USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1050 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 404 THR OG1 : rot 180:sc= 0.144 USER MOD Single : A 408 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 418 HIS : no HD1:sc= -1.38! C(o=-1.4!,f=-1.5!) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 420 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 426 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 432 THR OG1 : rot 180:sc= 0.0141 USER MOD Single : A 435 THR OG1 : rot 101:sc= 1.01 USER MOD Single : A 436 THR OG1 : rot 109:sc= 1.3 USER MOD Single : A 440 HIS : no HE2:sc= -1.46 K(o=-1.5,f=-3.7!) USER MOD Single : A 441 THR OG1 : rot 114:sc= 0.134 USER MOD Single : A 442 GLN : amide:sc= -0.119 K(o=-0.12,f=-1.6!) USER MOD Single : A 444 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.2) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.57) USER MOD Single : A 458 THR OG1 : rot 135:sc= 0.264 USER MOD Single : A 460 THR OG1 : rot 98:sc= 0.728 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= 0.101 USER MOD Single : B 408 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 416 SER OG : rot 180:sc= 0 USER MOD Single : B 418 HIS : no HD1:sc= -1.43! C(o=-1.4!,f=-1.5!) USER MOD Single : B 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 420 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 423 SER OG : rot 180:sc= 0 USER MOD Single : B 426 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.13) USER MOD Single : B 432 THR OG1 : rot 180:sc= 0.0149 USER MOD Single : B 435 THR OG1 : rot 109:sc= 1.07 USER MOD Single : B 436 THR OG1 : rot 93:sc= 1.19 USER MOD Single : B 440 HIS : no HE2:sc= -1.41 K(o=-1.4,f=-3.6!) USER MOD Single : B 441 THR OG1 : rot 117:sc= 0.13 USER MOD Single : B 442 GLN : amide:sc= -0.18 K(o=-0.18,f=-1.8!) USER MOD Single : B 444 HIS : no HD1:sc= -0.0957 X(o=-0.096,f=-0.18) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= -0.537 X(o=-0.54,f=-0.6) USER MOD Single : B 458 THR OG1 : rot 134:sc= 0.265 USER MOD Single : B 460 THR OG1 : rot 97:sc= 0.742 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 6.158 2.681 1.655 1.00 0.95 N ATOM 326 CA TRP A 402 4.813 2.837 1.026 1.00 0.86 C ATOM 327 C TRP A 402 3.947 3.840 1.791 1.00 0.79 C ATOM 328 O TRP A 402 3.654 4.908 1.300 1.00 0.71 O ATOM 329 CB TRP A 402 4.188 1.446 1.092 1.00 0.96 C ATOM 330 CG TRP A 402 3.571 1.128 -0.226 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.243 0.651 -1.295 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.181 1.264 -0.636 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.354 0.477 -2.345 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.069 0.842 -1.991 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.008 1.707 0.030 1.00 0.78 C ATOM 336 CZ2 TRP A 402 0.833 0.859 -2.666 1.00 0.83 C ATOM 337 CZ3 TRP A 402 -0.236 1.727 -0.644 1.00 0.72 C ATOM 338 CH2 TRP A 402 -0.322 1.304 -1.990 1.00 0.69 C ATOM 0 HA TRP A 402 4.892 3.217 0.008 1.00 0.86 H new ATOM 0 HB2 TRP A 402 4.947 0.704 1.341 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.435 1.409 1.879 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.302 0.439 -1.327 1.00 0.94 H new ATOM 0 HE1 TRP A 402 3.616 0.123 -3.265 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.066 2.031 1.059 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 0.770 0.534 -3.694 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -1.122 2.066 -0.129 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -1.273 1.322 -2.501 1.00 0.69 H new ATOM 349 N ALA A 403 3.523 3.501 2.981 1.00 0.85 N ATOM 350 CA ALA A 403 2.661 4.439 3.768 1.00 0.85 C ATOM 351 C ALA A 403 3.240 5.858 3.744 1.00 0.80 C ATOM 352 O ALA A 403 2.539 6.815 3.489 1.00 0.76 O ATOM 353 CB ALA A 403 2.663 3.881 5.191 1.00 0.99 C ATOM 0 H ALA A 403 3.735 2.617 3.443 1.00 0.85 H new ATOM 0 HA ALA A 403 1.654 4.508 3.357 1.00 0.85 H new ATOM 0 HB1 ALA A 403 2.051 4.516 5.832 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.256 2.870 5.186 1.00 0.99 H new ATOM 0 HB3 ALA A 403 3.684 3.859 5.572 1.00 0.99 H new ATOM 359 N THR A 404 4.511 6.003 3.994 1.00 0.82 N ATOM 360 CA THR A 404 5.113 7.365 3.966 1.00 0.81 C ATOM 361 C THR A 404 4.896 7.984 2.583 1.00 0.70 C ATOM 362 O THR A 404 4.635 9.164 2.451 1.00 0.68 O ATOM 363 CB THR A 404 6.603 7.153 4.238 1.00 0.89 C ATOM 364 OG1 THR A 404 6.772 6.051 5.118 1.00 1.07 O ATOM 365 CG2 THR A 404 7.190 8.413 4.877 1.00 0.89 C ATOM 0 H THR A 404 5.155 5.244 4.215 1.00 0.82 H new ATOM 0 HA THR A 404 4.669 8.038 4.699 1.00 0.81 H new ATOM 0 HB THR A 404 7.118 6.949 3.299 1.00 0.89 H new ATOM 0 HG1 THR A 404 7.727 5.914 5.291 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.252 8.262 5.071 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.061 9.258 4.200 1.00 0.89 H new ATOM 0 HG23 THR A 404 6.676 8.618 5.816 1.00 0.89 H new ATOM 373 N LEU A 405 4.985 7.187 1.554 1.00 0.67 N ATOM 374 CA LEU A 405 4.771 7.714 0.177 1.00 0.61 C ATOM 375 C LEU A 405 3.283 7.998 -0.035 1.00 0.53 C ATOM 376 O LEU A 405 2.908 8.894 -0.762 1.00 0.52 O ATOM 377 CB LEU A 405 5.256 6.588 -0.750 1.00 0.67 C ATOM 378 CG LEU A 405 5.201 7.018 -2.227 1.00 0.65 C ATOM 379 CD1 LEU A 405 3.752 7.011 -2.715 1.00 0.57 C ATOM 380 CD2 LEU A 405 5.793 8.424 -2.397 1.00 0.64 C ATOM 0 H LEU A 405 5.197 6.191 1.608 1.00 0.67 H new ATOM 0 HA LEU A 405 5.303 8.647 -0.012 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.277 6.312 -0.487 1.00 0.67 H new ATOM 0 HB3 LEU A 405 4.638 5.702 -0.604 1.00 0.67 H new ATOM 0 HG LEU A 405 5.787 6.314 -2.817 1.00 0.65 H new ATOM 0 HD11 LEU A 405 3.719 7.316 -3.761 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.340 6.007 -2.617 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.163 7.705 -2.116 1.00 0.57 H new ATOM 0 HD21 LEU A 405 5.747 8.714 -3.447 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.222 9.134 -1.799 1.00 0.64 H new ATOM 0 HD23 LEU A 405 6.831 8.424 -2.066 1.00 0.64 H new ATOM 392 N LEU A 406 2.435 7.234 0.596 1.00 0.53 N ATOM 393 CA LEU A 406 0.970 7.444 0.437 1.00 0.50 C ATOM 394 C LEU A 406 0.522 8.673 1.231 1.00 0.49 C ATOM 395 O LEU A 406 -0.371 9.391 0.830 1.00 0.45 O ATOM 396 CB LEU A 406 0.329 6.171 0.996 1.00 0.58 C ATOM 397 CG LEU A 406 -0.970 5.882 0.241 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.661 5.655 -1.240 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.628 4.627 0.815 1.00 1.02 C ATOM 0 H LEU A 406 2.696 6.469 1.218 1.00 0.53 H new ATOM 0 HA LEU A 406 0.685 7.621 -0.600 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.016 5.331 0.895 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.125 6.290 2.060 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.645 6.731 0.349 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.587 5.449 -1.777 1.00 0.94 H new ATOM 0 HD12 LEU A 406 -0.191 6.547 -1.655 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.016 4.807 -1.345 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.553 4.422 0.276 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.951 3.780 0.708 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.850 4.783 1.871 1.00 1.02 H new ATOM 411 N ALA A 407 1.139 8.924 2.353 1.00 0.56 N ATOM 412 CA ALA A 407 0.748 10.111 3.165 1.00 0.59 C ATOM 413 C ALA A 407 1.139 11.394 2.428 1.00 0.57 C ATOM 414 O ALA A 407 0.369 12.331 2.341 1.00 0.61 O ATOM 415 CB ALA A 407 1.535 9.978 4.468 1.00 0.70 C ATOM 0 H ALA A 407 1.895 8.360 2.742 1.00 0.56 H new ATOM 0 HA ALA A 407 -0.326 10.158 3.346 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.301 10.818 5.122 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.264 9.046 4.963 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.603 9.975 4.249 1.00 0.70 H new ATOM 421 N GLN A 408 2.329 11.443 1.894 1.00 0.57 N ATOM 422 CA GLN A 408 2.767 12.663 1.161 1.00 0.57 C ATOM 423 C GLN A 408 2.122 12.703 -0.227 1.00 0.50 C ATOM 424 O GLN A 408 1.768 13.752 -0.728 1.00 0.50 O ATOM 425 CB GLN A 408 4.286 12.534 1.048 1.00 0.62 C ATOM 426 CG GLN A 408 4.929 12.916 2.382 1.00 0.75 C ATOM 427 CD GLN A 408 6.265 13.615 2.126 1.00 0.78 C ATOM 428 OE1 GLN A 408 6.460 14.744 2.529 1.00 1.29 O ATOM 429 NE2 GLN A 408 7.200 12.989 1.465 1.00 1.46 N ATOM 0 H GLN A 408 3.016 10.690 1.934 1.00 0.57 H new ATOM 0 HA GLN A 408 2.476 13.581 1.672 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.556 11.512 0.781 1.00 0.62 H new ATOM 0 HB3 GLN A 408 4.659 13.181 0.254 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.265 13.574 2.942 1.00 0.75 H new ATOM 0 HG3 GLN A 408 5.084 12.025 2.991 1.00 0.75 H new ATOM 0 HE21 GLN A 408 7.037 12.041 1.126 1.00 1.46 H new ATOM 0 HE22 GLN A 408 8.093 13.448 1.287 1.00 1.46 H new ATOM 438 N TRP A 409 1.962 11.567 -0.851 1.00 0.46 N ATOM 439 CA TRP A 409 1.335 11.540 -2.204 1.00 0.43 C ATOM 440 C TRP A 409 -0.132 11.976 -2.103 1.00 0.40 C ATOM 441 O TRP A 409 -0.574 12.867 -2.801 1.00 0.41 O ATOM 442 CB TRP A 409 1.452 10.081 -2.659 1.00 0.43 C ATOM 443 CG TRP A 409 0.629 9.853 -3.889 1.00 0.42 C ATOM 444 CD1 TRP A 409 0.948 10.280 -5.134 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.640 9.150 -4.008 1.00 0.40 C ATOM 446 NE1 TRP A 409 -0.047 9.885 -6.014 1.00 0.53 N ATOM 447 CE2 TRP A 409 -1.049 9.185 -5.372 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.475 8.487 -3.072 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -2.248 8.583 -5.796 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.683 7.879 -3.492 1.00 0.43 C ATOM 451 CH2 TRP A 409 -3.068 7.928 -4.853 1.00 0.48 C ATOM 0 H TRP A 409 2.238 10.657 -0.483 1.00 0.46 H new ATOM 0 HA TRP A 409 1.815 12.218 -2.910 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.495 9.838 -2.861 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.119 9.416 -1.862 1.00 0.43 H new ATOM 0 HD1 TRP A 409 1.834 10.838 -5.398 1.00 0.50 H new ATOM 0 HE1 TRP A 409 -0.040 10.087 -7.014 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -1.187 8.446 -2.032 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -2.538 8.622 -6.835 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -3.312 7.377 -2.772 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -3.990 7.464 -5.170 1.00 0.48 H new ATOM 462 N ALA A 410 -0.887 11.357 -1.236 1.00 0.42 N ATOM 463 CA ALA A 410 -2.320 11.742 -1.092 1.00 0.44 C ATOM 464 C ALA A 410 -2.433 13.247 -0.836 1.00 0.45 C ATOM 465 O ALA A 410 -3.412 13.875 -1.186 1.00 0.47 O ATOM 466 CB ALA A 410 -2.825 10.949 0.114 1.00 0.51 C ATOM 0 H ALA A 410 -0.575 10.604 -0.623 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.901 11.527 -1.989 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.877 11.178 0.286 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.713 9.882 -0.079 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -2.246 11.220 0.996 1.00 0.51 H new ATOM 472 N ASP A 411 -1.433 13.828 -0.233 1.00 0.48 N ATOM 473 CA ASP A 411 -1.474 15.293 0.039 1.00 0.53 C ATOM 474 C ASP A 411 -1.092 16.068 -1.224 1.00 0.53 C ATOM 475 O ASP A 411 -1.796 16.959 -1.657 1.00 0.58 O ATOM 476 CB ASP A 411 -0.441 15.520 1.143 1.00 0.60 C ATOM 477 CG ASP A 411 -0.820 16.764 1.948 1.00 1.03 C ATOM 478 OD1 ASP A 411 -1.276 17.721 1.345 1.00 1.78 O ATOM 479 OD2 ASP A 411 -0.648 16.738 3.156 1.00 1.51 O ATOM 0 H ASP A 411 -0.588 13.352 0.084 1.00 0.48 H new ATOM 0 HA ASP A 411 -2.466 15.634 0.336 1.00 0.53 H new ATOM 0 HB2 ASP A 411 -0.396 14.650 1.798 1.00 0.60 H new ATOM 0 HB3 ASP A 411 0.551 15.643 0.708 1.00 0.60 H new ATOM 484 N ARG A 412 0.018 15.730 -1.822 1.00 0.51 N ATOM 485 CA ARG A 412 0.446 16.441 -3.060 1.00 0.56 C ATOM 486 C ARG A 412 -0.674 16.388 -4.102 1.00 0.55 C ATOM 487 O ARG A 412 -0.828 17.283 -4.909 1.00 0.63 O ATOM 488 CB ARG A 412 1.674 15.675 -3.551 1.00 0.58 C ATOM 489 CG ARG A 412 2.693 16.659 -4.128 1.00 0.96 C ATOM 490 CD ARG A 412 4.079 16.011 -4.136 1.00 1.50 C ATOM 491 NE ARG A 412 5.014 17.107 -4.507 1.00 1.90 N ATOM 492 CZ ARG A 412 6.193 16.823 -4.989 1.00 2.41 C ATOM 493 NH1 ARG A 412 6.316 15.907 -5.911 1.00 2.89 N ATOM 494 NH2 ARG A 412 7.247 17.452 -4.549 1.00 3.02 N ATOM 0 H ARG A 412 0.647 14.992 -1.506 1.00 0.51 H new ATOM 0 HA ARG A 412 0.670 17.493 -2.882 1.00 0.56 H new ATOM 0 HB2 ARG A 412 2.119 15.115 -2.729 1.00 0.58 H new ATOM 0 HB3 ARG A 412 1.383 14.949 -4.310 1.00 0.58 H new ATOM 0 HG2 ARG A 412 2.407 16.944 -5.141 1.00 0.96 H new ATOM 0 HG3 ARG A 412 2.710 17.572 -3.533 1.00 0.96 H new ATOM 0 HD2 ARG A 412 4.326 15.595 -3.159 1.00 1.50 H new ATOM 0 HD3 ARG A 412 4.127 15.191 -4.853 1.00 1.50 H new ATOM 0 HE ARG A 412 4.734 18.080 -4.385 1.00 1.90 H new ATOM 0 HH11 ARG A 412 5.491 15.414 -6.254 1.00 2.89 H new ATOM 0 HH12 ARG A 412 7.237 15.684 -6.289 1.00 2.89 H new ATOM 0 HH21 ARG A 412 7.150 18.167 -3.828 1.00 3.02 H new ATOM 0 HH22 ARG A 412 8.168 17.229 -4.926 1.00 3.02 H new ATOM 508 N ALA A 413 -1.458 15.347 -4.086 1.00 0.50 N ATOM 509 CA ALA A 413 -2.570 15.234 -5.069 1.00 0.53 C ATOM 510 C ALA A 413 -3.770 16.059 -4.597 1.00 0.57 C ATOM 511 O ALA A 413 -4.473 16.658 -5.386 1.00 0.66 O ATOM 512 CB ALA A 413 -2.921 13.746 -5.103 1.00 0.53 C ATOM 0 H ALA A 413 -1.376 14.568 -3.433 1.00 0.50 H new ATOM 0 HA ALA A 413 -2.293 15.607 -6.055 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -3.736 13.580 -5.808 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -2.048 13.173 -5.417 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -3.229 13.422 -4.109 1.00 0.53 H new ATOM 518 N LEU A 414 -4.006 16.096 -3.314 1.00 0.54 N ATOM 519 CA LEU A 414 -5.157 16.885 -2.789 1.00 0.61 C ATOM 520 C LEU A 414 -5.050 18.339 -3.256 1.00 0.71 C ATOM 521 O LEU A 414 -6.028 18.960 -3.619 1.00 0.82 O ATOM 522 CB LEU A 414 -5.037 16.801 -1.266 1.00 0.63 C ATOM 523 CG LEU A 414 -6.344 16.269 -0.678 1.00 0.71 C ATOM 524 CD1 LEU A 414 -6.542 14.814 -1.103 1.00 1.11 C ATOM 525 CD2 LEU A 414 -6.283 16.349 0.849 1.00 1.04 C ATOM 0 H LEU A 414 -3.452 15.614 -2.606 1.00 0.54 H new ATOM 0 HA LEU A 414 -6.116 16.504 -3.141 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -4.210 16.146 -0.992 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -4.815 17.785 -0.854 1.00 0.63 H new ATOM 0 HG LEU A 414 -7.177 16.870 -1.043 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -7.474 14.436 -0.683 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -6.584 14.755 -2.191 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -5.710 14.212 -0.739 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -7.214 15.970 1.271 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -5.449 15.748 1.212 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -6.142 17.386 1.154 1.00 1.04 H new ATOM 537 N ARG A 415 -3.863 18.884 -3.250 1.00 0.73 N ATOM 538 CA ARG A 415 -3.690 20.297 -3.694 1.00 0.86 C ATOM 539 C ARG A 415 -4.241 20.478 -5.110 1.00 0.92 C ATOM 540 O ARG A 415 -4.756 21.523 -5.458 1.00 1.26 O ATOM 541 CB ARG A 415 -2.179 20.534 -3.676 1.00 1.01 C ATOM 542 CG ARG A 415 -1.769 21.108 -2.318 1.00 1.40 C ATOM 543 CD ARG A 415 -0.340 21.648 -2.403 1.00 1.61 C ATOM 544 NE ARG A 415 0.071 21.874 -0.991 1.00 2.27 N ATOM 545 CZ ARG A 415 -0.480 22.833 -0.297 1.00 2.92 C ATOM 546 NH1 ARG A 415 -1.664 22.665 0.223 1.00 3.70 N ATOM 547 NH2 ARG A 415 0.156 23.959 -0.123 1.00 3.32 N ATOM 0 H ARG A 415 -3.007 18.413 -2.957 1.00 0.73 H new ATOM 0 HA ARG A 415 -4.223 20.999 -3.053 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -1.651 19.599 -3.862 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -1.898 21.222 -4.473 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -2.453 21.905 -2.026 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -1.833 20.336 -1.551 1.00 1.40 H new ATOM 0 HD2 ARG A 415 0.322 20.937 -2.898 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -0.301 22.573 -2.978 1.00 1.61 H new ATOM 0 HE ARG A 415 0.783 21.280 -0.565 1.00 2.27 H new ATOM 0 HH11 ARG A 415 -2.160 21.784 0.088 1.00 3.70 H new ATOM 0 HH12 ARG A 415 -2.094 23.414 0.765 1.00 3.70 H new ATOM 0 HH21 ARG A 415 1.083 24.089 -0.529 1.00 3.32 H new ATOM 0 HH22 ARG A 415 -0.273 24.709 0.419 1.00 3.32 H new ATOM 561 N SER A 416 -4.136 19.468 -5.927 1.00 0.90 N ATOM 562 CA SER A 416 -4.653 19.580 -7.322 1.00 0.99 C ATOM 563 C SER A 416 -6.129 19.180 -7.372 1.00 0.99 C ATOM 564 O SER A 416 -6.933 19.819 -8.022 1.00 1.63 O ATOM 565 CB SER A 416 -3.805 18.604 -8.136 1.00 1.20 C ATOM 566 OG SER A 416 -2.873 19.334 -8.922 1.00 1.69 O ATOM 0 H SER A 416 -3.715 18.569 -5.691 1.00 0.90 H new ATOM 0 HA SER