USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1050 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 Single : A 404 THR OG1 : rot 180:sc= 0.0657 USER MOD Single : A 408 GLN : amide:sc= -0.0997 X(o=-0.1,f=0) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 418 HIS : no HD1:sc= -2.87 X(o=-2.9,f=-3.2!) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 420 ASN : amide:sc= -0.258 K(o=-0.26,f=-2.6!) USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 426 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 432 THR OG1 : rot 180:sc= 0 USER MOD Single : A 435 THR OG1 : rot 90:sc= 0.821 USER MOD Single : A 436 THR OG1 : rot 114:sc= 1.13 USER MOD Single : A 440 HIS : no HD1:sc= -0.742 X(o=-0.74,f=-0.42) USER MOD Single : A 441 THR OG1 : rot 72:sc= 0.434 USER MOD Single : A 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 444 HIS : no HD1:sc= -0.0405 X(o=-0.04,f=-0.12) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.0869 X(o=-0.087,f=-0.49) USER MOD Single : A 458 THR OG1 : rot 180:sc= 0.0017 USER MOD Single : A 460 THR OG1 : rot 95:sc= 1.25 USER MOD Single : A 462 LYS NZ :NH3+ 163:sc=-0.00605 (180deg=-0.357) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 404 THR OG1 : rot 180:sc= 0.0822 USER MOD Single : B 408 GLN : amide:sc= -0.0974 X(o=-0.097,f=0) USER MOD Single : B 416 SER OG : rot 180:sc= 0 USER MOD Single : B 418 HIS : no HD1:sc= -2.56 K(o=-2.6,f=-3.2!) USER MOD Single : B 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 420 ASN : amide:sc= -0.244 K(o=-0.24,f=-2.7!) USER MOD Single : B 423 SER OG : rot 180:sc= 0 USER MOD Single : B 426 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : B 432 THR OG1 : rot 180:sc= 0 USER MOD Single : B 435 THR OG1 : rot 90:sc= 0.835 USER MOD Single : B 436 THR OG1 : rot 126:sc= 1.04 USER MOD Single : B 440 HIS : no HD1:sc= -0.707 X(o=-0.71,f=-0.42) USER MOD Single : B 441 THR OG1 : rot 72:sc= 0.394 USER MOD Single : B 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 444 HIS : no HD1:sc= -0.0313 X(o=-0.031,f=-0.099) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.4) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0 USER MOD Single : B 460 THR OG1 : rot 97:sc= 1.24 USER MOD Single : B 462 LYS NZ :NH3+ 164:sc=-0.00748 (180deg=-0.362) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 325 N TRP A 402 6.515 2.821 1.865 1.00 0.95 N ATOM 326 CA TRP A 402 5.153 2.994 1.280 1.00 0.86 C ATOM 327 C TRP A 402 4.340 4.047 2.039 1.00 0.79 C ATOM 328 O TRP A 402 4.011 5.082 1.501 1.00 0.71 O ATOM 329 CB TRP A 402 4.497 1.624 1.417 1.00 0.96 C ATOM 330 CG TRP A 402 3.811 1.282 0.139 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.429 0.819 -0.969 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.394 1.373 -0.183 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.484 0.614 -1.960 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.212 0.940 -1.528 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.254 1.785 0.554 1.00 0.78 C ATOM 336 CZ2 TRP A 402 0.938 0.917 -2.125 1.00 0.83 C ATOM 337 CZ3 TRP A 402 -0.029 1.764 -0.042 1.00 0.72 C ATOM 338 CH2 TRP A 402 -0.187 1.330 -1.380 1.00 0.69 C ATOM 0 HA TRP A 402 5.204 3.339 0.247 1.00 0.86 H new ATOM 0 HB2 TRP A 402 5.247 0.870 1.655 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.780 1.631 2.238 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.489 0.638 -1.066 1.00 0.94 H new ATOM 0 HE1 TRP A 402 3.700 0.265 -2.894 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.366 2.117 1.576 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 0.822 0.586 -3.146 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -0.891 2.080 0.526 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -1.168 1.315 -1.831 1.00 0.69 H new ATOM 349 N ALA A 403 3.999 3.785 3.273 1.00 0.85 N ATOM 350 CA ALA A 403 3.189 4.769 4.057 1.00 0.85 C ATOM 351 C ALA A 403 3.744 6.188 3.896 1.00 0.80 C ATOM 352 O ALA A 403 3.024 7.108 3.565 1.00 0.76 O ATOM 353 CB ALA A 403 3.305 4.310 5.511 1.00 0.99 C ATOM 0 H ALA A 403 4.246 2.932 3.774 1.00 0.85 H new ATOM 0 HA ALA A 403 2.154 4.802 3.717 1.00 0.85 H new ATOM 0 HB1 ALA A 403 2.736 4.983 6.152 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.910 3.299 5.606 1.00 0.99 H new ATOM 0 HB3 ALA A 403 4.352 4.320 5.813 1.00 0.99 H new ATOM 359 N THR A 404 5.016 6.375 4.115 1.00 0.82 N ATOM 360 CA THR A 404 5.595 7.738 3.957 1.00 0.81 C ATOM 361 C THR A 404 5.321 8.246 2.540 1.00 0.70 C ATOM 362 O THR A 404 5.043 9.410 2.328 1.00 0.68 O ATOM 363 CB THR A 404 7.095 7.568 4.191 1.00 0.89 C ATOM 364 OG1 THR A 404 7.308 6.577 5.187 1.00 1.07 O ATOM 365 CG2 THR A 404 7.696 8.896 4.652 1.00 0.89 C ATOM 0 H THR A 404 5.675 5.649 4.395 1.00 0.82 H new ATOM 0 HA THR A 404 5.164 8.460 4.651 1.00 0.81 H new ATOM 0 HB THR A 404 7.575 7.259 3.262 1.00 0.89 H new ATOM 0 HG1 THR A 404 8.270 6.465 5.337 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.766 8.773 4.818 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.533 9.654 3.886 1.00 0.89 H new ATOM 0 HG23 THR A 404 7.218 9.209 5.580 1.00 0.89 H new ATOM 373 N LEU A 405 5.386 7.374 1.569 1.00 0.67 N ATOM 374 CA LEU A 405 5.118 7.798 0.167 1.00 0.61 C ATOM 375 C LEU A 405 3.614 8.024 -0.025 1.00 0.53 C ATOM 376 O LEU A 405 3.189 8.719 -0.926 1.00 0.52 O ATOM 377 CB LEU A 405 5.620 6.629 -0.694 1.00 0.67 C ATOM 378 CG LEU A 405 5.587 6.986 -2.190 1.00 0.65 C ATOM 379 CD1 LEU A 405 4.143 6.971 -2.694 1.00 0.57 C ATOM 380 CD2 LEU A 405 6.195 8.376 -2.422 1.00 0.64 C ATOM 0 H LEU A 405 5.613 6.387 1.688 1.00 0.67 H new ATOM 0 HA LEU A 405 5.612 8.733 -0.099 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.637 6.369 -0.402 1.00 0.67 H new ATOM 0 HB3 LEU A 405 5.002 5.749 -0.514 1.00 0.67 H new ATOM 0 HG LEU A 405 6.173 6.247 -2.737 1.00 0.65 H new ATOM 0 HD11 LEU A 405 4.125 7.224 -3.754 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.718 5.977 -2.551 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.555 7.700 -2.136 1.00 0.57 H new ATOM 0 HD21 LEU A 405 6.164 8.614 -3.485 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.624 9.120 -1.867 1.00 0.64 H new ATOM 0 HD23 LEU A 405 7.229 8.383 -2.079 1.00 0.64 H new ATOM 392 N LEU A 406 2.806 7.444 0.823 1.00 0.53 N ATOM 393 CA LEU A 406 1.333 7.620 0.700 1.00 0.50 C ATOM 394 C LEU A 406 0.890 8.897 1.419 1.00 0.49 C ATOM 395 O LEU A 406 0.056 9.634 0.934 1.00 0.45 O ATOM 396 CB LEU A 406 0.731 6.383 1.376 1.00 0.58 C ATOM 397 CG LEU A 406 -0.638 6.075 0.763 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.489 5.834 -0.740 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.220 4.820 1.417 1.00 1.02 C ATOM 0 H LEU A 406 3.107 6.854 1.598 1.00 0.53 H new ATOM 0 HA LEU A 406 1.012 7.715 -0.337 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.396 5.529 1.252 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.630 6.555 2.448 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.304 6.921 0.932 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.466 5.615 -1.172 1.00 0.94 H new ATOM 0 HD12 LEU A 406 -0.075 6.725 -1.212 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.180 4.990 -0.909 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.194 4.601 0.981 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.549 3.978 1.249 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.331 4.986 2.488 1.00 1.02 H new ATOM 411 N ALA A 407 1.441 9.166 2.571 1.00 0.56 N ATOM 412 CA ALA A 407 1.048 10.397 3.312 1.00 0.59 C ATOM 413 C ALA A 407 1.485 11.637 2.529 1.00 0.57 C ATOM 414 O ALA A 407 0.767 12.612 2.440 1.00 0.61 O ATOM 415 CB ALA A 407 1.787 10.310 4.647 1.00 0.70 C ATOM 0 H ALA A 407 2.145 8.588 3.030 1.00 0.56 H new ATOM 0 HA ALA A 407 -0.030 10.473 3.454 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.549 11.184 5.253 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.479 9.408 5.175 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.861 10.276 4.467 1.00 0.70 H new ATOM 421 N GLN A 408 2.657 11.602 1.955 1.00 0.57 N ATOM 422 CA GLN A 408 3.135 12.776 1.171 1.00 0.57 C ATOM 423 C GLN A 408 2.437 12.806 -0.192 1.00 0.50 C ATOM 424 O GLN A 408 2.078 13.853 -0.695 1.00 0.50 O ATOM 425 CB GLN A 408 4.637 12.556 1.002 1.00 0.62 C ATOM 426 CG GLN A 408 5.371 13.119 2.220 1.00 0.75 C ATOM 427 CD GLN A 408 5.991 14.471 1.864 1.00 0.78 C ATOM 428 OE1 GLN A 408 7.182 14.664 2.008 1.00 1.29 O ATOM 429 NE2 GLN A 408 5.228 15.423 1.401 1.00 1.46 N ATOM 0 H GLN A 408 3.303 10.813 1.995 1.00 0.57 H new ATOM 0 HA GLN A 408 2.920 13.724 1.664 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.850 11.493 0.894 1.00 0.62 H new ATOM 0 HB3 GLN A 408 4.988 13.045 0.093 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.679 13.233 3.054 1.00 0.75 H new ATOM 0 HG3 GLN A 408 6.147 12.425 2.543 1.00 0.75 H new ATOM 0 HE21 GLN A 408 4.228 15.262 1.280 1.00 1.46 H new ATOM 0 HE22 GLN A 408 5.631 16.328 1.160 1.00 1.46 H new ATOM 438 N TRP A 409 2.237 11.662 -0.788 1.00 0.46 N ATOM 439 CA TRP A 409 1.557 11.615 -2.115 1.00 0.43 C ATOM 440 C TRP A 409 0.140 12.194 -1.992 1.00 0.40 C ATOM 441 O TRP A 409 -0.191 13.185 -2.614 1.00 0.41 O ATOM 442 CB TRP A 409 1.528 10.120 -2.479 1.00 0.43 C ATOM 443 CG TRP A 409 0.529 9.858 -3.565 1.00 0.42 C ATOM 444 CD1 TRP A 409 0.694 10.174 -4.871 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.781 9.236 -3.453 1.00 0.40 C ATOM 446 NE1 TRP A 409 -0.436 9.785 -5.573 1.00 0.53 N ATOM 447 CE2 TRP A 409 -1.376 9.201 -4.747 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.513 8.699 -2.362 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -2.655 8.651 -4.955 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.800 8.145 -2.565 1.00 0.43 C ATOM 451 CH2 TRP A 409 -3.369 8.121 -3.859 1.00 0.48 C ATOM 0 H TRP A 409 2.516 10.755 -0.413 1.00 0.46 H new ATOM 0 HA TRP A 409 2.064 12.203 -2.880 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.518 9.801 -2.804 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.277 9.531 -1.597 1.00 0.43 H new ATOM 0 HD1 TRP A 409 1.564 10.651 -5.297 1.00 0.50 H new ATOM 0 HE1 TRP A 409 -0.558 9.914 -6.577 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -1.085 8.713 -1.370 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -3.086 8.635 -5.945 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -3.349 7.739 -1.728 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -4.351 7.697 -4.009 1.00 0.48 H new ATOM 462 N ALA A 410 -0.697 11.582 -1.199 1.00 0.42 N ATOM 463 CA ALA A 410 -2.089 12.096 -1.040 1.00 0.44 C ATOM 464 C ALA A 410 -2.067 13.592 -0.712 1.00 0.45 C ATOM 465 O ALA A 410 -2.986 14.321 -1.027 1.00 0.47 O ATOM 466 CB ALA A 410 -2.677 11.298 0.124 1.00 0.51 C ATOM 0 H ALA A 410 -0.478 10.748 -0.654 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.678 11.980 -1.950 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.703 11.619 0.304 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.667 10.236 -0.121 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -2.081 11.469 1.020 1.00 0.51 H new ATOM 472 N ASP A 411 -1.018 14.055 -0.089 1.00 0.48 N ATOM 473 CA ASP A 411 -0.933 15.505 0.250 1.00 0.53 C ATOM 474 C ASP A 411 -0.646 16.315 -1.017 1.00 0.53 C ATOM 475 O ASP A 411 -1.283 17.317 -1.286 1.00 0.58 O ATOM 476 CB ASP A 411 0.231 15.614 1.235 1.00 0.60 C ATOM 477 CG ASP A 411 0.180 16.970 1.939 1.00 1.03 C ATOM 478 OD1 ASP A 411 -0.895 17.345 2.381 1.00 1.51 O ATOM 479 OD2 ASP A 411 1.214 17.610 2.027 1.00 1.78 O ATOM 0 H ASP A 411 -0.217 13.493 0.200 1.00 0.48 H new ATOM 0 HA ASP A 411 -1.859 15.891 0.676 1.00 0.53 H new ATOM 0 HB2 ASP A 411 0.177 14.810 1.969 1.00 0.60 H new ATOM 0 HB3 ASP A 411 1.179 15.502 0.708 1.00 0.60 H new ATOM 484 N ARG A 412 0.304 15.884 -1.803 1.00 0.51 N ATOM 485 CA ARG A 412 0.626 16.624 -3.057 1.00 0.56 C ATOM 486 C ARG A 412 -0.636 16.779 -3.904 1.00 0.55 C ATOM 487 O ARG A 412 -0.899 17.825 -4.463 1.00 0.63 O ATOM 488 CB ARG A 412 1.657 15.756 -3.777 1.00 0.58 C ATOM 489 CG ARG A 412 3.037 16.407 -3.670 1.00 0.96 C ATOM 490 CD ARG A 412 3.868 16.053 -4.905 1.00 1.50 C ATOM 491 NE ARG A 412 5.130 16.829 -4.754 1.00 1.90 N ATOM 492 CZ ARG A 412 5.984 16.509 -3.822 1.00 2.41 C ATOM 493 NH1 ARG A 412 6.860 15.565 -4.035 1.00 2.89 N ATOM 494 NH2 ARG A 412 5.964 17.132 -2.676 1.00 3.02 N ATOM 0 H ARG A 412 0.870 15.053 -1.631 1.00 0.51 H new ATOM 0 HA ARG A 412 1.008 17.626 -2.865 1.00 0.56 H new ATOM 0 HB2 ARG A 412 1.679 14.759 -3.338 1.00 0.58 H new ATOM 0 HB3 ARG A 412 1.380 15.637 -4.824 1.00 0.58 H new ATOM 0 HG2 ARG A 412 2.934 17.489 -3.586 1.00 0.96 H new ATOM 0 HG3 ARG A 412 3.543 16.064 -2.768 1.00 0.96 H new ATOM 0 HD2 ARG A 412 4.066 14.982 -4.954 1.00 1.50 H new ATOM 0 HD3 ARG A 412 3.346 16.323 -5.823 1.00 1.50 H new ATOM 0 HE ARG A 412 5.326 17.611 -5.379 1.00 1.90 H new ATOM 0 HH11 ARG A 412 6.877 15.077 -4.931 1.00 2.89 H new ATOM 0 HH12 ARG A 412 7.528 15.315 -3.306 1.00 2.89 H new ATOM 0 HH21 ARG A 412 5.280 17.870 -2.509 1.00 3.02 H new ATOM 0 HH22 ARG A 412 6.632 16.881 -1.947 1.00 3.02 H new ATOM 508 N ALA A 413 -1.424 15.745 -3.991 1.00 0.50 N ATOM 509 CA ALA A 413 -2.679 15.829 -4.790 1.00 0.53 C ATOM 510 C ALA A 413 -3.670 16.762 -4.092 1.00 0.57 C ATOM 511 O ALA A 413 -4.434 17.462 -4.726 1.00 0.66 O ATOM 512 CB ALA A 413 -3.223 14.401 -4.831 1.00 0.53 C ATOM 0 H ALA A 413 -1.254 14.844 -3.543 1.00 0.50 H new ATOM 0 HA ALA A 413 -2.511 16.224 -5.792 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -4.150 14.381 -5.404 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -2.491 13.746 -5.303 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -3.417 14.056 -3.815 1.00 0.53 H new ATOM 518 N LEU A 414 -3.656 16.781 -2.787 1.00 0.54 N ATOM 519 CA LEU A 414 -4.589 17.673 -2.043 1.00 0.61 C ATOM 520 C LEU A 414 -4.430 19.113 -2.533 1.00 0.71 C ATOM 521 O LEU A 414 -5.395 19.794 -2.818 1.00 0.82 O ATOM 522 CB LEU A 414 -4.164 17.555 -0.578 1.00 0.63 C ATOM 523 CG LEU A 414 -5.401 17.389 0.304 1.00 0.71 C ATOM 524 CD1 LEU A 414 -6.106 16.076 -0.043 1.00 1.11 C ATOM 525 CD2 LEU A 414 -4.976 17.365 1.775 1.00 1.04 C ATOM 0 H LEU A 414 -3.038 16.217 -2.204 1.00 0.54 H new ATOM 0 HA LEU A 414 -5.634 17.398 -2.186 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -3.497 16.702 -0.450 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -3.608 18.443 -0.278 1.00 0.63 H new ATOM 0 HG LEU A 414 -6.083 18.222 0.133 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -6.988 15.959 0.587 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -6.407 16.091 -1.090 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -5.426 15.242 0.127 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -5.857 17.247 2.406 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -4.294 16.531 1.943 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -4.474 18.300 2.024 1.00 1.04 H new ATOM 537 N ARG A 415 -3.215 19.579 -2.633 1.00 0.73 N ATOM 538 CA ARG A 415 -2.986 20.972 -3.107 1.00 0.86 C ATOM 539 C ARG A 415 -2.993 21.029 -4.641 1.00 0.92 C ATOM 540 O ARG A 415 -2.987 22.093 -5.227 1.00 1.26 O ATOM 541 CB ARG A 415 -1.608 21.350 -2.563 1.00 1.01 C ATOM 542 CG ARG A 415 -1.685 21.503 -1.042 1.00 1.40 C ATOM 543 CD ARG A 415 -1.931 22.972 -0.688 1.00 1.61 C ATOM 544 NE ARG A 415 -3.345 23.022 -0.225 1.00 2.27 N ATOM 545 CZ ARG A 415 -4.011 24.143 -0.286 1.00 2.92 C ATOM 546 NH1 ARG A 415 -3.748 25.105 0.557 1.00 3.32 N ATOM 547 NH2 ARG A 415 -4.938 24.303 -1.189 1.00 3.70 N ATOM 0 H ARG A 415 -2.370 19.054 -2.406 1.00 0.73 H new ATOM 0 HA ARG A 415 -3.765 21.654 -2.766 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -0.879 20.584 -2.826 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -1.269 22.282 -3.016 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -2.488 20.883 -0.644 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -0.758 21.158 -0.584 1.00 1.40 H new ATOM 0 HD2 ARG A 415 -1.248 23.311 0.091 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -1.775 23.618 -1.552 1.00 1.61 H new ATOM 0 HE ARG A 415 -3.793 22.181 0.139 1.00 2.27 H new ATOM 0 HH11 ARG A 415 -3.022 24.980 1.263 1.00 3.32 H new ATOM 0 HH12 ARG A 415 -4.268 25.981 0.510 1.00 3.32 H new ATOM 0 HH21 ARG A 415 -5.143 23.552 -1.848 1.00 3.70 H new ATOM 0 HH22 ARG A 415 -5.458 25.179 -1.236 1.00 3.70 H new ATOM 561 N SER A 416 -3.003 19.898 -5.297 1.00 0.90 N ATOM 562 CA SER A 416 -3.008 19.903 -6.789 1.00 0.99 C ATOM 563 C SER A 416 -4.413 19.598 -7.317 1.00 0.99 C ATOM 564 O SER A 416 -5.148 20.487 -7.701 1.00 