USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=30 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 516 SER OG : rot -150:sc=-0.00524 USER MOD Set 1.2: A 523 MET CE :methyl -171:sc= -0.115 (180deg=-0.33) USER MOD Set 2.1: A 497 CYS SG : rot -109:sc= 0.69 USER MOD Set 2.2: A 499 HIS : no HE2:sc= 0.905 K(o=1.6,f=-6.7!) USER MOD Set 3.1: A 430 GLN : amide:sc= 0.326 K(o=1.5,f=-0.75) USER MOD Set 3.2: A 432 TYR OH : rot -3:sc= 0.352 USER MOD Set 3.3: A 474 HIS :FLIP no HD1:sc= 0.354 F(o=0.65,f=1.5) USER MOD Set 3.4: A 478 LYS NZ :NH3+ -138:sc= 0.42 (180deg=0) USER MOD Set 4.1: A 476 THR OG1 : rot 91:sc= -0.615 USER MOD Set 4.2: A 477 ASN : amide:sc= 0.437 K(o=-0.18,f=-2.5!) USER MOD Set 5.1: A 456 GLN : amide:sc= 0.295 X(o=1.3,f=1) USER MOD Set 5.2: A 459 THR OG1 : rot -85:sc= 1.01 USER MOD Set 6.1: A 409 GLN :FLIP amide:sc= 0.41 F(o=-1.7!,f=0.87) USER MOD Set 6.2: A 424 THR OG1 : rot -11:sc= 0.456 USER MOD Set 7.1: A 398 LYS NZ :NH3+ -146:sc= 0.48 (180deg=-0.00858) USER MOD Set 7.2: A 472 GLN : amide:sc= -0.785 K(o=-0.31,f=-4.8!) USER MOD Single : A 403 SER OG : rot 33:sc= 0.238 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 429 CYS SG : rot 15:sc= -3.88! USER MOD Single : A 434 ASN : amide:sc= -0.011 X(o=-0.011,f=-0.059) USER MOD Single : A 438 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot -159:sc= 1.03 USER MOD Single : A 443 GLN : amide:sc= 0.0855 X(o=0.086,f=0) USER MOD Single : A 446 GLN : amide:sc= -0.205 X(o=-0.2,f=0) USER MOD Single : A 447 LYS NZ :NH3+ -120:sc= -0.307 (180deg=-1.86) USER MOD Single : A 450 MET CE :methyl 139:sc=-0.00715 (180deg=-0.579) USER MOD Single : A 451 GLN : amide:sc= -0.0483 X(o=-0.048,f=0) USER MOD Single : A 455 GLN : amide:sc= -0.874 X(o=-0.87,f=-0.68) USER MOD Single : A 460 THR OG1 : rot -73:sc= 0.648 USER MOD Single : A 467 ASN : amide:sc= -0.0503 K(o=-0.05,f=-2.5!) USER MOD Single : A 468 SER OG : rot -49:sc= 0.347 USER MOD Single : A 470 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 482 SER OG : rot 170:sc= -0.975 USER MOD Single : A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 MET CE :methyl 148:sc= -0.389 (180deg=-1.08) USER MOD Single : A 492 ASN : amide:sc= -0.0699 K(o=-0.07,f=-0.66) USER MOD Single : A 512 MET CE :methyl 180:sc= -1.55 (180deg=-1.55) USER MOD Single : A 515 TYR OH : rot 180:sc= -0.126 USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0228) USER MOD Single : A 519 LYS NZ :NH3+ 170:sc= -0.0178 (180deg=-0.145) USER MOD Single : A 520 LYS NZ :NH3+ -159:sc= 0.0312 (180deg=0.00236) USER MOD Single : A 528 TYR OH : rot 180:sc= -0.461 USER MOD Single : A 530 GLN : amide:sc= -1.52 K(o=-1.5,f=-5!) USER MOD Single : A 531 SER OG : rot 180:sc=-0.000369 USER MOD Single : A 535 ASN : amide:sc= -0.415 X(o=-0.42,f=-0.68) USER MOD Single : A 539 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 250 N LYS A 398 -17.008 8.523 5.748 1.00 63.22 N ATOM 251 CA LYS A 398 -15.810 8.888 4.960 1.00 20.15 C ATOM 252 C LYS A 398 -16.226 9.505 3.607 1.00 5.34 C ATOM 253 O LYS A 398 -17.210 9.076 2.998 1.00 3.52 O ATOM 254 CB LYS A 398 -14.934 7.622 4.703 1.00 4.23 C ATOM 255 CG LYS A 398 -14.044 7.162 5.881 1.00 73.34 C ATOM 256 CD LYS A 398 -12.918 8.176 6.201 1.00 43.14 C ATOM 257 CE LYS A 398 -11.834 7.609 7.139 1.00 61.43 C ATOM 258 NZ LYS A 398 -12.395 7.088 8.421 1.00 3.00 N ATOM 0 HA LYS A 398 -15.234 9.620 5.526 1.00 20.15 H new ATOM 0 HB2 LYS A 398 -15.593 6.798 4.428 1.00 4.23 H new ATOM 0 HB3 LYS A 398 -14.292 7.817 3.844 1.00 4.23 H new ATOM 0 HG2 LYS A 398 -14.663 7.019 6.767 1.00 73.34 H new ATOM 0 HG3 LYS A 398 -13.601 6.195 5.642 1.00 73.34 H new ATOM 0 HD2 LYS A 398 -12.451 8.496 5.269 1.00 43.14 H new ATOM 0 HD3 LYS A 398 -13.357 9.063 6.658 1.00 43.14 H new ATOM 0 HE2 LYS A 398 -11.301 6.807 6.628 1.00 61.43 H new ATOM 0 HE3 LYS A 398 -11.104 8.389 7.357 1.00 61.43 H new ATOM 0 HZ1 LYS A 398 -11.716 7.256 9.191 1.00 3.00 H new ATOM 0 HZ2 LYS A 398 -13.288 7.577 8.633 1.00 3.00 H new ATOM 0 HZ3 LYS A 398 -12.572 6.067 8.333 1.00 3.00 H new ATOM 272 N LEU A 399 -15.461 10.504 3.137 1.00 72.50 N ATOM 273 CA LEU A 399 -15.688 11.141 1.817 1.00 43.11 C ATOM 274 C LEU A 399 -14.694 10.600 0.773 1.00 42.31 C ATOM 275 O LEU A 399 -13.540 10.308 1.091 1.00 42.15 O ATOM 276 CB LEU A 399 -15.605 12.694 1.914 1.00 62.32 C ATOM 277 CG LEU A 399 -16.932 13.420 2.320 1.00 44.13 C ATOM 278 CD1 LEU A 399 -17.406 13.021 3.732 1.00 54.02 C ATOM 279 CD2 LEU A 399 -16.783 14.945 2.176 1.00 62.44 C ATOM 0 H LEU A 399 -14.672 10.895 3.652 1.00 72.50 H new ATOM 0 HA LEU A 399 -16.697 10.886 1.492 1.00 43.11 H new ATOM 0 HB2 LEU A 399 -14.834 12.954 2.639 1.00 62.32 H new ATOM 0 HB3 LEU A 399 -15.280 13.083 0.949 1.00 62.32 H new ATOM 0 HG LEU A 399 -17.711 13.092 1.632 1.00 44.13 H new ATOM 0 HD11 LEU A 399 -18.329 13.550 3.969 1.00 54.02 H new ATOM 0 HD12 LEU A 399 -17.585 11.946 3.766 1.00 54.02 H new ATOM 0 HD13 LEU A 399 -16.640 13.284 4.461 1.00 54.02 H new ATOM 0 HD21 LEU A 399 -17.716 15.430 2.463 1.00 62.44 H new ATOM 0 HD22 LEU A 399 -15.978 15.295 2.823 1.00 62.44 H new ATOM 0 HD23 LEU A 399 -16.549 15.192 1.140 1.00 62.44 H new ATOM 291 N LEU A 400 -15.163 10.500 -0.478 1.00 1.04 N ATOM 292 CA LEU A 400 -14.376 9.948 -1.597 1.00 73.13 C ATOM 293 C LEU A 400 -13.400 11.010 -2.166 1.00 42.21 C ATOM 294 O LEU A 400 -13.815 12.112 -2.544 1.00 24.10 O ATOM 295 CB LEU A 400 -15.326 9.416 -2.709 1.00 32.02 C ATOM 296 CG LEU A 400 -14.634 8.775 -3.955 1.00 54.32 C ATOM 297 CD1 LEU A 400 -13.722 7.598 -3.555 1.00 50.45 C ATOM 298 CD2 LEU A 400 -15.675 8.342 -5.017 1.00 33.31 C ATOM 0 H LEU A 400 -16.100 10.799 -0.747 1.00 1.04 H new ATOM 0 HA LEU A 400 -13.779 9.116 -1.222 1.00 73.13 H new ATOM 0 HB2 LEU A 400 -15.991 8.674 -2.266 1.00 32.02 H new ATOM 0 HB3 LEU A 400 -15.951 10.241 -3.050 1.00 32.02 H new ATOM 0 HG LEU A 400 -14.001 9.540 -4.404 1.00 54.32 H new ATOM 0 HD11 LEU A 400 -13.258 7.178 -4.447 1.00 50.45 H new ATOM 0 HD12 LEU A 400 -12.947 7.953 -2.876 1.00 50.45 H new ATOM 0 HD13 LEU A 400 -14.315 6.830 -3.059 1.00 50.45 H new ATOM 0 HD21 LEU A 400 -15.161 7.900 -5.871 1.00 33.31 H new ATOM 0 HD22 LEU A 400 -16.354 7.609 -4.583 1.00 33.31 H new ATOM 0 HD23 LEU A 400 -16.243 9.212 -5.346 1.00 33.31 H new ATOM 310 N ALA A 401 -12.102 10.666 -2.200 1.00 54.12 N ATOM 311 CA ALA A 401 -11.037 11.538 -2.743 1.00 13.44 C ATOM 312 C ALA A 401 -10.588 11.067 -4.147 1.00 52.44 C ATOM 313 O ALA A 401 -10.365 11.881 -5.049 1.00 11.02 O ATOM 314 CB ALA A 401 -9.852 11.557 -1.771 1.00 74.22 C ATOM 0 H ALA A 401 -11.756 9.772 -1.851 1.00 54.12 H new ATOM 0 HA ALA A 401 -11.431 12.549 -2.851 1.00 13.44 H new ATOM 0 HB1 ALA A 401 -9.066 12.199 -2.168 1.00 74.22 H new ATOM 0 HB2 ALA A 401 -10.180 11.941 -0.805 1.00 74.22 H new ATOM 0 HB3 ALA A 401 -9.467 10.545 -1.647 1.00 74.22 H new ATOM 320 N TRP A 402 -10.464 9.735 -4.319 1.00 23.21 N ATOM 321 CA TRP A 402 -9.998 9.117 -5.586 1.00 62.03 C ATOM 322 C TRP A 402 -10.708 7.768 -5.830 1.00 24.53 C ATOM 323 O TRP A 402 -10.873 6.980 -4.907 1.00 74.33 O ATOM 324 CB TRP A 402 -8.456 8.918 -5.545 1.00 45.02 C ATOM 325 CG TRP A 402 -7.848 8.357 -6.821 1.00 74.45 C ATOM 326 CD1 TRP A 402 -7.580 9.038 -7.978 1.00 32.04 C ATOM 327 CD2 TRP A 402 -7.417 7.002 -7.053 1.00 20.25 C ATOM 328 NE1 TRP A 402 -7.012 8.194 -8.901 1.00 3.24 N ATOM 329 CE2 TRP A 402 -6.902 6.943 -8.359 1.00 32.25 C ATOM 330 CE3 TRP A 402 -7.415 5.839 -6.278 1.00 62.43 C ATOM 331 CZ2 TRP A 402 -6.391 5.768 -8.911 1.00 52.13 C ATOM 332 CZ3 TRP A 402 -6.912 4.675 -6.826 1.00 43.13 C ATOM 333 CH2 TRP A 402 -6.402 4.647 -8.129 1.00 54.34 C ATOM 0 H TRP A 402 -10.682 9.056 -3.589 1.00 23.21 H new ATOM 0 HA TRP A 402 -10.247 9.786 -6.410 1.00 62.03 H new ATOM 0 HB2 TRP A 402 -7.986 9.877 -5.327 1.00 45.02 H new ATOM 0 HB3 TRP A 402 -8.213 8.249 -4.719 1.00 45.02 H new ATOM 0 HD1 TRP A 402 -7.785 10.086 -8.141 1.00 32.04 H new ATOM 0 HE1 TRP A 402 -6.719 8.458 -9.842 1.00 3.24 H new ATOM 0 HE3 TRP A 402 -7.800 5.850 -5.269 1.00 62.43 H new ATOM 0 HZ2 TRP A 402 -6.001 5.745 -9.918 1.00 52.13 H new ATOM 0 HZ3 TRP A 402 -6.912 3.769 -6.238 1.00 43.13 H new ATOM 0 HH2 TRP A 402 -6.010 3.722 -8.524 1.00 54.34 H new ATOM 344 N SER A 403 -11.118 7.522 -7.082 1.00 72.13 N ATOM 345 CA SER A 403 -11.703 6.231 -7.518 1.00 34.03 C ATOM 346 C SER A 403 -10.959 5.727 -8.770 1.00 35.53 C ATOM 347 O SER A 403 -10.893 6.424 -9.791 1.00 4.25 O ATOM 348 CB SER A 403 -13.219 6.382 -7.805 1.00 42.22 C ATOM 349 OG SER A 403 -13.474 7.310 -8.851 1.00 51.52 O ATOM 0 H SER A 403 -11.056 8.212 -7.830 1.00 72.13 H new ATOM 0 HA SER A 403 -11.588 5.501 -6.717 1.00 34.03 H new ATOM 0 HB2 SER A 403 -13.636 5.411 -8.073 1.00 42.22 H new ATOM 0 HB3 SER A 403 -13.729 6.709 -6.899 1.00 42.22 H new ATOM 0 HG SER A 403 -12.742 7.278 -9.502 1.00 51.52 H new ATOM 355 N GLY A 404 -10.403 4.513 -8.684 1.00 52.41 N ATOM 356 CA GLY A 404 -9.582 3.950 -9.760 1.00 2.23 C ATOM 357 C GLY A 404 -9.250 2.481 -9.540 1.00 43.02 C ATOM 358 O GLY A 404 -10.053 1.746 -8.978 1.00 53.41 O ATOM 0 H GLY A 404 -10.508 3.900 -7.876 1.00 52.41 H new ATOM 0 HA2 GLY A 404 -10.108 4.061 -10.708 1.00 2.23 H new ATOM 0 HA3 GLY A 404 -8.656 4.519 -9.840 1.00 2.23 H new ATOM 362 N VAL A 405 -8.071 2.051 -10.013 1.00 3.31 N ATOM 363 CA VAL A 405 -7.615 0.645 -9.932 1.00 75.33 C ATOM 364 C VAL A 405 -6.276 0.545 -9.156 1.00 14.13 C ATOM 365 O VAL A 405 -5.373 1.338 -9.378 1.00 65.43 O ATOM 366 CB VAL A 405 -7.429 0.027 -11.378 1.00 71.03 C ATOM 367 CG1 VAL A 405 -7.004 -1.468 -11.321 1.00 43.40 C ATOM 368 CG2 VAL A 405 -8.701 0.211 -12.245 1.00 72.12 C ATOM 0 H VAL A 405 -7.398 2.669 -10.467 1.00 3.31 H new ATOM 0 HA VAL A 405 -8.381 0.081 -9.400 1.00 75.33 H new ATOM 0 HB VAL A 405 -6.618 0.579 -11.854 1.00 71.03 H new ATOM 0 HG11 VAL A 405 -6.888 -1.852 -12.334 1.00 43.40 H new ATOM 0 HG12 VAL A 405 -6.057 -1.557 -10.788 1.00 43.40 H new ATOM 0 HG13 VAL A 405 -7.769 -2.044 -10.800 1.00 43.40 H new ATOM 0 HG21 VAL A 405 -8.536 -0.225 -13.230 1.00 72.12 H new ATOM 0 HG22 VAL A 405 -9.544 -0.286 -11.765 1.00 72.12 H new ATOM 0 HG23 VAL A 405 -8.919 1.274 -12.351 1.00 72.12 H new ATOM 378 N LEU A 406 -6.177 -0.417 -8.230 1.00 24.14 N ATOM 379 CA LEU A 406 -4.902 -0.837 -7.615 1.00 61.15 C ATOM 380 C LEU A 406 -4.387 -2.117 -8.320 1.00 65.44 C ATOM 381 O LEU A 406 -5.022 -3.168 -8.248 1.00 33.10 O ATOM 382 CB LEU A 406 -5.092 -1.099 -6.100 1.00 43.30 C ATOM 383 CG LEU A 406 -3.813 -1.525 -5.319 1.00 73.05 C ATOM 384 CD1 LEU A 406 -2.752 -0.401 -5.304 1.00 33.50 C ATOM 385 CD2 LEU A 406 -4.167 -1.982 -3.895 1.00 41.51 C ATOM 0 H LEU A 406 -6.984 -0.933 -7.880 1.00 24.14 H new ATOM 0 HA LEU A 406 -4.169 -0.040 -7.734 1.00 61.15 H new ATOM 0 HB2 LEU A 406 -5.490 -0.194 -5.641 1.00 43.30 H new ATOM 0 HB3 LEU A 406 -5.846 -1.877 -5.977 1.00 43.30 H new ATOM 0 HG LEU A 406 -3.373 -2.373 -5.844 1.00 73.05 H new ATOM 0 HD11 LEU A 406 -1.875 -0.736 -4.750 1.00 33.50 H new ATOM 0 HD12 LEU A 406 -2.464 -0.159 -6.327 1.00 33.50 H new ATOM 0 HD13 LEU A 406 -3.168 0.485 -4.824 1.00 33.50 H new ATOM 0 HD21 LEU A 406 -3.258 -2.274 -3.370 1.00 41.51 H new ATOM 0 HD22 LEU A 406 -4.648 -1.164 -3.359 1.00 41.51 H new ATOM 0 HD23 LEU A 406 -4.847 -2.833 -3.944 1.00 41.51 H new ATOM 397 N GLU A 407 -3.254 -1.999 -9.016 1.00 60.33 N ATOM 398 CA GLU A 407 -2.590 -3.113 -9.726 1.00 53.34 C ATOM 399 C GLU A 407 -1.258 -3.477 -9.029 1.00 71.31 C ATOM 400 O GLU A 407 -0.553 -2.590 -8.557 1.00 2.52 O ATOM 401 CB GLU A 407 -2.326 -2.685 -11.190 1.00 50.21 C ATOM 402 CG GLU A 407 -1.621 -3.737 -12.068 1.00 51.45 C ATOM 403 CD GLU A 407 -1.319 -3.214 -13.483 1.00 43.24 C ATOM 404 OE1 GLU A 407 -0.296 -2.519 -13.670 1.00 22.34 O ATOM 405 OE2 GLU A 407 -2.113 -3.466 -14.413 1.00 75.00 O ATOM 0 H GLU A 407 -2.757 -1.113 -9.108 1.00 60.33 H new ATOM 0 HA GLU A 407 -3.234 -3.992 -9.709 1.00 53.34 H new ATOM 0 HB2 GLU A 407 -3.279 -2.429 -11.653 1.00 50.21 H new ATOM 0 HB3 GLU A 407 -1.721 -1.778 -11.182 1.00 50.21 H new ATOM 0 HG2 GLU A 407 -0.690 -4.040 -11.589 1.00 51.45 H new ATOM 0 HG3 GLU A 407 -2.248 -4.626 -12.138 1.00 51.45 H new ATOM 412 N TRP A 408 -0.912 -4.780 -8.983 1.00 52.14 N ATOM 413 CA TRP A 408 0.355 -5.252 -8.390 1.00 10.43 C ATOM 414 C TRP A 408 0.851 -6.549 -9.063 1.00 11.14 C ATOM 415 O TRP A 408 0.162 -7.144 -9.905 1.00 3.22 O ATOM 416 CB TRP A 408 0.185 -5.450 -6.857 1.00 42.10 C ATOM 417 CG TRP A 408 -0.768 -6.552 -6.452 1.00 34.24 C ATOM 418 CD1 TRP A 408 -0.448 -7.856 -6.222 1.00 42.31 C ATOM 419 CD2 TRP A 408 -2.185 -6.447 -6.218 1.00 71.32 C ATOM 420 NE1 TRP A 408 -1.555 -8.561 -5.856 1.00 63.42 N ATOM 421 CE2 TRP A 408 -2.635 -7.726 -5.846 1.00 32.34 C ATOM 422 CE3 TRP A 408 -3.113 -5.401 -6.293 1.00 12.21 C ATOM 423 CZ2 TRP A 408 -3.964 -7.987 -5.537 1.00 22.30 C ATOM 424 CZ3 TRP A 408 -4.435 -5.662 -5.988 1.00 42.21 C ATOM 425 CH2 TRP A 408 -4.847 -6.951 -5.620 1.00 52.25 C ATOM 0 H TRP A 408 -1.498 -5.529 -9.353 1.00 52.14 H new ATOM 0 HA TRP A 408 1.115 -4.490 -8.564 1.00 10.43 H new ATOM 0 HB2 TRP A 408 1.163 -5.659 -6.423 1.00 42.10 H new ATOM 0 HB3 TRP A 408 -0.163 -4.513 -6.422 1.00 42.10 H new ATOM 0 HD1 TRP A 408 0.544 -8.273 -6.317 1.00 42.31 H new ATOM 0 HE1 TRP A 408 -1.574 -9.555 -5.626 1.00 63.42 H new ATOM 0 HE3 TRP A 408 -2.801 -4.409 -6.584 1.00 12.21 H new ATOM 0 HZ2 TRP A 408 -4.286 -8.975 -5.242 1.00 22.30 H new ATOM 0 HZ3 TRP A 408 -5.160 -4.863 -6.034 1.00 42.21 H new ATOM 0 HH2 TRP A 408 -5.889 -7.128 -5.397 1.00 52.25 H new ATOM 436 N GLN A 409 2.063 -6.973 -8.679 1.00 13.35 N ATOM 437 CA GLN A 409 2.656 -8.254 -9.107 1.00 21.04 C ATOM 438 C GLN A 409 2.733 -9.237 -7.919 1.00 54.35 C ATOM 439 O GLN A 409 3.146 -8.862 -6.813 1.00 12.30 O ATOM 440 CB GLN A 409 4.067 -8.016 -9.709 1.00 0.55 C ATOM 441 CG GLN A 409 4.099 -7.179 -11.017 1.00 23.44 C ATOM 442 CD GLN A 409 3.764 -7.944 -12.321 1.00 10.22 C ATOM 443 OE1 GLN A 409 2.936 -8.981 -12.275 1.00 40.24 O flip ATOM 444 NE2 GLN A 409 4.261 -7.598 -13.386 1.00 13.34 N flip ATOM 0 H GLN A 409 2.667 -6.434 -8.058 1.00 13.35 H new ATOM 0 HA GLN A 409 2.020 -8.694 -9.875 1.00 21.04 H new ATOM 0 HB2 GLN A 409 4.683 -7.515 -8.962 1.00 0.55 H new ATOM 0 HB3 GLN A 409 4.528 -8.984 -9.905 1.00 0.55 H new ATOM 0 HG2 GLN A 409 3.396 -6.353 -10.913 1.00 23.44 H new ATOM 0 HG3 GLN A 409 5.092 -6.742 -11.121 1.00 23.44 H new ATOM 0 HE21 GLN A 409 4.897 -6.801 -13.417 1.00 13.34 H new ATOM 0 HE22 GLN A 409 4.039 -8.107 -14.242 1.00 13.34 H new ATOM 453 N GLU A 410 2.334 -10.490 -8.180 1.00 0.34 N ATOM 454 CA GLU A 410 2.392 -11.600 -7.208 1.00 32.14 C ATOM 455 C GLU A 410 3.811 -12.196 -7.103 1.00 45.14 C ATOM 456 O GLU A 410 4.695 -11.914 -7.927 1.00 44.03 O ATOM 457 CB GLU A 410 1.392 -12.712 -7.644 1.00 44.14 C ATOM 458 CG GLU A 410 -0.096 -12.315 -7.604 1.00 21.12 C ATOM 459 CD GLU A 410 -0.662 -12.162 -6.182 