A 416 -4.587 20.597 -7.708 1.00 0.99 H new ATOM 0 HB2 SER A 416 -3.279 17.919 -7.471 1.00 1.20 H new ATOM 0 HB3 SER A 416 -4.444 17.998 -8.778 1.00 1.20 H new ATOM 0 HG SER A 416 -2.326 18.710 -9.444 1.00 1.69 H new ATOM 572 N GLY A 417 -6.493 18.129 -6.690 1.00 1.06 N ATOM 573 CA GLY A 417 -7.915 17.691 -6.698 1.00 1.06 C ATOM 574 C GLY A 417 -8.014 16.276 -7.273 1.00 0.99 C ATOM 575 O GLY A 417 -8.919 15.960 -8.020 1.00 1.31 O ATOM 0 H GLY A 417 -5.865 17.555 -6.127 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -8.318 17.712 -5.685 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -8.515 18.379 -7.294 1.00 1.06 H new ATOM 579 N HIS A 418 -7.089 15.421 -6.931 1.00 0.78 N ATOM 580 CA HIS A 418 -7.132 14.027 -7.458 1.00 0.87 C ATOM 581 C HIS A 418 -8.444 13.348 -7.057 1.00 0.89 C ATOM 582 O HIS A 418 -8.665 13.034 -5.905 1.00 1.17 O ATOM 583 CB HIS A 418 -5.947 13.324 -6.816 1.00 1.01 C ATOM 584 CG HIS A 418 -4.919 13.002 -7.867 1.00 1.68 C ATOM 585 ND1 HIS A 418 -4.574 13.902 -8.862 1.00 2.18 N ATOM 586 CD2 HIS A 418 -4.153 11.885 -8.089 1.00 2.31 C ATOM 587 CE1 HIS A 418 -3.637 13.317 -9.631 1.00 2.86 C ATOM 588 NE2 HIS A 418 -3.345 12.086 -9.204 1.00 2.97 N ATOM 0 H HIS A 418 -6.306 15.627 -6.310 1.00 0.78 H new ATOM 0 HA HIS A 418 -7.081 13.997 -8.546 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -5.508 13.959 -6.047 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -6.277 12.409 -6.324 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -4.174 10.987 -7.490 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -3.178 13.786 -10.489 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -2.674 11.433 -9.608 1.00 2.97 H new ATOM 596 N GLN A 419 -9.317 13.121 -8.000 1.00 1.08 N ATOM 597 CA GLN A 419 -10.615 12.464 -7.672 1.00 1.25 C ATOM 598 C GLN A 419 -10.403 10.967 -7.422 1.00 1.03 C ATOM 599 O GLN A 419 -10.929 10.406 -6.481 1.00 1.28 O ATOM 600 CB GLN A 419 -11.491 12.684 -8.905 1.00 1.71 C ATOM 601 CG GLN A 419 -12.536 13.760 -8.604 1.00 2.33 C ATOM 602 CD GLN A 419 -13.858 13.392 -9.278 1.00 2.91 C ATOM 603 OE1 GLN A 419 -13.894 13.114 -10.461 1.00 3.29 O ATOM 604 NE2 GLN A 419 -14.956 13.376 -8.571 1.00 3.52 N ATOM 0 H GLN A 419 -9.188 13.362 -8.983 1.00 1.08 H new ATOM 0 HA GLN A 419 -11.070 12.874 -6.770 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -10.875 12.987 -9.752 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -11.983 11.753 -9.185 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -12.678 13.852 -7.527 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -12.190 14.729 -8.964 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -14.927 13.609 -7.578 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -15.843 13.130 -9.011 1.00 3.52 H new ATOM 613 N ASN A 420 -9.639 10.319 -8.257 1.00 0.78 N ATOM 614 CA ASN A 420 -9.395 8.861 -8.067 1.00 0.70 C ATOM 615 C ASN A 420 -8.231 8.639 -7.097 1.00 0.58 C ATOM 616 O ASN A 420 -7.273 7.960 -7.408 1.00 0.71 O ATOM 617 CB ASN A 420 -9.043 8.333 -9.458 1.00 0.86 C ATOM 618 CG ASN A 420 -10.198 8.615 -10.421 1.00 1.35 C ATOM 619 OD1 ASN A 420 -10.027 9.298 -11.410 1.00 1.96 O ATOM 620 ND2 ASN A 420 -11.377 8.112 -10.172 1.00 1.88 N ATOM 0 H ASN A 420 -9.173 10.736 -9.063 1.00 0.78 H new ATOM 0 HA ASN A 420 -10.260 8.350 -7.644 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -8.131 8.809 -9.819 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -8.847 7.262 -9.413 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -12.153 8.293 -10.808 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -11.522 7.538 -9.341 1.00 1.88 H new ATOM 627 N LEU A 421 -8.308 9.205 -5.924 1.00 0.45 N ATOM 628 CA LEU A 421 -7.206 9.028 -4.935 1.00 0.40 C ATOM 629 C LEU A 421 -7.042 7.546 -4.583 1.00 0.39 C ATOM 630 O LEU A 421 -6.096 6.902 -4.988 1.00 0.53 O ATOM 631 CB LEU A 421 -7.643 9.825 -3.707 1.00 0.42 C ATOM 632 CG LEU A 421 -6.732 11.041 -3.534 1.00 0.39 C ATOM 633 CD1 LEU A 421 -7.415 12.064 -2.626 1.00 0.50 C ATOM 634 CD2 LEU A 421 -5.411 10.600 -2.898 1.00 0.41 C ATOM 0 H LEU A 421 -9.087 9.783 -5.607 1.00 0.45 H new ATOM 0 HA LEU A 421 -6.246 9.370 -5.322 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -8.678 10.147 -3.819 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -7.599 9.196 -2.818 1.00 0.42 H new ATOM 0 HG LEU A 421 -6.537 11.491 -4.507 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.766 12.931 -2.502 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -8.357 12.377 -3.075 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.609 11.614 -1.652 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.760 11.465 -2.774 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.608 10.151 -1.924 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.923 9.869 -3.542 1.00 0.41 H new ATOM 646 N LEU A 422 -7.959 7.002 -3.830 1.00 0.33 N ATOM 647 CA LEU A 422 -7.856 5.563 -3.451 1.00 0.34 C ATOM 648 C LEU A 422 -7.943 4.679 -4.697 1.00 0.35 C ATOM 649 O LEU A 422 -7.428 3.579 -4.727 1.00 0.37 O ATOM 650 CB LEU A 422 -9.051 5.311 -2.529 1.00 0.37 C ATOM 651 CG LEU A 422 -8.623 5.508 -1.075 1.00 0.38 C ATOM 652 CD1 LEU A 422 -9.837 5.340 -0.158 1.00 0.58 C ATOM 653 CD2 LEU A 422 -7.563 4.466 -0.710 1.00 0.63 C ATOM 0 H LEU A 422 -8.775 7.491 -3.461 1.00 0.33 H new ATOM 0 HA LEU A 422 -6.909 5.331 -2.964 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.864 5.993 -2.775 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.429 4.299 -2.674 1.00 0.37 H new ATOM 0 HG LEU A 422 -8.209 6.509 -0.951 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -9.532 5.480 0.879 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.594 6.080 -0.417 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -10.251 4.339 -0.282 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -7.257 4.606 0.327 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -7.978 3.466 -0.834 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -6.698 4.583 -1.362 1.00 0.63 H new ATOM 665 N SER A 423 -8.593 5.151 -5.723 1.00 0.35 N ATOM 666 CA SER A 423 -8.715 4.339 -6.967 1.00 0.38 C ATOM 667 C SER A 423 -7.334 4.098 -7.586 1.00 0.36 C ATOM 668 O SER A 423 -7.156 3.214 -8.402 1.00 0.40 O ATOM 669 CB SER A 423 -9.582 5.180 -7.903 1.00 0.44 C ATOM 670 OG SER A 423 -10.877 4.600 -7.991 1.00 1.23 O ATOM 0 H SER A 423 -9.046 6.064 -5.755 1.00 0.35 H new ATOM 0 HA SER A 423 -9.150 3.358 -6.777 1.00 0.38 H new ATOM 0 HB2 SER A 423 -9.653 6.202 -7.531 1.00 0.44 H new ATOM 0 HB3 SER A 423 -9.126 5.231 -8.892 1.00 0.44 H new ATOM 0 HG SER A 423 -11.436 5.138 -8.589 1.00 1.23 H new ATOM 676 N GLU A 424 -6.355 4.876 -7.210 1.00 0.34 N ATOM 677 CA GLU A 424 -4.991 4.686 -7.783 1.00 0.36 C ATOM 678 C GLU A 424 -4.226 3.619 -6.996 1.00 0.32 C ATOM 679 O GLU A 424 -3.654 2.708 -7.562 1.00 0.33 O ATOM 680 CB GLU A 424 -4.311 6.048 -7.642 1.00 0.38 C ATOM 681 CG GLU A 424 -4.067 6.641 -9.031 1.00 0.58 C ATOM 682 CD GLU A 424 -3.836 8.149 -8.910 1.00 0.81 C ATOM 683 OE1 GLU A 424 -4.388 8.741 -7.998 1.00 1.22 O ATOM 684 OE2 GLU A 424 -3.113 8.686 -9.732 1.00 1.54 O ATOM 0 H GLU A 424 -6.440 5.633 -6.532 1.00 0.34 H new ATOM 0 HA GLU A 424 -5.023 4.350 -8.819 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.936 6.719 -7.053 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -3.366 5.942 -7.109 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -3.202 6.166 -9.494 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -4.922 6.444 -9.677 1.00 0.58 H new ATOM 691 N ALA A 425 -4.209 3.723 -5.694 1.00 0.31 N ATOM 692 CA ALA A 425 -3.477 2.714 -4.875 1.00 0.29 C ATOM 693 C ALA A 425 -4.316 1.440 -4.705 1.00 0.28 C ATOM 694 O ALA A 425 -3.859 0.457 -4.155 1.00 0.28 O ATOM 695 CB ALA A 425 -3.254 3.390 -3.522 1.00 0.29 C ATOM 0 H ALA A 425 -4.670 4.462 -5.163 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.541 2.411 -5.344 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.719 2.710 -2.859 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.667 4.298 -3.661 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -4.217 3.645 -3.080 1.00 0.29 H new ATOM 701 N GLN A 426 -5.539 1.444 -5.167 1.00 0.30 N ATOM 702 CA GLN A 426 -6.395 0.230 -5.024 1.00 0.31 C ATOM 703 C GLN A 426 -5.726 -0.987 -5.676 1.00 0.30 C ATOM 704 O GLN A 426 -5.501 -1.987 -5.023 1.00 0.30 O ATOM 705 CB GLN A 426 -7.698 0.574 -5.746 1.00 0.36 C ATOM 706 CG GLN A 426 -8.866 0.496 -4.759 1.00 0.45 C ATOM 707 CD GLN A 426 -10.089 1.191 -5.358 1.00 0.54 C ATOM 708 OE1 GLN A 426 -10.607 0.767 -6.372 1.00 1.23 O ATOM 709 NE2 GLN A 426 -10.576 2.250 -4.771 1.00 1.09 N ATOM 0 H GLN A 426 -5.981 2.234 -5.636 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.561 -0.028 -3.978 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.636 1.575 -6.174 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.861 -0.117 -6.573 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -9.099 -0.545 -4.537 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -8.591 0.969 -3.816 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -10.142 2.606 -3.920 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.391 2.721 -5.163 1.00 1.09 H new ATOM 718 N PRO A 427 -5.430 -0.871 -6.949 1.00 0.32 N ATOM 719 CA PRO A 427 -4.787 -1.995 -7.675 1.00 0.34 C ATOM 720 C PRO A 427 -3.343 -2.183 -7.205 1.00 0.31 C ATOM 721 O PRO A 427 -2.756 -3.232 -7.381 1.00 0.35 O ATOM 722 CB PRO A 427 -4.840 -1.558 -9.138 1.00 0.39 C ATOM 723 CG PRO A 427 -4.922 -0.067 -9.090 1.00 0.38 C ATOM 724 CD PRO A 427 -5.656 0.288 -7.824 1.00 0.35 C ATOM 0 HA PRO A 427 -5.282 -2.952 -7.507 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -3.955 -1.888 -9.681 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.704 -1.985 -9.647 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.926 0.375 -9.096 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -5.448 0.320 -9.963 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -5.268 1.205 -7.381 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.718 0.448 -8.009 1.00 0.35 H new ATOM 732 N GLU A 428 -2.767 -1.181 -6.598 1.00 0.29 N ATOM 733 CA GLU A 428 -1.365 -1.318 -6.111 1.00 0.29 C ATOM 734 C GLU A 428 -1.299 -2.399 -5.030 1.00 0.27 C ATOM 735 O GLU A 428 -0.551 -3.350 -5.132 1.00 0.32 O ATOM 736 CB GLU A 428 -1.008 0.049 -5.530 1.00 0.29 C ATOM 737 CG GLU A 428 0.343 0.504 -6.089 1.00 0.71 C ATOM 738 CD GLU A 428 0.223 0.754 -7.596 1.00 1.37 C ATOM 739 OE1 GLU A 428 -0.817 0.437 -8.152 1.00 2.07 O ATOM 740 OE2 GLU A 428 1.174 1.259 -8.168 1.00 2.12 O ATOM 0 H GLU A 428 -3.205 -0.277 -6.419 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.674 -1.610 -6.902 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.781 0.776 -5.781 1.00 0.29 H new ATOM 0 HB3 GLU A 428 -0.964 -0.007 -4.442 1.00 0.29 H new ATOM 0 HG2 GLU A 428 0.668 1.414 -5.585 1.00 0.71 H new ATOM 0 HG3 GLU A 428 1.101 -0.255 -5.896 1.00 0.71 H new ATOM 747 N LEU A 429 -2.086 -2.264 -3.996 1.00 0.26 N ATOM 748 CA LEU A 429 -2.078 -3.289 -2.914 1.00 0.26 C ATOM 749 C LEU A 429 -2.604 -4.620 -3.460 1.00 0.25 C ATOM 750 O LEU A 429 -2.053 -5.671 -3.199 1.00 0.28 O ATOM 751 CB LEU A 429 -3.015 -2.730 -1.835 1.00 0.26 C ATOM 752 CG LEU A 429 -3.284 -3.799 -0.771 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.854 -3.280 0.602 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.779 -4.123 -0.744 1.00 0.56 C ATOM 0 H LEU A 429 -2.733 -1.489 -3.855 1.00 0.26 H new ATOM 0 HA LEU A 429 -1.080 -3.479 -2.519 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.567 -1.850 -1.373 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -3.954 -2.410 -2.287 1.00 0.26 H new ATOM 0 HG LEU A 429 -2.717 -4.698 -1.012 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -3.047 -4.043 1.356 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.789 -3.047 0.586 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -3.419 -2.380 0.844 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -4.973 -4.884 0.012 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -5.342 -3.221 -0.505 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -5.088 -4.495 -1.721 1.00 0.56 H new ATOM 766 N GLU A 430 -3.666 -4.582 -4.218 1.00 0.27 N ATOM 767 CA GLU A 430 -4.224 -5.845 -4.782 1.00 0.28 C ATOM 768 C GLU A 430 -3.164 -6.554 -5.629 1.00 0.30 C ATOM 769 O GLU A 430 -3.118 -7.766 -5.696 1.00 0.33 O ATOM 770 CB GLU A 430 -5.400 -5.405 -5.653 1.00 0.30 C ATOM 771 CG GLU A 430 -6.712 -5.647 -4.903 1.00 0.61 C ATOM 772 CD GLU A 430 -7.223 -4.325 -4.327 1.00 1.45 C ATOM 773 OE1 GLU A 430 -6.589 -3.813 -3.419 1.00 2.05 O ATOM 774 OE2 GLU A 430 -8.239 -3.848 -4.804 1.00 2.18 O ATOM 0 H GLU A 430 -4.171 -3.733 -4.471 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.533 -6.545 -4.006 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -5.303 -4.349 -5.906 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.398 -5.959 -6.592 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -7.455 -6.073 -5.577 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -6.557 -6.369 -4.101 1.00 0.61 H new ATOM 781 N ARG A 431 -2.312 -5.806 -6.275 1.00 0.33 N ATOM 782 CA ARG A 431 -1.255 -6.435 -7.118 1.00 0.37 C ATOM 783 C ARG A 431 -0.223 -7.138 -6.232 1.00 0.36 C ATOM 784 O ARG A 431 0.170 -8.258 -6.490 1.00 0.38 O ATOM 785 CB ARG A 431 -0.612 -5.276 -7.878 1.00 0.41 C ATOM 786 CG ARG A 431 0.338 -5.827 -8.943 1.00 0.59 C ATOM 787 CD ARG A 431 -0.309 -5.693 -10.323 1.00 1.32 C ATOM 788 NE ARG A 431 0.814 -5.840 -11.289 1.00 1.56 N ATOM 789 CZ ARG A 431 0.587 -5.758 -12.572 1.00 2.19 C ATOM 790 NH1 ARG A 431 -0.141 -6.665 -13.163 1.00 2.87 N ATOM 791 NH2 ARG A 431 1.089 -4.771 -13.261 1.00 2.78 N ATOM 0 H ARG A 431 -2.302 -4.786 -6.256 1.00 0.33 H new ATOM 0 HA ARG A 431 -1.659 -7.189 -7.794 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.382 -4.662 -8.345 1.00 0.41 H new ATOM 0 HB3 ARG A 431 -0.067 -4.633 -7.187 1.00 0.41 H new ATOM 0 HG2 ARG A 431 1.283 -5.284 -8.918 1.00 0.59 H new ATOM 0 HG3 ARG A 431 0.566 -6.873 -8.736 1.00 0.59 H new ATOM 0 HD2 ARG A 431 -1.068 -6.460 -10.480 1.00 1.32 H new ATOM 0 HD3 ARG A 431 -0.803 -4.728 -10.436 1.00 1.32 H new ATOM 0 HE ARG A 431 1.761 -6.005 -10.948 1.00 1.56 H new ATOM 0 HH11 ARG A 431 -0.532 -7.437 -12.623 1.00 2.87 H new ATOM 0 HH12 ARG A 431 -0.319 -6.602 -14.165 1.00 2.87 H new ATOM 0 HH21 ARG A 431 1.659 -4.063 -12.797 1.00 2.78 H new ATOM 0 HH22 ARG A 431 0.912 -4.707 -14.263 1.00 2.78 H new ATOM 805 N THR A 432 0.220 -6.489 -5.191 1.00 0.41 N ATOM 806 CA THR A 432 1.229 -7.123 -4.293 1.00 0.45 C ATOM 807 C THR A 432 0.697 -8.455 -3.755 1.00 0.40 C ATOM 808 O THR A 432 1.355 -9.473 -3.834 1.00 0.56 O ATOM 809 CB THR A 432 1.425 -6.125 -3.151 1.00 0.53 C ATOM 810 OG1 THR A 432 1.706 -4.841 -3.690 1.00 0.61 O ATOM 811 CG2 THR A 432 2.592 -6.577 -2.272 1.00 0.62 C ATOM 0 H THR A 432 -0.071 -5.549 -4.923 1.00 0.41 H new ATOM 0 HA THR A 432 2.163 -7.340 -4.811 1.00 0.45 H new ATOM 0 HB THR A 432 0.517 -6.077 -2.550 1.00 0.53 H new ATOM 0 HG1 THR A 432 1.830 -4.200 -2.960 1.00 0.61 H new ATOM 0 HG21 THR A 432 2.731 -5.865 -1.458 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.376 -7.563 -1.859 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.501 -6.626 -2.871 1.00 0.62 H new ATOM 819 N LEU A 433 -0.488 -8.455 -3.207 1.00 0.33 N ATOM 820 CA LEU A 433 -1.058 -9.722 -2.665 1.00 0.30 C ATOM 821 C LEU A 433 -1.332 -10.709 -3.801 1.00 0.27 C ATOM 822 O LEU A 433 -0.909 -11.848 -3.763 1.00 0.25 O ATOM 823 CB LEU A 433 -2.364 -9.309 -1.985 1.00 0.37 C ATOM 824 CG LEU A 433 -2.427 -9.922 -0.586 1.00 0.42 C ATOM 825 CD1 LEU A 433 -2.364 -11.447 -0.692 1.00 0.41 C ATOM 826 CD2 LEU A 433 -1.242 -9.422 0.243 1.00 0.44 C ATOM 0 H LEU A 433 -1.085 -7.634 -3.111 1.00 0.33 H new ATOM 0 HA LEU A 433 -0.377 -10.218 -1.973 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -2.425 -8.223 -1.921 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -3.216 -9.642 -2.578 1.00 0.37 H new ATOM 0 HG LEU A 433 -3.360 -9.629 -0.104 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -2.409 -11.883 0.306 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -3.207 -11.806 -1.283 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -1.431 -11.740 -1.174 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -1.286 -9.859 1.241 1.00 0.44 H new ATOM 0 HD22 LEU A 433 -0.310 -9.715 -0.241 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -1.285 -8.336 0.320 1.00 0.44 H new ATOM 838 N LEU A 434 -2.038 -10.284 -4.814 