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= 0.0136 USER MOD Single : A 408 GLN : amide:sc= -0.298 K(o=-0.3,f=-2.4!) USER MOD Single : A 416 SER OG : rot 180:sc= 0 USER MOD Single : A 418 HIS : no HD1:sc= -1.25 K(o=-1.2,f=-4.5!) USER MOD Single : A 419 GLN : amide:sc= -0.221 K(o=-0.22,f=-2.2!) USER MOD Single : A 420 ASN : amide:sc= -0.153 K(o=-0.15,f=-1.2) USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 426 GLN : amide:sc= -0.734 K(o=-0.73,f=-4.2!) USER MOD Single : A 432 THR OG1 : rot 89:sc= 0.601 USER MOD Single : A 435 THR OG1 : rot 99:sc= 1.22 USER MOD Single : A 436 THR OG1 : rot 78:sc= 1.26 USER MOD Single : A 440 HIS : no HD1:sc= -0.492 X(o=-0.49,f=-0.13) USER MOD Single : A 441 THR OG1 : rot 119:sc= 0.823 USER MOD Single : A 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 444 HIS : no HD1:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.049) USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 460 THR OG1 : rot 97:sc= 0.803 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= 0.00399 USER MOD Single : B 408 GLN : amide:sc= -0.422 K(o=-0.42,f=-2.3!) USER MOD Single : B 416 SER OG : rot 180:sc= 0 USER MOD Single : B 418 HIS : no HD1:sc= -1.22 K(o=-1.2,f=-4.7!) USER MOD Single : B 419 GLN : amide:sc= -0.299 K(o=-0.3,f=-2.2!) USER MOD Single : B 420 ASN : amide:sc= -0.157 K(o=-0.16,f=-1.2) USER MOD Single : B 423 SER OG : rot 180:sc= 0 USER MOD Single : B 426 GLN : amide:sc= -0.726 K(o=-0.73,f=-4.2!) USER MOD Single : B 432 THR OG1 : rot 89:sc= 0.633 USER MOD Single : B 435 THR OG1 : rot 100:sc= 1.14 USER MOD Single : B 436 THR OG1 : rot 95:sc= 1.28 USER MOD Single : B 440 HIS : no HD1:sc= -0.548 X(o=-0.55,f=-0.12) USER MOD Single : B 441 THR OG1 : rot 117:sc= 0.812 USER MOD Single : B 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 444 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 446 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.033) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0 USER MOD Single : B 460 THR OG1 : rot 96:sc= 0.8 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 6.336 2.726 1.580 1.00 0.95 N ATOM 326 CA TRP A 402 5.003 2.917 0.935 1.00 0.86 C ATOM 327 C TRP A 402 4.112 3.854 1.753 1.00 0.79 C ATOM 328 O TRP A 402 3.777 4.933 1.315 1.00 0.71 O ATOM 329 CB TRP A 402 4.395 1.519 0.883 1.00 0.96 C ATOM 330 CG TRP A 402 3.802 1.297 -0.466 1.00 0.84 C ATOM 331 CD1 TRP A 402 4.503 0.955 -1.568 1.00 0.94 C ATOM 332 CD2 TRP A 402 2.411 1.405 -0.874 1.00 0.76 C ATOM 333 NE1 TRP A 402 3.631 0.838 -2.638 1.00 1.00 N ATOM 334 CE2 TRP A 402 2.327 1.107 -2.264 1.00 0.83 C ATOM 335 CE3 TRP A 402 1.216 1.729 -0.181 1.00 0.78 C ATOM 336 CZ2 TRP A 402 1.096 1.129 -2.947 1.00 0.83 C ATOM 337 CZ3 TRP A 402 -0.023 1.753 -0.863 1.00 0.72 C ATOM 338 CH2 TRP A 402 -0.083 1.454 -2.244 1.00 0.69 C ATOM 0 HA TRP A 402 5.096 3.374 -0.050 1.00 0.86 H new ATOM 0 HB2 TRP A 402 5.159 0.769 1.086 1.00 0.96 H new ATOM 0 HB3 TRP A 402 3.630 1.412 1.652 1.00 0.96 H new ATOM 0 HD1 TRP A 402 5.571 0.798 -1.609 1.00 0.94 H new ATOM 0 HE1 TRP A 402 3.915 0.585 -3.584 1.00 1.00 H new ATOM 0 HE3 TRP A 402 1.253 1.959 0.874 1.00 0.78 H new ATOM 0 HZ2 TRP A 402 1.055 0.899 -4.001 1.00 0.83 H new ATOM 0 HZ3 TRP A 402 -0.927 2.001 -0.327 1.00 0.72 H new ATOM 0 HH2 TRP A 402 -1.031 1.474 -2.760 1.00 0.69 H new ATOM 349 N ALA A 403 3.715 3.450 2.932 1.00 0.85 N ATOM 350 CA ALA A 403 2.834 4.325 3.766 1.00 0.85 C ATOM 351 C ALA A 403 3.390 5.751 3.819 1.00 0.80 C ATOM 352 O ALA A 403 2.689 6.707 3.564 1.00 0.76 O ATOM 353 CB ALA A 403 2.845 3.692 5.158 1.00 0.99 C ATOM 0 H ALA A 403 3.961 2.554 3.354 1.00 0.85 H new ATOM 0 HA ALA A 403 1.825 4.396 3.359 1.00 0.85 H new ATOM 0 HB1 ALA A 403 2.219 4.279 5.830 1.00 0.99 H new ATOM 0 HB2 ALA A 403 2.459 2.675 5.098 1.00 0.99 H new ATOM 0 HB3 ALA A 403 3.866 3.670 5.540 1.00 0.99 H new ATOM 359 N THR A 404 4.647 5.902 4.133 1.00 0.82 N ATOM 360 CA THR A 404 5.232 7.271 4.181 1.00 0.81 C ATOM 361 C THR A 404 5.032 7.955 2.827 1.00 0.70 C ATOM 362 O THR A 404 4.763 9.137 2.746 1.00 0.68 O ATOM 363 CB THR A 404 6.720 7.062 4.466 1.00 0.89 C ATOM 364 OG1 THR A 404 6.867 6.251 5.624 1.00 1.07 O ATOM 365 CG2 THR A 404 7.392 8.416 4.701 1.00 0.89 C ATOM 0 H THR A 404 5.290 5.143 4.357 1.00 0.82 H new ATOM 0 HA THR A 404 4.766 7.902 4.938 1.00 0.81 H new ATOM 0 HB THR A 404 7.189 6.570 3.614 1.00 0.89 H new ATOM 0 HG1 THR A 404 7.820 6.114 5.808 1.00 1.07 H new ATOM 0 HG21 THR A 404 8.452 8.266 4.904 1.00 0.89 H new ATOM 0 HG22 THR A 404 7.277 9.038 3.813 1.00 0.89 H new ATOM 0 HG23 THR A 404 6.926 8.910 5.553 1.00 0.89 H new ATOM 373 N LEU A 405 5.151 7.209 1.760 1.00 0.67 N ATOM 374 CA LEU A 405 4.958 7.802 0.406 1.00 0.61 C ATOM 375 C LEU A 405 3.469 8.063 0.165 1.00 0.53 C ATOM 376 O LEU A 405 3.098 8.876 -0.658 1.00 0.52 O ATOM 377 CB LEU A 405 5.494 6.737 -0.564 1.00 0.67 C ATOM 378 CG LEU A 405 5.431 7.226 -2.023 1.00 0.65 C ATOM 379 CD1 LEU A 405 3.989 7.159 -2.532 1.00 0.57 C ATOM 380 CD2 LEU A 405 5.945 8.668 -2.130 1.00 0.64 C ATOM 0 H LEU A 405 5.374 6.214 1.769 1.00 0.67 H new ATOM 0 HA LEU A 405 5.471 8.756 0.282 1.00 0.61 H new ATOM 0 HB2 LEU A 405 6.524 6.491 -0.305 1.00 0.67 H new ATOM 0 HB3 LEU A 405 4.912 5.821 -0.460 1.00 0.67 H new ATOM 0 HG LEU A 405 6.063 6.580 -2.632 1.00 0.65 H new ATOM 0 HD11 LEU A 405 3.951 7.506 -3.565 1.00 0.57 H new ATOM 0 HD12 LEU A 405 3.633 6.130 -2.482 1.00 0.57 H new ATOM 0 HD13 LEU A 405 3.355 7.793 -1.913 1.00 0.57 H new ATOM 0 HD21 LEU A 405 5.893 8.997 -3.168 1.00 0.64 H new ATOM 0 HD22 LEU A 405 5.329 9.321 -1.511 1.00 0.64 H new ATOM 0 HD23 LEU A 405 6.979 8.712 -1.787 1.00 0.64 H new ATOM 392 N LEU A 406 2.616 7.375 0.873 1.00 0.53 N ATOM 393 CA LEU A 406 1.153 7.575 0.686 1.00 0.50 C ATOM 394 C LEU A 406 0.665 8.743 1.545 1.00 0.49 C ATOM 395 O LEU A 406 -0.176 9.518 1.134 1.00 0.45 O ATOM 396 CB LEU A 406 0.518 6.255 1.142 1.00 0.58 C ATOM 397 CG LEU A 406 -0.789 6.017 0.377 1.00 0.60 C ATOM 398 CD1 LEU A 406 -0.510 5.979 -1.126 1.00 0.94 C ATOM 399 CD2 LEU A 406 -1.396 4.680 0.806 1.00 1.02 C ATOM 0 H LEU A 406 2.871 6.681 1.575 1.00 0.53 H new ATOM 0 HA LEU A 406 0.891 7.817 -0.344 1.00 0.50 H new ATOM 0 HB2 LEU A 406 1.208 5.429 0.967 1.00 0.58 H new ATOM 0 HB3 LEU A 406 0.322 6.286 2.214 1.00 0.58 H new ATOM 0 HG LEU A 406 -1.484 6.827 0.599 1.00 0.60 H new ATOM 0 HD11 LEU A 406 -1.442 5.810 -1.665 1.00 0.94 H new ATOM 0 HD12 LEU A 406 -0.077 6.929 -1.440 1.00 0.94 H new ATOM 0 HD13 LEU A 406 0.188 5.171 -1.346 1.00 0.94 H new ATOM 0 HD21 LEU A 406 -2.325 4.511 0.262 1.00 1.02 H new ATOM 0 HD22 LEU A 406 -0.695 3.875 0.586 1.00 1.02 H new ATOM 0 HD23 LEU A 406 -1.601 4.700 1.876 1.00 1.02 H new ATOM 411 N ALA A 407 1.192 8.885 2.730 1.00 0.56 N ATOM 412 CA ALA A 407 0.761 10.011 3.604 1.00 0.59 C ATOM 413 C ALA A 407 1.241 11.338 3.012 1.00 0.57 C ATOM 414 O ALA A 407 0.559 12.342 3.075 1.00 0.61 O ATOM 415 CB ALA A 407 1.430 9.748 4.954 1.00 0.70 C ATOM 0 H ALA A 407 1.901 8.271 3.130 1.00 0.56 H new ATOM 0 HA ALA A 407 -0.323 10.074 3.699 1.00 0.59 H new ATOM 0 HB1 ALA A 407 1.159 10.538 5.654 1.00 0.70 H new ATOM 0 HB2 ALA A 407 1.096 8.787 5.345 1.00 0.70 H new ATOM 0 HB3 ALA A 407 2.512 9.731 4.827 1.00 0.70 H new ATOM 421 N GLN A 408 2.409 11.347 2.428 1.00 0.57 N ATOM 422 CA GLN A 408 2.932 12.604 1.824 1.00 0.57 C ATOM 423 C GLN A 408 2.324 12.808 0.433 1.00 0.50 C ATOM 424 O GLN A 408 1.955 13.903 0.059 1.00 0.50 O ATOM 425 CB GLN A 408 4.443 12.400 1.726 1.00 0.62 C ATOM 426 CG GLN A 408 5.077 12.616 3.102 1.00 0.75 C ATOM 427 CD GLN A 408 6.037 13.805 3.043 1.00 0.78 C ATOM 428 OE1 GLN A 408 5.948 14.631 2.155 1.00 1.29 O ATOM 429 NE2 GLN A 408 6.959 13.929 3.957 1.00 1.46 N ATOM 0 H GLN A 408 3.023 10.537 2.344 1.00 0.57 H new ATOM 0 HA GLN A 408 2.681 13.485 2.415 1.00 0.57 H new ATOM 0 HB2 GLN A 408 4.662 11.395 1.366 1.00 0.62 H new ATOM 0 HB3 GLN A 408 4.869 13.097 1.004 1.00 0.62 H new ATOM 0 HG2 GLN A 408 4.302 12.798 3.846 1.00 0.75 H new ATOM 0 HG3 GLN A 408 5.612 11.718 3.412 1.00 0.75 H new ATOM 0 HE21 GLN A 408 7.035 13.237 4.702 1.00 1.46 H new ATOM 0 HE22 GLN A 408 7.604 14.718 3.927 1.00 1.46 H new ATOM 438 N TRP A 409 2.210 11.756 -0.333 1.00 0.46 N ATOM 439 CA TRP A 409 1.620 11.885 -1.696 1.00 0.43 C ATOM 440 C TRP A 409 0.175 12.388 -1.586 1.00 0.40 C ATOM 441 O TRP A 409 -0.199 13.367 -2.200 1.00 0.41 O ATOM 442 CB TRP A 409 1.674 10.464 -2.276 1.00 0.43 C ATOM 443 CG TRP A 409 0.823 10.365 -3.505 1.00 0.42 C ATOM 444 CD1 TRP A 409 1.101 10.942 -4.698 1.00 0.50 C ATOM 445 CD2 TRP A 409 -0.436 9.656 -3.675 1.00 0.40 C ATOM 446 NE1 TRP A 409 0.091 10.633 -5.594 1.00 0.53 N ATOM 447 CE2 TRP A 409 -0.882 9.842 -5.014 1.00 0.47 C ATOM 448 CE3 TRP A 409 -1.233 8.871 -2.802 1.00 0.39 C ATOM 449 CZ2 TRP A 409 -2.082 9.268 -5.476 1.00 0.50 C ATOM 450 CZ3 TRP A 409 -2.440 8.291 -3.259 1.00 0.43 C ATOM 451 CH2 TRP A 409 -2.864 8.489 -4.595 1.00 0.48 C ATOM 0 H TRP A 409 2.500 10.813 -0.073 1.00 0.46 H new ATOM 0 HA TRP A 409 2.151 12.596 -2.329 1.00 0.43 H new ATOM 0 HB2 TRP A 409 2.704 10.203 -2.518 1.00 0.43 H new ATOM 0 HB3 TRP A 409 1.330 9.747 -1.530 1.00 0.43 H new ATOM 0 HD1 TRP A 409 1.970 11.546 -4.916 1.00 0.50 H new ATOM 0 HE1 TRP A 409 0.068 10.950 -6.563 1.00 0.53 H new ATOM 0 HE3 TRP A 409 -0.916 8.715 -1.781 1.00 0.39 H new ATOM 0 HZ2 TRP A 409 -2.402 9.422 -6.496 1.00 0.50 H new ATOM 0 HZ3 TRP A 409 -3.040 7.695 -2.587 1.00 0.43 H new ATOM 0 HH2 TRP A 409 -3.786 8.044 -4.941 1.00 0.48 H new ATOM 462 N ALA A 410 -0.634 11.727 -0.806 1.00 0.42 N ATOM 463 CA ALA A 410 -2.049 12.169 -0.656 1.00 0.44 C ATOM 464 C ALA A 410 -2.097 13.648 -0.261 1.00 0.45 C ATOM 465 O ALA A 410 -3.033 14.354 -0.577 1.00 0.47 O ATOM 466 CB ALA A 410 -2.622 11.289 0.456 1.00 0.51 C ATOM 0 H ALA A 410 -0.377 10.901 -0.266 1.00 0.42 H new ATOM 0 HA ALA A 410 -2.618 12.071 -1.581 1.00 0.44 H new ATOM 0 HB1 ALA A 410 -3.665 11.553 0.628 1.00 0.51 H new ATOM 0 HB2 ALA A 410 -2.557 10.242 0.161 1.00 0.51 H new ATOM 0 HB3 ALA A 410 -2.053 11.444 1.373 1.00 0.51 H new ATOM 472 N ASP A 411 -1.092 14.119 0.422 1.00 0.48 N ATOM 473 CA ASP A 411 -1.073 15.553 0.832 1.00 0.53 C ATOM 474 C ASP A 411 -0.611 16.425 -0.337 1.00 0.53 C ATOM 475 O ASP A 411 -1.253 17.394 -0.692 1.00 0.58 O ATOM 476 CB ASP A 411 -0.072 15.624 1.985 1.00 0.60 C ATOM 477 CG ASP A 411 -0.623 16.530 3.087 1.00 1.03 C ATOM 478 OD1 ASP A 411 -1.168 17.570 2.755 1.00 1.78 O ATOM 479 OD2 ASP A 411 -0.490 16.169 4.245 1.00 1.51 O ATOM 0 H ASP A 411 -0.281 13.574 0.715 1.00 0.48 H new ATOM 0 HA ASP A 411 -2.058 15.913 1.129 1.00 0.53 H new ATOM 0 HB2 ASP A 411 0.114 14.625 2.380 1.00 0.60 H new ATOM 0 HB3 ASP A 411 0.883 16.009 1.628 1.00 0.60 H new ATOM 484 N ARG A 412 0.496 16.087 -0.941 1.00 0.51 N ATOM 485 CA ARG A 412 0.992 16.897 -2.091 1.00 0.56 C ATOM 486 C ARG A 412 -0.091 16.986 -3.167 1.00 0.55 C ATOM 487 O ARG A 412 -0.238 17.989 -3.836 1.00 0.63 O ATOM 488 CB ARG A 412 2.215 16.141 -2.613 1.00 0.58 C ATOM 489 CG ARG A 412 3.452 16.559 -1.816 1.00 0.96 C ATOM 490 CD ARG A 412 4.695 16.444 -2.702 1.00 1.50 C ATOM 491 NE ARG A 412 5.826 16.243 -1.755 1.00 1.90 N ATOM 492 CZ ARG A 412 7.050 16.478 -2.140 1.00 2.41 C ATOM 493 NH1 ARG A 412 7.422 17.697 -2.426 1.00 2.89 N ATOM 494 NH2 ARG A 412 7.903 15.495 -2.241 1.00 3.02 N ATOM 0 H ARG A 412 1.077 15.287 -0.689 1.00 0.51 H new ATOM 0 HA ARG A 412 1.244 17.918 -1.805 1.00 0.56 H new ATOM 0 HB2 ARG A 412 2.057 15.066 -2.523 1.00 0.58 H new ATOM 0 HB3 ARG A 412 2.363 16.354 -3.672 1.00 0.58 H new ATOM 0 HG2 ARG A 412 3.339 17.583 -1.461 1.00 0.96 H new ATOM 0 HG3 ARG A 412 3.561 15.926 -0.935 1.00 0.96 H new ATOM 0 HD2 ARG A 412 4.609 15.608 -3.397 1.00 1.50 H new ATOM 0 HD3 ARG A 412 4.837 17.343 -3.301 1.00 1.50 H new ATOM 0 HE ARG A 412 5.644 15.921 -0.804 1.00 1.90 H new ATOM 0 HH11 ARG A 412 6.755 18.465 -2.348 1.00 2.89 H new ATOM 0 HH12 ARG A 412 8.379 17.881 -2.727 1.00 2.89 H new ATOM 0 HH21 ARG A 412 7.612 14.543 -2.019 1.00 3.02 H new ATOM 0 HH22 ARG A 412 8.860 15.679 -2.542 1.00 3.02 H new ATOM 508 N ALA A 413 -0.855 15.942 -3.331 1.00 0.50 N ATOM 509 CA ALA A 413 -1.937 15.960 -4.355 1.00 0.53 C ATOM 510 C ALA A 413 -3.131 16.760 -3.830 1.00 0.57 C ATOM 511 O ALA A 413 -3.834 17.412 -4.577 1.00 0.66 O ATOM 512 CB ALA A 413 -2.318 14.494 -4.556 1.00 0.53 C ATOM 0 H ALA A 413 -0.777 15.075 -2.799 1.00 0.50 H new ATOM 0 HA ALA A 413 -1.622 16.426 -5.289 1.00 0.53 H new ATOM 0 HB1 ALA A 413 -3.113 14.423 -5.299 1.00 0.53 H new ATOM 0 HB2 ALA A 413 -1.448 13.936 -4.901 1.00 0.53 H new ATOM 0 HB3 ALA A 413 -2.666 14.076 -3.612 1.00 0.53 H new ATOM 518 N LEU A 414 -3.362 16.715 -2.546 1.00 0.54 N ATOM 519 CA LEU A 414 -4.504 17.470 -1.962 1.00 0.61 C ATOM 520 C LEU A 414 -4.295 18.975 -2.155 1.00 0.71 C ATOM 521 O LEU A 414 -5.219 19.708 -2.447 1.00 0.82 O ATOM 522 CB LEU A 414 -4.487 17.111 -0.478 1.00 0.63 C ATOM 523 CG LEU A 414 -5.610 16.117 -0.187 1.00 0.71 C ATOM 524 CD1 LEU A 414 -5.145 15.112 0.868 1.00 1.11 C ATOM 525 CD2 LEU A 414 -6.832 16.873 0.335 1.00 1.04 C ATOM 0 H LEU A 414 -2.806 16.185 -1.875 1.00 0.54 H new ATOM 0 HA LEU A 414 -5.455 17.220 -2.433 1.00 0.61 H new ATOM 0 HB2 LEU A 414 -3.524 16.679 -0.208 1.00 0.63 H new ATOM 0 HB3 LEU A 414 -4.614 18.009 0.127 1.00 0.63 H new ATOM 0 HG LEU A 414 -5.871 15.586 -1.102 1.00 0.71 H new ATOM 0 HD11 LEU A 414 -5.947 14.404 1.074 1.00 1.11 H new ATOM 0 HD12 LEU A 414 -4.272 14.574 0.498 1.00 1.11 H new ATOM 0 HD13 LEU A 414 -4.884 15.641 1.784 1.00 1.11 H new ATOM 0 HD21 LEU A 414 -7.635 16.166 0.544 1.00 1.04 H new ATOM 0 HD22 LEU A 414 -6.568 17.403 1.250 1.00 1.04 H new ATOM 0 HD23 LEU A 414 -7.165 17.589 -0.416 1.00 1.04 H new ATOM 537 N ARG A 415 -3.087 19.440 -1.993 1.00 0.73 N ATOM 538 CA ARG A 415 -2.817 20.894 -2.166 1.00 0.86 C ATOM 539 C ARG A 415 -2.459 21.197 -3.623 1.00 0.92 C ATOM 540 O ARG A 415 -1.467 21.839 -3.908 1.00 1.26 O ATOM 541 CB ARG A 415 -1.631 21.190 -1.246 1.00 1.01 C ATOM 542 CG ARG A 415 -2.134 21.403 0.183 1.00 1.40 C ATOM 543 CD ARG A 415 -0.950 21.353 1.153 1.00 1.61 C ATOM 544 NE ARG A 415 -0.023 22.419 0.683 1.00 2.27 N ATOM 545 CZ ARG A 415 1.268 22.243 0.768 1.00 2.92 C ATOM 546 NH1 ARG A 415 1.897 22.551 1.869 1.00 3.32 N ATOM 547 NH2 ARG A 415 1.928 21.760 -0.249 1.00 3.70 N ATOM 0 H ARG A 415 -2.274 18.874 -1.748 1.00 0.73 H new ATOM 0 HA ARG A 415 -3.684 21.507 -1.920 1.00 0.86 H new ATOM 0 HB2 ARG A 415 -0.921 20.364 -1.273 1.00 1.01 H new ATOM 0 HB3 ARG A 415 -1.101 22.077 -1.592 1.00 1.01 H new ATOM 0 HG2 ARG A 415 -2.642 22.364 0.262 1.00 1.40 H new ATOM 0 HG3 ARG A 415 -2.863 20.635 0.442 1.00 1.40 H new ATOM 0 HD2 ARG A 415 -1.272 21.534 2.179 1.00 1.61 H new ATOM 0 HD3 ARG A 415 -0.468 20.376 1.138 1.00 1.61 H new ATOM 0 HE ARG A 415 -0.396 23.286 0.295 1.00 2.27 H new ATOM 0 HH11 ARG A 415 1.380 22.929 2.663 1.00 3.32 H new ATOM 0 HH12 ARG A 415 2.905 22.414 1.936 1.00 3.32 H new ATOM 0 HH21 ARG A 415 1.435 21.520 -1.109 1.00 3.70 H new ATOM 0 HH22 ARG A 415 