USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1050 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 404 THR OG1 : rot 180:sc= 0.0147 USER MOD Single : A 408 GLN : amide:sc= -0.145 X(o=-0.14,f=0) USER MOD Single : A 416 SER OG : rot 52:sc= 1.14 USER MOD Single : A 418 HIS : no HD1:sc= -2.04! C(o=-2!,f=-5.9!) USER MOD Single : A 419 GLN : amide:sc= -0.0934 K(o=-0.093,f=-1.6!) USER MOD Single : A 420 ASN : amide:sc= -0.727 K(o=-0.73,f=-6.2!) USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 426 GLN : amide:sc= -0.472 K(o=-0.47,f=-1.3) USER MOD Single : A 432 THR OG1 : rot 81:sc= 0.735 USER MOD Single : A 435 THR OG1 : rot 99:sc= 1.19 USER MOD Single : A 436 THR OG1 : rot 110:sc= 1.2 USER MOD Single : A 440 HIS : no HD1:sc= -0.125 X(o=-0.13,f=-0.26) USER MOD Single : A 441 THR OG1 : rot 119:sc= 0.0285 USER MOD Single : A 442 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 444 HIS : no HD1:sc= -0.0142 X(o=-0.014,f=-0.092) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.0225 K(o=-0.022,f=-1.5!) USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 460 THR OG1 : rot 116:sc= 1.26 USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 404 THR OG1 : rot 180:sc= 0.00377 USER MOD Single : B 408 GLN : amide:sc= -0.15 X(o=-0.15,f=0) USER MOD Single : B 416 SER OG : rot 43:sc= 1.12 USER MOD Single : B 418 HIS : no HD1:sc= -2.11! C(o=-2.1!,f=-6.1!) USER MOD Single : B 419 GLN : amide:sc= -0.0676 K(o=-0.068,f=-1.7!) USER MOD Single : B 420 ASN : amide:sc= -0.799 K(o=-0.8,f=-6.1!) USER MOD Single : B 423 SER OG : rot 180:sc= 0 USER MOD Single : B 426 GLN : amide:sc= -0.451 K(o=-0.45,f=-1.3) USER MOD Single : B 432 THR OG1 : rot 82:sc= 0.731 USER MOD Single : B 435 THR OG1 : rot 87:sc= 1.22 USER MOD Single : B 436 THR OG1 : rot 114:sc= 1.11 USER MOD Single : B 440 HIS : no HD1:sc= -0.11 X(o=-0.11,f=-0.28) USER MOD Single : B 441 THR OG1 : rot 120:sc= 0.0302 USER MOD Single : B 442 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : B 444 HIS : no HD1:sc= -0.0136 X(o=-0.014,f=-0.068) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= -0.0165 K(o=-0.016,f=-1.6!) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0 USER MOD Single : B 460 THR OG1 : rot 82:sc= 1.16 USER MOD Single : B 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 325 N TRP A 402 6.226 2.729 1.642 1.00 0.95 N ATOM 326 CA TRP A 402 4.902 2.896 0.974 1.00 0.86 C ATOM 327 C TRP A 402 3.985 3.826 1.773 1.00 0.79 C ATOM 328 O TRP A 402 3.692 4.921 1.349 1.00 0.71 O ATOM 329 CB TRP A 402 4.310 1.490 0.918 1.00 0.96 C ATOM 330 CG TRP A 402 3.774 1.243 -0.451 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.515 0.845 -1.508 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.406 1.378 -0.930 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.690 0.722 -2.615 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.380 1.039 -2.312 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.190 1.759 -0.305 1.00 0.78 C ATOM 336 CZ2 TRP A 402 1.184 1.076 -3.054 1.00 0.83 C ATOM 337 CZ3 TRP A 402 -0.015 1.797 -1.047 1.00 0.72 C ATOM 338 CH2 TRP A 402 -0.016 1.457 -2.420 1.00 0.69 C ATOM 0 HA TRP A 402 5.007 3.346 -0.013 1.00 0.86 H new ATOM 0 HB2 TRP A 402 5.072 0.751 1.163 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.516 1.386 1.658 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.578 0.654 -1.493 1.00 0.94 H new ATOM 0 HE1 TRP A 402 4.011 0.433 -3.539 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.184 2.021 0.743 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 1.186 0.814 -4.102 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -0.936 2.086 -0.563 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -0.937 1.489 -2.983 1.00 0.69 H new ATOM 349 N ALA A 403 3.520 3.394 2.916 1.00 0.85 N ATOM 350 CA ALA A 403 2.608 4.257 3.732 1.00 0.85 C ATOM 351 C ALA A 403 3.162 5.682 3.839 1.00 0.80 C ATOM 352 O ALA A 403 2.454 6.646 3.633 1.00 0.76 O ATOM 353 CB ALA A 403 2.558 3.595 5.109 1.00 0.99 C ATOM 0 H ALA A 403 3.731 2.482 3.321 1.00 0.85 H new ATOM 0 HA ALA A 403 1.618 4.341 3.283 1.00 0.85 H new ATOM 0 HB1 ALA A 403 1.907 4.171 5.766 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.170 2.581 5.011 1.00 0.99 H new ATOM 0 HB3 ALA A 403 3.562 3.560 5.532 1.00 0.99 H new ATOM 359 N THR A 404 4.421 5.826 4.145 1.00 0.82 N ATOM 360 CA THR A 404 5.000 7.195 4.243 1.00 0.81 C ATOM 361 C THR A 404 4.831 7.912 2.902 1.00 0.70 C ATOM 362 O THR A 404 4.586 9.102 2.845 1.00 0.68 O ATOM 363 CB THR A 404 6.481 6.982 4.565 1.00 0.89 C ATOM 364 OG1 THR A 404 6.600 6.112 5.682 1.00 1.07 O ATOM 365 CG2 THR A 404 7.135 8.327 4.891 1.00 0.89 C ATOM 0 H THR A 404 5.070 5.061 4.330 1.00 0.82 H new ATOM 0 HA THR A 404 4.514 7.807 5.003 1.00 0.81 H new ATOM 0 HB THR A 404 6.980 6.539 3.703 1.00 0.89 H new ATOM 0 HG1 THR A 404 7.548 5.973 5.889 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.189 8.173 5.120 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.044 8.993 4.033 1.00 0.89 H new ATOM 0 HG23 THR A 404 6.638 8.774 5.752 1.00 0.89 H new ATOM 373 N LEU A 405 4.947 7.189 1.821 1.00 0.67 N ATOM 374 CA LEU A 405 4.782 7.815 0.478 1.00 0.61 C ATOM 375 C LEU A 405 3.298 8.075 0.213 1.00 0.53 C ATOM 376 O LEU A 405 2.931 8.995 -0.491 1.00 0.52 O ATOM 377 CB LEU A 405 5.342 6.778 -0.508 1.00 0.67 C ATOM 378 CG LEU A 405 5.341 7.325 -1.949 1.00 0.65 C ATOM 379 CD1 LEU A 405 3.918 7.306 -2.509 1.00 0.57 C ATOM 380 CD2 LEU A 405 5.885 8.760 -1.979 1.00 0.64 C ATOM 0 H LEU A 405 5.149 6.189 1.810 1.00 0.67 H new ATOM 0 HA LEU A 405 5.295 8.773 0.389 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.358 6.508 -0.219 1.00 0.67 H new ATOM 0 HB3 LEU A 405 4.745 5.867 -0.461 1.00 0.67 H new ATOM 0 HG LEU A 405 5.983 6.692 -2.562 1.00 0.65 H new ATOM 0 HD11 LEU A 405 3.923 7.694 -3.528 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.542 6.283 -2.512 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.274 7.928 -1.887 1.00 0.57 H new ATOM 0 HD21 LEU A 405 5.877 9.131 -3.004 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.259 9.400 -1.357 1.00 0.64 H new ATOM 0 HD23 LEU A 405 6.906 8.770 -1.597 1.00 0.64 H new ATOM 392 N LEU A 406 2.443 7.267 0.775 1.00 0.53 N ATOM 393 CA LEU A 406 0.983 7.454 0.563 1.00 0.50 C ATOM 394 C LEU A 406 0.473 8.605 1.430 1.00 0.49 C ATOM 395 O LEU A 406 -0.426 9.330 1.051 1.00 0.45 O ATOM 396 CB LEU A 406 0.351 6.125 0.988 1.00 0.58 C ATOM 397 CG LEU A 406 -0.904 5.861 0.150 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.529 5.786 -1.330 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.532 4.533 0.575 1.00 1.02 C ATOM 0 H LEU A 406 2.695 6.482 1.375 1.00 0.53 H new ATOM 0 HA LEU A 406 0.737 7.705 -0.469 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.066 5.313 0.857 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.094 6.155 2.047 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.616 6.672 0.306 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.424 5.598 -1.923 1.00 0.94 H new ATOM 0 HD12 LEU A 406 -0.080 6.730 -1.640 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.185 4.977 -1.484 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.425 4.345 -0.021 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.816 3.726 0.420 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.803 4.580 1.630 1.00 1.02 H new ATOM 411 N ALA A 407 1.046 8.787 2.588 1.00 0.56 N ATOM 412 CA ALA A 407 0.599 9.900 3.471 1.00 0.59 C ATOM 413 C ALA A 407 1.033 11.236 2.865 1.00 0.57 C ATOM 414 O ALA A 407 0.293 12.200 2.863 1.00 0.61 O ATOM 415 CB ALA A 407 1.301 9.657 4.806 1.00 0.70 C ATOM 0 H ALA A 407 1.803 8.214 2.960 1.00 0.56 H new ATOM 0 HA ALA A 407 -0.484 9.934 3.591 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.021 10.439 5.512 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.003 8.686 5.202 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.381 9.672 4.657 1.00 0.70 H new ATOM 421 N GLN A 408 2.229 11.296 2.345 1.00 0.57 N ATOM 422 CA GLN A 408 2.715 12.563 1.732 1.00 0.57 C ATOM 423 C GLN A 408 2.124 12.727 0.329 1.00 0.50 C ATOM 424 O GLN A 408 1.764 13.813 -0.080 1.00 0.50 O ATOM 425 CB GLN A 408 4.234 12.410 1.663 1.00 0.62 C ATOM 426 CG GLN A 408 4.826 12.562 3.065 1.00 0.75 C ATOM 427 CD GLN A 408 6.334 12.797 2.960 1.00 0.78 C ATOM 428 OE1 GLN A 408 6.774 13.913 2.765 1.00 1.29 O ATOM 429 NE2 GLN A 408 7.150 11.786 3.084 1.00 1.46 N ATOM 0 H GLN A 408 2.891 10.520 2.319 1.00 0.57 H new ATOM 0 HA GLN A 408 2.421 13.443 2.305 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.494 11.435 1.251 1.00 0.62 H new ATOM 0 HB3 GLN A 408 4.656 13.161 0.995 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.352 13.396 3.583 1.00 0.75 H new ATOM 0 HG3 GLN A 408 4.627 11.667 3.654 1.00 0.75 H new ATOM 0 HE21 GLN A 408 6.780 10.849 3.248 1.00 1.46 H new ATOM 0 HE22 GLN A 408 8.157 11.932 3.017 1.00 1.46 H new ATOM 438 N TRP A 409 2.017 11.654 -0.408 1.00 0.46 N ATOM 439 CA TRP A 409 1.444 11.750 -1.782 1.00 0.43 C ATOM 440 C TRP A 409 -0.010 12.233 -1.704 1.00 0.40 C ATOM 441 O TRP A 409 -0.369 13.245 -2.270 1.00 0.41 O ATOM 442 CB TRP A 409 1.528 10.322 -2.341 1.00 0.43 C ATOM 443 CG TRP A 409 0.712 10.207 -3.591 1.00 0.42 C ATOM 444 CD1 TRP A 409 1.025 10.766 -4.783 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.548 9.503 -3.786 1.00 0.40 C ATOM 446 NE1 TRP A 409 0.039 10.451 -5.702 1.00 0.53 N ATOM 447 CE2 TRP A 409 -0.954 9.673 -5.140 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.375 8.735 -2.926 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -2.144 9.101 -5.628 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.573 8.157 -3.413 1.00 0.43 C ATOM 451 CH2 TRP A 409 -2.956 8.340 -4.762 1.00 0.48 C ATOM 0 H TRP A 409 2.301 10.718 -0.119 1.00 0.46 H new ATOM 0 HA TRP A 409 1.975 12.459 -2.417 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.567 10.067 -2.551 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.169 9.611 -1.597 1.00 0.43 H new ATOM 0 HD1 TRP A 409 1.903 11.362 -4.985 1.00 0.50 H new ATOM 0 HE1 TRP A 409 0.045 10.756 -6.675 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -1.090 8.590 -1.895 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -2.433 9.244 -6.659 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -3.197 7.574 -2.751 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -3.870 7.897 -5.129 1.00 0.48 H new ATOM 462 N ALA A 410 -0.848 11.514 -1.005 1.00 0.42 N ATOM 463 CA ALA A 410 -2.276 11.931 -0.891 1.00 0.44 C ATOM 464 C ALA A 410 -2.366 13.399 -0.463 1.00 0.45 C ATOM 465 O ALA A 410 -3.295 14.102 -0.808 1.00 0.47 O ATOM 466 CB ALA A 410 -2.868 11.017 0.183 1.00 0.51 C ATOM 0 H ALA A 410 -0.605 10.657 -0.508 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.810 11.846 -1.837 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.921 11.260 0.328 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.776 9.978 -0.132 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -2.330 11.161 1.120 1.00 0.51 H new ATOM 472 N ASP A 411 -1.401 13.865 0.279 1.00 0.48 N ATOM 473 CA ASP A 411 -1.422 15.288 0.724 1.00 0.53 C ATOM 474 C ASP A 411 -0.953 16.196 -0.416 1.00 0.53 C ATOM 475 O ASP A 411 -1.547 17.220 -0.693 1.00 0.58 O ATOM 476 CB ASP A 411 -0.444 15.351 1.898 1.00 0.60 C ATOM 477 CG ASP A 411 -1.222 15.514 3.203 1.00 1.03 C ATOM 478 OD1 ASP A 411 -2.236 16.193 3.185 1.00 1.51 O ATOM 479 OD2 ASP A 411 -0.792 14.957 4.200 1.00 1.78 O ATOM 0 H ASP A 411 -0.598 13.323 0.597 1.00 0.48 H new ATOM 0 HA ASP A 411 -2.420 15.621 1.010 1.00 0.53 H new ATOM 0 HB2 ASP A 411 0.158 14.443 1.932 1.00 0.60 H new ATOM 0 HB3 ASP A 411 0.245 16.185 1.767 1.00 0.60 H new ATOM 484 N ARG A 412 0.107 15.826 -1.080 1.00 0.51 N ATOM 485 CA ARG A 412 0.614 16.664 -2.203 1.00 0.56 C ATOM 486 C ARG A 412 -0.429 16.731 -3.319 1.00 0.55 C ATOM 487 O ARG A 412 -0.639 17.761 -3.927 1.00 0.63 O ATOM 488 CB ARG A 412 1.878 15.955 -2.689 1.00 0.58 C ATOM 489 CG ARG A 412 2.857 16.984 -3.255 1.00 0.96 C ATOM 490 CD ARG A 412 3.985 16.262 -3.996 1.00 1.50 C ATOM 491 NE ARG A 412 5.047 17.291 -4.176 1.00 1.90 N ATOM 492 CZ ARG A 412 4.936 18.183 -5.121 1.00 2.41 C ATOM 493 NH1 ARG A 412 5.314 17.896 -6.337 1.00 2.89 N ATOM 494 NH2 ARG A 412 4.447 19.362 -4.852 1.00 3.02 N ATOM 0 H ARG A 412 0.644 14.979 -0.893 1.00 0.51 H new ATOM 0 HA ARG A 412 0.818 17.690 -1.896 1.00 0.56 H new ATOM 0 HB2 ARG A 412 2.342 15.411 -1.866 1.00 0.58 H new ATOM 0 HB3 ARG A 412 1.624 15.221 -3.453 1.00 0.58 H new ATOM 0 HG2 ARG A 412 2.338 17.661 -3.933 1.00 0.96 H new ATOM 0 HG3 ARG A 412 3.268 17.592 -2.449 1.00 0.96 H new ATOM 0 HD2 ARG A 412 4.353 15.411 -3.423 1.00 1.50 H new ATOM 0 HD3 ARG A 412 3.643 15.876 -4.956 1.00 1.50 H new ATOM 0 HE ARG A 412 5.860 17.298 -3.561 1.00 1.90 H new ATOM 0 HH11 ARG A 412 5.696 16.974 -6.548 1.00 2.89 H new ATOM 0 HH12 ARG A 412 5.227 18.594 -7.076 1.00 2.89 H new ATOM 0 HH21 ARG A 412 4.151 19.587 -3.902 1.00 3.02 H new ATOM 0 HH22 ARG A 412 4.361 20.059 -5.592 1.00 3.02 H new ATOM 508 N ALA A 413 -1.086 15.639 -3.589 1.00 0.50 N ATOM 509 CA ALA A 413 -2.121 15.637 -4.661 1.00 0.53 C ATOM 510 C ALA A 413 -3.335 16.454 -4.213 1.00 0.57 C ATOM 511 O ALA A 413 -3.958 17.141 -4.997 1.00 0.66 O ATOM 512 CB ALA A 413 -2.497 14.168 -4.849 1.00 0.53 C ATOM 0 H ALA A 413 -0.952 14.747 -3.114 1.00 0.50 H new ATOM 0 HA ALA A 413 -1.761 16.082 -5.589 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -3.258 14.084 -5.625 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -1.614 13.601 -5.143 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -2.888 13.770 -3.913 1.00 0.53 H new ATOM 518 N LEU A 414 -3.672 16.385 -2.955 1.00 0.54 N ATOM 519 CA LEU A 414 -4.843 17.158 -2.451 1.00 0.61 C ATOM 520 C LEU A 414 -4.638 18.651 -2.718 1.00 0.71 C ATOM 521 O LEU A 414 -5.541 19.348 -3.137 1.00 0.82 O ATOM 522 CB LEU A 414 -4.881 16.884 -0.947 1.00 0.63 C ATOM 523 CG LEU A 414 -6.279 16.409 -0.547 1.00 0.71 C ATOM 524 CD1 LEU A 414 -6.517 15.001 -1.096 1.00 1.11 C ATOM 525 CD2 LEU A 414 -6.389 16.386 0.979 1.00 1.04 C ATOM 0 H LEU A 414 -3.187 15.826 -2.253 1.00 0.54 H new ATOM 0 HA LEU A 414 -5.773 16.869 -2.941 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -4.141 16.128 -0.686 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -4.621 17.788 -0.396 1.00 0.63 H new ATOM 0 HG LEU A 414 -7.026 17.089 -0.957 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -7.513 14.663 -0.811 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -6.436 15.016 -2.183 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -5.771 14.320 -0.686 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -7.384 16.048 1.267 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -5.642 15.705 1.387 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -6.219 17.389 1.371 1.00 1.04 H new ATOM 537 N ARG A 415 -3.455 19.149 -2.474 1.00 0.73 N ATOM 538 CA ARG A 415 -3.189 20.595 -2.710 1.00 0.86 C ATOM 539 C ARG A 415 -2.828 20.839 -4.178 1.00 0.92 C ATOM 540 O ARG A 415 -1.799 21.407 -4.486 1.00 1.26 O ATOM 541 CB ARG A 415 -2.003 20.931 -1.806 1.00 1.01 C ATOM 542 CG ARG A 415 -2.510 21.552 -0.503 1.00 1.40 C ATOM 543 CD ARG A 415 -1.334 21.762 0.452 1.00 1.61 C ATOM 544 NE ARG A 415 -1.953 22.190 1.737 1.00 2.27 N ATOM 545 CZ ARG A 415 -1.554 23.286 2.321 1.00 2.92 C ATOM 546 NH1 ARG A 415 -2.113 24.427 2.022 1.00 3.32 N ATOM 547 NH2 ARG A 415 -0.593 23.243 3.204 1.00 3.70 N ATOM 0 H ARG A 415 -2.661 18.615 -2.121 1.00 0.73 H new ATOM 0 HA ARG A 415 -4.060 21.214 -2.492 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -1.429 20.029 -1.592 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -1.331 21.623 -2.313 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -3.001 22.504 -0.708 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -3.254 20.902 -0.043 1.00 1.40 H new ATOM 0 HD2 ARG A 415 -0.759 20.845 0.577 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -0.648 22.519 0.073 1.00 1.61 H new ATOM 0 HE ARG A 415 -2.689 21.626 2.161 1.00 2.27 H new ATOM 0 HH11 ARG A 415 -2.863 24.462 1.331 1.00 3.32 H new ATOM 0 HH12 ARG A 415 -1.800 25.283 2.479 1.00 3.32 H new ATOM 0 HH21 ARG A 415 -0.154 22.352 3.437 1.00 3.70 H new ATOM 0 HH22 ARG A 415 -0.281 24.100 3.661 1.00 3.70 H new ATOM 561 N SER A 416 -3.665 20.418 -5.087 1.00 0.90 N ATOM 562 CA SER A 416 -3.361 20.631 -6.533 1.00 0.99 C ATOM 563 C SER A 416 -4.546 20.193 -7.398 1.00 0.99 C ATOM 564 O SER A 416 -5.352 21.000 -7.818 1.00 1.63 O ATOM 565 