1.00 0.32 N ATOM 839 CA LEU A 434 -2.340 -11.201 -5.952 1.00 0.32 C ATOM 840 C LEU A 434 -1.049 -11.830 -6.481 1.00 0.29 C ATOM 841 O LEU A 434 -0.985 -13.016 -6.740 1.00 0.30 O ATOM 842 CB LEU A 434 -2.981 -10.312 -7.018 1.00 0.41 C ATOM 843 CG LEU A 434 -3.643 -11.189 -8.082 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.162 -11.138 -7.912 1.00 0.84 C ATOM 845 CD2 LEU A 434 -3.269 -10.673 -9.473 1.00 1.14 C ATOM 0 H LEU A 434 -2.419 -9.342 -4.903 1.00 0.32 H new ATOM 0 HA LEU A 434 -2.995 -12.021 -5.659 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -3.721 -9.654 -6.562 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.226 -9.673 -7.476 1.00 0.41 H new ATOM 0 HG LEU A 434 -3.299 -12.217 -7.971 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -5.634 -11.763 -8.670 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.430 -11.505 -6.921 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -5.506 -10.110 -8.023 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -3.740 -11.298 -10.232 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -3.613 -9.645 -9.584 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -2.186 -10.708 -9.595 1.00 1.14 H new ATOM 857 N THR A 435 -0.017 -11.046 -6.641 1.00 0.34 N ATOM 858 CA THR A 435 1.269 -11.605 -7.149 1.00 0.37 C ATOM 859 C THR A 435 1.896 -12.517 -6.092 1.00 0.35 C ATOM 860 O THR A 435 2.362 -13.600 -6.390 1.00 0.39 O ATOM 861 CB THR A 435 2.159 -10.388 -7.405 1.00 0.45 C ATOM 862 OG1 THR A 435 1.445 -9.436 -8.182 1.00 0.52 O ATOM 863 CG2 THR A 435 3.417 -10.822 -8.159 1.00 0.55 C ATOM 0 H THR A 435 -0.008 -10.046 -6.443 1.00 0.34 H new ATOM 0 HA THR A 435 1.134 -12.204 -8.050 1.00 0.37 H new ATOM 0 HB THR A 435 2.445 -9.941 -6.453 1.00 0.45 H new ATOM 0 HG1 THR A 435 1.115 -8.720 -7.600 1.00 0.52 H new ATOM 0 HG21 THR A 435 4.050 -9.954 -8.341 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.965 -11.552 -7.563 1.00 0.55 H new ATOM 0 HG23 THR A 435 3.134 -11.270 -9.111 1.00 0.55 H new ATOM 871 N THR A 436 1.910 -12.091 -4.858 1.00 0.33 N ATOM 872 CA THR A 436 2.505 -12.937 -3.783 1.00 0.36 C ATOM 873 C THR A 436 1.767 -14.275 -3.703 1.00 0.36 C ATOM 874 O THR A 436 2.334 -15.322 -3.944 1.00 0.40 O ATOM 875 CB THR A 436 2.313 -12.136 -2.494 1.00 0.38 C ATOM 876 OG1 THR A 436 3.058 -10.929 -2.574 1.00 0.39 O ATOM 877 CG2 THR A 436 2.800 -12.961 -1.302 1.00 0.49 C ATOM 0 H THR A 436 1.536 -11.194 -4.548 1.00 0.33 H new ATOM 0 HA THR A 436 3.556 -13.163 -3.965 1.00 0.36 H new ATOM 0 HB THR A 436 1.256 -11.903 -2.364 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.444 -10.172 -2.678 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.663 -12.390 -0.384 1.00 0.49 H new ATOM 0 HG22 THR A 436 2.228 -13.887 -1.242 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.857 -13.195 -1.429 1.00 0.49 H new ATOM 885 N ALA A 437 0.504 -14.251 -3.372 1.00 0.34 N ATOM 886 CA ALA A 437 -0.267 -15.524 -3.285 1.00 0.36 C ATOM 887 C ALA A 437 -0.114 -16.315 -4.585 1.00 0.36 C ATOM 888 O ALA A 437 0.050 -17.519 -4.572 1.00 0.41 O ATOM 889 CB ALA A 437 -1.721 -15.097 -3.079 1.00 0.35 C ATOM 0 H ALA A 437 -0.026 -13.406 -3.158 1.00 0.34 H new ATOM 0 HA ALA A 437 0.081 -16.167 -2.477 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -2.353 -15.982 -3.005 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -1.803 -14.515 -2.161 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.045 -14.489 -3.924 1.00 0.35 H new ATOM 895 N LEU A 438 -0.154 -15.651 -5.710 1.00 0.34 N ATOM 896 CA LEU A 438 0.005 -16.384 -6.995 1.00 0.36 C ATOM 897 C LEU A 438 1.345 -17.119 -6.994 1.00 0.42 C ATOM 898 O LEU A 438 1.454 -18.227 -7.479 1.00 0.46 O ATOM 899 CB LEU A 438 -0.033 -15.317 -8.095 1.00 0.36 C ATOM 900 CG LEU A 438 0.350 -15.950 -9.440 1.00 0.41 C ATOM 901 CD1 LEU A 438 -0.570 -17.139 -9.733 1.00 0.42 C ATOM 902 CD2 LEU A 438 0.205 -14.916 -10.557 1.00 0.45 C ATOM 0 H LEU A 438 -0.289 -14.643 -5.793 1.00 0.34 H new ATOM 0 HA LEU A 438 -0.777 -17.127 -7.149 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.030 -14.880 -8.158 1.00 0.36 H new ATOM 0 HB3 LEU A 438 0.655 -14.507 -7.854 1.00 0.36 H new ATOM 0 HG LEU A 438 1.384 -16.292 -9.390 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -0.295 -17.585 -10.689 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -0.467 -17.882 -8.942 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -1.604 -16.797 -9.777 1.00 0.42 H new ATOM 0 HD21 LEU A 438 0.478 -15.369 -11.510 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -0.828 -14.571 -10.602 1.00 0.45 H new ATOM 0 HD23 LEU A 438 0.862 -14.069 -10.357 1.00 0.45 H new ATOM 914 N ARG A 439 2.367 -16.517 -6.443 1.00 0.43 N ATOM 915 CA ARG A 439 3.695 -17.199 -6.405 1.00 0.51 C ATOM 916 C ARG A 439 3.524 -18.604 -5.827 1.00 0.54 C ATOM 917 O ARG A 439 4.089 -19.563 -6.315 1.00 0.61 O ATOM 918 CB ARG A 439 4.566 -16.336 -5.491 1.00 0.52 C ATOM 919 CG ARG A 439 5.935 -16.126 -6.140 1.00 0.77 C ATOM 920 CD ARG A 439 6.504 -14.772 -5.707 1.00 1.28 C ATOM 921 NE ARG A 439 7.954 -14.840 -6.041 1.00 1.74 N ATOM 922 CZ ARG A 439 8.833 -14.296 -5.243 1.00 2.28 C ATOM 923 NH1 ARG A 439 8.951 -14.719 -4.016 1.00 2.82 N ATOM 924 NH2 ARG A 439 9.594 -13.328 -5.676 1.00 2.89 N ATOM 0 H ARG A 439 2.340 -15.589 -6.020 1.00 0.43 H new ATOM 0 HA ARG A 439 4.144 -17.305 -7.393 1.00 0.51 H new ATOM 0 HB2 ARG A 439 4.084 -15.374 -5.314 1.00 0.52 H new ATOM 0 HB3 ARG A 439 4.682 -16.818 -4.520 1.00 0.52 H new ATOM 0 HG2 ARG A 439 6.614 -16.927 -5.849 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.844 -16.164 -7.226 1.00 0.77 H new ATOM 0 HD2 ARG A 439 6.016 -13.952 -6.233 1.00 1.28 H new ATOM 0 HD3 ARG A 439 6.352 -14.602 -4.641 1.00 1.28 H new ATOM 0 HE ARG A 439 8.260 -15.311 -6.892 1.00 1.74 H new ATOM 0 HH11 ARG A 439 8.356 -15.476 -3.678 1.00 2.82 H new ATOM 0 HH12 ARG A 439 9.638 -14.293 -3.394 1.00 2.82 H new ATOM 0 HH21 ARG A 439 9.502 -12.997 -6.637 1.00 2.89 H new ATOM 0 HH22 ARG A 439 10.281 -12.902 -5.054 1.00 2.89 H new ATOM 938 N HIS A 440 2.718 -18.737 -4.807 1.00 0.52 N ATOM 939 CA HIS A 440 2.477 -20.083 -4.221 1.00 0.57 C ATOM 940 C HIS A 440 1.942 -21.001 -5.322 1.00 0.58 C ATOM 941 O HIS A 440 2.173 -22.194 -5.329 1.00 0.64 O ATOM 942 CB HIS A 440 1.421 -19.859 -3.136 1.00 0.56 C ATOM 943 CG HIS A 440 1.065 -21.176 -2.502 1.00 0.63 C ATOM 944 ND1 HIS A 440 1.765 -22.341 -2.775 1.00 1.04 N ATOM 945 CD2 HIS A 440 0.086 -21.528 -1.606 1.00 0.82 C ATOM 946 CE1 HIS A 440 1.203 -23.330 -2.055 1.00 0.96 C ATOM 947 NE2 HIS A 440 0.175 -22.888 -1.326 1.00 0.75 N ATOM 0 H HIS A 440 2.218 -17.971 -4.356 1.00 0.52 H new ATOM 0 HA HIS A 440 3.374 -20.544 -3.808 1.00 0.57 H new ATOM 0 HB2 HIS A 440 1.801 -19.171 -2.381 1.00 0.56 H new ATOM 0 HB3 HIS A 440 0.532 -19.399 -3.568 1.00 0.56 H new ATOM 0 HD1 HIS A 440 2.561 -22.432 -3.406 1.00 1.04 H new ATOM 0 HD2 HIS A 440 -0.642 -20.852 -1.183 1.00 0.82 H new ATOM 0 HE1 HIS A 440 1.542 -24.355 -2.066 1.00 0.96 H new ATOM 955 N THR A 441 1.244 -20.429 -6.264 1.00 0.54 N ATOM 956 CA THR A 441 0.694 -21.223 -7.398 1.00 0.55 C ATOM 957 C THR A 441 1.129 -20.569 -8.713 1.00 0.56 C ATOM 958 O THR A 441 0.322 -20.293 -9.578 1.00 0.55 O ATOM 959 CB THR A 441 -0.827 -21.150 -7.239 1.00 0.53 C ATOM 960 OG1 THR A 441 -1.257 -19.809 -7.420 1.00 0.48 O ATOM 961 CG2 THR A 441 -1.223 -21.629 -5.841 1.00 0.54 C ATOM 0 H THR A 441 1.029 -19.432 -6.296 1.00 0.54 H new ATOM 0 HA THR A 441 1.043 -22.256 -7.405 1.00 0.55 H new ATOM 0 HB THR A 441 -1.299 -21.789 -7.986 1.00 0.53 H new ATOM 0 HG1 THR A 441 -1.798 -19.746 -8.235 1.00 0.48 H new ATOM 0 HG21 THR A 441 -2.306 -21.576 -5.731 1.00 0.54 H new ATOM 0 HG22 THR A 441 -0.895 -22.659 -5.703 1.00 0.54 H new ATOM 0 HG23 THR A 441 -0.751 -20.994 -5.091 1.00 0.54 H new ATOM 969 N GLN A 442 2.407 -20.300 -8.846 1.00 0.59 N ATOM 970 CA GLN A 442 2.946 -19.641 -10.079 1.00 0.62 C ATOM 971 C GLN A 442 2.255 -20.148 -11.350 1.00 0.64 C ATOM 972 O GLN A 442 2.211 -21.332 -11.617 1.00 0.69 O ATOM 973 CB GLN A 442 4.429 -20.011 -10.101 1.00 0.69 C ATOM 974 CG GLN A 442 4.577 -21.536 -10.101 1.00 1.43 C ATOM 975 CD GLN A 442 5.988 -21.912 -9.646 1.00 1.79 C ATOM 976 OE1 GLN A 442 6.577 -21.234 -8.828 1.00 2.16 O ATOM 977 NE2 GLN A 442 6.558 -22.975 -10.145 1.00 2.47 N ATOM 0 H GLN A 442 3.111 -20.513 -8.139 1.00 0.59 H new ATOM 0 HA GLN A 442 2.776 -18.565 -10.057 1.00 0.62 H new ATOM 0 HB2 GLN A 442 4.907 -19.589 -10.985 1.00 0.69 H new ATOM 0 HB3 GLN A 442 4.933 -19.586 -9.233 1.00 0.69 H new ATOM 0 HG2 GLN A 442 3.838 -21.984 -9.437 1.00 1.43 H new ATOM 0 HG3 GLN A 442 4.388 -21.930 -11.100 1.00 1.43 H new ATOM 0 HE21 GLN A 442 6.063 -23.544 -10.832 1.00 2.47 H new ATOM 0 HE22 GLN A 442 7.498 -23.237 -9.848 1.00 2.47 H new ATOM 986 N GLY A 443 1.722 -19.251 -12.135 1.00 0.63 N ATOM 987 CA GLY A 443 1.039 -19.665 -13.391 1.00 0.66 C ATOM 988 C GLY A 443 -0.434 -19.960 -13.106 1.00 0.64 C ATOM 989 O GLY A 443 -1.316 -19.485 -13.793 1.00 0.66 O ATOM 0 H GLY A 443 1.731 -18.246 -11.959 1.00 0.63 H new ATOM 0 HA2 GLY A 443 1.123 -18.876 -14.139 1.00 0.66 H new ATOM 0 HA3 GLY A 443 1.523 -20.550 -13.805 1.00 0.66 H new ATOM 993 N HIS A 444 -0.709 -20.743 -12.098 1.00 0.62 N ATOM 994 CA HIS A 444 -2.128 -21.067 -11.775 1.00 0.62 C ATOM 995 C HIS A 444 -2.834 -19.840 -11.193 1.00 0.67 C ATOM 996 O HIS A 444 -3.072 -19.753 -10.005 1.00 1.34 O ATOM 997 CB HIS A 444 -2.053 -22.187 -10.737 1.00 0.63 C ATOM 998 CG HIS A 444 -2.016 -23.517 -11.437 1.00 0.95 C ATOM 999 ND1 HIS A 444 -1.533 -23.658 -12.729 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -2.399 -24.774 -11.041 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -1.638 -24.957 -13.060 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -2.159 -25.682 -12.067 1.00 1.86 N ATOM 0 H HIS A 444 -0.015 -21.171 -11.486 1.00 0.62 H new ATOM 0 HA HIS A 444 -2.693 -21.367 -12.657 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -1.164 -22.065 -10.118 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -2.914 -22.138 -10.071 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -2.823 -25.021 -10.079 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -1.337 -25.365 -14.014 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -2.342 -26.686 -12.062 1.00 1.86 H new ATOM 1010 N LYS A 445 -3.173 -18.891 -12.023 1.00 0.62 N ATOM 1011 CA LYS A 445 -3.867 -17.671 -11.519 1.00 0.51 C ATOM 1012 C LYS A 445 -5.203 -18.053 -10.872 1.00 0.51 C ATOM 1013 O LYS A 445 -5.756 -17.310 -10.085 1.00 0.57 O ATOM 1014 CB LYS A 445 -4.100 -16.808 -12.760 1.00 0.62 C ATOM 1015 CG LYS A 445 -4.983 -17.570 -13.752 1.00 1.31 C ATOM 1016 CD LYS A 445 -4.230 -17.764 -15.072 1.00 1.56 C ATOM 1017 CE LYS A 445 -4.949 -17.006 -16.190 1.00 2.23 C ATOM 1018 NZ LYS A 445 -4.000 -15.935 -16.599 1.00 2.52 N ATOM 0 H LYS A 445 -3.000 -18.908 -13.028 1.00 0.62 H new ATOM 0 HA LYS A 445 -3.285 -17.147 -10.761 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -4.577 -15.869 -12.479 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -3.147 -16.555 -13.225 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -5.262 -18.538 -13.336 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -5.908 -17.020 -13.927 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -3.206 -17.403 -14.975 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -4.172 -18.825 -15.317 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -5.185 -17.665 -17.026 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -5.892 -16.586 -15.839 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -4.422 -15.371 -17.364 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -3.799 -15.320 -15.785 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -3.115 -16.365 -16.934 1.00 2.52 H new ATOM 1032 N GLN A 446 -5.724 -19.204 -11.198 1.00 0.53 N ATOM 1033 CA GLN A 446 -7.024 -19.632 -10.604 1.00 0.56 C ATOM 1034 C GLN A 446 -6.844 -19.984 -9.124 1.00 0.52 C ATOM 1035 O GLN A 446 -7.584 -19.532 -8.274 1.00 0.51 O ATOM 1036 CB GLN A 446 -7.440 -20.868 -11.402 1.00 0.64 C ATOM 1037 CG GLN A 446 -8.966 -20.931 -11.488 1.00 1.11 C ATOM 1038 CD GLN A 446 -9.544 -21.261 -10.109 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -10.073 -20.399 -9.438 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -9.464 -22.482 -9.657 1.00 2.40 N ATOM 0 H GLN A 446 -5.306 -19.868 -11.850 1.00 0.53 H new ATOM 0 HA GLN A 446 -7.776 -18.844 -10.652 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -7.010 -20.829 -12.403 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -7.055 -21.769 -10.924 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -9.360 -19.978 -11.840 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -9.269 -21.688 -12.211 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -9.019 -23.206 -10.221 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -9.846 -22.712 -8.740 1.00 2.40 H new ATOM 1049 N GLU A 447 -5.863 -20.790 -8.809 1.00 0.52 N ATOM 1050 CA GLU A 447 -5.637 -21.170 -7.381 1.00 0.51 C ATOM 1051 C GLU A 447 -5.612 -19.921 -6.496 1.00 0.45 C ATOM 1052 O GLU A 447 -6.122 -19.920 -5.393 1.00 0.45 O ATOM 1053 CB GLU A 447 -4.277 -21.867 -7.365 1.00 0.53 C ATOM 1054 CG GLU A 447 -4.436 -23.285 -6.813 1.00 0.80 C ATOM 1055 CD GLU A 447 -5.215 -24.138 -7.815 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -4.690 -24.383 -8.889 1.00 1.96 O ATOM 1057 OE2 GLU A 447 -6.324 -24.533 -7.492 1.00 2.14 O ATOM 0 H GLU A 447 -5.210 -21.201 -9.476 1.00 0.52 H new ATOM 0 HA GLU A 447 -6.428 -21.814 -6.997 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -3.863 -21.902 -8.373 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -3.575 -21.303 -6.751 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -3.457 -23.726 -6.627 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -4.960 -23.258 -5.857 1.00 0.80 H new ATOM 1064 N ALA A 448 -5.027 -18.857 -6.971 1.00 0.42 N ATOM 1065 CA ALA A 448 -4.979 -17.610 -6.156 1.00 0.39 C ATOM 1066 C ALA A 448 -6.397 -17.214 -5.732 1.00 0.40 C ATOM 1067 O ALA A 448 -6.592 -16.508 -4.762 1.00 0.40 O ATOM 1068 CB ALA A 448 -4.378 -16.553 -7.082 1.00 0.39 C ATOM 0 H ALA A 448 -4.581 -18.796 -7.886 1.00 0.42 H new ATOM 0 HA ALA A 448 -4.392 -17.728 -5.245 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -4.309 -15.602 -6.553 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -3.382 -16.867 -7.395 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -5.013 -16.435 -7.960 1.00 0.39 H new ATOM 1074 N ALA A 449 -7.388 -17.669 -6.452 1.00 0.44 N ATOM 1075 CA ALA A 449 -8.793 -17.328 -6.092 1.00 0.47 C ATOM 1076 C ALA A 449 -9.071 -17.710 -4.635 1.00 0.48 C ATOM 1077 O ALA A 449 -9.223 -16.864 -3.777 1.00 0.49 O ATOM 1078 CB ALA A 449 -9.656 -18.171 -7.033 1.00 0.52 C ATOM 0 H ALA A 449 -7.284 -18.263 -7.275 1.00 0.44 H new ATOM 0 HA ALA A 449 -8.998 -16.262 -6.190 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -10.710 -17.977 -6.832 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -9.430 -17.909 -8.067 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -9.444 -19.228 -6.872 1.00 0.52 H new ATOM 1084 N ARG A 450 -9.141 -18.984 -4.354 1.00 0.49 N ATOM 1085 CA ARG A 450 -9.410 -19.432 -2.958 1.00 0.52 C ATOM 1086 C ARG A 450 -8.326 -18.908 -2.012 1.00 0.49 C ATOM 1087 O ARG A 450 -8.576 -18.645 -0.852 1.00 0.50 O ATOM 1088 CB ARG A 450 -9.370 -20.960 -3.021 1.00 0.56 C ATOM 1089 CG ARG A 450 -10.126 -21.543 -1.825 1.00 0.78 C ATOM 1090 CD ARG A 450 -10.909 -22.780 -2.269 1.00 1.37 C ATOM 1091 NE ARG A 450 -12.301 -22.297 -2.482 1.00 1.77 N ATOM 1092 CZ ARG A 450 -13.103 -22.947 -3.283 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -13.407 -24.190 -3.035 1.00 2.93 N ATOM 1094 NH2 ARG A 450 -13.601 -22.350 -4.331 1.00 2.97 N ATOM 0 H ARG A 450 -9.023 -19.735 -5.034 1.00 0.49 H new ATOM 0 HA ARG A 450 -10.364 -19.061 -2.583 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -9.818 -21.308 -3.952 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -8.337 -21.307 -3.015 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -9.426 -21.808 -1.033 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -10.806 -20.798 -1.413 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -10.494 -23.203 -3.184 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -10.874 -23.563 -1.511 1.00 1.37 H new ATOM 0 HE ARG A 450 -12.629 -21.458 -2.003 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -13.019 -24.656 -2.215 1.00 2.93 H new ATOM 0 HH12 ARG