 HD11 ILE A 526 -2.705 8.173 1.462 1.00 24.34 H new ATOM 0 HD12 ILE A 526 -1.717 7.767 2.885 1.00 24.34 H new ATOM 0 HD13 ILE A 526 -2.507 9.358 2.775 1.00 24.34 H new ATOM 2364 N PRO A 527 3.494 8.983 4.175 1.00 13.11 N ATOM 2365 CA PRO A 527 4.524 9.671 5.000 1.00 2.33 C ATOM 2366 C PRO A 527 4.869 11.084 4.452 1.00 24.41 C ATOM 2367 O PRO A 527 5.073 11.254 3.260 1.00 23.00 O ATOM 2368 CB PRO A 527 5.736 8.708 4.923 1.00 43.22 C ATOM 2369 CG PRO A 527 5.572 8.023 3.604 1.00 41.11 C ATOM 2370 CD PRO A 527 4.082 7.860 3.397 1.00 13.31 C ATOM 0 HA PRO A 527 4.191 9.857 6.021 1.00 2.33 H new ATOM 0 HB2 PRO A 527 6.680 9.250 4.976 1.00 43.22 H new ATOM 0 HB3 PRO A 527 5.731 7.994 5.747 1.00 43.22 H new ATOM 0 HG2 PRO A 527 6.015 8.613 2.801 1.00 41.11 H new ATOM 0 HG3 PRO A 527 6.074 7.055 3.603 1.00 41.11 H new ATOM 0 HD2 PRO A 527 3.815 7.921 2.342 1.00 13.31 H new ATOM 0 HD3 PRO A 527 3.730 6.894 3.760 1.00 13.31 H new ATOM 2378 N TYR A 528 4.965 12.092 5.336 1.00 54.53 N ATOM 2379 CA TYR A 528 5.239 13.504 4.924 1.00 4.32 C ATOM 2380 C TYR A 528 6.714 13.689 4.467 1.00 62.23 C ATOM 2381 O TYR A 528 7.127 14.773 4.042 1.00 21.00 O ATOM 2382 CB TYR A 528 4.874 14.468 6.082 1.00 31.52 C ATOM 2383 CG TYR A 528 3.421 14.351 6.608 1.00 53.40 C ATOM 2384 CD1 TYR A 528 2.429 13.644 5.912 1.00 42.54 C ATOM 2385 CD2 TYR A 528 3.045 14.960 7.808 1.00 41.01 C ATOM 2386 CE1 TYR A 528 1.134 13.556 6.392 1.00 5.14 C ATOM 2387 CE2 TYR A 528 1.752 14.871 8.288 1.00 2.13 C ATOM 2388 CZ TYR A 528 0.801 14.168 7.581 1.00 24.35 C ATOM 2389 OH TYR A 528 -0.488 14.085 8.063 1.00 73.43 O ATOM 0 H TYR A 528 4.859 11.968 6.343 1.00 54.53 H new ATOM 0 HA TYR A 528 4.614 13.744 4.064 1.00 4.32 H new ATOM 0 HB2 TYR A 528 5.559 14.289 6.911 1.00 31.52 H new ATOM 0 HB3 TYR A 528 5.040 15.492 5.747 1.00 31.52 H new ATOM 0 HD1 TYR A 528 2.682 13.158 4.981 1.00 42.54 H new ATOM 0 HD2 TYR A 528 3.781 15.513 8.373 1.00 41.01 H new ATOM 0 HE1 TYR A 528 0.386 13.009 5.836 1.00 5.14 H new ATOM 0 HE2 TYR A 528 1.487 15.353 9.218 1.00 2.13 H new ATOM 0 HH TYR A 528 -0.552 14.571 8.912 1.00 73.43 H new ATOM 2399 N ASP A 529 7.490 12.606 4.583 1.00 10.33 N ATOM 2400 CA ASP A 529 8.851 12.494 4.029 1.00 2.23 C ATOM 2401 C ASP A 529 8.809 12.265 2.497 1.00 64.31 C ATOM 2402 O ASP A 529 9.486 12.970 1.737 1.00 71.24 O ATOM 2403 CB ASP A 529 9.586 11.323 4.723 1.00 14.14 C ATOM 2404 CG ASP A 529 9.510 11.430 6.255 1.00 51.44 C ATOM 2405 OD1 ASP A 