CB SER A 416 -2.138 19.759 -6.812 1.00 1.20 C ATOM 566 OG SER A 416 -0.959 20.541 -6.664 1.00 1.69 O ATOM 0 H SER A 416 -4.543 19.937 -4.893 1.00 0.90 H new ATOM 0 HA SER A 416 -3.175 21.680 -6.765 1.00 0.99 H new ATOM 0 HB2 SER A 416 -2.116 18.913 -6.125 1.00 1.20 H new ATOM 0 HB3 SER A 416 -2.192 19.349 -7.820 1.00 1.20 H new ATOM 0 HG SER A 416 -0.973 20.992 -5.794 1.00 1.69 H new ATOM 572 N GLY A 417 -4.660 18.920 -7.670 1.00 1.06 N ATOM 573 CA GLY A 417 -5.792 18.435 -8.508 1.00 1.06 C ATOM 574 C GLY A 417 -6.010 16.944 -8.254 1.00 0.99 C ATOM 575 O GLY A 417 -6.148 16.161 -9.174 1.00 1.31 O ATOM 0 H GLY A 417 -4.018 18.196 -7.348 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -6.699 18.992 -8.271 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -5.578 18.608 -9.563 1.00 1.06 H new ATOM 579 N HIS A 418 -6.044 16.544 -7.014 1.00 0.78 N ATOM 580 CA HIS A 418 -6.254 15.103 -6.696 1.00 0.87 C ATOM 581 C HIS A 418 -7.535 14.593 -7.361 1.00 0.89 C ATOM 582 O HIS A 418 -8.442 15.351 -7.645 1.00 1.17 O ATOM 583 CB HIS A 418 -6.387 15.054 -5.175 1.00 1.01 C ATOM 584 CG HIS A 418 -7.532 15.931 -4.746 1.00 1.68 C ATOM 585 ND1 HIS A 418 -7.365 17.278 -4.465 1.00 2.18 N ATOM 586 CD2 HIS A 418 -8.865 15.668 -4.547 1.00 2.31 C ATOM 587 CE1 HIS A 418 -8.568 17.771 -4.116 1.00 2.86 C ATOM 588 NE2 HIS A 418 -9.517 16.831 -4.150 1.00 2.97 N ATOM 0 H HIS A 418 -5.935 17.154 -6.204 1.00 0.78 H new ATOM 0 HA HIS A 418 -5.439 14.477 -7.058 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -6.557 14.029 -4.846 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -5.462 15.390 -4.707 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -9.336 14.705 -4.679 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -8.745 18.801 -3.842 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -10.507 16.942 -3.932 1.00 2.97 H new ATOM 596 N GLN A 419 -7.616 13.315 -7.606 1.00 1.08 N ATOM 597 CA GLN A 419 -8.836 12.752 -8.247 1.00 1.25 C ATOM 598 C GLN A 419 -8.960 11.261 -7.917 1.00 1.03 C ATOM 599 O GLN A 419 -9.765 10.862 -7.100 1.00 1.28 O ATOM 600 CB GLN A 419 -8.627 12.959 -9.747 1.00 1.71 C ATOM 601 CG GLN A 419 -9.645 13.975 -10.268 1.00 2.33 C ATOM 602 CD GLN A 419 -9.681 13.928 -11.797 1.00 2.91 C ATOM 603 OE1 GLN A 419 -9.441 12.896 -12.391 1.00 3.29 O ATOM 604 NE2 GLN A 419 -9.973 15.011 -12.464 1.00 3.52 N ATOM 0 H GLN A 419 -6.888 12.635 -7.389 1.00 1.08 H new ATOM 0 HA GLN A 419 -9.750 13.232 -7.897 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -7.614 13.312 -9.939 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -8.739 12.012 -10.275 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -10.633 13.755 -9.864 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -9.379 14.977 -9.931 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -10.175 15.878 -11.966 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -10.000 14.991 -13.483 1.00 3.52 H new ATOM 613 N ASN A 420 -8.167 10.437 -8.546 1.00 0.78 N ATOM 614 CA ASN A 420 -8.238 8.976 -8.266 1.00 0.70 C ATOM 615 C ASN A 420 -7.278 8.605 -7.132 1.00 0.58 C ATOM 616 O ASN A 420 -6.420 7.758 -7.284 1.00 0.71 O ATOM 617 CB ASN A 420 -7.814 8.303 -9.571 1.00 0.86 C ATOM 618 CG ASN A 420 -8.867 8.572 -10.648 1.00 1.35 C ATOM 619 OD1 ASN A 420 -9.362 9.675 -10.770 1.00 1.96 O ATOM 620 ND2 ASN A 420 -9.236 7.601 -11.438 1.00 1.88 N ATOM 0 H ASN A 420 -7.474 10.713 -9.241 1.00 0.78 H new ATOM 0 HA ASN A 420 -9.234 8.664 -7.951 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -6.845 8.685 -9.891 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -7.700 7.230 -9.419 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -9.940 7.768 -12.157 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -8.821 6.675 -11.336 1.00 1.88 H new ATOM 627 N LEU A 421 -7.411 9.237 -5.998 1.00 0.45 N ATOM 628 CA LEU A 421 -6.502 8.923 -4.857 1.00 0.40 C ATOM 629 C LEU A 421 -6.617 7.445 -4.470 1.00 0.39 C ATOM 630 O LEU A 421 -5.811 6.625 -4.865 1.00 0.53 O ATOM 631 CB LEU A 421 -6.985 9.814 -3.712 1.00 0.42 C ATOM 632 CG LEU A 421 -6.209 11.130 -3.723 1.00 0.39 C ATOM 633 CD1 LEU A 421 -7.133 12.271 -3.290 1.00 0.50 C ATOM 634 CD2 LEU A 421 -5.031 11.034 -2.750 1.00 0.41 C ATOM 0 H LEU A 421 -8.109 9.957 -5.811 1.00 0.45 H new ATOM 0 HA LEU A 421 -5.456 9.102 -5.105 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -8.052 10.009 -3.815 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -6.845 9.305 -2.758 1.00 0.42 H new ATOM 0 HG LEU A 421 -5.837 11.324 -4.729 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.580 13.210 -3.298 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -7.974 12.340 -3.980 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.504 12.077 -2.284 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.476 11.972 -2.757 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.404 10.840 -1.744 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.372 10.221 -3.055 1.00 0.41 H new ATOM 646 N LEU A 422 -7.609 7.100 -3.695 1.00 0.33 N ATOM 647 CA LEU A 422 -7.774 5.678 -3.274 1.00 0.34 C ATOM 648 C LEU A 422 -7.816 4.757 -4.497 1.00 0.35 C ATOM 649 O LEU A 422 -7.465 3.597 -4.423 1.00 0.37 O ATOM 650 CB LEU A 422 -9.110 5.645 -2.532 1.00 0.37 C ATOM 651 CG LEU A 422 -8.876 5.927 -1.047 1.00 0.38 C ATOM 652 CD1 LEU A 422 -10.183 6.388 -0.400 1.00 0.58 C ATOM 653 CD2 LEU A 422 -8.388 4.652 -0.357 1.00 0.63 C ATOM 0 H LEU A 422 -8.314 7.743 -3.334 1.00 0.33 H new ATOM 0 HA LEU A 422 -6.948 5.333 -2.652 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.789 6.387 -2.951 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.584 4.672 -2.658 1.00 0.37 H new ATOM 0 HG LEU A 422 -8.124 6.709 -0.941 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -10.014 6.588 0.658 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.531 7.297 -0.891 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -10.936 5.607 -0.506 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -8.221 4.852 0.701 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -9.140 3.870 -0.464 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -7.455 4.324 -0.816 1.00 0.63 H new ATOM 665 N SER A 423 -8.249 5.263 -5.616 1.00 0.35 N ATOM 666 CA SER A 423 -8.321 4.415 -6.841 1.00 0.38 C ATOM 667 C SER A 423 -6.920 4.162 -7.410 1.00 0.36 C ATOM 668 O SER A 423 -6.722 3.278 -8.220 1.00 0.40 O ATOM 669 CB SER A 423 -9.161 5.222 -7.830 1.00 0.44 C ATOM 670 OG SER A 423 -9.413 4.434 -8.985 1.00 1.23 O ATOM 0 H SER A 423 -8.557 6.228 -5.738 1.00 0.35 H new ATOM 0 HA SER A 423 -8.754 3.436 -6.634 1.00 0.38 H new ATOM 0 HB2 SER A 423 -10.102 5.520 -7.367 1.00 0.44 H new ATOM 0 HB3 SER A 423 -8.638 6.137 -8.107 1.00 0.44 H new ATOM 0 HG SER A 423 -9.953 4.949 -9.621 1.00 1.23 H new ATOM 676 N GLU A 424 -5.945 4.929 -7.000 1.00 0.34 N ATOM 677 CA GLU A 424 -4.565 4.722 -7.528 1.00 0.36 C ATOM 678 C GLU A 424 -3.858 3.604 -6.757 1.00 0.32 C ATOM 679 O GLU A 424 -3.367 2.654 -7.334 1.00 0.33 O ATOM 680 CB GLU A 424 -3.853 6.057 -7.313 1.00 0.38 C ATOM 681 CG GLU A 424 -3.408 6.618 -8.665 1.00 0.58 C ATOM 682 CD GLU A 424 -2.269 7.617 -8.455 1.00 0.81 C ATOM 683 OE1 GLU A 424 -1.353 7.295 -7.714 1.00 1.54 O ATOM 684 OE2 GLU A 424 -2.330 8.688 -9.037 1.00 1.22 O ATOM 0 H GLU A 424 -6.044 5.687 -6.325 1.00 0.34 H new ATOM 0 HA GLU A 424 -4.568 4.426 -8.577 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.520 6.762 -6.816 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -2.990 5.921 -6.661 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -3.080 5.808 -9.316 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -4.247 7.106 -9.162 1.00 0.58 H new ATOM 691 N ALA A 425 -3.800 3.709 -5.458 1.00 0.31 N ATOM 692 CA ALA A 425 -3.123 2.651 -4.654 1.00 0.29 C ATOM 693 C ALA A 425 -4.020 1.412 -4.538 1.00 0.28 C ATOM 694 O ALA A 425 -3.565 0.335 -4.208 1.00 0.28 O ATOM 695 CB ALA A 425 -2.899 3.281 -3.279 1.00 0.29 C ATOM 0 H ALA A 425 -4.192 4.481 -4.918 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.189 2.323 -5.110 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.403 2.563 -2.626 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.275 4.168 -3.383 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -3.859 3.562 -2.847 1.00 0.29 H new ATOM 701 N GLN A 426 -5.289 1.558 -4.805 1.00 0.30 N ATOM 702 CA GLN A 426 -6.215 0.392 -4.710 1.00 0.31 C ATOM 703 C GLN A 426 -5.670 -0.804 -5.508 1.00 0.30 C ATOM 704 O GLN A 426 -5.468 -1.868 -4.956 1.00 0.30 O ATOM 705 CB GLN A 426 -7.530 0.885 -5.313 1.00 0.36 C ATOM 706 CG GLN A 426 -8.570 1.058 -4.205 1.00 0.45 C ATOM 707 CD GLN A 426 -9.813 1.745 -4.774 1.00 0.54 C ATOM 708 OE1 GLN A 426 -10.314 2.691 -4.201 1.00 1.23 O ATOM 709 NE2 GLN A 426 -10.334 1.304 -5.886 1.00 1.09 N ATOM 0 H GLN A 426 -5.726 2.436 -5.085 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.336 0.049 -3.682 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.373 1.832 -5.829 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.890 0.173 -6.056 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -8.837 0.087 -3.788 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -8.154 1.651 -3.391 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -9.912 0.509 -6.367 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.163 1.754 -6.275 1.00 1.09 H new ATOM 718 N PRO A 427 -5.453 -0.596 -6.786 1.00 0.32 N ATOM 719 CA PRO A 427 -4.932 -1.688 -7.649 1.00 0.34 C ATOM 720 C PRO A 427 -3.487 -2.024 -7.278 1.00 0.31 C ATOM 721 O PRO A 427 -2.994 -3.094 -7.576 1.00 0.35 O ATOM 722 CB PRO A 427 -5.020 -1.107 -9.059 1.00 0.39 C ATOM 723 CG PRO A 427 -4.989 0.373 -8.865 1.00 0.38 C ATOM 724 CD PRO A 427 -5.659 0.646 -7.544 1.00 0.35 C ATOM 0 HA PRO A 427 -5.490 -2.619 -7.545 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -4.187 -1.442 -9.678 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.936 -1.421 -9.560 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.964 0.742 -8.863 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -5.510 0.881 -9.676 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -5.213 1.502 -7.038 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.719 0.867 -7.671 1.00 0.35 H new ATOM 732 N GLU A 428 -2.804 -1.126 -6.623 1.00 0.29 N ATOM 733 CA GLU A 428 -1.395 -1.408 -6.232 1.00 0.29 C ATOM 734 C GLU A 428 -1.362 -2.516 -5.176 1.00 0.27 C ATOM 735 O GLU A 428 -0.717 -3.532 -5.348 1.00 0.32 O ATOM 736 CB GLU A 428 -0.870 -0.095 -5.649 1.00 0.29 C ATOM 737 CG GLU A 428 -0.044 0.640 -6.707 1.00 0.71 C ATOM 738 CD GLU A 428 1.412 0.166 -6.650 1.00 1.37 C ATOM 739 OE1 GLU A 428 1.749 -0.550 -5.720 1.00 2.07 O ATOM 740 OE2 GLU A 428 2.166 0.527 -7.539 1.00 2.12 O ATOM 0 H GLU A 428 -3.160 -0.212 -6.343 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.790 -1.745 -7.073 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.702 0.529 -5.324 1.00 0.29 H new ATOM 0 HB3 GLU A 428 -0.259 -0.294 -4.769 1.00 0.29 H new ATOM 0 HG2 GLU A 428 -0.458 0.455 -7.698 1.00 0.71 H new ATOM 0 HG3 GLU A 428 -0.093 1.716 -6.537 1.00 0.71 H new ATOM 747 N LEU A 429 -2.061 -2.334 -4.089 1.00 0.26 N ATOM 748 CA LEU A 429 -2.075 -3.384 -3.030 1.00 0.26 C ATOM 749 C LEU A 429 -2.646 -4.685 -3.601 1.00 0.25 C ATOM 750 O LEU A 429 -2.105 -5.752 -3.398 1.00 0.28 O ATOM 751 CB LEU A 429 -2.985 -2.829 -1.931 1.00 0.26 C ATOM 752 CG LEU A 429 -3.208 -3.896 -0.854 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.536 -3.462 0.449 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.710 -4.070 -0.615 1.00 0.56 C ATOM 0 H LEU A 429 -2.622 -1.506 -3.888 1.00 0.26 H new ATOM 0 HA LEU A 429 -1.079 -3.610 -2.650 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.535 -1.940 -1.488 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -3.941 -2.524 -2.357 1.00 0.26 H new ATOM 0 HG LEU A 429 -2.776 -4.840 -1.187 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -2.697 -4.223 1.212 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.466 -3.336 0.282 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -2.965 -2.517 0.783 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -4.871 -4.829 0.151 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -5.138 -3.124 -0.284 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -5.192 -4.382 -1.542 1.00 0.56 H new ATOM 766 N GLU A 430 -3.736 -4.602 -4.315 1.00 0.27 N ATOM 767 CA GLU A 430 -4.336 -5.835 -4.898 1.00 0.28 C ATOM 768 C GLU A 430 -3.336 -6.515 -5.837 1.00 0.30 C ATOM 769 O GLU A 430 -3.214 -7.723 -5.860 1.00 0.33 O ATOM 770 CB GLU A 430 -5.560 -5.352 -5.676 1.00 0.30 C ATOM 771 CG GLU A 430 -6.587 -6.483 -5.767 1.00 0.61 C ATOM 772 CD GLU A 430 -6.532 -7.113 -7.159 1.00 1.45 C ATOM 773 OE1 GLU A 430 -5.500 -6.998 -7.799 1.00 2.18 O ATOM 774 OE2 GLU A 430 -7.522 -7.702 -7.561 1.00 2.05 O ATOM 0 H GLU A 430 -4.235 -3.736 -4.519 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.603 -6.566 -4.134 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -6.000 -4.486 -5.181 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.266 -5.033 -6.676 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -6.381 -7.237 -5.007 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -7.587 -6.097 -5.571 1.00 0.61 H new ATOM 781 N ARG A 431 -2.618 -5.747 -6.610 1.00 0.33 N ATOM 782 CA ARG A 431 -1.627 -6.349 -7.549 1.00 0.37 C ATOM 783 C ARG A 431 -0.489 -7.016 -6.770 1.00 0.36 C ATOM 784 O ARG A 431 -0.010 -8.072 -7.134 1.00 0.38 O ATOM 785 CB ARG A 431 -1.092 -5.174 -8.368 1.00 0.41 C ATOM 786 CG ARG A 431 -0.264 -5.704 -9.540 1.00 0.59 C ATOM 787 CD ARG A 431 -1.170 -5.925 -10.752 1.00 1.32 C ATOM 788 NE ARG A 431 -0.559 -7.067 -11.486 1.00 1.56 N ATOM 789 CZ ARG A 431 -1.174 -7.589 -12.512 1.00 2.19 C ATOM 790 NH1 ARG A 431 -1.828 -6.821 -13.339 1.00 2.87 N ATOM 791 NH2 ARG A 431 -1.135 -8.878 -12.709 1.00 2.78 N ATOM 0 H ARG A 431 -2.674 -4.729 -6.633 1.00 0.33 H new ATOM 0 HA ARG A 431 -2.075 -7.118 -8.178 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.919 -4.568 -8.738 1.00 0.41 H new ATOM 0 HB3 ARG A 431 -0.480 -4.528 -7.739 1.00 0.41 H new ATOM 0 HG2 ARG A 431 0.527 -4.996 -9.789 1.00 0.59 H new ATOM 0 HG3 ARG A 431 0.222 -6.639 -9.261 1.00 0.59 H new ATOM 0 HD2 ARG A 431 -2.191 -6.154 -10.445 1.00 1.32 H new ATOM 0 HD3 ARG A 431 -1.217 -5.034 -11.377 1.00 1.32 H new ATOM 0 HE ARG A 431 0.341 -7.442 -11.187 1.00 1.56 H new ATOM 0 HH11 ARG A 431 -1.858 -5.813 -13.184 1.00 2.87 H new ATOM 0 HH12 ARG A 431 -2.309 -7.228 -14.141 1.00 2.87 H new ATOM 0 HH21 ARG A 431 -0.624 -9.478 -12.061 1.00 2.78 H new ATOM 0 HH22 ARG A 431 -1.616 -9.286 -13.511 1.00 2.78 H new ATOM 805 N THR A 432 -0.049 -6.406 -5.703 1.00 0.41 N ATOM 806 CA THR A 432 1.061 -7.005 -4.907 1.00 0.45 C ATOM 807 C THR A 432 0.582 -8.267 -4.185 1.00 0.40 C ATOM 808 O THR A 432 1.324 -9.213 -4.012 1.00 0.56 O ATOM 809 CB THR A 432 1.450 -5.924 -3.896 1.00 0.53 C ATOM 810 OG1 THR A 432 1.808 -4.738 -4.589 1.00 0.61 O ATOM 811 CG2 THR A 432 2.635 -6.408 -3.060 1.00 0.62 C ATOM 0 H THR A 432 -0.409 -5.520 -5.348 1.00 0.41 H new ATOM 0 HA THR A 432 1.902 -7.302 -5.534 1.00 0.45 H new ATOM 0 HB THR A 432 0.605 -5.719 -3.238 1.00 0.53 H new ATOM 0 HG1 THR A 432 0.997 -4.248 -4.839 1.00 0.61 H new ATOM 0 HG21 THR A 432 2.911 -5.637 -2.340 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.358 -7.318 -2.529 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.482 -6.614 -3.714 1.00 0.62 H new ATOM 819 N LEU A 433 -0.652 -8.291 -3.762 1.00 0.33 N ATOM 820 CA LEU A 433 -1.172 -9.495 -3.050 1.00 0.30 C ATOM 821 C LEU A 433 -1.551 -10.585 -4.056 1.00 0.27 C ATOM 822 O LEU A 433 -1.138 -11.721 -3.938 1.00 0.25 O ATOM 823 CB LEU A 433 -2.409 -9.004 -2.296 1.00 0.37 C ATOM 824 CG LEU A 433 -2.350 -9.489 -0.845 1.00 0.42 C ATOM 825 CD1 LEU A 433 -2.329 -11.017 -0.816 1.00 0.41 C ATOM 826 CD2 LEU A 433 -1.082 -8.949 -0.181 1.00 0.44 C ATOM 0 H LEU A 433 -1.322 -7.531 -3.878 1.00 0.33 H new ATOM 0 HA LEU A 433 -0.431 -9.930 -2.379 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -2.457 -7.915 -2.325 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -3.313 -9.376 -2.778 1.00 0.37 H new ATOM 0 HG LEU A 433 -3.226 -9.129 -0.306 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -2.287 -11.361 0.218 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -3.232 -11.402 -1.290 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -1.453 -11.379 -1.355 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -1.038 -9.293 0.852 1.00 0.44 H new ATOM 0 HD22 LEU A 433 -0.207 -9.309 -0.721 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -1.097 -7.859 -0.200 1.00 0.44 H new ATOM 838 N LEU A 434 -2.335 -10.249 -5.045 1.00 0.32 N ATOM 839 CA LEU A 434 -2.739 -11.269 -6.054 1.00 0.32 C ATOM 840 C LEU A 434 -1.501 -11.956 -6.638 1.00 0.29 C ATOM 841 O LEU A 434 -1.486 -13.153 -6.847 1.00 0.30 O ATOM 842 CB LEU A 434 -3.478 -10.485 -7.138 1.00 0.41 C ATOM 843 CG LEU A 434 -4.575 -11.360 -7.745 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.795 -11.360 -6.823 1.00 0.84 C ATOM 845 CD2 LEU A 434 -4.970 -10.802 -9.113 1.00 1.14 C ATOM 0 H LEU A 434 -2.712 -9.314 -5.197 1.00 0.32 H new ATOM 0 HA LEU A 434 -3.362 -12.052 -5.621 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -3.913 -9.580 -6.714 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.780 -10.170 -7.913 1.00 0.41 H new ATOM 0 HG LEU A 434 -4.207 -12.379 -7.860 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -6.578 -11.984 -7.255 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.513 -11.755 -5.847 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -6.165 -10.341 -6.709 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -5.752 -11.424 -9.548 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -5.339 -9.783 -8.997 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -4.100 -10.800 -9.770 1.00 1.14 H new ATOM 857 N THR A 435 -0.463 -11.211 -6.903 1.00 0.34 N ATOM 858 CA THR A 435 0.769 -11.828 -7.472 1.00 0.37 C ATOM 859 C THR A 435 1.443 -12.716 -6.424 1.00 0.35 C ATOM 860 O THR A 435 1.909 -13.798 -6.721 1.00 0.39 O ATOM 861 CB THR A 435 1.674 -10.651 -7.842 1.00 0.45 C ATOM 862 OG1 THR A 435 1.043 -9.870 -8.849 1.00 0.52 O ATOM 863 CG2 THR A 435 3.011 -11.178 -8.365 1.00 0.55 C ATOM 0 H THR A 435 -0.414 -10.204 -6.751 1.00 0.34 H new ATOM 0 HA THR A 435 0.554 -12.458 -8.335 1.00 0.37 H new ATOM 0 HB THR A 435 1.850 -10.035 -6.960 1.00 0.45 H new ATOM 0 HG1 THR A 435 0.611 -9.092 -8.437 1.00 0.52 H new ATOM 0 HG21 THR A 435 3.655 -10.339 -8.628 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.493 -11.777 -7.593 1.00 0.55 H new ATOM 0 HG23 THR A 435 2.839 -11.794 -9.247 1.00 0.55 H new ATOM 871 N THR A 436 1.497 -12.270 -5.199 1.00 0.33 N ATOM 872 CA THR A 436 2.137 -13.094 -4.135 1.00 0.36 C ATOM 873 C THR A 436 1.398 -14.425 -3.995 1.00 0.36 C ATOM 874 O THR A 436 1.946 -15.480 -4.246 1.00 0.40 O ATOM 875 CB THR A 436 2.008 -12.265 -2.856 1.00 0.38 C ATOM 876 OG1 THR A 436 2.722 -11.047 -3.010 1.00 0.39 O ATOM 877 CG2 THR A 436 2.583 -13.050 -1.676 1.00 0.49 C ATOM 0 H THR A 436 1.126 -11.372 -4.889 1.00 0.33 H new ATOM 0 HA THR A 436 3.178 -13.328 -4.358 1.00 0.36 H new ATOM 0 HB THR A 436 0.956 -12.049 -2.667 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.088 -10.303 -3.078 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.490 -12.458 -0.765 1.00 0.49 H new ATOM 0 HG22 THR A 436 2.034 -13.984 -1.559 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.635 -13.268 -1.862 1.00 0.49 H new ATOM 885 N ALA A 437 0.153 -14.386 -3.605 1.00 0.34 N ATOM 886 CA ALA A 437 -0.617 -15.653 -3.462 1.00 0.36 C ATOM 887 C ALA A 437 -0.603 -16.411 -4.789 1.00 0.36 C ATOM 888 O ALA A 437 -0.542 -17.624 -4.820 1.00 0.41 O ATOM 889 CB ALA A 437 -2.039 -15.221 -3.101 1.00 0.35 C ATOM 0 H ALA A 437 -0.362 -13.535 -3.380 1.00 0.34 H new ATOM 0 HA ALA A 437 -0.197 -16.315 -2.705 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -2.667 -16.103 -2.979 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -2.022 -14.656 -2.169 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.442 -14.596 -3.897 1.00 0.35 H new ATOM 895 N LEU A 438 -0.645 -15.707 -5.889 1.00 0.34 N ATOM 896 CA LEU A 438 -0.618 -16.404 -7.203 1.00 0.36 C ATOM 897 C LEU A 438 0.700 -17.166 -7.343 1.00 0.42 C ATOM 898 O LEU A 438 0.738 -18.263 -7.860 1.00 0.46 O ATOM 899 CB LEU A 438 -0.727 -15.305 -8.266 1.00 0.36 C ATOM 900 CG LEU A 438 -0.495 -15.910 -9.658 1.00 0.41 C ATOM 901 CD1 LEU A 438 -1.470 -17.068 -9.891 1.00 0.42 C ATOM 902 CD2 LEU A 438 -0.723 -14.843 -10.728 1.00 0.45 C ATOM 0 H LEU A 438 -0.696 -14.689 -5.933 1.00 0.34 H new ATOM 0 HA LEU A 438 -1.429 -17.125 -7.306 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.711 -14.838 -8.221 1.00 0.36 H new ATOM 0 HB3 LEU A 438 0.007 -14.523 -8.071 1.00 0.36 H new ATOM 0 HG LEU A 438 0.529 -16.278 -9.717 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -1.300 -17.493 -10.880 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -1.311 -17.836 -9.134 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -2.494 -16.700 -9.825 1.00 0.42 H new ATOM 0 HD21 LEU A 438 -0.557 -15.276 -11.715 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -1.746 -14.473 -10.661 1.00 0.45 H new ATOM 0 HD23 LEU A 438 -0.028 -14.018 -10.573 1.00 0.45 H new ATOM 914 N ARG A 439 1.784 -16.599 -6.878 1.00 0.43 N ATOM 915 CA ARG A 439 3.090 -17.312 -6.982 1.00 0.51 C ATOM 916 C ARG A 439 2.941 -18.723 -6.411 1.00 0.54 C ATOM 917 O ARG A 439 3.429 -19.686 -6.971 1.00 0.61 O ATOM 918 CB ARG A 439 4.071 -16.487 -6.147 1.00 0.52 C ATOM 919 CG ARG A 439 5.490 -16.685 -6.685 1.00 0.77 C ATOM 920 CD ARG A 439 6.409 -15.601 -6.118 1.00 1.28 C ATOM 921 NE ARG A 439 7.189 -16.279 -5.046 1.00 1.74 N ATOM 922 CZ ARG A 439 7.654 -15.588 -4.041 1.00 2.28 C ATOM 923 NH1 ARG A 439 6.836 -15.106 -3.147 1.00 2.82 N ATOM 924 NH2 ARG A 439 8.938 -15.380 -3.933 1.00 2.89 N ATOM 0 H ARG A 439 1.821 -15.681 -6.435 1.00 0.43 H new ATOM 0 HA ARG A 439 3.435 -17.411 -8.011 1.00 0.51 H new ATOM 0 HB2 ARG A 439 3.800 -15.432 -6.185 1.00 0.52 H new ATOM 0 HB3 ARG A 439 4.021 -16.791 -5.102 1.00 0.52 H new ATOM 0 HG2 ARG A 439 5.861 -17.672 -6.408 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.487 -16.640 -7.774 1.00 0.77 H new ATOM 0 HD2 ARG A 439 7.066 -15.197 -6.889 1.00 1.28 H new ATOM 0 HD3 ARG A 439 5.834 -14.765 -5.719 1.00 1.28 H new ATOM 0 HE ARG A 439 7.360 -17.283 -5.097 1.00 1.74 H new ATOM 0 HH11 ARG A 439 5.833 -15.269 -3.233 1.00 2.82 H new ATOM 0 HH12 ARG A 439 7.199 -14.566 -2.362 1.00 2.82 H new ATOM 0 HH21 ARG A 439 9.576 -15.757 -4.633 1.00 2.89 H new ATOM 0 HH22 ARG A 439 9.303 -14.840 -3.148 1.00 2.89 H new ATOM 938 N HIS A 440 2.241 -18.855 -5.317 1.00 0.52 N ATOM 939 CA HIS A 440 2.030 -20.208 -4.736 1.00 0.57 C ATOM 940 C HIS A 440 1.346 -21.086 -5.786 1.00 0.58 C ATOM 941 O HIS A 440 1.518 -22.288 -5.823 1.00 0.64 O ATOM 942 CB HIS A 440 1.115 -19.986 -3.530 1.00 0.56 C ATOM 943 CG HIS A 440 0.860 -21.301 -2.848 1.00 0.63 C ATOM 944 ND1 HIS A 440 1.818 -22.301 -2.787 1.00 1.04 N ATOM 945 CD2 HIS A 440 -0.242 -21.798 -2.195 1.00 0.82 C ATOM 946 CE1 HIS A 440 1.281 -23.338 -2.119 1.00 0.96 C ATOM 947 NE2 HIS A 440 0.026 -23.084 -1.735 1.00 0.75 N ATOM 0 H HIS A 440 1.809 -18.087 -4.804 1.00 0.52 H new ATOM 0 HA HIS A 440 2.956 -20.701 -4.440 1.00 0.57 H new ATOM 0 HB2 HIS A 440 1.576 -19.286 -2.833 1.00 0.56 H new ATOM 0 HB3 HIS A 440 0.173 -19.542 -3.851 1.00 0.56 H new ATOM 0 HD2 HIS A 440 -1.175 -21.271 -2.059 1.00 0.82 H new ATOM 0 HE1 HIS A 440 1.801 -24.263 -1.918 1.00 0.96 H new ATOM 0 HE2 HIS A 440 -0.600 -23.700 -1.217 1.00 0.75 H new ATOM 955 N THR A 441 0.583 -20.473 -6.652 1.00 0.54 N ATOM 956 CA THR A 441 -0.114 -21.232 -7.730 1.00 0.55 C ATOM 957 C THR A 441 0.182 -20.567 -9.077 1.00 0.56 C ATOM 958 O THR A 441 -0.715 -20.254 -9.833 1.00 0.55 O ATOM 959 CB THR A 441 -1.609 -21.131 -7.403 1.00 0.53 C ATOM 960 OG1 THR A 441 -2.045 -19.796 -7.616 1.00 0.48 O ATOM 961 CG2 THR A 441 -1.860 -21.523 -5.945 1.00 0.54 C ATOM 0 H THR A 441 0.412 -19.468 -6.658 1.00 0.54 H new ATOM 0 HA THR A 441 0.209 -22.271 -7.788 1.00 0.55 H new ATOM 0 HB THR A 441 -2.163 -21.810 -8.051 1.00 0.53 H new ATOM 0 HG1 THR A 441 -2.737 -19.785 -8.310 1.00 0.48 H new ATOM 0 HG21 THR A 441 -2.925 -21.447 -5.726 1.00 0.54 H new ATOM 0 HG22 THR A 441 -1.528 -22.548 -5.782 1.00 0.54 H new ATOM 0 HG23 THR A 441 -1.306 -20.853 -5.288 1.00 0.54 H new ATOM 969 N GLN A 442 1.441 -20.327 -9.360 1.00 0.59 N ATOM 970 CA GLN A 442 1.840 -19.655 -10.641 1.00 0.62 C ATOM 971 C GLN A 442 0.990 -20.129 -11.826 1.00 0.64 C ATOM 972 O GLN A 442 0.897 -21.307 -12.111 1.00 0.69 O ATOM 973 CB GLN A 442 3.303 -20.051 -10.847 1.00 0.69 C ATOM 974 CG GLN A 442 3.425 -21.577 -10.859 1.00 1.43 C ATOM 975 CD GLN A 442 4.901 -21.972 -10.764 1.00 1.79 C ATOM 976 OE1 GLN A 442 5.759 -21.288 -11.285 1.00 2.16 O ATOM 977 NE2 GLN A 442 5.233 -23.055 -10.117 1.00 2.47 N ATOM 0 H GLN A 442 2.221 -20.571 -8.749 1.00 0.59 H new ATOM 0 HA GLN A 442 1.695 -18.576 -10.584 1.00 0.62 H new ATOM 0 HB2 GLN A 442 3.673 -19.639 -11.786 1.00 0.69 H new ATOM 0 HB3 GLN A 442 3.919 -19.633 -10.051 1.00 0.69 H new ATOM 0 HG2 GLN A 442 2.869 -22.003 -10.024 1.00 1.43 H new ATOM 0 HG3 GLN A 442 2.988 -21.980 -11.772 1.00 1.43 H new ATOM 0 HE21 GLN A 442 4.512 -23.629 -9.680 1.00 2.47 H new ATOM 0 HE22 GLN A 442 6.213 -23.328 -10.048 1.00 2.47 H new ATOM 986 N GLY A 443 0.372 -19.209 -12.520 1.00 0.63 N ATOM 987 CA GLY A 443 -0.469 -19.589 -13.689 1.00 0.66 C ATOM 988 C GLY A 443 -1.896 -19.883 -13.227 1.00 0.64 C ATOM 989 O GLY A 443 -2.855 -19.406 -13.802 1.00 0.66 O ATOM 0 H GLY A 443 0.415 -18.209 -12.325 1.00 0.63 H new ATOM 0 HA2 GLY A 443 -0.473 -18.783 -14.423 1.00 0.66 H new ATOM 0 HA3 GLY A 443 -0.049 -20.466 -14.181 1.00 0.66 H new ATOM 993 N HIS A 444 -2.048 -20.666 -12.195 1.00 0.62 N ATOM 994 CA HIS A 444 -3.417 -20.989 -11.701 1.00 0.62 C ATOM 995 C HIS A 444 -4.052 -19.753 -11.059 1.00 0.67 C ATOM 996 O HIS A 444 -4.308 -19.721 -9.872 1.00 1.34 O ATOM 997 CB HIS A 444 -3.211 -22.091 -10.661 1.00 0.63 C ATOM 998 CG HIS A 444 -2.818 -23.367 -11.354 1.00 0.95 C ATOM 999 ND1 HIS A 444 -3.573 -23.917 -12.377 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -1.749 -24.211 -11.180 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -2.955 -25.044 -12.776 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -1.838 -25.271 -12.079 1.00 1.86 N ATOM 0 H HIS A 444 -1.285 -21.096 -11.673 1.00 0.62 H new ATOM 0 HA HIS A 444 -4.083 -21.306 -12.503 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -2.437 -21.797 -9.952 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -4.127 -22.242 -10.089 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -0.959 -24.074 -10.456 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -3.318 -25.687 -13.564 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -1.190 -26.052 -12.183 1.00 1.86 H new ATOM 1010 N LYS A 445 -4.309 -18.736 -11.836 1.00 0.62 N ATOM 1011 CA LYS A 445 -4.929 -17.504 -11.269 1.00 0.51 C ATOM 1012 C LYS A 445 -6.214 -17.859 -10.521 1.00 0.51 C ATOM 1013 O LYS A 445 -6.655 -17.140 -9.647 1.00 0.57 O ATOM 1014 CB LYS A 445 -5.238 -16.623 -12.480 1.00 0.62 C ATOM 1015 CG LYS A 445 -4.038 -15.722 -12.774 1.00 1.31 C ATOM 1016 CD LYS A 445 -4.452 -14.623 -13.755 1.00 1.56 C ATOM 1017 CE LYS A 445 -3.315 -14.367 -14.745 1.00 2.23 C ATOM 1018 NZ LYS A 445 -2.995 -12.920 -14.596 1.00 2.52 N ATOM 0 H LYS A 445 -4.117 -18.705 -12.837 1.00 0.62 H new ATOM 0 HA LYS A 445 -4.275 -17.001 -10.557 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -5.461 -17.244 -13.348 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -6.123 -16.017 -12.286 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -3.668 -15.278 -11.850 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -3.222 -16.311 -13.194 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -5.354 -14.920 -14.290 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -4.689 -13.708 -13.213 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -2.448 -14.988 -14.520 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -3.619 -14.601 -15.765 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -2.222 -12.667 -15.244 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -3.837 -12.353 -14.823 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -2.702 -12.728 -13.617 1.00 2.52 H new ATOM 1032 N GLN A 446 -6.816 -18.963 -10.857 1.00 0.53 N ATOM 1033 CA GLN A 446 -8.071 -19.366 -10.166 1.00 0.56 C ATOM 1034 C GLN A 446 -7.768 -19.795 -8.727 1.00 0.52 C ATOM 1035 O GLN A 446 -8.536 -19.546 -7.819 1.00 0.51 O ATOM 1036 CB GLN A 446 -8.610 -20.537 -10.987 1.00 0.64 C ATOM 1037 CG GLN A 446 -7.654 -21.729 -10.886 1.00 1.11 C ATOM 1038 CD GLN A 446 -8.081 -22.811 -11.881 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -8.673 -22.516 -12.901 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -7.803 -24.060 -11.625 1.00 2.40 N ATOM 0 H GLN A 446 -6.493 -19.605 -11.581 1.00 0.53 H new ATOM 0 HA GLN A 446 -8.793 -18.552 -10.101 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -9.598 -20.821 -10.626 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -8.725 -20.239 -12.029 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -6.633 -21.409 -11.096 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -7.660 -22.129 -9.872 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -7.306 -24.307 -10.769 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -8.082 -24.789 -12.281 1.00 2.40 H new ATOM 1049 N GLU A 447 -6.651 -20.436 -8.512 1.00 0.52 N ATOM 1050 CA GLU A 447 -6.299 -20.875 -7.132 1.00 0.51 C ATOM 1051 C GLU A 447 -6.175 -19.657 -6.215 1.00 0.45 C ATOM 1052 O GLU A 447 -6.564 -19.691 -5.064 1.00 0.45 O ATOM 1053 CB GLU A 447 -4.954 -21.588 -7.270 1.00 0.53 C ATOM 1054 CG GLU A 447 -5.062 -22.998 -6.685 1.00 0.80 C ATOM 1055 CD GLU A 447 -5.857 -23.888 -7.640 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -6.672 -23.355 -8.376 1.00 2.14 O ATOM 1057 OE2 GLU A 447 -5.640 -25.088 -7.620 1.00 1.96 O ATOM 0 H GLU A 447 -5.968 -20.674 -9.231 1.00 0.52 H new ATOM 0 HA GLU A 447 -7.056 -21.527 -6.697 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -4.663 -21.639 -8.319 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -4.177 -21.026 -6.751 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -4.067 -23.414 -6.527 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -5.552 -22.963 -5.712 1.00 0.80 H new ATOM 1064 N ALA A 448 -5.639 -18.577 -6.718 1.00 0.42 N ATOM 1065 CA ALA A 448 -5.496 -17.352 -5.878 1.00 0.39 C ATOM 1066 C ALA A 448 -6.841 -16.993 -5.243 1.00 0.40 C ATOM 1067 O ALA A 448 -6.903 -16.341 -4.219 1.00 0.40 O ATOM 1068 CB ALA A 448 -5.051 -16.257 -6.847 1.00 0.39 C ATOM 0 H ALA A 448 -5.294 -18.490 -7.674 1.00 0.42 H new ATOM 0 HA ALA A 448 -4.784 -17.488 -5.064 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -4.923 -15.321 -6.304 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -4.105 -16.541 -7.308 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -5.807 -16.127 -7.621 1.00 0.39 H new ATOM 1074 N ALA A 449 -7.920 -17.418 -5.842 1.00 0.44 N ATOM 1075 CA ALA A 449 -9.259 -17.106 -5.270 1.00 0.47 C ATOM 1076 C ALA A 449 -9.340 -17.611 -3.829 1.00 0.48 C ATOM 1077 O ALA A 449 -9.275 -16.845 -2.888 1.00 0.49 O ATOM 1078 CB ALA A 449 -10.256 -17.852 -6.162 1.00 0.52 C ATOM 0 H ALA A 449 -7.932 -17.967 -6.702 1.00 0.44 H new ATOM 0 HA ALA A 449 -9.463 -16.035 -5.245 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -11.270 -17.672 -5.804 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -10.164 -17.495 -7.188 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -10.044 -18.921 -6.129 1.00 0.52 H new ATOM 1084 N ARG A 450 -9.476 -18.897 -3.644 1.00 0.49 N ATOM 1085 CA ARG A 450 -9.557 -19.449 -2.261 1.00 0.52 C ATOM 1086 C ARG A 450 -8.376 -18.950 -1.422 1.00 0.49 C ATOM 1087 O ARG A 450 -8.488 -18.758 -0.228 1.00 0.50 O ATOM 1088 CB ARG A 450 -9.487 -20.966 -2.437 1.00 0.56 C ATOM 1089 CG ARG A 450 -10.049 -21.652 -1.192 1.00 0.78 C ATOM 1090 CD ARG A 450 -11.578 -21.610 -1.234 1.00 1.37 C ATOM 1091 NE ARG A 450 -12.017 -22.780 -0.424 1.00 1.77 N ATOM 1092 CZ ARG A 450 -12.927 -22.632 0.498 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -12.576 -22.333 1.720 1.00 2.97 N ATOM 1094 NH2 ARG A 450 -14.188 -22.781 0.200 1.00 2.93 N ATOM 0 H ARG A 450 -9.534 -19.589 -4.391 1.00 0.49 H new ATOM 0 HA ARG A 450 -10.466 -19.140 -1.745 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -10.054 -21.267 -3.318 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -8.455 -21.276 -2.601 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -9.704 -22.685 -1.146 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -9.685 -21.154 -0.293 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -11.959 -20.677 -0.819 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -11.947 -21.677 -2.257 1.00 1.37 H new ATOM 0 HE ARG A 