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 Set 1.1: B 419 GLN : amide:sc=-0.00102 K(o=-2,f=-3.1!) USER MOD Set 1.2: B 420 ASN : amide:sc= -0.105 X(o=-2,f=-1.9) USER MOD Set 1.3: B 423 SER OG : rot -106:sc= -1.94 USER MOD Set 2.1: A 419 GLN : amide:sc= 0 K(o=-2.1,f=-3.2!) USER MOD Set 2.2: A 420 ASN : amide:sc= -0.106 X(o=-2.1,f=-1.9) USER MOD Set 2.3: A 423 SER OG : rot -106:sc= -2 USER MOD Single : A 404 THR OG1 : rot 180:sc= 0.0151 USER MOD Single : A 408 GLN : amide:sc= -0.338 K(o=-0.34,f=-2.6!) USER MOD Single : A 416 SER OG : rot -100:sc= -0.587 USER MOD Single : A 418 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-4.7!) USER MOD Single : A 426 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 432 THR OG1 : rot 92:sc= 0.798 USER MOD Single : A 435 THR OG1 : rot 88:sc= 1.2 USER MOD Single : A 436 THR OG1 : rot 101:sc= 1.26 USER MOD Single : A 440 HIS : no HD1:sc= -0.332 X(o=-0.33,f=-0.01) USER MOD Single : A 441 THR OG1 : rot -160:sc=-0.00966 USER MOD Single : A 442 GLN : amide:sc= -0.0304 X(o=-0.03,f=-0.17) USER MOD Single : A 444 HIS : no HD1:sc= -1.21 K(o=-1.2,f=-2.9) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 458 THR OG1 : rot 132:sc= 0.036 USER MOD Single : A 460 THR OG1 : rot 100:sc= 1.21 USER MOD Single : A 462 LYS NZ :NH3+ 158:sc= 1.02 (180deg=0.17) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 404 THR OG1 : rot 180:sc= 0.00244 USER MOD Single : B 408 GLN : amide:sc= -0.398 K(o=-0.4,f=-2.5!) USER MOD Single : B 416 SER OG : rot -108:sc= -0.46 USER MOD Single : B 418 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-4.5!) USER MOD Single : B 426 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : B 432 THR OG1 : rot 92:sc= 0.815 USER MOD Single : B 435 THR OG1 : rot 97:sc= 1.22 USER MOD Single : B 436 THR OG1 : rot 91:sc= 1.22 USER MOD Single : B 440 HIS : no HD1:sc= -0.315 X(o=-0.32,f=-0.008) USER MOD Single : B 441 THR OG1 : rot -160:sc= -0.0268 USER MOD Single : B 442 GLN : amide:sc= -0.0127 X(o=-0.013,f=-0.2) USER MOD Single : B 444 HIS : no HD1:sc= -1.23 K(o=-1.2,f=-2.9) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 458 THR OG1 : rot 130:sc= 0.0303 USER MOD Single : B 460 THR OG1 : rot 121:sc= 1.24 USER MOD Single : B 462 LYS NZ :NH3+ 158:sc= 1.31 (180deg=0.034) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 325 N TRP A 402 6.529 2.614 1.505 1.00 0.95 N ATOM 326 CA TRP A 402 5.194 2.793 0.863 1.00 0.86 C ATOM 327 C TRP A 402 4.296 3.725 1.680 1.00 0.79 C ATOM 328 O TRP A 402 3.996 4.821 1.262 1.00 0.71 O ATOM 329 CB TRP A 402 4.592 1.392 0.813 1.00 0.96 C ATOM 330 CG TRP A 402 3.993 1.177 -0.532 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.682 0.787 -1.626 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.611 1.345 -0.949 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.810 0.698 -2.699 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.519 1.032 -2.335 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.429 1.732 -0.266 1.00 0.78 C ATOM 336 CZ2 TRP A 402 1.294 1.104 -3.024 1.00 0.83 C ATOM 337 CZ3 TRP A 402 0.195 1.807 -0.956 1.00 0.72 C ATOM 338 CH2 TRP A 402 0.129 1.493 -2.333 1.00 0.69 C ATOM 0 HA TRP A 402 5.286 3.248 -0.123 1.00 0.86 H new ATOM 0 HB2 TRP A 402 5.360 0.644 1.008 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.833 1.279 1.587 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.741 0.578 -1.659 1.00 0.94 H new ATOM 0 HE1 TRP A 402 4.086 0.420 -3.641 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.471 1.971 0.786 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 1.247 0.863 -4.076 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -0.699 2.105 -0.429 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -0.814 1.551 -2.855 1.00 0.69 H new ATOM 349 N ALA A 403 3.858 3.299 2.837 1.00 0.85 N ATOM 350 CA ALA A 403 2.970 4.169 3.670 1.00 0.85 C ATOM 351 C ALA A 403 3.549 5.584 3.772 1.00 0.80 C ATOM 352 O ALA A 403 2.846 6.562 3.620 1.00 0.76 O ATOM 353 CB ALA A 403 2.935 3.501 5.045 1.00 0.99 C ATOM 0 H ALA A 403 4.076 2.388 3.241 1.00 0.85 H new ATOM 0 HA ALA A 403 1.973 4.269 3.240 1.00 0.85 H new ATOM 0 HB1 ALA A 403 2.302 4.082 5.716 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.533 2.492 4.949 1.00 0.99 H new ATOM 0 HB3 ALA A 403 3.945 3.452 5.452 1.00 0.99 H new ATOM 359 N THR A 404 4.825 5.700 4.011 1.00 0.82 N ATOM 360 CA THR A 404 5.437 7.056 4.100 1.00 0.81 C ATOM 361 C THR A 404 5.253 7.781 2.766 1.00 0.70 C ATOM 362 O THR A 404 5.011 8.971 2.719 1.00 0.68 O ATOM 363 CB THR A 404 6.920 6.808 4.379 1.00 0.89 C ATOM 364 OG1 THR A 404 7.050 5.898 5.462 1.00 1.07 O ATOM 365 CG2 THR A 404 7.602 8.129 4.734 1.00 0.89 C ATOM 0 H THR A 404 5.468 4.920 4.148 1.00 0.82 H new ATOM 0 HA THR A 404 4.983 7.674 4.875 1.00 0.81 H new ATOM 0 HB THR A 404 7.392 6.386 3.492 1.00 0.89 H new ATOM 0 HG1 THR A 404 8.000 5.736 5.641 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.659 7.951 4.933 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.502 8.826 3.902 1.00 0.89 H new ATOM 0 HG23 THR A 404 7.133 8.554 5.621 1.00 0.89 H new ATOM 373 N LEU A 405 5.354 7.063 1.681 1.00 0.67 N ATOM 374 CA LEU A 405 5.174 7.693 0.343 1.00 0.61 C ATOM 375 C LEU A 405 3.689 7.977 0.108 1.00 0.53 C ATOM 376 O LEU A 405 3.327 8.872 -0.627 1.00 0.52 O ATOM 377 CB LEU A 405 5.700 6.649 -0.654 1.00 0.67 C ATOM 378 CG LEU A 405 5.688 7.198 -2.093 1.00 0.65 C ATOM 379 CD1 LEU A 405 4.255 7.218 -2.629 1.00 0.57 C ATOM 380 CD2 LEU A 405 6.270 8.618 -2.129 1.00 0.64 C ATOM 0 H LEU A 405 5.554 6.063 1.664 1.00 0.67 H new ATOM 0 HA LEU A 405 5.700 8.643 0.244 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.715 6.360 -0.381 1.00 0.67 H new ATOM 0 HB3 LEU A 405 5.087 5.749 -0.600 1.00 0.67 H new ATOM 0 HG LEU A 405 6.301 6.549 -2.718 1.00 0.65 H new ATOM 0 HD11 LEU A 405 4.253 7.607 -3.647 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.852 6.205 -2.627 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.638 7.856 -1.995 1.00 0.57 H new ATOM 0 HD21 LEU A 405 6.255 8.992 -3.153 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.672 9.272 -1.495 1.00 0.64 H new ATOM 0 HD23 LEU A 405 7.297 8.600 -1.765 1.00 0.64 H new ATOM 392 N LEU A 406 2.830 7.217 0.729 1.00 0.53 N ATOM 393 CA LEU A 406 1.370 7.435 0.549 1.00 0.50 C ATOM 394 C LEU A 406 0.905 8.605 1.420 1.00 0.49 C ATOM 395 O LEU A 406 0.030 9.360 1.047 1.00 0.45 O ATOM 396 CB LEU A 406 0.719 6.125 1.003 1.00 0.58 C ATOM 397 CG LEU A 406 -0.576 5.897 0.219 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.257 5.775 -1.272 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.243 4.606 0.697 1.00 1.02 C ATOM 0 H LEU A 406 3.079 6.452 1.356 1.00 0.53 H new ATOM 0 HA LEU A 406 1.106 7.683 -0.479 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.404 5.292 0.844 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.507 6.163 2.072 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.248 6.739 0.382 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.180 5.613 -1.829 1.00 0.94 H new ATOM 0 HD12 LEU A 406 0.220 6.692 -1.618 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.417 4.933 -1.432 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.165 4.444 0.138 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.568 3.766 0.534 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.472 4.687 1.760 1.00 1.02 H new ATOM 411 N ALA A 407 1.494 8.765 2.572 1.00 0.56 N ATOM 412 CA ALA A 407 1.096 9.891 3.463 1.00 0.59 C ATOM 413 C ALA A 407 1.559 11.217 2.856 1.00 0.57 C ATOM 414 O ALA A 407 0.855 12.207 2.889 1.00 0.61 O ATOM 415 CB ALA A 407 1.814 9.624 4.786 1.00 0.70 C ATOM 0 H ALA A 407 2.234 8.165 2.936 1.00 0.56 H new ATOM 0 HA ALA A 407 0.016 9.957 3.597 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.571 10.413 5.498 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.493 8.662 5.187 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.891 9.606 4.618 1.00 0.70 H new ATOM 421 N GLN A 408 2.738 11.241 2.293 1.00 0.57 N ATOM 422 CA GLN A 408 3.244 12.498 1.675 1.00 0.57 C ATOM 423 C GLN A 408 2.619 12.685 0.291 1.00 0.50 C ATOM 424 O GLN A 408 2.291 13.784 -0.111 1.00 0.50 O ATOM 425 CB GLN A 408 4.756 12.305 1.561 1.00 0.62 C ATOM 426 CG GLN A 408 5.421 12.682 2.887 1.00 0.75 C ATOM 427 CD GLN A 408 6.208 13.983 2.713 1.00 0.78 C ATOM 428 OE1 GLN A 408 6.040 14.683 1.734 1.00 1.29 O ATOM 429 NE2 GLN A 408 7.067 14.339 3.629 1.00 1.46 N ATOM 0 H GLN A 408 3.371 10.444 2.235 1.00 0.57 H new ATOM 0 HA GLN A 408 2.993 13.381 2.263 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.983 11.269 1.310 1.00 0.62 H new ATOM 0 HB3 GLN A 408 5.152 12.922 0.755 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.665 12.803 3.663 1.00 0.75 H new ATOM 0 HG3 GLN A 408 6.087 11.883 3.212 1.00 0.75 H new ATOM 0 HE21 GLN A 408 7.209 13.752 4.451 1.00 1.46 H new ATOM 0 HE22 GLN A 408 7.597 15.204 3.523 1.00 1.46 H new ATOM 438 N TRP A 409 2.448 11.616 -0.439 1.00 0.46 N ATOM 439 CA TRP A 409 1.838 11.726 -1.796 1.00 0.43 C ATOM 440 C TRP A 409 0.398 12.235 -1.675 1.00 0.40 C ATOM 441 O TRP A 409 0.032 13.236 -2.257 1.00 0.41 O ATOM 442 CB TRP A 409 1.880 10.297 -2.350 1.00 0.43 C ATOM 443 CG TRP A 409 1.055 10.190 -3.594 1.00 0.42 C ATOM 444 CD1 TRP A 409 1.366 10.751 -4.788 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.205 9.485 -3.787 1.00 0.40 C ATOM 446 NE1 TRP A 409 0.376 10.435 -5.704 1.00 0.53 N ATOM 447 CE2 TRP A 409 -0.615 9.657 -5.140 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.029 8.716 -2.926 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -1.806 9.084 -5.626 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.228 8.137 -3.408 1.00 0.43 C ATOM 451 CH2 TRP A 409 -2.615 8.321 -4.756 1.00 0.48 C ATOM 0 H TRP A 409 2.704 10.671 -0.154 1.00 0.46 H new ATOM 0 HA TRP A 409 2.361 12.426 -2.448 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.911 10.015 -2.565 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.508 9.599 -1.600 1.00 0.43 H new ATOM 0 HD1 TRP A 409 2.243 11.347 -4.992 1.00 0.50 H new ATOM 0 HE1 TRP A 409 0.379 10.740 -6.677 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -0.740 8.571 -1.896 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -2.098 9.227 -6.656 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -2.849 7.553 -2.744 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -3.530 7.878 -5.120 1.00 0.48 H new ATOM 462 N ALA A 410 -0.419 11.554 -0.918 1.00 0.42 N ATOM 463 CA ALA A 410 -1.831 12.003 -0.759 1.00 0.44 C ATOM 464 C ALA A 410 -1.867 13.453 -0.270 1.00 0.45 C ATOM 465 O ALA A 410 -2.759 14.209 -0.599 1.00 0.47 O ATOM 466 CB ALA A 410 -2.429 11.061 0.289 1.00 0.51 C ATOM 0 H ALA A 410 -0.170 10.709 -0.404 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.388 11.971 -1.696 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.472 11.326 0.464 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.371 10.033 -0.070 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -1.870 11.152 1.221 1.00 0.51 H new ATOM 472 N ASP A 411 -0.897 13.847 0.508 1.00 0.48 N ATOM 473 CA ASP A 411 -0.867 15.251 1.012 1.00 0.53 C ATOM 474 C ASP A 411 -0.464 16.201 -0.118 1.00 0.53 C ATOM 475 O ASP A 411 -1.103 17.206 -0.357 1.00 0.58 O ATOM 476 CB ASP A 411 0.187 15.252 2.120 1.00 0.60 C ATOM 477 CG ASP A 411 0.197 16.616 2.813 1.00 1.03 C ATOM 478 OD1 ASP A 411 0.485 17.596 2.144 1.00 1.51 O ATOM 479 OD2 ASP A 411 -0.083 16.658 4.000 1.00 1.78 O ATOM 0 H ASP A 411 -0.123 13.258 0.817 1.00 0.48 H new ATOM 0 HA ASP A 411 -1.838 15.584 1.378 1.00 0.53 H new ATOM 0 HB2 ASP A 411 -0.030 14.466 2.844 1.00 0.60 H new ATOM 0 HB3 ASP A 411 1.170 15.038 1.701 1.00 0.60 H new ATOM 484 N ARG A 412 0.590 15.884 -0.821 1.00 0.51 N ATOM 485 CA ARG A 412 1.031 16.764 -1.942 1.00 0.56 C ATOM 486 C ARG A 412 -0.130 16.991 -2.909 1.00 0.55 C ATOM 487 O ARG A 412 -0.381 18.096 -3.349 1.00 0.63 O ATOM 488 CB ARG A 412 2.160 15.996 -2.629 1.00 0.58 C ATOM 489 CG ARG A 412 3.503 16.641 -2.280 1.00 0.96 C ATOM 490 CD ARG A 412 4.519 16.330 -3.382 1.00 1.50 C ATOM 491 NE ARG A 412 5.370 17.549 -3.473 1.00 1.90 N ATOM 492 CZ ARG A 412 6.480 17.519 -4.157 1.00 2.41 C ATOM 493 NH1 ARG A 412 6.444 17.397 -5.456 1.00 3.02 N ATOM 494 NH2 ARG A 412 7.627 17.613 -3.543 1.00 2.89 N ATOM 0 H ARG A 412 1.164 15.055 -0.668 1.00 0.51 H new ATOM 0 HA ARG A 412 1.360 17.745 -1.598 1.00 0.56 H new ATOM 0 HB2 ARG A 412 2.151 14.954 -2.310 1.00 0.58 H new ATOM 0 HB3 ARG A 412 2.012 16.000 -3.709 1.00 0.58 H new ATOM 0 HG2 ARG A 412 3.384 17.719 -2.174 1.00 0.96 H new ATOM 0 HG3 ARG A 412 3.862 16.264 -1.322 1.00 0.96 H new ATOM 0 HD2 ARG A 412 5.114 15.451 -3.135 1.00 1.50 H new ATOM 0 HD3 ARG A 412 4.023 16.123 -4.330 1.00 1.50 H new ATOM 0 HE ARG A 412 5.085 18.407 -3.001 1.00 1.90 H new ATOM 0 HH11 ARG A 412 5.547 17.325 -5.937 1.00 3.02 H new ATOM 0 HH12 ARG A 412 7.313 17.374 -5.990 1.00 3.02 H new ATOM 0 HH21 ARG A 412 7.656 17.710 -2.528 1.00 2.89 H new ATOM 0 HH22 ARG A 412 8.495 17.590 -4.078 1.00 2.89 H new ATOM 508 N ALA A 413 -0.845 15.952 -3.234 1.00 0.50 N ATOM 509 CA ALA A 413 -1.998 16.100 -4.165 1.00 0.53 C ATOM 510 C ALA A 413 -3.097 16.930 -3.497 1.00 0.57 C ATOM 511 O ALA A 413 -3.820 17.660 -4.145 1.00 0.66 O ATOM 512 CB ALA A 413 -2.484 14.672 -4.423 1.00 0.53 C ATOM 0 H ALA A 413 -0.681 15.004 -2.895 1.00 0.50 H new ATOM 0 HA ALA A 413 -1.727 16.608 -5.090 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -3.336 14.695 -5.103 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -1.679 14.089 -4.870 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -2.784 14.214 -3.481 1.00 0.53 H new ATOM 518 N LEU A 414 -3.220 16.825 -2.202 1.00 0.54 N ATOM 519 CA LEU A 414 -4.266 17.610 -1.486 1.00 0.61 C ATOM 520 C LEU A 414 -4.081 19.103 -1.761 1.00 0.71 C ATOM 521 O LEU A 414 -5.017 19.806 -2.086 1.00 0.82 O ATOM 522 CB LEU A 414 -4.044 17.305 -0.002 1.00 0.63 C ATOM 523 CG LEU A 414 -5.343 16.783 0.615 1.00 0.71 C ATOM 524 CD1 LEU A 414 -5.716 15.448 -0.032 1.00 1.11 C ATOM 525 CD2 LEU A 414 -5.145 16.580 2.120 1.00 1.04 C ATOM 0 H LEU A 414 -2.642 16.230 -1.609 1.00 0.54 H new ATOM 0 HA LEU A 414 -5.274 17.349 -1.808 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -3.252 16.565 0.113 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -3.718 18.205 0.520 1.00 0.63 H new ATOM 0 HG LEU A 414 -6.142 17.505 0.445 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -6.642 15.076 0.408 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -5.855 15.589 -1.104 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -4.918 14.726 0.138 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -6.069 16.208 2.562 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -4.346 15.857 2.288 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -4.878 17.530 2.583 1.00 1.04 H new ATOM 537 N ARG A 415 -2.877 19.593 -1.632 1.00 0.73 N ATOM 538 CA ARG A 415 -2.630 21.040 -1.886 1.00 0.86 C ATOM 539 C ARG A 415 -2.316 21.273 -3.366 1.00 0.92 C ATOM 540 O ARG A 415 -1.315 21.871 -3.711 1.00 1.26 O ATOM 541 CB ARG A 415 -1.422 21.393 -1.018 1.00 1.01 C ATOM 542 CG ARG A 415 -1.767 22.587 -0.124 1.00 1.40 C ATOM 543 CD ARG A 415 -0.685 22.753 0.945 1.00 1.61 C ATOM 544 NE ARG A 415 -1.178 21.972 2.113 1.00 2.27 N ATOM 545 CZ ARG A 415 -0.364 21.186 2.762 1.00 2.92 C ATOM 546 NH1 ARG A 415 0.720 21.673 3.302 1.00 3.70 N ATOM 547 NH2 ARG A 415 -0.632 19.914 2.872 1.00 3.32 N ATOM 0 H ARG A 415 -2.055 19.053 -1.362 1.00 0.73 H new ATOM 0 HA ARG A 415 -3.497 21.655 -1.647 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -1.138 20.537 -0.406 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -0.565 21.632 -1.648 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -1.843 23.494 -0.724 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -2.738 22.434 0.347 1.00 1.40 H new ATOM 0 HD2 ARG A 415 0.277 22.377 0.596 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -0.542 23.802 1.203 1.00 1.61 H new ATOM 0 HE ARG A 415 -2.152 22.052 2.406 1.00 2.27 H new ATOM 0 HH11 ARG A 415 0.930 22.667 3.216 1.00 3.70 H new ATOM 0 HH12 ARG A 415 1.357 21.059 3.810 1.00 3.70 H new ATOM 0 HH21 ARG A 415 -1.479 19.533 2.450 1.00 3.32 H new ATOM 0 HH22 ARG A 415 0.005 19.301 3.380 1.00 3.32 H new ATOM 561 N SER A 416 -3.161 20.805 -4.244 1.00 0.90 N ATOM 562 CA SER A 416 -2.906 20.999 -5.701 1.00 0.99 C ATOM 563 C SER A 416 -4.143 20.604 -6.512 1.00 0.99 C ATOM 564 O SER A 416 -4.824 21.439 -7.074 1.00 1.63 