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 -91:sc= -1.02! USER MOD Set 1.2: A 499 HIS : no HD1:sc= 1.69 K(o=0.67,f=-14!) USER MOD Set 2.1: A 450 MET CE :methyl -177:sc= -0.487 (180deg=-0.415) USER MOD Set 2.2: A 490 MET CE :methyl -130:sc= -0.076 (180deg=-1.43) USER MOD Set 3.1: A 430 GLN : amide:sc= 0.347 K(o=0.74,f=-1!) USER MOD Set 3.2: A 432 TYR OH : rot -10:sc= 0.39 USER MOD Set 4.1: A 409 GLN : amide:sc= -0.0375 X(o=0.06,f=-0.28) USER MOD Set 4.2: A 424 THR OG1 : rot 180:sc= 0.0972 USER MOD Single : A 398 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 403 SER OG : rot 33:sc= 0.14 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 429 CYS SG : rot 162:sc= -3.83! USER MOD Single : A 434 ASN : amide:sc= 0.016 X(o=0.016,f=0) USER MOD Single : A 438 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot 142:sc= 0.572 USER MOD Single : A 443 GLN : amide:sc= -0.302 X(o=-0.3,f=-0.0093) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 447 LYS NZ :NH3+ 147:sc= 1.02 (180deg=0.324) USER MOD Single : A 451 GLN : amide:sc= -0.125 X(o=-0.12,f=0) USER MOD Single : A 455 GLN :FLIP amide:sc= -0.656 F(o=-1.5,f=-0.66) USER MOD Single : A 456 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 459 THR OG1 : rot -79:sc= 1.04 USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= 0.0845 X(o=0.084,f=-0.11) USER MOD Single : A 468 SER OG : rot 56:sc= 0.305 USER MOD Single : A 470 MET CE :methyl -161:sc= 0 (180deg=-0.805) USER MOD Single : A 472 GLN :FLIP amide:sc= -0.217 F(o=-1.1,f=-0.22) USER MOD Single : A 474 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 476 THR OG1 : rot 180:sc= 0.0115 USER MOD Single : A 477 ASN :FLIP amide:sc= -0.416 F(o=-1.5!,f=-0.42) USER MOD Single : A 478 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 SER OG : rot 171:sc= 0.0599 USER MOD Single : A 484 LYS NZ :NH3+ -155:sc= 0.00496 (180deg=-0.215) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 492 ASN : amide:sc= -0.0168 X(o=-0.017,f=-0.48) USER MOD Single : A 512 MET CE :methyl -170:sc= -2.24 (180deg=-2.31) USER MOD Single : A 515 TYR OH : rot 180:sc= -0.378 USER MOD Single : A 516 SER OG : rot 160:sc= 0.329 USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 LYS NZ :NH3+ 166:sc= -0.0312 (180deg=-0.266) USER MOD Single : A 519 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00186) USER MOD Single : A 520 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0262) USER MOD Single : A 523 MET CE :methyl 162:sc= 0 (180deg=-0.505) USER MOD Single : A 528 TYR OH : rot 180:sc= -0.392 USER MOD Single : A 530 GLN : amide:sc= -0.046 K(o=-0.046,f=-8.7!) USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD Single : A 535 ASN : amide:sc= 0.477 K(o=0.48,f=-4.4!) USER MOD Single : A 539 GLN : amide:sc= -0.0293 K(o=-0.029,f=-0.98) USER MOD ----------------------------------------------------------------- ATOM 250 N LYS A 398 -15.875 9.409 5.929 1.00 20.34 N ATOM 251 CA LYS A 398 -15.022 10.053 4.908 1.00 2.23 C ATOM 252 C LYS A 398 -15.751 10.186 3.550 1.00 72.14 C ATOM 253 O LYS A 398 -16.750 9.505 3.294 1.00 63.31 O ATOM 254 CB LYS A 398 -13.723 9.221 4.730 1.00 43.14 C ATOM 255 CG LYS A 398 -12.784 9.183 5.956 1.00 52.54 C ATOM 256 CD LYS A 398 -11.583 8.233 5.737 1.00 2.13 C ATOM 257 CE LYS A 398 -10.523 8.328 6.844 1.00 5.25 C ATOM 258 NZ LYS A 398 -11.069 8.046 8.198 1.00 2.24 N ATOM 0 HA LYS A 398 -14.781 11.059 5.251 1.00 2.23 H new ATOM 0 HB2 LYS A 398 -14.000 8.198 4.474 1.00 43.14 H new ATOM 0 HB3 LYS A 398 -13.168 9.623 3.882 1.00 43.14 H new ATOM 0 HG2 LYS A 398 -12.418 10.188 6.163 1.00 52.54 H new ATOM 0 HG3 LYS A 398 -13.346 8.861 6.833 1.00 52.54 H new ATOM 0 HD2 LYS A 398 -11.946 7.207 5.679 1.00 2.13 H new ATOM 0 HD3 LYS A 398 -11.118 8.462 4.778 1.00 2.13 H new ATOM 0 HE2 LYS A 398 -9.718 7.625 6.630 1.00 5.25 H new ATOM 0 HE3 LYS A 398 -10.085 9.326 6.836 1.00 5.25 H new ATOM 0 HZ1 LYS A 398 -10.308 8.125 8.903 1.00 2.24 H new ATOM 0 HZ2 LYS A 398 -11.819 8.732 8.420 1.00 2.24 H new ATOM 0 HZ3 LYS A 398 -11.463 7.084 8.220 1.00 2.24 H new ATOM 272 N LEU A 399 -15.225 11.071 2.682 1.00 15.13 N ATOM 273 CA LEU A 399 -15.741 11.284 1.306 1.00 40.14 C ATOM 274 C LEU A 399 -14.759 10.716 0.258 1.00 11.22 C ATOM 275 O LEU A 399 -13.543 10.671 0.491 1.00 2.42 O ATOM 276 CB LEU A 399 -16.016 12.800 1.038 1.00 40.15 C ATOM 277 CG LEU A 399 -17.361 13.384 1.598 1.00 34.20 C ATOM 278 CD1 LEU A 399 -18.568 12.613 1.059 1.00 32.34 C ATOM 279 CD2 LEU A 399 -17.396 13.409 3.133 1.00 12.02 C ATOM 0 H LEU A 399 -14.427 11.663 2.911 1.00 15.13 H new ATOM 0 HA LEU A 399 -16.686 10.748 1.216 1.00 40.14 H new ATOM 0 HB2 LEU A 399 -15.193 13.375 1.462 1.00 40.15 H new ATOM 0 HB3 LEU A 399 -15.997 12.964 -0.039 1.00 40.15 H new ATOM 0 HG LEU A 399 -17.415 14.415 1.249 1.00 34.20 H new ATOM 0 HD11 LEU A 399 -19.484 13.041 1.465 1.00 32.34 H new ATOM 0 HD12 LEU A 399 -18.587 12.681 -0.029 1.00 32.34 H new ATOM 0 HD13 LEU A 399 -18.494 11.567 1.356 1.00 32.34 H new ATOM 0 HD21 LEU A 399 -18.347 13.822 3.469 1.00 12.02 H new ATOM 0 HD22 LEU A 399 -17.285 12.395 3.516 1.00 12.02 H new ATOM 0 HD23 LEU A 399 -16.580 14.029 3.505 1.00 12.02 H new ATOM 291 N LEU A 400 -15.314 10.283 -0.891 1.00 51.30 N ATOM 292 CA LEU A 400 -14.538 9.690 -1.993 1.00 63.33 C ATOM 293 C LEU A 400 -13.671 10.759 -2.702 1.00 4.53 C ATOM 294 O LEU A 400 -14.190 11.614 -3.429 1.00 63.33 O ATOM 295 CB LEU A 400 -15.492 9.000 -3.008 1.00 14.02 C ATOM 296 CG LEU A 400 -14.809 8.340 -4.243 1.00 13.33 C ATOM 297 CD1 LEU A 400 -13.769 7.298 -3.808 1.00 72.35 C ATOM 298 CD2 LEU A 400 -15.846 7.713 -5.197 1.00 30.32 C ATOM 0 H LEU A 400 -16.315 10.336 -1.079 1.00 51.30 H new ATOM 0 HA LEU A 400 -13.867 8.940 -1.574 1.00 63.33 H new ATOM 0 HB2 LEU A 400 -16.061 8.235 -2.480 1.00 14.02 H new ATOM 0 HB3 LEU A 400 -16.208 9.740 -3.365 1.00 14.02 H new ATOM 0 HG LEU A 400 -14.292 9.129 -4.789 1.00 13.33 H new ATOM 0 HD11 LEU A 400 -13.308 6.854 -4.690 1.00 72.35 H new ATOM 0 HD12 LEU A 400 -13.002 7.780 -3.202 1.00 72.35 H new ATOM 0 HD13 LEU A 400 -14.257 6.519 -3.222 1.00 72.35 H new ATOM 0 HD21 LEU A 400 -15.333 7.262 -6.047 1.00 30.32 H new ATOM 0 HD22 LEU A 400 -16.412 6.947 -4.667 1.00 30.32 H new ATOM 0 HD23 LEU A 400 -16.527 8.486 -5.553 1.00 30.32 H new ATOM 310 N ALA A 401 -12.355 10.706 -2.454 1.00 20.41 N ATOM 311 CA ALA A 401 -11.368 11.600 -3.093 1.00 30.44 C ATOM 312 C ALA A 401 -10.917 11.060 -4.466 1.00 11.14 C ATOM 313 O ALA A 401 -10.824 11.806 -5.449 1.00 31.30 O ATOM 314 CB ALA A 401 -10.155 11.760 -2.165 1.00 22.03 C ATOM 0 H ALA A 401 -11.939 10.040 -1.802 1.00 20.41 H new ATOM 0 HA ALA A 401 -11.839 12.569 -3.260 1.00 30.44 H new ATOM 0 HB1 ALA A 401 -9.424 12.419 -2.633 1.00 22.03 H new ATOM 0 HB2 ALA A 401 -10.477 12.190 -1.216 1.00 22.03 H new ATOM 0 HB3 ALA A 401 -9.702 10.785 -1.986 1.00 22.03 H new ATOM 320 N TRP A 402 -10.643 9.745 -4.518 1.00 73.23 N ATOM 321 CA TRP A 402 -10.071 9.080 -5.709 1.00 4.32 C ATOM 322 C TRP A 402 -10.745 7.716 -5.947 1.00 14.14 C ATOM 323 O TRP A 402 -10.874 6.924 -5.022 1.00 23.45 O ATOM 324 CB TRP A 402 -8.542 8.899 -5.517 1.00 44.53 C ATOM 325 CG TRP A 402 -7.811 8.356 -6.728 1.00 54.51 C ATOM 326 CD1 TRP A 402 -7.356 9.077 -7.793 1.00 62.32 C ATOM 327 CD2 TRP A 402 -7.453 6.985 -6.997 1.00 14.11 C ATOM 328 NE1 TRP A 402 -6.740 8.252 -8.691 1.00 62.00 N ATOM 329 CE2 TRP A 402 -6.782 6.966 -8.230 1.00 64.42 C ATOM 330 CE3 TRP A 402 -7.628 5.779 -6.309 1.00 71.23 C ATOM 331 CZ2 TRP A 402 -6.296 5.792 -8.801 1.00 40.34 C ATOM 332 CZ3 TRP A 402 -7.146 4.613 -6.872 1.00 24.33 C ATOM 333 CH2 TRP A 402 -6.481 4.625 -8.107 1.00 53.12 C ATOM 0 H TRP A 402 -10.811 9.110 -3.737 1.00 73.23 H new ATOM 0 HA TRP A 402 -10.253 9.704 -6.584 1.00 4.32 H new ATOM 0 HB2 TRP A 402 -8.107 9.862 -5.249 1.00 44.53 H new ATOM 0 HB3 TRP A 402 -8.372 8.227 -4.676 1.00 44.53 H new ATOM 0 HD1 TRP A 402 -7.467 10.145 -7.909 1.00 62.32 H new ATOM 0 HE1 TRP A 402 -6.315 8.550 -9.569 1.00 62.00 H new ATOM 0 HE3 TRP A 402 -8.132 5.760 -5.354 1.00 71.23 H new ATOM 0 HZ2 TRP A 402 -5.792 5.801 -9.756 1.00 40.34 H new ATOM 0 HZ3 TRP A 402 -7.284 3.676 -6.352 1.00 24.33 H new ATOM 0 HH2 TRP A 402 -6.108 3.698 -8.518 1.00 53.12 H new ATOM 344 N SER A 403 -11.149 7.446 -7.192 1.00 62.41 N ATOM 345 CA SER A 403 -11.724 6.141 -7.600 1.00 45.33 C ATOM 346 C SER A 403 -10.999 5.621 -8.858 1.00 35.45 C ATOM 347 O SER A 403 -10.968 6.297 -9.895 1.00 3.42 O ATOM 348 CB SER A 403 -13.242 6.270 -7.857 1.00 42.42 C ATOM 349 OG SER A 403 -13.528 7.239 -8.854 1.00 62.33 O ATOM 0 H SER A 403 -11.090 8.122 -7.954 1.00 62.41 H new ATOM 0 HA SER A 403 -11.581 5.425 -6.791 1.00 45.33 H new ATOM 0 HB2 SER A 403 -13.642 5.304 -8.164 1.00 42.42 H new ATOM 0 HB3 SER A 403 -13.746 6.543 -6.930 1.00 42.42 H new ATOM 0 HG SER A 403 -12.810 7.244 -9.521 1.00 62.33 H new ATOM 355 N GLY A 404 -10.410 4.420 -8.758 1.00 24.21 N ATOM 356 CA GLY A 404 -9.642 3.841 -9.862 1.00 43.34 C ATOM 357 C GLY A 404 -9.243 2.388 -9.620 1.00 44.01 C ATOM 358 O GLY A 404 -9.970 1.635 -8.965 1.00 23.42 O ATOM 0 H GLY A 404 -10.453 3.834 -7.924 1.00 24.21 H new ATOM 0 HA2 GLY A 404 -10.231 3.902 -10.777 1.00 43.34 H new ATOM 0 HA3 GLY A 404 -8.743 4.436 -10.022 1.00 43.34 H new ATOM 362 N VAL A 405 -8.086 1.988 -10.171 1.00 30.25 N ATOM 363 CA VAL A 405 -7.594 0.593 -10.125 1.00 23.34 C ATOM 364 C VAL A 405 -6.254 0.505 -9.352 1.00 32.11 C ATOM 365 O VAL A 405 -5.385 1.339 -9.528 1.00 55.12 O ATOM 366 CB VAL A 405 -7.399 0.024 -11.588 1.00 21.01 C ATOM 367 CG1 VAL A 405 -6.925 -1.455 -11.582 1.00 31.34 C ATOM 368 CG2 VAL A 405 -8.695 0.184 -12.421 1.00 24.44 C ATOM 0 H VAL A 405 -7.459 2.623 -10.665 1.00 30.25 H new ATOM 0 HA VAL A 405 -8.341 -0.006 -9.604 1.00 23.34 H new ATOM 0 HB VAL A 405 -6.611 0.613 -12.058 1.00 21.01 H new ATOM 0 HG11 VAL A 405 -6.805 -1.803 -12.608 1.00 31.34 H new ATOM 0 HG12 VAL A 405 -5.971 -1.529 -11.060 1.00 31.34 H new ATOM 0 HG13 VAL A 405 -7.666 -2.072 -11.074 1.00 31.34 H new ATOM 0 HG21 VAL A 405 -8.535 -0.215 -13.423 1.00 24.44 H new ATOM 0 HG22 VAL A 405 -9.507 -0.361 -11.939 1.00 24.44 H new ATOM 0 HG23 VAL A 405 -8.956 1.240 -12.488 1.00 24.44 H new ATOM 378 N LEU A 406 -6.116 -0.506 -8.482 1.00 72.33 N ATOM 379 CA LEU A 406 -4.830 -0.858 -7.832 1.00 24.41 C ATOM 380 C LEU A 406 -4.184 -2.045 -8.581 1.00 65.20 C ATOM 381 O LEU A 406 -4.895 -2.869 -9.144 1.00 34.01 O ATOM 382 CB LEU A 406 -5.079 -1.248 -6.351 1.00 11.20 C ATOM 383 CG LEU A 406 -3.810 -1.620 -5.521 1.00 52.11 C ATOM 384 CD1 LEU A 406 -2.865 -0.408 -5.346 1.00 41.41 C ATOM 385 CD2 LEU A 406 -4.205 -2.233 -4.168 1.00 4.01 C ATOM 0 H LEU A 406 -6.891 -1.108 -8.204 1.00 72.33 H new ATOM 0 HA LEU A 406 -4.161 0.001 -7.867 1.00 24.41 H new ATOM 0 HB2 LEU A 406 -5.582 -0.417 -5.856 1.00 11.20 H new ATOM 0 HB3 LEU A 406 -5.765 -2.095 -6.329 1.00 11.20 H new ATOM 0 HG LEU A 406 -3.255 -2.374 -6.080 1.00 52.11 H new ATOM 0 HD11 LEU A 406 -1.994 -0.707 -4.763 1.00 41.41 H new ATOM 0 HD12 LEU A 406 -2.542 -0.054 -6.325 1.00 41.41 H new ATOM 0 HD13 LEU A 406 -3.392 0.392 -4.826 1.00 41.41 H new ATOM 0 HD21 LEU A 406 -3.306 -2.485 -3.606 1.00 4.01 H new ATOM 0 HD22 LEU A 406 -4.797 -1.514 -3.602 1.00 4.01 H new ATOM 0 HD23 LEU A 406 -4.793 -3.136 -4.335 1.00 4.01 H new ATOM 397 N GLU A 407 -2.840 -2.122 -8.585 1.00 51.44 N ATOM 398 CA GLU A 407 -2.094 -3.254 -9.184 1.00 14.51 C ATOM 399 C GLU A 407 -0.961 -3.720 -8.246 1.00 53.12 C ATOM 400 O GLU A 407 -0.397 -2.923 -7.509 1.00 15.41 O ATOM 401 CB GLU A 407 -1.492 -2.846 -10.558 1.00 53.54 C ATOM 402 CG GLU A 407 -0.724 -3.979 -11.274 1.00 14.43 C ATOM 403 CD GLU A 407 -0.057 -3.555 -12.592 1.00 54.53 C ATOM 404 OE1 GLU A 407 1.074 -3.033 -12.557 1.00 54.32 O ATOM 405 OE2 GLU A 407 -0.655 -3.753 -13.673 1.00 70.55 O ATOM 0 H GLU A 407 -2.239 -1.406 -8.176 1.00 51.44 H new ATOM 0 HA GLU A 407 -2.795 -4.076 -9.329 1.00 14.51 H new ATOM 0 HB2 GLU A 407 -2.297 -2.501 -11.207 1.00 53.54 H new ATOM 0 HB3 GLU A 407 -0.818 -2.002 -10.411 1.00 53.54 H new ATOM 0 HG2 GLU A 407 0.041 -4.365 -10.601 1.00 14.43 H new ATOM 0 HG3 GLU A 407 -1.414 -4.798 -11.476 1.00 14.43 H new ATOM 412 N TRP A 408 -0.660 -5.029 -8.285 1.00 71.13 N ATOM 413 CA TRP A 408 0.505 -5.634 -7.611 1.00 1.35 C ATOM 414 C TRP A 408 0.904 -6.928 -8.349 1.00 25.44 C ATOM 415 O TRP A 408 0.143 -7.443 -9.169 1.00 21.54 O ATOM 416 CB TRP A 408 0.192 -5.925 -6.122 1.00 15.23 C ATOM 417 CG TRP A 408 -0.867 -6.987 -5.895 1.00 4.22 C ATOM 418 CD1 TRP A 408 -0.660 -8.320 -5.693 1.00 23.33 C ATOM 419 CD2 TRP A 408 -2.287 -6.802 -5.877 1.00 22.12 C ATOM 420 NE1 TRP A 408 -1.848 -8.965 -5.517 1.00 11.42 N ATOM 421 CE2 TRP A 408 -2.861 -8.058 -5.630 1.00 74.43 C ATOM 422 CE3 TRP A 408 -3.129 -5.693 -6.036 1.00 2.31 C ATOM 423 CZ2 TRP A 408 -4.229 -8.242 -5.542 1.00 62.24 C ATOM 424 CZ3 TRP A 408 -4.489 -5.881 -5.954 1.00 62.55 C ATOM 425 CH2 TRP A 408 -5.022 -7.153 -5.709 1.00 41.23 C ATOM 0 H TRP A 408 -1.227 -5.708 -8.793 1.00 71.13 H new ATOM 0 HA TRP A 408 1.339 -4.932 -7.640 1.00 1.35 H new ATOM 0 HB2 TRP A 408 1.111 -6.235 -5.625 1.00 15.23 H new ATOM 0 HB3 TRP A 408 -0.132 -5.000 -5.645 1.00 15.23 H new ATOM 0 HD1 TRP A 408 0.309 -8.797 -5.675 1.00 23.33 H new ATOM 0 HE1 TRP A 408 -1.961 -9.962 -5.331 1.00 11.42 H new ATOM 0 HE3 TRP A 408 -2.718 -4.711 -6.219 1.00 2.31 H new ATOM 0 HZ2 TRP A 408 -4.651 -9.217 -5.347 1.00 62.24 H new ATOM 0 HZ3 TRP A 408 -5.153 -5.039 -6.080 1.00 62.55 H new ATOM 0 HH2 TRP A 408 -6.094 -7.271 -5.651 1.00 41.23 H new ATOM 436 N GLN A 409 2.101 -7.449 -8.050 1.00 42.21 N ATOM 437 CA GLN A 409 2.573 -8.747 -8.593 1.00 72.41 C ATOM 438 C GLN A 409 2.674 -9.775 -7.445 1.00 1.32 C ATOM 439 O GLN A 409 3.446 -9.577 -6.503 1.00 74.22 O ATOM 440 CB GLN A 409 3.949 -8.575 -9.325 1.00 51.43 C ATOM 441 CG GLN A 409 3.871 -7.899 -10.720 1.00 60.04 C ATOM 442 CD GLN A 409 3.440 -6.421 -10.709 1.00 61.32 C ATOM 443 OE1 GLN A 409 3.746 -5.670 -9.786 1.00 53.41 O ATOM 444 NE2 GLN A 409 2.695 -6.007 -11.720 1.00 35.05 N ATOM 0 H GLN A 409 2.771 -6.993 -7.431 1.00 42.21 H new ATOM 0 HA GLN A 409 1.857 -9.112 -9.329 1.00 72.41 H new ATOM 0 HB2 GLN A 409 4.610 -7.986 -8.689 1.00 51.43 H new ATOM 0 HB3 GLN A 409 4.408 -9.557 -9.439 1.00 51.43 H new ATOM 0 HG2 GLN A 409 4.849 -7.972 -11.197 1.00 60.04 H new ATOM 0 HG3 GLN A 409 3.171 -8.460 -11.339 1.00 60.04 H new ATOM 0 HE21 GLN A 409 2.455 -6.651 -12.474 1.00 35.05 H new ATOM 0 HE22 GLN A 409 2.360 -5.044 -11.746 1.00 35.05 H new ATOM 453 N GLU A 410 1.900 -10.874 -7.562 1.00 54.45 N ATOM 454 CA GLU A 410 1.743 -11.917 -6.503 1.00 30.43 C ATOM 455 C GLU A 410 3.104 -12.615 -6.206 1.00 1.03 C ATOM 456 O GLU A 410 3.947 -12.707 -7.094 1.00 12.25 O ATOM 457 CB GLU A 410 0.656 -12.949 -6.974 1.00 14.32 C ATOM 458 CG GLU A 410 -0.202 -13.603 -5.865 1.00 30.04 C ATOM 459 CD GLU A 