USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=18 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 USER MOD Single : A 408 GLN : amide:sc=-0.00128 X(o=-0.0013,f=-0.13) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 418 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-3.7!) USER MOD Single : A 419 GLN : amide:sc= -0.135 K(o=-0.14,f=-0.84) USER MOD Single : A 420 ASN : amide:sc= -0.044 K(o=-0.044,f=-2.3!) USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 426 GLN : amide:sc= -0.327 K(o=-0.33,f=-1.6!) USER MOD Single : A 432 THR OG1 : rot 90:sc= 1.2 USER MOD Single : A 435 THR OG1 : rot 86:sc= 0.874 USER MOD Single : A 436 THR OG1 : rot 81:sc= 1.23 USER MOD Single : A 440 HIS : no HD1:sc= -0.421 X(o=-0.42,f=0) USER MOD Single : A 441 THR OG1 : rot 71:sc= 0.432 USER MOD Single : A 442 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 444 HIS : no HD1:sc= -0.191 X(o=-0.19,f=-0.034) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 460 THR OG1 : rot 101:sc= 0.575 USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 404 THR OG1 : rot 180:sc= 0 USER MOD Single : B 408 GLN : amide:sc=-0.00679 X(o=-0.0068,f=-0.09) USER MOD Single : B 416 SER OG : rot 180:sc= 0 USER MOD Single : B 418 HIS : no HD1:sc= -1.51 K(o=-1.5,f=-4.2!) USER MOD Single : B 419 GLN : amide:sc= -0.115 K(o=-0.11,f=-0.87) USER MOD Single : B 420 ASN : amide:sc= -0.0487 K(o=-0.049,f=-2.2!) USER MOD Single : B 423 SER OG : rot 180:sc= 0 USER MOD Single : B 426 GLN : amide:sc= -0.347 K(o=-0.35,f=-1.8!) USER MOD Single : B 432 THR OG1 : rot 96:sc= 1.25 USER MOD Single : B 435 THR OG1 : rot 85:sc= 0.919 USER MOD Single : B 436 THR OG1 : rot 74:sc= 1.26 USER MOD Single : B 440 HIS : no HD1:sc= -0.403 X(o=-0.4,f=0) USER MOD Single : B 441 THR OG1 : rot 119:sc= 0.0986 USER MOD Single : B 442 GLN : amide:sc=-0.00579 K(o=-0.0058,f=-1) USER MOD Single : B 444 HIS : no HD1:sc= -0.155 X(o=-0.16,f=-0.043) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0 USER MOD Single : B 460 THR OG1 : rot 101:sc= 0.591 USER MOD Single : B 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 325 N TRP A 402 6.356 2.746 1.496 1.00 0.95 N ATOM 326 CA TRP A 402 5.058 2.986 0.798 1.00 0.86 C ATOM 327 C TRP A 402 4.137 3.900 1.611 1.00 0.79 C ATOM 328 O TRP A 402 3.856 5.010 1.216 1.00 0.71 O ATOM 329 CB TRP A 402 4.429 1.603 0.658 1.00 0.96 C ATOM 330 CG TRP A 402 3.874 1.464 -0.716 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.613 1.244 -1.824 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.488 1.541 -1.149 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.770 1.177 -2.921 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.449 1.352 -2.561 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.263 1.752 -0.463 1.00 0.78 C ATOM 336 CZ2 TRP A 402 1.235 1.374 -3.271 1.00 0.83 C ATOM 337 CZ3 TRP A 402 0.038 1.773 -1.175 1.00 0.72 C ATOM 338 CH2 TRP A 402 0.025 1.585 -2.576 1.00 0.69 C ATOM 0 HA TRP A 402 5.211 3.483 -0.160 1.00 0.86 H new ATOM 0 HB2 TRP A 402 5.174 0.829 0.844 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.640 1.471 1.399 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.687 1.137 -1.851 1.00 0.94 H new ATOM 0 HE1 TRP A 402 4.087 1.018 -3.877 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.265 1.897 0.607 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 1.229 1.230 -4.341 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -0.889 1.933 -0.645 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -0.911 1.603 -3.115 1.00 0.69 H new ATOM 349 N ALA A 403 3.656 3.438 2.736 1.00 0.85 N ATOM 350 CA ALA A 403 2.740 4.283 3.564 1.00 0.85 C ATOM 351 C ALA A 403 3.308 5.696 3.727 1.00 0.80 C ATOM 352 O ALA A 403 2.601 6.674 3.602 1.00 0.76 O ATOM 353 CB ALA A 403 2.658 3.576 4.916 1.00 0.99 C ATOM 0 H ALA A 403 3.857 2.514 3.118 1.00 0.85 H new ATOM 0 HA ALA A 403 1.759 4.394 3.102 1.00 0.85 H new ATOM 0 HB1 ALA A 403 2.002 4.137 5.581 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.260 2.571 4.777 1.00 0.99 H new ATOM 0 HB3 ALA A 403 3.654 3.515 5.356 1.00 0.99 H new ATOM 359 N THR A 404 4.580 5.813 3.990 1.00 0.82 N ATOM 360 CA THR A 404 5.178 7.170 4.139 1.00 0.81 C ATOM 361 C THR A 404 5.015 7.937 2.828 1.00 0.70 C ATOM 362 O THR A 404 4.786 9.131 2.814 1.00 0.68 O ATOM 363 CB THR A 404 6.656 6.926 4.446 1.00 0.89 C ATOM 364 OG1 THR A 404 6.769 6.102 5.598 1.00 1.07 O ATOM 365 CG2 THR A 404 7.354 8.262 4.702 1.00 0.89 C ATOM 0 H THR A 404 5.228 5.034 4.108 1.00 0.82 H new ATOM 0 HA THR A 404 4.703 7.759 4.924 1.00 0.81 H new ATOM 0 HB THR A 404 7.126 6.431 3.597 1.00 0.89 H new ATOM 0 HG1 THR A 404 7.716 5.943 5.795 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.407 8.086 4.921 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.267 8.893 3.818 1.00 0.89 H new ATOM 0 HG23 THR A 404 6.886 8.761 5.551 1.00 0.89 H new ATOM 373 N LEU A 405 5.117 7.251 1.723 1.00 0.67 N ATOM 374 CA LEU A 405 4.954 7.925 0.406 1.00 0.61 C ATOM 375 C LEU A 405 3.472 8.215 0.162 1.00 0.53 C ATOM 376 O LEU A 405 3.115 9.172 -0.493 1.00 0.52 O ATOM 377 CB LEU A 405 5.495 6.915 -0.619 1.00 0.67 C ATOM 378 CG LEU A 405 5.452 7.493 -2.047 1.00 0.65 C ATOM 379 CD1 LEU A 405 4.017 7.458 -2.578 1.00 0.57 C ATOM 380 CD2 LEU A 405 5.964 8.941 -2.056 1.00 0.64 C ATOM 0 H LEU A 405 5.307 6.250 1.676 1.00 0.67 H new ATOM 0 HA LEU A 405 5.479 8.878 0.345 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.520 6.647 -0.363 1.00 0.67 H new ATOM 0 HB3 LEU A 405 4.906 5.999 -0.577 1.00 0.67 H new ATOM 0 HG LEU A 405 6.094 6.886 -2.686 1.00 0.65 H new ATOM 0 HD11 LEU A 405 3.993 7.868 -3.588 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.661 6.428 -2.596 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.374 8.053 -1.929 1.00 0.57 H new ATOM 0 HD21 LEU A 405 5.927 9.334 -3.072 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.337 9.553 -1.407 1.00 0.64 H new ATOM 0 HD23 LEU A 405 6.992 8.966 -1.695 1.00 0.64 H new ATOM 392 N LEU A 406 2.609 7.392 0.691 1.00 0.53 N ATOM 393 CA LEU A 406 1.149 7.610 0.498 1.00 0.50 C ATOM 394 C LEU A 406 0.661 8.741 1.407 1.00 0.49 C ATOM 395 O LEU A 406 -0.200 9.515 1.041 1.00 0.45 O ATOM 396 CB LEU A 406 0.499 6.280 0.888 1.00 0.58 C ATOM 397 CG LEU A 406 -0.772 6.075 0.060 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.412 6.016 -1.426 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.444 4.763 0.469 1.00 1.02 C ATOM 0 H LEU A 406 2.854 6.575 1.251 1.00 0.53 H new ATOM 0 HA LEU A 406 0.901 7.899 -0.523 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.195 5.458 0.717 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.258 6.278 1.951 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.455 6.906 0.238 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.318 5.870 -2.014 1.00 0.94 H new ATOM 0 HD12 LEU A 406 0.066 6.950 -1.722 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.272 5.186 -1.602 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.349 4.618 -0.121 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.759 3.933 0.293 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.703 4.801 1.527 1.00 1.02 H new ATOM 411 N ALA A 407 1.210 8.847 2.587 1.00 0.56 N ATOM 412 CA ALA A 407 0.779 9.934 3.510 1.00 0.59 C ATOM 413 C ALA A 407 1.262 11.286 2.980 1.00 0.57 C ATOM 414 O ALA A 407 0.567 12.279 3.057 1.00 0.61 O ATOM 415 CB ALA A 407 1.444 9.608 4.848 1.00 0.70 C ATOM 0 H ALA A 407 1.936 8.230 2.950 1.00 0.56 H new ATOM 0 HA ALA A 407 -0.305 9.996 3.605 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.174 10.366 5.583 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.106 8.631 5.194 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.527 9.594 4.722 1.00 0.70 H new ATOM 421 N GLN A 408 2.448 11.328 2.436 1.00 0.57 N ATOM 422 CA GLN A 408 2.974 12.611 1.894 1.00 0.57 C ATOM 423 C GLN A 408 2.401 12.860 0.497 1.00 0.50 C ATOM 424 O GLN A 408 2.129 13.982 0.118 1.00 0.50 O ATOM 425 CB GLN A 408 4.490 12.426 1.832 1.00 0.62 C ATOM 426 CG GLN A 408 5.088 12.631 3.226 1.00 0.75 C ATOM 427 CD GLN A 408 6.518 13.159 3.096 1.00 0.78 C ATOM 428 OE1 GLN A 408 6.743 14.197 2.505 1.00 1.29 O ATOM 429 NE2 GLN A 408 7.500 12.484 3.627 1.00 1.46 N ATOM 0 H GLN A 408 3.075 10.529 2.344 1.00 0.57 H new ATOM 0 HA GLN A 408 2.698 13.467 2.509 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.730 11.428 1.465 1.00 0.62 H new ATOM 0 HB3 GLN A 408 4.925 13.137 1.130 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.480 13.335 3.794 1.00 0.75 H new ATOM 0 HG3 GLN A 408 5.085 11.690 3.776 1.00 0.75 H new ATOM 0 HE21 GLN A 408 7.311 11.613 4.123 1.00 1.46 H new ATOM 0 HE22 GLN A 408 8.457 12.827 3.546 1.00 1.46 H new ATOM 438 N TRP A 409 2.209 11.821 -0.267 1.00 0.46 N ATOM 439 CA TRP A 409 1.644 11.994 -1.637 1.00 0.43 C ATOM 440 C TRP A 409 0.191 12.474 -1.535 1.00 0.40 C ATOM 441 O TRP A 409 -0.173 13.499 -2.076 1.00 0.41 O ATOM 442 CB TRP A 409 1.727 10.598 -2.270 1.00 0.43 C ATOM 443 CG TRP A 409 0.921 10.547 -3.532 1.00 0.42 C ATOM 444 CD1 TRP A 409 1.244 11.171 -4.690 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.331 9.847 -3.776 1.00 0.40 C ATOM 446 NE1 TRP A 409 0.267 10.899 -5.634 1.00 0.53 N ATOM 447 CE2 TRP A 409 -0.727 10.087 -5.124 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.162 9.029 -2.967 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -1.908 9.535 -5.653 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.351 8.471 -3.494 1.00 0.43 C ATOM 451 CH2 TRP A 409 -2.723 8.724 -4.835 1.00 0.48 C ATOM 0 H TRP A 409 2.419 10.858 -0.003 1.00 0.46 H new ATOM 0 HA TRP A 409 2.179 12.734 -2.232 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.767 10.351 -2.485 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.360 9.851 -1.567 1.00 0.43 H new ATOM 0 HD1 TRP A 409 2.120 11.781 -4.851 1.00 0.50 H new ATOM 0 HE1 TRP A 409 0.280 11.255 -6.590 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -0.885 8.831 -1.942 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -2.189 9.730 -6.677 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -2.977 7.850 -2.870 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -3.631 8.296 -5.233 1.00 0.48 H new ATOM 462 N ALA A 410 -0.638 11.741 -0.844 1.00 0.42 N ATOM 463 CA ALA A 410 -2.063 12.156 -0.706 1.00 0.44 C ATOM 464 C ALA A 410 -2.142 13.597 -0.194 1.00 0.45 C ATOM 465 O ALA A 410 -3.043 14.338 -0.531 1.00 0.47 O ATOM 466 CB ALA A 410 -2.661 11.187 0.312 1.00 0.51 C ATOM 0 H ALA A 410 -0.391 10.873 -0.369 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.599 12.127 -1.655 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.712 11.427 0.469 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.574 10.167 -0.062 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -2.124 11.274 1.256 1.00 0.51 H new ATOM 472 N ASP A 411 -1.201 13.999 0.613 1.00 0.48 N ATOM 473 CA ASP A 411 -1.217 15.392 1.143 1.00 0.53 C ATOM 474 C ASP A 411 -0.706 16.360 0.073 1.00 0.53 C ATOM 475 O ASP A 411 -1.291 17.398 -0.170 1.00 0.58 O ATOM 476 CB ASP A 411 -0.272 15.371 2.344 1.00 0.60 C ATOM 477 CG ASP A 411 -0.936 16.080 3.527 1.00 1.03 C ATOM 478 OD1 ASP A 411 -1.902 15.545 4.047 1.00 1.78 O ATOM 479 OD2 ASP A 411 -0.467 17.145 3.891 1.00 1.51 O ATOM 0 H ASP A 411 -0.421 13.423 0.929 1.00 0.48 H new ATOM 0 HA ASP A 411 -2.218 15.720 1.422 1.00 0.53 H new ATOM 0 HB2 ASP A 411 -0.030 14.343 2.612 1.00 0.60 H new ATOM 0 HB3 ASP A 411 0.667 15.864 2.091 1.00 0.60 H new ATOM 484 N ARG A 412 0.379 16.026 -0.572 1.00 0.51 N ATOM 485 CA ARG A 412 0.925 16.926 -1.628 1.00 0.56 C ATOM 486 C ARG A 412 -0.103 17.098 -2.748 1.00 0.55 C ATOM 487 O ARG A 412 -0.269 18.170 -3.294 1.00 0.63 O ATOM 488 CB ARG A 412 2.174 16.214 -2.150 1.00 0.58 C ATOM 489 CG ARG A 412 3.007 17.191 -2.984 1.00 0.96 C ATOM 490 CD ARG A 412 3.951 17.970 -2.065 1.00 1.50 C ATOM 491 NE ARG A 412 5.141 18.276 -2.907 1.00 1.90 N ATOM 492 CZ ARG A 412 6.078 19.063 -2.451 1.00 2.41 C ATOM 493 NH1 ARG A 412 5.759 20.177 -1.852 1.00 2.89 N ATOM 494 NH2 ARG A 412 7.332 18.735 -2.595 1.00 3.02 N ATOM 0 H ARG A 412 0.910 15.170 -0.414 1.00 0.51 H new ATOM 0 HA ARG A 412 1.155 17.921 -1.248 1.00 0.56 H new ATOM 0 HB2 ARG A 412 2.765 15.835 -1.316 1.00 0.58 H new ATOM 0 HB3 ARG A 412 1.889 15.354 -2.755 1.00 0.58 H new ATOM 0 HG2 ARG A 412 3.580 16.648 -3.735 1.00 0.96 H new ATOM 0 HG3 ARG A 412 2.352 17.879 -3.519 1.00 0.96 H new ATOM 0 HD2 ARG A 412 3.481 18.883 -1.699 1.00 1.50 H new ATOM 0 HD3 ARG A 412 4.227 17.380 -1.191 1.00 1.50 H new ATOM 0 HE ARG A 412 5.224 17.871 -3.839 1.00 1.90 H new ATOM 0 HH11 ARG A 412 4.778 20.433 -1.740 1.00 2.89 H new ATOM 0 HH12 ARG A 412 6.491 20.792 -1.496 1.00 2.89 H new ATOM 0 HH21 ARG A 412 7.581 17.864 -3.064 1.00 3.02 H new ATOM 0 HH22 ARG A 412 8.064 19.350 -2.239 1.00 3.02 H new ATOM 508 N ALA A 413 -0.796 16.048 -3.088 1.00 0.50 N ATOM 509 CA ALA A 413 -1.819 16.147 -4.167 1.00 0.53 C ATOM 510 C ALA A 413 -3.034 16.928 -3.663 1.00 0.57 C ATOM 511 O ALA A 413 -3.683 17.637 -4.407 1.00 0.66 O ATOM 512 CB ALA A 413 -2.200 14.701 -4.484 1.00 0.53 C ATOM 0 H ALA A 413 -0.699 15.125 -2.666 1.00 0.50 H new ATOM 0 HA ALA A 413 -1.447 16.670 -5.048 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -2.952 14.687 -5.273 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -1.316 14.156 -4.816 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -2.603 14.227 -3.589 1.00 0.53 H new ATOM 518 N LEU A 414 -3.344 16.807 -2.401 1.00 0.54 N ATOM 519 CA LEU A 414 -4.513 17.547 -1.844 1.00 0.61 C ATOM 520 C LEU A 414 -4.261 19.056 -1.916 1.00 0.71 C ATOM 521 O LEU A 414 -5.163 19.837 -2.139 1.00 0.82 O ATOM 522 CB LEU A 414 -4.615 17.090 -0.388 1.00 0.63 C ATOM 523 CG LEU A 414 -6.003 16.504 -0.132 1.00 0.71 C ATOM 524 CD1 LEU A 414 -6.193 15.248 -0.984 1.00 1.11 C ATOM 525 CD2 LEU A 414 -6.134 16.139 1.349 1.00 1.04 C ATOM 0 H LEU A 414 -2.838 16.228 -1.731 1.00 0.54 H new ATOM 0 HA LEU A 414 -5.431 17.349 -2.397 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -3.849 16.344 -0.176 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -4.435 17.931 0.281 1.00 0.63 H new ATOM 0 HG LEU A 414 -6.763 17.240 -0.396 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -7.183 14.831 -0.801 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -6.097 15.506 -2.039 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -5.434 14.511 -0.720 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -7.123 15.721 1.535 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -5.374 15.403 1.611 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -5.998 17.033 1.957 1.00 1.04 H new ATOM 537 N ARG A 415 -3.036 19.468 -1.729 1.00 0.73 N ATOM 538 CA ARG A 415 -2.721 20.925 -1.785 1.00 0.86 C ATOM 539 C ARG A 415 -2.537 21.385 -3.238 1.00 0.92 C ATOM 540 O ARG A 415 -2.200 22.523 -3.495 1.00 1.26 O ATOM 541 CB ARG A 415 -1.414 21.073 -1.007 1.00 1.01 C ATOM 542 CG ARG A 415 -1.118 22.556 -0.778 1.00 1.40 C ATOM 543 CD ARG A 415 0.064 22.983 -1.651 1.00 1.61 C ATOM 544 NE ARG A 415 1.177 23.235 -0.694 1.00 2.27 N ATOM 545 CZ ARG A 415 1.228 24.360 -0.034 1.00 2.92 C ATOM 546 NH1 ARG A 415 1.452 25.479 -0.668 1.00 3.70 N ATOM 547 NH2 ARG A 415 1.056 24.367 1.260 1.00 3.32 N ATOM 0 H ARG A 415 -2.240 18.859 -1.540 1.00 0.73 H new ATOM 0 HA ARG A 415 -3.522 21.534 -1.366 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -1.488 20.555 -0.051 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -0.596 20.610 -1.559 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -1.997 23.154 -1.019 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -0.890 22.734 0.273 1.00 1.40 H new ATOM 0 HD2 ARG A 415 0.328 22.205 -2.367 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -0.173 23.878 -2.226 1.00 1.61 H new ATOM 0 HE ARG A 415 1.899 22.529 -0.554 1.00 2.27 H new ATOM 0 HH11 ARG A 415 1.587 25.474 -1.679 1.00 3.70 H new ATOM 0 HH12 ARG A 415 1.492 26.358 -0.152 1.00 3.70 H new ATOM 0 HH21 ARG A 415 0.882 23.493 1.756 1.00 3.32 H new ATOM 0 HH22 ARG A 415 1.096 25.247 1.775 1.00 3.32 H new ATOM 561 N SER A 416 -2.755 20.516 -4.190 1.00 0.90 N ATOM 562 CA SER A 416 -2.589 20.918 -5.616 1.00 0.99 C ATOM 563 C SER A 416 -3.835 20.536 -6.421 1.00 0.99 C ATOM 564 O SER A 416 -4.695 21.354 -6.677 1.00 1.63 O ATOM 565 CB SER A 416 -1.372 20.137 -6.109 1.00 1.20 C ATOM 566 OG SER A 416 -0.202 20.645 -5.480 1.00 1.69 O ATOM 0 H SER A 416 -3.040 19.548 -4.041 1.00 0.90 H new ATOM 0 HA SER A 