2.937 21.622 -0.184 1.00 3.70 H new ATOM 561 N SER A 416 -3.258 20.740 -4.547 1.00 0.90 N ATOM 562 CA SER A 416 -2.963 21.002 -5.986 1.00 0.99 C ATOM 563 C SER A 416 -4.139 20.547 -6.856 1.00 0.99 C ATOM 564 O SER A 416 -4.775 21.340 -7.520 1.00 1.63 O ATOM 565 CB SER A 416 -1.716 20.174 -6.292 1.00 1.20 C ATOM 566 OG SER A 416 -1.324 20.395 -7.640 1.00 1.69 O ATOM 0 H SER A 416 -4.103 20.196 -4.369 1.00 0.90 H new ATOM 0 HA SER A 416 -2.807 22.061 -6.191 1.00 0.99 H new ATOM 0 HB2 SER A 416 -0.907 20.451 -5.616 1.00 1.20 H new ATOM 0 HB3 SER A 416 -1.919 19.116 -6.129 1.00 1.20 H new ATOM 0 HG SER A 416 -0.523 19.866 -7.839 1.00 1.69 H new ATOM 572 N GLY A 417 -4.430 19.274 -6.856 1.00 1.06 N ATOM 573 CA GLY A 417 -5.564 18.769 -7.681 1.00 1.06 C ATOM 574 C GLY A 417 -5.723 17.265 -7.459 1.00 0.99 C ATOM 575 O GLY A 417 -5.506 16.469 -8.351 1.00 1.31 O ATOM 0 H GLY A 417 -3.932 18.563 -6.321 1.00 1.06 H new ATOM 0 HA2 GLY A 417 -6.484 19.287 -7.410 1.00 1.06 H new ATOM 0 HA3 GLY A 417 -5.381 18.975 -8.736 1.00 1.06 H new ATOM 579 N HIS A 418 -6.098 16.868 -6.275 1.00 0.78 N ATOM 580 CA HIS A 418 -6.269 15.415 -5.993 1.00 0.87 C ATOM 581 C HIS A 418 -7.520 14.878 -6.695 1.00 0.89 C ATOM 582 O HIS A 418 -8.363 15.629 -7.144 1.00 1.17 O ATOM 583 CB HIS A 418 -6.425 15.326 -4.476 1.00 1.01 C ATOM 584 CG HIS A 418 -7.631 16.117 -4.047 1.00 1.68 C ATOM 585 ND1 HIS A 418 -7.545 17.446 -3.663 1.00 2.18 N ATOM 586 CD2 HIS A 418 -8.958 15.780 -3.937 1.00 2.31 C ATOM 587 CE1 HIS A 418 -8.786 17.857 -3.343 1.00 2.86 C ATOM 588 NE2 HIS A 418 -9.685 16.881 -3.492 1.00 2.97 N ATOM 0 H HIS A 418 -6.294 17.488 -5.489 1.00 0.78 H new ATOM 0 HA HIS A 418 -5.428 14.823 -6.354 1.00 0.87 H new ATOM 0 HB2 HIS A 418 -6.533 14.285 -4.172 1.00 1.01 H new ATOM 0 HB3 HIS A 418 -5.531 15.711 -3.985 1.00 1.01 H new ATOM 0 HD2 HIS A 418 -9.374 14.809 -4.161 1.00 2.31 H new ATOM 0 HE1 HIS A 418 -9.026 18.855 -3.007 1.00 2.86 H new ATOM 0 HE2 HIS A 418 -10.689 16.931 -3.317 1.00 2.97 H new ATOM 596 N GLN A 419 -7.645 13.583 -6.790 1.00 1.08 N ATOM 597 CA GLN A 419 -8.840 12.991 -7.461 1.00 1.25 C ATOM 598 C GLN A 419 -8.859 11.475 -7.248 1.00 1.03 C ATOM 599 O GLN A 419 -9.606 10.962 -6.439 1.00 1.28 O ATOM 600 CB GLN A 419 -8.671 13.330 -8.945 1.00 1.71 C ATOM 601 CG GLN A 419 -9.771 12.642 -9.759 1.00 2.33 C ATOM 602 CD GLN A 419 -10.167 13.530 -10.939 1.00 2.91 C ATOM 603 OE1 GLN A 419 -10.072 14.739 -10.864 1.00 3.29 O ATOM 604 NE2 GLN A 419 -10.611 12.977 -12.035 1.00 3.52 N ATOM 0 H GLN A 419 -6.971 12.907 -6.432 1.00 1.08 H new ATOM 0 HA GLN A 419 -9.778 13.380 -7.064 1.00 1.25 H new ATOM 0 HB2 GLN A 419 -8.719 14.409 -9.089 1.00 1.71 H new ATOM 0 HB3 GLN A 419 -7.690 13.005 -9.293 1.00 1.71 H new ATOM 0 HG2 GLN A 419 -9.420 11.675 -10.120 1.00 2.33 H new ATOM 0 HG3 GLN A 419 -10.639 12.450 -9.128 1.00 2.33 H new ATOM 0 HE21 GLN A 419 -10.691 11.962 -12.098 1.00 3.52 H new ATOM 0 HE22 GLN A 419 -10.878 13.560 -12.828 1.00 3.52 H new ATOM 613 N ASN A 420 -8.039 10.755 -7.964 1.00 0.78 N ATOM 614 CA ASN A 420 -8.008 9.276 -7.799 1.00 0.70 C ATOM 615 C ASN A 420 -7.011 8.894 -6.702 1.00 0.58 C ATOM 616 O ASN A 420 -6.025 8.230 -6.947 1.00 0.71 O ATOM 617 CB ASN A 420 -7.549 8.737 -9.154 1.00 0.86 C ATOM 618 CG ASN A 420 -8.604 9.055 -10.215 1.00 1.35 C ATOM 619 OD1 ASN A 420 -9.783 9.084 -9.924 1.00 1.96 O ATOM 620 ND2 ASN A 420 -8.229 9.298 -11.441 1.00 1.88 N ATOM 0 H ASN A 420 -7.389 11.128 -8.656 1.00 0.78 H new ATOM 0 HA ASN A 420 -8.976 8.869 -7.507 1.00 0.70 H new ATOM 0 HB2 ASN A 420 -6.594 9.184 -9.430 1.00 0.86 H new ATOM 0 HB3 ASN A 420 -7.391 7.660 -9.094 1.00 0.86 H new ATOM 0 HD21 ASN A 420 -8.926 9.512 -12.154 1.00 1.88 H new ATOM 0 HD22 ASN A 420 -7.239 9.274 -11.686 1.00 1.88 H new ATOM 627 N LEU A 421 -7.259 9.319 -5.492 1.00 0.45 N ATOM 628 CA LEU A 421 -6.325 8.988 -4.377 1.00 0.40 C ATOM 629 C LEU A 421 -6.412 7.499 -4.030 1.00 0.39 C ATOM 630 O LEU A 421 -5.482 6.746 -4.241 1.00 0.53 O ATOM 631 CB LEU A 421 -6.802 9.838 -3.198 1.00 0.42 C ATOM 632 CG LEU A 421 -6.136 11.213 -3.256 1.00 0.39 C ATOM 633 CD1 LEU A 421 -7.140 12.285 -2.825 1.00 0.50 C ATOM 634 CD2 LEU A 421 -4.932 11.234 -2.311 1.00 0.41 C ATOM 0 H LEU A 421 -8.068 9.881 -5.228 1.00 0.45 H new ATOM 0 HA LEU A 421 -5.286 9.191 -4.638 1.00 0.40 H new ATOM 0 HB2 LEU A 421 -7.886 9.946 -3.229 1.00 0.42 H new ATOM 0 HB3 LEU A 421 -6.558 9.344 -2.258 1.00 0.42 H new ATOM 0 HG LEU A 421 -5.804 11.414 -4.275 1.00 0.39 H new ATOM 0 HD11 LEU A 421 -6.666 13.265 -2.866 1.00 0.50 H new ATOM 0 HD12 LEU A 421 -7.999 12.269 -3.495 1.00 0.50 H new ATOM 0 HD13 LEU A 421 -7.471 12.085 -1.806 1.00 0.50 H new ATOM 0 HD21 LEU A 421 -4.455 12.213 -2.351 1.00 0.41 H new ATOM 0 HD22 LEU A 421 -5.265 11.033 -1.293 1.00 0.41 H new ATOM 0 HD23 LEU A 421 -4.217 10.470 -2.616 1.00 0.41 H new ATOM 646 N LEU A 422 -7.520 7.071 -3.491 1.00 0.33 N ATOM 647 CA LEU A 422 -7.668 5.633 -3.124 1.00 0.34 C ATOM 648 C LEU A 422 -7.741 4.762 -4.380 1.00 0.35 C ATOM 649 O LEU A 422 -7.357 3.609 -4.370 1.00 0.37 O ATOM 650 CB LEU A 422 -8.983 5.560 -2.348 1.00 0.37 C ATOM 651 CG LEU A 422 -8.719 5.826 -0.865 1.00 0.38 C ATOM 652 CD1 LEU A 422 -10.049 5.901 -0.113 1.00 0.58 C ATOM 653 CD2 LEU A 422 -7.871 4.691 -0.287 1.00 0.63 C ATOM 0 H LEU A 422 -8.331 7.655 -3.288 1.00 0.33 H new ATOM 0 HA LEU A 422 -6.823 5.270 -2.539 1.00 0.34 H new ATOM 0 HB2 LEU A 422 -9.689 6.293 -2.739 1.00 0.37 H new ATOM 0 HB3 LEU A 422 -9.439 4.578 -2.476 1.00 0.37 H new ATOM 0 HG LEU A 422 -8.187 6.771 -0.756 1.00 0.38 H new ATOM 0 HD11 LEU A 422 -9.859 6.091 0.944 1.00 0.58 H new ATOM 0 HD12 LEU A 422 -10.654 6.709 -0.524 1.00 0.58 H new ATOM 0 HD13 LEU A 422 -10.582 4.957 -0.222 1.00 0.58 H new ATOM 0 HD21 LEU A 422 -7.682 4.880 0.770 1.00 0.63 H new ATOM 0 HD22 LEU A 422 -8.403 3.746 -0.398 1.00 0.63 H new ATOM 0 HD23 LEU A 422 -6.922 4.637 -0.821 1.00 0.63 H new ATOM 665 N SER A 423 -8.237 5.302 -5.458 1.00 0.35 N ATOM 666 CA SER A 423 -8.344 4.503 -6.714 1.00 0.38 C ATOM 667 C SER A 423 -6.956 4.236 -7.308 1.00 0.36 C ATOM 668 O SER A 423 -6.793 3.384 -8.159 1.00 0.40 O ATOM 669 CB SER A 423 -9.173 5.368 -7.662 1.00 0.44 C ATOM 670 OG SER A 423 -10.423 5.664 -7.055 1.00 1.23 O ATOM 0 H SER A 423 -8.574 6.263 -5.525 1.00 0.35 H new ATOM 0 HA SER A 423 -8.800 3.529 -6.539 1.00 0.38 H new ATOM 0 HB2 SER A 423 -8.640 6.290 -7.891 1.00 0.44 H new ATOM 0 HB3 SER A 423 -9.329 4.846 -8.606 1.00 0.44 H new ATOM 0 HG SER A 423 -10.957 6.220 -7.660 1.00 1.23 H new ATOM 676 N GLU A 424 -5.957 4.957 -6.877 1.00 0.34 N ATOM 677 CA GLU A 424 -4.589 4.738 -7.430 1.00 0.36 C ATOM 678 C GLU A 424 -3.864 3.637 -6.650 1.00 0.32 C ATOM 679 O GLU A 424 -3.300 2.728 -7.225 1.00 0.33 O ATOM 680 CB GLU A 424 -3.872 6.077 -7.262 1.00 0.38 C ATOM 681 CG GLU A 424 -3.677 6.727 -8.633 1.00 0.58 C ATOM 682 CD GLU A 424 -2.981 8.078 -8.464 1.00 0.81 C ATOM 683 OE1 GLU A 424 -1.768 8.085 -8.339 1.00 1.22 O ATOM 684 OE2 GLU A 424 -3.673 9.083 -8.464 1.00 1.54 O ATOM 0 H GLU A 424 -6.028 5.687 -6.168 1.00 0.34 H new ATOM 0 HA GLU A 424 -4.616 4.418 -8.472 1.00 0.36 H new ATOM 0 HB2 GLU A 424 -4.453 6.734 -6.616 1.00 0.38 H new ATOM 0 HB3 GLU A 424 -2.907 5.927 -6.778 1.00 0.38 H new ATOM 0 HG2 GLU A 424 -3.081 6.077 -9.274 1.00 0.58 H new ATOM 0 HG3 GLU A 424 -4.641 6.862 -9.124 1.00 0.58 H new ATOM 691 N ALA A 425 -3.874 3.710 -5.347 1.00 0.31 N ATOM 692 CA ALA A 425 -3.183 2.664 -4.540 1.00 0.29 C ATOM 693 C ALA A 425 -4.068 1.418 -4.418 1.00 0.28 C ATOM 694 O ALA A 425 -3.597 0.337 -4.124 1.00 0.28 O ATOM 695 CB ALA A 425 -2.958 3.303 -3.168 1.00 0.29 C ATOM 0 H ALA A 425 -4.329 4.446 -4.807 1.00 0.31 H new ATOM 0 HA ALA A 425 -2.246 2.343 -4.996 1.00 0.29 H new ATOM 0 HB1 ALA A 425 -2.452 2.593 -2.514 1.00 0.29 H new ATOM 0 HB2 ALA A 425 -2.343 4.196 -3.279 1.00 0.29 H new ATOM 0 HB3 ALA A 425 -3.919 3.576 -2.732 1.00 0.29 H new ATOM 701 N GLN A 426 -5.346 1.560 -4.646 1.00 0.30 N ATOM 702 CA GLN A 426 -6.263 0.386 -4.549 1.00 0.31 C ATOM 703 C GLN A 426 -5.713 -0.810 -5.343 1.00 0.30 C ATOM 704 O GLN A 426 -5.569 -1.888 -4.802 1.00 0.30 O ATOM 705 CB GLN A 426 -7.584 0.863 -5.153 1.00 0.36 C ATOM 706 CG GLN A 426 -8.634 0.991 -4.046 1.00 0.45 C ATOM 707 CD GLN A 426 -10.006 1.249 -4.670 1.00 0.54 C ATOM 708 OE1 GLN A 426 -10.106 1.845 -5.724 1.00 1.23 O ATOM 709 NE2 GLN A 426 -11.078 0.821 -4.060 1.00 1.09 N ATOM 0 H GLN A 426 -5.796 2.440 -4.896 1.00 0.30 H new ATOM 0 HA GLN A 426 -6.377 0.048 -3.519 1.00 0.31 H new ATOM 0 HB2 GLN A 426 -7.444 1.823 -5.649 1.00 0.36 H new ATOM 0 HB3 GLN A 426 -7.924 0.159 -5.912 1.00 0.36 H new ATOM 0 HG2 GLN A 426 -8.660 0.080 -3.448 1.00 0.45 H new ATOM 0 HG3 GLN A 426 -8.370 1.806 -3.373 1.00 0.45 H new ATOM 0 HE21 GLN A 426 -10.996 0.320 -3.175 1.00 1.09 H new ATOM 0 HE22 GLN A 426 -11.998 0.987 -4.468 1.00 1.09 H new ATOM 718 N PRO A 427 -5.428 -0.589 -6.606 1.00 0.32 N ATOM 719 CA PRO A 427 -4.900 -1.685 -7.458 1.00 0.34 C ATOM 720 C PRO A 427 -3.471 -2.050 -7.047 1.00 0.31 C ATOM 721 O PRO A 427 -3.016 -3.154 -7.270 1.00 0.35 O ATOM 722 CB PRO A 427 -4.937 -1.098 -8.867 1.00 0.39 C ATOM 723 CG PRO A 427 -4.885 0.381 -8.670 1.00 0.38 C ATOM 724 CD PRO A 427 -5.560 0.671 -7.354 1.00 0.35 C ATOM 0 HA PRO A 427 -5.477 -2.606 -7.374 1.00 0.34 H new ATOM 0 HB2 PRO A 427 -4.093 -1.447 -9.462 1.00 0.39 H new ATOM 0 HB3 PRO A 427 -5.844 -1.394 -9.395 1.00 0.39 H new ATOM 0 HG2 PRO A 427 -3.854 0.733 -8.661 1.00 0.38 H new ATOM 0 HG3 PRO A 427 -5.391 0.897 -9.486 1.00 0.38 H new ATOM 0 HD2 PRO A 427 -5.079 1.498 -6.832 1.00 0.35 H new ATOM 0 HD3 PRO A 427 -6.606 0.946 -7.493 1.00 0.35 H new ATOM 732 N GLU A 428 -2.762 -1.138 -6.443 1.00 0.29 N ATOM 733 CA GLU A 428 -1.369 -1.448 -6.016 1.00 0.29 C ATOM 734 C GLU A 428 -1.387 -2.552 -4.957 1.00 0.27 C ATOM 735 O GLU A 428 -0.682 -3.537 -5.059 1.00 0.32 O ATOM 736 CB GLU A 428 -0.831 -0.143 -5.426 1.00 0.29 C ATOM 737 CG GLU A 428 0.258 0.422 -6.340 1.00 0.71 C ATOM 738 CD GLU A 428 1.394 -0.594 -6.469 1.00 1.37 C ATOM 739 OE1 GLU A 428 2.301 -0.546 -5.655 1.00 2.12 O ATOM 740 OE2 GLU A 428 1.338 -1.402 -7.382 1.00 2.07 O ATOM 0 H GLU A 428 -3.085 -0.195 -6.227 1.00 0.29 H new ATOM 0 HA GLU A 428 -0.749 -1.802 -6.840 1.00 0.29 H new ATOM 0 HB2 GLU A 428 -1.640 0.580 -5.317 1.00 0.29 H new ATOM 0 HB3 GLU A 428 -0.427 -0.322 -4.429 1.00 0.29 H new ATOM 0 HG2 GLU A 428 -0.157 0.646 -7.323 1.00 0.71 H new ATOM 0 HG3 GLU A 428 0.638 1.359 -5.934 1.00 0.71 H new ATOM 747 N LEU A 429 -2.194 -2.399 -3.942 1.00 0.26 N ATOM 748 CA LEU A 429 -2.265 -3.444 -2.881 1.00 0.26 C ATOM 749 C LEU A 429 -2.827 -4.741 -3.466 1.00 0.25 C ATOM 750 O LEU A 429 -2.282 -5.809 -3.271 1.00 0.28 O ATOM 751 CB LEU A 429 -3.215 -2.874 -1.825 1.00 0.26 C ATOM 752 CG LEU A 429 -3.437 -3.904 -0.715 1.00 0.29 C ATOM 753 CD1 LEU A 429 -2.545 -3.569 0.481 1.00 0.45 C ATOM 754 CD2 LEU A 429 -4.904 -3.874 -0.279 1.00 0.56 C ATOM 0 H LEU A 429 -2.807 -1.596 -3.802 1.00 0.26 H new ATOM 0 HA LEU A 429 -1.287 -3.679 -2.461 1.00 0.26 H new ATOM 0 HB2 LEU A 429 -2.799 -1.958 -1.405 1.00 0.26 H new ATOM 0 HB3 LEU A 429 -4.168 -2.610 -2.284 1.00 0.26 H new ATOM 0 HG LEU A 429 -3.186 -4.897 -1.087 1.00 0.29 H new ATOM 0 HD11 LEU A 429 -2.704 -4.303 1.271 1.00 0.45 H new ATOM 0 HD12 LEU A 429 -1.500 -3.589 0.172 1.00 0.45 H new ATOM 0 HD13 LEU A 429 -2.794 -2.576 0.854 1.00 0.45 H new ATOM 0 HD21 LEU A 429 -5.064 -4.607 0.512 1.00 0.56 H new ATOM 0 HD22 LEU A 429 -5.153 -2.880 0.092 1.00 0.56 H new ATOM 0 HD23 LEU A 429 -5.541 -4.114 -1.130 1.00 0.56 H new ATOM 766 N GLU A 430 -3.915 -4.655 -4.182 1.00 0.27 N ATOM 767 CA GLU A 430 -4.511 -5.883 -4.779 1.00 0.28 C ATOM 768 C GLU A 430 -3.499 -6.570 -5.700 1.00 0.30 C ATOM 769 O GLU A 430 -3.420 -7.779 -5.756 1.00 0.33 O ATOM 770 CB GLU A 430 -5.716 -5.389 -5.581 1.00 0.30 C ATOM 771 CG GLU A 430 -7.001 -5.706 -4.816 1.00 0.61 C ATOM 772 CD GLU A 430 -7.462 -4.461 -4.055 1.00 1.45 C ATOM 773 OE1 GLU A 430 -8.129 -3.636 -4.658 1.00 2.05 O ATOM 774 OE2 GLU A 430 -7.140 -4.354 -2.883 1.00 2.18 O ATOM 0 H GLU A 430 -4.416 -3.789 -4.379 1.00 0.27 H new ATOM 0 HA GLU A 430 -4.796 -6.613 -4.021 1.00 0.28 H new ATOM 0 HB2 GLU A 430 -5.637 -4.315 -5.752 1.00 0.30 H new ATOM 0 HB3 GLU A 430 -5.736 -5.867 -6.560 1.00 0.30 H new ATOM 0 HG2 GLU A 430 -7.778 -6.031 -5.508 1.00 0.61 H new ATOM 0 HG3 GLU A 430 -6.830 -6.528 -4.121 1.00 0.61 H new ATOM 781 N ARG A 431 -2.726 -5.808 -6.423 1.00 0.33 N ATOM 782 CA ARG A 431 -1.722 -6.423 -7.341 1.00 0.37 C ATOM 783 C ARG A 431 -0.615 -7.113 -6.538 1.00 0.36 C ATOM 784 O ARG A 431 -0.344 -8.283 -6.716 1.00 0.38 O ATOM 785 CB ARG A 431 -1.149 -5.254 -8.141 1.00 0.41 C ATOM 786 CG ARG A 431 -0.358 -5.795 -9.334 1.00 0.59 C ATOM 787 CD ARG A 431 -0.854 -5.133 -10.621 1.00 1.32 C ATOM 788 NE ARG A 431 -0.389 -6.029 -11.717 1.00 1.56 N ATOM 789 CZ ARG A 431 -0.014 -5.522 -12.860 1.00 2.19 C ATOM 790 NH1 ARG A 431 0.878 -4.572 -12.890 1.00 2.87 N ATOM 791 NH2 ARG A 431 -0.532 -5.968 -13.972 1.00 2.78 N ATOM 0 H ARG A 431 -2.745 -4.788 -6.419 1.00 0.33 H new ATOM 0 HA ARG A 431 -2.166 -7.182 -7.984 1.00 0.37 H new ATOM 0 HB2 ARG A 431 -1.954 -4.607 -8.488 1.00 0.41 H new ATOM 0 HB3 ARG A 431 -0.503 -4.647 -7.507 1.00 0.41 H new ATOM 0 HG2 ARG A 431 0.705 -5.598 -9.198 1.00 0.59 H new ATOM 0 HG3 ARG A 431 -0.475 -6.877 -9.401 1.00 0.59 H new ATOM 0 HD2 ARG A 431 -1.940 -5.037 -10.623 1.00 1.32 H new ATOM 0 HD3 ARG A 431 -0.445 -4.129 -10.732 1.00 1.32 H new ATOM 0 HE ARG A 431 -0.364 -7.039 -11.574 1.00 1.56 H new ATOM 0 HH11 ARG A 431 1.283 -4.225 -12.020 1.00 2.87 H new ATOM 0 HH12 ARG A 431 1.171 -4.176 -13.783 1.00 2.87 H new ATOM 0 HH21 ARG A 431 -1.229 -6.712 -13.947 1.00 2.78 H new ATOM 0 HH22 ARG A 431 -0.240 -5.572 -14.866 1.00 2.78 H new ATOM 805 N THR A 432 0.031 -6.394 -5.661 1.00 0.41 N ATOM 806 CA THR A 432 1.128 -7.006 -4.851 1.00 0.45 C ATOM 807 C THR A 432 0.659 -8.315 -4.209 1.00 0.40 C ATOM 808 O THR A 432 1.309 -9.335 -4.311 1.00 0.56 O ATOM 809 CB THR A 432 1.450 -5.968 -3.775 1.00 0.53 C ATOM 810 OG1 THR A 432 1.889 -4.767 -4.395 1.00 0.61 O ATOM 811 CG2 THR A 432 2.550 -6.505 -2.859 1.00 0.62 C ATOM 0 H THR A 432 -0.152 -5.409 -5.469 1.00 0.41 H new ATOM 0 HA THR A 432 1.998 -7.251 -5.460 1.00 0.45 H new ATOM 0 HB THR A 432 0.556 -5.766 -3.184 1.00 0.53 H new ATOM 0 HG1 THR A 432 1.115 -4.198 -4.591 1.00 0.61 H new ATOM 0 HG21 THR A 432 2.779 -5.765 -2.092 1.00 0.62 H new ATOM 0 HG22 THR A 432 2.211 -7.426 -2.384 1.00 0.62 H new ATOM 0 HG23 THR A 432 3.446 -6.708 -3.446 1.00 0.62 H new ATOM 819 N LEU A 433 -0.462 -8.293 -3.543 1.00 0.33 N ATOM 820 CA LEU A 433 -0.966 -9.535 -2.892 1.00 0.30 C ATOM 821 C LEU A 433 -1.408 -10.551 -3.950 1.00 0.27 C ATOM 822 O LEU A 433 -1.059 -11.713 -3.893 1.00 0.25 O ATOM 823 CB LEU A 433 -2.158 -9.084 -2.048 1.00 0.37 C ATOM 824 CG LEU A 433 -2.031 -9.656 -0.634 1.00 0.42 C ATOM 825 CD1 LEU A 433 -2.040 -11.184 -0.699 1.00 0.41 C ATOM 826 CD2 LEU A 433 -0.719 -9.181 -0.005 1.00 0.44 C ATOM 0 H LEU A 433 -1.051 -7.469 -3.421 1.00 0.33 H new ATOM 0 HA LEU A 433 -0.200 -10.023 -2.289 1.00 0.30 H new ATOM 0 HB2 LEU A 433 -2.198 -7.995 -2.009 1.00 0.37 H new ATOM 0 HB3 LEU A 433 -3.088 -9.421 -2.505 1.00 0.37 H new ATOM 0 HG LEU A 433 -2.869 -9.312 -0.028 1.00 0.42 H new ATOM 0 HD11 LEU A 433 -1.950 -11.592 0.308 1.00 0.41 H new ATOM 0 HD12 LEU A 433 -2.975 -11.524 -1.145 1.00 0.41 H new ATOM 0 HD13 LEU A 433 -1.202 -11.527 -1.306 1.00 0.41 H new ATOM 0 HD21 LEU A 433 -0.630 -9.589 1.002 1.00 0.44 H new ATOM 0 HD22 LEU A 433 0.120 -9.523 -0.611 1.00 0.44 H new ATOM 0 HD23 LEU A 433 -0.712 -8.092 0.043 1.00 0.44 H new ATOM 838 N LEU A 434 -2.175 -10.123 -4.916 1.00 0.32 N ATOM 839 CA LEU A 434 -2.637 -11.068 -5.974 1.00 0.32 C ATOM 840 C LEU A 434 -1.439 -11.788 -6.599 1.00 0.29 C ATOM 841 O LEU A 434 -1.457 -12.988 -6.795 1.00 0.30 O ATOM 842 CB LEU A 434 -3.337 -10.191 -7.015 1.00 0.41 C ATOM 843 CG LEU A 434 -3.875 -11.070 -8.144 1.00 0.65 C ATOM 844 CD1 LEU A 434 -5.382 -11.268 -7.962 1.00 0.84 C ATOM 845 CD2 LEU A 434 -3.611 -10.390 -9.490 1.00 1.14 C ATOM 0 H LEU A 434 -2.501 -9.162 -5.019 1.00 0.32 H new ATOM 0 HA LEU A 434 -3.300 -11.837 -5.578 1.00 0.32 H new ATOM 0 HB2 LEU A 434 -4.153 -9.638 -6.550 1.00 0.41 H new ATOM 0 HB3 LEU A 434 -2.639 -9.455 -7.414 1.00 0.41 H new ATOM 0 HG LEU A 434 -3.375 -12.038 -8.120 1.00 0.65 H new ATOM 0 HD11 LEU A 434 -5.766 -11.895 -8.767 1.00 0.84 H new ATOM 0 HD12 LEU A 434 -5.572 -11.751 -7.003 1.00 0.84 H new ATOM 0 HD13 LEU A 434 -5.882 -10.300 -7.986 1.00 0.84 H new ATOM 0 HD21 LEU A 434 -3.994 -11.016 -10.295 1.00 1.14 H new ATOM 0 HD22 LEU A 434 -4.112 -9.422 -9.513 1.00 1.14 H new ATOM 0 HD23 LEU A 434 -2.538 -10.247 -9.621 1.00 1.14 H new ATOM 857 N THR A 435 -0.398 -11.066 -6.913 1.00 0.34 N ATOM 858 CA THR A 435 0.799 -11.711 -7.523 1.00 0.37 C ATOM 859 C THR A 435 1.470 -12.643 -6.511 1.00 0.35 C ATOM 860 O THR A 435 1.865 -13.744 -6.836 1.00 0.39 O ATOM 861 CB THR A 435 1.732 -10.556 -7.888 1.00 0.45 C ATOM 862 OG1 THR A 435 0.981 -9.520 -8.505 1.00 0.52 O ATOM 863 CG2 THR A 435 2.808 -11.053 -8.855 1.00 0.55 C ATOM 0 H THR A 435 -0.325 -10.058 -6.774 1.00 0.34 H new ATOM 0 HA THR A 435 0.543 -12.317 -8.392 1.00 0.37 H new ATOM 0 HB THR A 435 2.207 -10.173 -6.985 1.00 0.45 H new ATOM 0 HG1 THR A 435 0.783 -8.823 -7.846 1.00 0.52 H new ATOM 0 HG21 THR A 435 3.473 -10.229 -9.115 1.00 0.55 H new ATOM 0 HG22 THR A 435 3.384 -11.848 -8.381 1.00 0.55 H new ATOM 0 HG23 THR A 435 2.335 -11.437 -9.759 1.00 0.55 H new ATOM 871 N THR A 436 1.597 -12.214 -5.285 1.00 0.33 N ATOM 872 CA THR A 436 2.241 -13.082 -4.258 1.00 0.36 C ATOM 873 C THR A 436 1.509 -14.423 -4.177 1.00 0.36 C ATOM 874 O THR A 436 2.064 -15.461 -4.473 1.00 0.40 O ATOM 875 CB THR A 436 2.103 -12.311 -2.943 1.00 0.38 C ATOM 876 OG1 THR A 436 2.846 -11.103 -3.024 1.00 0.39 O ATOM 877 CG2 THR A 436 2.638 -13.164 -1.790 1.00 0.49 C ATOM 0 H THR A 436 1.284 -11.303 -4.951 1.00 0.33 H new ATOM 0 HA THR A 436 3.283 -13.300 -4.491 1.00 0.36 H new ATOM 0 HB THR A 436 1.052 -12.081 -2.765 1.00 0.38 H new ATOM 0 HG1 THR A 436 2.344 -10.445 -3.548 1.00 0.39 H new ATOM 0 HG21 THR A 436 2.539 -12.614 -0.854 1.00 0.49 H new ATOM 0 HG22 THR A 436 2.068 -14.091 -1.728 1.00 0.49 H new ATOM 0 HG23 THR A 436 3.689 -13.395 -1.966 1.00 0.49 H new ATOM 885 N ALA A 437 0.264 -14.408 -3.784 1.00 0.34 N ATOM 886 CA ALA A 437 -0.501 -15.685 -3.694 1.00 0.36 C ATOM 887 C ALA A 437 -0.431 -16.426 -5.028 1.00 0.36 C ATOM 888 O ALA A 437 -0.294 -17.633 -5.071 1.00 0.41 O ATOM 889 CB ALA A 437 -1.939 -15.267 -3.382 1.00 0.35 C ATOM 0 H ALA A 437 -0.255 -13.570 -3.522 1.00 0.34 H new ATOM 0 HA ALA A 437 -0.104 -16.357 -2.933 1.00 0.36 H new ATOM 0 HB1 ALA A 437 -2.566 -16.155 -3.300 1.00 0.35 H new ATOM 0 HB2 ALA A 437 -1.962 -14.718 -2.441 1.00 0.35 H new ATOM 0 HB3 ALA A 437 -2.315 -14.630 -4.183 1.00 0.35 H new ATOM 895 N LEU A 438 -0.516 -15.718 -6.122 1.00 0.34 N ATOM 896 CA LEU A 438 -0.441 -16.400 -7.441 1.00 0.36 C ATOM 897 C LEU A 438 0.901 -17.122 -7.562 1.00 0.42 C ATOM 898 O LEU A 438 0.981 -18.216 -8.082 1.00 0.46 O ATOM 899 CB LEU A 438 -0.559 -15.295 -8.495 1.00 0.36 C ATOM 900 CG LEU A 438 -0.298 -15.885 -9.888 1.00 0.41 C ATOM 901 CD1 LEU A 438 -1.239 -17.068 -10.136 1.00 0.42 C ATOM 902 CD2 LEU A 438 -0.547 -14.818 -10.955 1.00 0.45 C ATOM 0 H LEU A 438 -0.633 -14.705 -6.158 1.00 0.34 H new ATOM 0 HA LEU A 438 -1.229 -17.143 -7.567 1.00 0.36 H new ATOM 0 HB2 LEU A 438 -1.552 -14.848 -8.458 1.00 0.36 H new ATOM 0 HB3 LEU A 438 0.157 -14.500 -8.285 1.00 0.36 H new ATOM 0 HG LEU A 438 0.737 -16.223 -9.940 1.00 0.41 H new ATOM 0 HD11 LEU A 438 -1.049 -17.483 -11.126 1.00 0.42 H new ATOM 0 HD12 LEU A 438 -1.065 -17.835 -9.382 1.00 0.42 H new ATOM 0 HD13 LEU A 438 -2.273 -16.729 -10.077 1.00 0.42 H new ATOM 0 HD21 LEU A 438 -0.361 -15.240 -11.942 1.00 0.45 H new ATOM 0 HD22 LEU A 438 -1.581 -14.478 -10.895 1.00 0.45 H new ATOM 0 HD23 LEU A 438 0.123 -13.974 -10.789 1.00 0.45 H new ATOM 914 N ARG A 439 1.960 -16.525 -7.079 1.00 0.43 N ATOM 915 CA ARG A 439 3.290 -17.196 -7.163 1.00 0.51 C ATOM 916 C ARG A 439 3.178 -18.615 -6.606 1.00 0.54 C ATOM 917 O ARG A 439 3.697 -19.559 -7.171 1.00 0.61 O ATOM 918 CB ARG A 439 4.228 -16.346 -6.306 1.00 0.52 C ATOM 919 CG ARG A 439 5.679 -16.715 -6.623 1.00 0.77 C ATOM 920 CD ARG A 439 6.622 -15.719 -5.944 1.00 1.28 C ATOM 921 NE ARG A 439 7.976 -16.058 -6.463 1.00 1.74 N ATOM 922 CZ ARG A 439 8.882 -15.126 -6.579 1.00 2.28 C ATOM 923 NH1 ARG A 439 8.666 -14.099 -7.354 1.00 2.89 N ATOM 924 NH2 ARG A 439 10.004 -15.222 -5.920 1.00 2.82 N ATOM 0 H ARG A 439 1.961 -15.608 -6.633 1.00 0.43 H new ATOM 0 HA ARG A 439 3.656 -17.277 -8.186 1.00 0.51 H new ATOM 0 HB2 ARG A 439 4.059 -15.287 -6.503 1.00 0.52 H new ATOM 0 HB3 ARG A 439 4.022 -16.511 -5.248 1.00 0.52 H new ATOM 0 HG2 ARG A 439 5.892 -17.726 -6.277 1.00 0.77 H new ATOM 0 HG3 ARG A 439 5.840 -16.707 -7.701 1.00 0.77 H new ATOM 0 HD2 ARG A 439 6.352 -14.691 -6.186 1.00 1.28 H new ATOM 0 HD3 ARG A 439 6.580 -15.812 -4.859 1.00 1.28 H new ATOM 0 HE ARG A 439 8.195 -17.018 -6.728 1.00 1.74 H new ATOM 0 HH11 ARG A 439 7.789 -14.024 -7.869 1.00 2.89 H new ATOM 0 HH12 ARG A 439 9.374 -13.371 -7.445 1.00 2.89 H new ATOM 0 HH21 ARG A 439 10.173 -16.025 -5.314 1.00 2.82 H new ATOM 0 HH22 ARG A 439 10.712 -14.494 -6.010 1.00 2.82 H new ATOM 938 N HIS A 440 2.477 -18.779 -5.517 1.00 0.52 N ATOM 939 CA HIS A 440 2.303 -20.143 -4.950 1.00 0.57 C ATOM 940 C HIS A 440 1.668 -21.037 -6.018 1.00 0.58 C ATOM 941 O HIS A 440 1.884 -22.231 -6.064 1.00 0.64 O ATOM 942 CB HIS A 440 1.360 -19.962 -3.758 1.00 0.56 C ATOM 943 CG HIS A 440 1.148 -21.288 -3.083 1.00 0.63 C ATOM 944 ND1 HIS A 440 2.201 -22.123 -2.746 1.00 1.04 N ATOM 945 CD2 HIS A 440 0.009 -21.939 -2.677 1.00 0.82 C ATOM 946 CE1 HIS A 440 1.681 -23.219 -2.164 1.00 0.96 C ATOM 947 NE2 HIS A 440 0.349 -23.158 -2.096 1.00 0.75 N ATOM 0 H HIS A 440 2.019 -18.029 -4.998 1.00 0.52 H new ATOM 0 HA HIS A 440 3.241 -20.606 -4.642 1.00 0.57 H new ATOM 0 HB2 HIS A 440 1.781 -19.246 -3.053 1.00 0.56 H new ATOM 0 HB3 HIS A 440 0.406 -19.556 -4.094 1.00 0.56 H new ATOM 0 HD2 HIS A 440 -0.997 -21.563 -2.791 1.00 0.82 H new ATOM 0 HE1 HIS A 440 2.269 -24.047 -1.797 1.00 0.96 H new ATOM 0 HE2 HIS A 440 -0.284 -23.855 -1.703 1.00 0.75 H new ATOM 955 N THR A 441 0.900 -20.442 -6.892 1.00 0.54 N ATOM 956 CA THR A 441 0.251 -21.213 -7.989 1.00 0.55 C ATOM 957 C THR A 441 0.583 -20.543 -9.326 1.00 0.56 C ATOM 958 O THR A 441 -0.293 -20.256 -10.117 1.00 0.55 O ATOM 959 CB THR A 441 -1.254 -21.134 -7.711 1.00 0.53 C ATOM 960 OG1 THR A 441 -1.702 -19.803 -7.922 1.00 0.48 O ATOM 961 CG2 THR A 441 -1.543 -21.547 -6.266 1.00 0.54 C ATOM 0 H THR A 441 0.693 -19.443 -6.891 1.00 0.54 H new ATOM 0 HA THR A 441 0.590 -22.248 -8.035 1.00 0.55 H new ATOM 0 HB THR A 441 -1.779 -21.810 -8.386 1.00 0.53 H new ATOM 0 HG1 THR A 441 -2.378 -19.794 -8.632 1.00 0.48 H new ATOM 0 HG21 THR A 441 -2.615 -21.488 -6.078 1.00 0.54 H new ATOM 0 HG22 THR A 441 -1.202 -22.570 -6.105 1.00 0.54 H new ATOM 0 HG23 THR A 441 -1.018 -20.878 -5.584 1.00 0.54 H new ATOM 969 N GLN A 442 1.846 -20.273 -9.559 1.00 0.59 N ATOM 970 CA GLN A 442 2.284 -19.596 -10.824 1.00 0.62 C ATOM 971 C GLN A 442 1.479 -20.074 -12.038 1.00 0.64 C ATOM 972 O GLN A 442 1.510 -21.232 -12.403 1.00 0.69 O ATOM 973 CB GLN A 442 3.755 -19.983 -10.980 1.00 0.69 C ATOM 974 CG GLN A 442 4.537 -18.801 -11.559 1.00 1.43 C ATOM 975 CD GLN A 442 4.876 -19.081 -13.025 1.00 1.79 C ATOM 976 OE1 GLN A 442 5.924 -19.618 -13.325 1.00 2.16 O ATOM 977 NE2 GLN A 442 4.029 -18.739 -13.955 1.00 2.47 N ATOM 0 H GLN A 442 2.605 -20.497 -8.915 1.00 0.59 H new ATOM 0 HA GLN A 442 2.130 -18.518 -10.770 1.00 0.62 H new ATOM 0 HB2 GLN A 442 4.171 -20.269 -10.014 1.00 0.69 H new ATOM 0 HB3 GLN A 442 3.846 -20.849 -11.636 1.00 0.69 H new ATOM 0 HG2 GLN A 442 3.948 -17.888 -11.479 1.00 1.43 H new ATOM 0 HG3 GLN A 442 5.451 -18.641 -10.987 1.00 1.43 H new ATOM 0 HE21 GLN A 442 3.149 -18.288 -13.703 1.00 2.47 H new ATOM 0 HE22 GLN A 442 4.246 -18.922 -14.935 1.00 2.47 H new ATOM 986 N GLY A 443 0.765 -19.179 -12.666 1.00 0.63 N ATOM 987 CA GLY A 443 -0.041 -19.566 -13.859 1.00 0.66 C ATOM 988 C GLY A 443 -1.483 -19.849 -13.437 1.00 0.64 C ATOM 989 O GLY A 443 -2.423 -19.421 -14.077 1.00 0.66 O ATOM 0 H GLY A 443 0.705 -18.195 -12.404 1.00 0.63 H new ATOM 0 HA2 GLY A 443 -0.019 -18.767 -14.600 1.00 0.66 H new ATOM 0 HA3 GLY A 443 0.390 -20.449 -14.330 1.00 0.66 H new ATOM 993 N HIS A 444 -1.667 -20.571 -12.366 1.00 0.62 N ATOM 994 CA HIS A 444 -3.051 -20.882 -11.908 1.00 0.62 C ATOM 995 C HIS A 444 -3.653 -19.677 -11.179 1.00 0.67 C ATOM 996 O HIS A 444 -3.683 -19.625 -9.966 1.00 1.34 O ATOM 997 CB HIS A 444 -2.895 -22.067 -10.955 1.00 0.63 C ATOM 998 CG HIS A 444 -2.683 -23.324 -11.751 1.00 0.95 C ATOM 999 ND1 HIS A 444 -1.460 -23.975 -11.796 1.00 1.52 N ATOM 1000 CD2 HIS A 444 -3.529 -24.062 -12.542 1.00 1.62 C ATOM 1001 CE1 HIS A 444 -1.602 -25.052 -12.590 1.00 1.77 C ATOM 1002 NE2 HIS A 444 -2.844 -25.152 -13.071 1.00 1.86 N ATOM 0 H HIS A 444 -0.920 -20.959 -11.789 1.00 0.62 H new ATOM 0 HA HIS A 444 -3.719 -21.113 -12.738 1.00 0.62 H new ATOM 0 HB2 HIS A 444 -2.051 -21.901 -10.286 1.00 0.63 H new ATOM 0 HB3 HIS A 444 -3.783 -22.165 -10.330 1.00 0.63 H new ATOM 0 HD2 HIS A 444 -4.568 -23.832 -12.726 1.00 1.62 H new ATOM 0 HE1 HIS A 444 -0.808 -25.750 -12.811 1.00 1.77 H new ATOM 0 HE2 HIS A 444 -3.212 -25.872 -13.693 1.00 1.86 H new ATOM 1010 N LYS A 445 -4.131 -18.711 -11.913 1.00 0.62 N ATOM 1011 CA LYS A 445 -4.732 -17.509 -11.265 1.00 0.51 C ATOM 1012 C LYS A 445 -5.974 -17.909 -10.463 1.00 0.51 C ATOM 1013 O LYS A 445 -6.305 -17.298 -9.467 1.00 0.57 O ATOM 1014 CB LYS A 445 -5.116 -16.587 -12.424 1.00 0.62 C ATOM 1015 CG LYS A 445 -4.541 -15.191 -12.177 1.00 1.31 C ATOM 1016 CD LYS A 445 -4.802 -14.309 -13.400 1.00 1.56 C ATOM 1017 CE LYS A 445 -5.030 -12.864 -12.948 1.00 2.23 C ATOM 1018 NZ LYS A 445 -4.099 -12.050 -13.777 1.00 2.52 N ATOM 0 H LYS A 445 -4.132 -18.701 -12.933 1.00 0.62 H new ATOM 0 HA LYS A 445 -4.046 -17.026 -10.569 1.00 0.51 H new ATOM 0 HB2 LYS A 445 -4.735 -16.988 -13.363 1.00 0.62 H new ATOM 0 HB3 LYS A 445 -6.201 -16.534 -12.517 1.00 0.62 H new ATOM 0 HG2 LYS A 445 -4.998 -14.749 -11.292 1.00 1.31 H new ATOM 0 HG3 LYS A 445 -3.470 -15.256 -11.984 1.00 1.31 H new ATOM 0 HD2 LYS A 445 -3.955 -14.358 -14.084 1.00 1.56 H new ATOM 0 HD3 LYS A 445 -5.673 -14.673 -13.945 1.00 1.56 H new ATOM 0 HE2 LYS A 445 -6.065 -12.560 -13.104 1.00 2.23 H new ATOM 0 HE3 LYS A 445 -4.819 -12.745 -11.885 1.00 2.23 H new ATOM 0 HZ1 LYS A 445 -4.197 -11.046 -13.525 1.00 2.52 H new ATOM 0 HZ2 LYS A 445 -3.121 -12.357 -13.603 1.00 2.52 H new ATOM 0 HZ3 LYS A 445 -4.328 -12.178 -14.783 1.00 2.52 H new ATOM 1032 N GLN A 446 -6.665 -18.931 -10.892 1.00 0.53 N ATOM 1033 CA GLN A 446 -7.886 -19.369 -10.154 1.00 0.56 C ATOM 1034 C GLN A 446 -7.520 -19.790 -8.729 1.00 0.52 C ATOM 1035 O GLN A 446 -8.167 -19.410 -7.773 1.00 0.51 O ATOM 1036 CB GLN A 446 -8.421 -20.564 -10.944 1.00 0.64 C ATOM 1037 CG GLN A 446 -9.196 -20.063 -12.165 1.00 1.11 C ATOM 1038 CD GLN A 446 -8.338 -20.235 -13.419 1.00 1.79 C ATOM 1039 OE1 GLN A 446 -8.099 -19.288 -14.141 1.00 2.45 O ATOM 1040 NE2 GLN A 446 -7.860 -21.414 -13.710 1.00 2.40 N ATOM 0 H GLN A 446 -6.438 -19.481 -11.720 1.00 0.53 H new ATOM 0 HA GLN A 446 -8.625 -18.572 -10.071 1.00 0.56 H new ATOM 0 HB2 GLN A 446 -7.596 -21.203 -11.260 1.00 0.64 H new ATOM 0 HB3 GLN A 446 -9.070 -21.170 -10.312 1.00 0.64 H new ATOM 0 HG2 GLN A 446 -10.128 -20.618 -12.270 1.00 1.11 H new ATOM 0 HG3 GLN A 446 -9.462 -19.014 -12.035 1.00 1.11 H new ATOM 0 HE21 GLN A 446 -8.061 -22.209 -13.104 1.00 2.40 H new ATOM 0 HE22 GLN A 446 -7.286 -21.540 -14.544 1.00 2.40 H new ATOM 1049 N GLU A 447 -6.483 -20.571 -8.576 1.00 0.52 N ATOM 1050 CA GLU A 447 -6.076 -21.011 -7.209 1.00 0.51 C ATOM 1051 C GLU A 447 -5.942 -19.798 -6.285 1.00 0.45 C ATOM 1052 O GLU A 447 -6.275 -19.854 -5.118 1.00 0.45 O ATOM 1053 CB GLU A 447 -4.720 -21.693 -7.400 1.00 0.53 C ATOM 1054 CG GLU A 447 -4.799 -23.134 -6.892 1.00 0.80 C ATOM 1055 CD GLU A 447 -5.732 -23.943 -7.795 1.00 1.32 C ATOM 1056 OE1 GLU A 447 -5.494 -23.966 -8.992 1.00 2.14 O ATOM 1057 OE2 GLU A 447 -6.669 -24.526 -7.274 1.00 1.96 O ATOM 0 H GLU A 447 -5.901 -20.923 -9.337 1.00 0.52 H new ATOM 0 HA GLU A 447 -6.807 -21.679 -6.754 1.00 0.51 H new ATOM 0 HB2 GLU A 447 -4.440 -21.682 -8.453 1.00 0.53 H new ATOM 0 HB3 GLU A 447 -3.947 -21.147 -6.859 1.00 0.53 H new ATOM 0 HG2 GLU A 447 -3.806 -23.582 -6.883 1.00 0.80 H new ATOM 0 HG3 GLU A 447 -5.165 -23.149 -5.866 1.00 0.80 H new ATOM 1064 N ALA A 448 -5.463 -18.700 -6.801 1.00 0.42 N ATOM 1065 CA ALA A 448 -5.316 -17.482 -5.954 1.00 0.39 C ATOM 1066 C ALA A 448 -6.651 -17.153 -5.281 1.00 0.40 C ATOM 1067 O ALA A 448 -6.699 -16.518 -4.246 1.00 0.40 O ATOM 1068 CB ALA A 448 -4.914 -16.370 -6.923 1.00 0.39 C ATOM 0 H ALA A 448 -5.167 -18.593 -7.771 1.00 0.42 H new ATOM 0 HA ALA A 448 -4.580 -17.612 -5.161 1.00 0.39 H new ATOM 0 HB1 ALA A 448 -4.786 -15.437 -6.374 1.00 0.39 H new ATOM 0 HB2 ALA A 448 -3.976 -16.635 -7.412 1.00 0.39 H new ATOM 0 HB3 ALA A 448 -5.692 -16.244 -7.675 1.00 0.39 H new ATOM 1074 N ALA A 449 -7.736 -17.589 -5.863 1.00 0.44 N ATOM 1075 CA ALA A 449 -9.072 -17.313 -5.262 1.00 0.47 C ATOM 1076 C ALA A 449 -9.092 -17.760 -3.798 1.00 0.48 C ATOM 1077 O ALA A 449 -9.094 -16.952 -2.890 1.00 0.49 O ATOM 1078 CB ALA A 449 -10.052 -18.147 -6.086 1.00 0.52 C ATOM 0 H ALA A 449 -7.754 -18.125 -6.730 1.00 0.44 H new ATOM 0 HA ALA A 449 -9.323 -16.252 -5.276 1.00 0.47 H new ATOM 0 HB1 ALA A 449 -11.063 -18.000 -5.707 1.00 0.52 H new ATOM 0 HB2 ALA A 449 -10.007 -17.835 -7.130 1.00 0.52 H new ATOM 0 HB3 ALA A 449 -9.786 -19.201 -6.010 1.00 0.52 H new ATOM 1084 N ARG A 450 -9.103 -19.044 -3.565 1.00 0.49 N ATOM 1085 CA ARG A 450 -9.119 -19.547 -2.163 1.00 0.52 C ATOM 1086 C ARG A 450 -7.925 -18.981 -1.390 1.00 0.49 C ATOM 1087 O ARG A 450 -8.021 -18.666 -0.221 1.00 0.50 O ATOM 1088 CB ARG A 450 -9.007 -21.067 -2.287 1.00 0.56 C ATOM 1089 CG ARG A 450 -9.884 -21.732 -1.225 1.00 0.78 C ATOM 1090 CD ARG A 450 -10.364 -23.092 -1.737 1.00 1.37 C ATOM 1091 NE ARG A 450 -11.575 -23.402 -0.927 1.00 1.77 N ATOM 1092 CZ ARG A 450 -11.947 -24.642 -0.762 1.00 2.35 C ATOM 1093 NH1 ARG A 450 -12.349 -25.344 -1.785 1.00 2.93 N ATOM 1094 NH2 ARG A 450 -11.917 -25.178 0.427 1.00 2.97 N ATOM 0 H ARG A 450 -9.102 -19.766 -4.285 1.00 0.49 H new ATOM 0 HA ARG A 450 -10.018 -19.249 -1.624 1.00 0.52 H new ATOM 0 HB2 ARG A 450 -9.318 -21.385 -3.282 1.00 0.56 H new ATOM 0 HB3 ARG A 450 -7.969 -21.377 -2.163 1.00 0.56 H new ATOM 0 HG2 ARG A 450 -9.321 -21.858 -0.300 1.00 0.78 H new ATOM 0 HG3 ARG A 450 -10.739 -21.096 -0.994 1.00 0.78 H new ATOM 0 HD2 ARG A 450 -10.600 -23.053 -2.800 1.00 1.37 H new ATOM 0 HD3 ARG A 450 -9.597 -23.856 -1.608 1.00 1.37 H new ATOM 0 HE ARG A 450 -12.113 -22.646 -0.502 1.00 1.77 H new ATOM 0 HH11 ARG A 450 -12.373 -24.924 -2.714 1.00 2.93 H new ATOM 0 HH12 ARG A 450 -12.640 -26.313 -1.656 1.00 2.93 H new ATOM 0 HH21 ARG A 450 -11.603 -24.628 1.227 1.00 2.97 H new ATOM 0 HH22 ARG A 450 -12.208 -26.147 0.557 1.00 2.97 H new ATOM 1108 N LEU A 451 -6.800 -18.848 -2.039 1.00 0.47 N ATOM 1109 CA LEU A 451 -5.600 -18.299 -1.345 1.00 0.47 C ATOM 1110 C LEU A 451 -5.928 -16.938 -0.727 1.00 0.44 C ATOM 1111 O LEU A 451 -5.316 -16.518 0.235 1.00 0.48 O ATOM 1112 CB LEU A 451 -4.545 -18.152 -2.441 1.00 0.46 C ATOM 1113 CG LEU A 451 -3.543 -19.303 -2.344 1.00 0.53 C ATOM 1114 CD1 LEU A 451 -4.085 -20.518 -3.098 1.00 0.92 C ATOM 1115 CD2 LEU A 451 -2.214 -18.871 -2.965 1.00 1.04 C ATOM 0 H LEU A 451 -6.660 -19.095 -3.019 1.00 0.47 H new ATOM 0 HA LEU A 451 -5.258 -18.942 -0.534 1.00 0.47 H new ATOM 0 HB2 LEU A 451 -5.022 -18.153 -3.421 1.00 0.46 H new ATOM 0 HB3 LEU A 451 -4.029 -17.197 -2.338 1.00 0.46 H new ATOM 0 HG LEU A 451 -3.390 -19.565 -1.297 1.00 0.53 H new ATOM 0 HD11 LEU A 451 -3.370 -21.338 -3.028 1.00 0.92 H new ATOM 0 HD12 LEU A 451 -5.034 -20.825 -2.658 1.00 0.92 H new ATOM 0 HD13 LEU A 451 -4.238 -20.258 -4.145 1.00 0.92 H new ATOM 0 HD21 LEU A 451 -1.498 -19.690 -2.897 1.00 1.04 H new ATOM 0 HD22 LEU A 451 -2.369 -18.610 -4.012 1.00 1.04 H new ATOM 0 HD23 LEU A 451 -1.827 -18.005 -2.429 1.00 1.04 H new ATOM 1127 N LEU A 452 -6.888 -16.243 -1.274 1.00 0.42 N ATOM 1128 CA LEU A 452 -7.253 -14.908 -0.718 1.00 0.41 C ATOM 1129 C LEU A 452 -8.712 -14.910 -0.247 1.00 0.46 C ATOM 1130 O LEU A 452 -9.307 -13.869 -0.047 1.00 0.51 O ATOM 1131 CB LEU A 452 -7.075 -13.930 -1.880 1.00 0.37 C ATOM 1132 CG LEU A 452 -5.645 -14.013 -2.416 1.00 0.35 C ATOM 1133 CD1 LEU A 452 -5.655 -13.759 -3.924 1.00 0.31 C ATOM 1134 CD2 LEU A 452 -4.781 -12.953 -1.730 1.00 0.43 C ATOM 0 H LEU A 452 -7.435 -16.541 -2.081 1.00 0.42 H new ATOM 0 HA LEU A 452 -6.638 -14.641 0.141 1.00 0.41 H new ATOM 0 HB2 LEU A 452 -7.784 -14.162 -2.674 1.00 0.37 H new ATOM 0 HB3 LEU A 452 -7.290 -12.914 -1.548 1.00 0.37 H new ATOM 0 HG LEU A 452 -5.237 -15.003 -2.213 1.00 0.35 H new ATOM 0 HD11 LEU A 452 -4.637 -13.817 -4.310 1.00 0.31 H new ATOM 0 HD12 LEU A 452 -6.273 -14.511 -4.415 1.00 0.31 H new ATOM 0 HD13 LEU A 452 -6.062 -12.768 -4.123 1.00 0.31 H new ATOM 0 HD21 LEU A 452 -3.762 -13.012 -2.112 1.00 0.43 H new ATOM 0 HD22 LEU A 452 -5.189 -11.963 -1.935 1.00 0.43 H new ATOM 0 HD23 LEU A 452 -4.776 -13.128 -0.654 1.00 0.43 H new ATOM 1146 N GLY A 453 -9.295 -16.065 -0.073 1.00 0.50 N ATOM 1147 CA GLY A 453 -10.716 -16.119 0.378 1.00 0.56 C ATOM 1148 C GLY A 453 -11.583 -15.299 -0.577 1.00 0.58 C ATOM 1149 O GLY A 453 -12.511 -14.628 -0.171 1.00 0.68 O ATOM 0 H GLY A 453 -8.851 -16.971 -0.223 1.00 0.50 H new ATOM 0 HA2 GLY A 453 -11.062 -17.152 0.404 1.00 0.56 H new ATOM 0 HA3 GLY A 453 -10.802 -15.728 1.392 1.00 0.56 H new ATOM 1153 N TRP A 454 -11.280 -15.344 -1.843 1.00 0.54 N ATOM 1154 CA TRP A 454 -12.078 -14.563 -2.832 1.00 0.60 C ATOM 1155 C TRP A 454 -12.970 -15.492 -3.658 1.00 0.68 C ATOM 1156 O TRP A 454 -14.162 -15.583 -3.442 1.00 1.16 O ATOM 1157 CB TRP A 454 -11.037 -13.897 -3.738 1.00 0.53 C ATOM 1158 CG TRP A 454 -10.628 -12.569 -3.176 1.00 0.53 C ATOM 1159 CD1 TRP A 454 -10.752 -12.187 -1.880 1.00 0.58 C ATOM 1160 CD2 TRP A 454 -10.022 -11.444 -3.876 1.00 0.50 C ATOM 1161 NE1 TRP A 454 -10.263 -10.900 -1.740 1.00 0.58 N ATOM 1162 CE2 TRP A 454 -9.801 -10.395 -2.938 1.00 0.52 C ATOM 1163 CE3 TRP A 454 -9.644 -11.229 -5.228 1.00 0.51 C ATOM 1164 CZ2 TRP A 454 -9.222 -9.174 -3.326 1.00 0.52 C ATOM 1165 CZ3 TRP A 454 -9.062 -9.998 -5.622 1.00 0.53 C ATOM 1166 CH2 TRP A 454 -8.851 -8.974 -4.672 1.00 0.52 C ATOM 0 H TRP A 454 -10.513 -15.888 -2.238 1.00 0.54 H new ATOM 0 HA TRP A 454 -12.733 -13.840 -2.346 1.00 0.60 H new ATOM 0 HB2 TRP A 454 -10.164 -14.542 -3.835 1.00 0.53 H new ATOM 0 HB3 TRP A 454 -11.448 -13.764 -4.739 1.00 0.53 H new ATOM 0 HD1 TRP A 454 -11.166 -12.790 -1.085 1.00 0.58 H new ATOM 0 HE1 TRP A 454 -10.246 -10.387 -0.858 1.00 0.58 H new ATOM 0 HE3 TRP A 454 -9.801 -12.008 -5.960 1.00 0.51 H new ATOM 0 HZ2 TRP A 454 -9.062 -8.393 -2.597 1.00 0.52 H new ATOM 0 HZ3 TRP A 454 -8.779 -9.842 -6.653 1.00 0.53 H new ATOM 0 HH2 TRP A 454 -8.406 -8.038 -4.976 1.00 0.52 H new ATOM 1177 N GLY A 455 -12.396 -16.173 -4.612 1.00 0.72 N ATOM 1178 CA GLY A 455 -13.199 -17.090 -5.470 1.00 0.72 C ATOM 1179 C GLY A 455 -12.876 -16.793 -6.935 1.00 0.70 C ATOM 1180 O GLY A 455 -11.935 -16.090 -7.236 1.00 0.64 O ATOM 0 H GLY A 455 -11.401 -16.133 -4.835 1.00 0.72 H new ATOM 0 HA2 GLY A 455 -12.967 -18.129 -5.234 1.00 0.72 H new ATOM 0 HA3 GLY A 455 -14.263 -16.950 -5.281 1.00 0.72 H new ATOM 1184 N ALA A 456 -13.646 -17.314 -7.849 1.00 0.77 N ATOM 1185 CA ALA A 456 -13.369 -17.043 -9.290 1.00 0.77 C ATOM 1186 C ALA A 456 -14.133 -15.797 -9.740 1.00 0.82 C ATOM 1187 O ALA A 456 -13.665 -15.032 -10.559 1.00 0.83 O ATOM 1188 CB ALA A 456 -13.871 -18.282 -10.032 1.00 0.84 C ATOM 0 H ALA A 456 -14.451 -17.912 -7.664 1.00 0.77 H new ATOM 0 HA ALA A 456 -12.312 -16.858 -9.484 1.00 0.77 H new ATOM 0 HB1 ALA A 456 -13.702 -18.159 -11.102 1.00 0.84 H new ATOM 0 HB2 ALA A 456 -13.332 -19.161 -9.678 1.00 0.84 H new ATOM 0 HB3 ALA A 456 -14.937 -18.411 -9.846 1.00 0.84 H new ATOM 1194 N ALA A 457 -15.305 -15.585 -9.207 1.00 0.90 N ATOM 1195 CA ALA A 457 -16.095 -14.385 -9.602 1.00 0.97 C ATOM 1196 C ALA A 457 -15.419 -13.118 -9.073 1.00 0.89 C ATOM 1197 O ALA A 457 -15.381 -12.099 -9.734 1.00 0.91 O ATOM 1198 CB ALA A 457 -17.464 -14.578 -8.951 1.00 1.08 C ATOM 0 H ALA A 457 -15.749 -16.190 -8.516 1.00 0.90 H new ATOM 0 HA ALA A 457 -16.174 -14.277 -10.684 1.00 0.97 H new ATOM 0 HB1 ALA A 457 -18.106 -13.732 -9.196 1.00 1.08 H new ATOM 0 HB2 ALA A 457 -17.917 -15.497 -9.323 1.00 1.08 H new ATOM 0 HB3 ALA A 457 -17.347 -14.643 -7.869 1.00 1.08 H new ATOM 1204 N THR A 458 -14.878 -13.177 -7.886 1.00 0.84 N ATOM 1205 CA THR A 458 -14.199 -11.978 -7.319 1.00 0.77 C ATOM 1206 C THR A 458 -12.870 -11.743 -8.042 1.00 0.68 C ATOM 1207 O THR A 458 -12.594 -10.662 -8.520 1.00 0.67 O ATOM 1208 CB THR A 458 -13.957 -12.317 -5.846 1.00 0.76 C ATOM 1209 OG1 THR A 458 -15.184 -12.708 -5.246 1.00 0.85 O ATOM 1210 CG2 THR A 458 -13.401 -11.090 -5.122 1.00 0.72 C ATOM 0 H THR A 458 -14.877 -14.002 -7.286 1.00 0.84 H new ATOM 0 HA THR A 458 -14.792 -11.071 -7.433 1.00 0.77 H new ATOM 0 HB THR A 458 -13.239 -13.134 -5.773 1.00 0.76 H new ATOM 0 HG1 THR A 458 -15.032 -12.927 -4.303 1.00 0.85 H new ATOM 0 HG21 THR A 458 -13.229 -11.333 -4.073 1.00 0.72 H new ATOM 0 HG22 THR A 458 -12.460 -10.790 -5.584 1.00 0.72 H new ATOM 0 HG23 THR A 458 -14.117 -10.271 -5.192 1.00 0.72 H new ATOM 1218 N LEU A 459 -12.048 -12.754 -8.130 1.00 0.64 N ATOM 1219 CA LEU A 459 -10.739 -12.596 -8.829 1.00 0.57 C ATOM 1220 C LEU A 459 -10.955 -11.997 -10.221 1.00 0.60 C ATOM 1221 O LEU A 459 -10.103 -11.318 -10.758 1.00 0.58 O ATOM 1222 CB LEU A 459 -10.175 -14.014 -8.932 1.00 0.56 C ATOM 1223 CG LEU A 459 -8.866 -14.104 -8.144 1.00 0.47 C ATOM 1224 CD1 LEU A 459 -8.718 -15.507 -7.558 1.00 0.48 C ATOM 1225 CD2 LEU A 459 -7.688 -13.818 -9.074 1.00 0.46 C ATOM 0 H LEU A 459 -12.226 -13.683 -7.748 1.00 0.64 H new ATOM 0 HA LEU A 459 -10.061 -11.927 -8.299 1.00 0.57 H new ATOM 0 HB2 LEU A 459 -10.896 -14.732 -8.542 1.00 0.56 H new ATOM 0 HB3 LEU A 459 -10.001 -14.272 -9.977 1.00 0.56 H new ATOM 0 HG LEU A 459 -8.880 -13.371 -7.337 1.00 0.47 H new ATOM 0 HD11 LEU A 459 -7.786 -15.570 -6.997 1.00 0.48 H new ATOM 0 HD12 LEU A 459 -9.556 -15.714 -6.893 1.00 0.48 H new ATOM 0 HD13 LEU A 459 -8.706 -16.239 -8.365 1.00 0.48 H new ATOM 0 HD21 LEU A 459 -6.756 -13.882 -8.512 1.00 0.46 H new ATOM 0 HD22 LEU A 459 -7.676 -14.550 -9.881 1.00 0.46 H new ATOM 0 HD23 LEU A 459 -7.790 -12.817 -9.493 1.00 0.46 H new ATOM 1237 N THR A 460 -12.094 -12.246 -10.808 1.00 0.68 N ATOM 1238 CA THR A 460 -12.375 -11.694 -12.163 1.00 0.74 C ATOM 1239 C THR A 460 -13.044 -10.322 -12.049 1.00 0.76 C ATOM 1240 O THR A 460 -12.614 -9.359 -12.652 1.00 0.75 O ATOM 1241 CB THR A 460 -13.323 -12.705 -12.809 1.00 0.83 C ATOM 1242 OG1 THR A 460 -12.653 -13.948 -12.970 1.00 0.82 O ATOM 1243 CG2 THR A 460 -13.775 -12.187 -14.175 1.00 0.92 C ATOM 0 H THR A 460 -12.843 -12.809 -10.406 1.00 0.68 H new ATOM 0 HA THR A 460 -11.467 -11.553 -12.750 1.00 0.74 H new ATOM 0 HB THR A 460 -14.195 -12.842 -12.169 1.00 0.83 H new ATOM 0 HG1 THR A 460 -12.872 -14.537 -12.218 1.00 0.82 H new ATOM 0 HG21 THR A 460 -14.450 -12.910 -14.633 1.00 0.92 H new ATOM 0 HG22 THR A 460 -14.292 -11.235 -14.050 1.00 0.92 H new ATOM 0 HG23 THR A 460 -12.905 -12.046 -14.817 1.00 0.92 H new ATOM 1251 N ALA A 461 -14.095 -10.226 -11.281 1.00 0.81 N ATOM 1252 CA ALA A 461 -14.791 -8.915 -11.130 1.00 0.85 C ATOM 1253 C ALA A 461 -13.860 -7.894 -10.472 1.00 0.79 C ATOM 1254 O ALA A 461 -13.858 -6.729 -10.817 1.00 0.83 O ATOM 1255 CB ALA A 461 -15.992 -9.206 -10.230 1.00 0.92 C ATOM 0 H ALA A 461 -14.502 -10.997 -10.752 1.00 0.81 H new ATOM 0 HA ALA A 461 -15.093 -8.495 -12.089 1.00 0.85 H new ATOM 0 HB1 ALA A 461 -16.558 -8.288 -10.070 1.00 0.92 H new ATOM 0 HB2 ALA A 461 -16.632 -9.949 -10.706 1.00 0.92 H new ATOM 0 HB3 ALA A 461 -15.644 -9.589 -9.271 1.00 0.92 H new ATOM 1261 N LYS A 462 -13.066 -8.322 -9.529 1.00 0.72 N ATOM 1262 CA LYS A 462 -12.135 -7.374 -8.853 1.00 0.68 C ATOM 1263 C LYS A 462 -10.981 -7.005 -9.790 1.00 0.66 C ATOM 1264 O LYS A 462 -10.314 -6.006 -9.602 1.00 0.67 O ATOM 1265 CB LYS A 462 -11.614 -8.131 -7.630 1.00 0.66 C ATOM 1266 CG LYS A 462 -11.358 -7.144 -6.490 1.00 0.99 C ATOM 1267 CD LYS A 462 -12.500 -7.231 -5.475 1.00 0.91 C ATOM 1268 CE LYS A 462 -12.976 -5.820 -5.122 1.00 1.31 C ATOM 1269 NZ LYS A 462 -12.151 -5.419 -3.949 1.00 1.39 N ATOM 0 H LYS A 462 -13.021 -9.286 -9.198 1.00 0.72 H new ATOM 0 HA LYS A 462 -12.627 -6.442 -8.575 1.00 0.68 H new ATOM 0 HB2 LYS A 462 -12.339 -8.883 -7.318 1.00 0.66 H new ATOM 0 HB3 LYS A 462 -10.694 -8.660 -7.881 1.00 0.66 H new ATOM 0 HG2 LYS A 462 -10.408 -7.370 -6.005 1.00 0.99 H new ATOM 0 HG3 LYS A 462 -11.282 -6.130 -6.883 1.00 0.99 H new ATOM 0 HD2 LYS A 462 -13.325 -7.812 -5.888 1.00 0.91 H new ATOM 0 HD3 LYS A 462 -12.164 -7.749 -4.577 1.00 0.91 H new ATOM 0 HE2 LYS A 462 -12.834 -5.135 -5.958 1.00 1.31 H new ATOM 0 HE3 LYS A 462 -14.039 -5.811 -4.879 1.00 1.31 H new ATOM 0 HZ1 LYS A 462 -12.419 -4.460 -3.647 1.00 1.39 H new ATOM 0 HZ2 LYS A 462 -12.312 -6.086 -3.167 1.00 1.39 H new ATOM 0 HZ3 LYS A 462 -11.145 -5.430 -4.212 1.00 1.39 H new ATOM 1283 N LEU A 463 -10.739 -7.800 -10.797 1.00 0.65 N ATOM 1284 CA LEU A 463 -9.628 -7.489 -11.740 1.00 0.65 C ATOM 1285 C LEU A 463 -9.974 -6.256 -12.579 1.00 0.68 C ATOM 1286 O LEU A 463 -9.194 -5.332 -12.694 1.00 0.70 O ATOM 1287 CB LEU A 463 -9.507 -8.725 -12.631 1.00 0.68 C ATOM 1288 CG LEU A 463 -8.041 -8.938 -13.014 1.00 0.81 C ATOM 1289 CD1 LEU A 463 -7.712 -10.430 -12.966 1.00 0.99 C ATOM 1290 CD2 LEU A 463 -7.804 -8.411 -14.432 1.00 0.99 C ATOM 0 H LEU A 463 -11.262 -8.650 -11.007 1.00 0.65 H new ATOM 0 HA LEU A 463 -8.696 -7.268 -11.220 1.00 0.65 H new ATOM 0 HB2 LEU A 463 -9.888 -9.602 -12.108 1.00 0.68 H new ATOM 0 HB3 LEU A 463 -10.114 -8.600 -13.528 1.00 0.68 H new ATOM 0 HG LEU A 463 -7.401 -8.402 -12.313 1.00 0.81 H new ATOM 0 HD11 LEU A 463 -6.668 -10.581 -13.239 1.00 0.99 H new ATOM 0 HD12 LEU A 463 -7.882 -10.808 -11.958 1.00 0.99 H new ATOM 0 HD13 LEU A 463 -8.352 -10.966 -13.667 1.00 0.99 H new ATOM 0 HD21 LEU A 463 -6.760 -8.562 -14.706 1.00 0.99 H new ATOM 0 HD22 LEU A 463 -8.444 -8.948 -15.132 1.00 0.99 H new ATOM 0 HD23 LEU A 463 -8.039 -7.347 -14.469 1.00 0.99 H new ATOM 1302 N LYS A 464 -11.139 -6.234 -13.167 1.00 0.72 N ATOM 1303 CA LYS A 464 -11.534 -5.061 -13.999 1.00 0.77 C ATOM 1304 C LYS A 464 -12.068 -3.935 -13.109 1.00 0.76 C ATOM 1305 O LYS A 464 -12.018 -2.774 -13.464 1.00 0.82 O ATOM 1306 CB LYS A 464 -12.637 -5.584 -14.921 1.00 0.85 C ATOM 1307 CG LYS A 464 -12.183 -5.476 -16.378 1.00 1.20 C ATOM 1308 CD LYS A 464 -12.339 -6.835 -17.063 1.00 1.62 C ATOM 1309 CE LYS A 464 -11.847 -6.739 -18.508 1.00 2.25 C ATOM 1310 NZ LYS A 464 -12.249 -8.029 -19.136 1.00 2.66 N ATOM 0 H LYS A 464 -11.835 -6.978 -13.107 1.00 0.72 H new ATOM 0 HA LYS A 464 -10.694 -4.651 -14.559 1.00 0.77 H new ATOM 0 HB2 LYS A 464 -12.867 -6.621 -14.677 1.00 0.85 H new ATOM 0 HB3 LYS A 464 -13.552 -5.011 -14.771 1.00 0.85 H new ATOM 0 HG2 LYS A 464 -12.775 -4.724 -16.900 1.00 1.20 H new ATOM 0 HG3 LYS A 464 -11.143 -5.151 -16.423 1.00 1.20 H new ATOM 0 HD2 LYS A 464 -11.771 -7.593 -16.524 1.00 1.62 H new ATOM 0 HD3 LYS A 464 -13.384 -7.146 -17.043 1.00 1.62 H new ATOM 0 HE2 LYS A 464 -12.298 -5.891 -19.023 1.00 2.25 H new ATOM 0 HE3 LYS A 464 -10.767 -6.599 -18.549 1.00 2.25 H new ATOM 0 HZ1 LYS A 464 -11.946 -8.040 -20.131 1.00 2.66 H new ATOM 0 HZ2 LYS A 464 -11.799 -8.817 -18.628 1.00 2.66 H new ATOM 0 HZ3 LYS A 464 -13.283 -8.131 -19.088 1.00 2.66 H new ATOM 1324 N GLU A 465 -12.579 -4.269 -11.955 1.00 0.73 N ATOM 1325 CA GLU A 465 -13.115 -3.216 -11.045 1.00 0.76 C ATOM 1326 C GLU A 465 -12.039 -2.163 -10.762 1.00 0.69 C ATOM 1327 O GLU A 465 -12.250 -0.981 -10.946 1.00 0.85 O ATOM 1328 CB GLU A 465 -13.491 -3.954 -9.760 1.00 0.79 C ATOM 1329 CG GLU A 465 -14.986 -4.275 -9.774 1.00 1.12 C ATOM 1330 CD GLU A 465 -15.711 -3.369 -8.777 1.00 1.42 C ATOM 1331 OE1 GLU A 465 -15.609 -2.162 -8.921 1.00 1.95 O ATOM 1332 OE2 GLU A 465 -16.356 -3.897 -7.886 1.00 2.03 O ATOM 0 H GLU A 465 -12.649 -5.224 -11.603 1.00 0.73 H new ATOM 0 HA GLU A 465 -13.967 -2.692 -11.479 1.00 0.76 H new ATOM 0 HB2 GLU A 465 -12.912 -4.873 -9.673 1.00 0.79 H new ATOM 0 HB3 GLU A 465 -13.248 -3.341 -8.892 1.00 0.79 H new ATOM 0 HG2 GLU A 465 -15.391 -4.129 -10.775 1.00 1.12 H new ATOM 0 HG3 GLU A 465 -15.147 -5.321 -9.514 1.00 1.12 H new ATOM 1339 N LEU A 466 -10.888 -2.584 -10.317 1.00 0.56 N ATOM 1340 CA LEU A 466 -9.800 -1.608 -10.023 1.00 0.59 C ATOM 1341 C LEU A 466 -9.445 -0.813 -11.282 1.00 0.70 C ATOM 1342 O LEU A 466 -9.151 0.364 -11.223 