O ATOM 565 CB SER A 416 -1.735 20.073 -6.024 1.00 1.20 C ATOM 566 OG SER A 416 -1.988 18.787 -5.472 1.00 1.69 O ATOM 0 H SER A 416 -4.016 20.297 -4.016 1.00 0.90 H new ATOM 0 HA SER A 416 -2.684 22.037 -5.947 1.00 0.99 H new ATOM 0 HB2 SER A 416 -1.602 19.999 -7.103 1.00 1.20 H new ATOM 0 HB3 SER A 416 -0.810 20.481 -5.616 1.00 1.20 H new ATOM 0 HG SER A 416 -1.490 18.687 -4.634 1.00 1.69 H new ATOM 572 N GLY A 417 -4.439 19.335 -6.577 1.00 1.06 N ATOM 573 CA GLY A 417 -5.630 18.884 -7.351 1.00 1.06 C ATOM 574 C GLY A 417 -5.791 17.370 -7.201 1.00 0.99 C ATOM 575 O GLY A 417 -5.878 16.645 -8.171 1.00 1.31 O ATOM 0 H GLY A 417 -3.907 18.590 -6.127 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -6.525 19.393 -6.992 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -5.514 19.146 -8.403 1.00 1.06 H new ATOM 579 N HIS A 418 -5.827 16.889 -5.989 1.00 0.78 N ATOM 580 CA HIS A 418 -5.978 15.422 -5.770 1.00 0.87 C ATOM 581 C HIS A 418 -7.264 14.912 -6.428 1.00 0.89 C ATOM 582 O HIS A 418 -8.181 15.664 -6.689 1.00 1.17 O ATOM 583 CB HIS A 418 -6.052 15.258 -4.252 1.00 1.01 C ATOM 584 CG HIS A 418 -7.227 16.031 -3.719 1.00 1.68 C ATOM 585 ND1 HIS A 418 -7.125 17.357 -3.329 1.00 2.18 N ATOM 586 CD2 HIS A 418 -8.537 15.677 -3.506 1.00 2.31 C ATOM 587 CE1 HIS A 418 -8.340 17.750 -2.906 1.00 2.86 C ATOM 588 NE2 HIS A 418 -9.238 16.764 -2.992 1.00 2.97 N ATOM 0 H HIS A 418 -5.758 17.449 -5.139 1.00 0.78 H new ATOM 0 HA HIS A 418 -5.156 14.854 -6.205 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -6.150 14.203 -3.994 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -5.130 15.614 -3.792 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -8.959 14.703 -3.707 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -8.563 18.742 -2.541 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -10.225 16.800 -2.736 1.00 2.97 H new ATOM 596 N GLN A 419 -7.334 13.636 -6.694 1.00 1.08 N ATOM 597 CA GLN A 419 -8.557 13.070 -7.332 1.00 1.25 C ATOM 598 C GLN A 419 -8.579 11.548 -7.162 1.00 1.03 C ATOM 599 O GLN A 419 -9.345 11.012 -6.386 1.00 1.28 O ATOM 600 CB GLN A 419 -8.447 13.448 -8.810 1.00 1.71 C ATOM 601 CG GLN A 419 -9.628 12.853 -9.579 1.00 2.33 C ATOM 602 CD GLN A 419 -9.477 13.168 -11.069 1.00 2.91 C ATOM 603 OE1 GLN A 419 -8.753 14.070 -11.441 1.00 3.29 O ATOM 604 NE2 GLN A 419 -10.135 12.457 -11.944 1.00 3.52 N ATOM 0 H GLN A 419 -6.596 12.960 -6.497 1.00 1.08 H new ATOM 0 HA GLN A 419 -9.474 13.454 -6.885 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -8.438 14.532 -8.919 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -7.508 13.078 -9.222 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -9.669 11.774 -9.427 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -10.565 13.264 -9.203 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -10.743 11.700 -11.632 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -10.041 12.659 -12.939 1.00 3.52 H new ATOM 613 N ASN A 420 -7.741 10.850 -7.879 1.00 0.78 N ATOM 614 CA ASN A 420 -7.709 9.366 -7.754 1.00 0.70 C ATOM 615 C ASN A 420 -6.711 8.952 -6.669 1.00 0.58 C ATOM 616 O ASN A 420 -5.699 8.340 -6.945 1.00 0.71 O ATOM 617 CB ASN A 420 -7.254 8.862 -9.125 1.00 0.86 C ATOM 618 CG ASN A 420 -8.403 8.990 -10.125 1.00 1.35 C ATOM 619 OD1 ASN A 420 -9.275 8.145 -10.177 1.00 1.96 O ATOM 620 ND2 ASN A 420 -8.443 10.018 -10.928 1.00 1.88 N ATOM 0 H ASN A 420 -7.077 11.244 -8.546 1.00 0.78 H new ATOM 0 HA ASN A 420 -8.677 8.952 -7.471 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -6.394 9.437 -9.468 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -6.934 7.822 -9.054 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -9.206 10.112 -11.599 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -7.712 10.728 -10.885 1.00 1.88 H new ATOM 627 N LEU A 421 -6.986 9.288 -5.439 1.00 0.45 N ATOM 628 CA LEU A 421 -6.050 8.919 -4.337 1.00 0.40 C ATOM 629 C LEU A 421 -6.133 7.418 -4.042 1.00 0.39 C ATOM 630 O LEU A 421 -5.205 6.674 -4.291 1.00 0.53 O ATOM 631 CB LEU A 421 -6.525 9.727 -3.129 1.00 0.42 C ATOM 632 CG LEU A 421 -5.851 11.099 -3.130 1.00 0.39 C ATOM 633 CD1 LEU A 421 -6.898 12.183 -2.862 1.00 0.50 C ATOM 634 CD2 LEU A 421 -4.784 11.144 -2.034 1.00 0.41 C ATOM 0 H LEU A 421 -7.818 9.802 -5.148 1.00 0.45 H new ATOM 0 HA LEU A 421 -5.012 9.132 -4.592 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -7.608 9.843 -3.160 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -6.288 9.195 -2.208 1.00 0.42 H new ATOM 0 HG LEU A 421 -5.386 11.273 -4.100 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.417 13.161 -2.863 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -7.660 12.153 -3.640 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.363 12.008 -1.892 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.303 12.122 -2.034 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.251 10.969 -1.065 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.037 10.372 -2.221 1.00 0.41 H new ATOM 646 N LEU A 422 -7.234 6.969 -3.506 1.00 0.33 N ATOM 647 CA LEU A 422 -7.374 5.518 -3.187 1.00 0.34 C ATOM 648 C LEU A 422 -7.483 4.691 -4.470 1.00 0.35 C ATOM 649 O LEU A 422 -7.053 3.557 -4.527 1.00 0.37 O ATOM 650 CB LEU A 422 -8.666 5.416 -2.375 1.00 0.37 C ATOM 651 CG LEU A 422 -8.375 5.734 -0.908 1.00 0.38 C ATOM 652 CD1 LEU A 422 -9.690 5.814 -0.130 1.00 0.58 C ATOM 653 CD2 LEU A 422 -7.498 4.630 -0.313 1.00 0.63 C ATOM 0 H LEU A 422 -8.044 7.544 -3.274 1.00 0.33 H new ATOM 0 HA LEU A 422 -6.512 5.135 -2.641 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.410 6.109 -2.767 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.086 4.414 -2.464 1.00 0.37 H new ATOM 0 HG LEU A 422 -7.855 6.690 -0.840 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -9.481 6.041 0.915 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.316 6.599 -0.553 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -10.211 4.859 -0.197 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -7.289 4.855 0.733 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -8.019 3.675 -0.382 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -6.560 4.573 -0.866 1.00 0.63 H new ATOM 665 N SER A 423 -8.060 5.248 -5.497 1.00 0.35 N ATOM 666 CA SER A 423 -8.206 4.491 -6.775 1.00 0.38 C ATOM 667 C SER A 423 -6.833 4.193 -7.386 1.00 0.36 C ATOM 668 O SER A 423 -6.692 3.318 -8.216 1.00 0.40 O ATOM 669 CB SER A 423 -9.009 5.414 -7.690 1.00 0.44 C ATOM 670 OG SER A 423 -8.638 6.764 -7.440 1.00 1.23 O ATOM 0 H SER A 423 -8.438 6.195 -5.509 1.00 0.35 H new ATOM 0 HA SER A 423 -8.697 3.529 -6.627 1.00 0.38 H new ATOM 0 HB2 SER A 423 -8.823 5.161 -8.734 1.00 0.44 H new ATOM 0 HB3 SER A 423 -10.076 5.280 -7.515 1.00 0.44 H new ATOM 0 HG SER A 423 -9.354 7.213 -6.943 1.00 1.23 H new ATOM 676 N GLU A 424 -5.821 4.916 -6.989 1.00 0.34 N ATOM 677 CA GLU A 424 -4.464 4.669 -7.559 1.00 0.36 C ATOM 678 C GLU A 424 -3.733 3.585 -6.761 1.00 0.32 C ATOM 679 O GLU A 424 -3.225 2.631 -7.316 1.00 0.33 O ATOM 680 CB GLU A 424 -3.735 6.008 -7.435 1.00 0.38 C ATOM 681 CG GLU A 424 -3.605 6.646 -8.819 1.00 0.58 C ATOM 682 CD GLU A 424 -2.915 8.005 -8.693 1.00 0.81 C ATOM 683 OE1 GLU A 424 -3.589 8.956 -8.333 1.00 1.54 O ATOM 684 OE2 GLU A 424 -1.726 8.071 -8.958 1.00 1.22 O ATOM 0 H GLU A 424 -5.874 5.664 -6.298 1.00 0.34 H new ATOM 0 HA GLU A 424 -4.511 4.320 -8.590 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.283 6.672 -6.766 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -2.748 5.858 -6.997 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -3.031 5.995 -9.479 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -4.590 6.767 -9.269 1.00 0.58 H new ATOM 691 N ALA A 425 -3.673 3.724 -5.465 1.00 0.31 N ATOM 692 CA ALA A 425 -2.972 2.699 -4.638 1.00 0.29 C ATOM 693 C ALA A 425 -3.858 1.459 -4.449 1.00 0.28 C ATOM 694 O ALA A 425 -3.409 0.433 -3.981 1.00 0.28 O ATOM 695 CB ALA A 425 -2.712 3.386 -3.296 1.00 0.29 C ATOM 0 H ALA A 425 -4.078 4.501 -4.943 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.050 2.354 -5.107 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.197 2.696 -2.628 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.093 4.269 -3.453 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -3.661 3.683 -2.850 1.00 0.29 H new ATOM 701 N GLN A 426 -5.112 1.544 -4.809 1.00 0.30 N ATOM 702 CA GLN A 426 -6.015 0.368 -4.647 1.00 0.31 C ATOM 703 C GLN A 426 -5.454 -0.853 -5.390 1.00 0.30 C ATOM 704 O GLN A 426 -5.237 -1.889 -4.791 1.00 0.30 O ATOM 705 CB GLN A 426 -7.346 0.800 -5.260 1.00 0.36 C ATOM 706 CG GLN A 426 -8.397 0.925 -4.155 1.00 0.45 C ATOM 707 CD GLN A 426 -9.795 0.898 -4.775 1.00 0.54 C ATOM 708 OE1 GLN A 426 -10.008 1.428 -5.847 1.00 1.23 O ATOM 709 NE2 GLN A 426 -10.765 0.299 -4.140 1.00 1.09 N ATOM 0 H GLN A 426 -5.549 2.375 -5.207 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.120 0.078 -3.602 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.229 1.753 -5.776 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.670 0.072 -6.004 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -8.288 0.108 -3.441 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -8.251 1.853 -3.602 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -10.587 -0.146 -3.240 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.701 0.276 -4.544 1.00 1.09 H new ATOM 718 N PRO A 427 -5.239 -0.703 -6.676 1.00 0.32 N ATOM 719 CA PRO A 427 -4.705 -1.826 -7.487 1.00 0.34 C ATOM 720 C PRO A 427 -3.251 -2.121 -7.110 1.00 0.31 C ATOM 721 O PRO A 427 -2.768 -3.221 -7.292 1.00 0.35 O ATOM 722 CB PRO A 427 -4.813 -1.318 -8.923 1.00 0.39 C ATOM 723 CG PRO A 427 -4.807 0.171 -8.805 1.00 0.38 C ATOM 724 CD PRO A 427 -5.462 0.502 -7.490 1.00 0.35 C ATOM 0 HA PRO A 427 -5.246 -2.760 -7.333 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -3.979 -1.670 -9.530 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.727 -1.673 -9.400 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.789 0.558 -8.839 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -5.349 0.627 -9.633 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -5.015 1.384 -7.031 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.525 0.711 -7.613 1.00 0.35 H new ATOM 732 N GLU A 428 -2.551 -1.157 -6.581 1.00 0.29 N ATOM 733 CA GLU A 428 -1.135 -1.403 -6.190 1.00 0.29 C ATOM 734 C GLU A 428 -1.079 -2.479 -5.103 1.00 0.27 C ATOM 735 O GLU A 428 -0.331 -3.433 -5.196 1.00 0.32 O ATOM 736 CB GLU A 428 -0.628 -0.064 -5.653 1.00 0.29 C ATOM 737 CG GLU A 428 0.495 0.460 -6.552 1.00 0.71 C ATOM 738 CD GLU A 428 0.114 1.838 -7.095 1.00 1.37 C ATOM 739 OE1 GLU A 428 -0.726 1.894 -7.979 1.00 2.12 O ATOM 740 OE2 GLU A 428 0.668 2.815 -6.619 1.00 2.07 O ATOM 0 H GLU A 428 -2.896 -0.214 -6.403 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.527 -1.755 -7.023 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.445 0.657 -5.617 1.00 0.29 H new ATOM 0 HB3 GLU A 428 -0.264 -0.185 -4.633 1.00 0.29 H new ATOM 0 HG2 GLU A 428 1.426 0.524 -5.989 1.00 0.71 H new ATOM 0 HG3 GLU A 428 0.668 -0.232 -7.376 1.00 0.71 H new ATOM 747 N LEU A 429 -1.876 -2.340 -4.077 1.00 0.26 N ATOM 748 CA LEU A 429 -1.880 -3.362 -2.991 1.00 0.26 C ATOM 749 C LEU A 429 -2.524 -4.654 -3.503 1.00 0.25 C ATOM 750 O LEU A 429 -2.116 -5.744 -3.155 1.00 0.28 O ATOM 751 CB LEU A 429 -2.718 -2.738 -1.866 1.00 0.26 C ATOM 752 CG LEU A 429 -3.008 -3.783 -0.781 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.331 -3.374 0.528 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.521 -3.875 -0.561 1.00 0.56 C ATOM 0 H LEU A 429 -2.524 -1.563 -3.944 1.00 0.26 H new ATOM 0 HA LEU A 429 -0.878 -3.620 -2.648 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.186 -1.891 -1.433 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -3.654 -2.353 -2.270 1.00 0.26 H new ATOM 0 HG LEU A 429 -2.620 -4.751 -1.099 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -2.541 -4.120 1.295 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.254 -3.304 0.374 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -2.715 -2.406 0.849 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -4.732 -4.617 0.209 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -4.902 -2.904 -0.244 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -5.007 -4.170 -1.491 1.00 0.56 H new ATOM 766 N GLU A 430 -3.529 -4.538 -4.327 1.00 0.27 N ATOM 767 CA GLU A 430 -4.199 -5.757 -4.862 1.00 0.28 C ATOM 768 C GLU A 430 -3.238 -6.541 -5.759 1.00 0.30 C ATOM 769 O GLU A 430 -3.283 -7.752 -5.823 1.00 0.33 O ATOM 770 CB GLU A 430 -5.384 -5.232 -5.675 1.00 0.30 C ATOM 771 CG GLU A 430 -6.489 -4.762 -4.727 1.00 0.61 C ATOM 772 CD GLU A 430 -7.844 -5.244 -5.247 1.00 1.45 C ATOM 773 OE1 GLU A 430 -8.021 -5.264 -6.454 1.00 2.18 O ATOM 774 OE2 GLU A 430 -8.683 -5.584 -4.428 1.00 2.05 O ATOM 0 H GLU A 430 -3.915 -3.652 -4.653 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.516 -6.435 -4.069 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -5.064 -4.408 -6.313 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.763 -6.015 -6.332 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -6.313 -5.151 -3.724 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -6.482 -3.675 -4.653 1.00 0.61 H new ATOM 781 N ARG A 431 -2.371 -5.860 -6.457 1.00 0.33 N ATOM 782 CA ARG A 431 -1.414 -6.570 -7.353 1.00 0.37 C ATOM 783 C ARG A 431 -0.277 -7.195 -6.540 1.00 0.36 C ATOM 784 O ARG A 431 0.001 -8.373 -6.650 1.00 0.38 O ATOM 785 CB ARG A 431 -0.873 -5.487 -8.288 1.00 0.41 C ATOM 786 CG ARG A 431 -0.553 -6.103 -9.653 1.00 0.59 C ATOM 787 CD ARG A 431 0.834 -5.643 -10.109 1.00 1.32 C ATOM 788 NE ARG A 431 1.175 -6.532 -11.254 1.00 1.56 N ATOM 789 CZ ARG A 431 1.667 -6.024 -12.350 1.00 2.19 C ATOM 790 NH1 ARG A 431 2.952 -5.821 -12.458 1.00 2.87 N ATOM 791 NH2 ARG A 431 0.873 -5.716 -13.340 1.00 2.78 N ATOM 0 H ARG A 431 -2.284 -4.844 -6.446 1.00 0.33 H new ATOM 0 HA ARG A 431 -1.891 -7.384 -7.899 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.607 -4.689 -8.400 1.00 0.41 H new ATOM 0 HB3 ARG A 431 0.024 -5.038 -7.861 1.00 0.41 H new ATOM 0 HG2 ARG A 431 -0.584 -7.191 -9.589 1.00 0.59 H new ATOM 0 HG3 ARG A 431 -1.305 -5.805 -10.384 1.00 0.59 H new ATOM 0 HD2 ARG A 431 0.823 -4.596 -10.411 1.00 1.32 H new ATOM 0 HD3 ARG A 431 1.565 -5.735 -9.306 1.00 1.32 H new ATOM 0 HE ARG A 431 1.024 -7.538 -11.181 1.00 1.56 H new ATOM 0 HH11 ARG A 431 3.573 -6.060 -11.685 1.00 2.87 H new ATOM 0 HH12 ARG A 431 3.335 -5.424 -13.316 1.00 2.87 H new ATOM 0 HH21 ARG A 431 -0.131 -5.873 -13.256 1.00 2.78 H new ATOM 0 HH22 ARG A 431 1.257 -5.319 -14.197 1.00 2.78 H new ATOM 805 N THR A 432 0.386 -6.418 -5.725 1.00 0.41 N ATOM 806 CA THR A 432 1.505 -6.975 -4.910 1.00 0.45 C ATOM 807 C THR A 432 1.040 -8.219 -4.148 1.00 0.40 C ATOM 808 O THR A 432 1.800 -9.139 -3.918 1.00 0.56 O ATOM 809 CB THR A 432 1.882 -5.859 -3.935 1.00 0.53 C ATOM 810 OG1 THR A 432 2.192 -4.680 -4.665 1.00 0.61 O ATOM 811 CG2 THR A 432 3.098 -6.286 -3.112 1.00 0.62 C ATOM 0 H THR A 432 0.202 -5.424 -5.589 1.00 0.41 H new ATOM 0 HA THR A 432 2.350 -7.279 -5.527 1.00 0.45 H new ATOM 0 HB THR A 432 1.045 -5.663 -3.265 1.00 0.53 H new ATOM 0 HG1 THR A 432 1.385 -4.131 -4.758 1.00 0.61 H new ATOM 0 HG21 THR A 432 3.365 -5.489 -2.418 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.859 -7.190 -2.552 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.938 -6.483 -3.779 1.00 0.62 H new ATOM 819 N LEU A 433 -0.204 -8.254 -3.754 1.00 0.33 N ATOM 820 CA LEU A 433 -0.715 -9.438 -3.009 1.00 0.30 C ATOM 821 C LEU A 433 -1.217 -10.503 -3.988 1.00 0.27 C ATOM 822 O LEU A 433 -0.857 -11.661 -3.898 1.00 0.25 O ATOM 823 CB LEU A 433 -1.868 -8.904 -2.158 1.00 0.37 C ATOM 824 CG LEU A 433 -1.728 -9.419 -0.724 1.00 0.42 C ATOM 825 CD1 LEU A 433 -1.776 -10.947 -0.721 1.00 0.41 C ATOM 826 CD2 LEU A 433 -0.389 -8.950 -0.145 1.00 0.44 C ATOM 0 H LEU A 433 -0.887 -7.514 -3.916 1.00 0.33 H new ATOM 0 HA LEU A 433 0.057 -9.907 -2.399 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -1.865 -7.814 -2.166 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -2.822 -9.223 -2.578 1.00 0.37 H new ATOM 0 HG LEU A 433 -2.546 -9.030 -0.117 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -1.676 -11.312 0.301 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -2.727 -11.282 -1.135 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -0.959 -11.338 -1.327 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -0.286 -9.315 0.877 1.00 0.44 H new ATOM 0 HD22 LEU A 433 0.427 -9.340 -0.753 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -0.354 -7.861 -0.146 1.00 0.44 H new ATOM 838 N LEU A 434 -2.045 -10.123 -4.922 1.00 0.32 N ATOM 839 CA LEU A 434 -2.567 -11.117 -5.904 1.00 0.32 C ATOM 840 C LEU A 434 -1.405 -11.854 -6.574 1.00 0.29 C ATOM 841 O LEU A 434 -1.465 -13.044 -6.809 1.00 0.30 O ATOM 842 CB LEU A 434 -3.343 -10.294 -6.932 1.00 0.41 C ATOM 843 CG LEU A 434 -4.054 -11.235 -7.906 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.525 -10.832 -8.021 1.00 0.84 C ATOM 845 CD2 LEU A 434 -3.393 -11.145 -9.283 1.00 1.14 C ATOM 0 H LEU A 434 -2.383 -9.169 -5.048 1.00 0.32 H new ATOM 0 HA LEU A 434 -3.195 -11.872 -5.432 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -4.070 -9.656 -6.429 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.664 -9.637 -7.475 1.00 0.41 H new ATOM 0 HG LEU A 434 -3.983 -12.258 -7.537 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -6.033 -11.502 -8.715 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.998 -10.898 -7.041 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -5.594 -9.808 -8.389 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -3.901 -11.816 -9.975 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -3.461 -10.122 -9.653 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -2.345 -11.432 -9.203 1.00 1.14 H new ATOM 857 N THR A 435 -0.347 -11.155 -6.881 1.00 0.34 N ATOM 858 CA THR A 435 0.818 -11.818 -7.534 1.00 0.37 C ATOM 859 C THR A 435 1.458 -12.817 -6.568 1.00 0.35 C ATOM 860 O THR A 435 1.746 -13.942 -6.924 1.00 0.39 O ATOM 861 CB THR A 435 1.788 -10.682 -7.863 1.00 0.45 C ATOM 862 OG1 THR A 435 1.114 -9.695 -8.631 1.00 0.52 O ATOM 863 CG2 THR A 435 2.971 -11.232 -8.662 1.00 0.55 C ATOM 0 H THR A 435 -0.238 -10.156 -6.709 1.00 0.34 H new ATOM 0 HA THR A 435 0.535 -12.376 -8.426 1.00 0.37 H new ATOM 0 HB THR A 435 2.154 -10.237 -6.938 1.00 0.45 H new ATOM 0 HG1 THR A 435 0.678 -9.055 -8.031 1.00 0.52 H new ATOM 0 HG21 THR A 435 3.661 -10.421 -8.895 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.488 -11.989 -8.072 1.00 0.55 H new ATOM 0 HG23 THR A 435 2.609 -11.678 -9.588 1.00 0.55 H new ATOM 871 N THR A 436 1.680 -12.417 -5.344 1.00 0.33 N ATOM 872 CA THR A 436 2.295 -13.352 -4.359 1.00 0.36 C ATOM 873 C THR A 436 1.438 -14.613 -4.237 1.00 0.36 C ATOM 874 O THR A 436 1.902 -15.713 -4.458 1.00 0.40 O ATOM 875 CB THR A 436 2.315 -12.583 -3.036 1.00 0.38 C ATOM 876 OG1 THR A 436 3.116 -11.418 -3.179 1.00 0.39 O ATOM 877 CG2 THR A 436 2.898 -13.474 -1.938 1.00 0.49 C ATOM 0 H THR A 436 1.463 -11.487 -4.985 1.00 0.33 H new ATOM 0 HA THR A 436 3.295 -13.670 -4.654 1.00 0.36 H new ATOM 0 HB THR A 436 1.299 -12.294 -2.766 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.538 -10.637 -3.304 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.913 -12.927 -0.995 1.00 0.49 H new ATOM 0 HG22 THR A 436 2.283 -14.367 -1.830 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.914 -13.763 -2.206 1.00 0.49 H new ATOM 885 N ALA A 437 0.186 -14.462 -3.896 1.00 0.34 N ATOM 886 CA ALA A 437 -0.699 -15.655 -3.771 1.00 0.36 C ATOM 887 C ALA A 437 -0.653 -16.474 -5.062 1.00 0.36 C ATOM 888 O ALA A 437 -0.519 -17.681 -5.033 1.00 0.41 O ATOM 889 CB ALA A 437 -2.100 -15.091 -3.535 1.00 0.35 C ATOM 0 H ALA A 437 -0.261 -13.566 -3.699 1.00 0.34 H new ATOM 0 HA ALA A 437 -0.393 -16.318 -2.962 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -2.810 -15.912 -3.433 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -2.103 -14.493 -2.624 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.388 -14.466 -4.380 1.00 0.35 H new ATOM 895 N LEU A 438 -0.748 -15.833 -6.198 1.00 0.34 N ATOM 896 CA LEU A 438 -0.694 -16.599 -7.475 1.00 0.36 C ATOM 897 C LEU A 438 0.594 -17.419 -7.520 1.00 0.42 C ATOM 898 O LEU A 438 0.607 -18.545 -7.974 1.00 0.46 O ATOM 899 CB LEU A 438 -0.709 -15.556 -8.600 1.00 0.36 C ATOM 900 CG LEU A 438 -0.451 -16.249 -9.947 1.00 0.41 C ATOM 901 CD1 LEU A 438 -1.457 -17.387 -10.149 1.00 0.42 C ATOM 902 CD2 LEU A 438 -0.606 -15.242 -11.087 1.00 0.45 C ATOM 0 H LEU A 438 -0.859 -14.824 -6.295 1.00 0.34 H new ATOM 0 HA LEU A 438 -1.532 -17.289 -7.574 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.670 -15.043 -8.622 1.00 0.36 H new ATOM 0 HB3 LEU A 438 0.053 -14.798 -8.417 1.00 0.36 H new ATOM 0 HG LEU A 438 0.562 -16.651 -9.946 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -1.268 -17.874 -11.106 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -1.350 -18.114 -9.344 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -2.469 -16.983 -10.141 1.00 0.42 H new ATOM 0 HD21 LEU A 438 -0.422 -15.739 -12.039 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -1.618 -14.836 -11.079 1.00 0.45 H new ATOM 0 HD23 LEU A 438 0.111 -14.431 -10.956 1.00 0.45 H new ATOM 914 N ARG A 439 1.681 -16.868 -7.044 1.00 0.43 N ATOM 915 CA ARG A 439 2.965 -17.628 -7.052 1.00 0.51 C ATOM 916 C ARG A 439 2.741 -19.014 -6.442 1.00 0.54 C ATOM 917 O ARG A 439 3.235 -20.010 -6.931 1.00 0.61 O ATOM 918 CB ARG A 439 3.925 -16.805 -6.191 1.00 0.52 C ATOM 919 CG ARG A 439 5.316 -16.809 -6.829 1.00 0.77 C ATOM 920 CD ARG A 439 6.071 -15.542 -6.418 1.00 1.28 C ATOM 921 NE ARG A 439 7.448 -16.006 -6.092 1.00 1.74 N ATOM 922 CZ ARG A 439 8.442 -15.160 -6.106 1.00 2.28 C ATOM 923 NH1 ARG A 439 8.891 -14.699 -7.242 1.00 2.82 N ATOM 924 NH2 ARG A 439 8.987 -14.774 -4.985 1.00 2.89 N ATOM 0 H ARG A 439 1.734 -15.928 -6.652 1.00 0.43 H new ATOM 0 HA ARG A 439 3.360 -17.776 -8.057 1.00 0.51 H new ATOM 0 HB2 ARG A 439 3.560 -15.782 -6.097 1.00 0.52 H new ATOM 0 HB3 ARG A 439 3.974 -17.220 -5.184 1.00 0.52 H new ATOM 0 HG2 ARG A 439 5.870 -17.693 -6.514 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.230 -16.857 -7.914 1.00 0.77 H new ATOM 0 HD2 ARG A 439 6.082 -14.809 -7.225 1.00 1.28 H new ATOM 0 HD3 ARG A 439 5.601 -15.063 -5.559 1.00 1.28 H new ATOM 0 HE ARG A 439 7.614 -16.985 -5.858 1.00 1.74 H new ATOM 0 HH11 ARG A 439 8.465 -15.000 -8.119 1.00 2.82 H new ATOM 0 HH12 ARG A 439 9.668 -14.038 -7.253 1.00 2.82 H new ATOM 0 HH21 ARG A 439 8.636 -15.133 -4.097 1.00 2.89 H new ATOM 0 HH22 ARG A 439 9.764 -14.113 -4.997 1.00 2.89 H new ATOM 938 N HIS A 440 1.969 -19.081 -5.391 1.00 0.52 N ATOM 939 CA HIS A 440 1.678 -20.399 -4.764 1.00 0.57 C ATOM 940 C HIS A 440 1.007 -21.297 -5.807 1.00 0.58 C ATOM 941 O HIS A 440 1.190 -22.499 -5.827 1.00 0.64 O ATOM 942 CB HIS A 440 0.719 -20.080 -3.614 1.00 0.56 C ATOM 943 CG HIS A 440 0.358 -21.348 -2.891 1.00 0.63 C ATOM 944 ND1 HIS A 440 1.271 -22.038 -2.109 1.00 1.04 N ATOM 945 CD2 HIS A 440 -0.813 -22.060 -2.816 1.00 0.82 C ATOM 946 CE1 HIS A 440 0.641 -23.113 -1.604 1.00 0.96 C ATOM 947 NE2 HIS A 440 -0.632 -23.175 -2.003 1.00 0.75 N ATOM 0 H HIS A 440 1.528 -18.279 -4.941 1.00 0.52 H new ATOM 0 HA HIS A 440 2.567 -20.918 -4.405 1.00 0.57 H new ATOM 0 HB2 HIS A 440 1.184 -19.376 -2.924 1.00 0.56 H new ATOM 0 HB3 HIS A 440 -0.181 -19.601 -4.000 1.00 0.56 H new ATOM 0 HD2 HIS A 440 -1.735 -21.795 -3.312 1.00 0.82 H new ATOM 0 HE1 HIS A 440 1.108 -23.839 -0.954 1.00 0.96 H new ATOM 0 HE2 HIS A 440 -1.323 -23.886 -1.764 1.00 0.75 H new ATOM 955 N THR A 441 0.247 -20.703 -6.687 1.00 0.54 N ATOM 956 CA THR A 441 -0.434 -21.482 -7.760 1.00 0.55 C ATOM 957 C THR A 441 -0.113 -20.843 -9.115 1.00 0.56 C ATOM 958 O THR A 441 -0.992 -20.563 -9.907 1.00 0.55 O ATOM 959 CB THR A 441 -1.930 -21.369 -7.455 1.00 0.53 C ATOM 960 OG1 THR A 441 -2.344 -20.021 -7.623 1.00 0.48 O ATOM 961 CG2 THR A 441 -2.205 -21.813 -6.017 1.00 0.54 C ATOM 0 H THR A 441 0.067 -19.699 -6.708 1.00 0.54 H new ATOM 0 HA THR A 441 -0.115 -22.524 -7.796 1.00 0.55 H new ATOM 0 HB THR A 441 -2.485 -22.011 -8.138 1.00 0.53 H new ATOM 0 HG1 THR A 441 -3.184 -19.874 -7.140 1.00 0.48 H new ATOM 0 HG21 THR A 441 -3.272 -21.730 -5.808 1.00 0.54 H new ATOM 0 HG22 THR A 441 -1.890 -22.849 -5.889 1.00 0.54 H new ATOM 0 HG23 THR A 441 -1.649 -21.177 -5.327 1.00 0.54 H new ATOM 969 N GLN A 442 1.145 -20.587 -9.366 1.00 0.59 N ATOM 970 CA GLN A 442 1.561 -19.938 -10.648 1.00 0.62 C ATOM 971 C GLN A 442 0.812 -20.523 -11.851 1.00 0.64 C ATOM 972 O GLN A 442 0.860 -21.708 -12.112 1.00 0.69 O ATOM 973 CB GLN A 442 3.058 -20.226 -10.762 1.00 0.69 C ATOM 974 CG GLN A 442 3.752 -19.056 -11.463 1.00 1.43 C ATOM 975 CD GLN A 442 3.938 -19.386 -12.945 1.00 1.79 C ATOM 976 OE1 GLN A 442 4.532 -20.390 -13.286 1.00 2.16 O ATOM 977 NE2 GLN A 442 3.452 -18.578 -13.847 1.00 2.47 N ATOM 0 H GLN A 442 1.912 -20.803 -8.729 1.00 0.59 H new ATOM 0 HA GLN A 442 1.335 -18.872 -10.646 1.00 0.62 H new ATOM 0 HB2 GLN A 442 3.487 -20.376 -9.771 1.00 0.69 H new ATOM 0 HB3 GLN A 442 3.220 -21.147 -11.322 1.00 0.69 H new ATOM 0 HG2 GLN A 442 3.158 -18.149 -11.353 1.00 1.43 H new ATOM 0 HG3 GLN A 442 4.719 -18.862 -10.999 1.00 1.43 H new ATOM 0 HE21 GLN A 442 2.953 -17.735 -13.561 1.00 2.47 H new ATOM 0 HE22 GLN A 442 3.571 -18.789 -14.838 1.00 2.47 H new ATOM 986 N GLY A 443 0.135 -19.689 -12.594 1.00 0.63 N ATOM 987 CA GLY A 443 -0.604 -20.179 -13.791 1.00 0.66 C ATOM 988 C GLY A 443 -2.059 -20.484 -13.427 1.00 0.64 C ATOM 989 O GLY A 443 -2.973 -20.128 -14.143 1.00 0.66 O ATOM 0 H GLY A 443 0.062 -18.686 -12.422 1.00 0.63 H new ATOM 0 HA2 GLY A 443 -0.569 -19.429 -14.581 1.00 0.66 H new ATOM 0 HA3 GLY A 443 -0.124 -21.076 -14.182 1.00 0.66 H new ATOM 993 N HIS A 444 -2.284 -21.148 -12.326 1.00 0.62 N ATOM 994 CA HIS A 444 -3.685 -21.477 -11.932 1.00 0.62 C ATOM 995 C HIS A 444 -4.552 -20.216 -11.933 1.00 0.67 C ATOM 996 O HIS A 444 -5.631 -20.199 -12.490 1.00 1.34 O ATOM 997 CB HIS A 444 -3.573 -22.054 -10.522 1.00 0.63 C ATOM 998 CG HIS A 444 -2.874 -23.384 -10.577 1.00 0.95 C ATOM 999 ND1 HIS A 444 -2.643 -24.147 -9.443 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -2.350 -24.103 -11.625 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -2.007 -25.268 -9.831 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -1.804 -25.292 -11.151 1.00 1.86 N ATOM 0 H HIS A 444 -1.562 -21.476 -11.684 1.00 0.62 H new ATOM 0 HA HIS A 444 -4.153 -22.177 -12.624 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -3.021 -21.368 -9.880 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -4.565 -22.171 -10.086 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -2.360 -23.792 -12.659 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -1.698 -26.053 -9.157 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -1.347 -26.024 -11.695 1.00 1.86 H new ATOM 1010 N LYS A 445 -4.088 -19.158 -11.313 1.00 0.62 N ATOM 1011 CA LYS A 445 -4.880 -17.884 -11.267 1.00 0.51 C ATOM 1012 C LYS A 445 -6.153 -18.081 -10.435 1.00 0.51 C ATOM 1013 O LYS A 445 -6.316 -17.489 -9.387 1.00 0.57 O ATOM 1014 CB LYS A 445 -5.232 -17.553 -12.724 1.00 0.62 C ATOM 1015 CG LYS A 445 -5.057 -16.053 -12.965 1.00 1.31 C ATOM 1016 CD LYS A 445 -6.369 -15.465 -13.488 1.00 1.56 C ATOM 1017 CE LYS A 445 -6.280 -13.937 -13.492 1.00 2.23 C ATOM 1018 NZ LYS A 445 -5.750 -13.588 -14.839 1.00 2.52 N ATOM 0 H LYS A 445 -3.189 -19.120 -10.833 1.00 0.62 H new ATOM 0 HA LYS A 445 -4.315 -17.075 -10.803 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -4.591 -18.118 -13.401 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -6.259 -17.849 -12.937 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -4.767 -15.556 -12.039 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -4.256 -15.880 -13.684 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -6.567 -15.831 -14.496 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -7.200 -15.790 -12.862 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -7.257 -13.484 -13.322 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -5.620 -13.578 -12.702 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -5.660 -12.555 -14.920 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -4.817 -14.028 -14.969 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -6.402 -13.937 -15.570 1.00 2.52 H new ATOM 1032 N GLN A 446 -7.052 -18.910 -10.889 1.00 0.53 N ATOM 1033 CA GLN A 446 -8.307 -19.145 -10.119 1.00 0.56 C ATOM 1034 C GLN A 446 -7.974 -19.597 -8.696 1.00 0.52 C ATOM 1035 O GLN A 446 -8.565 -19.143 -7.737 1.00 0.51 O ATOM 1036 CB GLN A 446 -9.036 -20.255 -10.877 1.00 0.64 C ATOM 1037 CG GLN A 446 -10.535 -19.951 -10.913 1.00 1.11 C ATOM 1038 CD GLN A 446 -10.874 -19.200 -12.201 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -11.138 -19.807 -13.220 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -10.878 -17.895 -12.200 1.00 2.40 N ATOM 0 H GLN A 446 -6.972 -19.435 -11.760 1.00 0.53 H new ATOM 0 HA GLN A 446 -8.915 -18.244 -10.034 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -8.646 -20.333 -11.892 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -8.861 -21.216 -10.393 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -11.106 -20.878 -10.859 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -10.816 -19.353 -10.046 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -10.656 -17.385 -11.345 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -11.103 -17.385 -13.054 1.00 2.40 H new ATOM 1049 N GLU A 447 -7.027 -20.487 -8.548 1.00 0.52 N ATOM 1050 CA GLU A 447 -6.656 -20.963 -7.181 1.00 0.51 C ATOM 1051 C GLU A 447 -6.407 -19.767 -6.259 1.00 0.45 C ATOM 1052 O GLU A 447 -6.751 -19.784 -5.095 1.00 0.45 O ATOM 1053 CB GLU A 447 -5.372 -21.771 -7.377 1.00 0.53 C ATOM 1054 CG GLU A 447 -5.715 -23.141 -7.966 1.00 0.80 C ATOM 1055 CD GLU A 447 -6.200 -24.070 -6.852 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -5.712 -23.939 -5.741 1.00 2.14 O ATOM 1057 OE2 GLU A 447 -7.053 -24.898 -7.128 1.00 1.96 O ATOM 0 H GLU A 447 -6.496 -20.904 -9.312 1.00 0.52 H new ATOM 0 HA GLU A 447 -7.443 -21.560 -6.721 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -4.692 -21.238 -8.041 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -4.857 -21.892 -6.424 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -6.487 -23.037 -8.729 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -4.839 -23.568 -8.454 1.00 0.80 H new ATOM 1064 N ALA A 448 -5.820 -18.721 -6.778 1.00 0.42 N ATOM 1065 CA ALA A 448 -5.558 -17.517 -5.938 1.00 0.39 C ATOM 1066 C ALA A 448 -6.855 -17.054 -5.271 1.00 0.40 C ATOM 1067 O ALA A 448 -6.839 -16.387 -4.255 1.00 0.40 O ATOM 1068 CB ALA A 448 -5.050 -16.457 -6.916 1.00 0.39 C ATOM 0 H ALA A 448 -5.511 -18.649 -7.747 1.00 0.42 H new ATOM 0 HA ALA A 448 -4.840 -17.713 -5.141 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -4.833 -15.536 -6.374 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -4.142 -16.815 -7.401 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -5.812 -16.263 -7.671 1.00 0.39 H new ATOM 1074 N ALA A 449 -7.978 -17.406 -5.834 1.00 0.44 N ATOM 1075 CA ALA A 449 -9.277 -16.991 -5.236 1.00 0.47 C ATOM 1076 C ALA A 449 -9.345 -17.417 -3.766 1.00 0.48 C ATOM 1077 O ALA A 449 -9.382 -16.595 -2.873 1.00 0.49 O ATOM 1078 CB ALA A 449 -10.338 -17.729 -6.053 1.00 0.52 C ATOM 0 H ALA A 449 -8.052 -17.964 -6.684 1.00 0.44 H new ATOM 0 HA ALA A 449 -9.416 -15.910 -5.261 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -11.329 -17.477 -5.675 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -10.263 -17.433 -7.099 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -10.180 -18.804 -5.968 1.00 0.52 H new ATOM 1084 N ARG A 450 -9.364 -18.697 -3.512 1.00 0.49 N ATOM 1085 CA ARG A 450 -9.432 -19.177 -2.101 1.00 0.52 C ATOM 1086 C ARG A 450 -8.206 -18.701 -1.317 1.00 0.49 C ATOM 1087 O ARG A 450 -8.265 -18.494 -0.121 1.00 0.50 O ATOM 1088 CB ARG A 450 -9.446 -20.702 -2.204 1.00 0.56 C ATOM 1089 CG ARG A 450 -10.164 -21.289 -0.986 1.00 0.78 C ATOM 1090 CD ARG A 450 -10.074 -22.816 -1.028 1.00 1.37 C ATOM 1091 NE ARG A 450 -10.933 -23.283 0.095 1.00 1.77 N ATOM 1092 CZ ARG A 450 -10.415 -23.478 1.276 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -9.334 -24.198 1.403 1.00 2.97 N ATOM 1094 NH2 ARG A 450 -10.976 -22.952 2.331 1.00 2.93 N ATOM 0 H ARG A 450 -9.335 -19.431 -4.219 1.00 0.49 H new ATOM 0 HA ARG A 450 -10.308 -18.795 -1.577 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -9.950 -21.011 -3.120 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -8.426 -21.083 -2.257 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -9.713 -20.913 -0.068 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -11.208 -20.976 -0.980 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -10.426 -23.206 -1.983 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -9.045 -23.154 -0.905 1.00 1.37 H new ATOM 