1.63 O ATOM 565 CB SER A 416 -2.033 18.797 -7.190 1.00 1.20 C ATOM 566 OG SER A 416 -0.756 19.367 -7.447 1.00 1.69 O ATOM 0 H SER A 416 -3.008 18.974 -4.865 1.00 0.90 H new ATOM 0 HA SER A 416 -2.720 20.871 -7.199 1.00 0.99 H new ATOM 0 HB2 SER A 416 -1.960 18.055 -6.395 1.00 1.20 H new ATOM 0 HB3 SER A 416 -2.398 18.279 -8.077 1.00 1.20 H new ATOM 0 HG SER A 416 -0.128 18.660 -7.703 1.00 1.69 H new ATOM 572 N GLY A 417 -4.791 18.349 -7.340 1.00 1.06 N ATOM 573 CA GLY A 417 -6.147 17.990 -7.843 1.00 1.06 C ATOM 574 C GLY A 417 -6.537 16.607 -7.319 1.00 0.99 C ATOM 575 O GLY A 417 -6.704 15.670 -8.075 1.00 1.31 O ATOM 0 H GLY A 417 -4.220 17.562 -7.032 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -6.875 18.733 -7.517 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -6.155 17.993 -8.933 1.00 1.06 H new ATOM 579 N HIS A 418 -6.684 16.470 -6.030 1.00 0.78 N ATOM 580 CA HIS A 418 -7.064 15.147 -5.455 1.00 0.87 C ATOM 581 C HIS A 418 -8.386 14.661 -6.057 1.00 0.89 C ATOM 582 O HIS A 418 -9.343 15.403 -6.158 1.00 1.17 O ATOM 583 CB HIS A 418 -7.220 15.395 -3.952 1.00 1.01 C ATOM 584 CG HIS A 418 -8.197 16.516 -3.722 1.00 1.68 C ATOM 585 ND1 HIS A 418 -7.789 17.831 -3.562 1.00 2.18 N ATOM 586 CD2 HIS A 418 -9.566 16.534 -3.624 1.00 2.31 C ATOM 587 CE1 HIS A 418 -8.893 18.579 -3.378 1.00 2.86 C ATOM 588 NE2 HIS A 418 -10.003 17.838 -3.407 1.00 2.97 N ATOM 0 H HIS A 418 -6.557 17.218 -5.348 1.00 0.78 H new ATOM 0 HA HIS A 418 -6.319 14.380 -5.668 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -7.569 14.488 -3.458 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -6.254 15.645 -3.513 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -10.207 15.668 -3.703 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -8.882 19.648 -3.226 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -10.965 18.158 -3.294 1.00 2.97 H new ATOM 596 N GLN A 419 -8.446 13.419 -6.454 1.00 1.08 N ATOM 597 CA GLN A 419 -9.705 12.884 -7.045 1.00 1.25 C ATOM 598 C GLN A 419 -9.719 11.354 -6.957 1.00 1.03 C ATOM 599 O GLN A 419 -10.368 10.778 -6.106 1.00 1.28 O ATOM 600 CB GLN A 419 -9.687 13.342 -8.503 1.00 1.71 C ATOM 601 CG GLN A 419 -10.873 14.275 -8.760 1.00 2.33 C ATOM 602 CD GLN A 419 -10.635 15.060 -10.053 1.00 2.91 C ATOM 603 OE1 GLN A 419 -10.587 16.273 -10.040 1.00 3.29 O ATOM 604 NE2 GLN A 419 -10.484 14.412 -11.176 1.00 3.52 N ATOM 0 H GLN A 419 -7.677 12.752 -6.394 1.00 1.08 H new ATOM 0 HA GLN A 419 -10.592 13.240 -6.521 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -8.752 13.857 -8.722 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -9.739 12.479 -9.167 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -11.794 13.697 -8.837 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -10.997 14.962 -7.923 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -10.524 13.393 -11.186 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -10.326 14.925 -12.043 1.00 3.52 H new ATOM 613 N ASN A 420 -9.009 10.692 -7.829 1.00 0.78 N ATOM 614 CA ASN A 420 -8.981 9.203 -7.792 1.00 0.70 C ATOM 615 C ASN A 420 -7.835 8.715 -6.900 1.00 0.58 C ATOM 616 O ASN A 420 -7.072 7.847 -7.274 1.00 0.71 O ATOM 617 CB ASN A 420 -8.752 8.772 -9.241 1.00 0.86 C ATOM 618 CG ASN A 420 -9.873 9.328 -10.123 1.00 1.35 C ATOM 619 OD1 ASN A 420 -10.833 9.882 -9.627 1.00 1.96 O ATOM 620 ND2 ASN A 420 -9.790 9.201 -11.419 1.00 1.88 N ATOM 0 H ASN A 420 -8.447 11.118 -8.566 1.00 0.78 H new ATOM 0 HA ASN A 420 -9.901 8.785 -7.383 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -7.786 9.135 -9.591 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -8.727 7.684 -9.308 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -10.532 9.567 -12.016 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -8.983 8.736 -11.835 1.00 1.88 H new ATOM 627 N LEU A 421 -7.706 9.270 -5.726 1.00 0.45 N ATOM 628 CA LEU A 421 -6.606 8.840 -4.814 1.00 0.40 C ATOM 629 C LEU A 421 -6.726 7.346 -4.502 1.00 0.39 C ATOM 630 O LEU A 421 -5.939 6.540 -4.958 1.00 0.53 O ATOM 631 CB LEU A 421 -6.799 9.669 -3.542 1.00 0.42 C ATOM 632 CG LEU A 421 -5.977 10.956 -3.640 1.00 0.39 C ATOM 633 CD1 LEU A 421 -6.910 12.167 -3.604 1.00 0.50 C ATOM 634 CD2 LEU A 421 -5.005 11.034 -2.461 1.00 0.41 C ATOM 0 H LEU A 421 -8.314 10.002 -5.358 1.00 0.45 H new ATOM 0 HA LEU A 421 -5.622 8.993 -5.257 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -7.854 9.908 -3.408 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -6.490 9.093 -2.670 1.00 0.42 H new ATOM 0 HG LEU A 421 -5.419 10.954 -4.576 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.322 13.082 -3.674 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -7.604 12.117 -4.443 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.471 12.167 -2.669 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.420 11.951 -2.532 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.566 11.033 -1.526 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.336 10.174 -2.484 1.00 0.41 H new ATOM 646 N LEU A 422 -7.704 6.971 -3.723 1.00 0.33 N ATOM 647 CA LEU A 422 -7.875 5.530 -3.373 1.00 0.34 C ATOM 648 C LEU A 422 -7.845 4.660 -4.634 1.00 0.35 C ATOM 649 O LEU A 422 -7.503 3.494 -4.589 1.00 0.37 O ATOM 650 CB LEU A 422 -9.246 5.449 -2.702 1.00 0.37 C ATOM 651 CG LEU A 422 -9.084 5.624 -1.191 1.00 0.38 C ATOM 652 CD1 LEU A 422 -10.423 6.036 -0.576 1.00 0.58 C ATOM 653 CD2 LEU A 422 -8.623 4.302 -0.572 1.00 0.63 C ATOM 0 H LEU A 422 -8.394 7.601 -3.313 1.00 0.33 H new ATOM 0 HA LEU A 422 -7.076 5.169 -2.725 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.904 6.221 -3.100 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.713 4.489 -2.920 1.00 0.37 H new ATOM 0 HG LEU A 422 -8.342 6.397 -0.993 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -10.306 6.160 0.501 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.751 6.977 -1.016 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -11.167 5.264 -0.773 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -8.507 4.425 0.505 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -9.365 3.529 -0.771 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -7.668 4.009 -1.008 1.00 0.63 H new ATOM 665 N SER A 423 -8.204 5.216 -5.757 1.00 0.35 N ATOM 666 CA SER A 423 -8.199 4.420 -7.020 1.00 0.38 C ATOM 667 C SER A 423 -6.767 4.240 -7.539 1.00 0.36 C ATOM 668 O SER A 423 -6.508 3.406 -8.383 1.00 0.40 O ATOM 669 CB SER A 423 -9.025 5.243 -8.007 1.00 0.44 C ATOM 670 OG SER A 423 -10.399 5.161 -7.651 1.00 1.23 O ATOM 0 H SER A 423 -8.501 6.187 -5.857 1.00 0.35 H new ATOM 0 HA SER A 423 -8.607 3.420 -6.875 1.00 0.38 H new ATOM 0 HB2 SER A 423 -8.696 6.282 -7.997 1.00 0.44 H new ATOM 0 HB3 SER A 423 -8.877 4.872 -9.021 1.00 0.44 H new ATOM 0 HG SER A 423 -10.932 5.689 -8.281 1.00 1.23 H new ATOM 676 N GLU A 424 -5.837 5.015 -7.048 1.00 0.34 N ATOM 677 CA GLU A 424 -4.428 4.880 -7.525 1.00 0.36 C ATOM 678 C GLU A 424 -3.695 3.795 -6.731 1.00 0.32 C ATOM 679 O GLU A 424 -3.109 2.891 -7.293 1.00 0.33 O ATOM 680 CB GLU A 424 -3.793 6.249 -7.276 1.00 0.38 C ATOM 681 CG GLU A 424 -3.559 6.952 -8.615 1.00 0.58 C ATOM 682 CD GLU A 424 -3.155 8.406 -8.367 1.00 0.81 C ATOM 683 OE1 GLU A 424 -2.001 8.633 -8.041 1.00 1.54 O ATOM 684 OE2 GLU A 424 -4.007 9.269 -8.505 1.00 1.22 O ATOM 0 H GLU A 424 -5.990 5.733 -6.340 1.00 0.34 H new ATOM 0 HA GLU A 424 -4.376 4.590 -8.574 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.443 6.854 -6.644 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -2.849 6.133 -6.744 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -2.779 6.438 -9.176 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -4.465 6.914 -9.221 1.00 0.58 H new ATOM 691 N ALA A 425 -3.723 3.875 -5.427 1.00 0.31 N ATOM 692 CA ALA A 425 -3.026 2.843 -4.602 1.00 0.29 C ATOM 693 C ALA A 425 -3.850 1.552 -4.556 1.00 0.28 C ATOM 694 O ALA A 425 -3.345 0.493 -4.242 1.00 0.28 O ATOM 695 CB ALA A 425 -2.916 3.459 -3.207 1.00 0.29 C ATOM 0 H ALA A 425 -4.196 4.607 -4.898 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.050 2.580 -5.010 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.413 2.760 -2.539 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.342 4.384 -3.262 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -3.914 3.673 -2.824 1.00 0.29 H new ATOM 701 N GLN A 426 -5.116 1.634 -4.865 1.00 0.30 N ATOM 702 CA GLN A 426 -5.977 0.415 -4.842 1.00 0.31 C ATOM 703 C GLN A 426 -5.307 -0.751 -5.586 1.00 0.30 C ATOM 704 O GLN A 426 -5.103 -1.804 -5.016 1.00 0.30 O ATOM 705 CB GLN A 426 -7.267 0.832 -5.548 1.00 0.36 C ATOM 706 CG GLN A 426 -8.420 0.832 -4.543 1.00 0.45 C ATOM 707 CD GLN A 426 -9.719 1.217 -5.256 1.00 0.54 C ATOM 708 OE1 GLN A 426 -9.792 1.186 -6.469 1.00 1.23 O ATOM 709 NE2 GLN A 426 -10.754 1.580 -4.549 1.00 1.09 N ATOM 0 H GLN A 426 -5.593 2.495 -5.133 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.156 0.065 -3.825 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.151 1.824 -5.985 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.484 0.146 -6.367 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -8.520 -0.154 -4.089 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -8.213 1.535 -3.736 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -10.693 1.606 -3.531 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.624 1.838 -5.014 1.00 1.09 H new ATOM 718 N PRO A 427 -4.986 -0.534 -6.840 1.00 0.32 N ATOM 719 CA PRO A 427 -4.339 -1.600 -7.650 1.00 0.34 C ATOM 720 C PRO A 427 -2.929 -1.900 -7.138 1.00 0.31 C ATOM 721 O PRO A 427 -2.436 -3.001 -7.269 1.00 0.35 O ATOM 722 CB PRO A 427 -4.299 -1.008 -9.058 1.00 0.39 C ATOM 723 CG PRO A 427 -4.347 0.469 -8.850 1.00 0.38 C ATOM 724 CD PRO A 427 -5.185 0.697 -7.621 1.00 0.35 C ATOM 0 HA PRO A 427 -4.874 -2.548 -7.606 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -3.393 -1.304 -9.586 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.143 -1.351 -9.656 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.344 0.875 -8.717 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -4.782 0.969 -9.715 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -4.859 1.579 -7.070 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.235 0.848 -7.873 1.00 0.35 H new ATOM 732 N GLU A 428 -2.272 -0.936 -6.556 1.00 0.29 N ATOM 733 CA GLU A 428 -0.894 -1.186 -6.041 1.00 0.29 C ATOM 734 C GLU A 428 -0.909 -2.320 -5.011 1.00 0.27 C ATOM 735 O GLU A 428 -0.232 -3.319 -5.161 1.00 0.32 O ATOM 736 CB GLU A 428 -0.468 0.130 -5.389 1.00 0.29 C ATOM 737 CG GLU A 428 1.024 0.361 -5.634 1.00 0.71 C ATOM 738 CD GLU A 428 1.359 1.834 -5.393 1.00 1.37 C ATOM 739 OE1 GLU A 428 0.624 2.477 -4.661 1.00 2.07 O ATOM 740 OE2 GLU A 428 2.345 2.296 -5.945 1.00 2.12 O ATOM 0 H GLU A 428 -2.626 0.010 -6.414 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.207 -1.488 -6.832 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.047 0.956 -5.801 1.00 0.29 H new ATOM 0 HB3 GLU A 428 -0.671 0.100 -4.319 1.00 0.29 H new ATOM 0 HG2 GLU A 428 1.614 -0.270 -4.970 1.00 0.71 H new ATOM 0 HG3 GLU A 428 1.283 0.080 -6.655 1.00 0.71 H new ATOM 747 N LEU A 429 -1.676 -2.174 -3.965 1.00 0.26 N ATOM 748 CA LEU A 429 -1.736 -3.242 -2.926 1.00 0.26 C ATOM 749 C LEU A 429 -2.324 -4.527 -3.519 1.00 0.25 C ATOM 750 O LEU A 429 -1.757 -5.595 -3.398 1.00 0.28 O ATOM 751 CB LEU A 429 -2.652 -2.681 -1.838 1.00 0.26 C ATOM 752 CG LEU A 429 -2.898 -3.748 -0.769 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.479 -3.209 0.599 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.385 -4.105 -0.738 1.00 0.56 C ATOM 0 H LEU A 429 -2.264 -1.361 -3.785 1.00 0.26 H new ATOM 0 HA LEU A 429 -0.750 -3.498 -2.537 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.198 -1.798 -1.387 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -3.599 -2.365 -2.274 1.00 0.26 H new ATOM 0 HG LEU A 429 -2.313 -4.637 -1.005 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -2.655 -3.970 1.359 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.420 -2.953 0.580 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -3.063 -2.319 0.834 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -4.561 -4.865 0.023 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -4.968 -3.215 -0.503 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -4.687 -4.490 -1.712 1.00 0.56 H new ATOM 766 N GLU A 430 -3.460 -4.432 -4.154 1.00 0.27 N ATOM 767 CA GLU A 430 -4.087 -5.648 -4.749 1.00 0.28 C ATOM 768 C GLU A 430 -3.128 -6.311 -5.743 1.00 0.30 C ATOM 769 O GLU A 430 -3.254 -7.478 -6.054 1.00 0.33 O ATOM 770 CB GLU A 430 -5.336 -5.135 -5.468 1.00 0.30 C ATOM 771 CG GLU A 430 -6.573 -5.428 -4.615 1.00 0.61 C ATOM 772 CD GLU A 430 -6.927 -4.193 -3.785 1.00 1.45 C ATOM 773 OE1 GLU A 430 -7.346 -3.210 -4.372 1.00 2.18 O ATOM 774 OE2 GLU A 430 -6.772 -4.252 -2.576 1.00 2.05 O ATOM 0 H GLU A 430 -3.982 -3.566 -4.287 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.327 -6.399 -3.996 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -5.251 -4.063 -5.648 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.431 -5.615 -6.442 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -7.412 -5.702 -5.255 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -6.382 -6.277 -3.959 1.00 0.61 H new ATOM 781 N ARG A 431 -2.172 -5.576 -6.244 1.00 0.33 N ATOM 782 CA ARG A 431 -1.209 -6.170 -7.219 1.00 0.37 C ATOM 783 C ARG A 431 -0.191 -7.051 -6.490 1.00 0.36 C ATOM 784 O ARG A 431 -0.066 -8.228 -6.763 1.00 0.38 O ATOM 785 CB ARG A 431 -0.513 -4.974 -7.872 1.00 0.41 C ATOM 786 CG ARG A 431 0.574 -5.472 -8.825 1.00 0.59 C ATOM 787 CD ARG A 431 0.855 -4.403 -9.885 1.00 1.32 C ATOM 788 NE ARG A 431 1.600 -5.114 -10.960 1.00 1.56 N ATOM 789 CZ ARG A 431 2.494 -4.476 -11.667 1.00 2.19 C ATOM 790 NH1 ARG A 431 2.219 -3.298 -12.156 1.00 2.87 N ATOM 791 NH2 ARG A 431 3.661 -5.018 -11.884 1.00 2.78 N ATOM 0 H ARG A 431 -2.015 -4.593 -6.022 1.00 0.33 H new ATOM 0 HA ARG A 431 -1.706 -6.802 -7.954 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.239 -4.370 -8.416 1.00 0.41 H new ATOM 0 HB3 ARG A 431 -0.075 -4.333 -7.107 1.00 0.41 H new ATOM 0 HG2 ARG A 431 1.485 -5.696 -8.269 1.00 0.59 H new ATOM 0 HG3 ARG A 431 0.256 -6.399 -9.303 1.00 0.59 H new ATOM 0 HD2 ARG A 431 -0.071 -3.971 -10.265 1.00 1.32 H new ATOM 0 HD3 ARG A 431 1.443 -3.583 -9.473 1.00 1.32 H new ATOM 0 HE ARG A 431 1.412 -6.099 -11.144 1.00 1.56 H new ATOM 0 HH11 ARG A 431 1.306 -2.876 -11.986 1.00 2.87 H new ATOM 0 HH12 ARG A 431 2.917 -2.799 -12.708 1.00 2.87 H new ATOM 0 HH21 ARG A 431 3.875 -5.939 -11.502 1.00 2.78 H new ATOM 0 HH22 ARG A 431 4.360 -4.520 -12.436 1.00 2.78 H new ATOM 805 N THR A 432 0.540 -6.490 -5.565 1.00 0.41 N ATOM 806 CA THR A 432 1.551 -7.299 -4.822 1.00 0.45 C ATOM 807 C THR A 432 0.867 -8.447 -4.072 1.00 0.40 C ATOM 808 O THR A 432 1.492 -9.423 -3.710 1.00 0.56 O ATOM 809 CB THR A 432 2.196 -6.322 -3.837 1.00 0.53 C ATOM 810 OG1 THR A 432 2.863 -5.296 -4.561 1.00 0.61 O ATOM 811 CG2 THR A 432 3.203 -7.067 -2.959 1.00 0.62 C ATOM 0 H THR A 432 0.482 -5.509 -5.292 1.00 0.41 H new ATOM 0 HA THR A 432 2.286 -7.751 -5.488 1.00 0.45 H new ATOM 0 HB THR A 432 1.425 -5.881 -3.205 1.00 0.53 H new ATOM 0 HG1 THR A 432 3.276 -4.668 -3.933 1.00 0.61 H new ATOM 0 HG21 THR A 432 3.661 -6.369 -2.258 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.691 -7.854 -2.405 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.976 -7.510 -3.587 1.00 0.62 H new ATOM 819 N LEU A 433 -0.412 -8.339 -3.838 1.00 0.33 N ATOM 820 CA LEU A 433 -1.132 -9.426 -3.113 1.00 0.30 C ATOM 821 C LEU A 433 -1.567 -10.516 -4.097 1.00 0.27 C ATOM 822 O LEU A 433 -1.404 -11.694 -3.845 1.00 0.25 O ATOM 823 CB LEU A 433 -2.352 -8.747 -2.491 1.00 0.37 C ATOM 824 CG LEU A 433 -2.497 -9.195 -1.036 1.00 0.42 C ATOM 825 CD1 LEU A 433 -2.670 -10.715 -0.984 1.00 0.41 C ATOM 826 CD2 LEU A 433 -1.241 -8.799 -0.257 1.00 0.44 C ATOM 0 H LEU A 433 -0.990 -7.546 -4.117 1.00 0.33 H new ATOM 0 HA LEU A 433 -0.507 -9.907 -2.361 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -2.243 -7.664 -2.540 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -3.250 -9.003 -3.053 1.00 0.37 H new ATOM 0 HG LEU A 433 -3.369 -8.715 -0.592 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -2.773 -11.034 0.053 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -3.562 -10.999 -1.542 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -1.798 -11.196 -1.426 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -1.341 -9.117 0.781 1.00 0.44 H new ATOM 0 HD22 LEU A 433 -0.370 -9.281 -0.702 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -1.116 -7.717 -0.294 1.00 0.44 H new ATOM 838 N LEU A 434 -2.119 -10.132 -5.214 1.00 0.32 N ATOM 839 CA LEU A 434 -2.565 -11.145 -6.214 1.00 0.32 C ATOM 840 C LEU A 434 -1.367 -11.953 -6.717 1.00 0.29 C ATOM 841 O LEU A 434 -1.419 -13.162 -6.816 1.00 0.30 O ATOM 842 CB LEU A 434 -3.179 -10.332 -7.352 1.00 0.41 C ATOM 843 CG LEU A 434 -4.184 -11.196 -8.114 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.547 -11.122 -7.424 1.00 0.84 C ATOM 845 CD2 LEU A 434 -4.312 -10.682 -9.549 1.00 1.14 C ATOM 0 H LEU A 434 -2.281 -9.160 -5.479 1.00 0.32 H new ATOM 0 HA LEU A 434 -3.274 -11.858 -5.793 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -3.674 -9.446 -6.954 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.397 -9.984 -8.027 1.00 0.41 H new ATOM 0 HG LEU A 434 -3.838 -12.230 -8.126 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -6.264 -11.738 -7.967 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.457 -11.487 -6.401 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -5.893 -10.088 -7.412 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -5.028 -11.297 -10.093 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -4.658 -9.648 -9.536 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -3.341 -10.734 -10.042 1.00 1.14 H new ATOM 857 N THR A 435 -0.285 -11.294 -7.034 1.00 0.34 N ATOM 858 CA THR A 435 0.914 -12.028 -7.530 1.00 0.37 C ATOM 859 C THR A 435 1.428 -12.987 -6.453 1.00 0.35 C ATOM 860 O THR A 435 1.739 -14.129 -6.722 1.00 0.39 O ATOM 861 CB THR A 435 1.951 -10.943 -7.824 1.00 0.45 C ATOM 862 OG1 THR A 435 1.336 -9.889 -8.551 1.00 0.52 O ATOM 863 CG2 THR A 435 3.095 -11.536 -8.649 1.00 0.55 C ATOM 0 H THR A 435 -0.180 -10.281 -6.971 1.00 0.34 H new ATOM 0 HA THR A 435 0.695 -12.629 -8.412 1.00 0.37 H new ATOM 0 HB THR A 435 2.348 -10.555 -6.886 1.00 0.45 H new ATOM 0 HG1 THR A 435 0.981 -9.223 -7.925 1.00 0.52 H new ATOM 0 HG21 THR A 435 3.833 -10.761 -8.857 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.566 -12.345 -8.090 1.00 0.55 H new ATOM 0 HG23 THR A 435 2.702 -11.925 -9.588 1.00 0.55 H new ATOM 871 N THR A 436 1.516 -12.530 -5.233 1.00 0.33 N ATOM 872 CA THR A 436 2.006 -13.416 -4.139 1.00 0.36 C ATOM 873 C THR A 436 1.111 -14.652 -4.027 1.00 0.36 C ATOM 874 O THR A 436 1.553 -15.768 -4.216 1.00 0.40 O ATOM 875 CB THR A 436 1.915 -12.568 -2.870 1.00 0.38 C ATOM 876 OG1 THR A 436 2.718 -11.406 -3.021 1.00 0.39 O ATOM 877 CG2 THR A 436 2.407 -13.379 -1.672 1.00 0.49 C ATOM 0 H THR A 436 1.270 -11.582 -4.947 1.00 0.33 H new ATOM 0 HA THR A 436 3.021 -13.772 -4.316 1.00 0.36 H new ATOM 0 HB THR A 436 0.878 -12.275 -2.703 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.145 -10.611 -3.031 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.341 -12.771 -0.769 1.00 0.49 H new ATOM 0 HG22 THR A 436 1.789 -14.269 -1.557 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.443 -13.676 -1.834 1.00 0.49 H new ATOM 885 N ALA A 437 -0.144 -14.463 -3.726 1.00 0.34 N ATOM 886 CA ALA A 437 -1.061 -15.632 -3.610 1.00 0.36 C ATOM 887 C ALA A 437 -1.017 -16.452 -4.899 1.00 0.36 C ATOM 888 O ALA A 437 -1.008 -17.667 -4.869 1.00 0.41 O ATOM 889 CB ALA A 437 -2.450 -15.030 -3.395 1.00 0.35 C ATOM 0 H ALA A 437 -0.573 -13.553 -3.556 1.00 0.34 H new ATOM 0 HA ALA A 437 -0.785 -16.302 -2.795 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -3.183 -15.831 -3.300 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -2.449 -14.429 -2.486 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.709 -14.400 -4.246 1.00 0.35 H new ATOM 895 N LEU A 438 -0.976 -15.804 -6.033 1.00 0.34 N ATOM 896 CA LEU A 438 -0.918 -16.568 -7.309 1.00 0.36 C ATOM 897 C LEU A 438 0.336 -17.441 -7.319 1.00 0.42 C ATOM 898 O LEU A 438 0.317 -18.563 -7.778 1.00 0.46 O ATOM 899 CB LEU A 438 -0.857 -15.520 -8.426 1.00 0.36 C ATOM 900 CG LEU A 438 -0.596 -16.217 -9.768 1.00 0.41 C ATOM 901 CD1 LEU A 438 -1.673 -17.274 -10.022 1.00 0.42 C ATOM 902 CD2 LEU A 438 -0.630 -15.190 -10.901 1.00 0.45 C ATOM 0 H LEU A 438 -0.980 -14.789 -6.129 1.00 0.34 H new ATOM 0 HA LEU A 438 -1.779 -17.224 -7.437 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.793 -14.964 -8.469 1.00 0.36 H new ATOM 0 HB3 LEU A 438 -0.067 -14.798 -8.219 1.00 0.36 H new ATOM 0 HG LEU A 438 0.384 -16.693 -9.733 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -1.483 -17.765 -10.976 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -1.652 -18.014 -9.222 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -2.652 -16.796 -10.049 1.00 0.42 H new ATOM 0 HD21 LEU A 438 -0.444 -15.690 -11.851 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -1.609 -14.711 -10.929 1.00 0.45 H new ATOM 0 HD23 LEU A 438 0.139 -14.436 -10.732 1.00 0.45 H new ATOM 914 N ARG A 439 1.430 -16.937 -6.807 1.00 0.43 N ATOM 915 CA ARG A 439 2.680 -17.751 -6.782 1.00 0.51 C ATOM 916 C ARG A 439 2.379 -19.121 -6.168 1.00 0.54 C ATOM 917 O ARG A 439 2.845 -20.140 -6.636 1.00 0.61 O ATOM 918 CB ARG A 439 3.657 -16.966 -5.907 1.00 0.52 C ATOM 919 CG ARG A 439 4.951 -16.719 -6.685 1.00 0.77 C ATOM 920 CD ARG A 439 5.989 -17.774 -6.302 1.00 1.28 C ATOM 921 NE ARG A 439 7.148 -17.518 -7.201 1.00 1.74 N ATOM 922 CZ ARG A 439 7.959 -18.491 -7.515 1.00 2.28 C ATOM 923 NH1 ARG A 439 7.534 -19.480 -8.255 1.00 2.89 N ATOM 924 NH2 ARG A 439 9.194 -18.475 -7.093 1.00 2.82 N ATOM 0 H ARG A 439 1.511 -16.002 -6.407 1.00 0.43 H new ATOM 0 HA ARG A 439 3.091 -17.922 -7.777 1.00 0.51 H new ATOM 0 HB2 ARG A 439 3.213 -16.017 -5.608 1.00 0.52 H new ATOM 0 HB3 ARG A 439 3.870 -17.520 -4.993 1.00 0.52 H new ATOM 0 HG2 ARG A 439 4.756 -16.758 -7.757 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.334 -15.722 -6.467 1.00 0.77 H new ATOM 0 HD2 ARG A 439 6.275 -17.684 -5.254 1.00 1.28 H new ATOM 0 HD3 ARG A 439 5.597 -18.782 -6.440 1.00 1.28 H new ATOM 0 HE ARG A 439 7.308 -16.581 -7.572 1.00 1.74 H new ATOM 0 HH11 ARG A 439 6.569 -19.491 -8.587 1.00 2.89 H new ATOM 0 HH12 ARG A 439 8.167 -20.241 -8.501 1.00 2.89 H new ATOM 0 HH21 ARG A 439 9.526 -17.701 -6.517 1.00 2.82 H new ATOM 0 HH22 ARG A 439 9.827 -19.236 -7.339 1.00 2.82 H new ATOM 938 N HIS A 440 1.576 -19.149 -5.139 1.00 0.52 N ATOM 939 CA HIS A 440 1.215 -20.450 -4.516 1.00 0.57 C ATOM 940 C HIS A 440 0.527 -21.319 -5.569 1.00 0.58 C ATOM 941 O HIS A 440 0.617 -22.531 -5.557 1.00 0.64 O ATOM 942 CB HIS A 440 0.249 -20.091 -3.386 1.00 0.56 C ATOM 943 CG HIS A 440 -0.164 -21.341 -2.661 1.00 0.63 C ATOM 944 ND1 HIS A 440 -1.209 -21.357 -1.751 1.00 1.04 N ATOM 945 CD2 HIS A 440 0.320 -22.626 -2.700 1.00 0.82 C ATOM 946 CE1 HIS A 440 -1.321 -22.614 -1.283 1.00 0.96 C ATOM 947 NE2 HIS A 440 -0.413 -23.427 -1.829 1.00 0.75 N ATOM 0 H HIS A 440 1.156 -18.327 -4.705 1.00 0.52 H new ATOM 0 HA HIS A 440 2.074 -21.004 -4.138 1.00 0.57 H new ATOM 0 HB2 HIS A 440 0.725 -19.397 -2.693 1.00 0.56 H new ATOM 0 HB3 HIS A 440 -0.628 -19.586 -3.790 1.00 0.56 H new ATOM 0 HD2 HIS A 440 1.143 -22.963 -3.313 1.00 0.82 H new ATOM 0 HE1 HIS A 440 -2.055 -22.927 -0.555 1.00 0.96 H new ATOM 0 HE2 HIS A 440 -0.284 -24.422 -1.647 1.00 0.75 H new ATOM 955 N THR A 441 -0.149 -20.690 -6.493 1.00 0.54 N ATOM 956 CA THR A 441 -0.840 -21.442 -7.578 1.00 0.55 C ATOM 957 C THR A 441 -0.436 -20.846 -8.929 1.00 0.56 C ATOM 958 O THR A 441 -1.271 -20.521 -9.749 1.00 0.55 O ATOM 959 CB THR A 441 -2.339 -21.234 -7.330 1.00 0.53 C ATOM 960 OG1 THR A 441 -2.675 -19.879 -7.591 1.00 0.48 O ATOM 961 CG2 THR A 441 -2.681 -21.575 -5.877 1.00 0.54 C ATOM 0 H THR A 441 -0.252 -19.676 -6.542 1.00 0.54 H new ATOM 0 HA THR A 441 -0.583 -22.501 -7.586 1.00 0.55 H new ATOM 0 HB THR A 441 -2.907 -21.888 -7.992 1.00 0.53 H new ATOM 0 HG1 THR A 441 -2.652 -19.716 -8.557 1.00 0.48 H new ATOM 0 HG21 THR A 441 -3.747 -21.425 -5.709 1.00 0.54 H new ATOM 0 HG22 THR A 441 -2.426 -22.616 -5.678 1.00 0.54 H new ATOM 0 HG23 THR A 441 -2.114 -20.928 -5.208 1.00 0.54 H new ATOM 969 N GLN A 442 0.848 -20.682 -9.143 1.00 0.59 N ATOM 970 CA GLN A 442 1.357 -20.085 -10.421 1.00 0.62 C ATOM 971 C GLN A 442 0.560 -20.575 -11.636 1.00 0.64 C ATOM 972 O GLN A 442 0.382 -21.759 -11.843 1.00 0.69 O ATOM 973 CB GLN A 442 2.809 -20.553 -10.514 1.00 0.69 C ATOM 974 CG GLN A 442 3.720 -19.349 -10.754 1.00 1.43 C ATOM 975 CD GLN A 442 4.905 -19.773 -11.624 1.00 1.79 C ATOM 976 OE1 GLN A 442 5.184 -19.158 -12.633 1.00 2.16 O ATOM 977 NE2 GLN A 442 5.618 -20.807 -11.271 1.00 2.47 N ATOM 0 H GLN A 442 1.576 -20.940 -8.477 1.00 0.59 H new ATOM 0 HA GLN A 442 1.261 -18.999 -10.420 1.00 0.62 H new ATOM 0 HB2 GLN A 442 3.097 -21.063 -9.595 1.00 0.69 H new ATOM 0 HB3 GLN A 442 2.919 -21.273 -11.325 1.00 0.69 H new ATOM 0 HG2 GLN A 442 3.163 -18.550 -11.243 1.00 1.43 H new ATOM 0 HG3 GLN A 442 4.076 -18.953 -9.803 1.00 1.43 H new ATOM 0 HE21 GLN A 442 5.383 -21.323 -10.423 1.00 2.47 H new ATOM 0 HE22 GLN A 442 6.410 -21.099 -11.843 1.00 2.47 H new ATOM 986 N GLY A 443 0.080 -19.664 -12.439 1.00 0.63 N ATOM 987 CA GLY A 443 -0.704 -20.063 -13.642 1.00 0.66 C ATOM 988 C GLY A 443 -2.181 -20.192 -13.270 1.00 0.64 C ATOM 989 O GLY A 443 -3.046 -19.644 -13.925 1.00 0.66 O ATOM 0 H GLY A 443 0.198 -18.659 -12.313 1.00 0.63 H new ATOM 0 HA2 GLY A 443 -0.581 -19.322 -14.432 1.00 0.66 H new ATOM 0 HA3 GLY A 443 -0.333 -21.010 -14.033 1.00 0.66 H new ATOM 993 N HIS A 444 -2.478 -20.911 -12.224 1.00 0.62 N ATOM 994 CA HIS A 444 -3.900 -21.074 -11.812 1.00 0.62 C ATOM 995 C HIS A 444 -4.429 -19.766 -11.219 1.00 0.67 C ATOM 996 O HIS A 444 -4.728 -19.682 -10.044 1.00 1.34 O ATOM 997 CB HIS A 444 -3.879 -22.173 -10.751 1.00 0.63 C ATOM 998 CG HIS A 444 -3.507 -23.483 -11.390 1.00 0.95 C ATOM 999 ND1 HIS A 444 -2.210 -23.971 -11.372 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -4.250 -24.417 -12.069 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -2.212 -25.150 -12.021 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -3.431 -25.468 -12.466 1.00 1.86 N ATOM 0 H HIS A 444 -1.798 -21.393 -11.636 1.00 0.62 H new ATOM 0 HA HIS A 444 -4.548 -21.329 -12.650 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -3.164 -21.923 -9.968 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -4.857 -22.253 -10.276 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -5.310 -24.346 -12.265 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -1.335 -25.764 -12.165 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -3.703 -26.303 -12.986 1.00 1.86 H new ATOM 1010 N LYS A 445 -4.547 -18.744 -12.022 1.00 0.62 N ATOM 1011 CA LYS A 445 -5.057 -17.443 -11.503 1.00 0.51 C ATOM 1012 C LYS A 445 -6.394 -17.650 -10.786 1.00 0.51 C ATOM 1013 O LYS A 445 -6.779 -16.874 -9.933 1.00 0.57 O ATOM 1014 CB LYS A 445 -5.242 -16.565 -12.742 1.00 0.62 C ATOM 1015 CG LYS A 445 -6.165 -17.271 -13.737 1.00 1.31 C ATOM 1016 CD LYS A 445 -5.555 -17.198 -15.139 1.00 1.56 C ATOM 1017 CE LYS A 445 -5.500 -15.739 -15.599 1.00 2.23 C ATOM 1018 NZ LYS A 445 -6.215 -15.721 -16.905 1.00 2.52 N ATOM 0 H LYS A 445 -4.312 -18.754 -13.015 1.00 0.62 H new ATOM 0 HA LYS A 445 -4.376 -16.990 -10.783 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -5.666 -15.602 -12.458 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -4.276 -16.364 -13.206 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -6.306 -18.311 -13.444 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -7.149 -16.802 -13.732 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -4.553 -17.626 -15.133 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -6.150 -17.788 -15.837 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -5.980 -15.079 -14.877 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -4.471 -15.398 -15.708 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -6.220 -14.753 -17.285 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -5.731 -16.353 -17.574 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -7.194 -16.044 -16.769 1.00 2.52 H new ATOM 1032 N GLN A 446 -7.103 -18.694 -11.124 1.00 0.53 N ATOM 1033 CA GLN A 446 -8.415 -18.952 -10.461 1.00 0.56 C ATOM 1034 C GLN A 446 -8.196 -19.403 -9.014 1.00 0.52 C ATOM 1035 O GLN A 446 -8.899 -18.989 -8.114 1.00 0.51 O ATOM 1036 CB GLN A 446 -9.063 -20.071 -11.279 1.00 0.64 C ATOM 1037 CG GLN A 446 -10.495 -20.295 -10.790 1.00 1.11 C ATOM 1038 CD GLN A 446 -11.480 -19.922 -11.900 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -11.280 -18.951 -12.603 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -12.541 -20.657 -12.088 1.00 2.40 N ATOM 0 H GLN A 446 -6.831 -19.379 -11.830 1.00 0.53 H new ATOM 0 HA GLN A 446 -9.041 -18.060 -10.426 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -9.065 -19.808 -12.337 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -8.485 -20.990 -11.180 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -10.633 -21.337 -10.502 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -10.686 -19.691 -9.903 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -12.708 -21.472 -11.498 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -13.204 -20.417 -12.825 1.00 2.40 H new ATOM 1049 N GLU A 447 -7.224 -20.244 -8.781 1.00 0.52 N ATOM 1050 CA GLU A 447 -6.963 -20.713 -7.388 1.00 0.51 C ATOM 1051 C GLU A 447 -6.800 -19.510 -6.457 1.00 0.45 C ATOM 1052 O GLU A 447 -7.229 -19.530 -5.320 1.00 0.45 O ATOM 1053 CB GLU A 447 -5.662 -21.511 -7.474 1.00 0.53 C ATOM 1054 CG GLU A 447 -5.969 -23.003 -7.318 1.00 0.80 C ATOM 1055 CD GLU A 447 -4.664 -23.800 -7.362 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -4.059 -23.851 -8.420 1.00 1.96 O ATOM 1057 OE2 GLU A 447 -4.292 -24.345 -6.335 1.00 2.14 O ATOM 0 H GLU A 447 -6.601 -20.626 -9.492 1.00 0.52 H new ATOM 0 HA GLU A 447 -7.779 -21.316 -6.991 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -5.172 -21.327 -8.430 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -4.972 -21.187 -6.695 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -6.485 -23.182 -6.375 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -6.636 -23.333 -8.114 1.00 0.80 H new ATOM 1064 N ALA A 448 -6.194 -18.456 -6.935 1.00 0.42 N ATOM 1065 CA ALA A 448 -6.018 -17.246 -6.082 1.00 0.39 C ATOM 1066 C ALA A 448 -7.371 -16.811 -5.515 1.00 0.40 C ATOM 1067 O ALA A 448 -7.448 -16.149 -4.499 1.00 0.40 O ATOM 1068 CB ALA A 448 -5.457 -16.176 -7.018 1.00 0.39 C ATOM 0 H ALA A 448 -5.814 -18.381 -7.878 1.00 0.42 H new ATOM 0 HA ALA A 448 -5.357 -17.426 -5.234 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -5.300 -15.252 -6.462 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -4.508 -16.516 -7.432 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -6.163 -15.996 -7.829 1.00 0.39 H new ATOM 1074 N ALA A 449 -8.440 -17.186 -6.163 1.00 0.44 N ATOM 1075 CA ALA A 449 -9.790 -16.805 -5.664 1.00 0.47 C ATOM 1076 C ALA A 449 -9.958 -17.255 -4.209 1.00 0.48 C ATOM 1077 O ALA A 449 -9.970 -16.452 -3.298 1.00 0.49 O ATOM 1078 CB ALA A 449 -10.769 -17.552 -6.572 1.00 0.52 C ATOM 0 H ALA A 449 -8.436 -17.741 -7.019 1.00 0.44 H new ATOM 0 HA ALA A 449 -9.953 -15.728 -5.686 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -11.791 -17.325 -6.270 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -10.618 -17.239 -7.605 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -10.596 -18.625 -6.489 1.00 0.52 H new ATOM 1084 N ARG A 450 -10.083 -18.535 -3.986 1.00 0.49 N ATOM 1085 CA ARG A 450 -10.248 -19.039 -2.592 1.00 0.52 C ATOM 1086 C ARG A 450 -9.045 -18.630 -1.738 1.00 0.49 C ATOM 1087 O ARG A 450 -9.171 -18.366 -0.558 1.00 0.50 O ATOM 1088 CB ARG A 450 -10.313 -20.560 -2.729 1.00 0.56 C ATOM 1089 CG ARG A 450 -11.308 -21.123 -1.711 1.00 0.78 C ATOM 1090 CD ARG A 450 -12.737 -20.873 -2.201 1.00 1.37 C ATOM 1091 NE ARG A 450 -13.610 -21.521 -1.185 1.00 1.77 N ATOM 1092 CZ ARG A 450 -14.907 -21.390 -1.258 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -15.431 -20.224 -1.517 1.00 2.93 N ATOM 1094 NH2 ARG A 450 -15.679 -22.426 -1.071 1.00 2.97 N ATOM 0 H ARG A 450 -10.078 -19.254 -4.709 1.00 0.49 H new ATOM 0 HA ARG A 450 -11.136 -18.633 -2.107 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -10.618 -20.832 -3.740 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -9.326 -20.993 -2.566 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -11.140 -22.191 -1.575 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -11.157 -20.651 -0.740 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -12.947 -19.806 -2.279 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -12.896 -21.302 -3.190 1.00 