416 -2.455 21.994 -5.729 1.00 0.99 H new ATOM 0 HB2 SER A 416 -1.489 19.077 -5.883 1.00 1.20 H new ATOM 0 HB3 SER A 416 -1.284 20.224 -7.192 1.00 1.20 H new ATOM 0 HG SER A 416 0.581 20.145 -5.793 1.00 1.69 H new ATOM 572 N GLY A 417 -3.939 19.297 -6.818 1.00 1.06 N ATOM 573 CA GLY A 417 -5.126 18.861 -7.602 1.00 1.06 C ATOM 574 C GLY A 417 -5.341 17.360 -7.403 1.00 0.99 C ATOM 575 O GLY A 417 -5.086 16.564 -8.285 1.00 1.31 O ATOM 0 H GLY A 417 -3.251 18.567 -6.632 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -6.010 19.412 -7.281 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -4.979 19.082 -8.659 1.00 1.06 H new ATOM 579 N HIS A 418 -5.804 16.968 -6.248 1.00 0.78 N ATOM 580 CA HIS A 418 -6.032 15.520 -5.987 1.00 0.87 C ATOM 581 C HIS A 418 -7.167 14.990 -6.869 1.00 0.89 C ATOM 582 O HIS A 418 -8.029 15.730 -7.300 1.00 1.17 O ATOM 583 CB HIS A 418 -6.416 15.445 -4.510 1.00 1.01 C ATOM 584 CG HIS A 418 -7.663 16.252 -4.272 1.00 1.68 C ATOM 585 ND1 HIS A 418 -7.624 17.541 -3.765 1.00 2.18 N ATOM 586 CD2 HIS A 418 -8.991 15.965 -4.465 1.00 2.31 C ATOM 587 CE1 HIS A 418 -8.893 17.978 -3.669 1.00 2.86 C ATOM 588 NE2 HIS A 418 -9.767 17.056 -4.084 1.00 2.97 N ATOM 0 H HIS A 418 -6.034 17.590 -5.473 1.00 0.78 H new ATOM 0 HA HIS A 418 -5.154 14.915 -6.213 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -6.581 14.408 -4.219 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -5.602 15.824 -3.892 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -9.376 15.034 -4.854 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -9.171 18.955 -3.301 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -10.783 17.135 -4.115 1.00 2.97 H new ATOM 596 N GLN A 419 -7.172 13.713 -7.137 1.00 1.08 N ATOM 597 CA GLN A 419 -8.247 13.131 -7.988 1.00 1.25 C ATOM 598 C GLN A 419 -8.334 11.617 -7.766 1.00 1.03 C ATOM 599 O GLN A 419 -9.205 11.134 -7.070 1.00 1.28 O ATOM 600 CB GLN A 419 -7.829 13.449 -9.425 1.00 1.71 C ATOM 601 CG GLN A 419 -8.818 12.809 -10.401 1.00 2.33 C ATOM 602 CD GLN A 419 -9.153 13.807 -11.511 1.00 2.91 C ATOM 603 OE1 GLN A 419 -8.341 14.641 -11.858 1.00 3.29 O ATOM 604 NE2 GLN A 419 -10.324 13.758 -12.085 1.00 3.52 N ATOM 0 H GLN A 419 -6.476 13.046 -6.802 1.00 1.08 H new ATOM 0 HA GLN A 419 -9.230 13.539 -7.754 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -7.801 14.528 -9.576 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -6.823 13.074 -9.613 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -8.389 11.903 -10.829 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -9.726 12.515 -9.875 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -11.006 13.058 -11.794 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -10.557 14.420 -12.825 1.00 3.52 H new ATOM 613 N ASN A 420 -7.437 10.866 -8.346 1.00 0.78 N ATOM 614 CA ASN A 420 -7.469 9.388 -8.159 1.00 0.70 C ATOM 615 C ASN A 420 -6.628 8.997 -6.941 1.00 0.58 C ATOM 616 O ASN A 420 -5.716 8.200 -7.033 1.00 0.71 O ATOM 617 CB ASN A 420 -6.862 8.814 -9.440 1.00 0.86 C ATOM 618 CG ASN A 420 -7.917 8.803 -10.548 1.00 1.35 C ATOM 619 OD1 ASN A 420 -9.091 8.968 -10.285 1.00 1.96 O ATOM 620 ND2 ASN A 420 -7.545 8.614 -11.784 1.00 1.88 N ATOM 0 H ASN A 420 -6.684 11.212 -8.941 1.00 0.78 H new ATOM 0 HA ASN A 420 -8.477 9.012 -7.985 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -6.004 9.412 -9.747 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -6.498 7.802 -9.260 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -8.240 8.605 -12.530 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -6.559 8.475 -12.004 1.00 1.88 H new ATOM 627 N LEU A 421 -6.924 9.560 -5.801 1.00 0.45 N ATOM 628 CA LEU A 421 -6.138 9.231 -4.576 1.00 0.40 C ATOM 629 C LEU A 421 -6.208 7.730 -4.274 1.00 0.39 C ATOM 630 O LEU A 421 -5.301 6.982 -4.580 1.00 0.53 O ATOM 631 CB LEU A 421 -6.802 10.032 -3.456 1.00 0.42 C ATOM 632 CG LEU A 421 -6.151 11.413 -3.355 1.00 0.39 C ATOM 633 CD1 LEU A 421 -7.151 12.406 -2.762 1.00 0.50 C ATOM 634 CD2 LEU A 421 -4.920 11.330 -2.449 1.00 0.41 C ATOM 0 H LEU A 421 -7.677 10.234 -5.664 1.00 0.45 H new ATOM 0 HA LEU A 421 -5.082 9.477 -4.690 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -7.869 10.136 -3.653 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -6.703 9.502 -2.509 1.00 0.42 H new ATOM 0 HG LEU A 421 -5.852 11.747 -4.348 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.688 13.390 -2.690 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -8.030 12.465 -3.404 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.450 12.072 -1.768 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.455 12.313 -2.376 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.221 10.996 -1.456 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.206 10.621 -2.869 1.00 0.41 H new ATOM 646 N LEU A 422 -7.273 7.288 -3.663 1.00 0.33 N ATOM 647 CA LEU A 422 -7.398 5.840 -3.325 1.00 0.34 C ATOM 648 C LEU A 422 -7.415 4.982 -4.593 1.00 0.35 C ATOM 649 O LEU A 422 -7.007 3.838 -4.584 1.00 0.37 O ATOM 650 CB LEU A 422 -8.731 5.724 -2.587 1.00 0.37 C ATOM 651 CG LEU A 422 -8.509 5.953 -1.091 1.00 0.38 C ATOM 652 CD1 LEU A 422 -9.861 6.054 -0.382 1.00 0.58 C ATOM 653 CD2 LEU A 422 -7.716 4.779 -0.512 1.00 0.63 C ATOM 0 H LEU A 422 -8.064 7.868 -3.382 1.00 0.33 H new ATOM 0 HA LEU A 422 -6.558 5.489 -2.725 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.439 6.456 -2.976 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.166 4.739 -2.754 1.00 0.37 H new ATOM 0 HG LEU A 422 -7.953 6.879 -0.943 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -9.702 6.217 0.684 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.428 6.888 -0.796 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -10.418 5.129 -0.528 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -7.556 4.939 0.554 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -8.274 3.855 -0.661 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -6.753 4.706 -1.017 1.00 0.63 H new ATOM 665 N SER A 423 -7.891 5.520 -5.680 1.00 0.35 N ATOM 666 CA SER A 423 -7.943 4.727 -6.943 1.00 0.38 C ATOM 667 C SER A 423 -6.532 4.374 -7.426 1.00 0.36 C ATOM 668 O SER A 423 -6.354 3.514 -8.264 1.00 0.40 O ATOM 669 CB SER A 423 -8.641 5.640 -7.952 1.00 0.44 C ATOM 670 OG SER A 423 -10.027 5.707 -7.644 1.00 1.23 O ATOM 0 H SER A 423 -8.246 6.473 -5.751 1.00 0.35 H new ATOM 0 HA SER A 423 -8.468 3.782 -6.808 1.00 0.38 H new ATOM 0 HB2 SER A 423 -8.201 6.637 -7.923 1.00 0.44 H new ATOM 0 HB3 SER A 423 -8.499 5.259 -8.963 1.00 0.44 H new ATOM 0 HG SER A 423 -10.477 6.293 -8.288 1.00 1.23 H new ATOM 676 N GLU A 424 -5.526 5.030 -6.912 1.00 0.34 N ATOM 677 CA GLU A 424 -4.135 4.723 -7.357 1.00 0.36 C ATOM 678 C GLU A 424 -3.511 3.633 -6.478 1.00 0.32 C ATOM 679 O GLU A 424 -2.947 2.676 -6.969 1.00 0.33 O ATOM 680 CB GLU A 424 -3.369 6.036 -7.202 1.00 0.38 C ATOM 681 CG GLU A 424 -2.776 6.442 -8.554 1.00 0.58 C ATOM 682 CD GLU A 424 -1.598 7.392 -8.331 1.00 0.81 C ATOM 683 OE1 GLU A 424 -0.607 6.954 -7.768 1.00 1.54 O ATOM 684 OE2 GLU A 424 -1.705 8.540 -8.727 1.00 1.22 O ATOM 0 H GLU A 424 -5.606 5.762 -6.206 1.00 0.34 H new ATOM 0 HA GLU A 424 -4.110 4.350 -8.381 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.035 6.817 -6.835 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -2.575 5.922 -6.464 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -2.445 5.557 -9.098 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -3.537 6.927 -9.166 1.00 0.58 H new ATOM 691 N ALA A 425 -3.599 3.775 -5.184 1.00 0.31 N ATOM 692 CA ALA A 425 -3.001 2.751 -4.280 1.00 0.29 C ATOM 693 C ALA A 425 -3.928 1.536 -4.152 1.00 0.28 C ATOM 694 O ALA A 425 -3.509 0.463 -3.768 1.00 0.28 O ATOM 695 CB ALA A 425 -2.848 3.458 -2.932 1.00 0.29 C ATOM 0 H ALA A 425 -4.058 4.555 -4.714 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.049 2.376 -4.657 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.413 2.770 -2.208 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.196 4.324 -3.047 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -3.826 3.785 -2.579 1.00 0.29 H new ATOM 701 N GLN A 426 -5.184 1.696 -4.469 1.00 0.30 N ATOM 702 CA GLN A 426 -6.133 0.549 -4.364 1.00 0.31 C ATOM 703 C GLN A 426 -5.626 -0.655 -5.173 1.00 0.30 C ATOM 704 O GLN A 426 -5.460 -1.731 -4.633 1.00 0.30 O ATOM 705 CB GLN A 426 -7.450 1.066 -4.944 1.00 0.36 C ATOM 706 CG GLN A 426 -8.382 1.481 -3.803 1.00 0.45 C ATOM 707 CD GLN A 426 -9.762 1.821 -4.369 1.00 0.54 C ATOM 708 OE1 GLN A 426 -10.023 1.607 -5.536 1.00 1.23 O ATOM 709 NE2 GLN A 426 -10.664 2.344 -3.584 1.00 1.09 N ATOM 0 H GLN A 426 -5.595 2.570 -4.796 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.243 0.208 -3.335 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.262 1.915 -5.601 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.922 0.292 -5.550 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -8.465 0.674 -3.075 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -7.970 2.343 -3.278 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -10.445 2.524 -2.604 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.588 2.573 -3.950 1.00 1.09 H new ATOM 718 N PRO A 427 -5.401 -0.442 -6.450 1.00 0.32 N ATOM 719 CA PRO A 427 -4.918 -1.543 -7.322 1.00 0.34 C ATOM 720 C PRO A 427 -3.480 -1.921 -6.959 1.00 0.31 C ATOM 721 O PRO A 427 -3.035 -3.022 -7.216 1.00 0.35 O ATOM 722 CB PRO A 427 -5.000 -0.956 -8.728 1.00 0.39 C ATOM 723 CG PRO A 427 -4.929 0.523 -8.531 1.00 0.38 C ATOM 724 CD PRO A 427 -5.565 0.815 -7.196 1.00 0.35 C ATOM 0 HA PRO A 427 -5.502 -2.458 -7.221 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -4.181 -1.311 -9.353 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.927 -1.245 -9.223 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.895 0.866 -8.550 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -5.453 1.045 -9.331 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -5.074 1.647 -6.692 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.616 1.083 -7.303 1.00 0.35 H new ATOM 732 N GLU A 428 -2.754 -1.022 -6.354 1.00 0.29 N ATOM 733 CA GLU A 428 -1.352 -1.345 -5.969 1.00 0.29 C ATOM 734 C GLU A 428 -1.355 -2.436 -4.897 1.00 0.27 C ATOM 735 O GLU A 428 -0.592 -3.381 -4.952 1.00 0.32 O ATOM 736 CB GLU A 428 -0.780 -0.046 -5.406 1.00 0.29 C ATOM 737 CG GLU A 428 -0.611 0.973 -6.534 1.00 0.71 C ATOM 738 CD GLU A 428 0.859 1.031 -6.954 1.00 1.37 C ATOM 739 OE1 GLU A 428 1.262 0.195 -7.746 1.00 2.07 O ATOM 740 OE2 GLU A 428 1.556 1.911 -6.477 1.00 2.12 O ATOM 0 H GLU A 428 -3.069 -0.083 -6.111 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.763 -1.712 -6.809 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.444 0.353 -4.639 1.00 0.29 H new ATOM 0 HB3 GLU A 428 0.181 -0.237 -4.928 1.00 0.29 H new ATOM 0 HG2 GLU A 428 -1.233 0.695 -7.385 1.00 0.71 H new ATOM 0 HG3 GLU A 428 -0.945 1.956 -6.203 1.00 0.71 H new ATOM 747 N LEU A 429 -2.217 -2.315 -3.924 1.00 0.26 N ATOM 748 CA LEU A 429 -2.284 -3.345 -2.850 1.00 0.26 C ATOM 749 C LEU A 429 -2.857 -4.645 -3.418 1.00 0.25 C ATOM 750 O LEU A 429 -2.430 -5.729 -3.070 1.00 0.28 O ATOM 751 CB LEU A 429 -3.224 -2.752 -1.795 1.00 0.26 C ATOM 752 CG LEU A 429 -3.487 -3.781 -0.690 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.328 -3.771 0.307 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.784 -3.419 0.039 1.00 0.56 C ATOM 0 H LEU A 429 -2.879 -1.545 -3.827 1.00 0.26 H new ATOM 0 HA LEU A 429 -1.306 -3.582 -2.431 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.783 -1.852 -1.367 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -4.165 -2.456 -2.259 1.00 0.26 H new ATOM 0 HG LEU A 429 -3.577 -4.773 -1.132 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -2.517 -4.503 1.092 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.402 -4.023 -0.209 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -2.238 -2.779 0.750 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -4.975 -4.149 0.826 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -4.689 -2.427 0.480 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -5.613 -3.424 -0.669 1.00 0.56 H new ATOM 766 N GLU A 430 -3.823 -4.545 -4.291 1.00 0.27 N ATOM 767 CA GLU A 430 -4.423 -5.774 -4.882 1.00 0.28 C ATOM 768 C GLU A 430 -3.404 -6.484 -5.781 1.00 0.30 C ATOM 769 O GLU A 430 -3.223 -7.681 -5.700 1.00 0.33 O ATOM 770 CB GLU A 430 -5.612 -5.279 -5.707 1.00 0.30 C ATOM 771 CG GLU A 430 -6.802 -6.219 -5.503 1.00 0.61 C ATOM 772 CD GLU A 430 -7.918 -5.478 -4.763 1.00 1.45 C ATOM 773 OE1 GLU A 430 -8.711 -4.829 -5.425 1.00 2.05 O ATOM 774 OE2 GLU A 430 -7.962 -5.574 -3.547 1.00 2.18 O ATOM 0 H GLU A 430 -4.222 -3.666 -4.620 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.726 -6.491 -4.119 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -5.880 -4.266 -5.407 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.344 -5.238 -6.763 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -7.165 -6.577 -6.466 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -6.493 -7.095 -4.933 1.00 0.61 H new ATOM 781 N ARG A 431 -2.741 -5.756 -6.636 1.00 0.33 N ATOM 782 CA ARG A 431 -1.738 -6.392 -7.540 1.00 0.37 C ATOM 783 C ARG A 431 -0.651 -7.101 -6.724 1.00 0.36 C ATOM 784 O ARG A 431 -0.332 -8.248 -6.964 1.00 0.38 O ATOM 785 CB ARG A 431 -1.136 -5.238 -8.341 1.00 0.41 C ATOM 786 CG ARG A 431 -0.700 -5.746 -9.716 1.00 0.59 C ATOM 787 CD ARG A 431 0.814 -5.975 -9.719 1.00 1.32 C ATOM 788 NE ARG A 431 1.339 -5.086 -10.792 1.00 1.56 N ATOM 789 CZ ARG A 431 2.617 -5.070 -11.059 1.00 2.19 C ATOM 790 NH1 ARG A 431 3.309 -6.175 -11.003 1.00 2.87 N ATOM 791 NH2 ARG A 431 3.201 -3.950 -11.383 1.00 2.78 N ATOM 0 H ARG A 431 -2.849 -4.748 -6.749 1.00 0.33 H new ATOM 0 HA ARG A 431 -2.190 -7.146 -8.184 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.868 -4.438 -8.452 1.00 0.41 H new ATOM 0 HB3 ARG A 431 -0.282 -4.818 -7.809 1.00 0.41 H new ATOM 0 HG2 ARG A 431 -1.219 -6.674 -9.954 1.00 0.59 H new ATOM 0 HG3 ARG A 431 -0.971 -5.023 -10.485 1.00 0.59 H new ATOM 0 HD2 ARG A 431 1.252 -5.727 -8.752 1.00 1.32 H new ATOM 0 HD3 ARG A 431 1.054 -7.019 -9.919 1.00 1.32 H new ATOM 0 HE ARG A 431 0.700 -4.490 -11.318 1.00 1.56 H new ATOM 0 HH11 ARG A 431 2.851 -7.051 -10.751 1.00 2.87 H new ATOM 0 HH12 ARG A 431 4.307 -6.163 -11.212 1.00 2.87 H new ATOM 0 HH21 ARG A 431 2.659 -3.087 -11.428 1.00 2.78 H new ATOM 0 HH22 ARG A 431 4.199 -3.937 -11.592 1.00 2.78 H new ATOM 805 N THR A 432 -0.077 -6.425 -5.767 1.00 0.41 N ATOM 806 CA THR A 432 0.994 -7.058 -4.943 1.00 0.45 C ATOM 807 C THR A 432 0.511 -8.390 -4.360 1.00 0.40 C ATOM 808 O THR A 432 1.060 -9.437 -4.640 1.00 0.56 O ATOM 809 CB THR A 432 1.280 -6.055 -3.824 1.00 0.53 C ATOM 810 OG1 THR A 432 1.680 -4.817 -4.392 1.00 0.61 O ATOM 811 CG2 THR A 432 2.395 -6.593 -2.926 1.00 0.62 C ATOM 0 H THR A 432 -0.303 -5.462 -5.519 1.00 0.41 H new ATOM 0 HA THR A 432 1.884 -7.279 -5.532 1.00 0.45 H new ATOM 0 HB THR A 432 0.379 -5.907 -3.229 1.00 0.53 H new ATOM 0 HG1 THR A 432 0.890 -4.257 -4.545 1.00 0.61 H new ATOM 0 HG21 THR A 432 2.598 -5.877 -2.129 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.085 -7.543 -2.490 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.298 -6.743 -3.518 1.00 0.62 H new ATOM 819 N LEU A 433 -0.508 -8.360 -3.545 1.00 0.33 N ATOM 820 CA LEU A 433 -1.019 -9.624 -2.940 1.00 0.30 C ATOM 821 C LEU A 433 -1.438 -10.615 -4.030 1.00 0.27 C ATOM 822 O LEU A 433 -1.022 -11.756 -4.037 1.00 0.25 O ATOM 823 CB LEU A 433 -2.229 -9.205 -2.105 1.00 0.37 C ATOM 824 CG LEU A 433 -2.131 -9.829 -0.711 1.00 0.42 C ATOM 825 CD1 LEU A 433 -2.077 -11.353 -0.833 1.00 0.41 C ATOM 826 CD2 LEU A 433 -0.862 -9.329 -0.016 1.00 0.44 C ATOM 0 H LEU A 433 -1.009 -7.515 -3.272 1.00 0.33 H new ATOM 0 HA LEU A 433 -0.259 -10.123 -2.339 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -2.271 -8.119 -2.026 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -3.149 -9.525 -2.594 1.00 0.37 H new ATOM 0 HG LEU A 433 -3.005 -9.543 -0.125 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -2.007 -11.795 0.161 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -2.981 -11.711 -1.327 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -1.205 -11.640 -1.420 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -0.792 -9.773 0.977 1.00 0.44 H new ATOM 0 HD22 LEU A 433 0.011 -9.614 -0.603 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -0.900 -8.243 0.074 1.00 0.44 H new ATOM 838 N LEU A 434 -2.262 -10.190 -4.951 1.00 0.32 N