0 HE ARG A 450 -11.927 -23.451 -0.059 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -8.895 -24.608 0.579 1.00 2.97 H new ATOM 0 HH12 ARG A 450 -8.929 -24.351 2.326 1.00 2.97 H new ATOM 0 HH21 ARG A 450 -11.820 -22.388 2.232 1.00 2.93 H new ATOM 0 HH22 ARG A 450 -10.570 -23.105 3.254 1.00 2.93 H new ATOM 1108 N LEU A 451 -7.097 -18.526 -1.979 1.00 0.47 N ATOM 1109 CA LEU A 451 -5.869 -18.064 -1.270 1.00 0.47 C ATOM 1110 C LEU A 451 -6.132 -16.727 -0.571 1.00 0.44 C ATOM 1111 O LEU A 451 -5.556 -16.430 0.456 1.00 0.48 O ATOM 1112 CB LEU A 451 -4.818 -17.897 -2.367 1.00 0.46 C ATOM 1113 CG LEU A 451 -3.882 -19.107 -2.367 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -4.454 -20.196 -3.277 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -2.505 -18.684 -2.882 1.00 1.04 C ATOM 0 H LEU A 451 -6.987 -18.683 -2.981 1.00 0.47 H new ATOM 0 HA LEU A 451 -5.548 -18.766 -0.501 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.303 -17.800 -3.338 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -4.248 -16.983 -2.202 1.00 0.46 H new ATOM 0 HG LEU A 451 -3.789 -19.495 -1.352 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -3.787 -21.058 -3.277 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -5.436 -20.497 -2.911 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -4.547 -19.810 -4.292 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -1.837 -19.545 -2.883 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -2.599 -18.297 -3.897 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -2.097 -17.908 -2.234 1.00 1.04 H new ATOM 1127 N LEU A 452 -6.997 -15.919 -1.121 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.294 -14.601 -0.487 1.00 0.41 C ATOM 1129 C LEU A 452 -8.763 -14.537 -0.055 1.00 0.46 C ATOM 1130 O LEU A 452 -9.302 -13.473 0.178 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.013 -13.563 -1.575 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.592 -13.746 -2.111 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.626 -13.774 -3.639 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -4.715 -12.580 -1.644 1.00 0.43 C ATOM 0 H LEU A 452 -7.511 -16.113 -1.981 1.00 0.42 H new ATOM 0 HA LEU A 452 -6.692 -14.431 0.406 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -7.734 -13.668 -2.386 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.132 -12.558 -1.171 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.180 -14.683 -1.737 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.614 -13.904 -4.023 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.251 -14.602 -3.974 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -6.037 -12.836 -4.011 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -3.702 -12.711 -2.026 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.126 -11.643 -2.019 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -4.691 -12.556 -0.555 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.415 -15.664 0.053 1.00 0.50 N ATOM 1147 CA GLY A 453 -10.849 -15.657 0.468 1.00 0.56 C ATOM 1148 C GLY A 453 -11.644 -14.750 -0.470 1.00 0.58 C ATOM 1149 O GLY A 453 -12.425 -13.924 -0.042 1.00 0.68 O ATOM 0 H GLY A 453 -9.019 -16.586 -0.127 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -11.252 -16.669 0.441 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -10.940 -15.305 1.496 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.446 -14.896 -1.750 1.00 0.54 N ATOM 1154 CA TRP A 454 -12.182 -14.042 -2.725 1.00 0.60 C ATOM 1155 C TRP A 454 -13.162 -14.889 -3.541 1.00 0.68 C ATOM 1156 O TRP A 454 -14.364 -14.747 -3.430 1.00 1.16 O ATOM 1157 CB TRP A 454 -11.096 -13.462 -3.635 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.542 -12.199 -3.045 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -10.584 -11.855 -1.733 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -9.859 -11.109 -3.729 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -9.974 -10.624 -1.568 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -9.508 -10.120 -2.766 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.509 -10.880 -5.085 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -8.834 -8.941 -3.134 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -8.830 -9.695 -5.460 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.493 -8.728 -4.486 1.00 0.52 C ATOM 0 H TRP A 454 -10.804 -15.572 -2.165 1.00 0.54 H new ATOM 0 HA TRP A 454 -12.767 -13.265 -2.233 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -10.296 -14.191 -3.768 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.510 -13.259 -4.623 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.023 -12.447 -0.944 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -9.880 -10.147 -0.671 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.762 -11.614 -5.836 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -8.580 -8.204 -2.386 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -8.569 -9.530 -6.495 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -7.975 -7.826 -4.777 1.00 0.52 H new ATOM 1177 N GLY A 455 -12.656 -15.764 -4.367 1.00 0.72 N ATOM 1178 CA GLY A 455 -13.554 -16.616 -5.197 1.00 0.72 C ATOM 1179 C GLY A 455 -13.260 -16.362 -6.677 1.00 0.70 C ATOM 1180 O GLY A 455 -12.340 -15.648 -7.019 1.00 0.64 O ATOM 0 H GLY A 455 -11.658 -15.926 -4.503 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -13.400 -17.668 -4.958 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -14.597 -16.389 -4.977 1.00 0.72 H new ATOM 1184 N ALA A 456 -14.033 -16.937 -7.557 1.00 0.77 N ATOM 1185 CA ALA A 456 -13.788 -16.717 -9.012 1.00 0.77 C ATOM 1186 C ALA A 456 -14.528 -15.463 -9.478 1.00 0.82 C ATOM 1187 O ALA A 456 -14.127 -14.808 -10.419 1.00 0.83 O ATOM 1188 CB ALA A 456 -14.348 -17.962 -9.703 1.00 0.84 C ATOM 0 H ALA A 456 -14.820 -17.547 -7.334 1.00 0.77 H new ATOM 0 HA ALA A 456 -12.732 -16.570 -9.240 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -14.205 -17.876 -10.780 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -13.826 -18.847 -9.337 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -15.412 -18.052 -9.484 1.00 0.84 H new ATOM 1194 N ALA A 457 -15.602 -15.122 -8.821 1.00 0.90 N ATOM 1195 CA ALA A 457 -16.361 -13.905 -9.222 1.00 0.97 C ATOM 1196 C ALA A 457 -15.598 -12.654 -8.785 1.00 0.89 C ATOM 1197 O ALA A 457 -15.527 -11.674 -9.502 1.00 0.91 O ATOM 1198 CB ALA A 457 -17.697 -14.008 -8.486 1.00 1.08 C ATOM 0 H ALA A 457 -15.986 -15.632 -8.026 1.00 0.90 H new ATOM 0 HA ALA A 457 -16.501 -13.836 -10.301 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -18.315 -13.144 -8.731 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -18.211 -14.920 -8.791 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -17.519 -14.034 -7.411 1.00 1.08 H new ATOM 1204 N THR A 458 -15.019 -12.682 -7.616 1.00 0.84 N ATOM 1205 CA THR A 458 -14.251 -11.499 -7.133 1.00 0.77 C ATOM 1206 C THR A 458 -12.958 -11.357 -7.937 1.00 0.68 C ATOM 1207 O THR A 458 -12.678 -10.320 -8.505 1.00 0.67 O ATOM 1208 CB THR A 458 -13.944 -11.798 -5.665 1.00 0.76 C ATOM 1209 OG1 THR A 458 -15.161 -11.989 -4.956 1.00 0.85 O ATOM 1210 CG2 THR A 458 -13.173 -10.627 -5.052 1.00 0.72 C ATOM 0 H THR A 458 -15.044 -13.474 -6.974 1.00 0.84 H new ATOM 0 HA THR A 458 -14.804 -10.567 -7.248 1.00 0.77 H new ATOM 0 HB THR A 458 -13.339 -12.702 -5.599 1.00 0.76 H new ATOM 0 HG1 THR A 458 -15.103 -12.808 -4.421 1.00 0.85 H new ATOM 0 HG21 THR A 458 -12.955 -10.842 -4.006 1.00 0.72 H new ATOM 0 HG22 THR A 458 -12.239 -10.483 -5.595 1.00 0.72 H new ATOM 0 HG23 THR A 458 -13.775 -9.721 -5.118 1.00 0.72 H new ATOM 1218 N LEU A 459 -12.168 -12.397 -7.996 1.00 0.64 N ATOM 1219 CA LEU A 459 -10.894 -12.331 -8.772 1.00 0.57 C ATOM 1220 C LEU A 459 -11.167 -11.793 -10.182 1.00 0.60 C ATOM 1221 O LEU A 459 -10.323 -11.171 -10.796 1.00 0.58 O ATOM 1222 CB LEU A 459 -10.395 -13.776 -8.835 1.00 0.56 C ATOM 1223 CG LEU A 459 -9.007 -13.870 -8.196 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -8.829 -15.247 -7.561 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -7.935 -13.673 -9.266 1.00 0.46 C ATOM 0 H LEU A 459 -12.350 -13.291 -7.540 1.00 0.64 H new ATOM 0 HA LEU A 459 -10.161 -11.668 -8.313 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -11.091 -14.434 -8.315 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -10.353 -14.112 -9.871 1.00 0.56 H new ATOM 0 HG LEU A 459 -8.911 -13.097 -7.433 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -7.841 -15.313 -7.106 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -9.591 -15.396 -6.796 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -8.928 -16.016 -8.327 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -6.948 -13.740 -8.809 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -8.035 -14.446 -10.028 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -8.056 -12.692 -9.726 1.00 0.46 H new ATOM 1237 N THR A 460 -12.345 -12.028 -10.692 1.00 0.68 N ATOM 1238 CA THR A 460 -12.683 -11.532 -12.057 1.00 0.74 C ATOM 1239 C THR A 460 -13.305 -10.136 -11.976 1.00 0.76 C ATOM 1240 O THR A 460 -12.842 -9.203 -12.602 1.00 0.75 O ATOM 1241 CB THR A 460 -13.697 -12.540 -12.600 1.00 0.83 C ATOM 1242 OG1 THR A 460 -13.100 -13.828 -12.650 1.00 0.82 O ATOM 1243 CG2 THR A 460 -14.135 -12.123 -14.005 1.00 0.92 C ATOM 0 H THR A 460 -13.089 -12.543 -10.222 1.00 0.68 H new ATOM 0 HA THR A 460 -11.804 -11.449 -12.697 1.00 0.74 H new ATOM 0 HB THR A 460 -14.568 -12.567 -11.946 1.00 0.83 H new ATOM 0 HG1 THR A 460 -13.380 -14.349 -11.868 1.00 0.82 H new ATOM 0 HG21 THR A 460 -14.857 -12.843 -14.390 1.00 0.92 H new ATOM 0 HG22 THR A 460 -14.593 -11.135 -13.965 1.00 0.92 H new ATOM 0 HG23 THR A 460 -13.267 -12.094 -14.663 1.00 0.92 H new ATOM 1251 N ALA A 461 -14.351 -9.985 -11.210 1.00 0.81 N ATOM 1252 CA ALA A 461 -15.003 -8.649 -11.093 1.00 0.85 C ATOM 1253 C ALA A 461 -14.019 -7.633 -10.506 1.00 0.79 C ATOM 1254 O ALA A 461 -14.051 -6.464 -10.834 1.00 0.83 O ATOM 1255 CB ALA A 461 -16.183 -8.865 -10.145 1.00 0.92 C ATOM 0 H ALA A 461 -14.782 -10.728 -10.660 1.00 0.81 H new ATOM 0 HA ALA A 461 -15.325 -8.259 -12.059 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -16.716 -7.924 -10.007 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -16.860 -9.607 -10.570 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -15.816 -9.219 -9.182 1.00 0.92 H new ATOM 1261 N LYS A 462 -13.145 -8.070 -9.642 1.00 0.72 N ATOM 1262 CA LYS A 462 -12.161 -7.127 -9.037 1.00 0.68 C ATOM 1263 C LYS A 462 -11.122 -6.709 -10.082 1.00 0.66 C ATOM 1264 O LYS A 462 -10.531 -5.651 -9.994 1.00 0.67 O ATOM 1265 CB LYS A 462 -11.499 -7.916 -7.906 1.00 0.66 C ATOM 1266 CG LYS A 462 -10.815 -6.947 -6.939 1.00 0.99 C ATOM 1267 CD LYS A 462 -11.467 -7.058 -5.560 1.00 0.91 C ATOM 1268 CE LYS A 462 -12.906 -6.543 -5.632 1.00 1.31 C ATOM 1269 NZ LYS A 462 -12.919 -5.320 -4.783 1.00 1.39 N ATOM 0 H LYS A 462 -13.069 -9.038 -9.329 1.00 0.72 H new ATOM 0 HA LYS A 462 -12.632 -6.214 -8.673 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -12.245 -8.508 -7.377 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -10.769 -8.614 -8.315 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -9.752 -7.176 -6.870 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -10.898 -5.926 -7.311 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -11.457 -8.095 -5.224 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -10.899 -6.481 -4.830 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -13.193 -6.314 -6.658 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -13.611 -7.288 -5.263 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -13.717 -4.713 -5.060 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -13.021 -5.592 -3.784 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -12.028 -4.799 -4.911 1.00 1.39 H new ATOM 1283 N LEU A 463 -10.894 -7.531 -11.070 1.00 0.65 N ATOM 1284 CA LEU A 463 -9.894 -7.175 -12.117 1.00 0.65 C ATOM 1285 C LEU A 463 -10.274 -5.849 -12.781 1.00 0.68 C ATOM 1286 O LEU A 463 -9.482 -4.928 -12.849 1.00 0.70 O ATOM 1287 CB LEU A 463 -9.956 -8.319 -13.131 1.00 0.68 C ATOM 1288 CG LEU A 463 -8.865 -8.124 -14.184 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -8.046 -9.408 -14.315 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -9.511 -7.795 -15.532 1.00 0.99 C ATOM 0 H LEU A 463 -11.356 -8.432 -11.197 1.00 0.65 H new ATOM 0 HA LEU A 463 -8.893 -7.049 -11.705 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -9.822 -9.275 -12.625 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -10.936 -8.345 -13.607 1.00 0.68 H new ATOM 0 HG LEU A 463 -8.212 -7.305 -13.882 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -7.268 -9.268 -15.066 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -7.586 -9.646 -13.356 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -8.699 -10.227 -14.617 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -8.734 -7.656 -16.284 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -10.164 -8.615 -15.832 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -10.096 -6.880 -15.441 1.00 0.99 H new ATOM 1302 N LYS A 464 -11.478 -5.744 -13.274 1.00 0.72 N ATOM 1303 CA LYS A 464 -11.907 -4.477 -13.934 1.00 0.77 C ATOM 1304 C LYS A 464 -12.338 -3.449 -12.883 1.00 0.76 C ATOM 1305 O LYS A 464 -12.374 -2.262 -13.140 1.00 0.82 O ATOM 1306 CB LYS A 464 -13.093 -4.873 -14.813 1.00 0.85 C ATOM 1307 CG LYS A 464 -12.670 -4.847 -16.283 1.00 1.20 C ATOM 1308 CD LYS A 464 -13.520 -5.840 -17.078 1.00 1.62 C ATOM 1309 CE LYS A 464 -12.611 -6.703 -17.956 1.00 2.25 C ATOM 1310 NZ LYS A 464 -12.855 -6.227 -19.345 1.00 2.66 N ATOM 0 H LYS A 464 -12.183 -6.480 -13.249 1.00 0.72 H new ATOM 0 HA LYS A 464 -11.103 -4.020 -14.512 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -13.444 -5.869 -14.542 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -13.925 -4.187 -14.651 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -12.790 -3.843 -16.689 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -11.614 -5.103 -16.373 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -14.092 -6.471 -16.398 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -14.240 -5.305 -17.697 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -11.564 -6.585 -17.676 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -12.851 -7.761 -17.853 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -12.266 -6.772 -20.007 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -13.858 -6.358 -19.586 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -12.611 -5.218 -19.414 1.00 2.66 H new ATOM 1324 N GLU A 465 -12.667 -3.895 -11.701 1.00 0.73 N ATOM 1325 CA GLU A 465 -13.097 -2.942 -10.638 1.00 0.76 C ATOM 1326 C GLU A 465 -11.968 -1.957 -10.320 1.00 0.69 C ATOM 1327 O GLU A 465 -12.187 -0.768 -10.195 1.00 0.85 O ATOM 1328 CB GLU A 465 -13.404 -3.819 -9.424 1.00 0.79 C ATOM 1329 CG GLU A 465 -13.932 -2.947 -8.283 1.00 1.12 C ATOM 1330 CD GLU A 465 -14.794 -3.796 -7.348 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -15.724 -4.419 -7.834 1.00 1.95 O ATOM 1332 OE2 GLU A 465 -14.510 -3.811 -6.161 1.00 2.03 O ATOM 0 H GLU A 465 -12.657 -4.877 -11.426 1.00 0.73 H new ATOM 0 HA GLU A 465 -13.959 -2.347 -10.940 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -14.142 -4.577 -9.687 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -12.504 -4.346 -9.106 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -13.100 -2.510 -7.731 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -14.518 -2.120 -8.684 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.764 -2.442 -10.186 1.00 0.56 N ATOM 1340 CA LEU A 466 -9.624 -1.532 -9.874 1.00 0.59 C ATOM 1341 C LEU A 466 -9.532 -0.418 -10.922 1.00 0.70 C ATOM 1342 O LEU A 466 -9.083 0.675 -10.642 1.00 0.81 O ATOM 1343 CB LEU A 466 -8.381 -2.422 -9.929 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.162 -3.082 -8.568 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -6.963 -4.029 -8.648 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -7.890 -2.004 -7.515 1.00 0.52 C ATOM 0 H LEU A 466 -10.520 -3.428 -10.279 1.00 0.56 H new ATOM 0 HA LEU A 466 -9.737 -1.047 -8.904 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -8.501 -3.184 -10.699 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -7.508 -1.829 -10.201 1.00 0.56 H new ATOM 0 HG LEU A 466 -9.053 -3.645 -8.290 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -6.806 -4.500 -7.678 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -7.155 -4.797 -9.397 