1.37 H new ATOM 0 HE ARG A 450 -13.195 -22.068 -0.431 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -14.828 -19.415 -1.663 1.00 2.93 H new ATOM 0 HH12 ARG A 450 -16.444 -20.122 -1.574 1.00 2.93 H new ATOM 0 HH21 ARG A 450 -15.269 -23.338 -0.868 1.00 2.97 H new ATOM 0 HH22 ARG A 450 -16.692 -22.324 -1.128 1.00 2.97 H new ATOM 1108 N LEU A 451 -7.882 -18.574 -2.324 1.00 0.47 N ATOM 1109 CA LEU A 451 -6.671 -18.183 -1.547 1.00 0.47 C ATOM 1110 C LEU A 451 -6.894 -16.833 -0.861 1.00 0.44 C ATOM 1111 O LEU A 451 -6.509 -16.631 0.274 1.00 0.48 O ATOM 1112 CB LEU A 451 -5.556 -18.080 -2.589 1.00 0.46 C ATOM 1113 CG LEU A 451 -4.263 -18.661 -2.016 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -3.143 -18.535 -3.050 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -3.878 -17.890 -0.751 1.00 1.04 C ATOM 0 H LEU A 451 -7.717 -18.782 -3.309 1.00 0.47 H new ATOM 0 HA LEU A 451 -6.432 -18.899 -0.761 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.839 -18.618 -3.494 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -5.404 -17.038 -2.872 1.00 0.46 H new ATOM 0 HG LEU A 451 -4.413 -19.713 -1.772 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -2.222 -18.949 -2.641 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -3.417 -19.082 -3.952 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -2.991 -17.484 -3.295 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -2.956 -18.302 -0.340 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -3.727 -16.839 -0.997 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -4.676 -17.979 -0.014 1.00 1.04 H new ATOM 1127 N LEU A 452 -7.511 -15.905 -1.541 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.754 -14.567 -0.925 1.00 0.41 C ATOM 1129 C LEU A 452 -9.225 -14.426 -0.521 1.00 0.46 C ATOM 1130 O LEU A 452 -9.723 -13.333 -0.337 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.402 -13.557 -2.020 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.949 -13.756 -2.455 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.816 -13.444 -3.948 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -5.045 -12.819 -1.649 1.00 0.43 C ATOM 0 H LEU A 452 -7.857 -16.014 -2.494 1.00 0.42 H new ATOM 0 HA LEU A 452 -7.161 -14.416 -0.023 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -8.068 -13.684 -2.873 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.546 -12.541 -1.652 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.651 -14.789 -2.275 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.781 -13.586 -4.258 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.461 -14.113 -4.518 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -6.112 -12.411 -4.132 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -4.009 -12.959 -1.957 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.340 -11.785 -1.828 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -5.141 -13.045 -0.587 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.925 -15.520 -0.383 1.00 0.50 N ATOM 1147 CA GLY A 453 -11.363 -15.438 0.008 1.00 0.56 C ATOM 1148 C GLY A 453 -12.104 -14.525 -0.969 1.00 0.58 C ATOM 1149 O GLY A 453 -12.971 -13.763 -0.591 1.00 0.68 O ATOM 0 H GLY A 453 -9.565 -16.464 -0.523 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -11.810 -16.432 0.004 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -11.454 -15.052 1.023 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.765 -14.597 -2.225 1.00 0.54 N ATOM 1154 CA TRP A 454 -12.441 -13.732 -3.235 1.00 0.60 C ATOM 1155 C TRP A 454 -13.432 -14.552 -4.064 1.00 0.68 C ATOM 1156 O TRP A 454 -14.629 -14.484 -3.869 1.00 1.16 O ATOM 1157 CB TRP A 454 -11.308 -13.214 -4.126 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.814 -11.891 -3.623 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -10.926 -11.439 -2.347 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -10.123 -10.845 -4.366 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -10.353 -10.181 -2.262 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -9.843 -9.768 -3.476 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.715 -10.721 -5.720 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -9.178 -8.607 -3.913 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -9.046 -9.555 -6.164 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.778 -8.500 -5.261 1.00 0.52 C ATOM 0 H TRP A 454 -11.047 -15.218 -2.598 1.00 0.54 H new ATOM 0 HA TRP A 454 -13.007 -12.924 -2.771 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -10.490 -13.934 -4.141 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.661 -13.112 -5.152 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.387 -11.974 -1.530 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -10.313 -9.627 -1.406 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.916 -11.522 -6.416 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -8.975 -7.803 -3.220 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -8.739 -9.471 -7.196 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -8.267 -7.612 -5.604 1.00 0.52 H new ATOM 1177 N GLY A 455 -12.938 -15.323 -4.994 1.00 0.72 N ATOM 1178 CA GLY A 455 -13.843 -16.144 -5.846 1.00 0.72 C ATOM 1179 C GLY A 455 -13.456 -15.950 -7.313 1.00 0.70 C ATOM 1180 O GLY A 455 -12.432 -15.375 -7.618 1.00 0.64 O ATOM 0 H GLY A 455 -11.944 -15.420 -5.201 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -13.766 -17.196 -5.572 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -14.880 -15.848 -5.688 1.00 0.72 H new ATOM 1184 N ALA A 456 -14.263 -16.420 -8.224 1.00 0.77 N ATOM 1185 CA ALA A 456 -13.928 -16.251 -9.668 1.00 0.77 C ATOM 1186 C ALA A 456 -14.522 -14.944 -10.195 1.00 0.82 C ATOM 1187 O ALA A 456 -14.000 -14.338 -11.110 1.00 0.83 O ATOM 1188 CB ALA A 456 -14.566 -17.453 -10.366 1.00 0.84 C ATOM 0 H ALA A 456 -15.136 -16.912 -8.033 1.00 0.77 H new ATOM 0 HA ALA A 456 -12.853 -16.204 -9.842 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -14.364 -17.402 -11.436 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -14.146 -18.374 -9.961 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -15.643 -17.441 -10.199 1.00 0.84 H new ATOM 1194 N ALA A 457 -15.609 -14.502 -9.623 1.00 0.90 N ATOM 1195 CA ALA A 457 -16.229 -13.231 -10.092 1.00 0.97 C ATOM 1196 C ALA A 457 -15.389 -12.039 -9.631 1.00 0.89 C ATOM 1197 O ALA A 457 -15.063 -11.160 -10.403 1.00 0.91 O ATOM 1198 CB ALA A 457 -17.613 -13.199 -9.439 1.00 1.08 C ATOM 0 H ALA A 457 -16.093 -14.965 -8.854 1.00 0.90 H new ATOM 0 HA ALA A 457 -16.293 -13.176 -11.179 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -18.135 -12.289 -9.737 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -18.187 -14.068 -9.760 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -17.504 -13.216 -8.355 1.00 1.08 H new ATOM 1204 N THR A 458 -15.028 -12.006 -8.376 1.00 0.84 N ATOM 1205 CA THR A 458 -14.202 -10.873 -7.868 1.00 0.77 C ATOM 1206 C THR A 458 -12.854 -10.850 -8.591 1.00 0.68 C ATOM 1207 O THR A 458 -12.430 -9.833 -9.103 1.00 0.67 O ATOM 1208 CB THR A 458 -14.006 -11.159 -6.379 1.00 0.76 C ATOM 1209 OG1 THR A 458 -15.273 -11.323 -5.757 1.00 0.85 O ATOM 1210 CG2 THR A 458 -13.263 -9.991 -5.728 1.00 0.72 C ATOM 0 H THR A 458 -15.269 -12.713 -7.682 1.00 0.84 H new ATOM 0 HA THR A 458 -14.675 -9.905 -8.035 1.00 0.77 H new ATOM 0 HB THR A 458 -13.422 -12.072 -6.258 1.00 0.76 H new ATOM 0 HG1 THR A 458 -15.148 -11.508 -4.803 1.00 0.85 H new ATOM 0 HG21 THR A 458 -13.123 -10.195 -4.666 1.00 0.72 H new ATOM 0 HG22 THR A 458 -12.291 -9.867 -6.205 1.00 0.72 H new ATOM 0 HG23 THR A 458 -13.845 -9.077 -5.848 1.00 0.72 H new ATOM 1218 N LEU A 459 -12.180 -11.967 -8.640 1.00 0.64 N ATOM 1219 CA LEU A 459 -10.861 -12.015 -9.334 1.00 0.57 C ATOM 1220 C LEU A 459 -10.994 -11.451 -10.752 1.00 0.60 C ATOM 1221 O LEU A 459 -10.074 -10.866 -11.288 1.00 0.58 O ATOM 1222 CB LEU A 459 -10.492 -13.499 -9.375 1.00 0.56 C ATOM 1223 CG LEU A 459 -9.184 -13.720 -8.612 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -9.199 -15.101 -7.959 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -8.006 -13.638 -9.579 1.00 0.46 C ATOM 0 H LEU A 459 -12.486 -12.849 -8.229 1.00 0.64 H new ATOM 0 HA LEU A 459 -10.100 -11.422 -8.827 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -11.289 -14.095 -8.932 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -10.383 -13.829 -10.408 1.00 0.56 H new ATOM 0 HG LEU A 459 -9.083 -12.952 -7.845 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -8.267 -15.257 -7.416 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -10.038 -15.167 -7.266 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -9.303 -15.866 -8.728 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -7.076 -13.796 -9.033 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -8.111 -14.405 -10.346 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -7.989 -12.655 -10.049 1.00 0.46 H new ATOM 1237 N THR A 460 -12.137 -11.617 -11.359 1.00 0.68 N ATOM 1238 CA THR A 460 -12.334 -11.084 -12.737 1.00 0.74 C ATOM 1239 C THR A 460 -12.794 -9.627 -12.668 1.00 0.76 C ATOM 1240 O THR A 460 -12.232 -8.758 -13.306 1.00 0.75 O ATOM 1241 CB THR A 460 -13.424 -11.966 -13.350 1.00 0.83 C ATOM 1242 OG1 THR A 460 -12.966 -13.309 -13.407 1.00 0.82 O ATOM 1243 CG2 THR A 460 -13.748 -11.474 -14.761 1.00 0.92 C ATOM 0 H THR A 460 -12.943 -12.099 -10.961 1.00 0.68 H new ATOM 0 HA THR A 460 -11.419 -11.103 -13.328 1.00 0.74 H new ATOM 0 HB THR A 460 -14.323 -11.914 -12.736 1.00 0.83 H new ATOM 0 HG1 THR A 460 -13.279 -13.795 -12.616 1.00 0.82 H new ATOM 0 HG21 THR A 460 -14.524 -12.103 -15.196 1.00 0.92 H new ATOM 0 HG22 THR A 460 -14.099 -10.443 -14.715 1.00 0.92 H new ATOM 0 HG23 THR A 460 -12.851 -11.524 -15.379 1.00 0.92 H new ATOM 1251 N ALA A 461 -13.806 -9.351 -11.893 1.00 0.81 N ATOM 1252 CA ALA A 461 -14.294 -7.948 -11.778 1.00 0.85 C ATOM 1253 C ALA A 461 -13.189 -7.060 -11.202 1.00 0.79 C ATOM 1254 O ALA A 461 -13.025 -5.921 -11.593 1.00 0.83 O ATOM 1255 CB ALA A 461 -15.484 -8.018 -10.822 1.00 0.92 C ATOM 0 H ALA A 461 -14.316 -10.036 -11.335 1.00 0.81 H new ATOM 0 HA ALA A 461 -14.576 -7.524 -12.742 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -15.900 -7.020 -10.685 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -16.247 -8.676 -11.238 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -15.155 -8.409 -9.859 1.00 0.92 H new ATOM 1261 N LYS A 462 -12.426 -7.575 -10.277 1.00 0.72 N ATOM 1262 CA LYS A 462 -11.327 -6.766 -9.679 1.00 0.68 C ATOM 1263 C LYS A 462 -10.279 -6.444 -10.747 1.00 0.66 C ATOM 1264 O LYS A 462 -9.609 -5.431 -10.689 1.00 0.67 O ATOM 1265 CB LYS A 462 -10.726 -7.655 -8.589 1.00 0.66 C ATOM 1266 CG LYS A 462 -11.720 -7.790 -7.434 1.00 0.99 C ATOM 1267 CD LYS A 462 -11.654 -6.539 -6.555 1.00 0.91 C ATOM 1268 CE LYS A 462 -11.953 -6.920 -5.104 1.00 1.31 C ATOM 1269 NZ LYS A 462 -13.392 -6.594 -4.910 1.00 1.39 N ATOM 0 H LYS A 462 -12.517 -8.522 -9.909 1.00 0.72 H new ATOM 0 HA LYS A 462 -11.680 -5.816 -9.277 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -10.490 -8.638 -8.996 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -9.791 -7.226 -8.230 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -12.730 -7.921 -7.823 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -11.488 -8.676 -6.842 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -10.667 -6.083 -6.627 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -12.373 -5.798 -6.903 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -11.760 -7.978 -4.926 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -11.324 -6.360 -4.411 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -13.746 -7.079 -4.061 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -13.502 -5.567 -4.793 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -13.934 -6.908 -5.740 1.00 1.39 H new ATOM 1283 N LEU A 463 -10.135 -7.298 -11.722 1.00 0.65 N ATOM 1284 CA LEU A 463 -9.134 -7.040 -12.796 1.00 0.65 C ATOM 1285 C LEU A 463 -9.509 -5.771 -13.565 1.00 0.68 C ATOM 1286 O LEU A 463 -8.664 -4.967 -13.906 1.00 0.70 O ATOM 1287 CB LEU A 463 -9.209 -8.263 -13.710 1.00 0.68 C ATOM 1288 CG LEU A 463 -7.959 -8.321 -14.589 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -7.693 -9.768 -15.006 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -8.176 -7.465 -15.838 1.00 0.99 C ATOM 0 H LEU A 463 -10.666 -8.163 -11.822 1.00 0.65 H new ATOM 0 HA LEU A 463 -8.129 -6.890 -12.401 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -9.289 -9.172 -13.113 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -10.102 -8.211 -14.333 1.00 0.68 H new ATOM 0 HG LEU A 463 -7.104 -7.941 -14.029 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -6.802 -9.808 -15.632 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -7.540 -10.380 -14.117 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -8.547 -10.148 -15.566 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -7.286 -7.505 -16.466 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -9.031 -7.846 -16.396 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -8.366 -6.433 -15.543 1.00 0.99 H new ATOM 1302 N LYS A 464 -10.772 -5.583 -13.838 1.00 0.72 N ATOM 1303 CA LYS A 464 -11.203 -4.365 -14.581 1.00 0.77 C ATOM 1304 C LYS A 464 -11.526 -3.235 -13.599 1.00 0.76 C ATOM 1305 O LYS A 464 -11.339 -2.070 -13.894 1.00 0.82 O ATOM 1306 CB LYS A 464 -12.459 -4.791 -15.342 1.00 0.85 C ATOM 1307 CG LYS A 464 -12.126 -4.961 -16.826 1.00 1.20 C ATOM 1308 CD LYS A 464 -13.246 -5.744 -17.513 1.00 1.62 C ATOM 1309 CE LYS A 464 -13.115 -7.229 -17.173 1.00 2.25 C ATOM 1310 NZ LYS A 464 -14.288 -7.877 -17.823 1.00 2.66 N ATOM 0 H LYS A 464 -11.524 -6.221 -13.578 1.00 0.72 H new ATOM 0 HA LYS A 464 -10.428 -3.992 -15.251 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -12.843 -5.727 -14.935 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -13.243 -4.044 -15.218 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -12.008 -3.985 -17.297 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -11.178 -5.487 -16.939 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -14.217 -5.370 -17.188 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -13.194 -5.602 -18.592 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -12.178 -7.639 -17.550 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -13.122 -7.389 -16.095 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -14.268 -8.900 -17.635 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -15.165 -7.471 -17.440 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -14.250 -7.713 -18.849 1.00 2.66 H new ATOM 1324 N GLU A 465 -12.010 -3.570 -12.435 1.00 0.73 N ATOM 1325 CA GLU A 465 -12.345 -2.515 -11.434 1.00 0.76 C ATOM 1326 C GLU A 465 -11.098 -1.693 -11.095 1.00 0.69 C ATOM 1327 O GLU A 465 -11.062 -0.494 -11.288 1.00 0.85 O ATOM 1328 CB GLU A 465 -12.834 -3.278 -10.202 1.00 0.79 C ATOM 1329 CG GLU A 465 -14.364 -3.279 -10.176 1.00 1.12 C ATOM 1330 CD GLU A 465 -14.854 -4.134 -9.005 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -14.120 -5.017 -8.594 1.00 2.03 O ATOM 1332 OE2 GLU A 465 -15.955 -3.890 -8.540 1.00 1.95 O ATOM 0 H GLU A 465 -12.188 -4.528 -12.133 1.00 0.73 H new ATOM 0 HA GLU A 465 -13.095 -1.817 -11.806 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -12.459 -4.301 -10.223 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -12.445 -2.814 -9.296 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -14.737 -2.260 -10.077 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -14.754 -3.672 -11.115 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.075 -2.329 -10.592 1.00 0.56 N ATOM 1340 CA LEU A 466 -8.833 -1.582 -10.244 1.00 0.59 C ATOM 1341 C LEU A 466 -8.341 -0.784 -11.454 1.00 0.70 C ATOM 1342 O LEU A 466 -7.641 0.200 -11.318 1.00 0.81 O ATOM 1343 CB LEU A 466 -7.818 -2.659 -9.862 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.103 -3.152 -8.443 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -7.179 -4.327 -8.116 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -7.852 -2.017 -7.449 1.00 0.52 C ATOM 0 H LEU A 466 -10.046 -3.332 -10.407 1.00 0.56 H new ATOM 0 HA LEU A 466 -8.992 -0.868 -9.436 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -7.873 -3.490 -10.565 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -6.806 -2.257 -9.922 1.00 0.56 H new ATOM 0 HG LEU A 466 -9.142 -3.475 -8.373 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -7.382 -4.679 -7.104 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -7.356 -5.137 -8.824 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -6.140 -4.004 -8.186 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -8.055 -2.368 -6.437 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -6.813 -1.695 -7.520 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -8.509 -1.178 -7.681 1.00 0.52 H new ATOM 1358 N GLY A 467 -8.702 -1.201 -12.636 1.00 0.77 N ATOM 1359 CA GLY A 467 -8.255 -0.467 -13.854 1.00 0.97 C ATOM 1360 C GLY A 467 -8.974 0.881 -13.932 1.00 1.08 C ATOM 1361 O GLY A 467 -8.444 1.850 -14.440 1.00 1.38 O ATOM 0 H GLY A 467 -9.287 -2.018 -12.812 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -7.176 -0.314 -13.824 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -8.468 -1.057 -14.745 1.00 0.97 H new ATOM 1723 N TRP B 402 6.497 -1.374 4.380 1.00 0.95 N ATOM 1724 CA TRP B 402 5.185 -2.042 4.130 1.00 0.86 C ATOM 1725 C TRP B 402 5.322 -3.221 3.162 1.00 0.79 C ATOM 1726 O TRP B 402 5.106 -4.354 3.530 1.00 0.71 O ATOM 1727 CB TRP B 402 4.310 -0.956 3.511 1.00 0.96 C ATOM 1728 CG TRP B 402 2.967 -0.988 4.153 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.678 -0.460 5.362 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.732 -1.571 3.649 1.00 0.76 C ATOM 1731 NE1 TRP B 402 1.339 -0.679 5.641 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.708 -1.359 4.616 1.00 0.83 C ATOM 1733 CE3 TRP B 402 1.399 -2.258 2.453 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -0.607 -1.815 4.405 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 0.078 -2.719 2.237 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -0.923 -2.498 3.211 1.00 0.69 C ATOM 0 HA TRP B 402 4.768 -2.453 5.049 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.770 0.022 3.650 1.00 0.96 H new ATOM 0 HB3 TRP B 402 4.217 -1.115 2.437 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.378 0.050 6.007 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.875 -0.376 6.498 1.00 1.00 H new ATOM 0 HE3 TRP B 402 2.157 -2.430 1.703 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.369 -1.643 5.151 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.166 -3.242 1.324 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -1.929 -2.852 3.041 1.00 0.69 H new ATOM 1747 N ALA B 403 5.660 -2.961 1.927 1.00 0.85 N ATOM 1748 CA ALA B 403 5.790 -4.071 0.931 1.00 0.85 C ATOM 1749 C ALA B 403 6.589 -5.240 1.517 1.00 0.80 C ATOM 1750 O ALA B 403 6.153 -6.374 1.486 1.00 0.76 O ATOM 1751 CB ALA B 403 6.534 -3.456 -0.254 1.00 0.99 C ATOM 0 H ALA B 403 5.852 -2.028 1.562 1.00 0.85 H new ATOM 0 HA ALA B 403 4.818 -4.473 0.644 1.00 0.85 H new ATOM 0 HB1 ALA B 403 6.669 -4.210 -1.030 1.00 0.99 H new ATOM 0 HB2 ALA B 403 5.956 -2.623 -0.654 1.00 0.99 H new ATOM 0 HB3 ALA B 403 7.509 -3.096 0.076 1.00 0.99 H new ATOM 1757 N THR B 404 7.745 -4.979 2.059 1.00 0.82 N ATOM 1758 CA THR B 404 8.546 -6.087 2.649 1.00 0.81 C ATOM 1759 C THR B 404 7.720 -6.796 3.724 1.00 0.70 C ATOM 1760 O THR B 404 7.773 -8.002 3.869 1.00 0.69 O ATOM 1761 CB THR B 404 9.772 -5.411 3.265 1.00 0.89 C ATOM 1762 OG1 THR B 404 10.161 -4.312 2.453 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.920 -6.417 3.352 1.00 0.89 C ATOM 0 H THR B 404 8.168 -4.053 2.119 1.00 0.82 H new ATOM 0 HA THR B 404 8.833 -6.838 1.912 1.00 0.81 H new ATOM 0 HB THR B 404 9.529 -5.055 4.266 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.945 -3.876 2.847 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.794 -5.935 3.791 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.619 -7.259 3.975 1.00 0.89 H new ATOM 0 HG23 THR B 404 11.167 -6.775 2.352 1.00 0.89 H new ATOM 1771 N LEU B 405 6.947 -6.054 4.470 1.00 0.67 N ATOM 1772 CA LEU B 405 6.104 -6.682 5.527 1.00 0.61 C ATOM 1773 C LEU B 405 4.918 -7.405 4.877 1.00 0.53 C ATOM 1774 O LEU B 405 4.320 -8.286 5.461 1.00 0.52 O ATOM 1775 CB LEU B 405 5.632 -5.505 6.394 1.00 0.67 C ATOM 1776 CG LEU B 405 4.900 -6.003 7.652 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.508 -6.511 7.273 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.691 -7.134 8.323 1.00 0.64 C ATOM 0 H LEU B 405 6.863 -5.040 4.393 1.00 0.67 H new ATOM 0 HA LEU B 405 6.639 -7.426 6.118 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.489 -4.897 6.685 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.969 -4.864 5.813 1.00 0.67 H new ATOM 0 HG LEU B 405 4.810 -5.172 8.352 1.00 0.64 H new ATOM 0 HD11 LEU B 405 2.993 -6.863 8.167 1.00 0.57 H new ATOM 0 HD12 LEU B 405 2.936 -5.701 6.820 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.601 -7.332 6.562 1.00 0.57 H new ATOM 0 HD21 LEU B 405 5.158 -7.474 9.211 1.00 0.64 H new ATOM 0 HD22 LEU B 405 5.801 -7.965 7.626 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.677 -6.768 8.609 1.00 0.64 H new ATOM 1790 N LEU B 406 4.580 -7.039 3.670 1.00 0.53 N ATOM 1791 CA LEU B 406 3.439 -7.699 2.976 1.00 0.50 C ATOM 1792 C LEU B 406 3.914 -8.971 2.269 1.00 0.49 C ATOM 1793 O LEU B 406 3.248 -9.987 2.288 1.00 0.45 O ATOM 1794 CB LEU B 406 2.946 -6.665 1.958 1.00 0.57 C ATOM 1795 CG LEU B 406 1.456 -6.885 1.681 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.662 -6.760 2.983 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.961 -5.833 0.686 1.00 1.02 C ATOM 0 H LEU B 406 5.047 -6.308 3.133 1.00 0.53 H new ATOM 0 HA LEU B 406 2.650 -7.999 3.666 1.00 0.50 H new ATOM 0 HB2 LEU B 406 3.110 -5.657 2.340 1.00 0.57 H new ATOM 0 HB3 LEU B 406 3.515 -6.752 1.032 1.00 0.57 H new ATOM 0 HG LEU B 406 1.313 -7.882 1.264 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.397 -6.917 2.780 1.00 0.94 H new ATOM 0 HD12 LEU B 406 1.010 -7.509 3.695 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.807 -5.765 3.403 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.100 -5.989 0.489 1.00 1.02 H new ATOM 0 HD22 LEU B 406 1.109 -4.838 1.105 1.00 1.02 H new ATOM 0 HD23 LEU B 406 1.520 -5.922 -0.245 1.00 1.02 H new ATOM 1809 N ALA B 407 5.061 -8.926 1.647 1.00 0.56 N ATOM 1810 CA ALA B 407 5.570 -10.138 0.944 1.00 0.59 C ATOM 1811 C ALA B 407 5.878 -11.238 1.963 1.00 0.57 C ATOM 1812 O ALA B 407 5.598 -12.399 1.740 1.00 0.61 O ATOM 1813 CB ALA B 407 6.847 -9.681 0.237 1.00 0.70 C ATOM 0 H ALA B 407 5.665 -8.106 1.595 1.00 0.56 H new ATOM 0 HA ALA B 407 4.846 -10.548 0.240 1.00 0.59 H new ATOM 0 HB1 ALA B 407 7.283 -10.520 -0.305 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.608 -8.881 -0.464 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.561 -9.316 0.975 1.00 0.70 H new ATOM 1819 N GLN B 408 6.444 -10.881 3.083 1.00 0.57 N ATOM 1820 CA GLN B 408 6.760 -11.907 4.116 1.00 0.57 C ATOM 1821 C GLN B 408 5.482 -12.302 4.862 1.00 0.50 C ATOM 1822 O GLN B 408 5.272 -13.453 5.189 1.00 0.50 O ATOM 1823 CB GLN B 408 7.749 -11.229 5.063 1.00 0.62 C ATOM 1824 CG GLN B 408 9.167 -11.394 4.517 1.00 0.75 C ATOM 1825 CD GLN B 408 9.888 -12.499 5.293 1.00 0.78 C ATOM 1826 OE1 GLN B 408 10.946 -12.277 5.848 1.00 1.29 O ATOM 1827 NE2 GLN B 408 9.357 -13.689 5.353 1.00 1.46 N ATOM 0 H GLN B 408 6.701 -9.925 3.327 1.00 0.57 H new ATOM 0 HA GLN B 408 7.176 -12.818 3.685 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.507 -10.171 5.163 1.00 0.62 H new ATOM 0 HB3 GLN B 408 7.677 -11.668 6.058 1.00 0.62 H new ATOM 0 HG2 GLN B 408 9.133 -11.643 3.456 1.00 0.75 H new ATOM 0 HG3 GLN B 408 9.714 -10.456 4.607 1.00 0.75 H new ATOM 0 HE21 GLN B 408 8.469 -13.875 4.887 1.00 1.46 H new ATOM 0 HE22 GLN B 408 9.830 -14.433 5.866 1.00 1.46 H new ATOM 1836 N TRP B 409 4.626 -11.354 5.124 1.00 0.46 N ATOM 1837 CA TRP B 409 3.355 -11.666 5.839 1.00 0.43 C ATOM 1838 C TRP B 409 2.527 -12.660 5.014 1.00 0.40 C ATOM 1839 O TRP B 409 2.256 -13.764 5.443 1.00 0.41 O ATOM 1840 CB TRP B 409 2.647 -10.307 5.971 1.00 0.43 C ATOM 1841 CG TRP B 409 1.195 -10.496 6.292 1.00 0.42 C ATOM 1842 CD1 TRP B 409 0.702 -10.868 7.497 1.00 0.50 C ATOM 1843 CD2 TRP B 409 0.048 -10.327 5.413 1.00 0.40 C ATOM 1844 NE1 TRP B 409 -0.679 -10.941 7.416 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -1.134 -10.617 6.153 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.086 -9.953 4.050 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -2.409 -10.540 5.563 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.366 -9.873 3.451 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.526 -10.165 4.207 1.00 0.48 C ATOM 0 H TRP B 409 4.752 -10.373 4.873 1.00 0.46 H new ATOM 0 HA TRP B 409 3.509 -12.131 6.813 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.124 -9.717 6.754 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.749 -9.746 5.042 1.00 0.43 H new ATOM 0 HD1 TRP B 409 1.290 -11.074 8.379 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -1.285 -11.202 8.194 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.794 -9.728 3.466 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -3.291 -10.766 6.143 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -1.458 -9.588 2.413 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.501 -10.101 3.747 1.00 0.48 H new ATOM 1860 N ALA B 410 2.122 -12.275 3.833 1.00 0.42 N ATOM 1861 CA ALA B 410 1.311 -13.197 2.984 1.00 0.44 C ATOM 1862 C ALA B 410 1.997 -14.562 2.880 1.00 0.45 C ATOM 1863 O ALA B 410 1.355 -15.580 2.708 1.00 0.47 O ATOM 1864 CB ALA B 410 1.244 -12.520 1.615 1.00 0.51 C ATOM 0 H ALA B 410 2.317 -11.363 3.420 1.00 0.42 H new ATOM 0 HA ALA B 410 0.318 -13.374 3.398 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.662 -13.138 0.931 1.00 0.51 H new ATOM 0 HB2 ALA B 410 0.769 -11.544 1.715 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.253 -12.394 1.221 1.00 0.51 H new ATOM 1870 N ASP B 411 3.296 -14.591 2.992 1.00 0.48 N ATOM 1871 CA ASP B 411 4.022 -15.890 2.909 1.00 0.53 C ATOM 1872 C ASP B 411 3.806 -16.685 4.198 1.00 0.53 C ATOM 1873 O ASP B 411 3.496 -17.861 4.172 1.00 0.58 O ATOM 1874 CB ASP B 411 5.496 -15.512 2.749 1.00 0.60 C ATOM 1875 CG ASP B 411 6.287 -16.734 2.280 1.00 1.03 C ATOM 1876 OD1 ASP B 411 5.830 -17.395 1.363 1.00 1.51 O ATOM 1877 OD2 ASP B 411 7.338 -16.987 2.847 1.00 1.78 O ATOM 0 H ASP B 411 3.886 -13.772 3.137 1.00 0.48 H new ATOM 0 HA ASP B 411 3.674 -16.512 2.084 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.598 -14.701 2.028 1.00 0.60 H new ATOM 0 HB3 ASP B 411 5.894 -15.149 3.696 1.00 0.60 H new ATOM 1882 N ARG B 412 3.962 -16.049 5.328 1.00 0.52 N ATOM 1883 CA ARG B 412 3.757 -16.764 6.619 1.00 0.56 C ATOM 1884 C ARG B 412 2.371 -17.408 6.639 1.00 0.55 C ATOM 1885 O ARG B 412 2.202 -18.533 7.065 1.00 0.63 O ATOM 1886 CB ARG B 412 3.867 -15.684 7.696 1.00 0.58 C ATOM 1887 CG ARG B 412 5.197 -15.836 8.438 1.00 0.96 C ATOM 1888 CD ARG B 412 5.035 -15.357 9.882 1.00 1.50 C ATOM 1889 NE ARG B 412 6.338 -15.659 10.535 1.00 1.90 N ATOM 1890 CZ ARG B 412 7.406 -14.985 10.203 1.00 2.41 C ATOM 1891 NH1 ARG B 412 7.651 -13.834 10.767 1.00 2.89 N ATOM 1892 NH2 ARG B 412 8.228 -15.463 9.310 1.00 3.02 N ATOM 0 H ARG B 412 4.222 -15.066 5.412 1.00 0.52 H new ATOM 0 HA ARG B 412 4.484 -17.561 6.774 1.00 0.56 H new ATOM 0 HB2 ARG B 412 3.803 -14.695 7.242 1.00 0.58 H new ATOM 0 HB3 ARG B 412 3.036 -15.768 8.396 1.00 0.58 H new ATOM 0 HG2 ARG B 412 5.517 -16.878 8.423 1.00 0.96 H new ATOM 0 HG3 ARG B 412 5.973 -15.257 7.937 1.00 0.96 H new ATOM 0 HD2 ARG B 412 4.811 -14.291 9.922 1.00 1.50 H new ATOM 0 HD3 ARG B 412 4.215 -15.874 10.380 1.00 1.50 H new ATOM 0 HE ARG B 412 6.397 -16.392 11.242 1.00 1.90 H new ATOM 0 HH11 ARG B 412 7.009 -13.462 11.466 1.00 2.89 H new ATOM 0 HH12 ARG B 412 8.485 -13.307 10.508 1.00 2.89 H new ATOM 0 HH21 ARG B 412 8.037 -16.363 8.871 1.00 3.02 H new ATOM 0 HH22 ARG B 412 9.062 -14.936 9.051 1.00 3.02 H new ATOM 1906 N ALA B 413 1.382 -16.701 6.171 1.00 0.50 N ATOM 1907 CA ALA B 413 0.004 -17.268 6.148 1.00 0.53 C ATOM 1908 C ALA B 413 -0.070 -18.400 5.122 1.00 0.57 C ATOM 1909 O ALA B 413 -0.780 -19.370 5.299 1.00 0.66 O ATOM 1910 CB ALA B 413 -0.899 -16.107 5.737 1.00 0.53 C ATOM 0 H ALA B 413 1.467 -15.754 5.803 1.00 0.50 H new ATOM 0 HA ALA B 413 -0.293 -17.685 7.110 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -1.934 -16.447 5.698 1.00 0.53 H new ATOM 0 HB2 ALA B 413 -0.809 -15.301 6.465 1.00 0.53 H new ATOM 0 HB3 ALA B 413 -0.599 -15.743 4.754 1.00 0.53 H new ATOM 1916 N LEU B 414 0.669 -18.285 4.052 1.00 0.54 N ATOM 1917 CA LEU B 414 0.654 -19.354 3.015 1.00 0.62 C ATOM 1918 C LEU B 414 0.973 -20.704 3.660 1.00 0.71 C ATOM 1919 O LEU B 414 0.294 -21.686 3.442 1.00 0.82 O ATOM 1920 CB LEU B 414 1.752 -18.959 2.027 1.00 0.63 C ATOM 1921 CG LEU B 414 1.237 -19.119 0.596 1.00 0.71 C ATOM 1922 CD1 LEU B 414 0.076 -18.152 0.361 1.00 1.11 C ATOM 1923 CD2 LEU B 414 2.367 -18.806 -0.389 1.00 1.03 C ATOM 0 H LEU B 414 1.283 -17.496 3.852 1.00 0.54 H new ATOM 0 HA LEU B 414 -0.316 -19.451 2.527 1.00 0.62 H new ATOM 0 HB2 LEU B 414 2.058 -17.927 2.201 1.00 0.63 H new ATOM 0 HB3 LEU B 414 2.633 -19.582 2.179 1.00 0.63 H new ATOM 0 HG LEU B 414 0.894 -20.143 0.445 1.00 0.71 H new ATOM 0 HD11 LEU B 414 -0.291 -18.266 -0.659 1.00 1.11 H new ATOM 0 HD12 LEU B 414 -0.728 -18.372 1.063 1.00 1.11 H new ATOM 0 HD13 LEU B 414 0.419 -17.128 0.511 1.00 1.11 H new ATOM 0 HD21 LEU B 414 2.002 -18.920 -1.410 1.00 1.03 H new ATOM 0 HD22 LEU B 414 2.708 -17.782 -0.238 1.00 1.03 H new ATOM 0 HD23 LEU B 414 3.196 -19.493 -0.222 1.00 1.03 H new ATOM 1935 N ARG B 415 2.005 -20.755 4.458 1.00 0.73 N ATOM 1936 CA ARG B 415 2.373 -22.036 5.123 1.00 0.87 C ATOM 1937 C ARG B 415 1.539 -22.245 6.395 1.00 0.93 C ATOM 1938 O ARG B 415 1.562 -23.302 6.992 1.00 1.26 O ATOM 1939 CB ARG B 415 3.853 -21.887 5.473 1.00 1.02 C ATOM 1940 CG ARG B 415 4.684 -21.904 4.189 1.00 1.40 C ATOM 1941 CD ARG B 415 5.169 -23.328 3.913 1.00 1.61 C ATOM 1942 NE ARG B 415 4.356 -23.793 2.755 1.00 2.27 N ATOM 1943 CZ ARG B 415 4.177 -25.070 2.554 1.00 2.92 C ATOM 1944 NH1 ARG B 415 5.158 -25.803 2.102 1.00 3.32 N ATOM 1945 NH2 ARG B 415 3.018 -25.615 2.807 1.00 3.70 N ATOM 0 H ARG B 415 2.609 -19.963 4.678 1.00 0.73 H new ATOM 0 HA ARG B 415 2.186 -22.898 4.482 1.00 0.87 H new ATOM 0 HB2 ARG B 415 4.018 -20.955 6.013 1.00 1.02 H new ATOM 0 HB3 ARG B 415 4.165 -22.697 6.132 1.00 1.02 H new ATOM 0 HG2 ARG B 415 4.086 -21.544 3.352 1.00 1.40 H new ATOM 0 HG3 ARG B 415 5.536 -21.231 4.286 1.00 1.40 H new ATOM 0 HD2 ARG B 415 6.234 -23.344 3.680 1.00 1.61 H new ATOM 0 HD3 ARG B 415 5.023 -23.970 4.781 1.00 1.61 H new ATOM 0 HE ARG B 415 3.939 -23.113 2.119 1.00 2.27 H new ATOM 0 HH11 ARG B 415 6.064 -25.378 1.906 1.00 3.32 H new ATOM 0 HH12 ARG B 415 5.018 -26.801 1.945 1.00 3.32 H new ATOM 0 HH21 ARG B 415 2.252 -25.043 3.162 1.00 3.70 H new ATOM 0 HH22 ARG B 415 2.879 -26.613 2.650 1.00 3.70 H new ATOM 1959 N SER B 416 0.803 -21.250 6.815 1.00 0.90 N ATOM 1960 CA SER B 416 -0.024 -21.403 8.045 1.00 0.99 C ATOM 1961 C SER B 416 -1.494 -21.629 7.676 1.00 0.99 C ATOM 1962 O SER B 416 -1.980 -22.743 7.679 1.00 1.63 O ATOM 1963 CB SER B 416 0.140 -20.084 8.798 1.00 1.20 C ATOM 1964 OG SER B 416 1.165 -20.225 9.773 1.00 1.70 O ATOM 0 H SER B 416 0.740 -20.340 6.359 1.00 0.90 H new ATOM 0 HA SER B 416 0.286 -22.259 8.644 1.00 0.99 H new ATOM 0 HB2 SER B 416 0.391 -19.283 8.102 1.00 1.20 H new ATOM 0 HB3 SER B 416 -0.799 -19.806 9.278 1.00 1.20 H new ATOM 0 HG SER B 416 1.274 -19.380 10.257 1.00 1.70 H new ATOM 1970 N GLY B 417 -2.204 -20.582 7.357 1.00 1.06 N ATOM 1971 CA GLY B 417 -3.639 -20.737 6.990 1.00 1.06 C ATOM 1972 C GLY B 417 -4.100 -19.512 6.198 1.00 0.99 C ATOM 1973 O GLY B 417 -4.952 -18.763 6.635 1.00 1.31 O ATOM 0 H GLY B 417 -1.852 -19.625 7.335 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -3.778 -21.640 6.396 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -4.245 -20.851 7.889 1.00 1.06 H new ATOM 1977 N HIS B 418 -3.544 -19.303 5.037 1.00 0.78 N ATOM 1978 CA HIS B 418 -3.948 -18.126 4.214 1.00 0.88 C ATOM 1979 C HIS B 418 -5.452 -18.163 3.932 1.00 0.89 C ATOM 1980 O HIS B 418 -5.999 -19.183 3.559 1.00 1.17 O ATOM 1981 CB HIS B 418 -3.156 -18.262 2.912 1.00 1.01 C ATOM 1982 CG HIS B 418 -3.417 -19.612 2.299 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -2.587 -20.700 2.526 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -4.411 -20.067 1.468 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -3.093 -21.744 1.845 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -4.206 -21.413 1.183 1.00 2.97 N ATOM 0 H HIS B 418 -2.826 -19.897 4.621 1.00 0.78 H new ATOM 0 HA HIS B 418 -3.745 -17.182 4.720 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -3.444 -17.474 2.216 