USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=29 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 535 ASN : amide:sc= 0.0812 X(o=0.17,f=-0.048) USER MOD Set 1.2: A 539 GLN : amide:sc= 0.0842 X(o=0.17,f=-0.045) USER MOD Set 2.1: A 451 GLN : amide:sc= 0.142 K(o=-2,f=-2.6) USER MOD Set 2.2: A 497 CYS SG : rot -83:sc= -2.19 USER MOD Set 2.3: A 499 HIS : no HD1:sc= 0.00758 K(o=-2,f=-4.8) USER MOD Set 3.1: A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 443 GLN : amide:sc= -0.0122 X(o=-0.012,f=-0.14) USER MOD Set 4.1: A 430 GLN : amide:sc= 0.323 K(o=0.65,f=-0.45) USER MOD Set 4.2: A 432 TYR OH : rot -16:sc= 0.382 USER MOD Set 4.3: A 474 HIS : no HD1:sc= -0.0676 X(o=0.65,f=0.71) USER MOD Set 4.4: A 476 THR OG1 : rot 180:sc= 0.00858 USER MOD Set 5.1: A 409 GLN :FLIP amide:sc= 0.998 F(o=-1.5,f=2.2) USER MOD Set 5.2: A 424 THR OG1 : rot -29:sc= 1.18 USER MOD Single : A 398 LYS NZ :NH3+ -161:sc= 1.19 (180deg=0.627) 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 57:sc= -2.52! USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 438 ASN : amide:sc= -0.0181 K(o=-0.018,f=-2.2!) USER MOD Single : A 441 THR OG1 : rot -11:sc= 0.584 USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 447 LYS NZ :NH3+ 163:sc= 0.518 (180deg=0.067) USER MOD Single : A 450 MET CE :methyl 133:sc= -0.452 (180deg=-1.01) USER MOD Single : A 455 GLN : amide:sc= -1.22 X(o=-1.2,f=-0.74) USER MOD Single : A 456 GLN : amide:sc= -0.57 K(o=-0.57,f=-3.8!) USER MOD Single : A 459 THR OG1 : rot -86:sc= 0.798 USER MOD Single : A 460 THR OG1 : rot -73:sc= 0.931 USER MOD Single : A 467 ASN : amide:sc= 0.234 K(o=0.23,f=-0.35) USER MOD Single : A 468 SER OG : rot -61:sc= 0.598 USER MOD Single : A 470 MET CE :methyl 180:sc= -0.418 (180deg=-0.418) USER MOD Single : A 472 GLN : amide:sc= -0.454 K(o=-0.45,f=-4.1!) USER MOD Single : A 477 ASN : amide:sc= -0.0116 X(o=-0.012,f=-0.22) USER MOD Single : A 478 LYS NZ :NH3+ 175:sc= -0.002 (180deg=-0.0441) USER MOD Single : A 482 SER OG : rot 161:sc= 0.183 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 -163:sc= -0.0931 (180deg=-0.511) USER MOD Single : A 492 ASN : amide:sc= -0.659 K(o=-0.66,f=-4.7!) USER MOD Single : A 512 MET CE :methyl -115:sc= -2.13 (180deg=-3.64!) USER MOD Single : A 515 TYR OH : rot 71:sc= -0.034 USER MOD Single : A 516 SER OG : rot 160:sc= 0.206 USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 LYS NZ :NH3+ -172:sc=-0.00562 (180deg=-0.0803) USER MOD Single : A 519 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0826) USER MOD Single : A 520 LYS NZ :NH3+ 174:sc= 0.712 (180deg=0.685) USER MOD Single : A 523 MET CE :methyl 148:sc= -0.147 (180deg=-2.01!) USER MOD Single : A 528 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 GLN : amide:sc= -1.07 K(o=-1.1,f=-12!) USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 250 N LYS A 398 -16.960 7.711 5.856 1.00 3.53 N ATOM 251 CA LYS A 398 -15.977 8.536 5.115 1.00 14.15 C ATOM 252 C LYS A 398 -16.413 8.784 3.658 1.00 40.43 C ATOM 253 O LYS A 398 -17.099 7.961 3.048 1.00 1.53 O ATOM 254 CB LYS A 398 -14.574 7.873 5.141 1.00 50.35 C ATOM 255 CG LYS A 398 -13.893 7.893 6.521 1.00 34.21 C ATOM 256 CD LYS A 398 -12.510 7.200 6.514 1.00 31.13 C ATOM 257 CE LYS A 398 -11.808 7.257 7.885 1.00 21.42 C ATOM 258 NZ LYS A 398 -11.550 8.658 8.322 1.00 32.35 N ATOM 0 HA LYS A 398 -15.927 9.502 5.618 1.00 14.15 H new ATOM 0 HB2 LYS A 398 -14.667 6.839 4.809 1.00 50.35 H new ATOM 0 HB3 LYS A 398 -13.931 8.382 4.423 1.00 50.35 H new ATOM 0 HG2 LYS A 398 -13.776 8.926 6.849 1.00 34.21 H new ATOM 0 HG3 LYS A 398 -14.539 7.399 7.247 1.00 34.21 H new ATOM 0 HD2 LYS A 398 -12.632 6.159 6.216 1.00 31.13 H new ATOM 0 HD3 LYS A 398 -11.875 7.674 5.765 1.00 31.13 H new ATOM 0 HE2 LYS A 398 -12.424 6.753 8.629 1.00 21.42 H new ATOM 0 HE3 LYS A 398 -10.864 6.714 7.832 1.00 21.42 H new ATOM 0 HZ1 LYS A 398 -10.815 8.662 9.058 1.00 32.35 H new ATOM 0 HZ2 LYS A 398 -11.229 9.222 7.509 1.00 32.35 H new ATOM 0 HZ3 LYS A 398 -12.425 9.069 8.704 1.00 32.35 H new ATOM 272 N LEU A 399 -16.000 9.939 3.118 1.00 74.14 N ATOM 273 CA LEU A 399 -16.316 10.344 1.734 1.00 63.32 C ATOM 274 C LEU A 399 -15.229 9.876 0.757 1.00 61.20 C ATOM 275 O LEU A 399 -14.044 9.770 1.118 1.00 5.22 O ATOM 276 CB LEU A 399 -16.524 11.883 1.645 1.00 31.13 C ATOM 277 CG LEU A 399 -17.960 12.391 1.994 1.00 61.14 C ATOM 278 CD1 LEU A 399 -18.418 11.941 3.396 1.00 11.03 C ATOM 279 CD2 LEU A 399 -18.053 13.918 1.836 1.00 43.54 C ATOM 0 H LEU A 399 -15.437 10.622 3.626 1.00 74.14 H new ATOM 0 HA LEU A 399 -17.249 9.859 1.446 1.00 63.32 H new ATOM 0 HB2 LEU A 399 -15.814 12.367 2.315 1.00 31.13 H new ATOM 0 HB3 LEU A 399 -16.279 12.207 0.633 1.00 31.13 H new ATOM 0 HG LEU A 399 -18.646 11.932 1.282 1.00 61.14 H new ATOM 0 HD11 LEU A 399 -19.422 12.320 3.590 1.00 11.03 H new ATOM 0 HD12 LEU A 399 -18.425 10.852 3.444 1.00 11.03 H new ATOM 0 HD13 LEU A 399 -17.731 12.333 4.146 1.00 11.03 H new ATOM 0 HD21 LEU A 399 -19.062 14.249 2.084 1.00 43.54 H new ATOM 0 HD22 LEU A 399 -17.339 14.397 2.506 1.00 43.54 H new ATOM 0 HD23 LEU A 399 -17.825 14.192 0.806 1.00 43.54 H new ATOM 291 N LEU A 400 -15.652 9.621 -0.489 1.00 23.01 N ATOM 292 CA LEU A 400 -14.780 9.109 -1.549 1.00 51.34 C ATOM 293 C LEU A 400 -13.999 10.260 -2.216 1.00 74.14 C ATOM 294 O LEU A 400 -14.579 11.098 -2.916 1.00 41.01 O ATOM 295 CB LEU A 400 -15.611 8.332 -2.606 1.00 31.30 C ATOM 296 CG LEU A 400 -14.776 7.667 -3.740 1.00 70.52 C ATOM 297 CD1 LEU A 400 -13.761 6.668 -3.161 1.00 72.12 C ATOM 298 CD2 LEU A 400 -15.682 7.001 -4.798 1.00 0.33 C ATOM 0 H LEU A 400 -16.616 9.766 -0.789 1.00 23.01 H new ATOM 0 HA LEU A 400 -14.061 8.423 -1.100 1.00 51.34 H new ATOM 0 HB2 LEU A 400 -16.186 7.558 -2.097 1.00 31.30 H new ATOM 0 HB3 LEU A 400 -16.328 9.017 -3.058 1.00 31.30 H new ATOM 0 HG LEU A 400 -14.218 8.455 -4.246 1.00 70.52 H new ATOM 0 HD11 LEU A 400 -13.190 6.217 -3.973 1.00 72.12 H new ATOM 0 HD12 LEU A 400 -13.082 7.189 -2.486 1.00 72.12 H new ATOM 0 HD13 LEU A 400 -14.290 5.888 -2.613 1.00 72.12 H new ATOM 0 HD21 LEU A 400 -15.064 6.548 -5.573 1.00 0.33 H new ATOM 0 HD22 LEU A 400 -16.291 6.232 -4.323 1.00 0.33 H new ATOM 0 HD23 LEU A 400 -16.332 7.753 -5.246 1.00 0.33 H new ATOM 310 N ALA A 401 -12.684 10.297 -1.971 1.00 75.32 N ATOM 311 CA ALA A 401 -11.781 11.304 -2.561 1.00 21.43 C ATOM 312 C ALA A 401 -11.243 10.849 -3.936 1.00 30.25 C ATOM 313 O ALA A 401 -11.225 11.630 -4.900 1.00 21.03 O ATOM 314 CB ALA A 401 -10.627 11.594 -1.596 1.00 21.31 C ATOM 0 H ALA A 401 -12.212 9.632 -1.359 1.00 75.32 H new ATOM 0 HA ALA A 401 -12.350 12.219 -2.723 1.00 21.43 H new ATOM 0 HB1 ALA A 401 -9.963 12.338 -2.036 1.00 21.31 H new ATOM 0 HB2 ALA A 401 -11.026 11.974 -0.656 1.00 21.31 H new ATOM 0 HB3 ALA A 401 -10.070 10.676 -1.409 1.00 21.31 H new ATOM 320 N TRP A 402 -10.814 9.576 -4.020 1.00 24.31 N ATOM 321 CA TRP A 402 -10.144 9.035 -5.226 1.00 12.13 C ATOM 322 C TRP A 402 -10.670 7.629 -5.584 1.00 24.25 C ATOM 323 O TRP A 402 -11.051 6.859 -4.711 1.00 73.13 O ATOM 324 CB TRP A 402 -8.607 8.998 -4.995 1.00 53.44 C ATOM 325 CG TRP A 402 -7.803 8.639 -6.225 1.00 53.54 C ATOM 326 CD1 TRP A 402 -7.449 9.480 -7.238 1.00 21.22 C ATOM 327 CD2 TRP A 402 -7.269 7.349 -6.573 1.00 21.43 C ATOM 328 NE1 TRP A 402 -6.736 8.797 -8.185 1.00 24.55 N ATOM 329 CE2 TRP A 402 -6.613 7.490 -7.804 1.00 61.22 C ATOM 330 CE3 TRP A 402 -7.287 6.092 -5.963 1.00 22.04 C ATOM 331 CZ2 TRP A 402 -5.976 6.425 -8.436 1.00 23.14 C ATOM 332 CZ3 TRP A 402 -6.659 5.038 -6.591 1.00 0.20 C ATOM 333 CH2 TRP A 402 -6.011 5.212 -7.819 1.00 31.11 C ATOM 0 H TRP A 402 -10.918 8.897 -3.266 1.00 24.31 H new ATOM 0 HA TRP A 402 -10.369 9.691 -6.067 1.00 12.13 H new ATOM 0 HB2 TRP A 402 -8.282 9.974 -4.634 1.00 53.44 H new ATOM 0 HB3 TRP A 402 -8.387 8.277 -4.208 1.00 53.44 H new ATOM 0 HD1 TRP A 402 -7.695 10.530 -7.286 1.00 21.22 H new ATOM 0 HE1 TRP A 402 -6.356 9.200 -9.041 1.00 24.55 H new ATOM 0 HE3 TRP A 402 -7.785 5.949 -5.015 1.00 22.04 H new ATOM 0 HZ2 TRP A 402 -5.472 6.557 -9.382 1.00 23.14 H new ATOM 0 HZ3 TRP A 402 -6.667 4.062 -6.128 1.00 0.20 H new ATOM 0 HH2 TRP A 402 -5.529 4.367 -8.287 1.00 31.11 H new ATOM 344 N SER A 403 -10.651 7.309 -6.884 1.00 21.41 N ATOM 345 CA SER A 403 -11.021 5.980 -7.422 1.00 45.53 C ATOM 346 C SER A 403 -10.104 5.635 -8.612 1.00 42.51 C ATOM 347 O SER A 403 -9.739 6.522 -9.389 1.00 21.22 O ATOM 348 CB SER A 403 -12.508 5.970 -7.859 1.00 54.14 C ATOM 349 OG SER A 403 -12.781 6.974 -8.836 1.00 65.23 O ATOM 0 H SER A 403 -10.375 7.972 -7.608 1.00 21.41 H new ATOM 0 HA SER A 403 -10.892 5.228 -6.644 1.00 45.53 H new ATOM 0 HB2 SER A 403 -12.761 4.990 -8.264 1.00 54.14 H new ATOM 0 HB3 SER A 403 -13.144 6.128 -6.988 1.00 54.14 H new ATOM 0 HG SER A 403 -13.727 6.936 -9.088 1.00 65.23 H new ATOM 355 N GLY A 404 -9.721 4.358 -8.744 1.00 33.34 N ATOM 356 CA GLY A 404 -8.807 3.928 -9.811 1.00 4.24 C ATOM 357 C GLY A 404 -8.504 2.433 -9.790 1.00 64.23 C ATOM 358 O GLY A 404 -9.313 1.646 -9.308 1.00 32.13 O ATOM 0 H GLY A 404 -10.029 3.606 -8.127 1.00 33.34 H new ATOM 0 HA2 GLY A 404 -9.241 4.189 -10.776 1.00 4.24 H new ATOM 0 HA3 GLY A 404 -7.872 4.481 -9.722 1.00 4.24 H new ATOM 362 N VAL A 405 -7.332 2.040 -10.331 1.00 45.32 N ATOM 363 CA VAL A 405 -6.913 0.616 -10.434 1.00 44.44 C ATOM 364 C VAL A 405 -5.569 0.382 -9.703 1.00 63.51 C ATOM 365 O VAL A 405 -4.561 0.958 -10.077 1.00 64.32 O ATOM 366 CB VAL A 405 -6.760 0.164 -11.942 1.00 44.44 C ATOM 367 CG1 VAL A 405 -6.403 -1.348 -12.056 1.00 32.13 C ATOM 368 CG2 VAL A 405 -8.028 0.506 -12.761 1.00 2.14 C ATOM 0 H VAL A 405 -6.647 2.695 -10.709 1.00 45.32 H new ATOM 0 HA VAL A 405 -7.695 0.021 -9.963 1.00 44.44 H new ATOM 0 HB VAL A 405 -5.928 0.726 -12.367 1.00 44.44 H new ATOM 0 HG11 VAL A 405 -6.306 -1.621 -13.107 1.00 32.13 H new ATOM 0 HG12 VAL A 405 -5.460 -1.539 -11.543 1.00 32.13 H new ATOM 0 HG13 VAL A 405 -7.192 -1.944 -11.598 1.00 32.13 H new ATOM 0 HG21 VAL A 405 -7.892 0.183 -13.793 1.00 2.14 H new ATOM 0 HG22 VAL A 405 -8.888 -0.006 -12.331 1.00 2.14 H new ATOM 0 HG23 VAL A 405 -8.197 1.582 -12.737 1.00 2.14 H new ATOM 378 N LEU A 406 -5.565 -0.480 -8.681 1.00 55.12 N ATOM 379 CA LEU A 406 -4.338 -0.909 -7.983 1.00 63.52 C ATOM 380 C LEU A 406 -3.860 -2.260 -8.562 1.00 32.53 C ATOM 381 O LEU A 406 -4.575 -3.258 -8.476 1.00 51.33 O ATOM 382 CB LEU A 406 -4.618 -1.060 -6.465 1.00 45.45 C ATOM 383 CG LEU A 406 -3.377 -1.378 -5.575 1.00 11.10 C ATOM 384 CD1 LEU A 406 -2.415 -0.172 -5.498 1.00 54.33 C ATOM 385 CD2 LEU A 406 -3.802 -1.846 -4.173 1.00 1.11 C ATOM 0 H LEU A 406 -6.415 -0.905 -8.309 1.00 55.12 H new ATOM 0 HA LEU A 406 -3.562 -0.157 -8.128 1.00 63.52 H new ATOM 0 HB2 LEU A 406 -5.073 -0.137 -6.105 1.00 45.45 H new ATOM 0 HB3 LEU A 406 -5.353 -1.853 -6.327 1.00 45.45 H new ATOM 0 HG LEU A 406 -2.836 -2.198 -6.046 1.00 11.10 H new ATOM 0 HD11 LEU A 406 -1.561 -0.427 -4.870 1.00 54.33 H new ATOM 0 HD12 LEU A 406 -2.067 0.080 -6.500 1.00 54.33 H new ATOM 0 HD13 LEU A 406 -2.937 0.683 -5.070 1.00 54.33 H new ATOM 0 HD21 LEU A 406 -2.915 -2.060 -3.576 1.00 1.11 H new ATOM 0 HD22 LEU A 406 -4.385 -1.062 -3.689 1.00 1.11 H new ATOM 0 HD23 LEU A 406 -4.408 -2.748 -4.259 1.00 1.11 H new ATOM 397 N GLU A 407 -2.657 -2.279 -9.153 1.00 62.00 N ATOM 398 CA GLU A 407 -2.066 -3.494 -9.764 1.00 52.21 C ATOM 399 C GLU A 407 -0.658 -3.758 -9.198 1.00 1.41 C ATOM 400 O GLU A 407 0.134 -2.829 -9.036 1.00 74.43 O ATOM 401 CB GLU A 407 -2.005 -3.344 -11.305 1.00 30.03 C ATOM 402 CG GLU A 407 -1.460 -4.582 -12.050 1.00 62.25 C ATOM 403 CD GLU A 407 -1.432 -4.393 -13.573 1.00 74.35 C ATOM 404 OE1 GLU A 407 -2.478 -4.608 -14.226 1.00 35.52 O ATOM 405 OE2 GLU A 407 -0.377 -3.996 -14.123 1.00 4.03 O ATOM 0 H GLU A 407 -2.060 -1.455 -9.225 1.00 62.00 H new ATOM 0 HA GLU A 407 -2.700 -4.346 -9.518 1.00 52.21 H new ATOM 0 HB2 GLU A 407 -3.006 -3.125 -11.676 1.00 30.03 H new ATOM 0 HB3 GLU A 407 -1.380 -2.485 -11.549 1.00 30.03 H new ATOM 0 HG2 GLU A 407 -0.452 -4.799 -11.696 1.00 62.25 H new ATOM 0 HG3 GLU A 407 -2.076 -5.448 -11.807 1.00 62.25 H new ATOM 412 N TRP A 408 -0.347 -5.039 -8.940 1.00 4.40 N ATOM 413 CA TRP A 408 0.924 -5.462 -8.331 1.00 22.32 C ATOM 414 C TRP A 408 1.427 -6.792 -8.928 1.00 3.25 C ATOM 415 O TRP A 408 0.723 -7.475 -9.686 1.00 2.44 O ATOM 416 CB TRP A 408 0.751 -5.576 -6.791 1.00 3.22 C ATOM 417 CG TRP A 408 -0.242 -6.627 -6.336 1.00 1.33 C ATOM 418 CD1 TRP A 408 0.040 -7.915 -5.990 1.00 52.12 C ATOM 419 CD2 TRP A 408 -1.667 -6.477 -6.190 1.00 33.51 C ATOM 420 NE1 TRP A 408 -1.100 -8.560 -5.595 1.00 53.50 N ATOM 421 CE2 TRP A 408 -2.161 -7.702 -5.716 1.00 52.33 C ATOM 422 CE3 TRP A 408 -2.567 -5.423 -6.404 1.00 34.33 C ATOM 423 CZ2 TRP A 408 -3.514 -7.908 -5.454 1.00 64.34 C ATOM 424 CZ3 TRP A 408 -3.907 -5.630 -6.143 1.00 11.12 C ATOM 425 CH2 TRP A 408 -4.365 -6.866 -5.675 1.00 33.30 C ATOM 0 H TRP A 408 -0.975 -5.815 -9.150 1.00 4.40 H new ATOM 0 HA TRP A 408 1.679 -4.708 -8.552 1.00 22.32 H new ATOM 0 HB2 TRP A 408 1.721 -5.797 -6.347 1.00 3.22 H new ATOM 0 HB3 TRP A 408 0.436 -4.607 -6.403 1.00 3.22 H new ATOM 0 HD1 TRP A 408 1.023 -8.362 -6.023 1.00 52.12 H new ATOM 0 HE1 TRP A 408 -1.152 -9.523 -5.264 1.00 53.50 H new ATOM 0 HE3 TRP A 408 -2.218 -4.467 -6.766 1.00 34.33 H new ATOM 0 HZ2 TRP A 408 -3.875 -8.858 -5.089 1.00 64.34 H new ATOM 0 HZ3 TRP A 408 -4.611 -4.827 -6.302 1.00 11.12 H new ATOM 0 HH2 TRP A 408 -5.420 -6.998 -5.484 1.00 33.30 H new ATOM 436 N GLN A 409 2.654 -7.151 -8.541 1.00 14.23 N ATOM 437 CA GLN A 409 3.307 -8.419 -8.926 1.00 34.11 C ATOM 438 C GLN A 409 3.576 -9.253 -7.664 1.00 72.55 C ATOM 439 O GLN A 409 4.138 -8.736 -6.692 1.00 73.23 O ATOM 440 CB GLN A 409 4.651 -8.135 -9.669 1.00 43.43 C ATOM 441 CG GLN A 409 4.517 -7.450 -11.057 1.00 64.20 C ATOM 442 CD GLN A 409 4.225 -8.396 -12.243 1.00 70.25 C ATOM 443 OE1 GLN A 409 3.551 -9.509 -12.022 1.00 42.32 O flip ATOM 444 NE2 GLN A 409 4.622 -8.123 -13.370 1.00 70.52 N flip ATOM 0 H GLN A 409 3.236 -6.565 -7.942 1.00 14.23 H new ATOM 0 HA GLN A 409 2.649 -8.970 -9.598 1.00 34.11 H new ATOM 0 HB2 GLN A 409 5.272 -7.506 -9.032 1.00 43.43 H new ATOM 0 HB3 GLN A 409 5.181 -9.079 -9.799 1.00 43.43 H new ATOM 0 HG2 GLN A 409 3.719 -6.710 -11.001 1.00 64.20 H new ATOM 0 HG3 GLN A 409 5.440 -6.909 -11.266 1.00 64.20 H new ATOM 0 HE21 GLN A 409 5.142 -7.261 -13.533 1.00 70.52 H new ATOM 0 HE22 GLN A 409 4.432 -8.758 -14.145 1.00 70.52 H new ATOM 453 N GLU A 410 3.164 -10.527 -7.675 1.00 71.51 N ATOM 454 CA GLU A 410 3.468 -11.488 -6.585 1.00 14.24 C ATOM 455 C GLU A 410 4.657 -12.394 -6.954 1.00 30.14 C ATOM 456 O GLU A 410 5.006 -12.552 -8.123 1.00 42.42 O ATOM 457 CB GLU A 410 2.203 -12.338 -6.204 1.00 24.21 C ATOM 458 CG GLU A 410 1.512 -11.900 -4.897 1.00 71.13 C ATOM 459 CD GLU A 410 2.418 -12.074 -3.656 1.00 32.15 C ATOM 460 