A 450 -14.033 -24.697 -3.661 1.00 2.93 H new ATOM 0 HH21 ARG A 450 -13.364 -21.377 -4.524 1.00 2.97 H new ATOM 0 HH22 ARG A 450 -14.227 -22.856 -4.957 1.00 2.97 H new ATOM 1108 N LEU A 451 -7.125 -18.754 -2.496 1.00 0.47 N ATOM 1109 CA LEU A 451 -6.028 -18.248 -1.623 1.00 0.47 C ATOM 1110 C LEU A 451 -6.401 -16.882 -1.041 1.00 0.44 C ATOM 1111 O LEU A 451 -6.023 -16.544 0.063 1.00 0.48 O ATOM 1112 CB LEU A 451 -4.814 -18.124 -2.545 1.00 0.46 C ATOM 1113 CG LEU A 451 -3.823 -19.247 -2.237 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -2.920 -19.477 -3.450 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -2.967 -18.854 -1.032 1.00 1.04 C ATOM 0 H LEU A 451 -6.855 -18.957 -3.459 1.00 0.47 H new ATOM 0 HA LEU A 451 -5.834 -18.910 -0.779 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.129 -18.178 -3.587 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -4.336 -17.154 -2.406 1.00 0.46 H new ATOM 0 HG LEU A 451 -4.370 -20.163 -2.012 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -2.213 -20.277 -3.231 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -3.529 -19.756 -4.310 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -2.373 -18.562 -3.675 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -2.260 -19.654 -0.811 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -2.420 -17.938 -1.257 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -3.610 -18.689 -0.167 1.00 1.04 H new ATOM 1127 N LEU A 452 -7.139 -16.095 -1.774 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.533 -14.751 -1.259 1.00 0.41 C ATOM 1129 C LEU A 452 -9.042 -14.703 -1.000 1.00 0.46 C ATOM 1130 O LEU A 452 -9.627 -13.643 -0.895 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.155 -13.769 -2.369 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.670 -13.911 -2.707 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.477 -13.778 -4.219 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -4.877 -12.810 -1.997 1.00 0.43 C ATOM 0 H LEU A 452 -7.486 -16.323 -2.706 1.00 0.42 H new ATOM 0 HA LEU A 452 -7.038 -14.514 -0.317 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -7.759 -13.960 -3.256 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.369 -12.748 -2.052 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.315 -14.887 -2.377 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.419 -13.879 -4.461 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.042 -14.559 -4.728 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -5.832 -12.801 -4.547 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -3.819 -12.911 -2.238 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.233 -11.834 -2.328 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -5.014 -12.900 -0.919 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.681 -15.839 -0.902 1.00 0.50 N ATOM 1147 CA GLY A 453 -11.153 -15.845 -0.659 1.00 0.56 C ATOM 1148 C GLY A 453 -11.844 -15.005 -1.732 1.00 0.58 C ATOM 1149 O GLY A 453 -12.769 -14.266 -1.462 1.00 0.68 O ATOM 0 H GLY A 453 -9.249 -16.760 -0.979 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -11.533 -16.867 -0.680 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -11.372 -15.444 0.331 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.388 -15.108 -2.949 1.00 0.54 N ATOM 1154 CA TRP A 454 -12.000 -14.312 -4.051 1.00 0.60 C ATOM 1155 C TRP A 454 -12.812 -15.218 -4.981 1.00 0.68 C ATOM 1156 O TRP A 454 -14.014 -15.090 -5.097 1.00 1.16 O ATOM 1157 CB TRP A 454 -10.809 -13.719 -4.808 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.427 -12.390 -4.230 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -10.721 -11.961 -2.976 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -9.677 -11.314 -4.865 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -10.202 -10.688 -2.803 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -9.548 -10.243 -3.933 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.098 -11.161 -6.151 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -8.868 -9.058 -4.267 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -8.411 -9.970 -6.490 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.296 -8.921 -5.549 1.00 0.52 C ATOM 0 H TRP A 454 -10.615 -15.711 -3.230 1.00 0.54 H new ATOM 0 HA TRP A 454 -12.681 -13.548 -3.676 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -9.961 -14.402 -4.756 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.061 -13.604 -5.862 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.270 -12.521 -2.234 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -10.293 -10.146 -1.944 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.182 -11.957 -6.876 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -8.784 -8.258 -3.546 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -7.973 -9.863 -7.471 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -7.770 -8.015 -5.812 1.00 0.52 H new ATOM 1177 N GLY A 455 -12.156 -16.121 -5.656 1.00 0.72 N ATOM 1178 CA GLY A 455 -12.877 -17.027 -6.594 1.00 0.72 C ATOM 1179 C GLY A 455 -12.374 -16.761 -8.014 1.00 0.70 C ATOM 1180 O GLY A 455 -11.379 -16.095 -8.208 1.00 0.64 O ATOM 0 H GLY A 455 -11.149 -16.271 -5.598 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -12.706 -18.068 -6.321 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -13.952 -16.855 -6.535 1.00 0.72 H new ATOM 1184 N ALA A 456 -13.050 -17.265 -9.009 1.00 0.77 N ATOM 1185 CA ALA A 456 -12.595 -17.021 -10.409 1.00 0.77 C ATOM 1186 C ALA A 456 -13.254 -15.753 -10.957 1.00 0.82 C ATOM 1187 O ALA A 456 -12.681 -15.039 -11.755 1.00 0.83 O ATOM 1188 CB ALA A 456 -13.050 -18.250 -11.197 1.00 0.84 C ATOM 0 H ALA A 456 -13.893 -17.832 -8.916 1.00 0.77 H new ATOM 0 HA ALA A 456 -11.517 -16.876 -10.477 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -12.751 -18.145 -12.240 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -12.589 -19.143 -10.776 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -14.135 -18.339 -11.138 1.00 0.84 H new ATOM 1194 N ALA A 457 -14.452 -15.466 -10.528 1.00 0.90 N ATOM 1195 CA ALA A 457 -15.143 -14.241 -11.020 1.00 0.97 C ATOM 1196 C ALA A 457 -14.505 -13.000 -10.393 1.00 0.89 C ATOM 1197 O ALA A 457 -14.307 -11.995 -11.046 1.00 0.91 O ATOM 1198 CB ALA A 457 -16.595 -14.391 -10.562 1.00 1.08 C ATOM 0 H ALA A 457 -14.981 -16.025 -9.859 1.00 0.90 H new ATOM 0 HA ALA A 457 -15.072 -14.128 -12.102 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -17.171 -13.524 -10.888 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -17.022 -15.295 -10.997 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -16.628 -14.461 -9.475 1.00 1.08 H new ATOM 1204 N THR A 458 -14.177 -13.064 -9.132 1.00 0.84 N ATOM 1205 CA THR A 458 -13.543 -11.891 -8.465 1.00 0.77 C ATOM 1206 C THR A 458 -12.137 -11.673 -9.028 1.00 0.68 C ATOM 1207 O THR A 458 -11.780 -10.584 -9.434 1.00 0.67 O ATOM 1208 CB THR A 458 -13.476 -12.265 -6.983 1.00 0.76 C ATOM 1209 OG1 THR A 458 -14.790 -12.502 -6.498 1.00 0.85 O ATOM 1210 CG2 THR A 458 -12.836 -11.122 -6.194 1.00 0.72 C ATOM 0 H THR A 458 -14.320 -13.878 -8.534 1.00 0.84 H new ATOM 0 HA THR A 458 -14.101 -10.968 -8.624 1.00 0.77 H new ATOM 0 HB THR A 458 -12.875 -13.166 -6.861 1.00 0.76 H new ATOM 0 HG1 THR A 458 -14.796 -13.318 -5.955 1.00 0.85 H new ATOM 0 HG21 THR A 458 -12.789 -11.390 -5.139 1.00 0.72 H new ATOM 0 HG22 THR A 458 -11.828 -10.942 -6.568 1.00 0.72 H new ATOM 0 HG23 THR A 458 -13.434 -10.218 -6.313 1.00 0.72 H new ATOM 1218 N LEU A 459 -11.339 -12.705 -9.061 1.00 0.64 N ATOM 1219 CA LEU A 459 -9.958 -12.567 -9.606 1.00 0.57 C ATOM 1220 C LEU A 459 -10.009 -11.950 -11.007 1.00 0.60 C ATOM 1221 O LEU A 459 -9.124 -11.222 -11.410 1.00 0.58 O ATOM 1222 CB LEU A 459 -9.414 -13.996 -9.665 1.00 0.56 C ATOM 1223 CG LEU A 459 -8.148 -14.099 -8.814 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -7.973 -15.538 -8.334 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -6.933 -13.696 -9.650 1.00 0.46 C ATOM 0 H LEU A 459 -11.584 -13.639 -8.734 1.00 0.64 H new ATOM 0 HA LEU A 459 -9.330 -11.919 -8.995 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -10.166 -14.697 -9.303 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -9.194 -14.270 -10.697 1.00 0.56 H new ATOM 0 HG LEU A 459 -8.236 -13.434 -7.955 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -7.071 -15.612 -7.727 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -8.837 -15.830 -7.737 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -7.887 -16.201 -9.195 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -6.032 -13.770 -9.041 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -6.846 -14.361 -10.510 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -7.054 -12.669 -9.996 1.00 0.46 H new ATOM 1237 N THR A 460 -11.044 -12.238 -11.747 1.00 0.68 N ATOM 1238 CA THR A 460 -11.163 -11.670 -13.120 1.00 0.74 C ATOM 1239 C THR A 460 -11.908 -10.334 -13.074 1.00 0.76 C ATOM 1240 O THR A 460 -11.464 -9.345 -13.624 1.00 0.75 O ATOM 1241 CB THR A 460 -11.968 -12.709 -13.904 1.00 0.83 C ATOM 1242 OG1 THR A 460 -11.244 -13.930 -13.950 1.00 0.82 O ATOM 1243 CG2 THR A 460 -12.210 -12.205 -15.328 1.00 0.92 C ATOM 0 H THR A 460 -11.814 -12.843 -11.460 1.00 0.68 H new ATOM 0 HA THR A 460 -10.193 -11.476 -13.577 1.00 0.74 H new ATOM 0 HB THR A 460 -12.927 -12.871 -13.411 1.00 0.83 H new ATOM 0 HG1 THR A 460 -11.578 -14.535 -13.255 1.00 0.82 H new ATOM 0 HG21 THR A 460 -12.783 -12.947 -15.884 1.00 0.92 H new ATOM 0 HG22 THR A 460 -12.766 -11.268 -15.293 1.00 0.92 H new ATOM 0 HG23 THR A 460 -11.253 -12.040 -15.823 1.00 0.92 H new ATOM 1251 N ALA A 461 -13.035 -10.294 -12.417 1.00 0.81 N ATOM 1252 CA ALA A 461 -13.805 -9.021 -12.333 1.00 0.85 C ATOM 1253 C ALA A 461 -12.979 -7.959 -11.604 1.00 0.79 C ATOM 1254 O ALA A 461 -12.969 -6.802 -11.976 1.00 0.83 O ATOM 1255 CB ALA A 461 -15.062 -9.367 -11.534 1.00 0.92 C ATOM 0 H ALA A 461 -13.456 -11.088 -11.935 1.00 0.81 H new ATOM 0 HA ALA A 461 -14.049 -8.618 -13.316 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -15.683 -8.477 -11.429 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -15.623 -10.142 -12.056 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -14.777 -9.729 -10.546 1.00 0.92 H new ATOM 1261 N LYS A 462 -12.286 -8.344 -10.568 1.00 0.72 N ATOM 1262 CA LYS A 462 -11.458 -7.358 -9.816 1.00 0.68 C ATOM 1263 C LYS A 462 -10.317 -6.849 -10.700 1.00 0.66 C ATOM 1264 O LYS A 462 -9.805 -5.764 -10.506 1.00 0.67 O ATOM 1265 CB LYS A 462 -10.905 -8.136 -8.622 1.00 0.66 C ATOM 1266 CG LYS A 462 -10.227 -7.167 -7.651 1.00 0.99 C ATOM 1267 CD LYS A 462 -11.039 -7.089 -6.357 1.00 0.91 C ATOM 1268 CE LYS A 462 -11.215 -5.624 -5.952 1.00 1.31 C ATOM 1269 NZ LYS A 462 -11.556 -5.665 -4.503 1.00 1.39 N ATOM 0 H LYS A 462 -12.257 -9.298 -10.209 1.00 0.72 H new ATOM 0 HA LYS A 462 -12.032 -6.486 -9.503 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -11.711 -8.669 -8.117 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -10.191 -8.886 -8.962 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -9.212 -7.502 -7.436 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -10.148 -6.178 -8.103 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -12.013 -7.558 -6.498 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -10.532 -7.638 -5.564 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -10.303 -5.053 -6.127 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -12.006 -5.146 -6.531 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -11.692 -4.696 -4.151 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -12.432 -6.209 -4.368 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -10.782 -6.119 -3.977 1.00 1.39 H new ATOM 1283 N LEU A 463 -9.913 -7.624 -11.669 1.00 0.65 N ATOM 1284 CA LEU A 463 -8.805 -7.184 -12.564 1.00 0.65 C ATOM 1285 C LEU A 463 -9.210 -5.917 -13.322 1.00 0.68 C ATOM 1286 O LEU A 463 -8.437 -4.989 -13.457 1.00 0.70 O ATOM 1287 CB LEU A 463 -8.598 -8.348 -13.534 1.00 0.68 C ATOM 1288 CG LEU A 463 -7.246 -8.195 -14.233 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -6.787 -9.558 -14.756 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -7.386 -7.221 -15.404 1.00 0.99 C ATOM 0 H LEU A 463 -10.302 -8.543 -11.880 1.00 0.65 H new ATOM 0 HA LEU A 463 -7.896 -6.946 -12.013 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -8.636 -9.295 -12.996 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -9.400 -8.368 -14.271 1.00 0.68 H new ATOM 0 HG LEU A 463 -6.511 -7.810 -13.526 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -5.824 -9.451 -15.254 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -6.689 -10.253 -13.922 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -7.521 -9.942 -15.464 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -6.423 -7.111 -15.903 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -8.120 -7.606 -16.112 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -7.715 -6.250 -15.033 1.00 0.99 H new ATOM 1302 N LYS A 464 -10.417 -5.871 -13.817 1.00 0.72 N ATOM 1303 CA LYS A 464 -10.872 -4.663 -14.566 1.00 0.77 C ATOM 1304 C LYS A 464 -11.511 -3.655 -13.607 1.00 0.76 C ATOM 1305 O LYS A 464 -11.339 -2.460 -13.741 1.00 0.82 O ATOM 1306 CB LYS A 464 -11.906 -5.183 -15.565 1.00 0.85 C ATOM 1307 CG LYS A 464 -11.328 -5.121 -16.980 1.00 1.20 C ATOM 1308 CD LYS A 464 -12.103 -6.075 -17.892 1.00 1.62 C ATOM 1309 CE LYS A 464 -13.080 -5.277 -18.758 1.00 2.25 C ATOM 1310 NZ LYS A 464 -12.736 -5.643 -20.161 1.00 2.66 N ATOM 0 H LYS A 464 -11.108 -6.617 -13.736 1.00 0.72 H new ATOM 0 HA LYS A 464 -10.048 -4.150 -15.062 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -12.181 -6.208 -15.318 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -12.816 -4.586 -15.506 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -11.390 -4.103 -17.365 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -10.273 -5.393 -16.965 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -11.411 -6.631 -18.525 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -12.646 -6.806 -17.293 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -14.114 -5.533 -18.525 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -12.971 -4.205 -18.591 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -13.364 -5.135 -20.816 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -11.748 -5.382 -20.356 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -12.855 -6.668 -20.292 1.00 2.66 H new ATOM 1324 N GLU A 465 -12.249 -4.129 -12.639 1.00 0.73 N ATOM 1325 CA GLU A 465 -12.902 -3.199 -11.673 1.00 0.76 C ATOM 1326 C GLU A 465 -11.849 -2.327 -10.981 1.00 0.69 C ATOM 1327 O GLU A 465 -12.103 -1.190 -10.635 1.00 0.85 O ATOM 1328 CB GLU A 465 -13.595 -4.108 -10.658 1.00 0.79 C ATOM 1329 CG GLU A 465 -14.402 -3.256 -9.676 1.00 1.12 C ATOM 1330 CD GLU A 465 -15.729 -2.854 -10.322 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -15.788 -2.824 -11.539 1.00 2.03 O ATOM 1332 OE2 GLU A 465 -16.665 -2.583 -9.587 1.00 1.95 O ATOM 0 H GLU A 465 -12.428 -5.120 -12.476 1.00 0.73 H new ATOM 0 HA GLU A 465 -13.603 -2.522 -12.161 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -14.252 -4.810 -11.172 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -12.855 -4.700 -10.119 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -14.586 -3.815 -8.759 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -13.836 -2.367 -9.399 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.671 -2.848 -10.777 1.00 0.56 N ATOM 1340 CA LEU A 466 -9.608 -2.044 -10.106 1.00 0.59 C ATOM 1341 C LEU A 466 -9.281 -0.801 -10.937 1.00 0.70 C ATOM 1342 O LEU A 466 -9.001 0.256 -10.407 1.00 0.81 O ATOM 1343 CB LEU A 466 -8.395 -2.972 -10.031 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.274 -3.541 -8.616 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -7.069 -4.479 -8.543 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -8.085 -2.393 -7.622 1.00 0.52 C ATOM 0 H LEU A 466 -10.398 -3.793 -11.045 1.00 0.56 H new ATOM 0 HA LEU A 466 -9.916 -1.695 -9.120 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -8.499 -3.782 -10.753 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -7.489 -2.426 -10.293 1.00 0.56 H new ATOM 0 HG LEU A 466 -9.180 -4.094 -8.368 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -6.984 -4.884 -7.535 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -7.201 -5.296 -9.252 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -6.162 -3.927 -8.790 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -7.999 -2.796 -6.613 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -7.179 -1.841 -7.871 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -8.943 -1.723 -7.673 1.00 0.52 H new ATOM 1358 N GLY A 467 -9.314 -0.919 -12.236 1.00 0.77 N ATOM 1359 CA GLY A 467 -9.006 0.257 -13.099 1.00 0.97 C ATOM 1360 C GLY A 467 -10.208 0.564 -13.993 1.00 1.08 C ATOM 1361 O GLY A 467 -10.062 0.923 -15.145 1.00 1.38 O ATOM 0 H GLY A 467 -9.541 -1.778 -12.737 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -8.769 1.123 -12.481 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -8.127 0.052 -13.711 1.00 0.97 H new ATOM 1723 N TRP B 402 6.065 -1.380 4.357 1.00 0.95 N ATOM 1724 CA TRP B 402 4.736 -2.028 4.147 1.00 0.86 C ATOM 1725 C TRP B 402 4.823 -3.175 3.138 1.00 0.79 C ATOM 1726 O TRP B 402 4.675 -4.324 3.491 1.00 0.71 O ATOM 1727 CB TRP B 402 3.840 -0.917 3.607 1.00 0.96 C ATOM 1728 CG TRP B 402 2.534 -0.957 4.322 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.302 -0.401 5.529 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.286 -1.580 3.905 1.00 0.76 C ATOM 1731 NE1 TRP B 402 0.984 -0.635 5.889 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.312 -1.359 4.921 1.00 0.83 C ATOM 1733 CE3 TRP B 402 0.900 -2.311 2.750 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -1.001 -1.847 4.798 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 -0.421 -2.804 2.623 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -1.370 -2.572 3.646 1.00 0.69 C ATOM 0 HA TRP B 402 4.355 -2.464 5.071 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.317 0.053 3.748 1.00 0.96 H new ATOM 0 HB3 TRP B 402 3.687 -1.044 2.535 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.027 0.140 6.120 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.562 -0.313 6.760 1.00 1.00 H new ATOM 0 HE3 TRP B 402 1.618 -2.492 1.964 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.723 -1.668 5.581 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.705 -3.359 1.742 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -2.377 -2.950 3.545 1.00 0.69 H new ATOM 1747 N ALA B 403 5.045 -2.873 1.885 1.00 0.85 N ATOM 1748 CA ALA B 403 5.125 -3.956 0.852 1.00 0.85 C ATOM 1749 C ALA B 403 6.018 -5.102 1.336 1.00 0.80 C ATOM 1750 O ALA B 403 5.652 -6.256 1.255 1.00 0.76 O ATOM 1751 CB ALA B 403 5.732 -3.285 -0.380 1.00 0.99 C ATOM 0 H ALA B 403 5.175 -1.926 1.530 1.00 0.85 H new ATOM 0 HA ALA B 403 4.148 -4.391 0.642 1.00 0.85 H new ATOM 0 HB1 ALA B 403 5.824 -4.015 -1.184 1.00 0.99 H new ATOM 0 HB2 ALA B 403 5.088 -2.468 -0.704 1.00 0.99 H new ATOM 0 HB3 ALA B 403 6.718 -2.893 -0.132 1.00 0.99 H new ATOM 1757 N THR B 404 7.178 -4.797 1.848 1.00 0.82 N ATOM 1758 CA THR B 404 8.067 -5.884 2.344 1.00 0.81 C ATOM 1759 C THR B 404 7.338 -6.680 3.428 1.00 0.70 C ATOM 1760 O THR B 404 7.449 -7.887 3.512 1.00 0.69 O ATOM 1761 CB THR B 404 9.291 -5.173 2.922 1.00 0.89 C ATOM 1762 OG1 THR B 404 9.549 -3.991 2.175 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.505 -6.100 2.847 1.00 0.89 C ATOM 0 H THR B 404 7.546 -3.851 1.944 1.00 0.82 H new ATOM 0 HA THR B 404 8.351 -6.586 1.560 1.00 0.81 H new ATOM 0 HB THR B 404 9.100 -4.911 3.963 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.332 -3.534 2.546 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.377 -5.592 3.259 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.307 -7.005 3.421 1.00 0.89 H new ATOM 0 HG23 THR B 404 10.697 -6.364 1.807 1.00 0.89 H new ATOM 1771 N LEU B 405 6.580 -6.007 4.251 1.00 0.67 N ATOM 1772 CA LEU B 405 5.827 -6.714 5.324 1.00 0.61 C ATOM 1773 C LEU B 405 4.660 -7.486 4.706 1.00 0.53 C ATOM 1774 O LEU B 405 4.261 -8.524 5.193 1.00 0.52 O ATOM 1775 CB LEU B 405 5.320 -5.591 6.244 1.00 0.67 C ATOM 1776 CG LEU B 405 4.600 -6.163 7.478 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.216 -6.680 7.079 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.416 -7.308 8.092 1.00 0.64 C ATOM 0 H LEU B 405 6.450 -4.996 4.226 1.00 0.67 H new ATOM 0 HA LEU B 405 6.434 -7.438 5.868 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.159 -4.973 6.564 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.640 -4.944 5.691 1.00 0.67 H new ATOM 0 HG LEU B 405 4.494 -5.369 8.217 1.00 0.64 H new ATOM 0 HD11 LEU B 405 2.711 -7.084 7.957 1.00 0.57 H new ATOM 0 HD12 LEU B 405 2.627 -5.861 6.666 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.323 -7.464 6.329 1.00 0.57 H new ATOM 0 HD21 LEU B 405 4.893 -7.701 8.964 1.00 0.64 H new ATOM 0 HD22 LEU B 405 5.541 -8.102 7.355 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.395 -6.936 8.394 1.00 0.64 H new ATOM 1790 N LEU B 406 4.110 -6.981 3.637 1.00 0.53 N ATOM 1791 CA LEU B 406 2.968 -7.673 2.981 1.00 0.50 C ATOM 1792 C LEU B 406 3.464 -8.892 2.201 1.00 0.49 C ATOM 1793 O LEU B 406 2.792 -9.901 2.115 1.00 0.45 O ATOM 1794 CB LEU B 406 2.371 -6.628 2.033 1.00 0.57 C ATOM 1795 CG LEU B 406 0.863 -6.857 1.908 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.205 -6.695 3.280 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.268 -5.833 0.941 1.00 1.02 C ATOM 0 H LEU B 406 4.405 -6.114 3.188 1.00 0.53 H new ATOM 0 HA LEU B 406 2.235 -8.039 3.699 1.00 0.50 H new ATOM 0 HB2 LEU B 406 2.567 -5.624 2.410 1.00 0.57 H new ATOM 0 HB3 LEU B 406 2.843 -6.698 1.053 1.00 0.57 H new ATOM 0 HG LEU B 406 0.682 -7.864 1.532 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.869 -6.858 3.190 1.00 0.94 H new ATOM 0 HD12 LEU B 406 0.626 -7.423 3.974 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.389 -5.688 3.655 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.806 -5.997 0.853 1.00 1.02 H new ATOM 0 HD22 LEU B 406 0.452 -4.827 1.318 1.00 1.02 H new ATOM 0 HD23 LEU B 406 0.734 -5.944 -0.038 1.00 1.02 H new ATOM 1809 N ALA B 407 4.639 -8.813 1.638 1.00 0.56 N ATOM 1810 CA ALA B 407 5.175 -9.971 0.873 1.00 0.59 C ATOM 1811 C ALA B 407 5.485 -11.126 1.828 1.00 0.57 C ATOM 1812 O ALA B 407 5.150 -12.266 1.571 1.00 0.61 O ATOM 1813 CB ALA B 407 6.457 -9.457 0.217 1.00 0.70 C ATOM 0 H ALA B 407 5.249 -7.997 1.676 1.00 0.56 H new ATOM 0 HA ALA B 407 4.466 -10.346 0.135 1.00 0.59 H new ATOM 0 HB1 ALA B 407 6.913 -10.257 -0.367 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.220 -8.619 -0.438 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.154 -9.129 0.988 1.00 0.70 H new ATOM 1819 N GLN B 408 6.119 -10.838 2.933 1.00 0.57 N ATOM 1820 CA GLN B 408 6.447 -11.917 3.907 1.00 0.57 C ATOM 1821 C GLN B 408 5.198 -12.307 4.703 1.00 0.50 C ATOM 1822 O GLN B 408 4.994 -13.460 5.031 1.00 0.50 O ATOM 1823 CB GLN B 408 7.506 -11.309 4.827 1.00 0.62 C ATOM 1824 CG GLN B 408 8.863 -11.322 4.120 1.00 0.75 C ATOM 1825 CD GLN B 408 9.971 -11.571 5.144 1.00 0.78 C ATOM 1826 OE1 GLN B 408 10.711 -12.528 5.034 1.00 1.29 O ATOM 1827 NE2 GLN B 408 10.118 -10.743 6.142 1.00 1.46 N ATOM 0 H GLN B 408 6.423 -9.903 3.203 1.00 0.57 H new ATOM 0 HA GLN B 408 6.805 -12.823 3.418 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.231 -10.288 5.091 1.00 0.62 H new ATOM 0 HB3 GLN B 408 7.563 -11.874 5.757 1.00 0.62 H new ATOM 0 HG2 GLN B 408 8.879 -12.099 3.355 1.00 0.75 H new ATOM 0 HG3 GLN B 408 9.029 -10.372 3.613 1.00 0.75 H new ATOM 0 HE21 GLN B 408 9.496 -9.940 6.234 1.00 1.46 H new ATOM 0 HE22 GLN B 408 10.855 -10.899 6.830 1.00 1.46 H new ATOM 1836 N TRP B 409 4.358 -11.356 5.013 1.00 0.46 N ATOM 1837 CA TRP B 409 3.120 -11.674 5.783 1.00 0.43 C ATOM 1838 C TRP B 409 2.193 -12.550 4.932 1.00 0.40 C ATOM 1839 O TRP B 409 1.755 -13.602 5.356 1.00 0.41 O ATOM 1840 CB TRP B 409 2.483 -10.311 6.075 1.00 0.43 C ATOM 1841 CG TRP B 409 1.098 -10.490 6.613 1.00 0.42 C ATOM 1842 CD1 TRP B 409 0.794 -10.917 7.861 1.00 0.50 C ATOM 1843 CD2 TRP B 409 -0.169 -10.255 5.936 1.00 0.40 C ATOM 1844 NE1 TRP B 409 -0.584 -10.958 7.999 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -1.226 -10.560 6.842 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.508 -9.808 4.633 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -2.576 -10.427 6.468 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.864 -9.672 4.251 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.897 -9.982 5.169 1.00 0.48 C ATOM 0 H TRP B 409 4.475 -10.373 4.767 1.00 0.46 H new ATOM 0 HA TRP B 409 3.319 -12.228 6.701 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.092 -9.764 6.795 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.452 -9.714 5.164 1.00 0.43 H new ATOM 0 HD1 TRP B 409 1.509 -11.183 8.625 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -1.066 -11.247 8.851 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.274 -9.570 3.927 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -3.361 -10.664 7.171 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -2.112 -9.331 3.257 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.931 -9.878 4.874 1.00 0.48 H new ATOM 1860 N ALA B 410 1.893 -12.127 3.734 1.00 0.42 N ATOM 1861 CA ALA B 410 1.000 -12.940 2.860 1.00 0.44 C ATOM 1862 C ALA B 410 1.544 -14.365 2.741 1.00 0.45 C ATOM 1863 O ALA B 410 0.805 -15.310 2.554 1.00 0.47 O ATOM 1864 CB ALA B 410 1.025 -12.237 1.502 1.00 0.51 C ATOM 0 H ALA B 410 2.227 -11.255 3.323 1.00 0.42 H new ATOM 0 HA ALA B 410 -0.013 -13.017 3.256 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.389 -12.777 0.801 1.00 0.51 H new ATOM 0 HB2 ALA B 410 0.657 -11.217 1.614 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.047 -12.215 1.122 1.00 0.51 H new ATOM 1870 N ASP B 411 2.834 -14.524 2.855 1.00 0.48 N ATOM 1871 CA ASP B 411 3.431 -15.886 2.758 1.00 0.53 C ATOM 1872 C ASP B 411 3.279 -16.618 4.093 1.00 0.53 C ATOM 1873 O ASP B 411 2.789 -17.728 4.153 1.00 0.58 O ATOM 1874 CB ASP B 411 4.908 -15.648 2.441 1.00 0.60 C ATOM 1875 CG ASP B 411 5.471 -16.857 1.692 1.00 1.03 C ATOM 1876 OD1 ASP B 411 5.101 -17.967 2.035 1.00 1.78 O ATOM 1877 OD2 ASP B 411 6.263 -16.652 0.786 1.00 1.51 O ATOM 0 H ASP B 411 3.501 -13.769 3.011 1.00 0.48 H new ATOM 0 HA ASP B 411 2.947 -16.500 1.999 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.021 -14.748 1.837 1.00 0.60 H new ATOM 0 HB3 ASP B 411 5.467 -15.485 3.363 1.00 0.60 H new ATOM 1882 N ARG B 412 3.690 -15.999 5.167 1.00 0.52 N ATOM 1883 CA ARG B 412 3.565 -16.656 6.499 1.00 0.56 C ATOM 1884 C ARG B 412 2.113 -17.078 6.735 1.00 0.55 C ATOM 1885 O ARG B 412 1.840 -18.053 7.407 1.00 0.63 O ATOM 1886 CB ARG B 412 3.985 -15.586 7.508 1.00 0.58 C ATOM 1887 CG ARG B 412 4.767 -16.237 8.650 1.00 0.96 C ATOM 1888 CD ARG B 412 5.615 -15.177 9.355 1.00 1.50 C ATOM 1889 NE ARG B 412 6.487 -15.939 10.290 1.00 1.90 N ATOM 1890 CZ ARG B 412 7.030 -15.337 11.312 1.00 2.41 C ATOM 1891 NH1 ARG B 412 6.316 -14.531 12.048 1.00 2.89 N ATOM 1892 NH2 ARG B 412 8.287 -15.540 11.597 1.00 3.02 N ATOM 0 H ARG B 412 4.106 -15.068 5.179 1.00 0.52 H new ATOM 0 HA ARG B 412 4.178 -17.554 6.582 1.00 0.56 H new ATOM 0 HB2 ARG B 412 4.599 -14.830 7.018 1.00 0.58 H new ATOM 0 HB3 ARG B 412 3.105 -15.076 7.900 1.00 0.58 H new ATOM 0 HG2 ARG B 412 4.080 -16.699 9.359 1.00 0.96 H new ATOM 0 HG3 ARG B 412 5.406 -17.030 8.262 1.00 0.96 H new ATOM 0 HD2 ARG B 412 6.207 -14.606 8.640 1.00 1.50 H new ATOM 0 HD3 ARG B 412 4.989 -14.464 9.892 1.00 1.50 H new ATOM 0 HE ARG B 412 6.660 -16.932 10.132 1.00 1.90 H new ATOM 0 HH11 ARG B 412 5.334 -14.372 11.824 1.00 2.89 H new ATOM 0 HH12 ARG B 412 6.740 -14.060 12.847 1.00 2.89 H new ATOM 0 HH21 ARG B 412 8.845 -16.170 11.021 1.00 3.02 H new ATOM 0 HH22 ARG B 412 8.711 -15.069 12.396 1.00 3.02 H new ATOM 1906 N ALA B 413 1.183 -16.352 6.183 1.00 0.50 N ATOM 1907 CA ALA B 413 -0.252 -16.709 6.367 1.00 0.53 C ATOM 1908 C ALA B 413 -0.641 -17.826 5.398 1.00 0.57 C ATOM 1909 O ALA B 413 -1.421 -18.700 5.721 1.00 0.66 O ATOM 1910 CB ALA B 413 -1.024 -15.427 6.049 1.00 0.53 C ATOM 0 H ALA B 413 1.354 -15.525 5.611 1.00 0.50 H new ATOM 0 HA ALA B 413 -0.465 -17.071 7.373 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -2.093 -15.608 6.162 1.00 0.53 H new ATOM 0 HB2 ALA B 413 -0.715 -14.637 6.734 1.00 0.53 H new ATOM 0 HB3 ALA B 413 -0.814 -15.121 5.024 1.00 0.53 H new ATOM 1916 N LEU B 414 -0.101 -17.808 4.210 1.00 0.54 N ATOM 1917 CA LEU B 414 -0.437 -18.871 3.221 1.00 0.62 C ATOM 1918 C LEU B 414 -0.139 -20.250 3.815 1.00 0.71 C ATOM 1919 O LEU B 414 -0.888 -21.189 3.640 1.00 0.82 O ATOM 1920 CB LEU B 414 0.471 -18.599 2.020 1.00 0.63 C ATOM 1921 CG LEU B 414 -0.378 -18.463 0.756 1.00 0.71 C ATOM 1922 CD1 LEU B 414 -1.240 -17.203 0.851 1.00 1.11 C ATOM 1923 CD2 LEU B 414 0.540 -18.361 -0.464 1.00 1.03 C ATOM 0 H LEU B 414 0.559 -17.103 3.882 1.00 0.54 H new ATOM 0 HA LEU B 414 -1.491 -18.861 2.944 1.00 0.62 H new ATOM 0 HB2 LEU B 414 1.045 -17.687 2.184 1.00 0.63 H new ATOM 0 HB3 LEU B 414 1.189 -19.411 1.903 1.00 0.63 H new ATOM 0 HG LEU B 414 -1.023 -19.336 0.656 1.00 0.71 H new ATOM 0 HD11 LEU B 414 -1.845 -17.107 -0.051 1.00 1.11 H new ATOM 0 HD12 LEU B 414 -1.894 -17.274 1.720 1.00 1.11 H new ATOM 0 HD13 LEU B 414 -0.597 -16.329 0.951 1.00 1.11 H new ATOM 0 HD21 LEU B 414 -0.064 -18.264 -1.366 1.00 1.03 H new ATOM 0 HD22 LEU B 414 1.184 -17.488 -0.363 1.00 1.03 H new ATOM 0 HD23 LEU B 414 1.154 -19.259 -0.533 1.00 1.03 H new ATOM 1935 N ARG B 415 0.953 -20.375 4.519 1.00 0.73 N ATOM 1936 CA ARG B 415 1.302 -21.691 5.128 1.00 0.87 C ATOM 1937 C ARG B 415 0.156 -22.186 6.012 1.00 0.93 C ATOM 1938 O ARG B 415 -0.090 -23.370 6.123 1.00 1.26 O ATOM 1939 CB ARG B 415 2.549 -21.418 5.971 1.00 1.02 C ATOM 1940 CG ARG B 415 3.801 -21.686 5.134 1.00 1.40 C ATOM 1941 CD ARG B 415 5.025 -21.738 6.051 1.00 1.61 C ATOM 1942 NE ARG B 415 6.196 -21.671 5.132 1.00 2.27 N ATOM 1943 CZ ARG B 415 6.470 -22.681 4.352 1.00 2.92 C ATOM 1944 NH1 ARG B 415 5.794 -22.857 3.250 1.00 3.70 N ATOM 1945 NH2 ARG B 415 7.420 -23.514 4.674 1.00 3.32 N ATOM 0 H ARG B 415 1.619 -19.623 4.699 1.00 0.73 H new ATOM 0 HA ARG B 415 1.477 -22.460 4.376 1.00 0.87 H new ATOM 0 HB2 ARG B 415 2.546 -20.385 6.320 1.00 1.02 H new ATOM 0 HB3 ARG B 415 2.548 -22.053 6.857 1.00 1.02 H new ATOM 0 HG2 ARG B 415 3.697 -22.628 4.595 1.00 1.40 H new ATOM 0 HG3 ARG B 415 3.926 -20.903 4.386 1.00 1.40 H new ATOM 0 HD2 ARG B 415 5.027 -20.906 6.755 1.00 1.61 H new ATOM 0 HD3 ARG B 415 5.038 -22.654 6.641 1.00 1.61 H new ATOM 0 HE ARG B 415 6.783 -20.837 5.112 1.00 2.27 H new ATOM 0 HH11 ARG B 415 5.051 -22.205 2.998 1.00 3.70 H new ATOM 0 HH12 ARG B 415 6.008 -23.646 2.641 1.00 3.70 H new ATOM 0 HH21 ARG B 415 7.949 -23.376 5.535 1.00 3.32 H new ATOM 0 HH22 ARG B 415 7.634 -24.303 4.065 1.00 3.32 H new ATOM 1959 N SER B 416 -0.546 -21.287 6.642 1.00 0.90 N ATOM 1960 CA SER B 416 -1.677 -21.703 7.519 1.00 0.99 C ATOM 1961 C SER B 416 -2.966 -21.815 6.702 1.00 0.99 C ATOM 1962 O SER B 416 -3.733 -22.745 6.858 1.00 1.63 O ATOM 1963 CB SER B 416 -1.799 -20.594 8.563 1.00 1.20 C ATOM 1964 OG SER B 416 -1.279 -21.056 9.802 1.00 1.70 O ATOM 0 H SER B 416 -0.386 -20.281 6.588 1.00 0.90 H new ATOM 0 HA SER B 416 -1.506 -22.677 7.978 1.00 0.99 H new ATOM 0 HB2 SER B 416 -1.255 -19.708 8.235 1.00 1.20 H new ATOM 0 HB3 SER B 416 -2.843 -20.302 8.680 1.00 1.20 H new ATOM 0 HG SER B 416 -1.354 -20.346 10.473 1.00 1.70 H new ATOM 1970 N GLY B 417 -3.211 -20.874 5.831 1.00 1.06 N ATOM 1971 CA GLY B 417 -4.446 -20.928 5.006 1.00 1.06 C ATOM 1972 C GLY B 417 -5.301 -19.691 5.283 1.00 0.99 C ATOM 1973 O GLY B 417 -6.510 -19.766 5.368 1.00 1.31 O ATOM 0 H GLY B 417 -2.607 -20.071 5.657 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -4.187 -20.974 3.948 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -5.010 -21.832 5.236 1.00 1.06 H new ATOM 1977 N HIS B 418 -4.683 -18.550 5.425 1.00 0.78 N ATOM 1978 CA HIS B 418 -5.464 -17.309 5.696 1.00 0.88 C ATOM 1979 C HIS B 418 -6.470 -17.057 4.571 1.00 0.89 C ATOM 1980 O HIS B 418 -6.105 -16.715 3.463 1.00 1.17 O ATOM 1981 CB HIS B 418 -4.430 -16.195 5.749 1.00 1.01 C ATOM 1982 CG HIS B 418 -4.329 -15.664 7.154 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -4.320 -16.500 8.260 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -4.229 -14.387 7.647 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -4.218 -15.723 9.353 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -4.160 -14.427 9.037 1.00 2.97 N ATOM 0 H HIS B 418 -3.673 -18.423 5.365 1.00 0.78 H new ATOM 0 HA HIS B 418 -6.037 -17.377 6.621 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -3.460 -16.570 5.421 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -4.710 -15.393 5.066 