ATOM 839 CA LEU A 434 -2.711 -11.112 -6.038 1.00 0.32 C ATOM 840 C LEU A 434 -1.511 -11.823 -6.671 1.00 0.29 C ATOM 841 O LEU A 434 -1.491 -13.031 -6.797 1.00 0.30 O ATOM 842 CB LEU A 434 -3.402 -10.211 -7.062 1.00 0.41 C ATOM 843 CG LEU A 434 -4.244 -11.066 -8.009 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.493 -11.557 -7.276 1.00 0.84 C ATOM 845 CD2 LEU A 434 -4.661 -10.227 -9.218 1.00 1.14 C ATOM 0 H LEU A 434 -2.644 -9.245 -4.999 1.00 0.32 H new ATOM 0 HA LEU A 434 -3.375 -11.892 -5.664 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -4.034 -9.483 -6.553 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.659 -9.648 -7.627 1.00 0.41 H new ATOM 0 HG LEU A 434 -3.658 -11.922 -8.344 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -6.094 -12.167 -7.950 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.197 -12.154 -6.413 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -6.079 -10.701 -6.941 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -5.261 -10.836 -9.894 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -5.247 -9.372 -8.882 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -3.772 -9.875 -9.741 1.00 1.14 H new ATOM 857 N THR A 435 -0.510 -11.085 -7.066 1.00 0.34 N ATOM 858 CA THR A 435 0.685 -11.728 -7.687 1.00 0.37 C ATOM 859 C THR A 435 1.392 -12.621 -6.664 1.00 0.35 C ATOM 860 O THR A 435 1.814 -13.718 -6.972 1.00 0.39 O ATOM 861 CB THR A 435 1.590 -10.568 -8.104 1.00 0.45 C ATOM 862 OG1 THR A 435 0.890 -9.727 -9.010 1.00 0.52 O ATOM 863 CG2 THR A 435 2.847 -11.117 -8.779 1.00 0.55 C ATOM 0 H THR A 435 -0.467 -10.069 -6.987 1.00 0.34 H new ATOM 0 HA THR A 435 0.421 -12.361 -8.534 1.00 0.37 H new ATOM 0 HB THR A 435 1.877 -9.994 -7.223 1.00 0.45 H new ATOM 0 HG1 THR A 435 0.365 -9.070 -8.507 1.00 0.52 H new ATOM 0 HG21 THR A 435 3.491 -10.290 -9.076 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.382 -11.762 -8.082 1.00 0.55 H new ATOM 0 HG23 THR A 435 2.565 -11.692 -9.661 1.00 0.55 H new ATOM 871 N THR A 436 1.524 -12.162 -5.449 1.00 0.33 N ATOM 872 CA THR A 436 2.203 -12.990 -4.411 1.00 0.36 C ATOM 873 C THR A 436 1.476 -14.327 -4.250 1.00 0.36 C ATOM 874 O THR A 436 2.021 -15.377 -4.531 1.00 0.40 O ATOM 875 CB THR A 436 2.113 -12.170 -3.123 1.00 0.38 C ATOM 876 OG1 THR A 436 2.837 -10.958 -3.286 1.00 0.39 O ATOM 877 CG2 THR A 436 2.709 -12.970 -1.964 1.00 0.49 C ATOM 0 H THR A 436 1.192 -11.252 -5.131 1.00 0.33 H new ATOM 0 HA THR A 436 3.236 -13.217 -4.673 1.00 0.36 H new ATOM 0 HB THR A 436 1.069 -11.945 -2.906 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.287 -10.312 -3.776 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.644 -12.385 -1.047 1.00 0.49 H new ATOM 0 HG22 THR A 436 2.154 -13.900 -1.841 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.754 -13.196 -2.177 1.00 0.49 H new ATOM 885 N ALA A 437 0.248 -14.300 -3.806 1.00 0.34 N ATOM 886 CA ALA A 437 -0.511 -15.573 -3.637 1.00 0.36 C ATOM 887 C ALA A 437 -0.469 -16.379 -4.935 1.00 0.36 C ATOM 888 O ALA A 437 -0.259 -17.576 -4.924 1.00 0.41 O ATOM 889 CB ALA A 437 -1.943 -15.145 -3.316 1.00 0.35 C ATOM 0 H ALA A 437 -0.262 -13.453 -3.553 1.00 0.34 H new ATOM 0 HA ALA A 437 -0.094 -16.205 -2.853 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -2.565 -16.030 -3.177 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -1.949 -14.551 -2.402 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.338 -14.549 -4.139 1.00 0.35 H new ATOM 895 N LEU A 438 -0.653 -15.735 -6.057 1.00 0.34 N ATOM 896 CA LEU A 438 -0.604 -16.482 -7.343 1.00 0.36 C ATOM 897 C LEU A 438 0.750 -17.182 -7.465 1.00 0.42 C ATOM 898 O LEU A 438 0.843 -18.289 -7.956 1.00 0.46 O ATOM 899 CB LEU A 438 -0.776 -15.430 -8.446 1.00 0.36 C ATOM 900 CG LEU A 438 -0.493 -16.065 -9.816 1.00 0.41 C ATOM 901 CD1 LEU A 438 -1.368 -17.307 -10.007 1.00 0.42 C ATOM 902 CD2 LEU A 438 -0.806 -15.056 -10.922 1.00 0.45 C ATOM 0 H LEU A 438 -0.833 -14.734 -6.137 1.00 0.34 H new ATOM 0 HA LEU A 438 -1.379 -17.246 -7.411 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.789 -15.027 -8.423 1.00 0.36 H new ATOM 0 HB3 LEU A 438 -0.097 -14.595 -8.274 1.00 0.36 H new ATOM 0 HG LEU A 438 0.558 -16.352 -9.864 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -1.161 -17.751 -10.981 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -1.147 -18.032 -9.223 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -2.419 -17.023 -9.953 1.00 0.42 H new ATOM 0 HD21 LEU A 438 -0.605 -15.507 -11.894 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -1.856 -14.768 -10.866 1.00 0.45 H new ATOM 0 HD23 LEU A 438 -0.181 -14.172 -10.796 1.00 0.45 H new ATOM 914 N ARG A 439 1.803 -16.552 -7.011 1.00 0.43 N ATOM 915 CA ARG A 439 3.146 -17.199 -7.093 1.00 0.51 C ATOM 916 C ARG A 439 3.064 -18.603 -6.492 1.00 0.54 C ATOM 917 O ARG A 439 3.611 -19.551 -7.021 1.00 0.61 O ATOM 918 CB ARG A 439 4.073 -16.308 -6.264 1.00 0.52 C ATOM 919 CG ARG A 439 5.399 -16.120 -7.006 1.00 0.77 C ATOM 920 CD ARG A 439 6.411 -15.441 -6.081 1.00 1.28 C ATOM 921 NE ARG A 439 7.309 -16.538 -5.625 1.00 1.74 N ATOM 922 CZ ARG A 439 8.530 -16.268 -5.248 1.00 2.28 C ATOM 923 NH1 ARG A 439 8.744 -15.370 -4.327 1.00 2.82 N ATOM 924 NH2 ARG A 439 9.535 -16.898 -5.794 1.00 2.89 N ATOM 0 H ARG A 439 1.791 -15.623 -6.590 1.00 0.43 H new ATOM 0 HA ARG A 439 3.505 -17.300 -8.117 1.00 0.51 H new ATOM 0 HB2 ARG A 439 3.603 -15.341 -6.087 1.00 0.52 H new ATOM 0 HB3 ARG A 439 4.251 -16.759 -5.288 1.00 0.52 H new ATOM 0 HG2 ARG A 439 5.783 -17.085 -7.336 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.245 -15.516 -7.900 1.00 0.77 H new ATOM 0 HD2 ARG A 439 6.969 -14.666 -6.607 1.00 1.28 H new ATOM 0 HD3 ARG A 439 5.915 -14.960 -5.238 1.00 1.28 H new ATOM 0 HE ARG A 439 6.971 -17.500 -5.607 1.00 1.74 H new ATOM 0 HH11 ARG A 439 7.958 -14.879 -3.901 1.00 2.82 H new ATOM 0 HH12 ARG A 439 9.697 -15.159 -4.032 1.00 2.82 H new ATOM 0 HH21 ARG A 439 9.366 -17.600 -6.514 1.00 2.89 H new ATOM 0 HH22 ARG A 439 10.489 -16.688 -5.500 1.00 2.89 H new ATOM 938 N HIS A 440 2.355 -18.746 -5.405 1.00 0.52 N ATOM 939 CA HIS A 440 2.205 -20.090 -4.789 1.00 0.57 C ATOM 940 C HIS A 440 1.588 -21.035 -5.822 1.00 0.58 C ATOM 941 O HIS A 440 1.823 -22.227 -5.820 1.00 0.64 O ATOM 942 CB HIS A 440 1.258 -19.877 -3.605 1.00 0.56 C ATOM 943 CG HIS A 440 1.011 -21.190 -2.916 1.00 0.63 C ATOM 944 ND1 HIS A 440 2.006 -21.857 -2.219 1.00 1.04 N ATOM 945 CD2 HIS A 440 -0.113 -21.972 -2.804 1.00 0.82 C ATOM 946 CE1 HIS A 440 1.468 -22.987 -1.724 1.00 0.96 C ATOM 947 NE2 HIS A 440 0.178 -23.106 -2.051 1.00 0.75 N ATOM 0 H HIS A 440 1.874 -17.989 -4.919 1.00 0.52 H new ATOM 0 HA HIS A 440 3.149 -20.527 -4.465 1.00 0.57 H new ATOM 0 HB2 HIS A 440 1.690 -19.163 -2.904 1.00 0.56 H new ATOM 0 HB3 HIS A 440 0.315 -19.453 -3.952 1.00 0.56 H new ATOM 0 HD2 HIS A 440 -1.076 -21.742 -3.235 1.00 0.82 H new ATOM 0 HE1 HIS A 440 2.013 -23.710 -1.134 1.00 0.96 H new ATOM 0 HE2 HIS A 440 -0.457 -23.865 -1.802 1.00 0.75 H new ATOM 955 N THR A 441 0.812 -20.489 -6.720 1.00 0.54 N ATOM 956 CA THR A 441 0.176 -21.315 -7.786 1.00 0.55 C ATOM 957 C THR A 441 0.409 -20.640 -9.142 1.00 0.56 C ATOM 958 O THR A 441 -0.516 -20.399 -9.892 1.00 0.55 O ATOM 959 CB THR A 441 -1.319 -21.336 -7.450 1.00 0.53 C ATOM 960 OG1 THR A 441 -1.860 -20.036 -7.632 1.00 0.48 O ATOM 961 CG2 THR A 441 -1.522 -21.775 -5.997 1.00 0.54 C ATOM 0 H THR A 441 0.590 -19.494 -6.760 1.00 0.54 H new ATOM 0 HA THR A 441 0.585 -22.324 -7.837 1.00 0.55 H new ATOM 0 HB THR A 441 -1.826 -22.041 -8.109 1.00 0.53 H new ATOM 0 HG1 THR A 441 -1.892 -19.826 -8.589 1.00 0.48 H new ATOM 0 HG21 THR A 441 -2.587 -21.787 -5.766 1.00 0.54 H new ATOM 0 HG22 THR A 441 -1.109 -22.774 -5.858 1.00 0.54 H new ATOM 0 HG23 THR A 441 -1.015 -21.077 -5.332 1.00 0.54 H new ATOM 969 N GLN A 442 1.643 -20.314 -9.441 1.00 0.59 N ATOM 970 CA GLN A 442 1.977 -19.628 -10.730 1.00 0.62 C ATOM 971 C GLN A 442 1.182 -20.209 -11.906 1.00 0.64 C ATOM 972 O GLN A 442 1.239 -21.390 -12.187 1.00 0.69 O ATOM 973 CB GLN A 442 3.473 -19.878 -10.928 1.00 0.69 C ATOM 974 CG GLN A 442 4.199 -18.541 -11.086 1.00 1.43 C ATOM 975 CD GLN A 442 5.682 -18.795 -11.362 1.00 1.79 C ATOM 976 OE1 GLN A 442 6.036 -19.760 -12.011 1.00 2.16 O ATOM 977 NE2 GLN A 442 6.572 -17.962 -10.895 1.00 2.47 N ATOM 0 H GLN A 442 2.445 -20.497 -8.838 1.00 0.59 H new ATOM 0 HA GLN A 442 1.726 -18.568 -10.692 1.00 0.62 H new ATOM 0 HB2 GLN A 442 3.877 -20.424 -10.076 1.00 0.69 H new ATOM 0 HB3 GLN A 442 3.635 -20.498 -11.810 1.00 0.69 H new ATOM 0 HG2 GLN A 442 3.759 -17.970 -11.904 1.00 1.43 H new ATOM 0 HG3 GLN A 442 4.084 -17.943 -10.182 1.00 1.43 H new ATOM 0 HE21 GLN A 442 6.276 -17.152 -10.350 1.00 2.47 H new ATOM 0 HE22 GLN A 442 7.563 -18.121 -11.075 1.00 2.47 H new ATOM 986 N GLY A 443 0.444 -19.379 -12.593 1.00 0.63 N ATOM 987 CA GLY A 443 -0.354 -19.870 -13.752 1.00 0.66 C ATOM 988 C GLY A 443 -1.764 -20.240 -13.289 1.00 0.64 C ATOM 989 O GLY A 443 -2.736 -20.006 -13.978 1.00 0.66 O ATOM 0 H GLY A 443 0.360 -18.381 -12.401 1.00 0.63 H new ATOM 0 HA2 GLY A 443 -0.404 -19.101 -14.523 1.00 0.66 H new ATOM 0 HA3 GLY A 443 0.132 -20.738 -14.199 1.00 0.66 H new ATOM 993 N HIS A 444 -1.885 -20.819 -12.126 1.00 0.62 N ATOM 994 CA HIS A 444 -3.234 -21.205 -11.622 1.00 0.62 C ATOM 995 C HIS A 444 -3.933 -19.993 -11.000 1.00 0.67 C ATOM 996 O HIS A 444 -4.156 -19.937 -9.807 1.00 1.34 O ATOM 997 CB HIS A 444 -2.969 -22.276 -10.563 1.00 0.63 C ATOM 998 CG HIS A 444 -3.885 -23.445 -10.793 1.00 0.95 C ATOM 999 ND1 HIS A 444 -3.496 -24.751 -10.539 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -5.175 -23.522 -11.256 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -4.533 -25.551 -10.847 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -5.583 -24.853 -11.289 1.00 1.86 N ATOM 0 H HIS A 444 -1.109 -21.042 -11.503 1.00 0.62 H new ATOM 0 HA HIS A 444 -3.884 -21.571 -12.417 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -1.929 -22.600 -10.610 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -3.130 -21.865 -9.566 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -5.782 -22.678 -11.550 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -4.518 -26.626 -10.749 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -6.488 -25.217 -11.586 1.00 1.86 H new ATOM 1010 N LYS A 445 -4.284 -19.021 -11.800 1.00 0.62 N ATOM 1011 CA LYS A 445 -4.969 -17.816 -11.251 1.00 0.51 C ATOM 1012 C LYS A 445 -6.205 -18.233 -10.448 1.00 0.51 C ATOM 1013 O LYS A 445 -6.679 -17.506 -9.598 1.00 0.57 O ATOM 1014 CB LYS A 445 -5.377 -16.993 -12.476 1.00 0.62 C ATOM 1015 CG LYS A 445 -6.301 -17.822 -13.374 1.00 1.31 C ATOM 1016 CD LYS A 445 -7.176 -16.885 -14.210 1.00 1.56 C ATOM 1017 CE LYS A 445 -8.145 -17.711 -15.059 1.00 2.23 C ATOM 1018 NZ LYS A 445 -8.559 -16.801 -16.163 1.00 2.52 N ATOM 0 H LYS A 445 -4.126 -19.010 -12.808 1.00 0.62 H new ATOM 0 HA LYS A 445 -4.327 -17.248 -10.577 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -5.884 -16.081 -12.160 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -4.491 -16.689 -13.033 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -5.710 -18.464 -14.027 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -6.927 -18.475 -12.766 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -7.731 -16.211 -13.558 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -6.552 -16.264 -14.853 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -7.664 -18.609 -15.447 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -9.004 -18.037 -14.473 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -9.225 -17.296 -16.790 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -9.020 -15.958 -15.764 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -7.721 -16.512 -16.707 1.00 2.52 H new ATOM 1032 N GLN A 446 -6.730 -19.400 -10.711 1.00 0.53 N ATOM 1033 CA GLN A 446 -7.934 -19.863 -9.964 1.00 0.56 C ATOM 1034 C GLN A 446 -7.562 -20.196 -8.518 1.00 0.52 C ATOM 1035 O GLN A 446 -8.208 -19.761 -7.585 1.00 0.51 O ATOM 1036 CB GLN A 446 -8.397 -21.119 -10.701 1.00 0.64 C ATOM 1037 CG GLN A 446 -9.710 -21.613 -10.093 1.00 1.11 C ATOM 1038 CD GLN A 446 -10.357 -22.633 -11.033 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -10.130 -23.820 -10.908 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -11.158 -22.218 -11.976 1.00 2.40 N ATOM 0 H GLN A 446 -6.377 -20.052 -11.411 1.00 0.53 H new ATOM 0 HA GLN A 446 -8.714 -19.103 -9.924 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -8.534 -20.902 -11.760 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -7.636 -21.896 -10.630 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -9.524 -22.067 -9.120 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -10.386 -20.774 -9.930 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -11.349 -21.222 -12.081 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -11.593 -22.890 -12.608 1.00 2.40 H new ATOM 1049 N GLU A 447 -6.524 -20.963 -8.323 1.00 0.52 N ATOM 1050 CA GLU A 447 -6.113 -21.323 -6.935 1.00 0.51 C ATOM 1051 C GLU A 447 -5.959 -20.057 -6.088 1.00 0.45 C ATOM 1052 O GLU A 447 -6.294 -20.034 -4.921 1.00 0.45 O ATOM 1053 CB GLU A 447 -4.767 -22.031 -7.090 1.00 0.53 C ATOM 1054 CG GLU A 447 -4.746 -23.283 -6.212 1.00 0.80 C ATOM 1055 CD GLU A 447 -4.933 -22.882 -4.748 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -4.464 -21.817 -4.382 1.00 1.96 O ATOM 1057 OE2 GLU A 447 -5.542 -23.647 -4.018 1.00 2.14 O ATOM 0 H GLU A 447 -5.943 -21.356 -9.064 1.00 0.52 H new ATOM 0 HA GLU A 447 -6.849 -21.954 -6.436 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -4.605 -22.302 -8.133 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -3.956 -21.360 -6.805 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -5.538 -23.967 -6.517 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -3.801 -23.812 -6.337 1.00 0.80 H new ATOM 1064 N ALA A 448 -5.460 -19.000 -6.672 1.00 0.42 N ATOM 1065 CA ALA A 448 -5.291 -17.733 -5.903 1.00 0.39 C ATOM 1066 C ALA A 448 -6.614 -17.344 -5.238 1.00 0.40 C ATOM 1067 O ALA A 448 -6.640 -16.627 -4.257 1.00 0.40 O ATOM 1068 CB ALA A 448 -4.886 -16.689 -6.942 1.00 0.39 C ATOM 0 H ALA A 448 -5.163 -18.959 -7.647 1.00 0.42 H new ATOM 0 HA ALA A 448 -4.549 -17.825 -5.110 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -4.742 -15.726 -6.453 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -3.956 -16.995 -7.422 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -5.670 -16.601 -7.694 1.00 0.39 H new ATOM 1074 N ALA A 449 -7.712 -17.815 -5.764 1.00 0.44 N ATOM 1075 CA ALA A 449 -9.030 -17.474 -5.161 1.00 0.47 C ATOM 1076 C ALA A 449 -9.076 -17.946 -3.704 1.00 0.48 C ATOM 1077 O ALA A 449 -9.102 -17.151 -2.787 1.00 0.49 O ATOM 1078 CB ALA A 449 -10.062 -18.224 -6.005 1.00 0.52 C ATOM 0 H ALA A 449 -7.752 -18.420 -6.584 1.00 0.44 H new ATOM 0 HA ALA A 449 -9.219 -16.400 -5.155 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -11.062 -18.022 -5.621 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -9.997 -17.890 -7.041 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -9.864 -19.295 -5.956 1.00 0.52 H new ATOM 1084 N ARG A 450 -9.078 -19.232 -3.485 1.00 0.49 N ATOM 1085 CA ARG A 450 -9.118 -19.749 -2.086 1.00 0.52 C ATOM 1086 C ARG A 450 -7.936 -19.192 -1.289 1.00 0.49 C ATOM 1087 O ARG A 450 -8.009 -19.022 -0.087 1.00 0.50 O ATOM 1088 CB ARG A 450 -9.006 -21.268 -2.220 1.00 0.56 C ATOM 1089 CG ARG A 450 -10.150 -21.936 -1.456 1.00 0.78 C ATOM 1090 CD ARG A 450 -9.771 -22.069 0.020 1.00 1.37 C ATOM 1091 NE ARG A 450 -11.067 -22.066 0.753 1.00 1.77 N ATOM 1092 CZ ARG A 450 -11.122 -22.498 1.983 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -10.528 -21.831 2.935 1.00 2.97 N ATOM 1094 NH2 ARG A 450 -11.772 -23.594 2.263 1.00 2.93 N ATOM 0 H ARG A 450 -9.054 -19.947 -4.212 1.00 0.49 H new ATOM 0 HA ARG A 450 -10.026 -19.454 -1.561 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -9.041 -21.554 -3.271 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -8.047 -21.608 -1.829 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -11.061 -21.346 -1.556 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -10.358 -22.919 -1.879 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -9.216 -22.989 0.204 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -9.135 -21.244 0.340 1.00 1.37 H new ATOM 0 HE ARG A 450 -11.912 -21.726 0.294 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -10.021 -20.973 2.717 1.00 2.97 H new ATOM 0 HH12 ARG