450 -11.605 -23.698 -0.591 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -11.590 -22.215 1.953 1.00 2.97 H new ATOM 0 HH12 ARG A 450 -13.288 -22.217 2.441 1.00 2.97 H new ATOM 0 HH21 ARG A 450 -14.462 -23.013 -0.754 1.00 2.93 H new ATOM 0 HH22 ARG A 450 -14.900 -22.665 0.921 1.00 2.93 H new ATOM 1108 N LEU A 451 -7.246 -18.736 -2.039 1.00 0.47 N ATOM 1109 CA LEU A 451 -6.063 -18.247 -1.276 1.00 0.47 C ATOM 1110 C LEU A 451 -6.363 -16.875 -0.667 1.00 0.44 C ATOM 1111 O LEU A 451 -5.794 -16.492 0.336 1.00 0.48 O ATOM 1112 CB LEU A 451 -4.941 -18.140 -2.310 1.00 0.46 C ATOM 1113 CG LEU A 451 -4.013 -19.349 -2.182 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -3.211 -19.517 -3.474 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -3.053 -19.133 -1.012 1.00 1.04 C ATOM 0 H LEU A 451 -7.091 -18.878 -3.037 1.00 0.47 H new ATOM 0 HA LEU A 451 -5.796 -18.911 -0.454 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.361 -18.095 -3.315 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -4.379 -17.219 -2.158 1.00 0.46 H new ATOM 0 HG LEU A 451 -4.608 -20.245 -2.004 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -2.550 -20.379 -3.382 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -3.894 -19.671 -4.309 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -2.617 -18.621 -3.652 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -2.391 -19.994 -0.920 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -2.459 -18.236 -1.190 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -3.623 -19.014 -0.091 1.00 1.04 H new ATOM 1127 N LEU A 452 -7.256 -16.135 -1.264 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.596 -14.789 -0.719 1.00 0.41 C ATOM 1129 C LEU A 452 -9.076 -14.739 -0.326 1.00 0.46 C ATOM 1130 O LEU A 452 -9.663 -13.681 -0.214 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.317 -13.812 -1.865 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.865 -13.955 -2.327 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.768 -13.597 -3.810 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -4.978 -13.007 -1.516 1.00 0.43 C ATOM 0 H LEU A 452 -7.765 -16.404 -2.106 1.00 0.42 H new ATOM 0 HA LEU A 452 -7.018 -14.548 0.173 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -7.994 -14.010 -2.696 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.505 -12.790 -1.537 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.533 -14.982 -2.177 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.735 -13.698 -4.142 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.402 -14.269 -4.389 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -6.098 -12.569 -3.958 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -3.943 -13.107 -1.844 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.309 -11.980 -1.668 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -5.049 -13.258 -0.458 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.685 -15.876 -0.119 1.00 0.50 N ATOM 1147 CA GLY A 453 -11.125 -15.891 0.261 1.00 0.56 C ATOM 1148 C GLY A 453 -11.959 -15.291 -0.874 1.00 0.58 C ATOM 1149 O GLY A 453 -13.057 -14.814 -0.666 1.00 0.68 O ATOM 0 H GLY A 453 -9.247 -16.794 -0.197 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -11.448 -16.912 0.463 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -11.276 -15.321 1.178 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.444 -15.309 -2.074 1.00 0.54 N ATOM 1154 CA TRP A 454 -12.204 -14.739 -3.223 1.00 0.60 C ATOM 1155 C TRP A 454 -12.747 -15.864 -4.108 1.00 0.68 C ATOM 1156 O TRP A 454 -12.525 -17.032 -3.854 1.00 1.16 O ATOM 1157 CB TRP A 454 -11.182 -13.907 -4.004 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.886 -12.617 -3.294 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -11.287 -12.290 -2.039 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -10.127 -11.476 -3.787 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -10.820 -11.025 -1.730 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -10.100 -10.477 -2.771 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.458 -11.207 -5.010 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -9.432 -9.253 -2.960 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -8.786 -9.975 -5.206 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.773 -9.001 -4.181 1.00 0.52 C ATOM 0 H TRP A 454 -10.529 -15.694 -2.308 1.00 0.54 H new ATOM 0 HA TRP A 454 -13.056 -14.144 -2.894 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -10.262 -14.478 -4.129 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.565 -13.697 -5.003 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.876 -12.917 -1.386 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -10.988 -10.555 -0.841 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.461 -11.947 -5.797 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -9.424 -8.511 -2.175 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -8.282 -9.779 -6.141 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -8.258 -8.064 -4.333 1.00 0.52 H new ATOM 1177 N GLY A 455 -13.445 -15.517 -5.153 1.00 0.72 N ATOM 1178 CA GLY A 455 -13.993 -16.558 -6.067 1.00 0.72 C ATOM 1179 C GLY A 455 -13.447 -16.314 -7.474 1.00 0.70 C ATOM 1180 O GLY A 455 -12.430 -15.675 -7.648 1.00 0.64 O ATOM 0 H GLY A 455 -13.660 -14.555 -5.414 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -13.711 -17.552 -5.720 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -15.082 -16.520 -6.073 1.00 0.72 H new ATOM 1184 N ALA A 456 -14.113 -16.807 -8.480 1.00 0.77 N ATOM 1185 CA ALA A 456 -13.622 -16.585 -9.869 1.00 0.77 C ATOM 1186 C ALA A 456 -14.215 -15.287 -10.420 1.00 0.82 C ATOM 1187 O ALA A 456 -13.585 -14.576 -11.178 1.00 0.83 O ATOM 1188 CB ALA A 456 -14.120 -17.790 -10.668 1.00 0.84 C ATOM 0 H ALA A 456 -14.972 -17.352 -8.402 1.00 0.77 H new ATOM 0 HA ALA A 456 -12.537 -16.493 -9.921 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -13.797 -17.698 -11.705 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -13.710 -18.705 -10.240 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -15.209 -17.827 -10.629 1.00 0.84 H new ATOM 1194 N ALA A 457 -15.421 -14.970 -10.035 1.00 0.90 N ATOM 1195 CA ALA A 457 -16.050 -13.712 -10.526 1.00 0.97 C ATOM 1196 C ALA A 457 -15.338 -12.507 -9.906 1.00 0.89 C ATOM 1197 O ALA A 457 -15.154 -11.486 -10.539 1.00 0.91 O ATOM 1198 CB ALA A 457 -17.502 -13.781 -10.053 1.00 1.08 C ATOM 0 H ALA A 457 -15.997 -15.527 -9.403 1.00 0.90 H new ATOM 0 HA ALA A 457 -15.985 -13.606 -11.609 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -18.033 -12.886 -10.377 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -17.982 -14.662 -10.479 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -17.528 -13.844 -8.965 1.00 1.08 H new ATOM 1204 N THR A 458 -14.930 -12.626 -8.673 1.00 0.84 N ATOM 1205 CA THR A 458 -14.220 -11.497 -8.007 1.00 0.77 C ATOM 1206 C THR A 458 -12.807 -11.366 -8.579 1.00 0.68 C ATOM 1207 O THR A 458 -12.415 -10.325 -9.063 1.00 0.67 O ATOM 1208 CB THR A 458 -14.170 -11.878 -6.526 1.00 0.76 C ATOM 1209 OG1 THR A 458 -15.494 -12.044 -6.038 1.00 0.85 O ATOM 1210 CG2 THR A 458 -13.466 -10.776 -5.734 1.00 0.72 C ATOM 0 H THR A 458 -15.058 -13.458 -8.096 1.00 0.84 H new ATOM 0 HA THR A 458 -14.719 -10.540 -8.160 1.00 0.77 H new ATOM 0 HB THR A 458 -13.619 -12.811 -6.410 1.00 0.76 H new ATOM 0 HG1 THR A 458 -15.465 -12.290 -5.090 1.00 0.85 H new ATOM 0 HG21 THR A 458 -13.432 -11.051 -4.680 1.00 0.72 H new ATOM 0 HG22 THR A 458 -12.450 -10.651 -6.109 1.00 0.72 H new ATOM 0 HG23 THR A 458 -14.013 -9.840 -5.848 1.00 0.72 H new ATOM 1218 N LEU A 459 -12.041 -12.423 -8.532 1.00 0.64 N ATOM 1219 CA LEU A 459 -10.654 -12.367 -9.077 1.00 0.57 C ATOM 1220 C LEU A 459 -10.676 -11.839 -10.514 1.00 0.60 C ATOM 1221 O LEU A 459 -9.726 -11.243 -10.982 1.00 0.58 O ATOM 1222 CB LEU A 459 -10.159 -13.814 -9.042 1.00 0.56 C ATOM 1223 CG LEU A 459 -8.902 -13.900 -8.176 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -8.832 -15.274 -7.512 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -7.663 -13.699 -9.048 1.00 0.46 C ATOM 0 H LEU A 459 -12.316 -13.323 -8.139 1.00 0.64 H new ATOM 0 HA LEU A 459 -10.008 -11.702 -8.504 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -10.935 -14.466 -8.641 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -9.942 -14.160 -10.053 1.00 0.56 H new ATOM 0 HG LEU A 459 -8.939 -13.125 -7.411 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -7.936 -15.335 -6.895 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -9.713 -15.422 -6.888 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -8.797 -16.048 -8.279 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -6.768 -13.761 -8.429 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -7.628 -14.473 -9.814 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -7.708 -12.719 -9.524 1.00 0.46 H new ATOM 1237 N THR A 460 -11.756 -12.049 -11.216 1.00 0.68 N ATOM 1238 CA THR A 460 -11.842 -11.556 -12.620 1.00 0.74 C ATOM 1239 C THR A 460 -12.424 -10.139 -12.646 1.00 0.76 C ATOM 1240 O THR A 460 -11.876 -9.243 -13.254 1.00 0.75 O ATOM 1241 CB THR A 460 -12.781 -12.534 -13.328 1.00 0.83 C ATOM 1242 OG1 THR A 460 -12.256 -13.849 -13.225 1.00 0.82 O ATOM 1243 CG2 THR A 460 -12.910 -12.146 -14.801 1.00 0.92 C ATOM 0 H THR A 460 -12.583 -12.541 -10.878 1.00 0.68 H new ATOM 0 HA THR A 460 -10.866 -11.509 -13.102 1.00 0.74 H new ATOM 0 HB THR A 460 -13.765 -12.498 -12.860 1.00 0.83 H new ATOM 0 HG1 THR A 460 -12.872 -14.407 -12.705 1.00 0.82 H new ATOM 0 HG21 THR A 460 -13.579 -12.844 -15.304 1.00 0.92 H new ATOM 0 HG22 THR A 460 -13.314 -11.137 -14.877 1.00 0.92 H new ATOM 0 HG23 THR A 460 -11.928 -12.180 -15.274 1.00 0.92 H new ATOM 1251 N ALA A 461 -13.534 -9.932 -11.989 1.00 0.81 N ATOM 1252 CA ALA A 461 -14.152 -8.576 -11.976 1.00 0.85 C ATOM 1253 C ALA A 461 -13.220 -7.576 -11.285 1.00 0.79 C ATOM 1254 O ALA A 461 -13.191 -6.408 -11.619 1.00 0.83 O ATOM 1255 CB ALA A 461 -15.449 -8.739 -11.183 1.00 0.92 C ATOM 0 H ALA A 461 -14.039 -10.644 -11.461 1.00 0.81 H new ATOM 0 HA ALA A 461 -14.335 -8.196 -12.981 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -15.965 -7.780 -11.128 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -16.090 -9.468 -11.679 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -15.218 -9.085 -10.175 1.00 0.92 H new ATOM 1261 N LYS A 462 -12.459 -8.024 -10.325 1.00 0.72 N ATOM 1262 CA LYS A 462 -11.530 -7.098 -9.616 1.00 0.68 C ATOM 1263 C LYS A 462 -10.326 -6.778 -10.505 1.00 0.66 C ATOM 1264 O LYS A 462 -9.666 -5.771 -10.335 1.00 0.67 O ATOM 1265 CB LYS A 462 -11.089 -7.860 -8.365 1.00 0.66 C ATOM 1266 CG LYS A 462 -10.698 -6.863 -7.272 1.00 0.99 C ATOM 1267 CD LYS A 462 -11.618 -7.046 -6.064 1.00 0.91 C ATOM 1268 CE LYS A 462 -11.094 -6.214 -4.891 1.00 1.31 C ATOM 1269 NZ LYS A 462 -12.084 -5.112 -4.730 1.00 1.39 N ATOM 0 H LYS A 462 -12.440 -8.991 -10.000 1.00 0.72 H new ATOM 0 HA LYS A 462 -12.002 -6.148 -9.367 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -11.896 -8.503 -8.014 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -10.245 -8.508 -8.600 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -9.660 -7.017 -6.979 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -10.775 -5.844 -7.650 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -12.633 -6.739 -6.317 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -11.664 -8.099 -5.785 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -11.019 -6.813 -3.984 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -10.098 -5.823 -5.098 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -11.794 -4.497 -3.943 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -12.129 -4.555 -5.607 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -13.021 -5.514 -4.527 1.00 1.39 H new ATOM 1283 N LEU A 463 -10.037 -7.625 -11.454 1.00 0.65 N ATOM 1284 CA LEU A 463 -8.877 -7.369 -12.356 1.00 0.65 C ATOM 1285 C LEU A 463 -9.108 -6.086 -13.160 1.00 0.68 C ATOM 1286 O LEU A 463 -8.259 -5.219 -13.221 1.00 0.70 O ATOM 1287 CB LEU A 463 -8.822 -8.582 -13.284 1.00 0.68 C ATOM 1288 CG LEU A 463 -7.542 -8.528 -14.120 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -6.649 -9.719 -13.765 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -7.900 -8.586 -15.607 1.00 0.99 C ATOM 0 H LEU A 463 -10.554 -8.484 -11.645 1.00 0.65 H new ATOM 0 HA LEU A 463 -7.946 -7.236 -11.806 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -8.849 -9.502 -12.700 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -9.695 -8.594 -13.937 1.00 0.68 H new ATOM 0 HG LEU A 463 -7.011 -7.600 -13.910 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -5.737 -9.680 -14.361 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -6.393 -9.679 -12.706 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -7.180 -10.647 -13.975 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -6.988 -8.547 -16.203 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -8.432 -9.514 -15.817 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -8.536 -7.738 -15.862 1.00 0.99 H new ATOM 1302 N LYS A 464 -10.251 -5.960 -13.778 1.00 0.72 N ATOM 1303 CA LYS A 464 -10.536 -4.734 -14.578 1.00 0.77 C ATOM 1304 C LYS A 464 -11.092 -3.631 -13.674 1.00 0.76 C ATOM 1305 O LYS A 464 -10.808 -2.464 -13.857 1.00 0.82 O ATOM 1306 CB LYS A 464 -11.586 -5.167 -15.602 1.00 0.85 C ATOM 1307 CG LYS A 464 -11.203 -4.631 -16.984 1.00 1.20 C ATOM 1308 CD LYS A 464 -10.682 -5.778 -17.852 1.00 1.62 C ATOM 1309 CE LYS A 464 -10.270 -5.235 -19.222 1.00 2.25 C ATOM 1310 NZ LYS A 464 -11.029 -6.056 -20.205 1.00 2.66 N ATOM 0 H LYS A 464 -11.000 -6.653 -13.764 1.00 0.72 H new ATOM 0 HA LYS A 464 -9.641 -4.333 -15.055 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -11.657 -6.254 -15.629 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -12.568 -4.791 -15.314 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -12.068 -4.167 -17.458 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -10.440 -3.859 -16.887 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -9.831 -6.257 -17.368 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -11.453 -6.540 -17.968 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -10.516 -4.177 -19.318 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -9.195 -5.328 -19.377 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -10.799 -5.743 -21.170 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -10.770 -7.057 -20.095 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -12.049 -5.942 -20.038 1.00 2.66 H new ATOM 1324 N GLU A 465 -11.883 -3.990 -12.700 1.00 0.73 N ATOM 1325 CA GLU A 465 -12.458 -2.961 -11.786 1.00 0.76 C ATOM 1326 C GLU A 465 -11.341 -2.095 -11.195 1.00 0.69 C ATOM 1327 O GLU A 465 -11.322 -0.892 -11.363 1.00 0.85 O ATOM 1328 CB GLU A 465 -13.158 -3.757 -10.684 1.00 0.79 C ATOM 1329 CG GLU A 465 -13.798 -2.790 -9.685 1.00 1.12 C ATOM 1330 CD GLU A 465 -15.266 -3.167 -9.477 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -15.576 -4.342 -9.589 1.00 2.03 O ATOM 1332 OE2 GLU A 465 -16.054 -2.275 -9.210 1.00 1.95 O ATOM 0 H GLU A 465 -12.156 -4.952 -12.497 1.00 0.73 H new ATOM 0 HA GLU A 465 -13.143 -2.288 -12.301 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -13.919 -4.406 -11.117 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -12.441 -4.401 -10.175 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -13.264 -2.826 -8.735 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -13.723 -1.767 -10.054 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.411 -2.697 -10.507 1.00 0.56 N ATOM 1340 CA LEU A 466 -9.298 -1.908 -9.907 1.00 0.59 C ATOM 1341 C LEU A 466 -8.492 -1.210 -11.006 1.00 0.70 C ATOM 1342 O LEU A 466 -7.948 -0.142 -10.808 1.00 0.81 O ATOM 1343 CB LEU A 466 -8.432 -2.936 -9.178 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.994 -3.177 -7.777 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -8.433 -4.486 -7.219 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -8.589 -2.018 -6.863 1.00 0.52 C ATOM 0 H LEU A 466 -10.373 -3.702 -10.334 1.00 0.56 H new ATOM 0 HA LEU A 466 -9.659 -1.129 -9.235 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -8.410 -3.871 -9.738 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -7.404 -2.580 -9.112 1.00 0.56 H new ATOM 0 HG LEU A 466 -10.081 -3.241 -7.826 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -8.834 -4.657 -6.220 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -8.718 -5.311 -7.871 