USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1033 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 497 CYS SG : rot -120:sc= -1.42! USER MOD Set 1.2: A 499 HIS : no HE2:sc= 0.35 K(o=-1.1,f=-7.5!) USER MOD Set 2.1: A 430 GLN : amide:sc= 0.197 K(o=0.53,f=-0.69) USER MOD Set 2.2: A 432 TYR OH : rot -7:sc= 0.27 USER MOD Set 2.3: A 474 HIS :FLIP no HE2:sc= 0.0636 F(o=-0.26,f=0.53) USER MOD Set 3.1: A 409 GLN : amide:sc= 0.212 X(o=0.46,f=0.32) USER MOD Set 3.2: A 424 THR OG1 : rot 180:sc= 0.25 USER MOD Set 4.1: A 398 LYS NZ :NH3+ 156:sc= 0.771 (180deg=-0.0206) USER MOD Set 4.2: A 472 GLN : amide:sc= -1.32! C(o=-0.55!,f=-4.3!) 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 34:sc= -3.2! USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 438 ASN : amide:sc= -0.0083 X(o=-0.0083,f=0) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= -0.879 (180deg=-0.879) USER MOD Single : A 441 THR OG1 : rot 180:sc= 0.242 USER MOD Single : A 443 GLN :FLIP amide:sc= -0.0135 F(o=-0.79,f=-0.014) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 447 LYS NZ :NH3+ 163:sc= 0.516 (180deg=-0.0667) USER MOD Single : A 450 MET CE :methyl 163:sc= -0.0235 (180deg=-0.4) USER MOD Single : A 451 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 455 GLN : amide:sc= -0.797 X(o=-0.8,f=-0.57) USER MOD Single : A 456 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 459 THR OG1 : rot -88:sc= 0.781 USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 468 SER OG : rot 67:sc= 0.701 USER MOD Single : A 470 MET CE :methyl -171:sc= 0 (180deg=-0.178) USER MOD Single : A 476 THR OG1 : rot -51:sc= 1.02 USER MOD Single : A 477 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.8) USER MOD Single : A 478 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0374) USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ -173:sc=-0.00872 (180deg=-0.0771) USER MOD Single : A 487 TYR OH : rot 60:sc= -0.117 USER MOD Single : A 490 MET CE :methyl -120:sc= -0.114 (180deg=-1.42) USER MOD Single : A 492 ASN : amide:sc=-0.00302 X(o=-0.003,f=-0.45) USER MOD Single : A 512 MET CE :methyl 138:sc= -1.46 (180deg=-1.8) USER MOD Single : A 515 TYR OH : rot 75:sc= -0.222 USER MOD Single : A 516 SER OG : rot 140:sc= -0.451 USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 520 LYS NZ :NH3+ 167:sc= 0.777 (180deg=0.665) USER MOD Single : A 523 MET CE :methyl 161:sc= -0.549 (180deg=-0.65) USER MOD Single : A 528 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 GLN : amide:sc= 0.427 K(o=0.43,f=-1.1) USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD Single : A 535 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 539 GLN : amide:sc= -0.173 K(o=-0.17,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 250 N LYS A 398 -16.329 7.838 6.051 1.00 71.44 N ATOM 251 CA LYS A 398 -15.445 8.739 5.273 1.00 40.21 C ATOM 252 C LYS A 398 -16.004 9.101 3.871 1.00 15.11 C ATOM 253 O LYS A 398 -16.888 8.428 3.329 1.00 13.13 O ATOM 254 CB LYS A 398 -14.025 8.123 5.137 1.00 20.54 C ATOM 255 CG LYS A 398 -13.188 8.132 6.436 1.00 60.01 C ATOM 256 CD LYS A 398 -11.709 7.743 6.195 1.00 34.32 C ATOM 257 CE LYS A 398 -10.852 7.814 7.473 1.00 63.21 C ATOM 258 NZ LYS A 398 -11.338 6.885 8.528 1.00 71.20 N ATOM 0 HA LYS A 398 -15.394 9.671 5.836 1.00 40.21 H new ATOM 0 HB2 LYS A 398 -14.122 7.094 4.791 1.00 20.54 H new ATOM 0 HB3 LYS A 398 -13.480 8.668 4.366 1.00 20.54 H new ATOM 0 HG2 LYS A 398 -13.230 9.125 6.884 1.00 60.01 H new ATOM 0 HG3 LYS A 398 -13.630 7.440 7.153 1.00 60.01 H new ATOM 0 HD2 LYS A 398 -11.666 6.731 5.791 1.00 34.32 H new ATOM 0 HD3 LYS A 398 -11.283 8.405 5.441 1.00 34.32 H new ATOM 0 HE2 LYS A 398 -9.817 7.574 7.228 1.00 63.21 H new ATOM 0 HE3 LYS A 398 -10.860 8.834 7.858 1.00 63.21 H new ATOM 0 HZ1 LYS A 398 -10.557 6.654 9.174 1.00 71.20 H new ATOM 0 HZ2 LYS A 398 -12.107 7.338 9.062 1.00 71.20 H new ATOM 0 HZ3 LYS A 398 -11.691 6.012 8.086 1.00 71.20 H new ATOM 272 N LEU A 399 -15.437 10.185 3.316 1.00 51.32 N ATOM 273 CA LEU A 399 -15.800 10.757 2.004 1.00 44.35 C ATOM 274 C LEU A 399 -14.888 10.198 0.879 1.00 3.11 C ATOM 275 O LEU A 399 -13.672 10.058 1.070 1.00 23.03 O ATOM 276 CB LEU A 399 -15.660 12.301 2.093 1.00 64.30 C ATOM 277 CG LEU A 399 -16.186 13.125 0.878 1.00 21.12 C ATOM 278 CD1 LEU A 399 -17.686 12.844 0.619 1.00 42.31 C ATOM 279 CD2 LEU A 399 -15.918 14.631 1.101 1.00 71.42 C ATOM 0 H LEU A 399 -14.691 10.704 3.779 1.00 51.32 H new ATOM 0 HA LEU A 399 -16.826 10.483 1.758 1.00 44.35 H new ATOM 0 HB2 LEU A 399 -16.186 12.639 2.986 1.00 64.30 H new ATOM 0 HB3 LEU A 399 -14.606 12.539 2.234 1.00 64.30 H new ATOM 0 HG LEU A 399 -15.645 12.813 -0.015 1.00 21.12 H new ATOM 0 HD11 LEU A 399 -18.024 13.432 -0.234 1.00 42.31 H new ATOM 0 HD12 LEU A 399 -17.826 11.784 0.407 1.00 42.31 H new ATOM 0 HD13 LEU A 399 -18.265 13.117 1.501 1.00 42.31 H new ATOM 0 HD21 LEU A 399 -16.289 15.197 0.247 1.00 71.42 H new ATOM 0 HD22 LEU A 399 -16.429 14.962 2.005 1.00 71.42 H new ATOM 0 HD23 LEU A 399 -14.846 14.798 1.209 1.00 71.42 H new ATOM 291 N LEU A 400 -15.487 9.887 -0.293 1.00 13.41 N ATOM 292 CA LEU A 400 -14.760 9.342 -1.463 1.00 31.02 C ATOM 293 C LEU A 400 -13.873 10.429 -2.133 1.00 23.54 C ATOM 294 O LEU A 400 -14.378 11.357 -2.775 1.00 21.45 O ATOM 295 CB LEU A 400 -15.774 8.730 -2.481 1.00 45.21 C ATOM 296 CG LEU A 400 -15.160 8.084 -3.768 1.00 31.53 C ATOM 297 CD1 LEU A 400 -14.130 6.988 -3.422 1.00 44.15 C ATOM 298 CD2 LEU A 400 -16.269 7.536 -4.705 1.00 12.25 C ATOM 0 H LEU A 400 -16.487 10.007 -0.455 1.00 13.41 H new ATOM 0 HA LEU A 400 -14.093 8.551 -1.120 1.00 31.02 H new ATOM 0 HB2 LEU A 400 -16.362 7.971 -1.964 1.00 45.21 H new ATOM 0 HB3 LEU A 400 -16.466 9.514 -2.788 1.00 45.21 H new ATOM 0 HG LEU A 400 -14.629 8.871 -4.303 1.00 31.53 H new ATOM 0 HD11 LEU A 400 -13.727 6.564 -4.342 1.00 44.15 H new ATOM 0 HD12 LEU A 400 -13.319 7.422 -2.837 1.00 44.15 H new ATOM 0 HD13 LEU A 400 -14.615 6.202 -2.843 1.00 44.15 H new ATOM 0 HD21 LEU A 400 -15.812 7.094 -5.590 1.00 12.25 H new ATOM 0 HD22 LEU A 400 -16.848 6.778 -4.178 1.00 12.25 H new ATOM 0 HD23 LEU A 400 -16.927 8.351 -5.006 1.00 12.25 H new ATOM 310 N ALA A 401 -12.543 10.304 -1.944 1.00 40.22 N ATOM 311 CA ALA A 401 -11.536 11.250 -2.490 1.00 61.34 C ATOM 312 C ALA A 401 -11.052 10.841 -3.900 1.00 41.13 C ATOM 313 O ALA A 401 -10.809 11.698 -4.764 1.00 74.32 O ATOM 314 CB ALA A 401 -10.337 11.322 -1.532 1.00 11.10 C ATOM 0 H ALA A 401 -12.131 9.542 -1.406 1.00 40.22 H new ATOM 0 HA ALA A 401 -12.011 12.227 -2.580 1.00 61.34 H new ATOM 0 HB1 ALA A 401 -9.595 12.015 -1.929 1.00 11.10 H new ATOM 0 HB2 ALA A 401 -10.672 11.670 -0.555 1.00 11.10 H new ATOM 0 HB3 ALA A 401 -9.891 10.332 -1.432 1.00 11.10 H new ATOM 320 N TRP A 402 -10.906 9.523 -4.112 1.00 10.40 N ATOM 321 CA TRP A 402 -10.338 8.957 -5.356 1.00 5.42 C ATOM 322 C TRP A 402 -10.938 7.565 -5.655 1.00 24.24 C ATOM 323 O TRP A 402 -11.244 6.801 -4.740 1.00 14.11 O ATOM 324 CB TRP A 402 -8.789 8.870 -5.226 1.00 71.14 C ATOM 325 CG TRP A 402 -8.077 8.400 -6.480 1.00 44.11 C ATOM 326 CD1 TRP A 402 -7.735 9.164 -7.558 1.00 71.25 C ATOM 327 CD2 TRP A 402 -7.636 7.062 -6.785 1.00 11.23 C ATOM 328 NE1 TRP A 402 -7.095 8.396 -8.493 1.00 31.20 N ATOM 329 CE2 TRP A 402 -7.024 7.107 -8.048 1.00 70.45 C ATOM 330 CE3 TRP A 402 -7.695 5.840 -6.109 1.00 33.44 C ATOM 331 CZ2 TRP A 402 -6.481 5.977 -8.656 1.00 61.10 C ATOM 332 CZ3 TRP A 402 -7.152 4.720 -6.709 1.00 74.42 C ATOM 333 CH2 TRP A 402 -6.556 4.793 -7.974 1.00 22.34 C ATOM 0 H TRP A 402 -11.177 8.816 -3.428 1.00 10.40 H new ATOM 0 HA TRP A 402 -10.592 9.612 -6.189 1.00 5.42 H new ATOM 0 HB2 TRP A 402 -8.405 9.852 -4.952 1.00 71.14 H new ATOM 0 HB3 TRP A 402 -8.543 8.192 -4.408 1.00 71.14 H new ATOM 0 HD1 TRP A 402 -7.939 10.220 -7.659 1.00 71.25 H new ATOM 0 HE1 TRP A 402 -6.728 8.734 -9.383 1.00 31.20 H new ATOM 0 HE3 TRP A 402 -8.157 5.772 -5.135 1.00 33.44 H new ATOM 0 HZ2 TRP A 402 -6.018 6.034 -9.630 1.00 61.10 H new ATOM 0 HZ3 TRP A 402 -7.188 3.772 -6.193 1.00 74.42 H new ATOM 0 HH2 TRP A 402 -6.148 3.898 -8.420 1.00 22.34 H new ATOM 344 N SER A 403 -11.066 7.239 -6.951 1.00 45.31 N ATOM 345 CA SER A 403 -11.555 5.926 -7.429 1.00 45.23 C ATOM 346 C SER A 403 -10.783 5.521 -8.703 1.00 31.13 C ATOM 347 O SER A 403 -10.614 6.333 -9.621 1.00 44.51 O ATOM 348 CB SER A 403 -13.077 5.981 -7.712 1.00 45.41 C ATOM 349 OG SER A 403 -13.401 6.934 -8.718 1.00 75.41 O ATOM 0 H SER A 403 -10.832 7.882 -7.707 1.00 45.31 H new ATOM 0 HA SER A 403 -11.383 5.179 -6.654 1.00 45.23 H new ATOM 0 HB2 SER A 403 -13.423 4.995 -8.022 1.00 45.41 H new ATOM 0 HB3 SER A 403 -13.607 6.230 -6.793 1.00 45.41 H new ATOM 0 HG SER A 403 -14.370 6.936 -8.867 1.00 75.41 H new ATOM 355 N GLY A 404 -10.323 4.262 -8.748 1.00 4.41 N ATOM 356 CA GLY A 404 -9.511 3.760 -9.861 1.00 22.51 C ATOM 357 C GLY A 404 -9.141 2.284 -9.705 1.00 40.24 C ATOM 358 O GLY A 404 -9.909 1.506 -9.138 1.00 51.10 O ATOM 0 H GLY A 404 -10.502 3.570 -8.020 1.00 4.41 H new ATOM 0 HA2 GLY A 404 -10.058 3.896 -10.794 1.00 22.51 H new ATOM 0 HA3 GLY A 404 -8.599 4.353 -9.936 1.00 22.51 H new ATOM 362 N VAL A 405 -7.967 1.907 -10.229 1.00 14.35 N ATOM 363 CA VAL A 405 -7.442 0.522 -10.193 1.00 12.11 C ATOM 364 C VAL A 405 -6.166 0.434 -9.310 1.00 15.02 C ATOM 365 O VAL A 405 -5.364 1.355 -9.298 1.00 42.15 O ATOM 366 CB VAL A 405 -7.122 0.022 -11.663 1.00 53.22 C ATOM 367 CG1 VAL A 405 -6.441 -1.376 -11.689 1.00 32.51 C ATOM 368 CG2 VAL A 405 -8.399 0.037 -12.542 1.00 4.13 C ATOM 0 H VAL A 405 -7.340 2.561 -10.699 1.00 14.35 H new ATOM 0 HA VAL A 405 -8.206 -0.121 -9.755 1.00 12.11 H new ATOM 0 HB VAL A 405 -6.403 0.725 -12.084 1.00 53.22 H new ATOM 0 HG11 VAL A 405 -6.246 -1.666 -12.721 1.00 32.51 H new ATOM 0 HG12 VAL A 405 -5.500 -1.333 -11.140 1.00 32.51 H new ATOM 0 HG13 VAL A 405 -7.099 -2.110 -11.224 1.00 32.51 H new ATOM 0 HG21 VAL A 405 -8.154 -0.310 -13.546 1.00 4.13 H new ATOM 0 HG22 VAL A 405 -9.150 -0.620 -12.104 1.00 4.13 H new ATOM 0 HG23 VAL A 405 -8.792 1.052 -12.595 1.00 4.13 H new ATOM 378 N LEU A 406 -6.024 -0.657 -8.533 1.00 25.12 N ATOM 379 CA LEU A 406 -4.767 -1.018 -7.836 1.00 63.21 C ATOM 380 C LEU A 406 -4.182 -2.284 -8.496 1.00 31.44 C ATOM 381 O LEU A 406 -4.818 -3.337 -8.471 1.00 24.12 O ATOM 382 CB LEU A 406 -5.017 -1.291 -6.328 1.00 22.51 C ATOM 383 CG LEU A 406 -3.735 -1.546 -5.470 1.00 12.45 C ATOM 384 CD1 LEU A 406 -2.861 -0.273 -5.362 1.00 52.00 C ATOM 385 CD2 LEU A 406 -4.089 -2.107 -4.076 1.00 32.14 C ATOM 0 H LEU A 406 -6.782 -1.320 -8.368 1.00 25.12 H new ATOM 0 HA LEU A 406 -4.069 -0.184 -7.917 1.00 63.21 H new ATOM 0 HB2 LEU A 406 -5.552 -0.440 -5.906 1.00 22.51 H new ATOM 0 HB3 LEU A 406 -5.673 -2.157 -6.237 1.00 22.51 H new ATOM 0 HG LEU A 406 -3.145 -2.303 -5.986 1.00 12.45 H new ATOM 0 HD11 LEU A 406 -1.979 -0.487 -4.759 1.00 52.00 H new ATOM 0 HD12 LEU A 406 -2.551 0.041 -6.359 1.00 52.00 H new ATOM 0 HD13 LEU A 406 -3.437 0.525 -4.892 1.00 52.00 H new ATOM 0 HD21 LEU A 406 -3.174 -2.272 -3.507 1.00 32.14 H new ATOM 0 HD22 LEU A 406 -4.722 -1.394 -3.547 1.00 32.14 H new ATOM 0 HD23 LEU A 406 -4.622 -3.051 -4.188 1.00 32.14 H new ATOM 397 N GLU A 407 -2.983 -2.176 -9.081 1.00 12.02 N ATOM 398 CA GLU A 407 -2.316 -3.289 -9.794 1.00 71.20 C ATOM 399 C GLU A 407 -0.914 -3.542 -9.213 1.00 32.33 C ATOM 400 O GLU A 407 -0.139 -2.604 -9.028 1.00 5.40 O ATOM 401 CB GLU A 407 -2.205 -2.946 -11.298 1.00 72.15 C ATOM 402 CG GLU A 407 -1.537 -4.033 -12.168 1.00 1.23 C ATOM 403 CD GLU A 407 -1.317 -3.576 -13.620 1.00 44.52 C ATOM 404 OE1 GLU A 407 -0.264 -2.958 -13.913 1.00 40.45 O ATOM 405 OE2 GLU A 407 -2.207 -3.790 -14.469 1.00 71.11 O ATOM 0 H GLU A 407 -2.440 -1.313 -9.077 1.00 12.02 H new ATOM 0 HA GLU A 407 -2.911 -4.193 -9.667 1.00 71.20 H new ATOM 0 HB2 GLU A 407 -3.205 -2.755 -11.686 1.00 72.15 H new ATOM 0 HB3 GLU A 407 -1.640 -2.020 -11.403 1.00 72.15 H new ATOM 0 HG2 GLU A 407 -0.578 -4.307 -11.728 1.00 1.23 H new ATOM 0 HG3 GLU A 407 -2.157 -4.929 -12.163 1.00 1.23 H new ATOM 412 N TRP A 408 -0.587 -4.818 -8.968 1.00 3.10 N ATOM 413 CA TRP A 408 0.701 -5.235 -8.392 1.00 35.31 C ATOM 414 C TRP A 408 1.197 -6.558 -9.022 1.00 53.11 C ATOM 415 O TRP A 408 0.507 -7.172 -9.849 1.00 4.04 O ATOM 416 CB TRP A 408 0.550 -5.383 -6.855 1.00 75.22 C ATOM 417 CG TRP A 408 -0.391 -6.488 -6.409 1.00 44.23 C ATOM 418 CD1 TRP A 408 -0.044 -7.759 -6.065 1.00 2.51 C ATOM 419 CD2 TRP A 408 -1.819 -6.415 -6.261 1.00 30.32 C ATOM 420 NE1 TRP A 408 -1.150 -8.471 -5.699 1.00 71.11 N ATOM 421 CE2 TRP A 408 -2.249 -7.675 -5.814 1.00 50.25 C ATOM 422 CE3 TRP A 408 -2.773 -5.411 -6.460 1.00 44.03 C ATOM 423 CZ2 TRP A 408 -3.582 -7.960 -5.560 1.00 73.20 C ATOM 424 CZ3 TRP A 408 -4.101 -5.698 -6.213 1.00 64.02 C ATOM 425 CH2 TRP A 408 -4.491 -6.967 -5.763 1.00 21.23 C ATOM 0 H TRP A 408 -1.214 -5.598 -9.165 1.00 3.10 H new ATOM 0 HA TRP A 408 1.447 -4.472 -8.612 1.00 35.31 H new ATOM 0 HB2 TRP A 408 1.534 -5.568 -6.424 1.00 75.22 H new ATOM 0 HB3 TRP A 408 0.195 -4.437 -6.447 1.00 75.22 H new ATOM 0 HD1 TRP A 408 0.963 -8.149 -6.080 1.00 2.51 H new ATOM 0 HE1 TRP A 408 -1.153 -9.443 -5.389 1.00 71.11 H new ATOM 0 HE3 TRP A 408 -2.476 -4.430 -6.800 1.00 44.03 H new ATOM 0 HZ2 TRP A 408 -3.889 -8.936 -5.213 1.00 73.20 H new ATOM 0 HZ3 TRP A 408 -4.849 -4.935 -6.369 1.00 64.02 H new ATOM 0 HH2 TRP A 408 -5.536 -7.161 -5.573 1.00 21.23 H new ATOM 436 N GLN A 409 2.404 -6.976 -8.619 1.00 50.11 N ATOM 437 CA GLN A 409 2.967 -8.299 -8.950 1.00 25.01 C ATOM 438 C GLN A 409 3.003 -9.174 -7.678 1.00 35.22 C ATOM 439 O GLN A 409 3.635 -8.803 -6.679 1.00 1.42 O ATOM 440 CB GLN A 409 4.393 -8.147 -9.553 1.00 21.32 C ATOM 441 CG GLN A 409 4.440 -7.414 -10.914 1.00 71.33 C ATOM 442 CD GLN A 409 3.710 -8.161 -12.037 1.00 75.13 C ATOM 443 OE1 GLN A 409 3.653 -9.389 -12.058 1.00 31.55 O ATOM 444 NE2 GLN A 409 3.153 -7.425 -12.977 1.00 32.35 N ATOM 0 H GLN A 409 3.026 -6.403 -8.049 1.00 50.11 H new ATOM 0 HA GLN A 409 2.336 -8.782 -9.696 1.00 25.01 H new ATOM 0 HB2 GLN A 409 5.018 -7.607 -8.842 1.00 21.32 H new ATOM 0 HB3 GLN A 409 4.830 -9.138 -9.673 1.00 21.32 H new ATOM 0 HG2 GLN A 409 3.998 -6.424 -10.800 1.00 71.33 H new ATOM 0 HG3 GLN A 409 5.481 -7.267 -11.203 1.00 71.33 H new ATOM 0 HE21 GLN A 409 3.217 -6.408 -12.933 1.00 32.35 H new ATOM 0 HE22 GLN A 409 2.658 -7.872 -13.749 1.00 32.35 H new ATOM 453 N GLU A 410 2.304 -10.321 -7.721 1.00 71.51 N ATOM 454 CA GLU A 410 2.270 -11.299 -6.617 1.00 14.10 C ATOM 455 C GLU A 410 3.577 -12.113 -6.567 1.00 10.30 C ATOM 456 O GLU A 410 4.222 -12.352 -7.601 1.00 42.20 O ATOM 457 CB GLU A 410 1.052 -12.246 -6.756 1.00 75.21 C ATOM 458 CG GLU A 410 -0.308 -11.527 -6.809 1.00 32.04 C ATOM 459 CD GLU A 410 -1.522 -12.479 -6.871 1.00 53.54 C ATOM 460 OE1 GLU A 410 -1.558 -13.358 -7.761 1.00 3.33 O ATOM 461 OE2 GLU A 410 -2.459 -12.338 -6.046 1.00 53.33 O ATOM 0 H GLU A 410 1.743 -10.598 -8.527 1.00 71.51 H new ATOM 0 HA GLU A 410 2.171 -10.746 -5.683 1.00 14.10 H new ATOM 0 HB2 GLU A 410 1.171 -12.841 -7.662 1.00 75.21 H new ATOM 0 HB3 GLU A 410 1.050 -12.941 -5.916 1.00 75.21 H new ATOM 0 HG2 GLU A 410 -0.404 -10.889 -5.930 1.00 32.04 H new ATOM 0 HG3 GLU A 410 -0.328 -10.873 -7.681 1.00 32.04 H new ATOM 649 N LEU A 423 2.957 -13.179 -11.290 1.00 63.13 N ATOM 650 CA LEU A 423 1.486 -13.171 -11.178 1.00 12.44 C ATOM 651 C LEU A 423 0.918 -11.727 -11.135 1.00 20.44 C ATOM 652 O LEU A 423 0.774 -11.132 -10.068 1.00 22.34 O ATOM 653 CB LEU A 423 1.075 -13.987 -9.929 1.00 51.43 C ATOM 654 CG LEU A 423 1.695 -15.418 -9.801 1.00 71.03 C ATOM 655 CD1 LEU A 423 1.254 -16.093 -8.485 1.00 14.04 C ATOM 656 CD2 LEU A 423 1.364 -16.302 -11.031 1.00 62.33 C ATOM 0 HA LEU A 423 1.058 -13.636 -12.066 1.00 12.44 H new ATOM 0 HB2 LEU A 423 1.348 -13.415 -9.042 1.00 51.43 H new ATOM 0 HB3 LEU A 423 -0.011 -14.083 -9.925 1.00 51.43 H new ATOM 0 HG LEU A 423 2.779 -15.305 -9.774 1.00 71.03 H new ATOM 0 HD11 LEU A 423 1.698 -17.086 -8.419 1.00 14.04 H new ATOM 0 HD12 LEU A 423 1.585 -15.491 -7.639 1.00 14.04 H new ATOM 0 HD13 LEU A 423 0.168 -16.179 -8.467 1.00 14.04 H new ATOM 0 HD21 LEU A 423 1.813 -17.287 -10.903 1.00 62.33 H new ATOM 0 HD22 LEU A 423 0.283 -16.405 -11.125 1.00 62.33 H new ATOM 0 HD23 LEU A 423 1.763 -15.836 -11.932 1.00 62.33 H new ATOM 668 N THR A 424 0.635 -11.163 -12.324 1.00 52.43 N ATOM 669 CA THR A 424 0.021 -9.815 -12.455 1.00 61.23 C ATOM 670 C THR A 424 -1.446 -9.844 -11.951 1.00 65.31 C ATOM 671 O THR A 424 -2.267 -10.611 -12.469 1.00 41.15 O ATOM 672 CB THR A 424 0.045 -9.307 -13.941 1.00 15.24 C ATOM 673 OG1 THR A 424 1.379 -9.399 -14.475 1.00 25.40 O ATOM 674 CG2 THR A 424 -0.453 -7.847 -14.074 1.00 12.32 C ATOM 0 H THR A 424 0.821 -11.619 -13.217 1.00 52.43 H new ATOM 0 HA THR A 424 0.611 -9.129 -11.847 1.00 61.23 H new ATOM 0 HB THR A 424 -0.634 -9.947 -14.505 1.00 15.24 H new ATOM 0 HG1 THR A 424 1.383 -9.081 -15.402 1.00 25.40 H new ATOM 0 HG21 THR A 424 -0.417 -7.544 -15.120 1.00 12.32 H new ATOM 0 HG22 THR A 424 -1.479 -7.778 -13.712 1.00 12.32 H new ATOM 0 HG23 THR A 424 0.185 -7.190 -13.484 1.00 12.32 H new ATOM 682 N ARG A 425 -1.763 -9.008 -10.946 1.00 63.11 N ATOM 683 CA ARG A 425 -3.096 -8.986 -10.291 1.00 0.13 C ATOM 684 C ARG A 425 -3.591 -7.528 -10.116 1.00 33.53 C ATOM 685 O ARG A 425 -2.788 -6.632 -9.854 1.00 74.42 O ATOM 686 CB ARG A 425 -2.998 -9.698 -8.913 1.00 60.11 C ATOM 687 CG ARG A 425 -4.359 -10.045 -8.266 1.00 73.14 C ATOM 688 CD ARG A 425 -5.056 -11.250 -8.933 1.00 2.35 C ATOM 689 NE ARG A 425 -4.378 -12.516 -8.610 1.00 24.02 N ATOM 690 CZ ARG A 425 -4.932 -13.707 -8.593 1.00 40.41 C ATOM 691 NH1 ARG A 425 -6.170 -13.886 -8.936 1.00 24.22 N ATOM 692 NH2 ARG A 425 -4.220 -14.720 -8.231 1.00 34.42 N ATOM 0 H ARG A 425 -1.108 -8.327 -10.561 1.00 63.11 H new ATOM 0 HA ARG A 425 -3.816 -9.512 -10.918 1.00 0.13 H new ATOM 0 HB2 ARG A 425 -2.424 -10.617 -9.034 1.00 60.11 H new ATOM 0 HB3 ARG A 425 -2.438 -9.060 -8.229 1.00 60.11 H new ATOM 0 HG2 ARG A 425 -4.208 -10.260 -7.208 1.00 73.14 H new ATOM 0 HG3 ARG A 425 -5.014 -9.176 -8.324 1.00 73.14 H new ATOM 0 HD2 ARG A 425 -6.094 -11.298 -8.604 1.00 2.35 H new ATOM 0 HD3 ARG A 425 -5.071 -11.110 -10.014 1.00 2.35 H new ATOM 0 HE ARG A 425 -3.386 -12.464 -8.378 1.00 24.02 H new ATOM 0 HH11 ARG A 425 -6.738 -13.091 -9.228 1.00 24.22 H new ATOM 0 HH12 ARG A 425 -6.575 -14.822 -8.914 1.00 24.22 H new ATOM 0 HH21 ARG A 425 -3.244 -14.588 -7.964 1.00 34.42 H new ATOM 0 HH22 ARG A 425 -4.633 -15.653 -8.211 1.00 34.42 H new ATOM 706 N SER A 426 -4.922 -7.299 -10.235 1.00 51.04 N ATOM 707 CA SER A 426 -5.514 -5.929 -10.203 1.00 33.34 C ATOM 708 C SER A 426 -6.924 -5.911 -9.556 1.00 23.55 C ATOM 709 O SER A 426 -7.632 -6.927 -9.543 1.00 34.30 O ATOM 710 CB SER A 426 -5.573 -5.331 -11.630 1.00 63.45 C ATOM 711 OG SER A 426 -6.393 -6.107 -12.497 1.00 63.34 O ATOM 0 H SER A 426 -5.610 -8.043 -10.354 1.00 51.04 H new ATOM 0 HA SER A 426 -4.863 -5.314 -9.581 1.00 33.34 H new ATOM 0 HB2 SER A 426 -5.958 -4.312 -11.581 1.00 63.45 H new ATOM 0 HB3 SER A 426 -4.565 -5.271 -12.041 1.00 63.45 H new ATOM 0 HG SER A 426 -6.407 -5.698 -13.387 1.00 63.34 H new ATOM 717 N LEU A 427 -7.322 -4.723 -9.044 1.00 44.25 N ATOM 718 CA LEU A 427 -8.599 -4.503 -8.304 1.00 34.22 C ATOM 719 C LEU A 427 -9.205 -3.107 -8.605 1.00 74.13 C ATOM 720 O LEU A 427 -8.460 -2.176 -8.885 1.00 60.51 O ATOM 721 CB LEU A 427 -8.337 -4.616 -6.772 1.00 53.43 C ATOM 722 CG LEU A 427 -8.239 -6.058 -6.208 1.00 12.02 C ATOM 723 CD1 LEU A 427 -7.736 -6.043 -4.754 1.00 3.55 C ATOM 724 CD2 LEU A 427 -9.603 -6.777 -6.338 1.00 3.32 C ATOM 0 H LEU A 427 -6.762 -3.875 -9.131 1.00 44.25 H new ATOM 0 HA LEU A 427 -9.307 -5.264 -8.632 1.00 34.22 H new ATOM 0 HB2 LEU A 427 -7.409 -4.092 -6.542 1.00 53.43 H new ATOM 0 HB3 LEU A 427 -9.137 -4.094 -6.246 1.00 53.43 H new ATOM 0 HG LEU A 427 -7.510 -6.618 -6.795 1.00 12.02 H new ATOM 0 HD11 LEU A 427 -7.675 -7.065 -4.379 1.00 3.55 H new ATOM 0 HD12 LEU A 427 -6.749 -5.583 -4.715 1.00 3.55 H new ATOM 0 HD13 LEU A 427 -8.427 -5.470 -4.136 1.00 3.55 H new ATOM 0 HD21 LEU A 427 -9.521 -7.788 -5.939 1.00 3.32 H new ATOM 0 HD22 LEU A 427 -10.359 -6.226 -5.779 1.00 3.32 H new ATOM 0 HD23 LEU A 427 -9.891 -6.824 -7.388 1.00 3.32 H new ATOM 736 N PRO A 428 -10.565 -2.935 -8.546 1.00 72.50 N ATOM 737 CA PRO A 428 -11.192 -1.589 -8.513 1.00 73.42 C ATOM 738 C PRO A 428 -11.112 -0.959 -7.084 1.00 42.11 C ATOM 739 O PRO A 428 -11.956 -1.223 -6.225 1.00 12.32 O ATOM 740 CB PRO A 428 -12.651 -1.876 -8.960 1.00 23.15 C ATOM 741 CG PRO A 428 -12.922 -3.281 -8.488 1.00 63.30 C ATOM 742 CD PRO A 428 -11.589 -4.021 -8.556 1.00 73.25 C ATOM 0 HA PRO A 428 -10.697 -0.859 -9.153 1.00 73.42 H new ATOM 0 HB2 PRO A 428 -13.349 -1.167 -8.515 1.00 23.15 H new ATOM 0 HB3 PRO A 428 -12.758 -1.793 -10.042 1.00 23.15 H new ATOM 0 HG2 PRO A 428 -13.315 -3.280 -7.471 1.00 63.30 H new ATOM 0 HG3 PRO A 428 -13.668 -3.766 -9.118 1.00 63.30 H new ATOM 0 HD2 PRO A 428 -11.464 -4.694 -7.708 1.00 73.25 H new ATOM 0 HD3 PRO A 428 -11.516 -4.628 -9.458 1.00 73.25 H new ATOM 750 N CYS A 429 -10.085 -0.115 -6.844 1.00 60.11 N ATOM 751 CA CYS A 429 -9.771 0.419 -5.492 1.00 33.25 C ATOM 752 C CYS A 429 -10.242 1.875 -5.341 1.00 23.01 C ATOM 753 O CYS A 429 -10.130 2.679 -6.267 1.00 2.35 O ATOM 754 CB CYS A 429 -8.250 0.358 -5.236 1.00 32.44 C ATOM 755 SG CYS A 429 -7.266 1.411 -6.322 1.00 3.32 S ATOM 0 H CYS A 429 -9.452 0.216 -7.573 1.00 60.11 H new ATOM 0 HA CYS A 429 -10.298 -0.199 -4.765 1.00 33.25 H new ATOM 0 HB2 CYS A 429 -8.057 0.643 -4.202 1.00 32.44 H new ATOM 0 HB3 CYS A 429 -7.916 -0.673 -5.350 1.00 32.44 H new ATOM 0 HG CYS A 429 -7.934 2.490 -6.602 1.00 3.32 H new ATOM 761 N GLN A 430 -10.761 2.201 -4.146 1.00 75.14 N ATOM 762 CA GLN A 430 -11.309 3.538 -3.829 1.00 5.45 C ATOM 763 C GLN A 430 -10.657 4.088 -2.538 1.00 2.14 C ATOM 764 O GLN A 430 -10.735 3.454 -1.485 1.00 32.40 O ATOM 765 CB GLN A 430 -12.848 3.436 -3.646 1.00 75.20 C ATOM 766 CG GLN A 430 -13.632 2.925 -4.877 1.00 22.44 C ATOM 767 CD GLN A 430 -15.144 2.817 -4.634 1.00 24.52 C ATOM 768 OE1 GLN A 430 -15.593 2.592 -3.517 1.00 55.32 O ATOM 769 NE2 GLN A 430 -15.936 2.951 -5.682 1.00 22.43 N ATOM 0 H GLN A 430 -10.814 1.545 -3.367 1.00 75.14 H new ATOM 0 HA GLN A 430 -11.088 4.221 -4.649 1.00 5.45 H new ATOM 0 HB2 GLN A 430 -13.053 2.773 -2.805 1.00 75.20 H new ATOM 0 HB3 GLN A 430 -13.230 4.420 -3.376 1.00 75.20 H new ATOM 0 HG2 GLN A 430 -13.453 3.596 -5.717 1.00 22.44 H new ATOM 0 HG3 GLN A 430 -13.247 1.947 -5.164 1.00 22.44 H new ATOM 0 HE21 GLN A 430 -15.537 3.138 -6.602 1.00 22.43 H new ATOM 0 HE22 GLN A 430 -16.947 2.867 -5.572 1.00 22.43 H new ATOM 778 N VAL A 431 -10.030 5.273 -2.638 1.00 52.14 N ATOM 779 CA VAL A 431 -9.403 5.973 -1.491 1.00 61.12 C ATOM 780 C VAL A 431 -10.413 6.923 -0.808 1.00 11.41 C ATOM 781 O VAL A 431 -11.054 7.753 -1.465 1.00 5.03 O ATOM 782 CB VAL A 431 -8.128 6.777 -1.944 1.00 21.54 C ATOM 783 CG1 VAL A 431 -7.540 7.652 -0.796 1.00 64.34 C ATOM 784 CG2 VAL A 431 -7.062 5.808 -2.515 1.00 64.55 C ATOM 0 H VAL A 431 -9.941 5.779 -3.519 1.00 52.14 H new ATOM 0 HA VAL A 431 -9.094 5.214 -0.772 1.00 61.12 H new ATOM 0 HB VAL A 431 -8.434 7.466 -2.731 1.00 21.54 H new ATOM 0 HG11 VAL A 431 -6.662 8.187 -1.159 1.00 64.34 H new ATOM 0 HG12 VAL A 431 -8.291 8.370 -0.465 1.00 64.34 H new ATOM 0 HG13 VAL A 431 -7.256 7.013 0.040 1.00 64.34 H new ATOM 0 HG21 VAL A 431 -6.184 6.375 -2.825 1.00 64.55 H new ATOM 0 HG22 VAL A 431 -6.777 5.088 -1.748 1.00 64.55 H new ATOM 0 HG23 VAL A 431 -7.474 5.279 -3.374 1.00 64.55 H new ATOM 794 N TYR A 432 -10.541 6.779 0.520 1.00 70.00 N ATOM 795 CA TYR A 432 -11.457 7.580 1.356 1.00 22.51 C ATOM 796 C TYR A 432 -10.687 8.436 2.383 1.00 42.41 C ATOM 797 O TYR A 432 -9.850 7.923 3.143 1.00 5.40 O ATOM 798 CB TYR A 432 -12.465 6.648 2.076 1.00 3.02 C ATOM 799 CG TYR A 432 -13.558 6.091 1.152 1.00 51.12 C ATOM 800 CD1 TYR A 432 -13.297 5.048 0.266 1.00 54.20 C ATOM 801 CD2 TYR A 432 -14.844 6.629 1.152 1.00 31.14 C ATOM 802 CE1 TYR A 432 -14.277 4.571 -0.574 1.00 33.35 C ATOM 803 CE2 TYR A 432 -15.819 6.151 0.306 1.00 33.15 C ATOM 804 CZ TYR A 432 -15.532 5.121 -0.554 1.00 23.22 C ATOM 805 OH TYR A 432 -16.503 4.646 -1.406 1.00 35.45 O ATOM 0 H TYR A 432 -10.005 6.094 1.053 1.00 70.00 H new ATOM 0 HA TYR A 432 -12.001 8.262 0.703 1.00 22.51 H new ATOM 0 HB2 TYR A 432 -11.921 5.816 2.524 1.00 3.02 H new ATOM 0 HB3 TYR A 432 -12.936 7.197 2.891 1.00 3.02 H new ATOM 0 HD1 TYR A 432 -12.311 4.607 0.238 1.00 54.20 H new ATOM 0 HD2 TYR A 432 -15.080 7.437 1.829 1.00 31.14 H new ATOM 0 HE1 TYR A 432 -14.056 3.760 -1.252 1.00 33.35 H new ATOM 0 HE2 TYR A 432 -16.808 6.586 0.319 1.00 33.15 H new ATOM 0 HH TYR A 432 -16.105 4.005 -2.031 1.00 35.45 H new ATOM 815 N VAL A 433 -10.995 9.746 2.391 1.00 63.13 N ATOM 816 CA VAL A 433 -10.470 10.722 3.374 1.00 23.24 C ATOM 817 C VAL A 433 -11.619 11.271 4.256 1.00 25.41 C ATOM 818 O VAL A 433 -12.767 10.858 4.113 1.00 10.21 O ATOM 819 CB VAL A 433 -9.728 11.915 2.662 1.00 21.32 C ATOM 820 CG1 VAL A 433 -8.534 11.402 1.829 1.00 13.31 C ATOM 821 CG2 VAL A 433 -10.705 12.769 1.801 1.00 4.23 C ATOM 0 H VAL A 433 -11.624 10.166 1.707 1.00 63.13 H new ATOM 0 HA VAL A 433 -9.750 10.200 4.004 1.00 23.24 H new ATOM 0 HB VAL A 433 -9.334 12.571 3.438 1.00 21.32 H new ATOM 0 HG11 VAL A 433 -8.038 12.244 1.347 1.00 13.31 H new ATOM 0 HG12 VAL A 433 -7.828 10.890 2.483 1.00 13.31 H new ATOM 0 HG13 VAL A 433 -8.892 10.708 1.068 1.00 13.31 H new ATOM 0 HG21 VAL A 433 -10.156 13.582 1.326 1.00 4.23 H new ATOM 0 HG22 VAL A 433 -11.158 12.141 1.034 1.00 4.23 H new ATOM 0 HG23 VAL A 433 -11.486 13.183 2.439 1.00 4.23 H new ATOM 831 N ASN A 434 -11.307 12.216 5.158 1.00 64.43 N ATOM 832 CA ASN A 434 -12.327 12.863 6.024 1.00 32.15 C ATOM 833 C ASN A 434 -13.169 13.904 5.207 1.00 42.23 C ATOM 834 O ASN A 434 -12.752 14.349 4.130 1.00 61.40 O ATOM 835 CB ASN A 434 -11.621 13.527 7.245 1.00 22.04 C ATOM 836 CG ASN A 434 -12.583 13.996 8.342 1.00 62.44 C ATOM 837 OD1 ASN A 434 -13.050 15.132 8.337 1.00 11.14 O ATOM 838 ND2 ASN A 434 -12.898 13.126 9.289 1.00 55.44 N ATOM 0 H ASN A 434 -10.357 12.555 5.312 1.00 64.43 H new ATOM 0 HA ASN A 434 -13.022 12.109 6.393 1.00 32.15 H new ATOM 0 HB2 ASN A 434 -10.915 12.816 7.675 1.00 22.04 H new ATOM 0 HB3 ASN A 434 -11.040 14.381 6.896 1.00 22.04 H new ATOM 0 HD21 ASN A 434 -13.541 13.394 10.034 1.00 55.44 H new ATOM 0 HD22 ASN A 434 -12.498 12.188 9.273 1.00 55.44 H new ATOM 884 N ASN A 438 -7.879 18.335 3.800 1.00 30.33 N ATOM 885 CA ASN A 438 -6.811 19.075 3.068 1.00 74.31 C ATOM 886 C ASN A 438 -6.392 18.373 1.740 1.00 34.50 C ATOM 887 O ASN A 438 -6.039 19.045 0.756 1.00 10.41 O ATOM 888 CB ASN A 438 -5.578 19.234 4.010 1.00 25.32 C ATOM 889 CG ASN A 438 -4.394 19.986 3.381 1.00 54.44 C ATOM 890 OD1 ASN A 438 -4.290 21.205 3.469 1.00 21.20 O ATOM 891 ND2 ASN A 438 -3.486 19.263 2.744 1.00 4.24 N ATOM 0 HA ASN A 438 -7.207 20.051 2.787 1.00 74.31 H new ATOM 0 HB2 ASN A 438 -5.890 19.761 4.912 1.00 25.32 H new ATOM 0 HB3 ASN A 438 -5.242 18.244 4.319 1.00 25.32 H new ATOM 0 HD21 ASN A 438 -2.681 19.719 2.315 1.00 4.24 H new ATOM 0 HD22 ASN A 438 -3.592 18.250 2.683 1.00 4.24 H new ATOM 898 N LEU A 439 -6.414 17.024 1.730 1.00 12.21 N ATOM 899 CA LEU A 439 -6.084 16.221 0.529 1.00 60.12 C ATOM 900 C LEU A 439 -7.179 16.376 -0.561 1.00 31.54 C ATOM 901 O LEU A 439 -8.199 15.678 -0.560 1.00 62.43 O ATOM 902 CB LEU A 439 -5.880 14.731 0.920 1.00 21.21 C ATOM 903 CG LEU A 439 -5.411 13.751 -0.209 1.00 15.32 C ATOM 904 CD1 LEU A 439 -4.065 14.189 -0.837 1.00 63.42 C ATOM 905 CD2 LEU A 439 -5.339 12.304 0.332 1.00 14.44 C ATOM 0 H LEU A 439 -6.659 16.462 2.546 1.00 12.21 H new ATOM 0 HA LEU A 439 -5.150 16.593 0.107 1.00 60.12 H new ATOM 0 HB2 LEU A 439 -5.149 14.691 1.727 1.00 21.21 H new ATOM 0 HB3 LEU A 439 -6.821 14.356 1.323 1.00 21.21 H new ATOM 0 HG LEU A 439 -6.152 13.784 -1.008 1.00 15.32 H new ATOM 0 HD11 LEU A 439 -3.779 13.481 -1.615 1.00 63.42 H new ATOM 0 HD12 LEU A 439 -4.173 15.182 -1.273 1.00 63.42 H new ATOM 0 HD13 LEU A 439 -3.295 14.213 -0.066 1.00 63.42 H new ATOM 0 HD21 LEU A 439 -5.012 11.634 -0.463 1.00 14.44 H new ATOM 0 HD22 LEU A 439 -4.630 12.259 1.159 1.00 14.44 H new ATOM 0 HD23 LEU A 439 -6.324 11.997 0.682 1.00 14.44 H new ATOM 917 N LYS A 440 -6.949 17.345 -1.471 1.00 4.03 N ATOM 918 CA LYS A 440 -7.848 17.649 -2.617 1.00 11.52 C ATOM 919 C LYS A 440 -7.516 16.796 -3.874 1.00 33.41 C ATOM 920 O LYS A 440 -8.043 17.064 -4.961 1.00 30.45 O ATOM 921 CB LYS A 440 -7.817 19.194 -2.921 1.00 53.25 C ATOM 922 CG LYS A 440 -6.408 19.873 -2.928 1.00 33.11 C ATOM 923 CD LYS A 440 -5.598 19.701 -4.241 1.00 0.41 C ATOM 924 CE LYS A 440 -6.233 20.431 -5.441 1.00 14.41 C ATOM 925 NZ LYS A 440 -5.325 20.465 -6.614 1.00 4.12 N ATOM 0 H LYS A 440 -6.127 17.948 -1.435 1.00 4.03 H new ATOM 0 HA LYS A 440 -8.864 17.372 -2.336 1.00 11.52 H new ATOM 0 HB2 LYS A 440 -8.281 19.360 -3.893 1.00 53.25 H new ATOM 0 HB3 LYS A 440 -8.437 19.700 -2.181 1.00 53.25 H new ATOM 0 HG2 LYS A 440 -6.535 20.938 -2.735 1.00 33.11 H new ATOM 0 HG3 LYS A 440 -5.823 19.467 -2.103 1.00 33.11 H new ATOM 0 HD2 LYS A 440 -4.586 20.076 -4.089 1.00 0.41 H new ATOM 0 HD3 LYS A 440 -5.513 18.639 -4.472 1.00 0.41 H new ATOM 0 HE2 LYS A 440 -7.163 19.934 -5.717 1.00 14.41 H new ATOM 0 HE3 LYS A 440 -6.489 21.450 -5.151 1.00 14.41 H new ATOM 0 HZ1 LYS A 440 -5.790 20.965 -7.399 1.00 4.12 H new ATOM 0 HZ2 LYS A 440 -4.447 20.961 -6.359 1.00 4.12 H new ATOM 0 HZ3 LYS A 440 -5.100 19.493 -6.907 1.00 4.12 H new ATOM 939 N THR A 441 -6.662 15.760 -3.680 1.00 52.40 N ATOM 940 CA THR A 441 -6.211 14.804 -4.722 1.00 23.34 C ATOM 941 C THR A 441 -5.777 15.505 -6.051 1.00 53.10 C ATOM 942 O THR A 441 -4.699 16.115 -6.074 1.00 64.13 O ATOM 943 CB THR A 441 -7.237 13.618 -4.952 1.00 24.41 C ATOM 944 OG1 THR A 441 -8.521 14.109 -5.391 1.00 3.04 O ATOM 945 CG2 THR A 441 -7.429 12.783 -3.667 1.00 52.31 C ATOM 0 H THR A 441 -6.256 15.561 -2.766 1.00 52.40 H new ATOM 0 HA THR A 441 -5.306 14.342 -4.328 1.00 23.34 H new ATOM 0 HB THR A 441 -6.813 12.984 -5.731 1.00 24.41 H new ATOM 0 HG1 THR A 441 -9.131 13.354 -5.525 1.00 3.04 H new ATOM 0 HG21 THR A 441 -8.138 11.978 -3.859 1.00 52.31 H new ATOM 0 HG22 THR A 441 -6.472 12.359 -3.363 1.00 52.31 H new ATOM 0 HG23 THR A 441 -7.812 13.422 -2.872 1.00 52.31 H new ATOM 953 N GLU A 442 -6.641 15.466 -7.106 1.00 55.35 N ATOM 954 CA GLU A 442 -6.381 16.038 -8.469 1.00 33.54 C ATOM 955 C GLU A 442 -5.207 15.329 -9.219 1.00 45.32 C ATOM 956 O GLU A 442 -5.418 14.663 -10.237 1.00 50.31 O ATOM 957 CB GLU A 442 -6.141 17.575 -8.401 1.00 32.04 C ATOM 958 CG GLU A 442 -5.929 18.270 -9.765 1.00 32.10 C ATOM 959 CD GLU A 442 -5.595 19.766 -9.619 1.00 3.24 C ATOM 960 OE1 GLU A 442 -4.404 20.100 -9.438 1.00 0.30 O ATOM 961 OE2 GLU A 442 -6.523 20.610 -9.622 1.00 22.31 O ATOM 0 H GLU A 442 -7.559 15.027 -7.035 1.00 55.35 H new ATOM 0 HA GLU A 442 -7.283 15.850 -9.051 1.00 33.54 H new ATOM 0 HB2 GLU A 442 -6.994 18.038 -7.904 1.00 32.04 H new ATOM 0 HB3 GLU A 442 -5.268 17.763 -7.776 1.00 32.04 H new ATOM 0 HG2 GLU A 442 -5.122 17.771 -10.302 1.00 32.10 H new ATOM 0 HG3 GLU A 442 -6.829 18.159 -10.369 1.00 32.10 H new ATOM 968 N GLN A 443 -3.983 15.475 -8.669 1.00 43.02 N ATOM 969 CA GLN A 443 -2.704 14.950 -9.223 1.00 35.23 C ATOM 970 C GLN A 443 -2.529 13.402 -9.069 1.00 34.15 C ATOM 971 O GLN A 443 -1.400 12.900 -9.032 1.00 41.51 O ATOM 972 CB GLN A 443 -1.554 15.688 -8.478 1.00 21.44 C ATOM 973 CG GLN A 443 -1.566 17.224 -8.647 1.00 74.54 C ATOM 974 CD GLN A 443 -0.635 17.969 -7.682 1.00 54.20 C ATOM 975 OE1 GLN A 443 -0.536 17.514 -6.445 1.00 1.22 O flip ATOM 976 NE2 GLN A 443 -0.060 18.995 -8.028 1.00 72.31 N flip ATOM 0 H GLN A 443 -3.847 15.980 -7.793 1.00 43.02 H new ATOM 0 HA GLN A 443 -2.695 15.134 -10.297 1.00 35.23 H new ATOM 0 HB2 GLN A 443 -1.615 15.451 -7.416 1.00 21.44 H new ATOM 0 HB3 GLN A 443 -0.599 15.303 -8.836 1.00 21.44 H new ATOM 0 HG2 GLN A 443 -1.281 17.468 -9.670 1.00 74.54 H new ATOM 0 HG3 GLN A 443 -2.584 17.586 -8.505 1.00 74.54 H new ATOM 0 HE21 GLN A 443 -0.148 19.330 -8.987 1.00 72.31 H new ATOM 0 HE22 GLN A 443 0.507 19.513 -7.357 1.00 72.31 H new ATOM 985 N TRP A 444 -3.636 12.652 -9.002 1.00 41.11 N ATOM 986 CA TRP A 444 -3.620 11.178 -8.858 1.00 30.42 C ATOM 987 C TRP A 444 -4.009 10.515 -10.215 1.00 45.05 C ATOM 988 O TRP A 444 -4.955 10.972 -10.868 1.00 64.24 O ATOM 989 CB TRP A 444 -4.601 10.747 -7.726 1.00 71.21 C ATOM 990 CG TRP A 444 -4.223 11.206 -6.323 1.00 63.31 C ATOM 991 CD1 TRP A 444 -3.706 12.419 -5.953 1.00 52.02 C ATOM 992 CD2 TRP A 444 -4.367 10.459 -5.103 1.00 13.01 C ATOM 993 NE1 TRP A 444 -3.510 12.465 -4.604 1.00 55.25 N ATOM 994 CE2 TRP A 444 -3.907 11.278 -4.056 1.00 43.13 C ATOM 995 CE3 TRP A 444 -4.834 9.175 -4.797 1.00 11.10 C ATOM 996 CZ2 TRP A 444 -3.902 10.863 -2.734 1.00 43.32 C ATOM 997 CZ3 TRP A 444 -4.826 8.763 -3.478 1.00 4.44 C ATOM 998 CH2 TRP A 444 -4.359 9.607 -2.460 1.00 53.41 C ATOM 0 H TRP A 444 -4.576 13.046 -9.046 1.00 41.11 H new ATOM 0 HA TRP A 444 -2.618 10.847 -8.586 1.00 30.42 H new ATOM 0 HB2 TRP A 444 -5.593 11.133 -7.961 1.00 71.21 H new ATOM 0 HB3 TRP A 444 -4.674 9.659 -7.727 1.00 71.21 H new ATOM 0 HD1 TRP A 444 -3.484 13.227 -6.635 1.00 52.02 H new ATOM 0 HE1 TRP A 444 -3.129 13.258 -4.088 1.00 55.25 H new ATOM 0 HE3 TRP A 444 -5.193 8.520 -5.576 1.00 11.10 H new ATOM 0 HZ2 TRP A 444 -3.548 11.512 -1.947 1.00 43.32 H new ATOM 0 HZ3 TRP A 444 -5.185 7.776 -3.227 1.00 4.44 H new ATOM 0 HH2 TRP A 444 -4.361 9.256 -1.439 1.00 53.41 H new ATOM 1009 N PRO A 445 -3.272 9.444 -10.674 1.00 64.14 N ATOM 1010 CA PRO A 445 -3.585 8.721 -11.955 1.00 74.01 C ATOM 1011 C PRO A 445 -4.900 7.893 -11.904 1.00 0.45 C ATOM 1012 O PRO A 445 -5.657 7.968 -10.936 1.00 74.13 O ATOM 1013 CB PRO A 445 -2.345 7.802 -12.145 1.00 1.35 C ATOM 1014 CG PRO A 445 -1.816 7.587 -10.760 1.00 70.21 C ATOM 1015 CD PRO A 445 -2.068 8.877 -10.010 1.00 75.33 C ATOM 0 HA PRO A 445 -3.757 9.415 -12.778 1.00 74.01 H new ATOM 0 HB2 PRO A 445 -2.620 6.858 -12.615 1.00 1.35 H new ATOM 0 HB3 PRO A 445 -1.599 8.271 -12.786 1.00 1.35 H new ATOM 0 HG2 PRO A 445 -2.319 6.750 -10.276 1.00 70.21 H new ATOM 0 HG3 PRO A 445 -0.752 7.350 -10.781 1.00 70.21 H new ATOM 0 HD2 PRO A 445 -2.244 8.695 -8.950 1.00 75.33 H new ATOM 0 HD3 PRO A 445 -1.216 9.554 -10.080 1.00 75.33 H new ATOM 1023 N GLN A 446 -5.168 7.118 -12.976 1.00 52.11 N ATOM 1024 CA GLN A 446 -6.345 6.209 -13.037 1.00 63.25 C ATOM 1025 C GLN A 446 -6.031 4.828 -12.405 1.00 14.03 C ATOM 1026 O GLN A 446 -6.940 4.059 -12.078 1.00 14.40 O ATOM 1027 CB GLN A 446 -6.817 6.042 -14.508 1.00 32.31 C ATOM 1028 CG GLN A 446 -5.795 5.370 -15.454 1.00 51.23 C ATOM 1029 CD GLN A 446 -6.305 5.232 -16.887 1.00 52.30 C ATOM 1030 OE1 GLN A 446 -6.114 6.111 -17.721 1.00 41.22 O ATOM 1031 NE2 GLN A 446 -6.965 4.131 -17.186 1.00 34.22 N ATOM 0 H GLN A 446 -4.588 7.100 -13.815 1.00 52.11 H new ATOM 0 HA GLN A 446 -7.149 6.661 -12.456 1.00 63.25 H new ATOM 0 HB2 GLN A 446 -7.735 5.454 -14.514 1.00 32.31 H new ATOM 0 HB3 GLN A 446 -7.066 7.025 -14.907 1.00 32.31 H new ATOM 0 HG2 GLN A 446 -4.874 5.953 -15.457 1.00 51.23 H new ATOM 0 HG3 GLN A 446 -5.546 4.382 -15.067 1.00 51.23 H new ATOM 0 HE21 GLN A 446 -7.111 3.415 -16.475 1.00 34.22 H new ATOM 0 HE22 GLN A 446 -7.330 3.995 -18.129 1.00 34.22 H new ATOM 1040 N LYS A 447 -4.730 4.526 -12.246 1.00 70.23 N ATOM 1041 CA LYS A 447 -4.243 3.261 -11.661 1.00 32.14 C ATOM 1042 C LYS A 447 -3.006 3.516 -10.769 1.00 14.13 C ATOM 1043 O LYS A 447 -2.178 4.371 -11.073 1.00 74.30 O ATOM 1044 CB LYS A 447 -3.899 2.251 -12.792 1.00 12.12 C ATOM 1045 CG LYS A 447 -3.413 0.864 -12.302 1.00 65.01 C ATOM 1046 CD LYS A 447 -3.069 -0.102 -13.458 1.00 3.51 C ATOM 1047 CE LYS A 447 -1.888 0.382 -14.309 1.00 11.52 C ATOM 1048 NZ LYS A 447 -1.510 -0.609 -15.347 1.00 4.31 N ATOM 0 H LYS A 447 -3.979 5.158 -12.522 1.00 70.23 H new ATOM 0 HA LYS A 447 -5.031 2.837 -11.038 1.00 32.14 H new ATOM 0 HB2 LYS A 447 -4.782 2.111 -13.415 1.00 12.12 H new ATOM 0 HB3 LYS A 447 -3.127 2.687 -13.426 1.00 12.12 H new ATOM 0 HG2 LYS A 447 -2.533 0.996 -11.673 1.00 65.01 H new ATOM 0 HG3 LYS A 447 -4.186 0.414 -11.679 1.00 65.01 H new ATOM 0 HD2 LYS A 447 -2.836 -1.084 -13.047 1.00 3.51 H new ATOM 0 HD3 LYS A 447 -3.944 -0.223 -14.096 1.00 3.51 H new ATOM 0 HE2 LYS A 447 -2.148 1.327 -14.787 1.00 11.52 H new ATOM 0 HE3 LYS A 447 -1.031 0.576 -13.664 1.00 11.52 H new ATOM 0 HZ1 LYS A 447 -0.922 -0.147 -16.070 1.00 4.31 H new ATOM 0 HZ2 LYS A 447 -0.973 -1.384 -14.908 1.00 4.31 H new ATOM 0 HZ3 LYS A 447 -2.369 -0.991 -15.791 1.00 4.31 H new ATOM 1062 N LEU A 448 -2.899 2.763 -9.664 1.00 24.11 N ATOM 1063 CA LEU A 448 -1.767 2.820 -8.721 1.00 32.54 C ATOM 1064 C LEU A 448 -0.981 1.489 -8.758 1.00 2.15 C ATOM 1065 O LEU A 448 -1.575 0.412 -8.669 1.00 34.11 O ATOM 1066 CB LEU A 448 -2.297 3.104 -7.290 1.00 14.35 C ATOM 1067 CG LEU A 448 -3.048 4.460 -7.083 1.00 3.34 C ATOM 1068 CD1 LEU A 448 -3.516 4.638 -5.614 1.00 64.12 C ATOM 1069 CD2 LEU A 448 -2.188 5.655 -7.553 1.00 42.13 C ATOM 0 H LEU A 448 -3.610 2.083 -9.394 1.00 24.11 H new ATOM 0 HA LEU A 448 -1.092 3.625 -9.011 1.00 32.54 H new ATOM 0 HB2 LEU A 448 -2.970 2.294 -7.008 1.00 14.35 H new ATOM 0 HB3 LEU A 448 -1.453 3.072 -6.601 1.00 14.35 H new ATOM 0 HG LEU A 448 -3.943 4.435 -7.704 1.00 3.34 H new ATOM 0 HD11 LEU A 448 -4.033 5.592 -5.510 1.00 64.12 H new ATOM 0 HD12 LEU A 448 -4.193 3.827 -5.347 1.00 64.12 H new ATOM 0 HD13 LEU A 448 -2.650 4.621 -4.952 1.00 64.12 H new ATOM 0 HD21 LEU A 448 -2.738 6.583 -7.396 1.00 42.13 H new ATOM 0 HD22 LEU A 448 -1.260 5.682 -6.982 1.00 42.13 H new ATOM 0 HD23 LEU A 448 -1.959 5.544 -8.613 1.00 42.13 H new ATOM 1081 N ILE A 449 0.358 1.571 -8.890 1.00 64.15 N ATOM 1082 CA ILE A 449 1.235 0.382 -9.019 1.00 2.23 C ATOM 1083 C ILE A 449 1.848 0.042 -7.643 1.00 2.10 C ATOM 1084 O ILE A 449 2.731 0.752 -7.153 1.00 22.43 O ATOM 1085 CB ILE A 449 2.372 0.576 -10.119 1.00 44.52 C ATOM 1086 CG1 ILE A 449 1.770 0.677 -11.574 1.00 43.14 C ATOM 1087 CG2 ILE A 449 3.431 -0.567 -10.053 1.00 63.31 C ATOM 1088 CD1 ILE A 449 0.981 1.939 -11.893 1.00 34.03 C ATOM 0 H ILE A 449 0.863 2.457 -8.911 1.00 64.15 H new ATOM 0 HA ILE A 449 0.620 -0.451 -9.360 1.00 2.23 H new ATOM 0 HB ILE A 449 2.868 1.520 -9.893 1.00 44.52 H new ATOM 0 HG12 ILE A 449 2.589 0.596 -12.289 1.00 43.14 H new ATOM 0 HG13 ILE A 449 1.120 -0.183 -11.735 1.00 43.14 H new ATOM 0 HG21 ILE A 449 4.191 -0.403 -10.817 1.00 63.31 H new ATOM 0 HG22 ILE A 449 3.900 -0.572 -9.069 1.00 63.31 H new ATOM 0 HG23 ILE A 449 2.943 -1.526 -10.227 1.00 63.31 H new ATOM 0 HD11 ILE A 449 0.619 1.892 -12.920 1.00 34.03 H new ATOM 0 HD12 ILE A 449 0.133 2.020 -11.213 1.00 34.03 H new ATOM 0 HD13 ILE A 449 1.625 2.810 -11.775 1.00 34.03 H new ATOM 1100 N MET A 450 1.347 -1.037 -7.020 1.00 53.14 N ATOM 1101 CA MET A 450 1.748 -1.457 -5.663 1.00 3.43 C ATOM 1102 C MET A 450 2.899 -2.501 -5.690 1.00 21.23 C ATOM 1103 O MET A 450 3.048 -3.257 -6.652 1.00 54.13 O ATOM 1104 CB MET A 450 0.489 -1.980 -4.911 1.00 63.13 C ATOM 1105 CG MET A 450 0.713 -2.321 -3.429 1.00 42.41 C ATOM 1106 SD MET A 450 1.185 -4.039 -3.159 1.00 35.31 S ATOM 1107 CE MET A 450 -0.415 -4.840 -3.220 1.00 12.44 C ATOM 0 H MET A 450 0.648 -1.647 -7.444 1.00 53.14 H new ATOM 0 HA MET A 450 2.151 -0.599 -5.125 1.00 3.43 H new ATOM 0 HB2 MET A 450 -0.296 -1.227 -4.980 1.00 63.13 H new ATOM 0 HB3 MET A 450 0.123 -2.870 -5.422 1.00 63.13 H new ATOM 0 HG2 MET A 450 1.489 -1.670 -3.026 1.00 42.41 H new ATOM 0 HG3 MET A 450 -0.200 -2.110 -2.872 1.00 42.41 H new ATOM 0 HE1 MET A 450 -0.280 -5.911 -3.373 1.00 12.44 H new ATOM 0 HE2 MET A 450 -0.943 -4.671 -2.281 1.00 12.44 H new ATOM 0 HE3 MET A 450 -0.998 -4.427 -4.043 1.00 12.44 H new ATOM 1117 N GLN A 451 3.714 -2.516 -4.616 1.00 10.41 N ATOM 1118 CA GLN A 451 4.911 -3.382 -4.492 1.00 23.13 C ATOM 1119 C GLN A 451 4.848 -4.239 -3.200 1.00 12.13 C ATOM 1120 O GLN A 451 4.865 -3.699 -2.089 1.00 20.35 O ATOM 1121 CB GLN A 451 6.173 -2.482 -4.477 1.00 63.24 C ATOM 1122 CG GLN A 451 7.501 -3.222 -4.233 1.00 45.32 C ATOM 1123 CD GLN A 451 8.685 -2.266 -4.106 1.00 22.12 C ATOM 1124 OE1 GLN A 451 9.339 -1.938 -5.085 1.00 24.24 O ATOM 1125 NE2 GLN A 451 8.951 -1.791 -2.902 1.00 35.21 N ATOM 0 H GLN A 451 3.561 -1.923 -3.801 1.00 10.41 H new ATOM 0 HA GLN A 451 4.949 -4.066 -5.340 1.00 23.13 H new ATOM 0 HB2 GLN A 451 6.237 -1.957 -5.430 1.00 63.24 H new ATOM 0 HB3 GLN A 451 6.050 -1.724 -3.704 1.00 63.24 H new ATOM 0 HG2 GLN A 451 7.420 -3.818 -3.324 1.00 45.32 H new ATOM 0 HG3 GLN A 451 7.684 -3.915 -5.054 1.00 45.32 H new ATOM 0 HE21 GLN A 451 8.388 -2.083 -2.103 1.00 35.21 H new ATOM 0 HE22 GLN A 451 9.719 -1.133 -2.772 1.00 35.21 H new ATOM 1134 N LEU A 452 4.804 -5.576 -3.353 1.00 43.41 N ATOM 1135 CA LEU A 452 4.775 -6.515 -2.209 1.00 50.33 C ATOM 1136 C LEU A 452 6.189 -6.748 -1.617 1.00 12.32 C ATOM 1137 O LEU A 452 7.056 -7.367 -2.245 1.00 32.31 O ATOM 1138 CB LEU A 452 4.124 -7.853 -2.638 1.00 34.21 C ATOM 1139 CG LEU A 452 2.592 -7.777 -2.934 1.00 5.25 C ATOM 1140 CD1 LEU A 452 2.083 -9.093 -3.543 1.00 11.11 C ATOM 1141 CD2 LEU A 452 1.792 -7.400 -1.653 1.00 33.01 C ATOM 0 H LEU A 452 4.788 -6.035 -4.264 1.00 43.41 H new ATOM 0 HA LEU A 452 4.171 -6.066 -1.420 1.00 50.33 H new ATOM 0 HB2 LEU A 452 4.633 -8.218 -3.530 1.00 34.21 H new ATOM 0 HB3 LEU A 452 4.291 -8.589 -1.852 1.00 34.21 H new ATOM 0 HG LEU A 452 2.431 -6.987 -3.668 1.00 5.25 H new ATOM 0 HD11 LEU A 452 1.014 -9.013 -3.739 1.00 11.11 H new ATOM 0 HD12 LEU A 452 2.610 -9.290 -4.477 1.00 11.11 H new ATOM 0 HD13 LEU A 452 2.264 -9.911 -2.845 1.00 11.11 H new ATOM 0 HD21 LEU A 452 0.729 -7.354 -1.888 1.00 33.01 H new ATOM 0 HD22 LEU A 452 1.961 -8.153 -0.883 1.00 33.01 H new ATOM 0 HD23 LEU A 452 2.125 -6.428 -1.289 1.00 33.01 H new ATOM 1153 N ILE A 453 6.399 -6.216 -0.401 1.00 20.15 N ATOM 1154 CA ILE A 453 7.635 -6.390 0.400 1.00 31.13 C ATOM 1155 C ILE A 453 7.252 -6.822 1.850 1.00 22.22 C ATOM 1156 O ILE A 453 6.185 -6.430 2.337 1.00 32.42 O ATOM 1157 CB ILE A 453 8.516 -5.068 0.440 1.00 40.41 C ATOM 1158 CG1 ILE A 453 7.690 -3.842 0.964 1.00 72.03 C ATOM 1159 CG2 ILE A 453 9.159 -4.769 -0.942 1.00 20.15 C ATOM 1160 CD1 ILE A 453 8.491 -2.552 1.121 1.00 12.43 C ATOM 0 H ILE A 453 5.701 -5.639 0.068 1.00 20.15 H new ATOM 0 HA ILE A 453 8.238 -7.163 -0.076 1.00 31.13 H new ATOM 0 HB ILE A 453 9.328 -5.241 1.147 1.00 40.41 H new ATOM 0 HG12 ILE A 453 6.863 -3.659 0.278 1.00 72.03 H new ATOM 0 HG13 ILE A 453 7.253 -4.101 1.928 1.00 72.03 H new ATOM 0 HG21 ILE A 453 9.754 -3.858 -0.877 1.00 20.15 H new ATOM 0 HG22 ILE A 453 9.800 -5.601 -1.233 1.00 20.15 H new ATOM 0 HG23 ILE A 453 8.375 -4.638 -1.687 1.00 20.15 H new ATOM 0 HD11 ILE A 453 7.838 -1.760 1.488 1.00 12.43 H new ATOM 0 HD12 ILE A 453 9.302 -2.711 1.832 1.00 12.43 H new ATOM 0 HD13 ILE A 453 8.906 -2.262 0.156 1.00 12.43 H new ATOM 1172 N PRO A 454 8.096 -7.652 2.554 1.00 53.52 N ATOM 1173 CA PRO A 454 7.792 -8.112 3.942 1.00 71.30 C ATOM 1174 C PRO A 454 7.692 -6.941 4.965 1.00 64.04 C ATOM 1175 O PRO A 454 8.618 -6.130 5.101 1.00 52.42 O ATOM 1176 CB PRO A 454 8.967 -9.079 4.271 1.00 34.25 C ATOM 1177 CG PRO A 454 10.069 -8.666 3.340 1.00 4.35 C ATOM 1178 CD PRO A 454 9.384 -8.220 2.064 1.00 22.32 C ATOM 0 HA PRO A 454 6.815 -8.591 4.009 1.00 71.30 H new ATOM 0 HB2 PRO A 454 9.274 -8.990 5.313 1.00 34.25 H new ATOM 0 HB3 PRO A 454 8.682 -10.119 4.111 1.00 34.25 H new ATOM 0 HG2 PRO A 454 10.661 -7.858 3.769 1.00 4.35 H new ATOM 0 HG3 PRO A 454 10.751 -9.495 3.149 1.00 4.35 H new ATOM 0 HD2 PRO A 454 9.974 -7.477 1.528 1.00 22.32 H new ATOM 0 HD3 PRO A 454 9.223 -9.053 1.380 1.00 22.32 H new ATOM 1186 N GLN A 455 6.556 -6.893 5.691 1.00 41.43 N ATOM 1187 CA GLN A 455 6.242 -5.843 6.695 1.00 34.33 C ATOM 1188 C GLN A 455 7.260 -5.833 7.880 1.00 54.43 C ATOM 1189 O GLN A 455 7.402 -4.828 8.588 1.00 35.23 O ATOM 1190 CB GLN A 455 4.790 -6.057 7.208 1.00 21.14 C ATOM 1191 CG GLN A 455 4.245 -4.939 8.120 1.00 10.03 C ATOM 1192 CD GLN A 455 2.837 -5.205 8.665 1.00 11.32 C ATOM 1193 OE1 GLN A 455 2.430 -6.351 8.859 1.00 15.55 O ATOM 1194 NE2 GLN A 455 2.089 -4.151 8.937 1.00 11.21 N ATOM 0 H GLN A 455 5.817 -7.590 5.599 1.00 41.43 H new ATOM 0 HA GLN A 455 6.325 -4.868 6.214 1.00 34.33 H new ATOM 0 HB2 GLN A 455 4.129 -6.157 6.347 1.00 21.14 H new ATOM 0 HB3 GLN A 455 4.749 -7.000 7.752 1.00 21.14 H new ATOM 