410 0.538 -14.677 -5.040 1.00 55.43 C ATOM 460 OE1 GLU A 410 0.809 -15.770 -5.586 1.00 71.43 O ATOM 461 OE2 GLU A 410 0.866 -14.430 -3.856 1.00 35.00 O ATOM 0 H GLU A 410 1.356 -11.073 -8.401 1.00 54.45 H new ATOM 0 HA GLU A 410 1.417 -11.454 -5.572 1.00 30.43 H new ATOM 0 HB2 GLU A 410 -0.014 -12.445 -7.671 1.00 14.32 H new ATOM 0 HB3 GLU A 410 1.157 -13.742 -7.530 1.00 14.32 H new ATOM 0 HG2 GLU A 410 -0.558 -12.824 -5.190 1.00 30.04 H new ATOM 0 HG3 GLU A 410 -1.082 -14.055 -6.322 1.00 30.04 H new ATOM 649 N LEU A 423 2.351 -12.918 -12.240 1.00 34.41 N ATOM 650 CA LEU A 423 1.128 -13.033 -11.407 1.00 34.24 C ATOM 651 C LEU A 423 0.542 -11.659 -11.017 1.00 71.02 C ATOM 652 O LEU A 423 0.047 -11.449 -9.904 1.00 31.40 O ATOM 653 CB LEU A 423 1.398 -13.951 -10.190 1.00 33.45 C ATOM 654 CG LEU A 423 1.855 -15.411 -10.508 1.00 3.44 C ATOM 655 CD1 LEU A 423 1.857 -16.265 -9.231 1.00 70.53 C ATOM 656 CD2 LEU A 423 0.987 -16.059 -11.613 1.00 14.44 C ATOM 0 HA LEU A 423 0.350 -13.504 -12.007 1.00 34.24 H new ATOM 0 HB2 LEU A 423 2.162 -13.481 -9.571 1.00 33.45 H new ATOM 0 HB3 LEU A 423 0.489 -14.001 -9.591 1.00 33.45 H new ATOM 0 HG LEU A 423 2.874 -15.363 -10.892 1.00 3.44 H new ATOM 0 HD11 LEU A 423 2.178 -17.279 -9.472 1.00 70.53 H new ATOM 0 HD12 LEU A 423 2.543 -15.830 -8.504 1.00 70.53 H new ATOM 0 HD13 LEU A 423 0.852 -16.293 -8.810 1.00 70.53 H new ATOM 0 HD21 LEU A 423 1.338 -17.073 -11.804 1.00 14.44 H new ATOM 0 HD22 LEU A 423 -0.053 -16.090 -11.287 1.00 14.44 H new ATOM 0 HD23 LEU A 423 1.063 -15.471 -12.527 1.00 14.44 H new ATOM 668 N THR A 424 0.588 -10.743 -11.991 1.00 41.12 N ATOM 669 CA THR A 424 0.037 -9.381 -11.884 1.00 14.13 C ATOM 670 C THR A 424 -1.497 -9.398 -11.651 1.00 40.23 C ATOM 671 O THR A 424 -2.275 -9.754 -12.545 1.00 4.24 O ATOM 672 CB THR A 424 0.363 -8.547 -13.170 1.00 5.10 C ATOM 673 OG1 THR A 424 1.786 -8.479 -13.373 1.00 44.40 O ATOM 674 CG2 THR A 424 -0.200 -7.120 -13.106 1.00 72.30 C ATOM 0 H THR A 424 1.018 -10.929 -12.897 1.00 41.12 H new ATOM 0 HA THR A 424 0.509 -8.912 -11.021 1.00 14.13 H new ATOM 0 HB THR A 424 -0.116 -9.061 -14.004 1.00 5.10 H new ATOM 0 HG1 THR A 424 1.977 -7.957 -14.180 1.00 44.40 H new ATOM 0 HG21 THR A 424 0.055 -6.587 -14.022 1.00 72.30 H new ATOM 0 HG22 THR A 424 -1.284 -7.161 -13.000 1.00 72.30 H new ATOM 0 HG23 THR A 424 0.229 -6.598 -12.251 1.00 72.30 H new ATOM 682 N ARG A 425 -1.907 -9.039 -10.427 1.00 4.32 N ATOM 683 CA ARG A 425 -3.327 -8.927 -10.030 1.00 34.40 C ATOM 684 C ARG A 425 -3.745 -7.441 -9.881 1.00 63.34 C ATOM 685 O ARG A 425 -2.913 -6.579 -9.596 1.00 34.14 O ATOM 686 CB ARG A 425 -3.547 -9.681 -8.695 1.00 30.32 C ATOM 687 CG ARG A 425 -3.296 -11.208 -8.742 1.00 15.44 C ATOM 688 CD ARG A 425 -4.341 -11.958 -9.588 1.00 15.14 C ATOM 689 NE ARG A 425 -4.113 -13.412 -9.578 1.00 74.11 N ATOM 690 CZ ARG A 425 -5.042 -14.345 -9.671 1.00 33.33 C ATOM 691 NH1 ARG A 425 -6.304 -14.045 -9.764 1.00 0.50 N ATOM 692 NH2 ARG A 425 -4.691 -15.588 -9.659 1.00 4.21 N ATOM 0 H ARG A 425 -1.259 -8.815 -9.672 1.00 4.32 H new ATOM 0 HA ARG A 425 -3.946 -9.373 -10.808 1.00 34.40 H new ATOM 0 HB2 ARG A 425 -2.892 -9.246 -7.940 1.00 30.32 H new ATOM 0 HB3 ARG A 425 -4.572 -9.509 -8.365 1.00 30.32 H new ATOM 0 HG2 ARG A 425 -2.303 -11.396 -9.149 1.00 15.44 H new ATOM 0 HG3 ARG A 425 -3.305 -11.605 -7.727 1.00 15.44 H new ATOM 0 HD2 ARG A 425 -5.339 -11.744 -9.206 1.00 15.14 H new ATOM 0 HD3 ARG A 425 -4.308 -11.592 -10.614 1.00 15.14 H new ATOM 0 HE ARG A 425 -3.147 -13.728 -9.491 1.00 74.11 H new ATOM 0 HH11 ARG A 425 -6.597 -13.068 -9.766 1.00 0.50 H new ATOM 0 HH12 ARG A 425 -7.001 -14.787 -9.835 1.00 0.50 H new ATOM 0 HH21 ARG A 425 -3.706 -15.839 -9.578 1.00 4.21 H new ATOM 0 HH22 ARG A 425 -5.399 -16.319 -9.730 1.00 4.21 H new ATOM 706 N SER A 426 -5.053 -7.163 -10.050 1.00 3.15 N ATOM 707 CA SER A 426 -5.606 -5.785 -9.990 1.00 23.22 C ATOM 708 C SER A 426 -7.033 -5.767 -9.394 1.00 52.11 C ATOM 709 O SER A 426 -7.717 -6.798 -9.370 1.00 22.01 O ATOM 710 CB SER A 426 -5.609 -5.143 -11.401 1.00 42.04 C ATOM 711 OG SER A 426 -6.469 -5.834 -12.295 1.00 63.04 O ATOM 0 H SER A 426 -5.756 -7.879 -10.231 1.00 3.15 H new ATOM 0 HA SER A 426 -4.963 -5.201 -9.332 1.00 23.22 H new ATOM 0 HB2 SER A 426 -5.924 -4.102 -11.326 1.00 42.04 H new ATOM 0 HB3 SER A 426 -4.595 -5.141 -11.801 1.00 42.04 H new ATOM 0 HG SER A 426 -6.446 -5.399 -13.173 1.00 63.04 H new ATOM 717 N LEU A 427 -7.477 -4.577 -8.918 1.00 60.20 N ATOM 718 CA LEU A 427 -8.787 -4.397 -8.217 1.00 44.35 C ATOM 719 C LEU A 427 -9.348 -2.960 -8.368 1.00 3.31 C ATOM 720 O LEU A 427 -8.576 -2.014 -8.493 1.00 22.32 O ATOM 721 CB LEU A 427 -8.629 -4.716 -6.701 1.00 14.22 C ATOM 722 CG LEU A 427 -8.674 -6.217 -6.305 1.00 13.10 C ATOM 723 CD1 LEU A 427 -8.235 -6.416 -4.853 1.00 24.42 C ATOM 724 CD2 LEU A 427 -10.081 -6.804 -6.545 1.00 31.21 C ATOM 0 H LEU A 427 -6.943 -3.712 -9.006 1.00 60.20 H new ATOM 0 HA LEU A 427 -9.491 -5.086 -8.684 1.00 44.35 H new ATOM 0 HB2 LEU A 427 -7.680 -4.301 -6.361 1.00 14.22 H new ATOM 0 HB3 LEU A 427 -9.418 -4.195 -6.158 1.00 14.22 H new ATOM 0 HG LEU A 427 -7.971 -6.755 -6.941 1.00 13.10 H new ATOM 0 HD11 LEU A 427 -8.276 -7.476 -4.602 1.00 24.42 H new ATOM 0 HD12 LEU A 427 -7.215 -6.053 -4.728 1.00 24.42 H new ATOM 0 HD13 LEU A 427 -8.901 -5.861 -4.192 1.00 24.42 H new ATOM 0 HD21 LEU A 427 -10.090 -7.856 -6.261 1.00 31.21 H new ATOM 0 HD22 LEU A 427 -10.810 -6.260 -5.944 1.00 31.21 H new ATOM 0 HD23 LEU A 427 -10.339 -6.711 -7.600 1.00 31.21 H new ATOM 736 N PRO A 428 -10.711 -2.772 -8.341 1.00 63.24 N ATOM 737 CA PRO A 428 -11.335 -1.428 -8.204 1.00 4.23 C ATOM 738 C PRO A 428 -11.199 -0.872 -6.749 1.00 34.55 C ATOM 739 O PRO A 428 -11.959 -1.254 -5.850 1.00 3.52 O ATOM 740 CB PRO A 428 -12.831 -1.669 -8.605 1.00 35.54 C ATOM 741 CG PRO A 428 -12.873 -3.066 -9.171 1.00 14.31 C ATOM 742 CD PRO A 428 -11.753 -3.819 -8.492 1.00 31.03 C ATOM 0 HA PRO A 428 -10.854 -0.676 -8.829 1.00 4.23 H new ATOM 0 HB2 PRO A 428 -13.489 -1.575 -7.741 1.00 35.54 H new ATOM 0 HB3 PRO A 428 -13.164 -0.937 -9.341 1.00 35.54 H new ATOM 0 HG2 PRO A 428 -13.836 -3.538 -8.976 1.00 14.31 H new ATOM 0 HG3 PRO A 428 -12.737 -3.054 -10.252 1.00 14.31 H new ATOM 0 HD2 PRO A 428 -12.062 -4.226 -7.529 1.00 31.03 H new ATOM 0 HD3 PRO A 428 -11.403 -4.657 -9.095 1.00 31.03 H new ATOM 750 N CYS A 429 -10.198 0.010 -6.534 1.00 35.15 N ATOM 751 CA CYS A 429 -9.894 0.602 -5.201 1.00 13.14 C ATOM 752 C CYS A 429 -10.308 2.092 -5.135 1.00 31.34 C ATOM 753 O CYS A 429 -10.201 2.824 -6.126 1.00 50.23 O ATOM 754 CB CYS A 429 -8.386 0.475 -4.905 1.00 25.50 C ATOM 755 SG CYS A 429 -7.329 1.361 -6.069 1.00 15.54 S ATOM 0 H CYS A 429 -9.576 0.335 -7.274 1.00 35.15 H new ATOM 0 HA CYS A 429 -10.468 0.055 -4.453 1.00 13.14 H new ATOM 0 HB2 CYS A 429 -8.192 0.847 -3.899 1.00 25.50 H new ATOM 0 HB3 CYS A 429 -8.113 -0.580 -4.913 1.00 25.50 H new ATOM 0 HG CYS A 429 -6.149 1.523 -5.547 1.00 15.54 H new ATOM 761 N GLN A 430 -10.773 2.528 -3.948 1.00 73.30 N ATOM 762 CA GLN A 430 -11.258 3.911 -3.709 1.00 50.14 C ATOM 763 C GLN A 430 -10.538 4.554 -2.493 1.00 33.12 C ATOM 764 O GLN A 430 -10.606 4.027 -1.394 1.00 22.55 O ATOM 765 CB GLN A 430 -12.787 3.877 -3.437 1.00 51.13 C ATOM 766 CG GLN A 430 -13.666 3.412 -4.621 1.00 23.45 C ATOM 767 CD GLN A 430 -15.150 3.276 -4.254 1.00 73.32 C ATOM 768 OE1 GLN A 430 -15.665 3.978 -3.390 1.00 62.34 O ATOM 769 NE2 GLN A 430 -15.856 2.381 -4.918 1.00 74.23 N ATOM 0 H GLN A 430 -10.825 1.932 -3.122 1.00 73.30 H new ATOM 0 HA GLN A 430 -11.043 4.509 -4.594 1.00 50.14 H new ATOM 0 HB2 GLN A 430 -12.972 3.218 -2.589 1.00 51.13 H new ATOM 0 HB3 GLN A 430 -13.107 4.876 -3.140 1.00 51.13 H new ATOM 0 HG2 GLN A 430 -13.565 4.122 -5.442 1.00 23.45 H new ATOM 0 HG3 GLN A 430 -13.298 2.452 -4.983 1.00 23.45 H new ATOM 0 HE21 GLN A 430 -15.409 1.807 -5.633 1.00 74.23 H new ATOM 0 HE22 GLN A 430 -16.849 2.263 -4.717 1.00 74.23 H new ATOM 778 N VAL A 431 -9.878 5.710 -2.687 1.00 51.04 N ATOM 779 CA VAL A 431 -9.242 6.471 -1.583 1.00 21.41 C ATOM 780 C VAL A 431 -10.261 7.439 -0.933 1.00 22.34 C ATOM 781 O VAL A 431 -10.773 8.359 -1.584 1.00 73.23 O ATOM 782 CB VAL A 431 -7.987 7.273 -2.089 1.00 4.42 C ATOM 783 CG1 VAL A 431 -7.317 8.097 -0.950 1.00 32.45 C ATOM 784 CG2 VAL A 431 -6.972 6.316 -2.753 1.00 25.24 C ATOM 0 H VAL A 431 -9.768 6.145 -3.603 1.00 51.04 H new ATOM 0 HA VAL A 431 -8.908 5.751 -0.836 1.00 21.41 H new ATOM 0 HB VAL A 431 -8.333 7.990 -2.834 1.00 4.42 H new ATOM 0 HG11 VAL A 431 -6.455 8.633 -1.347 1.00 32.45 H new ATOM 0 HG12 VAL A 431 -8.035 8.811 -0.547 1.00 32.45 H new ATOM 0 HG13 VAL A 431 -6.991 7.424 -0.157 1.00 32.45 H new ATOM 0 HG21 VAL A 431 -6.108 6.884 -3.099 1.00 25.24 H new ATOM 0 HG22 VAL A 431 -6.648 5.569 -2.028 1.00 25.24 H new ATOM 0 HG23 VAL A 431 -7.442 5.819 -3.601 1.00 25.24 H new ATOM 794 N TYR A 432 -10.566 7.191 0.348 1.00 35.14 N ATOM 795 CA TYR A 432 -11.455 8.044 1.166 1.00 43.35 C ATOM 796 C TYR A 432 -10.642 8.933 2.133 1.00 31.13 C ATOM 797 O TYR A 432 -9.790 8.441 2.881 1.00 32.43 O ATOM 798 CB TYR A 432 -12.468 7.151 1.944 1.00 53.23 C ATOM 799 CG TYR A 432 -13.681 6.723 1.104 1.00 65.53 C ATOM 800 CD1 TYR A 432 -13.575 5.736 0.126 1.00 72.31 C ATOM 801 CD2 TYR A 432 -14.927 7.334 1.275 1.00 55.02 C ATOM 802 CE1 TYR A 432 -14.665 5.377 -0.643 1.00 15.20 C ATOM 803 CE2 TYR A 432 -16.016 6.980 0.503 1.00 3.14 C ATOM 804 CZ TYR A 432 -15.880 6.000 -0.452 1.00 51.40 C ATOM 805 OH TYR A 432 -16.959 5.659 -1.234 1.00 32.44 O ATOM 0 H TYR A 432 -10.201 6.385 0.856 1.00 35.14 H new ATOM 0 HA TYR A 432 -12.008 8.709 0.503 1.00 43.35 H new ATOM 0 HB2 TYR A 432 -11.953 6.260 2.304 1.00 53.23 H new ATOM 0 HB3 TYR A 432 -12.818 7.693 2.822 1.00 53.23 H new ATOM 0 HD1 TYR A 432 -12.627 5.244 -0.033 1.00 72.31 H new ATOM 0 HD2 TYR A 432 -15.040 8.100 2.028 1.00 55.02 H new ATOM 0 HE1 TYR A 432 -14.565 4.608 -1.394 1.00 15.20 H new ATOM 0 HE2 TYR A 432 -16.968 7.469 0.648 1.00 3.14 H new ATOM 0 HH TYR A 432 -16.660 5.089 -1.973 1.00 32.44 H new ATOM 815 N VAL A 433 -10.940 10.251 2.115 1.00 42.53 N ATOM 816 CA VAL A 433 -10.259 11.270 2.954 1.00 12.44 C ATOM 817 C VAL A 433 -11.256 11.988 3.887 1.00 2.45 C ATOM 818 O VAL A 433 -12.474 11.922 3.674 1.00 20.13 O ATOM 819 CB VAL A 433 -9.527 12.334 2.061 1.00 21.44 C ATOM 820 CG1 VAL A 433 -8.490 11.662 1.138 1.00 54.03 C ATOM 821 CG2 VAL A 433 -10.537 13.198 1.250 1.00 53.30 C ATOM 0 H VAL A 433 -11.665 10.644 1.514 1.00 42.53 H new ATOM 0 HA VAL A 433 -9.524 10.744 3.563 1.00 12.44 H new ATOM 0 HB VAL A 433 -8.991 13.010 2.727 1.00 21.44 H new ATOM 0 HG11 VAL A 433 -7.998 12.421 0.530 1.00 54.03 H new ATOM 0 HG12 VAL A 433 -7.747 11.143 1.743 1.00 54.03 H new ATOM 0 HG13 VAL A 433 -8.992 10.946 0.487 1.00 54.03 H new ATOM 0 HG21 VAL A 433 -9.992 13.922 0.645 1.00 53.30 H new ATOM 0 HG22 VAL A 433 -11.128 12.553 0.600 1.00 53.30 H new ATOM 0 HG23 VAL A 433 -11.199 13.725 1.937 1.00 53.30 H new ATOM 831 N ASN A 434 -10.731 12.703 4.898 1.00 2.11 N ATOM 832 CA ASN A 434 -11.562 13.440 5.874 1.00 32.33 C ATOM 833 C ASN A 434 -12.250 14.669 5.201 1.00 74.31 C ATOM 834 O ASN A 434 -11.692 15.774 5.181 1.00 72.10 O ATOM 835 CB ASN A 434 -10.705 13.871 7.093 1.00 4.02 C ATOM 836 CG ASN A 434 -11.520 14.512 8.228 1.00 4.11 C ATOM 837 OD1 ASN A 434 -11.968 13.835 9.148 1.00 72.11 O ATOM 838 ND2 ASN A 434 -11.739 15.815 8.165 1.00 71.33 N ATOM 0 H ASN A 434 -9.728 12.788 5.063 1.00 2.11 H new ATOM 0 HA ASN A 434 -12.350 12.777 6.231 1.00 32.33 H new ATOM 0 HB2 ASN A 434 -10.180 12.999 7.483 1.00 4.02 H new ATOM 0 HB3 ASN A 434 -9.945 14.578 6.760 1.00 4.02 H new ATOM 0 HD21 ASN A 434 -12.289 16.275 8.890 1.00 71.33 H new ATOM 0 HD22 ASN A 434 -11.357 16.359 7.391 1.00 71.33 H new ATOM 884 N ASN A 438 -6.585 18.096 2.726 1.00 73.45 N ATOM 885 CA ASN A 438 -5.485 18.710 1.937 1.00 51.11 C ATOM 886 C ASN A 438 -4.949 17.765 0.822 1.00 61.54 C ATOM 887 O ASN A 438 -4.289 18.228 -0.115 1.00 44.11 O ATOM 888 CB ASN A 438 -4.332 19.128 2.895 1.00 31.22 C ATOM 889 CG ASN A 438 -3.241 19.981 2.230 1.00 62.42 C ATOM 890 OD1 ASN A 438 -3.324 21.199 2.202 1.00 75.00 O ATOM 891 ND2 ASN A 438 -2.211 19.347 1.694 1.00 45.24 N ATOM 0 HA ASN A 438 -5.889 19.589 1.434 1.00 51.11 H new ATOM 0 HB2 ASN A 438 -4.753 19.685 3.732 1.00 31.22 H new ATOM 0 HB3 ASN A 438 -3.874 18.229 3.308 1.00 31.22 H new ATOM 0 HD21 ASN A 438 -1.464 19.876 1.245 1.00 45.24 H new ATOM 0 HD22 ASN A 438 -2.164 18.329 1.730 1.00 45.24 H new ATOM 898 N LEU A 439 -5.232 16.445 0.939 1.00 33.51 N ATOM 899 CA LEU A 439 -4.728 15.420 -0.005 1.00 31.42 C ATOM 900 C LEU A 439 -5.246 15.660 -1.453 1.00 71.11 C ATOM 901 O LEU A 439 -6.418 15.401 -1.766 1.00 72.53 O ATOM 902 CB LEU A 439 -5.125 13.997 0.475 1.00 73.12 C ATOM 903 CG LEU A 439 -4.472 12.816 -0.311 1.00 42.10 C ATOM 904 CD1 LEU A 439 -2.940 12.791 -0.101 1.00 33.25 C ATOM 905 CD2 LEU A 439 -5.118 11.469 0.069 1.00 3.51 C ATOM 0 H LEU A 439 -5.812 16.063 1.686 1.00 33.51 H new ATOM 0 HA LEU A 439 -3.641 15.502 -0.023 1.00 31.42 H new ATOM 0 HB2 LEU A 439 -4.860 13.900 1.528 1.00 73.12 H new ATOM 0 HB3 LEU A 439 -6.209 13.899 0.409 1.00 73.12 H new ATOM 0 HG LEU A 439 -4.656 12.976 -1.373 1.00 42.10 H new ATOM 0 HD11 LEU A 439 -2.510 11.959 -0.659 1.00 33.25 H new ATOM 0 HD12 LEU A 439 -2.509 13.727 -0.455 1.00 33.25 H new ATOM 0 HD13 LEU A 439 -2.720 12.669 0.960 1.00 33.25 H new ATOM 0 HD21 LEU A 439 -4.643 10.666 -0.494 1.00 3.51 H new ATOM 0 HD22 LEU A 439 -4.987 11.291 1.136 1.00 3.51 H new ATOM 0 HD23 LEU A 439 -6.182 11.497 -0.166 1.00 3.51 H new ATOM 917 N LYS A 440 -4.353 16.173 -2.322 1.00 62.00 N ATOM 918 CA LYS A 440 -4.679 16.515 -3.722 1.00 2.04 C ATOM 919 C LYS A 440 -4.602 15.270 -4.636 1.00 3.42 C ATOM 920 O LYS A 440 -3.563 14.972 -5.243 1.00 71.43 O ATOM 921 CB LYS A 440 -3.740 17.643 -4.212 1.00 14.22 C ATOM 922 CG LYS A 440 -3.934 18.991 -3.473 1.00 61.44 C ATOM 923 CD LYS A 440 -2.748 19.968 -3.660 1.00 12.13 C ATOM 924 CE LYS A 440 -2.402 20.243 -5.141 1.00 5.11 C ATOM 925 NZ LYS A 440 -1.176 21.070 -5.274 1.00 61.12 N ATOM 0 H LYS A 440 -3.382 16.363 -2.073 1.00 62.00 H new ATOM 0 HA LYS A 440 -5.707 16.875 -3.769 1.00 2.04 H new ATOM 0 HB2 LYS A 440 -2.706 17.319 -4.090 1.00 14.22 H new ATOM 0 HB3 LYS A 440 -3.902 17.799 -5.279 1.00 14.22 H new ATOM 0 HG2 LYS A 440 -4.847 19.466 -3.832 1.00 61.44 H new ATOM 0 HG3 LYS A 440 -4.072 18.798 -2.409 1.00 61.44 H new ATOM 0 HD2 LYS A 440 -2.985 20.912 -3.169 1.00 12.13 H new ATOM 0 HD3 LYS A 440 -1.870 19.560 -3.160 1.00 12.13 H new ATOM 0 HE2 LYS A 440 -2.261 19.297 -5.664 1.00 5.11 H new ATOM 0 HE3 LYS A 440 -3.238 20.751 -5.622 1.00 5.11 H new ATOM 0 HZ1 LYS A 440 -0.975 21.234 -6.281 1.00 61.12 H new ATOM 0 HZ2 LYS A 440 -1.319 21.983 -4.797 1.00 61.12 H new ATOM 0 HZ3 LYS A 440 -0.373 20.573 -4.837 1.00 