1.00 63.32 C ATOM 460 OE1 GLU A 410 -0.324 -11.171 -5.515 1.00 60.44 O ATOM 461 OE2 GLU A 410 -1.447 -13.038 -5.738 1.00 44.42 O ATOM 0 H GLU A 410 1.956 -10.769 -9.085 1.00 0.34 H new ATOM 0 HA GLU A 410 2.123 -11.207 -6.227 1.00 32.14 H new ATOM 0 HB2 GLU A 410 1.640 -13.023 -8.659 1.00 44.14 H new ATOM 0 HB3 GLU A 410 1.537 -13.580 -7.000 1.00 44.14 H new ATOM 0 HG2 GLU A 410 -0.225 -11.374 -8.139 1.00 21.12 H new ATOM 0 HG3 GLU A 410 -0.677 -13.068 -8.137 1.00 21.12 H new ATOM 649 N LEU A 423 2.620 -12.601 -12.456 1.00 72.20 N ATOM 650 CA LEU A 423 1.156 -12.614 -12.158 1.00 2.50 C ATOM 651 C LEU A 423 0.597 -11.201 -11.824 1.00 43.34 C ATOM 652 O LEU A 423 0.631 -10.755 -10.670 1.00 3.30 O ATOM 653 CB LEU A 423 0.827 -13.623 -11.028 1.00 41.13 C ATOM 654 CG LEU A 423 1.158 -15.118 -11.308 1.00 15.32 C ATOM 655 CD1 LEU A 423 0.951 -15.970 -10.039 1.00 4.12 C ATOM 656 CD2 LEU A 423 0.323 -15.663 -12.489 1.00 51.11 C ATOM 0 HA LEU A 423 0.656 -12.940 -13.070 1.00 2.50 H new ATOM 0 HB2 LEU A 423 1.366 -13.317 -10.131 1.00 41.13 H new ATOM 0 HB3 LEU A 423 -0.237 -13.546 -10.802 1.00 41.13 H new ATOM 0 HG LEU A 423 2.209 -15.184 -11.591 1.00 15.32 H new ATOM 0 HD11 LEU A 423 1.188 -17.011 -10.257 1.00 4.12 H new ATOM 0 HD12 LEU A 423 1.606 -15.607 -9.246 1.00 4.12 H new ATOM 0 HD13 LEU A 423 -0.087 -15.894 -9.715 1.00 4.12 H new ATOM 0 HD21 LEU A 423 0.576 -16.709 -12.661 1.00 51.11 H new ATOM 0 HD22 LEU A 423 -0.738 -15.580 -12.253 1.00 51.11 H new ATOM 0 HD23 LEU A 423 0.542 -15.085 -13.387 1.00 51.11 H new ATOM 668 N THR A 424 0.127 -10.489 -12.854 1.00 41.25 N ATOM 669 CA THR A 424 -0.453 -9.138 -12.695 1.00 13.34 C ATOM 670 C THR A 424 -1.914 -9.219 -12.197 1.00 33.00 C ATOM 671 O THR A 424 -2.826 -9.559 -12.961 1.00 4.30 O ATOM 672 CB THR A 424 -0.373 -8.324 -14.034 1.00 21.43 C ATOM 673 OG1 THR A 424 1.005 -8.195 -14.441 1.00 44.42 O ATOM 674 CG2 THR A 424 -0.994 -6.916 -13.907 1.00 53.52 C ATOM 0 H THR A 424 0.135 -10.824 -13.817 1.00 41.25 H new ATOM 0 HA THR A 424 0.137 -8.612 -11.944 1.00 13.34 H new ATOM 0 HB THR A 424 -0.946 -8.875 -14.780 1.00 21.43 H new ATOM 0 HG1 THR A 424 1.590 -8.491 -13.713 1.00 44.42 H new ATOM 0 HG21 THR A 424 -0.913 -6.395 -14.861 1.00 53.52 H new ATOM 0 HG22 THR A 424 -2.045 -7.005 -13.631 1.00 53.52 H new ATOM 0 HG23 THR A 424 -0.464 -6.352 -13.139 1.00 53.52 H new ATOM 682 N ARG A 425 -2.111 -8.954 -10.898 1.00 23.32 N ATOM 683 CA ARG A 425 -3.452 -8.845 -10.281 1.00 63.24 C ATOM 684 C ARG A 425 -3.898 -7.371 -10.228 1.00 72.21 C ATOM 685 O ARG A 425 -3.060 -6.468 -10.197 1.00 73.43 O ATOM 686 CB ARG A 425 -3.432 -9.440 -8.851 1.00 44.35 C ATOM 687 CG ARG A 425 -3.144 -10.950 -8.771 1.00 11.44 C ATOM 688 CD ARG A 425 -4.215 -11.804 -9.469 1.00 73.15 C ATOM 689 NE ARG A 425 -4.074 -13.238 -9.159 1.00 52.42 N ATOM 690 CZ ARG A 425 -5.048 -14.120 -9.193 1.00 31.04 C ATOM 691 NH1 ARG A 425 -6.263 -13.777 -9.499 1.00 54.10 N ATOM 692 NH2 ARG A 425 -4.803 -15.353 -8.908 1.00 74.50 N ATOM 0 H ARG A 425 -1.346 -8.808 -10.239 1.00 23.32 H new ATOM 0 HA ARG A 425 -4.161 -9.407 -10.890 1.00 63.24 H new ATOM 0 HB2 ARG A 425 -2.679 -8.912 -8.266 1.00 44.35 H new ATOM 0 HB3 ARG A 425 -4.396 -9.245 -8.381 1.00 44.35 H new ATOM 0 HG2 ARG A 425 -2.173 -11.154 -9.223 1.00 11.44 H new ATOM 0 HG3 ARG A 425 -3.076 -11.246 -7.724 1.00 11.44 H new ATOM 0 HD2 ARG A 425 -5.204 -11.464 -9.163 1.00 73.15 H new ATOM 0 HD3 ARG A 425 -4.147 -11.659 -10.547 1.00 73.15 H new ATOM 0 HE ARG A 425 -3.147 -13.573 -8.897 1.00 52.42 H new ATOM 0 HH11 ARG A 425 -6.478 -12.805 -9.720 1.00 54.10 H new ATOM 0 HH12 ARG A 425 -7.002 -14.480 -9.519 1.00 54.10 H new ATOM 0 HH21 ARG A 425 -3.857 -15.640 -8.658 1.00 74.50 H new ATOM 0 HH22 ARG A 425 -5.555 -16.041 -8.933 1.00 74.50 H new ATOM 706 N SER A 426 -5.222 -7.144 -10.190 1.00 74.44 N ATOM 707 CA SER A 426 -5.796 -5.782 -10.152 1.00 54.20 C ATOM 708 C SER A 426 -7.216 -5.790 -9.545 1.00 30.12 C ATOM 709 O SER A 426 -8.005 -6.715 -9.768 1.00 44.42 O ATOM 710 CB SER A 426 -5.822 -5.138 -11.570 1.00 41.35 C ATOM 711 OG SER A 426 -6.682 -5.834 -12.462 1.00 70.31 O ATOM 0 H SER A 426 -5.920 -7.888 -10.185 1.00 74.44 H new ATOM 0 HA SER A 426 -5.151 -5.178 -9.513 1.00 54.20 H new ATOM 0 HB2 SER A 426 -6.148 -4.101 -11.490 1.00 41.35 H new ATOM 0 HB3 SER A 426 -4.812 -5.124 -11.979 1.00 41.35 H new ATOM 0 HG SER A 426 -6.669 -5.395 -13.338 1.00 70.31 H new ATOM 717 N LEU A 427 -7.511 -4.749 -8.753 1.00 70.40 N ATOM 718 CA LEU A 427 -8.833 -4.511 -8.126 1.00 53.40 C ATOM 719 C LEU A 427 -9.228 -3.038 -8.324 1.00 14.33 C ATOM 720 O LEU A 427 -8.363 -2.174 -8.237 1.00 34.34 O ATOM 721 CB LEU A 427 -8.774 -4.804 -6.603 1.00 23.21 C ATOM 722 CG LEU A 427 -8.608 -6.288 -6.181 1.00 32.51 C ATOM 723 CD1 LEU A 427 -8.280 -6.391 -4.676 1.00 53.03 C ATOM 724 CD2 LEU A 427 -9.867 -7.115 -6.535 1.00 62.12 C ATOM 0 H LEU A 427 -6.826 -4.029 -8.521 1.00 70.40 H new ATOM 0 HA LEU A 427 -9.564 -5.172 -8.592 1.00 53.40 H new ATOM 0 HB2 LEU A 427 -7.946 -4.236 -6.180 1.00 23.21 H new ATOM 0 HB3 LEU A 427 -9.688 -4.422 -6.148 1.00 23.21 H new ATOM 0 HG LEU A 427 -7.772 -6.707 -6.741 1.00 32.51 H new ATOM 0 HD11 LEU A 427 -8.167 -7.439 -4.399 1.00 53.03 H new ATOM 0 HD12 LEU A 427 -7.351 -5.859 -4.469 1.00 53.03 H new ATOM 0 HD13 LEU A 427 -9.089 -5.948 -4.096 1.00 53.03 H new ATOM 0 HD21 LEU A 427 -9.721 -8.150 -6.227 1.00 62.12 H new ATOM 0 HD22 LEU A 427 -10.732 -6.701 -6.016 1.00 62.12 H new ATOM 0 HD23 LEU A 427 -10.037 -7.077 -7.611 1.00 62.12 H new ATOM 736 N PRO A 428 -10.524 -2.710 -8.593 1.00 12.41 N ATOM 737 CA PRO A 428 -10.989 -1.305 -8.591 1.00 34.54 C ATOM 738 C PRO A 428 -11.058 -0.747 -7.137 1.00 63.33 C ATOM 739 O PRO A 428 -11.968 -1.083 -6.384 1.00 51.21 O ATOM 740 CB PRO A 428 -12.389 -1.370 -9.282 1.00 12.42 C ATOM 741 CG PRO A 428 -12.513 -2.780 -9.811 1.00 44.35 C ATOM 742 CD PRO A 428 -11.627 -3.639 -8.930 1.00 23.34 C ATOM 0 HA PRO A 428 -10.317 -0.626 -9.116 1.00 34.54 H new ATOM 0 HB2 PRO A 428 -13.187 -1.145 -8.574 1.00 12.42 H new ATOM 0 HB3 PRO A 428 -12.463 -0.640 -10.088 1.00 12.42 H new ATOM 0 HG2 PRO A 428 -13.548 -3.121 -9.773 1.00 44.35 H new ATOM 0 HG3 PRO A 428 -12.197 -2.835 -10.853 1.00 44.35 H new ATOM 0 HD2 PRO A 428 -12.152 -3.987 -8.040 1.00 23.34 H new ATOM 0 HD3 PRO A 428 -11.267 -4.524 -9.454 1.00 23.34 H new ATOM 750 N CYS A 429 -10.066 0.080 -6.746 1.00 33.43 N ATOM 751 CA CYS A 429 -9.934 0.605 -5.360 1.00 51.45 C ATOM 752 C CYS A 429 -10.322 2.093 -5.276 1.00 41.41 C ATOM 753 O CYS A 429 -10.055 2.872 -6.195 1.00 44.51 O ATOM 754 CB CYS A 429 -8.484 0.440 -4.860 1.00 21.12 C ATOM 755 SG CYS A 429 -7.273 1.438 -5.755 1.00 73.03 S ATOM 0 H CYS A 429 -9.333 0.405 -7.376 1.00 33.43 H new ATOM 0 HA CYS A 429 -10.615 0.030 -4.732 1.00 51.45 H new ATOM 0 HB2 CYS A 429 -8.444 0.703 -3.803 1.00 21.12 H new ATOM 0 HB3 CYS A 429 -8.202 -0.610 -4.939 1.00 21.12 H new ATOM 0 HG CYS A 429 -7.889 2.343 -6.456 1.00 73.03 H new ATOM 761 N GLN A 430 -10.934 2.480 -4.147 1.00 71.22 N ATOM 762 CA GLN A 430 -11.365 3.869 -3.885 1.00 53.30 C ATOM 763 C GLN A 430 -10.726 4.389 -2.575 1.00 71.32 C ATOM 764 O GLN A 430 -10.894 3.785 -1.518 1.00 11.33 O ATOM 765 CB GLN A 430 -12.909 3.941 -3.783 1.00 31.11 C ATOM 766 CG GLN A 430 -13.670 3.498 -5.045 1.00 62.12 C ATOM 767 CD GLN A 430 -15.190 3.693 -4.941 1.00 74.12 C ATOM 768 OE1 GLN A 430 -15.779 3.612 -3.868 1.00 33.00 O ATOM 769 NE2 GLN A 430 -15.834 3.961 -6.058 1.00 5.34 N ATOM 0 H GLN A 430 -11.147 1.838 -3.384 1.00 71.22 H new ATOM 0 HA GLN A 430 -11.036 4.497 -4.713 1.00 53.30 H new ATOM 0 HB2 GLN A 430 -13.231 3.320 -2.947 1.00 31.11 H new ATOM 0 HB3 GLN A 430 -13.194 4.966 -3.547 1.00 31.11 H new ATOM 0 HG2 GLN A 430 -13.297 4.060 -5.901 1.00 62.12 H new ATOM 0 HG3 GLN A 430 -13.458 2.446 -5.237 1.00 62.12 H new ATOM 0 HE21 GLN A 430 -15.323 4.024 -6.939 1.00 5.34 H new ATOM 0 HE22 GLN A 430 -16.844 4.106 -6.042 1.00 5.34 H new ATOM 778 N VAL A 431 -10.009 5.518 -2.648 1.00 44.52 N ATOM 779 CA VAL A 431 -9.389 6.154 -1.470 1.00 45.43 C ATOM 780 C VAL A 431 -10.395 7.105 -0.780 1.00 23.21 C ATOM 781 O VAL A 431 -10.758 8.154 -1.325 1.00 32.51 O ATOM 782 CB VAL A 431 -8.079 6.924 -1.885 1.00 30.45 C ATOM 783 CG1 VAL A 431 -7.425 7.660 -0.682 1.00 22.53 C ATOM 784 CG2 VAL A 431 -7.081 5.943 -2.550 1.00 20.12 C ATOM 0 H VAL A 431 -9.841 6.018 -3.521 1.00 44.52 H new ATOM 0 HA VAL A 431 -9.113 5.376 -0.758 1.00 45.43 H new ATOM 0 HB VAL A 431 -8.356 7.693 -2.606 1.00 30.45 H new ATOM 0 HG11 VAL A 431 -6.525 8.176 -1.017 1.00 22.53 H new ATOM 0 HG12 VAL A 431 -8.129 8.385 -0.273 1.00 22.53 H new ATOM 0 HG13 VAL A 431 -7.162 6.935 0.088 1.00 22.53 H new ATOM 0 HG21 VAL A 431 -6.177 6.481 -2.835 1.00 20.12 H new ATOM 0 HG22 VAL A 431 -6.825 5.151 -1.846 1.00 20.12 H new ATOM 0 HG23 VAL A 431 -7.538 5.505 -3.438 1.00 20.12 H new ATOM 794 N TYR A 432 -10.870 6.685 0.405 1.00 72.43 N ATOM 795 CA TYR A 432 -11.774 7.474 1.263 1.00 50.35 C ATOM 796 C TYR A 432 -10.987 8.185 2.385 1.00 1.32 C ATOM 797 O TYR A 432 -10.385 7.540 3.259 1.00 45.51 O ATOM 798 CB TYR A 432 -12.886 6.565 1.856 1.00 14.23 C ATOM 799 CG TYR A 432 -14.031 6.252 0.879 1.00 74.32 C ATOM 800 CD1 TYR A 432 -13.846 5.384 -0.189 1.00 41.11 C ATOM 801 CD2 TYR A 432 -15.296 6.840 1.019 1.00 3.45 C ATOM 802 CE1 TYR A 432 -14.870 5.108 -1.075 1.00 52.11 C ATOM 803 CE2 TYR A 432 -16.321 6.566 0.132 1.00 73.41 C ATOM 804 CZ TYR A 432 -16.103 5.697 -0.913 1.00 61.42 C ATOM 805 OH TYR A 432 -17.114 5.423 -1.812 1.00 4.54 O ATOM 0 H TYR A 432 -10.634 5.775 0.800 1.00 72.43 H new ATOM 0 HA TYR A 432 -12.247 8.241 0.650 1.00 50.35 H new ATOM 0 HB2 TYR A 432 -12.437 5.628 2.184 1.00 14.23 H new ATOM 0 HB3 TYR A 432 -13.300 7.047 2.741 1.00 14.23 H new ATOM 0 HD1 TYR A 432 -12.883 4.916 -0.330 1.00 41.11 H new ATOM 0 HD2 TYR A 432 -15.474 7.522 1.837 1.00 3.45 H new ATOM 0 HE1 TYR A 432 -14.702 4.428 -1.897 1.00 52.11 H new ATOM 0 HE2 TYR A 432 -17.287 7.031 0.259 1.00 73.41 H new ATOM 0 HH TYR A 432 -16.773 4.838 -2.520 1.00 4.54 H new ATOM 815 N VAL A 433 -11.008 9.520 2.338 1.00 61.12 N ATOM 816 CA VAL A 433 -10.328 10.398 3.309 1.00 11.31 C ATOM 817 C VAL A 433 -11.308 10.951 4.365 1.00 75.11 C ATOM 818 O VAL A 433 -12.541 10.852 4.218 1.00 43.55 O ATOM 819 CB VAL A 433 -9.633 11.597 2.567 1.00 65.41 C ATOM 820 CG1 VAL A 433 -8.499 11.092 1.649 1.00 10.21 C ATOM 821 CG2 VAL A 433 -10.673 12.426 1.767 1.00 64.23 C ATOM 0 H VAL A 433 -11.506 10.036 1.612 1.00 61.12 H new ATOM 0 HA VAL A 433 -9.578 9.795 3.820 1.00 11.31 H new ATOM 0 HB VAL A 433 -9.189 12.251 3.318 1.00 65.41 H new ATOM 0 HG11 VAL A 433 -8.033 11.940 1.146 1.00 10.21 H new ATOM 0 HG12 VAL A 433 -7.752 10.569 2.247 1.00 10.21 H new ATOM 0 HG13 VAL A 433 -8.910 10.410 0.905 1.00 10.21 H new ATOM 0 HG21 VAL A 433 -10.170 13.250 1.262 1.00 64.23 H new ATOM 0 HG22 VAL A 433 -11.156 11.787 1.027 1.00 64.23 H new ATOM 0 HG23 VAL A 433 -11.424 12.823 2.449 1.00 64.23 H new ATOM 831 N ASN A 434 -10.745 11.550 5.426 1.00 33.14 N ATOM 832 CA ASN A 434 -11.540 12.178 6.503 1.00 43.00 C ATOM 833 C ASN A 434 -12.072 13.564 6.061 1.00 51.54 C ATOM 834 O ASN A 434 -11.429 14.592 6.309 1.00 62.02 O ATOM 835 CB ASN A 434 -10.711 12.289 7.813 1.00 12.15 C ATOM 836 CG ASN A 434 -10.355 10.923 8.395 1.00 71.14 C ATOM 837 OD1 ASN A 434 -11.120 10.337 9.154 1.00 51.33 O ATOM 838 ND2 ASN A 434 -9.200 10.402 8.043 1.00 14.00 N ATOM 0 H ASN A 434 -9.737 11.615 5.565 1.00 33.14 H new ATOM 0 HA ASN A 434 -12.399 11.539 6.705 1.00 43.00 H new ATOM 0 HB2 ASN A 434 -9.795 12.846 7.614 1.00 12.15 H new ATOM 0 HB3 ASN A 434 -11.277 12.859 8.550 1.00 12.15 H new ATOM 0 HD21 ASN A 434 -8.922 9.489 8.403 1.00 14.00 H new ATOM 0 HD22 ASN A 434 -8.583 10.911 7.410 1.00 14.00 H new ATOM 884 N ASN A 438 -6.289 17.235 4.010 1.00 44.32 N ATOM 885 CA ASN A 438 -5.265 17.920 3.181 1.00 24.21 C ATOM 886 C ASN A 438 -4.941 17.104 1.899 1.00 1.42 C ATOM 887 O ASN A 438 -4.255 17.605 1.001 1.00 62.20 O ATOM 888 CB ASN A 438 -3.970 18.150 3.999 1.00 52.35 C ATOM 889 CG ASN A 438 -4.189 18.972 5.268 1.00 12.02 C ATOM 890 OD1 ASN A 438 -5.086 19.805 5.343 1.00 32.25 O ATOM 891 ND2 ASN A 438 -3.364 18.757 6.269 1.00 23.01 N ATOM 0 HA ASN A 438 -5.674 18.885 2.880 1.00 24.21 H new ATOM 0 HB2 ASN A 438 -3.545 17.184 4.270 1.00 52.35 H new ATOM 0 HB3 ASN A 438 -3.237 18.656 3.370 1.00 52.35 H new ATOM 0 HD21 ASN A 438 -3.462 19.289 7.134 1.00 23.01 H new ATOM 0 HD22 ASN A 438 -2.626 18.058 6.181 1.00 23.01 H new ATOM 898 N LEU A 439 -5.416 15.838 1.829 1.00 63.33 N ATOM 899 CA LEU A 439 -5.198 14.976 0.650 1.00 32.34 C ATOM 900 C LEU A 439 -6.170 15.358 -0.499 1.00 44.23 C ATOM 901 O LEU A 439 -7.293 14.851 -0.585 1.00 20.24 O ATOM 902 CB LEU A 439 -5.324 13.467 1.020 1.00 2.43 C ATOM 903 CG LEU A 439 -4.829 12.462 -0.069 1.00 20.32 C ATOM 904 CD1 LEU A 439 -3.354 12.723 -0.432 1.00 22.55 C ATOM 905 CD2 LEU A 439 -5.047 10.993 0.371 1.00 11.14 C ATOM 0 H LEU A 439 -5.951 15.394 2.575 1.00 63.33 H new ATOM 0 HA LEU A 439 -4.180 15.141 0.298 1.00 32.34 H new ATOM 0 HB2 LEU A 439 -4.762 13.288 1.937 1.00 2.43 H new ATOM 0 HB3 LEU A 439 -6.370 13.251 1.240 1.00 2.43 H new ATOM 0 HG LEU A 439 -5.429 12.625 -0.964 1.00 20.32 H new ATOM 0 HD11 LEU A 439 -3.035 12.010 -1.192 1.00 22.55 H new ATOM 0 HD12 LEU A 439 -3.248 13.737 -0.818 1.00 22.55 H new ATOM 0 HD13 LEU A 439 -2.734 12.607 0.457 1.00 22.55 H new ATOM 0 HD21 LEU A 439 -4.691 10.322 -0.411 1.00 11.14 H new ATOM 0 HD22 LEU A 439 -4.495 10.803 1.291 1.00 11.14 H new ATOM 0 HD23 LEU A 439 -6.109 10.818 0.543 1.00 11.14 H new ATOM 917 N LYS A 440 -5.708 16.286 -1.360 1.00 72.15 N ATOM 918 CA LYS A 440 -6.467 16.775 -2.539 1.00 72.31 C ATOM 919 C LYS A 440 -6.570 15.715 -3.671 1.00 2.22 C ATOM 920 O LYS A 440 -7.366 15.883 -4.599 1.00 24.43 O ATOM 921 CB LYS A 440 -5.773 18.052 -3.100 1.00 60.22 C ATOM 922 CG LYS A 440 -4.327 17.819 -3.613 1.00 65.05 C ATOM 923 CD LYS A 440 -3.622 19.118 -4.066 1.00 24.00 C ATOM 924 CE LYS A 440 -2.172 18.878 -4.530 1.00 0.15 C ATOM 925 NZ LYS A 440 -1.455 20.147 -4.818 1.00 24.24 N ATOM 0 H LYS A 440 -4.792 16.723 -1.260 1.00 72.15 H new ATOM 0 HA LYS A 440 -7.481 16.993 -2.204 1.00 72.31 H new ATOM 0 HB2 LYS A 440 -6.376 18.450 -3.916 1.00 60.22 H new ATOM 0 HB3 LYS A 440 -5.751 18.812 -2.319 1.00 60.22 H new ATOM 0 HG2 LYS A 440 -3.739 17.352 -2.823 1.00 65.05 H new ATOM 0 HG3 LYS A 440 -4.353 17.118 -4.447 1.00 65.05 H new ATOM 0 HD2 LYS A 440 -4.189 19.569 -4.880 1.00 24.00 H new ATOM 0 HD3 LYS A 440 -3.622 19.832 -3.243 1.00 24.00 H new ATOM 0 HE2 LYS A 440 -1.633 18.325 -3.760 1.00 0.15 H new ATOM 0 HE3 LYS A 440 -2.177 18.255 -5.425 1.00 0.15 H new ATOM 0 HZ1 LYS A 440 -0.485 19.935 -5.126 1.00 24.24 H new ATOM 0 HZ2 LYS A 440 -1.953 20.664 -5.571 1.00 24.24 H new ATOM 0 HZ3 LYS A 440 -1.425 20.732 -3.958 1.00 