0 HG2 GLN A 455 4.928 -4.804 8.959 1.00 10.03 H new ATOM 0 HG3 GLN A 455 4.236 -4.002 7.563 1.00 10.03 H new ATOM 0 HE21 GLN A 455 2.450 -3.212 8.767 1.00 11.21 H new ATOM 0 HE22 GLN A 455 1.151 -4.276 9.317 1.00 11.21 H new ATOM 1203 N GLN A 456 7.968 -6.962 8.062 1.00 63.31 N ATOM 1204 CA GLN A 456 9.044 -7.108 9.074 1.00 63.24 C ATOM 1205 C GLN A 456 10.197 -6.079 8.864 1.00 30.51 C ATOM 1206 O GLN A 456 10.747 -5.543 9.829 1.00 10.12 O ATOM 1207 CB GLN A 456 9.603 -8.554 9.020 1.00 51.30 C ATOM 1208 CG GLN A 456 10.681 -8.875 10.078 1.00 55.21 C ATOM 1209 CD GLN A 456 11.264 -10.286 9.956 1.00 50.35 C ATOM 1210 OE1 GLN A 456 10.596 -11.219 9.519 1.00 50.04 O ATOM 1211 NE2 GLN A 456 12.517 -10.457 10.332 1.00 43.32 N ATOM 0 H GLN A 456 7.813 -7.806 7.511 1.00 63.31 H new ATOM 0 HA GLN A 456 8.612 -6.908 10.055 1.00 63.24 H new ATOM 0 HB2 GLN A 456 8.775 -9.253 9.142 1.00 51.30 H new ATOM 0 HB3 GLN A 456 10.024 -8.729 8.030 1.00 51.30 H new ATOM 0 HG2 GLN A 456 11.489 -8.149 9.992 1.00 55.21 H new ATOM 0 HG3 GLN A 456 10.249 -8.755 11.072 1.00 55.21 H new ATOM 0 HE21 GLN A 456 13.054 -9.668 10.692 1.00 43.32 H new ATOM 0 HE22 GLN A 456 12.949 -11.378 10.262 1.00 43.32 H new ATOM 1220 N LEU A 457 10.551 -5.813 7.588 1.00 13.21 N ATOM 1221 CA LEU A 457 11.635 -4.859 7.222 1.00 31.04 C ATOM 1222 C LEU A 457 11.206 -3.377 7.426 1.00 52.12 C ATOM 1223 O LEU A 457 12.057 -2.486 7.535 1.00 2.33 O ATOM 1224 CB LEU A 457 12.086 -5.107 5.755 1.00 14.11 C ATOM 1225 CG LEU A 457 12.641 -6.538 5.436 1.00 23.10 C ATOM 1226 CD1 LEU A 457 13.121 -6.644 3.972 1.00 74.13 C ATOM 1227 CD2 LEU A 457 13.757 -6.947 6.427 1.00 71.13 C ATOM 0 H LEU A 457 10.100 -6.248 6.783 1.00 13.21 H new ATOM 0 HA LEU A 457 12.477 -5.039 7.891 1.00 31.04 H new ATOM 0 HB2 LEU A 457 11.238 -4.914 5.098 1.00 14.11 H new ATOM 0 HB3 LEU A 457 12.856 -4.377 5.505 1.00 14.11 H new ATOM 0 HG LEU A 457 11.818 -7.242 5.562 1.00 23.10 H new ATOM 0 HD11 LEU A 457 13.499 -7.649 3.785 1.00 74.13 H new ATOM 0 HD12 LEU A 457 12.287 -6.439 3.300 1.00 74.13 H new ATOM 0 HD13 LEU A 457 13.915 -5.919 3.796 1.00 74.13 H new ATOM 0 HD21 LEU A 457 14.119 -7.944 6.176 1.00 71.13 H new ATOM 0 HD22 LEU A 457 14.580 -6.235 6.362 1.00 71.13 H new ATOM 0 HD23 LEU A 457 13.359 -6.950 7.442 1.00 71.13 H new ATOM 1239 N LEU A 458 9.882 -3.136 7.488 1.00 70.12 N ATOM 1240 CA LEU A 458 9.303 -1.782 7.710 1.00 54.43 C ATOM 1241 C LEU A 458 9.522 -1.246 9.146 1.00 15.43 C ATOM 1242 O LEU A 458 9.377 -0.044 9.382 1.00 3.31 O ATOM 1243 CB LEU A 458 7.788 -1.785 7.416 1.00 24.25 C ATOM 1244 CG LEU A 458 7.355 -2.142 5.966 1.00 55.31 C ATOM 1245 CD1 LEU A 458 5.829 -1.987 5.815 1.00 51.20 C ATOM 1246 CD2 LEU A 458 8.123 -1.299 4.919 1.00 62.04 C ATOM 0 H LEU A 458 9.179 -3.868 7.387 1.00 70.12 H new ATOM 0 HA LEU A 458 9.831 -1.121 7.022 1.00 54.43 H new ATOM 0 HB2 LEU A 458 7.312 -2.491 8.096 1.00 24.25 H new ATOM 0 HB3 LEU A 458 7.394 -0.797 7.655 1.00 24.25 H new ATOM 0 HG LEU A 458 7.612 -3.184 5.777 1.00 55.31 H new ATOM 0 HD11 LEU A 458 5.537 -2.239 4.796 1.00 51.20 H new ATOM 0 HD12 LEU A 458 5.325 -2.655 6.513 1.00 51.20 H new ATOM 0 HD13 LEU A 458 5.545 -0.957 6.029 1.00 51.20 H new ATOM 0 HD21 LEU A 458 7.794 -1.576 3.917 1.00 62.04 H new ATOM 0 HD22 LEU A 458 7.924 -0.241 5.087 1.00 62.04 H new ATOM 0 HD23 LEU A 458 9.193 -1.486 5.015 1.00 62.04 H new ATOM 1258 N THR A 459 9.831 -2.147 10.099 1.00 72.33 N ATOM 1259 CA THR A 459 10.019 -1.793 11.539 1.00 2.50 C ATOM 1260 C THR A 459 11.158 -0.761 11.759 1.00 13.23 C ATOM 1261 O THR A 459 11.151 -0.017 12.748 1.00 74.34 O ATOM 1262 CB THR A 459 10.302 -3.067 12.397 1.00 50.14 C ATOM 1263 OG1 THR A 459 11.505 -3.716 11.934 1.00 11.34 O ATOM 1264 CG2 THR A 459 9.119 -4.060 12.346 1.00 73.52 C ATOM 0 H THR A 459 9.959 -3.140 9.904 1.00 72.33 H new ATOM 0 HA THR A 459 9.085 -1.334 11.862 1.00 2.50 H new ATOM 0 HB THR A 459 10.432 -2.750 13.432 1.00 50.14 H new ATOM 0 HG1 THR A 459 11.282 -4.346 11.217 1.00 11.34 H new ATOM 0 HG21 THR A 459 9.351 -4.934 12.954 1.00 73.52 H new ATOM 0 HG22 THR A 459 8.222 -3.577 12.733 1.00 73.52 H new ATOM 0 HG23 THR A 459 8.949 -4.370 11.315 1.00 73.52 H new ATOM 1272 N THR A 460 12.127 -0.730 10.820 1.00 11.31 N ATOM 1273 CA THR A 460 13.208 0.288 10.784 1.00 34.00 C ATOM 1274 C THR A 460 12.644 1.711 10.521 1.00 4.21 C ATOM 1275 O THR A 460 13.104 2.695 11.116 1.00 1.44 O ATOM 1276 CB THR A 460 14.263 -0.067 9.677 1.00 3.03 C ATOM 1277 OG1 THR A 460 14.778 -1.388 9.905 1.00 42.45 O ATOM 1278 CG2 THR A 460 15.442 0.929 9.624 1.00 54.35 C ATOM 0 H THR A 460 12.185 -1.410 10.062 1.00 11.31 H new ATOM 0 HA THR A 460 13.690 0.283 11.762 1.00 34.00 H new ATOM 0 HB THR A 460 13.744 -0.011 8.720 1.00 3.03 H new ATOM 0 HG1 THR A 460 15.435 -1.607 9.212 1.00 42.45 H new ATOM 0 HG21 THR A 460 16.136 0.629 8.839 1.00 54.35 H new ATOM 0 HG22 THR A 460 15.064 1.929 9.412 1.00 54.35 H new ATOM 0 HG23 THR A 460 15.959 0.933 10.584 1.00 54.35 H new ATOM 1286 N LEU A 461 11.607 1.794 9.664 1.00 2.23 N ATOM 1287 CA LEU A 461 11.025 3.082 9.192 1.00 22.14 C ATOM 1288 C LEU A 461 9.942 3.630 10.168 1.00 33.23 C ATOM 1289 O LEU A 461 9.016 4.322 9.735 1.00 52.23 O ATOM 1290 CB LEU A 461 10.407 2.895 7.769 1.00 15.02 C ATOM 1291 CG LEU A 461 11.278 2.140 6.705 1.00 70.31 C ATOM 1292 CD1 LEU A 461 10.585 2.122 5.323 1.00 63.31 C ATOM 1293 CD2 LEU A 461 12.716 2.708 6.613 1.00 22.44 C ATOM 0 H LEU A 461 11.143 0.973 9.275 1.00 2.23 H new ATOM 0 HA LEU A 461 11.834 3.812 9.154 1.00 22.14 H new ATOM 0 HB2 LEU A 461 9.465 2.358 7.877 1.00 15.02 H new ATOM 0 HB3 LEU A 461 10.168 3.881 7.372 1.00 15.02 H new ATOM 0 HG LEU A 461 11.371 1.108 7.044 1.00 70.31 H new ATOM 0 HD11 LEU A 461 11.214 1.592 4.608 1.00 63.31 H new ATOM 0 HD12 LEU A 461 9.623 1.617 5.405 1.00 63.31 H new ATOM 0 HD13 LEU A 461 10.429 3.145 4.981 1.00 63.31 H new ATOM 0 HD21 LEU A 461 13.279 2.152 5.863 1.00 22.44 H new ATOM 0 HD22 LEU A 461 12.674 3.760 6.330 1.00 22.44 H new ATOM 0 HD23 LEU A 461 13.208 2.612 7.581 1.00 22.44 H new ATOM 1305 N GLY A 462 10.100 3.349 11.482 1.00 4.34 N ATOM 1306 CA GLY A 462 9.175 3.826 12.532 1.00 54.54 C ATOM 1307 C GLY A 462 8.845 5.335 12.454 1.00 62.01 C ATOM 1308 O GLY A 462 7.676 5.683 12.285 1.00 14.54 O ATOM 0 H GLY A 462 10.871 2.786 11.842 1.00 4.34 H new ATOM 0 HA2 GLY A 462 8.246 3.259 12.466 1.00 54.54 H new ATOM 0 HA3 GLY A 462 9.611 3.612 13.508 1.00 54.54 H new ATOM 1312 N PRO A 463 9.866 6.263 12.535 1.00 55.14 N ATOM 1313 CA PRO A 463 9.647 7.738 12.404 1.00 51.22 C ATOM 1314 C PRO A 463 8.991 8.162 11.057 1.00 62.52 C ATOM 1315 O PRO A 463 8.257 9.157 11.008 1.00 72.11 O ATOM 1316 CB PRO A 463 11.081 8.335 12.548 1.00 24.32 C ATOM 1317 CG PRO A 463 12.003 7.189 12.249 1.00 21.25 C ATOM 1318 CD PRO A 463 11.303 5.963 12.789 1.00 71.21 C ATOM 0 HA PRO A 463 8.943 8.099 13.153 1.00 51.22 H new ATOM 0 HB2 PRO A 463 11.238 9.161 11.854 1.00 24.32 H new ATOM 0 HB3 PRO A 463 11.248 8.726 13.552 1.00 24.32 H new ATOM 0 HG2 PRO A 463 12.184 7.099 11.178 1.00 21.25 H new ATOM 0 HG3 PRO A 463 12.973 7.330 12.725 1.00 21.25 H new ATOM 0 HD2 PRO A 463 11.623 5.056 12.276 1.00 71.21 H new ATOM 0 HD3 PRO A 463 11.504 5.817 13.850 1.00 71.21 H new ATOM 1326 N LEU A 464 9.254 7.390 9.975 1.00 33.22 N ATOM 1327 CA LEU A 464 8.656 7.637 8.639 1.00 53.03 C ATOM 1328 C LEU A 464 7.123 7.410 8.649 1.00 30.43 C ATOM 1329 O LEU A 464 6.373 8.208 8.080 1.00 43.52 O ATOM 1330 CB LEU A 464 9.352 6.769 7.556 1.00 43.43 C ATOM 1331 CG LEU A 464 10.817 7.196 7.199 1.00 11.42 C ATOM 1332 CD1 LEU A 464 11.485 6.194 6.237 1.00 13.13 C ATOM 1333 CD2 LEU A 464 10.848 8.632 6.616 1.00 41.14 C ATOM 0 H LEU A 464 9.881 6.586 10.002 1.00 33.22 H new ATOM 0 HA LEU A 464 8.822 8.685 8.388 1.00 53.03 H new ATOM 0 HB2 LEU A 464 9.365 5.734 7.896 1.00 43.43 H new ATOM 0 HB3 LEU A 464 8.750 6.799 6.648 1.00 43.43 H new ATOM 0 HG LEU A 464 11.394 7.191 8.124 1.00 11.42 H new ATOM 0 HD11 LEU A 464 12.499 6.525 6.013 1.00 13.13 H new ATOM 0 HD12 LEU A 464 11.519 5.209 6.703 1.00 13.13 H new ATOM 0 HD13 LEU A 464 10.910 6.138 5.313 1.00 13.13 H new ATOM 0 HD21 LEU A 464 11.876 8.905 6.376 1.00 41.14 H new ATOM 0 HD22 LEU A 464 10.242 8.670 5.711 1.00 41.14 H new ATOM 0 HD23 LEU A 464 10.449 9.332 7.350 1.00 41.14 H new ATOM 1345 N PHE A 465 6.673 6.337 9.333 1.00 73.35 N ATOM 1346 CA PHE A 465 5.226 6.040 9.505 1.00 33.24 C ATOM 1347 C PHE A 465 4.542 7.023 10.486 1.00 35.53 C ATOM 1348 O PHE A 465 3.356 7.340 10.322 1.00 10.14 O ATOM 1349 CB PHE A 465 5.020 4.581 9.984 1.00 64.03 C ATOM 1350 CG PHE A 465 5.431 3.530 8.956 1.00 0.42 C ATOM 1351 CD1 PHE A 465 4.807 3.479 7.709 1.00 31.45 C ATOM 1352 CD2 PHE A 465 6.431 2.598 9.225 1.00 65.14 C ATOM 1353 CE1 PHE A 465 5.171 2.537 6.774 1.00 13.04 C ATOM 1354 CE2 PHE A 465 6.791 1.657 8.283 1.00 2.52 C ATOM 1355 CZ PHE A 465 6.159 1.627 7.060 1.00 14.32 C ATOM 0 H PHE A 465 7.289 5.657 9.778 1.00 73.35 H new ATOM 0 HA PHE A 465 4.756 6.166 8.529 1.00 33.24 H new ATOM 0 HB2 PHE A 465 5.593 4.425 10.898 1.00 64.03 H new ATOM 0 HB3 PHE A 465 3.970 4.437 10.237 1.00 64.03 H new ATOM 0 HD1 PHE A 465 4.027 4.189 7.474 1.00 31.45 H new ATOM 0 HD2 PHE A 465 6.930 2.613 10.183 1.00 65.14 H new ATOM 0 HE1 PHE A 465 4.679 2.513 5.813 1.00 13.04 H new ATOM 0 HE2 PHE A 465 7.570 0.943 8.505 1.00 2.52 H new ATOM 0 HZ PHE A 465 6.440 0.887 6.325 1.00 14.32 H new ATOM 1365 N ARG A 466 5.292 7.501 11.506 1.00 2.45 N ATOM 1366 CA ARG A 466 4.794 8.533 12.463 1.00 61.54 C ATOM 1367 C ARG A 466 4.547 9.893 11.753 1.00 51.43 C ATOM 1368 O ARG A 466 3.737 10.707 12.207 1.00 61.10 O ATOM 1369 CB ARG A 466 5.787 8.723 13.645 1.00 33.54 C ATOM 1370 CG ARG A 466 6.083 7.436 14.448 1.00 54.22 C ATOM 1371 CD ARG A 466 6.994 7.679 15.671 1.00 34.34 C ATOM 1372 NE ARG A 466 6.287 8.361 16.773 1.00 70.31 N ATOM 1373 CZ ARG A 466 6.839 8.803 17.881 1.00 62.31 C ATOM 1374 NH1 ARG A 466 8.128 8.809 18.046 1.00 0.21 N ATOM 1375 NH2 ARG A 466 6.084 9.269 18.821 1.00 14.54 N ATOM 0 H ARG A 466 6.246 7.192 11.693 1.00 2.45 H new ATOM 0 HA ARG A 466 3.843 8.175 12.858 1.00 61.54 H new ATOM 0 HB2 ARG A 466 6.726 9.116 13.254 1.00 33.54 H new ATOM 0 HB3 ARG A 466 5.384 9.475 14.324 1.00 33.54 H new ATOM 0 HG2 ARG A 466 5.142 7.001 14.785 1.00 54.22 H new ATOM 0 HG3 ARG A 466 6.555 6.706 13.791 1.00 54.22 H new ATOM 0 HD2 ARG A 466 7.381 6.725 16.027 1.00 34.34 H new ATOM 0 HD3 ARG A 466 7.852 8.278 15.368 1.00 34.34 H new ATOM 0 HE ARG A 466 5.282 8.501 16.665 1.00 70.31 H new ATOM 0 HH11 ARG A 466 8.739 8.465 17.305 1.00 0.21 H new ATOM 0 HH12 ARG A 466 8.529 9.158 18.917 1.00 0.21 H new ATOM 0 HH21 ARG A 466 5.072 9.291 18.698 1.00 14.54 H new ATOM 0 HH22 ARG A 466 6.501 9.615 19.685 1.00 14.54 H new ATOM 1389 N ASN A 467 5.259 10.114 10.633 1.00 0.23 N ATOM 1390 CA ASN A 467 5.104 11.310 9.767 1.00 74.00 C ATOM 1391 C ASN A 467 4.290 10.971 8.485 1.00 20.14 C ATOM 1392 O ASN A 467 4.557 11.502 7.406 1.00 1.45 O ATOM 1393 CB ASN A 467 6.515 11.860 9.413 1.00 35.41 C ATOM 1394 CG ASN A 467 7.275 12.386 10.636 1.00 62.21 C ATOM 1395 OD1 ASN A 467 6.689 12.954 11.555 1.00 3.11 O ATOM 1396 ND2 ASN A 467 8.577 12.185 10.676 1.00 43.14 N ATOM 0 H ASN A 467 5.968 9.463 10.295 1.00 0.23 H new ATOM 0 HA ASN A 467 4.545 12.077 10.303 1.00 74.00 H new ATOM 0 HB2 ASN A 467 7.099 11.070 8.941 1.00 35.41 H new ATOM 0 HB3 ASN A 467 6.414 12.662 8.682 1.00 35.41 H new ATOM 0 HD21 ASN A 467 9.118 12.503 11.480 1.00 43.14 H new ATOM 0 HD22 ASN A 467 9.044 11.711 9.903 1.00 43.14 H new ATOM 1403 N SER A 468 3.270 10.103 8.627 1.00 53.10 N ATOM 1404 CA SER A 468 2.377 9.704 7.500 1.00 71.42 C ATOM 1405 C SER A 468 0.871 9.908 7.845 1.00 63.42 C ATOM 1406 O SER A 468 0.509 10.105 9.007 1.00 64.22 O ATOM 1407 CB SER A 468 2.619 8.222 7.119 1.00 42.31 C ATOM 1408 OG SER A 468 3.930 8.003 6.637 1.00 33.22 O ATOM 0 H SER A 468 3.036 9.657 9.514 1.00 53.10 H new ATOM 0 HA SER A 468 2.622 10.349 6.656 1.00 71.42 H new ATOM 0 HB2 SER A 468 2.444 7.591 7.990 1.00 42.31 H new ATOM 0 HB3 SER A 468 1.899 7.922 6.358 1.00 42.31 H new ATOM 0 HG SER A 468 4.574 8.149 7.362 1.00 33.22 H new ATOM 1414 N ARG A 469 0.012 9.852 6.803 1.00 53.22 N ATOM 1415 CA ARG A 469 -1.479 9.979 6.921 1.00 74.53 C ATOM 1416 C ARG A 469 -2.207 8.656 6.567 1.00 75.34 C ATOM 1417 O ARG A 469 -1.997 8.128 5.488 1.00 43.43 O ATOM 1418 CB ARG A 469 -1.991 11.082 5.950 1.00 23.55 C ATOM 1419 CG ARG A 469 -1.631 12.532 6.332 1.00 51.52 C ATOM 1420 CD ARG A 469 -2.178 13.549 5.307 1.00 11.42 C ATOM 1421 NE ARG A 469 -2.049 14.951 5.766 1.00 62.22 N ATOM 1422 CZ ARG A 469 -3.011 15.858 5.717 1.00 60.44 C ATOM 1423 NH1 ARG A 469 -4.176 15.560 5.261 1.00 0.54 N ATOM 1424 NH2 ARG A 469 -2.796 17.051 6.138 1.00 11.50 N ATOM 0 H ARG A 469 0.326 9.716 5.842 1.00 53.22 H new ATOM 0 HA ARG A 469 -1.696 10.234 7.958 1.00 74.53 H new ATOM 0 HB2 ARG A 469 -1.592 10.878 4.956 1.00 23.55 H new ATOM 0 HB3 ARG A 469 -3.076 11.003 5.880 1.00 23.55 H new ATOM 0 HG2 ARG A 469 -2.034 12.758 7.319 1.00 51.52 H new ATOM 0 HG3 ARG A 469 -0.548 12.631 6.400 1.00 51.52 H new ATOM 0 HD2 ARG A 469 -1.645 13.430 4.364 1.00 11.42 H new ATOM 0 HD3 ARG A 469 -3.228 13.331 5.110 1.00 11.42 H new ATOM 0 HE ARG A 469 -1.149 15.240 6.150 1.00 62.22 H new ATOM 0 HH11 ARG A 469 -4.368 14.614 4.931 1.00 0.54 H new ATOM 0 HH12 ARG A 469 -4.908 16.270 5.229 1.00 0.54 H new ATOM 0 HH21 ARG A 469 -1.881 17.303 6.512 1.00 11.50 H new ATOM 0 HH22 ARG A 469 -3.540 17.748 6.099 1.00 11.50 H new ATOM 1438 N MET A 470 -3.117 8.165 7.433 1.00 62.32 N ATOM 1439 CA MET A 470 -3.927 6.949 7.132 1.00 73.22 C ATOM 1440 C MET A 470 -5.181 7.284 6.290 1.00 0.00 C ATOM 1441 O MET A 470 -6.022 8.097 6.687 1.00 42.54 O ATOM 1442 CB MET A 470 -4.339 6.203 8.442 1.00 4.24 C ATOM 1443 CG MET A 470 -3.331 5.149 8.897 1.00 32.33 C ATOM 1444 SD MET A 470 -3.659 4.518 10.559 1.00 5.35 S ATOM 1445 CE MET A 470 -2.229 3.468 10.830 1.00 41.34 C ATOM 0 H MET A 470 -3.314 8.583 8.342 1.00 62.32 H new ATOM 0 HA MET A 470 -3.293 6.288 6.541 1.00 73.22 H new ATOM 0 HB2 MET A 470 -4.470 6.935 9.239 1.00 4.24 H new ATOM 0 HB3 MET A 470 -5.306 5.724 8.287 1.00 4.24 H new ATOM 0 HG2 MET A 470 -3.341 4.318 8.192 1.00 32.33 H new ATOM 0 HG3 MET A 470 -2.329 5.578 8.870 1.00 32.33 H new ATOM 0 HE1 MET A 470 -2.370 2.889 11.743 1.00 41.34 H new ATOM 0 HE2 MET A 470 -2.110 2.790 9.985 1.00 41.34 H new ATOM 0 HE3 MET A 470 -1.337 4.086 10.927 1.00 41.34 H new ATOM 1455 N VAL A 471 -5.281 6.637 5.121 1.00 4.21 N ATOM 1456 CA VAL A 471 -6.504 6.630 4.270 1.00 74.54 C ATOM 1457 C VAL A 471 -7.063 5.185 4.179 1.00 21.14 C ATOM 1458 O VAL A 471 -6.363 4.223 4.509 1.00 44.11 O ATOM 1459 CB VAL A 471 -6.234 7.217 2.826 1.00 22.31 C ATOM 1460 CG1 VAL A 471 -5.742 8.687 2.897 1.00 63.14 C ATOM 1461 CG2 VAL A 471 -5.246 6.334 2.015 1.00 32.24 