OE1 GLU A 410 2.499 -13.196 -3.106 1.00 64.51 O ATOM 461 OE2 GLU A 410 3.088 -11.102 -3.241 1.00 43.45 O ATOM 0 H GLU A 410 2.612 -10.928 -8.433 1.00 71.51 H new ATOM 0 HA GLU A 410 3.754 -10.909 -5.707 1.00 14.24 H new ATOM 0 HB2 GLU A 410 1.482 -12.280 -7.019 1.00 24.21 H new ATOM 0 HB3 GLU A 410 2.497 -13.384 -6.113 1.00 24.21 H new ATOM 0 HG2 GLU A 410 1.214 -10.855 -4.981 1.00 71.13 H new ATOM 0 HG3 GLU A 410 0.600 -12.481 -4.760 1.00 71.13 H new ATOM 649 N LEU A 423 2.283 -13.566 -11.379 1.00 42.40 N ATOM 650 CA LEU A 423 1.072 -13.367 -10.550 1.00 53.45 C ATOM 651 C LEU A 423 0.611 -11.888 -10.527 1.00 45.35 C ATOM 652 O LEU A 423 0.405 -11.286 -9.464 1.00 63.02 O ATOM 653 CB LEU A 423 1.315 -13.941 -9.130 1.00 64.22 C ATOM 654 CG LEU A 423 1.716 -15.448 -9.059 1.00 2.32 C ATOM 655 CD1 LEU A 423 2.000 -15.870 -7.607 1.00 63.35 C ATOM 656 CD2 LEU A 423 0.641 -16.350 -9.708 1.00 72.13 C ATOM 0 HA LEU A 423 0.246 -13.916 -11.002 1.00 53.45 H new ATOM 0 HB2 LEU A 423 2.099 -13.354 -8.652 1.00 64.22 H new ATOM 0 HB3 LEU A 423 0.408 -13.799 -8.542 1.00 64.22 H new ATOM 0 HG LEU A 423 2.634 -15.577 -9.632 1.00 2.32 H new ATOM 0 HD11 LEU A 423 2.277 -16.924 -7.582 1.00 63.35 H new ATOM 0 HD12 LEU A 423 2.817 -15.270 -7.207 1.00 63.35 H new ATOM 0 HD13 LEU A 423 1.107 -15.716 -7.002 1.00 63.35 H new ATOM 0 HD21 LEU A 423 0.952 -17.393 -9.641 1.00 72.13 H new ATOM 0 HD22 LEU A 423 -0.307 -16.220 -9.186 1.00 72.13 H new ATOM 0 HD23 LEU A 423 0.519 -16.074 -10.755 1.00 72.13 H new ATOM 668 N THR A 424 0.509 -11.310 -11.738 1.00 25.54 N ATOM 669 CA THR A 424 0.031 -9.927 -11.949 1.00 20.03 C ATOM 670 C THR A 424 -1.451 -9.808 -11.541 1.00 5.30 C ATOM 671 O THR A 424 -2.350 -10.197 -12.297 1.00 12.23 O ATOM 672 CB THR A 424 0.202 -9.469 -13.445 1.00 4.13 C ATOM 673 OG1 THR A 424 1.539 -9.749 -13.894 1.00 4.15 O ATOM 674 CG2 THR A 424 -0.090 -7.963 -13.626 1.00 15.10 C ATOM 0 H THR A 424 0.757 -11.790 -12.603 1.00 25.54 H new ATOM 0 HA THR A 424 0.640 -9.274 -11.324 1.00 20.03 H new ATOM 0 HB THR A 424 -0.520 -10.028 -14.040 1.00 4.13 H new ATOM 0 HG1 THR A 424 2.155 -9.709 -13.133 1.00 4.15 H new ATOM 0 HG21 THR A 424 0.040 -7.690 -14.673 1.00 15.10 H new ATOM 0 HG22 THR A 424 -1.115 -7.752 -13.321 1.00 15.10 H new ATOM 0 HG23 THR A 424 0.598 -7.383 -13.012 1.00 15.10 H new ATOM 682 N ARG A 425 -1.695 -9.355 -10.304 1.00 42.43 N ATOM 683 CA ARG A 425 -3.051 -9.200 -9.749 1.00 22.21 C ATOM 684 C ARG A 425 -3.460 -7.717 -9.747 1.00 75.31 C ATOM 685 O ARG A 425 -2.645 -6.846 -9.451 1.00 14.32 O ATOM 686 CB ARG A 425 -3.114 -9.799 -8.323 1.00 53.41 C ATOM 687 CG ARG A 425 -2.746 -11.301 -8.190 1.00 55.01 C ATOM 688 CD ARG A 425 -3.747 -12.252 -8.889 1.00 5.22 C ATOM 689 NE ARG A 425 -3.670 -12.213 -10.362 1.00 13.04 N ATOM 690 CZ ARG A 425 -4.391 -12.928 -11.188 1.00 13.13 C ATOM 691 NH1 ARG A 425 -5.221 -13.829 -10.765 1.00 30.51 N ATOM 692 NH2 ARG A 425 -4.261 -12.737 -12.456 1.00 11.55 N ATOM 0 H ARG A 425 -0.956 -9.084 -9.656 1.00 42.43 H new ATOM 0 HA ARG A 425 -3.757 -9.743 -10.377 1.00 22.21 H new ATOM 0 HB2 ARG A 425 -2.446 -9.225 -7.681 1.00 53.41 H new ATOM 0 HB3 ARG A 425 -4.124 -9.659 -7.938 1.00 53.41 H new ATOM 0 HG2 ARG A 425 -1.753 -11.461 -8.610 1.00 55.01 H new ATOM 0 HG3 ARG A 425 -2.691 -11.560 -7.133 1.00 55.01 H new ATOM 0 HD2 ARG A 425 -3.563 -13.272 -8.551 1.00 5.22 H new ATOM 0 HD3 ARG A 425 -4.759 -11.992 -8.580 1.00 5.22 H new ATOM 0 HE ARG A 425 -2.993 -11.570 -10.774 1.00 13.04 H new ATOM 0 HH11 ARG A 425 -5.326 -13.996 -9.764 1.00 30.51 H new ATOM 0 HH12 ARG A 425 -5.770 -14.371 -11.433 1.00 30.51 H new ATOM 0 HH21 ARG A 425 -3.604 -12.037 -12.802 1.00 11.55 H new ATOM 0 HH22 ARG A 425 -4.815 -13.285 -13.114 1.00 11.55 H new ATOM 706 N SER A 426 -4.733 -7.452 -10.060 1.00 31.44 N ATOM 707 CA SER A 426 -5.259 -6.078 -10.227 1.00 4.02 C ATOM 708 C SER A 426 -6.692 -5.960 -9.674 1.00 21.33 C ATOM 709 O SER A 426 -7.489 -6.906 -9.760 1.00 74.40 O ATOM 710 CB SER A 426 -5.214 -5.653 -11.716 1.00 20.51 C ATOM 711 OG SER A 426 -5.873 -6.593 -12.552 1.00 43.22 O ATOM 0 H SER A 426 -5.434 -8.179 -10.206 1.00 31.44 H new ATOM 0 HA SER A 426 -4.621 -5.404 -9.655 1.00 4.02 H new ATOM 0 HB2 SER A 426 -5.682 -4.675 -11.829 1.00 20.51 H new ATOM 0 HB3 SER A 426 -4.176 -5.549 -12.033 1.00 20.51 H new ATOM 0 HG SER A 426 -5.826 -6.292 -13.483 1.00 43.22 H new ATOM 717 N LEU A 427 -7.002 -4.779 -9.113 1.00 43.22 N ATOM 718 CA LEU A 427 -8.286 -4.483 -8.433 1.00 71.13 C ATOM 719 C LEU A 427 -8.695 -3.007 -8.635 1.00 13.23 C ATOM 720 O LEU A 427 -7.829 -2.152 -8.786 1.00 62.03 O ATOM 721 CB LEU A 427 -8.161 -4.774 -6.906 1.00 74.43 C ATOM 722 CG LEU A 427 -8.207 -6.270 -6.489 1.00 72.42 C ATOM 723 CD1 LEU A 427 -7.844 -6.450 -5.008 1.00 12.13 C ATOM 724 CD2 LEU A 427 -9.591 -6.876 -6.800 1.00 62.33 C ATOM 0 H LEU A 427 -6.360 -3.986 -9.116 1.00 43.22 H new ATOM 0 HA LEU A 427 -9.052 -5.123 -8.871 1.00 71.13 H new ATOM 0 HB2 LEU A 427 -7.223 -4.348 -6.551 1.00 74.43 H new ATOM 0 HB3 LEU A 427 -8.965 -4.249 -6.390 1.00 74.43 H new ATOM 0 HG LEU A 427 -7.460 -6.806 -7.074 1.00 72.42 H new ATOM 0 HD11 LEU A 427 -7.886 -7.508 -4.749 1.00 12.13 H new ATOM 0 HD12 LEU A 427 -6.837 -6.073 -4.832 1.00 12.13 H new ATOM 0 HD13 LEU A 427 -8.552 -5.897 -4.390 1.00 12.13 H new ATOM 0 HD21 LEU A 427 -9.605 -7.924 -6.501 1.00 62.33 H new ATOM 0 HD22 LEU A 427 -10.358 -6.332 -6.250 1.00 62.33 H new ATOM 0 HD23 LEU A 427 -9.789 -6.801 -7.869 1.00 62.33 H new ATOM 736 N PRO A 428 -10.024 -2.688 -8.655 1.00 52.23 N ATOM 737 CA PRO A 428 -10.498 -1.288 -8.552 1.00 73.33 C ATOM 738 C PRO A 428 -10.402 -0.761 -7.086 1.00 30.32 C ATOM 739 O PRO A 428 -11.126 -1.220 -6.204 1.00 53.31 O ATOM 740 CB PRO A 428 -11.960 -1.374 -9.055 1.00 40.21 C ATOM 741 CG PRO A 428 -12.395 -2.772 -8.717 1.00 2.25 C ATOM 742 CD PRO A 428 -11.156 -3.643 -8.834 1.00 52.42 C ATOM 0 HA PRO A 428 -9.900 -0.584 -9.131 1.00 73.33 H new ATOM 0 HB2 PRO A 428 -12.592 -0.633 -8.566 1.00 40.21 H new ATOM 0 HB3 PRO A 428 -12.022 -1.188 -10.127 1.00 40.21 H new ATOM 0 HG2 PRO A 428 -12.809 -2.818 -7.710 1.00 2.25 H new ATOM 0 HG3 PRO A 428 -13.175 -3.112 -9.398 1.00 2.25 H new ATOM 0 HD2 PRO A 428 -11.144 -4.423 -8.073 1.00 52.42 H new ATOM 0 HD3 PRO A 428 -11.108 -4.141 -9.802 1.00 52.42 H new ATOM 750 N CYS A 429 -9.497 0.201 -6.842 1.00 63.21 N ATOM 751 CA CYS A 429 -9.218 0.735 -5.485 1.00 23.05 C ATOM 752 C CYS A 429 -9.839 2.132 -5.289 1.00 62.21 C ATOM 753 O CYS A 429 -9.814 2.973 -6.191 1.00 20.43 O ATOM 754 CB CYS A 429 -7.693 0.802 -5.257 1.00 25.00 C ATOM 755 SG CYS A 429 -6.808 1.774 -6.495 1.00 51.31 S ATOM 0 H CYS A 429 -8.935 0.635 -7.575 1.00 63.21 H new ATOM 0 HA CYS A 429 -9.671 0.062 -4.757 1.00 23.05 H new ATOM 0 HB2 CYS A 429 -7.502 1.227 -4.272 1.00 25.00 H new ATOM 0 HB3 CYS A 429 -7.292 -0.212 -5.251 1.00 25.00 H new ATOM 0 HG CYS A 429 -7.293 2.980 -6.528 1.00 51.31 H new ATOM 761 N GLN A 430 -10.371 2.366 -4.081 1.00 40.42 N ATOM 762 CA GLN A 430 -11.101 3.591 -3.704 1.00 43.03 C ATOM 763 C GLN A 430 -10.562 4.146 -2.372 1.00 73.45 C ATOM 764 O GLN A 430 -10.580 3.453 -1.352 1.00 70.14 O ATOM 765 CB GLN A 430 -12.618 3.289 -3.556 1.00 44.11 C ATOM 766 CG GLN A 430 -13.359 2.949 -4.862 1.00 44.24 C ATOM 767 CD GLN A 430 -14.872 2.779 -4.667 1.00 32.54 C ATOM 768 OE1 GLN A 430 -15.340 2.384 -3.604 1.00 64.05 O ATOM 769 NE2 GLN A 430 -15.647 3.056 -5.702 1.00 22.25 N ATOM 0 H GLN A 430 -10.305 1.693 -3.317 1.00 40.42 H new ATOM 0 HA GLN A 430 -10.954 4.332 -4.490 1.00 43.03 H new ATOM 0 HB2 GLN A 430 -12.738 2.456 -2.863 1.00 44.11 H new ATOM 0 HB3 GLN A 430 -13.100 4.154 -3.101 1.00 44.11 H new ATOM 0 HG2 GLN A 430 -13.179 3.739 -5.591 1.00 44.24 H new ATOM 0 HG3 GLN A 430 -12.947 2.030 -5.279 1.00 44.24 H new ATOM 0 HE21 GLN A 430 -15.234 3.383 -6.575 1.00 22.25 H new ATOM 0 HE22 GLN A 430 -16.658 2.943 -5.627 1.00 22.25 H new ATOM 778 N VAL A 431 -10.112 5.404 -2.379 1.00 2.02 N ATOM 779 CA VAL A 431 -9.570 6.073 -1.186 1.00 33.35 C ATOM 780 C VAL A 431 -10.675 6.875 -0.455 1.00 24.11 C ATOM 781 O VAL A 431 -11.148 7.910 -0.947 1.00 51.41 O ATOM 782 CB VAL A 431 -8.370 7.014 -1.571 1.00 32.33 C ATOM 783 CG1 VAL A 431 -7.725 7.666 -0.324 1.00 14.31 C ATOM 784 CG2 VAL A 431 -7.321 6.232 -2.388 1.00 40.10 C ATOM 0 H VAL A 431 -10.112 5.991 -3.213 1.00 2.02 H new ATOM 0 HA VAL A 431 -9.199 5.304 -0.508 1.00 33.35 H new ATOM 0 HB VAL A 431 -8.764 7.823 -2.186 1.00 32.33 H new ATOM 0 HG11 VAL A 431 -6.901 8.308 -0.634 1.00 14.31 H new ATOM 0 HG12 VAL A 431 -8.471 8.262 0.202 1.00 14.31 H new ATOM 0 HG13 VAL A 431 -7.349 6.888 0.340 1.00 14.31 H new ATOM 0 HG21 VAL A 431 -6.495 6.894 -2.649 1.00 40.10 H new ATOM 0 HG22 VAL A 431 -6.945 5.399 -1.794 1.00 40.10 H new ATOM 0 HG23 VAL A 431 -7.781 5.850 -3.299 1.00 40.10 H new ATOM 794 N TYR A 432 -11.092 6.360 0.712 1.00 64.13 N ATOM 795 CA TYR A 432 -12.026 7.040 1.632 1.00 63.15 C ATOM 796 C TYR A 432 -11.235 7.760 2.737 1.00 52.42 C ATOM 797 O TYR A 432 -10.550 7.119 3.543 1.00 31.34 O ATOM 798 CB TYR A 432 -13.019 6.012 2.232 1.00 42.42 C ATOM 799 CG TYR A 432 -14.039 5.499 1.209 1.00 21.12 C ATOM 800 CD1 TYR A 432 -13.756 4.408 0.383 1.00 52.04 C ATOM 801 CD2 TYR A 432 -15.274 6.128 1.056 1.00 23.43 C ATOM 802 CE1 TYR A 432 -14.672 3.968 -0.553 1.00 54.02 C ATOM 803 CE2 TYR A 432 -16.191 5.690 0.118 1.00 15.01 C ATOM 804 CZ TYR A 432 -15.887 4.609 -0.681 1.00 12.50 C ATOM 805 OH TYR A 432 -16.791 4.177 -1.625 1.00 1.34 O ATOM 0 H TYR A 432 -10.788 5.447 1.051 1.00 64.13 H new ATOM 0 HA TYR A 432 -12.602 7.785 1.083 1.00 63.15 H new ATOM 0 HB2 TYR A 432 -12.460 5.167 2.635 1.00 42.42 H new ATOM 0 HB3 TYR A 432 -13.549 6.471 3.067 1.00 42.42 H new ATOM 0 HD1 TYR A 432 -12.807 3.901 0.478 1.00 52.04 H new ATOM 0 HD2 TYR A 432 -15.519 6.973 1.682 1.00 23.43 H new ATOM 0 HE1 TYR A 432 -14.437 3.123 -1.184 1.00 54.02 H new ATOM 0 HE2 TYR A 432 -17.141 6.193 0.012 1.00 15.01 H new ATOM 0 HH TYR A 432 -16.336 3.600 -2.274 1.00 1.34 H new ATOM 815 N VAL A 433 -11.331 9.099 2.764 1.00 51.21 N ATOM 816 CA VAL A 433 -10.475 9.946 3.619 1.00 3.31 C ATOM 817 C VAL A 433 -11.244 10.537 4.837 1.00 1.45 C ATOM 818 O VAL A 433 -11.002 10.122 5.980 1.00 61.43 O ATOM 819 CB VAL A 433 -9.763 11.058 2.744 1.00 63.51 C ATOM 820 CG1 VAL A 433 -8.769 10.412 1.763 1.00 22.32 C ATOM 821 CG2 VAL A 433 -10.752 11.956 1.950 1.00 13.42 C ATOM 0 H VAL A 433 -11.998 9.625 2.199 1.00 51.21 H new ATOM 0 HA VAL A 433 -9.700 9.315 4.053 1.00 3.31 H new ATOM 0 HB VAL A 433 -9.241 11.703 3.451 1.00 63.51 H new ATOM 0 HG11 VAL A 433 -8.288 11.189 1.169 1.00 22.32 H new ATOM 0 HG12 VAL A 433 -8.012 9.861 2.322 1.00 22.32 H new ATOM 0 HG13 VAL A 433 -9.302 9.728 1.103 1.00 22.32 H new ATOM 0 HG21 VAL A 433 -10.192 12.693 1.375 1.00 13.42 H new ATOM 0 HG22 VAL A 433 -11.341 11.338 1.272 1.00 13.42 H new ATOM 0 HG23 VAL A 433 -11.418 12.467 2.645 1.00 13.42 H new ATOM 831 N ASN A 434 -12.175 11.476 4.580 1.00 63.35 N ATOM 832 CA ASN A 434 -12.981 12.174 5.605 1.00 24.45 C ATOM 833 C ASN A 434 -13.964 13.157 4.909 1.00 34.32 C ATOM 834 O ASN A 434 -13.839 13.422 3.704 1.00 44.44 O ATOM 835 CB ASN A 434 -12.045 12.943 6.588 1.00 11.40 C ATOM 836 CG ASN A 434 -12.755 13.606 7.766 1.00 71.21 C ATOM 837 OD1 ASN A 434 -13.757 13.107 8.270 1.00 72.35 O ATOM 838 ND2 ASN A 434 -12.265 14.751 8.184 1.00 12.40 N ATOM 0 H ASN A 434 -12.394 11.779 3.631 1.00 63.35 H new ATOM 0 HA ASN A 434 -13.554 11.444 6.176 1.00 24.45 H new ATOM 0 HB2 ASN A 434 -11.300 12.248 6.976 1.00 11.40 H new ATOM 0 HB3 ASN A 434 -11.506 13.709 6.030 1.00 11.40 H new ATOM 0 HD21 ASN A 434 -12.719 15.251 8.948 1.00 12.40 H new ATOM 0 HD22 ASN A 434 -11.431 15.140 7.744 1.00 12.40 H new ATOM 884 N ASN A 438 -7.717 17.222 4.657 1.00 5.22 N ATOM 885 CA ASN A 438 -6.645 18.084 4.091 1.00 12.22 C ATOM 886 C ASN A 438 -6.011 17.452 2.803 1.00 1.12 C ATOM 887 O ASN A 438 -5.105 18.021 2.197 1.00 11.32 O ATOM 888 CB ASN A 438 -5.585 18.316 5.207 1.00 12.44 C ATOM 889 CG ASN A 438 -4.494 19.324 4.845 1.00 52.22 C ATOM 890 OD1 ASN A 438 -3.414 18.959 4.390 1.00 41.14 O ATOM 891 ND2 ASN A 438 -4.776 20.600 5.025 1.00 22.40 N ATOM 0 HA ASN A 438 -7.063 19.040 3.774 1.00 12.22 H new ATOM 0 HB2 ASN A 438 -6.094 18.658 6.108 1.00 12.44 H new ATOM 0 HB3 ASN A 438 -5.115 17.362 5.449 1.00 12.44 H new ATOM 0 HD21 ASN A 438 -4.088 21.313 4.784 1.00 22.40 H new ATOM 0 HD22 ASN A 438 -5.682 20.873 5.405 1.00 22.40 H new ATOM 898 N LEU A 439 -6.520 16.284 2.385 1.00 13.53 N ATOM 899 CA LEU A 439 -6.030 15.537 1.200 1.00 74.30 C ATOM 900 C LEU A 439 -7.028 15.699 0.020 1.00 52.34 C ATOM 901 O LEU A 439 -8.162 15.207 0.089 1.00 24.01 O ATOM 902 CB LEU A 439 -5.877 14.043 1.594 1.00 34.02 C ATOM 903 CG LEU A 439 -5.298 13.080 0.512 1.00 14.13 C ATOM 904 CD1 LEU A 439 -3.812 13.371 0.208 1.00 51.42 C ATOM 905 CD2 LEU A 439 -5.520 11.605 0.925 1.00 12.10 C ATOM 0 H LEU A 439 -7.293 15.819 2.861 1.00 13.53 H new ATOM 0 HA LEU A 439 -5.065 15.928 0.877 1.00 74.30 H new ATOM 0 HB2 LEU A 439 -5.236 13.989 2.474 1.00 34.02 H new ATOM 0 HB3 LEU A 439 -6.857 13.669 1.891 1.00 34.02 H new ATOM 0 HG LEU A 439 -5.842 13.259 -0.416 1.00 14.13 H new ATOM 0 HD11 LEU A 439 -3.453 12.676 -0.551 1.00 51.42 H new ATOM 0 HD12 LEU A 439 -3.709 14.393 -0.158 1.00 51.42 H new ATOM 0 HD13 LEU A 439 -3.224 13.250 1.118 1.00 51.42 H new ATOM 0 HD21 LEU A 439 -5.110 10.947 0.159 1.00 12.10 H new ATOM 0 HD22 LEU A 439 -5.019 11.413 1.874 1.00 12.10 H new ATOM 0 HD23 LEU A 439 -6.588 11.414 1.034 1.00 12.10 H new ATOM 917 N LYS A 440 -6.597 16.393 -1.055 1.00 52.14 N ATOM 918 CA LYS A 440 -7.479 16.757 -2.205 1.00 64.41 C ATOM 919 C LYS A 440 -7.535 15.667 -3.311 1.00 75.33 C ATOM 920 O LYS A 440 -8.488 15.651 -4.095 1.00 71.33 O ATOM 921 CB LYS A 440 -7.040 18.125 -2.801 1.00 52.43 C ATOM 922 CG LYS A 440 -5.576 18.189 -3.276 1.00 34.14 C ATOM 923 CD LYS A 440 -5.145 19.606 -3.727 1.00 73.23 C ATOM 924 CE LYS A 440 -3.635 19.704 -4.014 1.00 43.21 C ATOM 925 NZ LYS A 440 -3.200 21.099 -4.284 1.00 25.22 N ATOM 0 H LYS A 440 -5.636 16.719 -1.158 1.00 52.14 H new ATOM 0 HA LYS A 440 -8.492 16.836 -1.811 1.00 64.41 H new ATOM 0 HB2 LYS A 440 -7.690 18.363 -3.643 1.00 52.43 H new ATOM 0 HB3 LYS A 440 -7.196 18.899 -2.049 1.00 52.43 H new ATOM 0 HG2 LYS A 440 -4.923 17.857 -2.468 1.00 34.14 H new ATOM 0 HG3 LYS A 440 -5.438 17.493 -4.104 1.00 34.14 H new ATOM 0 HD2 LYS A 440 -5.700 19.882 -4.624 1.00 73.23 H new ATOM 0 HD3 LYS A 440 -5.411 20.326 -2.953 1.00 73.23 H new ATOM 0 HE2 LYS A 440 -3.080 19.311 -3.162 1.00 43.21 H new ATOM 0 HE3 LYS A 440 -3.389 19.077 -4.871 1.00 43.21 H new ATOM 0 HZ1 LYS A 440 -2.177 21.114 -4.471 1.00 25.22 H new ATOM 0 HZ2 LYS A 440 -3.709 21.467 -5.113 1.00 25.22 H new ATOM 0 HZ3 LYS A 440 -3.409 21.694 -3.457 1.00 25.22 H new ATOM 939 N THR A 441 -6.500 14.789 -3.372 1.00 21.10 N ATOM 940 CA THR A 441 -6.397 13.642 -4.340 1.00 54.11 C ATOM 941 C THR A 441 -6.591 14.061 -5.826 1.00 12.03 C ATOM 942 O THR A 441 -7.065 13.278 -6.668 1.00 62.32 O ATOM 943 CB THR A 441 -7.363 12.456 -3.984 1.00 22.33 C ATOM 944 OG1 THR A 441 -8.731 12.830 -4.185 1.00 64.34 O ATOM 945 CG2 THR A 441 -7.176 11.980 -2.537 1.00 63.11 C ATOM 0 H THR A 441 -5.697 14.851 -2.745 1.00 21.10 H new ATOM 0 HA THR A 441 -5.371 13.291 -4.232 1.00 54.11 H new ATOM 0 HB THR A 441 -7.109 11.634 -4.654 1.00 22.33 H new ATOM 0 HG1 THR A 441 -8.787 13.797 -4.336 1.00 64.34 H new ATOM 0 HG21 THR A 441 -7.863 11.159 -2.332 1.00 63.11 H new ATOM 0 HG22 THR A 441 -6.150 11.639 -2.396 1.00 63.11 H new ATOM 0 HG23 THR A 441 -7.381 12.804 -1.854 1.00 63.11 H new ATOM 953 N GLU A 442 -6.149 15.282 -6.136 1.00 15.53 N ATOM 954 CA GLU A 442 -6.399 15.953 -7.429 1.00 43.14 C ATOM 955 C GLU A 442 -5.315 15.609 -8.483 1.00 31.51 C ATOM 956 O GLU A 442 -5.607 15.433 -9.673 1.00 54.34 O ATOM 957 CB GLU A 442 -6.436 17.483 -7.168 1.00 64.44 C ATOM 958 CG GLU A 442 -6.809 18.353 -8.385 1.00 2.02 C ATOM 959 CD GLU A 442 -6.829 19.855 -8.057 1.00 50.45 C ATOM 960 OE1 GLU A 442 -7.759 20.304 -7.363 1.00 4.42 O ATOM 961 OE2 GLU A 442 -5.925 20.593 -8.498 1.00 74.14 O ATOM 0 H GLU A 442 -5.598 15.847 -5.490 1.00 15.53 H new ATOM 0 HA GLU A 442 -7.348 15.605 -7.837 1.00 43.14 H new ATOM 0 HB2 GLU A 442 -7.150 17.681 -6.369 1.00 64.44 H new ATOM 0 HB3 GLU A 442 -5.457 17.796 -6.805 1.00 64.44 H new ATOM 0 HG2 GLU A 442 -6.096 18.170 -9.189 1.00 2.02 H new ATOM 0 HG3 GLU A 442 -7.790 18.053 -8.754 1.00 2.02 H new ATOM 968 N GLN A 443 -4.064 15.509 -8.010 1.00 62.42 N ATOM 969 CA GLN A 443 -2.855 15.315 -8.851 1.00 41.05 C ATOM 970 C GLN A 443 -2.415 13.828 -8.865 1.00 55.02 C ATOM 971 O GLN A 443 -1.277 13.497 -9.233 1.00 43.42 O ATOM 972 CB GLN A 443 -1.730 16.230 -8.294 1.00 35.54 C ATOM 973 CG GLN A 443 -2.142 17.717 -8.202 1.00 73.10 C ATOM 974 CD GLN A 443 -1.150 18.607 -7.452 1.00 72.41 C ATOM 975 OE1 GLN A 443 0.054 18.364 -7.430 1.00 62.15 O ATOM 976 NE2 GLN A 443 -1.653 19.659 -6.834 1.00 52.34 N ATOM 0 H GLN A 443 -3.851 15.561 -7.014 1.00 62.42 H new ATOM 0 HA GLN A 443 -3.074 15.585 -9.884 1.00 41.05 H new ATOM 0 HB2 GLN A 443 -1.442 15.878 -7.304 1.00 35.54 H new ATOM 0 HB3 GLN A 443 -0.851 16.142 -8.932 1.00 35.54 H new ATOM 0 HG2 GLN A 443 -2.270 18.108 -9.211 1.00 73.10 H new ATOM 0 HG3 GLN A 443 -3.112 17.782 -7.710 1.00 73.10 H new ATOM 0 HE21 GLN A 443 -2.656 19.839 -6.867 1.00 52.34 H new ATOM 0 HE22 GLN A 443 -1.038 20.292 -6.323 1.00 52.34 H new ATOM 985 N TRP A 444 -3.340 12.944 -8.453 1.00 13.55 N ATOM 986 CA TRP A 444 -3.148 11.481 -8.467 1.00 32.21 C ATOM 987 C TRP A 444 -3.497 10.912 -9.874 1.00 13.23 C ATOM 988 O TRP A 444 -4.386 11.453 -10.554 1.00 52.41 O ATOM 989 CB TRP A 444 -4.057 10.809 -7.396 1.00 51.11 C ATOM 990 CG TRP A 444 -3.768 11.157 -5.944 1.00 53.32 C ATOM 991 CD1 TRP A 444 -3.273 12.329 -5.439 1.00 21.34 C ATOM 992 CD2 TRP A 444 -4.005 10.307 -4.807 1.00 43.34 C ATOM 993 NE1 TRP A 444 -3.192 12.258 -4.073 1.00 42.13 N ATOM 994 CE2 TRP A 444 -3.632 11.028 -3.661 1.00 74.33 C ATOM 995 CE3 TRP A 444 -4.498 9.005 -4.655 1.00 52.22 C ATOM 996 CZ2 TRP A 444 -3.735 10.491 -2.377 1.00 62.23 C ATOM 997 CZ3 TRP A 444 -4.596 8.473 -3.386 1.00 51.41 C ATOM 998 CH2 TRP A 444 -4.220 9.216 -2.257 1.00 53.03 C ATOM 0 H TRP A 444 -4.253 13.227 -8.097 1.00 13.55 H new ATOM 0 HA TRP A 444 -2.105 11.265 -8.238 1.00 32.21 H new ATOM 0 HB2 TRP A 444 -5.092 11.076 -7.611 1.00 51.11 H new ATOM 0 HB3 TRP A 444 -3.976 9.728 -7.510 1.00 51.11 H new ATOM 0 HD1 TRP A 444 -2.988 13.186 -6.031 1.00 21.34 H new ATOM 0 HE1 TRP A 444 -2.858 13.002 -3.461 1.00 42.13 H new ATOM 0 HE3 TRP A 444 -4.797 8.427 -5.517 1.00 52.22 H new ATOM 0 HZ2 TRP A 444 -3.442 11.061 -1.508 1.00 62.23 H new ATOM 0 HZ3 TRP A 444 -4.969 7.467 -3.259 1.00 51.41 H new ATOM 0 HH2 TRP A 444 -4.315 8.775 -1.276 1.00 53.03 H new ATOM 1009 N PRO A 445 -2.812 9.815 -10.336 1.00 32.10 N ATOM 1010 CA PRO A 445 -3.156 9.124 -11.620 1.00 20.41 C ATOM 1011 C PRO A 445 -4.507 8.357 -11.557 1.00 34.20 C ATOM 1012 O PRO A 445 -5.293 8.537 -10.632 1.00 14.51 O ATOM 1013 CB PRO A 445 -1.959 8.150 -11.814 1.00 72.45 C ATOM 1014 CG PRO A 445 -1.470 7.881 -10.425 1.00 35.34 C ATOM 1015 CD PRO A 445 -1.644 9.180 -9.670 1.00 33.32 C ATOM 0 HA PRO A 445 -3.295 9.825 -12.443 1.00 20.41 H new ATOM 0 HB2 PRO A 445 -2.271 7.231 -12.311 1.00 72.45 H new ATOM 0 HB3 PRO A 445 -1.179 8.597 -12.431 1.00 72.45 H new ATOM 0 HG2 PRO A 445 -2.040 7.078 -9.958 1.00 35.34 H new ATOM 0 HG3 PRO A 445 -0.426 7.569 -10.431 1.00 35.34 H new ATOM 0 HD2 PRO A 445 -1.832 9.006 -8.610 1.00 33.32 H new ATOM 0 HD3 PRO A 445 -0.754 9.806 -9.738 1.00 33.32 H new ATOM 1023 N GLN A 446 -4.779 7.512 -12.568 1.00 72.41 N ATOM 1024 CA GLN A 446 -5.976 6.622 -12.576 1.00 31.30 C ATOM 1025 C GLN A 446 -5.586 5.155 -12.282 1.00 74.22 C ATOM 1026 O GLN A 446 -6.453 4.308 -12.058 1.00 32.20 O ATOM 1027 CB GLN A 446 -6.726 6.727 -13.931 1.00 64.31 C ATOM 1028 CG GLN A 446 -5.895 6.346 -15.175 1.00 72.55 C ATOM 1029 CD GLN A 446 -6.718 6.362 -16.468 1.00 15.40 C ATOM 1030 OE1 GLN A 446 -6.834 7.381 -17.135 1.00 43.30 O ATOM 1031 NE2 GLN A 446 -7.287 5.231 -16.829 1.00 51.53 N ATOM 0 H GLN A 446 -4.190 7.420 -13.396 1.00 72.41 H new ATOM 0 HA GLN A 446 -6.645 6.955 -11.783 1.00 31.30 H new ATOM 0 HB2 GLN A 446 -7.606 6.085 -13.891 1.00 64.31 H new ATOM 0 HB3 GLN A 446 -7.083 7.750 -14.052 1.00 64.31 H new ATOM 0 HG2 GLN A 446 -5.059 7.038 -15.274 1.00 72.55 H new ATOM 0 HG3 GLN A 446 -5.471 5.352 -15.032 1.00 72.55 H new ATOM 0 HE21 GLN A 446 -7.173 4.397 -16.254 1.00 51.53 H new ATOM 0 HE22 GLN A 446 -7.841 5.189 -17.684 1.00 51.53 H new ATOM 1040 N LYS A 447 -4.273 4.869 -12.306 1.00 23.21 N ATOM 1041 CA LYS A 447 -3.718 3.541 -11.976 1.00 53.33 C ATOM 1042 C LYS A 447 -2.467 3.673 -11.069 1.00 42.13 C ATOM 1043 O LYS A 447 -1.561 4.466 -11.350 1.00 30.42 O ATOM 1044 CB LYS A 447 -3.363 2.769 -13.275 1.00 63.50 C ATOM 1045 CG LYS A 447 -2.859 1.329 -13.038 1.00 12.30 C ATOM 1046 CD LYS A 447 -2.453 0.608 -14.345 1.00 1.52 C ATOM 1047 CE LYS A 447 -1.997 -0.836 -14.085 1.00 4.43 C ATOM 1048 NZ LYS A 447 -1.569 -1.529 -15.327 1.00 3.24 N ATOM 0 H LYS A 447 -3.561 5.555 -12.556 1.00 23.21 H new ATOM 0 HA LYS A 447 -4.476 2.981 -11.429 1.00 53.33 H new ATOM 0 HB2 LYS A 447 -4.245 2.733 -13.915 1.00 63.50 H new ATOM 0 HB3 LYS A 447 -2.598 3.325 -13.817 1.00 63.50 H new ATOM 0 HG2 LYS A 447 -2.003 1.356 -12.363 1.00 12.30 H new ATOM 0 HG3 LYS A 447 -3.640 0.754 -12.540 1.00 12.30 H new ATOM 0 HD2 LYS A 447 -3.297 0.603 -15.034 1.00 1.52 H new ATOM 0 HD3 LYS A 447 -1.649 1.161 -14.830 1.00 1.52 H new ATOM 0 HE2 LYS A 447 -1.172 -0.830 -13.373 1.00 4.43 H new ATOM 0 HE3 LYS A 447 -2.812 -1.394 -13.624 1.00 4.43 H new ATOM 0 HZ1 LYS A 447 -1.011 -2.371 -15.080 1.00 3.24 H new ATOM 0 HZ2 LYS A 447 -2.408 -1.816 -15.871 1.00 3.24 H new ATOM 0 HZ3 LYS A 447 -0.988 -0.885 -15.901 1.00 3.24 H new ATOM 1062 N LEU A 448 -2.446 2.886 -9.983 1.00 12.41 N ATOM 1063 CA LEU A 448 -1.331 2.802 -9.024 1.00 45.22 C ATOM 1064 C LEU A 448 -0.612 1.435 -9.129 1.00 74.53 C ATOM 1065 O LEU A 448 -1.259 0.394 -9.279 1.00 4.31 O ATOM 1066 CB LEU A 448 -1.881 3.010 -7.588 1.00 75.11 C ATOM 1067 CG LEU A 448 -2.522 4.403 -7.301 1.00 54.22 C ATOM 1068 CD1 LEU A 448 -3.046 4.505 -5.848 1.00 4.44 C ATOM 1069 CD2 LEU A 448 -1.535 5.542 -7.624 1.00 53.31 C ATOM 0 H LEU A 448 -3.224 2.273 -9.740 1.00 12.41 H new ATOM 0 HA LEU A 448 -0.604 3.580 -9.256 1.00 45.22 H new ATOM 0 HB2 LEU A 448 -2.627 2.240 -7.390 1.00 75.11 H new ATOM 0 HB3 LEU A 448 -1.066 2.854 -6.881 1.00 75.11 H new ATOM 0 HG LEU A 448 -3.384 4.509 -7.960 1.00 54.22 H new ATOM 0 HD11 LEU A 448 -3.485 5.490 -5.688 1.00 4.44 H new ATOM 0 HD12 LEU A 448 -3.803 3.739 -5.679 1.00 4.44 H new ATOM 0 HD13 LEU A 448 -2.220 4.358 -5.152 1.00 4.44 H new ATOM 0 HD21 LEU A 448 -2.007 6.502 -7.415 1.00 53.31 H new ATOM 0 HD22 LEU A 448 -0.642 5.435 -7.008 1.00 53.31 H new ATOM 0 HD23 LEU A 448 -1.258 5.495 -8.677 1.00 53.31 H new ATOM 1081 N ILE A 449 0.734 1.453 -9.043 1.00 13.43 N ATOM 1082 CA ILE A 449 1.576 0.234 -9.115 1.00 24.12 C ATOM 1083 C ILE A 449 2.124 -0.086 -7.701 1.00 11.10 C ATOM 1084 O ILE A 449 2.957 0.650 -7.173 1.00 3.14 O ATOM 1085 CB ILE A 449 2.779 0.381 -10.151 1.00 30.24 C ATOM 1086 CG1 ILE A 449 2.276 0.578 -11.632 1.00 52.32 C ATOM 1087 CG2 ILE A 449 3.740 -0.843 -10.070 1.00 5.31 C ATOM 1088 CD1 ILE A 449 1.672 1.939 -11.966 1.00 4.34 C ATOM 0 H ILE A 449 1.271 2.312 -8.922 1.00 13.43 H new ATOM 0 HA ILE A 449 0.951 -0.584 -9.475 1.00 24.12 H new ATOM 0 HB ILE A 449 3.325 1.281 -9.867 1.00 30.24 H new ATOM 0 HG12 ILE A 449 3.115 0.402 -12.305 1.00 52.32 H new ATOM 0 HG13 ILE A 449 1.531 -0.188 -11.845 1.00 52.32 H new ATOM 0 HG21 ILE A 449 4.551 -0.717 -10.787 1.00 5.31 H new ATOM 0 HG22 ILE A 449 4.153 -0.915 -9.064 1.00 5.31 H new ATOM 0 HG23 ILE A 449 3.189 -1.754 -10.302 1.00 5.31 H new ATOM 0 HD11 ILE A 449 1.363 1.953 -13.011 1.00 4.34 H new ATOM 0 HD12 ILE A 449 0.806 2.119 -11.329 1.00 4.34 H new ATOM 0 HD13 ILE A 449 2.415 2.718 -11.796 1.00 4.34 H new ATOM 1100 N MET A 450 1.640 -1.183 -7.094 1.00 43.20 N ATOM 1101 CA MET A 450 2.020 -1.582 -5.721 1.00 21.45 C ATOM 1102 C MET A 450 3.176 -2.616 -5.713 1.00 33.31 C ATOM 1103 O MET A 450 3.294 -3.447 -6.617 1.00 73.32 O ATOM 1104 CB MET A 450 0.773 -2.137 -4.983 1.00 30.05 C ATOM 1105 CG MET A 450 1.004 -2.453 -3.503 1.00 55.33 C ATOM 1106 SD MET A 450 -0.501 -2.894 -2.610 1.00 64.32 S ATOM 1107 CE MET A 450 -0.921 -4.468 -3.346 1.00 43.32 C ATOM 0 H MET A 450 0.976 -1.819 -7.537 1.00 43.20 H new ATOM 0 HA MET A 450 2.389 -0.700 -5.198 1.00 21.45 H new ATOM 0 HB2 MET A 450 -0.036 -1.411 -5.065 1.00 30.05 H new ATOM 0 HB3 MET A 450 0.440 -3.044 -5.488 1.00 30.05 H new ATOM 0 HG2 MET A 450 1.717 -3.274 -3.423 1.00 55.33 H new ATOM 0 HG3 MET A 450 1.460 -1.587 -3.023 1.00 55.33 H new ATOM 0 HE1 MET A 450 -1.157 -5.186 -2.560 1.00 43.32 H new ATOM 0 HE2 MET A 450 -1.786 -4.346 -3.998 1.00 43.32 H new ATOM 0 HE3 MET A 450 -0.076 -4.834 -3.930 1.00 43.32 H new ATOM 1117 N GLN A 451 4.026 -2.540 -4.672 1.00 65.11 N ATOM 1118 CA GLN A 451 5.153 -3.470 -4.452 1.00 11.21 C ATOM 1119 C GLN A 451 4.975 -4.202 -3.094 1.00 22.44 C ATOM 1120 O GLN A 451 5.061 -3.573 -2.035 1.00 61.45 O ATOM 1121 CB GLN A 451 6.485 -2.668 -4.465 1.00 45.42 C ATOM 1122 CG GLN A 451 7.761 -3.527 -4.319 1.00 53.13 C ATOM 1123 CD GLN A 451 9.044 -2.705 -4.150 1.00 21.14 C ATOM 1124 OE1 GLN A 451 9.156 -1.580 -4.627 1.00 12.41 O ATOM 1125 NE2 GLN A 451 10.029 -3.270 -3.479 1.00 74.34 N ATOM 0 H GLN A 451 3.950 -1.823 -3.951 1.00 65.11 H new ATOM 0 HA GLN A 451 5.176 -4.216 -5.246 1.00 11.21 H new ATOM 0 HB2 GLN A 451 6.546 -2.108 -5.398 1.00 45.42 H new ATOM 0 HB3 GLN A 451 6.461 -1.938 -3.656 1.00 45.42 H new ATOM 0 HG2 GLN A 451 7.647 -4.187 -3.459 1.00 53.13 H new ATOM 0 HG3 GLN A 451 7.862 -4.164 -5.198 1.00 53.13 H new ATOM 0 HE21 GLN A 451 9.911 -4.206 -3.092 1.00 74.34 H new ATOM 0 HE22 GLN A 451 10.908 -2.771 -3.347 1.00 74.34 H new ATOM 1134 N LEU A 452 4.718 -5.524 -3.129 1.00 21.34 N ATOM 1135 CA LEU A 452 4.525 -6.334 -1.901 1.00 24.24 C ATOM 1136 C LEU A 452 5.879 -6.785 -1.291 1.00 31.24 C ATOM 1137 O LEU A 452 6.577 -7.634 -1.837 1.00 34.31 O ATOM 1138 CB LEU A 452 3.596 -7.542 -2.187 1.00 21.54 C ATOM 1139 CG LEU A 452 2.097 -7.178 -2.453 1.00 53.14 C ATOM 1140 CD1 LEU A 452 1.276 -8.417 -2.831 1.00 33.12 C ATOM 1141 CD2 LEU A 452 1.472 -6.465 -1.232 1.00 1.40 C ATOM 0 H LEU A 452 4.638 -6.058 -3.994 1.00 21.34 H new ATOM 0 HA LEU A 452 4.040 -5.704 -1.156 1.00 24.24 H new ATOM 0 HB2 LEU A 452 3.982 -8.081 -3.052 1.00 21.54 H new ATOM 0 HB3 LEU A 452 3.643 -8.225 -1.339 1.00 21.54 H new ATOM 0 HG LEU A 452 2.076 -6.491 -3.299 1.00 53.14 H new ATOM 0 HD11 LEU A 452 0.240 -8.127 -3.009 1.00 33.12 H new ATOM 0 HD12 LEU A 452 1.688 -8.864 -3.736 1.00 33.12 H new ATOM 0 HD13 LEU A 452 1.316 -9.142 -2.018 1.00 33.12 H new ATOM 0 HD21 LEU A 452 0.431 -6.224 -1.445 1.00 1.40 H new ATOM 0 HD22 LEU A 452 1.522 -7.121 -0.363 1.00 1.40 H new ATOM 0 HD23 LEU A 452 2.022 -5.547 -1.026 1.00 1.40 H new ATOM 1153 N ILE A 453 6.221 -6.184 -0.144 1.00 0.23 N ATOM 1154 CA ILE A 453 7.467 -6.444 0.609 1.00 40.50 C ATOM 1155 C ILE A 453 7.122 -6.983 2.024 1.00 40.32 C ATOM 1156 O ILE A 453 6.013 -6.742 2.521 1.00 2.03 O ATOM 1157 CB ILE A 453 8.339 -5.130 0.722 1.00 15.25 C ATOM 1158 CG1 ILE A 453 7.517 -3.956 1.351 1.00 41.41 C ATOM 1159 CG2 ILE A 453 8.924 -4.738 -0.657 1.00 21.12 C ATOM 1160 CD1 ILE A 453 8.278 -2.645 1.501 1.00 23.30 C ATOM 0 H ILE A 453 5.627 -5.485 0.302 1.00 0.23 H new ATOM 0 HA ILE A 453 8.049 -7.193 0.072 1.00 40.50 H new ATOM 0 HB ILE A 453 9.174 -5.336 1.391 1.00 15.25 H new ATOM 0 HG12 ILE A 453 6.636 -3.779 0.735 1.00 41.41 H new ATOM 0 HG13 ILE A 453 7.162 -4.267 2.333 1.00 41.41 H new ATOM 0 HG21 ILE A 453 9.520 -3.831 -0.555 1.00 21.12 H new ATOM 0 HG22 ILE A 453 9.554 -5.546 -1.028 1.00 21.12 H new ATOM 0 HG23 ILE A 453 8.110 -4.560 -1.360 1.00 21.12 H new ATOM 0 HD11 ILE A 453 7.625 -1.894 1.945 1.00 23.30 H new ATOM 0 HD12 ILE A 453 9.144 -2.799 2.144 1.00 23.30 H new ATOM 0 HD13 ILE A 453 8.610 -2.303 0.521 1.00 23.30 H new ATOM 1172 N PRO A 454 8.052 -7.750 2.682 1.00 31.21 N ATOM 1173 CA PRO A 454 7.827 -8.273 4.053 1.00 33.32 C ATOM 1174 C PRO A 454 7.649 -7.131 5.093 1.00 22.14 C ATOM 1175 O PRO A 454 8.533 -6.277 5.262 1.00 51.35 O ATOM 1176 CB PRO A 454 9.090 -9.137 4.326 1.00 24.52 C ATOM 1177 CG PRO A 454 10.124 -8.609 3.384 1.00 51.54 C ATOM 1178 CD PRO A 454 9.372 -8.183 2.145 1.00 3.34 C ATOM 0 HA PRO A 454 6.906 -8.849 4.139 1.00 33.32 H new ATOM 0 HB2 PRO A 454 9.415 -9.046 5.362 1.00 24.52 H new ATOM 0 HB3 PRO A 454 8.893 -10.194 4.146 1.00 24.52 H new ATOM 0 HG2 PRO A 454 10.661 -7.769 3.824 1.00 51.54 H new ATOM 0 HG3 PRO A 454 10.865 -9.373 3.148 1.00 51.54 H new ATOM 0 HD2 PRO A 454 9.881 -7.372 1.624 1.00 3.34 H new ATOM 0 HD3 PRO A 454 9.269 -9.003 1.434 1.00 3.34 H new ATOM 1186 N GLN A 455 6.494 -7.150 5.787 1.00 11.43 N ATOM 1187 CA GLN A 455 6.090 -6.109 6.762 1.00 54.51 C ATOM 1188 C GLN A 455 7.074 -6.008 7.969 1.00 4.34 C ATOM 1189 O GLN A 455 7.136 -4.981 8.651 1.00 22.52 O ATOM 1190 CB GLN A 455 4.639 -6.409 7.240 1.00 4.42 C ATOM 1191 CG GLN A 455 4.024 -5.343 8.169 1.00 43.05 C ATOM 1192 CD GLN A 455 2.594 -5.661 8.623 1.00 32.04 C ATOM 1193 OE1 GLN A 455 2.195 -6.816 8.709 1.00 11.53 O ATOM 1194 NE2 GLN A 455 1.827 -4.638 8.958 1.00 62.33 N ATOM 0 H GLN A 455 5.805 -7.896 5.688 1.00 11.43 H new ATOM 0 HA GLN A 455 6.124 -5.138 6.268 1.00 54.51 H new ATOM 0 HB2 GLN A 455 4.000 -6.518 6.364 1.00 4.42 H new ATOM 0 HB3 GLN A 455 4.635 -7.367 