24.24 H new ATOM 939 N THR A 441 -5.763 14.631 -3.551 1.00 23.34 N ATOM 940 CA THR A 441 -5.459 13.666 -4.633 1.00 23.31 C ATOM 941 C THR A 441 -5.033 14.393 -5.939 1.00 23.05 C ATOM 942 O THR A 441 -3.832 14.651 -6.113 1.00 43.32 O ATOM 943 CB THR A 441 -6.580 12.587 -4.882 1.00 5.22 C ATOM 944 OG1 THR A 441 -7.820 13.187 -5.299 1.00 65.32 O ATOM 945 CG2 THR A 441 -6.821 11.737 -3.621 1.00 74.33 C ATOM 0 H THR A 441 -5.294 14.400 -2.675 1.00 23.34 H new ATOM 0 HA THR A 441 -4.605 13.089 -4.277 1.00 23.31 H new ATOM 0 HB THR A 441 -6.221 11.944 -5.686 1.00 5.22 H new ATOM 0 HG1 THR A 441 -8.559 12.567 -5.123 1.00 65.32 H new ATOM 0 HG21 THR A 441 -7.599 11.001 -3.822 1.00 74.33 H new ATOM 0 HG22 THR A 441 -5.899 11.225 -3.346 1.00 74.33 H new ATOM 0 HG23 THR A 441 -7.135 12.383 -2.801 1.00 74.33 H new ATOM 953 N GLU A 442 -6.013 14.762 -6.810 1.00 71.42 N ATOM 954 CA GLU A 442 -5.796 15.613 -8.016 1.00 61.33 C ATOM 955 C GLU A 442 -4.870 14.950 -9.078 1.00 14.45 C ATOM 956 O GLU A 442 -5.338 14.398 -10.079 1.00 53.50 O ATOM 957 CB GLU A 442 -5.257 17.014 -7.576 1.00 41.12 C ATOM 958 CG GLU A 442 -4.925 17.997 -8.719 1.00 25.52 C ATOM 959 CD GLU A 442 -4.196 19.264 -8.227 1.00 72.32 C ATOM 960 OE1 GLU A 442 -2.954 19.221 -8.064 1.00 72.40 O ATOM 961 OE2 GLU A 442 -4.858 20.301 -8.009 1.00 32.43 O ATOM 0 H GLU A 442 -6.985 14.475 -6.694 1.00 71.42 H new ATOM 0 HA GLU A 442 -6.760 15.735 -8.511 1.00 61.33 H new ATOM 0 HB2 GLU A 442 -5.998 17.479 -6.926 1.00 41.12 H new ATOM 0 HB3 GLU A 442 -4.358 16.865 -6.978 1.00 41.12 H new ATOM 0 HG2 GLU A 442 -4.304 17.491 -9.458 1.00 25.52 H new ATOM 0 HG3 GLU A 442 -5.848 18.287 -9.222 1.00 25.52 H new ATOM 968 N GLN A 443 -3.560 14.979 -8.805 1.00 70.41 N ATOM 969 CA GLN A 443 -2.494 14.541 -9.736 1.00 72.44 C ATOM 970 C GLN A 443 -2.147 13.031 -9.588 1.00 62.20 C ATOM 971 O GLN A 443 -0.982 12.625 -9.689 1.00 51.13 O ATOM 972 CB GLN A 443 -1.253 15.448 -9.487 1.00 2.25 C ATOM 973 CG GLN A 443 -0.793 15.524 -8.010 1.00 64.32 C ATOM 974 CD GLN A 443 0.253 16.610 -7.766 1.00 43.24 C ATOM 975 OE1 GLN A 443 1.450 16.370 -7.850 1.00 44.10 O ATOM 976 NE2 GLN A 443 -0.197 17.820 -7.475 1.00 53.01 N ATOM 0 H GLN A 443 -3.196 15.314 -7.913 1.00 70.41 H new ATOM 0 HA GLN A 443 -2.843 14.648 -10.763 1.00 72.44 H new ATOM 0 HB2 GLN A 443 -0.424 15.081 -10.093 1.00 2.25 H new ATOM 0 HB3 GLN A 443 -1.481 16.456 -9.835 1.00 2.25 H new ATOM 0 HG2 GLN A 443 -1.659 15.712 -7.375 1.00 64.32 H new ATOM 0 HG3 GLN A 443 -0.383 14.559 -7.713 1.00 64.32 H new ATOM 0 HE21 GLN A 443 -1.201 17.989 -7.412 1.00 53.01 H new ATOM 0 HE22 GLN A 443 0.460 18.583 -7.314 1.00 53.01 H new ATOM 985 N TRP A 444 -3.178 12.203 -9.376 1.00 43.34 N ATOM 986 CA TRP A 444 -3.047 10.728 -9.349 1.00 0.21 C ATOM 987 C TRP A 444 -3.492 10.138 -10.717 1.00 23.34 C ATOM 988 O TRP A 444 -4.456 10.641 -11.306 1.00 74.23 O ATOM 989 CB TRP A 444 -3.935 10.123 -8.224 1.00 44.01 C ATOM 990 CG TRP A 444 -3.552 10.477 -6.797 1.00 62.22 C ATOM 991 CD1 TRP A 444 -2.889 11.588 -6.345 1.00 43.34 C ATOM 992 CD2 TRP A 444 -3.848 9.696 -5.630 1.00 51.44 C ATOM 993 NE1 TRP A 444 -2.787 11.553 -4.973 1.00 65.31 N ATOM 994 CE2 TRP A 444 -3.363 10.396 -4.513 1.00 45.04 C ATOM 995 CE3 TRP A 444 -4.488 8.474 -5.431 1.00 64.54 C ATOM 996 CZ2 TRP A 444 -3.497 9.904 -3.212 1.00 40.35 C ATOM 997 CZ3 TRP A 444 -4.616 7.987 -4.148 1.00 70.11 C ATOM 998 CH2 TRP A 444 -4.130 8.703 -3.049 1.00 2.41 C ATOM 0 H TRP A 444 -4.131 12.531 -9.217 1.00 43.34 H new ATOM 0 HA TRP A 444 -2.004 10.477 -9.156 1.00 0.21 H new ATOM 0 HB2 TRP A 444 -4.963 10.443 -8.391 1.00 44.01 H new ATOM 0 HB3 TRP A 444 -3.919 9.038 -8.323 1.00 44.01 H new ATOM 0 HD1 TRP A 444 -2.503 12.376 -6.974 1.00 43.34 H new ATOM 0 HE1 TRP A 444 -2.353 12.271 -4.392 1.00 65.31 H new ATOM 0 HE3 TRP A 444 -4.878 7.917 -6.270 1.00 64.54 H new ATOM 0 HZ2 TRP A 444 -3.114 10.453 -2.365 1.00 40.35 H new ATOM 0 HZ3 TRP A 444 -5.100 7.035 -3.988 1.00 70.11 H new ATOM 0 HH2 TRP A 444 -4.257 8.300 -2.055 1.00 2.41 H new ATOM 1009 N PRO A 445 -2.797 9.079 -11.259 1.00 75.40 N ATOM 1010 CA PRO A 445 -3.293 8.315 -12.447 1.00 71.53 C ATOM 1011 C PRO A 445 -4.626 7.560 -12.168 1.00 70.35 C ATOM 1012 O PRO A 445 -5.135 7.585 -11.049 1.00 23.41 O ATOM 1013 CB PRO A 445 -2.138 7.315 -12.750 1.00 55.20 C ATOM 1014 CG PRO A 445 -1.353 7.224 -11.472 1.00 35.30 C ATOM 1015 CD PRO A 445 -1.473 8.579 -10.801 1.00 22.41 C ATOM 0 HA PRO A 445 -3.526 8.976 -13.282 1.00 71.53 H new ATOM 0 HB2 PRO A 445 -2.528 6.340 -13.044 1.00 55.20 H new ATOM 0 HB3 PRO A 445 -1.515 7.670 -13.571 1.00 55.20 H new ATOM 0 HG2 PRO A 445 -1.746 6.436 -10.830 1.00 35.30 H new ATOM 0 HG3 PRO A 445 -0.310 6.981 -11.673 1.00 35.30 H new ATOM 0 HD2 PRO A 445 -1.430 8.494 -9.715 1.00 22.41 H new ATOM 0 HD3 PRO A 445 -0.666 9.248 -11.101 1.00 22.41 H new ATOM 1023 N GLN A 446 -5.182 6.879 -13.193 1.00 73.44 N ATOM 1024 CA GLN A 446 -6.402 6.040 -13.018 1.00 13.24 C ATOM 1025 C GLN A 446 -6.066 4.642 -12.449 1.00 23.01 C ATOM 1026 O GLN A 446 -6.961 3.919 -11.999 1.00 21.25 O ATOM 1027 CB GLN A 446 -7.175 5.879 -14.351 1.00 25.31 C ATOM 1028 CG GLN A 446 -6.399 5.190 -15.503 1.00 0.41 C ATOM 1029 CD GLN A 446 -7.288 4.572 -16.602 1.00 22.03 C ATOM 1030 OE1 GLN A 446 -6.891 3.620 -17.263 1.00 44.20 O ATOM 1031 NE2 GLN A 446 -8.510 5.053 -16.771 1.00 3.01 N ATOM 0 H GLN A 446 -4.815 6.889 -14.144 1.00 73.44 H new ATOM 0 HA GLN A 446 -7.033 6.564 -12.300 1.00 13.24 H new ATOM 0 HB2 GLN A 446 -8.082 5.307 -14.156 1.00 25.31 H new ATOM 0 HB3 GLN A 446 -7.488 6.867 -14.689 1.00 25.31 H new ATOM 0 HG2 GLN A 446 -5.733 5.921 -15.962 1.00 0.41 H new ATOM 0 HG3 GLN A 446 -5.770 4.406 -15.081 1.00 0.41 H new ATOM 0 HE21 GLN A 446 -8.827 5.846 -16.214 1.00 3.01 H new ATOM 0 HE22 GLN A 446 -9.134 4.630 -17.458 1.00 3.01 H new ATOM 1040 N LYS A 447 -4.775 4.269 -12.491 1.00 33.01 N ATOM 1041 CA LYS A 447 -4.296 2.962 -12.000 1.00 51.01 C ATOM 1042 C LYS A 447 -2.921 3.100 -11.300 1.00 10.20 C ATOM 1043 O LYS A 447 -1.969 3.635 -11.875 1.00 72.31 O ATOM 1044 CB LYS A 447 -4.231 1.947 -13.168 1.00 2.23 C ATOM 1045 CG LYS A 447 -3.799 0.519 -12.759 1.00 71.42 C ATOM 1046 CD LYS A 447 -4.006 -0.514 -13.891 1.00 5.24 C ATOM 1047 CE LYS A 447 -3.200 -0.187 -15.159 1.00 20.43 C ATOM 1048 NZ LYS A 447 -1.734 -0.231 -14.921 1.00 0.32 N ATOM 0 H LYS A 447 -4.035 4.863 -12.865 1.00 33.01 H new ATOM 0 HA LYS A 447 -5.003 2.589 -11.259 1.00 51.01 H new ATOM 0 HB2 LYS A 447 -5.212 1.894 -13.641 1.00 2.23 H new ATOM 0 HB3 LYS A 447 -3.535 2.322 -13.919 1.00 2.23 H new ATOM 0 HG2 LYS A 447 -2.748 0.530 -12.471 1.00 71.42 H new ATOM 0 HG3 LYS A 447 -4.367 0.209 -11.882 1.00 71.42 H new ATOM 0 HD2 LYS A 447 -3.720 -1.502 -13.530 1.00 5.24 H new ATOM 0 HD3 LYS A 447 -5.065 -0.561 -14.143 1.00 5.24 H new ATOM 0 HE2 LYS A 447 -3.460 -0.896 -15.945 1.00 20.43 H new ATOM 0 HE3 LYS A 447 -3.478 0.804 -15.518 1.00 20.43 H new ATOM 0 HZ1 LYS A 447 -1.321 0.701 -15.127 1.00 0.32 H new ATOM 0 HZ2 LYS A 447 -1.551 -0.479 -13.928 1.00 0.32 H new ATOM 0 HZ3 LYS A 447 -1.303 -0.946 -15.541 1.00 0.32 H new ATOM 1062 N LEU A 448 -2.850 2.606 -10.051 1.00 52.44 N ATOM 1063 CA LEU A 448 -1.656 2.671 -9.191 1.00 2.31 C ATOM 1064 C LEU A 448 -0.907 1.319 -9.178 1.00 75.34 C ATOM 1065 O LEU A 448 -1.474 0.299 -8.791 1.00 1.52 O ATOM 1066 CB LEU A 448 -2.086 3.052 -7.747 1.00 11.31 C ATOM 1067 CG LEU A 448 -2.859 4.396 -7.582 1.00 35.11 C ATOM 1068 CD1 LEU A 448 -3.195 4.667 -6.097 1.00 60.14 C ATOM 1069 CD2 LEU A 448 -2.092 5.575 -8.215 1.00 20.14 C ATOM 0 H LEU A 448 -3.639 2.140 -9.602 1.00 52.44 H new ATOM 0 HA LEU A 448 -0.979 3.427 -9.588 1.00 2.31 H new ATOM 0 HB2 LEU A 448 -2.710 2.249 -7.354 1.00 11.31 H new ATOM 0 HB3 LEU A 448 -1.192 3.094 -7.125 1.00 11.31 H new ATOM 0 HG LEU A 448 -3.801 4.302 -8.121 1.00 35.11 H new ATOM 0 HD11 LEU A 448 -3.734 5.611 -6.012 1.00 60.14 H new ATOM 0 HD12 LEU A 448 -3.816 3.859 -5.711 1.00 60.14 H new ATOM 0 HD13 LEU A 448 -2.272 4.723 -5.520 1.00 60.14 H new ATOM 0 HD21 LEU A 448 -2.662 6.494 -8.080 1.00 20.14 H new ATOM 0 HD22 LEU A 448 -1.120 5.677 -7.733 1.00 20.14 H new ATOM 0 HD23 LEU A 448 -1.952 5.388 -9.280 1.00 20.14 H new ATOM 1081 N ILE A 449 0.367 1.334 -9.601 1.00 60.01 N ATOM 1082 CA ILE A 449 1.225 0.125 -9.660 1.00 24.32 C ATOM 1083 C ILE A 449 1.945 -0.073 -8.295 1.00 12.21 C ATOM 1084 O ILE A 449 2.597 0.848 -7.782 1.00 34.22 O ATOM 1085 CB ILE A 449 2.264 0.199 -10.867 1.00 55.20 C ATOM 1086 CG1 ILE A 449 1.546 0.043 -12.265 1.00 64.44 C ATOM 1087 CG2 ILE A 449 3.396 -0.863 -10.725 1.00 15.35 C ATOM 1088 CD1 ILE A 449 0.568 1.141 -12.665 1.00 4.23 C ATOM 0 H ILE A 449 0.838 2.183 -9.914 1.00 60.01 H new ATOM 0 HA ILE A 449 0.592 -0.742 -9.849 1.00 24.32 H new ATOM 0 HB ILE A 449 2.719 1.189 -10.823 1.00 55.20 H new ATOM 0 HG12 ILE A 449 2.314 -0.024 -13.035 1.00 64.44 H new ATOM 0 HG13 ILE A 449 1.010 -0.906 -12.267 1.00 64.44 H new ATOM 0 HG21 ILE A 449 4.082 -0.778 -11.568 1.00 15.35 H new ATOM 0 HG22 ILE A 449 3.940 -0.693 -9.796 1.00 15.35 H new ATOM 0 HG23 ILE A 449 2.959 -1.861 -10.712 1.00 15.35 H new ATOM 0 HD11 ILE A 449 0.146 0.913 -13.644 1.00 4.23 H new ATOM 0 HD12 ILE A 449 -0.234 1.200 -11.929 1.00 4.23 H new ATOM 0 HD13 ILE A 449 1.091 2.096 -12.709 1.00 4.23 H new ATOM 1100 N MET A 450 1.818 -1.287 -7.729 1.00 40.00 N ATOM 1101 CA MET A 450 2.251 -1.601 -6.349 1.00 14.50 C ATOM 1102 C MET A 450 3.280 -2.762 -6.307 1.00 12.43 C ATOM 1103 O MET A 450 3.118 -3.777 -6.994 1.00 4.35 O ATOM 1104 CB MET A 450 0.991 -1.951 -5.507 1.00 72.41 C ATOM 1105 CG MET A 450 1.267 -2.288 -4.040 1.00 10.50 C ATOM 1106 SD MET A 450 -0.240 -2.443 -3.047 1.00 24.03 S ATOM 1107 CE MET A 450 -0.909 -4.010 -3.591 1.00 0.11 C ATOM 0 H MET A 450 1.410 -2.085 -8.217 1.00 40.00 H new ATOM 0 HA MET A 450 2.755 -0.729 -5.932 1.00 14.50 H new ATOM 0 HB2 MET A 450 0.300 -1.109 -5.547 1.00 72.41 H new ATOM 0 HB3 MET A 450 0.487 -2.799 -5.970 1.00 72.41 H new ATOM 0 HG2 MET A 450 1.826 -3.222 -3.988 1.00 10.50 H new ATOM 0 HG3 MET A 450 1.900 -1.513 -3.609 1.00 10.50 H new ATOM 0 HE1 MET A 450 -1.291 -4.560 -2.731 1.00 0.11 H new ATOM 0 HE2 MET A 450 -1.719 -3.834 -4.299 1.00 0.11 H new ATOM 0 HE3 MET A 450 -0.125 -4.592 -4.075 1.00 0.11 H new ATOM 1117 N GLN A 451 4.343 -2.585 -5.499 1.00 22.54 N ATOM 1118 CA GLN A 451 5.338 -3.641 -5.205 1.00 25.23 C ATOM 1119 C GLN A 451 5.052 -4.267 -3.814 1.00 60.55 C ATOM 1120 O GLN A 451 5.125 -3.572 -2.795 1.00 33.14 O ATOM 1121 CB GLN A 451 6.777 -3.043 -5.239 1.00 23.21 C ATOM 1122 CG GLN A 451 7.911 -4.063 -4.973 1.00 72.33 C ATOM 1123 CD GLN A 451 9.316 -3.445 -5.027 1.00 32.31 C ATOM 1124 OE1 GLN A 451 9.951 -3.407 -6.072 1.00 33.31 O ATOM 1125 NE2 GLN A 451 9.804 -2.949 -3.907 1.00 40.21 N ATOM 0 H GLN A 451 4.539 -1.702 -5.028 1.00 22.54 H new ATOM 0 HA GLN A 451 5.263 -4.420 -5.964 1.00 25.23 H new ATOM 0 HB2 GLN A 451 6.942 -2.584 -6.214 1.00 23.21 H new ATOM 0 HB3 GLN A 451 6.842 -2.247 -4.497 1.00 23.21 H new ATOM 0 HG2 GLN A 451 7.759 -4.516 -3.993 1.00 72.33 H new ATOM 0 HG3 GLN A 451 7.847 -4.865 -5.708 1.00 72.33 H new ATOM 0 HE21 GLN A 451 9.255 -2.993 -3.048 1.00 40.21 H new ATOM 0 HE22 GLN A 451 10.730 -2.522 -3.899 1.00 40.21 H new ATOM 1134 N LEU A 452 4.709 -5.572 -3.782 1.00 71.40 N ATOM 1135 CA LEU A 452 4.537 -6.323 -2.516 1.00 61.34 C ATOM 1136 C LEU A 452 5.910 -6.587 -1.842 1.00 23.11 C ATOM 1137 O LEU A 452 6.790 -7.215 -2.433 1.00 44.13 O ATOM 1138 CB LEU A 452 3.791 -7.662 -2.764 1.00 72.44 C ATOM 1139 CG LEU A 452 2.293 -7.544 -3.199 1.00 54.34 C ATOM 1140 CD1 LEU A 452 1.727 -8.925 -3.590 1.00 40.11 C ATOM 1141 CD2 LEU A 452 1.432 -6.880 -2.085 1.00 64.20 C ATOM 0 H LEU A 452 4.545 -6.130 -4.620 1.00 71.40 H new ATOM 0 HA LEU A 452 3.934 -5.713 -1.844 1.00 61.34 H new ATOM 0 HB2 LEU A 452 4.329 -8.217 -3.532 1.00 72.44 H new ATOM 0 HB3 LEU A 452 3.838 -8.255 -1.851 1.00 72.44 H new ATOM 0 HG LEU A 452 2.248 -6.899 -4.077 1.00 54.34 H new ATOM 0 HD11 LEU A 452 0.684 -8.819 -3.889 1.00 40.11 H new ATOM 0 HD12 LEU A 452 2.303 -9.332 -4.421 1.00 40.11 H new ATOM 0 HD13 LEU A 452 1.793 -9.600 -2.737 1.00 40.11 H new ATOM 0 HD21 LEU A 452 0.396 -6.812 -2.418 1.00 64.20 H new ATOM 0 HD22 LEU A 452 1.483 -7.482 -1.178 1.00 64.20 H new ATOM 0 HD23 LEU A 452 1.813 -5.880 -1.878 1.00 64.20 H new ATOM 1153 N ILE A 453 6.080 -6.073 -0.613 1.00 3.12 N ATOM 1154 CA ILE A 453 7.290 -6.281 0.213 1.00 23.45 C ATOM 1155 C ILE A 453 6.885 -6.852 1.595 1.00 12.34 C ATOM 1156 O ILE A 453 5.790 -6.557 2.076 1.00 21.20 O ATOM 1157 CB ILE A 453 8.115 -4.943 0.401 1.00 74.23 C ATOM 1158 CG1 ILE A 453 7.242 -3.815 1.054 1.00 4.43 C ATOM 1159 CG2 ILE A 453 8.724 -4.477 -0.944 1.00 70.11 C ATOM 1160 CD1 ILE A 453 7.992 -2.520 1.362 1.00 15.03 C ATOM 0 H ILE A 453 5.375 -5.494 -0.156 1.00 3.12 H new ATOM 0 HA ILE A 453 7.932 -6.991 -0.308 1.00 23.45 H new ATOM 0 HB ILE A 453 8.936 -5.153 1.086 1.00 74.23 H new ATOM 0 HG12 ILE A 453 6.411 -3.587 0.387 1.00 4.43 H new ATOM 0 HG13 ILE A 453 6.812 -4.198 1.980 1.00 4.43 H new ATOM 0 HG21 ILE A 453 9.286 -3.556 -0.789 1.00 70.11 H new ATOM 0 HG22 ILE A 453 9.391 -5.249 -1.328 1.00 70.11 H new ATOM 0 HG23 ILE A 453 7.924 -4.298 -1.663 1.00 70.11 H new ATOM 0 HD11 ILE A 453 7.307 -1.801 1.811 1.00 15.03 H new ATOM 0 HD12 ILE A 453 8.806 -2.727 2.056 1.00 15.03 H new ATOM 0 HD13 ILE A 453 8.399 -2.107 0.439 1.00 15.03 H new ATOM 1172 N PRO A 454 7.743 -7.695 2.253 1.00 52.13 N ATOM 1173 CA PRO A 454 7.446 -8.222 3.608 1.00 50.14 C ATOM 1174 C PRO A 454 7.411 -7.100 4.686 1.00 71.21 C ATOM 1175 O PRO A 454 8.290 -6.230 4.739 1.00 64.22 O ATOM 1176 CB PRO A 454 8.585 -9.240 3.861 1.00 44.13 C ATOM 1177 CG PRO A 454 9.702 -8.782 2.974 1.00 63.33 C ATOM 1178 CD PRO A 454 9.042 -8.209 1.736 1.00 40.44 C ATOM 0 HA PRO A 454 6.457 -8.675 3.670 1.00 50.14 H new ATOM 0 HB2 PRO A 454 8.887 -9.246 4.908 1.00 44.13 H new ATOM 0 HB3 PRO A 454 8.273 -10.255 3.614 1.00 44.13 H new ATOM 0 HG2 PRO A 454 10.314 -8.031 3.473 1.00 63.33 H new ATOM 0 HG3 PRO A 454 10.361 -9.611 2.717 1.00 63.33 H new ATOM 0 HD2 PRO A 454 9.641 -7.415 1.291 1.00 40.44 H new ATOM 0 HD3 PRO A 454 8.898 -8.969 0.968 1.00 40.44 H new ATOM 1186 N GLN A 455 6.381 -7.155 5.546 1.00 43.41 N ATOM 1187 CA GLN A 455 6.117 -6.150 6.603 1.00 53.53 C ATOM 1188 C GLN A 455 7.208 -6.176 7.725 1.00 1.51 C ATOM 1189 O GLN A 455 7.307 -5.243 8.530 1.00 54.05 O ATOM 1190 CB GLN A 455 4.697 -6.407 7.182 1.00 33.32 C ATOM 1191 CG GLN A 455 4.095 -5.253 8.008 1.00 2.34 C ATOM 1192 CD GLN A 455 2.732 -5.595 8.622 1.00 71.51 C ATOM 1193 OE1 GLN A 455 2.448 -6.749 8.931 1.00 71.14 O ATOM 1194 NE2 GLN A 455 1.885 -4.601 8.815 1.00 75.31 N ATOM 0 H GLN A 455 5.694 -7.909 5.531 1.00 43.41 H new ATOM 0 HA GLN A 455 6.161 -5.152 6.167 1.00 53.53 H new ATOM 0 HB2 GLN A 455 4.022 -6.629 6.355 1.00 