529 10.372 12.108 6.857 1.00 4.40 O ATOM 2406 OD2 ASP A 529 8.560 10.880 6.857 1.00 1.02 O ATOM 0 H ASP A 529 7.187 11.764 5.073 1.00 10.33 H new ATOM 0 HA ASP A 529 9.386 13.426 4.214 1.00 2.23 H new ATOM 0 HB2 ASP A 529 9.148 10.378 4.402 1.00 14.14 H new ATOM 0 HB3 ASP A 529 10.630 11.313 4.411 1.00 14.14 H new ATOM 2411 N GLN A 530 7.991 11.262 2.086 1.00 42.42 N ATOM 2412 CA GLN A 530 7.814 10.827 0.673 1.00 53.31 C ATOM 2413 C GLN A 530 9.136 10.374 0.003 1.00 11.21 C ATOM 2414 O GLN A 530 9.368 9.176 -0.155 1.00 53.42 O ATOM 2415 CB GLN A 530 7.076 11.908 -0.170 1.00 32.51 C ATOM 2416 CG GLN A 530 5.594 12.109 0.204 1.00 23.25 C ATOM 2417 CD GLN A 530 4.739 10.869 -0.090 1.00 12.23 C ATOM 2418 OE1 GLN A 530 4.216 10.713 -1.159 1.00 51.43 O ATOM 2419 NE2 GLN A 530 4.601 9.965 0.851 1.00 21.01 N ATOM 0 H GLN A 530 7.424 10.721 2.739 1.00 42.42 H new ATOM 0 HA GLN A 530 7.179 9.942 0.705 1.00 53.31 H new ATOM 0 HB2 GLN A 530 7.598 12.858 -0.057 1.00 32.51 H new ATOM 0 HB3 GLN A 530 7.138 11.634 -1.223 1.00 32.51 H new ATOM 0 HG2 GLN A 530 5.520 12.354 1.264 1.00 23.25 H new ATOM 0 HG3 GLN A 530 5.196 12.960 -0.348 1.00 23.25 H new ATOM 0 HE21 GLN A 530 5.047 10.101 1.758 1.00 21.01 H new ATOM 0 HE22 GLN A 530 4.048 9.126 0.675 1.00 21.01 H new ATOM 2428 N SER A 531 10.000 11.342 -0.375 1.00 12.01 N ATOM 2429 CA SER A 531 11.339 11.064 -0.954 1.00 52.51 C ATOM 2430 C SER A 531 12.207 10.229 0.019 1.00 74.50 C ATOM 2431 O SER A 531 12.749 9.189 -0.361 1.00 1.32 O ATOM 2432 CB SER A 531 12.062 12.392 -1.299 1.00 53.12 C ATOM 2433 OG SER A 531 12.151 13.240 -0.154 1.00 31.41 O ATOM 0 H SER A 531 9.792 12.337 -0.289 1.00 12.01 H new ATOM 0 HA SER A 531 11.195 10.486 -1.867 1.00 52.51 H new ATOM 0 HB2 SER A 531 13.062 12.178 -1.676 1.00 53.12 H new ATOM 0 HB3 SER A 531 11.524 12.906 -2.096 1.00 53.12 H new ATOM 0 HG SER A 531 12.612 14.070 -0.397 1.00 31.41 H new ATOM 2439 N GLY A 532 12.293 10.697 1.286 1.00 55.04 N ATOM 2440 CA GLY A 532 13.032 9.988 2.355 1.00 31.21 C ATOM 2441 C GLY A 532 12.506 8.571 2.633 1.00 14.14 C ATOM 2442 O GLY A 532 13.277 7.663 2.970 1.00 14.52 O ATOM 0 H GLY A 532 11.857 11.567 1.593 1.00 55.04 H new ATOM 0 HA2 GLY A 532 14.085 9.928 2.079 1.00 31.21 H new ATOM 0 HA3 GLY A 532 12.977 10.573 3.273 1.00 31.21 H new ATOM 2446 N PHE A 533 11.177 8.394 2.476 1.00 22.22 N ATOM 2447 CA PHE A 533 10.524 7.069 2.555 1.00 15.51 C ATOM 2448 C PHE A 533 11.004 6.143 1.411 1.00 42.34 C ATOM 