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -4.207 -13.488 7.048 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -4.187 -16.102 10.364 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -4.082 -13.636 9.676 1.00 2.97 H new ATOM 1994 N GLN B 419 -7.735 -17.226 4.844 1.00 1.08 N ATOM 1995 CA GLN B 419 -8.762 -16.997 3.788 1.00 1.24 C ATOM 1996 C GLN B 419 -8.948 -15.497 3.545 1.00 1.03 C ATOM 1997 O GLN B 419 -9.011 -15.043 2.420 1.00 1.28 O ATOM 1998 CB GLN B 419 -10.046 -17.614 4.344 1.00 1.71 C ATOM 1999 CG GLN B 419 -10.329 -18.936 3.628 1.00 2.32 C ATOM 2000 CD GLN B 419 -11.836 -19.090 3.415 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -12.608 -18.962 4.345 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -12.291 -19.359 2.223 1.00 3.52 N ATOM 0 H GLN B 419 -8.102 -17.512 5.752 1.00 1.08 H new ATOM 0 HA GLN B 419 -8.477 -17.439 2.833 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -9.946 -17.783 5.416 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -10.881 -16.927 4.206 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -9.811 -18.960 2.669 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -9.947 -19.770 4.217 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -11.644 -19.466 1.442 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -13.294 -19.462 2.071 1.00 3.52 H new ATOM 2011 N ASN B 420 -9.037 -14.723 4.592 1.00 0.78 N ATOM 2012 CA ASN B 420 -9.220 -13.254 4.420 1.00 0.70 C ATOM 2013 C ASN B 420 -7.863 -12.567 4.240 1.00 0.58 C ATOM 2014 O ASN B 420 -7.519 -11.650 4.958 1.00 0.70 O ATOM 2015 CB ASN B 420 -9.890 -12.784 5.711 1.00 0.86 C ATOM 2016 CG ASN B 420 -11.217 -13.523 5.897 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -11.411 -14.210 6.880 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -12.146 -13.411 4.986 1.00 1.87 N ATOM 0 H ASN B 420 -8.991 -15.044 5.559 1.00 0.78 H new ATOM 0 HA ASN B 420 -9.816 -13.014 3.540 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -9.235 -12.971 6.562 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -10.063 -11.708 5.673 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -13.034 -13.900 5.100 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -11.984 -12.834 4.160 1.00 1.87 H new ATOM 2025 N LEU B 421 -7.088 -13.003 3.283 1.00 0.45 N ATOM 2026 CA LEU B 421 -5.755 -12.375 3.058 1.00 0.40 C ATOM 2027 C LEU B 421 -5.918 -10.893 2.706 1.00 0.39 C ATOM 2028 O LEU B 421 -5.624 -10.021 3.499 1.00 0.53 O ATOM 2029 CB LEU B 421 -5.150 -13.141 1.882 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.959 -13.967 2.368 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.647 -15.060 1.345 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -2.739 -13.057 2.527 1.00 0.41 C ATOM 0 H LEU B 421 -7.321 -13.767 2.648 1.00 0.45 H new ATOM 0 HA LEU B 421 -5.123 -12.422 3.945 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -5.900 -13.793 1.435 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -4.831 -12.445 1.107 1.00 0.42 H new ATOM 0 HG LEU B 421 -4.200 -14.424 3.328 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -2.798 -15.650 1.690 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.516 -15.708 1.229 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.405 -14.602 0.386 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -1.889 -13.645 2.874 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -2.497 -12.601 1.567 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -2.960 -12.276 3.254 1.00 0.41 H new ATOM 2044 N LEU B 422 -6.382 -10.604 1.521 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.563 -9.178 1.118 1.00 0.34 C ATOM 2046 C LEU B 422 -7.606 -8.503 2.010 1.00 0.34 C ATOM 2047 O LEU B 422 -7.585 -7.305 2.211 1.00 0.37 O ATOM 2048 CB LEU B 422 -7.051 -9.234 -0.330 1.00 0.37 C ATOM 2049 CG LEU B 422 -5.855 -9.133 -1.276 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.332 -9.278 -2.722 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -5.179 -7.771 -1.097 1.00 0.63 C ATOM 0 H LEU B 422 -6.644 -11.292 0.815 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.643 -8.602 1.216 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.591 -10.164 -0.507 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -7.749 -8.419 -0.521 1.00 0.37 H new ATOM 0 HG LEU B 422 -5.144 -9.927 -1.048 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -5.478 -9.206 -3.396 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.815 -10.247 -2.850 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -7.044 -8.485 -2.952 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -4.326 -7.697 -1.771 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -5.892 -6.978 -1.325 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -4.838 -7.667 -0.067 1.00 0.63 H new ATOM 2063 N SER B 423 -8.520 -9.263 2.547 1.00 0.35 N ATOM 2064 CA SER B 423 -9.567 -8.667 3.426 1.00 0.38 C ATOM 2065 C SER B 423 -8.928 -8.054 4.677 1.00 0.36 C ATOM 2066 O SER B 423 -9.530 -7.248 5.358 1.00 0.39 O ATOM 2067 CB SER B 423 -10.474 -9.836 3.806 1.00 0.44 C ATOM 2068 OG SER B 423 -11.704 -9.723 3.102 1.00 1.23 O ATOM 0 H SER B 423 -8.588 -10.272 2.415 1.00 0.35 H new ATOM 0 HA SER B 423 -10.116 -7.867 2.929 1.00 0.38 H new ATOM 0 HB2 SER B 423 -9.989 -10.782 3.564 1.00 0.44 H new ATOM 0 HB3 SER B 423 -10.655 -9.836 4.881 1.00 0.44 H new ATOM 0 HG SER B 423 -12.288 -10.472 3.342 1.00 1.23 H new ATOM 2074 N GLU B 424 -7.716 -8.430 4.986 1.00 0.34 N ATOM 2075 CA GLU B 424 -7.048 -7.866 6.195 1.00 0.36 C ATOM 2076 C GLU B 424 -6.373 -6.533 5.858 1.00 0.32 C ATOM 2077 O GLU B 424 -6.543 -5.549 6.550 1.00 0.33 O ATOM 2078 CB GLU B 424 -6.005 -8.910 6.596 1.00 0.38 C ATOM 2079 CG GLU B 424 -6.394 -9.529 7.939 1.00 0.57 C ATOM 2080 CD GLU B 424 -5.658 -10.858 8.123 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -5.381 -11.501 7.124 1.00 1.22 O ATOM 2082 OE2 GLU B 424 -5.385 -11.210 9.258 1.00 1.54 O ATOM 0 H GLU B 424 -7.161 -9.101 4.455 1.00 0.34 H new ATOM 0 HA GLU B 424 -7.755 -7.666 7.000 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.938 -9.685 5.832 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -5.021 -8.447 6.668 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -6.143 -8.847 8.752 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -7.471 -9.690 7.979 1.00 0.57 H new ATOM 2089 N ALA B 425 -5.608 -6.491 4.801 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.924 -5.220 4.425 1.00 0.29 C ATOM 2091 C ALA B 425 -5.889 -4.279 3.690 1.00 0.28 C ATOM 2092 O ALA B 425 -5.554 -3.152 3.385 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.783 -5.643 3.501 1.00 0.29 C ATOM 0 H ALA B 425 -5.427 -7.281 4.182 1.00 0.31 H new ATOM 0 HA ALA B 425 -4.566 -4.677 5.300 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -3.229 -4.761 3.179 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -3.113 -6.317 4.035 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -4.191 -6.153 2.629 1.00 0.29 H new ATOM 2099 N GLN B 426 -7.081 -4.729 3.399 1.00 0.30 N ATOM 2100 CA GLN B 426 -8.052 -3.854 2.683 1.00 0.31 C ATOM 2101 C GLN B 426 -8.295 -2.556 3.468 1.00 0.30 C ATOM 2102 O GLN B 426 -8.087 -1.478 2.949 1.00 0.30 O ATOM 2103 CB GLN B 426 -9.340 -4.676 2.594 1.00 0.36 C ATOM 2104 CG GLN B 426 -9.714 -4.881 1.125 1.00 0.45 C ATOM 2105 CD GLN B 426 -10.757 -5.995 1.013 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -11.854 -5.870 1.520 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -10.458 -7.088 0.366 1.00 1.09 N ATOM 0 H GLN B 426 -7.423 -5.663 3.626 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.685 -3.560 1.700 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -9.203 -5.640 3.083 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -10.147 -4.164 3.118 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -10.109 -3.955 0.707 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -8.827 -5.139 0.546 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -9.537 -7.193 -0.060 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -11.145 -7.837 0.286 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.736 -2.697 4.698 1.00 0.32 N ATOM 2117 CA PRO B 427 -9.010 -1.505 5.540 1.00 0.34 C ATOM 2118 C PRO B 427 -7.703 -0.810 5.931 1.00 0.31 C ATOM 2119 O PRO B 427 -7.692 0.347 6.299 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.717 -2.081 6.763 1.00 0.39 C ATOM 2121 CG PRO B 427 -9.271 -3.506 6.831 1.00 0.38 C ATOM 2122 CD PRO B 427 -9.016 -3.951 5.415 1.00 0.35 C ATOM 0 HA PRO B 427 -9.608 -0.749 5.030 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -9.445 -1.538 7.668 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.800 -2.011 6.663 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -8.368 -3.600 7.434 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -10.034 -4.128 7.300 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -8.174 -4.641 5.358 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.880 -4.467 4.996 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.599 -1.501 5.847 1.00 0.29 N ATOM 2131 CA GLU B 428 -5.299 -0.866 6.208 1.00 0.29 C ATOM 2132 C GLU B 428 -5.001 0.281 5.239 1.00 0.27 C ATOM 2133 O GLU B 428 -4.788 1.408 5.642 1.00 0.32 O ATOM 2134 CB GLU B 428 -4.258 -1.977 6.066 1.00 0.29 C ATOM 2135 CG GLU B 428 -3.385 -2.021 7.322 1.00 0.71 C ATOM 2136 CD GLU B 428 -4.230 -2.448 8.527 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -5.437 -2.544 8.380 1.00 2.07 O ATOM 2138 OE2 GLU B 428 -3.652 -2.671 9.579 1.00 2.11 O ATOM 0 H GLU B 428 -6.540 -2.474 5.545 1.00 0.29 H new ATOM 0 HA GLU B 428 -5.303 -0.447 7.214 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.753 -2.937 5.920 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.639 -1.800 5.186 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -2.561 -2.719 7.179 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -2.944 -1.041 7.504 1.00 0.71 H new ATOM 2145 N LEU B 429 -4.996 0.004 3.964 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.725 1.079 2.969 1.00 0.26 C ATOM 2147 C LEU B 429 -5.863 2.105 2.994 1.00 0.25 C ATOM 2148 O LEU B 429 -5.639 3.299 2.980 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.665 0.359 1.616 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.632 1.385 0.478 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.374 1.177 -0.366 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.869 1.205 -0.405 1.00 0.56 C ATOM 0 H LEU B 429 -5.168 -0.920 3.569 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.803 1.622 3.175 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -3.780 -0.275 1.571 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.531 -0.294 1.503 1.00 0.26 H new ATOM 0 HG LEU B 429 -4.624 2.390 0.899 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.353 1.908 -1.174 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.491 1.303 0.260 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -3.380 0.171 -0.786 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.847 1.934 -1.215 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -5.874 0.198 -0.823 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.768 1.354 0.193 1.00 0.56 H new ATOM 2164 N GLU B 430 -7.085 1.645 3.037 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.236 2.592 3.066 1.00 0.28 C ATOM 2166 C GLU B 430 -8.124 3.517 4.281 1.00 0.30 C ATOM 2167 O GLU B 430 -8.523 4.664 4.239 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.476 1.705 3.179 1.00 0.30 C ATOM 2169 CG GLU B 430 -10.144 1.582 1.809 1.00 0.61 C ATOM 2170 CD GLU B 430 -9.788 0.231 1.185 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -8.633 0.047 0.839 1.00 2.05 O ATOM 2172 OE2 GLU B 430 -10.678 -0.596 1.066 1.00 2.17 O ATOM 0 H GLU B 430 -7.335 0.656 3.053 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.272 3.229 2.182 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -9.197 0.718 3.549 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -10.175 2.130 3.899 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -11.225 1.674 1.911 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -9.815 2.393 1.159 1.00 0.61 H new ATOM 2179 N ARG B 431 -7.583 3.027 5.363 1.00 0.33 N ATOM 2180 CA ARG B 431 -7.445 3.877 6.580 1.00 0.37 C ATOM 2181 C ARG B 431 -6.393 4.965 6.348 1.00 0.36 C ATOM 2182 O ARG B 431 -6.599 6.119 6.665 1.00 0.38 O ATOM 2183 CB ARG B 431 -6.993 2.919 7.682 1.00 0.41 C ATOM 2184 CG ARG B 431 -7.033 3.636 9.033 1.00 0.59 C ATOM 2185 CD ARG B 431 -8.249 3.158 9.829 1.00 1.32 C ATOM 2186 NE ARG B 431 -7.970 3.564 11.234 1.00 1.56 N ATOM 2187 CZ ARG B 431 -8.828 3.282 12.178 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -10.009 3.835 12.173 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -8.503 2.446 13.126 1.00 2.78 N ATOM 0 H ARG B 431 -7.230 2.074 5.457 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.374 4.385 6.838 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -7.641 2.043 7.705 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -5.983 2.563 7.477 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -6.118 3.435 9.591 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -7.084 4.714 8.883 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -9.167 3.615 9.460 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -8.375 2.078 9.747 1.00 1.32 H new ATOM 0 HE ARG B 431 -7.109 4.062 11.460 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -10.263 4.488 11.432 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -10.679 3.614 12.910 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -7.579 2.013 13.130 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -9.173 2.226 13.863 1.00 2.78 H new ATOM 2203 N THR B 432 -5.266 4.607 5.797 1.00 0.41 N ATOM 2204 CA THR B 432 -4.203 5.623 5.547 1.00 0.45 C ATOM 2205 C THR B 432 -4.747 6.756 4.674 1.00 0.40 C ATOM 2206 O THR B 432 -4.625 7.920 5.003 1.00 0.56 O ATOM 2207 CB THR B 432 -3.095 4.864 4.813 1.00 0.53 C ATOM 2208 OG1 THR B 432 -2.761 3.693 5.545 1.00 0.61 O ATOM 2209 CG2 THR B 432 -1.861 5.759 4.685 1.00 0.62 C ATOM 0 H THR B 432 -5.035 3.656 5.509 1.00 0.41 H new ATOM 0 HA THR B 432 -3.843 6.079 6.469 1.00 0.45 H new ATOM 0 HB THR B 432 -3.442 4.584 3.818 1.00 0.53 H new ATOM 0 HG1 THR B 432 -2.053 3.205 5.076 1.00 0.61 H new ATOM 0 HG21 THR B 432 -1.072 5.218 4.162 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.119 6.657 4.123 1.00 0.62 H new ATOM 0 HG23 THR B 432 -1.511 6.041 5.678 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.349 6.426 3.565 1.00 0.33 N ATOM 2218 CA LEU B 433 -5.901 7.485 2.671 1.00 0.30 C ATOM 2219 C LEU B 433 -7.064 8.207 3.358 1.00 0.27 C ATOM 2220 O LEU B 433 -7.089 9.418 3.443 1.00 0.25 O ATOM 2221 CB LEU B 433 -6.391 6.739 1.429 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.865 7.436 0.175 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -6.372 8.879 0.142 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -4.334 7.435 0.198 1.00 0.44 C ATOM 0 H LEU B 433 -5.483 5.469 3.238 1.00 0.33 H new ATOM 0 HA LEU B 433 -5.159 8.244 2.424 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -6.048 5.705 1.454 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.481 6.713 1.414 1.00 0.37 H new ATOM 0 HG LEU B 433 -6.218 6.907 -0.710 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -5.997 9.376 -0.753 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -7.462 8.881 0.128 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -6.019 9.409 1.027 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -3.956 7.932 -0.696 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -3.983 7.965 1.083 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.971 6.407 0.223 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.026 7.473 3.847 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.185 8.120 4.528 1.00 0.32 C ATOM 2238 C LEU B 434 -8.694 9.079 5.616 1.00 0.29 C ATOM 2239 O LEU B 434 -9.176 10.186 5.745 1.00 0.30 O ATOM 2240 CB LEU B 434 -9.977 6.967 5.146 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.360 7.467 5.571 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.415 6.941 4.596 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -11.672 6.961 6.980 1.00 1.14 C ATOM 0 H LEU B 434 -8.060 6.454 3.805 1.00 0.32 H new ATOM 0 HA LEU B 434 -9.792 8.708 3.839 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.078 6.154 4.427 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -9.443 6.566 6.007 1.00 0.41 H new ATOM 0 HG LEU B 