C ATOM 0 H VAL A 471 -4.513 6.095 4.725 1.00 4.21 H new ATOM 0 HA VAL A 471 -7.243 7.280 4.739 1.00 74.54 H new ATOM 0 HB VAL A 471 -7.186 7.207 2.295 1.00 22.31 H new ATOM 0 HG11 VAL A 471 -5.566 9.061 1.888 1.00 63.14 H new ATOM 0 HG12 VAL A 471 -6.499 9.301 3.384 1.00 63.14 H new ATOM 0 HG13 VAL A 471 -4.815 8.733 3.468 1.00 63.14 H new ATOM 0 HG21 VAL A 471 -5.089 6.774 1.030 1.00 32.24 H new ATOM 0 HG22 VAL A 471 -4.294 6.275 2.542 1.00 32.24 H new ATOM 0 HG23 VAL A 471 -5.661 5.332 1.903 1.00 32.24 H new ATOM 1471 N GLN A 472 -8.334 5.027 3.751 1.00 72.50 N ATOM 1472 CA GLN A 472 -8.992 3.688 3.670 1.00 62.41 C ATOM 1473 C GLN A 472 -9.255 3.266 2.207 1.00 31.00 C ATOM 1474 O GLN A 472 -9.689 4.079 1.385 1.00 10.23 O ATOM 1475 CB GLN A 472 -10.322 3.683 4.473 1.00 72.45 C ATOM 1476 CG GLN A 472 -10.160 3.974 5.980 1.00 33.33 C ATOM 1477 CD GLN A 472 -11.430 3.703 6.789 1.00 61.35 C ATOM 1478 OE1 GLN A 472 -12.277 4.571 6.968 1.00 45.03 O ATOM 1479 NE2 GLN A 472 -11.577 2.489 7.273 1.00 30.54 N ATOM 0 H GLN A 472 -8.929 5.801 3.456 1.00 72.50 H new ATOM 0 HA GLN A 472 -8.307 2.963 4.109 1.00 62.41 H new ATOM 0 HB2 GLN A 472 -10.994 4.425 4.043 1.00 72.45 H new ATOM 0 HB3 GLN A 472 -10.801 2.711 4.353 1.00 72.45 H new ATOM 0 HG2 GLN A 472 -9.348 3.363 6.376 1.00 33.33 H new ATOM 0 HG3 GLN A 472 -9.869 5.016 6.112 1.00 33.33 H new ATOM 0 HE21 GLN A 472 -10.858 1.784 7.110 1.00 30.54 H new ATOM 0 HE22 GLN A 472 -12.410 2.252 7.811 1.00 30.54 H new ATOM 1488 N PHE A 473 -8.982 1.982 1.901 1.00 70.45 N ATOM 1489 CA PHE A 473 -9.241 1.380 0.575 1.00 30.10 C ATOM 1490 C PHE A 473 -10.479 0.450 0.645 1.00 23.10 C ATOM 1491 O PHE A 473 -10.428 -0.635 1.229 1.00 3.13 O ATOM 1492 CB PHE A 473 -7.986 0.604 0.084 1.00 14.20 C ATOM 1493 CG PHE A 473 -6.806 1.487 -0.339 1.00 70.34 C ATOM 1494 CD1 PHE A 473 -6.061 2.207 0.602 1.00 44.21 C ATOM 1495 CD2 PHE A 473 -6.444 1.599 -1.686 1.00 41.24 C ATOM 1496 CE1 PHE A 473 -5.000 3.001 0.206 1.00 63.14 C ATOM 1497 CE2 PHE A 473 -5.384 2.394 -2.077 1.00 62.02 C ATOM 1498 CZ PHE A 473 -4.662 3.093 -1.133 1.00 32.21 C ATOM 0 H PHE A 473 -8.573 1.329 2.569 1.00 70.45 H new ATOM 0 HA PHE A 473 -9.451 2.173 -0.142 1.00 30.10 H new ATOM 0 HB2 PHE A 473 -7.655 -0.063 0.880 1.00 14.20 H new ATOM 0 HB3 PHE A 473 -8.272 -0.024 -0.760 1.00 14.20 H new ATOM 0 HD1 PHE A 473 -6.317 2.142 1.649 1.00 44.21 H new ATOM 0 HD2 PHE A 473 -7.003 1.055 -2.433 1.00 41.24 H new ATOM 0 HE1 PHE A 473 -4.434 3.551 0.943 1.00 63.14 H new ATOM 0 HE2 PHE A 473 -5.121 2.468 -3.122 1.00 62.02 H new ATOM 0 HZ PHE A 473 -3.832 3.713 -1.439 1.00 32.21 H new ATOM 1508 N HIS A 474 -11.584 0.897 0.026 1.00 25.02 N ATOM 1509 CA HIS A 474 -12.900 0.201 0.072 1.00 71.40 C ATOM 1510 C HIS A 474 -12.941 -1.028 -0.872 1.00 42.24 C ATOM 1511 O HIS A 474 -13.535 -2.058 -0.534 1.00 5.05 O ATOM 1512 CB HIS A 474 -14.007 1.219 -0.302 1.00 3.14 C ATOM 1513 CG HIS A 474 -15.437 0.755 -0.145 1.00 42.30 C ATOM 1514 ND1 HIS A 474 -16.467 0.810 -1.026 1.00 71.05 N flip ATOM 1515 CD2 HIS A 474 -15.894 0.217 1.030 1.00 35.40 C flip ATOM 1516 CE1 HIS A 474 -17.567 0.307 -0.391 1.00 51.53 C flip ATOM 1517 NE2 HIS A 474 -17.177 -0.036 0.838 1.00 73.14 N flip ATOM 0 H HIS A 474 -11.599 1.755 -0.526 1.00 25.02 H new ATOM 0 HA HIS A 474 -13.063 -0.178 1.081 1.00 71.40 H new ATOM 0 HB2 HIS A 474 -13.870 2.111 0.309 1.00 3.14 H new ATOM 0 HB3 HIS A 474 -13.858 1.518 -1.340 1.00 3.14 H new ATOM 0 HD1 HIS A 474 -16.428 1.161 -1.983 1.00 71.05 H new ATOM 0 HD2 HIS A 474 -15.323 0.037 1.929 1.00 35.40 H new ATOM 0 HE1 HIS A 474 -18.560 0.206 -0.804 1.00 51.53 H new ATOM 1525 N PHE A 475 -12.308 -0.879 -2.062 1.00 23.35 N ATOM 1526 CA PHE A 475 -12.286 -1.922 -3.134 1.00 13.31 C ATOM 1527 C PHE A 475 -13.706 -2.283 -3.665 1.00 34.41 C ATOM 1528 O PHE A 475 -13.885 -3.337 -4.288 1.00 1.31 O ATOM 1529 CB PHE A 475 -11.522 -3.201 -2.669 1.00 64.30 C ATOM 1530 CG PHE A 475 -10.022 -3.000 -2.474 1.00 63.20 C ATOM 1531 CD1 PHE A 475 -9.183 -2.851 -3.575 1.00 13.44 C ATOM 1532 CD2 PHE A 475 -9.448 -2.974 -1.206 1.00 11.02 C ATOM 1533 CE1 PHE A 475 -7.820 -2.683 -3.411 1.00 32.53 C ATOM 1534 CE2 PHE A 475 -8.085 -2.803 -1.050 1.00 61.02 C ATOM 1535 CZ PHE A 475 -7.273 -2.659 -2.150 1.00 53.23 C ATOM 0 H PHE A 475 -11.796 -0.033 -2.312 1.00 23.35 H new ATOM 0 HA PHE A 475 -11.744 -1.482 -3.971 1.00 13.31 H new ATOM 0 HB2 PHE A 475 -11.955 -3.548 -1.731 1.00 64.30 H new ATOM 0 HB3 PHE A 475 -11.678 -3.991 -3.404 1.00 64.30 H new ATOM 0 HD1 PHE A 475 -9.602 -2.867 -4.570 1.00 13.44 H new ATOM 0 HD2 PHE A 475 -10.075 -3.089 -0.334 1.00 11.02 H new ATOM 0 HE1 PHE A 475 -7.183 -2.570 -4.276 1.00 32.53 H new ATOM 0 HE2 PHE A 475 -7.656 -2.782 -0.059 1.00 61.02 H new ATOM 0 HZ PHE A 475 -6.208 -2.527 -2.024 1.00 53.23 H new ATOM 1545 N THR A 476 -14.670 -1.341 -3.476 1.00 23.20 N ATOM 1546 CA THR A 476 -16.133 -1.504 -3.760 1.00 12.44 C ATOM 1547 C THR A 476 -16.788 -2.617 -2.884 1.00 5.24 C ATOM 1548 O THR A 476 -17.621 -2.327 -2.012 1.00 65.54 O ATOM 1549 CB THR A 476 -16.490 -1.702 -5.291 1.00 12.23 C ATOM 1550 OG1 THR A 476 -16.116 -3.011 -5.768 1.00 13.15 O ATOM 1551 CG2 THR A 476 -15.820 -0.624 -6.178 1.00 11.24 C ATOM 0 H THR A 476 -14.448 -0.415 -3.110 1.00 23.20 H new ATOM 0 HA THR A 476 -16.568 -0.545 -3.477 1.00 12.44 H new ATOM 0 HB THR A 476 -17.573 -1.600 -5.365 1.00 12.23 H new ATOM 0 HG1 THR A 476 -15.183 -3.193 -5.528 1.00 13.15 H new ATOM 0 HG21 THR A 476 -16.088 -0.793 -7.221 1.00 11.24 H new ATOM 0 HG22 THR A 476 -16.162 0.364 -5.871 1.00 11.24 H new ATOM 0 HG23 THR A 476 -14.737 -0.683 -6.068 1.00 11.24 H new ATOM 1559 N ASN A 477 -16.395 -3.875 -3.118 1.00 32.51 N ATOM 1560 CA ASN A 477 -16.859 -5.065 -2.357 1.00 13.01 C ATOM 1561 C ASN A 477 -15.629 -5.828 -1.784 1.00 55.03 C ATOM 1562 O ASN A 477 -14.501 -5.629 -2.246 1.00 53.03 O ATOM 1563 CB ASN A 477 -17.699 -5.962 -3.321 1.00 31.55 C ATOM 1564 CG ASN A 477 -18.329 -7.194 -2.669 1.00 40.14 C ATOM 1565 OD1 ASN A 477 -18.636 -7.205 -1.487 1.00 5.42 O ATOM 1566 ND2 ASN A 477 -18.555 -8.237 -3.446 1.00 51.24 N ATOM 0 H ASN A 477 -15.731 -4.110 -3.856 1.00 32.51 H new ATOM 0 HA ASN A 477 -17.484 -4.772 -1.514 1.00 13.01 H new ATOM 0 HB2 ASN A 477 -18.492 -5.356 -3.760 1.00 31.55 H new ATOM 0 HB3 ASN A 477 -17.058 -6.290 -4.140 1.00 31.55 H new ATOM 0 HD21 ASN A 477 -18.994 -9.074 -3.062 1.00 51.24 H new ATOM 0 HD22 ASN A 477 -18.291 -8.206 -4.431 1.00 51.24 H new ATOM 1573 N LYS A 478 -15.845 -6.698 -0.773 1.00 25.13 N ATOM 1574 CA LYS A 478 -14.750 -7.499 -0.146 1.00 0.33 C ATOM 1575 C LYS A 478 -14.728 -8.981 -0.622 1.00 72.31 C ATOM 1576 O LYS A 478 -13.899 -9.774 -0.162 1.00 55.14 O ATOM 1577 CB LYS A 478 -14.831 -7.422 1.405 1.00 14.02 C ATOM 1578 CG LYS A 478 -14.610 -6.002 1.978 1.00 32.02 C ATOM 1579 CD LYS A 478 -14.415 -5.993 3.512 1.00 1.04 C ATOM 1580 CE LYS A 478 -14.227 -4.575 4.087 1.00 43.01 C ATOM 1581 NZ LYS A 478 -15.450 -3.751 3.928 1.00 42.33 N ATOM 0 H LYS A 478 -16.765 -6.869 -0.368 1.00 25.13 H new ATOM 0 HA LYS A 478 -13.812 -7.053 -0.477 1.00 0.33 H new ATOM 0 HB2 LYS A 478 -15.808 -7.784 1.726 1.00 14.02 H new ATOM 0 HB3 LYS A 478 -14.086 -8.094 1.831 1.00 14.02 H new ATOM 0 HG2 LYS A 478 -13.735 -5.557 1.504 1.00 32.02 H new ATOM 0 HG3 LYS A 478 -15.465 -5.376 1.722 1.00 32.02 H new ATOM 0 HD2 LYS A 478 -15.279 -6.459 3.985 1.00 1.04 H new ATOM 0 HD3 LYS A 478 -13.546 -6.600 3.766 1.00 1.04 H new ATOM 0 HE2 LYS A 478 -13.969 -4.642 5.144 1.00 43.01 H new ATOM 0 HE3 LYS A 478 -13.392 -4.087 3.585 1.00 43.01 H new ATOM 0 HZ1 LYS A 478 -15.328 -2.848 4.429 1.00 42.33 H new ATOM 0 HZ2 LYS A 478 -15.615 -3.567 2.918 1.00 42.33 H new ATOM 0 HZ3 LYS A 478 -16.265 -4.260 4.325 1.00 42.33 H new ATOM 1595 N ASP A 479 -15.618 -9.344 -1.564 1.00 53.31 N ATOM 1596 CA ASP A 479 -15.759 -10.741 -2.062 1.00 55.10 C ATOM 1597 C ASP A 479 -15.046 -10.989 -3.423 1.00 43.52 C ATOM 1598 O ASP A 479 -15.307 -12.009 -4.076 1.00 42.01 O ATOM 1599 CB ASP A 479 -17.267 -11.095 -2.164 1.00 21.13 C ATOM 1600 CG ASP A 479 -17.968 -11.101 -0.792 1.00 43.22 C ATOM 1601 OD1 ASP A 479 -18.316 -10.014 -0.285 1.00 61.30 O ATOM 1602 OD2 ASP A 479 -18.156 -12.188 -0.202 1.00 32.13 O ATOM 0 H ASP A 479 -16.261 -8.686 -2.005 1.00 53.31 H new ATOM 0 HA ASP A 479 -15.263 -11.393 -1.344 1.00 55.10 H new ATOM 0 HB2 ASP A 479 -17.762 -10.377 -2.818 1.00 21.13 H new ATOM 0 HB3 ASP A 479 -17.376 -12.075 -2.628 1.00 21.13 H new ATOM 1607 N LEU A 480 -14.132 -10.092 -3.848 1.00 21.44 N ATOM 1608 CA LEU A 480 -13.383 -10.275 -5.124 1.00 32.34 C ATOM 1609 C LEU A 480 -12.238 -11.309 -4.958 1.00 54.01 C ATOM 1610 O LEU A 480 -11.490 -11.244 -3.990 1.00 51.34 O ATOM 1611 CB LEU A 480 -12.827 -8.924 -5.678 1.00 74.33 C ATOM 1612 CG LEU A 480 -13.879 -7.894 -6.219 1.00 52.52 C ATOM 1613 CD1 LEU A 480 -14.876 -8.557 -7.195 1.00 64.13 C ATOM 1614 CD2 LEU A 480 -14.605 -7.157 -5.079 1.00 64.02 C ATOM 0 H LEU A 480 -13.892 -9.242 -3.339 1.00 21.44 H new ATOM 0 HA LEU A 480 -14.094 -10.661 -5.855 1.00 32.34 H new ATOM 0 HB2 LEU A 480 -12.256 -8.441 -4.885 1.00 74.33 H new ATOM 0 HB3 LEU A 480 -12.127 -9.149 -6.483 1.00 74.33 H new ATOM 0 HG LEU A 480 -13.326 -7.142 -6.781 1.00 52.52 H new ATOM 0 HD11 LEU A 480 -15.589 -7.812 -7.548 1.00 64.13 H new ATOM 0 HD12 LEU A 480 -14.333 -8.971 -8.044 1.00 64.13 H new ATOM 0 HD13 LEU A 480 -15.411 -9.356 -6.682 1.00 64.13 H new ATOM 0 HD21 LEU A 480 -15.324 -6.454 -5.500 1.00 64.02 H new ATOM 0 HD22 LEU A 480 -15.128 -7.880 -4.453 1.00 64.02 H new ATOM 0 HD23 LEU A 480 -13.878 -6.614 -4.475 1.00 64.02 H new ATOM 1626 N GLU A 481 -12.117 -12.251 -5.924 1.00 5.21 N ATOM 1627 CA GLU A 481 -11.058 -13.307 -5.931 1.00 0.03 C ATOM 1628 C GLU A 481 -9.625 -12.720 -5.954 1.00 22.24 C ATOM 1629 O GLU A 481 -8.723 -13.238 -5.285 1.00 24.45 O ATOM 1630 CB GLU A 481 -11.270 -14.277 -7.140 1.00 45.42 C ATOM 1631 CG GLU A 481 -12.248 -15.441 -6.874 1.00 54.33 C ATOM 1632 CD GLU A 481 -11.700 -16.459 -5.851 1.00 23.23 C ATOM 1633 OE1 GLU A 481 -10.730 -17.184 -6.183 1.00 22.23 O ATOM 1634 OE2 GLU A 481 -12.214 -16.536 -4.715 1.00 44.51 O ATOM 0 H GLU A 481 -12.748 -12.306 -6.724 1.00 5.21 H new ATOM 0 HA GLU A 481 -11.155 -13.861 -4.998 1.00 0.03 H new ATOM 0 HB2 GLU A 481 -11.636 -13.701 -7.990 1.00 45.42 H new ATOM 0 HB3 GLU A 481 -10.304 -14.692 -7.428 1.00 45.42 H new ATOM 0 HG2 GLU A 481 -13.194 -15.039 -6.510 1.00 54.33 H new ATOM 0 HG3 GLU A 481 -12.460 -15.954 -7.812 1.00 54.33 H new ATOM 1641 N SER A 482 -9.432 -11.649 -6.734 1.00 22.23 N ATOM 1642 CA SER A 482 -8.151 -10.898 -6.788 1.00 40.23 C ATOM 1643 C SER A 482 -7.800 -10.271 -5.415 1.00 65.51 C ATOM 1644 O SER A 482 -6.629 -10.192 -5.025 1.00 71.01 O ATOM 1645 CB SER A 482 -8.240 -9.797 -7.865 1.00 41.43 C ATOM 1646 OG SER A 482 -8.466 -10.354 -9.149 1.00 54.04 O ATOM 0 H SER A 482 -10.153 -11.271 -7.349 1.00 22.23 H new ATOM 0 HA SER A 482 -7.357 -11.600 -7.045 1.00 40.23 H new ATOM 0 HB2 SER A 482 -9.047 -9.107 -7.618 1.00 41.43 H new ATOM 0 HB3 SER A 482 -7.317 -9.218 -7.874 1.00 41.43 H new ATOM 0 HG SER A 482 -8.520 -9.635 -9.813 1.00 54.04 H new ATOM 1652 N LEU A 483 -8.848 -9.836 -4.700 1.00 22.11 N ATOM 1653 CA LEU A 483 -8.742 -9.272 -3.339 1.00 44.23 C ATOM 1654 C LEU A 483 -8.513 -10.374 -2.279 1.00 20.22 C ATOM 1655 O LEU A 483 -7.862 -10.136 -1.268 1.00 31.21 O ATOM 1656 CB LEU A 483 -10.023 -8.462 -3.034 1.00 12.44 C ATOM 1657 CG LEU A 483 -10.113 -7.753 -1.650 1.00 65.54 C ATOM 1658 CD1 LEU A 483 -8.951 -6.761 -1.417 1.00 54.22 C ATOM 1659 CD2 LEU A 483 -11.479 -7.063 -1.497 1.00 72.51 C ATOM 0 H LEU A 483 -9.805 -9.865 -5.051 1.00 22.11 H new ATOM 0 HA LEU A 483 -7.874 -8.614 -3.295 1.00 44.23 H new ATOM 0 HB2 LEU A 483 -10.133 -7.703 -3.809 1.00 12.44 H new ATOM 0 HB3 LEU A 483 -10.876 -9.135 -3.123 1.00 12.44 H new ATOM 0 HG LEU A 483 -10.018 -8.519 -0.880 1.00 65.54 H new ATOM 0 HD11 LEU A 483 -9.062 -6.294 -0.438 1.00 54.22 H new ATOM 0 HD12 LEU A 483 -8.002 -7.296 -1.459 1.00 54.22 H new ATOM 0 HD13 LEU A 483 -8.969 -5.992 -2.189 1.00 54.22 H new ATOM 0 HD21 LEU A 483 -11.531 -6.571 -0.526 1.00 72.51 H new ATOM 0 HD22 LEU A 483 -11.603 -6.322 -2.287 1.00 72.51 H new ATOM 0 HD23 LEU A 483 -12.272 -7.807 -1.570 1.00 72.51 H new ATOM 1671 N LYS A 484 -9.066 -11.578 -2.525 1.00 50.43 N ATOM 1672 CA LYS A 484 -8.868 -12.758 -1.648 1.00 32.13 C ATOM 1673 C LYS A 484 -7.427 -13.295 -1.746 1.00 45.55 C ATOM 1674 O LYS A 484 -6.888 -13.805 -0.763 1.00 63.15 O ATOM 1675 CB LYS A 484 -9.900 -13.866 -1.971 1.00 52.52 C ATOM 1676 CG LYS A 484 -11.363 -13.461 -1.673 1.00 42.12 C ATOM 1677 CD LYS A 484 -12.371 -14.595 -1.950 1.00 23.40 C ATOM 1678 CE LYS A 484 -13.827 -14.165 -1.705 1.00 24.02 C ATOM 1679 NZ LYS A 484 -14.054 -13.710 -0.308 1.00 51.11 N ATOM 0 H LYS A 484 -9.661 -11.764 -3.333 1.00 50.43 H new ATOM 0 HA LYS A 484 -9.029 -12.438 -0.619 1.00 32.13 H new ATOM 0 HB2 LYS A 484 -9.814 -14.134 -3.024 1.00 52.52 H new ATOM 0 HB3 LYS A 484 -9.655 -14.758 -1.394 1.00 52.52 H new ATOM 0 HG2 LYS A 484 -11.445 -13.157 -0.629 1.00 42.12 H new ATOM 0 HG3 LYS A 484 -11.625 -12.594 -2.279 1.00 42.12 H new ATOM 0 HD2 LYS A 484 -12.263 -14.928 -2.982 1.00 23.40 H new ATOM 0 HD3 LYS A 484 -12.136 -15.448 -1.314 1.00 23.40 H new ATOM 0 HE2 LYS A 484 -14.087 -13.361 -2.393 1.00 24.02 H new ATOM 0 HE3 LYS A 484 -14.492 -15.000 -1.925 1.00 24.02 H new ATOM 0 HZ1 LYS A 484 -15.070 -13.544 -0.158 1.00 51.11 H new ATOM 0 HZ2 LYS A 484 -13.721 -14.440 0.353 1.00 51.11 H new ATOM 0 HZ3 LYS A 484 -13.530 -12.827 -0.141 1.00 51.11 H new ATOM 1693 N GLY A 485 -6.811 -13.149 -2.936 1.00 60.04 N ATOM 1694 CA GLY A 485 -5.370 -13.387 -3.101 1.00 43.22 C ATOM 1695 C GLY A 485 -4.533 -12.420 -2.256 1.00 15.23 C ATOM 1696 O GLY A 485 -3.625 -12.835 -1.535 1.00 24.23 O ATOM 0 H GLY A 485 -7.290 -12.868 -3.792 1.00 60.04 H new ATOM 0 HA2 GLY A 485 -5.136 -14.413 -2.818 1.00 43.22 H new ATOM 0 HA3 GLY A 485 -5.101 -13.278 -4.152 1.00 43.22 H new ATOM 1700 N LEU A 486 -4.912 -11.128 -2.309 1.00 43.52 N ATOM 1701 CA LEU A 486 -4.273 -10.042 -1.527 1.00 42.01 C ATOM 1702 C LEU A 486 -4.480 -10.229 0.013 1.00 33.41 C ATOM 1703 O LEU A 486 -3.583 -9.920 0.808 1.00 3.21 O ATOM 1704 CB LEU A 486 -4.848 -8.675 -2.003 1.00 15.23 C ATOM 1705 CG LEU A 486 -4.112 -7.396 -1.500 1.00 52.11 C ATOM 1706 CD1 LEU A 486 -2.628 -7.407 -1.934 1.00 12.03 C ATOM 1707 CD2 LEU A 486 -4.832 -6.111 -1.981 1.00 63.12 C ATOM 0 H LEU A 486 -5.677 -10.802 -2.900 1.00 43.52 H new ATOM 0 HA LEU A 486 -3.197 -10.072 -1.701 1.00 42.01 H new ATOM 0 HB2 LEU A 486 -4.844 -8.664 -3.093 1.00 15.23 H new ATOM 0 HB3 LEU A 486 -5.890 -8.615 -1.688 1.00 15.23 H new ATOM 0 HG LEU A 486 -4.139 -7.398 -0.410 1.00 52.11 H new ATOM 0 HD11 LEU A 486 -2.136 -6.504 -1.571 1.00 12.03 H new ATOM 0 HD12 LEU A 486 -2.133 -8.283 -1.515 1.00 12.03 H