7.759 1.00 4.42 H new ATOM 0 HG2 GLN A 455 4.658 -5.234 9.049 1.00 43.05 H new ATOM 0 HG3 GLN A 455 4.025 -4.382 7.654 1.00 43.05 H new ATOM 0 HE21 GLN A 455 2.183 -3.686 8.877 1.00 62.33 H new ATOM 0 HE22 GLN A 455 0.879 -4.801 9.297 1.00 62.33 H new ATOM 1203 N GLN A 456 7.862 -7.075 8.180 1.00 40.23 N ATOM 1204 CA GLN A 456 8.892 -7.153 9.245 1.00 61.34 C ATOM 1205 C GLN A 456 9.977 -6.058 9.075 1.00 70.10 C ATOM 1206 O GLN A 456 10.469 -5.503 10.058 1.00 52.21 O ATOM 1207 CB GLN A 456 9.576 -8.554 9.249 1.00 21.14 C ATOM 1208 CG GLN A 456 8.654 -9.765 9.553 1.00 15.23 C ATOM 1209 CD GLN A 456 7.643 -10.108 8.442 1.00 25.43 C ATOM 1210 OE1 GLN A 456 7.908 -9.914 7.263 1.00 34.34 O ATOM 1211 NE2 GLN A 456 6.471 -10.592 8.806 1.00 15.43 N ATOM 0 H GLN A 456 7.806 -7.921 7.613 1.00 40.23 H new ATOM 0 HA GLN A 456 8.381 -6.992 10.194 1.00 61.34 H new ATOM 0 HB2 GLN A 456 10.039 -8.712 8.275 1.00 21.14 H new ATOM 0 HB3 GLN A 456 10.379 -8.541 9.986 1.00 21.14 H new ATOM 0 HG2 GLN A 456 9.277 -10.640 9.739 1.00 15.23 H new ATOM 0 HG3 GLN A 456 8.106 -9.563 10.473 1.00 15.23 H new ATOM 0 HE21 GLN A 456 6.268 -10.747 9.793 1.00 15.43 H new ATOM 0 HE22 GLN A 456 5.768 -10.811 8.100 1.00 15.43 H new ATOM 1220 N LEU A 457 10.330 -5.762 7.811 1.00 54.42 N ATOM 1221 CA LEU A 457 11.379 -4.770 7.467 1.00 71.30 C ATOM 1222 C LEU A 457 10.878 -3.309 7.625 1.00 13.15 C ATOM 1223 O LEU A 457 11.681 -2.391 7.780 1.00 55.10 O ATOM 1224 CB LEU A 457 11.884 -5.020 6.019 1.00 53.22 C ATOM 1225 CG LEU A 457 12.419 -6.463 5.723 1.00 11.53 C ATOM 1226 CD1 LEU A 457 12.995 -6.566 4.294 1.00 12.34 C ATOM 1227 CD2 LEU A 457 13.444 -6.929 6.788 1.00 11.21 C ATOM 0 H LEU A 457 9.900 -6.200 6.996 1.00 54.42 H new ATOM 0 HA LEU A 457 12.204 -4.901 8.168 1.00 71.30 H new ATOM 0 HB2 LEU A 457 11.069 -4.806 5.328 1.00 53.22 H new ATOM 0 HB3 LEU A 457 12.679 -4.307 5.804 1.00 53.22 H new ATOM 0 HG LEU A 457 11.569 -7.142 5.784 1.00 11.53 H new ATOM 0 HD11 LEU A 457 13.358 -7.579 4.120 1.00 12.34 H new ATOM 0 HD12 LEU A 457 12.215 -6.330 3.570 1.00 12.34 H new ATOM 0 HD13 LEU A 457 13.819 -5.861 4.182 1.00 12.34 H new ATOM 0 HD21 LEU A 457 13.790 -7.934 6.545 1.00 11.21 H new ATOM 0 HD22 LEU A 457 14.293 -6.246 6.799 1.00 11.21 H new ATOM 0 HD23 LEU A 457 12.971 -6.935 7.770 1.00 11.21 H new ATOM 1239 N LEU A 458 9.542 -3.114 7.603 1.00 63.30 N ATOM 1240 CA LEU A 458 8.903 -1.777 7.787 1.00 1.15 C ATOM 1241 C LEU A 458 9.141 -1.166 9.188 1.00 34.51 C ATOM 1242 O LEU A 458 8.981 0.045 9.375 1.00 60.24 O ATOM 1243 CB LEU A 458 7.383 -1.869 7.543 1.00 1.44 C ATOM 1244 CG LEU A 458 6.936 -2.259 6.109 1.00 21.03 C ATOM 1245 CD1 LEU A 458 5.401 -2.210 6.005 1.00 23.44 C ATOM 1246 CD2 LEU A 458 7.609 -1.363 5.040 1.00 75.52 C ATOM 0 H LEU A 458 8.872 -3.870 7.459 1.00 63.30 H new ATOM 0 HA LEU A 458 9.376 -1.121 7.056 1.00 1.15 H new ATOM 0 HB2 LEU A 458 6.969 -2.598 8.240 1.00 1.44 H new ATOM 0 HB3 LEU A 458 6.939 -0.904 7.789 1.00 1.44 H new ATOM 0 HG LEU A 458 7.262 -3.280 5.912 1.00 21.03 H new ATOM 0 HD11 LEU A 458 5.096 -2.485 4.995 1.00 23.44 H new ATOM 0 HD12 LEU A 458 4.965 -2.909 6.719 1.00 23.44 H new ATOM 0 HD13 LEU A 458 5.053 -1.201 6.227 1.00 23.44 H new ATOM 0 HD21 LEU A 458 7.273 -1.665 4.048 1.00 75.52 H new ATOM 0 HD22 LEU A 458 7.337 -0.322 5.214 1.00 75.52 H new ATOM 0 HD23 LEU A 458 8.692 -1.471 5.104 1.00 75.52 H new ATOM 1258 N THR A 459 9.501 -2.015 10.163 1.00 64.34 N ATOM 1259 CA THR A 459 9.774 -1.588 11.558 1.00 45.32 C ATOM 1260 C THR A 459 10.999 -0.635 11.654 1.00 32.44 C ATOM 1261 O THR A 459 11.147 0.096 12.638 1.00 14.21 O ATOM 1262 CB THR A 459 10.003 -2.828 12.481 1.00 74.24 C ATOM 1263 OG1 THR A 459 11.178 -3.549 12.055 1.00 45.15 O ATOM 1264 CG2 THR A 459 8.782 -3.775 12.465 1.00 14.55 C ATOM 0 H THR A 459 9.613 -3.018 10.014 1.00 64.34 H new ATOM 0 HA THR A 459 8.895 -1.039 11.895 1.00 45.32 H new ATOM 0 HB THR A 459 10.142 -2.465 13.499 1.00 74.24 H new ATOM 0 HG1 THR A 459 10.933 -4.189 11.355 1.00 45.15 H new ATOM 0 HG21 THR A 459 8.974 -4.627 13.117 1.00 14.55 H new ATOM 0 HG22 THR A 459 7.901 -3.239 12.818 1.00 14.55 H new ATOM 0 HG23 THR A 459 8.609 -4.128 11.448 1.00 14.55 H new ATOM 1272 N THR A 460 11.860 -0.650 10.609 1.00 12.53 N ATOM 1273 CA THR A 460 13.022 0.270 10.487 1.00 74.35 C ATOM 1274 C THR A 460 12.588 1.682 10.015 1.00 51.45 C ATOM 1275 O THR A 460 13.284 2.669 10.266 1.00 71.34 O ATOM 1276 CB THR A 460 14.100 -0.286 9.491 1.00 34.54 C ATOM 1277 OG1 THR A 460 13.582 -0.301 8.146 1.00 53.35 O ATOM 1278 CG2 THR A 460 14.556 -1.709 9.877 1.00 34.11 C ATOM 0 H THR A 460 11.771 -1.298 9.827 1.00 12.53 H new ATOM 0 HA THR A 460 13.457 0.343 11.484 1.00 74.35 H new ATOM 0 HB THR A 460 14.962 0.378 9.547 1.00 34.54 H new ATOM 0 HG1 THR A 460 12.922 -1.020 8.058 1.00 53.35 H new ATOM 0 HG21 THR A 460 15.302 -2.058 9.163 1.00 34.11 H new ATOM 0 HG22 THR A 460 14.990 -1.693 10.877 1.00 34.11 H new ATOM 0 HG23 THR A 460 13.699 -2.382 9.864 1.00 34.11 H new ATOM 1286 N LEU A 461 11.424 1.761 9.342 1.00 14.13 N ATOM 1287 CA LEU A 461 10.886 3.026 8.776 1.00 34.43 C ATOM 1288 C LEU A 461 9.923 3.729 9.775 1.00 65.44 C ATOM 1289 O LEU A 461 8.963 4.385 9.356 1.00 62.01 O ATOM 1290 CB LEU A 461 10.147 2.727 7.436 1.00 51.35 C ATOM 1291 CG LEU A 461 10.912 1.846 6.387 1.00 3.21 C ATOM 1292 CD1 LEU A 461 10.094 1.698 5.082 1.00 62.22 C ATOM 1293 CD2 LEU A 461 12.333 2.385 6.104 1.00 35.01 C ATOM 0 H LEU A 461 10.825 0.953 9.172 1.00 14.13 H new ATOM 0 HA LEU A 461 11.721 3.701 8.589 1.00 34.43 H new ATOM 0 HB2 LEU A 461 9.204 2.233 7.671 1.00 51.35 H new ATOM 0 HB3 LEU A 461 9.900 3.678 6.965 1.00 51.35 H new ATOM 0 HG LEU A 461 11.030 0.854 6.823 1.00 3.21 H new ATOM 0 HD11 LEU A 461 10.648 1.083 4.373 1.00 62.22 H new ATOM 0 HD12 LEU A 461 9.138 1.224 5.304 1.00 62.22 H new ATOM 0 HD13 LEU A 461 9.919 2.683 4.649 1.00 62.22 H new ATOM 0 HD21 LEU A 461 12.826 1.745 5.372 1.00 35.01 H new ATOM 0 HD22 LEU A 461 12.266 3.400 5.711 1.00 35.01 H new ATOM 0 HD23 LEU A 461 12.911 2.391 7.028 1.00 35.01 H new ATOM 1305 N GLY A 462 10.228 3.620 11.087 1.00 62.23 N ATOM 1306 CA GLY A 462 9.419 4.218 12.170 1.00 3.23 C ATOM 1307 C GLY A 462 9.041 5.706 11.970 1.00 34.42 C ATOM 1308 O GLY A 462 7.851 6.033 12.008 1.00 14.21 O ATOM 0 H GLY A 462 11.046 3.113 11.425 1.00 62.23 H new ATOM 0 HA2 GLY A 462 8.502 3.639 12.278 1.00 3.23 H new ATOM 0 HA3 GLY A 462 9.969 4.123 13.106 1.00 3.23 H new ATOM 1312 N PRO A 463 10.033 6.640 11.739 1.00 65.13 N ATOM 1313 CA PRO A 463 9.742 8.078 11.436 1.00 30.13 C ATOM 1314 C PRO A 463 8.916 8.295 10.138 1.00 71.01 C ATOM 1315 O PRO A 463 8.135 9.247 10.045 1.00 22.22 O ATOM 1316 CB PRO A 463 11.156 8.723 11.325 1.00 34.44 C ATOM 1317 CG PRO A 463 12.076 7.572 11.040 1.00 41.51 C ATOM 1318 CD PRO A 463 11.500 6.400 11.804 1.00 5.50 C ATOM 0 HA PRO A 463 9.116 8.524 12.209 1.00 30.13 H new ATOM 0 HB2 PRO A 463 11.191 9.466 10.528 1.00 34.44 H new ATOM 0 HB3 PRO A 463 11.433 9.233 12.248 1.00 34.44 H new ATOM 0 HG2 PRO A 463 12.122 7.361 9.972 1.00 41.51 H new ATOM 0 HG3 PRO A 463 13.093 7.792 11.365 1.00 41.51 H new ATOM 0 HD2 PRO A 463 11.773 5.449 11.348 1.00 5.50 H new ATOM 0 HD3 PRO A 463 11.859 6.375 12.833 1.00 5.50 H new ATOM 1326 N LEU A 464 9.084 7.395 9.152 1.00 62.14 N ATOM 1327 CA LEU A 464 8.364 7.466 7.858 1.00 43.20 C ATOM 1328 C LEU A 464 6.848 7.149 8.013 1.00 65.32 C ATOM 1329 O LEU A 464 6.008 7.725 7.309 1.00 1.34 O ATOM 1330 CB LEU A 464 9.036 6.524 6.830 1.00 12.34 C ATOM 1331 CG LEU A 464 10.523 6.866 6.475 1.00 2.44 C ATOM 1332 CD1 LEU A 464 11.115 5.847 5.484 1.00 61.20 C ATOM 1333 CD2 LEU A 464 10.659 8.307 5.933 1.00 55.51 C ATOM 0 H LEU A 464 9.719 6.600 9.225 1.00 62.14 H new ATOM 0 HA LEU A 464 8.428 8.490 7.491 1.00 43.20 H new ATOM 0 HB2 LEU A 464 8.998 5.506 7.217 1.00 12.34 H new ATOM 0 HB3 LEU A 464 8.449 6.538 5.912 1.00 12.34 H new ATOM 0 HG LEU A 464 11.097 6.803 7.399 1.00 2.44 H new ATOM 0 HD11 LEU A 464 12.148 6.115 5.260 1.00 61.20 H new ATOM 0 HD12 LEU A 464 11.086 4.851 5.926 1.00 61.20 H new ATOM 0 HD13 LEU A 464 10.531 5.853 4.564 1.00 61.20 H new ATOM 0 HD21 LEU A 464 11.704 8.510 5.697 1.00 55.51 H new ATOM 0 HD22 LEU A 464 10.056 8.415 5.032 1.00 55.51 H new ATOM 0 HD23 LEU A 464 10.314 9.014 6.688 1.00 55.51 H new ATOM 1345 N PHE A 465 6.508 6.237 8.949 1.00 15.14 N ATOM 1346 CA PHE A 465 5.097 5.936 9.310 1.00 22.05 C ATOM 1347 C PHE A 465 4.556 6.913 10.377 1.00 73.23 C ATOM 1348 O PHE A 465 3.344 7.107 10.484 1.00 2.41 O ATOM 1349 CB PHE A 465 4.956 4.479 9.813 1.00 24.01 C ATOM 1350 CG PHE A 465 5.238 3.437 8.739 1.00 25.22 C ATOM 1351 CD1 PHE A 465 4.330 3.235 7.704 1.00 0.51 C ATOM 1352 CD2 PHE A 465 6.399 2.669 8.753 1.00 42.20 C ATOM 1353 CE1 PHE A 465 4.572 2.302 6.726 1.00 10.05 C ATOM 1354 CE2 PHE A 465 6.636 1.736 7.767 1.00 23.13 C ATOM 1355 CZ PHE A 465 5.722 1.552 6.756 1.00 62.34 C ATOM 0 H PHE A 465 7.192 5.692 9.473 1.00 15.14 H new ATOM 0 HA PHE A 465 4.503 6.061 8.405 1.00 22.05 H new ATOM 0 HB2 PHE A 465 5.639 4.323 10.648 1.00 24.01 H new ATOM 0 HB3 PHE A 465 3.946 4.331 10.196 1.00 24.01 H new ATOM 0 HD1 PHE A 465 3.423 3.820 7.669 1.00 0.51 H new ATOM 0 HD2 PHE A 465 7.121 2.806 9.544 1.00 42.20 H new ATOM 0 HE1 PHE A 465 3.856 2.158 5.931 1.00 10.05 H new ATOM 0 HE2 PHE A 465 7.542 1.148 7.788 1.00 23.13 H new ATOM 0 HZ PHE A 465 5.909 0.818 5.986 1.00 62.34 H new ATOM 1365 N ARG A 466 5.453 7.513 11.169 1.00 11.42 N ATOM 1366 CA ARG A 466 5.077 8.508 12.198 1.00 24.13 C ATOM 1367 C ARG A 466 4.632 9.836 11.530 1.00 4.20 C ATOM 1368 O ARG A 466 3.686 10.489 11.984 1.00 23.32 O ATOM 1369 CB ARG A 466 6.273 8.709 13.182 1.00 31.12 C ATOM 1370 CG ARG A 466 5.989 9.563 14.454 1.00 43.51 C ATOM 1371 CD ARG A 466 6.128 11.084 14.233 1.00 0.22 C ATOM 1372 NE ARG A 466 5.707 11.860 15.409 1.00 4.00 N ATOM 1373 CZ ARG A 466 5.884 13.151 15.564 1.00 55.23 C ATOM 1374 NH1 ARG A 466 6.525 13.859 14.679 1.00 55.31 N ATOM 1375 NH2 ARG A 466 5.420 13.733 16.615 1.00 74.24 N ATOM 0 H ARG A 466 6.455 7.329 11.121 1.00 11.42 H new ATOM 0 HA ARG A 466 4.225 8.145 12.774 1.00 24.13 H new ATOM 0 HB2 ARG A 466 6.621 7.727 13.501 1.00 31.12 H new ATOM 0 HB3 ARG A 466 7.092 9.175 12.634 1.00 31.12 H new ATOM 0 HG2 ARG A 466 4.980 9.348 14.805 1.00 43.51 H new ATOM 0 HG3 ARG A 466 6.674 9.257 15.245 1.00 43.51 H new ATOM 0 HD2 ARG A 466 7.165 11.321 13.996 1.00 0.22 H new ATOM 0 HD3 ARG A 466 5.529 11.380 13.372 1.00 0.22 H new ATOM 0 HE ARG A 466 5.241 11.355 16.163 1.00 4.00 H new ATOM 0 HH11 ARG A 466 6.902 13.411 13.844 1.00 55.31 H new ATOM 0 HH12 ARG A 466 6.650 14.861 14.821 1.00 55.31 H new ATOM 0 HH21 ARG A 466 4.919 13.191 17.319 1.00 74.24 H new ATOM 0 HH22 ARG A 466 5.553 14.736 16.743 1.00 74.24 H new ATOM 1389 N ASN A 467 5.316 10.213 10.438 1.00 33.00 N ATOM 1390 CA ASN A 467 5.020 11.452 9.676 1.00 61.12 C ATOM 1391 C ASN A 467 4.035 11.192 8.504 1.00 33.13 C ATOM 1392 O ASN A 467 3.965 11.982 7.563 1.00 12.33 O ATOM 1393 CB ASN A 467 6.349 12.058 9.152 1.00 20.13 C ATOM 1394 CG ASN A 467 7.335 12.422 10.269 1.00 2.31 C ATOM 1395 OD1 ASN A 467 6.943 12.795 11.375 1.00 14.20 O ATOM 1396 ND2 ASN A 467 8.619 12.312 9.992 1.00 64.34 N ATOM 0 H ASN A 467 6.091 9.673 10.053 1.00 33.00 H new ATOM 0 HA ASN A 467 4.532 12.160 10.346 1.00 61.12 H new ATOM 0 HB2 ASN A 467 6.823 11.346 8.477 1.00 20.13 H new ATOM 0 HB3 ASN A 467 6.127 12.951 8.568 1.00 20.13 H new ATOM 0 HD21 ASN A 467 9.315 12.538 10.702 1.00 64.34 H new ATOM 0 HD22 ASN A 467 8.916 12.001 9.067 1.00 64.34 H new ATOM 1403 N SER A 468 3.253 10.098 8.578 1.00 42.24 N ATOM 1404 CA SER A 468 2.265 9.740 7.528 1.00 24.01 C ATOM 1405 C SER A 468 0.816 9.999 7.991 1.00 32.04 C ATOM 1406 O SER A 468 0.502 9.842 9.178 1.00 12.02 O ATOM 1407 CB SER A 468 2.422 8.256 7.115 1.00 70.31 C ATOM 1408 OG SER A 468 2.022 7.374 8.146 1.00 4.33 O ATOM 0 H SER A 468 3.283 9.440 9.357 1.00 42.24 H new ATOM 0 HA SER A 468 2.466 10.379 6.668 1.00 24.01 H new ATOM 0 HB2 SER A 468 1.827 8.063 6.222 1.00 70.31 H new ATOM 0 HB3 SER A 468 3.462 8.060 6.854 1.00 70.31 H new ATOM 0 HG SER A 468 2.579 7.523 8.938 1.00 4.33 H new ATOM 1414 N ARG A 469 -0.063 10.412 7.051 1.00 4.44 N ATOM 1415 CA ARG A 469 -1.518 10.543 7.313 1.00 60.33 C ATOM 1416 C ARG A 469 -2.235 9.203 7.008 1.00 2.33 C ATOM 1417 O ARG A 469 -1.840 8.476 6.091 1.00 0.45 O ATOM 1418 CB ARG A 469 -2.140 11.707 6.481 1.00 52.04 C ATOM 1419 CG ARG A 469 -2.162 11.496 4.949 1.00 53.03 C ATOM 1420 CD ARG A 469 -2.982 12.575 4.205 1.00 30.24 C ATOM 1421 NE ARG A 469 -2.379 13.923 4.283 1.00 74.41 N ATOM 1422 CZ ARG A 469 -2.901 14.979 4.888 1.00 35.33 C ATOM 1423 NH1 ARG A 469 -3.997 14.898 5.587 1.00 55.33 N ATOM 1424 NH2 ARG A 469 -2.290 16.117 4.803 1.00 11.42 N ATOM 0 H ARG A 469 0.209 10.662 6.100 1.00 4.44 H new ATOM 0 HA ARG A 469 -1.656 10.783 8.367 1.00 60.33 H new ATOM 0 HB2 ARG A 469 -3.163 11.868 6.822 1.00 52.04 H new ATOM 0 HB3 ARG A 469 -1.585 12.620 6.696 1.00 52.04 H new ATOM 0 HG2 ARG A 469 -1.139 11.500 4.572 1.00 53.03 H new ATOM 0 HG3 ARG A 469 -2.579 10.513 4.729 1.00 53.03 H new ATOM 0 HD2 ARG A 469 -3.081 12.289 3.158 1.00 30.24 H new ATOM 0 HD3 ARG A 469 -3.988 12.610 4.623 1.00 30.24 H new ATOM 0 HE ARG A 469 -1.475 14.052 3.828 1.00 74.41 H new ATOM 0 HH11 ARG A 469 -4.478 14.003 5.680 1.00 55.33 H new ATOM 0 HH12 ARG A 469 -4.375 15.729 6.041 1.00 55.33 H new ATOM 0 HH21 ARG A 469 -1.420 16.191 4.276 1.00 11.42 H new ATOM 0 HH22 ARG A 469 -2.679 16.940 5.263 1.00 11.42 H new ATOM 1438 N MET A 470 -3.292 8.882 7.771 1.00 13.21 N ATOM 1439 CA MET A 470 -3.955 7.559 7.703 1.00 24.11 C ATOM 1440 C MET A 470 -5.332 7.653 6.998 1.00 33.22 C ATOM 1441 O MET A 470 -6.259 8.299 7.497 1.00 22.12 O ATOM 1442 CB MET A 470 -4.106 6.987 9.138 1.00 3.35 C ATOM 1443 CG MET A 470 -4.426 5.488 9.199 1.00 12.10 C ATOM 1444 SD MET A 470 -4.584 4.891 10.898 1.00 41.42 S ATOM 1445 CE MET A 470 -4.638 3.116 10.653 1.00 42.21 C ATOM 0 H MET A 470 -3.711 9.520 8.447 1.00 13.21 H new ATOM 0 HA MET A 470 -3.336 6.886 7.110 1.00 24.11 H new ATOM 0 HB2 MET A 470 -3.182 7.170 9.687 1.00 3.35 H new ATOM 0 HB3 MET A 470 -4.896 7.535 9.652 1.00 3.35 H new ATOM 0 HG2 MET A 470 -5.353 5.294 8.660 1.00 12.10 H new ATOM 0 HG3 MET A 470 -3.640 4.930 8.691 1.00 12.10 H new ATOM 0 HE1 MET A 470 -4.734 2.618 11.618 1.00 42.21 H new ATOM 0 HE2 MET A 470 -5.493 2.861 10.026 1.00 42.21 H new ATOM 0 HE3 MET A 470 -3.720 2.788 10.166 1.00 42.21 H new ATOM 1455 N VAL A 471 -5.441 6.999 5.830 1.00 64.20 N ATOM 1456 CA VAL A 471 -6.695 6.896 5.041 1.00 2.53 C ATOM 1457 C VAL A 471 -7.139 5.416 4.942 1.00 12.02 C ATOM 1458 O VAL A 471 -6.461 4.517 5.462 1.00 34.43 O ATOM 1459 CB VAL A 471 -6.523 7.510 3.590 1.00 63.35 C ATOM 1460 CG1 VAL A 471 -5.943 8.944 3.656 1.00 0.34 C ATOM 1461 CG2 VAL A 471 -5.664 6.603 