61.12 H new ATOM 939 N THR A 441 -5.727 14.535 -4.692 1.00 5.31 N ATOM 940 CA THR A 441 -5.902 13.351 -5.570 1.00 34.22 C ATOM 941 C THR A 441 -6.135 13.734 -7.055 1.00 52.44 C ATOM 942 O THR A 441 -6.259 12.853 -7.911 1.00 65.33 O ATOM 943 CB THR A 441 -7.078 12.461 -5.065 1.00 5.12 C ATOM 944 OG1 THR A 441 -8.291 13.236 -5.012 1.00 23.43 O ATOM 945 CG2 THR A 441 -6.789 11.866 -3.671 1.00 62.43 C ATOM 0 H THR A 441 -6.550 14.743 -4.127 1.00 5.31 H new ATOM 0 HA THR A 441 -4.969 12.789 -5.520 1.00 34.22 H new ATOM 0 HB THR A 441 -7.192 11.636 -5.768 1.00 5.12 H new ATOM 0 HG1 THR A 441 -9.046 12.681 -5.298 1.00 23.43 H new ATOM 0 HG21 THR A 441 -7.633 11.252 -3.355 1.00 62.43 H new ATOM 0 HG22 THR A 441 -5.890 11.251 -3.717 1.00 62.43 H new ATOM 0 HG23 THR A 441 -6.640 12.674 -2.955 1.00 62.43 H new ATOM 953 N GLU A 442 -6.199 15.049 -7.330 1.00 1.53 N ATOM 954 CA GLU A 442 -6.230 15.640 -8.697 1.00 0.14 C ATOM 955 C GLU A 442 -5.096 15.090 -9.607 1.00 53.42 C ATOM 956 O GLU A 442 -5.321 14.704 -10.754 1.00 3.52 O ATOM 957 CB GLU A 442 -6.068 17.179 -8.545 1.00 41.44 C ATOM 958 CG GLU A 442 -5.904 17.990 -9.855 1.00 0.13 C ATOM 959 CD GLU A 442 -5.475 19.447 -9.598 1.00 54.40 C ATOM 960 OE1 GLU A 442 -4.256 19.712 -9.497 1.00 1.42 O ATOM 961 OE2 GLU A 442 -6.353 20.326 -9.461 1.00 0.44 O ATOM 0 H GLU A 442 -6.232 15.755 -6.595 1.00 1.53 H new ATOM 0 HA GLU A 442 -7.175 15.376 -9.172 1.00 0.14 H new ATOM 0 HB2 GLU A 442 -6.939 17.563 -8.013 1.00 41.44 H new ATOM 0 HB3 GLU A 442 -5.200 17.370 -7.915 1.00 41.44 H new ATOM 0 HG2 GLU A 442 -5.163 17.503 -10.489 1.00 0.13 H new ATOM 0 HG3 GLU A 442 -6.846 17.984 -10.403 1.00 0.13 H new ATOM 968 N GLN A 443 -3.883 15.054 -9.042 1.00 53.23 N ATOM 969 CA GLN A 443 -2.633 14.745 -9.781 1.00 33.32 C ATOM 970 C GLN A 443 -2.420 13.222 -10.006 1.00 31.31 C ATOM 971 O GLN A 443 -1.478 12.812 -10.696 1.00 53.32 O ATOM 972 CB GLN A 443 -1.454 15.339 -8.978 1.00 75.11 C ATOM 973 CG GLN A 443 -1.592 16.853 -8.701 1.00 52.32 C ATOM 974 CD GLN A 443 -0.557 17.376 -7.709 1.00 64.22 C ATOM 975 OE1 GLN A 443 0.524 17.811 -8.087 1.00 3.44 O ATOM 976 NE2 GLN A 443 -0.872 17.312 -6.432 1.00 40.32 N ATOM 0 H GLN A 443 -3.730 15.239 -8.051 1.00 53.23 H new ATOM 0 HA GLN A 443 -2.699 15.186 -10.775 1.00 33.32 H new ATOM 0 HB2 GLN A 443 -1.370 14.811 -8.028 1.00 75.11 H new ATOM 0 HB3 GLN A 443 -0.528 15.161 -9.524 1.00 75.11 H new ATOM 0 HG2 GLN A 443 -1.495 17.398 -9.640 1.00 52.32 H new ATOM 0 HG3 GLN A 443 -2.591 17.056 -8.316 1.00 52.32 H new ATOM 0 HE21 GLN A 443 -1.780 16.945 -6.149 1.00 40.32 H new ATOM 0 HE22 GLN A 443 -0.208 17.630 -5.726 1.00 40.32 H new ATOM 985 N TRP A 444 -3.306 12.402 -9.420 1.00 4.24 N ATOM 986 CA TRP A 444 -3.195 10.927 -9.426 1.00 60.14 C ATOM 987 C TRP A 444 -3.805 10.342 -10.730 1.00 0.32 C ATOM 988 O TRP A 444 -4.807 10.874 -11.223 1.00 61.34 O ATOM 989 CB TRP A 444 -3.923 10.345 -8.174 1.00 23.51 C ATOM 990 CG TRP A 444 -3.404 10.826 -6.822 1.00 42.34 C ATOM 991 CD1 TRP A 444 -2.671 11.956 -6.555 1.00 63.25 C ATOM 992 CD2 TRP A 444 -3.605 10.186 -5.551 1.00 35.31 C ATOM 993 NE1 TRP A 444 -2.422 12.055 -5.218 1.00 22.44 N ATOM 994 CE2 TRP A 444 -2.972 10.981 -4.580 1.00 62.21 C ATOM 995 CE3 TRP A 444 -4.256 9.019 -5.140 1.00 65.12 C ATOM 996 CZ2 TRP A 444 -2.967 10.654 -3.230 1.00 61.30 C ATOM 997 CZ3 TRP A 444 -4.246 8.691 -3.794 1.00 53.31 C ATOM 998 CH2 TRP A 444 -3.603 9.510 -2.854 1.00 40.43 C ATOM 0 H TRP A 444 -4.129 12.743 -8.923 1.00 4.24 H new ATOM 0 HA TRP A 444 -2.142 10.648 -9.389 1.00 60.14 H new ATOM 0 HB2 TRP A 444 -4.982 10.593 -8.245 1.00 23.51 H new ATOM 0 HB3 TRP A 444 -3.847 9.258 -8.205 1.00 23.51 H new ATOM 0 HD1 TRP A 444 -2.339 12.666 -7.298 1.00 63.25 H new ATOM 0 HE1 TRP A 444 -1.907 12.811 -4.767 1.00 22.44 H new ATOM 0 HE3 TRP A 444 -4.757 8.386 -5.857 1.00 65.12 H new ATOM 0 HZ2 TRP A 444 -2.476 11.285 -2.504 1.00 61.30 H new ATOM 0 HZ3 TRP A 444 -4.741 7.790 -3.463 1.00 53.31 H new ATOM 0 HH2 TRP A 444 -3.613 9.228 -1.812 1.00 40.43 H new ATOM 1009 N PRO A 445 -3.219 9.238 -11.316 1.00 74.45 N ATOM 1010 CA PRO A 445 -3.753 8.609 -12.562 1.00 21.34 C ATOM 1011 C PRO A 445 -5.047 7.789 -12.314 1.00 45.54 C ATOM 1012 O PRO A 445 -5.570 7.760 -11.207 1.00 42.42 O ATOM 1013 CB PRO A 445 -2.581 7.691 -13.051 1.00 40.14 C ATOM 1014 CG PRO A 445 -1.433 7.935 -12.100 1.00 3.22 C ATOM 1015 CD PRO A 445 -2.025 8.509 -10.832 1.00 1.43 C ATOM 0 HA PRO A 445 -4.046 9.358 -13.298 1.00 21.34 H new ATOM 0 HB2 PRO A 445 -2.878 6.642 -13.043 1.00 40.14 H new ATOM 0 HB3 PRO A 445 -2.297 7.934 -14.075 1.00 40.14 H new ATOM 0 HG2 PRO A 445 -0.901 7.007 -11.892 1.00 3.22 H new ATOM 0 HG3 PRO A 445 -0.711 8.626 -12.536 1.00 3.22 H new ATOM 0 HD2 PRO A 445 -2.292 7.726 -10.122 1.00 1.43 H new ATOM 0 HD3 PRO A 445 -1.325 9.174 -10.326 1.00 1.43 H new ATOM 1023 N GLN A 446 -5.540 7.109 -13.364 1.00 34.03 N ATOM 1024 CA GLN A 446 -6.710 6.194 -13.267 1.00 71.20 C ATOM 1025 C GLN A 446 -6.343 4.866 -12.551 1.00 24.21 C ATOM 1026 O GLN A 446 -7.225 4.098 -12.151 1.00 30.05 O ATOM 1027 CB GLN A 446 -7.256 5.898 -14.693 1.00 12.42 C ATOM 1028 CG GLN A 446 -6.267 5.149 -15.619 1.00 14.04 C ATOM 1029 CD GLN A 446 -6.830 4.874 -17.015 1.00 42.42 C ATOM 1030 OE1 GLN A 446 -6.657 5.661 -17.938 1.00 72.34 O ATOM 1031 NE2 GLN A 446 -7.519 3.762 -17.174 1.00 10.02 N ATOM 0 H GLN A 446 -5.147 7.172 -14.303 1.00 34.03 H new ATOM 0 HA GLN A 446 -7.478 6.687 -12.671 1.00 71.20 H new ATOM 0 HB2 GLN A 446 -8.168 5.307 -14.603 1.00 12.42 H new ATOM 0 HB3 GLN A 446 -7.532 6.841 -15.165 1.00 12.42 H new ATOM 0 HG2 GLN A 446 -5.353 5.736 -15.713 1.00 14.04 H new ATOM 0 HG3 GLN A 446 -5.991 4.203 -15.154 1.00 14.04 H new ATOM 0 HE21 GLN A 446 -7.647 3.125 -16.388 1.00 10.02 H new ATOM 0 HE22 GLN A 446 -7.924 3.539 -18.083 1.00 10.02 H new ATOM 1040 N LYS A 447 -5.030 4.610 -12.412 1.00 41.34 N ATOM 1041 CA LYS A 447 -4.497 3.355 -11.862 1.00 11.11 C ATOM 1042 C LYS A 447 -3.190 3.595 -11.061 1.00 51.00 C ATOM 1043 O LYS A 447 -2.267 4.254 -11.545 1.00 33.21 O ATOM 1044 CB LYS A 447 -4.246 2.375 -13.035 1.00 2.33 C ATOM 1045 CG LYS A 447 -3.735 0.978 -12.634 1.00 12.44 C ATOM 1046 CD LYS A 447 -3.518 0.072 -13.867 1.00 73.42 C ATOM 1047 CE LYS A 447 -3.066 -1.345 -13.496 1.00 51.53 C ATOM 1048 NZ LYS A 447 -2.802 -2.178 -14.695 1.00 11.14 N ATOM 0 H LYS A 447 -4.305 5.275 -12.681 1.00 41.34 H new ATOM 0 HA LYS A 447 -5.222 2.931 -11.167 1.00 11.11 H new ATOM 0 HB2 LYS A 447 -5.175 2.257 -13.592 1.00 2.33 H new ATOM 0 HB3 LYS A 447 -3.523 2.826 -13.714 1.00 2.33 H new ATOM 0 HG2 LYS A 447 -2.798 1.077 -12.086 1.00 12.44 H new ATOM 0 HG3 LYS A 447 -4.451 0.509 -11.959 1.00 12.44 H new ATOM 0 HD2 LYS A 447 -4.446 0.014 -14.436 1.00 73.42 H new ATOM 0 HD3 LYS A 447 -2.772 0.527 -14.518 1.00 73.42 H new ATOM 0 HE2 LYS A 447 -2.163 -1.290 -12.888 1.00 51.53 H new ATOM 0 HE3 LYS A 447 -3.833 -1.822 -12.886 1.00 51.53 H new ATOM 0 HZ1 LYS A 447 -2.029 -2.844 -14.492 1.00 11.14 H new ATOM 0 HZ2 LYS A 447 -3.660 -2.710 -14.944 1.00 11.14 H new ATOM 0 HZ3 LYS A 447 -2.531 -1.565 -15.491 1.00 11.14 H new ATOM 1062 N LEU A 448 -3.145 3.062 -9.824 1.00 1.43 N ATOM 1063 CA LEU A 448 -1.949 3.067 -8.956 1.00 31.14 C ATOM 1064 C LEU A 448 -1.307 1.661 -8.896 1.00 21.33 C ATOM 1065 O LEU A 448 -2.009 0.654 -8.783 1.00 32.11 O ATOM 1066 CB LEU A 448 -2.333 3.539 -7.531 1.00 42.05 C ATOM 1067 CG LEU A 448 -2.886 4.994 -7.423 1.00 71.03 C ATOM 1068 CD1 LEU A 448 -3.197 5.377 -5.957 1.00 60.23 C ATOM 1069 CD2 LEU A 448 -1.926 6.005 -8.084 1.00 30.33 C ATOM 0 H LEU A 448 -3.951 2.609 -9.393 1.00 1.43 H new ATOM 0 HA LEU A 448 -1.219 3.758 -9.378 1.00 31.14 H new ATOM 0 HB2 LEU A 448 -3.082 2.855 -7.132 1.00 42.05 H new ATOM 0 HB3 LEU A 448 -1.454 3.456 -6.892 1.00 42.05 H new ATOM 0 HG LEU A 448 -3.828 5.030 -7.970 1.00 71.03 H new ATOM 0 HD11 LEU A 448 -3.580 6.397 -5.921 1.00 60.23 H new ATOM 0 HD12 LEU A 448 -3.944 4.694 -5.553 1.00 60.23 H new ATOM 0 HD13 LEU A 448 -2.286 5.310 -5.362 1.00 60.23 H new ATOM 0 HD21 LEU A 448 -2.337 7.010 -7.993 1.00 30.33 H new ATOM 0 HD22 LEU A 448 -0.956 5.964 -7.588 1.00 30.33 H new ATOM 0 HD23 LEU A 448 -1.805 5.756 -9.138 1.00 30.33 H new ATOM 1081 N ILE A 449 0.036 1.606 -8.976 1.00 65.15 N ATOM 1082 CA ILE A 449 0.805 0.339 -8.946 1.00 30.15 C ATOM 1083 C ILE A 449 1.597 0.247 -7.613 1.00 24.50 C ATOM 1084 O ILE A 449 2.209 1.233 -7.183 1.00 73.51 O ATOM 1085 CB ILE A 449 1.801 0.208 -10.182 1.00 21.01 C ATOM 1086 CG1 ILE A 449 1.044 0.225 -11.566 1.00 73.05 C ATOM 1087 CG2 ILE A 449 2.669 -1.078 -10.063 1.00 32.34 C ATOM 1088 CD1 ILE A 449 0.509 1.575 -12.030 1.00 34.22 C ATOM 0 H ILE A 449 0.622 2.436 -9.063 1.00 65.15 H new ATOM 0 HA ILE A 449 0.094 -0.484 -9.017 1.00 30.15 H new ATOM 0 HB ILE A 449 2.453 1.081 -10.152 1.00 21.01 H new ATOM 0 HG12 ILE A 449 1.722 -0.155 -12.331 1.00 73.05 H new ATOM 0 HG13 ILE A 449 0.208 -0.472 -11.507 1.00 73.05 H new ATOM 0 HG21 ILE A 449 3.341 -1.144 -10.919 1.00 32.34 H new ATOM 0 HG22 ILE A 449 3.255 -1.038 -9.145 1.00 32.34 H new ATOM 0 HG23 ILE A 449 2.021 -1.954 -10.042 1.00 32.34 H new ATOM 0 HD11 ILE A 449 0.010 1.457 -12.992 1.00 34.22 H new ATOM 0 HD12 ILE A 449 -0.202 1.956 -11.297 1.00 34.22 H new ATOM 0 HD13 ILE A 449 1.336 2.278 -12.134 1.00 34.22 H new ATOM 1100 N MET A 450 1.587 -0.939 -6.974 1.00 51.11 N ATOM 1101 CA MET A 450 2.310 -1.190 -5.705 1.00 63.45 C ATOM 1102 C MET A 450 3.194 -2.449 -5.820 1.00 3.02 C ATOM 1103 O MET A 450 3.005 -3.276 -6.723 1.00 54.32 O ATOM 1104 CB MET A 450 1.317 -1.329 -4.507 1.00 13.11 C ATOM 1105 CG MET A 450 0.627 -2.684 -4.350 1.00 63.52 C ATOM 1106 SD MET A 450 -0.621 -2.674 -3.044 1.00 42.11 S ATOM 1107 CE MET A 450 -1.140 -4.389 -3.018 1.00 1.04 C ATOM 0 H MET A 450 1.078 -1.752 -7.321 1.00 51.11 H new ATOM 0 HA MET A 450 2.953 -0.331 -5.513 1.00 63.45 H new ATOM 0 HB2 MET A 450 1.860 -1.113 -3.587 1.00 13.11 H new ATOM 0 HB3 MET A 450 0.548 -0.564 -4.610 1.00 13.11 H new ATOM 0 HG2 MET A 450 0.159 -2.962 -5.294 1.00 63.52 H new ATOM 0 HG3 MET A 450 1.374 -3.446 -4.129 1.00 63.52 H new ATOM 0 HE1 MET A 450 -1.945 -4.514 -2.294 1.00 1.04 H new ATOM 0 HE2 MET A 450 -1.493 -4.677 -4.008 1.00 1.04 H new ATOM 0 HE3 MET A 450 -0.297 -5.020 -2.736 1.00 1.04 H new ATOM 1117 N GLN A 451 4.164 -2.586 -4.898 1.00 41.11 N ATOM 1118 CA GLN A 451 5.012 -3.799 -4.800 1.00 21.25 C ATOM 1119 C GLN A 451 4.842 -4.476 -3.424 1.00 30.11 C ATOM 1120 O GLN A 451 4.796 -3.803 -2.390 1.00 24.05 O ATOM 1121 CB GLN A 451 6.509 -3.468 -5.048 1.00 14.11 C ATOM 1122 CG GLN A 451 7.415 -4.720 -5.086 1.00 24.21 C ATOM 1123 CD GLN A 451 8.881 -4.434 -5.404 1.00 42.13 C ATOM 1124 OE1 GLN A 451 9.282 -4.404 -6.553 1.00 21.52 O ATOM 1125 NE2 GLN A 451 9.694 -4.244 -4.390 1.00 30.33 N ATOM 0 H GLN A 451 4.385 -1.871 -4.205 1.00 41.11 H new ATOM 0 HA GLN A 451 4.683 -4.489 -5.577 1.00 21.25 H new ATOM 0 HB2 GLN A 451 6.603 -2.931 -5.992 1.00 14.11 H new ATOM 0 HB3 GLN A 451 6.860 -2.798 -4.264 1.00 14.11 H new ATOM 0 HG2 GLN A 451 7.358 -5.223 -4.121 1.00 24.21 H new ATOM 0 HG3 GLN A 451 7.024 -5.413 -5.831 1.00 24.21 H new ATOM 0 HE21 GLN A 451 9.335 -4.274 -3.436 1.00 30.33 H new ATOM 0 HE22 GLN A 451 10.685 -4.067 -4.557 1.00 30.33 H new ATOM 1134 N LEU A 452 4.762 -5.818 -3.435 1.00 4.41 N ATOM 1135 CA LEU A 452 4.623 -6.636 -2.221 1.00 71.12 C ATOM 1136 C LEU A 452 5.987 -6.879 -1.547 1.00 33.42 C ATOM 1137 O LEU A 452 6.835 -7.616 -2.069 1.00 34.00 O ATOM 1138 CB LEU A 452 3.954 -7.972 -2.576 1.00 21.34 C ATOM 1139 CG LEU A 452 2.535 -7.855 -3.200 1.00 2.33 C ATOM 1140 CD1 LEU A 452 2.047 -9.230 -3.657 1.00 71.32 C ATOM 1141 CD2 LEU A 452 1.533 -7.197 -2.212 1.00 34.23 C ATOM 0 H LEU A 452 4.792 -6.368 -4.294 1.00 4.41 H new ATOM 0 HA LEU A 452 3.998 -6.095 -1.510 1.00 71.12 H new ATOM 0 HB2 LEU A 452 4.597 -8.508 -3.273 1.00 21.34 H new ATOM 0 HB3 LEU A 452 3.888 -8.578 -1.673 1.00 21.34 H new ATOM 0 HG LEU A 452 2.596 -7.204 -4.072 1.00 2.33 H new ATOM 0 HD11 LEU A 452 1.052 -9.137 -4.093 1.00 71.32 H new ATOM 0 HD12 LEU A 452 2.734 -9.630 -4.403 1.00 71.32 H new ATOM 0 HD13 LEU A 452 2.007 -9.905 -2.802 1.00 71.32 H new ATOM 0 HD21 LEU A 452 0.551 -7.131 -2.680 1.00 34.23 H new ATOM 0 HD22 LEU A 452 1.464 -7.801 -1.308 1.00 34.23 H new ATOM 0 HD23 LEU A 452 1.880 -6.197 -1.954 1.00 34.23 H new ATOM 1153 N ILE A 453 6.185 -6.237 -0.395 1.00 74.32 N ATOM 1154 CA ILE A 453 7.412 -6.353 0.421 1.00 21.41 C ATOM 1155 C ILE A 453 7.047 -6.824 1.856 1.00 44.12 C ATOM 1156 O ILE A 453 5.961 -6.495 2.353 1.00 15.32 O ATOM 1157 CB ILE A 453 8.211 -4.989 0.466 1.00 32.32 C ATOM 1158 CG1 ILE A 453 7.341 -3.823 1.044 1.00 24.12 C ATOM 1159 CG2 ILE A 453 8.770 -4.631 -0.938 1.00 11.45 C ATOM 1160 CD1 ILE A 453 8.076 -2.495 1.187 1.00 25.25 C ATOM 0 H ILE A 453 5.491 -5.610 0.011 1.00 74.32 H new ATOM 0 HA ILE A 453 8.062 -7.094 -0.044 1.00 21.41 H new ATOM 0 HB ILE A 453 9.054 -5.125 1.143 1.00 32.32 H new ATOM 0 HG12 ILE A 453 6.476 -3.677 0.397 1.00 24.12 H new ATOM 0 HG13 ILE A 453 6.961 -4.120 2.021 1.00 24.12 H new ATOM 0 HG21 ILE A 453 9.316 -3.689 -0.883 1.00 11.45 H new ATOM 0 HG22 ILE A 453 9.442 -5.421 -1.274 1.00 11.45 H new ATOM 0 HG23 ILE A 453 7.945 -4.532 -1.644 1.00 11.45 H new ATOM 0 HD11 ILE A 453 7.397 -1.746 1.594 1.00 25.25 H new ATOM 0 HD12 ILE A 453 8.925 -2.619 1.859 1.00 25.25 H new ATOM 0 HD13 ILE A 453 8.432 -2.169 0.210 1.00 25.25 H new ATOM 1172 N PRO A 454 7.929 -7.632 2.531 1.00 21.10 N ATOM 1173 CA PRO A 454 7.653 -8.157 3.896 1.00 51.54 C ATOM 1174 C PRO A 454 7.492 -7.030 4.958 1.00 12.21 C ATOM 1175 O PRO A 454 8.384 -6.190 5.144 1.00 54.30 O ATOM 1176 CB PRO A 454 8.875 -9.075 4.189 1.00 41.30 C ATOM 1177 CG PRO A 454 9.951 -8.574 3.273 1.00 10.12 C ATOM 1178 CD PRO A 454 9.246 -8.113 2.020 1.00 71.22 C ATOM 0 HA PRO A 454 6.704 -8.690 3.947 1.00 51.54 H new ATOM 0 HB2 PRO A 454 9.180 -9.008 5.233 1.00 41.30 H new ATOM 0 HB3 PRO A 454 8.641 -10.121 3.992 1.00 41.30 H new ATOM 0 HG2 PRO A 454 10.506 -7.756 3.733 1.00 10.12 H new ATOM 0 HG3 PRO A 454 10.671 -9.361 3.049 1.00 10.12 H new ATOM 0 HD2 PRO A 454 9.797 -7.319 1.516 1.00 71.22 H new ATOM 0 HD3 PRO A 454 9.128 -8.925 1.302 1.00 71.22 H new ATOM 1186 N GLN A 455 6.333 -7.046 5.644 1.00 31.32 N ATOM 1187 CA GLN A 455 5.942 -6.037 6.657 1.00 2.32 C ATOM 1188 C GLN A 455 6.888 -6.045 7.899 1.00 62.23 C ATOM 1189 O GLN A 455 6.939 -5.071 8.662 1.00 71.30 O ATOM 1190 CB GLN A 455 4.463 -6.294 7.065 1.00 61.42 C ATOM 1191 CG GLN A 455 3.792 -5.152 7.853 1.00 42.21 C ATOM 1192 CD GLN A 455 2.333 -5.441 8.240 1.00 21.34 C ATOM 1193 OE1 GLN A 455 1.518 -4.404 8.335 1.00 3.01 O flip ATOM 1194 NE2 GLN A 455 1.941 -6.585 8.457 1.00 40.13 N flip ATOM 0 H GLN A 455 5.628 -7.771 5.510 1.00 31.32 H new ATOM 0 HA GLN A 455 6.037 -5.043 6.220 1.00 2.32 H new ATOM 0 HB2 GLN A 455 3.881 -6.482 6.163 1.00 61.42 H new ATOM 0 HB3 GLN A 455 4.421 -7.202 7.666 1.00 61.42 H new ATOM 0 HG2 GLN A 455 4.368 -4.961 8.759 1.00 42.21 H new ATOM 0 HG3 GLN A 455 3.826 -4.241 7.255 1.00 42.21 H new ATOM 0 HE21 GLN A 455 2.588 -7.369 8.378 1.00 40.13 H new ATOM 0 HE22 GLN A 455 0.969 -6.750 8.717 1.00 40.13 H new ATOM 1203 N GLN A 456 7.636 -7.155 8.079 1.00 55.34 N ATOM 1204 CA GLN A 456 8.702 -7.281 9.109 1.00 13.33 C ATOM 1205 C GLN A 456 9.796 -6.190 8.943 1.00 60.31 C ATOM 1206 O GLN A 456 10.253 -5.604 9.924 1.00 72.30 O ATOM 1207 CB GLN A 456 9.337 -8.697 9.022 1.00 24.02 C ATOM 1208 CG GLN A 456 10.448 -9.000 10.056 1.00 34.01 C ATOM 1209 CD GLN A 456 11.002 -10.430 9.955 1.00 14.52 C ATOM 1210 OE1 GLN A 456 10.301 -11.362 9.563 1.00 14.04 O ATOM 1211 NE2 GLN A 456 12.261 -10.621 10.309 1.00 25.11 N ATOM 0 H GLN A 456 7.520 -7.996 7.513 1.00 55.34 H new ATOM 0 HA GLN A 456 8.248 -7.139 10.090 1.00 13.33 H new ATOM 0 HB2 GLN A 456 8.546 -9.438 9.139 1.00 24.02 H new ATOM 0 HB3 GLN A 456 9.751 -8.828 8.022 1.00 24.02 H new ATOM 0 HG2 GLN A 456 11.265 -8.291 9.919 1.00 34.01 H new ATOM 0 HG3 GLN A 456 10.053 -8.841 11.060 1.00 34.01 H new ATOM 0 HE21 GLN A 456 12.825 -9.835 10.631 1.00 25.11 H new ATOM 0 HE22 GLN A 456 12.669 -11.555 10.260 1.00 25.11 H new ATOM 1220 N LEU A 457 10.188 -5.916 7.683 1.00 32.22 N ATOM 1221 CA LEU A 457 11.239 -4.916 7.352 1.00 21.34 C ATOM 1222 C LEU A 457 10.736 -3.454 7.513 1.00 51.44 C ATOM 1223 O LEU A 457 11.545 -2.526 7.617 1.00 4.34 O ATOM 1224 CB LEU A 457 11.774 -5.163 5.912 1.00 42.51 C ATOM 1225 CG LEU A 457 12.390 -6.580 5.649 1.00 44.52 C ATOM 1226 CD1 LEU A 457 12.951 -6.688 4.214 1.00 30.10 C ATOM 1227 CD2 LEU A 457 13.467 -6.931 6.702 1.00 61.50 C ATOM 0 H LEU A 457 9.791 -6.376 6.864 1.00 32.22 H new ATOM 0 HA LEU A 457 12.054 -5.046 8.064 1.00 21.34 H new ATOM 0 HB2 LEU A 457 10.956 -5.007 5.209 1.00 42.51 H new ATOM 0 HB3 LEU A 457 12.532 -4.411 5.692 1.00 42.51 H new ATOM 0 HG LEU A 457 11.587 -7.311 5.746 1.00 44.52 H new ATOM 0 HD11 LEU A 457 13.371 -7.682 4.062 1.00 30.10 H new ATOM 0 HD12 LEU A 457 12.148 -6.519 3.496 1.00 30.10 H new ATOM 0 HD13 LEU A 457 13.730 -5.939 4.070 1.00 30.10 H new ATOM 0 HD21 LEU A 457 13.874 -7.920 6.491 1.00 61.50 H new ATOM 0 HD22 LEU A 457 14.268 -6.193 6.663 1.00 61.50 H new ATOM 0 HD23 LEU A 457 13.019 -6.928 7.696 1.00 61.50 H new ATOM 1239 N LEU A 458 9.399 -3.261 7.527 1.00 0.35 N ATOM 1240 CA LEU A 458 8.771 -1.925 7.721 1.00 71.24 C ATOM 1241 C LEU A 458 8.951 -1.380 9.161 1.00 33.11 C ATOM 1242 O LEU A 458 8.875 -0.166 9.381 1.00 31.35 O ATOM 1243 CB LEU A 458 7.265 -1.971 7.377 1.00 63.21 C ATOM 1244 CG LEU A 458 6.898 -2.332 5.907 1.00 25.34 C ATOM 1245 CD1 LEU A 458 5.378 -2.215 5.695 1.00 13.41 C ATOM 1246 CD2 LEU A 458 7.677 -1.464 4.892 1.00 1.55 C ATOM 0 H LEU A 458 8.725 -4.017 7.406 1.00 0.35 H new ATOM 0 HA LEU A 458 9.286 -1.246 7.041 1.00 71.24 H new ATOM 0 HB2 LEU A 458 6.787 -2.696 8.036 1.00 63.21 H new ATOM 0 HB3 LEU A 458 6.833 -0.997 7.607 1.00 63.21 H new ATOM 0 HG LEU A 458 7.193 -3.366 5.729 1.00 25.34 H new ATOM 0 HD11 LEU A 458 5.134 -2.470 4.664 1.00 13.41 H new ATOM 0 HD12 LEU A 458 4.863 -2.899 6.369 1.00 13.41 H new ATOM 0 HD13 LEU A 458 5.059 -1.193 5.901 1.00 13.41 H new ATOM 0 HD21 LEU A 458 7.393 -1.746 3.878 1.00 1.55 H new ATOM 0 HD22 LEU A 458 7.441 -0.413 5.055 1.00 1.55 H new ATOM 0 HD23 LEU A 458 8.747 -1.620 5.026 1.00 1.55 H new ATOM 1258 N THR A 459 9.174 -2.286 10.134 1.00 5.44 N ATOM 1259 CA THR A 459 9.448 -1.898 11.547 1.00 22.41 C ATOM 1260 C THR A 459 10.780 -1.110 11.662 1.00 34.11 C ATOM 1261 O THR A 459 10.956 -0.290 12.569 1.00 64.02 O ATOM 1262 CB THR A 459 9.508 -3.142 12.494 1.00 74.32 C ATOM 1263 OG1 THR A 459 10.650 -3.957 12.164 1.00 22.14 O ATOM 1264 CG2 THR A 459 8.225 -4.001 12.405 1.00 5.41 C ATOM 0 H THR A 459 9.171 -3.293 9.975 1.00 5.44 H new ATOM 0 HA THR A 459 8.620 -1.262 11.859 1.00 22.41 H new ATOM 0 HB THR A 459 9.594 -2.769 13.515 1.00 74.32 H new ATOM 0 HG1 THR A 459 10.444 -4.505 11.378 1.00 22.14 H new ATOM 0 HG21 THR A 459 8.310 -4.854 13.079 1.00 5.41 H new ATOM 0 HG22 THR A 459 7.363 -3.398 12.690 1.00 5.41 H new ATOM 0 HG23 THR A 459 8.096 -4.358 11.383 1.00 5.41 H new ATOM 1272 N THR A 460 11.703 -1.373 10.713 1.00 32.22 N ATOM 1273 CA THR A 460 12.988 -0.642 10.582 1.00 33.24 C ATOM 1274 C THR A 460 12.763 0.840 10.168 1.00 4.35 C ATOM 1275 O THR A 460 13.571 1.716 10.492 1.00 23.34 O ATOM 1276 CB THR A 460 13.920 -1.348 9.526 1.00 44.33 C ATOM 1277 OG1 THR A 460 14.000 -2.759 9.811 1.00 10.40 O ATOM 1278 CG2 THR A 460 15.351 -0.763 9.505 1.00 11.31 C ATOM 0 H THR A 460 11.580 -2.102 10.010 1.00 32.22 H new ATOM 0 HA THR A 460 13.471 -0.656 11.559 1.00 33.24 H new ATOM 0 HB THR A 460 13.474 -1.174 8.547 1.00 44.33 H new ATOM 0 HG1 THR A 460 14.579 -3.194 9.151 1.00 10.40 H new ATOM 0 HG21 THR A 460 15.948 -1.288 8.759 1.00 11.31 H new ATOM 0 HG22 THR A 460 15.307 0.297 9.254 1.00 11.31 H new ATOM 0 HG23 THR A 460 15.808 -0.885 10.487 1.00 11.31 H new ATOM 1286 N LEU A 461 11.652 1.113 9.447 1.00 45.23 N ATOM 1287 CA LEU A 461 11.317 2.478 8.968 1.00 23.32 C ATOM 1288 C LEU A 461 10.799 3.391 10.105 1.00 60.33 C ATOM 1289 O LEU A 461 10.965 4.603 10.017 1.00 32.45 O ATOM 1290 CB LEU A 461 10.272 2.418 7.822 1.00 74.43 C ATOM 1291 CG LEU A 461 10.662 1.545 6.582 1.00 33.35 C ATOM 1292 CD1 LEU A 461 9.629 1.688 5.447 1.00 64.24 C ATOM 1293 CD2 LEU A 461 12.088 1.863 6.084 1.00 61.22 C ATOM 0 H LEU A 461 10.968 0.404 9.182 1.00 45.23 H new ATOM 0 HA LEU A 461 12.242 2.913 8.591 1.00 23.32 H new ATOM 0 HB2 LEU A 461 9.336 2.036 8.230 1.00 74.43 H new ATOM 0 HB3 LEU A 461 10.079 3.435 7.479 1.00 74.43 H new ATOM 0 HG LEU A 461 10.656 0.504 6.907 1.00 33.35 H new ATOM 0 HD11 LEU A 461 9.930 1.069 4.601 1.00 64.24 H new ATOM 0 HD12 LEU A 461 8.650 1.366 5.803 1.00 64.24 H new ATOM 0 HD13 LEU A 461 9.575 2.730 5.133 1.00 64.24 H new ATOM 0 HD21 LEU A 461 12.321 1.237 5.223 1.00 61.22 H new ATOM 0 HD22 LEU A 461 12.147 2.913 5.796 1.00 61.22 H new ATOM 0 HD23 LEU A 461 12.804 1.665 6.881 1.00 61.22 H new ATOM 1305 N GLY A 462 10.161 2.770 11.132 1.00 40.02 N ATOM 1306 CA GLY A 462 9.646 3.432 12.357 1.00 44.00 C ATOM 1307 C GLY A 462 9.087 4.869 12.207 1.00 72.23 C ATOM 1308 O GLY A 462 7.899 5.035 11.893 1.00 63.25 O ATOM 0 H GLY A 462 9.986 1.765 11.129 1.00 40.02 H new ATOM 0 HA2 GLY A 462 8.857 2.805 12.773 1.00 44.00 H new ATOM 0 HA3 GLY A 462 10.452 3.459 13.090 1.00 44.00 H new ATOM 1312 N PRO A 463 9.953 5.931 12.421 1.00 15.31 N ATOM 1313 CA PRO A 463 9.573 7.370 12.289 1.00 11.44 C ATOM 1314 C PRO A 463 8.858 7.730 10.953 1.00 53.43 C ATOM 1315 O PRO A 463 8.017 8.625 10.941 1.00 65.33 O ATOM 1316 CB PRO A 463 10.937 8.124 12.430 1.00 11.53 C ATOM 1317 CG PRO A 463 11.983 7.056 12.258 1.00 62.32 C ATOM 1318 CD PRO A 463 11.375 5.803 12.840 1.00 71.12 C ATOM 0 HA PRO A 463 8.834 7.647 13.041 1.00 11.44 H new ATOM 0 HB2 PRO A 463 11.039 8.903 11.675 1.00 11.53 H new ATOM 0 HB3 PRO A 463 11.023 8.609 13.402 1.00 11.53 H new ATOM 0 HG2 PRO A 463 12.235 6.919 11.207 1.00 62.32 H new ATOM 0 HG3 PRO A 463 12.905 7.322 12.775 1.00 62.32 H new ATOM 0 HD2 PRO A 463 11.839 4.901 12.442 1.00 71.12 H new ATOM 0 HD3 PRO A 463 11.480 5.763 13.924 1.00 71.12 H new ATOM 1326 N LEU A 464 9.180 7.016 9.851 1.00 4.33 N ATOM 1327 CA LEU A 464 8.539 7.229 8.522 1.00 41.22 C ATOM 1328 C LEU A 464 6.995 7.046 8.574 1.00 62.02 C ATOM 1329 O LEU A 464 6.246 7.845 8.007 1.00 74.02 O ATOM 1330 CB LEU A 464 9.163 6.289 7.454 1.00 14.31 C ATOM 1331 CG LEU A 464 10.666 6.552 7.095 1.00 65.53 C ATOM 1332 CD1 LEU A 464 11.168 5.570 6.014 1.00 20.14 C ATOM 1333 CD2 LEU A 464 10.890 8.015 6.650 1.00 53.23 C ATOM 0 H LEU A 464 9.886 6.280 9.851 1.00 4.33 H new ATOM 0 HA LEU A 464 8.731 8.264 8.238 1.00 41.22 H new ATOM 0 HB2 LEU A 464 9.069 5.261 7.805 1.00 14.31 H new ATOM 0 HB3 LEU A 464 8.573 6.369 6.541 1.00 14.31 H new ATOM 0 HG LEU A 464 11.249 6.382 8.000 1.00 65.53 H new ATOM 0 HD11 LEU A 464 12.214 5.780 5.789 1.00 20.14 H new ATOM 0 HD12 LEU A 464 11.074 4.547 6.380 1.00 20.14 H new ATOM 0 HD13 LEU A 464 10.571 5.688 5.110 1.00 20.14 H new ATOM 0 HD21 LEU A 464 11.942 8.165 6.408 1.00 53.23 H new ATOM 0 HD22 LEU A 464 10.282 8.225 5.770 1.00 53.23 H new ATOM 0 HD23 LEU A 464 10.604 8.689 7.458 1.00 53.23 H new ATOM 1345 N PHE A 465 6.540 5.992 9.278 1.00 32.23 N ATOM 1346 CA PHE A 465 5.092 5.719 9.496 1.00 15.33 C ATOM 1347 C PHE A 465 4.487 6.632 10.591 1.00 4.12 C ATOM 1348 O PHE A 465 3.280 6.905 10.594 1.00 4.43 O ATOM 1349 CB PHE A 465 4.885 4.235 9.870 1.00 74.24 C ATOM 1350 CG PHE A 465 5.200 3.269 8.734 1.00 51.44 C ATOM 1351 CD1 PHE A 465 4.318 3.136 7.665 1.00 31.42 C ATOM 1352 CD2 PHE A 465 6.364 2.502 8.726 1.00 3.53 C ATOM 1353 CE1 PHE A 465 4.582 2.266 6.634 1.00 51.00 C ATOM 1354 CE2 PHE A 465 6.622 1.632 7.687 1.00 33.52 C ATOM 1355 CZ PHE A 465 5.728 1.517 6.643 1.00 53.53 C ATOM 0 H PHE A 465 7.156 5.305 9.713 1.00 32.23 H new ATOM 0 HA PHE A 465 4.572 5.938 8.563 1.00 15.33 H new ATOM 0 HB2 PHE A 465 5.515 3.994 10.726 1.00 74.24 H new ATOM 0 HB3 PHE A 465 3.851 4.089 10.184 1.00 74.24 H new ATOM 0 HD1 PHE A 465 3.413 3.725 7.645 1.00 31.42 H new ATOM 0 HD2 PHE A 465 7.069 2.590 9.539 1.00 3.53 H new ATOM 0 HE1 PHE A 465 3.884 2.173 5.815 1.00 51.00 H new ATOM 0 HE2 PHE A 465 7.525 1.040 7.691 1.00 33.52 H new ATOM 0 HZ PHE A 465 5.932 0.835 5.831 1.00 53.53 H new ATOM 1365 N ARG A 466 5.337 7.091 11.525 1.00 73.34 N ATOM 1366 CA ARG A 466 4.941 8.058 12.578 1.00 61.13 C ATOM 1367 C ARG A 466 4.808 9.497 12.000 1.00 61.51 C ATOM 1368 O ARG A 466 4.261 10.392 12.654 1.00 2.33 O ATOM 1369 CB ARG A 466 5.968 8.013 13.739 1.00 14.12 C ATOM 1370 CG ARG A 466 6.098 6.632 14.424 1.00 4.21 C ATOM 1371 CD ARG A 466 7.217 6.592 15.482 1.00 30.31 C ATOM 1372 NE ARG A 466 7.006 7.569 16.572 1.00 30.13 N ATOM 1373 CZ ARG A 466 6.516 7.297 17.765 1.00 12.44 C ATOM 1374 NH1 ARG A 466 6.081 6.107 18.063 1.00 51.35 N ATOM 1375 NH2 ARG A 466 6.445 8.234 18.651 1.00 54.10 N ATOM 0 H ARG A 466 6.315 6.807 11.577 1.00 73.34 H new ATOM 0 HA ARG A 466 3.962 7.775 12.964 1.00 61.13 H new ATOM 0 HB2 ARG A 466 6.945 8.308 13.356 1.00 14.12 H new ATOM 0 HB3 ARG A 466 5.683 8.751 14.489 1.00 14.12 H new ATOM 0 HG2 ARG A 466 5.149 6.375 14.895 1.00 4.21 H new ATOM 0 HG3 ARG A 466 6.293 5.873 13.666 1.00 4.21 H new ATOM 0 HD2 ARG A 466 7.276 5.589 15.905 1.00 30.31 H new ATOM 0 HD3 ARG A 466 8.174 6.792 15.000 1.00 30.31 H new ATOM 0 HE ARG A 466 7.262 8.538 16.384 1.00 30.13 H new ATOM 0 HH11 ARG A 466 6.115 5.362 17.367 1.00 51.35 H new ATOM 0 HH12 ARG A 466 5.706 5.919 18.993 1.00 51.35 H new ATOM 0 HH21 ARG A 466 6.767 9.175 18.425 1.00 54.10 H new ATOM 0 HH22 ARG A 466 6.067 8.033 19.577 1.00 54.10 H new ATOM 1389 N ASN A 467 5.325 9.708 10.769 1.00 43.21 N ATOM 1390 CA ASN A 467 5.152 10.968 10.004 1.00 12.15 C ATOM 1391 C ASN A 467 4.165 10.749 8.826 1.00 5.14 C ATOM 1392 O ASN A 467 4.315 11.344 7.756 1.00 65.04 O ATOM 1393 CB ASN A 467 6.523 11.451 9.452 1.00 52.53 C ATOM 1394 CG ASN A 467 7.614 11.638 10.502 1.00 14.12 C ATOM 1395 OD1 ASN A 467 7.350 11.949 11.661 1.00 2.04 O ATOM 1396 ND2 ASN A 467 8.859 11.462 10.095 1.00 2.34 N ATOM 0 H ASN A 467 5.877 9.007 10.274 1.00 43.21 H new ATOM 0 HA ASN A 467 4.747 11.727 10.673 1.00 12.15 H new ATOM 0 HB2 ASN A 467 6.873 10.732 8.711 1.00 52.53 H new ATOM 0 HB3 ASN A 467 6.375 12.397 8.932 1.00 52.53 H new ATOM 0 HD21 ASN A 467 9.632 11.584 10.750 1.00 2.34 H new ATOM 0 HD22 ASN A 467 9.047 11.204 9.126 1.00 2.34 H new ATOM 1403 N SER A 468 3.143 9.899 9.026 1.00 50.43 N ATOM 1404 CA SER A 468 2.154 9.565 7.959 1.00 64.14 C ATOM 1405 C SER A 468 0.706 9.914 8.366 1.00 12.14 C ATOM 1406 O SER A 468 0.409 10.101 9.550 1.00 22.43 O ATOM 1407 CB SER A 468 2.232 8.058 7.610 1.00 51.12 C ATOM 1408 OG SER A 468 3.514 7.677 7.147 1.00 21.44 O ATOM 0 H SER A 468 2.971 9.425 9.913 1.00 50.43 H new ATOM 0 HA SER A 468 2.414 10.169 7.090 1.00 64.14 H new ATOM 0 HB2 SER A 468 1.978 7.470 8.492 1.00 51.12 H new ATOM 0 HB3 SER A 468 1.489 7.826 6.847 1.00 51.12 H new ATOM 0 HG SER A 468 4.189 7.924 7.813 1.00 21.44 H new ATOM 1414 N ARG A 469 -0.196 10.005 7.360 1.00 71.44 N ATOM 1415 CA ARG A 469 -1.660 10.146 7.580 1.00 15.55 C ATOM 1416 C ARG A 469 -2.417 8.887 7.108 1.00 43.33 C ATOM 1417 O ARG A 469 -2.128 8.346 6.038 1.00 41.14 O ATOM 1418 CB ARG A 469 -2.225 11.413 6.872 1.00 11.40 C ATOM 1419 CG ARG A 469 -1.956 11.511 5.349 1.00 43.52 C ATOM 1420 CD ARG A 469 -2.657 12.729 4.702 1.00 52.43 C ATOM 1421 NE ARG A 469 -2.299 13.992 5.376 1.00 45.31 N ATOM 1422 CZ ARG A 469 -2.914 15.143 5.247 1.00 64.42 C ATOM 1423 NH1 ARG A 469 -3.933 15.297 4.461 1.00 25.13 N ATOM 1424 NH2 ARG A 469 -2.495 16.152 5.934 1.00 21.34 N ATOM 0 H ARG A 469 0.067 9.983 6.375 1.00 71.44 H new ATOM 0 HA ARG A 469 -1.815 10.261 8.653 1.00 15.55 H new ATOM 0 HB2 ARG A 469 -3.302 11.447 7.034 1.00 11.40 H new ATOM 0 HB3 ARG A 469 -1.802 12.294 7.354 1.00 11.40 H new ATOM 0 HG2 ARG A 469 -0.882 11.580 5.176 1.00 43.52 H new ATOM 0 HG3 ARG A 469 -2.299 10.598 4.863 1.00 43.52 H new ATOM 0 HD2 ARG A 469 -2.382 12.789 3.649 1.00 52.43 H new ATOM 0 HD3 ARG A 469 -3.737 12.590 4.742 1.00 52.43 H new ATOM 0 HE ARG A 469 -1.495 13.967 6.003 1.00 45.31 H new ATOM 0 HH11 ARG A 469 -4.282 14.508 3.917 1.00 25.13 H new ATOM 0 HH12 ARG A 469 -4.386 16.208 4.386 1.00 25.13 H new ATOM 0 HH21 ARG A 469 -1.699 16.046 6.563 1.00 21.34 H new ATOM 0 HH22 ARG A 469 -2.960 17.056 5.848 1.00 21.34 H new ATOM 1438 N MET A 470 -3.385 8.421 7.915 1.00 43.34 N ATOM 1439 CA MET A 470 -4.230 7.260 7.569 1.00 51.21 C ATOM 1440 C MET A 470 -5.459 7.684 6.738 1.00 35.10 C ATOM 1441 O MET A 470 -6.333 8.412 7.214 1.00 43.31 O ATOM 1442 CB MET A 470 -4.674 6.489 8.859 1.00 3.25 C ATOM 1443 CG MET A 470 -3.814 5.270 9.176 1.00 50.45 C ATOM 1444 SD MET A 470 -4.138 4.581 10.815 1.00 31.33 S ATOM 1445 CE MET A 470 -2.959 3.227 10.880 1.00 43.41 C ATOM 0 H MET A 470 -3.605 8.834 8.821 1.00 43.34 H new ATOM 0 HA MET A 470 -3.630 6.588 6.956 1.00 51.21 H new ATOM 0 HB2 MET A 470 -4.645 7.173 9.707 1.00 3.25 H new ATOM 0 HB3 MET A 470 -5.710 6.170 8.742 1.00 3.25 H new ATOM 0 HG2 MET A 470 -3.992 4.502 8.424 1.00 50.45 H new ATOM 0 HG3 MET A 470 -2.762 5.547 9.106 1.00 50.45 H new ATOM 0 HE1 MET A 470 -3.259 2.520 11.654 1.00 43.41 H new ATOM 0 HE2 MET A 470 -2.934 2.720 9.916 1.00 43.41 H new ATOM 0 HE3 MET A 470 -1.968 3.618 11.110 1.00 43.41 H new ATOM 1455 N VAL A 471 -5.487 7.218 5.491 1.00 63.00 N ATOM 1456 CA VAL A 471 -6.688 7.231 4.629 1.00 72.13 C ATOM 1457 C VAL A 471 -7.175 5.772 4.464 1.00 73.14 C ATOM 1458 O VAL A 471 -6.430 4.832 4.769 1.00 35.53 O ATOM 1459 CB VAL A 471 -6.401 7.896 3.221 1.00 21.43 C ATOM 1460 CG1 VAL A 471 -5.923 9.364 3.386 1.00 24.55 C ATOM 1461 CG2 VAL A 471 -5.387 7.071 2.383 1.00 72.33 C ATOM 0 H VAL A 471 -4.669 6.813 5.036 1.00 63.00 H new ATOM 0 HA VAL A 471 -7.462 7.837 5.100 1.00 72.13 H new ATOM 0 HB VAL A 471 -7.342 7.903 2.671 1.00 21.43 H new ATOM 0 HG11 VAL A 471 -5.733 9.797 2.404 1.00 24.55 H new ATOM 0 HG12 VAL A 471 -6.694 9.943 3.895 1.00 24.55 H new ATOM 0 HG13 VAL A 471 -5.006 9.384 3.975 1.00 24.55 H new ATOM 0 HG21 VAL A 471 -5.220 7.564 1.425 1.00 72.33 H new ATOM 0 HG22 VAL A 471 -4.443 6.998 2.923 1.00 72.33 H new ATOM 0 HG23 VAL A 471 -5.785 6.071 2.212 1.00 72.33 H new ATOM 1471 N GLN A 472 -8.417 5.560 4.007 1.00 50.33 N ATOM 1472 CA GLN A 472 -8.977 4.188 3.879 1.00 71.34 C ATOM 1473 C GLN A 472 -9.303 3.839 2.413 1.00 62.11 C ATOM 1474 O GLN A 472 -10.026 4.572 1.732 1.00 2.14 O ATOM 1475 CB GLN A 472 -10.225 4.024 4.784 1.00 32.20 C ATOM 1476 CG GLN A 472 -10.900 2.633 4.688 1.00 72.30 C ATOM 1477 CD GLN A 472 -11.988 2.387 5.736 1.00 23.44 C ATOM 1478 OE1 GLN A 472 -12.247 1.134 6.051 1.00 41.04 O flip ATOM 1479 NE2 GLN A 472 -12.618 3.313 6.231 1.00 63.30 N flip ATOM 0 H GLN A 472 -9.054 6.304 3.721 1.00 50.33 H new ATOM 0 HA GLN A 472 -8.215 3.485 4.214 1.00 71.34 H new ATOM 0 HB2 GLN A 472 -9.936 4.204 5.819 1.00 32.20 H new ATOM 0 HB3 GLN A 472 -10.955 4.789 4.519 1.00 32.20 H new ATOM 0 HG2 GLN A 472 -11.336 2.522 3.695 1.00 72.30 H new ATOM 0 HG3 GLN A 472 -10.135 1.863 4.788 1.00 72.30 H new ATOM 0 HE21 GLN A 472 -12.399 4.275 5.972 1.00 63.30 H new ATOM 0 HE22 GLN A 472 -13.361 3.122 6.903 1.00 63.30 H new ATOM 1488 N PHE A 473 -8.762 2.696 1.945 1.00 14.52 N ATOM 1489 CA PHE A 473 -9.048 2.152 0.607 1.00 62.54 C ATOM 1490 C PHE A 473 -10.285 1.222 0.657 1.00 13.34 C ATOM 1491 O PHE A 473 -10.230 0.115 1.208 1.00 2.41 O ATOM 1492 CB PHE A 473 -7.810 1.393 0.055 1.00 21.23 C ATOM 1493 CG PHE A 473 -6.645 2.296 -0.365 1.00 44.20 C ATOM 1494 CD1 PHE A 473 -5.950 3.064 0.577 1.00 10.24 C ATOM 1495 CD2 PHE A 473 -6.247 2.379 -1.701 1.00 55.41 C ATOM 1496 CE1 PHE A 473 -4.897 3.873 0.192 1.00 12.24 C ATOM 1497 CE2 PHE A 473 -5.191 3.188 -2.081 1.00 62.24 C ATOM 1498 CZ PHE A 473 -4.522 3.939 -1.135 1.00 43.45 C ATOM 0 H PHE A 473 -8.114 2.125 2.487 1.00 14.52 H new ATOM 0 HA PHE A 473 -9.269 2.980 -0.067 1.00 62.54 H new ATOM 0 HB2 PHE A 473 -7.457 0.697 0.816 1.00 21.23 H new ATOM 0 HB3 PHE A 473 -8.119 0.797 -0.804 1.00 21.23 H new ATOM 0 HD1 PHE A 473 -6.240 3.024 1.617 1.00 10.24 H new ATOM 0 HD2 PHE A 473 -6.772 1.803 -2.449 1.00 55.41 H new ATOM 0 HE1 PHE A 473 -4.366 4.455 0.931 1.00 12.24 H new ATOM 0 HE2 PHE A 473 -4.890 3.232 -3.117 1.00 62.24 H new ATOM 0 HZ PHE A 473 -3.705 4.579 -1.433 1.00 43.45 H new ATOM 1508 N HIS A 474 -11.399 1.701 0.083 1.00 71.51 N ATOM 1509 CA HIS A 474 -12.650 0.931 -0.056 1.00 64.35 C ATOM 1510 C HIS A 474 -12.660 0.177 -1.405 1.00 54.03 C ATOM 1511 O HIS A 474 -12.634 0.792 -2.474 1.00 33.23 O ATOM 1512 CB HIS A 474 -13.877 1.878 0.050 1.00 53.45 C ATOM 1513 CG HIS A 474 -15.217 1.192 -0.136 1.00 43.11 C ATOM 1514 ND1 HIS A 474 -15.770 0.428 0.858 1.00 20.31 N ATOM 1515 CD2 HIS A 474 -16.044 1.169 -1.216 1.00 71.54 C ATOM 1516 CE1 HIS A 474 -16.907 -0.038 0.373 1.00 44.53 C ATOM 1517 NE2 HIS A 474 -17.116 0.382 -0.882 1.00 44.55 N ATOM 0 H HIS A 474 -11.460 2.643 -0.303 1.00 71.51 H new ATOM 0 HA HIS A 474 -12.709 0.200 0.751 1.00 64.35 H new ATOM 0 HB2 HIS A 474 -13.863 2.362 1.026 1.00 53.45 H new ATOM 0 HB3 HIS A 474 -13.779 2.665 -0.698 1.00 53.45 H new ATOM 0 HD2 HIS A 474 -15.886 1.674 -2.157 1.00 71.54 H new ATOM 0 HE1 HIS A 474 -17.584 -0.678 0.920 1.00 44.53 H new ATOM 0 HE2 HIS A 474 -17.917 0.160 -1.474 1.00 44.55 H new ATOM 1525 N PHE A 475 -12.671 -1.157 -1.342 1.00 13.30 N ATOM 1526 CA PHE A 475 -12.816 -2.018 -2.534 1.00 34.10 C ATOM 1527 C PHE A 475 -14.313 -2.338 -2.754 1.00 53.25 C ATOM 1528 O PHE A 475 -15.057 -2.560 -1.788 1.00 0.21 O ATOM 1529 CB PHE A 475 -11.954 -3.299 -2.376 1.00 61.03 C ATOM 1530 CG PHE A 475 -10.444 -3.011 -2.372 1.00 41.41 C ATOM 1531 CD1 PHE A 475 -9.807 -2.512 -1.235 1.00 70.32 C ATOM 1532 CD2 PHE A 475 -9.667 -3.216 -3.511 1.00 1.42 C ATOM 1533 CE1 PHE A 475 -8.449 -2.236 -1.239 1.00 73.35 C ATOM 1534 CE2 PHE A 475 -8.307 -2.941 -3.511 1.00 2.11 C ATOM 1535 CZ PHE A 475 -7.702 -2.452 -2.374 1.00 3.42 C ATOM 0 H PHE A 475 -12.580 -1.676 -0.469 1.00 13.30 H new ATOM 0 HA PHE A 475 -12.452 -1.498 -3.420 1.00 34.10 H new ATOM 0 HB2 PHE A 475 -12.225 -3.800 -1.447 1.00 61.03 H new ATOM 0 HB3 PHE A 475 -12.185 -3.988 -3.189 1.00 61.03 H new ATOM 0 HD1 PHE A 475 -10.382 -2.338 -0.337 1.00 70.32 H new ATOM 0 HD2 PHE A 475 -10.132 -3.595 -4.409 1.00 1.42 H new ATOM 0 HE1 PHE A 475 -7.976 -1.850 -0.348 1.00 73.35 H new ATOM 0 HE2 PHE A 475 -7.722 -3.110 -4.403 1.00 2.11 H new ATOM 0 HZ PHE A 475 -6.643 -2.239 -2.374 1.00 3.42 H new ATOM 1545 N THR A 476 -14.735 -2.344 -4.031 1.00 44.40 N ATOM 1546 CA THR A 476 -16.166 -2.435 -4.434 1.00 74.44 C ATOM 1547 C THR A 476 -16.855 -3.739 -3.937 1.00 52.40 C ATOM 1548 O THR A 476 -17.845 -3.687 -3.200 1.00 75.24 O ATOM 1549 CB THR A 476 -16.295 -2.324 -5.991 1.00 32.11 C ATOM 1550 OG1 THR A 476 -15.470 -3.324 -6.621 1.00 10.22 O ATOM 1551 CG2 THR A 476 -15.886 -0.926 -6.498 1.00 22.43 C ATOM 0 H THR A 476 -14.096 -2.286 -4.824 1.00 44.40 H new ATOM 0 HA THR A 476 -16.681 -1.601 -3.957 1.00 74.44 H new ATOM 0 HB THR A 476 -17.341 -2.485 -6.251 1.00 32.11 H new ATOM 0 HG1 THR A 476 -15.555 -3.252 -7.595 1.00 10.22 H new ATOM 0 HG21 THR A 476 -15.989 -0.888 -7.582 1.00 22.43 H new ATOM 0 HG22 THR A 476 -16.530 -0.172 -6.046 1.00 22.43 H new ATOM 0 HG23 THR A 476 -14.849 -0.729 -6.225 1.00 22.43 H new ATOM 1559 N ASN A 477 -16.318 -4.893 -4.347 1.00 71.20 N ATOM 1560 CA ASN A 477 -16.798 -6.231 -3.920 1.00 71.14 C ATOM 1561 C ASN A 477 -15.704 -6.933 -3.078 1.00 43.02 C ATOM 1562 O ASN A 477 -14.516 -6.660 -3.261 1.00 42.32 O ATOM 1563 CB ASN A 477 -17.161 -7.054 -5.186 1.00 51.13 C ATOM 1564 CG ASN A 477 -17.675 -8.466 -4.908 1.00 53.24 C ATOM 1565 OD1 ASN A 477 -17.400 -9.389 -5.811 1.00 24.43 O flip ATOM 1566 ND2 ASN A 477 -18.312 -8.725 -3.896 1.00 15.33 N flip ATOM 0 H ASN A 477 -15.529 -4.935 -4.992 1.00 71.20 H new ATOM 0 HA ASN A 477 -17.687 -6.140 -3.296 1.00 71.14 H new ATOM 0 HB2 ASN A 477 -17.920 -6.511 -5.750 1.00 51.13 H new ATOM 0 HB3 ASN A 477 -16.279 -7.123 -5.823 1.00 51.13 H new ATOM 0 HD21 ASN A 477 -18.509 -7.991 -3.216 1.00 15.33 H new ATOM 0 HD22 ASN A 477 -18.646 -9.675 -3.733 1.00 15.33 H new ATOM 1573 N LYS A 478 -16.102 -7.844 -2.161 1.00 41.55 N ATOM 1574 CA LYS A 478 -15.157 -8.565 -1.263 1.00 34.35 C ATOM 1575 C LYS A 478 -15.059 -10.074 -1.601 1.00 41.13 C ATOM 1576 O LYS A 478 -14.673 -10.895 -0.754 1.00 31.42 O ATOM 1577 CB LYS A 478 -15.554 -8.324 0.223 1.00 41.30 C ATOM 1578 CG LYS A 478 -15.425 -6.846 0.651 1.00 31.33 C ATOM 1579 CD LYS A 478 -15.854 -6.590 2.110 1.00 4.33 C ATOM 1580 CE LYS A 478 -15.691 -5.111 2.516 1.00 60.53 C ATOM 1581 NZ LYS A 478 -16.220 -4.843 3.877 1.00 41.10 N ATOM 0 H LYS A 478 -17.079 -8.102 -2.019 1.00 41.55 H new ATOM 0 HA LYS A 478 -14.158 -8.160 -1.424 1.00 34.35 H new ATOM 0 HB2 LYS A 478 -16.582 -8.652 0.376 1.00 41.30 H new ATOM 0 HB3 LYS A 478 -14.924 -8.939 0.866 1.00 41.30 H new ATOM 0 HG2 LYS A 478 -14.390 -6.528 0.523 1.00 31.33 H new ATOM 0 HG3 LYS A 478 -16.032 -6.229 -0.012 1.00 31.33 H new ATOM 0 HD2 LYS A 478 -16.895 -6.887 2.238 1.00 4.33 H new ATOM 0 HD3 LYS A 478 -15.260 -7.215 2.776 1.00 4.33 H new ATOM 0 HE2 LYS A 478 -14.636 -4.839 2.478 1.00 60.53 H new ATOM 0 HE3 LYS A 478 -16.209 -4.479 1.795 1.00 60.53 H new ATOM 0 HZ1 LYS A 478 -16.090 -3.837 4.108 1.00 41.10 H new ATOM 0 HZ2 LYS A 478 -17.233 -5.077 3.908 1.00 41.10 H new ATOM 0 HZ3 LYS A 478 -15.708 -5.427 4.569 1.00 41.10 H new ATOM 1595 N ASP A 479 -15.336 -10.426 -2.875 1.00 61.41 N ATOM 1596 CA ASP A 479 -15.382 -11.837 -3.330 1.00 71.44 C ATOM 1597 C ASP A 479 -14.390 -12.158 -4.481 1.00 44.14 C ATOM 1598 O ASP A 479 -14.369 -13.298 -4.962 1.00 73.34 O ATOM 1599 CB ASP A 479 -16.827 -12.201 -3.761 1.00 31.52 C ATOM 1600 CG ASP A 479 -17.843 -12.123 -2.612 1.00 4.41 C ATOM 1601 OD1 ASP A 479 -17.626 -12.789 -1.576 1.00 73.32 O ATOM 1602 OD2 ASP A 479 -18.868 -11.420 -2.746 1.00 5.22 O ATOM 0 H ASP A 479 -15.533 -9.749 -3.612 1.00 61.41 H new ATOM 0 HA ASP A 479 -15.070 -12.445 -2.481 1.00 71.44 H new ATOM 0 HB2 ASP A 479 -17.140 -11.529 -4.560 1.00 31.52 H new ATOM 0 HB3 ASP A 479 -16.832 -13.210 -4.173 1.00 31.52 H new ATOM 1607 N LEU A 480 -13.560 -11.185 -4.913 1.00 44.53 N ATOM 1608 CA LEU A 480 -12.675 -11.380 -6.093 1.00 75.20 C ATOM 1609 C LEU A 480 -11.471 -12.295 -5.768 1.00 64.22 C ATOM 1610 O LEU A 480 -10.972 -12.282 -4.650 1.00 0.52 O ATOM 1611 CB LEU A 480 -12.205 -10.029 -6.686 1.00 55.15 C ATOM 1612 CG LEU A 480 -13.357 -9.074 -7.166 1.00 31.24 C ATOM 1613 CD1 LEU A 480 -13.820 -8.139 -6.034 1.00 60.34 C ATOM 1614 CD2 LEU A 480 -12.967 -8.285 -8.432 1.00 21.23 C ATOM 0 H LEU A 480 -13.480 -10.268 -4.474 1.00 44.53 H new ATOM 0 HA LEU A 480 -13.272 -11.885 -6.853 1.00 75.20 H new ATOM 0 HB2 LEU A 480 -11.611 -9.508 -5.935 1.00 55.15 H new ATOM 0 HB3 LEU A 480 -11.546 -10.230 -7.530 1.00 55.15 H new ATOM 0 HG LEU A 480 -14.203 -9.705 -7.437 1.00 31.24 H new ATOM 0 HD11 LEU A 480 -14.617 -7.492 -6.400 1.00 60.34 H new ATOM 0 HD12 LEU A 480 -14.190 -8.734 -5.199 1.00 60.34 H new ATOM 0 HD13 LEU A 480 -12.981 -7.528 -5.701 1.00 60.34 H new ATOM 0 HD21 LEU A 480 -13.794 -7.638 -8.727 1.00 21.23 H new ATOM 0 HD22 LEU A 480 -12.087 -7.677 -8.225 1.00 21.23 H new ATOM 0 HD23 LEU A 480 -12.745 -8.981 -9.241 1.00 21.23 H new ATOM 1626 N GLU A 481 -11.027 -13.091 -6.762 1.00 12.34 N ATOM 1627 CA GLU A 481 -9.903 -14.055 -6.606 1.00 44.01 C ATOM 1628 C GLU A 481 -8.554 -13.333 -6.348 1.00 22.44 C ATOM 1629 O GLU A 481 -7.716 -13.818 -5.584 1.00 61.51 O ATOM 1630 CB GLU A 481 -9.794 -14.959 -7.861 1.00 30.32 C ATOM 1631 CG GLU A 481 -11.029 -15.848 -8.133 1.00 53.05 C ATOM 1632 CD GLU A 481 -10.855 -16.764 -9.363 1.00 33.43 C ATOM 1633 OE1 GLU A 481 -10.282 -17.869 -9.227 1.00 14.41 O ATOM 1634 OE2 GLU A 481 -11.269 -16.372 -10.479 1.00 52.20 O ATOM 0 H GLU A 481 -11.433 -13.089 -7.698 1.00 12.34 H new ATOM 0 HA GLU A 481 -10.118 -14.673 -5.734 1.00 44.01 H new ATOM 0 HB2 GLU A 481 -9.621 -14.327 -8.732 1.00 30.32 H new ATOM 0 HB3 GLU A 481 -8.919 -15.601 -7.754 1.00 30.32 H new ATOM 0 HG2 GLU A 481 -11.228 -16.462 -7.255 1.00 53.05 H new ATOM 0 HG3 GLU A 481 -11.902 -15.212 -8.281 1.00 53.05 H new ATOM 1641 N SER A 482 -8.369 -12.169 -6.999 1.00 22.24 N ATOM 1642 CA SER A 482 -7.215 -11.266 -6.747 1.00 54.04 C ATOM 1643 C SER A 482 -7.213 -10.754 -5.290 1.00 40.45 C ATOM 1644 O SER A 482 -6.172 -10.711 -4.631 1.00 35.33 O ATOM 1645 CB SER A 482 -7.265 -10.057 -7.711 1.00 12.51 C ATOM 1646 OG SER A 482 -8.505 -9.379 -7.619 1.00 63.13 O ATOM 0 H SER A 482 -9.010 -11.823 -7.713 1.00 22.24 H new ATOM 0 HA SER A 482 -6.303 -11.838 -6.917 1.00 54.04 H new ATOM 0 HB2 SER A 482 -6.453 -9.368 -7.477 1.00 12.51 H new ATOM 0 HB3 SER A 482 -7.109 -10.398 -8.734 1.00 12.51 H new ATOM 0 HG SER A 482 -8.458 -8.541 -8.125 1.00 63.13 H new ATOM 1652 N LEU A 483 -8.406 -10.376 -4.815 1.00 33.20 N ATOM 1653 CA LEU A 483 -8.612 -9.799 -3.474 1.00 15.34 C ATOM 1654 C LEU A 483 -8.435 -10.832 -2.346 1.00 33.00 C ATOM 1655 O LEU A 483 -7.814 -10.537 -1.329 1.00 53.03 O ATOM 1656 CB LEU A 483 -10.017 -9.171 -3.410 1.00 1.12 C ATOM 1657 CG LEU A 483 -10.422 -8.504 -2.063 1.00 63.04 C ATOM 1658 CD1 LEU A 483 -9.432 -7.399 -1.620 1.00 41.00 C ATOM 1659 CD2 LEU A 483 -11.842 -7.959 -2.161 1.00 14.30 C ATOM 0 H LEU A 483 -9.267 -10.462 -5.354 1.00 33.20 H new ATOM 0 HA LEU A 483 -7.848 -9.038 -3.317 1.00 15.34 H new ATOM 0 HB2 LEU A 483 -10.091 -8.421 -4.197 1.00 1.12 H new ATOM 0 HB3 LEU A 483 -10.748 -9.947 -3.639 1.00 1.12 H new ATOM 0 HG LEU A 483 -10.384 -9.274 -1.292 1.00 63.04 H new ATOM 0 HD11 LEU A 483 -9.765 -6.970 -0.675 1.00 41.00 H new ATOM 0 HD12 LEU A 483 -8.439 -7.830 -1.493 1.00 41.00 H new ATOM 0 HD13 LEU A 483 -9.394 -6.618 -2.380 1.00 41.00 H new ATOM 0 HD21 LEU A 483 -12.119 -7.494 -1.215 1.00 14.30 H new ATOM 0 HD22 LEU A 483 -11.893 -7.218 -2.959 1.00 14.30 H new ATOM 0 HD23 LEU A 483 -12.531 -8.775 -2.379 1.00 14.30 H new ATOM 1671 N LYS A 484 -9.000 -12.035 -2.528 1.00 1.21 N ATOM 1672 CA LYS A 484 -8.849 -13.141 -1.561 1.00 1.33 C ATOM 1673 C LYS A 484 -7.393 -13.638 -1.545 1.00 24.40 C ATOM 1674 O LYS A 484 -6.880 -14.031 -0.502 1.00 42.22 O ATOM 1675 CB LYS A 484 -9.835 -14.295 -1.863 1.00 62.54 C ATOM 1676 CG LYS A 484 -11.329 -13.905 -1.774 1.00 73.20 C ATOM 1677 CD LYS A 484 -12.267 -15.132 -1.863 1.00 72.33 C ATOM 1678 CE LYS A 484 -13.756 -14.752 -1.808 1.00 72.40 C ATOM 1679 NZ LYS A 484 -14.105 -13.955 -0.598 1.00 31.12 N ATOM 0 H LYS A 484 -9.570 -12.271 -3.340 1.00 1.21 H new ATOM 0 HA LYS A 484 -9.094 -12.763 -0.568 1.00 1.33 H new ATOM 0 HB2 LYS A 484 -9.632 -14.677 -2.864 1.00 62.54 H new ATOM 0 HB3 LYS A 484 -9.644 -15.111 -1.166 1.00 62.54 H new ATOM 0 HG2 LYS A 484 -11.509 -13.381 -0.835 1.00 73.20 H new ATOM 0 HG3 LYS A 484 -11.568 -13.209 -2.578 1.00 73.20 H new ATOM 0 HD2 LYS A 484 -12.068 -15.668 -2.791 1.00 72.33 H new ATOM 0 HD3 LYS A 484 -12.041 -15.816 -1.045 1.00 72.33 H new ATOM 0 HE2 LYS A 484 -14.014 -14.181 -2.700 1.00 72.40 H new ATOM 0 HE3 LYS A 484 -14.359 -15.660 -1.826 1.00 72.40 H new ATOM 0 HZ1 LYS A 484 -15.114 -14.081 -0.378 1.00 31.12 H new ATOM 0 HZ2 LYS A 484 -13.532 -14.278 0.208 1.00 31.12 H new ATOM 0 HZ3 LYS A 484 -13.913 -12.949 -0.778 1.00 31.12 H new ATOM 1693 N GLY A 485 -6.739 -13.580 -2.723 1.00 62.15 N ATOM 1694 CA GLY A 485 -5.292 -13.791 -2.832 1.00 35.14 C ATOM 1695 C GLY A 485 -4.486 -12.748 -2.044 1.00 61.42 C ATOM 1696 O GLY A 485 -3.521 -13.091 -1.373 1.00 75.01 O ATOM 0 H GLY A 485 -7.198 -13.387 -3.613 1.00 62.15 H new ATOM 0 HA2 GLY A 485 -5.045 -14.788 -2.468 1.00 35.14 H new ATOM 0 HA3 GLY A 485 -5.000 -13.754 -3.882 1.00 35.14 H new ATOM 1700 N LEU A 486 -4.928 -11.472 -2.102 1.00 62.20 N ATOM 1701 CA LEU A 486 -4.294 -10.346 -1.366 1.00 64.23 C ATOM 1702 C LEU A 486 -4.512 -10.470 0.171 1.00 45.34 C ATOM 1703 O LEU A 486 -3.630 -10.107 0.962 1.00 0.34 O ATOM 1704 CB LEU A 486 -4.839 -8.987 -1.893 1.00 74.14 C ATOM 1705 CG LEU A 486 -4.115 -7.698 -1.376 1.00 31.12 C ATOM 1706 CD1 LEU A 486 -2.606 -7.722 -1.723 1.00 3.34 C ATOM 1707 CD2 LEU A 486 -4.798 -6.415 -1.919 1.00 41.03 C ATOM 0 H LEU A 486 -5.734 -11.190 -2.659 1.00 62.20 H new ATOM 0 HA LEU A 486 -3.220 -10.389 -1.546 1.00 64.23 H new ATOM 0 HB2 LEU A 486 -4.784 -8.996 -2.982 1.00 74.14 H new ATOM 0 HB3 LEU A 486 -5.894 -8.916 -1.628 1.00 74.14 H new ATOM 0 HG LEU A 486 -4.202 -7.684 -0.290 1.00 31.12 H new ATOM 0 HD11 LEU A 486 -2.133 -6.814 -1.351 