33.32 H new ATOM 0 HB3 GLN A 455 4.736 -7.297 7.810 1.00 33.32 H new ATOM 0 HG2 GLN A 455 4.788 -4.986 8.805 1.00 2.34 H new ATOM 0 HG3 GLN A 455 3.989 -4.375 7.370 1.00 2.34 H new ATOM 0 HE21 GLN A 455 2.145 -3.651 8.550 1.00 75.31 H new ATOM 0 HE22 GLN A 455 0.971 -4.783 9.229 1.00 75.31 H new ATOM 1203 N GLN A 456 8.023 -7.255 7.750 1.00 61.32 N ATOM 1204 CA GLN A 456 9.216 -7.367 8.630 1.00 31.10 C ATOM 1205 C GLN A 456 10.270 -6.262 8.312 1.00 2.13 C ATOM 1206 O GLN A 456 10.958 -5.774 9.210 1.00 41.13 O ATOM 1207 CB GLN A 456 9.852 -8.784 8.490 1.00 41.30 C ATOM 1208 CG GLN A 456 11.114 -9.046 9.356 1.00 45.54 C ATOM 1209 CD GLN A 456 10.865 -8.957 10.873 1.00 14.33 C ATOM 1210 OE1 GLN A 456 10.524 -9.945 11.516 1.00 31.11 O ATOM 1211 NE2 GLN A 456 11.042 -7.779 11.454 1.00 74.40 N ATOM 0 H GLN A 456 7.875 -8.075 7.161 1.00 61.32 H new ATOM 0 HA GLN A 456 8.889 -7.222 9.660 1.00 31.10 H new ATOM 0 HB2 GLN A 456 9.097 -9.527 8.747 1.00 41.30 H new ATOM 0 HB3 GLN A 456 10.113 -8.943 7.444 1.00 41.30 H new ATOM 0 HG2 GLN A 456 11.504 -10.036 9.120 1.00 45.54 H new ATOM 0 HG3 GLN A 456 11.885 -8.326 9.082 1.00 45.54 H new ATOM 0 HE21 GLN A 456 11.326 -6.973 10.897 1.00 74.40 H new ATOM 0 HE22 GLN A 456 10.895 -7.678 12.458 1.00 74.40 H new ATOM 1220 N LEU A 457 10.373 -5.870 7.025 1.00 72.32 N ATOM 1221 CA LEU A 457 11.287 -4.783 6.581 1.00 62.41 C ATOM 1222 C LEU A 457 10.751 -3.385 6.993 1.00 72.13 C ATOM 1223 O LEU A 457 11.519 -2.429 7.117 1.00 14.14 O ATOM 1224 CB LEU A 457 11.505 -4.855 5.042 1.00 24.21 C ATOM 1225 CG LEU A 457 12.058 -6.213 4.496 1.00 64.41 C ATOM 1226 CD1 LEU A 457 12.272 -6.160 2.969 1.00 35.10 C ATOM 1227 CD2 LEU A 457 13.347 -6.641 5.234 1.00 10.35 C ATOM 0 H LEU A 457 9.834 -6.289 6.267 1.00 72.32 H new ATOM 0 HA LEU A 457 12.246 -4.928 7.079 1.00 62.41 H new ATOM 0 HB2 LEU A 457 10.555 -4.647 4.549 1.00 24.21 H new ATOM 0 HB3 LEU A 457 12.194 -4.061 4.754 1.00 24.21 H new ATOM 0 HG LEU A 457 11.304 -6.975 4.695 1.00 64.41 H new ATOM 0 HD11 LEU A 457 12.657 -7.119 2.622 1.00 35.10 H new ATOM 0 HD12 LEU A 457 11.323 -5.950 2.476 1.00 35.10 H new ATOM 0 HD13 LEU A 457 12.988 -5.374 2.729 1.00 35.10 H new ATOM 0 HD21 LEU A 457 13.701 -7.588 4.828 1.00 10.35 H new ATOM 0 HD22 LEU A 457 14.114 -5.878 5.099 1.00 10.35 H new ATOM 0 HD23 LEU A 457 13.136 -6.759 6.297 1.00 10.35 H new ATOM 1239 N LEU A 458 9.425 -3.294 7.219 1.00 14.20 N ATOM 1240 CA LEU A 458 8.750 -2.036 7.634 1.00 52.25 C ATOM 1241 C LEU A 458 8.986 -1.676 9.118 1.00 53.34 C ATOM 1242 O LEU A 458 8.751 -0.531 9.516 1.00 32.24 O ATOM 1243 CB LEU A 458 7.230 -2.113 7.371 1.00 44.31 C ATOM 1244 CG LEU A 458 6.779 -2.270 5.887 1.00 74.10 C ATOM 1245 CD1 LEU A 458 5.251 -2.140 5.784 1.00 3.23 C ATOM 1246 CD2 LEU A 458 7.492 -1.262 4.956 1.00 72.31 C ATOM 0 H LEU A 458 8.789 -4.085 7.121 1.00 14.20 H new ATOM 0 HA LEU A 458 9.198 -1.249 7.027 1.00 52.25 H new ATOM 0 HB2 LEU A 458 6.830 -2.953 7.938 1.00 44.31 H new ATOM 0 HB3 LEU A 458 6.770 -1.210 7.772 1.00 44.31 H new ATOM 0 HG LEU A 458 7.069 -3.265 5.551 1.00 74.10 H new ATOM 0 HD11 LEU A 458 4.946 -2.251 4.744 1.00 3.23 H new ATOM 0 HD12 LEU A 458 4.778 -2.916 6.386 1.00 3.23 H new ATOM 0 HD13 LEU A 458 4.944 -1.160 6.150 1.00 3.23 H new ATOM 0 HD21 LEU A 458 7.148 -1.407 3.932 1.00 72.31 H new ATOM 0 HD22 LEU A 458 7.262 -0.246 5.276 1.00 72.31 H new ATOM 0 HD23 LEU A 458 8.569 -1.422 5.003 1.00 72.31 H new ATOM 1258 N THR A 459 9.413 -2.662 9.934 1.00 32.33 N ATOM 1259 CA THR A 459 9.690 -2.451 11.386 1.00 0.32 C ATOM 1260 C THR A 459 10.775 -1.366 11.626 1.00 54.54 C ATOM 1261 O THR A 459 10.795 -0.719 12.676 1.00 51.05 O ATOM 1262 CB THR A 459 10.130 -3.780 12.092 1.00 4.32 C ATOM 1263 OG1 THR A 459 11.377 -4.247 11.546 1.00 44.03 O ATOM 1264 CG2 THR A 459 9.061 -4.884 11.949 1.00 11.04 C ATOM 0 H THR A 459 9.576 -3.618 9.619 1.00 32.33 H new ATOM 0 HA THR A 459 8.751 -2.108 11.821 1.00 0.32 H new ATOM 0 HB THR A 459 10.253 -3.559 13.152 1.00 4.32 H new ATOM 0 HG1 THR A 459 11.203 -4.774 10.738 1.00 44.03 H new ATOM 0 HG21 THR A 459 9.403 -5.789 12.451 1.00 11.04 H new ATOM 0 HG22 THR A 459 8.128 -4.548 12.402 1.00 11.04 H new ATOM 0 HG23 THR A 459 8.896 -5.096 10.893 1.00 11.04 H new ATOM 1272 N THR A 460 11.650 -1.174 10.622 1.00 64.31 N ATOM 1273 CA THR A 460 12.724 -0.149 10.637 1.00 33.12 C ATOM 1274 C THR A 460 12.186 1.283 10.354 1.00 5.14 C ATOM 1275 O THR A 460 12.810 2.274 10.743 1.00 22.43 O ATOM 1276 CB THR A 460 13.824 -0.491 9.572 1.00 1.33 C ATOM 1277 OG1 THR A 460 13.262 -0.425 8.246 1.00 52.14 O ATOM 1278 CG2 THR A 460 14.424 -1.893 9.792 1.00 0.01 C ATOM 0 H THR A 460 11.636 -1.729 9.766 1.00 64.31 H new ATOM 0 HA THR A 460 13.148 -0.163 11.641 1.00 33.12 H new ATOM 0 HB THR A 460 14.622 0.244 9.684 1.00 1.33 H new ATOM 0 HG1 THR A 460 12.681 -1.200 8.098 1.00 52.14 H new ATOM 0 HG21 THR A 460 15.181 -2.088 9.032 1.00 0.01 H new ATOM 0 HG22 THR A 460 14.881 -1.942 10.781 1.00 0.01 H new ATOM 0 HG23 THR A 460 13.635 -2.642 9.719 1.00 0.01 H new ATOM 1286 N LEU A 461 11.023 1.378 9.674 1.00 32.01 N ATOM 1287 CA LEU A 461 10.448 2.672 9.210 1.00 21.33 C ATOM 1288 C LEU A 461 9.402 3.237 10.217 1.00 13.22 C ATOM 1289 O LEU A 461 8.439 3.895 9.808 1.00 42.34 O ATOM 1290 CB LEU A 461 9.784 2.483 7.810 1.00 71.15 C ATOM 1291 CG LEU A 461 10.611 1.704 6.728 1.00 31.14 C ATOM 1292 CD1 LEU A 461 9.846 1.632 5.390 1.00 34.15 C ATOM 1293 CD2 LEU A 461 12.028 2.292 6.531 1.00 45.30 C ATOM 0 H LEU A 461 10.454 0.568 9.429 1.00 32.01 H new ATOM 0 HA LEU A 461 11.264 3.391 9.140 1.00 21.33 H new ATOM 0 HB2 LEU A 461 8.837 1.962 7.952 1.00 71.15 H new ATOM 0 HB3 LEU A 461 9.549 3.470 7.411 1.00 71.15 H new ATOM 0 HG LEU A 461 10.742 0.688 7.101 1.00 31.14 H new ATOM 0 HD11 LEU A 461 10.443 1.087 4.659 1.00 34.15 H new ATOM 0 HD12 LEU A 461 8.897 1.117 5.541 1.00 34.15 H new ATOM 0 HD13 LEU A 461 9.657 2.641 5.024 1.00 34.15 H new ATOM 0 HD21 LEU A 461 12.558 1.717 5.772 1.00 45.30 H new ATOM 0 HD22 LEU A 461 11.950 3.331 6.210 1.00 45.30 H new ATOM 0 HD23 LEU A 461 12.576 2.243 7.472 1.00 45.30 H new ATOM 1305 N GLY A 462 9.627 3.015 11.526 1.00 11.21 N ATOM 1306 CA GLY A 462 8.716 3.492 12.595 1.00 11.34 C ATOM 1307 C GLY A 462 8.419 5.010 12.573 1.00 52.31 C ATOM 1308 O GLY A 462 7.249 5.398 12.486 1.00 35.21 O ATOM 0 H GLY A 462 10.438 2.504 11.875 1.00 11.21 H new ATOM 0 HA2 GLY A 462 7.773 2.952 12.515 1.00 11.34 H new ATOM 0 HA3 GLY A 462 9.150 3.236 13.562 1.00 11.34 H new ATOM 1312 N PRO A 463 9.466 5.900 12.653 1.00 51.53 N ATOM 1313 CA PRO A 463 9.304 7.379 12.481 1.00 14.01 C ATOM 1314 C PRO A 463 8.623 7.803 11.148 1.00 25.41 C ATOM 1315 O PRO A 463 7.966 8.850 11.081 1.00 64.11 O ATOM 1316 CB PRO A 463 10.760 7.905 12.541 1.00 43.33 C ATOM 1317 CG PRO A 463 11.490 6.883 13.359 1.00 15.34 C ATOM 1318 CD PRO A 463 10.878 5.551 12.981 1.00 21.52 C ATOM 0 HA PRO A 463 8.641 7.787 13.245 1.00 14.01 H new ATOM 0 HB2 PRO A 463 11.191 7.998 11.544 1.00 43.33 H new ATOM 0 HB3 PRO A 463 10.808 8.892 13.002 1.00 43.33 H new ATOM 0 HG2 PRO A 463 12.559 6.899 13.145 1.00 15.34 H new ATOM 0 HG3 PRO A 463 11.376 7.079 14.425 1.00 15.34 H new ATOM 0 HD2 PRO A 463 11.389 5.101 12.130 1.00 21.52 H new ATOM 0 HD3 PRO A 463 10.935 4.835 13.801 1.00 21.52 H new ATOM 1326 N LEU A 464 8.788 6.977 10.100 1.00 11.54 N ATOM 1327 CA LEU A 464 8.200 7.228 8.768 1.00 21.51 C ATOM 1328 C LEU A 464 6.668 6.970 8.740 1.00 33.02 C ATOM 1329 O LEU A 464 5.923 7.674 8.046 1.00 23.31 O ATOM 1330 CB LEU A 464 8.946 6.384 7.712 1.00 21.04 C ATOM 1331 CG LEU A 464 10.447 6.769 7.489 1.00 53.25 C ATOM 1332 CD1 LEU A 464 11.142 5.821 6.502 1.00 21.45 C ATOM 1333 CD2 LEU A 464 10.580 8.236 7.030 1.00 40.51 C ATOM 0 H LEU A 464 9.332 6.116 10.150 1.00 11.54 H new ATOM 0 HA LEU A 464 8.325 8.284 8.529 1.00 21.51 H new ATOM 0 HB2 LEU A 464 8.897 5.336 8.007 1.00 21.04 H new ATOM 0 HB3 LEU A 464 8.420 6.473 6.762 1.00 21.04 H new ATOM 0 HG LEU A 464 10.952 6.664 8.449 1.00 53.25 H new ATOM 0 HD11 LEU A 464 12.181 6.125 6.377 1.00 21.45 H new ATOM 0 HD12 LEU A 464 11.106 4.803 6.889 1.00 21.45 H new ATOM 0 HD13 LEU A 464 10.633 5.862 5.539 1.00 21.45 H new ATOM 0 HD21 LEU A 464 11.633 8.477 6.883 1.00 40.51 H new ATOM 0 HD22 LEU A 464 10.041 8.374 6.093 1.00 40.51 H new ATOM 0 HD23 LEU A 464 10.160 8.895 7.790 1.00 40.51 H new ATOM 1345 N PHE A 465 6.200 5.962 9.511 1.00 23.43 N ATOM 1346 CA PHE A 465 4.745 5.710 9.709 1.00 50.41 C ATOM 1347 C PHE A 465 4.147 6.671 10.762 1.00 42.22 C ATOM 1348 O PHE A 465 2.930 6.887 10.800 1.00 70.15 O ATOM 1349 CB PHE A 465 4.486 4.239 10.119 1.00 44.22 C ATOM 1350 CG PHE A 465 4.915 3.210 9.069 1.00 3.44 C ATOM 1351 CD1 PHE A 465 4.428 3.284 7.760 1.00 2.41 C ATOM 1352 CD2 PHE A 465 5.795 2.175 9.382 1.00 43.43 C ATOM 1353 CE1 PHE A 465 4.805 2.357 6.809 1.00 33.44 C ATOM 1354 CE2 PHE A 465 6.168 1.253 8.426 1.00 70.11 C ATOM 1355 CZ PHE A 465 5.675 1.345 7.142 1.00 41.33 C ATOM 0 H PHE A 465 6.804 5.308 10.008 1.00 23.43 H new ATOM 0 HA PHE A 465 4.250 5.896 8.756 1.00 50.41 H new ATOM 0 HB2 PHE A 465 5.015 4.034 11.050 1.00 44.22 H new ATOM 0 HB3 PHE A 465 3.423 4.112 10.323 1.00 44.22 H new ATOM 0 HD1 PHE A 465 3.747 4.078 7.489 1.00 2.41 H new ATOM 0 HD2 PHE A 465 6.189 2.094 10.384 1.00 43.43 H new ATOM 0 HE1 PHE A 465 4.417 2.426 5.804 1.00 33.44 H new ATOM 0 HE2 PHE A 465 6.849 0.456 8.685 1.00 70.11 H new ATOM 0 HZ PHE A 465 5.972 0.622 6.397 1.00 41.33 H new ATOM 1365 N ARG A 466 5.013 7.236 11.621 1.00 70.32 N ATOM 1366 CA ARG A 466 4.635 8.305 12.568 1.00 74.31 C ATOM 1367 C ARG A 466 4.282 9.596 11.780 1.00 2.00 C ATOM 1368 O ARG A 466 3.353 10.326 12.143 1.00 33.24 O ATOM 1369 CB ARG A 466 5.811 8.531 13.580 1.00 73.34 C ATOM 1370 CG ARG A 466 5.491 9.352 14.866 1.00 72.52 C ATOM 1371 CD ARG A 466 5.431 10.885 14.658 1.00 62.02 C ATOM 1372 NE ARG A 466 5.097 11.601 15.901 1.00 1.44 N ATOM 1373 CZ ARG A 466 3.888 11.947 16.281 1.00 20.52 C ATOM 1374 NH1 ARG A 466 2.857 11.745 15.525 1.00 41.22 N ATOM 1375 NH2 ARG A 466 3.729 12.541 17.414 1.00 63.04 N ATOM 0 H ARG A 466 5.995 6.966 11.680 1.00 70.32 H new ATOM 0 HA ARG A 466 3.751 8.019 13.139 1.00 74.31 H new ATOM 0 HB2 ARG A 466 6.186 7.555 13.886 1.00 73.34 H new ATOM 0 HB3 ARG A 466 6.621 9.033 13.051 1.00 73.34 H new ATOM 0 HG2 ARG A 466 4.535 9.016 15.266 1.00 72.52 H new ATOM 0 HG3 ARG A 466 6.247 9.131 15.619 1.00 72.52 H new ATOM 0 HD2 ARG A 466 6.392 11.237 14.285 1.00 62.02 H new ATOM 0 HD3 ARG A 466 4.688 11.118 13.895 1.00 62.02 H new ATOM 0 HE ARG A 466 5.870 11.849 16.519 1.00 1.44 H new ATOM 0 HH11 ARG A 466 2.973 11.308 14.611 1.00 41.22 H new ATOM 0 HH12 ARG A 466 1.929 12.023 15.844 1.00 41.22 H new ATOM 0 HH21 ARG A 466 4.537 12.738 18.005 1.00 63.04 H new ATOM 0 HH22 ARG A 466 2.795 12.815 17.720 1.00 63.04 H new ATOM 1389 N ASN A 467 5.031 9.845 10.687 1.00 75.42 N ATOM 1390 CA ASN A 467 4.852 11.033 9.813 1.00 53.14 C ATOM 1391 C ASN A 467 4.044 10.693 8.528 1.00 2.23 C ATOM 1392 O ASN A 467 4.299 11.255 7.462 1.00 31.24 O ATOM 1393 CB ASN A 467 6.252 11.608 9.447 1.00 63.32 C ATOM 1394 CG ASN A 467 7.009 12.204 10.641 1.00 31.13 C ATOM 1395 OD1 ASN A 467 6.808 11.820 11.789 1.00 71.51 O ATOM 1396 ND2 ASN A 467 7.906 13.130 10.373 1.00 15.30 N ATOM 0 H ASN A 467 5.782 9.227 10.380 1.00 75.42 H new ATOM 0 HA ASN A 467 4.276 11.781 10.358 1.00 53.14 H new ATOM 0 HB2 ASN A 467 6.856 10.815 9.005 1.00 63.32 H new ATOM 0 HB3 ASN A 467 6.130 12.378 8.685 1.00 63.32 H new ATOM 0 HD21 ASN A 467 8.452 13.545 11.128 1.00 15.30 H new ATOM 0 HD22 ASN A 467 8.055 13.433 9.410 1.00 15.30 H new ATOM 1403 N SER A 468 3.038 9.806 8.648 1.00 31.34 N ATOM 1404 CA SER A 468 2.162 9.419 7.505 1.00 1.43 C ATOM 1405 C SER A 468 0.662 9.506 7.894 1.00 51.01 C ATOM 1406 O SER A 468 0.290 9.148 9.019 1.00 64.31 O ATOM 1407 CB SER A 468 2.493 7.985 7.017 1.00 11.41 C ATOM 1408 OG SER A 468 2.148 7.000 7.981 1.00 52.21 O ATOM 0 H SER A 468 2.804 9.338 9.524 1.00 31.34 H new ATOM 0 HA SER A 468 2.353 10.122 6.694 1.00 1.43 H new ATOM 0 HB2 SER A 468 1.958 7.786 6.088 1.00 11.41 H new ATOM 0 HB3 SER A 468 3.557 7.915 6.793 1.00 11.41 H new ATOM 0 HG SER A 468 2.504 7.260 8.856 1.00 52.21 H new ATOM 1414 N ARG A 469 -0.188 9.984 6.957 1.00 12.31 N ATOM 1415 CA ARG A 469 -1.666 10.077 7.161 1.00 14.41 C ATOM 1416 C ARG A 469 -2.359 8.696 7.034 1.00 44.41 C ATOM 1417 O ARG A 469 -1.919 7.843 6.264 1.00 3.24 O ATOM 1418 CB ARG A 469 -2.319 11.051 6.136 1.00 50.45 C ATOM 1419 CG ARG A 469 -2.018 10.707 4.663 1.00 75.21 C ATOM 1420 CD ARG A 469 -2.877 11.481 3.646 1.00 42.44 C ATOM 1421 NE ARG A 469 -2.819 12.940 3.820 1.00 3.25 N ATOM 1422 CZ ARG A 469 -1.947 13.761 3.273 1.00 41.22 C ATOM 1423 NH1 ARG A 469 -0.917 13.323 2.609 1.00 31.41 N ATOM 1424 NH2 ARG A 469 -2.105 15.033 3.440 1.00 23.11 N ATOM 0 H ARG A 469 0.120 10.316 6.043 1.00 12.31 H new ATOM 0 HA ARG A 469 -1.807 10.455 8.173 1.00 14.41 H new ATOM 0 HB2 ARG A 469 -3.399 11.049 6.285 1.00 50.45 H new ATOM 0 HB3 ARG A 469 -1.971 12.064 6.340 1.00 50.45 H new ATOM 0 HG2 ARG A 469 -0.966 10.910 4.462 1.00 75.21 H new ATOM 0 HG3 ARG A 469 -2.171 9.638 4.512 1.00 75.21 H new ATOM 0 HD2 ARG A 469 -2.547 11.230 2.638 1.00 42.44 H new ATOM 0 HD3 ARG A 469 -3.913 11.153 3.733 1.00 42.44 H new ATOM 0 HE ARG A 469 -3.525 13.358 4.425 1.00 3.25 H new ATOM 0 HH11 ARG A 469 -0.769 12.320 2.501 1.00 31.41 H new ATOM 0 HH12 ARG A 469 -0.258 13.983 2.196 1.00 31.41 H new ATOM 0 HH21 ARG A 469 -2.893 15.382 3.986 1.00 23.11 H new ATOM 0 HH22 ARG A 469 -1.442 15.688 3.026 1.00 23.11 H new ATOM 1438 N MET A 470 -3.463 8.508 7.781 1.00 10.12 N ATOM 1439 CA MET A 470 -4.323 7.303 7.671 1.00 75.42 C ATOM 1440 C MET A 470 -5.544 7.566 6.765 1.00 45.14 C ATOM 1441 O MET A 470 -6.381 8.433 7.048 1.00 65.23 O ATOM 1442 CB MET A 470 -4.785 6.827 9.077 1.00 34.21 C ATOM 1443 CG MET A 470 -3.748 5.974 9.796 1.00 43.12 C ATOM 1444 SD MET A 470 -4.126 5.704 11.542 1.00 62.22 S ATOM 1445 CE MET A 470 -2.786 4.614 12.032 1.00 74.34 C ATOM 0 H MET A 470 -3.787 9.180 8.476 1.00 10.12 H new ATOM 0 HA MET A 470 -3.728 6.513 7.214 1.00 75.42 H new ATOM 0 HB2 MET A 470 -5.017 7.698 9.690 1.00 34.21 H new ATOM 0 HB3 MET A 470 -5.707 6.255 8.974 1.00 34.21 H new ATOM 0 HG2 MET A 470 -3.672 5.009 9.295 1.00 43.12 H new ATOM 0 HG3 MET A 470 -2.773 6.454 9.713 1.00 43.12 H new ATOM 0 HE1 MET A 470 -2.889 4.363 13.088 1.00 74.34 H new ATOM 0 HE2 MET A 470 -2.823 3.702 11.437 1.00 74.34 H new ATOM 0 HE3 MET A 470 -1.832 5.115 11.870 1.00 74.34 H new ATOM 1455 N VAL A 471 -5.619 6.797 5.675 1.00 30.30 N ATOM 1456 CA VAL A 471 -6.806 6.744 4.774 1.00 43.13 C ATOM 1457 C VAL A 471 -7.314 5.283 4.666 1.00 51.20 C ATOM 1458 O VAL A 471 -6.625 4.350 5.090 1.00 13.31 O ATOM 1459 CB VAL A 471 -6.518 7.328 3.328 1.00 43.23 C ATOM 1460 CG1 VAL A 471 -5.937 8.761 3.403 