2.669 1.00 11.15 C ATOM 0 H VAL A 471 -4.654 6.518 5.395 1.00 64.20 H new ATOM 0 HA VAL A 471 -7.463 7.471 5.558 1.00 2.53 H new ATOM 0 HB VAL A 471 -7.518 7.565 3.147 1.00 63.35 H new ATOM 0 HG11 VAL A 471 -5.836 9.340 2.646 1.00 0.34 H new ATOM 0 HG12 VAL A 471 -6.617 9.583 4.227 1.00 0.34 H new ATOM 0 HG13 VAL A 471 -4.967 8.920 4.142 1.00 0.34 H new ATOM 0 HG21 VAL A 471 -5.574 7.064 1.686 1.00 11.15 H new ATOM 0 HG22 VAL A 471 -4.672 6.478 3.104 1.00 11.15 H new ATOM 0 HG23 VAL A 471 -6.142 5.628 2.570 1.00 11.15 H new ATOM 1471 N GLN A 472 -8.289 5.167 4.294 1.00 50.22 N ATOM 1472 CA GLN A 472 -8.779 3.795 4.022 1.00 14.31 C ATOM 1473 C GLN A 472 -8.877 3.520 2.507 1.00 71.32 C ATOM 1474 O GLN A 472 -9.169 4.412 1.714 1.00 24.40 O ATOM 1475 CB GLN A 472 -10.156 3.558 4.695 1.00 2.44 C ATOM 1476 CG GLN A 472 -10.123 3.571 6.235 1.00 61.12 C ATOM 1477 CD GLN A 472 -11.464 3.184 6.857 1.00 54.12 C ATOM 1478 OE1 GLN A 472 -12.304 4.023 7.127 1.00 72.12 O ATOM 1479 NE2 GLN A 472 -11.678 1.900 7.070 1.00 43.43 N ATOM 0 H GLN A 472 -8.905 5.901 3.944 1.00 50.22 H new ATOM 0 HA GLN A 472 -8.054 3.101 4.447 1.00 14.31 H new ATOM 0 HB2 GLN A 472 -10.851 4.325 4.352 1.00 2.44 H new ATOM 0 HB3 GLN A 472 -10.550 2.598 4.360 1.00 2.44 H new ATOM 0 HG2 GLN A 472 -9.353 2.882 6.584 1.00 61.12 H new ATOM 0 HG3 GLN A 472 -9.841 4.566 6.580 1.00 61.12 H new ATOM 0 HE21 GLN A 472 -10.958 1.217 6.835 1.00 43.43 H new ATOM 0 HE22 GLN A 472 -12.564 1.590 7.470 1.00 43.43 H new ATOM 1488 N PHE A 473 -8.618 2.262 2.138 1.00 40.01 N ATOM 1489 CA PHE A 473 -8.769 1.737 0.767 1.00 64.41 C ATOM 1490 C PHE A 473 -9.848 0.633 0.743 1.00 1.10 C ATOM 1491 O PHE A 473 -9.660 -0.448 1.315 1.00 11.02 O ATOM 1492 CB PHE A 473 -7.425 1.166 0.221 1.00 10.54 C ATOM 1493 CG PHE A 473 -6.421 2.210 -0.269 1.00 51.10 C ATOM 1494 CD1 PHE A 473 -5.765 3.056 0.621 1.00 12.20 C ATOM 1495 CD2 PHE A 473 -6.126 2.331 -1.632 1.00 21.14 C ATOM 1496 CE1 PHE A 473 -4.851 3.988 0.170 1.00 13.01 C ATOM 1497 CE2 PHE A 473 -5.210 3.260 -2.081 1.00 44.43 C ATOM 1498 CZ PHE A 473 -4.575 4.090 -1.178 1.00 63.41 C ATOM 0 H PHE A 473 -8.288 1.558 2.798 1.00 40.01 H new ATOM 0 HA PHE A 473 -9.072 2.564 0.125 1.00 64.41 H new ATOM 0 HB2 PHE A 473 -6.955 0.575 1.007 1.00 10.54 H new ATOM 0 HB3 PHE A 473 -7.646 0.485 -0.601 1.00 10.54 H new ATOM 0 HD1 PHE A 473 -5.974 2.983 1.678 1.00 12.20 H new ATOM 0 HD2 PHE A 473 -6.623 1.687 -2.343 1.00 21.14 H new ATOM 0 HE1 PHE A 473 -4.352 4.638 0.873 1.00 13.01 H new ATOM 0 HE2 PHE A 473 -4.990 3.338 -3.136 1.00 44.43 H new ATOM 0 HZ PHE A 473 -3.861 4.821 -1.528 1.00 63.41 H new ATOM 1508 N HIS A 474 -10.984 0.939 0.110 1.00 23.11 N ATOM 1509 CA HIS A 474 -12.004 -0.061 -0.255 1.00 54.25 C ATOM 1510 C HIS A 474 -11.744 -0.550 -1.699 1.00 1.20 C ATOM 1511 O HIS A 474 -11.222 0.193 -2.524 1.00 12.30 O ATOM 1512 CB HIS A 474 -13.429 0.548 -0.128 1.00 10.33 C ATOM 1513 CG HIS A 474 -14.527 -0.390 -0.559 1.00 55.04 C ATOM 1514 ND1 HIS A 474 -14.867 -1.479 0.200 1.00 74.12 N ATOM 1515 CD2 HIS A 474 -15.261 -0.407 -1.703 1.00 73.14 C ATOM 1516 CE1 HIS A 474 -15.781 -2.130 -0.488 1.00 44.44 C ATOM 1517 NE2 HIS A 474 -16.051 -1.523 -1.652 1.00 4.51 N ATOM 0 H HIS A 474 -11.228 1.890 -0.167 1.00 23.11 H new ATOM 0 HA HIS A 474 -11.940 -0.910 0.426 1.00 54.25 H new ATOM 0 HB2 HIS A 474 -13.599 0.841 0.908 1.00 10.33 H new ATOM 0 HB3 HIS A 474 -13.482 1.456 -0.729 1.00 10.33 H new ATOM 0 HD2 HIS A 474 -15.227 0.321 -2.500 1.00 73.14 H new ATOM 0 HE1 HIS A 474 -16.255 -3.042 -0.155 1.00 44.44 H new ATOM 0 HE2 HIS A 474 -16.716 -1.832 -2.361 1.00 4.51 H new ATOM 1525 N PHE A 475 -12.102 -1.804 -1.998 1.00 63.44 N ATOM 1526 CA PHE A 475 -12.022 -2.357 -3.365 1.00 42.52 C ATOM 1527 C PHE A 475 -13.441 -2.609 -3.904 1.00 52.11 C ATOM 1528 O PHE A 475 -14.188 -3.421 -3.343 1.00 13.23 O ATOM 1529 CB PHE A 475 -11.151 -3.632 -3.381 1.00 5.41 C ATOM 1530 CG PHE A 475 -9.680 -3.336 -3.062 1.00 61.34 C ATOM 1531 CD1 PHE A 475 -8.828 -2.839 -4.048 1.00 42.04 C ATOM 1532 CD2 PHE A 475 -9.157 -3.525 -1.784 1.00 22.25 C ATOM 1533 CE1 PHE A 475 -7.510 -2.546 -3.767 1.00 45.41 C ATOM 1534 CE2 PHE A 475 -7.837 -3.231 -1.510 1.00 2.53 C ATOM 1535 CZ PHE A 475 -7.014 -2.744 -2.500 1.00 64.34 C ATOM 0 H PHE A 475 -12.454 -2.466 -1.306 1.00 63.44 H new ATOM 0 HA PHE A 475 -11.539 -1.637 -4.026 1.00 42.52 H new ATOM 0 HB2 PHE A 475 -11.541 -4.345 -2.655 1.00 5.41 H new ATOM 0 HB3 PHE A 475 -11.220 -4.104 -4.361 1.00 5.41 H new ATOM 0 HD1 PHE A 475 -9.206 -2.681 -5.047 1.00 42.04 H new ATOM 0 HD2 PHE A 475 -9.793 -3.906 -0.999 1.00 22.25 H new ATOM 0 HE1 PHE A 475 -6.866 -2.160 -4.544 1.00 45.41 H new ATOM 0 HE2 PHE A 475 -7.448 -3.384 -0.514 1.00 2.53 H new ATOM 0 HZ PHE A 475 -5.981 -2.518 -2.282 1.00 64.34 H new ATOM 1545 N THR A 476 -13.804 -1.865 -4.973 1.00 52.13 N ATOM 1546 CA THR A 476 -15.162 -1.870 -5.567 1.00 32.20 C ATOM 1547 C THR A 476 -15.573 -3.293 -6.001 1.00 54.41 C ATOM 1548 O THR A 476 -14.774 -3.979 -6.655 1.00 11.14 O ATOM 1549 CB THR A 476 -15.245 -0.916 -6.811 1.00 34.13 C ATOM 1550 OG1 THR A 476 -14.539 0.302 -6.544 1.00 13.42 O ATOM 1551 CG2 THR A 476 -16.703 -0.575 -7.178 1.00 73.41 C ATOM 0 H THR A 476 -13.158 -1.238 -5.453 1.00 52.13 H new ATOM 0 HA THR A 476 -15.846 -1.514 -4.796 1.00 32.20 H new ATOM 0 HB THR A 476 -14.791 -1.442 -7.651 1.00 34.13 H new ATOM 0 HG1 THR A 476 -14.595 0.890 -7.326 1.00 13.42 H new ATOM 0 HG21 THR A 476 -16.715 0.087 -8.044 1.00 73.41 H new ATOM 0 HG22 THR A 476 -17.243 -1.492 -7.415 1.00 73.41 H new ATOM 0 HG23 THR A 476 -17.184 -0.079 -6.335 1.00 73.41 H new ATOM 1559 N ASN A 477 -16.812 -3.697 -5.632 1.00 74.04 N ATOM 1560 CA ASN A 477 -17.339 -5.065 -5.815 1.00 23.45 C ATOM 1561 C ASN A 477 -16.619 -6.061 -4.859 1.00 54.54 C ATOM 1562 O ASN A 477 -15.579 -6.643 -5.204 1.00 41.03 O ATOM 1563 CB ASN A 477 -17.263 -5.526 -7.304 1.00 40.02 C ATOM 1564 CG ASN A 477 -17.857 -6.910 -7.561 1.00 74.44 C ATOM 1565 OD1 ASN A 477 -18.865 -7.288 -6.979 1.00 51.24 O ATOM 1566 ND2 ASN A 477 -17.215 -7.685 -8.410 1.00 5.12 N ATOM 0 H ASN A 477 -17.483 -3.068 -5.191 1.00 74.04 H new ATOM 0 HA ASN A 477 -18.397 -5.054 -5.551 1.00 23.45 H new ATOM 0 HB2 ASN A 477 -17.784 -4.798 -7.925 1.00 40.02 H new ATOM 0 HB3 ASN A 477 -16.220 -5.526 -7.620 1.00 40.02 H new ATOM 0 HD21 ASN A 477 -17.555 -8.628 -8.597 1.00 5.12 H new ATOM 0 HD22 ASN A 477 -16.377 -7.342 -8.880 1.00 5.12 H new ATOM 1573 N LYS A 478 -17.171 -6.213 -3.638 1.00 41.14 N ATOM 1574 CA LYS A 478 -16.670 -7.169 -2.615 1.00 0.11 C ATOM 1575 C LYS A 478 -16.987 -8.639 -3.027 1.00 21.12 C ATOM 1576 O LYS A 478 -17.892 -9.296 -2.487 1.00 73.14 O ATOM 1577 CB LYS A 478 -17.247 -6.802 -1.213 1.00 62.52 C ATOM 1578 CG LYS A 478 -18.785 -6.646 -1.156 1.00 55.04 C ATOM 1579 CD LYS A 478 -19.290 -6.355 0.272 1.00 13.41 C ATOM 1580 CE LYS A 478 -20.815 -6.144 0.336 1.00 64.33 C ATOM 1581 NZ LYS A 478 -21.583 -7.313 -0.183 1.00 44.52 N ATOM 0 H LYS A 478 -17.981 -5.676 -3.327 1.00 41.14 H new ATOM 0 HA LYS A 478 -15.585 -7.092 -2.551 1.00 0.11 H new ATOM 0 HB2 LYS A 478 -16.949 -7.572 -0.502 1.00 62.52 H new ATOM 0 HB3 LYS A 478 -16.790 -5.869 -0.882 1.00 62.52 H new ATOM 0 HG2 LYS A 478 -19.091 -5.837 -1.819 1.00 55.04 H new ATOM 0 HG3 LYS A 478 -19.255 -7.557 -1.527 1.00 55.04 H new ATOM 0 HD2 LYS A 478 -19.015 -7.183 0.925 1.00 13.41 H new ATOM 0 HD3 LYS A 478 -18.789 -5.466 0.655 1.00 13.41 H new ATOM 0 HE2 LYS A 478 -21.108 -5.952 1.368 1.00 64.33 H new ATOM 0 HE3 LYS A 478 -21.079 -5.257 -0.240 1.00 64.33 H new ATOM 0 HZ1 LYS A 478 -22.600 -7.152 -0.038 1.00 44.52 H new ATOM 0 HZ2 LYS A 478 -21.392 -7.431 -1.199 1.00 44.52 H new ATOM 0 HZ3 LYS A 478 -21.293 -8.172 0.326 1.00 44.52 H new ATOM 1595 N ASP A 479 -16.217 -9.148 -4.008 1.00 40.11 N ATOM 1596 CA ASP A 479 -16.542 -10.416 -4.707 1.00 65.13 C ATOM 1597 C ASP A 479 -15.298 -11.031 -5.391 1.00 61.21 C ATOM 1598 O ASP A 479 -15.196 -12.251 -5.535 1.00 4.22 O ATOM 1599 CB ASP A 479 -17.637 -10.127 -5.777 1.00 23.41 C ATOM 1600 CG ASP A 479 -18.470 -11.359 -6.144 1.00 21.42 C ATOM 1601 OD1 ASP A 479 -18.035 -12.162 -6.992 1.00 51.41 O ATOM 1602 OD2 ASP A 479 -19.567 -11.538 -5.566 1.00 14.10 O ATOM 0 H ASP A 479 -15.361 -8.702 -4.339 1.00 40.11 H new ATOM 0 HA ASP A 479 -16.901 -11.135 -3.971 1.00 65.13 H new ATOM 0 HB2 ASP A 479 -18.301 -9.347 -5.405 1.00 23.41 H new ATOM 0 HB3 ASP A 479 -17.161 -9.738 -6.677 1.00 23.41 H new ATOM 1607 N LEU A 480 -14.380 -10.157 -5.822 1.00 72.35 N ATOM 1608 CA LEU A 480 -13.238 -10.508 -6.695 1.00 13.44 C ATOM 1609 C LEU A 480 -12.242 -11.519 -6.059 1.00 35.04 C ATOM 1610 O LEU A 480 -11.978 -11.475 -4.860 1.00 42.30 O ATOM 1611 CB LEU A 480 -12.531 -9.193 -7.096 1.00 60.11 C ATOM 1612 CG LEU A 480 -13.414 -8.211 -7.968 1.00 20.24 C ATOM 1613 CD1 LEU A 480 -13.245 -6.740 -7.538 1.00 54.24 C ATOM 1614 CD2 LEU A 480 -13.126 -8.388 -9.480 1.00 44.22 C ATOM 0 H LEU A 480 -14.405 -9.168 -5.573 1.00 72.35 H new ATOM 0 HA LEU A 480 -13.625 -11.027 -7.572 1.00 13.44 H new ATOM 0 HB2 LEU A 480 -12.219 -8.673 -6.190 1.00 60.11 H new ATOM 0 HB3 LEU A 480 -11.626 -9.437 -7.652 1.00 60.11 H new ATOM 0 HG LEU A 480 -14.456 -8.479 -7.790 1.00 20.24 H new ATOM 0 HD11 LEU A 480 -13.870 -6.104 -8.165 1.00 54.24 H new ATOM 0 HD12 LEU A 480 -13.544 -6.629 -6.496 1.00 54.24 H new ATOM 0 HD13 LEU A 480 -12.201 -6.446 -7.649 1.00 54.24 H new ATOM 0 HD21 LEU A 480 -13.748 -7.700 -10.052 1.00 44.22 H new ATOM 0 HD22 LEU A 480 -12.075 -8.177 -9.677 1.00 44.22 H new ATOM 0 HD23 LEU A 480 -13.352 -9.412 -9.776 1.00 44.22 H new ATOM 1626 N GLU A 481 -11.697 -12.417 -6.901 1.00 2.50 N ATOM 1627 CA GLU A 481 -10.748 -13.485 -6.483 1.00 2.11 C ATOM 1628 C GLU A 481 -9.346 -12.922 -6.144 1.00 10.51 C ATOM 1629 O GLU A 481 -8.675 -13.431 -5.246 1.00 61.41 O ATOM 1630 CB GLU A 481 -10.629 -14.550 -7.603 1.00 54.11 C ATOM 1631 CG GLU A 481 -11.962 -15.228 -7.980 1.00 42.32 C ATOM 1632 CD GLU A 481 -11.823 -16.213 -9.152 1.00 30.33 C ATOM 1633 OE1 GLU A 481 -11.816 -15.764 -10.321 1.00 53.13 O ATOM 1634 OE2 GLU A 481 -11.702 -17.437 -8.917 1.00 1.11 O ATOM 0 H GLU A 481 -11.900 -12.428 -7.901 1.00 2.50 H new ATOM 0 HA GLU A 481 -11.146 -13.940 -5.576 1.00 2.11 H new ATOM 0 HB2 GLU A 481 -10.210 -14.079 -8.492 1.00 54.11 H new ATOM 0 HB3 GLU A 481 -9.922 -15.317 -7.285 1.00 54.11 H new ATOM 0 HG2 GLU A 481 -12.352 -15.758 -7.111 1.00 42.32 H new ATOM 0 HG3 GLU A 481 -12.692 -14.462 -8.241 1.00 42.32 H new ATOM 1641 N SER A 482 -8.908 -11.886 -6.889 1.00 61.23 N ATOM 1642 CA SER A 482 -7.649 -11.140 -6.590 1.00 22.40 C ATOM 1643 C SER A 482 -7.756 -10.371 -5.251 1.00 24.11 C ATOM 1644 O SER A 482 -6.753 -10.153 -4.568 1.00 15.43 O ATOM 1645 CB SER A 482 -7.307 -10.169 -7.750 1.00 2.14 C ATOM 1646 OG SER A 482 -8.446 -9.440 -8.172 1.00 61.11 O ATOM 0 H SER A 482 -9.405 -11.539 -7.709 1.00 61.23 H new ATOM 0 HA SER A 482 -6.843 -11.867 -6.493 1.00 22.40 H new ATOM 0 HB2 SER A 482 -6.529 -9.476 -7.428 1.00 2.14 H new ATOM 0 HB3 SER A 482 -6.903 -10.733 -8.591 1.00 2.14 H new ATOM 0 HG SER A 482 -8.160 -8.645 -8.668 1.00 61.11 H new ATOM 1652 N LEU A 483 -8.988 -9.960 -4.909 1.00 53.02 N ATOM 1653 CA LEU A 483 -9.323 -9.359 -3.600 1.00 70.11 C ATOM 1654 C LEU A 483 -9.224 -10.405 -2.468 1.00 73.23 C ATOM 1655 O LEU A 483 -8.560 -10.167 -1.457 1.00 32.51 O ATOM 1656 CB LEU A 483 -10.746 -8.741 -3.670 1.00 10.45 C ATOM 1657 CG LEU A 483 -11.325 -8.152 -2.352 1.00 33.54 C ATOM 1658 CD1 LEU A 483 -10.467 -6.983 -1.820 1.00 24.24 C ATOM 1659 CD2 LEU A 483 -12.804 -7.745 -2.534 1.00 63.35 C ATOM 0 H LEU A 483 -9.789 -10.035 -5.536 1.00 53.02 H new ATOM 0 HA LEU A 483 -8.604 -8.571 -3.373 1.00 70.11 H new ATOM 0 HB2 LEU A 483 -10.735 -7.949 -4.419 1.00 10.45 H new ATOM 0 HB3 LEU A 483 -11.432 -9.509 -4.028 1.00 10.45 H new ATOM 0 HG LEU A 483 -11.289 -8.935 -1.595 1.00 33.54 H new ATOM 0 HD11 LEU A 483 -10.905 -6.600 -0.899 1.00 24.24 H new ATOM 0 HD12 LEU A 483 -9.455 -7.336 -1.621 1.00 24.24 H new ATOM 0 HD13 LEU A 483 -10.434 -6.187 -2.564 1.00 24.24 H new ATOM 0 HD21 LEU A 483 -13.187 -7.336 -1.599 1.00 63.35 H new ATOM 0 HD22 LEU A 483 -12.880 -6.991 -3.318 1.00 63.35 H new ATOM 0 HD23 LEU A 483 -13.390 -8.620 -2.814 1.00 63.35 H new ATOM 1671 N LYS A 484 -9.882 -11.566 -2.675 1.00 53.10 N ATOM 1672 CA LYS A 484 -9.837 -12.723 -1.737 1.00 11.24 C ATOM 1673 C LYS A 484 -8.387 -13.194 -1.492 1.00 3.14 C ATOM 1674 O LYS A 484 -8.025 -13.559 -0.369 1.00 5.02 O ATOM 1675 CB LYS A 484 -10.695 -13.889 -2.292 1.00 2.10 C ATOM 1676 CG LYS A 484 -12.200 -13.566 -2.394 1.00 62.34 C ATOM 1677 CD LYS A 484 -13.007 -14.664 -3.131 1.00 72.13 C ATOM 1678 CE LYS A 484 -14.510 -14.336 -3.202 1.00 70.02 C ATOM 1679 NZ LYS A 484 -15.256 -15.284 -4.065 1.00 13.55 N ATOM 0 H LYS A 484 -10.462 -11.734 -3.497 1.00 53.10 H new ATOM 0 HA LYS A 484 -10.247 -12.399 -0.780 1.00 11.24 H new ATOM 0 HB2 LYS A 484 -10.324 -14.161 -3.280 1.00 2.10 H new ATOM 0 HB3 LYS A 484 -10.563 -14.761 -1.651 1.00 2.10 H new ATOM 0 HG2 LYS A 484 -12.607 -13.436 -1.391 1.00 62.34 H new ATOM 0 HG3 LYS A 484 -12.328 -12.617 -2.916 1.00 62.34 H new ATOM 0 HD2 LYS A 484 -12.615 -14.783 -4.141 1.00 72.13 H new ATOM 0 HD3 LYS A 484 -12.869 -15.617 -2.621 1.00 72.13 H new ATOM 0 HE2 LYS A 484 -14.931 -14.356 -2.197 1.00 70.02 H new ATOM 0 HE3 LYS A 484 -14.640 -13.323 -3.583 1.00 70.02 H new ATOM 0 HZ1 LYS A 484 -16.262 -15.021 -4.080 1.00 13.55 H new ATOM 0 HZ2 LYS A 484 -14.874 -15.248 -5.032 1.00 13.55 H new ATOM 0 HZ3 LYS A 484 -15.156 -16.248 -3.689 1.00 13.55 H new ATOM 1693 N GLY A 485 -7.574 -13.141 -2.561 1.00 54.30 N ATOM 1694 CA GLY A 485 -6.144 -13.422 -2.481 1.00 30.41 C ATOM 1695 C GLY A 485 -5.373 -12.367 -1.680 1.00 21.43 C ATOM 1696 O GLY A 485 -4.555 -12.717 -0.840 1.00 43.52 O ATOM 0 H GLY A 485 -7.896 -12.902 -3.499 1.00 54.30 H new ATOM 0 HA2 GLY A 485 -5.996 -14.399 -2.022 1.00 30.41 H new ATOM 0 HA3 GLY A 485 -5.733 -13.478 -3.489 1.00 30.41 H new ATOM 1700 N LEU A 486 -5.680 -11.074 -1.917 1.00 3.13 N ATOM 1701 CA LEU A 486 -4.993 -9.929 -1.253 1.00 4.53 C ATOM 1702 C LEU A 486 -5.231 -9.920 0.289 1.00 41.30 C ATOM 1703 O LEU A 486 -4.331 -9.539 1.060 1.00 20.14 O ATOM 1704 CB LEU A 486 -5.446 -8.588 -1.898 1.00 43.04 C ATOM 1705 CG LEU A 486 -4.669 -7.305 -1.448 1.00 73.35 C ATOM 1706 CD1 LEU A 486 -3.157 -7.424 -1.743 1.00 55.20 C ATOM 1707 CD2 LEU A 486 -5.269 -6.031 -2.091 1.00 4.23 C ATOM 0 H LEU A 486 -6.408 -10.787 -2.571 1.00 3.13 H new ATOM 0 HA LEU A 486 -3.920 -10.048 -1.405 1.00 4.53 H new ATOM 0 HB2 LEU A 486 -5.355 -8.681 -2.980 1.00 43.04 H new ATOM 0 HB3 LEU A 486 -6.504 -8.442 -1.678 1.00 43.04 H new ATOM 0 HG LEU A 486 -4.784 -7.216 -0.368 1.00 73.35 H new ATOM 0 HD11 LEU A 486 -2.650 -6.516 -1.417 1.00 55.20 H new ATOM 0 HD12 LEU A 486 -2.748 -8.280 -1.206 1.00 55.20 H new ATOM 0 HD13 