1.00 3.34 H new ATOM 0 HD12 LEU A 486 -2.140 -8.591 -1.259 1.00 3.34 H new ATOM 0 HD13 LEU A 486 -2.482 -7.778 -2.804 1.00 3.34 H new ATOM 0 HD21 LEU A 486 -4.273 -5.537 -1.543 1.00 41.03 H new ATOM 0 HD22 LEU A 486 -4.765 -6.419 -3.009 1.00 41.03 H new ATOM 0 HD23 LEU A 486 -5.836 -6.387 -1.587 1.00 41.03 H new ATOM 1719 N TYR A 487 -5.690 -11.000 0.574 1.00 2.04 N ATOM 1720 CA TYR A 487 -5.986 -11.367 1.987 1.00 31.40 C ATOM 1721 C TYR A 487 -4.974 -12.426 2.518 1.00 72.22 C ATOM 1722 O TYR A 487 -4.634 -12.436 3.706 1.00 11.21 O ATOM 1723 CB TYR A 487 -7.448 -11.905 2.134 1.00 11.13 C ATOM 1724 CG TYR A 487 -8.574 -10.847 2.042 1.00 63.23 C ATOM 1725 CD1 TYR A 487 -8.495 -9.651 2.754 1.00 71.54 C ATOM 1726 CD2 TYR A 487 -9.727 -11.056 1.266 1.00 20.32 C ATOM 1727 CE1 TYR A 487 -9.510 -8.714 2.699 1.00 51.14 C ATOM 1728 CE2 TYR A 487 -10.741 -10.119 1.214 1.00 33.01 C ATOM 1729 CZ TYR A 487 -10.627 -8.948 1.926 1.00 35.14 C ATOM 1730 OH TYR A 487 -11.638 -8.011 1.874 1.00 31.03 O ATOM 0 H TYR A 487 -6.463 -11.187 -0.065 1.00 2.04 H new ATOM 0 HA TYR A 487 -5.886 -10.462 2.586 1.00 31.40 H new ATOM 0 HB2 TYR A 487 -7.617 -12.655 1.361 1.00 11.13 H new ATOM 0 HB3 TYR A 487 -7.532 -12.413 3.095 1.00 11.13 H new ATOM 0 HD1 TYR A 487 -7.624 -9.453 3.360 1.00 71.54 H new ATOM 0 HD2 TYR A 487 -9.823 -11.969 0.698 1.00 20.32 H new ATOM 0 HE1 TYR A 487 -9.428 -7.797 3.263 1.00 51.14 H new ATOM 0 HE2 TYR A 487 -11.621 -10.306 0.616 1.00 33.01 H new ATOM 0 HH TYR A 487 -12.351 -8.331 1.283 1.00 31.03 H new ATOM 1740 N ARG A 488 -4.496 -13.308 1.609 1.00 34.32 N ATOM 1741 CA ARG A 488 -3.464 -14.327 1.930 1.00 3.41 C ATOM 1742 C ARG A 488 -2.071 -13.679 2.059 1.00 50.42 C ATOM 1743 O ARG A 488 -1.366 -13.926 3.030 1.00 44.51 O ATOM 1744 CB ARG A 488 -3.424 -15.439 0.847 1.00 51.13 C ATOM 1745 CG ARG A 488 -4.787 -16.097 0.570 1.00 4.15 C ATOM 1746 CD ARG A 488 -4.747 -17.135 -0.569 1.00 32.43 C ATOM 1747 NE ARG A 488 -6.090 -17.408 -1.118 1.00 23.35 N ATOM 1748 CZ ARG A 488 -6.921 -18.350 -0.720 1.00 72.33 C ATOM 1749 NH1 ARG A 488 -6.637 -19.147 0.269 1.00 3.21 N ATOM 1750 NH2 ARG A 488 -8.058 -18.476 -1.324 1.00 55.32 N ATOM 0 H ARG A 488 -4.811 -13.335 0.639 1.00 34.32 H new ATOM 0 HA ARG A 488 -3.734 -14.776 2.886 1.00 3.41 H new ATOM 0 HB2 ARG A 488 -3.043 -15.013 -0.081 1.00 51.13 H new ATOM 0 HB3 ARG A 488 -2.718 -16.209 1.158 1.00 51.13 H new ATOM 0 HG2 ARG A 488 -5.140 -16.581 1.481 1.00 4.15 H new ATOM 0 HG3 ARG A 488 -5.512 -15.322 0.320 1.00 4.15 H new ATOM 0 HD2 ARG A 488 -4.097 -16.774 -1.366 1.00 32.43 H new ATOM 0 HD3 ARG A 488 -4.312 -18.063 -0.198 1.00 32.43 H new ATOM 0 HE ARG A 488 -6.406 -16.808 -1.880 1.00 23.35 H new ATOM 0 HH11 ARG A 488 -5.749 -19.053 0.761 1.00 3.21 H new ATOM 0 HH12 ARG A 488 -7.303 -19.866 0.552 1.00 3.21 H new ATOM 0 HH21 ARG A 488 -8.298 -17.852 -2.094 1.00 55.32 H new ATOM 0 HH22 ARG A 488 -8.714 -19.199 -1.030 1.00 55.32 H new ATOM 1764 N ILE A 489 -1.710 -12.831 1.076 1.00 42.32 N ATOM 1765 CA ILE A 489 -0.368 -12.193 0.995 1.00 31.00 C ATOM 1766 C ILE A 489 -0.078 -11.305 2.235 1.00 11.14 C ATOM 1767 O ILE A 489 0.917 -11.499 2.936 1.00 3.14 O ATOM 1768 CB ILE A 489 -0.247 -11.315 -0.307 1.00 71.43 C ATOM 1769 CG1 ILE A 489 -0.531 -12.162 -1.593 1.00 11.32 C ATOM 1770 CG2 ILE A 489 1.142 -10.639 -0.397 1.00 22.11 C ATOM 1771 CD1 ILE A 489 -0.778 -11.355 -2.859 1.00 40.02 C ATOM 0 H ILE A 489 -2.334 -12.565 0.314 1.00 42.32 H new ATOM 0 HA ILE A 489 0.366 -12.999 0.965 1.00 31.00 H new ATOM 0 HB ILE A 489 -1.003 -10.533 -0.245 1.00 71.43 H new ATOM 0 HG12 ILE A 489 0.315 -12.827 -1.765 1.00 11.32 H new ATOM 0 HG13 ILE A 489 -1.400 -12.793 -1.408 1.00 11.32 H new ATOM 0 HG21 ILE A 489 1.197 -10.040 -1.306 1.00 22.11 H new ATOM 0 HG22 ILE A 489 1.291 -9.997 0.471 1.00 22.11 H new ATOM 0 HG23 ILE A 489 1.918 -11.404 -0.420 1.00 22.11 H new ATOM 0 HD11 ILE A 489 -0.964 -12.033 -3.692 1.00 40.02 H new ATOM 0 HD12 ILE A 489 -1.644 -10.709 -2.716 1.00 40.02 H new ATOM 0 HD13 ILE A 489 0.098 -10.744 -3.078 1.00 40.02 H new ATOM 1783 N MET A 490 -0.985 -10.352 2.515 1.00 72.45 N ATOM 1784 CA MET A 490 -0.862 -9.451 3.683 1.00 44.32 C ATOM 1785 C MET A 490 -1.167 -10.200 5.009 1.00 41.20 C ATOM 1786 O MET A 490 -0.740 -9.775 6.089 1.00 34.53 O ATOM 1787 CB MET A 490 -1.765 -8.210 3.492 1.00 24.22 C ATOM 1788 CG MET A 490 -1.319 -7.323 2.319 1.00 32.32 C ATOM 1789 SD MET A 490 -2.253 -5.787 2.188 1.00 62.21 S ATOM 1790 CE MET A 490 -1.340 -4.961 0.890 1.00 13.11 C ATOM 0 H MET A 490 -1.816 -10.183 1.948 1.00 72.45 H new ATOM 0 HA MET A 490 0.170 -9.106 3.753 1.00 44.32 H new ATOM 0 HB2 MET A 490 -2.792 -8.536 3.325 1.00 24.22 H new ATOM 0 HB3 MET A 490 -1.763 -7.620 4.409 1.00 24.22 H new ATOM 0 HG2 MET A 490 -0.261 -7.088 2.433 1.00 32.32 H new ATOM 0 HG3 MET A 490 -1.423 -7.883 1.390 1.00 32.32 H new ATOM 0 HE1 MET A 490 -1.097 -3.946 1.205 1.00 13.11 H new ATOM 0 HE2 MET A 490 -0.420 -5.509 0.687 1.00 13.11 H new ATOM 0 HE3 MET A 490 -1.947 -4.924 -0.015 1.00 13.11 H new ATOM 1800 N GLY A 491 -1.890 -11.338 4.894 1.00 3.52 N ATOM 1801 CA GLY A 491 -2.092 -12.275 6.009 1.00 11.54 C ATOM 1802 C GLY A 491 -0.839 -13.111 6.337 1.00 44.21 C ATOM 1803 O GLY A 491 -0.709 -13.627 7.450 1.00 30.34 O ATOM 0 H GLY A 491 -2.345 -11.626 4.028 1.00 3.52 H new ATOM 0 HA2 GLY A 491 -2.389 -11.715 6.896 1.00 11.54 H new ATOM 0 HA3 GLY A 491 -2.915 -12.947 5.765 1.00 11.54 H new ATOM 1807 N ASN A 492 0.073 -13.268 5.352 1.00 64.34 N ATOM 1808 CA ASN A 492 1.396 -13.930 5.552 1.00 71.32 C ATOM 1809 C ASN A 492 2.425 -12.956 6.181 1.00 24.30 C ATOM 1810 O ASN A 492 3.525 -13.372 6.568 1.00 51.03 O ATOM 1811 CB ASN A 492 1.951 -14.480 4.205 1.00 71.31 C ATOM 1812 CG ASN A 492 1.119 -15.615 3.601 1.00 34.52 C ATOM 1813 OD1 ASN A 492 0.493 -16.392 4.313 1.00 32.33 O ATOM 1814 ND2 ASN A 492 1.104 -15.724 2.282 1.00 4.12 N ATOM 0 H ASN A 492 -0.079 -12.943 4.397 1.00 64.34 H new ATOM 0 HA ASN A 492 1.241 -14.762 6.239 1.00 71.32 H new ATOM 0 HB2 ASN A 492 2.006 -13.662 3.486 1.00 71.31 H new ATOM 0 HB3 ASN A 492 2.970 -14.835 4.362 1.00 71.31 H new ATOM 0 HD21 ASN A 492 0.564 -16.466 1.838 1.00 4.12 H new ATOM 0 HD22 ASN A 492 1.633 -15.066 1.710 1.00 4.12 H new ATOM 1821 N GLY A 493 2.054 -11.667 6.285 1.00 10.32 N ATOM 1822 CA GLY A 493 2.939 -10.625 6.830 1.00 55.14 C ATOM 1823 C GLY A 493 3.653 -9.830 5.737 1.00 11.14 C ATOM 1824 O GLY A 493 4.866 -9.617 5.806 1.00 35.33 O ATOM 0 H GLY A 493 1.139 -11.322 5.996 1.00 10.32 H new ATOM 0 HA2 GLY A 493 2.354 -9.943 7.447 1.00 55.14 H new ATOM 0 HA3 GLY A 493 3.681 -11.087 7.481 1.00 55.14 H new ATOM 1828 N PHE A 494 2.902 -9.409 4.705 1.00 22.03 N ATOM 1829 CA PHE A 494 3.418 -8.535 3.619 1.00 51.12 C ATOM 1830 C PHE A 494 2.638 -7.208 3.560 1.00 4.15 C ATOM 1831 O PHE A 494 1.669 -7.001 4.300 1.00 72.14 O ATOM 1832 CB PHE A 494 3.358 -9.260 2.246 1.00 62.00 C ATOM 1833 CG PHE A 494 4.361 -10.406 2.102 1.00 51.35 C ATOM 1834 CD1 PHE A 494 4.069 -11.682 2.586 1.00 34.42 C ATOM 1835 CD2 PHE A 494 5.596 -10.202 1.489 1.00 14.40 C ATOM 1836 CE1 PHE A 494 4.982 -12.711 2.464 1.00 35.34 C ATOM 1837 CE2 PHE A 494 6.509 -11.234 1.367 1.00 43.22 C ATOM 1838 CZ PHE A 494 6.200 -12.487 1.855 1.00 34.15 C ATOM 0 H PHE A 494 1.920 -9.661 4.593 1.00 22.03 H new ATOM 0 HA PHE A 494 4.461 -8.309 3.843 1.00 51.12 H new ATOM 0 HB2 PHE A 494 2.352 -9.651 2.097 1.00 62.00 H new ATOM 0 HB3 PHE A 494 3.538 -8.532 1.455 1.00 62.00 H new ATOM 0 HD1 PHE A 494 3.117 -11.867 3.062 1.00 34.42 H new ATOM 0 HD2 PHE A 494 5.844 -9.224 1.104 1.00 14.40 H new ATOM 0 HE1 PHE A 494 4.742 -13.692 2.846 1.00 35.34 H new ATOM 0 HE2 PHE A 494 7.462 -11.059 0.890 1.00 43.22 H new ATOM 0 HZ PHE A 494 6.912 -13.293 1.760 1.00 34.15 H new ATOM 1848 N ALA A 495 3.070 -6.326 2.651 1.00 3.41 N ATOM 1849 CA ALA A 495 2.552 -4.954 2.534 1.00 72.53 C ATOM 1850 C ALA A 495 2.576 -4.479 1.066 1.00 21.43 C ATOM 1851 O ALA A 495 3.251 -5.077 0.226 1.00 22.23 O ATOM 1852 CB ALA A 495 3.396 -4.042 3.419 1.00 30.05 C ATOM 0 H ALA A 495 3.796 -6.545 1.969 1.00 3.41 H new ATOM 0 HA ALA A 495 1.513 -4.924 2.863 1.00 72.53 H new ATOM 0 HB1 ALA A 495 3.026 -3.019 3.345 1.00 30.05 H new ATOM 0 HB2 ALA A 495 3.331 -4.377 4.454 1.00 30.05 H new ATOM 0 HB3 ALA A 495 4.435 -4.077 3.091 1.00 30.05 H new ATOM 1858 N GLY A 496 1.856 -3.383 0.778 1.00 55.42 N ATOM 1859 CA GLY A 496 1.709 -2.861 -0.593 1.00 2.55 C ATOM 1860 C GLY A 496 2.252 -1.438 -0.738 1.00 55.54 C ATOM 1861 O GLY A 496 1.627 -0.491 -0.275 1.00 73.25 O ATOM 0 H GLY A 496 1.362 -2.836 1.483 1.00 55.42 H new ATOM 0 HA2 GLY A 496 2.232 -3.519 -1.287 1.00 2.55 H new ATOM 0 HA3 GLY A 496 0.656 -2.875 -0.873 1.00 2.55 H new ATOM 1865 N CYS A 497 3.406 -1.278 -1.407 1.00 5.10 N ATOM 1866 CA CYS A 497 4.113 0.031 -1.484 1.00 53.25 C ATOM 1867 C CYS A 497 3.807 0.737 -2.815 1.00 72.43 C ATOM 1868 O CYS A 497 4.401 0.408 -3.846 1.00 20.53 O ATOM 1869 CB CYS A 497 5.639 -0.150 -1.321 1.00 30.20 C ATOM 1870 SG CYS A 497 6.541 1.413 -1.220 1.00 60.33 S ATOM 0 H CYS A 497 3.877 -2.033 -1.905 1.00 5.10 H new ATOM 0 HA CYS A 497 3.750 0.652 -0.665 1.00 53.25 H new ATOM 0 HB2 CYS A 497 5.834 -0.732 -0.420 1.00 30.20 H new ATOM 0 HB3 CYS A 497 6.021 -0.727 -2.163 1.00 30.20 H new ATOM 0 HG CYS A 497 6.899 1.785 -2.413 1.00 60.33 H new ATOM 1876 N VAL A 498 2.852 1.683 -2.789 1.00 34.31 N ATOM 1877 CA VAL A 498 2.364 2.371 -4.002 1.00 13.33 C ATOM 1878 C VAL A 498 3.332 3.492 -4.441 1.00 54.31 C ATOM 1879 O VAL A 498 3.451 4.519 -3.768 1.00 23.13 O ATOM 1880 CB VAL A 498 0.918 2.951 -3.775 1.00 5.40 C ATOM 1881 CG1 VAL A 498 0.397 3.717 -5.019 1.00 3.50 C ATOM 1882 CG2 VAL A 498 -0.068 1.825 -3.362 1.00 33.53 C ATOM 0 H VAL A 498 2.397 1.993 -1.931 1.00 34.31 H new ATOM 0 HA VAL A 498 2.319 1.632 -4.802 1.00 13.33 H new ATOM 0 HB VAL A 498 0.981 3.671 -2.959 1.00 5.40 H new ATOM 0 HG11 VAL A 498 -0.604 4.100 -4.818 1.00 3.50 H new ATOM 0 HG12 VAL A 498 1.066 4.549 -5.241 1.00 3.50 H new ATOM 0 HG13 VAL A 498 0.362 3.042 -5.874 1.00 3.50 H new ATOM 0 HG21 VAL A 498 -1.061 2.248 -3.210 1.00 33.53 H new ATOM 0 HG22 VAL A 498 -0.111 1.072 -4.149 1.00 33.53 H new ATOM 0 HG23 VAL A 498 0.275 1.363 -2.436 1.00 33.53 H new ATOM 1892 N HIS A 499 4.030 3.265 -5.568 1.00 54.55 N ATOM 1893 CA HIS A 499 4.966 4.241 -6.165 1.00 33.24 C ATOM 1894 C HIS A 499 4.310 4.960 -7.374 1.00 23.55 C ATOM 1895 O HIS A 499 3.867 4.315 -8.333 1.00 63.43 O ATOM 1896 CB HIS A 499 6.281 3.538 -6.603 1.00 54.10 C ATOM 1897 CG HIS A 499 7.088 2.970 -5.460 1.00 54.40 C ATOM 1898 ND1 HIS A 499 8.008 3.737 -4.780 1.00 3.11 N ATOM 1899 CD2 HIS A 499 7.078 1.724 -4.920 1.00 43.32 C ATOM 1900 CE1 HIS A 499 8.526 2.951 -3.857 1.00 64.34 C ATOM 1901 NE2 HIS A 499 7.997 1.721 -3.901 1.00 53.33 N ATOM 0 H HIS A 499 3.962 2.395 -6.095 1.00 54.55 H new ATOM 0 HA HIS A 499 5.207 4.988 -5.409 1.00 33.24 H new ATOM 0 HB2 HIS A 499 6.036 2.733 -7.296 1.00 54.10 H new ATOM 0 HB3 HIS A 499 6.897 4.252 -7.149 1.00 54.10 H new ATOM 0 HD2 HIS A 499 6.463 0.893 -5.233 1.00 43.32 H new ATOM 0 HE1 HIS A 499 9.284 3.261 -3.152 1.00 64.34 H new ATOM 0 HE2 HIS A 499 8.232 0.935 -3.295 1.00 53.33 H new ATOM 1909 N PHE A 500 4.248 6.296 -7.299 1.00 45.45 N ATOM 1910 CA PHE A 500 3.725 7.167 -8.374 1.00 45.44 C ATOM 1911 C PHE A 500 4.853 7.497 -9.397 1.00 34.44 C ATOM 1912 O PHE A 500 5.973 7.831 -8.979 1.00 34.31 O ATOM 1913 CB PHE A 500 3.159 8.485 -7.764 1.00 45.41 C ATOM 1914 CG PHE A 500 1.900 8.321 -6.898 1.00 1.02 C ATOM 1915 CD1 PHE A 500 1.931 7.610 -5.692 1.00 54.43 C ATOM 1916 CD2 PHE A 500 0.690 8.899 -7.281 1.00 11.32 C ATOM 1917 CE1 PHE A 500 0.799 7.483 -4.907 1.00 62.30 C ATOM 1918 CE2 PHE A 500 -0.437 8.766 -6.496 1.00 14.44 C ATOM 1919 CZ PHE A 500 -0.384 8.060 -5.310 1.00 11.03 C ATOM 0 H PHE A 500 4.563 6.815 -6.480 1.00 45.45 H new ATOM 0 HA PHE A 500 2.923 6.641 -8.892 1.00 45.44 H new ATOM 0 HB2 PHE A 500 3.938 8.950 -7.159 1.00 45.41 H new ATOM 0 HB3 PHE A 500 2.933 9.175 -8.577 1.00 45.41 H new ATOM 0 HD1 PHE A 500 2.855 7.153 -5.369 1.00 54.43 H new ATOM 0 HD2 PHE A 500 0.634 9.458 -8.204 1.00 11.32 H new ATOM 0 HE1 PHE A 500 0.843 6.932 -3.979 1.00 62.30 H new ATOM 0 HE2 PHE A 500 -1.366 9.217 -6.811 1.00 14.44 H new ATOM 0 HZ PHE A 500 -1.269 7.961 -4.700 1.00 11.03 H new ATOM 1929 N PRO A 501 4.586 7.391 -10.750 1.00 31.01 N ATOM 1930 CA PRO A 501 5.561 7.808 -11.804 1.00 52.13 C ATOM 1931 C PRO A 501 5.890 9.324 -11.747 1.00 44.54 C ATOM 1932 O PRO A 501 7.015 9.746 -12.026 1.00 61.22 O ATOM 1933 CB PRO A 501 4.845 7.437 -13.138 1.00 71.43 C ATOM 1934 CG PRO A 501 3.796 6.437 -12.745 1.00 31.34 C ATOM 1935 CD PRO A 501 3.346 6.838 -11.358 1.00 24.55 C ATOM 0 HA PRO A 501 6.525 7.315 -11.682 1.00 52.13 H new ATOM 0 HB2 PRO A 501 4.399 8.315 -13.605 1.00 71.43 H new ATOM 0 HB3 PRO A 501 5.545 7.014 -13.858 1.00 71.43 H new ATOM 0 HG2 PRO A 501 2.961 6.449 -13.446 1.00 31.34 H new ATOM 0 HG3 PRO A 501 4.200 5.425 -12.748 1.00 31.34 H new ATOM 0 HD2 PRO A 501 2.548 7.579 -11.391 1.00 24.55 H new ATOM 0 HD3 PRO A 501 2.966 5.986 -10.795 1.00 24.55 H new ATOM 2024 N VAL A 508 2.813 14.277 -2.588 1.00 62.34 N ATOM 2025 CA VAL A 508 2.448 12.886 -2.937 1.00 44.24 C ATOM 2026 C VAL A 508 3.428 12.339 -4.000 1.00 51.31 C ATOM 2027 O VAL A 508 3.705 13.000 -5.006 1.00 73.25 O ATOM 2028 CB VAL A 508 0.967 12.766 -3.480 1.00 31.32 C ATOM 2029 CG1 VAL A 508 0.644 11.311 -3.911 1.00 12.40 C ATOM 2030 CG2 VAL A 508 -0.073 13.261 -2.441 1.00 52.12 C ATOM 0 HA VAL A 508 2.512 12.298 -2.021 1.00 44.24 H new ATOM 0 HB VAL A 508 0.899 13.412 -4.355 1.00 31.32 H new ATOM 0 HG11 VAL A 508 -0.380 11.260 -4.280 1.00 12.40 H new ATOM 0 HG12 VAL A 508 1.330 11.005 -4.701 1.00 12.40 H new ATOM 0 HG13 VAL A 508 0.756 10.645 -3.055 1.00 12.40 H new ATOM 0 HG21 VAL A 508 -1.076 13.161 -2.855 1.00 52.12 H new ATOM 0 HG22 VAL A 508 0.007 12.663 -1.533 1.00 52.12 H new ATOM 0 HG23 VAL A 508 0.119 14.307 -2.204 1.00 52.12 H new ATOM 2040 N ARG A 509 3.923 11.119 -3.749 1.00 62.04 N ATOM 2041 CA ARG A 509 4.846 10.378 -4.647 1.00 71.11 C ATOM 2042 C ARG A 509 4.874 8.873 -4.247 1.00 35.41 C ATOM 2043 O ARG A 509 5.198 8.004 -5.063 1.00 5.32 O ATOM 2044 CB ARG A 509 6.274 11.035 -4.598 1.00 51.24 C ATOM 2045 CG ARG A 509 7.345 10.423 -5.558 1.00 64.30 C ATOM 2046 CD ARG A 509 8.152 9.267 -4.931 1.00 72.34 C ATOM 2047 NE ARG A 509 8.905 8.493 -5.932 1.00 23.41 N ATOM 2048 CZ ARG A 509 8.796 7.197 -6.138 1.00 44.41 C ATOM 2049 NH1 ARG A 509 7.929 6.484 -5.477 1.00 61.44 N ATOM 2050 NH2 ARG A 509 9.549 6.624 -7.016 1.00 71.03 N ATOM 0 H ARG A 509 3.694 10.601 -2.901 1.00 62.04 H new ATOM 0 HA ARG A 509 4.494 10.435 -5.677 1.00 71.11 H new ATOM 0 HB2 ARG A 509 6.172 12.095 -4.829 1.00 51.24 H new ATOM 0 HB3 ARG A 509 6.649 10.966 -3.577 1.00 51.24 H new ATOM 0 HG2 ARG A 509 6.848 10.061 -6.458 1.00 