A 450 -10.570 -22.168 3.897 1.00 2.97 H new ATOM 0 HH21 ARG A 450 -12.238 -24.115 1.520 1.00 2.93 H new ATOM 0 HH22 ARG A 450 -11.814 -23.930 3.225 1.00 2.93 H new ATOM 1108 N LEU A 451 -6.847 -18.909 -1.948 1.00 0.47 N ATOM 1109 CA LEU A 451 -5.659 -18.364 -1.229 1.00 0.47 C ATOM 1110 C LEU A 451 -6.010 -17.037 -0.553 1.00 0.44 C ATOM 1111 O LEU A 451 -5.506 -16.716 0.505 1.00 0.48 O ATOM 1112 CB LEU A 451 -4.604 -18.152 -2.315 1.00 0.46 C ATOM 1113 CG LEU A 451 -3.675 -19.366 -2.366 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -2.649 -19.180 -3.486 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -2.946 -19.505 -1.027 1.00 1.04 C ATOM 0 H LEU A 451 -6.727 -19.031 -2.954 1.00 0.47 H new ATOM 0 HA LEU A 451 -5.308 -19.034 -0.444 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.086 -18.008 -3.282 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -4.029 -17.249 -2.108 1.00 0.46 H new ATOM 0 HG LEU A 451 -4.262 -20.264 -2.558 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -1.988 -20.046 -3.521 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -3.166 -19.079 -4.440 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -2.061 -18.282 -3.296 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -2.283 -20.370 -1.062 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -2.360 -18.606 -0.837 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -3.675 -19.638 -0.228 1.00 1.04 H new ATOM 1127 N LEU A 452 -6.871 -16.260 -1.155 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.251 -14.954 -0.544 1.00 0.41 C ATOM 1129 C LEU A 452 -8.706 -14.996 -0.068 1.00 0.46 C ATOM 1130 O LEU A 452 -9.380 -13.987 -0.014 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.088 -13.926 -1.665 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.664 -13.991 -2.223 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.715 -13.952 -3.752 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -4.860 -12.794 -1.711 1.00 0.43 C ATOM 0 H LEU A 452 -7.327 -16.473 -2.042 1.00 0.42 H new ATOM 0 HA LEU A 452 -6.637 -14.713 0.324 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -7.809 -14.122 -2.459 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.295 -12.925 -1.286 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.188 -14.916 -1.897 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.702 -13.998 -4.151 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.289 -14.803 -4.119 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -6.191 -13.027 -4.077 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -3.846 -12.840 -2.108 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.336 -11.869 -2.038 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -4.824 -12.819 -0.622 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.198 -16.156 0.274 1.00 0.50 N ATOM 1147 CA GLY A 453 -10.610 -16.257 0.742 1.00 0.56 C ATOM 1148 C GLY A 453 -11.541 -15.686 -0.330 1.00 0.58 C ATOM 1149 O GLY A 453 -12.639 -15.250 -0.045 1.00 0.68 O ATOM 0 H GLY A 453 -8.684 -17.037 0.250 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -10.865 -17.297 0.944 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -10.735 -15.711 1.677 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.109 -15.685 -1.560 1.00 0.54 N ATOM 1154 CA TRP A 454 -11.963 -15.143 -2.657 1.00 0.60 C ATOM 1155 C TRP A 454 -12.582 -16.288 -3.462 1.00 0.68 C ATOM 1156 O TRP A 454 -12.547 -17.435 -3.063 1.00 1.16 O ATOM 1157 CB TRP A 454 -11.004 -14.339 -3.543 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.685 -13.011 -2.920 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -11.005 -12.629 -1.657 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -9.982 -11.886 -3.520 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -10.541 -11.342 -1.444 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -9.905 -10.836 -2.559 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.406 -11.670 -4.799 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -9.275 -9.613 -2.855 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -8.772 -10.441 -5.102 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.708 -9.415 -4.131 1.00 0.52 C ATOM 0 H TRP A 454 -10.198 -16.037 -1.855 1.00 0.54 H new ATOM 0 HA TRP A 454 -12.784 -14.536 -2.276 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -10.084 -14.904 -3.696 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.452 -14.186 -4.525 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.536 -13.232 -0.935 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -10.655 -10.830 -0.569 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.452 -12.448 -5.546 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -9.226 -8.832 -2.111 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -8.336 -10.287 -6.078 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -8.224 -8.479 -4.367 1.00 0.52 H new ATOM 1177 N GLY A 455 -13.138 -15.981 -4.600 1.00 0.72 N ATOM 1178 CA GLY A 455 -13.750 -17.041 -5.450 1.00 0.72 C ATOM 1179 C GLY A 455 -13.295 -16.831 -6.893 1.00 0.70 C ATOM 1180 O GLY A 455 -12.298 -16.188 -7.146 1.00 0.64 O ATOM 0 H GLY A 455 -13.195 -15.036 -4.980 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -13.450 -18.028 -5.098 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -14.837 -16.997 -5.386 1.00 0.72 H new ATOM 1184 N ALA A 456 -14.015 -17.356 -7.845 1.00 0.77 N ATOM 1185 CA ALA A 456 -13.610 -17.165 -9.268 1.00 0.77 C ATOM 1186 C ALA A 456 -14.261 -15.897 -9.825 1.00 0.82 C ATOM 1187 O ALA A 456 -13.749 -15.270 -10.730 1.00 0.83 O ATOM 1188 CB ALA A 456 -14.127 -18.403 -10.001 1.00 0.84 C ATOM 0 H ALA A 456 -14.862 -17.906 -7.702 1.00 0.77 H new ATOM 0 HA ALA A 456 -12.532 -17.051 -9.383 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -13.867 -18.336 -11.057 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -13.673 -19.296 -9.572 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -15.210 -18.461 -9.897 1.00 0.84 H new ATOM 1194 N ALA A 457 -15.382 -15.511 -9.281 1.00 0.90 N ATOM 1195 CA ALA A 457 -16.061 -14.278 -9.770 1.00 0.97 C ATOM 1196 C ALA A 457 -15.354 -13.045 -9.204 1.00 0.89 C ATOM 1197 O ALA A 457 -15.125 -12.073 -9.898 1.00 0.91 O ATOM 1198 CB ALA A 457 -17.491 -14.373 -9.237 1.00 1.08 C ATOM 0 H ALA A 457 -15.857 -15.996 -8.519 1.00 0.90 H new ATOM 0 HA ALA A 457 -16.043 -14.191 -10.856 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -18.057 -13.498 -9.556 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -17.965 -15.274 -9.627 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -17.471 -14.415 -8.148 1.00 1.08 H new ATOM 1204 N THR A 458 -14.999 -13.083 -7.949 1.00 0.84 N ATOM 1205 CA THR A 458 -14.296 -11.920 -7.336 1.00 0.77 C ATOM 1206 C THR A 458 -12.916 -11.754 -7.976 1.00 0.68 C ATOM 1207 O THR A 458 -12.566 -10.693 -8.455 1.00 0.67 O ATOM 1208 CB THR A 458 -14.164 -12.274 -5.853 1.00 0.76 C ATOM 1209 OG1 THR A 458 -15.452 -12.550 -5.319 1.00 0.85 O ATOM 1210 CG2 THR A 458 -13.538 -11.102 -5.097 1.00 0.72 C ATOM 0 H THR A 458 -15.165 -13.869 -7.321 1.00 0.84 H new ATOM 0 HA THR A 458 -14.832 -10.982 -7.481 1.00 0.77 H new ATOM 0 HB THR A 458 -13.527 -13.152 -5.745 1.00 0.76 H new ATOM 0 HG1 THR A 458 -15.370 -12.779 -4.370 1.00 0.85 H new ATOM 0 HG21 THR A 458 -13.446 -11.358 -4.041 1.00 0.72 H new ATOM 0 HG22 THR A 458 -12.550 -10.890 -5.507 1.00 0.72 H new ATOM 0 HG23 THR A 458 -14.171 -10.221 -5.203 1.00 0.72 H new ATOM 1218 N LEU A 459 -12.132 -12.800 -7.994 1.00 0.64 N ATOM 1219 CA LEU A 459 -10.776 -12.711 -8.609 1.00 0.57 C ATOM 1220 C LEU A 459 -10.872 -12.114 -10.016 1.00 0.60 C ATOM 1221 O LEU A 459 -9.994 -11.401 -10.461 1.00 0.58 O ATOM 1222 CB LEU A 459 -10.279 -14.157 -8.668 1.00 0.56 C ATOM 1223 CG LEU A 459 -8.931 -14.260 -7.955 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -8.703 -15.701 -7.497 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -7.812 -13.847 -8.912 1.00 0.46 C ATOM 0 H LEU A 459 -12.373 -13.713 -7.609 1.00 0.64 H new ATOM 0 HA LEU A 459 -10.102 -12.070 -8.041 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -11.003 -14.822 -8.197 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -10.180 -14.477 -9.705 1.00 0.56 H new ATOM 0 HG LEU A 459 -8.930 -13.599 -7.088 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -7.741 -15.773 -6.989 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -9.498 -15.995 -6.812 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -8.706 -16.363 -8.363 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -6.851 -13.921 -8.402 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -7.814 -14.506 -9.780 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -7.972 -12.819 -9.237 1.00 0.46 H new ATOM 1237 N THR A 460 -11.936 -12.395 -10.716 1.00 0.68 N ATOM 1238 CA THR A 460 -12.096 -11.839 -12.090 1.00 0.74 C ATOM 1239 C THR A 460 -12.777 -10.471 -12.021 1.00 0.76 C ATOM 1240 O THR A 460 -12.344 -9.517 -12.639 1.00 0.75 O ATOM 1241 CB THR A 460 -12.982 -12.847 -12.825 1.00 0.83 C ATOM 1242 OG1 THR A 460 -12.294 -14.085 -12.940 1.00 0.82 O ATOM 1243 CG2 THR A 460 -13.319 -12.315 -14.220 1.00 0.92 C ATOM 0 H THR A 460 -12.703 -12.986 -10.396 1.00 0.68 H new ATOM 0 HA THR A 460 -11.141 -11.696 -12.596 1.00 0.74 H new ATOM 0 HB THR A 460 -13.905 -12.995 -12.264 1.00 0.83 H new ATOM 0 HG1 THR A 460 -12.622 -14.706 -12.256 1.00 0.82 H new ATOM 0 HG21 THR A 460 -13.950 -13.035 -14.741 1.00 0.92 H new ATOM 0 HG22 THR A 460 -13.849 -11.367 -14.130 1.00 0.92 H new ATOM 0 HG23 THR A 460 -12.399 -12.164 -14.784 1.00 0.92 H new ATOM 1251 N ALA A 461 -13.838 -10.364 -11.270 1.00 0.81 N ATOM 1252 CA ALA A 461 -14.544 -9.056 -11.157 1.00 0.85 C ATOM 1253 C ALA A 461 -13.619 -8.018 -10.517 1.00 0.79 C ATOM 1254 O ALA A 461 -13.588 -6.870 -10.913 1.00 0.83 O ATOM 1255 CB ALA A 461 -15.748 -9.331 -10.257 1.00 0.92 C ATOM 0 H ALA A 461 -14.247 -11.126 -10.729 1.00 0.81 H new ATOM 0 HA ALA A 461 -14.846 -8.661 -12.127 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -16.321 -8.413 -10.125 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -16.380 -10.090 -10.717 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -15.403 -9.686 -9.286 1.00 0.92 H new ATOM 1261 N LYS A 462 -12.862 -8.415 -9.530 1.00 0.72 N ATOM 1262 CA LYS A 462 -11.936 -7.453 -8.866 1.00 0.68 C ATOM 1263 C LYS A 462 -10.843 -7.015 -9.845 1.00 0.66 C ATOM 1264 O LYS A 462 -10.236 -5.975 -9.687 1.00 0.67 O ATOM 1265 CB LYS A 462 -11.328 -8.229 -7.698 1.00 0.66 C ATOM 1266 CG LYS A 462 -10.648 -7.254 -6.736 1.00 0.99 C ATOM 1267 CD LYS A 462 -11.180 -7.478 -5.320 1.00 0.91 C ATOM 1268 CE LYS A 462 -12.670 -7.131 -5.271 1.00 1.31 C ATOM 1269 NZ LYS A 462 -12.743 -5.860 -4.499 1.00 1.39 N ATOM 0 H LYS A 462 -12.845 -9.363 -9.155 1.00 0.72 H new ATOM 0 HA LYS A 462 -12.447 -6.550 -8.532 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -12.104 -8.789 -7.176 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -10.605 -8.956 -8.068 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -9.568 -7.400 -6.757 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -10.837 -6.227 -7.049 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -11.028 -8.516 -5.023 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -10.629 -6.860 -4.611 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -13.080 -7.008 -6.273 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -13.244 -7.921 -4.786 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -13.735 -5.557 -4.422 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -12.352 -6.009 -3.547 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -12.193 -5.125 -4.988 1.00 1.39 H new ATOM 1283 N LEU A 463 -10.589 -7.803 -10.854 1.00 0.65 N ATOM 1284 CA LEU A 463 -9.536 -7.433 -11.842 1.00 0.65 C ATOM 1285 C LEU A 463 -9.984 -6.221 -12.663 1.00 0.68 C ATOM 1286 O LEU A 463 -9.202 -5.341 -12.965 1.00 0.70 O ATOM 1287 CB LEU A 463 -9.386 -8.662 -12.739 1.00 0.68 C ATOM 1288 CG LEU A 463 -7.994 -8.665 -13.374 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -7.462 -10.098 -13.432 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -8.083 -8.097 -14.791 1.00 0.99 C ATOM 0 H LEU A 463 -11.065 -8.686 -11.037 1.00 0.65 H new ATOM 0 HA LEU A 463 -8.596 -7.161 -11.362 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -9.533 -9.571 -12.156 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -10.151 -8.654 -13.515 1.00 0.68 H new ATOM 0 HG LEU A 463 -7.319 -8.052 -12.776 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -6.470 -10.100 -13.884 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -7.401 -10.505 -12.423 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -8.135 -10.712 -14.030 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -7.093 -8.098 -15.246 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -8.757 -8.712 -15.388 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -8.463 -7.076 -14.751 1.00 0.99 H new ATOM 1302 N LYS A 464 -11.235 -6.169 -13.029 1.00 0.72 N ATOM 1303 CA LYS A 464 -11.729 -5.014 -13.834 1.00 0.77 C ATOM 1304 C LYS A 464 -12.232 -3.900 -12.912 1.00 0.76 C ATOM 1305 O LYS A 464 -12.281 -2.746 -13.288 1.00 0.82 O ATOM 1306 CB LYS A 464 -12.878 -5.578 -14.670 1.00 0.85 C ATOM 1307 CG LYS A 464 -12.591 -5.344 -16.154 1.00 1.20 C ATOM 1308 CD LYS A 464 -11.683 -6.456 -16.681 1.00 1.62 C ATOM 1309 CE LYS A 464 -10.690 -5.871 -17.688 1.00 2.25 C ATOM 1310 NZ LYS A 464 -11.444 -5.791 -18.969 1.00 2.66 N ATOM 0 H LYS A 464 -11.937 -6.875 -12.806 1.00 0.72 H new ATOM 0 HA LYS A 464 -10.946 -4.580 -14.456 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -12.995 -6.644 -14.475 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -13.816 -5.098 -14.390 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -13.524 -5.325 -16.717 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -12.114 -4.374 -16.294 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -11.147 -6.924 -15.855 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -12.281 -7.235 -17.154 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -10.341 -4.887 -17.373 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -9.809 -6.505 -17.787 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -10.829 -5.399 -19.710 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -11.757 -6.743 -19.247 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -12.273 -5.176 -18.846 1.00 2.66 H new ATOM 1324 N GLU A 465 -12.607 -4.235 -11.708 1.00 0.73 N ATOM 1325 CA GLU A 465 -13.108 -3.193 -10.764 1.00 0.76 C ATOM 1326 C GLU A 465 -12.103 -2.041 -10.663 1.00 0.69 C ATOM 1327 O GLU A 465 -12.452 -0.886 -10.806 1.00 0.85 O ATOM 1328 CB GLU A 465 -13.243 -3.908 -9.420 1.00 0.79 C ATOM 1329 CG GLU A 465 -14.659 -4.471 -9.282 1.00 1.12 C ATOM 1330 CD GLU A 465 -14.798 -5.182 -7.934 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -14.916 -4.495 -6.934 1.00 1.95 O ATOM 1332 OE2 GLU A 465 -14.783 -6.402 -7.926 1.00 2.03 O ATOM 0 H GLU A 465 -12.589 -5.185 -11.336 1.00 0.73 H new ATOM 0 HA GLU A 465 -14.053 -2.760 -11.091 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -12.512 -4.713 -9.349 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -13.035 -3.215 -8.605 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -15.390 -3.666 -9.358 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -14.866 -5.167 -10.095 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.858 -2.346 -10.419 1.00 0.56 N ATOM 1340 CA LEU A 466 -9.834 -1.269 -10.312 1.00 0.59 C ATOM 1341 C LEU A 466 -9.653 -0.576 -11.664 1.00 0.70 C ATOM 1342 O LEU A 466 -9.425 0.615 -11.739 1.00 0.81 O ATOM 1343 CB LEU A 466 -8.548 -1.985 -9.902 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.680 -2.489 -8.464 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -7.745 -3.681 -8.253 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -8.300 -1.366 -7.495 1.00 0.52 C ATOM 0 H LEU A 466 -10.506 -3.294 -10.289 1.00 0.56 H new ATOM 0 HA LEU A 466 -10.118 -0.499 -9.595 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -8.354 -2.820 -10.575 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -7.699 -1.306 -9.984 1.00 0.56 H new ATOM 0 HG LEU A 466 -9.709 -2.798 -8.280 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -7.839 -4.040 -7.228 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -8.013 -4.480 -8.944 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -6.716 -3.373 -8.436 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -8.393 -1.723 -6.469 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -7.271 -1.059 -7.680 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -8.965 -0.515 -7.645 1.00 0.52 H new ATOM 1358 N GLY A 467 -9.754 -1.314 -12.736 1.00 0.77 N ATOM 1359 CA GLY A 467 -9.588 -0.702 -14.084 1.00 0.97 C ATOM 1360 C GLY A 467 -10.853 0.078 -14.452 1.00 1.08 C ATOM 1361 O GLY A 467 -10.822 0.983 -15.261 1.00 1.38 O ATOM 0 H GLY A 467 -9.945 -2.316 -12.736 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -8.724 -0.037 -14.089 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -9.398 -1.478 -14.826 1.00 0.97 H new ATOM 1723 N TRP B 402 6.151 -1.389 4.605 1.00 0.95 N ATOM 1724 CA TRP B 402 4.848 -2.109 4.490 1.00 0.86 C ATOM 1725 C TRP B 402 4.889 -3.185 3.400 1.00 0.79 C ATOM 1726 O TRP B 402 4.819 -4.360 3.684 1.00 0.71 O ATOM 1727 CB TRP B 402 3.838 -1.028 4.118 1.00 0.96 C ATOM 1728 CG TRP B 402 2.607 -1.219 4.932 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.489 -0.887 6.236 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.330 -1.788 4.529 1.00 0.76 C ATOM 1731 NE1 TRP B 402 1.214 -1.212 6.668 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.458 -1.769 5.655 1.00 0.83 C ATOM 1733 CE3 TRP B 402 0.840 -2.313 3.305 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -0.858 -2.259 5.572 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 -0.485 -2.806 3.216 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -1.332 -2.779 4.349 1.00 0.69 C ATOM 0 HA TRP B 402 4.597 -2.625 5.417 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.260 -0.039 4.299 1.00 0.96 H new ATOM 0 HB3 TRP B 402 3.600 -1.084 3.056 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.263 -0.441 6.843 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.875 -1.059 7.618 1.00 1.00 H new ATOM 0 HE3 TRP B 402 1.481 -2.337 2.436 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.502 -2.237 6.439 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.850 -3.204 2.280 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -2.341 -3.156 4.278 1.00 0.69 H new ATOM 1747 N ALA B 403 4.989 -2.792 2.158 1.00 0.85 N ATOM 1748 CA ALA B 403 5.022 -3.798 1.052 1.00 0.85 C ATOM 1749 C ALA B 403 6.011 -4.923 1.373 1.00 0.80 C ATOM 1750 O ALA B 403 5.722 -6.086 1.179 1.00 0.76 O ATOM 1751 CB ALA B 403 5.476 -3.019 -0.182 1.00 0.99 C ATOM 0 H ALA B 403 5.049 -1.818 1.860 1.00 0.85 H new ATOM 0 HA ALA B 403 4.051 -4.271 0.903 1.00 0.85 H new ATOM 0 HB1 ALA B 403 5.525 -3.691 -1.039 1.00 0.99 H new ATOM 0 HB2 ALA B 403 4.765 -2.219 -0.389 1.00 0.99 H new ATOM 0 HB3 ALA B 403 6.462 -2.591 0.000 1.00 0.99 H new ATOM 1757 N THR B 404 7.168 -4.591 1.876 1.00 0.82 N ATOM 1758 CA THR B 404 8.153 -5.655 2.218 1.00 0.81 C ATOM 1759 C THR B 404 7.554 -6.566 3.289 1.00 0.70 C ATOM 1760 O THR B 404 7.759 -7.765 3.291 1.00 0.69 O ATOM 1761 CB THR B 404 9.377 -4.913 2.758 1.00 0.89 C ATOM 1762 OG1 THR B 404 9.831 -3.985 1.784 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.489 -5.915 3.068 1.00 0.89 C ATOM 0 H THR B 404 7.472 -3.636 2.064 1.00 0.82 H new ATOM 0 HA THR B 404 8.415 -6.280 1.364 1.00 0.81 H new ATOM 0 HB THR B 404 9.107 -4.382 3.671 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.614 -3.507 2.128 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.360 -5.384 3.453 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.139 -6.627 3.815 1.00 0.89 H new ATOM 0 HG23 THR B 404 10.762 -6.449 2.158 1.00 0.89 H new ATOM 1771 N LEU B 405 6.799 -6.004 4.192 1.00 0.67 N ATOM 1772 CA LEU B 405 6.165 -6.827 5.257 1.00 0.61 C ATOM 1773 C LEU B 405 4.991 -7.608 4.665 1.00 0.53 C ATOM 1774 O LEU B 405 4.669 -8.694 5.102 1.00 0.52 O ATOM 1775 CB LEU B 405 5.678 -5.809 6.302 1.00 0.67 C ATOM 1776 CG LEU B 405 5.043 -6.515 7.515 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.638 -7.002 7.153 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.902 -7.710 7.953 1.00 0.64 C ATOM 0 H LEU B 405 6.594 -5.006 4.237 1.00 0.67 H new ATOM 0 HA LEU B 405 6.846 -7.556 5.695 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.516 -5.195 6.633 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.950 -5.137 5.847 1.00 0.67 H new ATOM 0 HG LEU B 405 4.983 -5.804 8.339 1.00 0.64 H new ATOM 0 HD11 LEU B 405 3.193 -7.501 8.014 1.00 0.57 H new ATOM 0 HD12 LEU B 405 3.020 -6.151 6.867 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.699 -7.702 6.320 1.00 0.57 H new ATOM 0 HD21 LEU B 405 5.438 -8.197 8.811 1.00 0.64 H new ATOM 0 HD22 LEU B 405 5.981 -8.422 7.131 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.897 -7.361 8.228 1.00 0.64 H new ATOM 1790 N LEU B 406 4.351 -7.058 3.670 1.00 0.53 N ATOM 1791 CA LEU B 406 3.196 -7.757 3.042 1.00 0.50 C ATOM 1792 C LEU B 406 3.693 -8.885 2.136 1.00 0.49 C ATOM 1793 O LEU B 406 3.083 -9.932 2.040 1.00 0.45 O ATOM 1794 CB LEU B 406 2.481 -6.680 2.222 1.00 0.57 C ATOM 1795 CG LEU B 406 0.982 -6.985 2.180 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.417 -6.966 3.601 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.268 -5.928 1.336 1.00 1.02 C ATOM 0 H LEU B 406 4.580 -6.151 3.264 1.00 0.53 H new ATOM 0 HA LEU B 406 2.534 -8.212 3.779 1.00 0.50 H new ATOM 0 HB2 LEU B 406 2.651 -5.698 2.664 1.00 0.57 H new ATOM 0 HB3 LEU B 406 2.886 -6.649 1.210 1.00 0.57 H new ATOM 0 HG LEU B 406 0.826 -7.969 1.739 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.651 -7.183 3.571 1.00 0.94 H new ATOM 0 HD12 LEU B 406 0.924 -7.719 4.204 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.575 -5.982 4.042 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.800 -6.146 1.307 1.00 1.02 H new ATOM 0 HD22 LEU B 406 0.425 -4.943 1.777 1.00 1.02 H new ATOM 0 HD23 LEU B 406 0.669 -5.940 0.322 1.00 1.02 H new ATOM 1809 N ALA B 407 4.800 -8.684 1.474 1.00 0.56 N ATOM 1810 CA ALA B 407 5.335 -9.749 0.580 1.00 0.59 C ATOM 1811 C ALA B 407 5.855 -10.916 1.421 1.00 0.57 C ATOM 1812 O ALA B 407 5.693 -12.069 1.072 1.00 0.61 O ATOM 1813 CB ALA B 407 6.477 -9.086 -0.190 1.00 0.70 C ATOM 0 H ALA B 407 5.356 -7.830 1.514 1.00 0.56 H new ATOM 0 HA ALA B 407 4.577 -10.150 -0.093 1.00 0.59 H new ATOM 0 HB1 ALA B 407 6.924 -9.809 -0.872 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.090 -8.241 -0.760 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.233 -8.734 0.512 1.00 0.70 H new ATOM 1819 N GLN B 408 6.473 -10.625 2.534 1.00 0.57 N ATOM 1820 CA GLN B 408 6.997 -11.716 3.403 1.00 0.57 C ATOM 1821 C GLN B 408 5.868 -12.282 4.266 1.00 0.50 C ATOM 1822 O GLN B 408 5.812 -13.465 4.537 1.00 0.50 O ATOM 1823 CB GLN B 408 8.064 -11.053 4.274 1.00 0.62 C ATOM 1824 CG GLN B 408 9.361 -10.911 3.474 1.00 0.75 C ATOM 1825 CD GLN B 408 10.557 -10.956 4.426 1.00 0.78 C ATOM 1826 OE1 GLN B 408 10.742 -11.919 5.143 1.00 1.29 O ATOM 1827 NE2 GLN B 408 11.384 -9.948 4.462 1.00 1.46 N ATOM 0 H GLN B 408 6.637 -9.679 2.878 1.00 0.57 H new ATOM 0 HA GLN B 408 7.406 -12.547 2.828 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.720 -10.073 4.606 1.00 0.62 H new ATOM 0 HB3 GLN B 408 8.240 -11.650 5.169 1.00 0.62 H new ATOM 0 HG2 GLN B 408 9.437 -11.713 2.740 1.00 0.75 H new ATOM 0 HG3 GLN B 408 9.358 -9.972 2.921 1.00 0.75 H new ATOM 0 HE21 GLN B 408 11.229 -9.139 3.860 1.00 1.46 H new ATOM 0 HE22 GLN B 408 12.186 -9.968 5.092 1.00 1.46 H new ATOM 1836 N TRP B 409 4.960 -11.446 4.692 1.00 0.46 N ATOM 1837 CA TRP B 409 3.827 -11.934 5.529 1.00 0.43 C ATOM 1838 C TRP B 409 2.928 -12.852 4.691 1.00 0.40 C ATOM 1839 O TRP B 409 2.685 -13.989 5.041 1.00 0.41 O ATOM 1840 CB TRP B 409 3.082 -10.661 5.954 1.00 0.43 C ATOM 1841 CG TRP B 409 1.749 -11.008 6.543 1.00 0.42 C ATOM 1842 CD1 TRP B 409 1.557 -11.608 7.741 1.00 0.50 C ATOM 1843 CD2 TRP B 409 0.425 -10.785 5.978 1.00 0.40 C ATOM 1844 NE1 TRP B 409 0.197 -11.770 7.950 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -0.545 -11.279 6.896 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.028 -10.203 4.765 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -1.923 -11.201 6.620 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.414 -10.123 4.483 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.359 -10.621 5.410 1.00 0.48 C ATOM 0 H TRP B 409 4.954 -10.445 4.496 1.00 0.46 H new ATOM 0 HA TRP B 409 4.151 -12.514 6.393 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.677 -10.110 6.683 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.947 -10.006 5.093 1.00 0.43 H new ATOM 0 HD1 TRP B 409 2.337 -11.911 8.423 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -0.207 -12.200 8.782 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.688 -9.819 4.053 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -2.642 -11.583 7.330 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -1.750 -9.680 3.557 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.415 -10.557 5.192 1.00 0.48 H new ATOM 1860 N ALA B 410 2.434 -12.363 3.587 1.00 0.42 N ATOM 1861 CA ALA B 410 1.554 -13.205 2.727 1.00 0.44 C ATOM 1862 C ALA B 410 2.247 -14.529 2.403 1.00 0.45 C ATOM 1863 O ALA B 410 1.611 -15.555 2.258 1.00 0.47 O ATOM 1864 CB ALA B 410 1.338 -12.383 1.457 1.00 0.51 C ATOM 0 H ALA B 410 2.601 -11.417 3.243 1.00 0.42 H new ATOM 0 HA ALA B 410 0.611 -13.453 3.214 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.698 -12.936 0.770 1.00 0.51 H new ATOM 0 HB2 ALA B 410 0.863 -11.436 1.713 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.299 -12.190 0.981 1.00 0.51 H new ATOM 1870 N ASP B 411 3.546 -14.516 2.292 1.00 0.48 N ATOM 1871 CA ASP B 411 4.280 -15.776 1.984 1.00 0.53 C ATOM 1872 C ASP B 411 4.396 -16.634 3.246 1.00 0.53 C ATOM 1873 O ASP B 411 4.154 -17.825 3.225 1.00 0.58 O ATOM 1874 CB ASP B 411 5.663 -15.326 1.510 1.00 0.60 C ATOM 1875 CG ASP B 411 6.037 -16.084 0.235 1.00 1.03 C ATOM 1876 OD1 ASP B 411 5.409 -15.841 -0.782 1.00 1.78 O ATOM 1877 OD2 ASP B 411 6.946 -16.896 0.299 1.00 1.51 O ATOM 0 H ASP B 411 4.131 -13.688 2.401 1.00 0.48 H new ATOM 0 HA ASP B 411 3.772 -16.380 1.232 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.663 -14.253 1.321 1.00 0.60 H new ATOM 0 HB3 ASP B 411 6.404 -15.513 2.287 1.00 0.60 H new ATOM 1882 N ARG B 412 4.761 -16.036 4.347 1.00 0.52 N ATOM 1883 CA ARG B 412 4.888 -16.813 5.613 1.00 0.56 C ATOM 1884 C ARG B 412 3.538 -17.427 5.987 1.00 0.55 C ATOM 1885 O ARG B 412 3.459 -18.547 6.452 1.00 0.63 O ATOM 1886 CB ARG B 412 5.323 -15.790 6.662 1.00 0.58 C ATOM 1887 CG ARG B 412 5.818 -16.520 7.911 1.00 0.96 C ATOM 1888 CD ARG B 412 7.304 -16.850 7.752 1.00 1.50 C ATOM 1889 NE ARG B 412 7.850 -16.839 9.137 1.00 1.90 N ATOM 1890 CZ ARG B 412 9.076 -17.226 9.358 1.00 2.41 C ATOM 1891 NH1 ARG B 412 9.528 -18.315 8.797 1.00 2.89 N ATOM 1892 NH2 ARG B 412 9.851 -16.525 10.139 1.00 3.02 N ATOM 0 H ARG B 412 4.977 -15.042 4.425 1.00 0.52 H new ATOM 0 HA ARG B 412 5.599 -17.635 5.528 1.00 0.56 H new ATOM 0 HB2 ARG B 412 6.114 -15.156 6.261 1.00 0.58 H new ATOM 0 HB3 ARG B 412 4.488 -15.137 6.916 1.00 0.58 H new ATOM 0 HG2 ARG B 412 5.665 -15.899 8.793 1.00 0.96 H new ATOM 0 HG3 ARG B 412 5.245 -17.435 8.062 1.00 0.96 H new ATOM 0 HD2 ARG B 412 7.444 -17.822 7.280 1.00 1.50 H new ATOM 0 HD3 ARG B 412 7.807 -16.115 7.123 1.00 1.50 H new ATOM 0 HE ARG B 412 7.265 -16.529 9.913 1.00 1.90 H new ATOM 0 HH11 ARG B 412 8.922 -18.863 8.186 1.00 2.89 H new ATOM 0 HH12 ARG B 412 10.487 -18.618 8.970 1.00 2.89 H new ATOM 0 HH21 ARG B 412 9.498 -15.674 10.577 1.00 3.02 H new ATOM 0 HH22 ARG B 412 10.810 -16.828 10.312 1.00 3.02 H new ATOM 1906 N ALA B 413 2.476 -16.702 5.780 1.00 0.50 N ATOM 1907 CA ALA B 413 1.127 -17.239 6.117 1.00 0.53 C ATOM 1908 C ALA B 413 0.730 -18.317 5.105 1.00 0.57 C ATOM 1909 O ALA B 413 0.053 -19.272 5.431 1.00 0.66 O ATOM 1910 CB ALA B 413 0.186 -16.037 6.021 1.00 0.53 C ATOM 0 H ALA B 413 2.483 -15.759 5.391 1.00 0.50 H new ATOM 0 HA ALA B 413 1.095 -17.699 7.105 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -0.831 -16.351 6.256 1.00 0.53 H new ATOM 0 HB2 ALA B 413 0.502 -15.270 6.729 1.00 0.53 H new ATOM 0 HB3 ALA B 413 0.216 -15.631 5.010 1.00 0.53 H new ATOM 1916 N LEU B 414 1.152 -18.171 3.878 1.00 0.54 N ATOM 1917 CA LEU B 414 0.805 -19.186 2.844 1.00 0.62 C ATOM 1918 C LEU B 414 1.451 -20.529 3.192 1.00 0.71 C ATOM 1919 O LEU B 414 0.893 -21.580 2.949 1.00 0.82 O ATOM 1920 CB LEU B 414 1.383 -18.635 1.538 1.00 0.63 C ATOM 1921 CG LEU B 414 0.269 -18.513 0.497 1.00 0.71 C ATOM 1922 CD1 LEU B 414 -0.759 -17.483 0.966 1.00 1.11 C ATOM 1923 CD2 LEU B 414 0.868 -18.061 -0.837 1.00 1.03 C ATOM 0 H LEU B 414 1.722 -17.392 3.548 1.00 0.54 H new ATOM 0 HA LEU B 414 -0.269 -19.356 2.773 1.00 0.62 H new ATOM 0 HB2 LEU B 414 1.840 -17.661 1.713 1.00 0.63 H new ATOM 0 HB3 LEU B 414 2.169 -19.294 1.169 1.00 0.63 H new ATOM 0 HG LEU B 414 -0.218 -19.480 0.371 1.00 0.71 H new ATOM 0 HD11 LEU B 414 -1.552 -17.397 0.224 1.00 1.11 H new ATOM 0 HD12 LEU B 414 -1.185 -17.802 1.917 1.00 1.11 H new ATOM 0 HD13 LEU B 414 -0.273 -16.515 1.092 1.00 1.11 H new ATOM 0 HD21 LEU B 414 0.076 -17.973 -1.581 1.00 1.03 H new ATOM 0 HD22 LEU B 414 1.354 -17.094 -0.709 1.00 1.03 H new ATOM 0 HD23 LEU B 414 1.602 -18.794 -1.173 1.00 1.03 H new ATOM 1935 N ARG B 415 2.627 -20.500 3.759 1.00 0.73 N ATOM 1936 CA ARG B 415 3.312 -21.771 4.124 1.00 0.87 C ATOM 1937 C ARG B 415 2.801 -22.294 5.474 1.00 0.93 C ATOM 1938 O ARG B 415 3.292 -23.279 5.990 1.00 1.26 O ATOM 1939 CB ARG B 415 4.793 -21.404 4.219 1.00 1.02 C ATOM 1940 CG ARG B 415 5.629 -22.679 4.341 1.00 1.40 C ATOM 1941 CD ARG B 415 6.193 -22.786 5.760 1.00 1.61 C ATOM 1942 NE ARG B 415 7.657 -22.560 5.611 1.00 2.27 N ATOM 1943 CZ ARG B 415 8.429 -23.532 5.207 1.00 2.92 C ATOM 1944 NH1 ARG B 415 8.616 -24.576 5.968 1.00 3.70 N ATOM 1945 NH2 ARG B 415 9.014 -23.458 4.042 1.00 3.32 N ATOM 0 H ARG B 415 3.143 -19.649 3.985 1.00 0.73 H new ATOM 0 HA ARG B 415 3.128 -22.560 3.395 1.00 0.87 H new ATOM 0 HB2 ARG B 415 5.096 -20.841 3.336 1.00 1.02 H new ATOM 0 HB3 ARG B 415 4.964 -20.760 5.082 1.00 1.02 H new ATOM 0 HG2 ARG B 415 5.016 -23.552 4.115 1.00 1.40 H new ATOM 0 HG3 ARG B 415 6.442 -22.664 3.615 1.00 1.40 H new ATOM 0 HD2 ARG B 415 5.744 -22.044 6.420 1.00 1.61 H new ATOM 0 HD3 ARG B 415 5.987 -23.764 6.194 1.00 1.61 H new ATOM 0 HE ARG B 415 8.057 -21.646 5.824 1.00 2.27 H new ATOM 0 HH11 ARG B 415 8.159 -24.632 6.878 1.00 3.70 H new ATOM 0 HH12 ARG B 415 9.219 -25.336 5.652 1.00 3.70 H new ATOM 0 HH21 ARG B 415 8.868 -22.641 3.449 1.00 3.32 H new ATOM 0 HH22 ARG B 415 9.617 -24.217 3.725 1.00 3.32 H new ATOM 1959 N SER B 416 1.819 -21.651 6.050 1.00 0.90 N ATOM 1960 CA SER B 416 1.289 -22.123 7.362 1.00 0.99 C ATOM 1961 C SER B 416 -0.235 -22.254 7.297 1.00 0.99 C ATOM 1962 O SER B 416 -0.769 -23.329 7.113 1.00 1.63 O ATOM 1963 CB SER B 416 1.694 -21.043 8.365 1.00 1.20 C ATOM 1964 OG SER B 416 3.105 -21.073 8.543 1.00 1.70 O ATOM 0 H SER B 416 1.363 -20.822 5.669 1.00 0.90 H new ATOM 0 HA SER B 416 1.681 -23.102 7.640 1.00 0.99 H new ATOM 0 HB2 SER B 416 1.382 -20.062 8.007 1.00 1.20 H new ATOM 0 HB3 SER B 416 1.192 -21.209 9.318 1.00 1.20 H new ATOM 0 HG SER B 416 3.369 -20.381 9.184 1.00 1.70 H new ATOM 1970 N GLY B 417 -0.940 -21.165 7.444 1.00 1.06 N ATOM 1971 CA GLY B 417 -2.426 -21.223 7.388 1.00 1.06 C ATOM 1972 C GLY B 417 -2.967 -19.860 6.953 1.00 0.99 C ATOM 1973 O GLY B 417 -3.515 -19.119 7.744 1.00 1.31 O ATOM 0 H GLY B 417 -0.549 -20.236 7.601 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -2.746 -21.995 6.688 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -2.828 -21.492 8.365 1.00 1.06 H new ATOM 1977 N HIS B 418 -2.815 -19.524 5.702 1.00 0.78 N ATOM 1978 CA HIS B 418 -3.315 -18.208 5.216 1.00 0.88 C ATOM 1979 C HIS B 418 -4.844 -18.170 5.262 1.00 0.89 C ATOM 1980 O HIS B 418 -5.504 -19.189 5.215 1.00 1.17 O ATOM 1981 CB HIS B 418 -2.816 -18.106 3.775 1.00 1.01 C ATOM 1982 CG HIS B 418 -3.377 -19.244 2.968 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -2.645 -20.390 2.698 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -4.595 -19.427 2.363 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -3.422 -21.204 1.960 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -4.622 -20.665 1.726 1.00 2.97 N ATOM 0 H HIS B 418 -2.365 -20.105 4.994 1.00 0.78 H new ATOM 0 HA HIS B 418 -2.962 -17.379 5.830 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -3.120 -17.154 3.340 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -1.727 -18.133 3.753 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -5.410 -18.718 2.379 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -3.113 -22.175 1.601 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -5.392 -21.072 1.195 1.00 2.97 H new ATOM 1994 N GLN B 419 -5.412 -16.998 5.351 1.00 1.08 N ATOM 1995 CA GLN B 419 -6.897 -16.890 5.399 1.00 1.24 C ATOM 1996 C GLN B 419 -7.335 -15.472 5.017 1.00 1.03 C ATOM 1997 O GLN B 419 -7.775 -15.226 3.911 1.00 1.28 O ATOM 1998 CB GLN B 419 -7.269 -17.204 6.849 1.00 1.71 C ATOM 1999 CG GLN B 419 -8.775 -17.023 7.042 1.00 2.32 C ATOM 2000 CD GLN B 419 -9.323 -18.183 7.875 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -8.624 -18.740 8.698 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -10.555 -18.575 7.695 1.00 3.52 N ATOM 0 H GLN B 419 -4.911 -16.110 5.393 1.00 1.08 H new ATOM 0 HA GLN B 419 -7.387 -17.568 4.701 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -6.981 -18.226 7.096 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -6.724 -16.546 7.526 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -8.978 -16.075 7.541 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -9.275 -16.987 6.074 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -11.143 -18.108 7.004 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -10.930 -19.348 8.245 1.00 3.52 H new ATOM 2011 N ASN B 420 -7.215 -14.535 5.918 1.00 0.78 N ATOM 2012 CA ASN B 420 -7.620 -13.137 5.600 1.00 0.70 C ATOM 2013 C ASN B 420 -6.431 -12.367 5.018 1.00 0.58 C ATOM 2014 O ASN B 420 -6.051 -11.326 5.515 1.00 0.70 O ATOM 2015 CB ASN B 420 -8.051 -12.534 6.936 1.00 0.86 C ATOM 2016 CG ASN B 420 -9.476 -12.980 7.263 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -10.177 -13.489 6.410 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -9.941 -12.808 8.470 1.00 1.87 N ATOM 0 H ASN B 420 -6.854 -14.678 6.861 1.00 0.78 H new ATOM 0 HA ASN B 420 -8.420 -13.094 4.861 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -7.370 -12.850 7.726 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -8.001 -11.446 6.889 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -10.891 -13.100 8.697 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -9.354 -12.381 9.187 1.00 1.87 H new ATOM 2025 N LEU B 421 -5.838 -12.876 3.974 1.00 0.45 N ATOM 2026 CA LEU B 421 -4.669 -12.182 3.362 1.00 0.40 C ATOM 2027 C LEU B 421 -5.048 -10.763 2.923 1.00 0.39 C ATOM 2028 O LEU B 421 -4.776 -9.796 3.607 1.00 0.53 O ATOM 2029 CB LEU B 421 -4.296 -13.034 2.148 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.290 -14.107 2.562 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.404 -15.305 1.617 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -1.873 -13.534 2.489 1.00 0.41 C ATOM 0 H LEU B 421 -6.113 -13.745 3.517 1.00 0.45 H new ATOM 0 HA LEU B 421 -3.842 -12.080 4.065 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -5.189 -13.500 1.731 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -3.870 -12.404 1.367 1.00 0.42 H new ATOM 0 HG LEU B 421 -3.500 -14.427 3.582 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -2.686 -16.071 1.912 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.413 -15.714 1.668 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.194 -14.985 0.597 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -1.155 -14.299 2.784 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -1.662 -13.213 1.469 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -1.791 -12.680 3.162 1.00 0.41 H new ATOM 2044 N LEU B 422 -5.663 -10.631 1.778 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.048 -9.276 1.283 1.00 0.34 C ATOM 2046 C LEU B 422 -7.044 -8.607 2.235 1.00 0.34 C ATOM 2047 O LEU B 422 -7.101 -7.398 2.337 1.00 0.37 O ATOM 2048 CB LEU B 422 -6.700 -9.528 -0.077 1.00 0.37 C ATOM 2049 CG LEU B 422 -5.628 -9.513 -1.167 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.240 -9.972 -2.492 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -5.083 -8.092 -1.323 1.00 0.63 C ATOM 0 H LEU B 422 -5.916 -11.404 1.163 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.189 -8.609 1.216 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.216 -10.488 -0.073 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -7.450 -8.764 -0.280 1.00 0.37 H new ATOM 0 HG LEU B 422 -4.817 -10.187 -0.889 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -5.476 -9.961 -3.269 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.631 -10.984 -2.381 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -7.050 -9.299 -2.771 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -4.318 -8.079 -2.100 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -5.895 -7.420 -1.601 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -4.647 -7.764 -0.379 1.00 0.63 H new ATOM 2063 N SER B 423 -7.834 -9.380 2.924 1.00 0.35 N ATOM 2064 CA SER B 423 -8.832 -8.782 3.860 1.00 0.38 C ATOM 2065 C SER B 423 -8.131 -8.039 5.003 1.00 0.36 C ATOM 2066 O SER B 423 -8.739 -7.256 5.705 1.00 0.39 O ATOM 2067 CB SER B 423 -9.625 -9.970 4.401 1.00 0.44 C ATOM 2068 OG SER B 423 -10.498 -10.452 3.388 1.00 1.23 O ATOM 0 H SER B 423 -7.834 -10.399 2.882 1.00 0.35 H new ATOM 0 HA SER B 423 -9.470 -8.052 3.362 1.00 0.38 H new ATOM 0 HB2 SER B 423 -8.946 -10.761 4.719 1.00 0.44 H new ATOM 0 HB3 SER B 423 -10.198 -9.670 5.279 1.00 0.44 H new ATOM 0 HG SER B 423 -11.007 -11.216 3.731 1.00 1.23 H new ATOM 2074 N GLU B 424 -6.864 -8.277 5.201 1.00 0.34 N ATOM 2075 CA GLU B 424 -6.143 -7.582 6.307 1.00 0.36 C ATOM 2076 C GLU B 424 -5.534 -6.264 5.817 1.00 0.32 C ATOM 2077 O GLU B 424 -5.683 -5.231 6.440 1.00 0.33 O ATOM 2078 CB GLU B 424 -5.043 -8.552 6.736 1.00 0.38 C ATOM 2079 CG GLU B 424 -5.206 -8.877 8.221 1.00 0.57 C ATOM 2080 CD GLU B 424 -3.869 -9.360 8.788 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -2.943 -8.567 8.827 1.00 1.54 O ATOM 2082 OE2 GLU B 424 -3.795 -10.516 9.174 1.00 1.22 O ATOM 0 H GLU B 424 -6.297 -8.920 4.648 1.00 0.34 H new ATOM 0 HA GLU B 424 -6.812 -7.328 7.130 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.097 -9.466 6.144 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -4.063 -8.112 6.554 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -5.545 -7.994 8.762 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -5.968 -9.645 8.355 1.00 0.57 H new ATOM 2089 N ALA B 425 -4.841 -6.290 4.712 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.217 -5.038 4.195 1.00 0.29 C ATOM 2091 C ALA B 425 -5.252 -4.185 3.453 1.00 0.28 C ATOM 2092 O ALA B 425 -5.068 -2.999 3.260 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.121 -5.511 3.240 1.00 0.29 C ATOM 0 H ALA B 425 -4.680 -7.122 4.145 1.00 0.31 H new ATOM 0 HA ALA B 425 -3.821 -4.415 4.997 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -2.611 -4.647 2.815 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -2.403 -6.124 3.785 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -3.566 -6.100 2.438 1.00 0.29 H new ATOM 2099 N GLN B 426 -6.339 -4.776 3.037 1.00 0.30 N ATOM 2100 CA GLN B 426 -7.383 -3.995 2.309 1.00 0.31 C ATOM 2101 C GLN B 426 -7.835 -2.783 3.138 1.00 0.30 C ATOM 2102 O GLN B 426 -7.761 -1.660 2.675 1.00 0.30 O ATOM 2103 CB GLN B 426 -8.545 -4.969 2.110 1.00 0.36 C ATOM 2104 CG GLN B 426 -8.488 -5.547 0.695 1.00 0.45 C ATOM 2105 CD GLN B 426 -9.747 -6.373 0.429 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -10.664 -6.380 1.227 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -9.831 -7.074 -0.669 1.00 1.09 N ATOM 0 H GLN B 426 -6.550 -5.765 3.169 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.009 -3.604 1.363 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -8.491 -5.772 2.845 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -9.494 -4.457 2.267 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -8.408 -4.742 -0.035 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -7.601 -6.170 0.581 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -9.061 -7.068 -1.338 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -10.666 -7.628 -0.858 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.298 -3.042 4.339 1.00 0.32 N ATOM 2117 CA PRO B 427 -8.770 -1.939 5.216 1.00 0.34 C ATOM 2118 C PRO B 427 -7.591 -1.079 5.676 1.00 0.31 C ATOM 2119 O PRO B 427 -7.752 0.073 6.027 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.421 -2.665 6.390 1.00 0.39 C ATOM 2121 CG PRO B 427 -8.774 -4.011 6.417 1.00 0.38 C ATOM 2122 CD PRO B 427 -8.425 -4.353 4.992 1.00 0.35 C ATOM 0 HA PRO B 427 -9.458 -1.257 4.717 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -9.258 -2.129 7.325 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.499 -2.748 6.254 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -7.881 -3.998 7.042 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -9.448 -4.756 6.840 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -7.497 -4.921 4.933 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.201 -4.960 4.524 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.406 -1.622 5.665 1.00 0.29 N ATOM 2131 CA GLU B 428 -5.224 -0.822 6.091 1.00 0.29 C ATOM 2132 C GLU B 428 -4.986 0.313 5.093 1.00 0.27 C ATOM 2133 O GLU B 428 -4.736 1.442 5.466 1.00 0.32 O ATOM 2134 CB GLU B 428 -4.050 -1.801 6.073 1.00 0.29 C ATOM 2135 CG GLU B 428 -4.215 -2.822 7.201 1.00 0.71 C ATOM 2136 CD GLU B 428 -3.301 -2.443 8.368 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -3.704 -1.609 9.163 1.00 2.07 O ATOM 2138 OE2 GLU B 428 -2.216 -2.994 8.448 1.00 2.11 O ATOM 0 H GLU B 428 -6.205 -2.581 5.381 1.00 0.29 H new ATOM 0 HA GLU B 428 -5.358 -0.371 7.074 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.004 -2.311 5.111 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.111 -1.261 6.193 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -5.253 -2.850 7.532 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -3.968 -3.821 6.841 1.00 0.71 H new ATOM 2145 N LEU B 429 -5.072 0.020 3.825 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.864 1.076 2.796 1.00 0.26 C ATOM 2147 C LEU B 429 -6.041 2.054 2.816 1.00 0.25 C ATOM 2148 O LEU B 429 -5.874 3.247 2.655 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.807 0.322 1.464 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.733 1.316 0.301 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.291 1.787 0.118 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.207 0.628 -0.981 1.00 0.56 C ATOM 0 H LEU B 429 -5.278 -0.908 3.456 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.960 1.660 2.968 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -3.938 -0.336 1.446 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.688 -0.310 1.357 1.00 0.26 H new ATOM 0 HG LEU B 429 -5.369 2.174 0.516 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.241 2.494 -0.710 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.948 2.273 1.031 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -2.653 0.930 -0.098 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.156 1.332 -1.812 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -4.567 -0.229 -1.192 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.236 0.291 -0.854 1.00 0.56 H new ATOM 2164 N GLU B 430 -7.231 1.556 3.015 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.420 2.454 3.046 1.00 0.28 C ATOM 2166 C GLU B 430 -8.368 3.361 4.279 1.00 0.30 C ATOM 2167 O GLU B 430 -8.578 4.553 4.192 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.624 1.513 3.120 1.00 0.30 C ATOM 2169 CG GLU B 430 -10.732 2.028 2.199 1.00 0.61 C ATOM 2170 CD GLU B 430 -10.936 1.044 1.044 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -11.699 0.108 1.216 1.00 2.05 O ATOM 2172 OE2 GLU B 430 -10.325 1.245 0.008 1.00 2.17 O ATOM 0 H GLU B 430 -7.431 0.566 3.157 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.467 3.108 2.175 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -9.330 0.506 2.825 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -9.988 1.451 4.145 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -11.660 2.145 2.759 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -10.468 3.012 1.810 1.00 0.61 H new ATOM 2179 N ARG B 431 -8.095 2.806 5.428 1.00 0.33 N ATOM 2180 CA ARG B 431 -8.036 3.637 6.666 1.00 0.37 C ATOM 2181 C ARG B 431 -6.982 4.741 6.525 1.00 0.36 C ATOM 2182 O ARG B 431 -7.242 5.898 6.789 1.00 0.38 O ATOM 2183 CB ARG B 431 -7.641 2.663 7.778 1.00 0.41 C ATOM 2184 CG ARG B 431 -8.234 3.138 9.107 1.00 0.59 C ATOM 2185 CD ARG B 431 -7.152 3.845 9.927 1.00 1.32 C ATOM 2186 NE ARG B 431 -7.055 3.065 11.194 1.00 1.56 N ATOM 2187 CZ ARG B 431 -6.218 3.437 12.125 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -6.018 4.706 12.353 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -5.585 2.539 12.829 1.00 2.78 N ATOM 0 H ARG B 431 -7.910 1.812 5.564 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.985 4.133 6.870 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -8.002 1.661 7.544 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -6.555 2.601 7.853 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -9.067 3.816 8.924 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -8.631 2.289 9.664 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -6.200 3.856 9.397 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -7.420 4.883 10.122 1.00 1.32 H new ATOM 0 HE ARG B 431 -7.641 2.242 11.333 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -6.515 5.407 11.804 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -5.364 4.997 13.080 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -5.744 1.547 12.652 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -4.931 2.829 13.556 1.00 2.78 H new ATOM 2203 N THR B 432 -5.793 4.392 6.117 1.00 0.41 N ATOM 2204 CA THR B 432 -4.721 5.421 5.969 1.00 0.45 C ATOM 2205 C THR B 432 -5.203 6.576 5.085 1.00 0.40 C ATOM 2206 O THR B 432 -5.277 7.710 5.516 1.00 0.56 O ATOM 2207 CB THR B 432 -3.557 4.686 5.304 1.00 0.53 C ATOM 2208 OG1 THR B 432 -3.162 3.591 6.121 1.00 0.61 O ATOM 2209 CG2 THR B 432 -2.378 5.644 5.129 1.00 0.62 C ATOM 0 H THR B 432 -5.516 3.440 5.879 1.00 0.41 H new ATOM 0 HA THR B 432 -4.437 5.857 6.926 1.00 0.45 H new ATOM 0 HB THR B 432 -3.871 4.318 4.327 1.00 0.53 H new ATOM 0 HG1 THR B 432 -3.595 2.772 5.802 1.00 0.61 H new ATOM 0 HG21 THR B 432 -1.549 5.118 4.655 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.681 6.483 4.503 1.00 0.62 H new ATOM 0 HG23 THR B 432 -2.062 6.014 6.104 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.524 6.300 3.851 1.00 0.33 N ATOM 2218 CA LEU B 433 -5.992 7.384 2.939 1.00 0.30 C ATOM 2219 C LEU B 433 -7.241 8.066 3.508 1.00 0.27 C ATOM 2220 O LEU B 433 -7.298 9.274 3.627 1.00 0.25 O ATOM 2221 CB LEU B 433 -6.320 6.681 1.622 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.678 7.442 0.461 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -6.201 8.880 0.440 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -4.158 7.457 0.641 1.00 0.44 C ATOM 0 H LEU B 433 -5.483 5.370 3.434 1.00 0.33 H new ATOM 0 HA LEU B 433 -5.240 8.163 2.812 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -5.953 5.655 1.645 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.400 6.631 1.484 1.00 0.37 H new ATOM 0 HG LEU B 433 -5.930 6.950 -0.478 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -5.743 9.422 -0.388 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -7.284 8.872 0.313 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -5.949 9.372 1.379 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -3.699 7.999 -0.186 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -3.908 7.949 1.581 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.783 6.434 0.656 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.243 7.304 3.856 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.489 7.911 4.411 1.00 0.32 C ATOM 2238 C LEU B 434 -9.152 8.906 5.527 1.00 0.29 C ATOM 2239 O LEU B 434 -9.604 10.033 5.522 1.00 0.30 O ATOM 2240 CB LEU B 434 -10.291 6.732 4.966 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.740 7.161 5.196 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.454 7.289 3.849 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -12.453 6.109 6.051 1.00 1.14 C ATOM 0 H LEU B 434 -8.253 6.287 3.780 1.00 0.32 H new ATOM 0 HA LEU B 434 -10.046 8.465 3.656 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.255 5.895 4.269 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -9.850 6.387 5.901 1.00 0.41 H new ATOM 0 HG LEU B 434 -11.757 8.122 5.710 