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -6.072 -3.466 -8.926 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -7.734 -2.475 -6.544 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -6.999 -1.441 -7.793 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -8.743 -1.328 -7.457 1.00 0.52 H new ATOM 1358 N GLY A 467 -9.954 -0.688 -12.128 1.00 0.77 N ATOM 1359 CA GLY A 467 -9.889 0.355 -13.190 1.00 0.97 C ATOM 1360 C GLY A 467 -11.290 0.601 -13.752 1.00 1.08 C ATOM 1361 O GLY A 467 -11.456 0.932 -14.908 1.00 1.38 O ATOM 0 H GLY A 467 -10.340 -1.585 -12.423 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -9.482 1.280 -12.781 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -9.217 0.036 -13.987 1.00 0.97 H new ATOM 1723 N TRP B 402 6.243 -1.213 4.672 1.00 0.95 N ATOM 1724 CA TRP B 402 4.923 -1.881 4.484 1.00 0.86 C ATOM 1725 C TRP B 402 4.990 -2.968 3.409 1.00 0.79 C ATOM 1726 O TRP B 402 4.888 -4.139 3.702 1.00 0.71 O ATOM 1727 CB TRP B 402 3.979 -0.766 4.048 1.00 0.96 C ATOM 1728 CG TRP B 402 2.706 -0.893 4.808 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.502 -0.414 6.052 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.469 -1.545 4.405 1.00 0.76 C ATOM 1731 NE1 TRP B 402 1.212 -0.725 6.449 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.531 -1.422 5.469 1.00 0.83 C ATOM 1733 CE3 TRP B 402 1.067 -2.225 3.227 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -0.765 -1.959 5.370 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 -0.236 -2.767 3.122 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -1.151 -2.634 4.192 1.00 0.69 C ATOM 0 HA TRP B 402 4.595 -2.378 5.397 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.434 0.207 4.232 1.00 0.96 H new ATOM 0 HB3 TRP B 402 3.787 -0.831 2.977 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.227 0.125 6.643 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.814 -0.471 7.353 1.00 1.00 H new ATOM 0 HE3 TRP B 402 1.760 -2.330 2.405 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.460 -1.856 6.190 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.533 -3.284 2.221 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -2.145 -3.049 4.108 1.00 0.69 H new ATOM 1747 N ALA B 403 5.152 -2.593 2.166 1.00 0.85 N ATOM 1748 CA ALA B 403 5.215 -3.617 1.075 1.00 0.85 C ATOM 1749 C ALA B 403 6.175 -4.748 1.457 1.00 0.80 C ATOM 1750 O ALA B 403 5.870 -5.911 1.298 1.00 0.76 O ATOM 1751 CB ALA B 403 5.731 -2.861 -0.149 1.00 0.99 C ATOM 0 H ALA B 403 5.243 -1.625 1.858 1.00 0.85 H new ATOM 0 HA ALA B 403 4.246 -4.080 0.889 1.00 0.85 H new ATOM 0 HB1 ALA B 403 5.805 -3.545 -0.994 1.00 0.99 H new ATOM 0 HB2 ALA B 403 5.042 -2.053 -0.395 1.00 0.99 H new ATOM 0 HB3 ALA B 403 6.715 -2.445 0.068 1.00 0.99 H new ATOM 1757 N THR B 404 7.327 -4.416 1.974 1.00 0.82 N ATOM 1758 CA THR B 404 8.287 -5.480 2.378 1.00 0.81 C ATOM 1759 C THR B 404 7.645 -6.358 3.455 1.00 0.70 C ATOM 1760 O THR B 404 7.820 -7.559 3.482 1.00 0.69 O ATOM 1761 CB THR B 404 9.498 -4.734 2.940 1.00 0.89 C ATOM 1762 OG1 THR B 404 9.900 -3.728 2.022 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.649 -5.717 3.159 1.00 0.89 C ATOM 0 H THR B 404 7.643 -3.459 2.133 1.00 0.82 H new ATOM 0 HA THR B 404 8.569 -6.131 1.550 1.00 0.81 H new ATOM 0 HB THR B 404 9.232 -4.273 3.891 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.675 -3.248 2.382 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.511 -5.184 3.559 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.340 -6.488 3.864 1.00 0.89 H new ATOM 0 HG23 THR B 404 10.918 -6.180 2.210 1.00 0.89 H new ATOM 1771 N LEU B 405 6.889 -5.759 4.335 1.00 0.67 N ATOM 1772 CA LEU B 405 6.217 -6.545 5.408 1.00 0.61 C ATOM 1773 C LEU B 405 5.041 -7.323 4.812 1.00 0.53 C ATOM 1774 O LEU B 405 4.650 -8.357 5.312 1.00 0.52 O ATOM 1775 CB LEU B 405 5.730 -5.492 6.415 1.00 0.67 C ATOM 1776 CG LEU B 405 5.105 -6.156 7.657 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.716 -6.697 7.313 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.994 -7.304 8.154 1.00 0.64 C ATOM 0 H LEU B 405 6.708 -4.755 4.357 1.00 0.67 H new ATOM 0 HA LEU B 405 6.875 -7.276 5.879 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.566 -4.861 6.718 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.996 -4.842 5.939 1.00 0.67 H new ATOM 0 HG LEU B 405 5.019 -5.408 8.445 1.00 0.64 H new ATOM 0 HD11 LEU B 405 3.279 -7.165 8.195 1.00 0.57 H new ATOM 0 HD12 LEU B 405 3.078 -5.877 6.984 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.800 -7.434 6.515 1.00 0.57 H new ATOM 0 HD21 LEU B 405 5.539 -7.763 9.032 1.00 0.64 H new ATOM 0 HD22 LEU B 405 6.098 -8.051 7.367 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.978 -6.915 8.417 1.00 0.64 H new ATOM 1790 N LEU B 406 4.478 -6.827 3.745 1.00 0.53 N ATOM 1791 CA LEU B 406 3.329 -7.526 3.108 1.00 0.50 C ATOM 1792 C LEU B 406 3.837 -8.689 2.252 1.00 0.49 C ATOM 1793 O LEU B 406 3.205 -9.721 2.150 1.00 0.45 O ATOM 1794 CB LEU B 406 2.654 -6.462 2.238 1.00 0.57 C ATOM 1795 CG LEU B 406 1.153 -6.748 2.150 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.535 -6.679 3.546 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.485 -5.704 1.254 1.00 1.02 C ATOM 0 H LEU B 406 4.767 -5.963 3.285 1.00 0.53 H new ATOM 0 HA LEU B 406 2.638 -7.948 3.837 1.00 0.50 H new ATOM 0 HB2 LEU B 406 2.822 -5.472 2.661 1.00 0.57 H new ATOM 0 HB3 LEU B 406 3.093 -6.461 1.241 1.00 0.57 H new ATOM 0 HG LEU B 406 1.001 -7.743 1.731 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.534 -6.883 3.481 1.00 0.94 H new ATOM 0 HD12 LEU B 406 1.008 -7.421 4.190 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.690 -5.684 3.964 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.584 -5.908 1.192 1.00 1.02 H new ATOM 0 HD22 LEU B 406 0.641 -4.711 1.675 1.00 1.02 H new ATOM 0 HD23 LEU B 406 0.921 -5.748 0.256 1.00 1.02 H new ATOM 1809 N ALA B 407 4.979 -8.530 1.641 1.00 0.56 N ATOM 1810 CA ALA B 407 5.531 -9.628 0.800 1.00 0.59 C ATOM 1811 C ALA B 407 5.982 -10.786 1.694 1.00 0.57 C ATOM 1812 O ALA B 407 5.784 -11.942 1.378 1.00 0.61 O ATOM 1813 CB ALA B 407 6.725 -9.008 0.073 1.00 0.70 C ATOM 0 H ALA B 407 5.553 -7.688 1.688 1.00 0.56 H new ATOM 0 HA ALA B 407 4.798 -10.030 0.100 1.00 0.59 H new ATOM 0 HB1 ALA B 407 7.188 -9.757 -0.570 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.386 -8.169 -0.534 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.453 -8.656 0.804 1.00 0.70 H new ATOM 1819 N GLN B 408 6.583 -10.481 2.813 1.00 0.57 N ATOM 1820 CA GLN B 408 7.039 -11.560 3.733 1.00 0.57 C ATOM 1821 C GLN B 408 5.855 -12.079 4.552 1.00 0.50 C ATOM 1822 O GLN B 408 5.739 -13.259 4.817 1.00 0.50 O ATOM 1823 CB GLN B 408 8.073 -10.895 4.643 1.00 0.62 C ATOM 1824 CG GLN B 408 9.438 -10.899 3.954 1.00 0.75 C ATOM 1825 CD GLN B 408 10.370 -11.880 4.668 1.00 0.78 C ATOM 1826 OE1 GLN B 408 9.929 -12.689 5.458 1.00 1.29 O ATOM 1827 NE2 GLN B 408 11.651 -11.839 4.420 1.00 1.46 N ATOM 0 H GLN B 408 6.777 -9.531 3.129 1.00 0.57 H new ATOM 0 HA GLN B 408 7.459 -12.413 3.200 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.771 -9.872 4.868 1.00 0.62 H new ATOM 0 HB3 GLN B 408 8.132 -11.426 5.593 1.00 0.62 H new ATOM 0 HG2 GLN B 408 9.328 -11.183 2.907 1.00 0.75 H new ATOM 0 HG3 GLN B 408 9.867 -9.897 3.969 1.00 0.75 H new ATOM 0 HE21 GLN B 408 12.020 -11.159 3.756 1.00 1.46 H new ATOM 0 HE22 GLN B 408 12.283 -12.487 4.890 1.00 1.46 H new ATOM 1836 N TRP B 409 4.972 -11.205 4.950 1.00 0.46 N ATOM 1837 CA TRP B 409 3.789 -11.642 5.745 1.00 0.43 C ATOM 1838 C TRP B 409 2.916 -12.577 4.900 1.00 0.40 C ATOM 1839 O TRP B 409 2.634 -13.696 5.285 1.00 0.41 O ATOM 1840 CB TRP B 409 3.050 -10.342 6.078 1.00 0.43 C ATOM 1841 CG TRP B 409 1.696 -10.637 6.645 1.00 0.42 C ATOM 1842 CD1 TRP B 409 1.460 -11.184 7.861 1.00 0.50 C ATOM 1843 CD2 TRP B 409 0.394 -10.404 6.037 1.00 0.40 C ATOM 1844 NE1 TRP B 409 0.091 -11.302 8.042 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -0.612 -10.837 6.948 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.014 -9.863 4.791 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -1.981 -10.736 6.633 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.388 -9.759 4.468 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.370 -10.195 5.389 1.00 0.48 C ATOM 0 H TRP B 409 5.019 -10.204 4.759 1.00 0.46 H new ATOM 0 HA TRP B 409 4.057 -12.194 6.646 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.631 -9.760 6.793 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.949 -9.734 5.179 1.00 0.43 H new ATOM 0 HD1 TRP B 409 2.215 -11.480 8.574 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -0.344 -11.686 8.881 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.730 -9.528 4.083 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -2.728 -11.070 7.338 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -1.688 -9.346 3.516 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.418 -10.114 5.140 1.00 0.48 H new ATOM 1860 N ALA B 410 2.489 -12.129 3.752 1.00 0.42 N ATOM 1861 CA ALA B 410 1.639 -12.993 2.886 1.00 0.44 C ATOM 1862 C ALA B 410 2.354 -14.317 2.611 1.00 0.45 C ATOM 1863 O ALA B 410 1.734 -15.353 2.467 1.00 0.47 O ATOM 1864 CB ALA B 410 1.454 -12.197 1.594 1.00 0.51 C ATOM 0 H ALA B 410 2.692 -11.203 3.376 1.00 0.42 H new ATOM 0 HA ALA B 410 0.683 -13.238 3.348 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.836 -12.768 0.900 1.00 0.51 H new ATOM 0 HB2 ALA B 410 0.967 -11.248 1.818 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.427 -12.007 1.141 1.00 0.51 H new ATOM 1870 N ASP B 411 3.656 -14.292 2.546 1.00 0.48 N ATOM 1871 CA ASP B 411 4.414 -15.550 2.290 1.00 0.53 C ATOM 1872 C ASP B 411 4.409 -16.424 3.546 1.00 0.53 C ATOM 1873 O ASP B 411 4.112 -17.602 3.494 1.00 0.58 O ATOM 1874 CB ASP B 411 5.837 -15.097 1.957 1.00 0.60 C ATOM 1875 CG ASP B 411 6.673 -16.306 1.534 1.00 1.03 C ATOM 1876 OD1 ASP B 411 6.842 -17.199 2.348 1.00 1.51 O ATOM 1877 OD2 ASP B 411 7.130 -16.318 0.403 1.00 1.78 O ATOM 0 H ASP B 411 4.229 -13.455 2.659 1.00 0.48 H new ATOM 0 HA ASP B 411 3.979 -16.141 1.484 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.816 -14.358 1.156 1.00 0.60 H new ATOM 0 HB3 ASP B 411 6.289 -14.615 2.824 1.00 0.60 H new ATOM 1882 N ARG B 412 4.727 -15.854 4.677 1.00 0.52 N ATOM 1883 CA ARG B 412 4.732 -16.650 5.938 1.00 0.56 C ATOM 1884 C ARG B 412 3.381 -17.340 6.121 1.00 0.55 C ATOM 1885 O ARG B 412 3.304 -18.503 6.461 1.00 0.63 O ATOM 1886 CB ARG B 412 4.971 -15.628 7.053 1.00 0.58 C ATOM 1887 CG ARG B 412 6.402 -15.763 7.576 1.00 0.96 C ATOM 1888 CD ARG B 412 6.472 -15.250 9.017 1.00 1.50 C ATOM 1889 NE ARG B 412 7.471 -16.127 9.687 1.00 1.90 N ATOM 1890 CZ ARG B 412 7.935 -15.805 10.865 1.00 2.41 C ATOM 1891 NH1 ARG B 412 7.149 -15.835 11.906 1.00 3.02 N ATOM 1892 NH2 ARG B 412 9.185 -15.457 10.999 1.00 2.89 N ATOM 0 H ARG B 412 4.983 -14.872 4.782 1.00 0.52 H new ATOM 0 HA ARG B 412 5.493 -17.430 5.936 1.00 0.56 H new ATOM 0 HB2 ARG B 412 4.805 -14.619 6.677 1.00 0.58 H new ATOM 0 HB3 ARG B 412 4.260 -15.787 7.864 1.00 0.58 H new ATOM 0 HG2 ARG B 412 6.718 -16.805 7.534 1.00 0.96 H new ATOM 0 HG3 ARG B 412 7.086 -15.197 6.944 1.00 0.96 H new ATOM 0 HD2 ARG B 412 6.779 -14.205 9.050 1.00 1.50 H new ATOM 0 HD3 ARG B 412 5.500 -15.312 9.506 1.00 1.50 H new ATOM 0 HE ARG B 412 7.793 -16.978 9.227 1.00 1.90 H new ATOM 0 HH11 ARG B 412 6.172 -16.110 11.800 1.00 3.02 H new ATOM 0 HH12 ARG B 412 7.511 -15.584 12.826 1.00 3.02 H new ATOM 0 HH21 ARG B 412 9.799 -15.437 10.185 1.00 2.89 H new ATOM 0 HH22 ARG B 412 9.549 -15.205 11.918 1.00 2.89 H new ATOM 1906 N ALA B 413 2.315 -16.628 5.887 1.00 0.50 N ATOM 1907 CA ALA B 413 0.963 -17.237 6.035 1.00 0.53 C ATOM 1908 C ALA B 413 0.760 -18.308 4.961 1.00 0.57 C ATOM 1909 O ALA B 413 0.083 -19.296 5.173 1.00 0.66 O ATOM 1910 CB ALA B 413 -0.017 -16.081 5.834 1.00 0.53 C ATOM 0 H ALA B 413 2.321 -15.649 5.599 1.00 0.50 H new ATOM 0 HA ALA B 413 0.824 -17.719 7.003 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -1.039 -16.449 5.928 1.00 0.53 H new ATOM 0 HB2 ALA B 413 0.164 -15.315 6.589 1.00 0.53 H new ATOM 0 HB3 ALA B 413 0.124 -15.653 4.842 1.00 0.53 H new ATOM 1916 N LEU B 414 1.348 -18.121 3.812 1.00 0.54 N ATOM 1917 CA LEU B 414 1.197 -19.126 2.721 1.00 0.62 C ATOM 1918 C LEU B 414 1.675 -20.499 3.206 1.00 0.71 C ATOM 1919 O LEU B 414 1.008 -21.498 3.029 1.00 0.82 O ATOM 1920 CB LEU B 414 2.090 -18.620 1.588 1.00 0.63 C ATOM 1921 CG LEU B 414 1.267 -18.491 0.305 1.00 0.71 C ATOM 1922 CD1 LEU B 414 0.183 -17.429 0.498 1.00 1.11 C ATOM 1923 CD2 LEU B 414 2.183 -18.077 -0.848 1.00 1.03 C ATOM 0 H LEU B 414 1.928 -17.314 3.581 1.00 0.54 H new ATOM 0 HA LEU B 414 0.161 -19.239 2.402 1.00 0.62 H new ATOM 0 HB2 LEU B 414 2.521 -17.655 1.854 1.00 0.63 H new ATOM 0 HB3 LEU B 414 2.921 -19.308 1.431 1.00 0.63 H new ATOM 0 HG LEU B 414 0.801 -19.449 0.075 1.00 0.71 H new ATOM 0 HD11 LEU B 414 -0.403 -17.337 -0.416 1.00 1.11 H new ATOM 0 HD12 LEU B 414 -0.470 -17.721 1.320 1.00 1.11 H new ATOM 0 HD13 LEU B 414 0.649 -16.471 0.728 1.00 1.11 H new ATOM 0 HD21 LEU B 414 1.597 -17.985 -1.763 1.00 1.03 H new ATOM 0 HD22 LEU B 414 2.648 -17.119 -0.617 1.00 1.03 H new ATOM 0 HD23 LEU B 414 2.957 -18.832 -0.987 1.00 1.03 H new ATOM 1935 N ARG B 415 2.828 -20.551 3.818 1.00 0.73 N ATOM 1936 CA ARG B 415 3.349 -21.857 4.313 1.00 0.87 C ATOM 1937 C ARG B 415 2.849 -22.120 5.737 1.00 0.93 C ATOM 1938 O ARG B 415 3.620 -22.390 6.635 1.00 1.26 O ATOM 1939 CB ARG B 415 4.870 -21.707 4.298 1.00 1.02 C ATOM 1940 CG ARG B 415 5.489 -22.853 3.495 1.00 1.40 C ATOM 1941 CD ARG B 415 6.964 -22.550 3.225 1.00 1.61 C ATOM 1942 NE ARG B 415 6.980 -21.858 1.906 1.00 2.27 N ATOM 1943 CZ ARG B 415 7.707 -20.788 1.739 1.00 2.92 C ATOM 1944 NH1 ARG B 415 8.995 -20.837 1.941 1.00 3.70 N ATOM 1945 NH2 ARG B 415 7.146 -19.668 1.370 1.00 3.32 N ATOM 0 H ARG B 415 3.430 -19.747 3.996 1.00 0.73 H new ATOM 0 HA ARG B 415 3.016 -22.694 3.700 1.00 0.87 H new ATOM 0 HB2 ARG B 415 5.147 -20.749 3.857 1.00 1.02 H new ATOM 0 HB3 ARG B 415 5.257 -21.713 5.317 1.00 1.02 H new ATOM 0 HG2 ARG B 415 5.394 -23.789 4.045 1.00 1.40 H new ATOM 0 HG3 ARG B 415 4.955 -22.981 2.553 1.00 1.40 H new ATOM 0 HD2 ARG B 415 7.387 -21.919 4.007 1.00 1.61 H new ATOM 0 HD3 ARG B 415 7.556 -23.465 3.198 1.00 1.61 H new ATOM 0 HE ARG B 415 6.422 -22.221 1.133 1.00 2.27 H new ATOM 0 HH11 ARG B 415 9.433 -21.712 2.229 1.00 3.70 H new ATOM 0 HH12 ARG B 415 9.564 -20.000 1.810 1.00 3.70 H new ATOM 0 HH21 ARG B 415 6.139 -19.630 1.212 1.00 3.32 H new ATOM 0 HH22 ARG B 415 7.715 -18.831 1.240 1.00 3.32 H new ATOM 1959 N SER B 416 1.564 -22.045 5.948 1.00 0.90 N ATOM 1960 CA SER B 416 1.017 -22.292 7.314 1.00 0.99 C ATOM 1961 C SER B 416 -0.509 -22.406 7.260 1.00 0.99 C ATOM 1962 O SER B 416 -1.069 -23.471 7.433 1.00 1.63 O ATOM 1963 CB SER B 416 1.433 -21.072 8.133 1.00 1.20 C ATOM 1964 OG SER B 416 1.125 -19.890 7.406 1.00 1.70 O ATOM 0 H SER B 416 0.869 -21.824 5.235 1.00 0.90 H new ATOM 0 HA SER B 416 1.390 -23.220 7.746 1.00 0.99 H new ATOM 0 HB2 SER B 416 0.914 -21.069 9.091 1.00 1.20 H new ATOM 0 HB3 SER B 416 2.501 -21.112 8.349 1.00 1.20 H new ATOM 0 HG SER B 416 1.954 -19.479 7.083 1.00 1.70 H new ATOM 1970 N GLY B 417 -1.185 -21.316 7.023 1.00 1.06 N ATOM 1971 CA GLY B 417 -2.674 -21.360 6.959 1.00 1.06 C ATOM 1972 C GLY B 417 -3.206 -19.974 6.587 1.00 0.99 C ATOM 1973 O GLY B 417 -4.047 -19.419 7.266 1.00 1.31 O ATOM 0 H GLY B 417 -0.771 -20.396 6.871 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -2.996 -22.096 6.222 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -3.082 -21.673 7.920 1.00 1.06 H new ATOM 1977 N HIS B 418 -2.720 -19.412 5.515 1.00 0.78 N ATOM 1978 CA HIS B 418 -3.192 -18.062 5.098 1.00 0.88 C ATOM 1979 C HIS B 418 -4.708 -18.070 4.882 1.00 0.89 C ATOM 1980 O HIS B 418 -5.310 -19.103 4.669 1.00 1.17 O ATOM 1981 CB HIS B 418 -2.464 -17.780 3.784 1.00 1.01 C ATOM 1982 CG HIS B 418 -2.821 -18.837 2.776 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -2.094 -20.011 2.647 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -3.823 -18.913 1.841 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -2.665 -20.736 1.666 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -3.723 -20.112 1.142 1.00 2.97 N ATOM 0 H HIS B 418 -2.015 -19.831 4.909 1.00 0.78 H new ATOM 0 HA HIS B 418 -2.986 -17.302 5.852 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -2.740 -16.795 3.407 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -1.387 -17.768 3.948 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -4.575 -18.157 1.673 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -2.311 -21.704 1.343 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -4.328 -20.443 0.391 1.00 2.97 H new ATOM 1994 N GLN B 419 -5.326 -16.921 4.933 1.00 1.08 N ATOM 1995 CA GLN B 419 -6.801 -16.855 4.727 1.00 1.24 C ATOM 1996 C GLN B 419 -7.221 -15.415 4.418 1.00 1.03 C ATOM 1997 O GLN B 419 -7.555 -15.082 3.298 1.00 1.28 O ATOM 1998 CB GLN B 419 -7.409 -17.325 6.050 1.00 1.71 C ATOM 1999 CG GLN B 419 -8.934 -17.230 5.974 1.00 2.32 C ATOM 2000 CD GLN B 419 -9.541 -17.626 7.321 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -8.897 -18.275 8.122 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -10.760 -17.262 7.607 1.00 3.52 N ATOM 0 H GLN B 419 -4.872 -16.024 5.109 1.00 1.08 H new ATOM 0 HA GLN B 419 -7.133 -17.470 3.890 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -7.108 -18.352 6.256 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -7.036 -16.713 6.871 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -9.233 -16.215 5.714 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -9.310 -17.884 5.188 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -11.301 -16.717 6.935 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -11.173 -17.522 8.503 1.00 3.52 H new ATOM 2011 N ASN B 420 -7.201 -14.556 5.402 1.00 0.78 N ATOM 2012 CA ASN B 420 -7.592 -13.140 5.162 1.00 0.70 C ATOM 2013 C ASN B 420 -6.363 -12.315 4.771 1.00 0.58 C ATOM 2014 O ASN B 420 -5.938 -11.435 5.494 1.00 0.70 O ATOM 2015 CB ASN B 420 -8.163 -12.656 6.496 1.00 0.86 C ATOM 2016 CG ASN B 420 -9.557 -13.254 6.700 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -10.529 -12.752 6.172 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -9.694 -14.314 7.448 1.00 1.87 N ATOM 0 H ASN B 420 -6.931 -14.775 6.361 1.00 0.78 H new ATOM 0 HA ASN B 420 -8.313 -13.040 4.351 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -7.506 -12.951 7.314 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -8.217 -11.567 6.507 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -10.618 -14.722 7.590 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -8.877 -14.735 7.891 1.00 1.87 H new ATOM 2025 N LEU B 421 -5.784 -12.597 3.636 1.00 0.45 N ATOM 2026 CA LEU B 421 -4.577 -11.834 3.203 1.00 0.40 C ATOM 2027 C LEU B 421 -4.967 -10.420 2.760 1.00 0.39 C ATOM 2028 O LEU B 421 -4.634 -9.445 3.402 1.00 0.53 O ATOM 2029 CB LEU B 421 -4.010 -12.626 2.023 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.047 -13.696 2.539 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.350 -15.029 1.853 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -1.608 -13.279 2.225 1.00 0.41 C ATOM 0 H LEU B 421 -6.094 -13.322 2.989 1.00 0.45 H new ATOM 0 HA LEU B 421 -3.852 -11.723 4.009 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -4.820 -13.092 1.462 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -3.491 -11.956 1.338 1.00 0.42 H new ATOM 0 HG LEU B 421 -3.169 -13.805 3.617 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -2.664 -15.792 2.221 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.375 -15.327 2.073 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.227 -14.920 0.775 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -0.920 -14.041 2.592 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -1.488 -13.171 1.147 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -1.390 -12.328 2.712 1.00 0.41 H new ATOM 2044 N LEU B 422 -5.663 -10.304 1.662 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.065 -8.952 1.174 1.00 0.34 C ATOM 2046 C LEU B 422 -7.128 -8.341 2.090 1.00 0.34 C ATOM 2047 O LEU B 422 -7.198 -7.140 2.260 1.00 0.37 O ATOM 2048 CB LEU B 422 -6.641 -9.195 -0.223 1.00 0.37 C ATOM 2049 CG LEU B 422 -5.502 -9.251 -1.243 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.054 -9.678 -2.604 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -4.860 -7.867 -1.366 1.00 0.63 C ATOM 0 H LEU B 422 -5.971 -11.085 1.082 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.226 -8.256 1.161 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.203 -10.129 -0.239 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -7.338 -8.399 -0.484 1.00 0.37 H new ATOM 0 HG LEU B 422 -4.754 -9.972 -0.912 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -5.242 -9.718 -3.330 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.512 -10.663 -2.518 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -6.802 -8.958 -2.935 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -4.048 -7.906 -2.092 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -5.609 -7.147 -1.696 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -4.465 -7.562 -0.397 1.00 0.63 H new ATOM 2063 N SER B 423 -7.957 -9.157 2.677 1.00 0.35 N ATOM 2064 CA SER B 423 -9.020 -8.623 3.577 1.00 0.38 C ATOM 2065 C SER B 423 -8.400 -7.956 4.810 1.00 0.36 C ATOM 2066 O SER B 423 -9.034 -7.166 5.482 1.00 0.39 O ATOM 2067 CB SER B 423 -9.840 -9.845 3.986 1.00 0.44 C ATOM 2068 OG SER B 423 -8.977 -10.967 4.121 1.00 1.23 O ATOM 0 H SER B 423 -7.946 -10.172 2.573 1.00 0.35 H new ATOM 0 HA SER B 423 -9.629 -7.864 3.085 1.00 0.38 H new ATOM 0 HB2 SER B 423 -10.355 -9.653 4.927 1.00 0.44 H new ATOM 0 HB3 SER B 423 -10.607 -10.049 3.239 1.00 0.44 H new ATOM 0 HG SER B 423 -9.106 -11.572 3.361 1.00 1.23 H new ATOM 2074 N GLU B 424 -7.171 -8.268 5.117 1.00 0.34 N ATOM 2075 CA GLU B 424 -6.525 -7.650 6.312 1.00 0.36 C ATOM 2076 C GLU B 424 -5.879 -6.312 5.942 1.00 0.32 C ATOM 2077 O GLU B 424 -6.107 -5.305 6.582 1.00 0.33 O ATOM 2078 CB GLU B 424 -5.461 -8.656 6.752 1.00 0.38 C ATOM 2079 CG GLU B 424 -5.920 -9.354 8.034 1.00 0.57 C ATOM 2080 CD GLU B 424 -4.877 -10.391 8.450 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -4.878 -11.467 7.875 1.00 1.54 O ATOM 2082 OE2 GLU B 424 -4.094 -10.094 9.338 1.00 1.22 O ATOM 0 H GLU B 424 -6.587 -8.921 4.595 1.00 0.34 H new ATOM 0 HA GLU B 424 -7.244 -7.442 7.104 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.292 -9.391 5.965 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -4.512 -8.147 6.922 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -6.058 -8.622 8.830 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -6.884 -9.836 7.873 1.00 0.57 H new ATOM 2089 N ALA B 425 -5.071 -6.293 4.917 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.411 -5.016 4.515 1.00 0.29 C ATOM 2091 C ALA B 425 -5.390 -4.122 3.743 1.00 0.28 C ATOM 2092 O ALA B 425 -5.121 -2.962 3.500 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.244 -5.438 3.622 1.00 0.29 C ATOM 0 H ALA B 425 -4.839 -7.103 4.342 1.00 0.31 H new ATOM 0 HA ALA B 425 -4.077 -4.438 5.377 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -2.706 -4.552 3.284 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -2.568 -6.080 4.186 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -3.625 -5.983 2.758 1.00 0.29 H new ATOM 2099 N GLN B 426 -6.523 -4.646 3.355 1.00 0.30 N ATOM 2100 CA GLN B 426 -7.511 -3.819 2.603 1.00 0.31 C ATOM 2101 C GLN B 426 -7.889 -2.563 3.402 1.00 0.30 C ATOM 2102 O GLN B 426 -7.730 -1.460 2.919 1.00 0.30 O ATOM 2103 CB GLN B 426 -8.729 -4.723 2.418 1.00 0.36 C ATOM 2104 CG GLN B 426 -8.883 -5.069 0.937 1.00 0.45 C ATOM 2105 CD GLN B 426 -10.306 -5.565 0.672 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -10.889 -6.241 1.497 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -10.894 -5.255 -0.450 1.00 1.09 N ATOM 0 H GLN B 426 -6.806 -5.611 3.527 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.109 -3.473 1.651 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -8.613 -5.634 3.006 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -9.626 -4.222 2.781 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -8.672 -4.192 0.324 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -8.161 -5.836 0.655 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -10.405 -4.688 -1.142 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -11.843 -5.580 -0.635 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.385 -2.766 4.600 1.00 0.32 N ATOM 2117 CA PRO B 427 -8.790 -1.619 5.451 1.00 0.34 C ATOM 2118 C PRO B 427 -7.564 -0.828 5.913 1.00 0.31 C ATOM 2119 O PRO B 427 -7.650 0.343 6.219 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.502 -2.278 6.631 1.00 0.39 C ATOM 2121 CG PRO B 427 -8.947 -3.662 6.690 1.00 0.38 C ATOM 2122 CD PRO B 427 -8.612 -4.054 5.274 1.00 0.35 C ATOM 0 HA PRO B 427 -9.424 -0.902 4.929 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -9.314 -1.737 7.558 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.582 -2.291 6.483 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -8.059 -3.697 7.322 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -9.672 -4.352 7.121 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -7.727 -4.689 5.233 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.426 -4.611 4.810 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.419 -1.453 5.959 1.00 0.29 N ATOM 2131 CA GLU B 428 -5.196 -0.720 6.393 1.00 0.29 C ATOM 2132 C GLU B 428 -4.902 0.419 5.413 1.00 0.27 C ATOM 2133 O GLU B 428 -4.685 1.549 5.804 1.00 0.32 O ATOM 2134 CB GLU B 428 -4.076 -1.761 6.367 1.00 0.29 C ATOM 2135 CG GLU B 428 -3.541 -1.976 7.785 1.00 0.71 C ATOM 2136 CD GLU B 428 -3.683 -3.452 8.166 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -4.796 -3.868 8.440 1.00 2.11 O ATOM 2138 OE2 GLU B 428 -2.675 -4.140 8.177 1.00 2.07 O ATOM 0 H GLU B 428 -6.278 -2.434 5.716 1.00 0.29 H new ATOM 0 HA GLU B 428 -5.304 -0.273 7.381 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.449 -2.702 5.962 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.272 -1.428 5.711 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -2.495 -1.674 7.840 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -4.090 -1.353 8.491 1.00 0.71 H new ATOM 2145 N LEU B 429 -4.905 0.132 4.140 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.639 1.200 3.133 1.00 0.26 C ATOM 2147 C LEU B 429 -5.837 2.153 3.069 1.00 0.25 C ATOM 2148 O LEU B 429 -5.686 3.346 2.894 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.458 0.455 1.804 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.421 1.452 0.638 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.044 1.421 -0.026 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.489 1.069 -0.388 1.00 0.56 C ATOM 0 H LEU B 429 -5.080 -0.795 3.753 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.763 1.802 3.375 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -3.535 -0.124 1.826 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.275 -0.253 1.661 1.00 0.26 H new ATOM 0 HG LEU B 429 -4.616 2.456 1.015 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.023 2.131 -0.853 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.282 1.692 0.704 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -2.844 0.418 -0.403 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.466 1.775 -1.218 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -5.292 0.064 -0.761 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.472 1.095 0.083 1.00 0.56 H new ATOM 2164 N GLU B 430 -7.025 1.633 3.209 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.231 2.505 3.155 1.00 0.28 C ATOM 2166 C GLU B 430 -8.246 3.464 4.348 1.00 0.30 C ATOM 2167 O GLU B 430 -8.712 4.581 4.252 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.418 1.542 3.227 1.00 0.30 C ATOM 2169 CG GLU B 430 -9.587 0.837 1.879 1.00 0.61 C ATOM 2170 CD GLU B 430 -11.069 0.795 1.505 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -11.882 0.637 2.402 1.00 2.17 O ATOM 2172 OE2 GLU B 430 -11.367 0.923 0.329 1.00 2.05 O ATOM 0 H GLU B 430 -7.212 0.642 3.358 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.256 3.119 2.255 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -9.256 0.807 4.016 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -10.327 2.087 3.481 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -9.022 1.362 1.109 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -9.186 -0.175 1.934 1.00 0.61 H new ATOM 2179 N ARG B 431 -7.745 3.037 5.475 1.00 0.33 N ATOM 2180 CA ARG B 431 -7.737 3.925 6.673 1.00 0.37 C ATOM 2181 C ARG B 431 -6.618 4.966 6.563 1.00 0.36 C ATOM 2182 O ARG B 431 -6.849 6.152 6.691 1.00 0.38 O ATOM 2183 CB ARG B 431 -7.487 2.991 7.856 1.00 0.41 C ATOM 2184 CG ARG B 431 -8.198 3.536 9.097 1.00 0.59 C ATOM 2185 CD ARG B 431 -7.235 3.514 10.286 1.00 1.32 C ATOM 2186 NE ARG B 431 -7.896 4.346 11.330 1.00 1.56 N ATOM 2187 CZ ARG B 431 -7.960 3.919 12.561 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -6.967 4.139 13.380 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -9.014 3.271 12.974 1.00 2.78 N ATOM 0 H ARG B 431 -7.341 2.112 5.618 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.670 4.479 6.779 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -7.851 1.990 7.626 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -6.417 2.905 8.045 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -8.544 4.553 8.914 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -9.080 2.934 9.318 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -7.067 2.497 10.639 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -6.262 3.922 10.014 1.00 1.32 H new ATOM 0 HE ARG B 431 -8.299 5.250 11.082 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -6.142 4.644 13.057 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -7.016 3.805 14.343 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -9.789 3.098 12.334 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -9.063 2.938 13.937 1.00 2.78 H new ATOM 2203 N THR B 432 -5.409 4.534 6.330 1.00 0.41 N ATOM 2204 CA THR B 432 -4.281 5.505 6.217 1.00 0.45 C ATOM 2205 C THR B 432 -4.621 6.600 5.201 1.00 0.40 C ATOM 2206 O THR B 432 -4.210 7.735 5.335 1.00 0.56 O ATOM 2207 CB THR B 432 -3.088 4.677 5.735 1.00 0.53 C ATOM 2208 OG1 THR B 432 -2.868 3.599 6.633 1.00 0.61 O ATOM 2209 CG2 THR B 432 -1.840 5.560 5.681 1.00 0.62 C ATOM 0 H THR B 432 -5.153 3.554 6.213 1.00 0.41 H new ATOM 0 HA THR B 432 -4.073 6.005 7.163 1.00 0.45 H new ATOM 0 HB THR B 432 -3.297 4.285 4.740 1.00 0.53 H new ATOM 0 HG1 THR B 432 -3.357 2.809 6.321 1.00 0.61 H new ATOM 0 HG21 THR B 432 -0.991 4.969 5.338 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.009 6.387 4.992 1.00 0.62 H new ATOM 0 HG23 THR B 432 -1.630 5.954 6.675 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.371 6.267 4.186 1.00 0.33 N ATOM 2218 CA LEU B 433 -5.738 7.289 3.164 1.00 0.30 C ATOM 2219 C LEU B 433 -7.010 8.027 3.588 1.00 0.27 C ATOM 2220 O LEU B 433 -7.061 9.240 3.596 1.00 0.25 O ATOM 2221 CB LEU B 433 -5.977 6.498 1.878 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.243 7.174 0.717 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -5.778 8.595 0.529 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -3.745 7.232 1.028 1.00 0.44 C ATOM 0 H LEU B 433 -5.745 5.333 4.020 1.00 0.33 H new ATOM 0 HA LEU B 433 -4.962 8.044 3.037 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -5.624 5.474 1.998 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.045 6.444 1.665 1.00 0.37 H new ATOM 0 HG LEU B 433 -5.406 6.602 -0.197 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -5.254 9.075 -0.298 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -6.845 8.556 0.309 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -5.617 9.168 1.442 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -3.220 7.713 0.202 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -3.585 7.804 1.942 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.362 6.220 1.161 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.038 7.304 3.941 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.304 7.968 4.364 1.00 0.32 C ATOM 2238 C LEU B 434 -9.024 8.972 5.484 1.00 0.29 C ATOM 2239 O LEU B 434 -9.587 10.048 5.521 1.00 0.30 O ATOM 2240 CB LEU B 434 -10.201 6.839 4.873 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.590 7.397 5.186 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.651 6.529 4.512 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -11.816 7.391 6.701 1.00 1.14 C ATOM 0 H LEU B 434 -8.056 6.284 3.955 1.00 0.32 H new ATOM 0 HA LEU B 434 -9.770 8.519 3.547 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.274 6.051 4.123 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -9.767 6.390 5.766 1.00 0.41 H new