64.30 H new ATOM 0 HG3 ARG A 509 8.034 11.209 -5.868 1.00 64.30 H new ATOM 0 HD2 ARG A 509 8.845 9.671 -4.193 1.00 72.34 H new ATOM 0 HD3 ARG A 509 7.472 8.601 -4.399 1.00 72.34 H new ATOM 0 HE ARG A 509 9.567 9.004 -6.515 1.00 23.41 H new ATOM 0 HH11 ARG A 509 7.322 6.929 -4.788 1.00 61.44 H new ATOM 0 HH12 ARG A 509 7.857 5.481 -5.648 1.00 61.44 H new ATOM 0 HH21 ARG A 509 10.224 7.175 -7.546 1.00 71.03 H new ATOM 0 HH22 ARG A 509 9.469 5.620 -7.180 1.00 71.03 H new ATOM 2064 N VAL A 510 4.538 8.588 -2.979 1.00 63.23 N ATOM 2065 CA VAL A 510 4.516 7.222 -2.418 1.00 31.41 C ATOM 2066 C VAL A 510 3.551 7.146 -1.201 1.00 3.31 C ATOM 2067 O VAL A 510 3.343 8.145 -0.492 1.00 71.52 O ATOM 2068 CB VAL A 510 5.968 6.768 -2.004 1.00 13.15 C ATOM 2069 CG1 VAL A 510 6.528 7.629 -0.838 1.00 15.04 C ATOM 2070 CG2 VAL A 510 6.035 5.247 -1.689 1.00 32.33 C ATOM 0 H VAL A 510 4.271 9.305 -2.305 1.00 63.23 H new ATOM 0 HA VAL A 510 4.151 6.542 -3.188 1.00 31.41 H new ATOM 0 HB VAL A 510 6.614 6.938 -2.866 1.00 13.15 H new ATOM 0 HG11 VAL A 510 7.530 7.286 -0.581 1.00 15.04 H new ATOM 0 HG12 VAL A 510 6.570 8.674 -1.145 1.00 15.04 H new ATOM 0 HG13 VAL A 510 5.877 7.532 0.031 1.00 15.04 H new ATOM 0 HG21 VAL A 510 7.053 4.978 -1.408 1.00 32.33 H new ATOM 0 HG22 VAL A 510 5.359 5.016 -0.866 1.00 32.33 H new ATOM 0 HG23 VAL A 510 5.740 4.679 -2.571 1.00 32.33 H new ATOM 2080 N LEU A 511 2.943 5.968 -0.993 1.00 12.02 N ATOM 2081 CA LEU A 511 2.129 5.660 0.204 1.00 11.21 C ATOM 2082 C LEU A 511 2.174 4.150 0.506 1.00 15.00 C ATOM 2083 O LEU A 511 2.642 3.355 -0.325 1.00 43.21 O ATOM 2084 CB LEU A 511 0.669 6.192 0.032 1.00 32.02 C ATOM 2085 CG LEU A 511 -0.217 5.569 -1.115 1.00 22.42 C ATOM 2086 CD1 LEU A 511 -0.943 4.277 -0.664 1.00 3.31 C ATOM 2087 CD2 LEU A 511 -1.230 6.596 -1.671 1.00 62.22 C ATOM 0 H LEU A 511 3.000 5.193 -1.653 1.00 12.02 H new ATOM 0 HA LEU A 511 2.552 6.175 1.066 1.00 11.21 H new ATOM 0 HB2 LEU A 511 0.146 6.042 0.976 1.00 32.02 H new ATOM 0 HB3 LEU A 511 0.723 7.268 -0.135 1.00 32.02 H new ATOM 0 HG LEU A 511 0.468 5.295 -1.917 1.00 22.42 H new ATOM 0 HD11 LEU A 511 -1.539 3.888 -1.489 1.00 3.31 H new ATOM 0 HD12 LEU A 511 -0.206 3.531 -0.365 1.00 3.31 H new ATOM 0 HD13 LEU A 511 -1.595 4.502 0.180 1.00 3.31 H new ATOM 0 HD21 LEU A 511 -1.823 6.132 -2.459 1.00 62.22 H new ATOM 0 HD22 LEU A 511 -1.889 6.928 -0.869 1.00 62.22 H new ATOM 0 HD23 LEU A 511 -0.693 7.453 -2.078 1.00 62.22 H new ATOM 2099 N MET A 512 1.694 3.749 1.695 1.00 2.52 N ATOM 2100 CA MET A 512 1.690 2.329 2.113 1.00 11.41 C ATOM 2101 C MET A 512 0.259 1.801 2.330 1.00 32.21 C ATOM 2102 O MET A 512 -0.434 2.229 3.252 1.00 45.14 O ATOM 2103 CB MET A 512 2.549 2.138 3.408 1.00 22.35 C ATOM 2104 CG MET A 512 3.750 1.222 3.201 1.00 21.23 C ATOM 2105 SD MET A 512 3.279 -0.383 2.537 1.00 14.02 S ATOM 2106 CE MET A 512 4.887 -1.068 2.187 1.00 0.22 C ATOM 0 H MET A 512 1.302 4.387 2.388 1.00 2.52 H new ATOM 0 HA MET A 512 2.134 1.747 1.306 1.00 11.41 H new ATOM 0 HB2 MET A 512 2.898 3.112 3.752 1.00 22.35 H new ATOM 0 HB3 MET A 512 1.919 1.728 4.197 1.00 22.35 H new ATOM 0 HG2 MET A 512 4.456 1.700 2.522 1.00 21.23 H new ATOM 0 HG3 MET A 512 4.266 1.082 4.151 1.00 21.23 H new ATOM 0 HE1 MET A 512 4.774 -1.985 1.608 1.00 0.22 H new ATOM 0 HE2 MET A 512 5.473 -0.348 1.616 1.00 0.22 H new ATOM 0 HE3 MET A 512 5.399 -1.291 3.123 1.00 0.22 H new ATOM 2116 N LEU A 513 -0.157 0.848 1.489 1.00 63.54 N ATOM 2117 CA LEU A 513 -1.389 0.081 1.712 1.00 12.51 C ATOM 2118 C LEU A 513 -1.104 -1.044 2.730 1.00 34.25 C ATOM 2119 O LEU A 513 -0.307 -1.956 2.461 1.00 50.14 O ATOM 2120 CB LEU A 513 -1.930 -0.535 0.393 1.00 15.12 C ATOM 2121 CG LEU A 513 -3.276 -1.327 0.538 1.00 41.30 C ATOM 2122 CD1 LEU A 513 -4.445 -0.384 0.869 1.00 71.33 C ATOM 2123 CD2 LEU A 513 -3.584 -2.177 -0.707 1.00 73.33 C ATOM 0 H LEU A 513 0.346 0.587 0.641 1.00 63.54 H new ATOM 0 HA LEU A 513 -2.150 0.760 2.097 1.00 12.51 H new ATOM 0 HB2 LEU A 513 -2.073 0.265 -0.333 1.00 15.12 H new ATOM 0 HB3 LEU A 513 -1.173 -1.205 -0.015 1.00 15.12 H new ATOM 0 HG LEU A 513 -3.152 -2.016 1.374 1.00 41.30 H new ATOM 0 HD11 LEU A 513 -5.364 -0.963 0.963 1.00 71.33 H new ATOM 0 HD12 LEU A 513 -4.242 0.131 1.808 1.00 71.33 H new ATOM 0 HD13 LEU A 513 -4.558 0.349 0.070 1.00 71.33 H new ATOM 0 HD21 LEU A 513 -4.525 -2.708 -0.562 1.00 73.33 H new ATOM 0 HD22 LEU A 513 -3.664 -1.529 -1.580 1.00 73.33 H new ATOM 0 HD23 LEU A 513 -2.781 -2.898 -0.863 1.00 73.33 H new ATOM 2135 N LEU A 514 -1.752 -0.962 3.896 1.00 62.13 N ATOM 2136 CA LEU A 514 -1.596 -1.931 4.988 1.00 31.11 C ATOM 2137 C LEU A 514 -2.961 -2.501 5.384 1.00 11.10 C ATOM 2138 O LEU A 514 -3.774 -1.818 6.011 1.00 32.42 O ATOM 2139 CB LEU A 514 -0.906 -1.252 6.204 1.00 15.24 C ATOM 2140 CG LEU A 514 0.600 -0.901 5.993 1.00 43.42 C ATOM 2141 CD1 LEU A 514 1.181 -0.143 7.194 1.00 72.31 C ATOM 2142 CD2 LEU A 514 1.424 -2.169 5.691 1.00 52.24 C ATOM 0 H LEU A 514 -2.408 -0.212 4.112 1.00 62.13 H new ATOM 0 HA LEU A 514 -0.967 -2.754 4.650 1.00 31.11 H new ATOM 0 HB2 LEU A 514 -1.447 -0.337 6.446 1.00 15.24 H new ATOM 0 HB3 LEU A 514 -0.993 -1.911 7.067 1.00 15.24 H new ATOM 0 HG LEU A 514 0.662 -0.239 5.129 1.00 43.42 H new ATOM 0 HD11 LEU A 514 2.231 0.083 7.008 1.00 72.31 H new ATOM 0 HD12 LEU A 514 0.630 0.786 7.339 1.00 72.31 H new ATOM 0 HD13 LEU A 514 1.095 -0.759 8.089 1.00 72.31 H new ATOM 0 HD21 LEU A 514 2.470 -1.898 5.548 1.00 52.24 H new ATOM 0 HD22 LEU A 514 1.340 -2.865 6.526 1.00 52.24 H new ATOM 0 HD23 LEU A 514 1.045 -2.642 4.785 1.00 52.24 H new ATOM 2154 N TYR A 515 -3.207 -3.753 4.999 1.00 31.45 N ATOM 2155 CA TYR A 515 -4.409 -4.487 5.405 1.00 2.12 C ATOM 2156 C TYR A 515 -4.333 -4.876 6.905 1.00 21.20 C ATOM 2157 O TYR A 515 -3.404 -5.575 7.328 1.00 63.31 O ATOM 2158 CB TYR A 515 -4.593 -5.743 4.511 1.00 13.34 C ATOM 2159 CG TYR A 515 -5.657 -6.720 5.014 1.00 73.33 C ATOM 2160 CD1 TYR A 515 -6.983 -6.314 5.176 1.00 31.23 C ATOM 2161 CD2 TYR A 515 -5.326 -8.036 5.360 1.00 62.54 C ATOM 2162 CE1 TYR A 515 -7.934 -7.188 5.670 1.00 1.32 C ATOM 2163 CE2 TYR A 515 -6.273 -8.906 5.842 1.00 11.55 C ATOM 2164 CZ TYR A 515 -7.571 -8.480 6.002 1.00 52.41 C ATOM 2165 OH TYR A 515 -8.502 -9.353 6.506 1.00 13.35 O ATOM 0 H TYR A 515 -2.581 -4.288 4.398 1.00 31.45 H new ATOM 0 HA TYR A 515 -5.277 -3.841 5.273 1.00 2.12 H new ATOM 0 HB2 TYR A 515 -4.857 -5.422 3.503 1.00 13.34 H new ATOM 0 HB3 TYR A 515 -3.640 -6.267 4.439 1.00 13.34 H new ATOM 0 HD1 TYR A 515 -7.269 -5.306 4.913 1.00 31.23 H new ATOM 0 HD2 TYR A 515 -4.306 -8.373 5.246 1.00 62.54 H new ATOM 0 HE1 TYR A 515 -8.956 -6.863 5.796 1.00 1.32 H new ATOM 0 HE2 TYR A 515 -6.000 -9.920 6.094 1.00 11.55 H new ATOM 0 HH TYR A 515 -8.077 -10.218 6.684 1.00 13.35 H new ATOM 2175 N SER A 516 -5.318 -4.408 7.688 1.00 42.41 N ATOM 2176 CA SER A 516 -5.499 -4.822 9.090 1.00 20.10 C ATOM 2177 C SER A 516 -6.297 -6.135 9.148 1.00 33.35 C ATOM 2178 O SER A 516 -7.476 -6.160 8.786 1.00 51.31 O ATOM 2179 CB SER A 516 -6.236 -3.725 9.889 1.00 50.01 C ATOM 2180 OG SER A 516 -6.456 -4.122 11.240 1.00 31.34 O ATOM 0 H SER A 516 -6.012 -3.732 7.368 1.00 42.41 H new ATOM 0 HA SER A 516 -4.517 -4.977 9.536 1.00 20.10 H new ATOM 0 HB2 SER A 516 -5.652 -2.805 9.870 1.00 50.01 H new ATOM 0 HB3 SER A 516 -7.192 -3.506 9.413 1.00 50.01 H new ATOM 0 HG SER A 516 -6.620 -3.329 11.792 1.00 31.34 H new ATOM 2186 N SER A 517 -5.639 -7.221 9.589 1.00 50.13 N ATOM 2187 CA SER A 517 -6.290 -8.542 9.776 1.00 43.34 C ATOM 2188 C SER A 517 -7.364 -8.498 10.895 1.00 30.21 C ATOM 2189 O SER A 517 -8.322 -9.275 10.877 1.00 23.00 O ATOM 2190 CB SER A 517 -5.220 -9.612 10.108 1.00 5.53 C ATOM 2191 OG SER A 517 -4.492 -9.275 11.286 1.00 31.51 O ATOM 0 H SER A 517 -4.647 -7.215 9.826 1.00 50.13 H new ATOM 0 HA SER A 517 -6.793 -8.804 8.845 1.00 43.34 H new ATOM 0 HB2 SER A 517 -5.702 -10.581 10.241 1.00 5.53 H new ATOM 0 HB3 SER A 517 -4.531 -9.712 9.269 1.00 5.53 H new ATOM 0 HG SER A 517 -3.826 -9.970 11.469 1.00 31.51 H new ATOM 2197 N LYS A 518 -7.176 -7.574 11.857 1.00 55.15 N ATOM 2198 CA LYS A 518 -8.077 -7.395 13.016 1.00 33.01 C ATOM 2199 C LYS A 518 -9.352 -6.598 12.625 1.00 54.14 C ATOM 2200 O LYS A 518 -10.476 -7.042 12.888 1.00 3.35 O ATOM 2201 CB LYS A 518 -7.306 -6.676 14.158 1.00 51.21 C ATOM 2202 CG LYS A 518 -8.070 -6.585 15.497 1.00 41.24 C ATOM 2203 CD LYS A 518 -7.237 -5.939 16.629 1.00 20.04 C ATOM 2204 CE LYS A 518 -7.953 -5.987 17.992 1.00 3.53 C ATOM 2205 NZ LYS A 518 -8.252 -7.380 18.426 1.00 15.44 N ATOM 0 H LYS A 518 -6.389 -6.925 11.853 1.00 55.15 H new ATOM 0 HA LYS A 518 -8.404 -8.376 13.361 1.00 33.01 H new ATOM 0 HB2 LYS A 518 -6.365 -7.199 14.328 1.00 51.21 H new ATOM 0 HB3 LYS A 518 -7.055 -5.667 13.829 1.00 51.21 H new ATOM 0 HG2 LYS A 518 -8.982 -6.006 15.349 1.00 41.24 H new ATOM 0 HG3 LYS A 518 -8.374 -7.586 15.804 1.00 41.24 H new ATOM 0 HD2 LYS A 518 -6.278 -6.452 16.708 1.00 20.04 H new ATOM 0 HD3 LYS A 518 -7.023 -4.902 16.371 1.00 20.04 H new ATOM 0 HE2 LYS A 518 -7.331 -5.500 18.744 1.00 3.53 H new ATOM 0 HE3 LYS A 518 -8.882 -5.420 17.932 1.00 3.53 H new ATOM 0 HZ1 LYS A 518 -8.511 -7.382 19.433 1.00 15.44 H new ATOM 0 HZ2 LYS A 518 -9.042 -7.757 17.864 1.00 15.44 H new ATOM 0 HZ3 LYS A 518 -7.412 -7.976 18.284 1.00 15.44 H new ATOM 2219 N LYS A 519 -9.162 -5.420 11.994 1.00 2.10 N ATOM 2220 CA LYS A 519 -10.278 -4.535 11.559 1.00 14.41 C ATOM 2221 C LYS A 519 -10.952 -5.028 10.251 1.00 33.24 C ATOM 2222 O LYS A 519 -12.066 -4.592 9.932 1.00 4.22 O ATOM 2223 CB LYS A 519 -9.770 -3.079 11.363 1.00 13.13 C ATOM 2224 CG LYS A 519 -9.264 -2.371 12.641 1.00 63.42 C ATOM 2225 CD LYS A 519 -10.353 -2.254 13.730 1.00 33.32 C ATOM 2226 CE LYS A 519 -9.939 -1.334 14.892 1.00 10.21 C ATOM 2227 NZ LYS A 519 -8.701 -1.797 15.581 1.00 72.51 N ATOM 0 H LYS A 519 -8.238 -5.052 11.770 1.00 2.10 H new ATOM 0 HA LYS A 519 -11.028 -4.564 12.350 1.00 14.41 H new ATOM 0 HB2 LYS A 519 -8.962 -3.090 10.631 1.00 13.13 H new ATOM 0 HB3 LYS A 519 -10.578 -2.485 10.936 1.00 13.13 H new ATOM 0 HG2 LYS A 519 -8.412 -2.920 13.042 1.00 63.42 H new ATOM 0 HG3 LYS A 519 -8.907 -1.374 12.382 1.00 63.42 H new ATOM 0 HD2 LYS A 519 -11.270 -1.873 13.281 1.00 33.32 H new ATOM 0 HD3 LYS A 519 -10.577 -3.246 14.121 1.00 33.32 H new ATOM 0 HE2 LYS A 519 -9.782 -0.324 14.512 1.00 10.21 H new ATOM 0 HE3 LYS A 519 -10.753 -1.280 15.615 1.00 10.21 H new ATOM 0 HZ1 LYS A 519 -8.478 -1.151 16.365 1.00 72.51 H new ATOM 0 HZ2 LYS A 519 -8.850 -2.756 15.954 1.00 72.51 H new ATOM 0 HZ3 LYS A 519 -7.911 -1.807 14.905 1.00 72.51 H new ATOM 2241 N LYS A 520 -10.241 -5.898 9.491 1.00 11.10 N ATOM 2242 CA LYS A 520 -10.702 -6.443 8.181 1.00 43.14 C ATOM 2243 C LYS A 520 -10.783 -5.344 7.070 1.00 34.14 C ATOM 2244 O LYS A 520 -11.378 -5.568 6.007 1.00 21.21 O ATOM 2245 CB LYS A 520 -12.058 -7.241 8.339 1.00 15.35 C ATOM 2246 CG LYS A 520 -11.947 -8.772 8.141 1.00 34.10 C ATOM 2247 CD LYS A 520 -11.649 -9.159 6.671 1.00 2.32 C ATOM 2248 CE LYS A 520 -11.458 -10.675 6.483 1.00 4.54 C ATOM 2249 NZ LYS A 520 -12.658 -11.450 6.890 1.00 51.21 N ATOM 0 H LYS A 520 -9.323 -6.246 9.769 1.00 11.10 H new ATOM 0 HA LYS A 520 -9.946 -7.152 7.843 1.00 43.14 H new ATOM 0 HB2 LYS A 520 -12.462 -7.047 9.333 1.00 15.35 H new ATOM 0 HB3 LYS A 520 -12.778 -6.849 7.621 1.00 15.35 H new ATOM 0 HG2 LYS A 520 -11.158 -9.162 8.783 1.00 34.10 H new ATOM 0 HG3 LYS A 520 -12.877 -9.244 8.456 1.00 34.10 H new ATOM 0 HD2 LYS A 520 -12.468 -8.819 6.037 1.00 2.32 H new ATOM 0 HD3 LYS A 520 -10.750 -8.640 6.338 1.00 2.32 H new ATOM 0 HE2 LYS A 520 -11.231 -10.883 5.437 1.00 4.54 H new ATOM 0 HE3 LYS A 520 -10.599 -11.006 7.067 1.00 4.54 H new ATOM 0 HZ1 LYS A 520 -12.514 -12.456 6.667 1.00 51.21 H new ATOM 0 HZ2 LYS A 520 -12.811 -11.341 7.913 1.00 51.21 H new ATOM 0 HZ3 LYS A 520 -13.490 -11.097 6.376 1.00 51.21 H new ATOM 2263 N ILE A 521 -10.129 -4.182 7.312 1.00 52.23 N ATOM 2264 CA ILE A 521 -10.124 -3.028 6.371 1.00 45.32 C ATOM 2265 C ILE A 521 -8.715 -2.792 5.771 1.00 44.34 C ATOM 2266 O ILE A 521 -7.705 -3.249 6.320 1.00 23.20 O ATOM 2267 CB ILE A 521 -10.627 -1.693 7.059 1.00 41.20 C ATOM 2268 CG1 ILE A 521 -9.605 -1.167 8.128 1.00 71.50 C ATOM 2269 CG2 ILE A 521 -12.030 -1.886 7.683 1.00 42.52 C ATOM 2270 CD1 ILE A 521 -9.955 0.178 8.757 1.00 32.24 C ATOM 0 H ILE A 521 -9.590 -4.015 8.162 1.00 52.23 H new ATOM 0 HA ILE A 521 -10.817 -3.287 5.571 1.00 45.32 H new ATOM 0 HB ILE A 521 -10.701 -0.935 6.280 1.00 41.20 H new ATOM 0 HG12 ILE A 521 -9.520 -1.909 8.921 1.00 71.50 H new ATOM 0 HG13 ILE A 521 -8.624 -1.086 7.660 1.00 71.50 H new ATOM 0 HG21 ILE A 521 -12.352 -0.955 8.149 1.00 42.52 H new ATOM 0 HG22 ILE A 521 -12.739 -2.166 6.904 1.00 42.52 H new ATOM 0 HG23 ILE A 521 -11.988 -2.673 8.436 1.00 42.52 H new ATOM 0 HD11 ILE A 521 -9.187 0.452 9.481 1.00 32.24 H new ATOM 0 HD12 ILE A 521 -10.009 0.940 7.980 1.00 32.24 H new ATOM 0 HD13 ILE A 521 -10.919 0.104 9.261 1.00 32.24 H new ATOM 2282 N PHE A 522 -8.668 -2.054 4.650 1.00 20.24 N ATOM 2283 CA PHE A 522 -7.408 -1.664 3.979 1.00 42.32 C ATOM 2284 C PHE A 522 -7.040 -0.201 4.321 1.00 73.43 C ATOM 2285 O PHE A 522 -7.742 0.738 3.935 1.00 61.12 O ATOM 2286 CB PHE A 522 -7.543 -1.857 2.450 1.00 4.13 C ATOM 2287 CG PHE A 522 -7.588 -3.323 2.027 1.00 51.02 C ATOM 2288 CD1 PHE A 522 -8.783 -4.044 2.042 1.00 20.53 C ATOM 2289 CD2 PHE A 522 -6.428 -3.980 1.612 1.00 53.33 C ATOM 2290 CE1 PHE A 522 -8.813 -5.370 1.660 1.00 21.15 C ATOM 2291 CE2 PHE A 522 -6.461 -5.306 1.232 1.00 12.41 C ATOM 2292 CZ PHE A 522 -7.651 -5.999 1.254 1.00 12.34 C ATOM 0 H PHE A 522 -9.504 -1.708 4.179 1.00 20.24 H new ATOM 0 HA PHE A 522 -6.603 -2.304 4.339 1.00 42.32 H new ATOM 0 HB2 PHE A 522 -8.450 -1.359 2.107 1.00 4.13 H new ATOM 0 HB3 PHE A 522 -6.704 -1.369 1.954 1.00 4.13 H new ATOM 0 HD1 PHE A 522 -9.695 -3.559 2.356 1.00 20.53 H new ATOM 0 HD2 PHE A 522 -5.492 -3.443 1.588 1.00 53.33 H new ATOM 0 HE1 PHE A 522 -9.745 -5.916 1.678 1.00 21.15 H new ATOM 0 HE2 PHE A 522 -5.554 -5.800 0.917 1.00 12.41 H new ATOM 0 HZ PHE A 522 -7.676 -7.036 0.953 1.00 12.34 H new ATOM 2302 N MET A 523 -5.946 -0.038 5.080 1.00 31.01 N ATOM 2303 CA MET A 523 -5.421 1.294 5.504 1.00 15.13 C ATOM 2304 C MET A 523 -4.409 1.861 4.474 1.00 10.21 C ATOM 2305 O MET A 523 -3.843 1.117 3.682 1.00 52.42 O ATOM 2306 CB MET A 523 -4.762 1.181 6.915 1.00 25.32 C ATOM 2307 CG MET A 523 -5.683 0.559 7.978 1.00 50.51 C ATOM 2308 SD MET A 523 -4.969 0.578 9.638 1.00 11.23 S ATOM 2309 CE MET A 523 -6.358 0.005 10.621 1.00 10.03 C ATOM 0 H MET A 523 -5.390 -0.821 5.424 1.00 31.01 H new ATOM 0 HA MET A 523 -6.259 1.989 5.555 1.00 15.13 H new ATOM 0 HB2 MET A 523 -3.855 0.581 6.836 1.00 25.32 H new ATOM 0 HB3 MET A 523 -4.459 2.174 7.246 1.00 25.32 H new ATOM 0 HG2 MET A 523 -6.629 1.099 7.990 1.00 50.51 H new ATOM 0 HG3 MET A 523 -5.907 -0.470 7.698 1.00 50.51 H new ATOM 0 HE1 MET A 523 -6.000 -0.339 11.591 1.00 10.03 H new ATOM 0 HE2 MET A 523 -7.064 0.823 10.764 1.00 10.03 H new ATOM 0 HE3 MET A 523 -6.854 -0.817 10.105 1.00 10.03 H new ATOM 2319 N GLY A 524 -4.176 3.188 4.518 1.00 50.32 N ATOM 2320 CA GLY A 524 -3.262 3.871 3.584 1.00 41.12 C ATOM 2321 C GLY A 524 -2.440 4.967 4.268 1.00 74.22 C ATOM 2322 O GLY A 524 -2.906 6.098 4.415 1.00 12.41 O ATOM 0 H GLY A 524 -4.613 3.811 5.197 1.00 50.32 H new ATOM 0 HA2 GLY A 524 -2.588 3.139 3.139 1.00 41.12 H new ATOM 0 HA3 GLY A 524 -3.839 4.309 2.770 1.00 41.12 H new ATOM 2326 N LEU A 525 -1.215 4.626 4.691 1.00 22.51 N ATOM 2327 CA LEU A 525 -0.287 5.571 5.352 1.00 64.31 C ATOM 2328 C LEU A 525 0.511 6.393 4.317 1.00 41.21 C ATOM 2329 O LEU A 525 1.410 5.876 3.651 1.00 54.32 O ATOM 2330 CB LEU A 525 0.653 4.783 6.311 1.00 53.13 C ATOM 2331 CG LEU A 525 -0.009 4.350 7.660 1.00 35.02 C ATOM 2332 CD1 LEU A 525 0.854 3.336 8.427 1.00 4.24 C ATOM 2333 CD2 LEU A 525 -0.305 5.591 8.533 1.00 0.42 C ATOM 0 H LEU A 525 -0.833 3.686 4.587 1.00 22.51 H new ATOM 0 HA LEU A 525 -0.864 6.287 5.938 1.00 64.31 H new ATOM 0 HB2 LEU A 525 1.013 3.892 5.796 1.00 53.13 H new ATOM 0 HB3 LEU A 525 1.525 5.398 6.530 1.00 53.13 H new ATOM 0 HG LEU A 525 -0.949 3.853 7.422 1.00 35.02 H new ATOM 0 HD11 LEU A 525 0.355 3.064 9.357 1.00 4.24 H new ATOM 0 HD12 LEU A 525 0.996 2.444 7.817 1.00 4.24 H new ATOM 0 HD13 LEU A 525 1.824 3.780 8.652 1.00 4.24 H new ATOM 0 HD21 LEU A 525 -0.766 5.276 9.469 1.00 0.42 H new ATOM 0 HD22 LEU A 525 0.626 6.117 8.746 1.00 0.42 H new ATOM 0 HD23 LEU A 525 -0.984 6.257 8.001 1.00 0.42 H new ATOM 2345 N ILE A 526 0.163 7.690 4.201 1.00 33.30 N ATOM 2346 CA ILE A 526 0.804 8.630 3.259 1.00 62.02 C ATOM 2347 C ILE A 526 1.833 9.506 4.022 1.00 13.14 C ATOM 2348 O ILE A 526 1.441 10.434 4.752 1.00 14.10 O ATOM 2349 CB ILE A 526 -0.276 9.522 2.536 1.00 51.21 C ATOM 2350 CG1 ILE A 526 -1.381 8.607 1.909 1.00 72.44 C ATOM 2351 CG2 ILE A 526 0.384 10.444 1.469 1.00 33.12 C ATOM 2352 CD1 ILE A 526 -2.502 9.334 1.202 1.00 1.43 C ATOM 0 H ILE A 526 -0.575 8.117 4.761 1.00 33.30 H new ATOM 0 HA ILE A 526 1.327 8.063 2.489 1.00 62.02 H new ATOM 0 HB ILE A 526 -0.748 10.175 3.270 1.00 51.21 H new ATOM 0 HG12 ILE A 526 -0.907 7.928 1.200 1.00 72.44 H new ATOM 0 HG13 ILE A 526 -1.811 7.992 2.700 1.00 72.44 H new ATOM 0 HG21 ILE A 526 -0.384 11.048 0.986 1.00 33.12 H new ATOM 0 HG22 ILE A 526 1.110 11.098 1.952 1.00 33.12 H new ATOM 0 HG23 ILE A 526 0.888 9.832 0.721 1.00 33.12 H new ATOM 0 HD11 ILE A 526 -3.212 8.609 0.805 1.00 1.43 H new ATOM 0 HD12 ILE A 526 -3.011 9.992 1.907 1.00 1.43 H new ATOM 0 HD13 ILE A 526 -2.092 9.926 0.384 1.00 1.43 H new ATOM 2364 N PRO A 527 3.167 9.201 3.894 1.00 50.03 N ATOM 2365 CA PRO A 527 4.237 9.853 4.687 1.00 40.44 C ATOM 2366 C PRO A 527 4.678 11.204 4.091 1.00 65.54 C ATOM 2367 O PRO A 527 5.050 11.272 2.924 1.00 13.01 O ATOM 2368 CB PRO A 527 5.401 8.806 4.653 1.00 32.45 C ATOM 2369 CG PRO A 527 4.884 7.658 3.817 1.00 50.51 C ATOM 2370 CD PRO A 527 3.762 8.205 2.980 1.00 62.41 C ATOM 0 HA PRO A 527 3.908 10.101 5.696 1.00 40.44 H new ATOM 0 HB2 PRO A 527 6.303 9.235 4.216 1.00 32.45 H new ATOM 0 HB3 PRO A 527 5.661 8.474 5.658 1.00 32.45 H new ATOM 0 HG2 PRO A 527 5.675 7.252 3.186 1.00 50.51 H new ATOM 0 HG3 PRO A 527 4.532 6.845 4.452 1.00 50.51 H new ATOM 0 HD2 PRO A 527 4.123 8.660 2.058 1.00 62.41 H new ATOM 0 HD3 PRO A 527 3.048 7.432 2.696 1.00 62.41 H new ATOM 2378 N TYR A 528 4.684 12.260 4.919 1.00 61.12 N ATOM 2379 CA TYR A 528 5.081 13.627 4.495 1.00 15.24 C ATOM 2380 C TYR A 528 6.585 13.701 4.107 1.00 21.34 C ATOM 2381 O TYR A 528 7.026 14.667 3.470 1.00 21.31 O ATOM 2382 CB TYR A 528 4.760 14.643 5.620 1.00 65.13 C ATOM 2383 CG TYR A 528 3.339 14.496 6.194 1.00 33.51 C ATOM 2384 CD1 TYR A 528 2.213 14.720 5.399 1.00 30.31 C ATOM 2385 CD2 TYR A 528 3.134 14.132 7.523 1.00 20.15 C ATOM 2386 CE1 TYR A 528 0.938 14.585 5.917 1.00 55.03 C ATOM 2387 CE2 TYR A 528 1.863 13.992 8.042 1.00 55.44 C ATOM 2388 CZ TYR A 528 0.769 14.225 7.238 1.00 60.53 C ATOM 2389 OH TYR A 528 -0.502 14.105 7.759 1.00 14.51 O ATOM 0 H TYR A 528 4.416 12.199 5.901 1.00 61.12 H new ATOM 0 HA TYR A 528 4.505 13.881 3.605 1.00 15.24 H new ATOM 0 HB2 TYR A 528 5.483 14.521 6.426 1.00 65.13 H new ATOM 0 HB3 TYR A 528 4.884 15.654 5.232 1.00 65.13 H new ATOM 0 HD1 TYR A 528 2.340 15.003 4.364 1.00 30.31 H new ATOM 0 HD2 TYR A 528 3.988 13.956 8.161 1.00 20.15 H new ATOM 0 HE1 TYR A 528 0.077 14.761 5.289 1.00 55.03 H new ATOM 0 HE2 TYR A 528 1.727 13.701 9.073 1.00 55.44 H new ATOM 0 HH TYR A 528 -0.446 13.844 8.702 1.00 14.51 H new ATOM 2399 N ASP A 529 7.351 12.672 4.526 1.00 43.31 N ATOM 2400 CA ASP A 529 8.761 12.471 4.118 1.00 1.31 C ATOM 2401 C ASP A 529 8.872 12.307 2.582 1.00 34.45 C ATOM 2402 O ASP A 529 9.702 12.962 1.936 1.00 2.41 O ATOM 2403 CB ASP A 529 9.349 11.208 4.807 1.00 55.15 C ATOM 2404 CG ASP A 529 9.058 11.153 6.315 1.00 32.33 C ATOM 2405 OD1 ASP A 529 9.843 11.723 7.108 1.00 62.00 O ATOM 2406 OD2 ASP A 529 8.032 10.556 6.701 1.00 72.41 O ATOM 0 H ASP A 529 7.008 11.951 5.161 1.00 43.31 H new ATOM 0 HA ASP A 529 9.325 13.352 4.425 1.00 1.31 H new ATOM 0 HB2 ASP A 529 8.938 10.317 4.331 1.00 55.15 H new ATOM 0 HB3 ASP A 529 10.427 11.185 4.650 1.00 55.15 H new ATOM 2411 N GLN A 530 8.010 11.411 2.036 1.00 33.21 N ATOM 2412 CA GLN A 530 7.927 11.074 0.595 1.00 34.32 C ATOM 2413 C GLN A 530 9.273 10.553 0.019 1.00 52.00 C ATOM 2414 O GLN A 530 9.450 9.343 -0.135 1.00 1.21 O ATOM 2415 CB GLN A 530 7.343 12.267 -0.231 1.00 54.54 C ATOM 2416 CG GLN A 530 5.854 12.555 0.068 1.00 34.41 C ATOM 2417 CD GLN A 530 4.930 11.393 -0.325 1.00 14.20 C ATOM 2418 OE1 GLN A 530 5.190 10.695 -1.279 1.00 5.13 O ATOM 2419 NE2 GLN A 530 3.881 11.140 0.438 1.00 51.15 N ATOM 0 H GLN A 530 7.338 10.892 2.601 1.00 33.21 H new ATOM 0 HA GLN A 530 7.229 10.242 0.502 1.00 34.32 H new ATOM 0 HB2 GLN A 530 7.927 13.163 -0.022 1.00 54.54 H new ATOM 0 HB3 GLN A 530 7.457 12.053 -1.294 1.00 54.54 H new ATOM 0 HG2 GLN A 530 5.736 12.763 1.131 1.00 34.41 H new ATOM 0 HG3 GLN A 530 5.548 13.453 -0.468 1.00 34.41 H new ATOM 0 HE21 GLN A 530 3.676 11.738 1.238 1.00 51.15 H new ATOM 0 HE22 GLN A 530 3.276 10.346 0.227 1.00 51.15 H new ATOM 2428 N SER A 531 10.227 11.465 -0.253 1.00 74.14 N ATOM 2429 CA SER A 531 11.590 11.103 -0.725 1.00 31.24 C ATOM 2430 C SER A 531 12.345 10.293 0.356 1.00 52.10 C ATOM 2431 O SER A 531 13.027 9.306 0.049 1.00 71.15 O ATOM 2432 CB SER A 531 12.384 12.378 -1.090 1.00 10.25 C ATOM 2433 OG SER A 531 11.710 13.129 -2.090 1.00 22.43 O ATOM 0 H SER A 531 10.082 12.470 -0.154 1.00 74.14 H new ATOM 0 HA SER A 531 11.493 10.481 -1.615 1.00 31.24 H new ATOM 0 HB2 SER A 531 12.522 12.992 -0.200 1.00 10.25 H new ATOM 0 HB3 SER A 531 13.377 12.103 -1.444 1.00 10.25 H new ATOM 0 HG SER A 531 12.231 13.932 -2.303 1.00 22.43 H new ATOM 2439 N GLY A 532 12.178 10.715 1.626 1.00 62.32 N ATOM 2440 CA GLY A 532 12.759 10.010 2.782 1.00 22.04 C ATOM 2441 C GLY A 532 12.148 8.622 3.030 1.00 11.30 C ATOM 2442 O GLY A 532 12.814 7.733 3.577 1.00 42.13 O ATOM 0 H GLY A 532 11.642 11.546 1.876 1.00 62.32 H new ATOM 0 HA2 GLY A 532 13.833 9.902 2.629 1.00 22.04 H new ATOM 0 HA3 GLY A 532 12.624 10.621 3.674 1.00 22.04 H new ATOM 2446 N PHE A 533 10.874 8.435 2.624 1.00 64.44 N ATOM 2447 CA PHE A 533 10.198 7.122 2.715 1.00 44.24 C ATOM 2448 C PHE A 533 10.739 6.144 1.641 1.00 55.53 C ATOM 2449 O PHE A 533 11.110 5.012 1.962 1.00 43.41 O ATOM 2450 CB PHE A 533 8.667 7.282 2.586 1.00 21.03 C ATOM 2451 CG PHE A 533 7.880 5.995 2.853 1.00 14.00 C ATOM 2452 CD1 PHE A 533 7.804 5.464 4.140 1.00 51.24 C ATOM 2453 CD2 PHE A 533 7.201 5.327 1.834 1.00 71.54 C ATOM 2454 CE1 PHE A 533 7.080 4.317 4.397 1.00 31.40 C ATOM 2455 CE2 PHE A 533 6.478 4.175 2.090 1.00 73.20 C ATOM 2456 CZ PHE A 533 6.420 3.674 3.374 1.00 71.43 C ATOM 0 H PHE A 533 10.293 9.175 2.230 1.00 64.44 H new ATOM 0 HA PHE A 533 10.415 6.700 3.696 1.00 44.24 H new ATOM 0 HB2 PHE A 533 8.333 8.051 3.282 1.00 21.03 H new ATOM 0 HB3 PHE A 533 8.433 7.637 1.582 1.00 21.03 H new ATOM 0 HD1 PHE A 533 8.320 5.958 4.950 1.00 51.24 H new ATOM 0 HD2 PHE A 533 7.240 5.716 0.827 1.00 71.54 H new ATOM 0 HE1 PHE A 533 7.031 3.924 5.402 1.00 31.40 H new ATOM 0 HE2 PHE A 533 5.961 3.670 1.287 1.00 73.20 H new ATOM 0 HZ PHE A 533 5.856 2.776 3.577 1.00 71.43 H new ATOM 2466 N VAL A 534 10.805 6.621 0.377 1.00 61.21 N ATOM 2467 CA VAL A 534 11.341 5.842 -0.776 1.00 34.20 C ATOM 2468 C VAL A 534 12.812 5.423 -0.540 1.00 15.14 C ATOM 2469 O VAL A 534 13.241 4.379 -1.021 1.00 62.02 O ATOM 2470 CB VAL A 534 11.230 6.663 -2.121 1.00 10.50 C ATOM 2471 CG1 VAL A 534 11.862 5.919 -3.336 1.00 5.50 C ATOM 2472 CG2 VAL A 534 9.762 7.021 -2.422 1.00 2.35 C ATOM 0 H VAL A 534 10.489 7.557 0.122 1.00 61.21 H new ATOM 0 HA VAL A 534 10.733 4.941 -0.863 1.00 34.20 H new ATOM 0 HB VAL A 534 11.802 7.579 -1.973 1.00 10.50 H new ATOM 0 HG11 VAL A 534 11.756 6.530 -4.232 1.00 5.50 H new ATOM 0 HG12 VAL A 534 12.919 5.739 -3.142 1.00 5.50 H new ATOM 0 HG13 VAL A 534 11.353 4.967 -3.484 1.00 5.50 H new ATOM 0 HG21 VAL A 534 9.709 7.586 -3.353 1.00 2.35 H new ATOM 0 HG22 VAL A 534 9.177 6.106 -2.519 1.00 2.35 H new ATOM 0 HG23 VAL A 534 9.360 7.624 -1.608 1.00 2.35 H new ATOM 2482 N ASN A 535 13.560 6.247 0.218 1.00 65.52 N ATOM 2483 CA ASN A 535 14.937 5.943 0.644 1.00 53.13 C ATOM 2484 C ASN A 535 14.996 4.597 1.419 1.00 4.35 C ATOM 2485 O ASN A 535 15.813 3.727 1.106 1.00 32.51 O ATOM 2486 CB ASN A 535 15.438 7.114 1.519 1.00 1.23 C ATOM 2487 CG ASN A 535 16.841 6.925 2.084 1.00 33.55 C ATOM 2488 OD1 ASN A 535 17.721 6.342 1.451 1.00 74.24 O ATOM 2489 ND2 ASN A 535 17.055 7.407 3.287 1.00 14.41 N ATOM 0 H ASN A 535 13.222 7.149 0.554 1.00 65.52 H new ATOM 0 HA ASN A 535 15.581 5.833 -0.228 1.00 53.13 H new ATOM 0 HB2 ASN A 535 15.419 8.028 0.926 1.00 1.23 H new ATOM 0 HB3 ASN A 535 14.743 7.256 2.346 1.00 1.23 H new ATOM 0 HD21 ASN A 535 17.972 7.303 3.722 1.00 14.41 H new ATOM 0 HD22 ASN A 535 16.305 7.885 3.786 1.00 14.41 H new ATOM 2496 N GLY A 536 14.090 4.443 2.407 1.00 60.03 N ATOM 2497 CA GLY A 536 14.001 3.213 3.214 1.00 11.33 C ATOM 2498 C GLY A 536 13.396 2.019 2.458 1.00 31.11 C ATOM 2499 O GLY A 536 13.808 0.871 2.662 1.00 0.44 O ATOM 0 H GLY A 536 13.409 5.158 2.664 1.00 60.03 H new ATOM 0 HA2 GLY A 536 14.999 2.944 3.561 1.00 11.33 H new ATOM 0 HA3 GLY A 536 13.399 3.413 4.100 1.00 11.33 H new ATOM 2503 N ILE A 537 12.405 2.295 1.589 1.00 43.05 N ATOM 2504 CA ILE A 537 11.761 1.267 0.728 1.00 64.43 C ATOM 2505 C ILE A 537 12.764 0.690 -0.301 1.00 32.13 C ATOM 2506 O ILE A 537 12.770 -0.509 -0.576 1.00 40.33 O ATOM 2507 CB ILE A 537 10.511 1.873 -0.020 1.00 55.23 C ATOM 2508 CG1 ILE A 537 9.446 2.375 0.999 1.00 64.44 C ATOM 2509 CG2 ILE A 537 9.872 0.870 -1.010 1.00 43.55 C ATOM 2510 CD1 ILE A 537 8.828 1.287 1.863 1.00 3.31 C ATOM 0 H ILE A 537 12.024 3.232 1.459 1.00 43.05 H new ATOM 0 HA ILE A 537 11.428 0.455 1.375 1.00 64.43 H new ATOM 0 HB ILE A 537 10.874 2.719 -0.603 1.00 55.23 H new ATOM 0 HG12 ILE A 537 9.908 3.118 1.650 1.00 64.44 H new ATOM 0 HG13 ILE A 537 8.650 2.881 0.452 1.00 64.44 H new ATOM 0 HG21 ILE A 537 9.016 1.336 -1.498 1.00 43.55 H new ATOM 0 HG22 ILE A 537 10.607 0.583 -1.762 1.00 43.55 H new ATOM 0 HG23 ILE A 537 9.542 -0.016 -0.468 1.00 43.55 H new ATOM 0 HD11 ILE A 537 8.099 1.731 2.541 1.00 3.31 H new ATOM 0 HD12 ILE A 537 8.332 0.554 1.226 1.00 3.31 H new ATOM 0 HD13 ILE A 537 9.609 0.795 2.442 1.00 3.31 H new ATOM 2522 N ARG A 538 13.620 1.570 -0.834 1.00 42.42 N ATOM 2523 CA ARG A 538 14.661 1.213 -1.821 1.00 43.51 C ATOM 2524 C ARG A 538 15.680 0.219 -1.216 1.00 4.14 C ATOM 2525 O ARG A 538 16.132 -0.702 -1.896 1.00 61.54 O ATOM 2526 CB ARG A 538 15.400 2.488 -2.288 1.00 55.22 C ATOM 2527 CG ARG A 538 16.374 2.291 -3.480 1.00 45.24 C ATOM 2528 CD ARG A 538 17.541 3.291 -3.452 1.00 60.41 C ATOM 2529 NE ARG A 538 18.468 2.984 -2.344 1.00 2.53 N ATOM 2530 CZ ARG A 538 18.666 3.698 -1.257 1.00 22.23 C ATOM 2531 NH1 ARG A 538 18.083 4.849 -1.074 1.00 10.40 N ATOM 2532 NH2 ARG A 538 19.457 3.237 -0.352 1.00 22.15 N ATOM 0 H ARG A 538 13.614 2.561 -0.594 1.00 42.42 H new ATOM 0 HA ARG A 538 14.174 0.737 -2.672 1.00 43.51 H new ATOM 0 HB2 ARG A 538 14.658 3.237 -2.566 1.00 55.22 H new ATOM 0 HB3 ARG A 538 15.961 2.892 -1.445 1.00 55.22 H new ATOM 0 HG2 ARG A 538 16.769 1.275 -3.460 1.00 45.24 H new ATOM 0 HG3 ARG A 538 15.826 2.402 -4.416 1.00 45.24 H new ATOM 0 HD2 ARG A 538 18.077 3.258 -4.400 1.00 60.41 H new ATOM 0 HD3 ARG A 538 17.155 4.304 -3.339 1.00 60.41 H new ATOM 0 HE ARG A 538 19.013 2.126 -2.431 1.00 2.53 H new ATOM 0 HH11 ARG A 538 17.452 5.220 -1.785 1.00 10.40 H new ATOM 0 HH12 ARG A 538 18.257 5.379 -0.220 1.00 10.40 H new ATOM 0 HH21 ARG A 538 19.915 2.336 -0.486 1.00 22.15 H new ATOM 0 HH22 ARG A 538 19.626 3.773 0.499 1.00 22.15 H new ATOM 2546 N GLN A 539 16.016 0.429 0.078 1.00 61.24 N ATOM 2547 CA GLN A 539 16.890 -0.483 0.863 1.00 53.24 C ATOM 2548 C GLN A 539 16.311 -1.924 0.922 1.00 10.42 C ATOM 2549 O GLN A 539 17.055 -2.908 0.866 1.00 13.21 O ATOM 2550 CB GLN A 539 17.086 0.069 2.301 1.00 5.35 C ATOM 2551 CG GLN A 539 17.790 1.441 2.370 1.00 74.44 C ATOM 2552 CD GLN A 539 17.844 2.032 3.787 1.00 62.23 C ATOM 2553 OE1 GLN A 539 16.967 1.799 4.613 1.00 51.35 O ATOM 2554 NE2 GLN A 539 18.870 2.811 4.082 1.00 23.41 N ATOM 0 H GLN A 539 15.690 1.236 0.611 1.00 61.24 H new ATOM 0 HA GLN A 539 17.855 -0.531 0.358 1.00 53.24 H new ATOM 0 HB2 GLN A 539 16.111 0.151 2.781 1.00 5.35 H new ATOM 0 HB3 GLN A 539 17.666 -0.652 2.877 1.00 5.35 H new ATOM 0 HG2 GLN A 539 18.806 1.339 1.989 1.00 74.44 H new ATOM 0 HG3 GLN A 539 17.272 2.140 1.713 1.00 74.44 H new ATOM 0 HE21 GLN A 539 19.590 2.993 3.382 1.00 23.41 H new ATOM 0 HE22 GLN A 539 18.942 3.230 5.009 1.00 23.41 H new ATOM 2563 N VAL A 540 14.970 -2.013 1.031 1.00 32.22 N ATOM 2564 CA VAL A 540 14.225 -3.292 0.987 1.00 72.24 C ATOM 2565 C VAL A 540 14.263 -3.905 -0.442 1.00 52.35 C ATOM 2566 O VAL A 540 14.439 -5.121 -0.610 1.00 34.30 O ATOM 2567 CB VAL A 540 12.726 -3.081 1.446 1.00 45.50 C ATOM 2568 CG1 VAL A 540 11.914 -4.402 1.409 1.00 73.21 C ATOM 2569 CG2 VAL A 540 12.655 -2.427 2.852 1.00 61.43 C ATOM 0 H VAL A 540 14.369 -1.198 1.153 1.00 32.22 H new ATOM 0 HA VAL A 540 14.708 -3.985 1.676 1.00 72.24 H new ATOM 0 HB VAL A 540 12.268 -2.399 0.730 1.00 45.50 H new ATOM 0 HG11 VAL A 540 10.891 -4.209 1.732 1.00 73.21 H new ATOM 0 HG12 VAL A 540 11.906 -4.796 0.393 1.00 73.21 H new ATOM 0 HG13 VAL A 540 12.374 -5.131 2.076 1.00 73.21 H new ATOM 0 HG21 VAL A 540 11.612 -2.295 3.140 1.00 61.43 H new ATOM 0 HG22 VAL A 540 13.153 -3.070 3.578 1.00 61.43 H new ATOM 0 HG23 VAL A 540 13.150 -1.456 2.827 1.00 61.43 H new