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -7.346 -4.423 -7.168 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -8.988 -2.187 -5.863 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -7.502 -1.956 -6.814 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -8.988 -1.085 -7.260 1.00 0.52 H new ATOM 1358 N GLY A 467 -8.411 -1.805 -12.165 1.00 0.77 N ATOM 1359 CA GLY A 467 -7.641 -1.175 -13.274 1.00 0.97 C ATOM 1360 C GLY A 467 -8.459 -0.035 -13.883 1.00 1.08 C ATOM 1361 O GLY A 467 -7.921 0.887 -14.465 1.00 1.38 O ATOM 0 H GLY A 467 -8.845 -2.700 -12.391 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -6.690 -0.795 -12.900 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -7.409 -1.918 -14.037 1.00 0.97 H new ATOM 1723 N TRP B 402 6.124 -1.405 4.414 1.00 0.95 N ATOM 1724 CA TRP B 402 4.795 -2.063 4.252 1.00 0.86 C ATOM 1725 C TRP B 402 4.837 -3.152 3.179 1.00 0.79 C ATOM 1726 O TRP B 402 4.737 -4.321 3.478 1.00 0.71 O ATOM 1727 CB TRP B 402 3.852 -0.940 3.827 1.00 0.96 C ATOM 1728 CG TRP B 402 2.603 -1.020 4.637 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.456 -0.510 5.879 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.334 -1.641 4.290 1.00 0.76 C ATOM 1731 NE1 TRP B 402 1.170 -0.775 6.324 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.437 -1.471 5.383 1.00 0.83 C ATOM 1733 CE3 TRP B 402 0.872 -2.333 3.140 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -0.878 -1.971 5.337 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 -0.451 -2.837 3.091 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -1.323 -2.656 4.187 1.00 0.69 C ATOM 0 HA TRP B 402 4.477 -2.554 5.172 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.332 0.028 3.970 1.00 0.96 H new ATOM 0 HB3 TRP B 402 3.618 -1.026 2.766 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.216 0.018 6.435 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.809 -0.491 7.235 1.00 1.00 H new ATOM 0 HE3 TRP B 402 1.533 -2.476 2.298 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.542 -1.831 6.177 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.794 -3.362 2.212 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -2.331 -3.042 4.145 1.00 0.69 H new ATOM 1747 N ALA B 403 4.973 -2.780 1.933 1.00 0.85 N ATOM 1748 CA ALA B 403 5.008 -3.804 0.841 1.00 0.85 C ATOM 1749 C ALA B 403 5.956 -4.950 1.204 1.00 0.80 C ATOM 1750 O ALA B 403 5.613 -6.109 1.082 1.00 0.76 O ATOM 1751 CB ALA B 403 5.519 -3.054 -0.390 1.00 0.99 C ATOM 0 H ALA B 403 5.061 -1.813 1.622 1.00 0.85 H new ATOM 0 HA ALA B 403 4.029 -4.252 0.671 1.00 0.85 H new ATOM 0 HB1 ALA B 403 5.573 -3.738 -1.237 1.00 0.99 H new ATOM 0 HB2 ALA B 403 4.838 -2.237 -0.627 1.00 0.99 H new ATOM 0 HB3 ALA B 403 6.511 -2.651 -0.185 1.00 0.99 H new ATOM 1757 N THR B 404 7.138 -4.644 1.661 1.00 0.82 N ATOM 1758 CA THR B 404 8.083 -5.730 2.040 1.00 0.81 C ATOM 1759 C THR B 404 7.444 -6.599 3.127 1.00 0.70 C ATOM 1760 O THR B 404 7.614 -7.803 3.158 1.00 0.69 O ATOM 1761 CB THR B 404 9.325 -5.016 2.575 1.00 0.89 C ATOM 1762 OG1 THR B 404 9.751 -4.042 1.631 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.445 -6.032 2.803 1.00 0.89 C ATOM 0 H THR B 404 7.489 -3.695 1.788 1.00 0.82 H new ATOM 0 HA THR B 404 8.332 -6.383 1.204 1.00 0.81 H new ATOM 0 HB THR B 404 9.085 -4.528 3.520 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.546 -3.582 1.972 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.329 -5.520 3.184 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.117 -6.778 3.527 1.00 0.89 H new ATOM 0 HG23 THR B 404 10.688 -6.523 1.861 1.00 0.89 H new ATOM 1771 N LEU B 405 6.701 -5.993 4.013 1.00 0.67 N ATOM 1772 CA LEU B 405 6.036 -6.773 5.093 1.00 0.61 C ATOM 1773 C LEU B 405 4.836 -7.529 4.517 1.00 0.53 C ATOM 1774 O LEU B 405 4.467 -8.585 4.988 1.00 0.52 O ATOM 1775 CB LEU B 405 5.582 -5.717 6.113 1.00 0.67 C ATOM 1776 CG LEU B 405 4.962 -6.376 7.358 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.554 -6.879 7.031 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.829 -7.551 7.831 1.00 0.64 C ATOM 0 H LEU B 405 6.526 -4.988 4.034 1.00 0.67 H new ATOM 0 HA LEU B 405 6.692 -7.516 5.547 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.433 -5.104 6.409 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.854 -5.050 5.651 1.00 0.67 H new ATOM 0 HG LEU B 405 4.909 -5.634 8.154 1.00 0.64 H new ATOM 0 HD11 LEU B 405 3.119 -7.345 7.916 1.00 0.57 H new ATOM 0 HD12 LEU B 405 2.931 -6.040 6.719 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.607 -7.611 6.225 1.00 0.57 H new ATOM 0 HD21 LEU B 405 5.376 -8.006 8.712 1.00 0.64 H new ATOM 0 HD22 LEU B 405 5.901 -8.293 7.036 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.826 -7.190 8.081 1.00 0.64 H new ATOM 1790 N LEU B 406 4.226 -6.989 3.499 1.00 0.53 N ATOM 1791 CA LEU B 406 3.051 -7.662 2.885 1.00 0.50 C ATOM 1792 C LEU B 406 3.517 -8.823 2.002 1.00 0.49 C ATOM 1793 O LEU B 406 2.856 -9.836 1.894 1.00 0.45 O ATOM 1794 CB LEU B 406 2.370 -6.575 2.048 1.00 0.57 C ATOM 1795 CG LEU B 406 0.859 -6.819 2.019 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.302 -6.779 3.444 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.182 -5.731 1.187 1.00 1.02 C ATOM 0 H LEU B 406 4.493 -6.106 3.065 1.00 0.53 H new ATOM 0 HA LEU B 406 2.372 -8.084 3.626 1.00 0.50 H new ATOM 0 HB2 LEU B 406 2.582 -5.592 2.469 1.00 0.57 H new ATOM 0 HB3 LEU B 406 2.769 -6.580 1.034 1.00 0.57 H new ATOM 0 HG LEU B 406 0.663 -7.796 1.578 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.774 -6.953 3.419 1.00 0.94 H new ATOM 0 HD12 LEU B 406 0.781 -7.553 4.044 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.501 -5.802 3.885 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.894 -5.905 1.167 1.00 1.02 H new ATOM 0 HD22 LEU B 406 0.383 -4.756 1.630 1.00 1.02 H new ATOM 0 HD23 LEU B 406 0.573 -5.755 0.170 1.00 1.02 H new ATOM 1809 N ALA B 407 4.656 -8.687 1.380 1.00 0.56 N ATOM 1810 CA ALA B 407 5.166 -9.789 0.517 1.00 0.59 C ATOM 1811 C ALA B 407 5.601 -10.965 1.394 1.00 0.57 C ATOM 1812 O ALA B 407 5.349 -12.113 1.085 1.00 0.61 O ATOM 1813 CB ALA B 407 6.363 -9.196 -0.223 1.00 0.70 C ATOM 0 H ALA B 407 5.254 -7.862 1.432 1.00 0.56 H new ATOM 0 HA ALA B 407 4.412 -10.162 -0.176 1.00 0.59 H new ATOM 0 HB1 ALA B 407 6.794 -9.950 -0.881 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.037 -8.341 -0.816 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.113 -8.873 0.499 1.00 0.70 H new ATOM 1819 N GLN B 408 6.248 -10.683 2.493 1.00 0.57 N ATOM 1820 CA GLN B 408 6.695 -11.778 3.398 1.00 0.57 C ATOM 1821 C GLN B 408 5.520 -12.269 4.247 1.00 0.50 C ATOM 1822 O GLN B 408 5.373 -13.448 4.498 1.00 0.50 O ATOM 1823 CB GLN B 408 7.770 -11.147 4.281 1.00 0.62 C ATOM 1824 CG GLN B 408 9.050 -10.952 3.466 1.00 0.75 C ATOM 1825 CD GLN B 408 10.224 -10.692 4.412 1.00 0.78 C ATOM 1826 OE1 GLN B 408 10.815 -11.616 4.933 1.00 1.29 O ATOM 1827 NE2 GLN B 408 10.587 -9.463 4.657 1.00 1.46 N ATOM 0 H GLN B 408 6.486 -9.741 2.802 1.00 0.57 H new ATOM 0 HA GLN B 408 7.075 -12.641 2.851 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.422 -10.189 4.667 1.00 0.62 H new ATOM 0 HB3 GLN B 408 7.968 -11.785 5.143 1.00 0.62 H new ATOM 0 HG2 GLN B 408 9.246 -11.837 2.861 1.00 0.75 H new ATOM 0 HG3 GLN B 408 8.932 -10.115 2.778 1.00 0.75 H new ATOM 0 HE21 GLN B 408 10.090 -8.687 4.219 1.00 1.46 H new ATOM 0 HE22 GLN B 408 11.368 -9.278 5.287 1.00 1.46 H new ATOM 1836 N TRP B 409 4.679 -11.372 4.688 1.00 0.46 N ATOM 1837 CA TRP B 409 3.512 -11.790 5.515 1.00 0.43 C ATOM 1838 C TRP B 409 2.598 -12.708 4.693 1.00 0.40 C ATOM 1839 O TRP B 409 2.338 -13.835 5.065 1.00 0.41 O ATOM 1840 CB TRP B 409 2.801 -10.478 5.879 1.00 0.43 C ATOM 1841 CG TRP B 409 1.444 -10.765 6.447 1.00 0.42 C ATOM 1842 CD1 TRP B 409 1.208 -11.312 7.663 1.00 0.50 C ATOM 1843 CD2 TRP B 409 0.142 -10.532 5.840 1.00 0.40 C ATOM 1844 NE1 TRP B 409 -0.161 -11.431 7.844 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -0.864 -10.964 6.752 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.267 -9.990 4.594 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -2.232 -10.863 6.439 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.642 -9.885 4.274 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.624 -10.322 5.195 1.00 0.48 C ATOM 0 H TRP B 409 4.750 -10.370 4.511 1.00 0.46 H new ATOM 0 HA TRP B 409 3.799 -12.349 6.405 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.396 -9.922 6.603 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.707 -9.849 4.994 1.00 0.43 H new ATOM 0 HD1 TRP B 409 1.964 -11.607 8.376 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -0.596 -11.817 8.682 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.476 -9.655 3.885 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -2.977 -11.197 7.146 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -1.943 -9.470 3.323 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.672 -10.242 4.947 1.00 0.48 H new ATOM 1860 N ALA B 410 2.110 -12.232 3.579 1.00 0.42 N ATOM 1861 CA ALA B 410 1.215 -13.075 2.735 1.00 0.44 C ATOM 1862 C ALA B 410 1.859 -14.442 2.481 1.00 0.45 C ATOM 1863 O ALA B 410 1.184 -15.440 2.325 1.00 0.47 O ATOM 1864 CB ALA B 410 1.059 -12.298 1.428 1.00 0.51 C ATOM 0 H ALA B 410 2.292 -11.296 3.217 1.00 0.42 H new ATOM 0 HA ALA B 410 0.253 -13.265 3.211 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.412 -12.854 0.749 1.00 0.51 H new ATOM 0 HB2 ALA B 410 0.617 -11.323 1.635 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.037 -12.162 0.966 1.00 0.51 H new ATOM 1870 N ASP B 411 3.162 -14.493 2.449 1.00 0.48 N ATOM 1871 CA ASP B 411 3.854 -15.792 2.215 1.00 0.53 C ATOM 1872 C ASP B 411 3.879 -16.610 3.510 1.00 0.53 C ATOM 1873 O ASP B 411 3.604 -17.793 3.515 1.00 0.58 O ATOM 1874 CB ASP B 411 5.275 -15.414 1.793 1.00 0.60 C ATOM 1875 CG ASP B 411 5.453 -15.687 0.298 1.00 1.03 C ATOM 1876 OD1 ASP B 411 4.886 -16.656 -0.179 1.00 1.51 O ATOM 1877 OD2 ASP B 411 6.153 -14.921 -0.343 1.00 1.78 O ATOM 0 H ASP B 411 3.778 -13.690 2.575 1.00 0.48 H new ATOM 0 HA ASP B 411 3.354 -16.399 1.460 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.461 -14.361 2.006 1.00 0.60 H new ATOM 0 HB3 ASP B 411 6.001 -15.989 2.368 1.00 0.60 H new ATOM 1882 N ARG B 412 4.205 -15.985 4.609 1.00 0.52 N ATOM 1883 CA ARG B 412 4.245 -16.722 5.903 1.00 0.56 C ATOM 1884 C ARG B 412 2.850 -17.239 6.256 1.00 0.55 C ATOM 1885 O ARG B 412 2.689 -18.339 6.746 1.00 0.63 O ATOM 1886 CB ARG B 412 4.711 -15.692 6.932 1.00 0.58 C ATOM 1887 CG ARG B 412 5.485 -16.399 8.046 1.00 0.96 C ATOM 1888 CD ARG B 412 5.703 -15.429 9.210 1.00 1.50 C ATOM 1889 NE ARG B 412 6.753 -16.068 10.050 1.00 1.90 N ATOM 1890 CZ ARG B 412 6.438 -17.041 10.861 1.00 2.41 C ATOM 1891 NH1 ARG B 412 5.962 -16.773 12.046 1.00 2.89 N ATOM 1892 NH2 ARG B 412 6.599 -18.280 10.487 1.00 3.02 N ATOM 0 H ARG B 412 4.445 -14.995 4.666 1.00 0.52 H new ATOM 0 HA ARG B 412 4.906 -17.588 5.866 1.00 0.56 H new ATOM 0 HB2 ARG B 412 5.343 -14.944 6.453 1.00 0.58 H new ATOM 0 HB3 ARG B 412 3.853 -15.165 7.349 1.00 0.58 H new ATOM 0 HG2 ARG B 412 4.934 -17.275 8.387 1.00 0.96 H new ATOM 0 HG3 ARG B 412 6.444 -16.753 7.669 1.00 0.96 H new ATOM 0 HD2 ARG B 412 6.024 -14.450 8.854 1.00 1.50 H new ATOM 0 HD3 ARG B 412 4.783 -15.277 9.775 1.00 1.50 H new ATOM 0 HE ARG B 412 7.719 -15.745 9.992 1.00 1.90 H new ATOM 0 HH11 ARG B 412 5.836 -15.804 12.338 1.00 2.89 H new ATOM 0 HH12 ARG B 412 5.716 -17.533 12.680 1.00 2.89 H new ATOM 0 HH21 ARG B 412 6.971 -18.489 9.561 1.00 3.02 H new ATOM 0 HH22 ARG B 412 6.353 -19.040 11.121 1.00 3.02 H new ATOM 1906 N ALA B 413 1.841 -16.455 6.004 1.00 0.50 N ATOM 1907 CA ALA B 413 0.455 -16.902 6.318 1.00 0.53 C ATOM 1908 C ALA B 413 0.040 -18.019 5.359 1.00 0.57 C ATOM 1909 O ALA B 413 -0.644 -18.952 5.733 1.00 0.66 O ATOM 1910 CB ALA B 413 -0.418 -15.664 6.112 1.00 0.53 C ATOM 0 H ALA B 413 1.915 -15.524 5.594 1.00 0.50 H new ATOM 0 HA ALA B 413 0.363 -17.297 7.330 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -1.458 -15.913 6.324 1.00 0.53 H new ATOM 0 HB2 ALA B 413 -0.090 -14.871 6.784 1.00 0.53 H new ATOM 0 HB3 ALA B 413 -0.330 -15.324 5.080 1.00 0.53 H new ATOM 1916 N LEU B 414 0.452 -17.932 4.124 1.00 0.54 N ATOM 1917 CA LEU B 414 0.088 -18.990 3.139 1.00 0.62 C ATOM 1918 C LEU B 414 0.584 -20.353 3.625 1.00 0.71 C ATOM 1919 O LEU B 414 -0.114 -21.345 3.545 1.00 0.82 O ATOM 1920 CB LEU B 414 0.803 -18.590 1.847 1.00 0.63 C ATOM 1921 CG LEU B 414 -0.203 -18.557 0.694 1.00 0.71 C ATOM 1922 CD1 LEU B 414 -1.147 -17.367 0.873 1.00 1.11 C ATOM 1923 CD2 LEU B 414 0.549 -18.415 -0.632 1.00 1.03 C ATOM 0 H LEU B 414 1.025 -17.174 3.754 1.00 0.54 H new ATOM 0 HA LEU B 414 -0.990 -19.073 3.000 1.00 0.62 H new ATOM 0 HB2 LEU B 414 1.269 -17.612 1.965 1.00 0.63 H new ATOM 0 HB3 LEU B 414 1.601 -19.299 1.627 1.00 0.63 H new ATOM 0 HG LEU B 414 -0.781 -19.481 0.689 1.00 0.71 H new ATOM 0 HD11 LEU B 414 -1.863 -17.344 0.052 1.00 1.11 H new ATOM 0 HD12 LEU B 414 -1.681 -17.465 1.818 1.00 1.11 H new ATOM 0 HD13 LEU B 414 -0.570 -16.442 0.877 1.00 1.11 H new ATOM 0 HD21 LEU B 414 -0.166 -18.391 -1.455 1.00 1.03 H new ATOM 0 HD22 LEU B 414 1.126 -17.490 -0.626 1.00 1.03 H new ATOM 0 HD23 LEU B 414 1.223 -19.262 -0.761 1.00 1.03 H new ATOM 1935 N ARG B 415 1.787 -20.410 4.128 1.00 0.73 N ATOM 1936 CA ARG B 415 2.332 -21.708 4.617 1.00 0.87 C ATOM 1937 C ARG B 415 1.875 -21.971 6.056 1.00 0.93 C ATOM 1938 O ARG B 415 2.678 -22.204 6.938 1.00 1.26 O ATOM 1939 CB ARG B 415 3.851 -21.546 4.561 1.00 1.02 C ATOM 1940 CG ARG B 415 4.385 -22.158 3.265 1.00 1.40 C ATOM 1941 CD ARG B 415 5.885 -21.875 3.147 1.00 1.61 C ATOM 1942 NE ARG B 415 6.259 -22.348 1.786 1.00 2.27 N ATOM 1943 CZ ARG B 415 7.247 -23.188 1.636 1.00 2.92 C ATOM 1944 NH1 ARG B 415 7.026 -24.473 1.688 1.00 3.32 N ATOM 1945 NH2 ARG B 415 8.457 -22.742 1.434 1.00 3.70 N ATOM 0 H ARG B 415 2.416 -19.613 4.221 1.00 0.73 H new ATOM 0 HA ARG B 415 1.987 -22.550 4.017 1.00 0.87 H new ATOM 0 HB2 ARG B 415 4.116 -20.490 4.613 1.00 1.02 H new ATOM 0 HB3 ARG B 415 4.311 -22.033 5.421 1.00 1.02 H new ATOM 0 HG2 ARG B 415 4.205 -23.233 3.257 1.00 1.40 H new ATOM 0 HG3 ARG B 415 3.857 -21.740 2.408 1.00 1.40 H new ATOM 0 HD2 ARG B 415 6.097 -20.813 3.268 1.00 1.61 H new ATOM 0 HD3 ARG B 415 6.448 -22.402 3.917 1.00 1.61 H new ATOM 0 HE ARG B 415 5.743 -22.016 0.971 1.00 2.27 H new ATOM 0 HH11 ARG B 415 6.081 -24.822 1.846 1.00 3.32 H new ATOM 0 HH12 ARG B 415 7.799 -25.129 1.571 1.00 3.32 H new ATOM 0 HH21 ARG B 415 8.630 -21.738 1.393 1.00 3.70 H new ATOM 0 HH22 ARG B 415 9.229 -23.398 1.317 1.00 3.70 H new ATOM 1959 N SER B 416 0.593 -21.939 6.302 1.00 0.90 N ATOM 1960 CA SER B 416 0.096 -22.191 7.686 1.00 0.99 C ATOM 1961 C SER B 416 -1.434 -22.252 7.700 1.00 0.99 C ATOM 1962 O SER B 416 -2.023 -23.316 7.678 1.00 1.63 O ATOM 1963 CB SER B 416 0.594 -21.001 8.507 1.00 1.20 C ATOM 1964 OG SER B 416 1.834 -21.338 9.116 1.00 1.70 O ATOM 0 H SER B 416 -0.130 -21.750 5.607 1.00 0.90 H new ATOM 0 HA SER B 416 0.452 -23.141 8.085 1.00 0.99 H new ATOM 0 HB2 SER B 416 0.716 -20.128 7.866 1.00 1.20 H new ATOM 0 HB3 SER B 416 -0.139 -20.738 9.269 1.00 1.20 H new ATOM 0 HG SER B 416 2.399 -21.809 8.469 1.00 1.70 H new ATOM 1970 N GLY B 417 -2.086 -21.122 7.737 1.00 1.06 N ATOM 1971 CA GLY B 417 -3.576 -21.120 7.753 1.00 1.06 C ATOM 1972 C GLY B 417 -4.090 -19.765 7.266 1.00 0.99 C ATOM 1973 O GLY B 417 -4.960 -19.168 7.867 1.00 1.31 O ATOM 0 H GLY B 417 -1.651 -20.200 7.757 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -3.958 -21.917 7.115 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -3.940 -21.318 8.761 1.00 1.06 H new ATOM 1977 N HIS B 418 -3.557 -19.274 6.181 1.00 0.78 N ATOM 1978 CA HIS B 418 -4.013 -17.956 5.656 1.00 0.88 C ATOM 1979 C HIS B 418 -5.530 -17.962 5.442 1.00 0.89 C ATOM 1980 O HIS B 418 -6.135 -18.998 5.248 1.00 1.17 O ATOM 1981 CB HIS B 418 -3.289 -17.797 4.321 1.00 1.01 C ATOM 1982 CG HIS B 418 -3.643 -18.948 3.420 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -2.922 -20.132 3.414 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -4.643 -19.114 2.493 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -3.492 -20.950 2.511 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -4.545 -20.379 1.921 1.00 2.97 N ATOM 0 H HIS B 418 -2.825 -19.729 5.635 1.00 0.78 H new ATOM 0 HA HIS B 418 -3.794 -17.140 6.345 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -3.571 -16.854 3.852 