1.00 51.53 C ATOM 1461 CG2 VAL A 471 -5.605 6.401 2.484 1.00 12.10 C ATOM 0 H VAL A 471 -4.860 6.184 5.379 1.00 30.30 H new ATOM 0 HA VAL A 471 -7.572 7.379 5.219 1.00 43.13 H new ATOM 0 HB VAL A 471 -7.479 7.378 2.817 1.00 43.23 H new ATOM 0 HG11 VAL A 471 -5.751 9.131 2.395 1.00 51.53 H new ATOM 0 HG12 VAL A 471 -6.649 9.416 3.905 1.00 51.53 H new ATOM 0 HG13 VAL A 471 -5.001 8.745 3.962 1.00 51.53 H new ATOM 0 HG21 VAL A 471 -5.440 6.848 1.504 1.00 12.10 H new ATOM 0 HG22 VAL A 471 -4.648 6.273 2.991 1.00 12.10 H new ATOM 0 HG23 VAL A 471 -6.084 5.430 2.364 1.00 12.10 H new ATOM 1471 N GLN A 472 -8.522 5.092 4.103 1.00 10.54 N ATOM 1472 CA GLN A 472 -9.115 3.742 3.904 1.00 63.21 C ATOM 1473 C GLN A 472 -9.279 3.414 2.402 1.00 20.24 C ATOM 1474 O GLN A 472 -9.680 4.269 1.613 1.00 42.03 O ATOM 1475 CB GLN A 472 -10.488 3.644 4.624 1.00 3.13 C ATOM 1476 CG GLN A 472 -10.408 3.690 6.166 1.00 73.24 C ATOM 1477 CD GLN A 472 -11.769 3.487 6.841 1.00 11.11 C ATOM 1478 OE1 GLN A 472 -12.484 4.438 7.139 1.00 63.43 O ATOM 1479 NE2 GLN A 472 -12.150 2.241 7.045 1.00 53.20 N ATOM 0 H GLN A 472 -9.114 5.855 3.774 1.00 10.54 H new ATOM 0 HA GLN A 472 -8.431 3.011 4.337 1.00 63.21 H new ATOM 0 HB2 GLN A 472 -11.123 4.461 4.281 1.00 3.13 H new ATOM 0 HB3 GLN A 472 -10.975 2.716 4.326 1.00 3.13 H new ATOM 0 HG2 GLN A 472 -9.718 2.920 6.512 1.00 73.24 H new ATOM 0 HG3 GLN A 472 -9.995 4.650 6.475 1.00 73.24 H new ATOM 0 HE21 GLN A 472 -11.534 1.470 6.787 1.00 53.20 H new ATOM 0 HE22 GLN A 472 -13.061 2.048 7.461 1.00 53.20 H new ATOM 1488 N PHE A 473 -8.965 2.161 2.020 1.00 61.22 N ATOM 1489 CA PHE A 473 -9.152 1.668 0.636 1.00 51.41 C ATOM 1490 C PHE A 473 -10.424 0.791 0.545 1.00 74.42 C ATOM 1491 O PHE A 473 -10.457 -0.351 1.020 1.00 62.33 O ATOM 1492 CB PHE A 473 -7.892 0.883 0.156 1.00 10.53 C ATOM 1493 CG PHE A 473 -6.732 1.775 -0.305 1.00 72.45 C ATOM 1494 CD1 PHE A 473 -6.059 2.603 0.595 1.00 72.11 C ATOM 1495 CD2 PHE A 473 -6.322 1.788 -1.643 1.00 5.42 C ATOM 1496 CE1 PHE A 473 -5.018 3.410 0.173 1.00 42.03 C ATOM 1497 CE2 PHE A 473 -5.280 2.595 -2.060 1.00 30.14 C ATOM 1498 CZ PHE A 473 -4.629 3.407 -1.152 1.00 64.31 C ATOM 0 H PHE A 473 -8.577 1.464 2.655 1.00 61.22 H new ATOM 0 HA PHE A 473 -9.282 2.525 -0.025 1.00 51.41 H new ATOM 0 HB2 PHE A 473 -7.544 0.245 0.968 1.00 10.53 H new ATOM 0 HB3 PHE A 473 -8.178 0.226 -0.665 1.00 10.53 H new ATOM 0 HD1 PHE A 473 -6.355 2.614 1.634 1.00 72.11 H new ATOM 0 HD2 PHE A 473 -6.827 1.158 -2.360 1.00 5.42 H new ATOM 0 HE1 PHE A 473 -4.508 4.045 0.882 1.00 42.03 H new ATOM 0 HE2 PHE A 473 -4.975 2.591 -3.096 1.00 30.14 H new ATOM 0 HZ PHE A 473 -3.816 4.039 -1.478 1.00 64.31 H new ATOM 1508 N HIS A 474 -11.463 1.364 -0.073 1.00 74.15 N ATOM 1509 CA HIS A 474 -12.728 0.689 -0.391 1.00 21.12 C ATOM 1510 C HIS A 474 -12.619 0.023 -1.783 1.00 23.31 C ATOM 1511 O HIS A 474 -12.736 0.689 -2.816 1.00 63.31 O ATOM 1512 CB HIS A 474 -13.865 1.748 -0.340 1.00 51.31 C ATOM 1513 CG HIS A 474 -15.263 1.282 -0.701 1.00 41.11 C ATOM 1514 ND1 HIS A 474 -15.821 1.051 -1.922 1.00 33.34 N flip ATOM 1515 CD2 HIS A 474 -16.237 1.142 0.257 1.00 21.44 C flip ATOM 1516 CE1 HIS A 474 -17.146 0.781 -1.709 1.00 62.13 C flip ATOM 1517 NE2 HIS A 474 -17.346 0.849 -0.391 1.00 32.11 N flip ATOM 0 H HIS A 474 -11.447 2.338 -0.375 1.00 74.15 H new ATOM 0 HA HIS A 474 -12.950 -0.098 0.330 1.00 21.12 H new ATOM 0 HB2 HIS A 474 -13.897 2.162 0.668 1.00 51.31 H new ATOM 0 HB3 HIS A 474 -13.597 2.564 -1.011 1.00 51.31 H new ATOM 0 HD2 HIS A 474 -16.118 1.250 1.325 1.00 21.44 H new ATOM 0 HE1 HIS A 474 -17.887 0.556 -2.462 1.00 62.13 H new ATOM 0 HE2 HIS A 474 -18.248 0.693 0.060 1.00 32.11 H new ATOM 1525 N PHE A 475 -12.329 -1.284 -1.802 1.00 44.34 N ATOM 1526 CA PHE A 475 -12.344 -2.085 -3.044 1.00 53.44 C ATOM 1527 C PHE A 475 -13.807 -2.364 -3.456 1.00 44.42 C ATOM 1528 O PHE A 475 -14.564 -2.923 -2.673 1.00 51.11 O ATOM 1529 CB PHE A 475 -11.550 -3.401 -2.837 1.00 25.43 C ATOM 1530 CG PHE A 475 -10.063 -3.166 -2.555 1.00 73.04 C ATOM 1531 CD1 PHE A 475 -9.159 -2.991 -3.600 1.00 33.54 C ATOM 1532 CD2 PHE A 475 -9.569 -3.110 -1.252 1.00 4.44 C ATOM 1533 CE1 PHE A 475 -7.816 -2.775 -3.356 1.00 70.54 C ATOM 1534 CE2 PHE A 475 -8.223 -2.891 -1.013 1.00 53.52 C ATOM 1535 CZ PHE A 475 -7.350 -2.724 -2.063 1.00 44.13 C ATOM 0 H PHE A 475 -12.079 -1.817 -0.969 1.00 44.34 H new ATOM 0 HA PHE A 475 -11.861 -1.531 -3.849 1.00 53.44 H new ATOM 0 HB2 PHE A 475 -11.988 -3.956 -2.007 1.00 25.43 H new ATOM 0 HB3 PHE A 475 -11.651 -4.023 -3.726 1.00 25.43 H new ATOM 0 HD1 PHE A 475 -9.514 -3.025 -4.619 1.00 33.54 H new ATOM 0 HD2 PHE A 475 -10.245 -3.239 -0.419 1.00 4.44 H new ATOM 0 HE1 PHE A 475 -7.132 -2.646 -4.182 1.00 70.54 H new ATOM 0 HE2 PHE A 475 -7.857 -2.851 0.002 1.00 53.52 H new ATOM 0 HZ PHE A 475 -6.301 -2.553 -1.872 1.00 44.13 H new ATOM 1545 N THR A 476 -14.190 -1.946 -4.674 1.00 40.54 N ATOM 1546 CA THR A 476 -15.586 -2.023 -5.163 1.00 11.41 C ATOM 1547 C THR A 476 -16.093 -3.483 -5.240 1.00 20.11 C ATOM 1548 O THR A 476 -17.069 -3.849 -4.577 1.00 4.43 O ATOM 1549 CB THR A 476 -15.738 -1.345 -6.570 1.00 64.43 C ATOM 1550 OG1 THR A 476 -14.978 -2.066 -7.553 1.00 71.15 O ATOM 1551 CG2 THR A 476 -15.275 0.124 -6.562 1.00 11.11 C ATOM 0 H THR A 476 -13.543 -1.544 -5.352 1.00 40.54 H new ATOM 0 HA THR A 476 -16.195 -1.483 -4.438 1.00 11.41 H new ATOM 0 HB THR A 476 -16.799 -1.368 -6.819 1.00 64.43 H new ATOM 0 HG1 THR A 476 -15.541 -2.757 -7.960 1.00 71.15 H new ATOM 0 HG21 THR A 476 -15.399 0.550 -7.558 1.00 11.11 H new ATOM 0 HG22 THR A 476 -15.873 0.690 -5.848 1.00 11.11 H new ATOM 0 HG23 THR A 476 -14.225 0.173 -6.275 1.00 11.11 H new ATOM 1559 N ASN A 477 -15.397 -4.318 -6.033 1.00 14.32 N ATOM 1560 CA ASN A 477 -15.755 -5.739 -6.224 1.00 24.05 C ATOM 1561 C ASN A 477 -15.266 -6.606 -5.034 1.00 32.54 C ATOM 1562 O ASN A 477 -14.191 -7.226 -5.080 1.00 72.42 O ATOM 1563 CB ASN A 477 -15.198 -6.272 -7.572 1.00 62.23 C ATOM 1564 CG ASN A 477 -15.817 -5.621 -8.816 1.00 12.24 C ATOM 1565 OD1 ASN A 477 -16.196 -4.453 -8.815 1.00 2.11 O ATOM 1566 ND2 ASN A 477 -15.923 -6.377 -9.896 1.00 11.30 N ATOM 0 H ASN A 477 -14.572 -4.029 -6.559 1.00 14.32 H new ATOM 0 HA ASN A 477 -16.842 -5.810 -6.257 1.00 24.05 H new ATOM 0 HB2 ASN A 477 -14.120 -6.115 -7.593 1.00 62.23 H new ATOM 0 HB3 ASN A 477 -15.364 -7.348 -7.620 1.00 62.23 H new ATOM 0 HD21 ASN A 477 -16.326 -5.992 -10.750 1.00 11.30 H new ATOM 0 HD22 ASN A 477 -15.602 -7.345 -9.875 1.00 11.30 H new ATOM 1573 N LYS A 478 -16.075 -6.622 -3.960 1.00 53.04 N ATOM 1574 CA LYS A 478 -15.803 -7.406 -2.736 1.00 60.13 C ATOM 1575 C LYS A 478 -16.235 -8.881 -2.928 1.00 51.22 C ATOM 1576 O LYS A 478 -17.243 -9.336 -2.372 1.00 74.24 O ATOM 1577 CB LYS A 478 -16.512 -6.731 -1.529 1.00 15.34 C ATOM 1578 CG LYS A 478 -15.968 -5.324 -1.213 1.00 64.43 C ATOM 1579 CD LYS A 478 -16.888 -4.507 -0.284 1.00 31.23 C ATOM 1580 CE LYS A 478 -16.359 -3.079 -0.042 1.00 62.13 C ATOM 1581 NZ LYS A 478 -17.356 -2.221 0.638 1.00 43.11 N ATOM 0 H LYS A 478 -16.943 -6.088 -3.914 1.00 53.04 H new ATOM 0 HA LYS A 478 -14.732 -7.420 -2.532 1.00 60.13 H new ATOM 0 HB2 LYS A 478 -17.580 -6.662 -1.736 1.00 15.34 H new ATOM 0 HB3 LYS A 478 -16.398 -7.364 -0.649 1.00 15.34 H new ATOM 0 HG2 LYS A 478 -14.986 -5.418 -0.749 1.00 64.43 H new ATOM 0 HG3 LYS A 478 -15.829 -4.778 -2.146 1.00 64.43 H new ATOM 0 HD2 LYS A 478 -17.885 -4.453 -0.720 1.00 31.23 H new ATOM 0 HD3 LYS A 478 -16.986 -5.022 0.671 1.00 31.23 H new ATOM 0 HE2 LYS A 478 -15.452 -3.127 0.561 1.00 62.13 H new ATOM 0 HE3 LYS A 478 -16.085 -2.628 -0.996 1.00 62.13 H new ATOM 0 HZ1 LYS A 478 -17.357 -1.277 0.202 1.00 43.11 H new ATOM 0 HZ2 LYS A 478 -18.301 -2.646 0.545 1.00 43.11 H new ATOM 0 HZ3 LYS A 478 -17.112 -2.137 1.645 1.00 43.11 H new ATOM 1595 N ASP A 479 -15.439 -9.610 -3.739 1.00 31.42 N ATOM 1596 CA ASP A 479 -15.783 -10.965 -4.236 1.00 71.13 C ATOM 1597 C ASP A 479 -14.590 -11.613 -5.003 1.00 41.23 C ATOM 1598 O ASP A 479 -14.427 -12.839 -4.996 1.00 2.12 O ATOM 1599 CB ASP A 479 -17.035 -10.862 -5.158 1.00 4.41 C ATOM 1600 CG ASP A 479 -17.506 -12.208 -5.723 1.00 2.31 C ATOM 1601 OD1 ASP A 479 -18.150 -12.985 -4.981 1.00 2.54 O ATOM 1602 OD2 ASP A 479 -17.241 -12.495 -6.915 1.00 72.25 O ATOM 0 H ASP A 479 -14.534 -9.276 -4.071 1.00 31.42 H new ATOM 0 HA ASP A 479 -16.003 -11.607 -3.383 1.00 71.13 H new ATOM 0 HB2 ASP A 479 -17.852 -10.410 -4.595 1.00 4.41 H new ATOM 0 HB3 ASP A 479 -16.809 -10.191 -5.987 1.00 4.41 H new ATOM 1607 N LEU A 480 -13.752 -10.765 -5.638 1.00 41.31 N ATOM 1608 CA LEU A 480 -12.705 -11.198 -6.608 1.00 30.53 C ATOM 1609 C LEU A 480 -11.574 -12.071 -6.003 1.00 73.25 C ATOM 1610 O LEU A 480 -11.304 -12.034 -4.802 1.00 75.55 O ATOM 1611 CB LEU A 480 -12.127 -9.957 -7.356 1.00 23.02 C ATOM 1612 CG LEU A 480 -12.781 -9.656 -8.749 1.00 72.34 C ATOM 1613 CD1 LEU A 480 -14.321 -9.682 -8.682 1.00 40.33 C ATOM 1614 CD2 LEU A 480 -12.281 -8.320 -9.314 1.00 20.42 C ATOM 0 H LEU A 480 -13.777 -9.755 -5.496 1.00 41.31 H new ATOM 0 HA LEU A 480 -13.207 -11.858 -7.316 1.00 30.53 H new ATOM 0 HB2 LEU A 480 -12.246 -9.080 -6.719 1.00 23.02 H new ATOM 0 HB3 LEU A 480 -11.056 -10.104 -7.499 1.00 23.02 H new ATOM 0 HG LEU A 480 -12.473 -10.452 -9.427 1.00 72.34 H new ATOM 0 HD11 LEU A 480 -14.732 -9.468 -9.669 1.00 40.33 H new ATOM 0 HD12 LEU A 480 -14.654 -10.667 -8.356 1.00 40.33 H new ATOM 0 HD13 LEU A 480 -14.667 -8.929 -7.974 1.00 40.33 H new ATOM 0 HD21 LEU A 480 -12.750 -8.135 -10.280 1.00 20.42 H new ATOM 0 HD22 LEU A 480 -12.539 -7.515 -8.626 1.00 20.42 H new ATOM 0 HD23 LEU A 480 -11.199 -8.359 -9.438 1.00 20.42 H new ATOM 1626 N GLU A 481 -10.916 -12.848 -6.892 1.00 21.41 N ATOM 1627 CA GLU A 481 -9.791 -13.747 -6.540 1.00 42.35 C ATOM 1628 C GLU A 481 -8.505 -12.949 -6.199 1.00 32.01 C ATOM 1629 O GLU A 481 -7.748 -13.343 -5.309 1.00 20.31 O ATOM 1630 CB GLU A 481 -9.531 -14.744 -7.703 1.00 42.04 C ATOM 1631 CG GLU A 481 -8.296 -15.647 -7.514 1.00 73.54 C ATOM 1632 CD GLU A 481 -8.147 -16.725 -8.596 1.00 32.24 C ATOM 1633 OE1 GLU A 481 -7.535 -16.445 -9.652 1.00 52.50 O ATOM 1634 OE2 GLU A 481 -8.623 -17.860 -8.389 1.00 22.23 O ATOM 0 H GLU A 481 -11.152 -12.870 -7.884 1.00 21.41 H new ATOM 0 HA GLU A 481 -10.068 -14.306 -5.646 1.00 42.35 H new ATOM 0 HB2 GLU A 481 -10.411 -15.376 -7.825 1.00 42.04 H new ATOM 0 HB3 GLU A 481 -9.413 -14.179 -8.628 1.00 42.04 H new ATOM 0 HG2 GLU A 481 -7.400 -15.026 -7.507 1.00 73.54 H new ATOM 0 HG3 GLU A 481 -8.356 -16.130 -6.539 1.00 73.54 H new ATOM 1641 N SER A 482 -8.268 -11.835 -6.928 1.00 2.21 N ATOM 1642 CA SER A 482 -7.176 -10.866 -6.604 1.00 51.35 C ATOM 1643 C SER A 482 -7.331 -10.321 -5.160 1.00 54.25 C ATOM 1644 O SER A 482 -6.346 -10.059 -4.474 1.00 21.53 O ATOM 1645 CB SER A 482 -7.178 -9.679 -7.608 1.00 1.11 C ATOM 1646 OG SER A 482 -6.972 -10.114 -8.941 1.00 71.31 O ATOM 0 H SER A 482 -8.816 -11.577 -7.749 1.00 2.21 H new ATOM 0 HA SER A 482 -6.228 -11.398 -6.682 1.00 51.35 H new ATOM 0 HB2 SER A 482 -8.128 -9.149 -7.542 1.00 1.11 H new ATOM 0 HB3 SER A 482 -6.398 -8.970 -7.333 1.00 1.11 H new ATOM 0 HG SER A 482 -7.139 -9.371 -9.557 1.00 71.31 H new ATOM 1652 N LEU A 483 -8.599 -10.183 -4.727 1.00 44.25 N ATOM 1653 CA LEU A 483 -8.964 -9.721 -3.371 1.00 4.21 C ATOM 1654 C LEU A 483 -8.712 -10.812 -2.299 1.00 2.51 C ATOM 1655 O LEU A 483 -8.107 -10.532 -1.260 1.00 41.43 O ATOM 1656 CB LEU A 483 -10.450 -9.287 -3.368 1.00 25.42 C ATOM 1657 CG LEU A 483 -11.018 -8.785 -2.009 1.00 13.34 C ATOM 1658 CD1 LEU A 483 -10.351 -7.467 -1.549 1.00 43.51 C ATOM 1659 CD2 LEU A 483 -12.548 -8.669 -2.076 1.00 42.51 C ATOM 0 H LEU A 483 -9.407 -10.391 -5.313 1.00 44.25 H new ATOM 0 HA LEU A 483 -8.330 -8.873 -3.113 1.00 4.21 H new ATOM 0 HB2 LEU A 483 -10.577 -8.495 -4.106 1.00 25.42 H new ATOM 0 HB3 LEU A 483 -11.054 -10.131 -3.700 1.00 25.42 H new ATOM 0 HG LEU A 483 -10.773 -9.527 -1.249 1.00 13.34 H new ATOM 0 HD11 LEU A 483 -10.779 -7.156 -0.596 1.00 43.51 H new ATOM 0 HD12 LEU A 483 -9.279 -7.624 -1.431 1.00 43.51 H new ATOM 0 HD13 LEU A 483 -10.524 -6.692 -2.295 1.00 43.51 H new ATOM 0 HD21 LEU A 483 -12.929 -8.317 -1.117 1.00 42.51 H new ATOM 0 HD22 LEU A 483 -12.825 -7.962 -2.858 1.00 42.51 H new ATOM 0 HD23 LEU A 483 -12.977 -9.645 -2.300 1.00 42.51 H new ATOM 1671 N LYS A 484 -9.190 -12.046 -2.563 1.00 24.23 N ATOM 1672 CA LYS A 484 -8.983 -13.217 -1.658 1.00 34.41 C ATOM 1673 C LYS A 484 -7.479 -13.517 -1.460 1.00 12.33 C ATOM 1674 O LYS A 484 -7.038 -13.887 -0.363 1.00 72.12 O ATOM 1675 CB LYS A 484 -9.682 -14.471 -2.231 1.00 32.42 C ATOM 1676 CG LYS A 484 -11.218 -14.370 -2.371 1.00 3.51 C ATOM 1677 CD LYS A 484 -11.830 -15.672 -2.937 1.00 44.41 C ATOM 1678 CE LYS A 484 -11.633 -16.891 -2.002 1.00 20.05 C ATOM 1679 NZ LYS A 484 -11.823 -18.170 -2.721 1.00 74.31 N ATOM 0 H LYS A 484 -9.728 -12.267 -3.401 1.00 24.23 H new ATOM 0 HA LYS A 484 -9.418 -12.964 -0.691 1.00 34.41 H new ATOM 0 HB2 LYS A 484 -9.258 -14.685 -3.212 1.00 32.42 H new ATOM 0 HB3 LYS A 484 -9.448 -15.321 -1.590 1.00 32.42 H new ATOM 0 HG2 LYS A 484 -11.658 -14.155 -1.397 1.00 3.51 H new ATOM 0 HG3 LYS A 484 -11.469 -13.536 -3.026 1.00 3.51 H new ATOM 0 HD2 LYS A 484 -12.896 -15.521 -3.108 1.00 44.41 H new ATOM 0 HD3 LYS A 484 -11.379 -15.888 -3.906 1.00 44.41 H new ATOM 0 HE2 LYS A 484 -10.632 -16.861 -1.571 1.00 20.05 H new ATOM 0 HE3 LYS A 484 -12.338 -16.831 -1.173 1.00 20.05 H new ATOM 0 HZ1 LYS A 484 -11.683 -18.963 -2.062 1.00 74.31 H new ATOM 0 HZ2 LYS A 484 -12.786 -18.209 -3.111 1.00 74.31 H new ATOM 0 HZ3 LYS A 484 -11.133 -18.238 -3.496 1.00 74.31 H new ATOM 1693 N GLY A 485 -6.724 -13.357 -2.557 1.00 32.33 N ATOM 1694 CA GLY A 485 -5.269 -13.422 -2.531 1.00 63.03 C ATOM 1695 C GLY A 485 -4.655 -12.317 -1.670 1.00 12.55 C ATOM 1696 O GLY A 485 -3.813 -12.593 -0.827 1.00 14.41 O ATOM 0 H GLY A 485 -7.112 -13.179 -3.483 1.00 32.33 H new ATOM 0 HA2 GLY A 485 -4.958 -14.394 -2.148 1.00 63.03 H new ATOM 0 HA3 GLY A 485 -4.886 -13.343 -3.548 1.00 63.03 H new ATOM 1700 N LEU A 486 -5.142 -11.069 -1.856 1.00 33.22 N ATOM 1701 CA LEU A 486 -4.647 -9.867 -1.131 1.00 72.14 C ATOM 1702 C LEU A 486 -4.861 -9.981 0.412 1.00 41.13 C ATOM 1703 O LEU A 486 -4.029 -9.501 1.192 1.00 2.41 O ATOM 1704 CB LEU A 486 -5.322 -8.586 -1.706 1.00 13.33 C ATOM 1705 CG LEU A 486 -4.710 -7.212 -1.269 1.00 52.30 C ATOM 1706 CD1 LEU A 486 -3.218 -7.105 -1.664 1.00 71.13 C ATOM 1707 CD2 LEU A 486 -5.530 -6.029 -1.843 1.00 31.11 C ATOM 0 H LEU A 486 -5.893 -10.862 -2.515 1.00 33.22 H new ATOM 0 HA LEU A 486 -3.571 -9.797 -1.288 1.00 72.14 H new ATOM 0 HB2 LEU A 486 -5.288 -8.643 -2.794 1.00 13.33 H new ATOM 0 HB3 LEU A 486 -6.373 -8.597 -1.419 1.00 13.33 H new ATOM 0 HG LEU A 486 -4.763 -7.158 -0.182 1.00 52.30 H new ATOM 0 HD11 LEU A 486 -2.826 -6.139 -1.346 1.00 71.13 H new ATOM 0 