LEU A 486 -3.005 -7.561 -2.814 1.00 55.20 H new ATOM 0 HD21 LEU A 486 -4.708 -5.157 -1.759 1.00 4.23 H new ATOM 0 HD22 LEU A 486 -5.210 -6.109 -3.177 1.00 4.23 H new ATOM 0 HD23 LEU A 486 -6.312 -5.928 -1.790 1.00 4.23 H new ATOM 1719 N TYR A 487 -6.442 -10.356 0.720 1.00 72.41 N ATOM 1720 CA TYR A 487 -6.756 -10.626 2.153 1.00 21.11 C ATOM 1721 C TYR A 487 -5.725 -11.610 2.781 1.00 74.32 C ATOM 1722 O TYR A 487 -5.229 -11.397 3.895 1.00 32.44 O ATOM 1723 CB TYR A 487 -8.192 -11.233 2.298 1.00 60.32 C ATOM 1724 CG TYR A 487 -9.364 -10.241 2.128 1.00 65.44 C ATOM 1725 CD1 TYR A 487 -9.548 -9.202 3.032 1.00 10.12 C ATOM 1726 CD2 TYR A 487 -10.295 -10.356 1.094 1.00 3.13 C ATOM 1727 CE1 TYR A 487 -10.598 -8.312 2.919 1.00 51.44 C ATOM 1728 CE2 TYR A 487 -11.349 -9.471 0.974 1.00 55.30 C ATOM 1729 CZ TYR A 487 -11.494 -8.448 1.888 1.00 3.35 C ATOM 1730 OH TYR A 487 -12.541 -7.558 1.767 1.00 22.42 O ATOM 0 H TYR A 487 -7.226 -10.530 0.091 1.00 72.41 H new ATOM 0 HA TYR A 487 -6.705 -9.674 2.681 1.00 21.11 H new ATOM 0 HB2 TYR A 487 -8.305 -12.029 1.562 1.00 60.32 H new ATOM 0 HB3 TYR A 487 -8.272 -11.695 3.282 1.00 60.32 H new ATOM 0 HD1 TYR A 487 -8.849 -9.087 3.847 1.00 10.12 H new ATOM 0 HD2 TYR A 487 -10.189 -11.153 0.373 1.00 3.13 H new ATOM 0 HE1 TYR A 487 -10.713 -7.514 3.637 1.00 51.44 H new ATOM 0 HE2 TYR A 487 -12.058 -9.580 0.166 1.00 55.30 H new ATOM 0 HH TYR A 487 -13.082 -7.793 0.984 1.00 22.42 H new ATOM 1740 N ARG A 488 -5.412 -12.670 2.019 1.00 34.51 N ATOM 1741 CA ARG A 488 -4.532 -13.780 2.454 1.00 71.22 C ATOM 1742 C ARG A 488 -3.028 -13.401 2.409 1.00 34.30 C ATOM 1743 O ARG A 488 -2.288 -13.743 3.329 1.00 31.42 O ATOM 1744 CB ARG A 488 -4.807 -15.019 1.563 1.00 41.32 C ATOM 1745 CG ARG A 488 -6.285 -15.481 1.580 1.00 24.24 C ATOM 1746 CD ARG A 488 -6.582 -16.603 0.570 1.00 1.34 C ATOM 1747 NE ARG A 488 -8.006 -16.992 0.587 1.00 23.12 N ATOM 1748 CZ ARG A 488 -8.512 -18.069 0.031 1.00 11.51 C ATOM 1749 NH1 ARG A 488 -7.771 -18.910 -0.626 1.00 4.22 N ATOM 1750 NH2 ARG A 488 -9.771 -18.303 0.144 1.00 45.32 N ATOM 0 H ARG A 488 -5.765 -12.787 1.069 1.00 34.51 H new ATOM 0 HA ARG A 488 -4.762 -14.006 3.495 1.00 71.22 H new ATOM 0 HB2 ARG A 488 -4.519 -14.789 0.537 1.00 41.32 H new ATOM 0 HB3 ARG A 488 -4.174 -15.842 1.895 1.00 41.32 H new ATOM 0 HG2 ARG A 488 -6.539 -15.827 2.582 1.00 24.24 H new ATOM 0 HG3 ARG A 488 -6.928 -14.628 1.364 1.00 24.24 H new ATOM 0 HD2 ARG A 488 -6.307 -16.273 -0.432 1.00 1.34 H new ATOM 0 HD3 ARG A 488 -5.965 -17.472 0.800 1.00 1.34 H new ATOM 0 HE ARG A 488 -8.653 -16.371 1.073 1.00 23.12 H new ATOM 0 HH11 ARG A 488 -6.769 -18.742 -0.720 1.00 4.22 H new ATOM 0 HH12 ARG A 488 -8.191 -19.738 -1.048 1.00 4.22 H new ATOM 0 HH21 ARG A 488 -10.366 -17.655 0.661 1.00 45.32 H new ATOM 0 HH22 ARG A 488 -10.175 -19.136 -0.284 1.00 45.32 H new ATOM 1764 N ILE A 489 -2.598 -12.684 1.339 1.00 60.31 N ATOM 1765 CA ILE A 489 -1.162 -12.333 1.095 1.00 22.15 C ATOM 1766 C ILE A 489 -0.583 -11.442 2.226 1.00 50.43 C ATOM 1767 O ILE A 489 0.540 -11.662 2.694 1.00 11.13 O ATOM 1768 CB ILE A 489 -0.976 -11.601 -0.293 1.00 33.20 C ATOM 1769 CG1 ILE A 489 -1.467 -12.494 -1.480 1.00 33.41 C ATOM 1770 CG2 ILE A 489 0.502 -11.177 -0.514 1.00 25.22 C ATOM 1771 CD1 ILE A 489 -1.574 -11.769 -2.820 1.00 13.11 C ATOM 0 H ILE A 489 -3.229 -12.331 0.620 1.00 60.31 H new ATOM 0 HA ILE A 489 -0.614 -13.275 1.079 1.00 22.15 H new ATOM 0 HB ILE A 489 -1.591 -10.701 -0.266 1.00 33.20 H new ATOM 0 HG12 ILE A 489 -0.783 -13.336 -1.591 1.00 33.41 H new ATOM 0 HG13 ILE A 489 -2.443 -12.907 -1.227 1.00 33.41 H new ATOM 0 HG21 ILE A 489 0.597 -10.676 -1.478 1.00 25.22 H new ATOM 0 HG22 ILE A 489 0.808 -10.496 0.280 1.00 25.22 H new ATOM 0 HG23 ILE A 489 1.140 -12.061 -0.500 1.00 25.22 H new ATOM 0 HD11 ILE A 489 -1.921 -12.465 -3.584 1.00 13.11 H new ATOM 0 HD12 ILE A 489 -2.281 -10.944 -2.732 1.00 13.11 H new ATOM 0 HD13 ILE A 489 -0.596 -11.379 -3.102 1.00 13.11 H new ATOM 1783 N MET A 490 -1.354 -10.433 2.654 1.00 43.12 N ATOM 1784 CA MET A 490 -0.962 -9.560 3.787 1.00 60.11 C ATOM 1785 C MET A 490 -1.124 -10.293 5.144 1.00 40.23 C ATOM 1786 O MET A 490 -0.470 -9.942 6.132 1.00 53.01 O ATOM 1787 CB MET A 490 -1.756 -8.238 3.735 1.00 54.31 C ATOM 1788 CG MET A 490 -1.422 -7.391 2.502 1.00 21.10 C ATOM 1789 SD MET A 490 -2.157 -5.746 2.548 1.00 33.01 S ATOM 1790 CE MET A 490 -1.303 -4.977 1.177 1.00 41.45 C ATOM 0 H MET A 490 -2.254 -10.195 2.238 1.00 43.12 H new ATOM 0 HA MET A 490 0.096 -9.315 3.694 1.00 60.11 H new ATOM 0 HB2 MET A 490 -2.823 -8.460 3.739 1.00 54.31 H new ATOM 0 HB3 MET A 490 -1.548 -7.659 4.635 1.00 54.31 H new ATOM 0 HG2 MET A 490 -0.339 -7.296 2.418 1.00 21.10 H new ATOM 0 HG3 MET A 490 -1.767 -7.911 1.608 1.00 21.10 H new ATOM 0 HE1 MET A 490 -1.404 -3.894 1.247 1.00 41.45 H new ATOM 0 HE2 MET A 490 -0.247 -5.245 1.209 1.00 41.45 H new ATOM 0 HE3 MET A 490 -1.736 -5.322 0.238 1.00 41.45 H new ATOM 1800 N GLY A 491 -1.979 -11.340 5.155 1.00 10.44 N ATOM 1801 CA GLY A 491 -2.057 -12.289 6.277 1.00 34.42 C ATOM 1802 C GLY A 491 -0.839 -13.239 6.352 1.00 4.31 C ATOM 1803 O GLY A 491 -0.613 -13.886 7.380 1.00 3.32 O ATOM 0 H GLY A 491 -2.626 -11.546 4.393 1.00 10.44 H new ATOM 0 HA2 GLY A 491 -2.135 -11.733 7.211 1.00 34.42 H new ATOM 0 HA3 GLY A 491 -2.967 -12.881 6.182 1.00 34.42 H new ATOM 1807 N ASN A 492 -0.064 -13.337 5.240 1.00 72.25 N ATOM 1808 CA ASN A 492 1.267 -14.007 5.232 1.00 23.44 C ATOM 1809 C ASN A 492 2.375 -13.082 5.827 1.00 33.15 C ATOM 1810 O ASN A 492 3.551 -13.463 5.864 1.00 71.41 O ATOM 1811 CB ASN A 492 1.676 -14.443 3.797 1.00 33.23 C ATOM 1812 CG ASN A 492 0.729 -15.458 3.161 1.00 41.04 C ATOM 1813 OD1 ASN A 492 -0.144 -15.124 2.383 1.00 31.33 O ATOM 1814 ND2 ASN A 492 0.913 -16.713 3.476 1.00 32.12 N ATOM 0 H ASN A 492 -0.338 -12.959 4.333 1.00 72.25 H new ATOM 0 HA ASN A 492 1.174 -14.895 5.858 1.00 23.44 H new ATOM 0 HB2 ASN A 492 1.725 -13.560 3.160 1.00 33.23 H new ATOM 0 HB3 ASN A 492 2.679 -14.869 3.830 1.00 33.23 H new ATOM 0 HD21 ASN A 492 0.318 -17.434 3.067 1.00 32.12 H new ATOM 0 HD22 ASN A 492 1.651 -16.972 4.131 1.00 32.12 H new ATOM 1821 N GLY A 493 1.987 -11.871 6.278 1.00 72.35 N ATOM 1822 CA GLY A 493 2.917 -10.919 6.902 1.00 62.02 C ATOM 1823 C GLY A 493 3.598 -9.990 5.903 1.00 65.03 C ATOM 1824 O GLY A 493 4.754 -9.604 6.098 1.00 62.43 O ATOM 0 H GLY A 493 1.027 -11.532 6.219 1.00 72.35 H new ATOM 0 HA2 GLY A 493 2.374 -10.319 7.632 1.00 62.02 H new ATOM 0 HA3 GLY A 493 3.680 -11.474 7.449 1.00 62.02 H new ATOM 1828 N PHE A 494 2.880 -9.630 4.823 1.00 5.31 N ATOM 1829 CA PHE A 494 3.387 -8.708 3.776 1.00 71.14 C ATOM 1830 C PHE A 494 2.614 -7.375 3.774 1.00 51.21 C ATOM 1831 O PHE A 494 1.583 -7.226 4.439 1.00 10.11 O ATOM 1832 CB PHE A 494 3.331 -9.386 2.375 1.00 3.03 C ATOM 1833 CG PHE A 494 4.310 -10.553 2.223 1.00 53.12 C ATOM 1834 CD1 PHE A 494 5.642 -10.321 1.880 1.00 22.22 C ATOM 1835 CD2 PHE A 494 3.911 -11.870 2.438 1.00 64.31 C ATOM 1836 CE1 PHE A 494 6.540 -11.364 1.757 1.00 40.50 C ATOM 1837 CE2 PHE A 494 4.809 -12.916 2.315 1.00 73.21 C ATOM 1838 CZ PHE A 494 6.124 -12.662 1.975 1.00 44.12 C ATOM 0 H PHE A 494 1.933 -9.966 4.647 1.00 5.31 H new ATOM 0 HA PHE A 494 4.428 -8.481 4.007 1.00 71.14 H new ATOM 0 HB2 PHE A 494 2.318 -9.746 2.194 1.00 3.03 H new ATOM 0 HB3 PHE A 494 3.546 -8.640 1.610 1.00 3.03 H new ATOM 0 HD1 PHE A 494 5.977 -9.309 1.708 1.00 22.22 H new ATOM 0 HD2 PHE A 494 2.885 -12.078 2.705 1.00 64.31 H new ATOM 0 HE1 PHE A 494 7.567 -11.164 1.490 1.00 40.50 H new ATOM 0 HE2 PHE A 494 4.482 -13.931 2.485 1.00 73.21 H new ATOM 0 HZ PHE A 494 6.825 -13.478 1.880 1.00 44.12 H new ATOM 1848 N ALA A 495 3.137 -6.417 3.004 1.00 61.44 N ATOM 1849 CA ALA A 495 2.646 -5.031 2.968 1.00 23.01 C ATOM 1850 C ALA A 495 2.871 -4.414 1.573 1.00 34.42 C ATOM 1851 O ALA A 495 3.772 -4.833 0.846 1.00 14.14 O ATOM 1852 CB ALA A 495 3.374 -4.232 4.038 1.00 60.34 C ATOM 0 H ALA A 495 3.925 -6.582 2.378 1.00 61.44 H new ATOM 0 HA ALA A 495 1.574 -5.012 3.166 1.00 23.01 H new ATOM 0 HB1 ALA A 495 3.021 -3.201 4.025 1.00 60.34 H new ATOM 0 HB2 ALA A 495 3.177 -4.670 5.016 1.00 60.34 H new ATOM 0 HB3 ALA A 495 4.446 -4.252 3.841 1.00 60.34 H new ATOM 1858 N GLY A 496 2.092 -3.377 1.232 1.00 15.23 N ATOM 1859 CA GLY A 496 2.000 -2.889 -0.153 1.00 33.02 C ATOM 1860 C GLY A 496 2.519 -1.467 -0.371 1.00 53.42 C ATOM 1861 O GLY A 496 1.765 -0.507 -0.250 1.00 33.13 O ATOM 0 H GLY A 496 1.516 -2.860 1.896 1.00 15.23 H new ATOM 0 HA2 GLY A 496 2.558 -3.567 -0.799 1.00 33.02 H new ATOM 0 HA3 GLY A 496 0.958 -2.932 -0.469 1.00 33.02 H new ATOM 1865 N CYS A 497 3.809 -1.327 -0.729 1.00 44.23 N ATOM 1866 CA CYS A 497 4.405 -0.014 -1.077 1.00 63.23 C ATOM 1867 C CYS A 497 3.882 0.475 -2.451 1.00 14.15 C ATOM 1868 O CYS A 497 4.395 0.087 -3.504 1.00 74.43 O ATOM 1869 CB CYS A 497 5.948 -0.100 -1.084 1.00 0.03 C ATOM 1870 SG CYS A 497 6.765 1.458 -1.484 1.00 24.15 S ATOM 0 H CYS A 497 4.464 -2.107 -0.786 1.00 44.23 H new ATOM 0 HA CYS A 497 4.106 0.709 -0.318 1.00 63.23 H new ATOM 0 HB2 CYS A 497 6.288 -0.436 -0.104 1.00 0.03 H new ATOM 0 HB3 CYS A 497 6.257 -0.857 -1.805 1.00 0.03 H new ATOM 0 HG CYS A 497 6.814 1.603 -2.775 1.00 24.15 H new ATOM 1876 N VAL A 498 2.824 1.298 -2.415 1.00 43.30 N ATOM 1877 CA VAL A 498 2.145 1.816 -3.614 1.00 2.32 C ATOM 1878 C VAL A 498 2.924 3.002 -4.236 1.00 0.25 C ATOM 1879 O VAL A 498 2.877 4.126 -3.729 1.00 13.43 O ATOM 1880 CB VAL A 498 0.678 2.256 -3.257 1.00 42.24 C ATOM 1881 CG1 VAL A 498 -0.060 2.838 -4.482 1.00 33.12 C ATOM 1882 CG2 VAL A 498 -0.126 1.086 -2.633 1.00 11.40 C ATOM 0 H VAL A 498 2.410 1.627 -1.543 1.00 43.30 H new ATOM 0 HA VAL A 498 2.109 1.015 -4.353 1.00 2.32 H new ATOM 0 HB VAL A 498 0.755 3.048 -2.512 1.00 42.24 H new ATOM 0 HG11 VAL A 498 -1.070 3.130 -4.194 1.00 33.12 H new ATOM 0 HG12 VAL A 498 0.479 3.711 -4.850 1.00 33.12 H new ATOM 0 HG13 VAL A 498 -0.111 2.085 -5.268 1.00 33.12 H new ATOM 0 HG21 VAL A 498 -1.136 1.423 -2.398 1.00 11.40 H new ATOM 0 HG22 VAL A 498 -0.175 0.260 -3.342 1.00 11.40 H new ATOM 0 HG23 VAL A 498 0.367 0.752 -1.720 1.00 11.40 H new ATOM 1892 N HIS A 499 3.654 2.719 -5.324 1.00 32.43 N ATOM 1893 CA HIS A 499 4.413 3.733 -6.086 1.00 73.44 C ATOM 1894 C HIS A 499 3.517 4.419 -7.152 1.00 33.44 C ATOM 1895 O HIS A 499 2.904 3.750 -8.002 1.00 52.30 O ATOM 1896 CB HIS A 499 5.645 3.085 -6.769 1.00 12.02 C ATOM 1897 CG HIS A 499 6.624 2.454 -5.804 1.00 23.53 C ATOM 1898 ND1 HIS A 499 7.591 3.200 -5.168 1.00 34.31 N ATOM 1899 CD2 HIS A 499 6.746 1.159 -5.414 1.00 72.45 C ATOM 1900 CE1 HIS A 499 8.269 2.356 -4.415 1.00 2.44 C ATOM 1901 NE2 HIS A 499 7.796 1.107 -4.531 1.00 41.21 N ATOM 0 H HIS A 499 3.738 1.777 -5.706 1.00 32.43 H new ATOM 0 HA HIS A 499 4.753 4.494 -5.383 1.00 73.44 H new ATOM 0 HB2 HIS A 499 5.301 2.325 -7.470 1.00 12.02 H new ATOM 0 HB3 HIS A 499 6.165 3.845 -7.353 1.00 12.02 H new ATOM 0 HD2 HIS A 499 6.134 0.329 -5.737 1.00 72.45 H new ATOM 0 HE1 HIS A 499 9.100 2.636 -3.785 1.00 2.44 H new ATOM 0 HE2 HIS A 499 8.149 0.277 -4.054 1.00 41.21 H new ATOM 1909 N PHE A 500 3.445 5.754 -7.078 1.00 0.44 N ATOM 1910 CA PHE A 500 2.744 6.603 -8.063 1.00 64.14 C ATOM 1911 C PHE A 500 3.681 6.913 -9.257 1.00 44.42 C ATOM 1912 O PHE A 500 4.857 7.215 -9.042 1.00 5.01 O ATOM 1913 CB PHE A 500 2.293 7.946 -7.406 1.00 12.04 C ATOM 1914 CG PHE A 500 1.177 7.828 -6.361 1.00 65.02 C ATOM 1915 CD1 PHE A 500 1.243 6.888 -5.329 1.00 61.40 C ATOM 1916 CD2 PHE A 500 0.062 8.663 -6.411 1.00 32.40 C ATOM 1917 CE1 PHE A 500 0.237 6.787 -4.396 1.00 71.33 C ATOM 1918 CE2 PHE A 500 -0.943 8.560 -5.476 1.00 74.53 C ATOM 1919 CZ PHE A 500 -0.858 7.622 -4.471 1.00 10.15 C ATOM 0 H PHE A 500 3.877 6.287 -6.323 1.00 0.44 H new ATOM 0 HA PHE A 500 1.865 6.063 -8.415 1.00 64.14 H new ATOM 0 HB2 PHE A 500 3.160 8.409 -6.935 1.00 12.04 H new ATOM 0 HB3 PHE A 500 1.959 8.621 -8.194 1.00 12.04 H new ATOM 0 HD1 PHE A 500 2.097 6.230 -5.263 1.00 61.40 H new ATOM 0 HD2 PHE A 500 -0.015 9.402 -7.195 1.00 32.40 H new ATOM 0 HE1 PHE A 500 0.305 6.054 -3.605 1.00 71.33 H new ATOM 0 HE2 PHE A 500 -1.799 9.216 -5.531 1.00 74.53 H new ATOM 0 HZ PHE A 500 -1.650 7.540 -3.741 1.00 10.15 H new ATOM 1929 N PRO A 501 3.190 6.834 -10.538 1.00 73.13 N ATOM 1930 CA PRO A 501 3.944 7.356 -11.715 1.00 71.40 C ATOM 1931 C PRO A 501 4.173 8.898 -11.646 1.00 51.11 C ATOM 1932 O PRO A 501 5.103 9.424 -12.269 1.00 0.31 O ATOM 1933 CB PRO A 501 3.049 6.959 -12.928 1.00 13.52 C ATOM 1934 CG PRO A 501 1.683 6.742 -12.341 1.00 33.01 C ATOM 1935 CD PRO A 501 1.918 6.185 -10.951 1.00 0.24 C ATOM 0 HA PRO A 501 4.951 6.942 -11.774 1.00 71.40 H new ATOM 0 HB2 PRO A 501 3.035 7.745 -13.683 1.00 13.52 H new ATOM 0 HB3 PRO A 501 3.419 6.056 -13.414 1.00 13.52 H new ATOM 0 HG2 PRO A 501 1.122 7.676 -12.299 1.00 33.01 H new ATOM 0 HG3 PRO A 501 1.102 6.048 -12.948 1.00 33.01 H new ATOM 0 HD2 PRO A 501 1.101 6.433 -10.274 1.00 0.24 H new ATOM 0 HD3 PRO A 501 2.005 5.099 -10.961 1.00 0.24 H new ATOM 2024 N VAL A 508 1.208 13.250 -3.556 1.00 61.54 N ATOM 2025 CA VAL A 508 1.766 11.934 -3.195 1.00 10.11 C ATOM 2026 C VAL A 508 2.622 11.302 -4.325 1.00 31.24 C ATOM 2027 O VAL A 508 2.228 11.275 -5.494 1.00 71.23 O ATOM 2028 CB VAL A 508 0.595 10.958 -2.811 1.00 65.10 C ATOM 2029 CG1 VAL A 508 1.120 9.639 -2.185 1.00 44.20 C ATOM 2030 CG2 VAL A 508 -0.420 11.663 -1.872 1.00 71.45 C ATOM 0 HA VAL A 508 2.432 12.092 -2.347 1.00 10.11 H new ATOM 0 HB VAL A 508 0.078 10.687 -3.731 1.00 65.10 H new ATOM 0 HG11 VAL A 508 0.277 8.994 -1.935 1.00 44.20 H new ATOM 0 HG12 VAL A 508 1.767 9.130 -2.899 1.00 44.20 H new ATOM 0 HG13 VAL A 508 1.685 9.865 -1.281 1.00 44.20 H new ATOM 0 HG21 VAL A 508 -1.223 10.970 -1.618 1.00 71.45 H new ATOM 0 HG22 VAL A 508 0.087 11.981 -0.961 1.00 71.45 H new ATOM 0 HG23 VAL A 508 -0.838 12.534 -2.377 1.00 71.45 H new ATOM 2040 N ARG A 509 3.804 10.810 -3.933 1.00 73.43 N ATOM 2041 CA ARG A 509 4.705 9.999 -4.780 1.00 2.03 C ATOM 2042 C ARG A 509 4.573 8.490 -4.432 1.00 4.35 C ATOM 2043 O ARG A 509 4.759 7.621 -5.287 1.00 62.21 O ATOM 2044 CB ARG A 509 6.174 10.482 -4.559 1.00 31.51 C ATOM 2045 CG ARG A 509 7.263 9.694 -5.324 1.00 5.11 C ATOM 2046 CD ARG A 509 7.050 9.729 -6.844 1.00 11.22 C ATOM 2047 NE ARG A 509 8.113 9.024 -7.579 1.00 12.04 N ATOM 2048 CZ ARG A 509 8.060 8.684 -8.849 1.00 22.13 C ATOM 2049 NH1 ARG A 509 6.995 8.907 -9.563 1.00 32.32 N ATOM 2050 NH2 ARG A 509 9.073 8.106 -9.401 1.00 41.04 N ATOM 0 H ARG A 509 4.175 10.966 -2.996 1.00 73.43 H new ATOM 0 HA ARG A 509 4.430 10.125 -5.827 1.00 2.03 H new ATOM 0 HB2 ARG A 509 6.239 11.531 -4.849 1.00 31.51 H new ATOM 0 HB3 ARG A 509 6.397 10.432 -3.493 1.00 31.51 H new ATOM 0 HG2 ARG A 509 8.242 10.110 -5.087 1.00 5.11 H new ATOM 0 HG3 ARG A 509 7.265 8.658 -4.984 1.00 5.11 H new ATOM 0 HD2 ARG A 