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -2.211 -17.764 4.481 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -5.391 -18.375 2.246 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -3.141 -21.947 2.290 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -5.148 -20.783 1.205 1.00 2.97 H new ATOM 1994 N GLN B 419 -6.145 -16.813 5.474 1.00 1.08 N ATOM 1995 CA GLN B 419 -7.618 -16.747 5.270 1.00 1.24 C ATOM 1996 C GLN B 419 -8.018 -15.354 4.775 1.00 1.03 C ATOM 1997 O GLN B 419 -8.311 -15.158 3.613 1.00 1.28 O ATOM 1998 CB GLN B 419 -8.221 -17.026 6.646 1.00 1.71 C ATOM 1999 CG GLN B 419 -8.957 -18.367 6.618 1.00 2.32 C ATOM 2000 CD GLN B 419 -9.847 -18.491 7.856 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -10.328 -17.503 8.374 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -10.087 -19.672 8.356 1.00 3.52 N ATOM 0 H GLN B 419 -5.689 -15.914 5.633 1.00 1.08 H new ATOM 0 HA GLN B 419 -7.967 -17.460 4.523 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -7.436 -17.046 7.402 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -8.909 -16.227 6.922 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -9.562 -18.442 5.714 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -8.239 -19.187 6.590 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -9.683 -20.502 7.921 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -10.678 -19.766 9.182 1.00 3.52 H new ATOM 2011 N ASN B 420 -8.028 -14.385 5.650 1.00 0.78 N ATOM 2012 CA ASN B 420 -8.405 -13.005 5.231 1.00 0.70 C ATOM 2013 C ASN B 420 -7.161 -12.228 4.790 1.00 0.58 C ATOM 2014 O ASN B 420 -6.863 -11.169 5.306 1.00 0.70 O ATOM 2015 CB ASN B 420 -9.020 -12.370 6.479 1.00 0.86 C ATOM 2016 CG ASN B 420 -10.336 -13.074 6.813 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -10.422 -14.284 6.755 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -11.372 -12.361 7.163 1.00 1.87 N ATOM 0 H ASN B 420 -7.791 -14.490 6.637 1.00 0.78 H new ATOM 0 HA ASN B 420 -9.096 -13.002 4.388 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -8.329 -12.449 7.319 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -9.196 -11.308 6.310 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -12.255 -12.820 7.388 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -11.299 -11.345 7.211 1.00 1.87 H new ATOM 2025 N LEU B 421 -6.431 -12.746 3.839 1.00 0.45 N ATOM 2026 CA LEU B 421 -5.204 -12.039 3.368 1.00 0.40 C ATOM 2027 C LEU B 421 -5.558 -10.646 2.834 1.00 0.39 C ATOM 2028 O LEU B 421 -5.423 -9.654 3.522 1.00 0.53 O ATOM 2029 CB LEU B 421 -4.649 -12.916 2.246 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.628 -13.900 2.819 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.723 -15.229 2.067 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -2.219 -13.324 2.657 1.00 0.41 C ATOM 0 H LEU B 421 -6.631 -13.628 3.368 1.00 0.45 H new ATOM 0 HA LEU B 421 -4.481 -11.893 4.171 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -5.460 -13.459 1.761 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -4.181 -12.294 1.483 1.00 0.42 H new ATOM 0 HG LEU B 421 -3.836 -14.064 3.876 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -2.995 -15.931 2.475 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.726 -15.640 2.180 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.515 -15.064 1.010 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -1.490 -14.025 3.065 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -2.012 -13.160 1.599 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -2.150 -12.376 3.191 1.00 0.41 H new ATOM 2044 N LEU B 422 -6.004 -10.566 1.609 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.361 -9.239 1.027 1.00 0.34 C ATOM 2046 C LEU B 422 -7.369 -8.513 1.921 1.00 0.34 C ATOM 2047 O LEU B 422 -7.436 -7.300 1.940 1.00 0.37 O ATOM 2048 CB LEU B 422 -6.987 -9.565 -0.330 1.00 0.37 C ATOM 2049 CG LEU B 422 -5.894 -9.606 -1.399 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.390 -10.398 -2.611 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -5.551 -8.178 -1.830 1.00 0.63 C ATOM 0 H LEU B 422 -6.137 -11.362 0.986 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.495 -8.583 0.936 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.502 -10.525 -0.284 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -7.734 -8.815 -0.587 1.00 0.37 H new ATOM 0 HG LEU B 422 -5.006 -10.088 -0.991 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -5.610 -10.426 -3.372 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.635 -11.415 -2.305 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -7.279 -9.918 -3.021 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -4.772 -8.205 -2.592 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -6.440 -7.697 -2.237 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -5.196 -7.613 -0.968 1.00 0.63 H new ATOM 2063 N SER B 423 -8.157 -9.245 2.657 1.00 0.35 N ATOM 2064 CA SER B 423 -9.166 -8.599 3.545 1.00 0.38 C ATOM 2065 C SER B 423 -8.489 -7.964 4.765 1.00 0.36 C ATOM 2066 O SER B 423 -9.075 -7.153 5.455 1.00 0.39 O ATOM 2067 CB SER B 423 -10.092 -9.735 3.978 1.00 0.44 C ATOM 2068 OG SER B 423 -11.182 -9.197 4.715 1.00 1.23 O ATOM 0 H SER B 423 -8.147 -10.265 2.683 1.00 0.35 H new ATOM 0 HA SER B 423 -9.704 -7.799 3.037 1.00 0.38 H new ATOM 0 HB2 SER B 423 -10.459 -10.273 3.104 1.00 0.44 H new ATOM 0 HB3 SER B 423 -9.545 -10.453 4.588 1.00 0.44 H new ATOM 0 HG SER B 423 -11.779 -9.923 4.993 1.00 1.23 H new ATOM 2074 N GLU B 424 -7.264 -8.322 5.041 1.00 0.34 N ATOM 2075 CA GLU B 424 -6.567 -7.732 6.222 1.00 0.36 C ATOM 2076 C GLU B 424 -5.961 -6.372 5.861 1.00 0.32 C ATOM 2077 O GLU B 424 -6.214 -5.378 6.513 1.00 0.33 O ATOM 2078 CB GLU B 424 -5.466 -8.733 6.575 1.00 0.38 C ATOM 2079 CG GLU B 424 -5.690 -9.254 7.997 1.00 0.57 C ATOM 2080 CD GLU B 424 -4.376 -9.801 8.555 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -3.370 -9.125 8.417 1.00 1.54 O ATOM 2082 OE2 GLU B 424 -4.398 -10.887 9.112 1.00 1.22 O ATOM 0 H GLU B 424 -6.717 -8.994 4.503 1.00 0.34 H new ATOM 0 HA GLU B 424 -7.247 -7.562 7.057 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.472 -9.562 5.867 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -4.488 -8.257 6.500 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -6.062 -8.452 8.635 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -6.449 -10.036 7.993 1.00 0.57 H new ATOM 2089 N ALA B 425 -5.164 -6.318 4.831 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.546 -5.019 4.433 1.00 0.29 C ATOM 2091 C ALA B 425 -5.574 -4.136 3.714 1.00 0.28 C ATOM 2092 O ALA B 425 -5.395 -2.942 3.581 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.406 -5.396 3.488 1.00 0.29 C ATOM 0 H ALA B 425 -4.913 -7.116 4.247 1.00 0.31 H new ATOM 0 HA ALA B 425 -4.192 -4.451 5.293 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -2.900 -4.492 3.150 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -2.695 -6.035 4.012 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -3.808 -5.930 2.627 1.00 0.29 H new ATOM 2099 N GLN B 426 -6.648 -4.715 3.249 1.00 0.30 N ATOM 2100 CA GLN B 426 -7.685 -3.912 2.539 1.00 0.31 C ATOM 2101 C GLN B 426 -8.098 -2.693 3.378 1.00 0.30 C ATOM 2102 O GLN B 426 -7.984 -1.569 2.927 1.00 0.30 O ATOM 2103 CB GLN B 426 -8.868 -4.864 2.360 1.00 0.36 C ATOM 2104 CG GLN B 426 -8.994 -5.255 0.886 1.00 0.45 C ATOM 2105 CD GLN B 426 -10.039 -6.364 0.739 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -9.798 -7.358 0.086 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -11.197 -6.233 1.326 1.00 1.09 N ATOM 0 H GLN B 426 -6.852 -5.711 3.330 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.320 -3.525 1.587 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -8.727 -5.755 2.972 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -9.787 -4.386 2.700 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -9.283 -4.388 0.292 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -8.031 -5.595 0.506 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -11.399 -5.397 1.875 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -11.900 -6.966 1.236 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.572 -2.947 4.576 1.00 0.32 N ATOM 2117 CA PRO B 427 -9.006 -1.840 5.467 1.00 0.34 C ATOM 2118 C PRO B 427 -7.803 -1.015 5.926 1.00 0.31 C ATOM 2119 O PRO B 427 -7.939 0.118 6.341 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.664 -2.560 6.643 1.00 0.39 C ATOM 2121 CG PRO B 427 -9.048 -3.920 6.650 1.00 0.38 C ATOM 2122 CD PRO B 427 -8.744 -4.261 5.216 1.00 0.35 C ATOM 0 HA PRO B 427 -9.680 -1.136 4.978 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -9.479 -2.037 7.581 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.745 -2.616 6.518 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -8.139 -3.931 7.252 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -9.728 -4.651 7.086 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -7.843 -4.869 5.131 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.555 -4.827 4.758 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.624 -1.568 5.851 1.00 0.29 N ATOM 2131 CA GLU B 428 -5.419 -0.805 6.280 1.00 0.29 C ATOM 2132 C GLU B 428 -5.171 0.357 5.314 1.00 0.27 C ATOM 2133 O GLU B 428 -5.103 1.503 5.711 1.00 0.32 O ATOM 2134 CB GLU B 428 -4.267 -1.808 6.221 1.00 0.29 C ATOM 2135 CG GLU B 428 -3.979 -2.338 7.628 1.00 0.71 C ATOM 2136 CD GLU B 428 -2.986 -1.412 8.338 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -2.446 -0.535 7.683 1.00 2.07 O ATOM 2138 OE2 GLU B 428 -2.784 -1.595 9.527 1.00 2.11 O ATOM 0 H GLU B 428 -6.443 -2.513 5.512 1.00 0.29 H new ATOM 0 HA GLU B 428 -5.530 -0.378 7.277 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.522 -2.633 5.555 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.377 -1.332 5.811 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -4.905 -2.400 8.200 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -3.572 -3.347 7.570 1.00 0.71 H new ATOM 2145 N LEU B 429 -5.046 0.070 4.047 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.813 1.160 3.057 1.00 0.26 C ATOM 2147 C LEU B 429 -5.991 2.138 3.080 1.00 0.25 C ATOM 2148 O LEU B 429 -5.813 3.339 3.105 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.719 0.454 1.702 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.644 1.494 0.579 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.269 1.436 -0.086 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.724 1.192 -0.463 1.00 0.56 C ATOM 0 H LEU B 429 -5.095 -0.870 3.655 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.913 1.736 3.272 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -3.838 -0.187 1.676 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.586 -0.190 1.556 1.00 0.26 H new ATOM 0 HG LEU B 429 -4.802 2.489 0.996 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.219 2.177 -0.884 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.498 1.648 0.654 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -3.108 0.442 -0.503 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.674 1.930 -1.264 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -5.562 0.196 -0.876 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.706 1.234 0.008 1.00 0.56 H new ATOM 2164 N GLU B 430 -7.195 1.632 3.077 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.380 2.534 3.102 1.00 0.28 C ATOM 2166 C GLU B 430 -8.353 3.403 4.363 1.00 0.30 C ATOM 2167 O GLU B 430 -8.668 4.575 4.327 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.590 1.600 3.120 1.00 0.30 C ATOM 2169 CG GLU B 430 -10.796 2.316 2.509 1.00 0.61 C ATOM 2170 CD GLU B 430 -11.728 2.789 3.626 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -11.253 2.950 4.739 1.00 2.17 O ATOM 2172 OE2 GLU B 430 -12.901 2.981 3.351 1.00 2.05 O ATOM 0 H GLU B 430 -7.408 0.635 3.058 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.403 3.211 2.248 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -9.370 0.692 2.559 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -9.813 1.297 4.143 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -10.464 3.166 1.913 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -11.329 1.644 1.836 1.00 0.61 H new ATOM 2179 N ARG B 431 -7.981 2.835 5.479 1.00 0.33 N ATOM 2180 CA ARG B 431 -7.937 3.629 6.742 1.00 0.37 C ATOM 2181 C ARG B 431 -6.851 4.707 6.658 1.00 0.36 C ATOM 2182 O ARG B 431 -7.030 5.818 7.117 1.00 0.38 O ATOM 2183 CB ARG B 431 -7.599 2.616 7.836 1.00 0.41 C ATOM 2184 CG ARG B 431 -7.785 3.265 9.209 1.00 0.59 C ATOM 2185 CD ARG B 431 -9.223 3.050 9.688 1.00 1.32 C ATOM 2186 NE ARG B 431 -9.534 4.248 10.516 1.00 1.56 N ATOM 2187 CZ ARG B 431 -10.743 4.432 10.970 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -11.452 3.411 11.370 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -11.245 5.635 11.024 1.00 2.78 N ATOM 0 H ARG B 431 -7.706 1.857 5.571 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.879 4.143 6.936 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -8.242 1.740 7.746 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -6.571 2.271 7.722 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -7.084 2.834 9.924 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -7.566 4.331 9.151 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -9.911 2.962 8.847 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -9.313 2.133 10.270 1.00 1.32 H new ATOM 0 HE ARG B 431 -8.801 4.925 10.728 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -11.060 2.470 11.327 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -12.397 3.554 11.725 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -10.692 6.433 10.711 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -12.190 5.778 11.379 1.00 2.78 H new ATOM 2203 N THR B 432 -5.725 4.387 6.083 1.00 0.41 N ATOM 2204 CA THR B 432 -4.628 5.394 5.978 1.00 0.45 C ATOM 2205 C THR B 432 -5.008 6.498 4.988 1.00 0.40 C ATOM 2206 O THR B 432 -4.652 7.647 5.159 1.00 0.56 O ATOM 2207 CB THR B 432 -3.418 4.608 5.467 1.00 0.53 C ATOM 2208 OG1 THR B 432 -3.139 3.538 6.359 1.00 0.61 O ATOM 2209 CG2 THR B 432 -2.204 5.534 5.383 1.00 0.62 C ATOM 0 H THR B 432 -5.516 3.473 5.681 1.00 0.41 H new ATOM 0 HA THR B 432 -4.426 5.883 6.931 1.00 0.45 H new ATOM 0 HB THR B 432 -3.636 4.208 4.477 1.00 0.53 H new ATOM 0 HG1 THR B 432 -3.728 2.781 6.157 1.00 0.61 H new ATOM 0 HG21 THR B 432 -1.343 4.973 5.019 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.419 6.354 4.698 1.00 0.62 H new ATOM 0 HG23 THR B 432 -1.984 5.936 6.372 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.726 6.161 3.953 1.00 0.33 N ATOM 2218 CA LEU B 433 -6.124 7.195 2.953 1.00 0.30 C ATOM 2219 C LEU B 433 -7.328 7.994 3.463 1.00 0.27 C ATOM 2220 O LEU B 433 -7.318 9.209 3.474 1.00 0.25 O ATOM 2221 CB LEU B 433 -6.497 6.408 1.697 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.808 7.031 0.481 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -6.275 8.478 0.315 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -4.292 7.004 0.686 1.00 0.44 C ATOM 0 H LEU B 433 -6.055 5.216 3.755 1.00 0.33 H new ATOM 0 HA LEU B 433 -5.326 7.913 2.764 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -6.196 5.366 1.805 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.578 6.414 1.559 1.00 0.37 H new ATOM 0 HG LEU B 433 -6.064 6.463 -0.413 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -5.784 8.922 -0.551 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -7.355 8.497 0.169 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -6.019 9.048 1.208 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -3.800 7.448 -0.180 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -4.036 7.572 1.580 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.959 5.973 0.804 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.365 7.321 3.883 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.566 8.045 4.389 1.00 0.32 C ATOM 2238 C LEU B 434 -9.166 9.035 5.486 1.00 0.29 C ATOM 2239 O LEU B 434 -9.661 10.144 5.545 1.00 0.30 O ATOM 2240 CB LEU B 434 -10.476 6.954 4.955 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.939 7.356 4.762 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.366 7.052 3.325 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -12.816 6.561 5.732 1.00 1.14 C ATOM 0 H LEU B 434 -8.432 6.303 3.898 1.00 0.32 H new ATOM 0 HA LEU B 434 -10.059 8.623 3.607 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.280 6.006 4.454 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -10.266 6.804 