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -2.091 -18.141 3.108 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -5.229 -19.470 1.092 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -2.653 -22.730 1.834 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -4.781 -22.017 0.596 1.00 2.97 H new ATOM 1994 N GLN B 419 -6.123 -17.058 4.103 1.00 1.08 N ATOM 1995 CA GLN B 419 -7.589 -17.026 3.840 1.00 1.24 C ATOM 1996 C GLN B 419 -8.049 -15.584 3.601 1.00 1.03 C ATOM 1997 O GLN B 419 -8.261 -15.168 2.480 1.00 1.28 O ATOM 1998 CB GLN B 419 -8.234 -17.597 5.105 1.00 1.71 C ATOM 1999 CG GLN B 419 -8.980 -18.886 4.760 1.00 2.32 C ATOM 2000 CD GLN B 419 -9.256 -19.677 6.040 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -8.816 -20.800 6.181 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -9.973 -19.134 6.987 1.00 3.52 N ATOM 0 H GLN B 419 -5.719 -16.175 4.414 1.00 1.08 H new ATOM 0 HA GLN B 419 -7.864 -17.598 2.954 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -7.471 -17.796 5.857 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -8.923 -16.870 5.535 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -9.918 -18.652 4.256 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -8.388 -19.487 4.069 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -10.343 -18.191 6.869 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -10.163 -19.653 7.844 1.00 3.52 H new ATOM 2011 N ASN B 420 -8.204 -14.818 4.646 1.00 0.78 N ATOM 2012 CA ASN B 420 -8.647 -13.406 4.478 1.00 0.70 C ATOM 2013 C ASN B 420 -7.434 -12.485 4.322 1.00 0.58 C ATOM 2014 O ASN B 420 -7.337 -11.457 4.962 1.00 0.70 O ATOM 2015 CB ASN B 420 -9.412 -13.075 5.760 1.00 0.86 C ATOM 2016 CG ASN B 420 -10.577 -14.052 5.929 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -10.858 -14.839 5.046 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -11.272 -14.035 7.034 1.00 1.87 N ATOM 0 H ASN B 420 -8.043 -15.110 5.610 1.00 0.78 H new ATOM 0 HA ASN B 420 -9.264 -13.270 3.590 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -8.745 -13.137 6.620 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -9.785 -12.052 5.719 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -12.051 -14.682 7.157 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -11.036 -13.375 7.775 1.00 1.87 H new ATOM 2025 N LEU B 421 -6.507 -12.847 3.477 1.00 0.45 N ATOM 2026 CA LEU B 421 -5.300 -11.992 3.284 1.00 0.40 C ATOM 2027 C LEU B 421 -5.707 -10.594 2.807 1.00 0.39 C ATOM 2028 O LEU B 421 -5.619 -9.627 3.537 1.00 0.53 O ATOM 2029 CB LEU B 421 -4.477 -12.706 2.210 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.479 -13.657 2.877 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.781 -15.096 2.458 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -2.059 -13.294 2.441 1.00 0.41 C ATOM 0 H LEU B 421 -6.533 -13.696 2.913 1.00 0.45 H new ATOM 0 HA LEU B 421 -4.738 -11.859 4.209 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -5.135 -13.263 1.543 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -3.947 -11.976 1.598 1.00 0.42 H new ATOM 0 HG LEU B 421 -3.565 -13.567 3.960 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -3.069 -15.771 2.934 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.793 -15.360 2.766 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.696 -15.185 1.375 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -1.348 -13.971 2.916 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -1.977 -13.383 1.358 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -1.838 -12.269 2.738 1.00 0.41 H new ATOM 2044 N LEU B 422 -6.150 -10.483 1.584 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.558 -9.149 1.051 1.00 0.34 C ATOM 2046 C LEU B 422 -7.513 -8.448 2.024 1.00 0.34 C ATOM 2047 O LEU B 422 -7.601 -7.236 2.058 1.00 0.37 O ATOM 2048 CB LEU B 422 -7.265 -9.457 -0.268 1.00 0.37 C ATOM 2049 CG LEU B 422 -6.250 -9.415 -1.411 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.802 -10.178 -2.617 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -5.987 -7.960 -1.805 1.00 0.63 C ATOM 0 H LEU B 422 -6.248 -11.259 0.929 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.707 -8.481 0.917 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.735 -10.439 -0.220 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -8.059 -8.732 -0.446 1.00 0.37 H new ATOM 0 HG LEU B 422 -5.319 -9.879 -1.085 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -6.077 -10.147 -3.430 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.989 -11.215 -2.337 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -7.734 -9.717 -2.944 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -5.264 -7.929 -2.620 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -6.919 -7.497 -2.129 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -5.591 -7.417 -0.947 1.00 0.63 H new ATOM 2063 N SER B 423 -8.229 -9.199 2.811 1.00 0.35 N ATOM 2064 CA SER B 423 -9.180 -8.578 3.778 1.00 0.38 C ATOM 2065 C SER B 423 -8.427 -7.994 4.980 1.00 0.36 C ATOM 2066 O SER B 423 -8.964 -7.208 5.735 1.00 0.39 O ATOM 2067 CB SER B 423 -10.092 -9.721 4.224 1.00 0.44 C ATOM 2068 OG SER B 423 -10.976 -10.056 3.163 1.00 1.23 O ATOM 0 H SER B 423 -8.198 -10.218 2.828 1.00 0.35 H new ATOM 0 HA SER B 423 -9.738 -7.756 3.330 1.00 0.38 H new ATOM 0 HB2 SER B 423 -9.496 -10.589 4.504 1.00 0.44 H new ATOM 0 HB3 SER B 423 -10.660 -9.426 5.106 1.00 0.44 H new ATOM 0 HG SER B 423 -11.561 -10.790 3.444 1.00 1.23 H new ATOM 2074 N GLU B 424 -7.190 -8.370 5.167 1.00 0.34 N ATOM 2075 CA GLU B 424 -6.417 -7.832 6.325 1.00 0.36 C ATOM 2076 C GLU B 424 -5.768 -6.493 5.960 1.00 0.32 C ATOM 2077 O GLU B 424 -5.919 -5.509 6.658 1.00 0.33 O ATOM 2078 CB GLU B 424 -5.347 -8.886 6.613 1.00 0.38 C ATOM 2079 CG GLU B 424 -5.678 -9.604 7.923 1.00 0.57 C ATOM 2080 CD GLU B 424 -4.757 -10.814 8.089 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -3.618 -10.618 8.480 1.00 1.54 O ATOM 2082 OE2 GLU B 424 -5.206 -11.917 7.823 1.00 1.22 O ATOM 0 H GLU B 424 -6.683 -9.024 4.571 1.00 0.34 H new ATOM 0 HA GLU B 424 -7.052 -7.648 7.191 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.299 -9.604 5.794 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -4.366 -8.415 6.682 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -5.555 -8.922 8.765 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -6.720 -9.924 7.921 1.00 0.57 H new ATOM 2089 N ALA B 425 -5.047 -6.445 4.874 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.392 -5.166 4.470 1.00 0.29 C ATOM 2091 C ALA B 425 -5.420 -4.217 3.843 1.00 0.28 C ATOM 2092 O ALA B 425 -5.204 -3.026 3.751 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.335 -5.569 3.442 1.00 0.29 C ATOM 0 H ALA B 425 -4.882 -7.234 4.249 1.00 0.31 H new ATOM 0 HA ALA B 425 -3.954 -4.641 5.319 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -2.808 -4.680 3.095 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -2.625 -6.257 3.901 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -3.818 -6.058 2.596 1.00 0.29 H new ATOM 2099 N GLN B 426 -6.536 -4.739 3.411 1.00 0.30 N ATOM 2100 CA GLN B 426 -7.581 -3.873 2.789 1.00 0.31 C ATOM 2101 C GLN B 426 -7.857 -2.635 3.655 1.00 0.30 C ATOM 2102 O GLN B 426 -7.730 -1.520 3.187 1.00 0.30 O ATOM 2103 CB GLN B 426 -8.826 -4.757 2.704 1.00 0.36 C ATOM 2104 CG GLN B 426 -9.155 -5.033 1.236 1.00 0.45 C ATOM 2105 CD GLN B 426 -10.419 -5.890 1.146 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -11.157 -6.007 2.104 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -10.702 -6.498 0.027 1.00 1.09 N ATOM 0 H GLN B 426 -6.770 -5.730 3.462 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.271 -3.501 1.812 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -8.656 -5.695 3.232 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -9.668 -4.265 3.191 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -9.302 -4.094 0.703 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -8.321 -5.545 0.756 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -10.083 -6.400 -0.777 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -11.543 -7.071 -0.043 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.233 -2.860 4.892 1.00 0.32 N ATOM 2117 CA PRO B 427 -8.530 -1.728 5.809 1.00 0.34 C ATOM 2118 C PRO B 427 -7.261 -0.935 6.133 1.00 0.31 C ATOM 2119 O PRO B 427 -7.315 0.248 6.398 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.085 -2.412 7.058 1.00 0.39 C ATOM 2121 CG PRO B 427 -8.525 -3.795 7.013 1.00 0.38 C ATOM 2122 CD PRO B 427 -8.414 -4.159 5.557 1.00 0.35 C ATOM 0 HA PRO B 427 -9.225 -1.007 5.379 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -8.779 -1.890 7.965 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.175 -2.426 7.051 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -7.550 -3.836 7.499 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -9.174 -4.494 7.540 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -7.571 -4.825 5.373 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.308 -4.671 5.202 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.122 -1.568 6.115 1.00 0.29 N ATOM 2131 CA GLU B 428 -4.862 -0.832 6.425 1.00 0.29 C ATOM 2132 C GLU B 428 -4.675 0.333 5.447 1.00 0.27 C ATOM 2133 O GLU B 428 -4.569 1.478 5.842 1.00 0.32 O ATOM 2134 CB GLU B 428 -3.745 -1.862 6.253 1.00 0.29 C ATOM 2135 CG GLU B 428 -2.659 -1.617 7.302 1.00 0.71 C ATOM 2136 CD GLU B 428 -1.788 -2.869 7.439 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -1.739 -3.638 6.493 1.00 2.07 O ATOM 2138 OE2 GLU B 428 -1.185 -3.036 8.486 1.00 2.11 O ATOM 0 H GLU B 428 -6.007 -2.559 5.900 1.00 0.29 H new ATOM 0 HA GLU B 428 -4.870 -0.406 7.428 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.146 -2.870 6.358 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.321 -1.790 5.251 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -2.045 -0.764 7.013 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -3.114 -1.371 8.261 1.00 0.71 H new ATOM 2145 N LEU B 429 -4.636 0.050 4.173 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.456 1.140 3.170 1.00 0.26 C ATOM 2147 C LEU B 429 -5.654 2.095 3.202 1.00 0.25 C ATOM 2148 O LEU B 429 -5.499 3.295 3.307 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.374 0.423 1.820 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.320 1.455 0.691 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.063 1.226 -0.152 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.559 1.306 -0.195 1.00 0.56 C ATOM 0 H LEU B 429 -4.721 -0.889 3.783 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.569 1.742 3.367 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -3.489 -0.212 1.788 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.239 -0.228 1.690 1.00 0.26 H new ATOM 0 HG LEU B 429 -4.294 2.458 1.118 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.025 1.961 -0.956 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.179 1.330 0.477 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -3.089 0.223 -0.578 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.522 2.041 -0.999 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -5.583 0.303 -0.621 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.456 1.468 0.403 1.00 0.56 H new ATOM 2164 N GLU B 430 -6.845 1.571 3.108 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.051 2.449 3.129 1.00 0.28 C ATOM 2166 C GLU B 430 -8.081 3.286 4.412 1.00 0.30 C ATOM 2167 O GLU B 430 -8.728 4.311 4.479 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.240 1.488 3.084 1.00 0.30 C ATOM 2169 CG GLU B 430 -9.813 1.449 1.666 1.00 0.61 C ATOM 2170 CD GLU B 430 -9.227 0.254 0.911 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -9.554 -0.865 1.268 1.00 2.17 O ATOM 2172 OE2 GLU B 430 -8.462 0.479 -0.012 1.00 2.05 O ATOM 0 H GLU B 430 -7.036 0.573 3.018 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.063 3.152 2.296 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -8.926 0.490 3.388 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -10.007 1.809 3.789 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -10.900 1.372 1.704 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -9.577 2.375 1.142 1.00 0.61 H new ATOM 2179 N ARG B 431 -7.387 2.855 5.431 1.00 0.33 N ATOM 2180 CA ARG B 431 -7.380 3.630 6.706 1.00 0.37 C ATOM 2181 C ARG B 431 -6.483 4.863 6.574 1.00 0.36 C ATOM 2182 O ARG B 431 -6.923 5.983 6.745 1.00 0.38 O ATOM 2183 CB ARG B 431 -6.817 2.668 7.755 1.00 0.41 C ATOM 2184 CG ARG B 431 -6.672 3.397 9.093 1.00 0.59 C ATOM 2185 CD ARG B 431 -6.693 2.379 10.234 1.00 1.32 C ATOM 2186 NE ARG B 431 -6.945 3.184 11.462 1.00 1.56 N ATOM 2187 CZ ARG B 431 -6.442 2.806 12.605 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -6.538 1.560 12.981 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -5.843 3.674 13.372 1.00 2.78 N ATOM 0 H ARG B 431 -6.826 2.003 5.436 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.374 3.988 6.973 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -7.478 1.809 7.867 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -5.849 2.286 7.431 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -5.740 3.962 9.112 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -7.482 4.115 9.217 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -7.474 1.633 10.084 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -5.747 1.841 10.301 1.00 1.32 H new ATOM 0 HE ARG B 431 -7.511 4.031 11.409 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -7.006 0.881 12.381 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -6.145 1.265 13.875 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -5.768 4.648 13.078 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -5.450 3.379 14.266 1.00 2.78 H new ATOM 2203 N THR B 432 -5.227 4.668 6.272 1.00 0.41 N ATOM 2204 CA THR B 432 -4.306 5.833 6.133 1.00 0.45 C ATOM 2205 C THR B 432 -4.791 6.765 5.017 1.00 0.40 C ATOM 2206 O THR B 432 -4.431 7.923 4.963 1.00 0.56 O ATOM 2207 CB THR B 432 -2.949 5.226 5.773 1.00 0.53 C ATOM 2208 OG1 THR B 432 -2.500 4.411 6.847 1.00 0.61 O ATOM 2209 CG2 THR B 432 -1.936 6.345 5.520 1.00 0.62 C ATOM 0 H THR B 432 -4.800 3.755 6.116 1.00 0.41 H new ATOM 0 HA THR B 432 -4.257 6.430 7.044 1.00 0.45 H new ATOM 0 HB THR B 432 -3.048 4.621 4.872 1.00 0.53 H new ATOM 0 HG1 THR B 432 -1.631 4.019 6.619 1.00 0.61 H new ATOM 0 HG21 THR B 432 -0.970 5.910 5.264 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.282 6.970 4.697 1.00 0.62 H new ATOM 0 HG23 THR B 432 -1.833 6.953 6.419 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.609 6.269 4.127 1.00 0.33 N ATOM 2218 CA LEU B 433 -6.115 7.129 3.019 1.00 0.30 C ATOM 2219 C LEU B 433 -7.348 7.910 3.479 1.00 0.27 C ATOM 2220 O LEU B 433 -7.470 9.094 3.237 1.00 0.25 O ATOM 2221 CB LEU B 433 -6.484 6.156 1.899 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.937 6.677 0.569 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -6.538 8.052 0.274 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -4.414 6.794 0.655 1.00 0.44 C ATOM 0 H LEU B 433 -5.948 5.307 4.120 1.00 0.33 H new ATOM 0 HA LEU B 433 -5.377 7.862 2.694 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -6.074 5.169 2.111 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.567 6.046 1.841 1.00 0.37 H new ATOM 0 HG LEU B 433 -6.204 5.985 -0.230 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -6.148 8.424 -0.674 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -7.623 7.969 0.213 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -6.271 8.745 1.072 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -4.024 7.165 -0.293 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -4.147 7.486 1.454 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.985 5.814 0.865 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.263 7.256 4.141 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.487 7.962 4.616 1.00 0.32 C ATOM 2238 C LEU B 434 -9.110 9.063 5.611 1.00 0.29 C ATOM 2239 O LEU B 434 -9.599 10.173 5.538 1.00 0.30 O ATOM 2240 CB LEU B 434 -10.323 6.882 5.303 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.797 7.292 5.287 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.437 6.847 3.971 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -12.522 6.623 6.457 1.00 1.14 C ATOM 0 H LEU B 434 -8.216 6.264 4.373 1.00 0.32 H new ATOM 0 HA LEU B 434 -10.030 8.443 3.802 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.194 5.928 4.793 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -9.984 