1.00 0.81 O ATOM 1343 CB LEU A 466 -8.612 -2.463 -9.581 1.00 0.56 C ATOM 1344 CG LEU A 466 -8.845 -2.968 -8.156 1.00 0.54 C ATOM 1345 CD1 LEU A 466 -7.971 -4.199 -7.902 1.00 0.62 C ATOM 1346 CD2 LEU A 466 -8.476 -1.870 -7.158 1.00 0.52 C ATOM 0 H LEU A 466 -10.653 -3.561 -10.144 1.00 0.56 H new ATOM 0 HA LEU A 466 -10.091 -0.884 -9.262 1.00 0.59 H new ATOM 0 HB2 LEU A 466 -8.485 -3.306 -10.260 1.00 0.56 H new ATOM 0 HB3 LEU A 466 -7.694 -1.878 -9.625 1.00 0.56 H new ATOM 0 HG LEU A 466 -9.895 -3.234 -8.033 1.00 0.54 H new ATOM 0 HD11 LEU A 466 -8.136 -4.559 -6.887 1.00 0.62 H new ATOM 0 HD12 LEU A 466 -8.232 -4.983 -8.613 1.00 0.62 H new ATOM 0 HD13 LEU A 466 -6.921 -3.932 -8.026 1.00 0.62 H new ATOM 0 HD21 LEU A 466 -8.642 -2.230 -6.143 1.00 0.52 H new ATOM 0 HD22 LEU A 466 -7.426 -1.604 -7.281 1.00 0.52 H new ATOM 0 HD23 LEU A 466 -9.096 -0.992 -7.337 1.00 0.52 H new ATOM 1358 N GLY A 467 -9.469 -1.448 -12.422 1.00 0.77 N ATOM 1359 CA GLY A 467 -9.131 -0.731 -13.685 1.00 0.97 C ATOM 1360 C GLY A 467 -10.310 0.141 -14.121 1.00 1.08 C ATOM 1361 O GLY A 467 -10.156 1.066 -14.893 1.00 1.38 O ATOM 0 H GLY A 467 -9.708 -2.433 -12.534 1.00 0.77 H new ATOM 0 HA2 GLY A 467 -8.246 -0.113 -13.537 1.00 0.97 H new ATOM 0 HA3 GLY A 467 -8.890 -1.450 -14.468 1.00 0.97 H new ATOM 1723 N TRP B 402 6.174 -1.371 4.523 1.00 0.95 N ATOM 1724 CA TRP B 402 4.858 -2.051 4.338 1.00 0.86 C ATOM 1725 C TRP B 402 4.933 -3.139 3.263 1.00 0.79 C ATOM 1726 O TRP B 402 4.789 -4.308 3.550 1.00 0.71 O ATOM 1727 CB TRP B 402 3.906 -0.942 3.901 1.00 0.96 C ATOM 1728 CG TRP B 402 2.635 -1.065 4.666 1.00 0.84 C ATOM 1729 CD1 TRP B 402 2.451 -0.629 5.931 1.00 0.94 C ATOM 1730 CD2 TRP B 402 1.376 -1.660 4.246 1.00 0.76 C ATOM 1731 NE1 TRP B 402 1.152 -0.914 6.321 1.00 1.00 N ATOM 1732 CE2 TRP B 402 0.446 -1.550 5.319 1.00 0.83 C ATOM 1733 CE3 TRP B 402 0.948 -2.282 3.044 1.00 0.78 C ATOM 1734 CZ2 TRP B 402 -0.868 -2.043 5.205 1.00 0.83 C ATOM 1735 CZ3 TRP B 402 -0.373 -2.778 2.925 1.00 0.72 C ATOM 1736 CH2 TRP B 402 -1.278 -2.658 4.005 1.00 0.69 C ATOM 0 HA TRP B 402 4.534 -2.550 5.252 1.00 0.86 H new ATOM 0 HB2 TRP B 402 4.359 0.034 4.077 1.00 0.96 H new ATOM 0 HB3 TRP B 402 3.710 -1.014 2.831 1.00 0.96 H new ATOM 0 HD1 TRP B 402 3.196 -0.138 6.540 1.00 0.94 H new ATOM 0 HE1 TRP B 402 0.765 -0.682 7.236 1.00 1.00 H new ATOM 0 HE3 TRP B 402 1.634 -2.378 2.215 1.00 0.78 H new ATOM 0 HZ2 TRP B 402 -1.557 -1.950 6.032 1.00 0.83 H new ATOM 0 HZ3 TRP B 402 -0.690 -3.249 2.007 1.00 0.72 H new ATOM 0 HH2 TRP B 402 -2.284 -3.038 3.910 1.00 0.69 H new ATOM 1747 N ALA B 403 5.148 -2.767 2.028 1.00 0.85 N ATOM 1748 CA ALA B 403 5.221 -3.791 0.939 1.00 0.85 C ATOM 1749 C ALA B 403 6.142 -4.943 1.349 1.00 0.80 C ATOM 1750 O ALA B 403 5.776 -6.098 1.270 1.00 0.76 O ATOM 1751 CB ALA B 403 5.792 -3.048 -0.269 1.00 0.99 C ATOM 0 H ALA B 403 5.276 -1.801 1.725 1.00 0.85 H new ATOM 0 HA ALA B 403 4.247 -4.230 0.723 1.00 0.85 H new ATOM 0 HB1 ALA B 403 5.876 -3.734 -1.112 1.00 0.99 H new ATOM 0 HB2 ALA B 403 5.130 -2.225 -0.536 1.00 0.99 H new ATOM 0 HB3 ALA B 403 6.778 -2.655 -0.021 1.00 0.99 H new ATOM 1757 N THR B 404 7.330 -4.643 1.800 1.00 0.82 N ATOM 1758 CA THR B 404 8.251 -5.734 2.226 1.00 0.81 C ATOM 1759 C THR B 404 7.570 -6.580 3.304 1.00 0.70 C ATOM 1760 O THR B 404 7.703 -7.788 3.339 1.00 0.69 O ATOM 1761 CB THR B 404 9.480 -5.022 2.791 1.00 0.89 C ATOM 1762 OG1 THR B 404 9.971 -4.094 1.834 1.00 1.07 O ATOM 1763 CG2 THR B 404 10.566 -6.051 3.109 1.00 0.89 C ATOM 0 H THR B 404 7.700 -3.697 1.891 1.00 0.82 H new ATOM 0 HA THR B 404 8.520 -6.403 1.409 1.00 0.81 H new ATOM 0 HB THR B 404 9.205 -4.492 3.703 1.00 0.89 H new ATOM 0 HG1 THR B 404 10.758 -3.636 2.196 1.00 1.07 H new ATOM 0 HG21 THR B 404 11.442 -5.543 3.512 1.00 0.89 H new ATOM 0 HG22 THR B 404 10.189 -6.762 3.844 1.00 0.89 H new ATOM 0 HG23 THR B 404 10.842 -6.582 2.198 1.00 0.89 H new ATOM 1771 N LEU B 405 6.831 -5.950 4.177 1.00 0.67 N ATOM 1772 CA LEU B 405 6.126 -6.709 5.250 1.00 0.61 C ATOM 1773 C LEU B 405 4.936 -7.465 4.651 1.00 0.53 C ATOM 1774 O LEU B 405 4.462 -8.434 5.207 1.00 0.52 O ATOM 1775 CB LEU B 405 5.652 -5.632 6.240 1.00 0.67 C ATOM 1776 CG LEU B 405 4.958 -6.263 7.462 1.00 0.64 C ATOM 1777 CD1 LEU B 405 3.547 -6.722 7.079 1.00 0.57 C ATOM 1778 CD2 LEU B 405 5.765 -7.462 7.980 1.00 0.64 C ATOM 0 H LEU B 405 6.685 -4.941 4.193 1.00 0.67 H new ATOM 0 HA LEU B 405 6.761 -7.451 5.734 1.00 0.61 H new ATOM 0 HB2 LEU B 405 6.504 -5.037 6.570 1.00 0.67 H new ATOM 0 HB3 LEU B 405 4.963 -4.952 5.739 1.00 0.67 H new ATOM 0 HG LEU B 405 4.896 -5.513 8.251 1.00 0.64 H new ATOM 0 HD11 LEU B 405 3.061 -7.167 7.947 1.00 0.57 H new ATOM 0 HD12 LEU B 405 2.966 -5.865 6.738 1.00 0.57 H new ATOM 0 HD13 LEU B 405 3.609 -7.460 6.279 1.00 0.57 H new ATOM 0 HD21 LEU B 405 5.260 -7.895 8.843 1.00 0.64 H new ATOM 0 HD22 LEU B 405 5.847 -8.212 7.194 1.00 0.64 H new ATOM 0 HD23 LEU B 405 6.762 -7.131 8.271 1.00 0.64 H new ATOM 1790 N LEU B 406 4.450 -7.023 3.524 1.00 0.53 N ATOM 1791 CA LEU B 406 3.290 -7.706 2.888 1.00 0.50 C ATOM 1792 C LEU B 406 3.771 -8.876 2.028 1.00 0.49 C ATOM 1793 O LEU B 406 3.151 -9.920 1.981 1.00 0.45 O ATOM 1794 CB LEU B 406 2.624 -6.627 2.025 1.00 0.57 C ATOM 1795 CG LEU B 406 1.123 -6.908 1.909 1.00 0.59 C ATOM 1796 CD1 LEU B 406 0.490 -6.937 3.301 1.00 0.94 C ATOM 1797 CD2 LEU B 406 0.458 -5.805 1.083 1.00 1.02 C ATOM 0 H LEU B 406 4.808 -6.215 3.015 1.00 0.53 H new ATOM 0 HA LEU B 406 2.598 -8.123 3.620 1.00 0.50 H new ATOM 0 HB2 LEU B 406 2.786 -5.644 2.467 1.00 0.57 H new ATOM 0 HB3 LEU B 406 3.078 -6.610 1.034 1.00 0.57 H new ATOM 0 HG LEU B 406 0.980 -7.873 1.423 1.00 0.59 H new ATOM 0 HD11 LEU B 406 -0.578 -7.137 3.211 1.00 0.94 H new ATOM 0 HD12 LEU B 406 0.957 -7.721 3.897 1.00 0.94 H new ATOM 0 HD13 LEU B 406 0.639 -5.973 3.788 1.00 0.94 H new ATOM 0 HD21 LEU B 406 -0.610 -6.006 1.001 1.00 1.02 H new ATOM 0 HD22 LEU B 406 0.610 -4.843 1.572 1.00 1.02 H new ATOM 0 HD23 LEU B 406 0.900 -5.780 0.087 1.00 1.02 H new ATOM 1809 N ALA B 407 4.878 -8.717 1.354 1.00 0.56 N ATOM 1810 CA ALA B 407 5.396 -9.828 0.508 1.00 0.59 C ATOM 1811 C ALA B 407 5.869 -10.979 1.399 1.00 0.57 C ATOM 1812 O ALA B 407 5.708 -12.139 1.072 1.00 0.61 O ATOM 1813 CB ALA B 407 6.571 -9.227 -0.265 1.00 0.70 C ATOM 0 H ALA B 407 5.444 -7.868 1.353 1.00 0.56 H new ATOM 0 HA ALA B 407 4.637 -10.230 -0.163 1.00 0.59 H new ATOM 0 HB1 ALA B 407 7.007 -9.987 -0.913 1.00 0.70 H new ATOM 0 HB2 ALA B 407 6.219 -8.392 -0.871 1.00 0.70 H new ATOM 0 HB3 ALA B 407 7.325 -8.873 0.437 1.00 0.70 H new ATOM 1819 N GLN B 408 6.446 -10.667 2.528 1.00 0.57 N ATOM 1820 CA GLN B 408 6.922 -11.740 3.445 1.00 0.57 C ATOM 1821 C GLN B 408 5.753 -12.271 4.279 1.00 0.50 C ATOM 1822 O GLN B 408 5.619 -13.460 4.494 1.00 0.50 O ATOM 1823 CB GLN B 408 7.961 -11.065 4.340 1.00 0.62 C ATOM 1824 CG GLN B 408 9.278 -10.921 3.575 1.00 0.75 C ATOM 1825 CD GLN B 408 10.370 -11.731 4.277 1.00 0.78 C ATOM 1826 OE1 GLN B 408 10.080 -12.626 5.047 1.00 1.29 O ATOM 1827 NE2 GLN B 408 11.622 -11.452 4.043 1.00 1.46 N ATOM 0 H GLN B 408 6.608 -9.714 2.854 1.00 0.57 H new ATOM 0 HA GLN B 408 7.343 -12.590 2.908 1.00 0.57 H new ATOM 0 HB2 GLN B 408 7.603 -10.085 4.656 1.00 0.62 H new ATOM 0 HB3 GLN B 408 8.116 -11.654 5.244 1.00 0.62 H new ATOM 0 HG2 GLN B 408 9.155 -11.270 2.550 1.00 0.75 H new ATOM 0 HG3 GLN B 408 9.567 -9.871 3.522 1.00 0.75 H new ATOM 0 HE21 GLN B 408 11.865 -10.701 3.397 1.00 1.46 H new ATOM 0 HE22 GLN B 408 12.358 -11.985 4.506 1.00 1.46 H new ATOM 1836 N TRP B 409 4.901 -11.397 4.744 1.00 0.46 N ATOM 1837 CA TRP B 409 3.736 -11.850 5.557 1.00 0.43 C ATOM 1838 C TRP B 409 2.855 -12.784 4.718 1.00 0.40 C ATOM 1839 O TRP B 409 2.547 -13.889 5.118 1.00 0.41 O ATOM 1840 CB TRP B 409 2.994 -10.558 5.921 1.00 0.43 C ATOM 1841 CG TRP B 409 1.629 -10.869 6.456 1.00 0.42 C ATOM 1842 CD1 TRP B 409 1.369 -11.445 7.654 1.00 0.50 C ATOM 1843 CD2 TRP B 409 0.339 -10.629 5.826 1.00 0.40 C ATOM 1844 NE1 TRP B 409 -0.002 -11.574 7.802 1.00 0.53 N ATOM 1845 CE2 TRP B 409 -0.684 -11.088 6.705 1.00 0.47 C ATOM 1846 CE3 TRP B 409 -0.044 -10.061 4.585 1.00 0.39 C ATOM 1847 CZ2 TRP B 409 -2.046 -10.986 6.363 1.00 0.50 C ATOM 1848 CZ3 TRP B 409 -1.411 -9.956 4.235 1.00 0.43 C ATOM 1849 CH2 TRP B 409 -2.411 -10.417 5.124 1.00 0.48 C ATOM 0 H TRP B 409 4.962 -10.390 4.596 1.00 0.46 H new ATOM 0 HA TRP B 409 4.024 -12.409 6.447 1.00 0.43 H new ATOM 0 HB2 TRP B 409 3.564 -10.001 6.665 1.00 0.43 H new ATOM 0 HB3 TRP B 409 2.909 -9.920 5.041 1.00 0.43 H new ATOM 0 HD1 TRP B 409 2.110 -11.754 8.376 1.00 0.50 H new ATOM 0 HE1 TRP B 409 -0.453 -11.979 8.622 1.00 0.53 H new ATOM 0 HE3 TRP B 409 0.713 -9.706 3.902 1.00 0.39 H new ATOM 0 HZ2 TRP B 409 -2.806 -11.341 7.044 1.00 0.50 H new ATOM 0 HZ3 TRP B 409 -1.692 -9.523 3.287 1.00 0.43 H new ATOM 0 HH2 TRP B 409 -3.453 -10.333 4.854 1.00 0.48 H new ATOM 1860 N ALA B 410 2.448 -12.347 3.557 1.00 0.42 N ATOM 1861 CA ALA B 410 1.590 -13.208 2.697 1.00 0.44 C ATOM 1862 C ALA B 410 2.255 -14.573 2.493 1.00 0.45 C ATOM 1863 O ALA B 410 1.594 -15.574 2.308 1.00 0.47 O ATOM 1864 CB ALA B 410 1.478 -12.455 1.371 1.00 0.51 C ATOM 0 H ALA B 410 2.673 -11.431 3.168 1.00 0.42 H new ATOM 0 HA ALA B 410 0.611 -13.396 3.139 1.00 0.44 H new ATOM 0 HB1 ALA B 410 0.859 -13.026 0.679 1.00 0.51 H new ATOM 0 HB2 ALA B 410 1.024 -11.479 1.544 1.00 0.51 H new ATOM 0 HB3 ALA B 410 2.472 -12.322 0.943 1.00 0.51 H new ATOM 1870 N ASP B 411 3.558 -14.617 2.532 1.00 0.48 N ATOM 1871 CA ASP B 411 4.267 -15.917 2.349 1.00 0.53 C ATOM 1872 C ASP B 411 4.259 -16.707 3.660 1.00 0.53 C ATOM 1873 O ASP B 411 3.886 -17.862 3.698 1.00 0.58 O ATOM 1874 CB ASP B 411 5.696 -15.538 1.958 1.00 0.60 C ATOM 1875 CG ASP B 411 6.179 -16.456 0.833 1.00 1.03 C ATOM 1876 OD1 ASP B 411 5.919 -17.645 0.912 1.00 1.78 O ATOM 1877 OD2 ASP B 411 6.804 -15.954 -0.087 1.00 1.51 O ATOM 0 H ASP B 411 4.163 -13.810 2.683 1.00 0.48 H new ATOM 0 HA ASP B 411 3.794 -16.546 1.595 1.00 0.53 H new ATOM 0 HB2 ASP B 411 5.732 -14.498 1.633 1.00 0.60 H new ATOM 0 HB3 ASP B 411 6.356 -15.625 2.821 1.00 0.60 H new ATOM 1882 N ARG B 412 4.662 -16.089 4.737 1.00 0.52 N ATOM 1883 CA ARG B 412 4.670 -16.806 6.045 1.00 0.56 C ATOM 1884 C ARG B 412 3.275 -17.352 6.345 1.00 0.55 C ATOM 1885 O ARG B 412 3.119 -18.409 6.922 1.00 0.63 O ATOM 1886 CB ARG B 412 5.072 -15.750 7.076 1.00 0.58 C ATOM 1887 CG ARG B 412 6.598 -15.659 7.144 1.00 0.96 C ATOM 1888 CD ARG B 412 7.023 -15.238 8.553 1.00 1.50 C ATOM 1889 NE ARG B 412 8.349 -14.583 8.375 1.00 1.90 N ATOM 1890 CZ ARG B 412 9.150 -14.445 9.396 1.00 2.41 C ATOM 1891 NH1 ARG B 412 9.676 -15.496 9.961 1.00 2.89 N ATOM 1892 NH2 ARG B 412 9.427 -13.253 9.850 1.00 3.02 N ATOM 0 H ARG B 412 4.985 -15.122 4.768 1.00 0.52 H new ATOM 0 HA ARG B 412 5.354 -17.655 6.052 1.00 0.56 H new ATOM 0 HB2 ARG B 412 4.651 -14.782 6.804 1.00 0.58 H new ATOM 0 HB3 ARG B 412 4.668 -16.010 8.055 1.00 0.58 H new ATOM 0 HG2 ARG B 412 7.042 -16.622 6.891 1.00 0.96 H new ATOM 0 HG3 ARG B 412 6.963 -14.938 6.412 1.00 0.96 H new ATOM 0 HD2 ARG B 412 6.300 -14.552 8.995 1.00 1.50 H new ATOM 0 HD3 ARG B 412 7.094 -16.099 9.218 1.00 1.50 H new ATOM 0 HE ARG B 412 8.631 -14.243 7.456 1.00 1.90 H new ATOM 0 HH11 ARG B 412 9.462 -16.427 9.605 1.00 2.89 H new ATOM 0 HH12 ARG B 412 10.302 -15.387 10.759 1.00 2.89 H new ATOM 0 HH21 ARG B 412 9.018 -12.431 9.407 1.00 3.02 H new ATOM 0 HH22 ARG B 412 10.053 -13.144 10.648 1.00 3.02 H new ATOM 1906 N ALA B 413 2.258 -16.638 5.951 1.00 0.50 N ATOM 1907 CA ALA B 413 0.868 -17.114 6.200 1.00 0.53 C ATOM 1908 C ALA B 413 0.505 -18.200 5.186 1.00 0.57 C ATOM 1909 O ALA B 413 -0.233 -19.119 5.482 1.00 0.66 O ATOM 1910 CB ALA B 413 -0.014 -15.880 6.007 1.00 0.53 C ATOM 0 H ALA B 413 2.329 -15.743 5.466 1.00 0.50 H new ATOM 0 HA ALA B 413 0.745 -17.546 7.193 1.00 0.53 H new ATOM 0 HB1 ALA B 413 -1.057 -16.149 6.174 1.00 0.53 H new ATOM 0 HB2 ALA B 413 0.280 -15.108 6.718 1.00 0.53 H new ATOM 0 HB3 ALA B 413 0.106 -15.502 4.991 1.00 0.53 H new ATOM 1916 N LEU B 414 1.024 -18.100 3.992 1.00 0.54 N ATOM 1917 CA LEU B 414 0.719 -19.123 2.955 1.00 0.62 C ATOM 1918 C LEU B 414 1.263 -20.489 3.382 1.00 0.71 C ATOM 1919 O LEU B 414 0.633 -21.509 3.184 1.00 0.82 O ATOM 1920 CB LEU B 414 1.435 -18.626 1.699 1.00 0.63 C ATOM 1921 CG LEU B 414 0.410 -18.028 0.735 1.00 0.71 C ATOM 1922 CD1 LEU B 414 1.024 -16.824 0.020 1.00 1.11 C ATOM 1923 CD2 LEU B 414 0.010 -19.083 -0.295 1.00 1.03 C ATOM 0 H LEU B 414 1.648 -17.351 3.691 1.00 0.54 H new ATOM 0 HA LEU B 414 -0.352 -19.248 2.795 1.00 0.62 H new ATOM 0 HB2 LEU B 414 2.181 -17.877 1.964 1.00 0.63 H new ATOM 0 HB3 LEU B 414 1.965 -19.449 1.219 1.00 0.63 H new ATOM 0 HG LEU B 414 -0.471 -17.708 1.291 1.00 0.71 H new ATOM 0 HD11 LEU B 414 0.293 -16.398 -0.667 1.00 1.11 H new ATOM 0 HD12 LEU B 414 1.313 -16.073 0.755 1.00 1.11 H new ATOM 0 HD13 LEU B 414 1.904 -17.142 -0.538 1.00 1.11 H new ATOM 0 HD21 LEU B 414 -0.721 -18.660 -0.984 1.00 1.03 H new ATOM 0 HD22 LEU B 414 0.892 -19.401 -0.851 1.00 1.03 H new ATOM 0 HD23 LEU B 414 -0.427 -19.942 0.215 1.00 1.03 H new ATOM 1935 N ARG B 415 2.431 -20.516 3.966 1.00 0.73 N ATOM 1936 CA ARG B 415 3.014 -21.814 4.405 1.00 0.87 C ATOM 1937 C ARG B 415 2.581 -22.131 5.840 1.00 0.93 C ATOM 1938 O ARG B 415 3.392 -22.440 6.689 1.00 1.26 O ATOM 1939 CB ARG B 415 4.528 -21.613 4.333 1.00 1.02 C ATOM 1940 CG ARG B 415 5.004 -21.828 2.895 1.00 1.40 C ATOM 1941 CD ARG B 415 6.430 -21.294 2.742 1.00 1.61 C ATOM 1942 NE ARG B 415 7.230 -22.041 3.752 1.00 2.27 N ATOM 1943 CZ ARG B 415 8.209 -21.447 4.378 1.00 2.92 C ATOM 1944 NH1 ARG B 415 9.401 -21.418 3.848 1.00 3.32 N ATOM 1945 NH2 ARG B 415 7.996 -20.882 5.535 1.00 3.70 N ATOM 0 H ARG B 415 3.005 -19.695 4.157 1.00 0.73 H new ATOM 0 HA ARG B 415 2.684 -22.646 3.783 1.00 0.87 H new ATOM 0 HB2 ARG B 415 4.788 -20.609 4.667 1.00 1.02 H new ATOM 0 HB3 ARG B 415 5.030 -22.312 5.002 1.00 1.02 H new ATOM 0 HG2 ARG B 415 4.973 -22.889 2.646 1.00 1.40 H new ATOM 0 HG3 ARG B 415 4.337 -21.318 2.200 1.00 1.40 H new ATOM 0 HD2 ARG B 415 6.809 -21.463 1.734 1.00 1.61 H new ATOM 0 HD3 ARG B 415 6.471 -20.220 2.922 1.00 1.61 H new ATOM 0 HE ARG B 415 7.013 -23.017 3.954 1.00 2.27 H new ATOM 0 HH11 ARG B 415 9.568 -21.860 2.944 1.00 3.32 H new ATOM 0 HH12 ARG B 415 10.166 -20.954 4.338 1.00 3.32 H new ATOM 0 HH21 ARG B 415 7.064 -20.905 5.950 1.00 3.70 H new ATOM 0 HH22 ARG B 415 8.761 -20.418 6.024 1.00 3.70 H new ATOM 1959 N SER B 416 1.308 -22.058 6.114 1.00 0.90 N ATOM 1960 CA SER B 416 0.823 -22.355 7.492 1.00 0.99 C ATOM 1961 C SER B 416 -0.707 -22.398 7.515 1.00 0.99 C ATOM 1962 O SER B 416 -1.305 -23.420 7.791 1.00 1.63 O ATOM 1963 CB SER B 416 1.338 -21.201 8.351 1.00 1.20 C ATOM 1964 OG SER B 416 0.965 -21.421 9.705 1.00 1.70 O ATOM 0 H SER B 416 0.582 -21.806 5.443 1.00 0.90 H new ATOM 0 HA SER B 416 1.175 -23.321 7.854 1.00 0.99 H new ATOM 0 HB2 SER B 416 2.422 -21.126 8.268 1.00 1.20 H new ATOM 0 HB3 SER B 416 0.925 -20.256 7.997 1.00 1.20 H new ATOM 