6.014 1.00 0.41 H new ATOM 0 HG LEU B 434 -12.052 8.422 4.957 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.409 7.338 3.187 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -11.740 7.615 2.633 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.254 5.985 3.130 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -13.859 6.846 5.596 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -12.702 5.495 5.535 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -12.512 6.775 6.757 1.00 1.14 H new ATOM 2255 N THR B 435 -8.274 8.646 6.355 1.00 0.34 N ATOM 2256 CA THR B 435 -7.845 9.569 7.444 1.00 0.37 C ATOM 2257 C THR B 435 -7.037 10.730 6.861 1.00 0.35 C ATOM 2258 O THR B 435 -7.197 11.869 7.252 1.00 0.39 O ATOM 2259 CB THR B 435 -6.974 8.718 8.370 1.00 0.45 C ATOM 2260 OG1 THR B 435 -7.762 7.678 8.933 1.00 0.52 O ATOM 2261 CG2 THR B 435 -6.407 9.594 9.487 1.00 0.55 C ATOM 0 H THR B 435 -7.824 7.731 6.358 1.00 0.34 H new ATOM 0 HA THR B 435 -8.692 10.005 7.974 1.00 0.37 H new ATOM 0 HB THR B 435 -6.152 8.284 7.801 1.00 0.45 H new ATOM 0 HG1 THR B 435 -7.763 6.905 8.330 1.00 0.52 H new ATOM 0 HG21 THR B 435 -5.787 8.987 10.146 1.00 0.55 H new ATOM 0 HG22 THR B 435 -5.803 10.391 9.053 1.00 0.55 H new ATOM 0 HG23 THR B 435 -7.226 10.030 10.059 1.00 0.55 H new ATOM 2269 N THR B 436 -6.172 10.452 5.923 1.00 0.33 N ATOM 2270 CA THR B 436 -5.362 11.545 5.314 1.00 0.36 C ATOM 2271 C THR B 436 -6.287 12.568 4.653 1.00 0.36 C ATOM 2272 O THR B 436 -6.350 13.712 5.057 1.00 0.40 O ATOM 2273 CB THR B 436 -4.482 10.855 4.270 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.623 9.926 4.916 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.643 11.901 3.534 1.00 0.49 C ATOM 0 H THR B 436 -5.992 9.519 5.553 1.00 0.33 H new ATOM 0 HA THR B 436 -4.764 12.083 6.050 1.00 0.36 H new ATOM 0 HB THR B 436 -5.113 10.330 3.553 1.00 0.38 H new ATOM 0 HG1 THR B 436 -3.865 9.015 4.647 1.00 0.39 H new ATOM 0 HG21 THR B 436 -3.017 11.408 2.791 1.00 0.49 H new ATOM 0 HG22 THR B 436 -4.303 12.613 3.038 1.00 0.49 H new ATOM 0 HG23 THR B 436 -3.011 12.429 4.248 1.00 0.49 H new ATOM 2283 N ALA B 437 -7.013 12.166 3.647 1.00 0.34 N ATOM 2284 CA ALA B 437 -7.938 13.120 2.976 1.00 0.36 C ATOM 2285 C ALA B 437 -8.907 13.700 4.004 1.00 0.36 C ATOM 2286 O ALA B 437 -9.274 14.856 3.941 1.00 0.41 O ATOM 2287 CB ALA B 437 -8.689 12.288 1.935 1.00 0.35 C ATOM 0 H ALA B 437 -7.006 11.221 3.262 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.414 13.957 2.515 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.392 12.925 1.398 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -7.977 11.858 1.230 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -9.234 11.487 2.434 1.00 0.35 H new ATOM 2293 N LEU B 438 -9.319 12.913 4.962 1.00 0.34 N ATOM 2294 CA LEU B 438 -10.253 13.442 5.993 1.00 0.36 C ATOM 2295 C LEU B 438 -9.569 14.572 6.761 1.00 0.42 C ATOM 2296 O LEU B 438 -10.184 15.563 7.098 1.00 0.46 O ATOM 2297 CB LEU B 438 -10.566 12.264 6.922 1.00 0.36 C ATOM 2298 CG LEU B 438 -11.357 12.768 8.139 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -12.610 13.515 7.672 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -11.777 11.582 9.007 1.00 0.45 C ATOM 0 H LEU B 438 -9.051 11.935 5.074 1.00 0.34 H new ATOM 0 HA LEU B 438 -11.167 13.845 5.556 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -11.142 11.509 6.388 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.641 11.788 7.248 1.00 0.36 H new ATOM 0 HG LEU B 438 -10.725 13.442 8.718 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -13.167 13.870 8.539 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -12.318 14.365 7.056 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -13.238 12.842 7.088 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -12.338 11.943 9.869 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -12.403 10.908 8.423 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -10.890 11.049 9.348 1.00 0.45 H new ATOM 2312 N ARG B 439 -8.296 14.441 7.034 1.00 0.43 N ATOM 2313 CA ARG B 439 -7.585 15.525 7.771 1.00 0.50 C ATOM 2314 C ARG B 439 -7.843 16.862 7.074 1.00 0.54 C ATOM 2315 O ARG B 439 -8.091 17.868 7.709 1.00 0.60 O ATOM 2316 CB ARG B 439 -6.102 15.155 7.708 1.00 0.52 C ATOM 2317 CG ARG B 439 -5.378 15.748 8.918 1.00 0.77 C ATOM 2318 CD ARG B 439 -4.006 15.088 9.069 1.00 1.27 C ATOM 2319 NE ARG B 439 -3.038 16.089 8.545 1.00 1.73 N ATOM 2320 CZ ARG B 439 -1.900 15.697 8.043 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -1.874 15.069 6.899 1.00 2.81 N ATOM 2322 NH2 ARG B 439 -0.788 15.931 8.684 1.00 2.89 N ATOM 0 H ARG B 439 -7.723 13.636 6.780 1.00 0.43 H new ATOM 0 HA ARG B 439 -7.922 15.624 8.803 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -5.987 14.071 7.697 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -5.661 15.532 6.786 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -5.263 16.825 8.794 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -5.969 15.592 9.821 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -3.797 14.845 10.111 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -3.953 14.155 8.507 1.00 1.27 H new ATOM 0 HE ARG B 439 -3.265 17.083 8.578 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -2.743 14.885 6.398 1.00 2.81 H new ATOM 0 HH12 ARG B 439 -0.984 14.762 6.506 1.00 2.81 H new ATOM 0 HH21 ARG B 439 -0.808 16.421 9.578 1.00 2.89 H new ATOM 0 HH22 ARG B 439 0.102 15.624 8.291 1.00 2.89 H new ATOM 2336 N HIS B 440 -7.820 16.871 5.768 1.00 0.52 N ATOM 2337 CA HIS B 440 -8.101 18.134 5.034 1.00 0.57 C ATOM 2338 C HIS B 440 -9.493 18.629 5.434 1.00 0.58 C ATOM 2339 O HIS B 440 -9.773 19.811 5.437 1.00 0.64 O ATOM 2340 CB HIS B 440 -8.065 17.748 3.554 1.00 0.55 C ATOM 2341 CG HIS B 440 -8.310 18.971 2.713 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -7.866 20.228 3.091 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -8.953 19.146 1.512 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -8.244 21.097 2.136 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -8.910 20.489 1.149 1.00 0.75 N ATOM 0 H HIS B 440 -7.619 16.061 5.182 1.00 0.52 H new ATOM 0 HA HIS B 440 -7.388 18.929 5.251 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -7.099 17.309 3.305 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -8.822 16.992 3.345 1.00 0.55 H new ATOM 0 HD2 HIS B 440 -9.421 18.361 0.937 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -8.035 22.156 2.163 1.00 0.97 H new ATOM 0 HE2 HIS B 440 -9.302 20.917 0.310 1.00 0.75 H new ATOM 2353 N THR B 441 -10.357 17.716 5.790 1.00 0.53 N ATOM 2354 CA THR B 441 -11.735 18.090 6.216 1.00 0.55 C ATOM 2355 C THR B 441 -12.036 17.424 7.562 1.00 0.56 C ATOM 2356 O THR B 441 -13.041 16.760 7.722 1.00 0.55 O ATOM 2357 CB THR B 441 -12.665 17.539 5.129 1.00 0.53 C ATOM 2358 OG1 THR B 441 -12.680 16.121 5.199 1.00 0.48 O ATOM 2359 CG2 THR B 441 -12.177 17.977 3.746 1.00 0.54 C ATOM 0 H THR B 441 -10.163 16.715 5.803 1.00 0.53 H new ATOM 0 HA THR B 441 -11.860 19.166 6.336 1.00 0.55 H new ATOM 0 HB THR B 441 -13.671 17.927 5.289 1.00 0.53 H new ATOM 0 HG1 THR B 441 -13.593 15.812 5.374 1.00 0.48 H new ATOM 0 HG21 THR B 441 -12.845 17.580 2.982 1.00 0.54 H new ATOM 0 HG22 THR B 441 -12.169 19.066 3.691 1.00 0.54 H new ATOM 0 HG23 THR B 441 -11.169 17.598 3.579 1.00 0.54 H new ATOM 2367 N GLN B 442 -11.149 17.578 8.517 1.00 0.59 N ATOM 2368 CA GLN B 442 -11.332 16.946 9.865 1.00 0.62 C ATOM 2369 C GLN B 442 -12.794 16.991 10.327 1.00 0.64 C ATOM 2370 O GLN B 442 -13.404 18.040 10.399 1.00 0.69 O ATOM 2371 CB GLN B 442 -10.455 17.774 10.804 1.00 0.69 C ATOM 2372 CG GLN B 442 -10.867 19.245 10.725 1.00 1.43 C ATOM 2373 CD GLN B 442 -9.814 20.109 11.422 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -9.221 19.693 12.398 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -9.555 21.302 10.960 1.00 2.47 N ATOM 0 H GLN B 442 -10.293 18.123 8.418 1.00 0.59 H new ATOM 0 HA GLN B 442 -11.058 15.891 9.847 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -10.557 17.412 11.827 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -9.406 17.664 10.530 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -10.971 19.549 9.683 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -11.839 19.387 11.197 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -10.053 21.651 10.141 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -8.855 21.885 11.418 1.00 2.47 H new ATOM 2384 N GLY B 443 -13.353 15.854 10.646 1.00 0.63 N ATOM 2385 CA GLY B 443 -14.768 15.816 11.111 1.00 0.66 C ATOM 2386 C GLY B 443 -15.704 15.675 9.909 1.00 0.64 C ATOM 2387 O GLY B 443 -16.600 14.853 9.902 1.00 0.66 O ATOM 0 H GLY B 443 -12.888 14.947 10.604 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -14.913 14.981 11.797 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -15.004 16.726 11.663 1.00 0.66 H new ATOM 2391 N HIS B 444 -15.507 16.467 8.893 1.00 0.62 N ATOM 2392 CA HIS B 444 -16.388 16.377 7.695 1.00 0.62 C ATOM 2393 C HIS B 444 -16.118 15.074 6.938 1.00 0.67 C ATOM 2394 O HIS B 444 -15.648 15.081 5.817 1.00 1.34 O ATOM 2395 CB HIS B 444 -16.013 17.584 6.836 1.00 0.63 C ATOM 2396 CG HIS B 444 -16.508 18.842 7.495 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -17.833 19.009 7.867 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -15.868 20.003 7.855 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -17.947 20.230 8.423 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -16.778 20.877 8.441 1.00 1.86 N ATOM 0 H HIS B 444 -14.773 17.174 8.840 1.00 0.62 H new ATOM 0 HA HIS B 444 -17.446 16.378 7.959 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -14.932 17.630 6.707 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -16.449 17.486 5.842 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -14.818 20.206 7.706 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -18.871 20.637 8.808 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -16.593 21.811 8.806 1.00 1.86 H new ATOM 2408 N LYS B 445 -16.410 13.954 7.542 1.00 0.62 N ATOM 2409 CA LYS B 445 -16.170 12.654 6.854 1.00 0.51 C ATOM 2410 C LYS B 445 -16.855 12.645 5.489 1.00 0.51 C ATOM 2411 O LYS B 445 -16.475 11.915 4.596 1.00 0.57 O ATOM 2412 CB LYS B 445 -16.788 11.600 7.773 1.00 0.62 C ATOM 2413 CG LYS B 445 -15.736 11.114 8.771 1.00 1.31 C ATOM 2414 CD LYS B 445 -16.238 9.847 9.464 1.00 1.56 C ATOM 2415 CE LYS B 445 -15.831 9.874 10.938 1.00 2.23 C ATOM 2416 NZ LYS B 445 -15.032 8.634 11.139 1.00 2.52 N ATOM 0 H LYS B 445 -16.804 13.883 8.480 1.00 0.62 H new ATOM 0 HA LYS B 445 -15.110 12.469 6.677 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -17.642 12.021 8.304 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -17.161 10.762 7.184 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -14.797 10.912 8.256 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -15.534 11.890 9.510 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -17.322 9.778 9.377 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -15.822 8.965 8.977 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -15.245 10.763 11.169 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -16.705 9.890 11.589 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -14.716 8.581 12.129 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -15.618 7.804 10.918 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -14.203 8.650 10.511 1.00 2.52 H new ATOM 2430 N GLN B 446 -17.863 13.452 5.321 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.574 13.494 4.015 1.00 0.56 C ATOM 2432 C GLN B 446 -17.685 14.145 2.950 1.00 0.52 C ATOM 2433 O GLN B 446 -17.693 13.756 1.799 1.00 0.51 O ATOM 2434 CB GLN B 446 -19.823 14.334 4.277 1.00 0.64 C ATOM 2435 CG GLN B 446 -19.424 15.778 4.601 1.00 1.11 C ATOM 2436 CD GLN B 446 -20.654 16.553 5.077 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -21.575 15.979 5.623 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -20.708 17.844 4.892 1.00 2.40 N ATOM 0 H GLN B 446 -18.226 14.086 6.033 1.00 0.53 H new ATOM 0 HA GLN B 446 -18.826 12.501 3.643 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -20.474 14.315 3.403 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -20.390 13.910 5.106 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -18.653 15.789 5.372 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -18.999 16.256 3.718 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -19.935 18.326 4.434 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -21.523 18.371 5.206 1.00 2.40 H new ATOM 2447 N GLU B 447 -16.917 15.131 3.326 1.00 0.52 N ATOM 2448 CA GLU B 447 -16.027 15.801 2.335 1.00 0.51 C ATOM 2449 C GLU B 447 -15.026 14.790 1.769 1.00 0.45 C ATOM 2450 O GLU B 447 -14.700 14.812 0.600 1.00 0.45 O ATOM 2451 CB GLU B 447 -15.302 16.893 3.120 1.00 0.53 C ATOM 2452 CG GLU B 447 -15.519 18.244 2.433 1.00 0.80 C ATOM 2453 CD GLU B 447 -16.947 18.726 2.692 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -17.806 17.886 2.903 1.00 2.14 O ATOM 2455 OE2 GLU B 447 -17.158 19.926 2.675 1.00 1.96 O ATOM 0 H GLU B 447 -16.867 15.501 4.275 1.00 0.52 H new ATOM 0 HA GLU B 447 -16.581 16.213 1.492 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -15.675 16.929 4.143 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -14.237 16.669 3.177 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -14.803 18.975 2.810 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -15.344 18.151 1.361 1.00 0.80 H new ATOM 2462 N ALA B 448 -14.543 13.898 2.591 1.00 0.43 N ATOM 2463 CA ALA B 448 -13.569 12.880 2.101 1.00 0.39 C ATOM 2464 C ALA B 448 -14.133 12.169 0.868 1.00 0.40 C ATOM 2465 O ALA B 448 -13.401 11.639 0.056 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.404 11.896 3.259 1.00 0.39 C ATOM 0 H ALA B 448 -14.781 13.830 3.581 1.00 0.43 H new ATOM 0 HA ALA B 448 -12.617 13.324 1.809 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -12.700 11.114 2.975 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -13.026 12.424 4.134 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.369 11.447 3.495 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.429 12.157 0.722 1.00 0.44 N ATOM 2473 CA ALA B 449 -16.038 11.485 -0.460 1.00 0.47 C ATOM 2474 C ALA B 449 -15.465 12.082 -1.749 1.00 0.48 C ATOM 2475 O ALA B 449 -14.644 11.479 -2.411 1.00 0.49 O ATOM 2476 CB ALA B 449 -17.537 11.770 -0.353 1.00 0.52 C ATOM 0 H ALA B 449 -16.092 12.583 1.369 1.00 0.44 H new ATOM 0 HA ALA B 449 -15.833 10.415 -0.483 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -18.056 11.306 -1.191 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -17.919 11.361 0.582 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -17.705 12.847 -0.373 1.00 0.52 H new ATOM 2482 N ARG B 450 -15.887 13.264 -2.108 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.363 13.900 -3.351 1.00 0.52 C ATOM 2484 C ARG B 450 -13.831 13.901 -3.339 1.00 0.49 C ATOM 2485 O ARG B 450 -13.192 13.807 -4.368 1.00 0.50 O ATOM 2486 CB ARG B 450 -15.901 15.329 -3.320 1.00 0.57 C ATOM 2487 CG ARG B 450 -15.867 15.919 -4.732 1.00 0.78 C ATOM 2488 CD ARG B 450 -17.048 15.377 -5.540 1.00 1.37 C ATOM 2489 NE ARG B 450 -17.318 16.417 -6.571 1.00 1.76 N ATOM 2490 CZ ARG B 450 -17.455 16.074 -7.822 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -16.413 16.034 -8.606 1.00 2.97 N ATOM 2492 NH2 ARG B 450 -18.636 15.772 -8.289 1.00 2.93 N ATOM 0 H ARG B 450 -16.573 13.817 -1.594 1.00 0.49 H new ATOM 0 HA ARG B 450 -15.672 13.368 -4.250 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -16.921 15.336 -2.936 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -15.302 15.940 -2.645 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -15.914 17.007 -4.684 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -14.928 15.662 -5.223 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -16.805 14.419 -6.000 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -17.919 15.215 -4.905 1.00 1.37 H new ATOM 0 HE ARG B 450 -17.396 17.397 -6.299 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -15.491 16.271 -8.241 1.00 2.97 H new ATOM 0 HH12 ARG B 450 -16.521 15.766 -9.584 1.00 2.97 H new ATOM 0 HH21 ARG B 450 -19.450 15.804 -7.676 1.00 2.93 H new ATOM 0 HH22 ARG B 450 -18.744 15.504 -9.267 1.00 2.93 H new ATOM 2506 N LEU B 451 -13.237 14.005 -2.182 1.00 0.48 N ATOM 2507 CA LEU B 451 -11.748 14.010 -2.107 1.00 0.47 C ATOM 2508 C LEU B 451 -11.193 12.686 -2.637 1.00 0.44 C ATOM 2509 O LEU B 451 -10.076 12.612 -3.107 1.00 