509 6.087 9.278 -7.083 1.00 11.22 H new ATOM 0 HD3 ARG A 509 7.008 10.766 -7.178 1.00 11.22 H new ATOM 0 HE ARG A 509 8.958 8.780 -7.063 1.00 12.04 H new ATOM 0 HH11 ARG A 509 6.181 9.353 -9.140 1.00 32.32 H new ATOM 0 HH12 ARG A 509 6.974 8.636 -10.546 1.00 32.32 H new ATOM 0 HH21 ARG A 509 9.912 7.914 -8.853 1.00 41.04 H new ATOM 0 HH22 ARG A 509 9.035 7.841 -10.385 1.00 41.04 H new ATOM 2064 N VAL A 510 4.281 8.207 -3.157 1.00 33.12 N ATOM 2065 CA VAL A 510 4.235 6.843 -2.600 1.00 55.04 C ATOM 2066 C VAL A 510 3.386 6.804 -1.294 1.00 64.51 C ATOM 2067 O VAL A 510 3.278 7.810 -0.577 1.00 51.33 O ATOM 2068 CB VAL A 510 5.699 6.314 -2.330 1.00 53.42 C ATOM 2069 CG1 VAL A 510 6.411 7.149 -1.231 1.00 64.22 C ATOM 2070 CG2 VAL A 510 5.719 4.796 -2.007 1.00 71.42 C ATOM 0 H VAL A 510 4.066 8.929 -2.469 1.00 33.12 H new ATOM 0 HA VAL A 510 3.757 6.189 -3.330 1.00 55.04 H new ATOM 0 HB VAL A 510 6.263 6.445 -3.253 1.00 53.42 H new ATOM 0 HG11 VAL A 510 7.416 6.758 -1.071 1.00 64.22 H new ATOM 0 HG12 VAL A 510 6.473 8.190 -1.548 1.00 64.22 H new ATOM 0 HG13 VAL A 510 5.844 7.086 -0.302 1.00 64.22 H new ATOM 0 HG21 VAL A 510 6.745 4.476 -1.828 1.00 71.42 H new ATOM 0 HG22 VAL A 510 5.119 4.605 -1.117 1.00 71.42 H new ATOM 0 HG23 VAL A 510 5.306 4.239 -2.849 1.00 71.42 H new ATOM 2080 N LEU A 511 2.778 5.644 -1.006 1.00 5.52 N ATOM 2081 CA LEU A 511 2.093 5.368 0.278 1.00 44.15 C ATOM 2082 C LEU A 511 2.203 3.869 0.623 1.00 51.11 C ATOM 2083 O LEU A 511 2.633 3.067 -0.208 1.00 13.12 O ATOM 2084 CB LEU A 511 0.611 5.864 0.244 1.00 53.32 C ATOM 2085 CG LEU A 511 -0.388 5.178 -0.769 1.00 32.45 C ATOM 2086 CD1 LEU A 511 -1.014 3.883 -0.202 1.00 73.13 C ATOM 2087 CD2 LEU A 511 -1.494 6.159 -1.221 1.00 51.31 C ATOM 0 H LEU A 511 2.744 4.861 -1.659 1.00 5.52 H new ATOM 0 HA LEU A 511 2.588 5.927 1.072 1.00 44.15 H new ATOM 0 HB2 LEU A 511 0.199 5.748 1.246 1.00 53.32 H new ATOM 0 HB3 LEU A 511 0.623 6.932 0.026 1.00 53.32 H new ATOM 0 HG LEU A 511 0.205 4.897 -1.639 1.00 32.45 H new ATOM 0 HD11 LEU A 511 -1.692 3.453 -0.939 1.00 73.13 H new ATOM 0 HD12 LEU A 511 -0.225 3.167 0.026 1.00 73.13 H new ATOM 0 HD13 LEU A 511 -1.567 4.115 0.708 1.00 73.13 H new ATOM 0 HD21 LEU A 511 -2.164 5.656 -1.917 1.00 51.31 H new ATOM 0 HD22 LEU A 511 -2.059 6.495 -0.352 1.00 51.31 H new ATOM 0 HD23 LEU A 511 -1.039 7.019 -1.713 1.00 51.31 H new ATOM 2099 N MET A 512 1.839 3.490 1.860 1.00 44.50 N ATOM 2100 CA MET A 512 1.838 2.067 2.291 1.00 53.13 C ATOM 2101 C MET A 512 0.402 1.531 2.469 1.00 43.33 C ATOM 2102 O MET A 512 -0.421 2.167 3.113 1.00 51.41 O ATOM 2103 CB MET A 512 2.659 1.884 3.610 1.00 10.22 C ATOM 2104 CG MET A 512 3.846 0.936 3.452 1.00 71.21 C ATOM 2105 SD MET A 512 3.351 -0.682 2.837 1.00 30.21 S ATOM 2106 CE MET A 512 4.951 -1.379 2.459 1.00 12.42 C ATOM 0 H MET A 512 1.541 4.143 2.584 1.00 44.50 H new ATOM 0 HA MET A 512 2.316 1.486 1.502 1.00 53.13 H new ATOM 0 HB2 MET A 512 3.021 2.857 3.943 1.00 10.22 H new ATOM 0 HB3 MET A 512 2.000 1.504 4.391 1.00 10.22 H new ATOM 0 HG2 MET A 512 4.571 1.376 2.767 1.00 71.21 H new ATOM 0 HG3 MET A 512 4.346 0.819 4.414 1.00 71.21 H new ATOM 0 HE1 MET A 512 5.032 -1.542 1.384 1.00 12.42 H new ATOM 0 HE2 MET A 512 5.733 -0.691 2.781 1.00 12.42 H new ATOM 0 HE3 MET A 512 5.066 -2.329 2.980 1.00 12.42 H new ATOM 2116 N LEU A 513 0.132 0.346 1.914 1.00 30.41 N ATOM 2117 CA LEU A 513 -1.151 -0.356 2.071 1.00 61.30 C ATOM 2118 C LEU A 513 -0.976 -1.478 3.123 1.00 73.14 C ATOM 2119 O LEU A 513 -0.179 -2.402 2.923 1.00 20.53 O ATOM 2120 CB LEU A 513 -1.622 -0.937 0.708 1.00 34.31 C ATOM 2121 CG LEU A 513 -3.074 -1.522 0.681 1.00 54.52 C ATOM 2122 CD1 LEU A 513 -4.122 -0.404 0.829 1.00 42.51 C ATOM 2123 CD2 LEU A 513 -3.337 -2.357 -0.591 1.00 63.14 C ATOM 0 H LEU A 513 0.803 -0.161 1.337 1.00 30.41 H new ATOM 0 HA LEU A 513 -1.917 0.341 2.412 1.00 61.30 H new ATOM 0 HB2 LEU A 513 -1.554 -0.151 -0.044 1.00 34.31 H new ATOM 0 HB3 LEU A 513 -0.928 -1.723 0.411 1.00 34.31 H new ATOM 0 HG LEU A 513 -3.166 -2.194 1.534 1.00 54.52 H new ATOM 0 HD11 LEU A 513 -5.122 -0.837 0.807 1.00 42.51 H new ATOM 0 HD12 LEU A 513 -3.971 0.113 1.777 1.00 42.51 H new ATOM 0 HD13 LEU A 513 -4.016 0.305 0.008 1.00 42.51 H new ATOM 0 HD21 LEU A 513 -4.356 -2.744 -0.568 1.00 63.14 H new ATOM 0 HD22 LEU A 513 -3.207 -1.729 -1.472 1.00 63.14 H new ATOM 0 HD23 LEU A 513 -2.634 -3.189 -0.632 1.00 63.14 H new ATOM 2135 N LEU A 514 -1.700 -1.376 4.249 1.00 15.31 N ATOM 2136 CA LEU A 514 -1.547 -2.280 5.410 1.00 34.15 C ATOM 2137 C LEU A 514 -2.906 -2.864 5.838 1.00 13.34 C ATOM 2138 O LEU A 514 -3.742 -2.165 6.407 1.00 63.31 O ATOM 2139 CB LEU A 514 -0.881 -1.500 6.583 1.00 74.15 C ATOM 2140 CG LEU A 514 0.636 -1.177 6.384 1.00 33.34 C ATOM 2141 CD1 LEU A 514 1.169 -0.216 7.456 1.00 74.20 C ATOM 2142 CD2 LEU A 514 1.467 -2.474 6.355 1.00 65.31 C ATOM 0 H LEU A 514 -2.414 -0.660 4.384 1.00 15.31 H new ATOM 0 HA LEU A 514 -0.908 -3.117 5.129 1.00 34.15 H new ATOM 0 HB2 LEU A 514 -1.420 -0.564 6.730 1.00 74.15 H new ATOM 0 HB3 LEU A 514 -0.996 -2.081 7.498 1.00 74.15 H new ATOM 0 HG LEU A 514 0.736 -0.673 5.422 1.00 33.34 H new ATOM 0 HD11 LEU A 514 2.226 -0.021 7.277 1.00 74.20 H new ATOM 0 HD12 LEU A 514 0.615 0.721 7.412 1.00 74.20 H new ATOM 0 HD13 LEU A 514 1.045 -0.665 8.441 1.00 74.20 H new ATOM 0 HD21 LEU A 514 2.520 -2.229 6.216 1.00 65.31 H new ATOM 0 HD22 LEU A 514 1.340 -3.008 7.297 1.00 65.31 H new ATOM 0 HD23 LEU A 514 1.129 -3.104 5.532 1.00 65.31 H new ATOM 2154 N TYR A 515 -3.112 -4.152 5.554 1.00 31.40 N ATOM 2155 CA TYR A 515 -4.358 -4.859 5.883 1.00 64.23 C ATOM 2156 C TYR A 515 -4.460 -5.205 7.398 1.00 22.24 C ATOM 2157 O TYR A 515 -3.499 -5.676 8.009 1.00 63.04 O ATOM 2158 CB TYR A 515 -4.466 -6.143 5.028 1.00 23.20 C ATOM 2159 CG TYR A 515 -5.688 -7.005 5.354 1.00 11.11 C ATOM 2160 CD1 TYR A 515 -6.972 -6.490 5.204 1.00 75.43 C ATOM 2161 CD2 TYR A 515 -5.555 -8.307 5.842 1.00 42.31 C ATOM 2162 CE1 TYR A 515 -8.075 -7.235 5.531 1.00 62.24 C ATOM 2163 CE2 TYR A 515 -6.661 -9.060 6.164 1.00 33.54 C ATOM 2164 CZ TYR A 515 -7.918 -8.520 6.014 1.00 35.12 C ATOM 2165 OH TYR A 515 -9.035 -9.264 6.347 1.00 54.41 O ATOM 0 H TYR A 515 -2.419 -4.738 5.088 1.00 31.40 H new ATOM 0 HA TYR A 515 -5.189 -4.192 5.654 1.00 64.23 H new ATOM 0 HB2 TYR A 515 -4.501 -5.864 3.975 1.00 23.20 H new ATOM 0 HB3 TYR A 515 -3.565 -6.739 5.170 1.00 23.20 H new ATOM 0 HD1 TYR A 515 -7.101 -5.487 4.824 1.00 75.43 H new ATOM 0 HD2 TYR A 515 -4.569 -8.729 5.969 1.00 42.31 H new ATOM 0 HE1 TYR A 515 -9.064 -6.819 5.411 1.00 62.24 H new ATOM 0 HE2 TYR A 515 -6.543 -10.068 6.532 1.00 33.54 H new ATOM 0 HH TYR A 515 -9.510 -9.525 5.530 1.00 54.41 H new ATOM 2175 N SER A 516 -5.655 -4.968 7.978 1.00 43.44 N ATOM 2176 CA SER A 516 -6.016 -5.402 9.348 1.00 3.33 C ATOM 2177 C SER A 516 -6.840 -6.701 9.296 1.00 13.20 C ATOM 2178 O SER A 516 -7.970 -6.703 8.789 1.00 10.12 O ATOM 2179 CB SER A 516 -6.833 -4.309 10.064 1.00 60.43 C ATOM 2180 OG SER A 516 -7.296 -4.747 11.337 1.00 41.51 O ATOM 0 H SER A 516 -6.406 -4.465 7.505 1.00 43.44 H new ATOM 0 HA SER A 516 -5.094 -5.579 9.902 1.00 3.33 H new ATOM 0 HB2 SER A 516 -6.218 -3.417 10.187 1.00 60.43 H new ATOM 0 HB3 SER A 516 -7.684 -4.026 9.445 1.00 60.43 H new ATOM 0 HG SER A 516 -7.520 -3.969 11.889 1.00 41.51 H new ATOM 2186 N SER A 517 -6.271 -7.792 9.836 1.00 34.12 N ATOM 2187 CA SER A 517 -6.929 -9.123 9.897 1.00 3.13 C ATOM 2188 C SER A 517 -8.218 -9.099 10.753 1.00 73.12 C ATOM 2189 O SER A 517 -9.152 -9.864 10.506 1.00 14.53 O ATOM 2190 CB SER A 517 -5.947 -10.173 10.475 1.00 65.53 C ATOM 2191 OG SER A 517 -5.617 -9.877 11.829 1.00 32.54 O ATOM 0 H SER A 517 -5.337 -7.783 10.246 1.00 34.12 H new ATOM 0 HA SER A 517 -7.209 -9.392 8.879 1.00 3.13 H new ATOM 0 HB2 SER A 517 -6.394 -11.165 10.415 1.00 65.53 H new ATOM 0 HB3 SER A 517 -5.039 -10.196 9.873 1.00 65.53 H new ATOM 0 HG SER A 517 -4.998 -10.555 12.171 1.00 32.54 H new ATOM 2197 N LYS A 518 -8.243 -8.212 11.763 1.00 61.34 N ATOM 2198 CA LYS A 518 -9.372 -8.073 12.709 1.00 75.13 C ATOM 2199 C LYS A 518 -10.518 -7.200 12.118 1.00 52.20 C ATOM 2200 O LYS A 518 -11.697 -7.560 12.216 1.00 64.03 O ATOM 2201 CB LYS A 518 -8.852 -7.467 14.044 1.00 55.01 C ATOM 2202 CG LYS A 518 -9.910 -7.399 15.169 1.00 64.53 C ATOM 2203 CD LYS A 518 -9.368 -6.779 16.480 1.00 11.24 C ATOM 2204 CE LYS A 518 -10.432 -6.748 17.598 1.00 53.33 C ATOM 2205 NZ LYS A 518 -11.634 -5.953 17.212 1.00 44.25 N ATOM 0 H LYS A 518 -7.477 -7.565 11.950 1.00 61.34 H new ATOM 0 HA LYS A 518 -9.790 -9.063 12.895 1.00 75.13 H new ATOM 0 HB2 LYS A 518 -8.006 -8.059 14.393 1.00 55.01 H new ATOM 0 HB3 LYS A 518 -8.479 -6.461 13.851 1.00 55.01 H new ATOM 0 HG2 LYS A 518 -10.762 -6.813 14.823 1.00 64.53 H new ATOM 0 HG3 LYS A 518 -10.277 -8.404 15.375 1.00 64.53 H new ATOM 0 HD2 LYS A 518 -8.504 -7.351 16.819 1.00 11.24 H new ATOM 0 HD3 LYS A 518 -9.021 -5.764 16.283 1.00 11.24 H new ATOM 0 HE2 LYS A 518 -10.735 -7.767 17.837 1.00 53.33 H new ATOM 0 HE3 LYS A 518 -9.994 -6.325 18.502 1.00 53.33 H new ATOM 0 HZ1 LYS A 518 -12.259 -5.846 18.036 1.00 44.25 H new ATOM 0 HZ2 LYS A 518 -11.337 -5.014 16.879 1.00 44.25 H new ATOM 0 HZ3 LYS A 518 -12.145 -6.444 16.451 1.00 44.25 H new ATOM 2219 N LYS A 519 -10.148 -6.059 11.501 1.00 43.24 N ATOM 2220 CA LYS A 519 -11.120 -5.067 10.954 1.00 53.11 C ATOM 2221 C LYS A 519 -11.616 -5.409 9.525 1.00 45.55 C ATOM 2222 O LYS A 519 -12.641 -4.870 9.091 1.00 4.25 O ATOM 2223 CB LYS A 519 -10.481 -3.655 10.936 1.00 60.14 C ATOM 2224 CG LYS A 519 -10.177 -3.036 12.313 1.00 10.33 C ATOM 2225 CD LYS A 519 -11.451 -2.832 13.166 1.00 71.42 C ATOM 2226 CE LYS A 519 -11.182 -2.010 14.433 1.00 51.33 C ATOM 2227 NZ LYS A 519 -10.854 -0.591 14.130 1.00 72.01 N ATOM 0 H LYS A 519 -9.173 -5.792 11.364 1.00 43.24 H new ATOM 0 HA LYS A 519 -11.987 -5.097 11.614 1.00 53.11 H new ATOM 0 HB2 LYS A 519 -9.552 -3.705 10.369 1.00 60.14 H new ATOM 0 HB3 LYS A 519 -11.148 -2.983 10.396 1.00 60.14 H new ATOM 0 HG2 LYS A 519 -9.482 -3.680 12.852 1.00 10.33 H new ATOM 0 HG3 LYS A 519 -9.679 -2.076 12.174 1.00 10.33 H new ATOM 0 HD2 LYS A 519 -12.210 -2.331 12.566 1.00 71.42 H new ATOM 0 HD3 LYS A 519 -11.857 -3.804 13.446 1.00 71.42 H new ATOM 0 HE2 LYS A 519 -12.059 -2.047 15.080 1.00 51.33 H new ATOM 0 HE3 LYS A 519 -10.358 -2.460 14.987 1.00 51.33 H new ATOM 0 HZ1 LYS A 519 -10.847 -0.040 15.012 1.00 72.01 H new ATOM 0 HZ2 LYS A 519 -9.917 -0.539 13.682 1.00 72.01 H new ATOM 0 HZ3 LYS A 519 -11.568 -0.200 13.483 1.00 72.01 H new ATOM 2241 N LYS A 520 -10.860 -6.271 8.804 1.00 52.31 N ATOM 2242 CA LYS A 520 -11.148 -6.661 7.389 1.00 24.24 C ATOM 2243 C LYS A 520 -11.042 -5.445 6.415 1.00 71.51 C ATOM 2244 O LYS A 520 -11.641 -5.442 5.334 1.00 70.03 O ATOM 2245 CB LYS A 520 -12.532 -7.402 7.245 1.00 52.21 C ATOM 2246 CG LYS A 520 -12.563 -8.877 7.742 1.00 43.25 C ATOM 2247 CD LYS A 520 -12.246 -9.024 9.250 1.00 55.34 C ATOM 2248 CE LYS A 520 -12.315 -10.475 9.752 1.00 64.25 C ATOM 2249 NZ LYS A 520 -11.884 -10.582 11.172 1.00 1.21 N ATOM 0 H LYS A 520 -10.027 -6.722 9.183 1.00 52.31 H new ATOM 0 HA LYS A 520 -10.375 -7.373 7.100 1.00 24.24 H new ATOM 0 HB2 LYS A 520 -13.285 -6.837 7.795 1.00 52.21 H new ATOM 0 HB3 LYS A 520 -12.825 -7.385 6.195 1.00 52.21 H new ATOM 0 HG2 LYS A 520 -13.548 -9.299 7.542 1.00 43.25 H new ATOM 0 HG3 LYS A 520 -11.843 -9.461 7.168 1.00 43.25 H new ATOM 0 HD2 LYS A 520 -11.249 -8.628 9.444 1.00 55.34 H new ATOM 0 HD3 LYS A 520 -12.947 -8.416 9.822 1.00 55.34 H new ATOM 0 HE2 LYS A 520 -13.334 -10.848 9.651 1.00 64.25 H new ATOM 0 HE3 LYS A 520 -11.681 -11.107 9.130 1.00 64.25 H new ATOM 0 HZ1 LYS A 520 -12.038 -11.554 11.509 1.00 1.21 H new ATOM 0 HZ2 LYS A 520 -10.874 -10.346 11.247 1.00 1.21 H new ATOM 0 HZ3 LYS A 520 -12.438 -9.921 11.754 1.00 1.21 H new ATOM 2263 N ILE A 521 -10.221 -4.438 6.797 1.00 3.33 N ATOM 2264 CA ILE A 521 -10.009 -3.200 5.996 1.00 20.45 C ATOM 2265 C ILE A 521 -8.536 -3.076 5.545 1.00 63.32 C ATOM 2266 O ILE A 521 -7.623 -3.533 6.240 1.00 61.14 O ATOM 2267 CB ILE A 521 -10.407 -1.903 6.811 1.00 34.33 C ATOM 2268 CG1 ILE A 521 -9.483 -1.716 8.064 1.00 12.04 C ATOM 2269 CG2 ILE A 521 -11.898 -1.953 7.213 1.00 53.30 C ATOM 2270 CD1 ILE A 521 -9.838 -0.551 8.977 1.00 22.21 C ATOM 0 H ILE A 521 -9.687 -4.457 7.666 1.00 3.33 H new ATOM 0 HA ILE A 521 -10.653 -3.279 5.120 1.00 20.45 H new ATOM 0 HB ILE A 521 -10.260 -1.036 6.167 1.00 34.33 H new ATOM 0 HG12 ILE A 521 -9.507 -2.634 8.651 1.00 12.04 H new ATOM 0 HG13 ILE A 521 -8.457 -1.585 7.720 1.00 12.04 H new ATOM 0 HG21 ILE A 521 -12.154 -1.053 7.773 1.00 53.30 H new ATOM 0 HG22 ILE A 521 -12.515 -2.011 6.316 1.00 53.30 H new ATOM 0 HG23 ILE A 521 -12.078 -2.830 7.834 1.00 53.30 H new ATOM 0 HD11 ILE A 521 -9.136 -0.515 9.810 1.00 22.21 H new ATOM 0 HD12 ILE A 521 -9.783 0.381 8.415 1.00 22.21 H new ATOM 0 HD13 ILE A 521 -10.850 -0.684 9.361 1.00 22.21 H new ATOM 2282 N PHE A 522 -8.320 -2.449 4.385 1.00 41.14 N ATOM 2283 CA PHE A 522 -6.971 -2.137 3.867 1.00 14.45 C ATOM 2284 C PHE A 522 -6.640 -0.657 4.157 1.00 62.15 C ATOM 2285 O PHE A 522 -7.266 0.235 3.611 1.00 41.22 O ATOM 2286 CB PHE A 522 -6.903 -2.440 2.349 1.00 73.20 C ATOM 2287 CG PHE A 522 -7.120 -3.915 2.003 1.00 3.42 C ATOM 2288 CD1 PHE A 522 -8.404 -4.426 1.800 1.00 0.52 C ATOM 2289 CD2 PHE A 522 -6.040 -4.789 1.882 1.00 72.20 C ATOM 2290 CE1 PHE A 522 -8.596 -5.757 1.486 1.00 73.30 C ATOM 2291 CE2 PHE A 522 -6.236 -6.120 1.571 1.00 11.40 C ATOM 2292 CZ PHE A 522 -7.513 -6.604 1.372 1.00 63.11 C ATOM 0 H PHE A 522 -9.074 -2.140 3.772 1.00 41.14 H new ATOM 0 HA PHE A 522 -6.231 -2.762 4.367 1.00 14.45 H new ATOM 0 HB2 PHE A 522 -7.655 -1.841 1.835 1.00 73.20 H new ATOM 0 HB3 PHE A 522 -5.931 -2.126 1.969 1.00 73.20 H new ATOM 0 HD1 PHE A 522 -9.258 -3.771 1.890 1.00 0.52 H new ATOM 0 HD2 PHE A 522 -5.036 -4.420 2.034 1.00 72.20 H new ATOM 0 HE1 PHE A 522 -9.595 -6.135 1.329 1.00 73.30 H new ATOM 0 HE2 PHE A 522 -5.388 -6.784 1.483 1.00 11.40 H new ATOM 0 HZ PHE A 522 -7.664 -7.645 1.127 1.00 63.11 H new ATOM 2302 N MET A 523 -5.687 -0.418 5.062 1.00 42.41 N ATOM 2303 CA MET A 523 -5.279 0.956 5.489 1.00 4.43 C ATOM 2304 C MET A 523 -4.256 1.583 4.507 1.00 61.41 C ATOM 2305 O MET A 523 -3.568 0.865 3.795 1.00 41.53 O ATOM 2306 CB MET A 523 -4.685 0.886 6.923 1.00 33.15 C ATOM 2307 CG MET A 523 -5.621 0.221 7.942 1.00 73.23 C ATOM 2308 SD MET A 523 -4.852 -0.011 9.558 1.00 5.31 S ATOM 2309 CE MET A 523 -6.218 -0.684 10.500 1.00 60.21 C ATOM 0 H MET A 523 -5.166 -1.160 5.529 1.00 42.41 H new ATOM 0 HA MET A 523 -6.161 1.597 5.484 1.00 4.43 H new ATOM 0 HB2 MET A 523 -3.745 0.335 6.892 1.00 33.15 H new ATOM 0 HB3 MET A 523 -4.452 1.896 7.261 1.00 33.15 H new ATOM 0 HG2 MET A 523 -6.517 0.831 8.056 1.00 73.23 H new ATOM 0 HG3 MET A 523 -5.941 -0.747 7.556 1.00 73.23 H