HD12 LEU A 486 -2.655 -7.903 -1.179 1.00 71.13 H new ATOM 0 HD13 LEU A 486 -3.120 -7.197 -2.746 1.00 71.13 H new ATOM 0 HD21 LEU A 486 -5.083 -5.088 -1.524 1.00 31.11 H new ATOM 0 HD22 LEU A 486 -5.529 -6.080 -2.932 1.00 31.11 H new ATOM 0 HD23 LEU A 486 -6.555 -6.086 -1.478 1.00 31.11 H new ATOM 1719 N TYR A 487 -5.969 -10.637 0.831 1.00 33.41 N ATOM 1720 CA TYR A 487 -6.214 -10.994 2.255 1.00 33.44 C ATOM 1721 C TYR A 487 -5.088 -11.911 2.805 1.00 23.52 C ATOM 1722 O TYR A 487 -4.528 -11.654 3.878 1.00 21.03 O ATOM 1723 CB TYR A 487 -7.589 -11.709 2.422 1.00 54.34 C ATOM 1724 CG TYR A 487 -8.829 -10.808 2.275 1.00 4.30 C ATOM 1725 CD1 TYR A 487 -8.984 -9.669 3.065 1.00 71.51 C ATOM 1726 CD2 TYR A 487 -9.855 -11.108 1.372 1.00 42.53 C ATOM 1727 CE1 TYR A 487 -10.104 -8.866 2.959 1.00 1.52 C ATOM 1728 CE2 TYR A 487 -10.976 -10.308 1.265 1.00 24.00 C ATOM 1729 CZ TYR A 487 -11.096 -9.187 2.058 1.00 12.34 C ATOM 1730 OH TYR A 487 -12.212 -8.382 1.951 1.00 73.33 O ATOM 0 H TYR A 487 -6.714 -10.933 0.200 1.00 33.41 H new ATOM 0 HA TYR A 487 -6.223 -10.064 2.824 1.00 33.44 H new ATOM 0 HB2 TYR A 487 -7.654 -12.509 1.685 1.00 54.34 H new ATOM 0 HB3 TYR A 487 -7.617 -12.178 3.405 1.00 54.34 H new ATOM 0 HD1 TYR A 487 -8.212 -9.409 3.775 1.00 71.51 H new ATOM 0 HD2 TYR A 487 -9.769 -11.983 0.746 1.00 42.53 H new ATOM 0 HE1 TYR A 487 -10.201 -7.989 3.581 1.00 1.52 H new ATOM 0 HE2 TYR A 487 -11.756 -10.560 0.562 1.00 24.00 H new ATOM 0 HH TYR A 487 -12.815 -8.747 1.270 1.00 73.33 H new ATOM 1740 N ARG A 488 -4.769 -12.968 2.036 1.00 54.22 N ATOM 1741 CA ARG A 488 -3.721 -13.958 2.384 1.00 42.40 C ATOM 1742 C ARG A 488 -2.314 -13.312 2.454 1.00 12.35 C ATOM 1743 O ARG A 488 -1.586 -13.532 3.415 1.00 40.41 O ATOM 1744 CB ARG A 488 -3.747 -15.127 1.356 1.00 42.34 C ATOM 1745 CG ARG A 488 -2.574 -16.137 1.459 1.00 24.20 C ATOM 1746 CD ARG A 488 -2.765 -17.401 0.581 1.00 11.32 C ATOM 1747 NE ARG A 488 -3.650 -18.409 1.211 1.00 54.45 N ATOM 1748 CZ ARG A 488 -4.956 -18.507 1.061 1.00 65.20 C ATOM 1749 NH1 ARG A 488 -5.631 -17.634 0.380 1.00 2.34 N ATOM 1750 NH2 ARG A 488 -5.590 -19.483 1.630 1.00 71.50 N ATOM 0 H ARG A 488 -5.232 -13.165 1.149 1.00 54.22 H new ATOM 0 HA ARG A 488 -3.937 -14.348 3.379 1.00 42.40 H new ATOM 0 HB2 ARG A 488 -4.683 -15.672 1.476 1.00 42.34 H new ATOM 0 HB3 ARG A 488 -3.751 -14.704 0.352 1.00 42.34 H new ATOM 0 HG2 ARG A 488 -1.650 -15.639 1.167 1.00 24.20 H new ATOM 0 HG3 ARG A 488 -2.458 -16.441 2.499 1.00 24.20 H new ATOM 0 HD2 ARG A 488 -3.183 -17.109 -0.382 1.00 11.32 H new ATOM 0 HD3 ARG A 488 -1.792 -17.851 0.383 1.00 11.32 H new ATOM 0 HE ARG A 488 -3.205 -19.095 1.821 1.00 54.45 H new ATOM 0 HH11 ARG A 488 -5.152 -16.846 -0.056 1.00 2.34 H new ATOM 0 HH12 ARG A 488 -6.641 -17.735 0.280 1.00 2.34 H new ATOM 0 HH21 ARG A 488 -5.079 -20.167 2.188 1.00 71.50 H new ATOM 0 HH22 ARG A 488 -6.601 -19.568 1.520 1.00 71.50 H new ATOM 1764 N ILE A 489 -1.973 -12.500 1.436 1.00 31.15 N ATOM 1765 CA ILE A 489 -0.652 -11.824 1.314 1.00 65.10 C ATOM 1766 C ILE A 489 -0.326 -10.982 2.567 1.00 71.14 C ATOM 1767 O ILE A 489 0.689 -11.197 3.233 1.00 3.43 O ATOM 1768 CB ILE A 489 -0.661 -10.888 0.042 1.00 72.13 C ATOM 1769 CG1 ILE A 489 -0.826 -11.719 -1.267 1.00 63.31 C ATOM 1770 CG2 ILE A 489 0.594 -9.980 -0.029 1.00 70.34 C ATOM 1771 CD1 ILE A 489 -1.216 -10.895 -2.483 1.00 25.50 C ATOM 0 H ILE A 489 -2.606 -12.288 0.665 1.00 31.15 H new ATOM 0 HA ILE A 489 0.114 -12.593 1.215 1.00 65.10 H new ATOM 0 HB ILE A 489 -1.525 -10.230 0.139 1.00 72.13 H new ATOM 0 HG12 ILE A 489 0.111 -12.235 -1.477 1.00 63.31 H new ATOM 0 HG13 ILE A 489 -1.583 -12.486 -1.104 1.00 63.31 H new ATOM 0 HG21 ILE A 489 0.541 -9.355 -0.921 1.00 70.34 H new ATOM 0 HG22 ILE A 489 0.635 -9.346 0.856 1.00 70.34 H new ATOM 0 HG23 ILE A 489 1.490 -10.600 -0.073 1.00 70.34 H new ATOM 0 HD11 ILE A 489 -1.310 -11.548 -3.350 1.00 25.50 H new ATOM 0 HD12 ILE A 489 -2.169 -10.400 -2.297 1.00 25.50 H new ATOM 0 HD13 ILE A 489 -0.449 -10.145 -2.675 1.00 25.50 H new ATOM 1783 N MET A 490 -1.248 -10.076 2.901 1.00 61.40 N ATOM 1784 CA MET A 490 -1.099 -9.165 4.048 1.00 64.02 C ATOM 1785 C MET A 490 -1.179 -9.948 5.390 1.00 51.34 C ATOM 1786 O MET A 490 -0.499 -9.612 6.367 1.00 61.53 O ATOM 1787 CB MET A 490 -2.196 -8.084 3.972 1.00 33.30 C ATOM 1788 CG MET A 490 -2.158 -7.235 2.689 1.00 70.44 C ATOM 1789 SD MET A 490 -0.629 -6.293 2.523 1.00 2.32 S ATOM 1790 CE MET A 490 -0.986 -5.283 1.087 1.00 73.43 C ATOM 0 H MET A 490 -2.120 -9.950 2.387 1.00 61.40 H new ATOM 0 HA MET A 490 -0.120 -8.688 4.009 1.00 64.02 H new ATOM 0 HB2 MET A 490 -3.171 -8.566 4.047 1.00 33.30 H new ATOM 0 HB3 MET A 490 -2.100 -7.424 4.834 1.00 33.30 H new ATOM 0 HG2 MET A 490 -2.274 -7.887 1.823 1.00 70.44 H new ATOM 0 HG3 MET A 490 -3.005 -6.549 2.687 1.00 70.44 H new ATOM 0 HE1 MET A 490 -0.473 -4.326 1.179 1.00 73.43 H new ATOM 0 HE2 MET A 490 -0.642 -5.794 0.188 1.00 73.43 H new ATOM 0 HE3 MET A 490 -2.061 -5.114 1.019 1.00 73.43 H new ATOM 1800 N GLY A 491 -2.007 -11.018 5.391 1.00 24.12 N ATOM 1801 CA GLY A 491 -2.163 -11.919 6.546 1.00 75.15 C ATOM 1802 C GLY A 491 -0.945 -12.826 6.806 1.00 60.15 C ATOM 1803 O GLY A 491 -0.803 -13.386 7.899 1.00 3.35 O ATOM 0 H GLY A 491 -2.583 -11.277 4.590 1.00 24.12 H new ATOM 0 HA2 GLY A 491 -2.353 -11.320 7.437 1.00 75.15 H new ATOM 0 HA3 GLY A 491 -3.041 -12.545 6.389 1.00 75.15 H new ATOM 1807 N ASN A 492 -0.070 -12.988 5.789 1.00 41.23 N ATOM 1808 CA ASN A 492 1.215 -13.729 5.927 1.00 52.43 C ATOM 1809 C ASN A 492 2.360 -12.801 6.411 1.00 64.11 C ATOM 1810 O ASN A 492 3.506 -13.245 6.560 1.00 53.01 O ATOM 1811 CB ASN A 492 1.606 -14.392 4.575 1.00 3.42 C ATOM 1812 CG ASN A 492 0.626 -15.468 4.107 1.00 44.41 C ATOM 1813 OD1 ASN A 492 -0.054 -16.106 4.905 1.00 21.13 O ATOM 1814 ND2 ASN A 492 0.557 -15.690 2.808 1.00 41.11 N ATOM 0 H ASN A 492 -0.228 -12.614 4.853 1.00 41.23 H new ATOM 0 HA ASN A 492 1.068 -14.504 6.679 1.00 52.43 H new ATOM 0 HB2 ASN A 492 1.675 -13.619 3.809 1.00 3.42 H new ATOM 0 HB3 ASN A 492 2.597 -14.835 4.672 1.00 3.42 H new ATOM 0 HD21 ASN A 492 -0.073 -16.406 2.446 1.00 41.11 H new ATOM 0 HD22 ASN A 492 1.133 -15.145 2.166 1.00 41.11 H new ATOM 1821 N GLY A 493 2.036 -11.516 6.670 1.00 11.35 N ATOM 1822 CA GLY A 493 3.026 -10.528 7.112 1.00 24.12 C ATOM 1823 C GLY A 493 3.738 -9.834 5.948 1.00 41.33 C ATOM 1824 O GLY A 493 4.970 -9.718 5.939 1.00 35.25 O ATOM 0 H GLY A 493 1.091 -11.144 6.578 1.00 11.35 H new ATOM 0 HA2 GLY A 493 2.532 -9.777 7.728 1.00 24.12 H new ATOM 0 HA3 GLY A 493 3.767 -11.020 7.742 1.00 24.12 H new ATOM 1828 N PHE A 494 2.953 -9.389 4.949 1.00 64.21 N ATOM 1829 CA PHE A 494 3.448 -8.571 3.811 1.00 3.50 C ATOM 1830 C PHE A 494 2.778 -7.180 3.799 1.00 33.32 C ATOM 1831 O PHE A 494 1.982 -6.843 4.683 1.00 41.24 O ATOM 1832 CB PHE A 494 3.215 -9.296 2.457 1.00 43.25 C ATOM 1833 CG PHE A 494 4.101 -10.516 2.223 1.00 33.30 C ATOM 1834 CD1 PHE A 494 3.768 -11.763 2.755 1.00 74.01 C ATOM 1835 CD2 PHE A 494 5.271 -10.417 1.467 1.00 43.51 C ATOM 1836 CE1 PHE A 494 4.571 -12.865 2.542 1.00 54.12 C ATOM 1837 CE2 PHE A 494 6.076 -11.522 1.254 1.00 33.14 C ATOM 1838 CZ PHE A 494 5.724 -12.745 1.793 1.00 14.21 C ATOM 0 H PHE A 494 1.953 -9.584 4.903 1.00 64.21 H new ATOM 0 HA PHE A 494 4.521 -8.435 3.944 1.00 3.50 H new ATOM 0 HB2 PHE A 494 2.172 -9.606 2.402 1.00 43.25 H new ATOM 0 HB3 PHE A 494 3.379 -8.585 1.647 1.00 43.25 H new ATOM 0 HD1 PHE A 494 2.868 -11.867 3.343 1.00 74.01 H new ATOM 0 HD2 PHE A 494 5.551 -9.464 1.043 1.00 43.51 H new ATOM 0 HE1 PHE A 494 4.297 -13.822 2.962 1.00 54.12 H new ATOM 0 HE2 PHE A 494 6.978 -11.429 0.667 1.00 33.14 H new ATOM 0 HZ PHE A 494 6.352 -13.608 1.628 1.00 14.21 H new ATOM 1848 N ALA A 495 3.114 -6.388 2.770 1.00 33.32 N ATOM 1849 CA ALA A 495 2.681 -4.989 2.636 1.00 75.03 C ATOM 1850 C ALA A 495 2.703 -4.546 1.160 1.00 54.22 C ATOM 1851 O ALA A 495 3.387 -5.151 0.330 1.00 54.12 O ATOM 1852 CB ALA A 495 3.593 -4.100 3.480 1.00 54.12 C ATOM 0 H ALA A 495 3.701 -6.705 1.998 1.00 33.32 H new ATOM 0 HA ALA A 495 1.655 -4.896 2.992 1.00 75.03 H new ATOM 0 HB1 ALA A 495 3.277 -3.061 3.385 1.00 54.12 H new ATOM 0 HB2 ALA A 495 3.532 -4.404 4.525 1.00 54.12 H new ATOM 0 HB3 ALA A 495 4.621 -4.200 3.133 1.00 54.12 H new ATOM 1858 N GLY A 496 1.963 -3.468 0.849 1.00 74.24 N ATOM 1859 CA GLY A 496 1.831 -2.971 -0.528 1.00 44.34 C ATOM 1860 C GLY A 496 2.440 -1.582 -0.738 1.00 75.24 C ATOM 1861 O GLY A 496 1.775 -0.570 -0.515 1.00 72.14 O ATOM 0 H GLY A 496 1.445 -2.923 1.538 1.00 74.24 H new ATOM 0 HA2 GLY A 496 2.311 -3.676 -1.207 1.00 44.34 H new ATOM 0 HA3 GLY A 496 0.775 -2.940 -0.795 1.00 44.34 H new ATOM 1865 N CYS A 497 3.710 -1.531 -1.187 1.00 14.43 N ATOM 1866 CA CYS A 497 4.417 -0.251 -1.457 1.00 51.41 C ATOM 1867 C CYS A 497 4.024 0.317 -2.847 1.00 75.01 C ATOM 1868 O CYS A 497 4.580 -0.078 -3.878 1.00 33.22 O ATOM 1869 CB CYS A 497 5.947 -0.452 -1.353 1.00 30.34 C ATOM 1870 SG CYS A 497 6.901 1.080 -1.407 1.00 60.44 S ATOM 0 H CYS A 497 4.273 -2.361 -1.372 1.00 14.43 H new ATOM 0 HA CYS A 497 4.114 0.476 -0.704 1.00 51.41 H new ATOM 0 HB2 CYS A 497 6.171 -0.974 -0.422 1.00 30.34 H new ATOM 0 HB3 CYS A 497 6.273 -1.099 -2.167 1.00 30.34 H new ATOM 0 HG CYS A 497 7.529 1.160 -2.542 1.00 60.44 H new ATOM 1876 N VAL A 498 3.027 1.216 -2.855 1.00 21.12 N ATOM 1877 CA VAL A 498 2.482 1.837 -4.083 1.00 64.13 C ATOM 1878 C VAL A 498 3.326 3.062 -4.523 1.00 75.43 C ATOM 1879 O VAL A 498 3.231 4.135 -3.921 1.00 24.13 O ATOM 1880 CB VAL A 498 0.988 2.290 -3.866 1.00 51.24 C ATOM 1881 CG1 VAL A 498 0.386 2.906 -5.153 1.00 42.31 C ATOM 1882 CG2 VAL A 498 0.114 1.124 -3.348 1.00 40.12 C ATOM 0 H VAL A 498 2.569 1.539 -2.003 1.00 21.12 H new ATOM 0 HA VAL A 498 2.523 1.082 -4.868 1.00 64.13 H new ATOM 0 HB VAL A 498 0.995 3.067 -3.101 1.00 51.24 H new ATOM 0 HG11 VAL A 498 -0.645 3.206 -4.965 1.00 42.31 H new ATOM 0 HG12 VAL A 498 0.970 3.778 -5.447 1.00 42.31 H new ATOM 0 HG13 VAL A 498 0.408 2.168 -5.955 1.00 42.31 H new ATOM 0 HG21 VAL A 498 -0.910 1.471 -3.209 1.00 40.12 H new ATOM 0 HG22 VAL A 498 0.126 0.310 -4.073 1.00 40.12 H new ATOM 0 HG23 VAL A 498 0.509 0.768 -2.396 1.00 40.12 H new ATOM 1892 N HIS A 499 4.142 2.895 -5.577 1.00 34.12 N ATOM 1893 CA HIS A 499 4.997 3.982 -6.112 1.00 63.31 C ATOM 1894 C HIS A 499 4.275 4.764 -7.236 1.00 64.22 C ATOM 1895 O HIS A 499 3.798 4.174 -8.211 1.00 11.14 O ATOM 1896 CB HIS A 499 6.339 3.410 -6.641 1.00 42.04 C ATOM 1897 CG HIS A 499 7.233 2.845 -5.562 1.00 34.32 C ATOM 1898 ND1 HIS A 499 8.207 3.613 -4.968 1.00 53.42 N ATOM 1899 CD2 HIS A 499 7.251 1.608 -5.004 1.00 34.20 C ATOM 1900 CE1 HIS A 499 8.786 2.836 -4.074 1.00 70.52 C ATOM 1901 NE2 HIS A 499 8.242 1.612 -4.058 1.00 51.54 N ATOM 0 H HIS A 499 4.232 2.013 -6.082 1.00 34.12 H new ATOM 0 HA HIS A 499 5.203 4.673 -5.294 1.00 63.31 H new ATOM 0 HB2 HIS A 499 6.127 2.628 -7.370 1.00 42.04 H new ATOM 0 HB3 HIS A 499 6.876 4.199 -7.168 1.00 42.04 H new ATOM 0 HD1 HIS A 499 8.435 4.585 -5.176 1.00 53.42 H new ATOM 0 HD2 HIS A 499 6.607 0.779 -5.257 1.00 34.20 H new ATOM 0 HE1 HIS A 499 9.598 3.148 -3.434 1.00 70.52 H new ATOM 1909 N PHE A 500 4.201 6.096 -7.077 1.00 31.22 N ATOM 1910 CA PHE A 500 3.642 7.019 -8.092 1.00 34.44 C ATOM 1911 C PHE A 500 4.794 7.561 -8.982 1.00 1.11 C ATOM 1912 O PHE A 500 5.696 8.218 -8.456 1.00 72.42 O ATOM 1913 CB PHE A 500 2.910 8.196 -7.401 1.00 75.20 C ATOM 1914 CG PHE A 500 1.649 7.829 -6.611 1.00 1.31 C ATOM 1915 CD1 PHE A 500 1.682 6.887 -5.576 1.00 73.41 C ATOM 1916 CD2 PHE A 500 0.432 8.452 -6.887 1.00 21.45 C ATOM 1917 CE1 PHE A 500 0.544 6.584 -4.857 1.00 73.01 C ATOM 1918 CE2 PHE A 500 -0.699 8.144 -6.166 1.00 73.25 C ATOM 1919 CZ PHE A 500 -0.647 7.213 -5.152 1.00 65.14 C ATOM 0 H PHE A 500 4.529 6.571 -6.236 1.00 31.22 H new ATOM 0 HA PHE A 500 2.925 6.480 -8.711 1.00 34.44 H new ATOM 0 HB2 PHE A 500 3.610 8.686 -6.724 1.00 75.20 H new ATOM 0 HB3 PHE A 500 2.638 8.927 -8.163 1.00 75.20 H new ATOM 0 HD1 PHE A 500 2.611 6.391 -5.337 1.00 73.41 H new ATOM 0 HD2 PHE A 500 0.376 9.186 -7.677 1.00 21.45 H new ATOM 0 HE1 PHE A 500 0.586 5.854 -4.063 1.00 73.01 H new ATOM 0 HE2 PHE A 500 -1.633 8.635 -6.397 1.00 73.25 H new ATOM 0 HZ PHE A 500 -1.538 6.976 -4.589 1.00 65.14 H new ATOM 1929 N PRO A 501 4.780 7.300 -10.336 1.00 25.00 N ATOM 1930 CA PRO A 501 5.930 7.617 -11.249 1.00 52.10 C ATOM 1931 C PRO A 501 6.346 9.125 -11.275 1.00 55.24 C ATOM 1932 O PRO A 501 7.533 9.447 -11.165 1.00 74.13 O ATOM 1933 CB PRO A 501 5.430 7.135 -12.649 1.00 33.10 C ATOM 1934 CG PRO A 501 3.933 7.071 -12.522 1.00 4.33 C ATOM 1935 CD PRO A 501 3.660 6.673 -11.087 1.00 44.45 C ATOM 0 HA PRO A 501 6.841 7.123 -10.910 1.00 52.10 H new ATOM 0 HB2 PRO A 501 5.731 7.827 -13.436 1.00 33.10 H new ATOM 0 HB3 PRO A 501 5.847 6.161 -12.904 1.00 33.10 H new ATOM 0 HG2 PRO A 501 3.479 8.034 -12.754 1.00 4.33 H new ATOM 0 HG3 PRO A 501 3.512 6.344 -13.217 1.00 4.33 H new ATOM 0 HD2 PRO A 501 2.692 7.040 -10.745 1.00 44.45 H new ATOM 0 HD3 PRO A 501 3.651 5.590 -10.965 1.00 44.45 H new ATOM 2024 N VAL A 508 1.790 12.864 -2.952 1.00 50.40 N ATOM 2025 CA VAL A 508 1.938 11.409 -2.738 1.00 65.03 C ATOM 2026 C VAL A 508 2.957 10.791 -3.716 1.00 72.33 C ATOM 2027 O VAL A 508 2.593 10.306 -4.785 1.00 2.35 O ATOM 2028 CB VAL A 508 0.557 10.668 -2.857 1.00 25.51 C ATOM 2029 CG1 VAL A 508 0.653 9.192 -2.379 1.00 71.34 C ATOM 2030 CG2 VAL A 508 -0.533 11.446 -2.096 1.00 5.23 C ATOM 0 HA VAL A 508 2.315 11.276 -1.724 1.00 65.03 H new ATOM 0 HB VAL A 508 0.278 10.636 -3.910 1.00 25.51 H new ATOM 0 HG11 VAL A 508 -0.322 8.714 -2.477 1.00 71.34 H new ATOM 0 HG12 VAL A 508 1.382 8.659 -2.989 1.00 71.34 H new ATOM 0 HG13 VAL A 508 0.966 9.167 -1.335 1.00 71.34 H new ATOM 0 HG21 VAL A 508 -1.484 10.922 -2.187 1.00 5.23 H new ATOM 0 HG22 VAL A 508 -0.259 11.521 -1.044 1.00 5.23 H new ATOM 0 HG23 VAL A 508 -0.628 12.446 -2.518 1.00 5.23 H new ATOM 2040 N ARG A 509 4.239 10.869 -3.340 1.00 53.31 N ATOM 2041 CA ARG A 509 5.353 10.222 -4.070 1.00 50.53 C ATOM 2042 C ARG A 509 5.224 8.675 -4.007 1.00 15.12 C ATOM 2043 O ARG A 509 5.463 7.967 -4.996 1.00 22.25 O ATOM 2044 CB ARG A 509 6.689 10.723 -3.453 1.00 0.52 C ATOM 2045 CG ARG A 509 7.996 10.197 -4.093 1.00 35.33 C ATOM 2046 CD ARG A 509 8.130 10.495 -5.614 1.00 12.53 C ATOM 2047 NE ARG A 509 7.787 9.325 -6.447 1.00 34.12 N ATOM 2048 CZ ARG A 509 8.662 8.476 -6.959 1.00 22.22 C ATOM 2049 NH1 ARG A 509 9.943 8.639 -6.797 1.00 20.33 N ATOM 2050 NH2 ARG A 509 8.243 7.470 -7.646 1.00 61.54 N ATOM 0 H ARG A 509 4.542 11.386 -2.515 1.00 53.31 H new ATOM 0 HA ARG A 509 5.326 10.490 -5.126 1.00 50.53 H new ATOM 0 HB2 ARG A 509 6.700 11.812 -3.505 1.00 0.52 H new ATOM 0 HB3 ARG A 509 6.697 10.455 -2.397 1.00 0.52 H new ATOM 0 HG2 ARG A 509 8.845 10.639 -3.572 1.00 35.33 H new ATOM 0 HG3 ARG A 