6.743 6.330 1.00 0.41 H new ATOM 0 HG LEU B 434 -11.874 8.375 5.380 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.487 7.139 3.960 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -11.920 7.320 3.136 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.361 5.764 3.877 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -13.573 6.913 6.448 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -12.444 5.540 6.362 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -12.066 6.938 7.396 1.00 1.14 H new ATOM 2255 N THR B 435 -8.244 8.766 6.541 1.00 0.34 N ATOM 2256 CA THR B 435 -7.837 9.798 7.537 1.00 0.37 C ATOM 2257 C THR B 435 -7.161 10.975 6.828 1.00 0.35 C ATOM 2258 O THR B 435 -7.444 12.123 7.105 1.00 0.39 O ATOM 2259 CB THR B 435 -6.848 9.088 8.462 1.00 0.45 C ATOM 2260 OG1 THR B 435 -7.377 7.824 8.836 1.00 0.52 O ATOM 2261 CG2 THR B 435 -6.616 9.937 9.713 1.00 0.55 C ATOM 0 H THR B 435 -7.801 7.854 6.654 1.00 0.34 H new ATOM 0 HA THR B 435 -8.687 10.203 8.086 1.00 0.37 H new ATOM 0 HB THR B 435 -5.901 8.947 7.942 1.00 0.45 H new ATOM 0 HG1 THR B 435 -7.088 7.145 8.191 1.00 0.52 H new ATOM 0 HG21 THR B 435 -5.911 9.430 10.371 1.00 0.55 H new ATOM 0 HG22 THR B 435 -6.210 10.907 9.425 1.00 0.55 H new ATOM 0 HG23 THR B 435 -7.562 10.081 10.236 1.00 0.55 H new ATOM 2269 N THR B 436 -6.271 10.697 5.916 1.00 0.33 N ATOM 2270 CA THR B 436 -5.580 11.800 5.189 1.00 0.36 C ATOM 2271 C THR B 436 -6.606 12.681 4.475 1.00 0.36 C ATOM 2272 O THR B 436 -6.737 13.854 4.762 1.00 0.40 O ATOM 2273 CB THR B 436 -4.673 11.102 4.174 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.760 10.256 4.862 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.898 12.148 3.372 1.00 0.49 C ATOM 0 H THR B 436 -5.992 9.755 5.642 1.00 0.33 H new ATOM 0 HA THR B 436 -5.015 12.447 5.860 1.00 0.36 H new ATOM 0 HB THR B 436 -5.281 10.506 3.493 1.00 0.38 H new ATOM 0 HG1 THR B 436 -3.816 9.348 4.496 1.00 0.39 H new ATOM 0 HG21 THR B 436 -3.253 11.648 2.650 1.00 0.49 H new ATOM 0 HG22 THR B 436 -4.599 12.795 2.845 1.00 0.49 H new ATOM 0 HG23 THR B 436 -3.289 12.747 4.049 1.00 0.49 H new ATOM 2283 N ALA B 437 -7.340 12.126 3.549 1.00 0.34 N ATOM 2284 CA ALA B 437 -8.359 12.937 2.827 1.00 0.36 C ATOM 2285 C ALA B 437 -9.304 13.595 3.834 1.00 0.36 C ATOM 2286 O ALA B 437 -9.675 14.742 3.689 1.00 0.41 O ATOM 2287 CB ALA B 437 -9.112 11.941 1.944 1.00 0.35 C ATOM 0 H ALA B 437 -7.278 11.149 3.263 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.914 13.737 2.236 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.882 12.466 1.379 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -8.414 11.467 1.253 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -9.577 11.179 2.570 1.00 0.35 H new ATOM 2293 N LEU B 438 -9.690 12.885 4.860 1.00 0.34 N ATOM 2294 CA LEU B 438 -10.598 13.494 5.870 1.00 0.36 C ATOM 2295 C LEU B 438 -9.925 14.723 6.479 1.00 0.42 C ATOM 2296 O LEU B 438 -10.559 15.727 6.730 1.00 0.46 O ATOM 2297 CB LEU B 438 -10.825 12.416 6.936 1.00 0.36 C ATOM 2298 CG LEU B 438 -11.594 13.022 8.119 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -12.905 13.636 7.624 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -11.908 11.932 9.144 1.00 0.45 C ATOM 0 H LEU B 438 -9.418 11.919 5.040 1.00 0.34 H new ATOM 0 HA LEU B 438 -11.544 13.817 5.435 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -11.385 11.583 6.512 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.869 12.018 7.275 1.00 0.36 H new ATOM 0 HG LEU B 438 -10.980 13.794 8.582 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -13.447 14.065 8.467 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -12.689 14.418 6.896 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -13.515 12.863 7.156 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -12.454 12.367 9.982 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -12.517 11.158 8.677 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -10.978 11.493 9.505 1.00 0.45 H new ATOM 2312 N ARG B 439 -8.639 14.659 6.712 1.00 0.43 N ATOM 2313 CA ARG B 439 -7.932 15.836 7.295 1.00 0.50 C ATOM 2314 C ARG B 439 -8.269 17.086 6.480 1.00 0.54 C ATOM 2315 O ARG B 439 -8.502 18.151 7.018 1.00 0.60 O ATOM 2316 CB ARG B 439 -6.444 15.502 7.191 1.00 0.52 C ATOM 2317 CG ARG B 439 -5.798 15.613 8.573 1.00 0.77 C ATOM 2318 CD ARG B 439 -5.133 16.983 8.717 1.00 1.27 C ATOM 2319 NE ARG B 439 -4.655 17.030 10.127 1.00 1.73 N ATOM 2320 CZ ARG B 439 -4.524 18.179 10.733 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -5.580 18.896 11.006 1.00 2.89 N ATOM 2322 NH2 ARG B 439 -3.338 18.609 11.064 1.00 2.81 N ATOM 0 H ARG B 439 -8.051 13.847 6.525 1.00 0.43 H new ATOM 0 HA ARG B 439 -8.222 16.034 8.327 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -6.313 14.494 6.797 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -5.956 16.183 6.494 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -6.551 15.479 9.350 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -5.059 14.823 8.705 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -4.306 17.097 8.016 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -5.838 17.788 8.512 1.00 1.27 H new ATOM 0 HE ARG B 439 -4.430 16.165 10.619 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -6.507 18.559 10.746 1.00 2.89 H new ATOM 0 HH12 ARG B 439 -5.478 19.794 11.479 1.00 2.89 H new ATOM 0 HH21 ARG B 439 -2.514 18.048 10.849 1.00 2.81 H new ATOM 0 HH22 ARG B 439 -3.235 19.507 11.537 1.00 2.81 H new ATOM 2336 N HIS B 440 -8.326 16.953 5.181 1.00 0.52 N ATOM 2337 CA HIS B 440 -8.681 18.121 4.333 1.00 0.57 C ATOM 2338 C HIS B 440 -10.075 18.607 4.731 1.00 0.58 C ATOM 2339 O HIS B 440 -10.395 19.776 4.643 1.00 0.64 O ATOM 2340 CB HIS B 440 -8.678 17.582 2.901 1.00 0.55 C ATOM 2341 CG HIS B 440 -9.004 18.695 1.943 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -9.310 18.458 0.612 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -9.074 20.056 2.107 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -9.548 19.649 0.032 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -9.418 20.656 0.900 1.00 0.75 N ATOM 0 H HIS B 440 -8.142 16.087 4.675 1.00 0.52 H new ATOM 0 HA HIS B 440 -7.994 18.961 4.441 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -7.702 17.158 2.663 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -9.408 16.778 2.803 1.00 0.55 H new ATOM 0 HD2 HIS B 440 -8.890 20.581 3.033 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -9.812 19.775 -1.008 1.00 0.97 H new ATOM 0 HE2 HIS B 440 -9.544 21.652 0.717 1.00 0.75 H new ATOM 2353 N THR B 441 -10.897 17.702 5.190 1.00 0.53 N ATOM 2354 CA THR B 441 -12.273 18.073 5.627 1.00 0.55 C ATOM 2355 C THR B 441 -12.516 17.510 7.031 1.00 0.56 C ATOM 2356 O THR B 441 -13.504 16.851 7.282 1.00 0.55 O ATOM 2357 CB THR B 441 -13.218 17.414 4.615 1.00 0.53 C ATOM 2358 OG1 THR B 441 -13.178 16.004 4.786 1.00 0.48 O ATOM 2359 CG2 THR B 441 -12.788 17.767 3.189 1.00 0.54 C ATOM 0 H THR B 441 -10.671 16.712 5.282 1.00 0.53 H new ATOM 0 HA THR B 441 -12.426 19.152 5.665 1.00 0.55 H new ATOM 0 HB THR B 441 -14.232 17.778 4.781 1.00 0.53 H new ATOM 0 HG1 THR B 441 -13.641 15.762 5.615 1.00 0.48 H new ATOM 0 HG21 THR B 441 -13.465 17.294 2.477 1.00 0.54 H new ATOM 0 HG22 THR B 441 -12.819 18.848 3.057 1.00 0.54 H new ATOM 0 HG23 THR B 441 -11.773 17.410 3.016 1.00 0.54 H new ATOM 2367 N GLN B 442 -11.594 17.752 7.934 1.00 0.59 N ATOM 2368 CA GLN B 442 -11.716 17.230 9.334 1.00 0.62 C ATOM 2369 C GLN B 442 -13.158 17.308 9.848 1.00 0.64 C ATOM 2370 O GLN B 442 -13.793 18.342 9.800 1.00 0.69 O ATOM 2371 CB GLN B 442 -10.809 18.137 10.166 1.00 0.69 C ATOM 2372 CG GLN B 442 -9.845 17.280 10.989 1.00 1.43 C ATOM 2373 CD GLN B 442 -9.553 17.978 12.319 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -9.696 17.389 13.371 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -9.146 19.218 12.315 1.00 2.47 N ATOM 0 H GLN B 442 -10.750 18.297 7.757 1.00 0.59 H new ATOM 0 HA GLN B 442 -11.434 16.179 9.392 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -10.250 18.807 9.513 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -11.410 18.763 10.826 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -10.279 16.296 11.169 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -8.918 17.123 10.437 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -9.026 19.713 11.431 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -8.948 19.693 13.196 1.00 2.47 H new ATOM 2384 N GLY B 443 -13.673 16.213 10.342 1.00 0.63 N ATOM 2385 CA GLY B 443 -15.067 16.212 10.863 1.00 0.66 C ATOM 2386 C GLY B 443 -16.038 15.888 9.728 1.00 0.64 C ATOM 2387 O GLY B 443 -16.887 15.027 9.850 1.00 0.66 O ATOM 0 H GLY B 443 -13.186 15.319 10.406 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -15.167 15.477 11.662 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -15.306 17.185 11.293 1.00 0.66 H new ATOM 2391 N HIS B 444 -15.920 16.569 8.622 1.00 0.62 N ATOM 2392 CA HIS B 444 -16.836 16.300 7.479 1.00 0.62 C ATOM 2393 C HIS B 444 -16.488 14.956 6.833 1.00 0.67 C ATOM 2394 O HIS B 444 -16.040 14.897 5.705 1.00 1.34 O ATOM 2395 CB HIS B 444 -16.592 17.447 6.498 1.00 0.63 C ATOM 2396 CG HIS B 444 -17.087 18.734 7.098 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -16.242 19.620 7.749 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -18.337 19.300 7.153 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -16.986 20.661 8.163 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -18.271 20.517 7.826 1.00 1.86 N ATOM 0 H HIS B 444 -15.228 17.301 8.460 1.00 0.62 H new ATOM 0 HA HIS B 444 -17.880 16.245 7.787 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -15.529 17.525 6.270 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -17.106 17.251 5.557 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -19.235 18.867 6.737 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -16.593 21.510 8.702 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -19.038 21.160 8.020 1.00 1.86 H new ATOM 2408 N LYS B 445 -16.690 13.876 7.538 1.00 0.62 N ATOM 2409 CA LYS B 445 -16.370 12.539 6.961 1.00 0.51 C ATOM 2410 C LYS B 445 -17.068 12.371 5.607 1.00 0.51 C ATOM 2411 O LYS B 445 -16.637 11.606 4.767 1.00 0.57 O ATOM 2412 CB LYS B 445 -16.912 11.528 7.974 1.00 0.62 C ATOM 2413 CG LYS B 445 -18.400 11.791 8.217 1.00 1.31 C ATOM 2414 CD LYS B 445 -18.681 11.783 9.721 1.00 1.56 C ATOM 2415 CE LYS B 445 -18.419 10.384 10.283 1.00 2.23 C ATOM 2416 NZ LYS B 445 -19.683 10.002 10.971 1.00 2.52 N ATOM 0 H LYS B 445 -17.062 13.862 8.487 1.00 0.62 H new ATOM 0 HA LYS B 445 -15.302 12.407 6.788 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -16.768 10.513 7.603 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -16.361 11.606 8.911 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -18.685 12.752 7.788 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -19.001 11.029 7.720 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -18.047 12.513 10.224 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -19.714 12.075 9.910 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -18.174 9.679 9.489 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -17.578 10.388 10.976 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -19.581 9.052 11.383 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -19.888 10.687 11.726 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -20.465 10.000 10.285 1.00 2.52 H new ATOM 2430 N GLN B 446 -18.142 13.082 5.389 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.865 12.965 4.089 1.00 0.56 C ATOM 2432 C GLN B 446 -18.040 13.604 2.968 1.00 0.52 C ATOM 2433 O GLN B 446 -17.943 13.074 1.878 1.00 0.51 O ATOM 2434 CB GLN B 446 -20.177 13.725 4.291 1.00 0.64 C ATOM 2435 CG GLN B 446 -21.080 13.516 3.074 1.00 1.11 C ATOM 2436 CD GLN B 446 -22.327 12.731 3.489 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -22.245 11.813 4.281 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -23.486 13.057 2.985 1.00 2.40 N ATOM 0 H GLN B 446 -18.550 13.739 6.055 1.00 0.53 H new ATOM 0 HA GLN B 446 -19.038 11.927 3.805 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -20.678 13.374 5.193 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -19.977 14.787 4.430 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -21.368 14.479 2.652 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -20.540 12.976 2.296 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -23.555 13.828 2.320 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -24.323 12.541 3.256 1.00 2.40 H new ATOM 2447 N GLU B 447 -17.443 14.738 3.225 1.00 0.52 N ATOM 2448 CA GLU B 447 -16.623 15.403 2.170 1.00 0.51 C ATOM 2449 C GLU B 447 -15.591 14.420 1.613 1.00 0.45 C ATOM 2450 O GLU B 447 -15.298 14.412 0.434 1.00 0.45 O ATOM 2451 CB GLU B 447 -15.933 16.570 2.875 1.00 0.53 C ATOM 2452 CG GLU B 447 -16.569 17.886 2.423 1.00 0.80 C ATOM 2453 CD GLU B 447 -15.853 19.059 3.093 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -15.990 19.201 4.297 1.00 1.96 O ATOM 2455 OE2 GLU B 447 -15.179 19.795 2.391 1.00 2.14 O ATOM 0 H GLU B 447 -17.487 15.231 4.117 1.00 0.52 H new ATOM 0 HA GLU B 447 -17.227 15.742 1.328 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -16.025 16.462 3.956 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -14.868 16.570 2.644 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -16.505 17.979 1.339 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -17.628 17.898 2.682 1.00 0.80 H new ATOM 2462 N ALA B 448 -15.049 13.579 2.452 1.00 0.43 N ATOM 2463 CA ALA B 448 -14.048 12.585 1.968 1.00 0.39 C ATOM 2464 C ALA B 448 -14.632 11.791 0.797 1.00 0.40 C ATOM 2465 O ALA B 448 -13.914 11.244 -0.017 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.786 11.670 3.164 1.00 0.39 C ATOM 0 H ALA B 448 -15.256 13.537 3.450 1.00 0.43 H new ATOM 0 HA ALA B 448 -13.131 13.054 1.612 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -13.057 10.909 2.887 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -13.397 12.259 3.995 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.717 11.189 3.465 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.933 11.730 0.704 1.00 0.44 N ATOM 2473 CA ALA B 449 -16.567 10.979 -0.415 1.00 0.47 C ATOM 2474 C ALA B 449 -16.039 11.493 -1.758 1.00 0.48 C ATOM 2475 O ALA B 449 -15.285 10.825 -2.436 1.00 0.49 O ATOM 2476 CB ALA B 449 -18.063 11.267 -0.280 1.00 0.52 C ATOM 0 H ALA B 449 -16.584 12.168 1.356 1.00 0.44 H new ATOM 0 HA ALA B 449 -16.351 9.911 -0.376 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -18.606 10.749 -1.070 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -18.415 10.918 0.691 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -18.236 12.340 -0.364 1.00 0.52 H new ATOM 2482 N ARG B 450 -16.431 12.678 -2.143 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.952 13.239 -3.440 1.00 0.52 C ATOM 2484 C ARG B 450 -14.425 13.334 -3.444 1.00 0.49 C ATOM 2485 O ARG B 450 -13.784 13.163 -4.462 1.00 0.50 O ATOM 2486 CB ARG B 450 -16.576 14.634 -3.521 1.00 0.57 C ATOM 2487 CG ARG B 450 -16.960 14.941 -4.971 1.00 0.78 C ATOM 2488 CD ARG B 450 -18.244 14.190 -5.329 1.00 1.37 C ATOM 2489 NE ARG B 450 -18.565 14.616 -6.720 1.00 1.76 N ATOM 2490 CZ ARG B 450 -19.558 14.062 -7.359 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -19.722 12.767 -7.311 1.00 2.93 N ATOM 2492 NH2 ARG B 450 -20.388 14.799 -8.046 1.00 2.97 N ATOM 0 H ARG B 450 -17.062 13.282 -1.616 1.00 0.49 H new ATOM 0 HA ARG B 450 -16.233 12.616 -4.289 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -17.457 14.687 -2.882 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -15.871 15.381 -3.155 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -17.105 16.013 -5.101 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -16.154 14.645 -5.642 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -18.100 13.111 -5.270 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -19.053 14.441 -4.643 1.00 1.37 H new ATOM 0 HE ARG B 450 -18.008 15.341 -7.173 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -19.074 12.190 -6.774 1.00 2.93 H new ATOM 0 HH12 ARG B 450 -20.498 12.332 -7.810 1.00 2.93 H new ATOM 0 HH21 ARG B 450 -20.261 15.810 -8.084 1.00 2.97 H new ATOM 0 HH22 ARG B 450 -21.164 14.364 -8.545 1.00 2.97 H new ATOM 2506 N LEU B 451 -13.837 13.605 -2.311 1.00 0.48 N ATOM 2507 CA LEU B 451 -12.352 13.710 -2.245 1.00 0.47 C ATOM 2508 C LEU B 451 -11.703 12.437 -2.796 1.00 0.44 C ATOM 2509 O LEU B 451 -10.716 