new ATOM 0 HD13 LEU A 486 -2.567 -7.441 -3.022 1.00 12.03 H new ATOM 0 HD21 LEU A 486 -4.296 -5.235 -1.615 1.00 63.12 H new ATOM 0 HD22 LEU A 486 -4.855 -6.093 -3.071 1.00 63.12 H new ATOM 0 HD23 LEU A 486 -5.852 -6.100 -1.596 1.00 63.12 H new ATOM 1719 N TYR A 487 -5.664 -10.766 0.411 1.00 74.03 N ATOM 1720 CA TYR A 487 -5.981 -11.126 1.824 1.00 73.43 C ATOM 1721 C TYR A 487 -4.977 -12.174 2.372 1.00 43.02 C ATOM 1722 O TYR A 487 -4.516 -12.076 3.517 1.00 23.01 O ATOM 1723 CB TYR A 487 -7.444 -11.681 1.955 1.00 5.44 C ATOM 1724 CG TYR A 487 -8.581 -10.634 1.930 1.00 45.44 C ATOM 1725 CD1 TYR A 487 -8.452 -9.430 2.602 1.00 31.24 C ATOM 1726 CD2 TYR A 487 -9.797 -10.869 1.269 1.00 64.34 C ATOM 1727 CE1 TYR A 487 -9.468 -8.502 2.619 1.00 4.32 C ATOM 1728 CE2 TYR A 487 -10.818 -9.938 1.285 1.00 4.04 C ATOM 1729 CZ TYR A 487 -10.645 -8.755 1.964 1.00 52.45 C ATOM 1730 OH TYR A 487 -11.651 -7.818 1.988 1.00 1.22 O ATOM 0 H TYR A 487 -6.427 -10.962 -0.237 1.00 74.03 H new ATOM 0 HA TYR A 487 -5.898 -10.214 2.415 1.00 73.43 H new ATOM 0 HB2 TYR A 487 -7.614 -12.390 1.145 1.00 5.44 H new ATOM 0 HB3 TYR A 487 -7.515 -12.240 2.888 1.00 5.44 H new ATOM 0 HD1 TYR A 487 -7.532 -9.214 3.125 1.00 31.24 H new ATOM 0 HD2 TYR A 487 -9.938 -11.798 0.736 1.00 64.34 H new ATOM 0 HE1 TYR A 487 -9.337 -7.571 3.150 1.00 4.32 H new ATOM 0 HE2 TYR A 487 -11.745 -10.138 0.768 1.00 4.04 H new ATOM 0 HH TYR A 487 -11.329 -6.982 1.590 1.00 1.22 H new ATOM 1740 N ARG A 488 -4.651 -13.165 1.524 1.00 3.44 N ATOM 1741 CA ARG A 488 -3.702 -14.251 1.862 1.00 51.22 C ATOM 1742 C ARG A 488 -2.250 -13.722 1.977 1.00 23.02 C ATOM 1743 O ARG A 488 -1.593 -13.940 2.994 1.00 75.03 O ATOM 1744 CB ARG A 488 -3.784 -15.374 0.791 1.00 32.43 C ATOM 1745 CG ARG A 488 -5.169 -16.052 0.681 1.00 51.41 C ATOM 1746 CD ARG A 488 -5.262 -17.017 -0.520 1.00 4.44 C ATOM 1747 NE ARG A 488 -4.314 -18.141 -0.406 1.00 33.23 N ATOM 1748 CZ ARG A 488 -3.883 -18.889 -1.397 1.00 55.53 C ATOM 1749 NH1 ARG A 488 -4.254 -18.682 -2.622 1.00 43.31 N ATOM 1750 NH2 ARG A 488 -3.063 -19.852 -1.139 1.00 42.32 N ATOM 0 H ARG A 488 -5.036 -13.239 0.583 1.00 3.44 H new ATOM 0 HA ARG A 488 -3.983 -14.657 2.834 1.00 51.22 H new ATOM 0 HB2 ARG A 488 -3.521 -14.954 -0.180 1.00 32.43 H new ATOM 0 HB3 ARG A 488 -3.038 -16.135 1.022 1.00 32.43 H new ATOM 0 HG2 ARG A 488 -5.375 -16.600 1.600 1.00 51.41 H new ATOM 0 HG3 ARG A 488 -5.938 -15.286 0.587 1.00 51.41 H new ATOM 0 HD2 ARG A 488 -6.277 -17.406 -0.593 1.00 4.44 H new ATOM 0 HD3 ARG A 488 -5.064 -16.469 -1.441 1.00 4.44 H new ATOM 0 HE ARG A 488 -3.961 -18.357 0.526 1.00 33.23 H new ATOM 0 HH11 ARG A 488 -4.898 -17.921 -2.838 1.00 43.31 H new ATOM 0 HH12 ARG A 488 -3.902 -19.280 -3.369 1.00 43.31 H new ATOM 0 HH21 ARG A 488 -2.761 -20.021 -0.180 1.00 42.32 H new ATOM 0 HH22 ARG A 488 -2.717 -20.444 -1.895 1.00 42.32 H new ATOM 1764 N ILE A 489 -1.786 -13.001 0.935 1.00 34.55 N ATOM 1765 CA ILE A 489 -0.382 -12.515 0.835 1.00 13.31 C ATOM 1766 C ILE A 489 -0.019 -11.540 1.984 1.00 23.34 C ATOM 1767 O ILE A 489 0.959 -11.750 2.706 1.00 52.44 O ATOM 1768 CB ILE A 489 -0.143 -11.789 -0.542 1.00 75.31 C ATOM 1769 CG1 ILE A 489 -0.447 -12.740 -1.745 1.00 61.35 C ATOM 1770 CG2 ILE A 489 1.296 -11.213 -0.637 1.00 45.44 C ATOM 1771 CD1 ILE A 489 -0.468 -12.044 -3.102 1.00 12.03 C ATOM 0 H ILE A 489 -2.367 -12.737 0.139 1.00 34.55 H new ATOM 0 HA ILE A 489 0.259 -13.394 0.911 1.00 13.31 H new ATOM 0 HB ILE A 489 -0.839 -10.952 -0.594 1.00 75.31 H new ATOM 0 HG12 ILE A 489 0.302 -13.531 -1.767 1.00 61.35 H new ATOM 0 HG13 ILE A 489 -1.412 -13.219 -1.580 1.00 61.35 H new ATOM 0 HG21 ILE A 489 1.427 -10.719 -1.600 1.00 45.44 H new ATOM 0 HG22 ILE A 489 1.453 -10.492 0.165 1.00 45.44 H new ATOM 0 HG23 ILE A 489 2.019 -12.023 -0.544 1.00 45.44 H new ATOM 0 HD11 ILE A 489 -0.686 -12.774 -3.882 1.00 12.03 H new ATOM 0 HD12 ILE A 489 -1.237 -11.272 -3.103 1.00 12.03 H new ATOM 0 HD13 ILE A 489 0.504 -11.589 -3.292 1.00 12.03 H new ATOM 1783 N MET A 490 -0.836 -10.485 2.150 1.00 14.50 N ATOM 1784 CA MET A 490 -0.594 -9.442 3.173 1.00 33.15 C ATOM 1785 C MET A 490 -0.869 -9.980 4.593 1.00 43.20 C ATOM 1786 O MET A 490 -0.238 -9.545 5.562 1.00 40.53 O ATOM 1787 CB MET A 490 -1.445 -8.189 2.872 1.00 61.43 C ATOM 1788 CG MET A 490 -1.213 -7.600 1.472 1.00 1.21 C ATOM 1789 SD MET A 490 -2.102 -6.049 1.209 1.00 13.02 S ATOM 1790 CE MET A 490 -1.193 -4.943 2.278 1.00 3.22 C ATOM 0 H MET A 490 -1.673 -10.328 1.589 1.00 14.50 H new ATOM 0 HA MET A 490 0.457 -9.157 3.132 1.00 33.15 H new ATOM 0 HB2 MET A 490 -2.499 -8.444 2.978 1.00 61.43 H new ATOM 0 HB3 MET A 490 -1.225 -7.425 3.618 1.00 61.43 H new ATOM 0 HG2 MET A 490 -0.146 -7.431 1.326 1.00 1.21 H new ATOM 0 HG3 MET A 490 -1.527 -8.325 0.721 1.00 1.21 H new ATOM 0 HE1 MET A 490 -1.865 -4.531 3.031 1.00 3.22 H new ATOM 0 HE2 MET A 490 -0.389 -5.491 2.770 1.00 3.22 H new ATOM 0 HE3 MET A 490 -0.770 -4.131 1.686 1.00 3.22 H new ATOM 1800 N GLY A 491 -1.793 -10.966 4.683 1.00 65.41 N ATOM 1801 CA GLY A 491 -2.059 -11.699 5.931 1.00 32.02 C ATOM 1802 C GLY A 491 -0.880 -12.577 6.406 1.00 13.43 C ATOM 1803 O GLY A 491 -0.850 -13.005 7.563 1.00 5.24 O ATOM 0 H GLY A 491 -2.367 -11.269 3.896 1.00 65.41 H new ATOM 0 HA2 GLY A 491 -2.305 -10.983 6.715 1.00 32.02 H new ATOM 0 HA3 GLY A 491 -2.936 -12.331 5.790 1.00 32.02 H new ATOM 1807 N ASN A 492 0.093 -12.848 5.505 1.00 52.22 N ATOM 1808 CA ASN A 492 1.343 -13.597 5.833 1.00 54.34 C ATOM 1809 C ASN A 492 2.473 -12.666 6.364 1.00 15.34 C ATOM 1810 O ASN A 492 3.647 -13.062 6.400 1.00 62.33 O ATOM 1811 CB ASN A 492 1.832 -14.370 4.575 1.00 54.10 C ATOM 1812 CG ASN A 492 0.859 -15.450 4.113 1.00 14.41 C ATOM 1813 OD1 ASN A 492 0.173 -16.078 4.914 1.00 12.32 O ATOM 1814 ND2 ASN A 492 0.778 -15.674 2.812 1.00 25.33 N ATOM 0 H ASN A 492 0.040 -12.557 4.529 1.00 52.22 H new ATOM 0 HA ASN A 492 1.107 -14.298 6.633 1.00 54.34 H new ATOM 0 HB2 ASN A 492 1.991 -13.662 3.761 1.00 54.10 H new ATOM 0 HB3 ASN A 492 2.797 -14.829 4.791 1.00 54.10 H new ATOM 0 HD21 ASN A 492 0.135 -16.381 2.455 1.00 25.33 H new ATOM 0 HD22 ASN A 492 1.358 -15.140 2.165 1.00 25.33 H new ATOM 1821 N GLY A 493 2.107 -11.446 6.801 1.00 0.41 N ATOM 1822 CA GLY A 493 3.083 -10.475 7.320 1.00 3.32 C ATOM 1823 C GLY A 493 3.796 -9.684 6.219 1.00 13.13 C ATOM 1824 O GLY A 493 4.979 -9.342 6.347 1.00 42.02 O ATOM 0 H GLY A 493 1.143 -11.112 6.804 1.00 0.41 H new ATOM 0 HA2 GLY A 493 2.573 -9.779 7.986 1.00 3.32 H new ATOM 0 HA3 GLY A 493 3.826 -11.002 7.918 1.00 3.32 H new ATOM 1828 N PHE A 494 3.064 -9.400 5.128 1.00 62.15 N ATOM 1829 CA PHE A 494 3.559 -8.573 4.002 1.00 35.44 C ATOM 1830 C PHE A 494 2.807 -7.230 3.926 1.00 63.53 C ATOM 1831 O PHE A 494 1.763 -7.034 4.558 1.00 40.22 O ATOM 1832 CB PHE A 494 3.445 -9.341 2.650 1.00 23.22 C ATOM 1833 CG PHE A 494 4.439 -10.495 2.500 1.00 51.25 C ATOM 1834 CD1 PHE A 494 4.153 -11.767 2.996 1.00 52.11 C ATOM 1835 CD2 PHE A 494 5.666 -10.303 1.862 1.00 74.33 C ATOM 1836 CE1 PHE A 494 5.057 -12.805 2.860 1.00 74.52 C ATOM 1837 CE2 PHE A 494 6.571 -11.341 1.728 1.00 31.02 C ATOM 1838 CZ PHE A 494 6.266 -12.592 2.227 1.00 41.00 C ATOM 0 H PHE A 494 2.110 -9.736 4.997 1.00 62.15 H new ATOM 0 HA PHE A 494 4.612 -8.362 4.187 1.00 35.44 H new ATOM 0 HB2 PHE A 494 2.433 -9.733 2.552 1.00 23.22 H new ATOM 0 HB3 PHE A 494 3.596 -8.637 1.831 1.00 23.22 H new ATOM 0 HD1 PHE A 494 3.211 -11.944 3.494 1.00 52.11 H new ATOM 0 HD2 PHE A 494 5.913 -9.329 1.467 1.00 74.33 H new ATOM 0 HE1 PHE A 494 4.817 -13.783 3.249 1.00 74.52 H new ATOM 0 HE2 PHE A 494 7.516 -11.173 1.233 1.00 31.02 H new ATOM 0 HZ PHE A 494 6.972 -13.403 2.122 1.00 41.00 H new ATOM 1848 N ALA A 495 3.363 -6.325 3.123 1.00 41.20 N ATOM 1849 CA ALA A 495 2.891 -4.939 2.977 1.00 15.13 C ATOM 1850 C ALA A 495 2.901 -4.527 1.494 1.00 44.52 C ATOM 1851 O ALA A 495 3.477 -5.225 0.648 1.00 31.31 O ATOM 1852 CB ALA A 495 3.786 -4.025 3.812 1.00 32.42 C ATOM 0 H ALA A 495 4.173 -6.534 2.540 1.00 41.20 H new ATOM 0 HA ALA A 495 1.865 -4.854 3.334 1.00 15.13 H new ATOM 0 HB1 ALA A 495 3.447 -2.994 3.713 1.00 32.42 H new ATOM 0 HB2 ALA A 495 3.736 -4.324 4.859 1.00 32.42 H new ATOM 0 HB3 ALA A 495 4.815 -4.104 3.461 1.00 32.42 H new ATOM 1858 N GLY A 496 2.291 -3.371 1.190 1.00 24.12 N ATOM 1859 CA GLY A 496 2.092 -2.935 -0.196 1.00 61.40 C ATOM 1860 C GLY A 496 2.536 -1.494 -0.459 1.00 63.05 C ATOM 1861 O GLY A 496 1.755 -0.565 -0.292 1.00 23.53 O ATOM 0 H GLY A 496 1.927 -2.722 1.888 1.00 24.12 H new ATOM 0 HA2 GLY A 496 2.642 -3.602 -0.860 1.00 61.40 H new ATOM 0 HA3 GLY A 496 1.036 -3.032 -0.450 1.00 61.40 H new ATOM 1865 N CYS A 497 3.782 -1.310 -0.909 1.00 50.34 N ATOM 1866 CA CYS A 497 4.332 0.027 -1.243 1.00 0.02 C ATOM 1867 C CYS A 497 3.707 0.558 -2.562 1.00 12.05 C ATOM 1868 O CYS A 497 4.158 0.222 -3.660 1.00 54.11 O ATOM 1869 CB CYS A 497 5.877 -0.043 -1.341 1.00 23.41 C ATOM 1870 SG CYS A 497 6.678 1.559 -1.537 1.00 15.32 S ATOM 0 H CYS A 497 4.442 -2.074 -1.055 1.00 50.34 H new ATOM 0 HA CYS A 497 4.073 0.726 -0.448 1.00 0.02 H new ATOM 0 HB2 CYS A 497 6.265 -0.523 -0.443 1.00 23.41 H new ATOM 0 HB3 CYS A 497 6.148 -0.678 -2.185 1.00 23.41 H new ATOM 0 HG CYS A 497 7.340 1.579 -2.656 1.00 15.32 H new ATOM 1876 N VAL A 498 2.630 1.352 -2.425 1.00 50.25 N ATOM 1877 CA VAL A 498 1.857 1.902 -3.558 1.00 60.34 C ATOM 1878 C VAL A 498 2.553 3.148 -4.159 1.00 45.43 C ATOM 1879 O VAL A 498 2.546 4.224 -3.557 1.00 2.00 O ATOM 1880 CB VAL A 498 0.395 2.271 -3.100 1.00 43.02 C ATOM 1881 CG1 VAL A 498 -0.420 2.937 -4.231 1.00 43.14 C ATOM 1882 CG2 VAL A 498 -0.357 1.038 -2.536 1.00 22.12 C ATOM 0 H VAL A 498 2.266 1.634 -1.515 1.00 50.25 H new ATOM 0 HA VAL A 498 1.805 1.134 -4.329 1.00 60.34 H new ATOM 0 HB VAL A 498 0.498 3.000 -2.297 1.00 43.02 H new ATOM 0 HG11 VAL A 498 -1.420 3.173 -3.868 1.00 43.14 H new ATOM 0 HG12 VAL A 498 0.077 3.854 -4.546 1.00 43.14 H new ATOM 0 HG13 VAL A 498 -0.493 2.254 -5.078 1.00 43.14 H new ATOM 0 HG21 VAL A 498 -1.361 1.332 -2.231 1.00 22.12 H new ATOM 0 HG22 VAL A 498 -0.422 0.269 -3.305 1.00 22.12 H new ATOM 0 HG23 VAL A 498 0.183 0.645 -1.675 1.00 22.12 H new ATOM 1892 N HIS A 499 3.156 2.978 -5.342 1.00 33.55 N ATOM 1893 CA HIS A 499 3.871 4.061 -6.056 1.00 63.01 C ATOM 1894 C HIS A 499 2.993 4.745 -7.139 1.00 73.31 C ATOM 1895 O HIS A 499 2.106 4.129 -7.752 1.00 51.21 O ATOM 1896 CB HIS A 499 5.165 3.515 -6.705 1.00 2.32 C ATOM 1897 CG HIS A 499 6.184 3.003 -5.715 1.00 45.12 C ATOM 1898 ND1 HIS A 499 7.024 3.862 -5.046 1.00 45.44 N ATOM 1899 CD2 HIS A 499 6.465 1.733 -5.332 1.00 43.52 C ATOM 1900 CE1 HIS A 499 7.787 3.108 -4.284 1.00 51.23 C ATOM 1901 NE2 HIS A 499 7.489 1.808 -4.423 1.00 30.23 N ATOM 0 H HIS A 499 3.166 2.087 -5.838 1.00 33.55 H new ATOM 0 HA HIS A 499 4.120 4.817 -5.311 1.00 63.01 H new ATOM 0 HB2 HIS A 499 4.903 2.708 -7.390 1.00 2.32 H new ATOM 0 HB3 HIS A 499 5.620 4.305 -7.302 1.00 2.32 H new ATOM 0 HD1 HIS A 499 7.050 4.879 -5.125 1.00 45.44 H new ATOM 0 HD2 HIS A 499 5.976 0.834 -5.677 1.00 43.52 H new ATOM 0 HE1 HIS A 499 8.557 3.488 -3.629 1.00 51.23 H new ATOM 1909 N PHE A 500 3.286 6.037 -7.345 1.00 21.24 N ATOM 1910 CA PHE A 500 2.685 6.913 -8.375 1.00 52.42 C ATOM 1911 C PHE A 500 3.786 7.235 -9.434 1.00 51.41 C ATOM 1912 O PHE A 500 4.960 7.341 -9.050 1.00 73.24 O ATOM 1913 CB PHE A 500 2.183 8.244 -7.723 1.00 10.04 C ATOM 1914 CG PHE A 500 1.006 8.131 -6.728 1.00 64.35 C ATOM 1915 CD1 PHE A 500 1.035 7.245 -5.637 1.00 73.43 C ATOM 1916 CD2 PHE A 500 -0.126 8.937 -6.870 1.00 14.44 C ATOM 1917 CE1 PHE A 500 -0.018 7.172 -4.743 1.00 32.03 C ATOM 1918 CE2 PHE A 500 -1.176 8.859 -5.977 1.00 65.41 C ATOM 1919 CZ PHE A 500 -1.124 7.976 -4.915 1.00 51.42 C ATOM 0 H PHE A 500 3.977 6.526 -6.777 1.00 21.24 H new ATOM 0 HA PHE A 500 1.836 6.414 -8.842 1.00 52.42 H new ATOM 0 HB2 PHE A 500 3.023 8.706 -7.205 1.00 10.04 H new ATOM 0 HB3 PHE A 500 1.888 8.924 -8.522 1.00 10.04 H new ATOM 0 HD1 PHE A 500 1.896 6.609 -5.494 1.00 73.43 H new ATOM 0 HD2 PHE A 500 -0.181 9.634 -7.693 1.00 14.44 H new ATOM 0 HE1 PHE A 500 0.027 6.485 -3.911 1.00 32.03 H new ATOM 0 HE2 PHE A 500 -2.042 9.491 -6.109 1.00 65.41 H new ATOM 0 HZ PHE A 500 -1.949 7.916 -4.221 1.00 51.42 H new ATOM 1929 N PRO A 501 3.441 7.395 -10.766 1.00 34.44 N ATOM 1930 CA PRO A 501 4.442 7.665 -11.849 1.00 11.44 C ATOM 1931 C PRO A 501 5.394 8.869 -11.549 1.00 4.44 C ATOM 1932 O PRO A 501 6.618 8.691 -11.513 1.00 23.10 O ATOM 1933 CB PRO A 501 3.568 7.910 -13.126 1.00 63.14 C ATOM 1934 CG PRO A 501 2.152 8.048 -12.633 1.00 74.24 C ATOM 1935 CD PRO A 501 2.075 7.282 -11.329 1.00 42.22 C ATOM 0 HA PRO A 501 5.133 6.829 -11.960 1.00 11.44 H new ATOM 0 HB2 PRO A 501 3.888 8.809 -13.653 1.00 63.14 H new ATOM 0 HB3 PRO A 501 3.659 7.081 -13.827 1.00 63.14 H new ATOM 0 HG2 PRO A 501 1.894 9.096 -12.483 1.00 74.24 H new ATOM 0 HG3 PRO A 501 1.447 7.647 -13.361 1.00 74.24 H new ATOM 0 HD2 PRO A 501 1.330 7.710 -10.658 1.00 42.22 H new ATOM 0 HD3 PRO A 501 1.796 6.241 -11.493 1.00 42.22 H new ATOM 2024 N VAL A 508 2.312 13.443 -2.426 1.00 64.54 N ATOM 2025 CA VAL A 508 1.756 12.069 -2.653 1.00 50.02 C ATOM 2026 C VAL A 508 2.255 11.373 -3.961 1.00 61.03 C ATOM 2027 O VAL A 508 1.657 11.501 -5.034 1.00 0.00 O ATOM 2028 CB VAL A 508 0.174 12.037 -2.641 1.00 34.24 C ATOM 2029 CG1 VAL A 508 -0.341 10.573 -2.580 1.00 15.33 C ATOM 2030 CG2 VAL A 508 -0.427 12.881 -1.492 1.00 24.55 C ATOM 0 HA VAL A 508 2.144 11.505 -1.805 1.00 50.02 H new ATOM 0 HB VAL A 508 -0.163 12.491 -3.573 1.00 34.24 H new ATOM 0 HG11 VAL A 508 -1.431 10.571 -2.572 1.00 15.33 H new ATOM 0 HG12 VAL A 508 0.017 10.025 -3.451 1.00 15.33 H new ATOM 0 HG13 VAL A 508 0.029 10.095 -1.673 1.00 15.33 H new ATOM 0 HG21 VAL A 508 -1.515 12.825 -1.530 1.00 24.55 H new ATOM 0 HG22 VAL A 508 -0.077 12.495 -0.535 1.00 24.55 H new ATOM 0 HG23 VAL A 508 -0.114 13.919 -1.601 1.00 24.55 H new ATOM 2040 N ARG A 509 3.397 10.698 -3.832 1.00 30.54 N ATOM 2041 CA ARG A 509 4.017 9.863 -4.886 1.00 1.04 C ATOM 2042 C ARG A 509 4.172 8.400 -4.386 1.00 3.21 C ATOM 2043 O ARG A 509 4.386 7.471 -5.169 1.00 5.25 O ATOM 2044 CB ARG A 509 5.391 10.464 -5.297 1.00 23.32 C ATOM 2045 CG ARG A 509 6.142 9.657 -6.377 1.00 40.24 C ATOM 2046 CD ARG A 509 7.572 10.155 -6.624 1.00 10.30 C ATOM 2047 NE ARG A 509 8.371 9.126 -7.315 1.00 51.14 N ATOM 2048 CZ ARG A 509 9.665 8.927 -7.170 1.00 52.21 C ATOM 2049 NH1 ARG A 509 10.409 9.737 -6.481 1.00 41.50 N ATOM 2050 NH2 ARG A 509 10.211 7.909 -7.737 1.00 64.31 N ATOM 0 H ARG A 509 3.940 10.711 -2.969 1.00 30.54 H new ATOM 0 HA ARG A 509 3.372 9.853 -5.765 1.00 1.04 H new ATOM 0 HB2 ARG A 509 5.235 11.479 -5.662 1.00 23.32 H new ATOM 0 HB3 ARG A 509 6.022 10.537 -4.411 1.00 23.32 H new ATOM 0 HG2 ARG A 509 6.176 8.609 -6.079 1.00 40.24 H new ATOM 0 HG3 ARG A 509 5.582 9.705 -7.311 1.00 40.24 