509 8.054 9.119 -3.939 1.00 35.33 H new ATOM 0 HD2 ARG A 509 7.479 11.329 -5.877 1.00 12.53 H new ATOM 0 HD3 ARG A 509 9.151 10.807 -5.832 1.00 12.53 H new ATOM 0 HE ARG A 509 6.800 9.159 -6.642 1.00 34.12 H new ATOM 0 HH11 ARG A 509 10.292 9.436 -6.265 1.00 20.33 H new ATOM 0 HH12 ARG A 509 10.598 7.970 -7.202 1.00 20.33 H new ATOM 0 HH21 ARG A 509 7.243 7.333 -7.792 1.00 61.54 H new ATOM 0 HH22 ARG A 509 8.911 6.811 -8.044 1.00 61.54 H new ATOM 2064 N VAL A 510 4.832 8.188 -2.820 1.00 23.24 N ATOM 2065 CA VAL A 510 4.599 6.753 -2.528 1.00 12.10 C ATOM 2066 C VAL A 510 3.621 6.613 -1.322 1.00 52.11 C ATOM 2067 O VAL A 510 3.449 7.562 -0.551 1.00 42.35 O ATOM 2068 CB VAL A 510 5.980 6.034 -2.235 1.00 4.13 C ATOM 2069 CG1 VAL A 510 6.719 6.724 -1.065 1.00 23.20 C ATOM 2070 CG2 VAL A 510 5.830 4.507 -1.982 1.00 32.44 C ATOM 0 H VAL A 510 4.662 8.789 -2.014 1.00 23.24 H new ATOM 0 HA VAL A 510 4.143 6.271 -3.393 1.00 12.10 H new ATOM 0 HB VAL A 510 6.583 6.135 -3.138 1.00 4.13 H new ATOM 0 HG11 VAL A 510 7.665 6.214 -0.881 1.00 23.20 H new ATOM 0 HG12 VAL A 510 6.912 7.766 -1.321 1.00 23.20 H new ATOM 0 HG13 VAL A 510 6.102 6.679 -0.168 1.00 23.20 H new ATOM 0 HG21 VAL A 510 6.810 4.072 -1.787 1.00 32.44 H new ATOM 0 HG22 VAL A 510 5.183 4.343 -1.120 1.00 32.44 H new ATOM 0 HG23 VAL A 510 5.391 4.034 -2.861 1.00 32.44 H new ATOM 2080 N LEU A 511 2.945 5.457 -1.192 1.00 63.44 N ATOM 2081 CA LEU A 511 2.167 5.106 0.023 1.00 11.30 C ATOM 2082 C LEU A 511 2.280 3.597 0.336 1.00 53.33 C ATOM 2083 O LEU A 511 2.744 2.816 -0.496 1.00 25.43 O ATOM 2084 CB LEU A 511 0.677 5.578 -0.112 1.00 35.45 C ATOM 2085 CG LEU A 511 -0.251 4.885 -1.191 1.00 74.12 C ATOM 2086 CD1 LEU A 511 -0.884 3.568 -0.677 1.00 33.44 C ATOM 2087 CD2 LEU A 511 -1.357 5.852 -1.697 1.00 52.04 C ATOM 0 H LEU A 511 2.919 4.740 -1.917 1.00 63.44 H new ATOM 0 HA LEU A 511 2.594 5.638 0.873 1.00 11.30 H new ATOM 0 HB2 LEU A 511 0.202 5.452 0.861 1.00 35.45 H new ATOM 0 HB3 LEU A 511 0.688 6.647 -0.325 1.00 35.45 H new ATOM 0 HG LEU A 511 0.399 4.630 -2.028 1.00 74.12 H new ATOM 0 HD11 LEU A 511 -1.510 3.136 -1.458 1.00 33.44 H new ATOM 0 HD12 LEU A 511 -0.095 2.864 -0.414 1.00 33.44 H new ATOM 0 HD13 LEU A 511 -1.493 3.776 0.203 1.00 33.44 H new ATOM 0 HD21 LEU A 511 -1.975 5.343 -2.436 1.00 52.04 H new ATOM 0 HD22 LEU A 511 -1.979 6.165 -0.858 1.00 52.04 H new ATOM 0 HD23 LEU A 511 -0.894 6.728 -2.152 1.00 52.04 H new ATOM 2099 N MET A 512 1.865 3.193 1.554 1.00 63.54 N ATOM 2100 CA MET A 512 1.799 1.765 1.951 1.00 64.24 C ATOM 2101 C MET A 512 0.347 1.310 2.135 1.00 62.32 C ATOM 2102 O MET A 512 -0.470 2.033 2.697 1.00 54.41 O ATOM 2103 CB MET A 512 2.575 1.510 3.265 1.00 21.20 C ATOM 2104 CG MET A 512 4.067 1.819 3.174 1.00 30.02 C ATOM 2105 SD MET A 512 4.911 0.950 1.830 1.00 13.33 S ATOM 2106 CE MET A 512 4.674 -0.766 2.285 1.00 33.43 C ATOM 0 H MET A 512 1.568 3.838 2.286 1.00 63.54 H new ATOM 0 HA MET A 512 2.259 1.191 1.147 1.00 64.24 H new ATOM 0 HB2 MET A 512 2.136 2.116 4.058 1.00 21.20 H new ATOM 0 HB3 MET A 512 2.447 0.467 3.554 1.00 21.20 H new ATOM 0 HG2 MET A 512 4.199 2.893 3.039 1.00 30.02 H new ATOM 0 HG3 MET A 512 4.542 1.556 4.119 1.00 30.02 H new ATOM 0 HE1 MET A 512 5.145 -1.408 1.541 1.00 33.43 H new ATOM 0 HE2 MET A 512 5.125 -0.949 3.260 1.00 33.43 H new ATOM 0 HE3 MET A 512 3.607 -0.986 2.331 1.00 33.43 H new ATOM 2116 N LEU A 513 0.044 0.095 1.678 1.00 73.40 N ATOM 2117 CA LEU A 513 -1.246 -0.562 1.935 1.00 41.51 C ATOM 2118 C LEU A 513 -1.035 -1.618 3.040 1.00 42.10 C ATOM 2119 O LEU A 513 -0.271 -2.572 2.851 1.00 0.21 O ATOM 2120 CB LEU A 513 -1.795 -1.223 0.645 1.00 32.43 C ATOM 2121 CG LEU A 513 -3.214 -1.872 0.776 1.00 12.05 C ATOM 2122 CD1 LEU A 513 -4.304 -0.799 0.964 1.00 12.41 C ATOM 2123 CD2 LEU A 513 -3.535 -2.803 -0.413 1.00 22.04 C ATOM 0 H LEU A 513 0.685 -0.466 1.117 1.00 73.40 H new ATOM 0 HA LEU A 513 -1.980 0.176 2.258 1.00 41.51 H new ATOM 0 HB2 LEU A 513 -1.829 -0.470 -0.143 1.00 32.43 H new ATOM 0 HB3 LEU A 513 -1.091 -1.990 0.322 1.00 32.43 H new ATOM 0 HG LEU A 513 -3.203 -2.493 1.672 1.00 12.05 H new ATOM 0 HD11 LEU A 513 -5.278 -1.281 1.052 1.00 12.41 H new ATOM 0 HD12 LEU A 513 -4.099 -0.227 1.869 1.00 12.41 H new ATOM 0 HD13 LEU A 513 -4.307 -0.129 0.104 1.00 12.41 H new ATOM 0 HD21 LEU A 513 -4.528 -3.232 -0.281 1.00 22.04 H new ATOM 0 HD22 LEU A 513 -3.506 -2.231 -1.341 1.00 22.04 H new ATOM 0 HD23 LEU A 513 -2.797 -3.604 -0.457 1.00 22.04 H new ATOM 2135 N LEU A 514 -1.686 -1.423 4.197 1.00 34.43 N ATOM 2136 CA LEU A 514 -1.565 -2.321 5.366 1.00 10.55 C ATOM 2137 C LEU A 514 -2.959 -2.767 5.836 1.00 11.54 C ATOM 2138 O LEU A 514 -3.714 -1.981 6.407 1.00 24.24 O ATOM 2139 CB LEU A 514 -0.804 -1.600 6.519 1.00 2.10 C ATOM 2140 CG LEU A 514 0.690 -1.245 6.225 1.00 64.30 C ATOM 2141 CD1 LEU A 514 1.312 -0.401 7.354 1.00 14.31 C ATOM 2142 CD2 LEU A 514 1.524 -2.516 5.971 1.00 64.22 C ATOM 0 H LEU A 514 -2.315 -0.636 4.353 1.00 34.43 H new ATOM 0 HA LEU A 514 -0.998 -3.205 5.076 1.00 10.55 H new ATOM 0 HB2 LEU A 514 -1.336 -0.680 6.762 1.00 2.10 H new ATOM 0 HB3 LEU A 514 -0.841 -2.233 7.406 1.00 2.10 H new ATOM 0 HG LEU A 514 0.703 -0.640 5.318 1.00 64.30 H new ATOM 0 HD11 LEU A 514 2.350 -0.176 7.110 1.00 14.31 H new ATOM 0 HD12 LEU A 514 0.755 0.530 7.462 1.00 14.31 H new ATOM 0 HD13 LEU A 514 1.271 -0.959 8.290 1.00 14.31 H new ATOM 0 HD21 LEU A 514 2.559 -2.238 5.769 1.00 64.22 H new ATOM 0 HD22 LEU A 514 1.486 -3.158 6.851 1.00 64.22 H new ATOM 0 HD23 LEU A 514 1.118 -3.052 5.113 1.00 64.22 H new ATOM 2154 N TYR A 515 -3.292 -4.030 5.574 1.00 32.02 N ATOM 2155 CA TYR A 515 -4.584 -4.622 5.961 1.00 60.05 C ATOM 2156 C TYR A 515 -4.654 -4.869 7.489 1.00 72.24 C ATOM 2157 O TYR A 515 -3.892 -5.681 8.027 1.00 53.13 O ATOM 2158 CB TYR A 515 -4.793 -5.940 5.180 1.00 12.51 C ATOM 2159 CG TYR A 515 -6.046 -6.736 5.559 1.00 44.34 C ATOM 2160 CD1 TYR A 515 -7.314 -6.177 5.425 1.00 63.51 C ATOM 2161 CD2 TYR A 515 -5.963 -8.050 6.040 1.00 61.32 C ATOM 2162 CE1 TYR A 515 -8.444 -6.894 5.749 1.00 21.33 C ATOM 2163 CE2 TYR A 515 -7.100 -8.764 6.371 1.00 43.43 C ATOM 2164 CZ TYR A 515 -8.333 -8.181 6.222 1.00 44.10 C ATOM 2165 OH TYR A 515 -9.470 -8.892 6.522 1.00 52.34 O ATOM 0 H TYR A 515 -2.675 -4.679 5.086 1.00 32.02 H new ATOM 0 HA TYR A 515 -5.382 -3.923 5.711 1.00 60.05 H new ATOM 0 HB2 TYR A 515 -4.838 -5.709 4.116 1.00 12.51 H new ATOM 0 HB3 TYR A 515 -3.920 -6.575 5.332 1.00 12.51 H new ATOM 0 HD1 TYR A 515 -7.413 -5.165 5.061 1.00 63.51 H new ATOM 0 HD2 TYR A 515 -4.994 -8.513 6.154 1.00 61.32 H new ATOM 0 HE1 TYR A 515 -9.419 -6.445 5.632 1.00 21.33 H new ATOM 0 HE2 TYR A 515 -7.018 -9.774 6.744 1.00 43.43 H new ATOM 0 HH TYR A 515 -9.223 -9.784 6.843 1.00 52.34 H new ATOM 2175 N SER A 516 -5.556 -4.141 8.171 1.00 2.14 N ATOM 2176 CA SER A 516 -5.875 -4.380 9.587 1.00 44.21 C ATOM 2177 C SER A 516 -6.590 -5.741 9.751 1.00 74.22 C ATOM 2178 O SER A 516 -7.756 -5.891 9.368 1.00 73.51 O ATOM 2179 CB SER A 516 -6.767 -3.242 10.139 1.00 61.14 C ATOM 2180 OG SER A 516 -6.153 -1.976 9.978 1.00 21.03 O ATOM 0 H SER A 516 -6.082 -3.372 7.756 1.00 2.14 H new ATOM 0 HA SER A 516 -4.944 -4.400 10.153 1.00 44.21 H new ATOM 0 HB2 SER A 516 -7.728 -3.249 9.624 1.00 61.14 H new ATOM 0 HB3 SER A 516 -6.970 -3.417 11.196 1.00 61.14 H new ATOM 0 HG SER A 516 -6.445 -1.377 10.696 1.00 21.03 H new ATOM 2186 N SER A 517 -5.866 -6.727 10.307 1.00 53.14 N ATOM 2187 CA SER A 517 -6.378 -8.102 10.543 1.00 51.25 C ATOM 2188 C SER A 517 -7.522 -8.130 11.588 1.00 51.21 C ATOM 2189 O SER A 517 -8.389 -9.007 11.548 1.00 12.32 O ATOM 2190 CB SER A 517 -5.220 -9.016 11.018 1.00 23.04 C ATOM 2191 OG SER A 517 -4.666 -8.558 12.247 1.00 23.54 O ATOM 0 H SER A 517 -4.901 -6.599 10.610 1.00 53.14 H new ATOM 0 HA SER A 517 -6.784 -8.466 9.599 1.00 51.25 H new ATOM 0 HB2 SER A 517 -5.586 -10.035 11.140 1.00 23.04 H new ATOM 0 HB3 SER A 517 -4.442 -9.046 10.255 1.00 23.04 H new ATOM 0 HG SER A 517 -3.939 -9.156 12.521 1.00 23.54 H new ATOM 2197 N LYS A 518 -7.496 -7.161 12.519 1.00 34.41 N ATOM 2198 CA LYS A 518 -8.478 -7.049 13.629 1.00 1.33 C ATOM 2199 C LYS A 518 -9.770 -6.290 13.195 1.00 50.41 C ATOM 2200 O LYS A 518 -10.860 -6.556 13.709 1.00 62.54 O ATOM 2201 CB LYS A 518 -7.797 -6.322 14.822 1.00 30.23 C ATOM 2202 CG LYS A 518 -6.450 -6.949 15.264 1.00 32.20 C ATOM 2203 CD LYS A 518 -5.750 -6.147 16.387 1.00 23.42 C ATOM 2204 CE LYS A 518 -4.350 -6.703 16.726 1.00 41.30 C ATOM 2205 NZ LYS A 518 -4.408 -8.117 17.191 1.00 25.50 N ATOM 0 H LYS A 518 -6.790 -6.424 12.529 1.00 34.41 H new ATOM 0 HA LYS A 518 -8.787 -8.052 13.923 1.00 1.33 H new ATOM 0 HB2 LYS A 518 -7.628 -5.280 14.549 1.00 30.23 H new ATOM 0 HB3 LYS A 518 -8.481 -6.322 15.671 1.00 30.23 H new ATOM 0 HG2 LYS A 518 -6.625 -7.968 15.608 1.00 32.20 H new ATOM 0 HG3 LYS A 518 -5.785 -7.013 14.402 1.00 32.20 H new ATOM 0 HD2 LYS A 518 -5.659 -5.104 16.082 1.00 23.42 H new ATOM 0 HD3 LYS A 518 -6.371 -6.164 17.283 1.00 23.42 H new ATOM 0 HE2 LYS A 518 -3.711 -6.637 15.845 1.00 41.30 H new ATOM 0 HE3 LYS A 518 -3.892 -6.086 17.499 1.00 41.30 H new ATOM 0 HZ1 LYS A 518 -3.454 -8.435 17.456 1.00 25.50 H new ATOM 0 HZ2 LYS A 518 -5.037 -8.186 18.016 1.00 25.50 H new ATOM 0 HZ3 LYS A 518 -4.773 -8.719 16.426 1.00 25.50 H new ATOM 2219 N LYS A 519 -9.616 -5.336 12.249 1.00 22.21 N ATOM 2220 CA LYS A 519 -10.732 -4.480 11.738 1.00 45.42 C ATOM 2221 C LYS A 519 -11.305 -4.973 10.386 1.00 51.22 C ATOM 2222 O LYS A 519 -12.392 -4.537 9.985 1.00 2.23 O ATOM 2223 CB LYS A 519 -10.248 -2.993 11.619 1.00 10.24 C ATOM 2224 CG LYS A 519 -10.490 -2.139 12.880 1.00 41.14 C ATOM 2225 CD LYS A 519 -12.003 -1.909 13.124 1.00 61.03 C ATOM 2226 CE LYS A 519 -12.284 -1.067 14.372 1.00 55.33 C ATOM 2227 NZ LYS A 519 -11.606 0.254 14.316 1.00 23.23 N ATOM 0 H LYS A 519 -8.717 -5.131 11.813 1.00 22.21 H new ATOM 0 HA LYS A 519 -11.546 -4.549 12.460 1.00 45.42 H new ATOM 0 HB2 LYS A 519 -9.182 -2.988 11.391 1.00 10.24 H new ATOM 0 HB3 LYS A 519 -10.756 -2.525 10.776 1.00 10.24 H new ATOM 0 HG2 LYS A 519 -10.051 -2.634 13.746 1.00 41.14 H new ATOM 0 HG3 LYS A 519 -9.987 -1.178 12.773 1.00 41.14 H new ATOM 0 HD2 LYS A 519 -12.435 -1.415 12.254 1.00 61.03 H new ATOM 0 HD3 LYS A 519 -12.501 -2.874 13.223 1.00 61.03 H new ATOM 0 HE2 LYS A 519 -13.359 -0.919 14.475 1.00 55.33 H new ATOM 0 HE3 LYS A 519 -11.951 -1.608 15.257 1.00 55.33 H new ATOM 0 HZ1 LYS A 519 -11.953 0.856 15.090 1.00 23.23 H new ATOM 0 HZ2 LYS A 519 -10.579 0.122 14.414 1.00 23.23 H new ATOM 0 HZ3 LYS A 519 -11.810 0.711 13.404 1.00 23.23 H new ATOM 2241 N LYS A 520 -10.560 -5.865 9.702 1.00 44.43 N ATOM 2242 CA LYS A 520 -10.914 -6.412 8.364 1.00 11.24 C ATOM 2243 C LYS A 520 -11.022 -5.309 7.265 1.00 51.14 C ATOM 2244 O LYS A 520 -11.692 -5.500 6.242 1.00 64.21 O ATOM 2245 CB LYS A 520 -12.205 -7.287 8.431 1.00 11.21 C ATOM 2246 CG LYS A 520 -12.145 -8.435 9.465 1.00 54.44 C ATOM 2247 CD LYS A 520 -10.964 -9.403 9.237 1.00 42.53 C ATOM 2248 CE LYS A 520 -10.930 -10.544 10.268 1.00 63.31 C ATOM 2249 NZ LYS A 520 -9.756 -11.424 10.063 1.00 13.53 N ATOM 0 H LYS A 520 -9.681 -6.235 10.064 1.00 44.43 H new ATOM 0 HA LYS A 520 -10.088 -7.057 8.065 1.00 11.24 H new ATOM 0 HB2 LYS A 520 -13.053 -6.644 8.668 1.00 11.21 H new ATOM 0 HB3 LYS A 520 -12.393 -7.712 7.445 1.00 11.21 H new ATOM 0 HG2 LYS A 520 -12.069 -8.009 10.466 1.00 54.44 H new ATOM 0 HG3 LYS A 520 -13.078 -8.997 9.428 1.00 54.44 H new ATOM 0 HD2 LYS A 520 -11.033 -9.825 8.235 1.00 42.53 H new ATOM 0 HD3 LYS A 520 -10.028 -8.847 9.285 1.00 42.53 H new ATOM 0 HE2 LYS A 520 -10.902 -10.126 11.274 1.00 63.31 H new ATOM 0 HE3 LYS A 520 -11.845 -11.132 10.192 1.00 63.31 H new ATOM 0 HZ1 LYS A 520 -9.933 -12.348 10.507 1.00 13.53 H new ATOM 0 HZ2 LYS A 520 -9.594 -11.555 9.044 1.00 13.53 H new ATOM 0 HZ3 LYS A 520 -8.916 -10.988 10.494 1.00 13.53 H new ATOM 2263 N ILE A 521 -10.295 -4.186 7.459 1.00 75.35 N ATOM 2264 CA ILE A 521 -10.236 -3.065 6.479 1.00 53.43 C ATOM 2265 C ILE A 521 -8.779 -2.818 6.019 1.00 15.11 C ATOM 2266 O ILE A 521 -7.827 -3.167 6.720 1.00 11.11 O ATOM 2267 CB ILE A 521 -10.842 -1.730 7.070 1.00 32.21 C ATOM 2268 CG1 ILE A 521 -9.987 -1.202 8.274 1.00 3.33 C ATOM 2269 CG2 ILE A 521 -12.322 -1.934 7.472 1.00 3.42 C ATOM 2270 CD1 ILE A 521 -10.564 0.009 9.001 1.00 23.04 C ATOM 0 H ILE A 521 -9.732 -4.026 8.295 1.00 75.35 H new ATOM 0 HA ILE A 521 -10.841 -3.359 5.622 1.00 53.43 H new ATOM 0 HB ILE A 521 -10.809 -0.968 6.291 1.00 32.21 H new ATOM 0 HG12 ILE A 521 -9.863 -2.012 8.993 1.00 3.33 H new ATOM 0 HG13 ILE A 521 -8.993 -0.946 7.908 1.00 3.33 H new ATOM 0 HG21 ILE A 521 -12.721 -1.004 7.876 1.00 3.42 H new ATOM 0 HG22 ILE A 521 -12.900 -2.226 6.595 1.00 3.42 H new ATOM 0 HG23 ILE A 521 -12.389 -2.716 8.228 1.00 3.42 H new ATOM 0 HD11 ILE A 521 -9.899 0.295 9.816 1.00 23.04 H new ATOM 0 HD12 ILE A 521 -10.661 0.840 8.303 1.00 23.04 H new ATOM 0 HD13 ILE A 521 -11.545 -0.242 9.405 1.00 23.04 H new ATOM 2282 N PHE A 522 -8.617 -2.218 4.831 1.00 14.35 N ATOM 2283 CA PHE A 522 -7.291 -1.908 4.254 1.00 20.13 C ATOM 2284 C PHE A 522 -6.892 -0.437 4.535 1.00 71.34 C ATOM 2285 O PHE A 522 -7.551 0.490 4.060 1.00 64.11 O ATOM 2286 CB PHE A 522 -7.304 -2.189 2.731 1.00 21.22 C ATOM 2287 CG PHE A 522 -7.474 -3.665 2.364 1.00 62.24 C ATOM 2288 CD1 PHE A 522 -8.742 -4.251 2.298 1.00 25.45 C ATOM 2289 CD2 PHE A 522 -6.366 -4.466 2.074 1.00 0.21 C ATOM 2290 CE1 PHE A 522 -8.893 -5.581 1.954 1.00 25.11 C ATOM 2291 CE2 PHE A 522 -6.521 -5.796 1.731 1.00 31.10 C ATOM 2292 CZ PHE A 522 -7.783 -6.354 1.671 1.00 62.02 C ATOM 0 H PHE A 522 -9.398 -1.932 4.240 1.00 14.35 H new ATOM 0 HA PHE A 522 -6.547 -2.549 4.727 1.00 20.13 H new ATOM 0 HB2 PHE A 522 -8.113 -1.618 2.275 1.00 21.22 H new ATOM 0 HB3 PHE A 522 -6.373 -1.824 2.298 1.00 21.22 H new ATOM 0 HD1 PHE A 522 -9.616 -3.656 2.519 1.00 25.45 H new ATOM 0 HD2 PHE A 522 -5.375 -4.040 2.119 1.00 0.21 H new ATOM 0 HE1 PHE A 522 -9.880 -6.017 1.906 1.00 25.11 H new ATOM 0 HE2 PHE A 522 -5.654 -6.400 1.509 1.00 31.10 H new ATOM 0 HZ PHE A 522 -7.902 -7.393 1.403 1.00 62.02 H new ATOM 2302 N MET A 523 -5.830 -0.247 5.331 1.00 53.01 N ATOM 2303 CA MET A 523 -5.265 1.094 5.631 1.00 35.43 C ATOM 2304 C MET A 523 -4.315 1.574 4.506 1.00 13.33 C ATOM 2305 O MET A 523 -3.699 0.764 3.811 1.00 2.21 O ATOM 2306 CB MET A 523 -4.496 1.063 6.977 1.00 32.42 C ATOM 2307 CG MET A 523 -5.361 0.705 8.192 1.00 33.25 C ATOM 2308 SD MET A 523 -6.625 1.947 8.530 1.00 40.44 S ATOM 2309 CE MET A 523 -7.328 1.302 10.046 1.00 55.41 C ATOM 0 H MET A 523 -5.333 -1.011 5.788 1.00 53.01 H new ATOM 0 HA MET A 523 -6.098 1.794 5.700 1.00 35.43 H new ATOM 0 HB2 MET A 523 -3.682 0.342 6.900 1.00 32.42 H new ATOM 0 HB3 MET A 523 -4.042 2.040 7.145 1.00 32.42 H new ATOM 0 HG2 MET A 523 -5.840 -0.259 8.022 1.00 33.25 H new ATOM 0 HG3 MET