2449 O PHE A 533 11.422 5.019 1.668 1.00 41.14 O ATOM 2450 CB PHE A 533 8.985 7.220 2.516 1.00 44.00 C ATOM 2451 CG PHE A 533 8.194 5.907 2.640 1.00 54.24 C ATOM 2452 CD1 PHE A 533 8.116 5.230 3.858 1.00 31.13 C ATOM 2453 CD2 PHE A 533 7.507 5.365 1.548 1.00 43.41 C ATOM 2454 CE1 PHE A 533 7.385 4.063 3.981 1.00 1.31 C ATOM 2455 CE2 PHE A 533 6.778 4.195 1.672 1.00 61.54 C ATOM 2456 CZ PHE A 533 6.717 3.545 2.888 1.00 62.41 C ATOM 0 H PHE A 533 10.529 9.160 2.292 1.00 22.22 H new ATOM 0 HA PHE A 533 10.806 6.611 3.503 1.00 15.51 H new ATOM 0 HB2 PHE A 533 8.681 7.886 3.323 1.00 44.00 H new ATOM 0 HB3 PHE A 533 8.707 7.706 1.580 1.00 44.00 H new ATOM 0 HD1 PHE A 533 8.635 5.624 4.719 1.00 31.13 H new ATOM 0 HD2 PHE A 533 7.546 5.868 0.593 1.00 43.41 H new ATOM 0 HE1 PHE A 533 7.336 3.555 4.933 1.00 1.31 H new ATOM 0 HE2 PHE A 533 6.257 3.791 0.817 1.00 61.54 H new ATOM 0 HZ PHE A 533 6.148 2.632 2.985 1.00 62.41 H new ATOM 2466 N VAL A 534 10.978 6.657 0.160 1.00 52.44 N ATOM 2467 CA VAL A 534 11.385 5.890 -1.045 1.00 31.34 C ATOM 2468 C VAL A 534 12.885 5.489 -0.994 1.00 63.51 C ATOM 2469 O VAL A 534 13.245 4.439 -1.503 1.00 23.30 O ATOM 2470 CB VAL A 534 11.072 6.685 -2.375 1.00 74.12 C ATOM 2471 CG1 VAL A 534 11.576 5.937 -3.641 1.00 44.34 C ATOM 2472 CG2 VAL A 534 9.560 6.977 -2.500 1.00 44.31 C ATOM 0 H VAL A 534 10.676 7.610 -0.045 1.00 52.44 H new ATOM 0 HA VAL A 534 10.792 4.975 -1.048 1.00 31.34 H new ATOM 0 HB VAL A 534 11.614 7.629 -2.311 1.00 74.12 H new ATOM 0 HG11 VAL A 534 11.338 6.523 -4.529 1.00 44.34 H new ATOM 0 HG12 VAL A 534 12.655 5.799 -3.576 1.00 44.34 H new ATOM 0 HG13 VAL A 534 11.089 4.964 -3.707 1.00 44.34 H new ATOM 0 HG21 VAL A 534 9.370 7.525 -3.423 1.00 44.31 H new ATOM 0 HG22 VAL A 534 9.008 6.037 -2.516 1.00 44.31 H new ATOM 0 HG23 VAL A 534 9.233 7.575 -1.649 1.00 44.31 H new ATOM 2482 N ASN A 535 13.749 6.319 -0.366 1.00 0.05 N ATOM 2483 CA ASN A 535 15.175 5.953 -0.124 1.00 4.04 C ATOM 2484 C ASN A 535 15.292 4.770 0.876 1.00 43.01 C ATOM 2485 O ASN A 535 16.171 3.912 0.728 1.00 30.12 O ATOM 2486 CB ASN A 535 16.006 7.172 0.367 1.00 25.52 C ATOM 2487 CG ASN A 535 16.288 8.192 -0.743 1.00 41.44 C ATOM 2488 OD1 ASN A 535 17.219 8.030 -1.525 1.00 51.03 O ATOM 2489 ND2 ASN A 535 15.513 9.257 -0.815 1.00 50.14 N ATOM 0 H ASN A 535 13.492 7.242 -0.017 1.00 0.05 H new ATOM 0 HA ASN A 535 15.590 5.632 -1.080 1.00 4.04 H new ATOM 0 HB2 ASN A 535 15.472 7.665 1.179 1.00 25.52 H