434 -11.371 8.557 5.564 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.400 7.297 4.899 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -12.193 7.300 3.591 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.405 5.851 4.603 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -12.657 7.316 7.284 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -11.662 5.871 6.986 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -10.921 7.335 7.676 1.00 1.14 H new ATOM 2255 N THR B 435 -7.734 8.662 6.397 1.00 0.34 N ATOM 2256 CA THR B 435 -7.212 9.553 7.472 1.00 0.37 C ATOM 2257 C THR B 435 -6.443 10.724 6.855 1.00 0.35 C ATOM 2258 O THR B 435 -6.602 11.861 7.251 1.00 0.39 O ATOM 2259 CB THR B 435 -6.277 8.671 8.302 1.00 0.45 C ATOM 2260 OG1 THR B 435 -6.946 7.466 8.645 1.00 0.52 O ATOM 2261 CG2 THR B 435 -5.872 9.412 9.578 1.00 0.55 C ATOM 0 H THR B 435 -7.290 7.746 6.337 1.00 0.34 H new ATOM 0 HA THR B 435 -8.009 9.981 8.080 1.00 0.37 H new ATOM 0 HB THR B 435 -5.385 8.439 7.720 1.00 0.45 H new ATOM 0 HG1 THR B 435 -6.564 6.723 8.133 1.00 0.52 H new ATOM 0 HG21 THR B 435 -5.206 8.783 10.168 1.00 0.55 H new ATOM 0 HG22 THR B 435 -5.359 10.337 9.314 1.00 0.55 H new ATOM 0 HG23 THR B 435 -6.763 9.645 10.162 1.00 0.55 H new ATOM 2269 N THR B 436 -5.613 10.454 5.884 1.00 0.33 N ATOM 2270 CA THR B 436 -4.839 11.554 5.240 1.00 0.36 C ATOM 2271 C THR B 436 -5.796 12.578 4.628 1.00 0.36 C ATOM 2272 O THR B 436 -5.835 13.724 5.032 1.00 0.40 O ATOM 2273 CB THR B 436 -4.010 10.872 4.149 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.092 9.970 4.750 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.244 11.929 3.352 1.00 0.49 C ATOM 0 H THR B 436 -5.438 9.522 5.509 1.00 0.33 H new ATOM 0 HA THR B 436 -4.210 12.090 5.951 1.00 0.36 H new ATOM 0 HB THR B 436 -4.671 10.324 3.478 1.00 0.38 H new ATOM 0 HG1 THR B 436 -3.489 9.075 4.786 1.00 0.39 H new ATOM 0 HG21 THR B 436 -2.654 11.442 2.575 1.00 0.49 H new ATOM 0 HG22 THR B 436 -3.950 12.620 2.892 1.00 0.49 H new ATOM 0 HG23 THR B 436 -2.581 12.479 4.020 1.00 0.49 H new ATOM 2283 N ALA B 437 -6.575 12.176 3.660 1.00 0.34 N ATOM 2284 CA ALA B 437 -7.533 13.129 3.031 1.00 0.36 C ATOM 2285 C ALA B 437 -8.394 13.788 4.109 1.00 0.36 C ATOM 2286 O ALA B 437 -8.657 14.975 4.065 1.00 0.41 O ATOM 2287 CB ALA B 437 -8.392 12.274 2.100 1.00 0.35 C ATOM 0 H ALA B 437 -6.589 11.230 3.278 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.029 13.930 2.490 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.125 12.906 1.598 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -7.756 11.795 1.356 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -8.909 11.510 2.681 1.00 0.35 H new ATOM 2293 N LEU B 438 -8.828 13.038 5.087 1.00 0.34 N ATOM 2294 CA LEU B 438 -9.657 13.648 6.163 1.00 0.36 C ATOM 2295 C LEU B 438 -8.867 14.775 6.828 1.00 0.42 C ATOM 2296 O LEU B 438 -9.412 15.801 7.177 1.00 0.46 O ATOM 2297 CB LEU B 438 -9.945 12.520 7.160 1.00 0.36 C ATOM 2298 CG LEU B 438 -10.602 13.101 8.420 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -11.860 13.886 8.034 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -10.991 11.967 9.368 1.00 0.45 C ATOM 0 H LEU B 438 -8.646 12.039 5.186 1.00 0.34 H new ATOM 0 HA LEU B 438 -10.585 14.076 5.783 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -10.601 11.778 6.705 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.019 12.009 7.423 1.00 0.36 H new ATOM 0 HG LEU B 438 -9.894 13.766 8.915 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -12.323 14.296 8.932 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -11.589 14.700 7.361 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -12.565 13.221 7.534 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -11.457 12.383 10.261 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -11.694 11.301 8.869 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -10.099 11.407 9.651 1.00 0.45 H new ATOM 2312 N ARG B 439 -7.582 14.599 6.998 1.00 0.43 N ATOM 2313 CA ARG B 439 -6.766 15.677 7.630 1.00 0.50 C ATOM 2314 C ARG B 439 -7.035 17.002 6.915 1.00 0.54 C ATOM 2315 O ARG B 439 -7.184 18.037 7.534 1.00 0.60 O ATOM 2316 CB ARG B 439 -5.310 15.245 7.443 1.00 0.52 C ATOM 2317 CG ARG B 439 -4.551 15.427 8.759 1.00 0.77 C ATOM 2318 CD ARG B 439 -3.434 14.384 8.854 1.00 1.27 C ATOM 2319 NE ARG B 439 -2.531 14.884 9.927 1.00 1.73 N ATOM 2320 CZ ARG B 439 -1.239 14.742 9.811 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -0.606 15.305 8.818 1.00 2.81 N ATOM 2322 NH2 ARG B 439 -0.578 14.035 10.688 1.00 2.89 N ATOM 0 H ARG B 439 -7.066 13.762 6.729 1.00 0.43 H new ATOM 0 HA ARG B 439 -7.004 15.821 8.684 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -5.266 14.203 7.127 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -4.842 15.837 6.656 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -4.131 16.431 8.813 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -5.234 15.322 9.602 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -3.833 13.400 9.100 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -2.904 14.285 7.906 1.00 1.27 H new ATOM 0 HE ARG B 439 -2.922 15.337 10.753 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -1.121 15.857 8.132 1.00 2.81 H new ATOM 0 HH12 ARG B 439 0.404 15.193 8.728 1.00 2.81 H new ATOM 0 HH21 ARG B 439 -1.072 13.594 11.464 1.00 2.89 H new ATOM 0 HH22 ARG B 439 0.432 13.924 10.597 1.00 2.89 H new ATOM 2336 N HIS B 440 -7.134 16.968 5.613 1.00 0.52 N ATOM 2337 CA HIS B 440 -7.433 18.215 4.860 1.00 0.57 C ATOM 2338 C HIS B 440 -8.751 18.791 5.380 1.00 0.58 C ATOM 2339 O HIS B 440 -8.968 19.986 5.392 1.00 0.64 O ATOM 2340 CB HIS B 440 -7.569 17.771 3.401 1.00 0.55 C ATOM 2341 CG HIS B 440 -7.921 18.958 2.545 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -7.915 20.253 3.038 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -8.291 19.060 1.227 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -8.270 21.072 2.031 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -8.511 20.396 0.905 1.00 0.75 N ATOM 0 H HIS B 440 -7.021 16.131 5.041 1.00 0.52 H new ATOM 0 HA HIS B 440 -6.667 18.983 4.969 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -6.636 17.325 3.057 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -8.339 17.005 3.313 1.00 0.55 H new ATOM 0 HD1 HIS B 440 -7.684 20.534 3.991 1.00 1.04 H new ATOM 0 HD2 HIS B 440 -8.395 18.230 0.544 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -8.350 22.145 2.122 1.00 0.97 H new ATOM 2353 N THR B 441 -9.622 17.928 5.829 1.00 0.53 N ATOM 2354 CA THR B 441 -10.929 18.378 6.382 1.00 0.55 C ATOM 2355 C THR B 441 -11.109 17.772 7.776 1.00 0.56 C ATOM 2356 O THR B 441 -12.117 17.162 8.073 1.00 0.55 O ATOM 2357 CB THR B 441 -11.984 17.831 5.417 1.00 0.53 C ATOM 2358 OG1 THR B 441 -11.975 16.411 5.465 1.00 0.48 O ATOM 2359 CG2 THR B 441 -11.670 18.296 3.993 1.00 0.54 C ATOM 0 H THR B 441 -9.480 16.918 5.836 1.00 0.53 H new ATOM 0 HA THR B 441 -11.002 19.462 6.476 1.00 0.55 H new ATOM 0 HB THR B 441 -12.967 18.200 5.708 1.00 0.53 H new ATOM 0 HG1 THR B 441 -12.838 16.090 5.801 1.00 0.48 H new ATOM 0 HG21 THR B 441 -12.423 17.905 3.308 1.00 0.54 H new ATOM 0 HG22 THR B 441 -11.677 19.385 3.956 1.00 0.54 H new ATOM 0 HG23 THR B 441 -10.687 17.929 3.699 1.00 0.54 H new ATOM 2367 N GLN B 442 -10.115 17.922 8.620 1.00 0.59 N ATOM 2368 CA GLN B 442 -10.168 17.351 10.004 1.00 0.62 C ATOM 2369 C GLN B 442 -11.566 17.473 10.621 1.00 0.64 C ATOM 2370 O GLN B 442 -12.135 18.544 10.697 1.00 0.69 O ATOM 2371 CB GLN B 442 -9.163 18.180 10.805 1.00 0.69 C ATOM 2372 CG GLN B 442 -9.548 19.660 10.733 1.00 1.43 C ATOM 2373 CD GLN B 442 -8.338 20.522 11.100 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -7.213 20.160 10.818 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -8.524 21.655 11.720 1.00 2.47 N ATOM 0 H GLN B 442 -9.254 18.425 8.404 1.00 0.59 H new ATOM 0 HA GLN B 442 -9.935 16.286 10.001 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -9.147 17.848 11.843 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -8.158 18.035 10.408 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -9.893 19.908 9.729 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -10.374 19.865 11.414 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -9.469 21.958 11.956 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -7.725 22.238 11.968 1.00 2.47 H new ATOM 2384 N GLY B 443 -12.117 16.376 11.067 1.00 0.63 N ATOM 2385 CA GLY B 443 -13.471 16.414 11.685 1.00 0.66 C ATOM 2386 C GLY B 443 -14.537 16.240 10.605 1.00 0.64 C ATOM 2387 O GLY B 443 -15.437 15.434 10.732 1.00 0.66 O ATOM 0 H GLY B 443 -11.685 15.453 11.029 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -13.563 15.624 12.430 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -13.617 17.361 12.204 1.00 0.66 H new ATOM 2391 N HIS B 444 -14.448 16.991 9.542 1.00 0.62 N ATOM 2392 CA HIS B 444 -15.462 16.867 8.456 1.00 0.62 C ATOM 2393 C HIS B 444 -15.282 15.543 7.709 1.00 0.67 C ATOM 2394 O HIS B 444 -14.781 15.506 6.602 1.00 1.34 O ATOM 2395 CB HIS B 444 -15.193 18.051 7.528 1.00 0.63 C ATOM 2396 CG HIS B 444 -15.987 19.240 7.992 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -16.380 19.397 9.312 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -16.473 20.337 7.323 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -17.069 20.550 9.396 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -17.156 21.163 8.212 1.00 1.86 N ATOM 0 H HIS B 444 -13.718 17.684 9.378 1.00 0.62 H new ATOM 0 HA HIS B 444 -16.482 16.874 8.840 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -14.129 18.289 7.524 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -15.466 17.794 6.505 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -16.345 20.530 6.268 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -17.499 20.933 10.309 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -17.622 22.046 8.004 1.00 1.86 H new ATOM 2408 N LYS B 445 -15.690 14.455 8.304 1.00 0.62 N ATOM 2409 CA LYS B 445 -15.546 13.134 7.627 1.00 0.51 C ATOM 2410 C LYS B 445 -16.338 13.122 6.315 1.00 0.51 C ATOM 2411 O LYS B 445 -16.090 12.320 5.437 1.00 0.57 O ATOM 2412 CB LYS B 445 -16.129 12.120 8.613 1.00 0.62 C ATOM 2413 CG LYS B 445 -17.604 12.444 8.867 1.00 1.31 C ATOM 2414 CD LYS B 445 -17.821 12.738 10.354 1.00 1.56 C ATOM 2415 CE LYS B 445 -18.743 11.676 10.959 1.00 2.23 C ATOM 2416 NZ LYS B 445 -17.891 10.936 11.931 1.00 2.52 N ATOM 0 H LYS B 445 -16.117 14.424 9.230 1.00 0.62 H new ATOM 0 HA LYS B 445 -14.510 12.910 7.374 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -16.031 11.111 8.213 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -15.573 12.147 9.550 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -17.905 13.304 8.269 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -18.229 11.606 8.557 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -16.865 12.744 10.877 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -18.259 13.728 10.479 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -19.600 12.133 11.453 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -19.135 11.010 10.191 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -18.453 10.190 12.388 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -17.087 10.506 11.431 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -17.537 11.594 12.654 1.00 2.52 H new ATOM 2430 N GLN B 446 -17.292 14.004 6.177 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.099 14.041 4.923 1.00 0.56 C ATOM 2432 C GLN B 446 -17.260 14.583 3.764 1.00 0.52 C ATOM 2433 O GLN B 446 -17.214 14.006 2.696 1.00 0.51 O ATOM 2434 CB GLN B 446 -19.262 14.985 5.229 1.00 0.64 C ATOM 2435 CG GLN B 446 -20.500 14.538 4.449 1.00 1.11 C ATOM 2436 CD GLN B 446 -20.287 14.800 2.958 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -20.039 13.885 2.198 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -20.374 16.020 2.504 1.00 2.40 N ATOM 0 H GLN B 446 -17.547 14.700 6.878 1.00 0.53 H new ATOM 0 HA GLN B 446 -18.443 13.050 4.627 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -19.473 14.985 6.298 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -18.997 16.007 4.957 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -20.687 13.478 4.619 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -21.379 15.077 4.802 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -20.582 16.788 3.142 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -20.234 16.206 1.511 1.00 2.40 H new ATOM 2447 N GLU B 447 -16.593 15.690 3.965 1.00 0.52 N ATOM 2448 CA GLU B 447 -15.756 16.268 2.871 1.00 0.51 C ATOM 2449 C GLU B 447 -14.838 15.194 2.281 1.00 0.45 C ATOM 2450 O GLU B 447 -14.620 15.139 1.087 1.00 0.45 O ATOM 2451 CB GLU B 447 -14.933 17.369 3.539 1.00 0.53 C ATOM 2452 CG GLU B 447 -15.214 18.704 2.848 1.00 0.80 C ATOM 2453 CD GLU B 447 -16.642 19.150 3.160 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -16.913 19.441 4.314 1.00 1.96 O ATOM 2455 OE2 GLU B 447 -17.443 19.193 2.241 1.00 2.14 O ATOM 0 H GLU B 447 -16.591 16.218 4.838 1.00 0.52 H new ATOM 0 HA GLU B 447 -16.361 16.653 2.050 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -15.185 17.435 4.597 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -13.871 17.132 3.478 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -14.504 19.458 3.188 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -15.081 18.603 1.771 1.00 0.80 H new ATOM 2462 N ALA B 448 -14.306 14.335 3.108 1.00 0.43 N ATOM 2463 CA ALA B 448 -13.413 13.263 2.587 1.00 0.39 C ATOM 2464 C ALA B 448 -14.135 12.472 1.491 1.00 0.40 C ATOM 2465 O ALA B 448 -13.519 11.843 0.654 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.121 12.368 3.792 1.00 0.39 C ATOM 0 H ALA B 448 -14.451 14.330 4.118 1.00 0.43 H new ATOM 0 HA ALA B 448 -12.498 13.660 2.147 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -12.466 11.551 3.488 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -12.633 12.954 4.571 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.056 11.960 4.177 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.441 12.505 1.492 1.00 0.44 N ATOM 2473 CA ALA B 449 -16.209 11.763 0.451 1.00 0.47 C ATOM 2474 C ALA B 449 -15.742 12.179 -0.946 1.00 0.48 C ATOM 2475 O ALA B 449 -15.107 11.422 -1.653 1.00 0.49 O ATOM 2476 CB ALA B 449 -17.666 12.177 0.667 1.00 0.52 C ATOM 0 H ALA B 449 -16.009 13.014 2.169 1.00 0.44 H new ATOM 0 HA ALA B 449 -16.072 10.684 0.527 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -18.300 11.672 -0.062 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -17.978 11.898 1.673 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -17.760 13.256 0.544 1.00 0.52 H new ATOM 2482 N ARG B 450 -16.054 13.382 -1.347 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.634 13.857 -2.696 1.00 0.52 C ATOM 2484 C ARG B 450 -14.108 13.811 -2.825 1.00 0.49 C ATOM 2485 O ARG B 450 -13.572 13.600 -3.895 1.00 0.50 O ATOM 2486 CB ARG B 450 -16.135 15.300 -2.776 1.00 0.57 C ATOM 2487 CG ARG B 450 -16.244 15.724 -4.243 1.00 0.78 C ATOM 2488 CD ARG B 450 -17.496 16.584 -4.434 1.00 1.37 C ATOM 2489 NE ARG B 450 -18.522 15.654 -4.980 1.00 1.76 N ATOM 2490 CZ ARG B 450 -19.790 15.920 -4.829 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -20.291 17.017 -5.329 1.00 2.93 N ATOM 2492 NH2 ARG B 450 -20.559 15.091 -4.175 1.00 2.97 N ATOM 0 H ARG B 450 -16.583 14.058 -0.796 1.00 0.49 H new ATOM 0 HA ARG B 450 -16.037 13.237 -3.497 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -17.106 15.386 -2.289 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -15.452 15.963 -2.245 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -15.357 16.284 -4.538 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -16.293 14.844 -4.884 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -17.822 17.022 -3.490 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -17.307 17.410 -5.120 1.00 1.37 H new ATOM 0 HE ARG B 450 -18.233 14.809 -5.472 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -19.691 17.666 -5.838 1.00 2.93 H new ATOM 0 HH12 ARG B 450 -21.283 17.225 -5.211 1.00 2.93 H new ATOM 0 HH21 ARG B 450 -20.168 14.235 -3.782 1.00 2.97 H new ATOM 0 HH22 ARG B 450 -21.550 15.300 -4.057 1.00 2.97 H new ATOM 2506 N LEU B 451 -13.407 14.011 -1.744 1.00 0.48 N ATOM 2507 CA LEU B 451 -11.916 13.982 -1.806 1.00 0.47 C ATOM 2508 C LEU B 451 -11.434 12.637 -2.356 1.00 0.44 C ATOM 2509 O LEU B 451 -10.423 12.554 -3.023 1.00 0.48 O ATOM 