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.487 7.595 4.013 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -11.947 8.036 3.238 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.437 6.328 3.335 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -13.486 6.414 6.216 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -12.436 5.149 5.536 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -11.945 6.015 7.011 1.00 1.14 H new ATOM 2255 N THR B 435 -8.362 8.498 6.481 1.00 0.34 N ATOM 2256 CA THR B 435 -7.998 9.425 7.590 1.00 0.37 C ATOM 2257 C THR B 435 -7.180 10.600 7.047 1.00 0.35 C ATOM 2258 O THR B 435 -7.388 11.738 7.420 1.00 0.39 O ATOM 2259 CB THR B 435 -7.157 8.583 8.552 1.00 0.45 C ATOM 2260 OG1 THR B 435 -7.922 7.470 8.993 1.00 0.52 O ATOM 2261 CG2 THR B 435 -6.749 9.434 9.755 1.00 0.55 C ATOM 0 H THR B 435 -7.953 7.565 6.541 1.00 0.34 H new ATOM 0 HA THR B 435 -8.875 9.848 8.081 1.00 0.37 H new ATOM 0 HB THR B 435 -6.261 8.230 8.041 1.00 0.45 H new ATOM 0 HG1 THR B 435 -7.842 6.740 8.344 1.00 0.52 H new ATOM 0 HG21 THR B 435 -6.150 8.833 10.439 1.00 0.55 H new ATOM 0 HG22 THR B 435 -6.164 10.288 9.415 1.00 0.55 H new ATOM 0 HG23 THR B 435 -7.642 9.788 10.270 1.00 0.55 H new ATOM 2269 N THR B 436 -6.254 10.335 6.165 1.00 0.33 N ATOM 2270 CA THR B 436 -5.429 11.441 5.600 1.00 0.36 C ATOM 2271 C THR B 436 -6.334 12.477 4.930 1.00 0.36 C ATOM 2272 O THR B 436 -6.417 13.611 5.359 1.00 0.40 O ATOM 2273 CB THR B 436 -4.520 10.773 4.568 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.661 9.851 5.223 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.683 11.840 3.859 1.00 0.49 C ATOM 0 H THR B 436 -6.034 9.404 5.812 1.00 0.33 H new ATOM 0 HA THR B 436 -4.855 11.964 6.365 1.00 0.36 H new ATOM 0 HB THR B 436 -5.128 10.244 3.834 1.00 0.38 H new ATOM 0 HG1 THR B 436 -4.173 9.059 5.489 1.00 0.39 H new ATOM 0 HG21 THR B 436 -3.035 11.364 3.123 1.00 0.49 H new ATOM 0 HG22 THR B 436 -4.344 12.547 3.357 1.00 0.49 H new ATOM 0 HG23 THR B 436 -3.073 12.370 4.591 1.00 0.49 H new ATOM 2283 N ALA B 437 -7.020 12.097 3.886 1.00 0.34 N ATOM 2284 CA ALA B 437 -7.926 13.062 3.197 1.00 0.36 C ATOM 2285 C ALA B 437 -8.875 13.698 4.214 1.00 0.36 C ATOM 2286 O ALA B 437 -9.097 14.893 4.203 1.00 0.41 O ATOM 2287 CB ALA B 437 -8.703 12.225 2.182 1.00 0.35 C ATOM 0 H ALA B 437 -6.993 11.161 3.480 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.382 13.874 2.715 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.393 12.866 1.634 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -8.006 11.761 1.484 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -9.265 11.450 2.703 1.00 0.35 H new ATOM 2293 N LEU B 438 -9.429 12.917 5.102 1.00 0.34 N ATOM 2294 CA LEU B 438 -10.346 13.501 6.118 1.00 0.36 C ATOM 2295 C LEU B 438 -9.606 14.585 6.899 1.00 0.42 C ATOM 2296 O LEU B 438 -10.168 15.603 7.249 1.00 0.46 O ATOM 2297 CB LEU B 438 -10.747 12.340 7.038 1.00 0.36 C ATOM 2298 CG LEU B 438 -11.495 12.885 8.263 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -12.677 13.751 7.811 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -12.020 11.720 9.104 1.00 0.45 C ATOM 0 H LEU B 438 -9.287 11.909 5.167 1.00 0.34 H new ATOM 0 HA LEU B 438 -11.226 13.962 5.669 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -11.380 11.636 6.497 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.860 11.792 7.356 1.00 0.36 H new ATOM 0 HG LEU B 438 -10.809 13.489 8.857 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -13.203 14.134 8.686 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -12.309 14.586 7.214 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -13.360 13.150 7.211 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -12.551 12.109 9.973 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -12.700 11.116 8.504 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -11.184 11.104 9.435 1.00 0.45 H new ATOM 2312 N ARG B 439 -8.341 14.383 7.168 1.00 0.43 N ATOM 2313 CA ARG B 439 -7.569 15.417 7.916 1.00 0.50 C ATOM 2314 C ARG B 439 -7.758 16.774 7.236 1.00 0.54 C ATOM 2315 O ARG B 439 -7.938 17.787 7.882 1.00 0.60 O ATOM 2316 CB ARG B 439 -6.109 14.969 7.837 1.00 0.52 C ATOM 2317 CG ARG B 439 -5.446 15.144 9.204 1.00 0.77 C ATOM 2318 CD ARG B 439 -3.936 14.934 9.072 1.00 1.27 C ATOM 2319 NE ARG B 439 -3.355 16.305 9.085 1.00 1.73 N ATOM 2320 CZ ARG B 439 -2.125 16.489 9.477 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -1.157 15.810 8.924 1.00 2.81 N ATOM 2322 NH2 ARG B 439 -1.862 17.351 10.421 1.00 2.89 N ATOM 0 H ARG B 439 -7.813 13.551 6.903 1.00 0.43 H new ATOM 0 HA ARG B 439 -7.894 15.520 8.951 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -6.054 13.926 7.525 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -5.578 15.554 7.086 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -5.652 16.141 9.595 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -5.862 14.430 9.915 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -3.548 14.333 9.894 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -3.689 14.409 8.149 1.00 1.27 H new ATOM 0 HE ARG B 439 -3.919 17.101 8.787 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -1.363 15.137 8.186 1.00 2.81 H new ATOM 0 HH12 ARG B 439 -0.194 15.953 9.230 1.00 2.81 H new ATOM 0 HH21 ARG B 439 -2.619 17.881 10.853 1.00 2.89 H new ATOM 0 HH22 ARG B 439 -0.900 17.494 10.727 1.00 2.89 H new ATOM 2336 N HIS B 440 -7.747 16.790 5.931 1.00 0.52 N ATOM 2337 CA HIS B 440 -7.960 18.069 5.203 1.00 0.57 C ATOM 2338 C HIS B 440 -9.314 18.648 5.622 1.00 0.58 C ATOM 2339 O HIS B 440 -9.522 19.845 5.631 1.00 0.64 O ATOM 2340 CB HIS B 440 -7.963 17.682 3.723 1.00 0.55 C ATOM 2341 CG HIS B 440 -8.198 18.908 2.883 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -7.267 19.932 2.793 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -9.253 19.290 2.090 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -7.775 20.871 1.973 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -8.984 20.529 1.517 1.00 0.75 N ATOM 0 H HIS B 440 -7.600 15.972 5.339 1.00 0.52 H new ATOM 0 HA HIS B 440 -7.199 18.821 5.412 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -7.012 17.222 3.455 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -8.741 16.943 3.531 1.00 0.55 H new ATOM 0 HD2 HIS B 440 -10.154 18.716 1.935 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -7.268 21.789 1.715 1.00 0.97 H new ATOM 0 HE2 HIS B 440 -9.581 21.062 0.885 1.00 0.75 H new ATOM 2353 N THR B 441 -10.229 17.789 5.988 1.00 0.53 N ATOM 2354 CA THR B 441 -11.574 18.249 6.434 1.00 0.55 C ATOM 2355 C THR B 441 -11.926 17.551 7.751 1.00 0.56 C ATOM 2356 O THR B 441 -12.972 16.947 7.884 1.00 0.55 O ATOM 2357 CB THR B 441 -12.541 17.821 5.325 1.00 0.53 C ATOM 2358 OG1 THR B 441 -12.635 16.404 5.306 1.00 0.48 O ATOM 2359 CG2 THR B 441 -12.034 18.317 3.969 1.00 0.54 C ATOM 0 H THR B 441 -10.098 16.777 5.996 1.00 0.53 H new ATOM 0 HA THR B 441 -11.617 19.325 6.602 1.00 0.55 H new ATOM 0 HB THR B 441 -13.523 18.253 5.518 1.00 0.53 H new ATOM 0 HG1 THR B 441 -13.561 16.135 5.479 1.00 0.48 H new ATOM 0 HG21 THR B 441 -12.727 18.008 3.186 1.00 0.54 H new ATOM 0 HG22 THR B 441 -11.963 19.405 3.983 1.00 0.54 H new ATOM 0 HG23 THR B 441 -11.050 17.892 3.771 1.00 0.54 H new ATOM 2367 N GLN B 442 -11.037 17.614 8.713 1.00 0.59 N ATOM 2368 CA GLN B 442 -11.270 16.944 10.033 1.00 0.62 C ATOM 2369 C GLN B 442 -12.719 17.109 10.505 1.00 0.64 C ATOM 2370 O GLN B 442 -13.216 18.208 10.657 1.00 0.69 O ATOM 2371 CB GLN B 442 -10.317 17.646 11.000 1.00 0.69 C ATOM 2372 CG GLN B 442 -9.413 16.608 11.669 1.00 1.43 C ATOM 2373 CD GLN B 442 -8.515 17.299 12.696 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -8.919 18.251 13.333 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -7.302 16.855 12.885 1.00 2.47 N ATOM 0 H GLN B 442 -10.148 18.108 8.639 1.00 0.59 H new ATOM 0 HA GLN B 442 -11.094 15.870 9.970 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -9.713 18.379 10.465 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -10.884 18.191 11.755 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -10.018 15.843 12.156 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -8.804 16.103 10.919 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -6.962 16.056 12.350 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -6.694 17.308 13.567 1.00 2.47 H new ATOM 2384 N GLY B 443 -13.396 16.017 10.744 1.00 0.63 N ATOM 2385 CA GLY B 443 -14.807 16.097 11.213 1.00 0.66 C ATOM 2386 C GLY B 443 -15.753 16.035 10.013 1.00 0.64 C ATOM 2387 O GLY B 443 -16.803 15.424 10.070 1.00 0.66 O ATOM 0 H GLY B 443 -13.030 15.071 10.634 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -15.020 15.277 11.899 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -14.965 17.023 11.765 1.00 0.66 H new ATOM 2391 N HIS B 444 -15.394 16.663 8.928 1.00 0.62 N ATOM 2392 CA HIS B 444 -16.276 16.639 7.728 1.00 0.62 C ATOM 2393 C HIS B 444 -16.074 15.336 6.948 1.00 0.67 C ATOM 2394 O HIS B 444 -15.567 15.335 5.844 1.00 1.34 O ATOM 2395 CB HIS B 444 -15.838 17.841 6.890 1.00 0.63 C ATOM 2396 CG HIS B 444 -17.048 18.618 6.456 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -17.036 19.999 6.331 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -18.318 18.222 6.113 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -18.262 20.381 5.928 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -19.082 19.337 5.780 1.00 1.86 N ATOM 0 H HIS B 444 -14.528 17.192 8.820 1.00 0.62 H new ATOM 0 HA HIS B 444 -17.333 16.690 7.991 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -15.172 18.479 7.471 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -15.277 17.505 6.018 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -18.670 17.201 6.103 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -18.548 21.407 5.746 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -20.059 19.353 5.486 1.00 1.86 H new ATOM 2408 N LYS B 445 -16.468 14.226 7.513 1.00 0.62 N ATOM 2409 CA LYS B 445 -16.297 12.928 6.800 1.00 0.51 C ATOM 2410 C LYS B 445 -16.935 13.003 5.409 1.00 0.51 C ATOM 2411 O LYS B 445 -16.590 12.253 4.517 1.00 0.57 O ATOM 2412 CB LYS B 445 -17.018 11.894 7.668 1.00 0.62 C ATOM 2413 CG LYS B 445 -18.494 12.280 7.812 1.00 1.31 C ATOM 2414 CD LYS B 445 -19.320 11.028 8.112 1.00 1.56 C ATOM 2415 CE LYS B 445 -20.802 11.401 8.194 1.00 2.23 C ATOM 2416 NZ LYS B 445 -21.433 10.296 8.969 1.00 2.52 N ATOM 0 H LYS B 445 -16.900 14.162 8.435 1.00 0.62 H new ATOM 0 HA LYS B 445 -15.247 12.672 6.656 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -16.933 10.905 7.218 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -16.549 11.839 8.650 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -18.614 13.009 8.613 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -18.849 12.752 6.896 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -19.165 10.282 7.333 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -18.994 10.581 9.051 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -20.941 12.361 8.691 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -21.243 11.489 7.201 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -22.452 10.479 9.068 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -21.290 9.396 8.469 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -20.998 10.241 9.912 1.00 2.52 H new ATOM 2430 N GLN B 446 -17.863 13.900 5.219 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.524 14.022 3.889 1.00 0.56 C ATOM 2432 C GLN B 446 -17.549 14.606 2.866 1.00 0.52 C ATOM 2433 O GLN B 446 -17.387 14.087 1.780 1.00 0.51 O ATOM 2434 CB GLN B 446 -19.697 14.975 4.116 1.00 0.64 C ATOM 2435 CG GLN B 446 -20.527 15.076 2.835 1.00 1.11 C ATOM 2436 CD GLN B 446 -21.875 15.727 3.150 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -22.021 16.929 3.052 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -22.876 14.977 3.526 1.00 2.40 N ATOM 0 H GLN B 446 -18.193 14.555 5.928 1.00 0.53 H new ATOM 0 HA GLN B 446 -18.851 13.058 3.501 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -20.318 14.616 4.937 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -19.329 15.960 4.402 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -19.993 15.664 2.088 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -20.681 14.084 2.410 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -22.754 13.968 3.608 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -23.780 15.401 3.737 1.00 2.40 H new ATOM 2447 N GLU B 447 -16.894 15.685 3.203 1.00 0.52 N ATOM 2448 CA GLU B 447 -15.928 16.300 2.249 1.00 0.51 C ATOM 2449 C GLU B 447 -14.929 15.249 1.761 1.00 0.45 C ATOM 2450 O GLU B 447 -14.532 15.241 0.612 1.00 0.45 O ATOM 2451 CB GLU B 447 -15.214 17.388 3.050 1.00 0.53 C ATOM 2452 CG GLU B 447 -15.121 18.662 2.210 1.00 0.80 C ATOM 2453 CD GLU B 447 -14.322 18.376 0.936 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -13.412 17.565 1.000 1.00 1.96 O ATOM 2455 OE2 GLU B 447 -14.634 18.973 -0.081 1.00 2.14 O ATOM 0 H GLU B 447 -16.987 16.166 4.097 1.00 0.52 H new ATOM 0 HA GLU B 447 -16.421 16.705 1.366 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -15.755 17.588 3.975 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -14.216 17.052 3.331 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -16.120 19.015 1.954 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -14.640 19.454 2.784 1.00 0.80 H new ATOM 2462 N ALA B 448 -14.524 14.358 2.624 1.00 0.43 N ATOM 2463 CA ALA B 448 -13.556 13.302 2.209 1.00 0.39 C ATOM 2464 C ALA B 448 -14.073 12.576 0.965 1.00 0.40 C ATOM 2465 O ALA B 448 -13.317 11.996 0.212 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.479 12.344 3.397 1.00 0.39 C ATOM 0 H ALA B 448 -14.821 14.315 3.599 1.00 0.43 H new ATOM 0 HA ALA B 448 -12.579 13.712 1.956 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -12.784 11.536 3.168 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -13.131 12.884 4.278 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.467 11.928 3.593 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.360 12.605 0.745 1.00 0.44 N ATOM 2473 CA ALA B 449 -15.923 11.919 -0.452 1.00 0.47 C ATOM 2474 C ALA B 449 -15.305 12.499 -1.728 1.00 0.48 C ATOM 2475 O ALA B 449 -14.556 11.839 -2.419 1.00 0.49 O ATOM 2476 CB ALA B 449 -17.428 12.201 -0.403 1.00 0.52 C ATOM 0 H ALA B 449 -16.043 13.073 1.341 1.00 0.44 H new ATOM 0 HA ALA B 449 -15.713 10.849 -0.454 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -17.915 11.727 -1.255 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -17.843 11.800 0.522 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -17.598 13.277 -0.440 1.00 0.52 H new ATOM 2482 N ARG B 450 -15.606 13.729 -2.041 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.029 14.347 -3.269 1.00 0.52 C ATOM 2484 C ARG B 450 -13.500 14.291 -3.218 1.00 0.49 C ATOM 2485 O ARG B 450 -12.836 14.232 -4.234 1.00 0.50 O ATOM 2486 CB ARG B 450 -15.513 15.798 -3.247 1.00 0.57 C ATOM 2487 CG ARG B 450 -16.186 16.134 -4.579 1.00 0.78 C ATOM 2488 CD ARG B 450 -15.121 16.536 -5.602 1.00 1.37 C ATOM 2489 NE ARG B 450 -15.708 16.187 -6.925 1.00 1.76 N ATOM 2490 CZ ARG B 450 -15.209 16.701 -8.016 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -14.011 16.366 -8.406 1.00 2.97 N ATOM 2492 NH2 ARG B 450 -15.910 17.549 -8.716 1.00 2.93 N ATOM 0 H ARG B 450 -16.226 14.333 -1.501 1.00 0.49 H new ATOM 0 HA ARG B 450 -15.337 13.829 -4.177 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -16.215 15.946 -2.426 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -14.673 16.470 -3.073 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -16.748 15.273 -4.942 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -16.900 16.946 -4.443 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -14.895 17.600 -5.539 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -14.187 16.001 -5.431 1.00 1.37 H new ATOM 0 HE ARG B 450 -16.500 15.546 -6.979 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -13.463 15.702 -7.858 1.00 2.97 H new ATOM 0 HH12 ARG B 450 -13.621 16.768 -9.259 1.00 2.97 H new ATOM 0 HH21 ARG B 450 -16.848 17.810 -8.411 1.00 2.93 H new ATOM 0 HH22 ARG B 450 -15.521 17.951 -9.569 1.00 2.93 H new ATOM 2506 N LEU B 451 -12.938 14.310 -2.041 1.00 0.48 N ATOM 2507 CA LEU B 451 -11.453 14.259 -1.922 1.00 0.47 C ATOM 2508 C LEU B 451 -10.913 12.965 -2.541 1.00 0.44 C ATOM 2509 O LEU B 451 -9.836 12.937 -3.101 1.00 0.48 O ATOM 2510 CB LEU B 451 -11.176 