0 HG SER B 416 1.295 -20.683 10.259 1.00 1.70 H new ATOM 1970 N GLY B 417 -1.345 -21.297 7.225 1.00 1.06 N ATOM 1971 CA GLY B 417 -2.835 -21.275 7.230 1.00 1.06 C ATOM 1972 C GLY B 417 -3.324 -19.890 6.803 1.00 0.99 C ATOM 1973 O GLY B 417 -3.909 -19.161 7.580 1.00 1.31 O ATOM 0 H GLY B 417 -0.899 -20.412 6.985 1.00 1.06 H new ATOM 0 HA2 GLY B 417 -3.223 -22.035 6.552 1.00 1.06 H new ATOM 0 HA3 GLY B 417 -3.210 -21.514 8.225 1.00 1.06 H new ATOM 1977 N HIS B 418 -3.088 -19.520 5.574 1.00 0.78 N ATOM 1978 CA HIS B 418 -3.538 -18.181 5.099 1.00 0.88 C ATOM 1979 C HIS B 418 -5.059 -18.158 4.931 1.00 0.89 C ATOM 1980 O HIS B 418 -5.709 -19.184 4.910 1.00 1.17 O ATOM 1981 CB HIS B 418 -2.846 -17.992 3.748 1.00 1.01 C ATOM 1982 CG HIS B 418 -3.275 -19.083 2.807 1.00 1.69 C ATOM 1983 ND1 HIS B 418 -2.563 -20.264 2.673 1.00 2.18 N ATOM 1984 CD2 HIS B 418 -4.340 -19.186 1.948 1.00 2.31 C ATOM 1985 CE1 HIS B 418 -3.203 -21.021 1.762 1.00 2.86 C ATOM 1986 NE2 HIS B 418 -4.293 -20.412 1.289 1.00 2.97 N ATOM 0 H HIS B 418 -2.603 -20.087 4.878 1.00 0.78 H new ATOM 0 HA HIS B 418 -3.288 -17.387 5.803 1.00 0.88 H new ATOM 0 HB2 HIS B 418 -3.099 -17.017 3.331 1.00 1.01 H new ATOM 0 HB3 HIS B 418 -1.764 -18.012 3.876 1.00 1.01 H new ATOM 0 HD2 HIS B 418 -5.099 -18.431 1.805 1.00 2.31 H new ATOM 0 HE1 HIS B 418 -2.875 -22.002 1.451 1.00 2.86 H new ATOM 0 HE2 HIS B 418 -4.950 -20.768 0.595 1.00 2.97 H new ATOM 1994 N GLN B 419 -5.630 -16.991 4.811 1.00 1.08 N ATOM 1995 CA GLN B 419 -7.108 -16.893 4.643 1.00 1.24 C ATOM 1996 C GLN B 419 -7.499 -15.452 4.303 1.00 1.03 C ATOM 1997 O GLN B 419 -7.790 -15.130 3.169 1.00 1.28 O ATOM 1998 CB GLN B 419 -7.689 -17.309 5.998 1.00 1.71 C ATOM 1999 CG GLN B 419 -9.206 -17.101 5.994 1.00 2.32 C ATOM 2000 CD GLN B 419 -9.872 -18.187 6.840 1.00 2.91 C ATOM 2001 OE1 GLN B 419 -9.361 -19.284 6.954 1.00 3.29 O ATOM 2002 NE2 GLN B 419 -10.999 -17.927 7.443 1.00 3.52 N ATOM 0 H GLN B 419 -5.136 -16.099 4.822 1.00 1.08 H new ATOM 0 HA GLN B 419 -7.480 -17.523 3.835 1.00 1.24 H new ATOM 0 HB2 GLN B 419 -7.456 -18.355 6.199 1.00 1.71 H new ATOM 0 HB3 GLN B 419 -7.234 -16.722 6.796 1.00 1.71 H new ATOM 0 HG2 GLN B 419 -9.450 -16.115 6.391 1.00 2.32 H new ATOM 0 HG3 GLN B 419 -9.586 -17.136 4.973 1.00 2.32 H new ATOM 0 HE21 GLN B 419 -11.428 -17.007 7.348 1.00 3.52 H new ATOM 0 HE22 GLN B 419 -11.451 -18.644 8.010 1.00 3.52 H new ATOM 2011 N ASN B 420 -7.503 -14.583 5.276 1.00 0.78 N ATOM 2012 CA ASN B 420 -7.869 -13.165 5.007 1.00 0.70 C ATOM 2013 C ASN B 420 -6.623 -12.369 4.612 1.00 0.58 C ATOM 2014 O ASN B 420 -6.220 -11.446 5.294 1.00 0.70 O ATOM 2015 CB ASN B 420 -8.444 -12.646 6.324 1.00 0.86 C ATOM 2016 CG ASN B 420 -9.737 -13.399 6.648 1.00 1.35 C ATOM 2017 OD1 ASN B 420 -10.470 -13.780 5.757 1.00 1.96 O ATOM 2018 ND2 ASN B 420 -10.048 -13.631 7.893 1.00 1.87 N ATOM 0 H ASN B 420 -7.268 -14.794 6.246 1.00 0.78 H new ATOM 0 HA ASN B 420 -8.582 -13.068 4.188 1.00 0.70 H new ATOM 0 HB2 ASN B 420 -7.720 -12.782 7.128 1.00 0.86 H new ATOM 0 HB3 ASN B 420 -8.642 -11.577 6.250 1.00 0.86 H new ATOM 0 HD21 ASN B 420 -10.907 -14.133 8.119 1.00 1.87 H new ATOM 0 HD22 ASN B 420 -9.432 -13.311 8.641 1.00 1.87 H new ATOM 2025 N LEU B 421 -6.006 -12.722 3.517 1.00 0.45 N ATOM 2026 CA LEU B 421 -4.782 -11.993 3.077 1.00 0.40 C ATOM 2027 C LEU B 421 -5.142 -10.586 2.591 1.00 0.39 C ATOM 2028 O LEU B 421 -4.792 -9.598 3.204 1.00 0.53 O ATOM 2029 CB LEU B 421 -4.219 -12.827 1.927 1.00 0.42 C ATOM 2030 CG LEU B 421 -3.290 -13.907 2.483 1.00 0.39 C ATOM 2031 CD1 LEU B 421 -3.469 -15.197 1.681 1.00 0.50 C ATOM 2032 CD2 LEU B 421 -1.838 -13.434 2.371 1.00 0.41 C ATOM 0 H LEU B 421 -6.298 -13.486 2.907 1.00 0.45 H new ATOM 0 HA LEU B 421 -4.063 -11.872 3.887 1.00 0.40 H new ATOM 0 HB2 LEU B 421 -5.032 -13.287 1.366 1.00 0.42 H new ATOM 0 HB3 LEU B 421 -3.674 -12.187 1.233 1.00 0.42 H new ATOM 0 HG LEU B 421 -3.533 -14.094 3.529 1.00 0.39 H new ATOM 0 HD11 LEU B 421 -2.807 -15.967 2.077 1.00 0.50 H new ATOM 0 HD12 LEU B 421 -4.503 -15.533 1.758 1.00 0.50 H new ATOM 0 HD13 LEU B 421 -3.225 -15.012 0.635 1.00 0.50 H new ATOM 0 HD21 LEU B 421 -1.174 -14.202 2.767 1.00 0.41 H new ATOM 0 HD22 LEU B 421 -1.595 -13.248 1.325 1.00 0.41 H new ATOM 0 HD23 LEU B 421 -1.710 -12.514 2.942 1.00 0.41 H new ATOM 2044 N LEU B 422 -5.835 -10.490 1.489 1.00 0.33 N ATOM 2045 CA LEU B 422 -6.212 -9.149 0.958 1.00 0.34 C ATOM 2046 C LEU B 422 -7.247 -8.483 1.867 1.00 0.34 C ATOM 2047 O LEU B 422 -7.323 -7.274 1.958 1.00 0.37 O ATOM 2048 CB LEU B 422 -6.814 -9.429 -0.420 1.00 0.37 C ATOM 2049 CG LEU B 422 -5.702 -9.440 -1.471 1.00 0.38 C ATOM 2050 CD1 LEU B 422 -6.281 -9.869 -2.821 1.00 0.59 C ATOM 2051 CD2 LEU B 422 -5.105 -8.038 -1.596 1.00 0.63 C ATOM 0 H LEU B 422 -6.157 -11.283 0.933 1.00 0.33 H new ATOM 0 HA LEU B 422 -5.359 -8.473 0.906 1.00 0.34 H new ATOM 0 HB2 LEU B 422 -7.332 -10.388 -0.414 1.00 0.37 H new ATOM 0 HB3 LEU B 422 -7.554 -8.668 -0.667 1.00 0.37 H new ATOM 0 HG LEU B 422 -4.924 -10.141 -1.169 1.00 0.38 H new ATOM 0 HD11 LEU B 422 -5.489 -9.877 -3.570 1.00 0.59 H new ATOM 0 HD12 LEU B 422 -6.708 -10.868 -2.733 1.00 0.59 H new ATOM 0 HD13 LEU B 422 -7.059 -9.168 -3.123 1.00 0.59 H new ATOM 0 HD21 LEU B 422 -4.313 -8.045 -2.345 1.00 0.63 H new ATOM 0 HD22 LEU B 422 -5.883 -7.337 -1.898 1.00 0.63 H new ATOM 0 HD23 LEU B 422 -4.693 -7.731 -0.635 1.00 0.63 H new ATOM 2063 N SER B 423 -8.048 -9.263 2.538 1.00 0.35 N ATOM 2064 CA SER B 423 -9.085 -8.677 3.438 1.00 0.38 C ATOM 2065 C SER B 423 -8.436 -8.035 4.669 1.00 0.36 C ATOM 2066 O SER B 423 -9.057 -7.267 5.376 1.00 0.39 O ATOM 2067 CB SER B 423 -9.962 -9.858 3.851 1.00 0.44 C ATOM 2068 OG SER B 423 -10.488 -10.483 2.688 1.00 1.23 O ATOM 0 H SER B 423 -8.031 -10.282 2.503 1.00 0.35 H new ATOM 0 HA SER B 423 -9.657 -7.892 2.943 1.00 0.38 H new ATOM 0 HB2 SER B 423 -9.379 -10.574 4.430 1.00 0.44 H new ATOM 0 HB3 SER B 423 -10.774 -9.516 4.493 1.00 0.44 H new ATOM 0 HG SER B 423 -11.050 -11.242 2.950 1.00 1.23 H new ATOM 2074 N GLU B 424 -7.196 -8.345 4.938 1.00 0.34 N ATOM 2075 CA GLU B 424 -6.527 -7.748 6.131 1.00 0.36 C ATOM 2076 C GLU B 424 -5.900 -6.396 5.775 1.00 0.32 C ATOM 2077 O GLU B 424 -6.084 -5.416 6.469 1.00 0.33 O ATOM 2078 CB GLU B 424 -5.445 -8.754 6.525 1.00 0.38 C ATOM 2079 CG GLU B 424 -5.843 -9.444 7.832 1.00 0.57 C ATOM 2080 CD GLU B 424 -4.775 -10.470 8.216 1.00 0.81 C ATOM 2081 OE1 GLU B 424 -3.772 -10.069 8.783 1.00 1.22 O ATOM 2082 OE2 GLU B 424 -4.979 -11.640 7.935 1.00 1.54 O ATOM 0 H GLU B 424 -6.620 -8.982 4.387 1.00 0.34 H new ATOM 0 HA GLU B 424 -7.229 -7.564 6.944 1.00 0.36 H new ATOM 0 HB2 GLU B 424 -5.316 -9.494 5.735 1.00 0.38 H new ATOM 0 HB3 GLU B 424 -4.488 -8.247 6.646 1.00 0.38 H new ATOM 0 HG2 GLU B 424 -5.954 -8.705 8.626 1.00 0.57 H new ATOM 0 HG3 GLU B 424 -6.809 -9.935 7.716 1.00 0.57 H new ATOM 2089 N ALA B 425 -5.161 -6.334 4.701 1.00 0.31 N ATOM 2090 CA ALA B 425 -4.527 -5.041 4.307 1.00 0.29 C ATOM 2091 C ALA B 425 -5.545 -4.145 3.591 1.00 0.28 C ATOM 2092 O ALA B 425 -5.373 -2.946 3.499 1.00 0.28 O ATOM 2093 CB ALA B 425 -3.389 -5.429 3.363 1.00 0.29 C ATOM 0 H ALA B 425 -4.968 -7.120 4.080 1.00 0.31 H new ATOM 0 HA ALA B 425 -4.166 -4.479 5.168 1.00 0.29 H new ATOM 0 HB1 ALA B 425 -2.872 -4.530 3.028 1.00 0.29 H new ATOM 0 HB2 ALA B 425 -2.687 -6.078 3.887 1.00 0.29 H new ATOM 0 HB3 ALA B 425 -3.796 -5.956 2.500 1.00 0.29 H new ATOM 2099 N GLN B 426 -6.604 -4.719 3.086 1.00 0.30 N ATOM 2100 CA GLN B 426 -7.636 -3.905 2.379 1.00 0.31 C ATOM 2101 C GLN B 426 -8.042 -2.682 3.218 1.00 0.30 C ATOM 2102 O GLN B 426 -7.985 -1.566 2.741 1.00 0.30 O ATOM 2103 CB GLN B 426 -8.827 -4.845 2.196 1.00 0.36 C ATOM 2104 CG GLN B 426 -8.977 -5.196 0.715 1.00 0.45 C ATOM 2105 CD GLN B 426 -10.290 -5.948 0.498 1.00 0.53 C ATOM 2106 OE1 GLN B 426 -10.755 -6.648 1.375 1.00 1.23 O ATOM 2107 NE2 GLN B 426 -10.912 -5.834 -0.644 1.00 1.09 N ATOM 0 H GLN B 426 -6.800 -5.719 3.133 1.00 0.30 H new ATOM 0 HA GLN B 426 -7.265 -3.520 1.429 1.00 0.31 H new ATOM 0 HB2 GLN B 426 -8.681 -5.752 2.783 1.00 0.36 H new ATOM 0 HB3 GLN B 426 -9.738 -4.371 2.562 1.00 0.36 H new ATOM 0 HG2 GLN B 426 -8.962 -4.288 0.112 1.00 0.45 H new ATOM 0 HG3 GLN B 426 -8.137 -5.809 0.389 1.00 0.45 H new ATOM 0 HE21 GLN B 426 -10.522 -5.246 -1.381 1.00 1.09 H new ATOM 0 HE22 GLN B 426 -11.788 -6.333 -0.800 1.00 1.09 H new ATOM 2116 N PRO B 427 -8.451 -2.924 4.442 1.00 0.32 N ATOM 2117 CA PRO B 427 -8.876 -1.810 5.328 1.00 0.34 C ATOM 2118 C PRO B 427 -7.672 -0.959 5.742 1.00 0.31 C ATOM 2119 O PRO B 427 -7.806 0.204 6.066 1.00 0.35 O ATOM 2120 CB PRO B 427 -9.492 -2.518 6.532 1.00 0.39 C ATOM 2121 CG PRO B 427 -8.862 -3.872 6.546 1.00 0.38 C ATOM 2122 CD PRO B 427 -8.557 -4.228 5.116 1.00 0.35 C ATOM 0 HA PRO B 427 -9.573 -1.124 4.846 1.00 0.34 H new ATOM 0 HB2 PRO B 427 -9.287 -1.977 7.456 1.00 0.39 H new ATOM 0 HB3 PRO B 427 -10.576 -2.588 6.438 1.00 0.39 H new ATOM 0 HG2 PRO B 427 -7.952 -3.868 7.145 1.00 0.38 H new ATOM 0 HG3 PRO B 427 -9.534 -4.606 6.992 1.00 0.38 H new ATOM 0 HD2 PRO B 427 -7.630 -4.796 5.035 1.00 0.35 H new ATOM 0 HD3 PRO B 427 -9.346 -4.840 4.680 1.00 0.35 H new ATOM 2130 N GLU B 428 -6.496 -1.524 5.728 1.00 0.29 N ATOM 2131 CA GLU B 428 -5.292 -0.734 6.114 1.00 0.29 C ATOM 2132 C GLU B 428 -5.079 0.406 5.116 1.00 0.27 C ATOM 2133 O GLU B 428 -4.913 1.550 5.492 1.00 0.32 O ATOM 2134 CB GLU B 428 -4.129 -1.726 6.055 1.00 0.29 C ATOM 2135 CG GLU B 428 -3.617 -1.998 7.471 1.00 0.71 C ATOM 2136 CD GLU B 428 -3.146 -0.688 8.105 1.00 1.36 C ATOM 2137 OE1 GLU B 428 -1.986 -0.353 7.934 1.00 2.11 O ATOM 2138 OE2 GLU B 428 -3.953 -0.043 8.752 1.00 2.07 O ATOM 0 H GLU B 428 -6.317 -2.494 5.467 1.00 0.29 H new ATOM 0 HA GLU B 428 -5.388 -0.283 7.102 1.00 0.29 H new ATOM 0 HB2 GLU B 428 -4.454 -2.656 5.590 1.00 0.29 H new ATOM 0 HB3 GLU B 428 -3.326 -1.324 5.437 1.00 0.29 H new ATOM 0 HG2 GLU B 428 -4.407 -2.443 8.075 1.00 0.71 H new ATOM 0 HG3 GLU B 428 -2.797 -2.715 7.441 1.00 0.71 H new ATOM 2145 N LEU B 429 -5.089 0.104 3.847 1.00 0.25 N ATOM 2146 CA LEU B 429 -4.897 1.171 2.823 1.00 0.26 C ATOM 2147 C LEU B 429 -6.074 2.146 2.864 1.00 0.25 C ATOM 2148 O LEU B 429 -5.898 3.348 2.895 1.00 0.28 O ATOM 2149 CB LEU B 429 -4.854 0.431 1.484 1.00 0.26 C ATOM 2150 CG LEU B 429 -4.749 1.441 0.337 1.00 0.29 C ATOM 2151 CD1 LEU B 429 -3.297 1.540 -0.127 1.00 0.45 C ATOM 2152 CD2 LEU B 429 -5.622 0.975 -0.831 1.00 0.56 C ATOM 0 H LEU B 429 -5.222 -0.836 3.474 1.00 0.25 H new ATOM 0 HA LEU B 429 -3.992 1.755 2.991 1.00 0.26 H new ATOM 0 HB2 LEU B 429 -4.003 -0.249 1.461 1.00 0.26 H new ATOM 0 HB3 LEU B 429 -5.751 -0.177 1.365 1.00 0.26 H new ATOM 0 HG LEU B 429 -5.088 2.418 0.683 1.00 0.29 H new ATOM 0 HD11 LEU B 429 -3.224 2.259 -0.943 1.00 0.45 H new ATOM 0 HD12 LEU B 429 -2.671 1.868 0.703 1.00 0.45 H new ATOM 0 HD13 LEU B 429 -2.958 0.563 -0.473 1.00 0.45 H new ATOM 0 HD21 LEU B 429 -5.549 1.692 -1.649 1.00 0.56 H new ATOM 0 HD22 LEU B 429 -5.280 -0.002 -1.174 1.00 0.56 H new ATOM 0 HD23 LEU B 429 -6.659 0.902 -0.504 1.00 0.56 H new ATOM 2164 N GLU B 430 -7.275 1.638 2.863 1.00 0.26 N ATOM 2165 CA GLU B 430 -8.465 2.534 2.900 1.00 0.28 C ATOM 2166 C GLU B 430 -8.422 3.415 4.151 1.00 0.30 C ATOM 2167 O GLU B 430 -8.788 4.572 4.117 1.00 0.33 O ATOM 2168 CB GLU B 430 -9.669 1.593 2.948 1.00 0.30 C ATOM 2169 CG GLU B 430 -10.336 1.548 1.572 1.00 0.61 C ATOM 2170 CD GLU B 430 -9.862 0.307 0.815 1.00 1.45 C ATOM 2171 OE1 GLU B 430 -10.436 -0.748 1.027 1.00 2.05 O ATOM 2172 OE2 GLU B 430 -8.932 0.433 0.035 1.00 2.17 O ATOM 0 H GLU B 430 -7.484 0.640 2.838 1.00 0.26 H new ATOM 0 HA GLU B 430 -8.506 3.203 2.040 1.00 0.28 H new ATOM 0 HB2 GLU B 430 -9.351 0.593 3.243 1.00 0.30 H new ATOM 0 HB3 GLU B 430 -10.382 1.935 3.698 1.00 0.30 H new ATOM 0 HG2 GLU B 430 -11.420 1.528 1.682 1.00 0.61 H new ATOM 0 HG3 GLU B 430 -10.090 2.447 1.007 1.00 0.61 H new ATOM 2179 N ARG B 431 -7.981 2.879 5.255 1.00 0.33 N ATOM 2180 CA ARG B 431 -7.921 3.690 6.506 1.00 0.37 C ATOM 2181 C ARG B 431 -6.854 4.781 6.384 1.00 0.36 C ATOM 2182 O ARG B 431 -7.127 5.951 6.557 1.00 0.38 O ATOM 2183 CB ARG B 431 -7.543 2.695 7.605 1.00 0.41 C ATOM 2184 CG ARG B 431 -7.774 3.340 8.973 1.00 0.59 C ATOM 2185 CD ARG B 431 -8.650 2.423 9.831 1.00 1.32 C ATOM 2186 NE ARG B 431 -9.193 3.304 10.902 1.00 1.56 N ATOM 2187 CZ ARG B 431 -9.372 2.833 12.106 1.00 2.19 C ATOM 2188 NH1 ARG B 431 -8.394 2.227 12.722 1.00 2.87 N ATOM 2189 NH2 ARG B 431 -10.530 2.969 12.694 1.00 2.78 N ATOM 0 H ARG B 431 -7.659 1.915 5.346 1.00 0.33 H new ATOM 0 HA ARG B 431 -8.865 4.193 6.715 1.00 0.37 H new ATOM 0 HB2 ARG B 431 -8.141 1.788 7.512 1.00 0.41 H new ATOM 0 HB3 ARG B 431 -6.499 2.400 7.501 1.00 0.41 H new ATOM 0 HG2 ARG B 431 -6.820 3.517 9.469 1.00 0.59 H new ATOM 0 HG3 ARG B 431 -8.255 4.311 8.852 1.00 0.59 H new ATOM 0 HD2 ARG B 431 -9.451 1.978 9.242 1.00 1.32 H new ATOM 0 HD3 ARG B 431 -8.069 1.602 10.251 1.00 1.32 H new ATOM 0 HE ARG B 431 -9.425 4.275 10.695 1.00 1.56 H new ATOM 0 HH11 ARG B 431 -7.489 2.121 12.263 1.00 2.87 H new ATOM 0 HH12 ARG B 431 -8.534 1.859 13.663 1.00 2.87 H new ATOM 0 HH21 ARG B 431 -11.294 3.443 12.212 1.00 2.78 H new ATOM 0 HH22 ARG B 431 -10.671 2.601 13.635 1.00 2.78 H new ATOM 2203 N THR B 432 -5.638 4.405 6.093 1.00 0.41 N ATOM 2204 CA THR B 432 -4.549 5.419 5.967 1.00 0.45 C ATOM 2205 C THR B 432 -4.980 6.563 5.044 1.00 0.40 C ATOM 2206 O THR B 432 -4.870 7.724 5.385 1.00 0.56 O ATOM 2207 CB THR B 432 -3.370 4.659 5.359 1.00 0.53 C ATOM 2208 OG1 THR B 432 -2.984 3.608 6.234 1.00 0.61 O ATOM 2209 CG2 THR B 432 -2.195 5.616 5.155 1.00 0.62 C ATOM 0 H THR B 432 -5.350 3.439 5.937 1.00 0.41 H new ATOM 0 HA THR B 432 -4.298 5.869 6.927 1.00 0.45 H new ATOM 0 HB THR B 432 -3.664 4.240 4.397 1.00 0.53 H new ATOM 0 HG1 THR B 432 -3.501 2.802 6.025 1.00 0.61 H new ATOM 0 HG21 THR B 432 -1.355 5.073 4.722 1.00 0.62 H new ATOM 0 HG22 THR B 432 -2.493 6.420 4.483 1.00 0.62 H new ATOM 0 HG23 THR B 432 -1.898 6.037 6.115 1.00 0.62 H new ATOM 2217 N LEU B 433 -5.464 6.245 3.876 1.00 0.33 N ATOM 2218 CA LEU B 433 -5.895 7.316 2.932 1.00 0.30 C ATOM 2219 C LEU B 433 -7.150 8.018 3.460 1.00 0.27 C ATOM 2220 O LEU B 433 -7.228 9.231 3.487 1.00 0.25 O ATOM 2221 CB LEU B 433 -6.194 6.588 1.621 1.00 0.37 C ATOM 2222 CG LEU B 433 -5.501 7.312 0.464 1.00 0.42 C ATOM 2223 CD1 LEU B 433 -6.043 8.738 0.359 1.00 0.41 C ATOM 2224 CD2 LEU B 433 -3.992 7.359 0.718 1.00 0.44 C ATOM 0 H LEU B 433 -5.580 5.291 3.534 1.00 0.33 H new ATOM 0 HA LEU B 433 -5.135 8.087 2.806 1.00 0.30 H new ATOM 0 HB2 LEU B 433 -5.847 5.556 1.678 1.00 0.37 H new ATOM 0 HB3 LEU B 433 -7.270 6.553 1.450 1.00 0.37 H new ATOM 0 HG LEU B 433 -5.696 6.778 -0.466 1.00 0.42 H new ATOM 0 HD11 LEU B 433 -5.550 9.255 -0.465 1.00 0.41 H new ATOM 0 HD12 LEU B 433 -7.117 8.706 0.177 1.00 0.41 H new ATOM 0 HD13 LEU B 433 -5.848 9.271 1.290 1.00 0.41 H new ATOM 0 HD21 LEU B 433 -3.500 7.875 -0.107 1.00 0.44 H new ATOM 0 HD22 LEU B 433 -3.796 7.892 1.648 1.00 0.44 H new ATOM 0 HD23 LEU B 433 -3.604 