2510 CB LEU B 451 -11.457 14.167 -0.361 1.00 0.46 C ATOM 2511 CG LEU B 451 -10.893 15.577 -0.182 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -10.946 15.965 1.298 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -9.442 15.610 -0.663 1.00 1.04 C ATOM 0 H LEU B 451 -13.800 14.193 -0.821 1.00 0.48 H new ATOM 0 HA LEU B 451 -11.515 14.754 -2.463 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.293 14.009 0.320 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -10.698 13.426 -0.112 1.00 0.46 H new ATOM 0 HG LEU B 451 -11.487 16.281 -0.764 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -10.544 16.970 1.425 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -11.979 15.941 1.644 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -10.352 15.260 1.880 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -9.039 16.615 -0.536 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -8.849 14.905 -0.080 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.402 15.334 -1.717 1.00 1.04 H new ATOM 2525 N LEU B 452 -12.151 11.581 -2.079 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.730 10.244 -2.587 1.00 0.40 C ATOM 2527 C LEU B 452 -12.728 9.733 -3.630 1.00 0.46 C ATOM 2528 O LEU B 452 -12.773 8.557 -3.932 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.735 9.331 -1.358 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.828 9.914 -0.270 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.475 9.697 1.099 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.470 9.209 -0.307 1.00 0.43 C ATOM 0 H LEU B 452 -13.007 11.586 -1.525 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.753 10.279 -3.069 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.751 9.224 -0.978 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -11.392 8.334 -1.634 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.689 10.981 -0.444 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.832 10.111 1.875 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.444 10.196 1.127 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.611 8.629 1.272 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.824 9.623 0.467 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.609 8.142 -0.131 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -9.009 9.359 -1.283 1.00 0.43 H new ATOM 2544 N GLY B 453 -13.535 10.603 -4.180 1.00 0.50 N ATOM 2545 CA GLY B 453 -14.530 10.154 -5.197 1.00 0.56 C ATOM 2546 C GLY B 453 -15.379 9.028 -4.604 1.00 0.58 C ATOM 2547 O GLY B 453 -15.697 8.060 -5.265 1.00 0.68 O ATOM 0 H GLY B 453 -13.548 11.601 -3.970 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -15.166 10.988 -5.494 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -14.019 9.807 -6.095 1.00 0.56 H new ATOM 2551 N TRP B 454 -15.736 9.149 -3.358 1.00 0.54 N ATOM 2552 CA TRP B 454 -16.555 8.088 -2.704 1.00 0.60 C ATOM 2553 C TRP B 454 -17.987 8.577 -2.477 1.00 0.69 C ATOM 2554 O TRP B 454 -18.930 8.054 -3.035 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.867 7.841 -1.359 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.820 6.777 -1.491 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -14.211 6.404 -2.645 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -14.246 5.946 -0.441 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -13.302 5.396 -2.372 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -13.282 5.076 -1.030 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.463 5.860 0.959 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -12.558 4.150 -0.255 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.737 4.930 1.742 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.786 4.077 1.135 1.00 0.51 C ATOM 0 H TRP B 454 -15.496 9.940 -2.760 1.00 0.54 H new ATOM 0 HA TRP B 454 -16.620 7.187 -3.314 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.412 8.765 -1.002 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.606 7.542 -0.616 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -14.404 6.826 -3.620 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -12.719 4.945 -3.077 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -15.187 6.508 1.430 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.833 3.500 -0.722 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -13.910 4.872 2.806 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -12.234 3.369 1.736 1.00 0.51 H new ATOM 2575 N GLY B 455 -18.153 9.571 -1.648 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.519 10.090 -1.362 1.00 0.72 C ATOM 2577 C GLY B 455 -19.831 9.859 0.117 1.00 0.70 C ATOM 2578 O GLY B 455 -18.957 9.537 0.894 1.00 0.64 O ATOM 0 H GLY B 455 -17.398 10.047 -1.155 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.577 11.152 -1.599 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -20.254 9.583 -1.987 1.00 0.72 H new ATOM 2582 N ALA B 456 -21.063 10.012 0.516 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.411 9.789 1.950 1.00 0.77 C ATOM 2584 C ALA B 456 -21.805 8.326 2.166 1.00 0.82 C ATOM 2585 O ALA B 456 -21.574 7.759 3.216 1.00 0.83 O ATOM 2586 CB ALA B 456 -22.595 10.715 2.225 1.00 0.84 C ATOM 0 H ALA B 456 -21.842 10.281 -0.085 1.00 0.77 H new ATOM 0 HA ALA B 456 -20.576 9.999 2.619 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -22.908 10.607 3.263 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.299 11.748 2.041 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.423 10.452 1.567 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.394 7.710 1.178 1.00 0.90 N ATOM 2593 CA ALA B 457 -22.796 6.283 1.325 1.00 0.97 C ATOM 2594 C ALA B 457 -21.556 5.388 1.286 1.00 0.89 C ATOM 2595 O ALA B 457 -21.436 4.441 2.038 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.705 6.000 0.129 1.00 1.07 C ATOM 0 H ALA B 457 -22.614 8.133 0.276 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.302 6.087 2.270 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -24.044 4.965 0.166 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.568 6.665 0.162 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -23.153 6.168 -0.796 1.00 1.07 H new ATOM 2602 N THR B 458 -20.627 5.687 0.418 1.00 0.84 N ATOM 2603 CA THR B 458 -19.391 4.859 0.336 1.00 0.77 C ATOM 2604 C THR B 458 -18.553 5.055 1.602 1.00 0.68 C ATOM 2605 O THR B 458 -18.147 4.106 2.244 1.00 0.67 O ATOM 2606 CB THR B 458 -18.642 5.382 -0.891 1.00 0.76 C ATOM 2607 OG1 THR B 458 -19.457 5.224 -2.044 1.00 0.85 O ATOM 2608 CG2 THR B 458 -17.342 4.598 -1.071 1.00 0.72 C ATOM 0 H THR B 458 -20.671 6.468 -0.237 1.00 0.84 H new ATOM 0 HA THR B 458 -19.607 3.794 0.253 1.00 0.77 H new ATOM 0 HB THR B 458 -18.409 6.438 -0.752 1.00 0.76 H new ATOM 0 HG1 THR B 458 -19.440 6.049 -2.572 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.810 4.972 -1.946 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.717 4.721 -0.186 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.571 3.541 -1.210 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.299 6.281 1.967 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.495 6.546 3.195 1.00 0.57 C ATOM 2618 C LEU B 459 -18.108 5.807 4.388 1.00 0.60 C ATOM 2619 O LEU B 459 -17.415 5.370 5.285 1.00 0.58 O ATOM 2620 CB LEU B 459 -17.576 8.060 3.400 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.167 8.654 3.386 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.235 10.114 2.941 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -15.566 8.584 4.790 1.00 0.46 C ATOM 0 H LEU B 459 -18.614 7.113 1.468 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.464 6.204 3.102 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.180 8.512 2.614 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.067 8.283 4.347 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.544 8.087 2.694 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.231 10.538 2.931 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -16.663 10.170 1.940 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -16.860 10.677 3.634 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -14.562 9.008 4.777 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -16.190 9.150 5.482 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -15.517 7.544 5.113 1.00 0.46 H new ATOM 2635 N THR B 460 -19.405 5.663 4.398 1.00 0.68 N ATOM 2636 CA THR B 460 -20.070 4.951 5.526 1.00 0.74 C ATOM 2637 C THR B 460 -20.178 3.456 5.212 1.00 0.76 C ATOM 2638 O THR B 460 -19.819 2.616 6.014 1.00 0.75 O ATOM 2639 CB THR B 460 -21.459 5.584 5.625 1.00 0.83 C ATOM 2640 OG1 THR B 460 -21.326 6.963 5.939 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.267 4.885 6.718 1.00 0.92 C ATOM 0 H THR B 460 -20.034 6.008 3.673 1.00 0.68 H new ATOM 0 HA THR B 460 -19.516 5.039 6.460 1.00 0.74 H new ATOM 0 HB THR B 460 -21.976 5.475 4.672 1.00 0.83 H new ATOM 0 HG1 THR B 460 -21.379 7.492 5.116 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.256 5.338 6.786 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.369 3.827 6.475 1.00 0.92 H new ATOM 0 HG23 THR B 460 -21.753 4.990 7.674 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.667 3.119 4.051 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.794 1.680 3.685 1.00 0.85 C ATOM 2651 C ALA B 461 -19.410 1.026 3.648 1.00 0.79 C ATOM 2652 O ALA B 461 -19.230 -0.095 4.080 1.00 0.83 O ATOM 2653 CB ALA B 461 -21.426 1.678 2.293 1.00 0.92 C ATOM 0 H ALA B 461 -20.984 3.778 3.340 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.394 1.120 4.403 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -21.553 0.650 1.952 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -22.398 2.169 2.334 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.778 2.213 1.599 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.432 1.721 3.134 1.00 0.72 N ATOM 2660 CA LYS B 462 -17.060 1.142 3.071 1.00 0.68 C ATOM 2661 C LYS B 462 -16.507 0.943 4.484 1.00 0.65 C ATOM 2662 O LYS B 462 -15.656 0.108 4.717 1.00 0.66 O ATOM 2663 CB LYS B 462 -16.228 2.176 2.310 1.00 0.66 C ATOM 2664 CG LYS B 462 -14.855 1.584 1.982 1.00 0.99 C ATOM 2665 CD LYS B 462 -14.737 1.379 0.470 1.00 0.91 C ATOM 2666 CE LYS B 462 -14.171 -0.015 0.187 1.00 1.31 C ATOM 2667 NZ LYS B 462 -13.642 0.060 -1.204 1.00 1.39 N ATOM 0 H LYS B 462 -18.524 2.664 2.755 1.00 0.72 H new ATOM 0 HA LYS B 462 -17.044 0.168 2.583 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.740 2.466 1.392 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -16.113 3.079 2.910 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -14.067 2.250 2.332 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -14.723 0.634 2.500 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -15.714 1.489 -0.000 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -14.088 2.141 0.038 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -13.384 -0.273 0.895 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -14.943 -0.780 0.275 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -13.237 -0.860 -1.471 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -14.415 0.300 -1.857 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -12.905 0.792 -1.256 1.00 1.39 H new ATOM 2681 N LEU B 463 -16.986 1.705 5.431 1.00 0.65 N ATOM 2682 CA LEU B 463 -16.489 1.559 6.829 1.00 0.65 C ATOM 2683 C LEU B 463 -16.805 0.158 7.360 1.00 0.68 C ATOM 2684 O LEU B 463 -15.985 -0.477 7.992 1.00 0.70 O ATOM 2685 CB LEU B 463 -17.246 2.620 7.628 1.00 0.68 C ATOM 2686 CG LEU B 463 -16.547 2.847 8.969 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -16.929 4.223 9.517 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -16.984 1.766 9.960 1.00 0.99 C ATOM 0 H LEU B 463 -17.699 2.422 5.297 1.00 0.65 H new ATOM 0 HA LEU B 463 -15.409 1.687 6.900 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.287 3.553 7.065 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -18.275 2.301 7.792 1.00 0.68 H new ATOM 0 HG LEU B 463 -15.467 2.798 8.829 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -16.431 4.385 10.473 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -16.620 4.994 8.811 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -18.009 4.272 9.658 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -16.486 1.927 10.916 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -18.064 1.816 10.100 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -16.713 0.785 9.571 1.00 0.99 H new ATOM 2700 N LYS B 464 -17.990 -0.328 7.107 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.358 -1.688 7.598 1.00 0.77 C ATOM 2702 C LYS B 464 -17.988 -2.745 6.554 1.00 0.76 C ATOM 2703 O LYS B 464 -17.541 -3.826 6.882 1.00 0.82 O ATOM 2704 CB LYS B 464 -19.873 -1.639 7.796 1.00 0.85 C ATOM 2705 CG LYS B 464 -20.193 -1.655 9.293 1.00 1.20 C ATOM 2706 CD LYS B 464 -21.602 -1.103 9.519 1.00 1.62 C ATOM 2707 CE LYS B 464 -22.569 -2.261 9.779 1.00 2.25 C ATOM 2708 NZ LYS B 464 -23.201 -1.947 11.090 1.00 2.66 N ATOM 0 H LYS B 464 -18.718 0.156 6.583 1.00 0.72 H new ATOM 0 HA LYS B 464 -17.834 -1.952 8.517 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.282 -0.740 7.336 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.343 -2.491 7.304 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -20.123 -2.672 9.680 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -19.464 -1.055 9.838 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -21.604 -0.417 10.366 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -21.925 -0.534 8.647 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -23.316 -2.337 8.989 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -22.043 -3.215 9.813 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -23.878 -2.697 11.337 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -22.467 -1.888 11.824 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -23.700 -1.037 11.026 1.00 2.66 H new ATOM 2722 N GLU B 465 -18.175 -2.441 5.299 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.837 -3.429 4.233 1.00 0.76 C ATOM 2724 C GLU B 465 -16.364 -3.834 4.330 1.00 0.69 C ATOM 2725 O GLU B 465 -15.995 -4.947 4.013 1.00 0.85 O ATOM 2726 CB GLU B 465 -18.108 -2.698 2.917 1.00 0.79 C ATOM 2727 CG GLU B 465 -17.903 -3.661 1.746 1.00 1.12 C ATOM 2728 CD GLU B 465 -19.144 -4.540 1.584 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -19.854 -4.714 2.561 1.00 2.03 O ATOM 2730 OE2 GLU B 465 -19.364 -5.024 0.487 1.00 1.94 O ATOM 0 H GLU B 465 -18.547 -1.552 4.965 1.00 0.73 H new ATOM 0 HA GLU B 465 -18.421 -4.345 4.319 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -19.126 -2.309 2.908 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -17.439 -1.843 2.820 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -17.719 -3.101 0.829 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -17.025 -4.282 1.922 1.00 1.12 H new ATOM 2737 N LEU B 466 -15.518 -2.940 4.764 1.00 0.56 N ATOM 2738 CA LEU B 466 -14.070 -3.280 4.878 1.00 0.59 C ATOM 2739 C LEU B 466 -13.871 -4.427 5.872 1.00 0.70 C ATOM 2740 O LEU B 466 -13.016 -5.272 5.697 1.00 0.81 O ATOM 2741 CB LEU B 466 -13.400 -2.005 5.393 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.709 -1.288 4.232 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -12.049 -0.006 4.742 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.640 -2.204 3.631 1.00 0.52 C ATOM 0 H LEU B 466 -15.765 -1.991 5.044 1.00 0.56 H new ATOM 0 HA LEU B 466 -13.649 -3.606 3.927 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -14.142 -1.350 5.849 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -12.673 -2.251 6.167 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.447 -1.039 3.470 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -11.557 0.504 3.914 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -12.808 0.648 5.171 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -11.311 -0.255 5.505 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -11.147 -1.694 2.803 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.903 -2.453 4.395 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -12.108 -3.119 3.266 1.00 0.52 H new ATOM 2756 N GLY B 467 -14.656 -4.464 6.915 1.00 0.77 N ATOM 2757 CA GLY B 467 -14.511 -5.558 7.917 1.00 0.97 C ATOM 2758 C GLY B 467 -15.826 -6.328 8.026 1.00 1.08 C ATOM 2759 O GLY B 467 -16.233 -6.734 9.096 1.00 1.38 O ATOM 0 H GLY B 467 -15.390 -3.785 7.116 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -13.706 -6.232 7.622 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -14.239 -5.143 8.887 1.00 0.97 H new