ATOM 0 HG LEU B 434 -11.662 8.418 4.812 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.641 6.926 4.735 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -12.493 6.533 3.434 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.577 5.508 4.886 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -12.806 7.789 6.923 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -11.743 6.370 7.076 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -11.060 8.010 7.184 1.00 1.14 H new ATOM 2255 N THR B 435 -8.157 8.629 6.397 1.00 0.34 N ATOM 2256 CA THR B 435 -7.842 9.566 7.511 1.00 0.37 C ATOM 2257 C THR B 435 -7.142 10.811 6.964 1.00 0.35 C ATOM 2258 O THR B 435 -7.484 11.927 7.304 1.00 0.39 O ATOM 2259 CB THR B 435 -6.909 8.785 8.437 1.00 0.45 C ATOM 2260 OG1 THR B 435 -7.528 7.560 8.806 1.00 0.52 O ATOM 2261 CG2 THR B 435 -6.621 9.610 9.692 1.00 0.55 C ATOM 0 H THR B 435 -7.654 7.742 6.419 1.00 0.34 H new ATOM 0 HA THR B 435 -8.736 9.906 8.033 1.00 0.37 H new ATOM 0 HB THR B 435 -5.973 8.579 7.919 1.00 0.45 H new ATOM 0 HG1 THR B 435 -7.207 6.842 8.221 1.00 0.52 H new ATOM 0 HG21 THR B 435 -5.956 9.051 10.350 1.00 0.55 H new ATOM 0 HG22 THR B 435 -6.146 10.549 9.409 1.00 0.55 H new ATOM 0 HG23 THR B 435 -7.556 9.819 10.213 1.00 0.55 H new ATOM 2269 N THR B 436 -6.168 10.633 6.114 1.00 0.33 N ATOM 2270 CA THR B 436 -5.457 11.813 5.545 1.00 0.36 C ATOM 2271 C THR B 436 -6.457 12.730 4.841 1.00 0.36 C ATOM 2272 O THR B 436 -6.582 13.894 5.167 1.00 0.40 O ATOM 2273 CB THR B 436 -4.458 11.235 4.541 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.542 10.387 5.222 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.695 12.375 3.865 1.00 0.49 C ATOM 0 H THR B 436 -5.835 9.725 5.790 1.00 0.33 H new ATOM 0 HA THR B 436 -4.959 12.407 6.311 1.00 0.36 H new ATOM 0 HB THR B 436 -4.993 10.660 3.785 1.00 0.38 H new ATOM 0 HG1 THR B 436 -3.883 9.468 5.219 1.00 0.39 H new ATOM 0 HG21 THR B 436 -2.983 11.963 3.150 1.00 0.49 H new ATOM 0 HG22 THR B 436 -4.398 13.025 3.344 1.00 0.49 H new ATOM 0 HG23 THR B 436 -3.159 12.951 4.619 1.00 0.49 H new ATOM 2283 N ALA B 437 -7.179 12.215 3.881 1.00 0.34 N ATOM 2284 CA ALA B 437 -8.175 13.062 3.166 1.00 0.36 C ATOM 2285 C ALA B 437 -9.120 13.718 4.174 1.00 0.36 C ATOM 2286 O ALA B 437 -9.395 14.899 4.098 1.00 0.41 O ATOM 2287 CB ALA B 437 -8.937 12.099 2.255 1.00 0.35 C ATOM 0 H ALA B 437 -7.122 11.248 3.563 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.707 13.866 2.598 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.691 12.650 1.693 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -8.241 11.627 1.562 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -9.423 11.333 2.860 1.00 0.35 H new ATOM 2293 N LEU B 438 -9.614 12.970 5.127 1.00 0.34 N ATOM 2294 CA LEU B 438 -10.528 13.580 6.134 1.00 0.36 C ATOM 2295 C LEU B 438 -9.831 14.768 6.797 1.00 0.42 C ATOM 2296 O LEU B 438 -10.438 15.786 7.059 1.00 0.46 O ATOM 2297 CB LEU B 438 -10.819 12.481 7.164 1.00 0.36 C ATOM 2298 CG LEU B 438 -11.591 13.081 8.349 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -12.845 13.803 7.846 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -12.011 11.966 9.310 1.00 0.45 C ATOM 0 H LEU B 438 -9.426 11.975 5.250 1.00 0.34 H new ATOM 0 HA LEU B 438 -11.451 13.946 5.683 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -11.401 11.682 6.704 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.886 12.037 7.511 1.00 0.36 H new ATOM 0 HG LEU B 438 -10.944 13.790 8.866 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -13.386 14.225 8.693 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -12.556 14.603 7.165 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -13.487 13.095 7.322 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -12.558 12.396 10.149 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -12.650 11.255 8.786 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -11.124 11.452 9.680 1.00 0.45 H new ATOM 2312 N ARG B 439 -8.556 14.651 7.064 1.00 0.43 N ATOM 2313 CA ARG B 439 -7.822 15.784 7.701 1.00 0.50 C ATOM 2314 C ARG B 439 -8.108 17.075 6.928 1.00 0.54 C ATOM 2315 O ARG B 439 -8.321 18.124 7.502 1.00 0.60 O ATOM 2316 CB ARG B 439 -6.342 15.411 7.603 1.00 0.52 C ATOM 2317 CG ARG B 439 -5.628 15.804 8.897 1.00 0.77 C ATOM 2318 CD ARG B 439 -4.409 14.904 9.103 1.00 1.27 C ATOM 2319 NE ARG B 439 -3.323 15.821 9.545 1.00 1.73 N ATOM 2320 CZ ARG B 439 -2.294 15.349 10.191 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -2.427 14.947 11.426 1.00 2.81 N ATOM 2322 NH2 ARG B 439 -1.131 15.277 9.604 1.00 2.89 N ATOM 0 H ARG B 439 -7.993 13.823 6.869 1.00 0.43 H new ATOM 0 HA ARG B 439 -8.123 15.950 8.735 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -6.237 14.340 7.429 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -5.884 15.919 6.754 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -5.318 16.848 8.851 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -6.309 15.711 9.743 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -4.607 14.137 9.852 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -4.139 14.388 8.182 1.00 1.27 H new ATOM 0 HE ARG B 439 -3.384 16.819 9.342 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -3.336 15.002 11.885 1.00 2.81 H new ATOM 0 HH12 ARG B 439 -1.622 14.578 11.932 1.00 2.81 H new ATOM 0 HH21 ARG B 439 -1.027 15.590 8.639 1.00 2.89 H new ATOM 0 HH22 ARG B 439 -0.326 14.908 10.110 1.00 2.89 H new ATOM 2336 N HIS B 440 -8.141 16.991 5.626 1.00 0.52 N ATOM 2337 CA HIS B 440 -8.447 18.197 4.810 1.00 0.57 C ATOM 2338 C HIS B 440 -9.829 18.716 5.208 1.00 0.58 C ATOM 2339 O HIS B 440 -10.093 19.902 5.197 1.00 0.64 O ATOM 2340 CB HIS B 440 -8.440 17.699 3.363 1.00 0.55 C ATOM 2341 CG HIS B 440 -8.729 18.846 2.433 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -7.821 19.871 2.220 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -9.817 19.140 1.650 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -8.375 20.726 1.342 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -9.592 20.328 0.962 1.00 0.75 N ATOM 0 H HIS B 440 -7.969 16.138 5.093 1.00 0.52 H new ATOM 0 HA HIS B 440 -7.737 19.012 4.950 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -7.472 17.259 3.124 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -9.187 16.916 3.234 1.00 0.55 H new ATOM 0 HD2 HIS B 440 -10.712 18.540 1.579 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -7.894 21.626 0.987 1.00 0.97 H new ATOM 0 HE2 HIS B 440 -10.221 20.795 0.308 1.00 0.75 H new ATOM 2353 N THR B 441 -10.704 17.822 5.581 1.00 0.53 N ATOM 2354 CA THR B 441 -12.073 18.225 6.012 1.00 0.55 C ATOM 2355 C THR B 441 -12.368 17.591 7.375 1.00 0.56 C ATOM 2356 O THR B 441 -13.388 16.962 7.573 1.00 0.55 O ATOM 2357 CB THR B 441 -13.017 17.661 4.946 1.00 0.53 C ATOM 2358 OG1 THR B 441 -12.987 16.242 4.996 1.00 0.48 O ATOM 2359 CG2 THR B 441 -12.577 18.133 3.559 1.00 0.54 C ATOM 0 H THR B 441 -10.526 16.818 5.606 1.00 0.53 H new ATOM 0 HA THR B 441 -12.185 19.305 6.110 1.00 0.55 H new ATOM 0 HB THR B 441 -14.030 18.014 5.138 1.00 0.53 H new ATOM 0 HG1 THR B 441 -13.318 15.878 4.148 1.00 0.48 H new ATOM 0 HG21 THR B 441 -13.253 17.728 2.806 1.00 0.54 H new ATOM 0 HG22 THR B 441 -12.601 19.222 3.521 1.00 0.54 H new ATOM 0 HG23 THR B 441 -11.563 17.786 3.361 1.00 0.54 H new ATOM 2367 N GLN B 442 -11.460 17.737 8.305 1.00 0.59 N ATOM 2368 CA GLN B 442 -11.639 17.133 9.660 1.00 0.62 C ATOM 2369 C GLN B 442 -13.069 17.316 10.182 1.00 0.64 C ATOM 2370 O GLN B 442 -13.564 18.418 10.301 1.00 0.69 O ATOM 2371 CB GLN B 442 -10.649 17.882 10.552 1.00 0.69 C ATOM 2372 CG GLN B 442 -10.120 16.937 11.633 1.00 1.43 C ATOM 2373 CD GLN B 442 -10.902 17.158 12.929 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -10.961 18.260 13.436 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -11.509 16.148 13.489 1.00 2.47 N ATOM 0 H GLN B 442 -10.591 18.256 8.182 1.00 0.59 H new ATOM 0 HA GLN B 442 -11.464 16.057 9.642 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -9.823 18.266 9.954 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -11.136 18.742 11.012 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -10.220 15.902 11.307 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -9.058 17.117 11.801 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -11.459 15.223 13.063 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -12.034 16.284 14.353 1.00 2.47 H new ATOM 2384 N GLY B 443 -13.725 16.235 10.509 1.00 0.63 N ATOM 2385 CA GLY B 443 -15.114 16.332 11.040 1.00 0.66 C ATOM 2386 C GLY B 443 -16.127 16.183 9.902 1.00 0.64 C ATOM 2387 O GLY B 443 -17.107 15.476 10.024 1.00 0.66 O ATOM 0 H GLY B 443 -13.357 15.287 10.431 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -15.280 15.557 11.788 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -15.254 17.291 11.538 1.00 0.66 H new ATOM 2391 N HIS B 444 -15.906 16.845 8.800 1.00 0.62 N ATOM 2392 CA HIS B 444 -16.868 16.739 7.666 1.00 0.62 C ATOM 2393 C HIS B 444 -17.123 15.269 7.315 1.00 0.67 C ATOM 2394 O HIS B 444 -18.253 14.846 7.179 1.00 1.34 O ATOM 2395 CB HIS B 444 -16.192 17.458 6.500 1.00 0.63 C ATOM 2396 CG HIS B 444 -16.121 18.932 6.796 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -15.566 19.839 5.906 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -16.532 19.671 7.878 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -15.658 21.061 6.463 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -16.239 21.015 7.665 1.00 1.86 N ATOM 0 H HIS B 444 -15.104 17.453 8.635 1.00 0.62 H new ATOM 0 HA HIS B 444 -17.836 17.177 7.909 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -15.190 17.058 6.344 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -16.751 17.287 5.580 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -17.010 19.270 8.760 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -15.305 21.968 5.995 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -16.427 21.797 8.292 1.00 1.86 H new ATOM 2408 N LYS B 445 -16.080 14.487 7.172 1.00 0.62 N ATOM 2409 CA LYS B 445 -16.249 13.036 6.827 1.00 0.51 C ATOM 2410 C LYS B 445 -16.827 12.891 5.415 1.00 0.51 C ATOM 2411 O LYS B 445 -16.179 12.386 4.519 1.00 0.57 O ATOM 2412 CB LYS B 445 -17.216 12.464 7.871 1.00 0.62 C ATOM 2413 CG LYS B 445 -16.727 11.085 8.319 1.00 1.31 C ATOM 2414 CD LYS B 445 -17.831 10.051 8.087 1.00 1.56 C ATOM 2415 CE LYS B 445 -17.264 8.645 8.299 1.00 2.23 C ATOM 2416 NZ LYS B 445 -17.490 8.353 9.742 1.00 2.52 N ATOM 0 H LYS B 445 -15.113 14.792 7.280 1.00 0.62 H new ATOM 0 HA LYS B 445 -15.297 12.505 6.838 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -17.281 13.135 8.728 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -18.218 12.387 7.450 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -15.831 10.807 7.763 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -16.453 11.110 9.374 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -18.660 10.228 8.772 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -18.227 10.147 7.076 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -17.769 7.916 7.665 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -16.204 8.605 8.049 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -17.127 7.404 9.965 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -16.992 9.059 10.321 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -18.509 8.391 9.949 1.00 2.52 H new ATOM 2430 N GLN B 446 -18.039 13.331 5.207 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.651 13.219 3.852 1.00 0.56 C ATOM 2432 C GLN B 446 -17.756 13.897 2.812 1.00 0.52 C ATOM 2433 O GLN B 446 -17.529 13.373 1.740 1.00 0.51 O ATOM 2434 CB GLN B 446 -19.992 13.945 3.962 1.00 0.64 C ATOM 2435 CG GLN B 446 -21.060 13.164 3.193 1.00 1.11 C ATOM 2436 CD GLN B 446 -21.788 12.219 4.150 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -22.752 12.601 4.784 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -21.366 10.991 4.282 1.00 2.40 N ATOM 0 H GLN B 446 -18.631 13.763 5.916 1.00 0.53 H new ATOM 0 HA GLN B 446 -18.774 12.183 3.538 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -20.280 14.042 5.009 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -19.905 14.955 3.561 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -21.770 13.853 2.735 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -20.599 12.596 2.385 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -20.557 10.670 3.750 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -21.845 10.353 4.917 1.00 2.40 H new ATOM 2447 N GLU B 447 -17.241 15.058 3.121 1.00 0.52 N ATOM 2448 CA GLU B 447 -16.355 15.764 2.147 1.00 0.51 C ATOM 2449 C GLU B 447 -15.264 14.814 1.645 1.00 0.45 C ATOM 2450 O GLU B 447 -14.888 14.838 0.490 1.00 0.45 O ATOM 2451 CB GLU B 447 -15.742 16.922 2.935 1.00 0.53 C ATOM 2452 CG GLU B 447 -16.776 18.039 3.091 1.00 0.80 C ATOM 2453 CD GLU B 447 -16.837 18.865 1.806 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -15.805 19.012 1.171 1.00 2.14 O ATOM 2455 OE2 GLU B 447 -17.914 19.337 1.477 1.00 1.96 O ATOM 0 H GLU B 447 -17.394 15.547 4.003 1.00 0.52 H new ATOM 0 HA GLU B 447 -16.899 16.115 1.270 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -15.415 16.576 3.915 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -14.859 17.299 2.419 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -17.756 17.614 3.309 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -16.512 18.678 3.934 1.00 0.80 H new ATOM 2462 N ALA B 448 -14.762 13.969 2.505 1.00 0.43 N ATOM 2463 CA ALA B 448 -13.706 13.007 2.079 1.00 0.39 C ATOM 2464 C ALA B 448 -14.180 12.217 0.858 1.00 0.40 C ATOM 2465 O ALA B 448 -13.390 11.696 0.096 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.511 12.078 3.276 1.00 0.39 C ATOM 0 H ALA B 448 -15.038 13.904 3.485 1.00 0.43 H new ATOM 0 HA ALA B 448 -12.779 13.506 1.797 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -12.746 11.338 3.041 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -13.198 12.661 4.142 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.450 11.571 3.500 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.468 12.125 0.667 1.00 0.44 N ATOM 2473 CA ALA B 449 -15.999 11.370 -0.502 1.00 0.47 C ATOM 2474 C ALA B 449 -15.378 11.896 -1.799 1.00 0.48 C ATOM 2475 O ALA B 449 -14.647 11.201 -2.476 1.00 0.49 O ATOM 2476 CB ALA B 449 -17.505 11.634 -0.487 1.00 0.52 C ATOM 0 H ALA B 449 -16.176 12.541 1.272 1.00 0.44 H new ATOM 0 HA ALA B 449 -15.767 10.306 -0.448 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -17.974 11.111 -1.320 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -17.928 11.275 0.451 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -17.688 12.704 -0.581 1.00 0.52 H new ATOM 2482 N ARG B 450 -15.666 13.119 -2.150 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.096 13.690 -3.404 1.00 0.52 C ATOM 2484 C ARG B 450 -13.567 13.721 -3.327 1.00 0.49 C ATOM 2485 O ARG B 450 -12.885 13.629 -4.327 1.00 0.50 O ATOM 2486 CB ARG B 450 -15.658 15.110 -3.484 1.00 0.57 C ATOM 2487 CG ARG B 450 -15.727 15.549 -4.949 1.00 0.78 C ATOM 2488 CD ARG B 450 -16.181 17.009 -5.023 1.00 1.37 C ATOM 2489 NE ARG B 450 -16.370 17.278 -6.476 1.00 1.76 N ATOM 2490 CZ ARG B 450 -15.382 17.751 -7.186 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -14.719 18.794 -6.768 1.00 2.97 N ATOM 2492 NH2 ARG B 450 -15.060 17.181 -8.315 1.00 2.93 N ATOM 0 H ARG B 450 -16.272 13.748 -1.623 1.00 0.49 H new ATOM 0 HA ARG B 450 -15.356 13.098 -4.282 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -16.651 15.146 -3.035 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -15.027 15.795 -2.917 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -14.750 15.436 -5.420 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -16.421 14.913 -5.498 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -17.107 17.163 -4.469 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -15.436 17.677 -4.591 1.00 1.37 H new ATOM 0 HE ARG B 450 -17.271 17.093 -6.916 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -14.973 19.240 -5.886 1.00 2.97 H new ATOM 0 HH12 ARG B 450 -13.947 19.164 -7.323 1.00 2.97 H new ATOM 0 HH21 ARG B 450 -15.580 16.367 -8.642 1.00 2.93 H new ATOM 0 HH22 ARG B 450 -14.288 17.550 -8.871 1.00 2.93 H new ATOM 2506 N LEU B 451 -13.026 13.851 -2.147 1.00 0.48 N ATOM 2507 CA LEU B 451 -11.542 13.889 -2.009 1.00 0.47 C ATOM 2508 C LEU B 451 -10.921 12.617 -2.595 1.00 0.44 C ATOM 2509 O LEU B 451 -9.815 12.629 -3.096 1.00 0.48 O