6.343 0.794 1.00 0.44 H new ATOM 2236 N LEU B 434 -8.133 7.268 3.877 1.00 0.32 N ATOM 2237 CA LEU B 434 -9.381 7.897 4.400 1.00 0.32 C ATOM 2238 C LEU B 434 -9.043 8.899 5.506 1.00 0.29 C ATOM 2239 O LEU B 434 -9.558 10.000 5.538 1.00 0.30 O ATOM 2240 CB LEU B 434 -10.207 6.739 4.961 1.00 0.41 C ATOM 2241 CG LEU B 434 -11.532 7.272 5.509 1.00 0.65 C ATOM 2242 CD1 LEU B 434 -12.651 6.985 4.506 1.00 0.84 C ATOM 2243 CD2 LEU B 434 -11.850 6.580 6.836 1.00 1.14 C ATOM 0 H LEU B 434 -8.127 6.248 3.879 1.00 0.32 H new ATOM 0 HA LEU B 434 -9.921 8.445 3.628 1.00 0.32 H new ATOM 0 HB2 LEU B 434 -10.395 6.002 4.181 1.00 0.41 H new ATOM 0 HB3 LEU B 434 -9.652 6.233 5.751 1.00 0.41 H new ATOM 0 HG LEU B 434 -11.452 8.347 5.668 1.00 0.65 H new ATOM 0 HD11 LEU B 434 -13.595 7.365 4.896 1.00 0.84 H new ATOM 0 HD12 LEU B 434 -12.426 7.476 3.559 1.00 0.84 H new ATOM 0 HD13 LEU B 434 -12.730 5.910 4.347 1.00 0.84 H new ATOM 0 HD21 LEU B 434 -12.794 6.959 7.227 1.00 1.14 H new ATOM 0 HD22 LEU B 434 -11.929 5.505 6.676 1.00 1.14 H new ATOM 0 HD23 LEU B 434 -11.053 6.782 7.552 1.00 1.14 H new ATOM 2255 N THR B 435 -8.181 8.528 6.413 1.00 0.34 N ATOM 2256 CA THR B 435 -7.812 9.462 7.515 1.00 0.37 C ATOM 2257 C THR B 435 -7.044 10.661 6.955 1.00 0.35 C ATOM 2258 O THR B 435 -7.280 11.791 7.330 1.00 0.39 O ATOM 2259 CB THR B 435 -6.922 8.643 8.450 1.00 0.45 C ATOM 2260 OG1 THR B 435 -7.501 7.360 8.649 1.00 0.52 O ATOM 2261 CG2 THR B 435 -6.794 9.361 9.795 1.00 0.55 C ATOM 0 H THR B 435 -7.717 7.620 6.439 1.00 0.34 H new ATOM 0 HA THR B 435 -8.687 9.858 8.031 1.00 0.37 H new ATOM 0 HB THR B 435 -5.933 8.531 8.005 1.00 0.45 H new ATOM 0 HG1 THR B 435 -7.051 6.705 8.075 1.00 0.52 H new ATOM 0 HG21 THR B 435 -6.159 8.776 10.461 1.00 0.55 H new ATOM 0 HG22 THR B 435 -6.350 10.345 9.642 1.00 0.55 H new ATOM 0 HG23 THR B 435 -7.782 9.475 10.242 1.00 0.55 H new ATOM 2269 N THR B 436 -6.127 10.424 6.056 1.00 0.33 N ATOM 2270 CA THR B 436 -5.350 11.554 5.474 1.00 0.36 C ATOM 2271 C THR B 436 -6.302 12.584 4.865 1.00 0.36 C ATOM 2272 O THR B 436 -6.377 13.712 5.308 1.00 0.40 O ATOM 2273 CB THR B 436 -4.475 10.920 4.390 1.00 0.38 C ATOM 2274 OG1 THR B 436 -3.558 10.017 4.992 1.00 0.39 O ATOM 2275 CG2 THR B 436 -3.704 12.014 3.648 1.00 0.49 C ATOM 0 H THR B 436 -5.883 9.499 5.701 1.00 0.33 H new ATOM 0 HA THR B 436 -4.752 12.075 6.222 1.00 0.36 H new ATOM 0 HB THR B 436 -5.106 10.381 3.683 1.00 0.38 H new ATOM 0 HG1 THR B 436 -3.928 9.110 4.966 1.00 0.39 H new ATOM 0 HG21 THR B 436 -3.081 11.561 2.876 1.00 0.49 H new ATOM 0 HG22 THR B 436 -4.408 12.706 3.186 1.00 0.49 H new ATOM 0 HG23 THR B 436 -3.072 12.555 4.352 1.00 0.49 H new ATOM 2283 N ALA B 437 -7.036 12.204 3.855 1.00 0.34 N ATOM 2284 CA ALA B 437 -7.988 13.165 3.227 1.00 0.36 C ATOM 2285 C ALA B 437 -8.916 13.747 4.293 1.00 0.36 C ATOM 2286 O ALA B 437 -9.226 14.922 4.281 1.00 0.41 O ATOM 2287 CB ALA B 437 -8.780 12.340 2.213 1.00 0.35 C ATOM 0 H ALA B 437 -7.018 11.273 3.438 1.00 0.34 H new ATOM 0 HA ALA B 437 -7.479 14.004 2.752 1.00 0.36 H new ATOM 0 HB1 ALA B 437 -9.504 12.980 1.709 1.00 0.35 H new ATOM 0 HB2 ALA B 437 -8.097 11.914 1.478 1.00 0.35 H new ATOM 0 HB3 ALA B 437 -9.305 11.536 2.729 1.00 0.35 H new ATOM 2293 N LEU B 438 -9.354 12.941 5.222 1.00 0.34 N ATOM 2294 CA LEU B 438 -10.250 13.473 6.284 1.00 0.36 C ATOM 2295 C LEU B 438 -9.523 14.575 7.054 1.00 0.42 C ATOM 2296 O LEU B 438 -10.107 15.576 7.417 1.00 0.46 O ATOM 2297 CB LEU B 438 -10.563 12.287 7.203 1.00 0.36 C ATOM 2298 CG LEU B 438 -11.327 12.783 8.438 1.00 0.41 C ATOM 2299 CD1 LEU B 438 -12.571 13.563 8.003 1.00 0.42 C ATOM 2300 CD2 LEU B 438 -11.762 11.589 9.290 1.00 0.45 C ATOM 0 H LEU B 438 -9.132 11.948 5.290 1.00 0.34 H new ATOM 0 HA LEU B 438 -11.165 13.903 5.876 1.00 0.36 H new ATOM 0 HB2 LEU B 438 -11.157 11.546 6.668 1.00 0.36 H new ATOM 0 HB3 LEU B 438 -9.639 11.795 7.507 1.00 0.36 H new ATOM 0 HG LEU B 438 -10.673 13.432 9.019 1.00 0.41 H new ATOM 0 HD11 LEU B 438 -13.108 13.912 8.885 1.00 0.42 H new ATOM 0 HD12 LEU B 438 -12.271 14.419 7.399 1.00 0.42 H new ATOM 0 HD13 LEU B 438 -13.220 12.914 7.416 1.00 0.42 H new ATOM 0 HD21 LEU B 438 -12.304 11.945 10.166 1.00 0.45 H new ATOM 0 HD22 LEU B 438 -12.410 10.939 8.702 1.00 0.45 H new ATOM 0 HD23 LEU B 438 -10.882 11.031 9.610 1.00 0.45 H new ATOM 2312 N ARG B 439 -8.250 14.409 7.300 1.00 0.43 N ATOM 2313 CA ARG B 439 -7.495 15.463 8.038 1.00 0.50 C ATOM 2314 C ARG B 439 -7.736 16.819 7.372 1.00 0.54 C ATOM 2315 O ARG B 439 -7.961 17.816 8.029 1.00 0.60 O ATOM 2316 CB ARG B 439 -6.024 15.059 7.935 1.00 0.52 C ATOM 2317 CG ARG B 439 -5.207 15.845 8.962 1.00 0.77 C ATOM 2318 CD ARG B 439 -3.784 15.286 9.024 1.00 1.27 C ATOM 2319 NE ARG B 439 -3.144 15.992 10.170 1.00 1.73 N ATOM 2320 CZ ARG B 439 -2.210 15.400 10.864 1.00 2.28 C ATOM 2321 NH1 ARG B 439 -2.471 14.285 11.490 1.00 2.89 N ATOM 2322 NH2 ARG B 439 -1.017 15.924 10.931 1.00 2.81 N ATOM 0 H ARG B 439 -7.703 13.594 7.023 1.00 0.43 H new ATOM 0 HA ARG B 439 -7.806 15.551 9.079 1.00 0.50 H new ATOM 0 HB2 ARG B 439 -5.916 13.989 8.111 1.00 0.52 H new ATOM 0 HB3 ARG B 439 -5.651 15.256 6.930 1.00 0.52 H new ATOM 0 HG2 ARG B 439 -5.182 16.900 8.691 1.00 0.77 H new ATOM 0 HG3 ARG B 439 -5.677 15.779 9.943 1.00 0.77 H new ATOM 0 HD2 ARG B 439 -3.790 14.207 9.178 1.00 1.27 H new ATOM 0 HD3 ARG B 439 -3.246 15.472 8.095 1.00 1.27 H new ATOM 0 HE ARG B 439 -3.436 16.939 10.412 1.00 1.73 H new ATOM 0 HH11 ARG B 439 -3.404 13.877 11.437 1.00 2.89 H new ATOM 0 HH12 ARG B 439 -1.742 13.822 12.032 1.00 2.89 H new ATOM 0 HH21 ARG B 439 -0.815 16.796 10.441 1.00 2.81 H new ATOM 0 HH22 ARG B 439 -0.287 15.462 11.473 1.00 2.81 H new ATOM 2336 N HIS B 440 -7.723 16.855 6.065 1.00 0.52 N ATOM 2337 CA HIS B 440 -7.988 18.139 5.361 1.00 0.57 C ATOM 2338 C HIS B 440 -9.357 18.663 5.802 1.00 0.58 C ATOM 2339 O HIS B 440 -9.608 19.851 5.834 1.00 0.64 O ATOM 2340 CB HIS B 440 -7.995 17.783 3.873 1.00 0.55 C ATOM 2341 CG HIS B 440 -8.215 19.030 3.062 1.00 0.63 C ATOM 2342 ND1 HIS B 440 -7.492 20.192 3.283 1.00 1.04 N ATOM 2343 CD2 HIS B 440 -9.075 19.313 2.031 1.00 0.82 C ATOM 2344 CE1 HIS B 440 -7.926 21.112 2.402 1.00 0.97 C ATOM 2345 NE2 HIS B 440 -8.890 20.630 1.614 1.00 0.75 N ATOM 0 H HIS B 440 -7.541 16.054 5.460 1.00 0.52 H new ATOM 0 HA HIS B 440 -7.249 18.911 5.578 1.00 0.57 H new ATOM 0 HB2 HIS B 440 -7.050 17.317 3.595 1.00 0.55 H new ATOM 0 HB3 HIS B 440 -8.781 17.057 3.665 1.00 0.55 H new ATOM 0 HD2 HIS B 440 -9.787 18.620 1.607 1.00 0.82 H new ATOM 0 HE1 HIS B 440 -7.541 22.119 2.340 1.00 0.97 H new ATOM 0 HE2 HIS B 440 -9.384 21.120 0.868 1.00 0.75 H new ATOM 2353 N THR B 441 -10.235 17.764 6.162 1.00 0.53 N ATOM 2354 CA THR B 441 -11.591 18.164 6.632 1.00 0.55 C ATOM 2355 C THR B 441 -11.859 17.505 7.987 1.00 0.56 C ATOM 2356 O THR B 441 -12.874 16.867 8.185 1.00 0.55 O ATOM 2357 CB THR B 441 -12.564 17.627 5.576 1.00 0.53 C ATOM 2358 OG1 THR B 441 -12.590 16.208 5.639 1.00 0.48 O ATOM 2359 CG2 THR B 441 -12.119 18.068 4.179 1.00 0.54 C ATOM 0 H THR B 441 -10.067 16.758 6.150 1.00 0.53 H new ATOM 0 HA THR B 441 -11.694 19.242 6.754 1.00 0.55 H new ATOM 0 HB THR B 441 -13.560 18.023 5.773 1.00 0.53 H new ATOM 0 HG1 THR B 441 -13.490 15.908 5.885 1.00 0.48 H new ATOM 0 HG21 THR B 441 -12.817 17.681 3.436 1.00 0.54 H new ATOM 0 HG22 THR B 441 -12.102 19.157 4.129 1.00 0.54 H new ATOM 0 HG23 THR B 441 -11.121 17.680 3.976 1.00 0.54 H new ATOM 2367 N GLN B 442 -10.932 17.640 8.908 1.00 0.59 N ATOM 2368 CA GLN B 442 -11.075 17.016 10.264 1.00 0.62 C ATOM 2369 C GLN B 442 -12.521 17.080 10.774 1.00 0.64 C ATOM 2370 O GLN B 442 -13.077 18.141 10.972 1.00 0.69 O ATOM 2371 CB GLN B 442 -10.160 17.843 11.168 1.00 0.69 C ATOM 2372 CG GLN B 442 -9.497 16.927 12.199 1.00 1.43 C ATOM 2373 CD GLN B 442 -10.137 17.151 13.569 1.00 1.79 C ATOM 2374 OE1 GLN B 442 -9.675 17.966 14.343 1.00 2.16 O ATOM 2375 NE2 GLN B 442 -11.191 16.458 13.905 1.00 2.47 N ATOM 0 H GLN B 442 -10.068 18.165 8.774 1.00 0.59 H new ATOM 0 HA GLN B 442 -10.812 15.958 10.244 1.00 0.62 H new ATOM 0 HB2 GLN B 442 -9.400 18.346 10.571 1.00 0.69 H new ATOM 0 HB3 GLN B 442 -10.735 18.620 11.672 1.00 0.69 H new ATOM 0 HG2 GLN B 442 -9.609 15.885 11.900 1.00 1.43 H new ATOM 0 HG3 GLN B 442 -8.427 17.132 12.248 1.00 1.43 H new ATOM 0 HE21 GLN B 442 -11.580 15.774 13.256 1.00 2.47 H new ATOM 0 HE22 GLN B 442 -11.626 16.601 14.816 1.00 2.47 H new ATOM 2384 N GLY B 443 -13.125 15.942 10.990 1.00 0.63 N ATOM 2385 CA GLY B 443 -14.528 15.921 11.490 1.00 0.66 C ATOM 2386 C GLY B 443 -15.492 15.761 10.315 1.00 0.64 C ATOM 2387 O GLY B 443 -16.426 14.985 10.368 1.00 0.66 O ATOM 0 H GLY B 443 -12.705 15.024 10.841 1.00 0.63 H new ATOM 0 HA2 GLY B 443 -14.660 15.101 12.196 1.00 0.66 H new ATOM 0 HA3 GLY B 443 -14.746 16.843 12.029 1.00 0.66 H new ATOM 2391 N HIS B 444 -15.277 16.489 9.253 1.00 0.62 N ATOM 2392 CA HIS B 444 -16.186 16.375 8.077 1.00 0.62 C ATOM 2393 C HIS B 444 -15.849 15.121 7.266 1.00 0.67 C ATOM 2394 O HIS B 444 -15.181 15.185 6.254 1.00 1.34 O ATOM 2395 CB HIS B 444 -15.926 17.636 7.253 1.00 0.63 C ATOM 2396 CG HIS B 444 -16.614 18.806 7.900 1.00 0.95 C ATOM 2397 ND1 HIS B 444 -15.912 19.810 8.548 1.00 1.52 N ATOM 2398 CD2 HIS B 444 -17.940 19.143 8.012 1.00 1.62 C ATOM 2399 CE1 HIS B 444 -16.810 20.695 9.015 1.00 1.77 C ATOM 2400 NE2 HIS B 444 -18.062 20.337 8.717 1.00 1.86 N ATOM 0 H HIS B 444 -14.513 17.156 9.149 1.00 0.62 H new ATOM 0 HA HIS B 444 -17.232 16.289 8.370 1.00 0.62 H new ATOM 0 HB2 HIS B 444 -14.855 17.823 7.183 1.00 0.63 H new ATOM 0 HB3 HIS B 444 -16.293 17.501 6.236 1.00 0.63 H new ATOM 0 HD2 HIS B 444 -18.763 18.569 7.614 1.00 1.62 H new ATOM 0 HE1 HIS B 444 -16.550 21.588 9.565 1.00 1.77 H new ATOM 0 HE2 HIS B 444 -18.922 20.832 8.955 1.00 1.86 H new ATOM 2408 N LYS B 445 -16.309 13.981 7.704 1.00 0.62 N ATOM 2409 CA LYS B 445 -16.017 12.723 6.959 1.00 0.51 C ATOM 2410 C LYS B 445 -16.655 12.777 5.566 1.00 0.51 C ATOM 2411 O LYS B 445 -16.158 12.195 4.623 1.00 0.57 O ATOM 2412 CB LYS B 445 -16.651 11.612 7.796 1.00 0.62 C ATOM 2413 CG LYS B 445 -15.618 10.513 8.053 1.00 1.31 C ATOM 2414 CD LYS B 445 -16.205 9.474 9.010 1.00 1.56 C ATOM 2415 CE LYS B 445 -15.660 8.088 8.657 1.00 2.23 C ATOM 2416 NZ LYS B 445 -15.138 7.542 9.941 1.00 2.52 N ATOM 0 H LYS B 445 -16.874 13.866 8.545 1.00 0.62 H new ATOM 0 HA LYS B 445 -14.948 12.565 6.815 1.00 0.51 H new ATOM 0 HB2 LYS B 445 -17.011 12.016 8.742 1.00 0.62 H new ATOM 0 HB3 LYS B 445 -17.515 11.199 7.276 1.00 0.62 H new ATOM 0 HG2 LYS B 445 -15.335 10.038 7.113 1.00 1.31 H new ATOM 0 HG3 LYS B 445 -14.712 10.944 8.478 1.00 1.31 H new ATOM 0 HD2 LYS B 445 -15.948 9.726 10.039 1.00 1.56 H new ATOM 0 HD3 LYS B 445 -17.293 9.476 8.943 1.00 1.56 H new ATOM 0 HE2 LYS B 445 -16.441 7.450 8.245 1.00 2.23 H new ATOM 0 HE3 LYS B 445 -14.872 8.153 7.906 1.00 2.23 H new ATOM 0 HZ1 LYS B 445 -14.747 6.592 9.781 1.00 2.52 H new ATOM 0 HZ2 LYS B 445 -14.391 8.167 10.306 1.00 2.52 H new ATOM 0 HZ3 LYS B 445 -15.911 7.485 10.634 1.00 2.52 H new ATOM 2430 N GLN B 446 -17.755 13.468 5.433 1.00 0.53 N ATOM 2431 CA GLN B 446 -18.426 13.558 4.104 1.00 0.56 C ATOM 2432 C GLN B 446 -17.495 14.219 3.085 1.00 0.52 C ATOM 2433 O GLN B 446 -17.339 13.748 1.976 1.00 0.51 O ATOM 2434 CB GLN B 446 -19.662 14.425 4.339 1.00 0.64 C ATOM 2435 CG GLN B 446 -20.769 13.578 4.971 1.00 1.11 C ATOM 2436 CD GLN B 446 -20.860 13.890 6.466 1.00 1.79 C ATOM 2437 OE1 GLN B 446 -20.769 13.003 7.290 1.00 2.45 O ATOM 2438 NE2 GLN B 446 -21.040 15.124 6.851 1.00 2.40 N ATOM 0 H GLN B 446 -18.218 13.974 6.188 1.00 0.53 H new ATOM 0 HA GLN B 446 -18.687 12.577 3.708 1.00 0.56 H new ATOM 0 HB2 GLN B 446 -19.413 15.262 4.991 1.00 0.64 H new ATOM 0 HB3 GLN B 446 -20.007 14.848 3.395 1.00 0.64 H new ATOM 0 HG2 GLN B 446 -21.723 13.787 4.486 1.00 1.11 H new ATOM 0 HG3 GLN B 446 -20.561 12.519 4.822 1.00 1.11 H new ATOM 0 HE21 GLN B 446 -21.116 15.868 6.158 1.00 2.40 H new ATOM 0 HE22 GLN B 446 -21.104 15.344 7.845 1.00 2.40 H new ATOM 2447 N GLU B 447 -16.869 15.305 3.453 1.00 0.52 N ATOM 2448 CA GLU B 447 -15.945 15.993 2.505 1.00 0.51 C ATOM 2449 C GLU B 447 -14.935 14.992 1.937 1.00 0.45 C ATOM 2450 O GLU B 447 -14.564 15.055 0.782 1.00 0.45 O ATOM 2451 CB GLU B 447 -15.233 17.055 3.343 1.00 0.53 C ATOM 2452 CG GLU B 447 -15.481 18.436 2.735 1.00 0.80 C ATOM 2453 CD GLU B 447 -16.959 18.801 2.882 1.00 1.32 C ATOM 2454 OE1 GLU B 447 -17.447 18.778 4.001 1.00 2.14 O ATOM 2455 OE2 GLU B 447 -17.580 19.098 1.875 1.00 1.96 O ATOM 0 H GLU B 447 -16.958 15.745 4.369 1.00 0.52 H new ATOM 0 HA GLU B 447 -16.473 16.431 1.658 1.00 0.51 H new ATOM 0 HB2 GLU B 447 -15.597 17.027 4.370 1.00 0.53 H new ATOM 0 HB3 GLU B 447 -14.163 16.848 3.379 1.00 0.53 H new ATOM 0 HG2 GLU B 447 -14.860 19.181 3.233 1.00 0.80 H new ATOM 0 HG3 GLU B 447 -15.198 18.438 1.682 1.00 0.80 H new ATOM 2462 N ALA B 448 -14.495 14.062 2.742 1.00 0.43 N ATOM 2463 CA ALA B 448 -13.517 13.053 2.248 1.00 0.39 C ATOM 2464 C ALA B 448 -14.060 12.376 0.988 1.00 0.40 C ATOM 2465 O ALA B 448 -13.318 11.865 0.173 1.00 0.40 O ATOM 2466 CB ALA B 448 -13.381 12.041 3.385 1.00 0.39 C ATOM 0 H ALA B 448 -14.771 13.958 3.719 1.00 0.43 H new ATOM 0 HA ALA B 448 -12.557 13.498 1.986 1.00 0.39 H new ATOM 0 HB1 ALA B 448 -12.675 11.263 3.097 1.00 0.39 H new ATOM 0 HB2 ALA B 448 -13.019 12.546 4.280 1.00 0.39 H new ATOM 0 HB3 ALA B 448 -14.353 11.591 3.590 1.00 0.39 H new ATOM 2472 N ALA B 449 -15.355 12.375 0.822 1.00 0.44 N ATOM 2473 CA ALA B 449 -15.955 11.740 -0.385 1.00 0.47 C ATOM 2474 C ALA B 449 -15.306 12.303 -1.651 1.00 0.48 C ATOM 2475 O ALA B 449 -14.537 11.638 -2.317 1.00 0.49 O ATOM 2476 CB ALA B 449 -17.436 12.118 -0.332 1.00 0.52 C ATOM 0 H ALA B 449 -16.024 12.788 1.472 1.00 0.44 H new ATOM 0 HA ALA B 449 -15.808 10.660 -0.403 1.00 0.47 H new ATOM 0 HB1 ALA B 449 -17.952 11.687 -1.190 1.00 0.52 H new ATOM 0 HB2 ALA B 449 -17.877 11.733 0.587 1.00 0.52 H new ATOM 0 HB3 ALA B 449 -17.536 13.203 -0.356 1.00 0.52 H new ATOM 2482 N ARG B 450 -15.607 13.528 -1.984 1.00 0.49 N ATOM 2483 CA ARG B 450 -15.007 14.140 -3.202 1.00 0.52 C ATOM 2484 C ARG B 450 -13.480 14.076 -3.122 1.00 0.49 C ATOM 2485 O ARG B 450 -12.803 13.868 -4.109 1.00 0.50 O ATOM 2486 CB ARG B 450 -15.486 15.592 -3.190 1.00 0.57 C ATOM 2487 CG ARG B 450 -15.785 16.042 -4.620 1.00 0.78 C ATOM 2488 CD ARG B 450 -16.880 17.112 -4.601 1.00 1.37 C ATOM 2489 NE ARG B 450 -17.460 17.092 -5.971 1.00 1.76 N ATOM 2490 CZ ARG B 450 -18.059 18.152 -6.442 1.00 2.35 C ATOM 2491 NH1 ARG B 450 -19.164 18.575 -5.892 1.00 2.93 N ATOM 2492 NH2 ARG B 450 -17.553 18.788 -7.464 1.00 2.97 N ATOM 0 H ARG B 450 -16.244 14.132 -1.464 1.00 0.49 H new ATOM 0 HA ARG B 450 -15.300 13.623 -4.116 1.00 0.52 H new ATOM 0 HB2 ARG B 450 -16.380 15.686 -2.573 1.00 0.57 H new ATOM 0 HB3 ARG B 450 -14.724 16.234 -2.747 1.00 0.57 H new ATOM 0 HG2 ARG B 450 -14.882 16.439 -5.084 1.00 0.78 H new ATOM 0 HG3 ARG B 450 -16.104 15.191 -5.221 1.00 0.78 H new ATOM 0 HD2 ARG B 450 -17.637 16.889 -3.849 1.00 1.37 H new ATOM 0 HD3 ARG B 450 -16.470 18.093 -4.360 1.00 1.37 H new ATOM 0 HE ARG B 450 -17.390 16.250 -6.542 1.00 1.76 H new ATOM 0 HH11 ARG B 450 -19.560 18.078 -5.094 1.00 2.93 H new ATOM 0 HH12 ARG B 450 -19.632 19.403 -6.260 1.00 2.93 H new ATOM 0 HH21 ARG B 450 -16.690 18.457 -7.894 1.00 2.97 H new ATOM 0 HH22 ARG B 450 -18.021 19.616 -7.832 1.00 2.97 H new ATOM 2506 N LEU B 451 -12.933 14.251 -1.950 1.00 0.48 N ATOM 2507 CA LEU B 451 -11.450 14.198 -1.803 1.00 0.47 C ATOM 2508 C LEU B 451 -10.914 12.875 -2.355 1.00 0.44 C ATOM 2509 O LEU B 451 -9.777 12.780 -2.770 1.00 0.48 O ATOM 2510 CB LEU B 451 -11.199 14.292 -0.297 1.00 0.46 C ATOM 2511 CG LEU B 451 -10.752 15.710 0.059 1.00 0.53 C ATOM 2512 CD1 LEU B 451 -11.982 16.599 0.258 1.00 0.92 C ATOM 2513 CD2 LEU B 451 -9.934 15.676 1.352 1.00 1.04 C ATOM 0 H LEU B 451 -13.448 14.428 -1.088 1.00 0.48 H new ATOM 0 HA LEU B 451 -10.950 14.997 -2.350 1.00 0.47 H new ATOM 0 HB2 LEU B 451 -12.107 14.038 0.250 1.00 0.46 H new ATOM 0 HB3 LEU B 451 -10.435 13.573 0.001 1.00 0.46 H new ATOM 0 HG LEU B 451 -10.141 16.112 -0.749 1.00 0.53 H new ATOM 0 HD11 LEU B 451 -11.663 17.610 0.512 1.00 0.92 H new ATOM 0 HD12 LEU B 451 -12.566 16.623 -0.662 1.00 0.92 H new ATOM 0 HD13 LEU B 451 -12.594 16.198 1.066 1.00 0.92 H new ATOM 0 HD21 LEU B 451 -9.615 16.686 1.607 1.00 1.04 H new ATOM 0 HD22 LEU B 451 -10.546 15.274 2.159 1.00 1.04 H new ATOM 0 HD23 LEU B 451 -9.058 15.043 1.212 1.00 1.04 H new ATOM 2525 N LEU B 452 -11.727 11.853 -2.364 1.00 0.42 N ATOM 2526 CA LEU B 452 -11.263 10.538 -2.891 1.00 0.40 C ATOM 2527 C LEU B 452 -12.121 10.112 -4.087 1.00 0.46 C ATOM 2528 O LEU B 452 -12.130 8.961 -4.475 1.00 0.51 O ATOM 2529 CB LEU B 452 -11.448 9.556 -1.733 1.00 0.37 C ATOM 2530 CG LEU B 452 -10.676 10.046 -0.507 1.00 0.35 C ATOM 2531 CD1 LEU B 452 -11.435 9.650 0.761 1.00 0.31 C ATOM 2532 CD2 LEU B 452 -9.289 9.402 -0.489 1.00 0.43 C ATOM 0 H LEU B 452 -12.691 11.872 -2.030 1.00 0.42 H new ATOM 0 HA LEU B 452 -10.229 10.577 -3.235 1.00 0.40 H new ATOM 0 HB2 LEU B 452 -12.507 9.459 -1.492 1.00 0.37 H new ATOM 0 HB3 LEU B 452 -11.096 8.566 -2.024 1.00 0.37 H new ATOM 0 HG LEU B 452 -10.574 11.130 -0.549 1.00 0.35 H new ATOM 0 HD11 LEU B 452 -10.887 9.998 1.637 1.00 0.31 H new ATOM 0 HD12 LEU B 452 -12.426 10.104 0.749 1.00 0.31 H new ATOM 0 HD13 LEU B 452 -11.534 8.565 0.802 1.00 0.31 H new ATOM 0 HD21 LEU B 452 -8.737 9.750 0.384 1.00 0.43 H new ATOM 0 HD22 LEU B 452 -9.392 8.318 -0.445 1.00 0.43 H new ATOM 0 HD23 LEU B 452 -8.748 9.678 -1.394 1.00 0.43 H new ATOM 2544 N GLY B 453 -12.848 11.027 -4.673 1.00 0.50 N ATOM 2545 CA GLY B 453 -13.704 10.663 -5.837 1.00 0.56 C ATOM 2546 C GLY B 453 -14.630 9.511 -5.444 1.00 0.58 C ATOM 2547 O GLY B 453 -14.895 8.618 -6.224 1.00 0.68 O ATOM 0 H GLY B 453 -12.885 12.008 -4.396 1.00 0.50 H new ATOM 0 HA2 GLY B 453 -14.291 11.525 -6.154 1.00 0.56 H new ATOM 0 HA3 GLY B 453 -13.082 10.372 -6.683 1.00 0.56 H new ATOM 2551 N TRP B 454 -15.116 9.522 -4.235 1.00 0.54 N ATOM 2552 CA TRP B 454 -16.019 8.426 -3.780 1.00 0.60 C ATOM 2553 C TRP B 454 -17.462 8.925 -3.685 1.00 0.69 C ATOM 2554 O TRP B 454 -18.288 8.642 -4.531 1.00 1.16 O ATOM 2555 CB TRP B 454 -15.505 8.046 -2.389 1.00 0.53 C ATOM 2556 CG TRP B 454 -14.446 6.989 -2.490 1.00 0.52 C ATOM 2557 CD1 TRP B 454 -13.699 6.723 -3.592 1.00 0.58 C ATOM 2558 CD2 TRP B 454 -14.002 6.058 -1.462 1.00 0.50 C ATOM 2559 NE1 TRP B 454 -12.826 5.687 -3.304 1.00 0.58 N ATOM 2560 CE2 TRP B 454 -12.970 5.242 -2.006 1.00 0.52 C ATOM 2561 CE3 TRP B 454 -14.391 5.840 -0.114 1.00 0.51 C ATOM 2562 CZ2 TRP B 454 -12.342 4.242 -1.241 1.00 0.52 C ATOM 2563 CZ3 TRP B 454 -13.762 4.836 0.660 1.00 0.53 C ATOM 2564 CH2 TRP B 454 -12.738 4.039 0.096 1.00 0.51 C ATOM 0 H TRP B 454 -14.927 10.244 -3.540 1.00 0.54 H new ATOM 0 HA TRP B 454 -16.017 7.583 -4.471 1.00 0.60 H new ATOM 0 HB2 TRP B 454 -15.101 8.927 -1.891 1.00 0.53 H new ATOM 0 HB3 TRP B 454 -16.331 7.684 -1.776 1.00 0.53 H new ATOM 0 HD1 TRP B 454 -13.773 7.236 -4.539 1.00 0.58 H new ATOM 0 HE1 TRP B 454 -12.158 5.300 -3.971 1.00 0.58 H new ATOM 0 HE3 TRP B 454 -15.172 6.444 0.323 1.00 0.51 H new ATOM 0 HZ2 TRP B 454 -11.562 3.634 -1.675 1.00 0.52 H new ATOM 0 HZ3 TRP B 454 -14.065 4.678 1.685 1.00 0.53 H new ATOM 0 HH2 TRP B 454 -12.260 3.275 0.690 1.00 0.51 H new ATOM 2575 N GLY B 455 -17.772 9.654 -2.649 1.00 0.72 N ATOM 2576 CA GLY B 455 -19.161 10.165 -2.476 1.00 0.72 C ATOM 2577 C GLY B 455 -19.628 9.840 -1.058 1.00 0.70 C ATOM 2578 O GLY B 455 -18.843 9.453 -0.217 1.00 0.64 O ATOM 0 H GLY B 455 -17.120 9.919 -1.911 1.00 0.72 H new ATOM 0 HA2 GLY B 455 -19.192 11.241 -2.647 1.00 0.72 H new ATOM 0 HA3 GLY B 455 -19.826 9.707 -3.208 1.00 0.72 H new ATOM 2582 N ALA B 456 -20.893 9.986 -0.780 1.00 0.77 N ATOM 2583 CA ALA B 456 -21.388 9.673 0.591 1.00 0.77 C ATOM 2584 C ALA B 456 -21.817 8.207 0.668 1.00 0.82 C ATOM 2585 O ALA B 456 -21.662 7.556 1.682 1.00 0.83 O ATOM 2586 CB ALA B 456 -22.586 10.599 0.802 1.00 0.84 C ATOM 0 H ALA B 456 -21.603 10.307 -1.438 1.00 0.77 H new ATOM 0 HA ALA B 456 -20.624 9.822 1.354 1.00 0.77 H new ATOM 0 HB1 ALA B 456 -23.008 10.428 1.793 1.00 0.84 H new ATOM 0 HB2 ALA B 456 -22.263 11.637 0.719 1.00 0.84 H new ATOM 0 HB3 ALA B 456 -23.343 10.393 0.045 1.00 0.84 H new ATOM 2592 N ALA B 457 -22.352 7.680 -0.399 1.00 0.90 N ATOM 2593 CA ALA B 457 -22.786 6.254 -0.386 1.00 0.97 C ATOM 2594 C ALA B 457 -21.562 5.339 -0.319 1.00 0.89 C ATOM 2595 O ALA B 457 -21.566 4.327 0.354 1.00 0.91 O ATOM 2596 CB ALA B 457 -23.539 6.055 -1.701 1.00 1.07 C ATOM 0 H ALA B 457 -22.507 8.174 -1.278 1.00 0.90 H new ATOM 0 HA ALA B 457 -23.411 6.016 0.475 1.00 0.97 H new ATOM 0 HB1 ALA B 457 -23.891 5.026 -1.766 1.00 1.07 H new ATOM 0 HB2 ALA B 457 -24.391 6.733 -1.739 1.00 1.07 H new ATOM 0 HB3 ALA B 457 -22.872 6.264 -2.537 1.00 1.07 H new ATOM 2602 N THR B 458 -20.511 5.689 -1.009 1.00 0.84 N ATOM 2603 CA THR B 458 -19.284 4.843 -0.980 1.00 0.77 C ATOM 2604 C THR B 458 -18.589 4.982 0.376 1.00 0.68 C ATOM 2605 O THR B 458 -18.290 4.006 1.035 1.00 0.67 O ATOM 2606 CB THR B 458 -18.397 5.392 -2.099 1.00 0.76 C ATOM 2607 OG1 THR B 458 -19.133 5.421 -3.314 1.00 0.85 O ATOM 2608 CG2 THR B 458 -17.168 4.498 -2.265 1.00 0.72 C ATOM 0 H THR B 458 -20.449 6.524 -1.591 1.00 0.84 H new ATOM 0 HA THR B 458 -19.503 3.785 -1.121 1.00 0.77 H new ATOM 0 HB THR B 458 -18.075 6.402 -1.845 1.00 0.76 H new ATOM 0 HG1 THR B 458 -18.566 5.774 -4.031 1.00 0.85 H new ATOM 0 HG21 THR B 458 -16.537 4.891 -3.063 1.00 0.72 H new ATOM 0 HG22 THR B 458 -16.604 4.478 -1.333 1.00 0.72 H new ATOM 0 HG23 THR B 458 -17.485 3.486 -2.518 1.00 0.72 H new ATOM 2616 N LEU B 459 -18.336 6.191 0.800 1.00 0.64 N ATOM 2617 CA LEU B 459 -17.667 6.396 2.118 1.00 0.57 C ATOM 2618 C LEU B 459 -18.408 5.621 3.210 1.00 0.60 C ATOM 2619 O LEU B 459 -17.830 5.206 4.195 1.00 0.58 O ATOM 2620 CB LEU B 459 -17.754 7.902 2.372 1.00 0.56 C ATOM 2621 CG LEU B 459 -16.345 8.495 2.435 1.00 0.47 C ATOM 2622 CD1 LEU B 459 -16.365 9.922 1.891 1.00 0.48 C ATOM 2623 CD2 LEU B 459 -15.862 8.518 3.886 1.00 0.46 C ATOM 0 H LEU B 459 -18.563 7.045 0.291 1.00 0.64 H new ATOM 0 HA LEU B 459 -16.636 6.041 2.122 1.00 0.57 H new ATOM 0 HB2 LEU B 459 -18.326 8.382 1.578 1.00 0.56 H new ATOM 0 HB3 LEU B 459 -18.282 8.093 3.306 1.00 0.56 H new ATOM 0 HG LEU B 459 -15.672 7.883 1.835 1.00 0.47 H new ATOM 0 HD11 LEU B 459 -15.361 10.343 1.937 1.00 0.48 H new ATOM 0 HD12 LEU B 459 -16.708 9.912 0.856 1.00 0.48 H new ATOM 0 HD13 LEU B 459 -17.041 10.531 2.491 1.00 0.48 H new ATOM 0 HD21 LEU B 459 -14.858 8.941 3.929 1.00 0.46 H new ATOM 0 HD22 LEU B 459 -16.538 9.128 4.485 1.00 0.46 H new ATOM 0 HD23 LEU B 459 -15.845 7.502 4.280 1.00 0.46 H new ATOM 2635 N THR B 460 -19.687 5.422 3.040 1.00 0.68 N ATOM 2636 CA THR B 460 -20.472 4.674 4.062 1.00 0.74 C ATOM 2637 C THR B 460 -20.477 3.178 3.736 1.00 0.76 C ATOM 2638 O THR B 460 -20.169 2.350 4.570 1.00 0.75 O ATOM 2639 CB THR B 460 -21.886 5.250 3.969 1.00 0.83 C ATOM 2640 OG1 THR B 460 -21.862 6.619 4.350 1.00 0.82 O ATOM 2641 CG2 THR B 460 -22.822 4.477 4.900 1.00 0.92 C ATOM 0 H THR B 460 -20.223 5.746 2.235 1.00 0.68 H new ATOM 0 HA THR B 460 -20.054 4.777 5.063 1.00 0.74 H new ATOM 0 HB THR B 460 -22.246 5.161 2.944 1.00 0.83 H new ATOM 0 HG1 THR B 460 -21.790 7.180 3.550 1.00 0.82 H new ATOM 0 HG21 THR B 460 -23.828 4.891 4.830 1.00 0.92 H new ATOM 0 HG22 THR B 460 -22.841 3.427 4.608 1.00 0.92 H new ATOM 0 HG23 THR B 460 -22.465 4.561 5.927 1.00 0.92 H new ATOM 2649 N ALA B 461 -20.825 2.824 2.529 1.00 0.81 N ATOM 2650 CA ALA B 461 -20.849 1.381 2.153 1.00 0.85 C ATOM 2651 C ALA B 461 -19.438 0.792 2.228 1.00 0.79 C ATOM 2652 O ALA B 461 -19.249 -0.340 2.627 1.00 0.83 O ATOM 2653 CB ALA B 461 -21.366 1.354 0.714 1.00 0.92 C ATOM 0 H ALA B 461 -21.094 3.471 1.787 1.00 0.81 H new ATOM 0 HA ALA B 461 -21.476 0.791 2.821 1.00 0.85 H new ATOM 0 HB1 ALA B 461 -21.413 0.323 0.363 1.00 0.92 H new ATOM 0 HB2 ALA B 461 -22.362 1.795 0.677 1.00 0.92 H new ATOM 0 HB3 ALA B 461 -20.692 1.924 0.075 1.00 0.92 H new ATOM 2659 N LYS B 462 -18.447 1.551 1.848 1.00 0.72 N ATOM 2660 CA LYS B 462 -17.050 1.032 1.898 1.00 0.68 C ATOM 2661 C LYS B 462 -16.561 0.968 3.349 1.00 0.65 C ATOM 2662 O LYS B 462 -15.620 0.267 3.665 1.00 0.66 O ATOM 2663 CB LYS B 462 -16.222 2.039 1.096 1.00 0.66 C ATOM 2664 CG LYS B 462 -15.072 1.311 0.398 1.00 0.99 C ATOM 2665 CD LYS B 462 -15.411 1.125 -1.082 1.00 0.91 C ATOM 2666 CE LYS B 462 -15.120 -0.321 -1.495 1.00 1.31 C ATOM 2667 NZ LYS B 462 -13.707 -0.309 -1.966 1.00 1.39 N ATOM 0 H LYS B 462 -18.544 2.507 1.505 1.00 0.72 H new ATOM 0 HA LYS B 462 -16.970 0.024 1.491 1.00 0.68 H new ATOM 0 HB2 LYS B 462 -16.851 2.539 0.359 1.00 0.66 H new ATOM 0 HB3 LYS B 462 -15.830 2.812 1.757 1.00 0.66 H new ATOM 0 HG2 LYS B 462 -14.149 1.882 0.502 1.00 0.99 H new ATOM 0 HG3 LYS B 462 -14.902 0.342 0.868 1.00 0.99 H new ATOM 0 HD2 LYS B 462 -16.461 1.360 -1.258 1.00 0.91 H new ATOM 0 HD3 LYS B 462 -14.824 1.813 -1.690 1.00 0.91 H new ATOM 0 HE2 LYS B 462 -15.251 -1.005 -0.657 1.00 1.31 H new ATOM 0 HE3 LYS B 462 -15.796 -0.650 -2.284 1.00 1.31 H new ATOM 0 HZ1 LYS B 462 -13.433 -1.266 -2.267 1.00 1.39 H new ATOM 0 HZ2 LYS B 462 -13.614 0.346 -2.769 1.00 1.39 H new ATOM 0 HZ3 LYS B 462 -13.086 0.002 -1.192 1.00 1.39 H new ATOM 2681 N LEU B 463 -17.193 1.691 4.234 1.00 0.65 N ATOM 2682 CA LEU B 463 -16.762 1.665 5.662 1.00 0.65 C ATOM 2683 C LEU B 463 -17.089 0.306 6.288 1.00 0.68 C ATOM 2684 O LEU B 463 -16.254 -0.321 6.907 1.00 0.70 O ATOM 2685 CB LEU B 463 -17.565 2.774 6.339 1.00 0.68 C ATOM 2686 CG LEU B 463 -16.725 3.412 7.446 1.00 0.81 C ATOM 2687 CD1 LEU B 463 -16.932 4.927 7.437 1.00 0.99 C ATOM 2688 CD2 LEU B 463 -17.154 2.847 8.801 1.00 0.99 C ATOM 0 H LEU B 463 -17.988 2.297 4.031 1.00 0.65 H new ATOM 0 HA LEU B 463 -15.688 1.815 5.772 1.00 0.65 H new ATOM 0 HB2 LEU B 463 -17.853 3.528 5.606 1.00 0.68 H new ATOM 0 HB3 LEU B 463 -18.486 2.367 6.756 1.00 0.68 H new ATOM 0 HG LEU B 463 -15.672 3.189 7.276 1.00 0.81 H new ATOM 0 HD11 LEU B 463 -16.333 5.381 8.226 1.00 0.99 H new ATOM 0 HD12 LEU B 463 -16.626 5.330 6.472 1.00 0.99 H new ATOM 0 HD13 LEU B 463 -17.985 5.151 7.606 1.00 0.99 H new ATOM 0 HD21 LEU B 463 -16.556 3.301 9.591 1.00 0.99 H new ATOM 0 HD22 LEU B 463 -18.208 3.069 8.971 1.00 0.99 H new ATOM 0 HD23 LEU B 463 -17.005 1.767 8.809 1.00 0.99 H new ATOM 2700 N LYS B 464 -18.301 -0.153 6.131 1.00 0.72 N ATOM 2701 CA LYS B 464 -18.681 -1.469 6.718 1.00 0.77 C ATOM 2702 C LYS B 464 -18.230 -2.610 5.804 1.00 0.76 C ATOM 2703 O LYS B 464 -18.005 -3.720 6.245 1.00 0.82 O ATOM 2704 CB LYS B 464 -20.207 -1.432 6.816 1.00 0.85 C ATOM 2705 CG LYS B 464 -20.631 -1.536 8.282 1.00 1.20 C ATOM 2706 CD LYS B 464 -21.572 -0.379 8.624 1.00 1.62 C ATOM 2707 CE LYS B 464 -21.964 -0.460 10.101 1.00 2.25 C ATOM 2708 NZ LYS B 464 -23.041 0.556 10.269 1.00 2.66 N ATOM 0 H LYS B 464 -19.044 0.326 5.622 1.00 0.72 H new ATOM 0 HA LYS B 464 -18.213 -1.638 7.688 1.00 0.77 H new ATOM 0 HB2 LYS B 464 -20.587 -0.507 6.382 1.00 0.85 H new ATOM 0 HB3 LYS B 464 -20.638 -2.253 6.243 1.00 0.85 H new ATOM 0 HG2 LYS B 464 -21.129 -2.489 8.461 1.00 1.20 H new ATOM 0 HG3 LYS B 464 -19.754 -1.509 8.928 1.00 1.20 H new ATOM 0 HD2 LYS B 464 -21.084 0.574 8.418 1.00 1.62 H new ATOM 0 HD3 LYS B 464 -22.463 -0.423 7.997 1.00 1.62 H new ATOM 0 HE2 LYS B 464 -22.318 -1.457 10.362 1.00 2.25 H new ATOM 0 HE3 LYS B 464 -21.113 -0.245 10.748 1.00 2.25 H new ATOM 0 HZ1 LYS B 464 -23.363 0.561 11.258 1.00 2.66 H new ATOM 0 HZ2 LYS B 464 -22.673 1.496 10.020 1.00 2.66 H new ATOM 0 HZ3 LYS B 464 -23.840 0.321 9.646 1.00 2.66 H new ATOM 2722 N GLU B 465 -18.095 -2.347 4.533 1.00 0.73 N ATOM 2723 CA GLU B 465 -17.658 -3.419 3.592 1.00 0.76 C ATOM 2724 C GLU B 465 -16.335 -4.029 4.062 1.00 0.69 C ATOM 2725 O GLU B 465 -16.214 -5.227 4.220 1.00 0.85 O ATOM 2726 CB GLU B 465 -17.477 -2.714 2.248 1.00 0.79 C ATOM 2727 CG GLU B 465 -18.734 -2.905 1.397 1.00 1.12 C ATOM 2728 CD GLU B 465 -18.440 -3.888 0.263 1.00 1.42 C ATOM 2729 OE1 GLU B 465 -18.046 -5.005 0.559 1.00 1.94 O ATOM 2730 OE2 GLU B 465 -18.612 -3.509 -0.884 1.00 2.03 O ATOM 0 H GLU B 465 -18.268 -1.437 4.105 1.00 0.73 H new ATOM 0 HA GLU B 465 -18.378 -4.235 3.531 1.00 0.76 H new ATOM 0 HB2 GLU B 465 -17.289 -1.652 2.405 1.00 0.79 H new ATOM 0 HB3 GLU B 465 -16.608 -3.118 1.728 1.00 0.79 H new ATOM 0 HG2 GLU B 465 -19.550 -3.280 2.015 1.00 1.12 H new ATOM 0 HG3 GLU B 465 -19.057 -1.948 0.988 1.00 1.12 H new ATOM 2737 N LEU B 466 -15.342 -3.212 4.287 1.00 0.56 N ATOM 2738 CA LEU B 466 -14.027 -3.746 4.746 1.00 0.59 C ATOM 2739 C LEU B 466 -14.193 -4.507 6.065 1.00 0.70 C ATOM 2740 O LEU B 466 -13.551 -5.511 6.298 1.00 0.81 O ATOM 2741 CB LEU B 466 -13.149 -2.511 4.950 1.00 0.56 C ATOM 2742 CG LEU B 466 -12.706 -1.965 3.592 1.00 0.54 C ATOM 2743 CD1 LEU B 466 -12.297 -0.498 3.739 1.00 0.62 C ATOM 2744 CD2 LEU B 466 -11.512 -2.776 3.081 1.00 0.52 C ATOM 0 H LEU B 466 -15.384 -2.199 4.173 1.00 0.56 H new ATOM 0 HA LEU B 466 -13.593 -4.444 4.030 1.00 0.59 H new ATOM 0 HB2 LEU B 466 -13.701 -1.747 5.498 1.00 0.56 H new ATOM 0 HB3 LEU B 466 -12.277 -2.768 5.552 1.00 0.56 H new ATOM 0 HG LEU B 466 -13.531 -2.044 2.884 1.00 0.54 H new ATOM 0 HD11 LEU B 466 -11.981 -0.110 2.771 1.00 0.62 H new ATOM 0 HD12 LEU B 466 -13.145 0.081 4.103 1.00 0.62 H new ATOM 0 HD13 LEU B 466 -11.473 -0.419 4.448 1.00 0.62 H new ATOM 0 HD21 LEU B 466 -11.196 -2.387 2.113 1.00 0.52 H new ATOM 0 HD22 LEU B 466 -10.688 -2.697 3.790 1.00 0.52 H new ATOM 0 HD23 LEU B 466 -11.801 -3.822 2.975 1.00 0.52 H new ATOM 2756 N GLY B 467 -15.049 -4.034 6.929 1.00 0.77 N ATOM 2757 CA GLY B 467 -15.255 -4.726 8.233 1.00 0.97 C ATOM 2758 C GLY B 467 -16.115 -5.975 8.028 1.00 1.08 C ATOM 2759 O GLY B 467 -16.121 -6.873 8.846 1.00 1.38 O ATOM 0 H GLY B 467 -15.615 -3.197 6.788 1.00 0.77 H new ATOM 0 HA2 GLY B 467 -14.293 -5.003 8.664 1.00 0.97 H new ATOM 0 HA3 GLY B 467 -15.739 -4.052 8.940 1.00 0.97 H new