A 523 -4.722 0.593 9.068 1.00 33.25 H new ATOM 0 HE1 MET A 523 -8.226 1.866 10.300 1.00 55.41 H new ATOM 0 HE2 MET A 523 -7.586 0.252 9.910 1.00 55.41 H new ATOM 0 HE3 MET A 523 -6.601 1.395 10.853 1.00 55.41 H new ATOM 2319 N GLY A 524 -4.192 2.900 4.367 1.00 72.41 N ATOM 2320 CA GLY A 524 -3.293 3.523 3.390 1.00 11.42 C ATOM 2321 C GLY A 524 -2.486 4.659 4.023 1.00 11.40 C ATOM 2322 O GLY A 524 -3.050 5.695 4.388 1.00 23.52 O ATOM 0 H GLY A 524 -4.714 3.571 4.930 1.00 72.41 H new ATOM 0 HA2 GLY A 524 -2.614 2.772 2.987 1.00 11.42 H new ATOM 0 HA3 GLY A 524 -3.874 3.909 2.553 1.00 11.42 H new ATOM 2326 N LEU A 525 -1.168 4.461 4.179 1.00 64.40 N ATOM 2327 CA LEU A 525 -0.277 5.434 4.841 1.00 3.34 C ATOM 2328 C LEU A 525 0.548 6.234 3.815 1.00 15.42 C ATOM 2329 O LEU A 525 1.472 5.697 3.202 1.00 33.33 O ATOM 2330 CB LEU A 525 0.647 4.681 5.837 1.00 54.11 C ATOM 2331 CG LEU A 525 -0.097 3.982 7.021 1.00 42.33 C ATOM 2332 CD1 LEU A 525 0.864 3.165 7.891 1.00 22.15 C ATOM 2333 CD2 LEU A 525 -0.868 5.007 7.877 1.00 1.42 C ATOM 0 H LEU A 525 -0.687 3.623 3.851 1.00 64.40 H new ATOM 0 HA LEU A 525 -0.885 6.155 5.387 1.00 3.34 H new ATOM 0 HB2 LEU A 525 1.213 3.929 5.288 1.00 54.11 H new ATOM 0 HB3 LEU A 525 1.369 5.388 6.246 1.00 54.11 H new ATOM 0 HG LEU A 525 -0.818 3.291 6.584 1.00 42.33 H new ATOM 0 HD11 LEU A 525 0.309 2.695 8.703 1.00 22.15 H new ATOM 0 HD12 LEU A 525 1.340 2.395 7.283 1.00 22.15 H new ATOM 0 HD13 LEU A 525 1.627 3.823 8.307 1.00 22.15 H new ATOM 0 HD21 LEU A 525 -1.375 4.492 8.693 1.00 1.42 H new ATOM 0 HD22 LEU A 525 -0.170 5.737 8.287 1.00 1.42 H new ATOM 0 HD23 LEU A 525 -1.604 5.518 7.257 1.00 1.42 H new ATOM 2345 N ILE A 526 0.193 7.524 3.635 1.00 74.11 N ATOM 2346 CA ILE A 526 0.929 8.455 2.749 1.00 24.41 C ATOM 2347 C ILE A 526 1.916 9.296 3.604 1.00 22.30 C ATOM 2348 O ILE A 526 1.468 10.115 4.417 1.00 41.42 O ATOM 2349 CB ILE A 526 -0.010 9.447 1.942 1.00 4.35 C ATOM 2350 CG1 ILE A 526 -1.032 8.704 1.001 1.00 14.44 C ATOM 2351 CG2 ILE A 526 0.843 10.457 1.129 1.00 42.53 C ATOM 2352 CD1 ILE A 526 -2.176 7.979 1.695 1.00 74.34 C ATOM 0 H ILE A 526 -0.610 7.950 4.098 1.00 74.11 H new ATOM 0 HA ILE A 526 1.449 7.838 2.016 1.00 24.41 H new ATOM 0 HB ILE A 526 -0.604 9.985 2.681 1.00 4.35 H new ATOM 0 HG12 ILE A 526 -1.456 9.434 0.311 1.00 14.44 H new ATOM 0 HG13 ILE A 526 -0.481 7.980 0.400 1.00 14.44 H new ATOM 0 HG21 ILE A 526 0.185 11.131 0.581 1.00 42.53 H new ATOM 0 HG22 ILE A 526 1.469 11.035 1.809 1.00 42.53 H new ATOM 0 HG23 ILE A 526 1.475 9.916 0.425 1.00 42.53 H new ATOM 0 HD11 ILE A 526 -2.813 7.506 0.948 1.00 74.34 H new ATOM 0 HD12 ILE A 526 -1.773 7.218 2.362 1.00 74.34 H new ATOM 0 HD13 ILE A 526 -2.763 8.694 2.272 1.00 74.34 H new ATOM 2364 N PRO A 527 3.265 9.100 3.447 1.00 23.31 N ATOM 2365 CA PRO A 527 4.293 9.904 4.166 1.00 2.23 C ATOM 2366 C PRO A 527 4.237 11.410 3.819 1.00 11.43 C ATOM 2367 O PRO A 527 3.816 11.792 2.727 1.00 63.34 O ATOM 2368 CB PRO A 527 5.643 9.277 3.713 1.00 31.41 C ATOM 2369 CG PRO A 527 5.278 7.933 3.157 1.00 2.43 C ATOM 2370 CD PRO A 527 3.896 8.081 2.576 1.00 20.41 C ATOM 0 HA PRO A 527 4.140 9.870 5.245 1.00 2.23 H new ATOM 0 HB2 PRO A 527 6.133 9.896 2.961 1.00 31.41 H new ATOM 0 HB3 PRO A 527 6.335 9.183 4.550 1.00 31.41 H new ATOM 0 HG2 PRO A 527 5.990 7.621 2.393 1.00 2.43 H new ATOM 0 HG3 PRO A 527 5.293 7.172 3.937 1.00 2.43 H new ATOM 0 HD2 PRO A 527 3.930 8.406 1.536 1.00 20.41 H new ATOM 0 HD3 PRO A 527 3.348 7.139 2.597 1.00 20.41 H new ATOM 2378 N TYR A 528 4.648 12.249 4.770 1.00 33.32 N ATOM 2379 CA TYR A 528 4.704 13.720 4.602 1.00 24.32 C ATOM 2380 C TYR A 528 6.115 14.166 4.185 1.00 4.43 C ATOM 2381 O TYR A 528 6.281 15.204 3.531 1.00 0.11 O ATOM 2382 CB TYR A 528 4.244 14.423 5.908 1.00 64.21 C ATOM 2383 CG TYR A 528 2.720 14.405 6.101 1.00 13.23 C ATOM 2384 CD1 TYR A 528 2.008 13.203 6.108 1.00 21.32 C ATOM 2385 CD2 TYR A 528 1.989 15.589 6.245 1.00 15.44 C ATOM 2386 CE1 TYR A 528 0.640 13.183 6.247 1.00 51.00 C ATOM 2387 CE2 TYR A 528 0.617 15.568 6.392 1.00 14.05 C ATOM 2388 CZ TYR A 528 -0.053 14.363 6.389 1.00 22.41 C ATOM 2389 OH TYR A 528 -1.423 14.335 6.521 1.00 51.32 O ATOM 0 H TYR A 528 4.956 11.934 5.690 1.00 33.32 H new ATOM 0 HA TYR A 528 4.022 14.012 3.804 1.00 24.32 H new ATOM 0 HB2 TYR A 528 4.717 13.937 6.761 1.00 64.21 H new ATOM 0 HB3 TYR A 528 4.590 15.457 5.898 1.00 64.21 H new ATOM 0 HD1 TYR A 528 2.543 12.271 6.002 1.00 21.32 H new ATOM 0 HD2 TYR A 528 2.508 16.536 6.241 1.00 15.44 H new ATOM 0 HE1 TYR A 528 0.110 12.242 6.245 1.00 51.00 H new ATOM 0 HE2 TYR A 528 0.070 16.492 6.509 1.00 14.05 H new ATOM 0 HH TYR A 528 -1.762 15.250 6.613 1.00 51.32 H new ATOM 2399 N ASP A 529 7.120 13.366 4.567 1.00 63.50 N ATOM 2400 CA ASP A 529 8.516 13.584 4.143 1.00 51.22 C ATOM 2401 C ASP A 529 8.724 13.082 2.685 1.00 74.21 C ATOM 2402 O ASP A 529 9.282 13.801 1.847 1.00 50.21 O ATOM 2403 CB ASP A 529 9.492 12.895 5.133 1.00 53.44 C ATOM 2404 CG ASP A 529 9.286 11.370 5.231 1.00 54.10 C ATOM 2405 OD1 ASP A 529 8.297 10.937 5.868 1.00 61.33 O ATOM 2406 OD2 ASP A 529 10.098 10.613 4.654 1.00 23.32 O ATOM 0 H ASP A 529 6.994 12.556 5.173 1.00 63.50 H new ATOM 0 HA ASP A 529 8.731 14.653 4.157 1.00 51.22 H new ATOM 0 HB2 ASP A 529 10.517 13.097 4.822 1.00 53.44 H new ATOM 0 HB3 ASP A 529 9.367 13.336 6.122 1.00 53.44 H new ATOM 2411 N GLN A 530 8.236 11.845 2.422 1.00 62.23 N ATOM 2412 CA GLN A 530 8.259 11.159 1.104 1.00 22.24 C ATOM 2413 C GLN A 530 9.680 10.811 0.585 1.00 41.20 C ATOM 2414 O GLN A 530 9.985 9.633 0.419 1.00 62.34 O ATOM 2415 CB GLN A 530 7.423 11.926 0.039 1.00 4.34 C ATOM 2416 CG GLN A 530 5.894 11.878 0.281 1.00 22.11 C ATOM 2417 CD GLN A 530 5.252 10.500 0.029 1.00 41.23 C ATOM 2418 OE1 GLN A 530 5.890 9.467 0.096 1.00 65.41 O ATOM 2419 NE2 GLN A 530 3.965 10.471 -0.202 1.00 43.24 N ATOM 0 H GLN A 530 7.800 11.276 3.147 1.00 62.23 H new ATOM 0 HA GLN A 530 7.780 10.195 1.278 1.00 22.24 H new ATOM 0 HB2 GLN A 530 7.745 12.967 0.021 1.00 4.34 H new ATOM 0 HB3 GLN A 530 7.638 11.509 -0.945 1.00 4.34 H new ATOM 0 HG2 GLN A 530 5.692 12.177 1.310 1.00 22.11 H new ATOM 0 HG3 GLN A 530 5.413 12.613 -0.365 1.00 22.11 H new ATOM 0 HE21 GLN A 530 3.437 11.342 -0.257 1.00 43.24 H new ATOM 0 HE22 GLN A 530 3.489 9.577 -0.327 1.00 43.24 H new ATOM 2428 N SER A 531 10.528 11.829 0.321 1.00 44.02 N ATOM 2429 CA SER A 531 11.926 11.628 -0.156 1.00 43.34 C ATOM 2430 C SER A 531 12.730 10.686 0.780 1.00 45.21 C ATOM 2431 O SER A 531 13.370 9.741 0.311 1.00 3.55 O ATOM 2432 CB SER A 531 12.651 12.991 -0.277 1.00 61.33 C ATOM 2433 OG SER A 531 12.693 13.667 0.976 1.00 72.14 O ATOM 0 H SER A 531 10.271 12.810 0.430 1.00 44.02 H new ATOM 0 HA SER A 531 11.870 11.154 -1.136 1.00 43.34 H new ATOM 0 HB2 SER A 531 13.666 12.834 -0.643 1.00 61.33 H new ATOM 0 HB3 SER A 531 12.140 13.613 -1.012 1.00 61.33 H new ATOM 0 HG SER A 531 13.158 14.523 0.870 1.00 72.14 H new ATOM 2439 N GLY A 532 12.637 10.945 2.105 1.00 20.15 N ATOM 2440 CA GLY A 532 13.291 10.109 3.131 1.00 32.13 C ATOM 2441 C GLY A 532 12.722 8.686 3.224 1.00 24.03 C ATOM 2442 O GLY A 532 13.460 7.728 3.482 1.00 31.03 O ATOM 0 H GLY A 532 12.112 11.731 2.487 1.00 20.15 H new ATOM 0 HA2 GLY A 532 14.357 10.051 2.913 1.00 32.13 H new ATOM 0 HA3 GLY A 532 13.190 10.595 4.101 1.00 32.13 H new ATOM 2446 N PHE A 533 11.401 8.557 3.011 1.00 24.32 N ATOM 2447 CA PHE A 533 10.709 7.252 3.000 1.00 51.32 C ATOM 2448 C PHE A 533 11.182 6.379 1.807 1.00 0.22 C ATOM 2449 O PHE A 533 11.498 5.201 1.984 1.00 32.51 O ATOM 2450 CB PHE A 533 9.173 7.447 2.955 1.00 32.32 C ATOM 2451 CG PHE A 533 8.374 6.147 3.096 1.00 20.12 C ATOM 2452 CD1 PHE A 533 8.132 5.597 4.349 1.00 64.43 C ATOM 2453 CD2 PHE A 533 7.874 5.473 1.984 1.00 25.13 C ATOM 2454 CE1 PHE A 533 7.422 4.424 4.490 1.00 75.11 C ATOM 2455 CE2 PHE A 533 7.162 4.301 2.122 1.00 54.11 C ATOM 2456 CZ PHE A 533 6.939 3.779 3.378 1.00 53.35 C ATOM 0 H PHE A 533 10.783 9.350 2.842 1.00 24.32 H new ATOM 0 HA PHE A 533 10.964 6.730 3.922 1.00 51.32 H new ATOM 0 HB2 PHE A 533 8.880 8.129 3.753 1.00 32.32 H new ATOM 0 HB3 PHE A 533 8.905 7.925 2.013 1.00 32.32 H new ATOM 0 HD1 PHE A 533 8.507 6.098 5.229 1.00 64.43 H new ATOM 0 HD2 PHE A 533 8.047 5.876 0.997 1.00 25.13 H new ATOM 0 HE1 PHE A 533 7.246 4.013 5.473 1.00 75.11 H new ATOM 0 HE2 PHE A 533 6.780 3.793 1.249 1.00 54.11 H new ATOM 0 HZ PHE A 533 6.383 2.860 3.488 1.00 53.35 H new ATOM 2466 N VAL A 534 11.247 6.991 0.606 1.00 21.00 N ATOM 2467 CA VAL A 534 11.717 6.325 -0.635 1.00 1.20 C ATOM 2468 C VAL A 534 13.206 5.901 -0.507 1.00 41.44 C ATOM 2469 O VAL A 534 13.610 4.894 -1.078 1.00 22.14 O ATOM 2470 CB VAL A 534 11.527 7.256 -1.901 1.00 22.02 C ATOM 2471 CG1 VAL A 534 12.072 6.602 -3.199 1.00 12.30 C ATOM 2472 CG2 VAL A 534 10.044 7.657 -2.093 1.00 3.11 C ATOM 0 H VAL A 534 10.975 7.964 0.465 1.00 21.00 H new ATOM 0 HA VAL A 534 11.107 5.432 -0.773 1.00 1.20 H new ATOM 0 HB VAL A 534 12.111 8.156 -1.709 1.00 22.02 H new ATOM 0 HG11 VAL A 534 11.919 7.279 -4.040 1.00 12.30 H new ATOM 0 HG12 VAL A 534 13.137 6.400 -3.085 1.00 12.30 H new ATOM 0 HG13 VAL A 534 11.543 5.667 -3.385 1.00 12.30 H new ATOM 0 HG21 VAL A 534 9.951 8.296 -2.971 1.00 3.11 H new ATOM 0 HG22 VAL A 534 9.440 6.760 -2.231 1.00 3.11 H new ATOM 0 HG23 VAL A 534 9.696 8.197 -1.213 1.00 3.11 H new ATOM 2482 N ASN A 535 14.004 6.684 0.252 1.00 55.24 N ATOM 2483 CA ASN A 535 15.408 6.322 0.589 1.00 44.01 C ATOM 2484 C ASN A 535 15.467 5.007 1.409 1.00 63.04 C ATOM 2485 O ASN A 535 16.331 4.156 1.171 1.00 22.21 O ATOM 2486 CB ASN A 535 16.100 7.475 1.367 1.00 74.32 C ATOM 2487 CG ASN A 535 16.301 8.738 0.525 1.00 74.02 C ATOM 2488 OD1 ASN A 535 16.468 8.673 -0.688 1.00 2.13 O ATOM 2489 ND2 ASN A 535 16.287 9.894 1.164 1.00 43.13 N ATOM 0 H ASN A 535 13.703 7.575 0.646 1.00 55.24 H new ATOM 0 HA ASN A 535 15.944 6.162 -0.347 1.00 44.01 H new ATOM 0 HB2 ASN A 535 15.502 7.723 2.244 1.00 74.32 H new ATOM 0 HB3 ASN A 535 17.069 7.130 1.729 1.00 74.32 H new ATOM 0 HD21 ASN A 535 16.417 10.764 0.647 1.00 43.13 H new ATOM 0 HD22 ASN A 535 16.146 9.917 2.174 1.00 43.13 H new ATOM 2496 N GLY A 536 14.524 4.853 2.358 1.00 33.41 N ATOM 2497 CA GLY A 536 14.376 3.607 3.128 1.00 32.43 C ATOM 2498 C GLY A 536 13.894 2.420 2.273 1.00 63.14 C ATOM 2499 O GLY A 536 14.402 1.304 2.404 1.00 33.30 O ATOM 0 H GLY A 536 13.853 5.579 2.609 1.00 33.41 H new ATOM 0 HA2 GLY A 536 15.333 3.353 3.584 1.00 32.43 H new ATOM 0 HA3 GLY A 536 13.669 3.772 3.941 1.00 32.43 H new ATOM 2503 N ILE A 537 12.921 2.684 1.375 1.00 51.30 N ATOM 2504 CA ILE A 537 12.351 1.660 0.461 1.00 32.11 C ATOM 2505 C ILE A 537 13.384 1.205 -0.602 1.00 72.30 C ATOM 2506 O ILE A 537 13.428 0.027 -0.965 1.00 23.35 O ATOM 2507 CB ILE A 537 11.042 2.194 -0.236 1.00 21.34 C ATOM 2508 CG1 ILE A 537 9.954 2.535 0.825 1.00 50.11 C ATOM 2509 CG2 ILE A 537 10.477 1.190 -1.275 1.00 11.21 C ATOM 2510 CD1 ILE A 537 9.463 1.348 1.639 1.00 13.13 C ATOM 0 H ILE A 537 12.507 3.609 1.260 1.00 51.30 H new ATOM 0 HA ILE A 537 12.092 0.792 1.067 1.00 32.11 H new ATOM 0 HB ILE A 537 11.317 3.102 -0.773 1.00 21.34 H new ATOM 0 HG12 ILE A 537 10.354 3.285 1.507 1.00 50.11 H new ATOM 0 HG13 ILE A 537 9.102 2.988 0.318 1.00 50.11 H new ATOM 0 HG21 ILE A 537 9.576 1.603 -1.728 1.00 11.21 H new ATOM 0 HG22 ILE A 537 11.222 1.010 -2.050 1.00 11.21 H new ATOM 0 HG23 ILE A 537 10.235 0.250 -0.779 1.00 11.21 H new ATOM 0 HD11 ILE A 537 8.708 1.682 2.351 1.00 13.13 H new ATOM 0 HD12 ILE A 537 9.028 0.604 0.972 1.00 13.13 H new ATOM 0 HD13 ILE A 537 10.300 0.906 2.179 1.00 13.13 H new ATOM 2522 N ARG A 538 14.233 2.150 -1.044 1.00 51.51 N ATOM 2523 CA ARG A 538 15.303 1.905 -2.048 1.00 15.40 C ATOM 2524 C ARG A 538 16.290 0.808 -1.569 1.00 33.04 C ATOM 2525 O ARG A 538 16.808 0.026 -2.370 1.00 34.33 O ATOM 2526 CB ARG A 538 16.056 3.236 -2.351 1.00 4.34 C ATOM 2527 CG ARG A 538 17.264 3.100 -3.306 1.00 54.33 C ATOM 2528 CD ARG A 538 17.899 4.454 -3.687 1.00 21.24 C ATOM 2529 NE ARG A 538 19.077 4.274 -4.558 1.00 34.23 N ATOM 2530 CZ ARG A 538 19.043 4.053 -5.856 1.00 52.32 C ATOM 2531 NH1 ARG A 538 17.926 4.043 -6.517 1.00 44.02 N ATOM 2532 NH2 ARG A 538 20.147 3.845 -6.491 1.00 5.42 N ATOM 0 H ARG A 538 14.202 3.115 -0.716 1.00 51.51 H new ATOM 0 HA ARG A 538 14.838 1.543 -2.965 1.00 15.40 H new ATOM 0 HB2 ARG A 538 15.350 3.946 -2.782 1.00 4.34 H new ATOM 0 HB3 ARG A 538 16.402 3.662 -1.410 1.00 4.34 H new ATOM 0 HG2 ARG A 538 18.021 2.472 -2.836 1.00 54.33 H new ATOM 0 HG3 ARG A 538 16.944 2.589 -4.214 1.00 54.33 H new ATOM 0 HD2 ARG A 538 17.160 5.073 -4.196 1.00 21.24 H new ATOM 0 HD3 ARG A 538 18.192 4.987 -2.782 1.00 21.24 H new ATOM 0 HE ARG A 538 19.995 4.325 -4.117 1.00 34.23 H new ATOM 0 HH11 ARG A 538 17.045 4.209 -6.031 1.00 44.02 H new ATOM 0 HH12 ARG A 538 17.930 3.869 -7.522 1.00 44.02 H new ATOM 0 HH21 ARG A 538 21.034 3.853 -5.988 1.00 5.42 H new ATOM 0 HH22 ARG A 538 20.132 3.673 -7.496 1.00 5.42 H new ATOM 2546 N GLN A 539 16.511 0.765 -0.245 1.00 35.42 N ATOM 2547 CA GLN A 539 17.322 -0.279 0.419 1.00 24.31 C ATOM 2548 C GLN A 539 16.631 -1.662 0.343 1.00 5.12 C ATOM 2549 O GLN A 539 17.258 -2.669 0.016 1.00 22.42 O ATOM 2550 CB GLN A 539 17.537 0.121 1.902 1.00 60.12 C ATOM 2551 CG GLN A 539 18.149 1.524 2.088 1.00 64.54 C ATOM 2552 CD GLN A 539 18.287 1.955 3.550 1.00 45.02 C ATOM 2553 OE1 GLN A 539 18.493 1.138 4.439 1.00 33.22 O ATOM 2554 NE2 GLN A 539 18.168 3.242 3.808 1.00 41.34 N ATOM 0 H GLN A 539 16.131 1.456 0.402 1.00 35.42 H new ATOM 0 HA GLN A 539 18.280 -0.358 -0.094 1.00 24.31 H new ATOM 0 HB2 GLN A 539 16.580 0.081 2.421 1.00 60.12 H new ATOM 0 HB3 GLN A 539 18.187 -0.614 2.376 1.00 60.12 H new ATOM 0 HG2 GLN A 539 19.133 1.545 1.620 1.00 64.54 H new ATOM 0 HG3 GLN A 539 17.530 2.251 1.562 1.00 64.54 H new ATOM 0 HE21 GLN A 539 17.997 3.901 3.048 1.00 41.34 H new ATOM 0 HE22 GLN A 539 18.247 3.579 4.767 1.00 41.34 H new ATOM 2563 N VAL A 540 15.315 -1.677 0.624 1.00 0.02 N ATOM 2564 CA VAL A 540 14.525 -2.921 0.821 1.00 31.21 C ATOM 2565 C VAL A 540 13.601 -3.261 -0.387 1.00 15.21 C ATOM 2566 O VAL A 540 12.567 -3.926 -0.227 1.00 33.41 O ATOM 2567 CB VAL A 540 13.689 -2.820 2.149 1.00 74.54 C ATOM 2568 CG1 VAL A 540 14.616 -2.781 3.393 1.00 33.34 C ATOM 2569 CG2 VAL A 540 12.728 -1.604 2.139 1.00 42.04 C ATOM 0 H VAL A 540 14.761 -0.826 0.723 1.00 0.02 H new ATOM 0 HA VAL A 540 15.238 -3.742 0.897 1.00 31.21 H new ATOM 0 HB VAL A 540 13.075 -3.719 2.209 1.00 74.54 H new ATOM 0 HG11 VAL A 540 14.010 -2.711 4.296 1.00 33.34 H new ATOM 0 HG12 VAL A 540 15.216 -3.690 3.428 1.00 33.34 H new ATOM 0 HG13 VAL A 540 15.274 -1.914 3.329 1.00 33.34 H new ATOM 0 HG21 VAL A 540 12.171 -1.573 3.075 1.00 42.04 H new ATOM 0 HG22 VAL A 540 13.305 -0.685 2.029 1.00 42.04 H new ATOM 0 HG23 VAL A 540 12.032 -1.697 1.305 1.00 42.04 H new