H new ATOM 0 HD2 ARG A 509 7.547 11.066 -7.223 1.00 10.30 H new ATOM 0 HD3 ARG A 509 8.042 10.411 -5.675 1.00 10.30 H new ATOM 0 HE ARG A 509 7.877 8.513 -7.964 1.00 51.14 H new ATOM 0 HH11 ARG A 509 9.994 10.554 -6.034 1.00 41.50 H new ATOM 0 HH12 ARG A 509 11.408 9.556 -6.387 1.00 41.50 H new ATOM 0 HH21 ARG A 509 9.643 7.268 -8.291 1.00 64.31 H new ATOM 0 HH22 ARG A 509 11.212 7.743 -7.633 1.00 64.31 H new ATOM 2064 N VAL A 510 4.052 8.200 -3.067 1.00 30.24 N ATOM 2065 CA VAL A 510 4.025 6.859 -2.455 1.00 50.14 C ATOM 2066 C VAL A 510 3.148 6.868 -1.182 1.00 63.13 C ATOM 2067 O VAL A 510 3.008 7.901 -0.514 1.00 73.54 O ATOM 2068 CB VAL A 510 5.478 6.312 -2.129 1.00 71.32 C ATOM 2069 CG1 VAL A 510 6.179 7.129 -1.014 1.00 31.53 C ATOM 2070 CG2 VAL A 510 5.461 4.792 -1.792 1.00 41.11 C ATOM 0 H VAL A 510 3.971 8.960 -2.392 1.00 30.24 H new ATOM 0 HA VAL A 510 3.588 6.179 -3.186 1.00 50.14 H new ATOM 0 HB VAL A 510 6.068 6.442 -3.037 1.00 71.32 H new ATOM 0 HG11 VAL A 510 7.170 6.715 -0.828 1.00 31.53 H new ATOM 0 HG12 VAL A 510 6.273 8.168 -1.329 1.00 31.53 H new ATOM 0 HG13 VAL A 510 5.587 7.079 -0.100 1.00 31.53 H new ATOM 0 HG21 VAL A 510 6.475 4.456 -1.575 1.00 41.11 H new ATOM 0 HG22 VAL A 510 4.827 4.619 -0.922 1.00 41.11 H new ATOM 0 HG23 VAL A 510 5.069 4.235 -2.643 1.00 41.11 H new ATOM 2080 N LEU A 511 2.522 5.719 -0.904 1.00 51.12 N ATOM 2081 CA LEU A 511 1.835 5.434 0.364 1.00 21.44 C ATOM 2082 C LEU A 511 2.013 3.944 0.710 1.00 30.54 C ATOM 2083 O LEU A 511 2.320 3.128 -0.167 1.00 21.42 O ATOM 2084 CB LEU A 511 0.335 5.858 0.286 1.00 55.14 C ATOM 2085 CG LEU A 511 -0.596 5.124 -0.756 1.00 5.45 C ATOM 2086 CD1 LEU A 511 -1.231 3.841 -0.169 1.00 45.35 C ATOM 2087 CD2 LEU A 511 -1.692 6.069 -1.315 1.00 70.12 C ATOM 0 H LEU A 511 2.477 4.945 -1.566 1.00 51.12 H new ATOM 0 HA LEU A 511 2.277 6.021 1.169 1.00 21.44 H new ATOM 0 HB2 LEU A 511 -0.101 5.722 1.276 1.00 55.14 H new ATOM 0 HB3 LEU A 511 0.302 6.925 0.068 1.00 55.14 H new ATOM 0 HG LEU A 511 0.047 4.825 -1.584 1.00 5.45 H new ATOM 0 HD11 LEU A 511 -1.863 3.370 -0.922 1.00 45.35 H new ATOM 0 HD12 LEU A 511 -0.444 3.148 0.128 1.00 45.35 H new ATOM 0 HD13 LEU A 511 -1.835 4.099 0.701 1.00 45.35 H new ATOM 0 HD21 LEU A 511 -2.311 5.526 -2.029 1.00 70.12 H new ATOM 0 HD22 LEU A 511 -2.314 6.430 -0.496 1.00 70.12 H new ATOM 0 HD23 LEU A 511 -1.222 6.916 -1.814 1.00 70.12 H new ATOM 2099 N MET A 512 1.825 3.581 1.986 1.00 34.51 N ATOM 2100 CA MET A 512 1.988 2.184 2.437 1.00 62.54 C ATOM 2101 C MET A 512 0.618 1.537 2.692 1.00 10.14 C ATOM 2102 O MET A 512 -0.076 1.894 3.645 1.00 13.03 O ATOM 2103 CB MET A 512 2.893 2.095 3.712 1.00 34.41 C ATOM 2104 CG MET A 512 4.092 1.157 3.536 1.00 62.24 C ATOM 2105 SD MET A 512 3.629 -0.450 2.862 1.00 61.21 S ATOM 2106 CE MET A 512 5.230 -1.045 2.325 1.00 72.53 C ATOM 0 H MET A 512 1.560 4.231 2.726 1.00 34.51 H new ATOM 0 HA MET A 512 2.488 1.632 1.641 1.00 62.54 H new ATOM 0 HB2 MET A 512 3.254 3.092 3.964 1.00 34.41 H new ATOM 0 HB3 MET A 512 2.291 1.752 4.554 1.00 34.41 H new ATOM 0 HG2 MET A 512 4.821 1.627 2.875 1.00 62.24 H new ATOM 0 HG3 MET A 512 4.581 1.015 4.500 1.00 62.24 H new ATOM 0 HE1 MET A 512 5.332 -2.099 2.584 1.00 72.53 H new ATOM 0 HE2 MET A 512 5.319 -0.926 1.245 1.00 72.53 H new ATOM 0 HE3 MET A 512 6.015 -0.472 2.819 1.00 72.53 H new ATOM 2116 N LEU A 513 0.263 0.568 1.846 1.00 44.11 N ATOM 2117 CA LEU A 513 -0.942 -0.239 2.031 1.00 44.14 C ATOM 2118 C LEU A 513 -0.644 -1.308 3.103 1.00 43.43 C ATOM 2119 O LEU A 513 0.219 -2.169 2.916 1.00 53.11 O ATOM 2120 CB LEU A 513 -1.360 -0.910 0.689 1.00 50.35 C ATOM 2121 CG LEU A 513 -2.714 -1.689 0.708 1.00 43.44 C ATOM 2122 CD1 LEU A 513 -3.897 -0.740 0.981 1.00 54.10 C ATOM 2123 CD2 LEU A 513 -2.929 -2.492 -0.597 1.00 53.31 C ATOM 0 H LEU A 513 0.802 0.322 1.016 1.00 44.11 H new ATOM 0 HA LEU A 513 -1.769 0.392 2.355 1.00 44.14 H new ATOM 0 HB2 LEU A 513 -1.418 -0.138 -0.078 1.00 50.35 H new ATOM 0 HB3 LEU A 513 -0.571 -1.599 0.389 1.00 50.35 H new ATOM 0 HG LEU A 513 -2.666 -2.407 1.526 1.00 43.44 H new ATOM 0 HD11 LEU A 513 -4.826 -1.310 0.988 1.00 54.10 H new ATOM 0 HD12 LEU A 513 -3.760 -0.257 1.948 1.00 54.10 H new ATOM 0 HD13 LEU A 513 -3.943 0.019 0.200 1.00 54.10 H new ATOM 0 HD21 LEU A 513 -3.881 -3.020 -0.546 1.00 53.31 H new ATOM 0 HD22 LEU A 513 -2.937 -1.810 -1.447 1.00 53.31 H new ATOM 0 HD23 LEU A 513 -2.120 -3.213 -0.718 1.00 53.31 H new ATOM 2135 N LEU A 514 -1.337 -1.202 4.243 1.00 73.12 N ATOM 2136 CA LEU A 514 -1.175 -2.099 5.397 1.00 75.34 C ATOM 2137 C LEU A 514 -2.530 -2.718 5.759 1.00 33.42 C ATOM 2138 O LEU A 514 -3.454 -2.022 6.205 1.00 60.34 O ATOM 2139 CB LEU A 514 -0.574 -1.330 6.606 1.00 24.14 C ATOM 2140 CG LEU A 514 0.909 -0.866 6.436 1.00 50.42 C ATOM 2141 CD1 LEU A 514 1.409 -0.093 7.670 1.00 1.41 C ATOM 2142 CD2 LEU A 514 1.836 -2.060 6.122 1.00 74.40 C ATOM 0 H LEU A 514 -2.039 -0.478 4.394 1.00 73.12 H new ATOM 0 HA LEU A 514 -0.482 -2.899 5.135 1.00 75.34 H new ATOM 0 HB2 LEU A 514 -1.191 -0.453 6.800 1.00 24.14 H new ATOM 0 HB3 LEU A 514 -0.639 -1.967 7.488 1.00 24.14 H new ATOM 0 HG LEU A 514 0.937 -0.183 5.587 1.00 50.42 H new ATOM 0 HD11 LEU A 514 2.444 0.212 7.513 1.00 1.41 H new ATOM 0 HD12 LEU A 514 0.789 0.790 7.822 1.00 1.41 H new ATOM 0 HD13 LEU A 514 1.349 -0.734 8.550 1.00 1.41 H new ATOM 0 HD21 LEU A 514 2.861 -1.705 6.009 1.00 74.40 H new ATOM 0 HD22 LEU A 514 1.789 -2.781 6.938 1.00 74.40 H new ATOM 0 HD23 LEU A 514 1.514 -2.538 5.197 1.00 74.40 H new ATOM 2154 N TYR A 515 -2.636 -4.027 5.543 1.00 4.23 N ATOM 2155 CA TYR A 515 -3.850 -4.794 5.817 1.00 14.15 C ATOM 2156 C TYR A 515 -4.087 -4.924 7.346 1.00 53.11 C ATOM 2157 O TYR A 515 -3.294 -5.550 8.053 1.00 41.53 O ATOM 2158 CB TYR A 515 -3.730 -6.181 5.136 1.00 10.12 C ATOM 2159 CG TYR A 515 -4.928 -7.105 5.344 1.00 2.41 C ATOM 2160 CD1 TYR A 515 -6.235 -6.618 5.243 1.00 62.34 C ATOM 2161 CD2 TYR A 515 -4.753 -8.465 5.634 1.00 73.51 C ATOM 2162 CE1 TYR A 515 -7.315 -7.455 5.429 1.00 34.24 C ATOM 2163 CE2 TYR A 515 -5.832 -9.301 5.821 1.00 15.50 C ATOM 2164 CZ TYR A 515 -7.109 -8.795 5.719 1.00 33.44 C ATOM 2165 OH TYR A 515 -8.188 -9.634 5.908 1.00 20.02 O ATOM 0 H TYR A 515 -1.873 -4.592 5.169 1.00 4.23 H new ATOM 0 HA TYR A 515 -4.716 -4.274 5.407 1.00 14.15 H new ATOM 0 HB2 TYR A 515 -3.585 -6.033 4.066 1.00 10.12 H new ATOM 0 HB3 TYR A 515 -2.836 -6.678 5.513 1.00 10.12 H new ATOM 0 HD1 TYR A 515 -6.400 -5.575 5.017 1.00 62.34 H new ATOM 0 HD2 TYR A 515 -3.753 -8.865 5.712 1.00 73.51 H new ATOM 0 HE1 TYR A 515 -8.320 -7.067 5.349 1.00 34.24 H new ATOM 0 HE2 TYR A 515 -5.678 -10.346 6.046 1.00 15.50 H new ATOM 0 HH TYR A 515 -8.599 -9.838 5.042 1.00 20.02 H new ATOM 2175 N SER A 516 -5.195 -4.322 7.829 1.00 20.13 N ATOM 2176 CA SER A 516 -5.567 -4.299 9.274 1.00 11.55 C ATOM 2177 C SER A 516 -5.993 -5.693 9.813 1.00 50.11 C ATOM 2178 O SER A 516 -5.997 -5.916 11.028 1.00 35.31 O ATOM 2179 CB SER A 516 -6.716 -3.291 9.496 1.00 12.22 C ATOM 2180 OG SER A 516 -7.927 -3.716 8.868 1.00 24.02 O ATOM 0 H SER A 516 -5.863 -3.835 7.232 1.00 20.13 H new ATOM 0 HA SER A 516 -4.677 -3.998 9.827 1.00 11.55 H new ATOM 0 HB2 SER A 516 -6.887 -3.165 10.565 1.00 12.22 H new ATOM 0 HB3 SER A 516 -6.425 -2.317 9.102 1.00 12.22 H new ATOM 0 HG SER A 516 -8.686 -3.520 9.455 1.00 24.02 H new ATOM 2186 N SER A 517 -6.360 -6.592 8.874 1.00 43.43 N ATOM 2187 CA SER A 517 -6.796 -7.992 9.131 1.00 25.20 C ATOM 2188 C SER A 517 -8.220 -8.095 9.733 1.00 2.42 C ATOM 2189 O SER A 517 -9.114 -8.656 9.094 1.00 1.40 O ATOM 2190 CB SER A 517 -5.772 -8.805 9.967 1.00 22.32 C ATOM 2191 OG SER A 517 -6.219 -10.134 10.200 1.00 75.33 O ATOM 0 H SER A 517 -6.363 -6.360 7.881 1.00 43.43 H new ATOM 0 HA SER A 517 -6.840 -8.450 8.143 1.00 25.20 H new ATOM 0 HB2 SER A 517 -4.815 -8.829 9.446 1.00 22.32 H new ATOM 0 HB3 SER A 517 -5.603 -8.306 10.921 1.00 22.32 H new ATOM 0 HG SER A 517 -5.549 -10.617 10.728 1.00 75.33 H new ATOM 2197 N LYS A 518 -8.428 -7.557 10.952 1.00 63.44 N ATOM 2198 CA LYS A 518 -9.716 -7.690 11.683 1.00 65.12 C ATOM 2199 C LYS A 518 -10.902 -6.980 10.977 1.00 64.11 C ATOM 2200 O LYS A 518 -11.987 -7.557 10.841 1.00 52.42 O ATOM 2201 CB LYS A 518 -9.577 -7.179 13.145 1.00 62.43 C ATOM 2202 CG LYS A 518 -8.640 -8.036 14.031 1.00 74.33 C ATOM 2203 CD LYS A 518 -8.721 -7.649 15.527 1.00 61.13 C ATOM 2204 CE LYS A 518 -7.853 -8.548 16.422 1.00 0.24 C ATOM 2205 NZ LYS A 518 -8.019 -8.214 17.856 1.00 23.23 N ATOM 0 H LYS A 518 -7.721 -7.023 11.457 1.00 63.44 H new ATOM 0 HA LYS A 518 -9.949 -8.755 11.691 1.00 65.12 H new ATOM 0 HB2 LYS A 518 -9.204 -6.155 13.126 1.00 62.43 H new ATOM 0 HB3 LYS A 518 -10.566 -7.150 13.603 1.00 62.43 H new ATOM 0 HG2 LYS A 518 -8.900 -9.088 13.917 1.00 74.33 H new ATOM 0 HG3 LYS A 518 -7.613 -7.922 13.685 1.00 74.33 H new ATOM 0 HD2 LYS A 518 -8.407 -6.612 15.647 1.00 61.13 H new ATOM 0 HD3 LYS A 518 -9.758 -7.708 15.857 1.00 61.13 H new ATOM 0 HE2 LYS A 518 -8.120 -9.592 16.258 1.00 0.24 H new ATOM 0 HE3 LYS A 518 -6.805 -8.439 16.141 1.00 0.24 H new ATOM 0 HZ1 LYS A 518 -7.419 -8.840 18.430 1.00 23.23 H new ATOM 0 HZ2 LYS A 518 -7.741 -7.225 18.017 1.00 23.23 H new ATOM 0 HZ3 LYS A 518 -9.014 -8.342 18.129 1.00 23.23 H new ATOM 2219 N LYS A 519 -10.687 -5.731 10.535 1.00 21.41 N ATOM 2220 CA LYS A 519 -11.755 -4.909 9.902 1.00 74.21 C ATOM 2221 C LYS A 519 -11.721 -4.954 8.348 1.00 2.13 C ATOM 2222 O LYS A 519 -12.674 -4.508 7.700 1.00 62.22 O ATOM 2223 CB LYS A 519 -11.664 -3.448 10.416 1.00 42.33 C ATOM 2224 CG LYS A 519 -11.803 -3.306 11.952 1.00 41.54 C ATOM 2225 CD LYS A 519 -11.849 -1.838 12.439 1.00 53.00 C ATOM 2226 CE LYS A 519 -13.100 -1.087 11.941 1.00 55.10 C ATOM 2227 NZ LYS A 519 -13.167 0.300 12.461 1.00 53.43 N ATOM 0 H LYS A 519 -9.785 -5.259 10.600 1.00 21.41 H new ATOM 0 HA LYS A 519 -12.712 -5.342 10.193 1.00 74.21 H new ATOM 0 HB2 LYS A 519 -10.708 -3.025 10.108 1.00 42.33 H new ATOM 0 HB3 LYS A 519 -12.443 -2.856 9.936 1.00 42.33 H new ATOM 0 HG2 LYS A 519 -12.711 -3.815 12.274 1.00 41.54 H new ATOM 0 HG3 LYS A 519 -10.966 -3.813 12.432 1.00 41.54 H new ATOM 0 HD2 LYS A 519 -11.829 -1.820 13.529 1.00 53.00 H new ATOM 0 HD3 LYS A 519 -10.956 -1.317 12.095 1.00 53.00 H new ATOM 0 HE2 LYS A 519 -13.098 -1.065 10.851 1.00 55.10 H new ATOM 0 HE3 LYS A 519 -13.994 -1.631 12.247 1.00 55.10 H new ATOM 0 HZ1 LYS A 519 -14.024 0.765 12.100 1.00 53.43 H new ATOM 0 HZ2 LYS A 519 -13.196 0.280 13.500 1.00 53.43 H new ATOM 0 HZ3 LYS A 519 -12.328 0.829 12.148 1.00 53.43 H new ATOM 2241 N LYS A 520 -10.621 -5.505 7.767 1.00 64.32 N ATOM 2242 CA LYS A 520 -10.400 -5.610 6.287 1.00 23.43 C ATOM 2243 C LYS A 520 -10.472 -4.230 5.551 1.00 25.34 C ATOM 2244 O LYS A 520 -10.721 -4.181 4.342 1.00 10.11 O ATOM 2245 CB LYS A 520 -11.389 -6.632 5.617 1.00 23.21 C ATOM 2246 CG LYS A 520 -11.213 -8.132 5.988 1.00 51.15 C ATOM 2247 CD LYS A 520 -11.766 -8.521 7.380 1.00 33.52 C ATOM 2248 CE LYS A 520 -13.294 -8.355 7.509 1.00 74.13 C ATOM 2249 NZ LYS A 520 -13.781 -8.785 8.846 1.00 11.42 N ATOM 0 H LYS A 520 -9.852 -5.894 8.313 1.00 64.32 H new ATOM 0 HA LYS A 520 -9.382 -5.983 6.175 1.00 23.43 H new ATOM 0 HB2 LYS A 520 -12.406 -6.337 5.874 1.00 23.21 H new ATOM 0 HB3 LYS A 520 -11.293 -6.537 4.535 1.00 23.21 H new ATOM 0 HG2 LYS A 520 -11.709 -8.740 5.232 1.00 51.15 H new ATOM 0 HG3 LYS A 520 -10.152 -8.380 5.951 1.00 51.15 H new ATOM 0 HD2 LYS A 520 -11.503 -9.558 7.589 1.00 33.52 H new ATOM 0 HD3 LYS A 520 -11.278 -7.910 8.139 1.00 33.52 H new ATOM 0 HE2 LYS A 520 -13.562 -7.312 7.342 1.00 74.13 H new ATOM 0 HE3 LYS A 520 -13.791 -8.940 6.735 1.00 74.13 H new ATOM 0 HZ1 LYS A 520 -14.760 -8.460 8.980 1.00 11.42 H new ATOM 0 HZ2 LYS A 520 -13.748 -9.823 8.910 1.00 11.42 H new ATOM 0 HZ3 LYS A 520 -13.176 -8.373 9.585 1.00 11.42 H new ATOM 2263 N ILE A 521 -10.198 -3.129 6.278 1.00 13.51 N ATOM 2264 CA ILE A 521 -10.360 -1.739 5.756 1.00 44.22 C ATOM 2265 C ILE A 521 -9.236 -1.317 4.776 1.00 15.23 C ATOM 2266 O ILE A 521 -9.438 -0.408 3.963 1.00 34.13 O ATOM 2267 CB ILE A 521 -10.417 -0.693 6.933 1.00 44.12 C ATOM 2268 CG1 ILE A 521 -9.116 -0.751 7.805 1.00 43.42 C ATOM 2269 CG2 ILE A 521 -11.685 -0.898 7.794 1.00 63.22 C ATOM 2270 CD1 ILE A 521 -9.041 0.273 8.924 1.00 64.11 C ATOM 0 H ILE A 521 -9.859 -3.167 7.239 1.00 13.51 H new ATOM 0 HA ILE A 521 -11.302 -1.746 5.208 1.00 44.22 H new ATOM 0 HB ILE A 521 -10.472 0.304 6.495 1.00 44.12 H new ATOM 0 HG12 ILE A 521 -9.033 -1.747 8.240 1.00 43.42 H new ATOM 0 HG13 ILE A 521 -8.254 -0.616 7.152 1.00 43.42 H new ATOM 0 HG21 ILE A 521 -11.701 -0.164 8.599 1.00 63.22 H new ATOM 0 HG22 ILE A 521 -12.571 -0.773 7.172 1.00 63.22 H new ATOM 0 HG23 ILE A 521 -11.678 -1.902 8.218 1.00 63.22 H new ATOM 0 HD11 ILE A 521 -8.104 0.150 9.468 1.00 64.11 H new ATOM 0 HD12 ILE A 521 -9.087 1.277 8.502 1.00 64.11 H new ATOM 0 HD13 ILE A 521 -9.878 0.128 9.607 1.00 64.11 H new ATOM 2282 N PHE A 522 -8.061 -1.972 4.911 1.00 25.41 N ATOM 2283 CA PHE A 522 -6.827 -1.652 4.146 1.00 74.23 C ATOM 2284 C PHE A 522 -6.372 -0.187 4.365 1.00 74.04 C ATOM 2285 O PHE A 522 -6.865 0.749 3.724 1.00 33.11 O ATOM 2286 CB PHE A 522 -6.979 -1.967 2.634 1.00 33.12 C ATOM 2287 CG PHE A 522 -6.936 -3.450 2.295 1.00 74.51 C ATOM 2288 CD1 PHE A 522 -5.725 -4.085 2.006 1.00 21.53 C ATOM 2289 CD2 PHE A 522 -8.100 -4.205 2.249 1.00 62.22 C ATOM 2290 CE1 PHE A 522 -5.686 -5.424 1.678 1.00 63.21 C ATOM 2291 CE2 PHE A 522 -8.059 -5.538 1.923 1.00 23.41 C ATOM 2292 CZ PHE A 522 -6.852 -6.152 1.637 1.00 1.32 C ATOM 0 H PHE A 522 -7.938 -2.748 5.562 1.00 25.41 H new ATOM 0 HA PHE A 522 -6.045 -2.302 4.539 1.00 74.23 H new ATOM 0 HB2 PHE A 522 -7.924 -1.553 2.282 1.00 33.12 H new ATOM 0 HB3 PHE A 522 -6.185 -1.458 2.087 1.00 33.12 H new ATOM 0 HD1 PHE A 522 -4.806 -3.519 2.040 1.00 21.53 H new ATOM 0 HD2 PHE A 522 -9.048 -3.739 2.472 1.00 62.22 H new ATOM 0 HE1 PHE A 522 -4.743 -5.899 1.454 1.00 63.21 H new ATOM 0 HE2 PHE A 522 -8.974 -6.111 1.890 1.00 23.41 H new ATOM 0 HZ PHE A 522 -6.826 -7.201 1.382 1.00 1.32 H new ATOM 2302 N MET A 523 -5.427 -0.019 5.289 1.00 50.35 N ATOM 2303 CA MET A 523 -4.856 1.309 5.634 1.00 14.12 C ATOM 2304 C MET A 523 -3.857 1.783 4.549 1.00 51.13 C ATOM 2305 O MET A 523 -3.231 0.967 3.890 1.00 11.31 O ATOM 2306 CB MET A 523 -4.164 1.245 7.025 1.00 0.50 C ATOM 2307 CG MET A 523 -5.079 0.752 8.153 1.00 41.32 C ATOM 2308 SD MET A 523 -4.281 0.767 9.771 1.00 22.30 S ATOM 2309 CE MET A 523 -5.615 0.178 10.817 1.00 23.12 C ATOM 0 H MET A 523 -5.028 -0.789 5.826 1.00 50.35 H new ATOM 0 HA MET A 523 -5.669 2.034 5.678 1.00 14.12 H new ATOM 0 HB2 MET A 523 -3.298 0.586 6.959 1.00 0.50 H new ATOM 0 HB3 MET A 523 -3.791 2.237 7.280 1.00 0.50 H new ATOM 0 HG2 MET A 523 -5.971 1.378 8.189 1.00 41.32 H new ATOM 0 HG3 MET A 523 -5.410 -0.262 7.927 1.00 41.32 H new