12.488 -3.502 1.00 0.48 O ATOM 2510 CB LEU B 451 -12.036 13.871 -0.757 1.00 0.46 C ATOM 2511 CG LEU B 451 -10.918 14.898 -0.578 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -10.592 15.043 0.909 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -9.671 14.428 -1.330 1.00 1.04 C ATOM 0 H LEU B 451 -14.322 13.758 -1.427 1.00 0.48 H new ATOM 0 HA LEU B 451 -11.970 14.541 -2.838 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.928 14.192 -0.218 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -11.735 12.913 -0.333 1.00 0.46 H new ATOM 0 HG LEU B 451 -11.241 15.861 -0.974 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -9.795 15.775 1.037 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -11.480 15.376 1.445 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -10.268 14.081 1.306 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -8.873 15.159 -1.203 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -9.348 13.466 -0.933 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.903 14.324 -2.390 1.00 1.04 H new ATOM 2525 N LEU B 452 -12.249 11.294 -2.478 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.661 10.019 -2.982 1.00 0.40 C ATOM 2527 C LEU B 452 -12.520 9.446 -4.114 1.00 0.46 C ATOM 2528 O LEU B 452 -12.444 8.275 -4.429 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.667 9.075 -1.779 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.858 9.694 -0.637 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.479 9.290 0.703 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.413 9.189 -0.708 1.00 0.43 C ATOM 0 H LEU B 452 -13.077 11.188 -1.891 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.659 10.162 -3.385 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.691 8.890 -1.454 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -11.242 8.111 -2.058 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.868 10.780 -0.727 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.904 9.730 1.518 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.507 9.648 0.750 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.468 8.204 0.796 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.834 9.628 0.104 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.402 8.103 -0.616 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -8.974 9.476 -1.663 1.00 0.43 H new ATOM 2544 N GLY B 453 -13.339 10.259 -4.727 1.00 0.50 N ATOM 2545 CA GLY B 453 -14.200 9.753 -5.835 1.00 0.56 C ATOM 2546 C GLY B 453 -15.012 8.555 -5.342 1.00 0.58 C ATOM 2547 O GLY B 453 -15.219 7.594 -6.056 1.00 0.68 O ATOM 0 H GLY B 453 -13.449 11.249 -4.509 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -14.868 10.542 -6.180 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -13.583 9.463 -6.686 1.00 0.56 H new ATOM 2551 N TRP B 454 -15.468 8.604 -4.123 1.00 0.54 N ATOM 2552 CA TRP B 454 -16.263 7.469 -3.571 1.00 0.60 C ATOM 2553 C TRP B 454 -17.749 7.834 -3.516 1.00 0.69 C ATOM 2554 O TRP B 454 -18.536 7.401 -4.333 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.717 7.262 -2.155 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.627 6.231 -2.161 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -13.863 5.899 -3.233 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -14.167 5.399 -1.058 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -12.965 4.912 -2.857 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -13.109 4.569 -1.528 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.562 5.282 0.300 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -12.462 3.651 -0.679 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.914 4.360 1.158 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.865 3.546 0.668 1.00 0.51 C ATOM 0 H TRP B 454 -15.325 9.384 -3.481 1.00 0.54 H new ATOM 0 HA TRP B 454 -16.179 6.572 -4.184 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.333 8.205 -1.765 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.521 6.946 -1.491 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -13.942 6.333 -4.219 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -12.281 4.491 -3.486 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -15.362 5.900 0.682 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.662 3.031 -1.057 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -14.222 4.278 2.190 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -12.373 2.845 1.326 1.00 0.51 H new ATOM 2575 N GLY B 455 -18.134 8.623 -2.553 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.566 9.016 -2.430 1.00 0.72 C ATOM 2577 C GLY B 455 -20.018 8.813 -0.984 1.00 0.70 C ATOM 2578 O GLY B 455 -19.213 8.578 -0.105 1.00 0.64 O ATOM 0 H GLY B 455 -17.516 9.015 -1.842 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.696 10.058 -2.722 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -20.179 8.417 -3.103 1.00 0.72 H new ATOM 2582 N ALA B 456 -21.293 8.901 -0.724 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.781 8.708 0.673 1.00 0.77 C ATOM 2584 C ALA B 456 -22.102 7.232 0.918 1.00 0.82 C ATOM 2585 O ALA B 456 -22.013 6.745 2.027 1.00 0.83 O ATOM 2586 CB ALA B 456 -23.047 9.559 0.774 1.00 0.84 C ATOM 0 H ALA B 456 -22.017 9.097 -1.415 1.00 0.77 H new ATOM 0 HA ALA B 456 -21.038 8.999 1.415 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -23.467 9.469 1.776 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.801 10.602 0.575 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.777 9.213 0.043 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.471 6.517 -0.109 1.00 0.90 N ATOM 2593 CA ALA B 457 -22.793 5.072 0.068 1.00 0.97 C ATOM 2594 C ALA B 457 -21.503 4.274 0.272 1.00 0.89 C ATOM 2595 O ALA B 457 -21.394 3.476 1.183 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.485 4.655 -1.230 1.00 1.07 C ATOM 0 H ALA B 457 -22.563 6.870 -1.062 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.425 4.890 0.937 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -23.754 3.600 -1.176 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.386 5.252 -1.370 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -22.809 4.815 -2.070 1.00 1.07 H new ATOM 2602 N THR B 458 -20.524 4.486 -0.563 1.00 0.84 N ATOM 2603 CA THR B 458 -19.242 3.742 -0.410 1.00 0.77 C ATOM 2604 C THR B 458 -18.599 4.088 0.935 1.00 0.68 C ATOM 2605 O THR B 458 -18.223 3.220 1.697 1.00 0.67 O ATOM 2606 CB THR B 458 -18.361 4.226 -1.563 1.00 0.76 C ATOM 2607 OG1 THR B 458 -19.045 4.029 -2.793 1.00 0.85 O ATOM 2608 CG2 THR B 458 -17.050 3.436 -1.573 1.00 0.72 C ATOM 0 H THR B 458 -20.556 5.141 -1.344 1.00 0.84 H new ATOM 0 HA THR B 458 -19.383 2.661 -0.433 1.00 0.77 H new ATOM 0 HB THR B 458 -18.142 5.286 -1.434 1.00 0.76 H new ATOM 0 HG1 THR B 458 -18.483 4.340 -3.533 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.423 3.782 -2.395 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.527 3.588 -0.629 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.265 2.375 -1.702 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.475 5.353 1.231 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.862 5.760 2.529 1.00 0.57 C ATOM 2618 C LEU B 459 -18.563 5.045 3.687 1.00 0.60 C ATOM 2619 O LEU B 459 -17.962 4.744 4.699 1.00 0.58 O ATOM 2620 CB LEU B 459 -18.083 7.271 2.612 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.729 7.982 2.680 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.828 9.340 1.987 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -16.335 8.193 4.140 1.00 0.46 C ATOM 0 H LEU B 459 -18.771 6.123 0.631 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.805 5.501 2.591 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.643 7.616 1.743 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.678 7.514 3.492 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.977 7.370 2.182 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.863 9.845 2.036 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -17.110 9.196 0.944 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -17.582 9.949 2.486 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -15.371 8.699 4.187 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -17.090 8.803 4.636 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -16.263 7.227 4.641 1.00 0.46 H new ATOM 2635 N THR B 460 -19.828 4.766 3.541 1.00 0.68 N ATOM 2636 CA THR B 460 -20.568 4.064 4.626 1.00 0.74 C ATOM 2637 C THR B 460 -20.409 2.551 4.469 1.00 0.76 C ATOM 2638 O THR B 460 -20.052 1.854 5.398 1.00 0.75 O ATOM 2639 CB THR B 460 -22.030 4.474 4.442 1.00 0.83 C ATOM 2640 OG1 THR B 460 -22.149 5.881 4.603 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.897 3.764 5.481 1.00 0.92 C ATOM 0 H THR B 460 -20.382 4.994 2.716 1.00 0.68 H new ATOM 0 HA THR B 460 -20.198 4.324 5.618 1.00 0.74 H new ATOM 0 HB THR B 460 -22.363 4.193 3.443 1.00 0.83 H new ATOM 0 HG1 THR B 460 -22.144 6.313 3.723 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.938 4.058 5.348 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.805 2.685 5.355 1.00 0.92 H new ATOM 0 HG23 THR B 460 -22.567 4.042 6.482 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.665 2.039 3.295 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.520 0.571 3.076 1.00 0.85 C ATOM 2651 C ALA B 461 -19.065 0.155 3.299 1.00 0.79 C ATOM 2652 O ALA B 461 -18.785 -0.903 3.828 1.00 0.83 O ATOM 2653 CB ALA B 461 -20.927 0.344 1.620 1.00 0.92 C ATOM 0 H ALA B 461 -20.968 2.572 2.480 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.131 -0.015 3.762 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -20.847 -0.716 1.381 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -21.956 0.672 1.475 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.269 0.915 0.965 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.136 0.984 2.905 1.00 0.72 N ATOM 2660 CA LYS B 462 -16.699 0.642 3.100 1.00 0.68 C ATOM 2661 C LYS B 462 -16.379 0.574 4.595 1.00 0.65 C ATOM 2662 O LYS B 462 -15.504 -0.154 5.021 1.00 0.66 O ATOM 2663 CB LYS B 462 -15.926 1.784 2.438 1.00 0.66 C ATOM 2664 CG LYS B 462 -16.094 1.702 0.919 1.00 0.99 C ATOM 2665 CD LYS B 462 -15.150 0.637 0.357 1.00 0.91 C ATOM 2666 CE LYS B 462 -14.701 1.042 -1.048 1.00 1.31 C ATOM 2667 NZ LYS B 462 -15.591 0.283 -1.971 1.00 1.39 N ATOM 0 H LYS B 462 -18.311 1.883 2.457 1.00 0.72 H new ATOM 0 HA LYS B 462 -16.439 -0.326 2.671 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.291 2.744 2.803 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -14.870 1.723 2.701 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -17.126 1.456 0.670 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -15.878 2.670 0.466 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -14.284 0.524 1.009 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -15.653 -0.329 0.325 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -14.800 2.117 -1.199 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -13.653 0.792 -1.215 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -15.538 0.697 -2.923 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -15.286 -0.711 -2.008 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -16.571 0.332 -1.626 1.00 1.39 H new ATOM 2681 N LEU B 463 -17.086 1.325 5.395 1.00 0.65 N ATOM 2682 CA LEU B 463 -16.826 1.301 6.862 1.00 0.65 C ATOM 2683 C LEU B 463 -17.124 -0.092 7.422 1.00 0.68 C ATOM 2684 O LEU B 463 -16.403 -0.604 8.254 1.00 0.70 O ATOM 2685 CB LEU B 463 -17.788 2.336 7.450 1.00 0.68 C ATOM 2686 CG LEU B 463 -17.333 2.711 8.861 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -17.830 4.116 9.201 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -17.910 1.710 9.865 1.00 0.99 C ATOM 0 H LEU B 463 -17.832 1.954 5.096 1.00 0.65 H new ATOM 0 HA LEU B 463 -15.788 1.527 7.106 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.816 3.223 6.817 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -18.800 1.933 7.478 1.00 0.68 H new ATOM 0 HG LEU B 463 -16.244 2.689 8.909 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -17.506 4.383 10.207 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -17.421 4.830 8.486 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -18.919 4.138 9.153 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -17.586 1.976 10.871 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -18.999 1.732 9.816 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -17.556 0.708 9.624 1.00 0.99 H new ATOM 2700 N LYS B 464 -18.183 -0.706 6.970 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.527 -2.067 7.472 1.00 0.77 C ATOM 2702 C LYS B 464 -17.865 -3.135 6.598 1.00 0.76 C ATOM 2703 O LYS B 464 -17.509 -4.200 7.064 1.00 0.82 O ATOM 2704 CB LYS B 464 -20.050 -2.153 7.363 1.00 0.85 C ATOM 2705 CG LYS B 464 -20.668 -2.034 8.757 1.00 1.20 C ATOM 2706 CD LYS B 464 -22.163 -1.734 8.629 1.00 1.62 C ATOM 2707 CE LYS B 464 -22.359 -0.260 8.265 1.00 2.25 C ATOM 2708 NZ LYS B 464 -23.829 -0.099 8.090 1.00 2.66 N ATOM 0 H LYS B 464 -18.825 -0.324 6.275 1.00 0.72 H new ATOM 0 HA LYS B 464 -18.180 -2.233 8.492 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.425 -1.358 6.718 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.340 -3.098 6.904 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -20.518 -2.960 9.313 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -20.174 -1.241 9.319 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -22.608 -2.371 7.864 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -22.671 -1.959 9.567 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -21.981 0.394 9.051 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -21.822 -0.004 7.351 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -24.043 0.887 7.839 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -24.159 -0.729 7.331 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -24.313 -0.343 8.978 1.00 2.66 H new ATOM 2722 N GLU B 465 -17.699 -2.861 5.333 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.060 -3.862 4.430 1.00 0.76 C ATOM 2724 C GLU B 465 -15.650 -4.194 4.923 1.00 0.69 C ATOM 2725 O GLU B 465 -15.339 -5.329 5.226 1.00 0.85 O ATOM 2726 CB GLU B 465 -17.004 -3.184 3.061 1.00 0.79 C ATOM 2727 CG GLU B 465 -18.165 -3.679 2.196 1.00 1.12 C ATOM 2728 CD GLU B 465 -18.172 -2.918 0.868 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -17.669 -1.807 0.843 1.00 2.03 O ATOM 2730 OE2 GLU B 465 -18.682 -3.459 -0.098 1.00 1.94 O ATOM 0 H GLU B 465 -17.978 -1.988 4.885 1.00 0.73 H new ATOM 0 HA GLU B 465 -17.614 -4.800 4.397 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -17.059 -2.102 3.177 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -16.054 -3.404 2.573 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -18.066 -4.749 2.014 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -19.110 -3.530 2.718 1.00 1.12 H new ATOM 2737 N LEU B 466 -14.795 -3.213 5.005 1.00 0.56 N ATOM 2738 CA LEU B 466 -13.406 -3.474 5.478 1.00 0.59 C ATOM 2739 C LEU B 466 -13.435 -4.183 6.835 1.00 0.70 C ATOM 2740 O LEU B 466 -12.501 -4.864 7.210 1.00 0.81 O ATOM 2741 CB LEU B 466 -12.767 -2.091 5.609 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.365 -1.579 4.226 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -11.859 -0.141 4.342 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.254 -2.465 3.659 1.00 0.52 C ATOM 0 H LEU B 466 -14.997 -2.242 4.765 1.00 0.56 H new ATOM 0 HA LEU B 466 -12.850 -4.117 4.796 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -13.468 -1.398 6.075 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -11.892 -2.143 6.257 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.229 -1.608 3.562 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -11.572 0.224 3.356 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -12.649 0.491 4.748 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -10.995 -0.112 5.005 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -10.966 -2.101 2.673 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.390 -2.435 4.323 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -11.613 -3.491 3.577 1.00 0.52 H new ATOM 2756 N GLY B 467 -14.501 -4.030 7.572 1.00 0.77 N ATOM 2757 CA GLY B 467 -14.589 -4.696 8.902 1.00 0.97 C ATOM 2758 C GLY B 467 -14.744 -6.205 8.708 1.00 1.08 C ATOM 2759 O GLY B 467 -14.301 -6.994 9.519 1.00 1.38 O ATOM 0 H GLY B 467 -15.314 -3.473 7.311 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -13.694 -4.484 9.487 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -15.437 -4.302 9.463 1.00 0.97 H new