new ATOM 0 HE1 MET A 523 -5.836 -1.374 11.253 1.00 60.21 H new ATOM 0 HE2 MET A 523 -6.756 0.127 10.991 1.00 60.21 H new ATOM 0 HE3 MET A 523 -6.895 -1.216 9.831 1.00 60.21 H new ATOM 2319 N GLY A 524 -4.152 2.928 4.497 1.00 13.05 N ATOM 2320 CA GLY A 524 -3.241 3.645 3.579 1.00 12.10 C ATOM 2321 C GLY A 524 -2.487 4.796 4.264 1.00 1.14 C ATOM 2322 O GLY A 524 -3.074 5.832 4.558 1.00 22.11 O ATOM 0 H GLY A 524 -4.687 3.540 5.114 1.00 13.05 H new ATOM 0 HA2 GLY A 524 -2.520 2.940 3.166 1.00 12.10 H new ATOM 0 HA3 GLY A 524 -3.815 4.041 2.741 1.00 12.10 H new ATOM 2326 N LEU A 525 -1.186 4.611 4.530 1.00 53.03 N ATOM 2327 CA LEU A 525 -0.330 5.625 5.198 1.00 1.13 C ATOM 2328 C LEU A 525 0.497 6.439 4.167 1.00 54.42 C ATOM 2329 O LEU A 525 1.441 5.913 3.579 1.00 21.44 O ATOM 2330 CB LEU A 525 0.598 4.904 6.217 1.00 30.11 C ATOM 2331 CG LEU A 525 -0.128 4.325 7.477 1.00 44.31 C ATOM 2332 CD1 LEU A 525 0.793 3.401 8.295 1.00 62.42 C ATOM 2333 CD2 LEU A 525 -0.678 5.465 8.365 1.00 14.33 C ATOM 0 H LEU A 525 -0.688 3.754 4.290 1.00 53.03 H new ATOM 0 HA LEU A 525 -0.965 6.338 5.724 1.00 1.13 H new ATOM 0 HB2 LEU A 525 1.111 4.090 5.705 1.00 30.11 H new ATOM 0 HB3 LEU A 525 1.364 5.605 6.548 1.00 30.11 H new ATOM 0 HG LEU A 525 -0.965 3.724 7.121 1.00 44.31 H new ATOM 0 HD11 LEU A 525 0.251 3.020 9.161 1.00 62.42 H new ATOM 0 HD12 LEU A 525 1.116 2.566 7.673 1.00 62.42 H new ATOM 0 HD13 LEU A 525 1.665 3.962 8.631 1.00 62.42 H new ATOM 0 HD21 LEU A 525 -1.179 5.039 9.235 1.00 14.33 H new ATOM 0 HD22 LEU A 525 0.145 6.099 8.694 1.00 14.33 H new ATOM 0 HD23 LEU A 525 -1.389 6.061 7.793 1.00 14.33 H new ATOM 2345 N ILE A 526 0.128 7.727 3.969 1.00 12.53 N ATOM 2346 CA ILE A 526 0.814 8.644 3.018 1.00 13.43 C ATOM 2347 C ILE A 526 1.887 9.486 3.768 1.00 22.31 C ATOM 2348 O ILE A 526 1.529 10.413 4.507 1.00 20.14 O ATOM 2349 CB ILE A 526 -0.178 9.641 2.276 1.00 74.23 C ATOM 2350 CG1 ILE A 526 -1.276 8.903 1.428 1.00 14.22 C ATOM 2351 CG2 ILE A 526 0.618 10.624 1.379 1.00 61.44 C ATOM 2352 CD1 ILE A 526 -2.367 8.203 2.218 1.00 64.32 C ATOM 0 H ILE A 526 -0.652 8.162 4.462 1.00 12.53 H new ATOM 0 HA ILE A 526 1.271 8.006 2.262 1.00 13.43 H new ATOM 0 HB ILE A 526 -0.702 10.194 3.055 1.00 74.23 H new ATOM 0 HG12 ILE A 526 -1.745 9.630 0.765 1.00 14.22 H new ATOM 0 HG13 ILE A 526 -0.783 8.165 0.795 1.00 14.22 H new ATOM 0 HG21 ILE A 526 -0.074 11.300 0.877 1.00 61.44 H new ATOM 0 HG22 ILE A 526 1.308 11.201 1.995 1.00 61.44 H new ATOM 0 HG23 ILE A 526 1.181 10.062 0.634 1.00 61.44 H new ATOM 0 HD11 ILE A 526 -3.067 7.729 1.530 1.00 64.32 H new ATOM 0 HD12 ILE A 526 -1.921 7.444 2.861 1.00 64.32 H new ATOM 0 HD13 ILE A 526 -2.897 8.932 2.831 1.00 64.32 H new ATOM 2364 N PRO A 527 3.214 9.189 3.595 1.00 24.34 N ATOM 2365 CA PRO A 527 4.308 9.894 4.316 1.00 64.21 C ATOM 2366 C PRO A 527 4.577 11.314 3.764 1.00 33.52 C ATOM 2367 O PRO A 527 4.639 11.512 2.556 1.00 45.43 O ATOM 2368 CB PRO A 527 5.548 8.964 4.108 1.00 31.54 C ATOM 2369 CG PRO A 527 5.015 7.732 3.425 1.00 25.21 C ATOM 2370 CD PRO A 527 3.772 8.160 2.692 1.00 52.44 C ATOM 0 HA PRO A 527 4.059 10.056 5.365 1.00 64.21 H new ATOM 0 HB2 PRO A 527 6.308 9.453 3.499 1.00 31.54 H new ATOM 0 HB3 PRO A 527 6.015 8.714 5.060 1.00 31.54 H new ATOM 0 HG2 PRO A 527 5.751 7.321 2.735 1.00 25.21 H new ATOM 0 HG3 PRO A 527 4.789 6.952 4.152 1.00 25.21 H new ATOM 0 HD2 PRO A 527 4.000 8.564 1.706 1.00 52.44 H new ATOM 0 HD3 PRO A 527 3.081 7.330 2.544 1.00 52.44 H new ATOM 2378 N TYR A 528 4.751 12.294 4.664 1.00 52.15 N ATOM 2379 CA TYR A 528 5.174 13.667 4.285 1.00 25.04 C ATOM 2380 C TYR A 528 6.638 13.642 3.766 1.00 74.34 C ATOM 2381 O TYR A 528 7.059 14.502 2.982 1.00 61.22 O ATOM 2382 CB TYR A 528 5.011 14.643 5.489 1.00 12.54 C ATOM 2383 CG TYR A 528 3.552 14.927 5.943 1.00 50.12 C ATOM 2384 CD1 TYR A 528 2.492 14.049 5.657 1.00 71.32 C ATOM 2385 CD2 TYR A 528 3.248 16.077 6.679 1.00 50.15 C ATOM 2386 CE1 TYR A 528 1.203 14.304 6.088 1.00 31.42 C ATOM 2387 CE2 TYR A 528 1.957 16.337 7.108 1.00 30.34 C ATOM 2388 CZ TYR A 528 0.938 15.449 6.809 1.00 44.14 C ATOM 2389 OH TYR A 528 -0.346 15.702 7.244 1.00 10.43 O ATOM 0 H TYR A 528 4.607 12.168 5.666 1.00 52.15 H new ATOM 0 HA TYR A 528 4.533 14.031 3.482 1.00 25.04 H new ATOM 0 HB2 TYR A 528 5.562 14.237 6.337 1.00 12.54 H new ATOM 0 HB3 TYR A 528 5.481 15.592 5.228 1.00 12.54 H new ATOM 0 HD1 TYR A 528 2.689 13.153 5.087 1.00 71.32 H new ATOM 0 HD2 TYR A 528 4.036 16.776 6.918 1.00 50.15 H new ATOM 0 HE1 TYR A 528 0.408 13.610 5.861 1.00 31.42 H new ATOM 0 HE2 TYR A 528 1.746 17.231 7.675 1.00 30.34 H new ATOM 0 HH TYR A 528 -0.363 16.548 7.738 1.00 10.43 H new ATOM 2399 N ASP A 529 7.398 12.631 4.222 1.00 70.03 N ATOM 2400 CA ASP A 529 8.703 12.264 3.650 1.00 52.25 C ATOM 2401 C ASP A 529 8.494 11.308 2.447 1.00 63.51 C ATOM 2402 O ASP A 529 8.563 10.089 2.589 1.00 2.25 O ATOM 2403 CB ASP A 529 9.585 11.601 4.737 1.00 3.34 C ATOM 2404 CG ASP A 529 9.770 12.489 5.973 1.00 54.31 C ATOM 2405 OD1 ASP A 529 10.669 13.355 5.965 1.00 15.55 O ATOM 2406 OD2 ASP A 529 9.013 12.329 6.955 1.00 12.32 O ATOM 0 H ASP A 529 7.120 12.041 5.006 1.00 70.03 H new ATOM 0 HA ASP A 529 9.213 13.160 3.295 1.00 52.25 H new ATOM 0 HB2 ASP A 529 9.134 10.656 5.038 1.00 3.34 H new ATOM 0 HB3 ASP A 529 10.562 11.367 4.313 1.00 3.34 H new ATOM 2411 N GLN A 530 8.195 11.885 1.271 1.00 63.42 N ATOM 2412 CA GLN A 530 7.872 11.115 0.043 1.00 60.13 C ATOM 2413 C GLN A 530 9.126 10.449 -0.577 1.00 43.24 C ATOM 2414 O GLN A 530 9.219 9.217 -0.627 1.00 72.40 O ATOM 2415 CB GLN A 530 7.133 12.041 -0.972 1.00 10.20 C ATOM 2416 CG GLN A 530 5.641 12.282 -0.619 1.00 34.40 C ATOM 2417 CD GLN A 530 4.825 10.983 -0.672 1.00 63.23 C ATOM 2418 OE1 GLN A 530 5.144 10.099 -1.422 1.00 51.13 O ATOM 2419 NE2 GLN A 530 3.784 10.852 0.114 1.00 42.13 N ATOM 0 H GLN A 530 8.169 12.896 1.138 1.00 63.42 H new ATOM 0 HA GLN A 530 7.207 10.295 0.312 1.00 60.13 H new ATOM 0 HB2 GLN A 530 7.647 13.001 -1.016 1.00 10.20 H new ATOM 0 HB3 GLN A 530 7.196 11.600 -1.967 1.00 10.20 H new ATOM 0 HG2 GLN A 530 5.569 12.716 0.378 1.00 34.40 H new ATOM 0 HG3 GLN A 530 5.216 13.007 -1.313 1.00 34.40 H new ATOM 0 HE21 GLN A 530 3.524 11.609 0.746 1.00 42.13 H new ATOM 0 HE22 GLN A 530 3.235 9.993 0.094 1.00 42.13 H new ATOM 2428 N SER A 531 10.090 11.271 -1.031 1.00 13.12 N ATOM 2429 CA SER A 531 11.404 10.786 -1.543 1.00 72.42 C ATOM 2430 C SER A 531 12.206 10.047 -0.443 1.00 14.14 C ATOM 2431 O SER A 531 12.980 9.130 -0.738 1.00 54.51 O ATOM 2432 CB SER A 531 12.235 11.965 -2.099 1.00 52.32 C ATOM 2433 OG SER A 531 11.559 12.616 -3.166 1.00 75.34 O ATOM 0 H SER A 531 9.990 12.286 -1.057 1.00 13.12 H new ATOM 0 HA SER A 531 11.202 10.078 -2.347 1.00 72.42 H new ATOM 0 HB2 SER A 531 12.434 12.681 -1.301 1.00 52.32 H new ATOM 0 HB3 SER A 531 13.201 11.599 -2.447 1.00 52.32 H new ATOM 0 HG SER A 531 12.107 13.358 -3.496 1.00 75.34 H new ATOM 2439 N GLY A 532 12.006 10.485 0.823 1.00 13.11 N ATOM 2440 CA GLY A 532 12.581 9.821 2.002 1.00 35.53 C ATOM 2441 C GLY A 532 12.024 8.410 2.245 1.00 23.12 C ATOM 2442 O GLY A 532 12.758 7.516 2.690 1.00 44.14 O ATOM 0 H GLY A 532 11.443 11.305 1.048 1.00 13.11 H new ATOM 0 HA2 GLY A 532 13.663 9.760 1.883 1.00 35.53 H new ATOM 0 HA3 GLY A 532 12.391 10.434 2.883 1.00 35.53 H new ATOM 2446 N PHE A 533 10.720 8.207 1.949 1.00 34.53 N ATOM 2447 CA PHE A 533 10.081 6.877 2.064 1.00 4.23 C ATOM 2448 C PHE A 533 10.587 5.931 0.958 1.00 42.14 C ATOM 2449 O PHE A 533 10.994 4.812 1.255 1.00 72.51 O ATOM 2450 CB PHE A 533 8.539 6.974 2.026 1.00 73.21 C ATOM 2451 CG PHE A 533 7.825 5.654 2.361 1.00 5.11 C ATOM 2452 CD1 PHE A 533 7.712 5.225 3.684 1.00 50.45 C ATOM 2453 CD2 PHE A 533 7.272 4.851 1.366 1.00 20.55 C ATOM 2454 CE1 PHE A 533 7.074 4.044 3.998 1.00 2.20 C ATOM 2455 CE2 PHE A 533 6.633 3.667 1.679 1.00 75.22 C ATOM 2456 CZ PHE A 533 6.536 3.266 2.997 1.00 11.20 C ATOM 0 H PHE A 533 10.092 8.945 1.630 1.00 34.53 H new ATOM 0 HA PHE A 533 10.362 6.466 3.034 1.00 4.23 H new ATOM 0 HB2 PHE A 533 8.215 7.740 2.730 1.00 73.21 H new ATOM 0 HB3 PHE A 533 8.229 7.302 1.034 1.00 73.21 H new ATOM 0 HD1 PHE A 533 8.131 5.828 4.475 1.00 50.45 H new ATOM 0 HD2 PHE A 533 7.344 5.159 0.333 1.00 20.55 H new ATOM 0 HE1 PHE A 533 6.996 3.729 5.028 1.00 2.20 H new ATOM 0 HE2 PHE A 533 6.210 3.056 0.895 1.00 75.22 H new ATOM 0 HZ PHE A 533 6.037 2.340 3.243 1.00 11.20 H new ATOM 2466 N VAL A 534 10.578 6.409 -0.309 1.00 33.14 N ATOM 2467 CA VAL A 534 11.100 5.640 -1.476 1.00 54.51 C ATOM 2468 C VAL A 534 12.585 5.242 -1.264 1.00 31.15 C ATOM 2469 O VAL A 534 13.004 4.162 -1.678 1.00 65.31 O ATOM 2470 CB VAL A 534 10.969 6.451 -2.826 1.00 75.31 C ATOM 2471 CG1 VAL A 534 11.500 5.642 -4.044 1.00 13.00 C ATOM 2472 CG2 VAL A 534 9.512 6.910 -3.071 1.00 64.24 C ATOM 0 H VAL A 534 10.213 7.329 -0.555 1.00 33.14 H new ATOM 0 HA VAL A 534 10.489 4.740 -1.551 1.00 54.51 H new ATOM 0 HB VAL A 534 11.593 7.339 -2.721 1.00 75.31 H new ATOM 0 HG11 VAL A 534 11.391 6.237 -4.951 1.00 13.00 H new ATOM 0 HG12 VAL A 534 12.552 5.403 -3.891 1.00 13.00 H new ATOM 0 HG13 VAL A 534 10.929 4.719 -4.144 1.00 13.00 H new ATOM 0 HG21 VAL A 534 9.458 7.465 -4.008 1.00 64.24 H new ATOM 0 HG22 VAL A 534 8.860 6.038 -3.128 1.00 64.24 H new ATOM 0 HG23 VAL A 534 9.190 7.551 -2.251 1.00 64.24 H new ATOM 2482 N ASN A 535 13.356 6.131 -0.602 1.00 60.15 N ATOM 2483 CA ASN A 535 14.748 5.858 -0.199 1.00 1.21 C ATOM 2484 C ASN A 535 14.817 4.654 0.777 1.00 52.43 C ATOM 2485 O ASN A 535 15.617 3.745 0.581 1.00 10.25 O ATOM 2486 CB ASN A 535 15.366 7.117 0.457 1.00 32.13 C ATOM 2487 CG ASN A 535 16.865 6.976 0.695 1.00 33.14 C ATOM 2488 OD1 ASN A 535 17.303 6.496 1.731 1.00 42.10 O ATOM 2489 ND2 ASN A 535 17.658 7.385 -0.272 1.00 63.14 N ATOM 0 H ASN A 535 13.028 7.059 -0.333 1.00 60.15 H new ATOM 0 HA ASN A 535 15.321 5.604 -1.091 1.00 1.21 H new ATOM 0 HB2 ASN A 535 15.183 7.982 -0.180 1.00 32.13 H new ATOM 0 HB3 ASN A 535 14.867 7.310 1.407 1.00 32.13 H new ATOM 0 HD21 ASN A 535 18.670 7.306 -0.170 1.00 63.14 H new ATOM 0 HD22 ASN A 535 17.261 7.781 -1.124 1.00 63.14 H new ATOM 2496 N GLY A 536 13.948 4.674 1.813 1.00 62.31 N ATOM 2497 CA GLY A 536 13.848 3.570 2.787 1.00 62.32 C ATOM 2498 C GLY A 536 13.402 2.233 2.165 1.00 10.02 C ATOM 2499 O GLY A 536 13.871 1.160 2.563 1.00 44.22 O ATOM 0 H GLY A 536 13.306 5.446 1.994 1.00 62.31 H new ATOM 0 HA2 GLY A 536 14.817 3.432 3.267 1.00 62.32 H new ATOM 0 HA3 GLY A 536 13.142 3.850 3.569 1.00 62.32 H new ATOM 2503 N ILE A 537 12.498 2.315 1.174 1.00 51.01 N ATOM 2504 CA ILE A 537 12.045 1.155 0.375 1.00 20.52 C ATOM 2505 C ILE A 537 13.185 0.647 -0.538 1.00 32.41 C ATOM 2506 O ILE A 537 13.345 -0.554 -0.733 1.00 53.44 O ATOM 2507 CB ILE A 537 10.776 1.538 -0.485 1.00 52.42 C ATOM 2508 CG1 ILE A 537 9.626 2.047 0.435 1.00 12.54 C ATOM 2509 CG2 ILE A 537 10.273 0.369 -1.369 1.00 23.12 C ATOM 2510 CD1 ILE A 537 9.121 1.041 1.455 1.00 12.33 C ATOM 0 H ILE A 537 12.056 3.192 0.900 1.00 51.01 H new ATOM 0 HA ILE A 537 11.769 0.352 1.059 1.00 20.52 H new ATOM 0 HB ILE A 537 11.086 2.337 -1.158 1.00 52.42 H new ATOM 0 HG12 ILE A 537 9.972 2.935 0.964 1.00 12.54 H new ATOM 0 HG13 ILE A 537 8.790 2.355 -0.192 1.00 12.54 H new ATOM 0 HG21 ILE A 537 9.400 0.691 -1.936 1.00 23.12 H new ATOM 0 HG22 ILE A 537 11.062 0.068 -2.058 1.00 23.12 H new ATOM 0 HG23 ILE A 537 10.002 -0.476 -0.736 1.00 23.12 H new ATOM 0 HD11 ILE A 537 8.323 1.491 2.045 1.00 12.33 H new ATOM 0 HD12 ILE A 537 8.739 0.160 0.939 1.00 12.33 H new ATOM 0 HD13 ILE A 537 9.939 0.749 2.114 1.00 12.33 H new ATOM 2522 N ARG A 538 14.001 1.587 -1.045 1.00 53.35 N ATOM 2523 CA ARG A 538 15.175 1.283 -1.889 1.00 23.32 C ATOM 2524 C ARG A 538 16.259 0.516 -1.091 1.00 11.34 C ATOM 2525 O ARG A 538 16.960 -0.323 -1.652 1.00 52.21 O ATOM 2526 CB ARG A 538 15.754 2.591 -2.489 1.00 54.44 C ATOM 2527 CG ARG A 538 17.027 2.397 -3.339 1.00 54.14 C ATOM 2528 CD ARG A 538 17.505 3.690 -4.006 1.00 10.54 C ATOM 2529 NE ARG A 538 18.764 3.483 -4.744 1.00 72.11 N ATOM 2530 CZ ARG A 538 19.401 4.398 -5.435 1.00 55.04 C ATOM 2531 NH1 ARG A 538 18.918 5.597 -5.577 1.00 53.03 N ATOM 2532 NH2 ARG A 538 20.526 4.102 -5.997 1.00 32.22 N ATOM 0 H ARG A 538 13.866 2.585 -0.881 1.00 53.35 H new ATOM 0 HA ARG A 538 14.850 0.637 -2.705 1.00 23.32 H new ATOM 0 HB2 ARG A 538 14.989 3.062 -3.106 1.00 54.44 H new ATOM 0 HB3 ARG A 538 15.977 3.281 -1.675 1.00 54.44 H new ATOM 0 HG2 ARG A 538 17.823 2.005 -2.706 1.00 54.14 H new ATOM 0 HG3 ARG A 538 16.833 1.649 -4.107 1.00 54.14 H new ATOM 0 HD2 ARG A 538 16.737 4.054 -4.689 1.00 10.54 H new ATOM 0 HD3 ARG A 538 17.649 4.460 -3.248 1.00 10.54 H new ATOM 0 HE ARG A 538 19.174 2.550 -4.715 1.00 72.11 H new ATOM 0 HH11 ARG A 538 18.026 5.842 -5.147 1.00 53.03 H new ATOM 0 HH12 ARG A 538 19.431 6.293 -6.119 1.00 53.03 H new ATOM 0 HH21 ARG A 538 20.912 3.163 -5.902 1.00 32.22 H new ATOM 0 HH22 ARG A 538 21.028 4.808 -6.536 1.00 32.22 H new ATOM 2546 N GLN A 539 16.364 0.797 0.224 1.00 72.54 N ATOM 2547 CA GLN A 539 17.288 0.062 1.133 1.00 23.24 C ATOM 2548 C GLN A 539 16.854 -1.428 1.291 1.00 41.41 C ATOM 2549 O GLN A 539 17.666 -2.291 1.639 1.00 61.25 O ATOM 2550 CB GLN A 539 17.359 0.753 2.527 1.00 2.02 C ATOM 2551 CG GLN A 539 17.632 2.280 2.497 1.00 30.00 C ATOM 2552 CD GLN A 539 18.886 2.709 1.716 1.00 51.04 C ATOM 2553 OE1 GLN A 539 19.888 2.003 1.670 1.00 65.53 O ATOM 2554 NE2 GLN A 539 18.833 3.875 1.087 1.00 31.22 N ATOM 0 H GLN A 539 15.823 1.527 0.687 1.00 72.54 H new ATOM 0 HA GLN A 539 18.281 0.083 0.683 1.00 23.24 H new ATOM 0 HB2 GLN A 539 16.418 0.579 3.049 1.00 2.02 H new ATOM 0 HB3 GLN A 539 18.142 0.272 3.113 1.00 2.02 H new ATOM 0 HG2 GLN A 539 16.766 2.779 2.063 1.00 30.00 H new ATOM 0 HG3 GLN A 539 17.724 2.636 3.523 1.00 30.00 H new ATOM 0 HE21 GLN A 539 17.989 4.445 1.140 1.00 31.22 H new ATOM 0 HE22 GLN A 539 19.636 4.202 0.550 1.00 31.22 H new ATOM 2563 N VAL A 540 15.552 -1.693 1.059 1.00 70.32 N ATOM 2564 CA VAL A 540 14.983 -3.059 0.993 1.00 3.41 C ATOM 2565 C VAL A 540 15.242 -3.694 -0.407 1.00 33.10 C ATOM 2566 O VAL A 540 15.614 -4.868 -0.506 1.00 20.41 O ATOM 2567 CB VAL A 540 13.430 -3.031 1.297 1.00 13.32 C ATOM 2568 CG1 VAL A 540 12.788 -4.441 1.209 1.00 42.43 C ATOM 2569 CG2 VAL A 540 13.146 -2.372 2.675 1.00 23.35 C ATOM 0 H VAL A 540 14.858 -0.960 0.911 1.00 70.32 H new ATOM 0 HA VAL A 540 15.476 -3.669 1.750 1.00 3.41 H new ATOM 0 HB VAL A 540 12.963 -2.422 0.523 1.00 13.32 H new ATOM 0 HG11 VAL A 540 11.722 -4.370 1.426 1.00 42.43 H new ATOM 0 HG12 VAL A 540 12.928 -4.843 0.205 1.00 42.43 H new ATOM 0 HG13 VAL A 540 13.262 -5.103 1.934 1.00 42.43 H new ATOM 0 HG21 VAL A 540 12.072 -2.365 2.860 1.00 23.35 H new ATOM 0 HG22 VAL A 540 13.646 -2.940 3.460 1.00 23.35 H new ATOM 0 HG23 VAL A 540 13.521 -1.348 2.673 1.00 23.35 H new