new ATOM 0 HB3 ASN A 535 16.952 6.818 0.777 1.00 25.52 H new ATOM 0 HD21 ASN A 535 15.683 9.964 -1.530 1.00 50.14 H new ATOM 0 HD22 ASN A 535 14.744 9.373 -0.155 1.00 50.14 H new ATOM 2496 N GLY A 536 14.395 4.734 1.880 1.00 21.51 N ATOM 2497 CA GLY A 536 14.280 3.576 2.791 1.00 14.33 C ATOM 2498 C GLY A 536 13.756 2.312 2.086 1.00 21.22 C ATOM 2499 O GLY A 536 14.214 1.196 2.352 1.00 51.42 O ATOM 0 H GLY A 536 13.741 5.490 2.081 1.00 21.51 H new ATOM 0 HA2 GLY A 536 15.256 3.365 3.228 1.00 14.33 H new ATOM 0 HA3 GLY A 536 13.612 3.831 3.613 1.00 14.33 H new ATOM 2503 N ILE A 537 12.791 2.509 1.174 1.00 33.41 N ATOM 2504 CA ILE A 537 12.198 1.433 0.353 1.00 40.31 C ATOM 2505 C ILE A 537 13.172 0.974 -0.768 1.00 65.21 C ATOM 2506 O ILE A 537 13.153 -0.180 -1.149 1.00 20.15 O ATOM 2507 CB ILE A 537 10.818 1.903 -0.259 1.00 42.23 C ATOM 2508 CG1 ILE A 537 9.826 2.337 0.865 1.00 61.40 C ATOM 2509 CG2 ILE A 537 10.162 0.823 -1.155 1.00 43.14 C ATOM 2510 CD1 ILE A 537 9.431 1.235 1.839 1.00 13.24 C ATOM 0 H ILE A 537 12.394 3.429 0.981 1.00 33.41 H new ATOM 0 HA ILE A 537 12.016 0.576 1.002 1.00 40.31 H new ATOM 0 HB ILE A 537 11.041 2.761 -0.893 1.00 42.23 H new ATOM 0 HG12 ILE A 537 10.275 3.155 1.429 1.00 61.40 H new ATOM 0 HG13 ILE A 537 8.922 2.730 0.399 1.00 61.40 H new ATOM 0 HG21 ILE A 537 9.218 1.200 -1.548 1.00 43.14 H new ATOM 0 HG22 ILE A 537 10.829 0.583 -1.983 1.00 43.14 H new ATOM 0 HG23 ILE A 537 9.977 -0.075 -0.566 1.00 43.14 H new ATOM 0 HD11 ILE A 537 8.740 1.636 2.581 1.00 13.24 H new ATOM 0 HD12 ILE A 537 8.948 0.424 1.294 1.00 13.24 H new ATOM 0 HD13 ILE A 537 10.322 0.856 2.340 1.00 13.24 H new ATOM 2522 N ARG A 538 14.042 1.887 -1.245 1.00 42.12 N ATOM 2523 CA ARG A 538 14.969 1.664 -2.401 1.00 21.43 C ATOM 2524 C ARG A 538 15.898 0.442 -2.171 1.00 3.01 C ATOM 2525 O ARG A 538 16.155 -0.354 -3.087 1.00 44.14 O ATOM 2526 CB ARG A 538 15.821 2.947 -2.628 1.00 20.00 C ATOM 2527 CG ARG A 538 16.701 2.959 -3.902 1.00 13.25 C ATOM 2528 CD ARG A 538 15.886 3.062 -5.214 1.00 54.21 C ATOM 2529 NE ARG A 538 16.755 3.140 -6.407 1.00 60.21 N ATOM 2530 CZ ARG A 538 17.329 4.240 -6.872 1.00 73.33 C ATOM 2531 NH1 ARG A 538 17.168 5.392 -6.287 1.00 73.22 N ATOM 2532 NH2 ARG A 538 18.052 4.174 -7.944 1.00 34.42 N ATOM 0 H ARG A 538 14.131 2.819 -0.840 1.00 42.12 H new ATOM 0 HA ARG A 538 14.367 1.452 -3.285 1.00 21.43 H new ATOM 0 HB2 ARG A 538 15.149 3.804 -2.667 1.00 20.00 H new ATOM 0 HB3 ARG A 538 