ATOM 2510 CB LEU B 451 -11.285 13.964 -0.505 1.00 0.46 C ATOM 2511 CG LEU B 451 -10.962 15.407 -0.113 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -12.258 16.151 0.211 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -10.052 15.409 1.117 1.00 1.04 C ATOM 0 H LEU B 451 -13.546 13.932 -1.273 1.00 0.48 H new ATOM 0 HA LEU B 451 -11.101 14.732 -2.541 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.161 13.615 0.042 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -10.457 13.308 -0.234 1.00 0.46 H new ATOM 0 HG LEU B 451 -10.456 15.903 -0.941 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -12.027 17.179 0.490 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -12.907 16.150 -0.665 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -12.765 15.655 1.039 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -9.821 16.437 1.397 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -10.558 14.912 1.945 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.128 14.879 0.887 1.00 1.04 H new ATOM 2525 N LEU B 452 -11.625 11.520 -2.534 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.073 10.249 -3.087 1.00 0.40 C ATOM 2527 C LEU B 452 -11.940 9.754 -4.251 1.00 0.46 C ATOM 2528 O LEU B 452 -11.876 8.604 -4.636 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.120 9.255 -1.925 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.385 9.838 -0.715 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.264 9.700 0.529 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.074 9.077 -0.498 1.00 0.43 C ATOM 0 H LEU B 452 -12.557 11.448 -2.126 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.062 10.375 -3.475 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.155 9.036 -1.663 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -10.660 8.312 -2.222 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.169 10.891 -0.894 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.742 10.115 1.391 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.198 10.240 0.376 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.479 8.646 0.707 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.551 9.492 0.363 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.290 8.024 -0.318 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -8.447 9.173 -1.384 1.00 0.43 H new ATOM 2544 N GLY B 453 -12.752 10.612 -4.813 1.00 0.50 N ATOM 2545 CA GLY B 453 -13.619 10.182 -5.947 1.00 0.56 C ATOM 2546 C GLY B 453 -14.451 8.975 -5.519 1.00 0.58 C ATOM 2547 O GLY B 453 -14.543 7.987 -6.222 1.00 0.68 O ATOM 0 H GLY B 453 -12.851 11.589 -4.536 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -14.273 11.000 -6.250 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -13.006 9.927 -6.812 1.00 0.56 H new ATOM 2551 N TRP B 454 -15.052 9.047 -4.367 1.00 0.54 N ATOM 2552 CA TRP B 454 -15.877 7.905 -3.879 1.00 0.60 C ATOM 2553 C TRP B 454 -17.357 8.298 -3.832 1.00 0.69 C ATOM 2554 O TRP B 454 -18.170 7.784 -4.574 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.357 7.625 -2.466 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.194 6.678 -2.517 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -13.389 6.476 -3.591 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -13.692 5.808 -1.462 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -12.429 5.534 -3.263 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -12.569 5.090 -1.964 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.099 5.568 -0.123 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -11.871 4.165 -1.167 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.398 4.638 0.683 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.286 3.938 0.161 1.00 0.51 C ATOM 0 H TRP B 454 -15.009 9.849 -3.739 1.00 0.54 H new ATOM 0 HA TRP B 454 -15.801 7.033 -4.529 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.054 8.558 -1.991 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.154 7.200 -1.855 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -13.482 6.970 -4.547 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -11.706 5.208 -3.904 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -14.948 6.098 0.283 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.022 3.632 -1.570 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -13.714 4.463 1.701 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -11.755 3.230 0.779 1.00 0.51 H new ATOM 2575 N GLY B 455 -17.711 9.202 -2.960 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.136 9.624 -2.857 1.00 0.72 C ATOM 2577 C GLY B 455 -19.645 9.330 -1.445 1.00 0.70 C ATOM 2578 O GLY B 455 -18.896 8.921 -0.582 1.00 0.64 O ATOM 0 H GLY B 455 -17.074 9.667 -2.314 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.230 10.688 -3.077 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -19.740 9.092 -3.592 1.00 0.72 H new ATOM 2582 N ALA B 456 -20.910 9.532 -1.201 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.455 9.257 0.160 1.00 0.77 C ATOM 2584 C ALA B 456 -21.873 7.790 0.265 1.00 0.82 C ATOM 2585 O ALA B 456 -21.873 7.209 1.333 1.00 0.83 O ATOM 2586 CB ALA B 456 -22.670 10.176 0.295 1.00 0.84 C ATOM 0 H ALA B 456 -21.588 9.874 -1.881 1.00 0.77 H new ATOM 0 HA ALA B 456 -20.723 9.438 0.947 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -23.128 10.032 1.274 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.354 11.214 0.191 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.395 9.938 -0.483 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.220 7.184 -0.836 1.00 0.90 N ATOM 2593 CA ALA B 457 -22.627 5.753 -0.800 1.00 0.97 C ATOM 2594 C ALA B 457 -21.393 4.869 -0.611 1.00 0.89 C ATOM 2595 O ALA B 457 -21.415 3.899 0.120 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.279 5.489 -2.158 1.00 1.07 C ATOM 0 H ALA B 457 -22.239 7.618 -1.759 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.308 5.533 0.022 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -23.607 4.451 -2.209 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.139 6.147 -2.283 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -22.557 5.681 -2.952 1.00 1.07 H new ATOM 2602 N THR B 458 -20.310 5.205 -1.260 1.00 0.84 N ATOM 2603 CA THR B 458 -19.070 4.391 -1.114 1.00 0.77 C ATOM 2604 C THR B 458 -18.474 4.601 0.280 1.00 0.68 C ATOM 2605 O THR B 458 -18.228 3.661 1.010 1.00 0.67 O ATOM 2606 CB THR B 458 -18.119 4.918 -2.190 1.00 0.76 C ATOM 2607 OG1 THR B 458 -18.724 4.770 -3.467 1.00 0.85 O ATOM 2608 CG2 THR B 458 -16.810 4.128 -2.148 1.00 0.72 C ATOM 0 H THR B 458 -20.231 6.008 -1.884 1.00 0.84 H new ATOM 0 HA THR B 458 -19.256 3.323 -1.228 1.00 0.77 H new ATOM 0 HB THR B 458 -17.910 5.972 -2.007 1.00 0.76 H new ATOM 0 HG1 THR B 458 -18.666 5.617 -3.957 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.133 4.504 -2.915 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.347 4.243 -1.168 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.015 3.073 -2.331 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.245 5.831 0.659 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.674 6.105 2.011 1.00 0.57 C ATOM 2618 C LEU B 459 -18.486 5.369 3.081 1.00 0.60 C ATOM 2619 O LEU B 459 -17.976 4.999 4.120 1.00 0.58 O ATOM 2620 CB LEU B 459 -17.796 7.621 2.187 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.409 8.226 2.418 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.369 9.643 1.850 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -16.116 8.283 3.916 1.00 0.46 C ATOM 0 H LEU B 459 -18.429 6.658 0.091 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.642 5.766 2.107 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.254 8.064 1.303 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.448 7.848 3.031 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.662 7.607 1.921 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.381 10.073 2.015 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -16.578 9.612 0.781 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -17.120 10.256 2.349 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -15.128 8.714 4.077 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -16.866 8.900 4.410 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -16.144 7.275 4.331 1.00 0.46 H new ATOM 2635 N THR B 460 -19.749 5.153 2.829 1.00 0.68 N ATOM 2636 CA THR B 460 -20.600 4.439 3.822 1.00 0.74 C ATOM 2637 C THR B 460 -20.577 2.931 3.555 1.00 0.76 C ATOM 2638 O THR B 460 -20.268 2.142 4.426 1.00 0.75 O ATOM 2639 CB THR B 460 -22.007 5.001 3.608 1.00 0.83 C ATOM 2640 OG1 THR B 460 -21.995 6.402 3.845 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.983 4.327 4.573 1.00 0.92 C ATOM 0 H THR B 460 -20.228 5.441 1.976 1.00 0.68 H new ATOM 0 HA THR B 460 -20.252 4.583 4.845 1.00 0.74 H new ATOM 0 HB THR B 460 -22.324 4.807 2.583 1.00 0.83 H new ATOM 0 HG1 THR B 460 -22.282 6.873 3.035 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.984 4.729 4.418 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.992 3.252 4.390 1.00 0.92 H new ATOM 0 HG23 THR B 460 -22.670 4.518 5.599 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.905 2.524 2.358 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.903 1.068 2.038 1.00 0.85 C ATOM 2651 C ALA B 461 -19.494 0.493 2.201 1.00 0.79 C ATOM 2652 O ALA B 461 -19.318 -0.649 2.575 1.00 0.83 O ATOM 2653 CB ALA B 461 -21.353 0.982 0.580 1.00 0.92 C ATOM 0 H ALA B 461 -21.174 3.137 1.588 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.556 0.499 2.699 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -21.377 -0.062 0.268 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -22.349 1.414 0.480 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.654 1.533 -0.050 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.488 1.278 1.927 1.00 0.72 N ATOM 2660 CA LYS B 462 -17.092 0.775 2.068 1.00 0.68 C ATOM 2661 C LYS B 462 -16.735 0.615 3.549 1.00 0.65 C ATOM 2662 O LYS B 462 -15.887 -0.175 3.910 1.00 0.66 O ATOM 2663 CB LYS B 462 -16.216 1.846 1.416 1.00 0.66 C ATOM 2664 CG LYS B 462 -14.843 1.255 1.094 1.00 0.99 C ATOM 2665 CD LYS B 462 -14.615 1.286 -0.419 1.00 0.91 C ATOM 2666 CE LYS B 462 -15.592 0.325 -1.102 1.00 1.31 C ATOM 2667 NZ LYS B 462 -14.734 -0.744 -1.686 1.00 1.39 N ATOM 0 H LYS B 462 -18.572 2.245 1.612 1.00 0.72 H new ATOM 0 HA LYS B 462 -16.955 -0.201 1.602 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.689 2.213 0.505 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -16.108 2.700 2.085 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -14.063 1.823 1.602 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -14.781 0.230 1.461 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -14.758 2.298 -0.798 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -13.588 1.002 -0.649 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -16.305 -0.087 -0.388 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -16.171 0.833 -1.874 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -15.302 -1.602 -1.835 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -14.349 -0.421 -2.596 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -13.952 -0.956 -1.034 1.00 1.39 H new ATOM 2681 N LEU B 463 -17.377 1.361 4.408 1.00 0.65 N ATOM 2682 CA LEU B 463 -17.072 1.248 5.864 1.00 0.65 C ATOM 2683 C LEU B 463 -17.298 -0.191 6.340 1.00 0.68 C ATOM 2684 O LEU B 463 -16.429 -0.803 6.929 1.00 0.70 O ATOM 2685 CB LEU B 463 -18.052 2.201 6.549 1.00 0.68 C ATOM 2686 CG LEU B 463 -17.735 2.268 8.044 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -17.598 3.731 8.470 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -18.869 1.610 8.833 1.00 0.99 C ATOM 0 H LEU B 463 -18.097 2.042 4.166 1.00 0.65 H new ATOM 0 HA LEU B 463 -16.036 1.498 6.091 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.980 3.194 6.106 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -19.076 1.858 6.398 1.00 0.68 H new ATOM 0 HG LEU B 463 -16.801 1.743 8.243 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -17.372 3.780 9.535 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -16.792 4.200 7.906 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -18.532 4.256 8.273 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -18.645 1.656 9.899 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -19.803 2.136 8.635 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -18.968 0.568 8.528 1.00 0.99 H new ATOM 2700 N LYS B 464 -18.458 -0.733 6.091 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.740 -2.130 6.531 1.00 0.77 C ATOM 2702 C LYS B 464 -18.155 -3.130 5.528 1.00 0.76 C ATOM 2703 O LYS B 464 -17.938 -4.284 5.844 1.00 0.82 O ATOM 2704 CB LYS B 464 -20.265 -2.235 6.563 1.00 0.85 C ATOM 2705 CG LYS B 464 -20.744 -2.268 8.015 1.00 1.20 C ATOM 2706 CD LYS B 464 -22.159 -1.693 8.100 1.00 1.62 C ATOM 2707 CE LYS B 464 -22.229 -0.672 9.240 1.00 2.25 C ATOM 2708 NZ LYS B 464 -23.030 -1.339 10.304 1.00 2.66 N ATOM 0 H LYS B 464 -19.224 -0.269 5.602 1.00 0.72 H new ATOM 0 HA LYS B 464 -18.295 -2.355 7.500 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.709 -1.387 6.042 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.589 -3.136 6.041 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -20.733 -3.292 8.389 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -20.067 -1.691 8.645 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -22.427 -1.219 7.156 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -22.879 -2.494 8.270 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -21.233 -0.412 9.599 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -22.701 0.254 8.912 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -23.122 -0.701 11.120 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -23.975 -1.568 9.935 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -22.553 -2.214 10.601 1.00 2.66 H new ATOM 2722 N GLU B 465 -17.898 -2.698 4.325 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.330 -3.625 3.305 1.00 0.76 C ATOM 2724 C GLU B 465 -15.966 -4.151 3.765 1.00 0.69 C ATOM 2725 O GLU B 465 -15.676 -5.326 3.662 1.00 0.85 O ATOM 2726 CB GLU B 465 -17.178 -2.779 2.041 1.00 0.79 C ATOM 2727 CG GLU B 465 -16.670 -3.657 0.896 1.00 1.12 C ATOM 2728 CD GLU B 465 -17.092 -3.048 -0.441 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -18.277 -2.816 -0.617 1.00 1.94 O ATOM 2730 OE2 GLU B 465 -16.223 -2.822 -1.267 1.00 2.03 O ATOM 0 H GLU B 465 -18.056 -1.743 4.003 1.00 0.73 H new ATOM 0 HA GLU B 465 -17.966 -4.495 3.140 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -18.135 -2.332 1.773 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -16.482 -1.959 2.221 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -15.584 -3.741 0.943 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -17.072 -4.666 0.991 1.00 1.12 H new ATOM 2737 N LEU B 466 -15.127 -3.289 4.273 1.00 0.56 N ATOM 2738 CA LEU B 466 -13.784 -3.740 4.738 1.00 0.59 C ATOM 2739 C LEU B 466 -13.930 -4.862 5.769 1.00 0.70 C ATOM 2740 O LEU B 466 -13.072 -5.713 5.898 1.00 0.81 O ATOM 2741 CB LEU B 466 -13.150 -2.504 5.378 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.447 -1.674 4.302 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -11.878 -0.401 4.930 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.308 -2.494 3.693 1.00 0.52 C ATOM 0 H LEU B 466 -15.313 -2.293 4.386 1.00 0.56 H new ATOM 0 HA LEU B 466 -13.177 -4.134 3.923 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -13.915 -1.905 5.872 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -12.436 -2.805 6.145 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.162 -1.406 3.524 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -11.377 0.190 4.163 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -12.688 0.183 5.367 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -11.162 -0.667 5.708 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -10.805 -1.905 2.926 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.594 -2.760 4.472 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -11.712 -3.402 3.246 1.00 0.52 H new ATOM 2756 N GLY B 467 -15.007 -4.868 6.504 1.00 0.77 N ATOM 2757 CA GLY B 467 -15.205 -5.935 7.526 1.00 0.97 C ATOM 2758 C GLY B 467 -16.510 -6.680 7.243 1.00 1.08 C ATOM 2759 O GLY B 467 -17.170 -7.161 8.143 1.00 1.38 O ATOM 0 H GLY B 467 -15.758 -4.181 6.442 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -14.366 -6.631 7.508 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -15.234 -5.496 8.523 1.00 0.97 H new