0.48 O ATOM 2510 CB LEU B 451 -11.427 14.170 -0.621 1.00 0.46 C ATOM 2511 CG LEU B 451 -11.038 15.621 -0.336 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -11.193 15.906 1.158 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -9.581 15.849 -0.749 1.00 1.04 C ATOM 0 H LEU B 451 -13.717 14.087 -1.286 1.00 0.48 H new ATOM 0 HA LEU B 451 -11.304 14.805 -2.706 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.291 13.889 -0.019 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -10.613 13.502 -0.340 1.00 0.46 H new ATOM 0 HG LEU B 451 -11.686 16.289 -0.903 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -10.916 16.940 1.362 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -12.229 15.743 1.454 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -10.544 15.238 1.725 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -9.303 16.883 -0.546 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -8.933 15.181 -0.181 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.469 15.645 -1.814 1.00 1.04 H new ATOM 2525 N LEU B 452 -11.969 11.639 -2.565 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.489 10.318 -3.066 1.00 0.40 C ATOM 2527 C LEU B 452 -12.391 9.830 -4.205 1.00 0.46 C ATOM 2528 O LEU B 452 -12.435 8.656 -4.513 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.590 9.374 -1.867 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.779 9.932 -0.695 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.408 9.473 0.621 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.340 9.416 -0.779 1.00 0.43 C ATOM 0 H LEU B 452 -12.914 11.640 -2.181 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.473 10.370 -3.458 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.633 9.254 -1.574 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -11.220 8.386 -2.139 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.778 11.021 -0.739 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.832 9.869 1.457 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.433 9.838 0.681 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.408 8.384 0.664 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.762 9.813 0.055 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.341 8.327 -0.734 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -8.891 9.740 -1.718 1.00 0.43 H new ATOM 2544 N GLY B 453 -13.113 10.721 -4.829 1.00 0.50 N ATOM 2545 CA GLY B 453 -14.013 10.304 -5.942 1.00 0.56 C ATOM 2546 C GLY B 453 -15.082 9.351 -5.404 1.00 0.58 C ATOM 2547 O GLY B 453 -15.656 8.569 -6.136 1.00 0.68 O ATOM 0 H GLY B 453 -13.119 11.719 -4.616 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -14.483 11.179 -6.391 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -13.436 9.815 -6.727 1.00 0.56 H new ATOM 2551 N TRP B 454 -15.356 9.410 -4.128 1.00 0.54 N ATOM 2552 CA TRP B 454 -16.389 8.509 -3.542 1.00 0.60 C ATOM 2553 C TRP B 454 -17.660 9.298 -3.225 1.00 0.69 C ATOM 2554 O TRP B 454 -17.730 10.494 -3.430 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.766 7.979 -2.246 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.726 6.935 -2.538 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -14.231 6.630 -3.765 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -14.043 6.060 -1.594 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -13.289 5.623 -3.633 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -13.134 5.236 -2.318 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.121 5.899 -0.185 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -12.328 4.284 -1.668 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.312 4.941 0.472 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.417 4.135 -0.268 1.00 0.51 C ATOM 0 H TRP B 454 -14.908 10.044 -3.466 1.00 0.54 H new ATOM 0 HA TRP B 454 -16.667 7.707 -4.226 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.315 8.802 -1.692 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.544 7.555 -1.611 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -14.524 7.097 -4.694 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -12.773 5.217 -4.413 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -14.801 6.511 0.388 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.645 3.671 -2.237 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -13.379 4.825 1.544 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -11.802 3.406 0.238 1.00 0.51 H new ATOM 2575 N GLY B 455 -18.662 8.639 -2.715 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.927 9.346 -2.368 1.00 0.72 C ATOM 2577 C GLY B 455 -20.208 9.152 -0.878 1.00 0.70 C ATOM 2578 O GLY B 455 -19.316 8.867 -0.105 1.00 0.64 O ATOM 0 H GLY B 455 -18.660 7.637 -2.523 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.842 10.407 -2.601 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -20.753 8.955 -2.962 1.00 0.72 H new ATOM 2582 N ALA B 456 -21.436 9.292 -0.464 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.756 9.099 0.980 1.00 0.77 C ATOM 2584 C ALA B 456 -22.094 7.631 1.237 1.00 0.82 C ATOM 2585 O ALA B 456 -21.803 7.090 2.286 1.00 0.83 O ATOM 2586 CB ALA B 456 -22.972 9.988 1.245 1.00 0.84 C ATOM 0 H ALA B 456 -22.230 9.531 -1.059 1.00 0.77 H new ATOM 0 HA ALA B 456 -20.922 9.359 1.632 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -23.267 9.899 2.291 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.719 11.025 1.027 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.798 9.674 0.607 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.698 6.978 0.282 1.00 0.90 N ATOM 2593 CA ALA B 457 -23.043 5.542 0.467 1.00 0.97 C ATOM 2594 C ALA B 457 -21.762 4.705 0.472 1.00 0.89 C ATOM 2595 O ALA B 457 -21.638 3.741 1.201 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.917 5.182 -0.734 1.00 1.07 C ATOM 0 H ALA B 457 -22.967 7.377 -0.617 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.559 5.353 1.408 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -24.212 4.135 -0.668 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.808 5.811 -0.737 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -23.355 5.344 -1.654 1.00 1.07 H new ATOM 2602 N THR B 458 -20.805 5.076 -0.334 1.00 0.84 N ATOM 2603 CA THR B 458 -19.524 4.313 -0.375 1.00 0.77 C ATOM 2604 C THR B 458 -18.715 4.594 0.893 1.00 0.68 C ATOM 2605 O THR B 458 -18.345 3.692 1.618 1.00 0.67 O ATOM 2606 CB THR B 458 -18.791 4.842 -1.610 1.00 0.76 C ATOM 2607 OG1 THR B 458 -19.588 4.617 -2.764 1.00 0.85 O ATOM 2608 CG2 THR B 458 -17.452 4.119 -1.761 1.00 0.72 C ATOM 0 H THR B 458 -20.854 5.875 -0.966 1.00 0.84 H new ATOM 0 HA THR B 458 -19.678 3.235 -0.426 1.00 0.77 H new ATOM 0 HB THR B 458 -18.611 5.911 -1.496 1.00 0.76 H new ATOM 0 HG1 THR B 458 -19.121 4.957 -3.556 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.932 4.497 -2.641 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.842 4.295 -0.875 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.627 3.049 -1.875 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.445 5.841 1.169 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.665 6.185 2.394 1.00 0.57 C ATOM 2618 C LEU B 459 -18.303 5.534 3.624 1.00 0.60 C ATOM 2619 O LEU B 459 -17.640 5.238 4.598 1.00 0.58 O ATOM 2620 CB LEU B 459 -17.738 7.710 2.490 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.324 8.290 2.464 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.351 9.673 1.814 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -15.795 8.415 3.891 1.00 0.46 C ATOM 0 H LEU B 459 -18.731 6.637 0.599 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.636 5.829 2.347 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.322 8.110 1.661 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.246 8.003 3.409 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.674 7.628 1.891 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.343 10.086 1.796 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -16.727 9.589 0.794 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -17.003 10.332 2.388 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -14.787 8.829 3.870 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -16.446 9.075 4.464 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -15.774 7.431 4.359 1.00 0.46 H new ATOM 2635 N THR B 460 -19.588 5.305 3.584 1.00 0.68 N ATOM 2636 CA THR B 460 -20.271 4.670 4.748 1.00 0.74 C ATOM 2637 C THR B 460 -20.271 3.147 4.592 1.00 0.76 C ATOM 2638 O THR B 460 -19.893 2.421 5.491 1.00 0.75 O ATOM 2639 CB THR B 460 -21.701 5.211 4.712 1.00 0.83 C ATOM 2640 OG1 THR B 460 -21.669 6.629 4.784 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.489 4.653 5.897 1.00 0.92 C ATOM 0 H THR B 460 -20.194 5.530 2.795 1.00 0.68 H new ATOM 0 HA THR B 460 -19.774 4.894 5.692 1.00 0.74 H new ATOM 0 HB THR B 460 -22.184 4.905 3.784 1.00 0.83 H new ATOM 0 HG1 THR B 460 -21.487 6.998 3.894 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.508 5.039 5.871 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.512 3.565 5.839 1.00 0.92 H new ATOM 0 HG23 THR B 460 -22.010 4.957 6.828 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.691 2.657 3.457 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.715 1.182 3.243 1.00 0.85 C ATOM 2651 C ALA B 461 -19.293 0.616 3.287 1.00 0.79 C ATOM 2652 O ALA B 461 -19.073 -0.506 3.696 1.00 0.83 O ATOM 2653 CB ALA B 461 -21.326 0.995 1.855 1.00 0.92 C ATOM 0 H ALA B 461 -21.019 3.215 2.668 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.285 0.662 4.013 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -21.379 -0.068 1.621 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -22.329 1.420 1.839 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.706 1.499 1.114 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.325 1.386 2.870 1.00 0.72 N ATOM 2660 CA LYS B 462 -16.919 0.891 2.891 1.00 0.68 C ATOM 2661 C LYS B 462 -16.383 0.890 4.325 1.00 0.65 C ATOM 2662 O LYS B 462 -15.456 0.176 4.652 1.00 0.66 O ATOM 2663 CB LYS B 462 -16.136 1.878 2.025 1.00 0.66 C ATOM 2664 CG LYS B 462 -14.906 1.183 1.437 1.00 0.99 C ATOM 2665 CD LYS B 462 -15.000 1.180 -0.090 1.00 0.91 C ATOM 2666 CE LYS B 462 -13.678 0.689 -0.683 1.00 1.31 C ATOM 2667 NZ LYS B 462 -13.987 -0.652 -1.253 1.00 1.39 N ATOM 0 H LYS B 462 -18.447 2.335 2.516 1.00 0.72 H new ATOM 0 HA LYS B 462 -16.834 -0.130 2.519 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.770 2.256 1.223 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -15.830 2.737 2.622 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -13.999 1.697 1.755 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -14.840 0.161 1.810 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -15.817 0.535 -0.413 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -15.223 2.183 -0.453 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -13.313 1.370 -1.452 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -12.903 0.625 0.080 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -13.128 -1.055 -1.679 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -14.326 -1.281 -0.497 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -14.723 -0.558 -1.981 1.00 1.39 H new ATOM 2681 N LEU B 463 -16.963 1.684 5.183 1.00 0.65 N ATOM 2682 CA LEU B 463 -16.488 1.728 6.597 1.00 0.65 C ATOM 2683 C LEU B 463 -16.692 0.366 7.265 1.00 0.68 C ATOM 2684 O LEU B 463 -15.793 -0.177 7.875 1.00 0.70 O ATOM 2685 CB LEU B 463 -17.355 2.792 7.271 1.00 0.68 C ATOM 2686 CG LEU B 463 -16.819 3.073 8.676 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -16.328 4.519 8.754 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -17.936 2.859 9.701 1.00 0.99 C ATOM 0 H LEU B 463 -17.744 2.304 4.967 1.00 0.65 H new ATOM 0 HA LEU B 463 -15.426 1.961 6.670 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.351 3.707 6.679 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -18.389 2.452 7.326 1.00 0.68 H new ATOM 0 HG LEU B 463 -15.993 2.396 8.892 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -15.946 4.720 9.755 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -15.533 4.673 8.024 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -17.155 5.196 8.538 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -17.554 3.059 10.702 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -18.762 3.536 9.485 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -18.288 1.829 9.646 1.00 0.99 H new ATOM 2700 N LYS B 464 -17.867 -0.188 7.154 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.129 -1.515 7.782 1.00 0.77 C ATOM 2702 C LYS B 464 -17.696 -2.641 6.840 1.00 0.76 C ATOM 2703 O LYS B 464 -17.197 -3.663 7.267 1.00 0.82 O ATOM 2704 CB LYS B 464 -19.642 -1.554 8.005 1.00 0.85 C ATOM 2705 CG LYS B 464 -19.937 -2.077 9.412 1.00 1.20 C ATOM 2706 CD LYS B 464 -20.392 -0.918 10.302 1.00 1.62 C ATOM 2707 CE LYS B 464 -20.658 -1.434 11.718 1.00 2.25 C ATOM 2708 NZ LYS B 464 -22.053 -1.012 12.025 1.00 2.66 N ATOM 0 H LYS B 464 -18.658 0.220 6.656 1.00 0.72 H new ATOM 0 HA LYS B 464 -17.576 -1.649 8.711 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.065 -0.557 7.880 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.114 -2.196 7.261 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -20.710 -2.844 9.372 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -19.046 -2.544 9.832 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -19.628 -0.141 10.324 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -21.295 -0.465 9.893 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -20.553 -2.518 11.770 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -19.951 -1.011 12.432 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -22.309 -1.330 12.981 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -22.121 0.025 11.975 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -22.704 -1.436 11.333 1.00 2.66 H new ATOM 2722 N GLU B 465 -17.882 -2.461 5.560 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.480 -3.523 4.592 1.00 0.76 C ATOM 2724 C GLU B 465 -16.016 -3.911 4.810 1.00 0.69 C ATOM 2725 O GLU B 465 -15.701 -5.053 5.080 1.00 0.85 O ATOM 2726 CB GLU B 465 -17.666 -2.891 3.212 1.00 0.79 C ATOM 2727 CG GLU B 465 -17.288 -3.905 2.131 1.00 1.12 C ATOM 2728 CD GLU B 465 -18.419 -4.007 1.107 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -19.101 -3.016 0.905 1.00 2.03 O ATOM 2730 OE2 GLU B 465 -18.585 -5.076 0.540 1.00 1.94 O ATOM 0 H GLU B 465 -18.294 -1.626 5.143 1.00 0.73 H new ATOM 0 HA GLU B 465 -18.070 -4.432 4.708 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -18.701 -2.574 3.082 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -17.046 -1.999 3.122 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -16.364 -3.600 1.639 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -17.102 -4.880 2.581 1.00 1.12 H new ATOM 2737 N LEU B 466 -15.119 -2.970 4.696 1.00 0.56 N ATOM 2738 CA LEU B 466 -13.676 -3.288 4.897 1.00 0.59 C ATOM 2739 C LEU B 466 -13.440 -3.794 6.324 1.00 0.70 C ATOM 2740 O LEU B 466 -12.563 -4.598 6.570 1.00 0.81 O ATOM 2741 CB LEU B 466 -12.943 -1.967 4.667 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.676 -1.782 3.173 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -12.364 -0.312 2.889 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.481 -2.643 2.760 1.00 0.52 C ATOM 0 H LEU B 466 -15.322 -1.996 4.473 1.00 0.56 H new ATOM 0 HA LEU B 466 -13.327 -4.069 4.222 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -13.540 -1.137 5.045 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -12.003 -1.960 5.218 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.557 -2.083 2.606 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -12.174 -0.180 1.824 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -13.213 0.304 3.185 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -11.483 -0.011 3.455 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -11.289 -2.512 1.695 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.601 -2.340 3.327 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -11.700 -3.691 2.963 1.00 0.52 H new ATOM 2756 N GLY B 467 -14.215 -3.327 7.265 1.00 0.77 N ATOM 2757 CA GLY B 467 -14.034 -3.781 8.674 1.00 0.97 C ATOM 2758 C GLY B 467 -14.626 -5.181 8.839 1.00 1.08 C ATOM 2759 O GLY B 467 -14.240 -5.929 9.715 1.00 1.38 O ATOM 0 H GLY B 467 -14.965 -2.651 7.119 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -12.975 -3.790 8.931 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -14.522 -3.086 9.357 1.00 0.97 H new