16.468 3.088 -1.762 1.00 20.00 H new ATOM 0 HG2 ARG A 538 17.394 3.798 -3.847 1.00 13.25 H new ATOM 0 HG3 ARG A 538 17.302 2.050 -3.927 1.00 13.25 H new ATOM 0 HD2 ARG A 538 15.230 2.196 -5.301 1.00 54.21 H new ATOM 0 HD3 ARG A 538 15.247 3.944 -5.174 1.00 54.21 H new ATOM 0 HE ARG A 538 16.928 2.273 -6.916 1.00 60.21 H new ATOM 0 HH11 ARG A 538 16.589 5.463 -5.450 1.00 73.22 H new ATOM 0 HH12 ARG A 538 17.621 6.224 -6.665 1.00 73.22 H new ATOM 0 HH21 ARG A 538 18.175 3.281 -8.422 1.00 34.42 H new ATOM 0 HH22 ARG A 538 18.498 5.015 -8.311 1.00 34.42 H new ATOM 2546 N GLN A 539 16.372 0.325 -0.919 1.00 52.14 N ATOM 2547 CA GLN A 539 17.188 -0.816 -0.439 1.00 12.43 C ATOM 2548 C GLN A 539 16.358 -2.137 -0.542 1.00 62.12 C ATOM 2549 O GLN A 539 16.830 -3.155 -1.066 1.00 12.40 O ATOM 2550 CB GLN A 539 17.636 -0.521 1.037 1.00 24.23 C ATOM 2551 CG GLN A 539 18.974 -1.149 1.501 1.00 63.32 C ATOM 2552 CD GLN A 539 19.030 -2.679 1.446 1.00 43.45 C ATOM 2553 OE1 GLN A 539 18.648 -3.360 2.387 1.00 33.24 O ATOM 2554 NE2 GLN A 539 19.515 -3.228 0.347 1.00 45.15 N ATOM 0 H GLN A 539 16.200 1.026 -0.199 1.00 52.14 H new ATOM 0 HA GLN A 539 18.079 -0.942 -1.055 1.00 12.43 H new ATOM 0 HB2 GLN A 539 17.707 0.560 1.161 1.00 24.23 H new ATOM 0 HB3 GLN A 539 16.848 -0.867 1.706 1.00 24.23 H new ATOM 0 HG2 GLN A 539 19.778 -0.749 0.883 1.00 63.32 H new ATOM 0 HG3 GLN A 539 19.171 -0.831 2.525 1.00 63.32 H new ATOM 0 HE21 GLN A 539 19.827 -2.637 -0.424 1.00 45.15 H new ATOM 0 HE22 GLN A 539 19.578 -4.243 0.269 1.00 45.15 H new ATOM 2563 N VAL A 540 15.100 -2.062 -0.070 1.00 34.55 N ATOM 2564 CA VAL A 540 14.127 -3.186 -0.073 1.00 12.01 C ATOM 2565 C VAL A 540 13.720 -3.607 -1.527 1.00 54.34 C ATOM 2566 O VAL A 540 13.525 -4.796 -1.805 1.00 4.11 O ATOM 2567 CB VAL A 540 12.845 -2.790 0.764 1.00 54.30 C ATOM 2568 CG1 VAL A 540 11.820 -3.944 0.826 1.00 14.34 C ATOM 2569 CG2 VAL A 540 13.233 -2.305 2.188 1.00 41.23 C ATOM 0 H VAL A 540 14.718 -1.206 0.333 1.00 34.55 H new ATOM 0 HA VAL A 540 14.612 -4.046 0.389 1.00 12.01 H new ATOM 0 HB VAL A 540 12.364 -1.960 0.246 1.00 54.30 H new ATOM 0 HG11 VAL A 540 10.955 -3.631 1.410 1.00 14.34 H new ATOM 0 HG12 VAL A 540 11.502 -4.203 -0.184 1.00 14.34 H new ATOM 0 HG13 VAL A 540 12.279 -4.814 1.296 1.00 14.34 H new ATOM 0 HG21 VAL A 540 12.331 -2.040 2.740 1.00 41.23 H new ATOM 0 HG22 VAL A 540 13.759 -3.102 2.713 1.00 41.23 H new ATOM 0 HG23 VAL A 540 13.881 -1.432 2.111 1.00 41.23 H new