14.291 -0.419 1.00 0.46 C ATOM 2511 CG LEU B 451 -10.890 15.729 0.018 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -10.664 15.770 1.530 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -9.636 16.237 -0.698 1.00 1.04 C ATOM 0 H LEU B 451 -13.443 14.359 -1.156 1.00 0.48 H new ATOM 0 HA LEU B 451 -10.969 15.084 -2.444 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.033 13.897 0.128 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -10.326 13.652 -0.182 1.00 0.46 H new ATOM 0 HG LEU B 451 -11.740 16.362 -0.238 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -10.460 16.795 1.840 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -11.556 15.407 2.041 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -9.815 15.137 1.788 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -9.430 17.262 -0.388 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -8.788 15.603 -0.440 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.796 16.209 -1.776 1.00 1.04 H new ATOM 2525 N LEU B 452 -11.654 11.894 -2.445 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.180 10.606 -3.030 1.00 0.40 C ATOM 2527 C LEU B 452 -12.045 10.220 -4.232 1.00 0.46 C ATOM 2528 O LEU B 452 -12.205 9.057 -4.546 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.338 9.576 -1.910 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.581 10.045 -0.666 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.456 9.837 0.571 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.292 9.234 -0.518 1.00 0.43 C ATOM 0 H LEU B 452 -12.565 11.855 -1.988 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.151 10.671 -3.384 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.394 9.439 -1.675 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -10.956 8.609 -2.236 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.337 11.103 -0.766 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.917 10.171 1.458 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.376 10.412 0.467 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.699 8.779 0.671 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.752 9.568 0.368 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.537 8.177 -0.417 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -8.668 9.379 -1.399 1.00 0.43 H new ATOM 2544 N GLY B 453 -12.608 11.184 -4.907 1.00 0.50 N ATOM 2545 CA GLY B 453 -13.465 10.865 -6.085 1.00 0.56 C ATOM 2546 C GLY B 453 -14.585 9.915 -5.655 1.00 0.58 C ATOM 2547 O GLY B 453 -15.125 9.174 -6.451 1.00 0.68 O ATOM 0 H GLY B 453 -12.512 12.177 -4.695 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -13.888 11.780 -6.499 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -12.866 10.406 -6.871 1.00 0.56 H new ATOM 2551 N TRP B 454 -14.936 9.933 -4.398 1.00 0.54 N ATOM 2552 CA TRP B 454 -16.020 9.034 -3.910 1.00 0.60 C ATOM 2553 C TRP B 454 -17.314 9.826 -3.702 1.00 0.69 C ATOM 2554 O TRP B 454 -17.439 10.957 -4.125 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.514 8.500 -2.565 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.492 7.419 -2.771 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -13.915 7.085 -3.954 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -13.920 6.525 -1.772 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -13.025 6.046 -3.743 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -12.989 5.662 -2.418 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.115 6.378 -0.374 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -12.274 4.686 -1.702 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.397 5.396 0.351 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.478 4.552 -0.313 1.00 0.51 C ATOM 0 H TRP B 454 -14.518 10.533 -3.687 1.00 0.54 H new ATOM 0 HA TRP B 454 -16.240 8.236 -4.619 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.077 9.314 -1.986 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.351 8.110 -1.985 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -14.118 7.554 -4.905 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -12.464 5.616 -4.478 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -14.816 7.019 0.140 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.573 4.043 -2.213 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -13.552 5.292 1.415 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -11.932 3.804 0.243 1.00 0.51 H new ATOM 2575 N GLY B 455 -18.271 9.237 -3.040 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.555 9.944 -2.783 1.00 0.72 C ATOM 2577 C GLY B 455 -19.938 9.743 -1.317 1.00 0.70 C ATOM 2578 O GLY B 455 -19.106 9.432 -0.492 1.00 0.64 O ATOM 0 H GLY B 455 -18.217 8.290 -2.664 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.453 11.006 -3.005 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -20.338 9.556 -3.435 1.00 0.72 H new ATOM 2582 N ALA B 456 -21.187 9.907 -0.982 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.603 9.710 0.437 1.00 0.77 C ATOM 2584 C ALA B 456 -21.994 8.249 0.662 1.00 0.82 C ATOM 2585 O ALA B 456 -21.895 7.729 1.756 1.00 0.83 O ATOM 2586 CB ALA B 456 -22.808 10.629 0.633 1.00 0.84 C ATOM 0 H ALA B 456 -21.935 10.168 -1.624 1.00 0.77 H new ATOM 0 HA ALA B 456 -20.805 9.942 1.142 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -23.171 10.539 1.657 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.514 11.661 0.442 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.600 10.343 -0.060 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.430 7.579 -0.370 1.00 0.90 N ATOM 2593 CA ALA B 457 -22.817 6.148 -0.218 1.00 0.97 C ATOM 2594 C ALA B 457 -21.560 5.278 -0.169 1.00 0.89 C ATOM 2595 O ALA B 457 -21.450 4.370 0.631 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.648 5.827 -1.460 1.00 1.07 C ATOM 0 H ALA B 457 -22.535 7.960 -1.310 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.376 5.960 0.699 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -23.972 4.787 -1.422 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.522 6.478 -1.491 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -23.044 5.987 -2.353 1.00 1.07 H new ATOM 2602 N THR B 458 -20.606 5.558 -1.015 1.00 0.84 N ATOM 2603 CA THR B 458 -19.349 4.757 -1.015 1.00 0.77 C ATOM 2604 C THR B 458 -18.592 4.983 0.297 1.00 0.68 C ATOM 2605 O THR B 458 -18.243 4.051 0.993 1.00 0.67 O ATOM 2606 CB THR B 458 -18.542 5.289 -2.202 1.00 0.76 C ATOM 2607 OG1 THR B 458 -19.323 5.185 -3.385 1.00 0.85 O ATOM 2608 CG2 THR B 458 -17.261 4.470 -2.361 1.00 0.72 C ATOM 0 H THR B 458 -20.643 6.307 -1.706 1.00 0.84 H new ATOM 0 HA THR B 458 -19.534 3.686 -1.099 1.00 0.77 H new ATOM 0 HB THR B 458 -18.282 6.333 -2.026 1.00 0.76 H new ATOM 0 HG1 THR B 458 -18.810 5.526 -4.147 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.688 4.851 -3.207 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.663 4.549 -1.453 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.517 3.425 -2.537 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.343 6.220 0.641 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.617 6.515 1.910 1.00 0.57 C ATOM 2618 C LEU B 459 -18.275 5.777 3.080 1.00 0.60 C ATOM 2619 O LEU B 459 -17.616 5.347 4.006 1.00 0.58 O ATOM 2620 CB LEU B 459 -17.742 8.030 2.089 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.347 8.639 2.234 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.391 10.116 1.840 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -15.883 8.515 3.687 1.00 0.46 C ATOM 0 H LEU B 459 -18.612 7.039 0.096 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.577 6.192 1.879 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.255 8.468 1.233 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.343 8.255 2.970 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.652 8.109 1.583 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.396 10.550 1.943 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -16.721 10.207 0.805 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -17.087 10.645 2.490 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -14.889 8.949 3.790 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -16.579 9.044 4.338 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -15.850 7.463 3.970 1.00 0.46 H new ATOM 2635 N THR B 460 -19.570 5.621 3.039 1.00 0.68 N ATOM 2636 CA THR B 460 -20.270 4.905 4.142 1.00 0.74 C ATOM 2637 C THR B 460 -20.307 3.404 3.845 1.00 0.76 C ATOM 2638 O THR B 460 -20.007 2.586 4.692 1.00 0.75 O ATOM 2639 CB THR B 460 -21.685 5.487 4.156 1.00 0.83 C ATOM 2640 OG1 THR B 460 -21.626 6.863 4.509 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.541 4.733 5.177 1.00 0.92 C ATOM 0 H THR B 460 -20.173 5.959 2.289 1.00 0.68 H new ATOM 0 HA THR B 460 -19.772 5.029 5.104 1.00 0.74 H new ATOM 0 HB THR B 460 -22.130 5.383 3.166 1.00 0.83 H new ATOM 0 HG1 THR B 460 -21.698 7.412 3.700 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.548 5.149 5.185 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.586 3.678 4.906 1.00 0.92 H new ATOM 0 HG23 THR B 460 -22.099 4.834 6.168 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.668 3.037 2.646 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.720 1.590 2.293 1.00 0.85 C ATOM 2651 C ALA B 461 -19.319 0.981 2.381 1.00 0.79 C ATOM 2652 O ALA B 461 -19.140 -0.129 2.840 1.00 0.83 O ATOM 2653 CB ALA B 461 -21.233 1.551 0.853 1.00 0.92 C ATOM 0 H ALA B 461 -20.929 3.677 1.896 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.360 1.020 2.967 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -21.300 0.516 0.518 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -22.220 2.012 0.806 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.546 2.098 0.207 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.321 1.704 1.947 1.00 0.72 N ATOM 2660 CA LYS B 462 -16.931 1.170 2.009 1.00 0.68 C ATOM 2661 C LYS B 462 -16.494 1.012 3.467 1.00 0.65 C ATOM 2662 O LYS B 462 -15.605 0.245 3.779 1.00 0.66 O ATOM 2663 CB LYS B 462 -16.072 2.220 1.303 1.00 0.66 C ATOM 2664 CG LYS B 462 -14.700 1.624 0.983 1.00 0.99 C ATOM 2665 CD LYS B 462 -14.397 1.808 -0.506 1.00 0.91 C ATOM 2666 CE LYS B 462 -15.398 1.002 -1.336 1.00 1.31 C ATOM 2667 NZ LYS B 462 -14.611 -0.137 -1.886 1.00 1.39 N ATOM 0 H LYS B 462 -18.409 2.641 1.553 1.00 0.72 H new ATOM 0 HA LYS B 462 -16.842 0.190 1.541 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.561 2.548 0.386 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -15.960 3.100 1.937 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -13.932 2.110 1.584 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -14.683 0.565 1.240 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -14.455 2.864 -0.772 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -13.381 1.480 -0.724 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -16.227 0.650 -0.722 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -15.827 1.607 -2.134 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -15.229 -0.737 -2.468 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -13.833 0.229 -2.471 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -14.220 -0.699 -1.103 1.00 1.39 H new ATOM 2681 N LEU B 463 -17.113 1.731 4.363 1.00 0.65 N ATOM 2682 CA LEU B 463 -16.734 1.622 5.800 1.00 0.65 C ATOM 2683 C LEU B 463 -17.136 0.253 6.353 1.00 0.68 C ATOM 2684 O LEU B 463 -16.416 -0.352 7.123 1.00 0.70 O ATOM 2685 CB LEU B 463 -17.517 2.733 6.500 1.00 0.68 C ATOM 2686 CG LEU B 463 -16.803 3.123 7.794 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -16.896 4.638 7.992 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -17.469 2.412 8.974 1.00 0.99 C ATOM 0 H LEU B 463 -17.865 2.390 4.162 1.00 0.65 H new ATOM 0 HA LEU B 463 -15.659 1.721 5.952 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.604 3.600 5.845 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -18.530 2.396 6.719 1.00 0.68 H new ATOM 0 HG LEU B 463 -15.755 2.829 7.735 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -16.387 4.916 8.915 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -16.424 5.145 7.150 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -17.943 4.933 8.052 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -16.962 2.688 9.898 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -18.517 2.707 9.033 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -17.404 1.333 8.833 1.00 0.99 H new ATOM 2700 N LYS B 464 -18.281 -0.241 5.967 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.729 -1.571 6.474 1.00 0.77 C ATOM 2702 C LYS B 464 -18.241 -2.686 5.545 1.00 0.76 C ATOM 2703 O LYS B 464 -18.110 -3.826 5.943 1.00 0.82 O ATOM 2704 CB LYS B 464 -20.256 -1.501 6.470 1.00 0.85 C ATOM 2705 CG LYS B 464 -20.783 -1.782 7.879 1.00 1.20 C ATOM 2706 CD LYS B 464 -20.740 -0.496 8.706 1.00 1.62 C ATOM 2707 CE LYS B 464 -20.344 -0.829 10.145 1.00 2.25 C ATOM 2708 NZ LYS B 464 -21.605 -1.283 10.795 1.00 2.66 N ATOM 0 H LYS B 464 -18.926 0.218 5.323 1.00 0.72 H new ATOM 0 HA LYS B 464 -18.332 -1.789 7.465 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.585 -0.517 6.137 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.662 -2.228 5.767 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -21.804 -2.160 7.828 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -20.180 -2.554 8.357 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -20.025 0.204 8.273 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -21.714 -0.007 8.689 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -19.582 -1.608 10.175 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -19.930 0.042 10.652 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -21.415 -1.530 11.787 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -22.310 -0.519 10.757 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -21.972 -2.118 10.295 1.00 2.66 H new ATOM 2722 N GLU B 465 -17.970 -2.368 4.308 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.492 -3.411 3.356 1.00 0.76 C ATOM 2724 C GLU B 465 -16.291 -4.156 3.945 1.00 0.69 C ATOM 2725 O GLU B 465 -16.261 -5.371 3.985 1.00 0.85 O ATOM 2726 CB GLU B 465 -17.085 -2.643 2.098 1.00 0.79 C ATOM 2727 CG GLU B 465 -18.275 -2.562 1.141 1.00 1.12 C ATOM 2728 CD GLU B 465 -17.865 -1.800 -0.120 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -17.177 -2.380 -0.943 1.00 1.94 O ATOM 2730 OE2 GLU B 465 -18.246 -0.647 -0.241 1.00 2.03 O ATOM 0 H GLU B 465 -18.059 -1.431 3.916 1.00 0.73 H new ATOM 0 HA GLU B 465 -18.256 -4.160 3.146 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -16.750 -1.640 2.364 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -16.246 -3.141 1.611 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -18.613 -3.564 0.879 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -19.112 -2.060 1.626 1.00 1.12 H new ATOM 2737 N LEU B 466 -15.302 -3.439 4.405 1.00 0.56 N ATOM 2738 CA LEU B 466 -14.107 -4.109 4.992 1.00 0.59 C ATOM 2739 C LEU B 466 -14.493 -4.841 6.280 1.00 0.70 C ATOM 2740 O LEU B 466 -13.968 -5.893 6.589 1.00 0.81 O ATOM 2741 CB LEU B 466 -13.127 -2.975 5.294 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.594 -2.395 3.983 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -12.149 -0.949 4.208 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.400 -3.227 3.506 1.00 0.52 C ATOM 0 H LEU B 466 -15.270 -2.420 4.400 1.00 0.56 H new ATOM 0 HA LEU B 466 -13.677 -4.852 4.320 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -13.624 -2.196 5.873 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -12.302 -3.346 5.901 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.380 -2.420 3.229 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -11.769 -0.536 3.274 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -12.998 -0.356 4.549 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -11.363 -0.924 4.962 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -11.019 -2.815 2.572 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.614 -3.202 4.261 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -11.716 -4.258 3.346 1.00 0.52 H new ATOM 2756 N GLY B 467 -15.406 -4.293 7.034 1.00 0.77 N ATOM 2757 CA GLY B 467 -15.825 -4.955 8.301 1.00 0.97 C ATOM 2758 C GLY B 467 -16.742 -6.137 7.983 1.00 1.08 C ATOM 2759 O GLY B 467 -16.868 -7.063 8.760 1.00 1.38 O ATOM 0 H GLY B 467 -15.880 -3.414 6.827 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -14.949 -5.299 8.850 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -16.343 -4.242 8.942 1.00 0.97 H new