ATOM 0 HE1 MET A 523 -5.205 -0.186 11.759 1.00 23.12 H new ATOM 0 HE2 MET A 523 -6.310 0.994 11.015 1.00 23.12 H new ATOM 0 HE3 MET A 523 -6.142 -0.632 10.313 1.00 23.12 H new ATOM 2319 N GLY A 524 -3.732 3.108 4.363 1.00 62.11 N ATOM 2320 CA GLY A 524 -2.790 3.685 3.387 1.00 3.24 C ATOM 2321 C GLY A 524 -2.034 4.883 3.957 1.00 3.13 C ATOM 2322 O GLY A 524 -2.537 6.003 3.921 1.00 53.02 O ATOM 0 H GLY A 524 -4.274 3.802 4.878 1.00 62.11 H new ATOM 0 HA2 GLY A 524 -2.077 2.921 3.077 1.00 3.24 H new ATOM 0 HA3 GLY A 524 -3.336 3.992 2.495 1.00 3.24 H new ATOM 2326 N LEU A 525 -0.819 4.639 4.485 1.00 43.23 N ATOM 2327 CA LEU A 525 0.023 5.679 5.123 1.00 71.12 C ATOM 2328 C LEU A 525 0.790 6.508 4.068 1.00 64.21 C ATOM 2329 O LEU A 525 1.785 6.044 3.516 1.00 62.21 O ATOM 2330 CB LEU A 525 1.002 4.997 6.127 1.00 23.22 C ATOM 2331 CG LEU A 525 0.373 4.593 7.504 1.00 71.32 C ATOM 2332 CD1 LEU A 525 1.245 3.565 8.249 1.00 45.14 C ATOM 2333 CD2 LEU A 525 0.131 5.848 8.387 1.00 61.34 C ATOM 0 H LEU A 525 -0.389 3.714 4.483 1.00 43.23 H new ATOM 0 HA LEU A 525 -0.619 6.374 5.664 1.00 71.12 H new ATOM 0 HB2 LEU A 525 1.414 4.103 5.658 1.00 23.22 H new ATOM 0 HB3 LEU A 525 1.837 5.673 6.312 1.00 23.22 H new ATOM 0 HG LEU A 525 -0.588 4.122 7.299 1.00 71.32 H new ATOM 0 HD11 LEU A 525 0.775 3.310 9.199 1.00 45.14 H new ATOM 0 HD12 LEU A 525 1.346 2.666 7.642 1.00 45.14 H new ATOM 0 HD13 LEU A 525 2.231 3.991 8.434 1.00 45.14 H new ATOM 0 HD21 LEU A 525 -0.306 5.545 9.338 1.00 61.34 H new ATOM 0 HD22 LEU A 525 1.079 6.354 8.568 1.00 61.34 H new ATOM 0 HD23 LEU A 525 -0.550 6.527 7.875 1.00 61.34 H new ATOM 2345 N ILE A 526 0.328 7.750 3.825 1.00 25.31 N ATOM 2346 CA ILE A 526 0.965 8.705 2.898 1.00 13.02 C ATOM 2347 C ILE A 526 2.021 9.550 3.658 1.00 15.24 C ATOM 2348 O ILE A 526 1.642 10.442 4.434 1.00 64.24 O ATOM 2349 CB ILE A 526 -0.098 9.679 2.249 1.00 71.15 C ATOM 2350 CG1 ILE A 526 -1.210 8.885 1.482 1.00 31.10 C ATOM 2351 CG2 ILE A 526 0.598 10.716 1.323 1.00 11.33 C ATOM 2352 CD1 ILE A 526 -2.335 9.739 0.903 1.00 75.12 C ATOM 0 H ILE A 526 -0.509 8.123 4.273 1.00 25.31 H new ATOM 0 HA ILE A 526 1.440 8.129 2.104 1.00 13.02 H new ATOM 0 HB ILE A 526 -0.589 10.224 3.056 1.00 71.15 H new ATOM 0 HG12 ILE A 526 -0.742 8.329 0.669 1.00 31.10 H new ATOM 0 HG13 ILE A 526 -1.645 8.152 2.161 1.00 31.10 H new ATOM 0 HG21 ILE A 526 -0.152 11.376 0.887 1.00 11.33 H new ATOM 0 HG22 ILE A 526 1.306 11.306 1.905 1.00 11.33 H new ATOM 0 HG23 ILE A 526 1.129 10.194 0.527 1.00 11.33 H new ATOM 0 HD11 ILE A 526 -3.053 9.097 0.392 1.00 75.12 H new ATOM 0 HD12 ILE A 526 -2.836 10.275 1.709 1.00 75.12 H new ATOM 0 HD13 ILE A 526 -1.920 10.455 0.194 1.00 75.12 H new ATOM 2364 N PRO A 527 3.353 9.294 3.463 1.00 73.05 N ATOM 2365 CA PRO A 527 4.412 10.078 4.144 1.00 53.24 C ATOM 2366 C PRO A 527 4.454 11.545 3.665 1.00 1.44 C ATOM 2367 O PRO A 527 4.061 11.853 2.543 1.00 24.31 O ATOM 2368 CB PRO A 527 5.714 9.315 3.775 1.00 43.00 C ATOM 2369 CG PRO A 527 5.391 8.651 2.470 1.00 44.05 C ATOM 2370 CD PRO A 527 3.936 8.250 2.577 1.00 72.53 C ATOM 0 HA PRO A 527 4.250 10.152 5.219 1.00 53.24 H new ATOM 0 HB2 PRO A 527 6.560 9.995 3.678 1.00 43.00 H new ATOM 0 HB3 PRO A 527 5.978 8.584 4.539 1.00 43.00 H new ATOM 0 HG2 PRO A 527 5.552 9.330 1.633 1.00 44.05 H new ATOM 0 HG3 PRO A 527 6.027 7.782 2.302 1.00 44.05 H new ATOM 0 HD2 PRO A 527 3.451 8.235 1.601 1.00 72.53 H new ATOM 0 HD3 PRO A 527 3.825 7.253 3.004 1.00 72.53 H new ATOM 2378 N TYR A 528 4.886 12.449 4.545 1.00 60.10 N ATOM 2379 CA TYR A 528 5.167 13.859 4.173 1.00 71.15 C ATOM 2380 C TYR A 528 6.479 13.940 3.369 1.00 72.40 C ATOM 2381 O TYR A 528 6.679 14.841 2.549 1.00 14.42 O ATOM 2382 CB TYR A 528 5.224 14.740 5.450 1.00 24.10 C ATOM 2383 CG TYR A 528 3.985 14.605 6.356 1.00 40.14 C ATOM 2384 CD1 TYR A 528 2.722 14.311 5.820 1.00 54.32 C ATOM 2385 CD2 TYR A 528 4.075 14.767 7.739 1.00 55.11 C ATOM 2386 CE1 TYR A 528 1.613 14.185 6.623 1.00 72.53 C ATOM 2387 CE2 TYR A 528 2.961 14.640 8.550 1.00 20.15 C ATOM 2388 CZ TYR A 528 1.732 14.348 7.986 1.00 5.23 C ATOM 2389 OH TYR A 528 0.618 14.223 8.792 1.00 55.22 O ATOM 0 H TYR A 528 5.053 12.240 5.529 1.00 60.10 H new ATOM 0 HA TYR A 528 4.364 14.237 3.540 1.00 71.15 H new ATOM 0 HB2 TYR A 528 6.112 14.475 6.023 1.00 24.10 H new ATOM 0 HB3 TYR A 528 5.335 15.784 5.155 1.00 24.10 H new ATOM 0 HD1 TYR A 528 2.619 14.181 4.753 1.00 54.32 H new ATOM 0 HD2 TYR A 528 5.032 14.996 8.185 1.00 55.11 H new ATOM 0 HE1 TYR A 528 0.651 13.959 6.187 1.00 72.53 H new ATOM 0 HE2 TYR A 528 3.051 14.768 9.619 1.00 20.15 H new ATOM 0 HH TYR A 528 0.873 14.366 9.727 1.00 55.22 H new ATOM 2399 N ASP A 529 7.361 12.967 3.633 1.00 73.43 N ATOM 2400 CA ASP A 529 8.639 12.795 2.913 1.00 25.44 C ATOM 2401 C ASP A 529 8.591 11.526 2.034 1.00 40.41 C ATOM 2402 O ASP A 529 8.878 10.422 2.508 1.00 22.13 O ATOM 2403 CB ASP A 529 9.811 12.716 3.928 1.00 45.52 C ATOM 2404 CG ASP A 529 9.958 14.003 4.757 1.00 41.54 C ATOM 2405 OD1 ASP A 529 9.127 14.238 5.663 1.00 45.10 O ATOM 2406 OD2 ASP A 529 10.884 14.800 4.492 1.00 23.43 O ATOM 0 H ASP A 529 7.210 12.267 4.360 1.00 73.43 H new ATOM 0 HA ASP A 529 8.800 13.655 2.262 1.00 25.44 H new ATOM 0 HB2 ASP A 529 9.651 11.872 4.599 1.00 45.52 H new ATOM 0 HB3 ASP A 529 10.740 12.525 3.391 1.00 45.52 H new ATOM 2411 N GLN A 530 8.178 11.688 0.763 1.00 61.12 N ATOM 2412 CA GLN A 530 8.185 10.594 -0.239 1.00 54.44 C ATOM 2413 C GLN A 530 9.623 10.122 -0.543 1.00 53.24 C ATOM 2414 O GLN A 530 9.885 8.926 -0.595 1.00 55.04 O ATOM 2415 CB GLN A 530 7.462 11.044 -1.548 1.00 34.02 C ATOM 2416 CG GLN A 530 5.939 10.795 -1.564 1.00 3.41 C ATOM 2417 CD GLN A 530 5.139 11.465 -0.447 1.00 64.44 C ATOM 2418 OE1 GLN A 530 5.493 12.530 0.054 1.00 71.04 O ATOM 2419 NE2 GLN A 530 4.042 10.839 -0.052 1.00 11.13 N ATOM 0 H GLN A 530 7.831 12.575 0.398 1.00 61.12 H new ATOM 0 HA GLN A 530 7.641 9.749 0.183 1.00 54.44 H new ATOM 0 HB2 GLN A 530 7.644 12.108 -1.699 1.00 34.02 H new ATOM 0 HB3 GLN A 530 7.911 10.521 -2.392 1.00 34.02 H new ATOM 0 HG2 GLN A 530 5.545 11.137 -2.521 1.00 3.41 H new ATOM 0 HG3 GLN A 530 5.766 9.720 -1.513 1.00 3.41 H new ATOM 0 HE21 GLN A 530 3.774 9.956 -0.487 1.00 11.13 H new ATOM 0 HE22 GLN A 530 3.465 11.239 0.687 1.00 11.13 H new ATOM 2428 N SER A 531 10.540 11.082 -0.715 1.00 14.44 N ATOM 2429 CA SER A 531 11.969 10.808 -0.997 1.00 51.32 C ATOM 2430 C SER A 531 12.663 10.159 0.223 1.00 21.31 C ATOM 2431 O SER A 531 13.507 9.276 0.059 1.00 34.35 O ATOM 2432 CB SER A 531 12.689 12.118 -1.378 1.00 31.23 C ATOM 2433 OG SER A 531 12.538 13.097 -0.357 1.00 14.11 O ATOM 0 H SER A 531 10.319 12.076 -0.664 1.00 14.44 H new ATOM 0 HA SER A 531 12.024 10.108 -1.831 1.00 51.32 H new ATOM 0 HB2 SER A 531 13.748 11.920 -1.544 1.00 31.23 H new ATOM 0 HB3 SER A 531 12.285 12.500 -2.316 1.00 31.23 H new ATOM 0 HG SER A 531 13.004 13.918 -0.620 1.00 14.11 H new ATOM 2439 N GLY A 532 12.284 10.614 1.437 1.00 52.33 N ATOM 2440 CA GLY A 532 12.776 10.031 2.696 1.00 25.22 C ATOM 2441 C GLY A 532 12.242 8.618 2.969 1.00 32.31 C ATOM 2442 O GLY A 532 12.953 7.770 3.516 1.00 1.03 O ATOM 0 H GLY A 532 11.634 11.389 1.568 1.00 52.33 H new ATOM 0 HA2 GLY A 532 13.865 10.000 2.671 1.00 25.22 H new ATOM 0 HA3 GLY A 532 12.494 10.683 3.523 1.00 25.22 H new ATOM 2446 N PHE A 533 10.978 8.369 2.575 1.00 70.52 N ATOM 2447 CA PHE A 533 10.325 7.054 2.756 1.00 13.14 C ATOM 2448 C PHE A 533 10.896 6.007 1.772 1.00 33.21 C ATOM 2449 O PHE A 533 11.314 4.920 2.184 1.00 23.42 O ATOM 2450 CB PHE A 533 8.793 7.182 2.587 1.00 70.14 C ATOM 2451 CG PHE A 533 8.033 5.894 2.901 1.00 61.11 C ATOM 2452 CD1 PHE A 533 7.993 5.403 4.204 1.00 61.04 C ATOM 2453 CD2 PHE A 533 7.381 5.167 1.902 1.00 32.13 C ATOM 2454 CE1 PHE A 533 7.328 4.234 4.499 1.00 22.54 C ATOM 2455 CE2 PHE A 533 6.711 3.996 2.201 1.00 71.02 C ATOM 2456 CZ PHE A 533 6.692 3.531 3.499 1.00 31.24 C ATOM 0 H PHE A 533 10.384 9.066 2.126 1.00 70.52 H new ATOM 0 HA PHE A 533 10.535 6.710 3.769 1.00 13.14 H new ATOM 0 HB2 PHE A 533 8.429 7.977 3.238 1.00 70.14 H new ATOM 0 HB3 PHE A 533 8.573 7.483 1.563 1.00 70.14 H new ATOM 0 HD1 PHE A 533 8.490 5.947 4.994 1.00 61.04 H new ATOM 0 HD2 PHE A 533 7.401 5.525 0.883 1.00 32.13 H new ATOM 0 HE1 PHE A 533 7.305 3.868 5.515 1.00 22.54 H new ATOM 0 HE2 PHE A 533 6.204 3.447 1.421 1.00 71.02 H new ATOM 0 HZ PHE A 533 6.176 2.611 3.733 1.00 31.24 H new ATOM 2466 N VAL A 534 10.910 6.362 0.471 1.00 1.41 N ATOM 2467 CA VAL A 534 11.486 5.520 -0.605 1.00 21.33 C ATOM 2468 C VAL A 534 13.019 5.329 -0.418 1.00 73.32 C ATOM 2469 O VAL A 534 13.565 4.340 -0.875 1.00 33.01 O ATOM 2470 CB VAL A 534 11.144 6.102 -2.040 1.00 54.31 C ATOM 2471 CG1 VAL A 534 11.811 5.297 -3.192 1.00 2.33 C ATOM 2472 CG2 VAL A 534 9.606 6.165 -2.249 1.00 31.43 C ATOM 0 H VAL A 534 10.522 7.243 0.133 1.00 1.41 H new ATOM 0 HA VAL A 534 11.024 4.535 -0.533 1.00 21.33 H new ATOM 0 HB VAL A 534 11.557 7.110 -2.076 1.00 54.31 H new ATOM 0 HG11 VAL A 534 11.541 5.741 -4.150 1.00 2.33 H new ATOM 0 HG12 VAL A 534 12.894 5.321 -3.073 1.00 2.33 H new ATOM 0 HG13 VAL A 534 11.465 4.264 -3.161 1.00 2.33 H new ATOM 0 HG21 VAL A 534 9.389 6.567 -3.239 1.00 31.43 H new ATOM 0 HG22 VAL A 534 9.186 5.163 -2.164 1.00 31.43 H new ATOM 0 HG23 VAL A 534 9.162 6.810 -1.491 1.00 31.43 H new ATOM 2482 N ASN A 535 13.700 6.260 0.291 1.00 43.24 N ATOM 2483 CA ASN A 535 15.116 6.080 0.702 1.00 62.35 C ATOM 2484 C ASN A 535 15.299 4.789 1.551 1.00 64.52 C ATOM 2485 O ASN A 535 16.274 4.049 1.380 1.00 21.41 O ATOM 2486 CB ASN A 535 15.599 7.325 1.487 1.00 61.54 C ATOM 2487 CG ASN A 535 17.066 7.240 1.895 1.00 71.45 C ATOM 2488 OD1 ASN A 535 17.404 6.836 3.005 1.00 20.54 O ATOM 2489 ND2 ASN A 535 17.950 7.592 0.987 1.00 42.13 N ATOM 0 H ASN A 535 13.292 7.145 0.591 1.00 43.24 H new ATOM 0 HA ASN A 535 15.723 5.970 -0.197 1.00 62.35 H new ATOM 0 HB2 ASN A 535 15.449 8.214 0.875 1.00 61.54 H new ATOM 0 HB3 ASN A 535 14.986 7.445 2.380 1.00 61.54 H new ATOM 0 HD21 ASN A 535 18.947 7.533 1.196 1.00 42.13 H new ATOM 0 HD22 ASN A 535 17.639 7.924 0.074 1.00 42.13 H new ATOM 2496 N GLY A 536 14.340 4.545 2.465 1.00 35.25 N ATOM 2497 CA GLY A 536 14.294 3.303 3.248 1.00 34.12 C ATOM 2498 C GLY A 536 13.819 2.087 2.431 1.00 1.14 C ATOM 2499 O GLY A 536 14.452 1.025 2.457 1.00 13.51 O ATOM 0 H GLY A 536 13.585 5.197 2.677 1.00 35.25 H new ATOM 0 HA2 GLY A 536 15.286 3.097 3.649 1.00 34.12 H new ATOM 0 HA3 GLY A 536 13.628 3.443 4.100 1.00 34.12 H new ATOM 2503 N ILE A 537 12.698 2.268 1.691 1.00 21.32 N ATOM 2504 CA ILE A 537 12.042 1.198 0.889 1.00 33.22 C ATOM 2505 C ILE A 537 12.988 0.592 -0.181 1.00 74.22 C ATOM 2506 O ILE A 537 13.128 -0.625 -0.263 1.00 41.34 O ATOM 2507 CB ILE A 537 10.716 1.736 0.213 1.00 23.23 C ATOM 2508 CG1 ILE A 537 9.663 2.109 1.305 1.00 13.21 C ATOM 2509 CG2 ILE A 537 10.112 0.736 -0.811 1.00 23.23 C ATOM 2510 CD1 ILE A 537 9.183 0.938 2.152 1.00 23.50 C ATOM 0 H ILE A 537 12.218 3.166 1.631 1.00 21.32 H new ATOM 0 HA ILE A 537 11.787 0.397 1.583 1.00 33.22 H new ATOM 0 HB ILE A 537 10.986 2.631 -0.348 1.00 23.23 H new ATOM 0 HG12 ILE A 537 10.094 2.863 1.963 1.00 13.21 H new ATOM 0 HG13 ILE A 537 8.801 2.565 0.818 1.00 13.21 H new ATOM 0 HG21 ILE A 537 9.205 1.160 -1.242 1.00 23.23 H new ATOM 0 HG22 ILE A 537 10.835 0.546 -1.604 1.00 23.23 H new ATOM 0 HG23 ILE A 537 9.872 -0.200 -0.307 1.00 23.23 H new ATOM 0 HD11 ILE A 537 8.455 1.291 2.882 1.00 23.50 H new ATOM 0 HD12 ILE A 537 8.719 0.190 1.509 1.00 23.50 H new ATOM 0 HD13 ILE A 537 10.031 0.493 2.672 1.00 23.50 H new ATOM 2522 N ARG A 538 13.663 1.471 -0.933 1.00 74.14 N ATOM 2523 CA ARG A 538 14.603 1.122 -2.039 1.00 32.10 C ATOM 2524 C ARG A 538 15.653 0.060 -1.625 1.00 52.22 C ATOM 2525 O ARG A 538 16.017 -0.820 -2.415 1.00 54.10 O ATOM 2526 CB ARG A 538 15.307 2.427 -2.493 1.00 72.11 C ATOM 2527 CG ARG A 538 16.401 2.284 -3.572 1.00 25.31 C ATOM 2528 CD ARG A 538 17.007 3.647 -3.955 1.00 11.34 C ATOM 2529 NE ARG A 538 18.086 3.523 -4.951 1.00 40.44 N ATOM 2530 CZ ARG A 538 18.186 4.220 -6.067 1.00 42.42 C ATOM 2531 NH1 ARG A 538 17.227 5.001 -6.470 1.00 24.24 N ATOM 2532 NH2 ARG A 538 19.242 4.099 -6.796 1.00 42.33 N ATOM 0 H ARG A 538 13.577 2.478 -0.795 1.00 74.14 H new ATOM 0 HA ARG A 538 14.031 0.678 -2.854 1.00 32.10 H new ATOM 0 HB2 ARG A 538 14.546 3.111 -2.868 1.00 72.11 H new ATOM 0 HB3 ARG A 538 15.753 2.896 -1.616 1.00 72.11 H new ATOM 0 HG2 ARG A 538 17.189 1.626 -3.206 1.00 25.31 H new ATOM 0 HG3 ARG A 538 15.978 1.812 -4.459 1.00 25.31 H new ATOM 0 HD2 ARG A 538 16.223 4.292 -4.352 1.00 11.34 H new ATOM 0 HD3 ARG A 538 17.396 4.133 -3.060 1.00 11.34 H new ATOM 0 HE ARG A 538 18.819 2.839 -4.761 1.00 40.44 H new ATOM 0 HH11 ARG A 538 16.373 5.085 -5.919 1.00 24.24 H new ATOM 0 HH12 ARG A 538 17.329 5.529 -7.337 1.00 24.24 H new ATOM 0 HH21 ARG A 538 19.991 3.469 -6.508 1.00 42.33 H new ATOM 0 HH22 ARG A 538 19.329 4.633 -7.660 1.00 42.33 H new ATOM 2546 N GLN A 539 16.105 0.158 -0.367 1.00 41.15 N ATOM 2547 CA GLN A 539 17.098 -0.760 0.220 1.00 12.10 C ATOM 2548 C GLN A 539 16.484 -2.151 0.533 1.00 60.41 C ATOM 2549 O GLN A 539 17.100 -3.190 0.265 1.00 3.21 O ATOM 2550 CB GLN A 539 17.661 -0.114 1.514 1.00 25.41 C ATOM 2551 CG GLN A 539 18.216 1.329 1.355 1.00 12.13 C ATOM 2552 CD GLN A 539 19.450 1.496 0.434 1.00 15.14 C ATOM 2553 OE1 GLN A 539 19.665 0.759 -0.524 1.00 75.22 O ATOM 2554 NE2 GLN A 539 20.259 2.506 0.705 1.00 55.51 N ATOM 0 H GLN A 539 15.791 0.882 0.279 1.00 41.15 H new ATOM 0 HA GLN A 539 17.898 -0.922 -0.502 1.00 12.10 H new ATOM 0 HB2 GLN A 539 16.872 -0.100 2.265 1.00 25.41 H new ATOM 0 HB3 GLN A 539 18.457 -0.750 1.900 1.00 25.41 H new ATOM 0 HG2 GLN A 539 17.416 1.962 0.972 1.00 12.13 H new ATOM 0 HG3 GLN A 539 18.475 1.706 2.344 1.00 12.13 H new ATOM 0 HE21 GLN A 539 20.069 3.111 1.504 1.00 55.51 H new ATOM 0 HE22 GLN A 539 21.073 2.680 0.115 1.00 55.51 H new ATOM 2563 N VAL A 540 15.262 -2.141 1.090 1.00 31.15 N ATOM 2564 CA VAL A 540 14.585 -3.361 1.613 1.00 50.43 C ATOM 2565 C VAL A 540 13.641 -4.046 0.577 1.00 24.22 C ATOM 2566 O VAL A 540 12.873 -4.950 0.927 1.00 44.44 O ATOM 2567 CB VAL A 540 13.813 -3.024 2.945 1.00 61.23 C ATOM 2568 CG1 VAL A 540 14.813 -2.703 4.087 1.00 74.44 C ATOM 2569 CG2 VAL A 540 12.812 -1.867 2.748 1.00 11.43 C ATOM 0 H VAL A 540 14.707 -1.292 1.195 1.00 31.15 H new ATOM 0 HA VAL A 540 15.370 -4.088 1.821 1.00 50.43 H new ATOM 0 HB VAL A 540 13.237 -3.906 3.226 1.00 61.23 H new ATOM 0 HG11 VAL A 540 14.262 -2.473 4.999 1.00 74.44 H new ATOM 0 HG12 VAL A 540 15.457 -3.565 4.260 1.00 74.44 H new ATOM 0 HG13 VAL A 540 15.424 -1.845 3.806 1.00 74.44 H new ATOM 0 HG21 VAL A 540 12.300 -1.665 3.689 1.00 11.43 H new ATOM 0 HG22 VAL A 540 13.347 -0.973 2.427 1.00 11.43 H new ATOM 0 HG23 VAL A 540 12.080 -2.144 1.989 1.00 11.43 H new